Chembase list of 866358 unique molecular structures

3-(azetidin-3-yl)-4-methyl-1H-pyrazole; bis(trifluoroacetic acid)

$$$$ Data

M. F.

C11H13F6N3O4

Suppliers	Catalog Number
Matrix Scientific	068362

Database	Data ID
PubChem	71298999

M. W.

365.2290392

CAS

Similarity

N/A

ID: 63052

3-{1-methyl-1H-pyrazolo[3,4-b]pyrazin-3-yl}azetidine hydrochloride

$$$$ Data

M. F.

C9H12ClN5

Suppliers	Catalog Number
Matrix Scientific	068363

Database	Data ID
PubChem	71299000

M. W.

225.67808

CAS

Similarity

N/A

ID: 63053

2-[3-(pyrrolidin-3-yl)-1H-pyrazol-5-yl]ethan-1-ol dihydrochloride

$$$$ Data

M. F.

C9H17Cl2N3O

Suppliers	Catalog Number
Matrix Scientific	068364

Database	Data ID
PubChem	71299001

M. W.

254.15678

CAS

Similarity

N/A

ID: 63054

2-[3-(piperidin-2-yl)-1H-pyrazol-5-yl]ethan-1-ol

$$$$ Data

M. F.

C10H17N3O

Suppliers	Catalog Number
Matrix Scientific	068365

Database	Data ID
PubChem	66509768

M. W.

195.26148

CAS

Similarity

N/A

ID: 63055

2-methyl-6-(piperidin-3-yl)pyridin-4-ol dihydrochloride

$$$$ Data

M. F.

C11H18Cl2N2O

Suppliers	Catalog Number
Matrix Scientific	068366

Database	Data ID
PubChem	71299002

M. W.

265.17942

CAS

Similarity

N/A

ID: 63056

[3-(pyrrolidin-2-yl)-1H-pyrazol-5-yl]methanol dihydrochloride

$$$$ Data

M. F.

C8H15Cl2N3O

Suppliers	Catalog Number
Matrix Scientific	068367

Database	Data ID
PubChem	71299003

M. W.

240.1302

CAS

Similarity

N/A

ID: 63057

3-(pyrrolidin-2-yl)-5-(trifluoromethyl)-1H-pyrazole hydrochloride

$$$$ Data

M. F.

C8H11ClF3N3

Suppliers	Catalog Number
Matrix Scientific	068368

Database	Data ID
PubChem	71299004

M. W.

241.6412496

CAS

Similarity

N/A

ID: 63058

2-[3-(pyrrolidin-2-yl)-1H-pyrazol-5-yl]ethan-1-ol

$$$$ Data

M. F.

C9H15N3O

Suppliers	Catalog Number
Matrix Scientific	068369

Database	Data ID
PubChem	66509228

M. W.

181.2349

CAS

Similarity

N/A

ID: 63059

N-methyl-6-(piperidin-4-yl)pyridin-2-amine hydrochloride

$$$$ Data

M. F.

C11H18ClN3

Suppliers	Catalog Number
Matrix Scientific	068370

Database	Data ID
PubChem	71299005

M. W.

227.73372

CAS

Similarity

N/A

ID: 63060

5-bromo-2-[1-(propan-2-yl)pyrrolidin-2-yl]pyridine dihydrochloride

$$$$ Data

M. F.

C12H19BrCl2N2

Suppliers	Catalog Number
Matrix Scientific	068371

Database	Data ID
PubChem	71299006

M. W.

342.10266

CAS

Similarity

N/A

ID: 63061

N,N-dimethyl-3-[3-(pyrazin-2-yl)propyl]azetidine-3-carboxamide

$$$$ Data

M. F.

C13H20N4O

Suppliers	Catalog Number
Matrix Scientific	068372

Database	Data ID
PubChem	66509256

M. W.

248.3241

CAS

Similarity

N/A

ID: 63062

1-methyl-3-[3-(pyrazin-2-yl)propyl]piperidine-3-carboxylic acid

$$$$ Data

M. F.

C14H21N3O2

Suppliers	Catalog Number
Matrix Scientific	068373

Database	Data ID
PubChem	66509248

M. W.

263.33544

CAS

Similarity

N/A

ID: 63063

2-(pyrrolidin-3-ylmethyl)pyrimidine

$$$$ Data

M. F.

C9H13N3

Suppliers	Catalog Number
Matrix Scientific	068374

Database	Data ID
PubChem	66510010

M. W.

163.21962

CAS

Similarity

N/A

ID: 63064

4,6-dimethyl-2-(piperidin-3-yl)pyrimidine dihydrochloride

$$$$ Data

M. F.

C11H19Cl2N3

Suppliers	Catalog Number
Matrix Scientific	068375

Database	Data ID
PubChem	71299007

M. W.

264.19466

CAS

Similarity

N/A

ID: 63065

4,6-dimethyl-2-(pyrrolidin-2-yl)pyrimidine

$$$$ Data

M. F.

C10H15N3

Suppliers	Catalog Number
