Chembase list of 866358 unique molecular structures

$$$$ Data More

M. F.

C4H9N

Suppliers	Catalog Number
Sigma Aldrich	08460
Alfa Aesar	A13946
Matrix Scientific	037104

Database	Data ID
PubChem	75646

M. W.

71.12096

CAS

2516-47-4

Similarity

N/A

ID: 34352

1-(1-methylpiperidin-4-yl)piperazine

$$$$ Data More

M. F.

C10H21N3

Suppliers	Catalog Number
Sigma Aldrich	71277
Alfa Aesar	H27624
Matrix Scientific	037105

Database	Data ID
PubChem	566324

M. W.

183.29384

CAS

23995-88-2

Similarity

N/A

ID: 34353

(2,4,6-trimethylphenyl)methanamine

$$$$ Data

M. F.

C10H15N

Suppliers	Catalog Number
Matrix Scientific	037106
Apollo Scientific	OR6192
Enamine	EN300-33151

Database	Data ID
PubChem	458433

M. W.

149.2328

CAS

40393-99-5

Similarity

N/A

ID: 34354

methyl({[4-(pyrrolidin-1-yl)phenyl]methyl})amine

$$$$ Data More

M. F.

C12H18N2

Suppliers	Catalog Number
Matrix Scientific	037107
Maybridge	CC30146
Apollo Scientific	OR9272

Database	Data ID
PubChem	7064073

M. W.

190.28472

CAS

823188-79-0

Similarity

N/A

ID: 34355

(3,5-dimethoxyphenyl)methanamine

$$$$ Data More

M. F.

C9H13NO2

Suppliers	Catalog Number
Sigma Aldrich	339806
Matrix Scientific	037108
Enamine	EN300-35206

Database	Data ID
PubChem	420973

M. W.

167.20502

CAS

34967-24-3

Similarity

N/A

ID: 34356

(2-ethoxyphenyl)methanamine

$$$$ Data

M. F.

C9H13NO

Suppliers	Catalog Number
Sigma Aldrich	191388
Matrix Scientific	037109
Enamine	EN300-52538

Database	Data ID
PubChem	123465

M. W.

151.20562

CAS

37806-29-4

Similarity

N/A

ID: 34357

2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-amine

$$$$ Data

M. F.

C11H16N2

Suppliers	Catalog Number
ChemBridge	4003442
Matrix Scientific	037110
Enamine	EN300-31281

Database	Data ID
PubChem	40742

M. W.

176.25814

CAS

53356-51-7

Similarity

N/A

ID: 34358

(3-ethoxyphenyl)methanamine

$$$$ Data

M. F.

C9H13NO

Suppliers	Catalog Number
Matrix Scientific	037111
Enamine	EN300-41941

Database	Data ID
PubChem	7016224

M. W.

151.20562

CAS

93071-76-2

Similarity

N/A

ID: 34359

1-[(3-methylphenyl)methyl]-1H-pyrazol-3-amine

$$$$ Data

M. F.

C11H13N3

Suppliers	Catalog Number
ChemBridge	3001687
Matrix Scientific	037112

Database	Data ID
PubChem	1511721

M. W.

187.24102

CAS

955962-44-4

Similarity

N/A

ID: 34360

1-benzyl-1H-pyrazol-3-amine

$$$$ Data More

M. F.

C10H11N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00217
ChemBridge	4031721
Matrix Scientific	037113

Database	Data ID
PubChem	1508616

M. W.

173.21444

CAS

21377-09-3

Similarity

N/A

ID: 34361

5-methyl-1-[(3-methylphenyl)methyl]-1H-pyrazol-3-amine

$$$$ Data

M. F.

C12H15N3

Suppliers	Catalog Number
Matrix Scientific	037114

Database	Data ID
PubChem	5300168

M. W.

201.2676

CAS

Similarity

N/A

ID: 34362

2-[(3-methyl-1H-1,2,4-triazol-5-yl)sulfanyl]acetic acid

$$$$ Data

M. F.

C5H7N3O2S

Suppliers	Catalog Number
ChemBridge	4021954
Matrix Scientific	037115
Enamine	EN300-92725

Database	Data ID
PubChem	254566

M. W.

173.19298

CAS

64679-65-8

Similarity

N/A

ID: 34363

4-methyl-6-phenylpyrimidin-2-amine

$$$$ Data

M. F.

C11H11N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00532
ChemBridge	4012253 19796200
Matrix Scientific	037116

