Chembase list of 866358 unique molecular structures

$$$$ Data

M. F.

C12H16ClN

Suppliers	Catalog Number
Apollo Scientific	OR59388

Database	Data ID
PubChem	26967047

M. W.

209.71514

CAS

Similarity

N/A

ID: 90152

methyl 5-(2-chlorophenyl)-1,3-oxazole-4-carboxylate

$$$$ Data

M. F.

C11H8ClNO3

Suppliers	Catalog Number
Apollo Scientific	OR59389
Bide Pharmatech	BD231214

Database	Data ID
PubChem	13290634

M. W.

237.63912

CAS

89204-91-1

Similarity

N/A

ID: 90153

1-(3-chlorophenyl)pyrrolidine

$$$$ Data

M. F.

C10H12ClN

Suppliers	Catalog Number
Apollo Scientific	OR59390

Database	Data ID
PubChem	14509632

M. W.

181.66198

CAS

Similarity

N/A

ID: 90154

methyl 2-(4-bromo-1H-pyrazol-1-yl)acetate

$$$$ Data

M. F.

C6H7BrN2O2

Suppliers	Catalog Number
Apollo Scientific	OR59391
Bide Pharmatech	BD230049
A&J Pharmtech	AJA-O1736

Database	Data ID
PubChem	26967051

M. W.

219.03598

CAS

1072944-71-8

Similarity

N/A

ID: 90155

6-bromo-2-cyclohexyl-3,4-dihydroquinazolin-4-one

$$$$ Data

M. F.

C14H15BrN2O

Suppliers	Catalog Number
Apollo Scientific	OR59392

Database	Data ID
PubChem	26967053

M. W.

307.1857

CAS

Similarity

N/A

ID: 90156

4-nitrobenzene-1-carboximidamide hydrochloride

$$$$ Data More

M. F.

C7H8ClN3O2

Suppliers	Catalog Number
Apollo Scientific	OR59393
TRC	N492575
Enamine	EN300-18674

Database	Data ID
PubChem	170625

M. W.

201.61032

CAS

15723-90-7

Similarity

N/A

ID: 90157

N-ethyl-N-[(4-methoxyphenyl)methyl]benzenesulfonamide

$$$$ Data

M. F.

C16H19NO3S

Suppliers	Catalog Number
Apollo Scientific	OR59397

Database	Data ID
PubChem	26967057

M. W.

305.39196

CAS

Similarity

N/A

ID: 90158

N-(4-bromo-3-chloro-2-methylphenyl)acetamide

$$$$ Data

M. F.

C9H9BrClNO

Suppliers	Catalog Number
Apollo Scientific	OR59398

Database	Data ID
PubChem	86376

M. W.

262.53086

CAS

Similarity

N/A

ID: 90159

N,2,2-trimethyl-N-(pyridin-2-yl)propanamide

$$$$ Data

M. F.

C11H16N2O

Suppliers	Catalog Number
Apollo Scientific	OR59399
Bide Pharmatech	BD229872

Database	Data ID
PubChem	13352178

M. W.

192.25754

CAS

96830-03-4

Similarity

N/A

ID: 90160

N-[(4-methoxyphenyl)methyl]-N-methylbenzenesulfonamide

$$$$ Data

M. F.

C15H17NO3S

Suppliers	Catalog Number
Apollo Scientific	OR59400

Database	Data ID
PubChem	6464074

M. W.

291.36538

CAS

Similarity

N/A

ID: 90161

2-(2-bromophenyl)-2-(dimethylamino)acetonitrile

$$$$ Data

M. F.

C10H11BrN2

Suppliers	Catalog Number
Apollo Scientific	OR59401
Life Chemicals	F2189-0163
Enamine	EN300-84691