Matrix Scientific	068376

Database	Data ID
PubChem	63317274

M. W.

177.2462

CAS

Similarity

N/A

ID: 63066

2-(piperidin-3-ylmethyl)pyrimidine hydrochloride

$$$$ Data

M. F.

C10H16ClN3

Suppliers	Catalog Number
Matrix Scientific	068377

Database	Data ID
PubChem	71299008

M. W.

213.70714

CAS

Similarity

N/A

ID: 63067

2-[(2R,5S)-1-acetyl-5-(aminomethyl)pyrrolidin-2-yl]acetamide hydrochloride

$$$$ Data

M. F.

C9H18ClN3O2

Suppliers	Catalog Number
Matrix Scientific	068378

Database	Data ID
PubChem	71299009

M. W.

235.71112

CAS

Similarity

N/A

ID: 63068

5-methyl-2-(piperidin-4-ylmethyl)pyridine dihydrochloride

$$$$ Data

M. F.

C12H20Cl2N2

Suppliers	Catalog Number
Matrix Scientific	068379

Database	Data ID
PubChem	71299011

M. W.

263.2066

CAS

Similarity

N/A

ID: 63069

4-(methylsulfanyl)piperidine hydrochloride

$$$$ Data

M. F.

C6H14ClNS

Suppliers	Catalog Number
Matrix Scientific	068380
Bide Pharmatech	BD227243

Database	Data ID
PubChem	50998950

M. W.

167.70006

CAS

208245-70-9

Similarity

N/A

ID: 63070

tert-butyl 3-aminopyrrolidine-1-carboxylate

$$$$ Data More

M. F.

C9H18N2O2

Suppliers	Catalog Number
Sigma Aldrich	706582
ChemBridge	4036805
Alfa Aesar	H29231

Database	Data ID
PubChem	2756370

M. W.

186.25142

CAS

186550-13-0

Similarity

N/A

ID: 63071

3-chloro-4-hydroxy-5-methylbenzonitrile

$$$$ Data

M. F.

C8H6ClNO

Suppliers	Catalog Number
Matrix Scientific	068382

Database	Data ID
PubChem	19038348

M. W.

167.59234

CAS

173900-45-3

Similarity

N/A

ID: 63072

6-amino-2-methyl-2,3-dihydro-1H-isoindol-1-one

$$$$ Data

M. F.

C9H10N2O

Suppliers	Catalog Number
Matrix Scientific	068383

Database	Data ID
PubChem	12496565

M. W.

162.1885

CAS

69189-26-0

Similarity

N/A

ID: 63073

4-amino-3,5-dimethylbenzonitrile

$$$$ Data

M. F.

C9H10N2

Suppliers	Catalog Number
Matrix Scientific	068384
Bide Pharmatech	BD34818
A&J Pharmtech	AJA-O16928

Database	Data ID
PubChem	278944

M. W.

146.1891

CAS

74896-24-5

Similarity

N/A

ID: 63074

methyl 6-bromopyridine-3-carboxylate

$$$$ Data More

M. F.

C7H6BrNO2

Suppliers	Catalog Number
Matrix Scientific	068385
Apollo Scientific	OR9561
Bide Pharmatech	BD19798

Database	Data ID
PubChem	13349623

M. W.

216.03204

CAS

26218-78-0

Similarity

N/A

ID: 63075

6-hydroxy-4-methyl-1,2-dihydropyridin-2-one

$$$$ Data

M. F.

C6H7NO2

Suppliers	Catalog Number
Matrix Scientific	068386
Bide Pharmatech	BD159332

Database	Data ID
PubChem	78395

M. W.

125.12528

CAS

4664-16-8

Similarity

N/A

ID: 63076

tert-butyl N-(pyridin-2-yl)carbamate

$$$$ Data More

M. F.

C10H14N2O2

Suppliers	Catalog Number
Sigma Aldrich	734705
Alfa Aesar	H30741
Matrix Scientific	068387

Database	Data ID
PubChem	11206349

M. W.

194.23036

CAS

38427-94-0

Similarity

N/A

ID: 63077

3-methylimidazo[1,2-a]pyridine

$$$$ Data

M. F.

C8H8N2

Suppliers	Catalog Number
Matrix Scientific	068388

Database	Data ID
PubChem	12230338

M. W.

132.16252

CAS

5857-45-4

Similarity

N/A

ID: 63078

pyridazin-4-ylmethanamine

$$$$ Data

M. F.

C5H7N3

Suppliers	Catalog Number
Matrix Scientific	068389
A&J Pharmtech	AJA-O21854

Database	Data ID
PubChem	15034997

M. W.

109.12918

CAS

519020-42-9

Similarity

N/A

ID: 63079

pyrimidin-5-ylmethanamine

$$$$ Data More

M. F.

C5H7N3

Suppliers	Catalog Number
Matrix Scientific	068390
TRC	P997350
Bide Pharmatech	BD40749