Database	Data ID
PubChem	603940

M. W.

185.22514

CAS

15755-15-4

Similarity

N/A

ID: 34364

4-methyl-2-phenylpyrimidine-5-carboxylic acid

$$$$ Data More

M. F.

C12H10N2O2

Suppliers	Catalog Number
ChemBridge	4035612
Matrix Scientific	037117
Maybridge	CC20201

Database	Data ID
PubChem	239975

M. W.

214.22

CAS

103249-79-2

Similarity

N/A

ID: 34365

4-methyl-2-(4-methylphenyl)pyrimidine-5-carboxylic acid

$$$$ Data

M. F.

C13H12N2O2

Suppliers	Catalog Number
ChemBridge	3005042
Matrix Scientific	037118

Database	Data ID
PubChem	25219461

M. W.

228.24658

CAS

861583-66-6

Similarity

N/A

ID: 34366

4-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidine-5-carboxylic acid

$$$$ Data

M. F.

C13H9F3N2O2

Suppliers	Catalog Number
Matrix Scientific	037119

Database	Data ID
PubChem	22250832

M. W.

282.2179696

CAS

Similarity

N/A

ID: 34367

2-(2-oxo-1,2-dihydropyrimidin-1-yl)acetic acid

$$$$ Data More

M. F.

C6H6N2O3

Suppliers	Catalog Number
Sigma Aldrich	CBR00231
ChemBridge	4028397
Matrix Scientific	037120

Database	Data ID
PubChem	1096409

M. W.

154.12344

CAS

95209-83-9

Similarity

N/A

ID: 34368

5-methyl-1,2-oxazole-4-carboxylic acid

$$$$ Data More

M. F.

C5H5NO3

Suppliers	Catalog Number
Sigma Aldrich	633771
ChemBridge	3001678
Alfa Aesar	L14628

Database	Data ID
PubChem	1425240

M. W.

127.0981

CAS

42831-50-5

Similarity

N/A

ID: 34369

4-methyl-6-(trifluoromethyl)pyrimidin-2-amine

$$$$ Data

M. F.

C6H6F3N3

Suppliers	Catalog Number
ChemBridge	4027846
Matrix Scientific	037122

Database	Data ID
PubChem	600769

M. W.

177.1271496

CAS

5734-63-4

Similarity

N/A

ID: 34370

1-(3,4-dimethylphenyl)-1H-pyrazole-4-carbaldehyde

$$$$ Data

M. F.

C12H12N2O

Suppliers	Catalog Number
ChemBridge	4028446
Matrix Scientific	037123

Database	Data ID
PubChem	25219462

M. W.

200.23648

CAS

Similarity

N/A

ID: 34371

3-(4-aminophenyl)-1,2,3$l^{5},4-oxatriazol-3-ylium-5-olate

$$$$ Data

M. F.

C7H6N4O2

Suppliers	Catalog Number
Matrix Scientific	037124

Database	Data ID
PubChem	25219463

M. W.

178.14814

CAS

Similarity

N/A

ID: 34372

2-amino-3-cyanoquinoxaline-1,4-diium-1,4-bis(olate)

$$$$ Data More

M. F.

C9H6N4O2

Suppliers	Catalog Number
Matrix Scientific	037125
Apollo Scientific	OR30344
InterBioScreen	Bio-0835

Database	Data ID
PubChem	464050

M. W.

202.16954

CAS

23190-84-3

Similarity

N/A

ID: 34373

[1-(4-fluorophenyl)-1H-pyrazol-4-yl]methanol

$$$$ Data

M. F.

C10H9FN2O

Suppliers	Catalog Number
ChemBridge	4010495
Matrix Scientific	037126

Database	Data ID
PubChem	21770104

M. W.

192.1896632

CAS

153863-34-4

Similarity

N/A

ID: 34374

2-(3-phenyl-1H-pyrazol-1-yl)acetic acid

$$$$ Data

M. F.

C11H10N2O2

Suppliers	Catalog Number
Matrix Scientific	037127
Apollo Scientific	OR9431
Enamine	EN300-92459