Database	Data ID
PubChem	10657608

M. W.

239.11174

CAS

Similarity

N/A

ID: 90162

4-chloro-N,N-bis(propan-2-yl)benzamide

$$$$ Data

M. F.

C13H18ClNO

Suppliers	Catalog Number
Alfa Aesar	H59839
Apollo Scientific	OR59402

Database	Data ID
PubChem	241026

M. W.

239.74112

CAS

79606-45-4

Similarity

N/A

ID: 90163

methyl 4-methoxypyridine-3-carboxylate

$$$$ Data

M. F.

C8H9NO3

Suppliers	Catalog Number
Apollo Scientific	OR59403

Database	Data ID
PubChem	10678657

M. W.

167.16196

CAS

10177-32-9

Similarity

N/A

ID: 90164

(6-chloro-1-methyl-1H-indol-2-yl)boronic acid

$$$$ Data

M. F.

C9H9BClNO2

Suppliers	Catalog Number
Apollo Scientific	OR59404
Bide Pharmatech	BD168112

Database	Data ID
PubChem	44119594

M. W.

209.43726

CAS

957066-11-4

Similarity

N/A

ID: 90165

N'-(4,4-dimethylcyclohexylidene)-2,4,6-trimethylbenzene-1-sulfonohydrazide

$$$$ Data

M. F.

C17H26N2O2S

Suppliers	Catalog Number
Apollo Scientific	OR59405

Database	Data ID
PubChem	26967065

M. W.

322.46554

CAS

957066-12-5

Similarity

N/A

ID: 90166

1-bromocyclohept-1-ene

$$$$ Data

M. F.

C7H11Br

Suppliers	Catalog Number
Apollo Scientific	OR59406

Database	Data ID
PubChem	565318

M. W.

175.06624

CAS

18317-64-1

Similarity

N/A

ID: 90167

3-bromo-N-cyclohexylbenzamide

$$$$ Data

M. F.

C13H16BrNO

Suppliers	Catalog Number
Apollo Scientific	OR59407

Database	Data ID
PubChem	2306322

M. W.

282.17624

CAS

59507-55-0

Similarity

N/A

ID: 90168

N-(9H-fluoren-9-ylidene)hydroxylamine

$$$$ Data

M. F.

C13H9NO

Suppliers	Catalog Number
Alfa Aesar	L03950
Apollo Scientific	OR59408

Database	Data ID
PubChem	16543

M. W.

195.21666

CAS

2157-52-0

Similarity

N/A

ID: 90169

2-bromo-N,2-dimethylpropanamide

$$$$ Data

M. F.

C5H10BrNO

Suppliers	Catalog Number
Apollo Scientific	OR59409
Bide Pharmatech	BD231640

Database	Data ID
PubChem	287560

M. W.

180.043

CAS

69959-88-2

Similarity

N/A

ID: 90170

(1S)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylic acid

$$$$ Data

M. F.

C10H14O4

Suppliers	Catalog Number
Apollo Scientific	OR5941

Database	Data ID
PubChem	12302326

M. W.

198.21576

CAS

13429-83-9

Similarity

N/A

ID: 90171

3-bromo-5-[(4-methoxyphenyl)methoxy]pyridine

$$$$ Data

M. F.

C13H12BrNO2

Suppliers	Catalog Number
Apollo Scientific	OR59410

Database	Data ID
PubChem	22607345

M. W.

294.14388

CAS

552331-73-4

Similarity

N/A

ID: 90172

5-bromo-2-[(4-methoxyphenyl)methoxy]pyridine

$$$$ Data

M. F.

C13H12BrNO2

Suppliers	Catalog Number
Apollo Scientific	OR59411

Database	Data ID
PubChem	26967066

M. W.

294.14388

CAS

663955-79-1

Similarity

N/A

ID: 90173

{4-[(3-chloro-2-methylphenyl)sulfamoyl]phenyl}boronic acid

$$$$ Data

M. F.

C13H13BClNO4S

Suppliers	Catalog Number
Apollo Scientific	OR59412

Database	Data ID
PubChem	44119595

M. W.

325.57562

CAS

957066-10-3

Similarity

N/A

ID: 90174

1-(benzenesulfonyl)pyrrolidine

$$$$ Data

M. F.

C10H13NO2S

Suppliers	Catalog Number
Apollo Scientific	OR59413

Database	Data ID
PubChem	246138

M. W.

211.28072

CAS

5033-22-7

Similarity

N/A

ID: 90175

4-chloro-5-(dihydroxyboranyl)-2-methoxybenzoic acid

$$$$ Data

M. F.

C8H8BClO5

Suppliers	Catalog Number
Apollo Scientific	OR59414