Database	Data ID
PubChem	2737161

M. W.

202.2093

CAS

959574-98-2

Similarity

N/A

ID: 34375

2-[3-(4-methoxyphenyl)-1H-pyrazol-1-yl]acetic acid

$$$$ Data More

M. F.

C12H12N2O3

Suppliers	Catalog Number
Matrix Scientific	037128
Apollo Scientific	OR3289
Bide Pharmatech	BD222889

Database	Data ID
PubChem	2736767

M. W.

232.23528

CAS

959584-25-9

Similarity

N/A

ID: 34376

4-methyl-6-(trifluoromethyl)pyrimidin-2-ol

$$$$ Data

M. F.

C6H5F3N2O

Suppliers	Catalog Number
ChemBridge	4040017
Matrix Scientific	037129
Enamine	EN300-129841

Database	Data ID
PubChem	4913130

M. W.

178.1119096

CAS

91606-60-9

Similarity

N/A

ID: 34377

5-methyl-3-phenyl-1H-pyrazol-4-amine

$$$$ Data

M. F.

C10H11N3

Suppliers	Catalog Number
Matrix Scientific	037130
A&J Pharmtech	AJA-O1288

Database	Data ID
PubChem	3381778

M. W.

173.21444

CAS

112884-51-2

Similarity

N/A

ID: 34378

5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid

$$$$ Data

M. F.

C5H3N3O6

Suppliers	Catalog Number
Matrix Scientific	037131
Bide Pharmatech	BD105065

Database	Data ID
PubChem	103442

M. W.

201.09382

CAS

17687-24-0

Similarity

N/A

ID: 34379

N-(5-amino-1H-1,2,4-triazol-3-yl)acetamide

$$$$ Data

M. F.

C4H7N5O

Suppliers	Catalog Number
ChemBridge	3001899
Matrix Scientific	037132
Enamine	EN300-82352

Database	Data ID
PubChem	4008423

M. W.

141.13128

CAS

80616-55-3

Similarity

N/A

ID: 34380

5-hydroxy-3-methyl-1H-pyrazole-4-carbaldehyde

$$$$ Data

M. F.

C5H6N2O2

Suppliers	Catalog Number
ChemBridge	3001850
Matrix Scientific	037133

Database	Data ID
PubChem	10942418

M. W.

126.11334

CAS

470704-73-5

Similarity

N/A

ID: 34381

5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

$$$$ Data More

M. F.

C7H9N5

Suppliers	Catalog Number
ChemBridge	3002698
Matrix Scientific	037134
Key Organics	CA-0724

Database	Data ID
PubChem	267310

M. W.

163.17986

CAS

7135-02-6

Similarity

N/A

ID: 34382

4-methyl-1H-1,2,3-benzotriazole

$$$$ Data

M. F.

C7H7N3

Suppliers	Catalog Number
Sigma Aldrich	14593
Matrix Scientific	037135
TRC	M288780

Database	Data ID
PubChem	122499

M. W.

133.15058

CAS

29878-31-7

Similarity

N/A

ID: 34383

5-(hydroxymethyl)-6-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

$$$$ Data

M. F.

C6H8N2O3

Suppliers	Catalog Number
Matrix Scientific	037136
InterBioScreen	STOCK1N-00496
Enamine	EN300-125289

Database	Data ID
PubChem	8983

M. W.

156.13932

CAS

147-61-5

Similarity

N/A

ID: 34384

quinazolin-4-amine

$$$$ Data More

M. F.

C8H7N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00181
ChemBridge	4031515
Matrix Scientific	037137

Database	Data ID
PubChem	84759

M. W.

145.16128

CAS

15018-66-3

Similarity

N/A

ID: 34385

3-tert-butyl-1H-pyrazole

$$$$ Data

M. F.

C7H12N2

Suppliers	Catalog Number
ChemBridge	4031006
Matrix Scientific	037138

Database	Data ID
PubChem	139978

M. W.

124.18358

CAS

15802-80-9

Similarity

N/A

ID: 34386

3-phenyl-1H-pyrazole

$$$$ Data More

M. F.

C9H8N2

Suppliers	Catalog Number
Sigma Aldrich	676349
Matrix Scientific	037139
Apollo Scientific	OR9451

Database	Data ID
PubChem	17155

M. W.

144.17322

CAS

2458-26-6

Similarity

N/A

ID: 34387

6-bromo-2,3,4,9-tetrahydro-1H-carbazole

$$$$ Data

M. F.

C12H12BrN

Suppliers	Catalog Number
Matrix Scientific	037140
InterBioScreen	STOCK1N-02048

Database	Data ID
PubChem	268877

M. W.

250.13438

CAS

21865-50-9

Similarity

N/A

ID: 34388

N-[(4Z)-4,5,6,7-tetrahydro-1H-indazol-4-ylidene]hydroxylamine

$$$$ Data

M. F.

C7H9N3O

Suppliers	Catalog Number
Matrix Scientific	037141

Database	Data ID
PubChem	25219466

M. W.

151.16586

CAS

Similarity

N/A

ID: 34389

6-fluoro-2,3,4,9-tetrahydro-1H-carbazole

$$$$ Data

M. F.

C12H12FN

Suppliers	Catalog Number
Matrix Scientific	037142
Bide Pharmatech	BD180494

Database	Data ID
PubChem	5067013

M. W.

189.2287832

CAS

2367-17-1

Similarity

N/A

ID: 34390

7-fluoro-1H,2H,3H,4H-cyclopenta[b]indole

$$$$ Data

M. F.

C11H10FN

Suppliers	Catalog Number
Matrix Scientific	037143
Bide Pharmatech	BD122879

Database	Data ID
PubChem	25219467

M. W.

175.2022032

CAS

327021-84-1

Similarity

N/A

ID: 34391

5-methyl-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

$$$$ Data

M. F.

C7H6F3N5

Suppliers	Catalog Number
ChemBridge	3002567
Matrix Scientific	037144

Database	Data ID
PubChem	7341290

M. W.

217.1512496

CAS

339201-69-3

Similarity

N/A

ID: 34392

bis[2-(propan-2-yloxy)ethyl]amine

$$$$ Data

M. F.

C10H23NO2

Suppliers	Catalog Number
Matrix Scientific	037145

Database	Data ID
PubChem	22450263

M. W.

189.29512

CAS

Similarity

N/A

ID: 34393

ethyl 3-hydroxyquinoxaline-2-carboxylate

$$$$ Data

M. F.

C11H10N2O3

Suppliers	Catalog Number
Matrix Scientific	037146

Database	Data ID
PubChem	248643

M. W.

218.2087

CAS

Similarity

N/A

ID: 34394

2,2-dimethyl-3-[(4-methylbenzenesulfonyl)oxy]propanenitrile

$$$$ Data

M. F.

C12H15NO3S

Suppliers	Catalog Number
Matrix Scientific	037147

Database	Data ID
PubChem	25219468

M. W.

253.3174

CAS

157736-55-5

Similarity

N/A

ID: 34395

[1-(4-bromophenyl)ethyl]dimethylamine hydrochloride

$$$$ Data

M. F.

C10H15BrClN

Suppliers	Catalog Number
Matrix Scientific	037148

Database	Data ID
PubChem	24190701

M. W.

264.5898

CAS

Similarity

N/A

ID: 34396

3-(3-chloro-4-nitro-1,2-oxazol-5-yl)propanoic acid

$$$$ Data

M. F.

C6H5ClN2O5

Suppliers	Catalog Number
Matrix Scientific	037149

Database	Data ID
PubChem	25219469

M. W.

220.5673

CAS

Similarity

N/A

ID: 34397

N-(2-hydroxy-4-methylquinolin-6-yl)acetamide

$$$$ Data

M. F.

C12H12N2O2

Suppliers	Catalog Number
Matrix Scientific	037150

Database	Data ID
PubChem	20971549

M. W.

216.23588

CAS

Similarity

N/A

ID: 34398

2-{4-[(methylamino)methyl]phenoxy}benzonitrile hydrochloride

$$$$ Data

M. F.

C15H15ClN2O

Suppliers	Catalog Number
Matrix Scientific	037151

Database	Data ID
PubChem	46736942

M. W.

274.7454

CAS

Similarity

N/A

ID: 34399

4-methyl-6-nitroquinolin-2-ol

$$$$ Data

M. F.

C10H8N2O3

Suppliers	Catalog Number
Matrix Scientific	037152
InterBioScreen	BB_SC-0414

Database	Data ID
PubChem	609262

M. W.

204.18212

CAS

Similarity

N/A

ID: 34400

ethyl 4-methyl-2-(methylamino)-1,3-thiazole-5-carboxylate

$$$$ Data

M. F.

C8H12N2O2S