Bide Pharmatech	BD231239

Database	Data ID
PubChem	44119596

M. W.

230.41012

CAS

957066-09-0

Similarity

N/A

ID: 90176

[4-(3-acetohydrazido-3-oxopropyl)phenyl]boronic acid

$$$$ Data

M. F.

C11H15BN2O4

Suppliers	Catalog Number
Apollo Scientific	OR59415
Bide Pharmatech	BD230207

Database	Data ID
PubChem	44119597

M. W.

250.0588

CAS

957066-08-9

Similarity

N/A

ID: 90177

[2-chloro-4-methoxy-5-(methoxycarbonyl)phenyl]boronic acid

$$$$ Data

M. F.

C9H10BClO5

Suppliers	Catalog Number
Apollo Scientific	OR59416
Bide Pharmatech	BD231626

Database	Data ID
PubChem	44119653

M. W.

244.4367

CAS

957066-07-8

Similarity

N/A

ID: 90178

1-(4-chlorobenzoyl)pyrrolidine

$$$$ Data

M. F.

C11H12ClNO

Suppliers	Catalog Number
Alfa Aesar	H55325
Apollo Scientific	OR59417

Database	Data ID
PubChem	819717

M. W.

209.67208

CAS

19202-05-2

Similarity

N/A

ID: 90179

1-[3-bromo-4-(morpholin-4-yl)phenyl]ethan-1-one

$$$$ Data

M. F.

C12H14BrNO2

Suppliers	Catalog Number
Apollo Scientific	OR59418

Database	Data ID
PubChem	26967067

M. W.

284.14906

CAS

957066-05-6

Similarity

N/A

ID: 90180

methyl 2-(4-chloro-3-nitrophenyl)acetate

$$$$ Data

M. F.

C9H8ClNO4

Suppliers	Catalog Number
Apollo Scientific	OR5942

Database	Data ID
PubChem	12069505

M. W.

229.61712

CAS

Similarity

N/A

ID: 90181

1,4-diethyl but-2-ynedioate

$$$$ Data More

M. F.

C8H10O4

Suppliers	Catalog Number
Sigma Aldrich	159441
Alfa Aesar	A11719
Apollo Scientific	OR59420

Database	Data ID
PubChem	69803

M. W.

170.1626

CAS

762-21-0

Similarity

N/A

ID: 90182

4-(2-carboxybenzoyl)benzoic acid

$$$$ Data

M. F.

C15H10O5

Suppliers	Catalog Number
MP Biomedicals	05220756
Apollo Scientific	OR59421

Database	Data ID
PubChem	221116

M. W.

270.2369

CAS

85-58-5

Similarity

N/A

ID: 90183

(benzenesulfonyl)methanesulfonylbenzene

$$$$ Data More

M. F.

C13H12O4S2

Suppliers	Catalog Number
Sigma Aldrich	302961 15153
Apollo Scientific	OR59422
Chemik	CHH20553

Database	Data ID
PubChem	76948

M. W.

296.36198

CAS

3406-02-8

Similarity

N/A

ID: 90184

3-(bromomethyl)pentane

$$$$ Data

M. F.

C6H13Br

Suppliers	Catalog Number
Sigma Aldrich	252263
MP Biomedicals	05202726 05222778
Apollo Scientific	OR59423

Database	Data ID
PubChem	77432

M. W.

165.07142

CAS

3814-34-4

Similarity

N/A

ID: 90185

2-bromo-5-nitroaniline

$$$$ Data More

M. F.

C6H5BrN2O2

Suppliers	Catalog Number
Sigma Aldrich	454257
Alfa Aesar	L02597
Apollo Scientific	OR59426

Database	Data ID
PubChem	82607

M. W.

217.0201

CAS

10403-47-1

Similarity

N/A

ID: 90186

9H-carbazol-2-ol

$$$$ Data More

M. F.

C12H9NO

Suppliers	Catalog Number
Sigma Aldrich	213497 55010
Alfa Aesar	H27765
Apollo Scientific	OR59428

Database	Data ID
PubChem	93551

M. W.

183.20596

CAS

86-79-3

Similarity

N/A

ID: 90187

2-chloroethanecarbonyl isocyanate

$$$$ Data

M. F.

C3H2ClNO2

Suppliers	Catalog Number
Sigma Aldrich	259322
Alfa Aesar	L00301
Apollo Scientific	OR59429

Database	Data ID
PubChem	78209

M. W.

119.50648

CAS

4461-30-7

Similarity

N/A

ID: 90188

(2,3-dichlorophenyl)hydrazine hydrochloride

$$$$ Data

M. F.

C6H7Cl3N2

Suppliers	Catalog Number
Alfa Aesar	A10717
Apollo Scientific	OR5943
A&J Pharmtech	AJA-O2533