Suppliers	Catalog Number
Matrix Scientific	037153

Database	Data ID
PubChem	4820961

M. W.

200.25808

CAS

Similarity

N/A

Part I: Carbon
- I.1: Carbon-Carbon Bonds
- I.1.1 Alkanes
- Primary carbon
- Secondary carbon
- Tertiary carbon
- Quaternary carbon
- I.1.2 C-C double and Triple Bonds
- Alkene
- Alkyne
- Allene
- I.2: One Carbon-Hetero Bond
- I.2.1 Alkyl Halogenides
- Alkylchloride
- Alkylfluoride
- Alkylbromide
- Alkyliodide
- I.2.2 Alcohols and Ethers
- Alcohol
- Primary alcohol
- Secondary alcohol
- Tertiary alcohol
- Dialkylether
- Dialkylthioether
- Alkylarylether
- Diarylether
- Alkylarylthioether
- Diarylthioether
- Oxonium
- I.2.3 Amines
- Amine
- Primary aliphatic amine
- Secondary aliphatic amine
- Tertiary aliphatic amine
- Quaternary aliphatic ammonium
- Primary aromatic amine
- Secondary aromatic amine
- Tertiary aromatic amine
- Quaternary aromatic ammonium
- Secondary mixed amine
- Tertiary mixed amine
- Quaternary mixed ammonium
- Ammonium
- I.2.4 Others
- Alkylthiol
- Dialkylthioether
- Alkylarylthioether
- Disulfide
- 1,2-Aminoalcohol
- 1,2-Diol
- 1,1-Diol
- Hydroperoxide
- Peroxo
- Organolithium compounds
- Organomagnesium compounds
- Organometallic compounds
- I.3: Two Carbon-Hetero Bonds (Carbonyl and Derivatives)
- I.3.1 Double Bond to Hetero
- Aldehyde
- Ketone
- Thioaldehyde
- Thioketone
- Imine
- Immonium
- Oxime
- Oximether
- I.3.2. Two Single Bonds to Hetero
- Acetal
- Hemiacetal
- Aminal
- Hemiaminal
- Thioacetal
- Thiohemiacetal
- Halogen acetal like
- Acetal like
- Halogenmethylen ester and similar
- NOS methylen ester and similar
- Hetero methylen ester and similar
- Cyanhydrine
- I.3.3 Single Bond to Hetero, C=C Double Bond (Enols and Similar)
- Chloroalkene
- Fluoroalkene
- Bromoalkene
- Iodoalkene
- Enol
- Endiol
- Enolether
- Enolester
- Enamine
- Thioenol
- Thioenolether
- I.4: Three Carbon-Hetero Bonds (Carboxyl and Derivatives)
- Acylchloride
- Acylfluoride
- Acylbromide
- Acyliodide
- Acylhalide
- Carboxylic acid
- Carboxylic ester
- Lactone
- Carboxylic anhydride
- Carboxylic acid derivative
- Carbothioic acid
- Carbothioic S ester
- Carbothioic S lactone
- Carbothioic O ester
- Carbothioic O lactone
- Carbothioic halide
- Carbodithioic acid
- Carbodithioic ester
- Carbodithiolactone
- Amide
- Primary amide
- Secondary amide
- Tertiary amide
- Lactam
- Alkyl imide
- N hetero imide
- Imide acidic
- Thioamide
- Thiolactam
- Oximester
- Amidine
- Hydroxamic acid
- Hydroxamic acid ester
- Imidoacid
- Imidoacid cyclic
- Imidoester
- Imidolactone
- Imidothioacid
- Imidothioacid cyclic
- Imidothioester
- Imidothiolactone
- Amidine
- Imidolactam
- Imidoylhalide
- Imidoylhalide cyclic
- Amidrazone
- Alpha aminoacid
- Alpha hydroxyacid
- Peptide middle
- Peptide C term
- Peptide N term
- Carboxylic orthoester
- Ketene
- Ketenacetal
- Nitrile
- Isonitrile
- Vinylogous carbonyl or carboxyl derivative
- Vinylogous acid
- Vinylogous ester
- Vinylogous amide
- Vinylogous halide
- I.5: Four Carbon-Hetero Bonds (Carbonic Acid and Derivatives)
- Carbonic acid dieester
- Carbonic acid esterhalide
- Carbonic acid monoester
- Carbonic acid derivatives
- Thiocarbonic acid dieester
- Thiocarbonic acid esterhalide
- Thiocarbonic acid monoester
- Urea
- Thiourea
- Isourea
- Isothiourea
- Guanidine
- Carbaminic acid
- Urethan(Carbamate ester)
- Biuret
- Semicarbazide
- Carbazide
- Semicarbazone
- Carbazone
- Thiosemicarbazide
- Thiocarbazide
- Thiosemicarbazone
- Thiocarbazone
- Isocyanate
- Cyanate
- Isothiocyanate
- Thiocyanate
- Carbodiimide
- Orthocarbonic derivatives
- I.6 Aromatics
- Phenol
- 1,2-Diphenol
- Arylchloride
- Arylfluoride
- Arylbromide
- Aryliodide
- Arylthiol
- Iminoarene
- Oxoarene
- Thioarene
- Hetero N basic H
- Hetero N basic no H
- Hetero N nonbasic
- Hetero O
- Hetero S
- Heteroaromatic
Part II: N, S, P, Si, B
- II.1 Nitrogen
- Nitrite
- Thionitrite
- Nitrate
- Nitro
- Nitroso
- Azide
- Acylazide
- Diazo
- Diazonium
- Nitrosamine
- Nitrosamide
- N-Oxide
- Hydrazine
- Hydrazone
- Hydroxylamine
- II.2 Sulfur
- Sulfon
- Sulfoxide
- Sulfonium
- Sulfuric acid
- Sulfuric monoester
- Sulfuric diester
- Sulfuric monoamide
- Sulfuric diamide
- Sulfuric esteramide
- Sulfuric derivative
- Sulfonic acid
- Sulfonamide
- Sulfonic ester
- Sulfonic halide
- Sulfonic derivative
- Sulfinic acid
- Sulfinic amide
- Sulfinic ester
- Sulfinic halide
- Sulfinic derivative
- Sulfenic acid
- Sulfenic amide
- Sulfenic ester
- Sulfenic halide
- Sulfenic derivative
- II.3 Phosphorous
- Phosphine
- Phosphine oxide
- Phosphonium
- Phosphorylen
- Phosphonic acid
- Phosphonic monoester
- Phosphonic diester
- Phosphonic monoamide
- Phosphonic diamide
- Phosphonic esteramide
- Phosphonic acid derivative
- Phosphoric acid
- Phosphoric monoester
- Phosphoric diester
- Phosphoric triester
- Phosphoric monoamide
- Phosphoric diamide
- Phosphoric triamide
- Phosphoric monoestermonoamide
- Phosphoric diestermonoamide
- Phosphoric monoesterdiamide
- Phosphoric acid derivative
- Phosphinic acid
- Phosphinic ester
- Phosphinic amide
- Phosphinic acid derivative
- Phosphonous acid
- Phosphonous monoester
- Phosphonous diester
- Phosphonous monoamide
- Phosphonous diamide
- Phosphonous esteramide
- Phosphonous derivatives
- Phosphinous acid
- Phosphinous ester
- Phosphinous amide
- Phosphinous derivatives
- II.4 Silicon
- Quart silane
- Non-quart silane
- Silylmonohalide
- Het trialkylsilane
- Dihet dialkylsilane
- Trihet alkylsilane
- Silicic acid derivative
- II.5 Boron
- Trialkylborane
- Boric acid derivatives
- Boronic acid derivative
- Borohydride
- Quaternary boron
Part III: Some Special Patterns
- III.1 Chains
- III.2 Rings
- Aromatic
- Heterocyclic
- Epoxide
- NH aziridine
- Spiro
- Annelated rings
- Bridged rings
- III.3 Sugars and Nucleosides/Nucleotides, Steroids
- Sugar pattern 1
- Sugar pattern 2
- Sugar pattern combi
- Sugar pattern 2 reducing
- Sugar pattern 2 alpha
- Sugar pattern 2 beta
- III.4 Everything else...
- Conjugated double bond
- Conjugated tripple bond
- Cis double bond
- Trans double bond
- Mixed anhydrides
- Halogen on hetero
- Halogen multi subst
- Trifluoromethyl
- C ONS bond
- Charged
- Anion
- Kation
- Salt
- 1,3-Tautomerizable
- 1,5-Tautomerizable
- Rotatable bond
- Michael acceptor
- Dicarbodiazene
- CH-acidic
- CH-acidic strong
- Chiral center specified