Database	Data ID
PubChem	12276572

M. W.

213.49218

CAS

21938-47-6

Similarity

N/A

ID: 90189

4-chloro-1-phenylbutan-1-one

$$$$ Data More

M. F.

C10H11ClO

Suppliers	Catalog Number
Sigma Aldrich	363448 24070
MP Biomedicals	05206187
Alfa Aesar	A14531 L06383

Database	Data ID
PubChem	253533

M. W.

182.64674

CAS

939-52-6

Similarity

N/A

ID: 90190

1-[4-(chloromethyl)phenyl]-1H-pyrazole

$$$$ Data More

M. F.

C10H9ClN2

Suppliers	Catalog Number
Sigma Aldrich	CBR00371
ChemBridge	4015563
Apollo Scientific	OR59436

Database	Data ID
PubChem	7130887

M. W.

192.64486

CAS

143426-52-2

Similarity

N/A

ID: 90191

N-(propan-2-yl)hydroxylamine hydrochloride

$$$$ Data

M. F.

C3H10ClNO

Suppliers	Catalog Number
Sigma Aldrich	248657 59428
Apollo Scientific	OR59437

Database	Data ID
PubChem	170873

M. W.

111.5706

CAS

50632-53-6

Similarity

N/A

ID: 90192

methyl[2-(pyridin-4-yl)ethyl]amine hydrochloride

$$$$ Data

M. F.

C8H13ClN2

Suppliers	Catalog Number
Apollo Scientific	OR59439

Database	Data ID
PubChem	44119600

M. W.

172.65522

CAS

Similarity

N/A

ID: 90193

3-methoxybenzoic acid

$$$$ Data More

M. F.

C8H8O3

Suppliers	Catalog Number
Sigma Aldrich	117714 W394440 64800
MP Biomedicals	05204526
Alfa Aesar	A10767

Database	Data ID
PubChem	11461

M. W.

152.14732

CAS

586-38-9

Similarity

N/A

ID: 90194

ethyl 3-isocyanatopropanoate

$$$$ Data More

M. F.

C6H9NO3

Suppliers	Catalog Number
Sigma Aldrich	479012
Alfa Aesar	L09616
Apollo Scientific	OR59440

Database	Data ID
PubChem	2733373

M. W.

143.14056

CAS

5100-34-5

Similarity

N/A

ID: 90195

tert-butyl (2R)-2-methylpyrrolidine-1-carboxylate

$$$$ Data More

M. F.

C10H19NO2

Suppliers	Catalog Number
Sigma Aldrich	697346
Alfa Aesar	H57231
Apollo Scientific	OR59441

Database	Data ID
PubChem	1519407

M. W.

185.26336

CAS

157007-54-0

Similarity

N/A

ID: 90196

methyl 2-(3-aminophenyl)acetate

$$$$ Data More

M. F.

C9H11NO2

Suppliers	Catalog Number
ChemBridge	4033474
Apollo Scientific	OR59446
Bide Pharmatech	BD138599

Database	Data ID
PubChem	13054266

M. W.

165.18914

CAS

52913-11-8

Similarity

N/A

ID: 90197

4-[6-(tributylstannyl)pyridin-2-yl]morpholine

$$$$ Data

M. F.

C21H38N2OSn

Suppliers	Catalog Number
Maybridge	CC38341
Apollo Scientific	OR59449

Database	Data ID
PubChem	18525739

M. W.

453.24022

CAS

869901-24-6

Similarity

N/A

ID: 90198

2-[(naphthalen-1-yloxy)methyl]oxirane

$$$$ Data

M. F.

C13H12O2

Suppliers	Catalog Number
Apollo Scientific	OR5945
TRC	N378400
Enamine	EN300-09936

Database	Data ID
PubChem	91521

M. W.

200.23318

CAS

2461-42-9

Similarity

N/A

ID: 90199

2-bromo-6-(piperidin-1-yl)pyridine

$$$$ Data

M. F.

C10H13BrN2

Suppliers	Catalog Number
Maybridge	CC38110
Apollo Scientific	OR59450
A&J Pharmtech	AJA-O25711

Database	Data ID
PubChem	7164597

M. W.

241.12762

CAS

24255-97-8

Similarity

N/A

ID: 90200

1-bromoisoquinoline

$$$$ Data

M. F.

C9H6BrN

Suppliers	Catalog Number
Sigma Aldrich	716510
Apollo Scientific	OR59454
Bide Pharmatech	BD11485

Database	Data ID
PubChem	640963

M. W.

208.05464

CAS

1532-71-4

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