Database	Data ID
PubChem	18953632

M. W.

109.12918

CAS

25198-95-2

Similarity

N/A

ID: 63080

pyrimidin-2-ylmethanamine

$$$$ Data

M. F.

C5H7N3

Suppliers	Catalog Number
Matrix Scientific	068392
Bide Pharmatech	BD29576
A&J Pharmtech	AJA-O30696

Database	Data ID
PubChem	4658047

M. W.

109.12918

CAS

75985-45-4

Similarity

N/A

ID: 63081

pyridazin-3-ylmethanamine

$$$$ Data More

M. F.

C5H7N3

Suppliers	Catalog Number
Matrix Scientific	068393
Apollo Scientific	OR8924
Bide Pharmatech	BD160746

Database	Data ID
PubChem	22639518

M. W.

109.12918

CAS

93319-65-4

Similarity

N/A

ID: 63082

pyrimidin-4-ylmethanamine dihydrochloride

$$$$ Data

M. F.

C5H9Cl2N3

Suppliers	Catalog Number
Matrix Scientific	068394

Database	Data ID
PubChem	45595827

M. W.

182.05106

CAS

618446-08-5

Similarity

N/A

ID: 63083

methyl 2-{[(tert-butoxy)carbonyl]amino}-2-(dimethoxyphosphoryl)acetate

$$$$ Data More

M. F.

C10H20NO7P

Suppliers	Catalog Number
Sigma Aldrich	09659
Alfa Aesar	B25421
Matrix Scientific	068395

Database	Data ID
PubChem	397380

M. W.

297.242061

CAS

89524-98-1

Similarity

N/A

ID: 63084

1H,2H,3H-pyrrolo[2,3-b]pyridin-2-one

$$$$ Data

M. F.

C7H6N2O

Suppliers	Catalog Number
Matrix Scientific	068396
TRC	A801725
Bide Pharmatech	BD54074

Database	Data ID
PubChem	13864095

M. W.

134.13534

CAS

5654-97-7

Similarity

N/A

ID: 63085

6-bromoquinazoline

$$$$ Data

M. F.

C8H5BrN2

Suppliers	Catalog Number
Matrix Scientific	068397
Bide Pharmatech	BD29851
A&J Pharmtech	AJA-O13946 AJA-O14040

Database	Data ID
PubChem	17750034

M. W.

209.0427

CAS

89892-21-7

Similarity

N/A

ID: 63086

7-bromoquinazoline

$$$$ Data

M. F.

C8H5BrN2

Suppliers	Catalog Number
Matrix Scientific	068398
Bide Pharmatech	BD41027
A&J Pharmtech	AJA-O14039

Database	Data ID
PubChem	11195146

M. W.

209.0427

CAS

89892-22-8

Similarity

N/A

ID: 63087

4-bromopyridine-2-carbonitrile

$$$$ Data More

M. F.

C6H3BrN2

Suppliers	Catalog Number
Alfa Aesar	H34424
Matrix Scientific	068399
Apollo Scientific	OR17101

Database	Data ID
PubChem	693283

M. W.

183.00542

CAS

62150-45-2

Similarity

N/A

ID: 63088

7-chloro-1H-imidazo[4,5-b]pyridine

$$$$ Data

M. F.

C6H4ClN3

Suppliers	Catalog Number
Matrix Scientific	068400
Bide Pharmatech	BD105387

Database	Data ID
PubChem	12782383

M. W.

153.56906

CAS

6980-11-6

Similarity

N/A

ID: 63089

4-(2H-1,2,3,4-tetrazol-5-yl)benzene-1-sulfonyl chloride

$$$$ Data

M. F.

C7H5ClN4O2S

Suppliers	Catalog Number
Matrix Scientific	068401

Database	Data ID
PubChem	52911271

M. W.

244.6582

CAS

924964-20-5

Similarity

N/A

ID: 63090

5-(1H-1,2,3,4-tetrazol-5-yl)thiophene-2-sulfonyl chloride

$$$$ Data

M. F.

C5H3ClN4O2S2

Suppliers	Catalog Number
Matrix Scientific	068402

Database	Data ID
PubChem	52911272

M. W.

250.68592

CAS

924964-21-6

Similarity

N/A

ID: 63091

methyl 4-chloro-7-methoxyquinoline-6-carboxylate

$$$$ Data

M. F.

C12H10ClNO3

Suppliers	Catalog Number
Matrix Scientific	068403

Database	Data ID
PubChem	22646520

M. W.

251.6657

CAS

205448-66-4

Similarity

N/A

ID: 63092

4-bromopyrimidine

$$$$ Data

M. F.

C4H3BrN2

Suppliers	Catalog Number
Matrix Scientific	068404
A&J Pharmtech	AJA-O22196

Database	Data ID
PubChem	12752220

M. W.

158.98402

CAS

31462-56-3

Similarity

N/A

ID: 63093

4-amino-1,2-dihydropyridin-2-one

$$$$ Data

M. F.

C5H6N2O

Suppliers	Catalog Number
Matrix Scientific	068405
TRC	A629020

Database	Data ID
PubChem	573530

M. W.

110.11394

CAS

38767-72-5

Similarity

N/A

ID: 63094

4-amino-1-methyl-1,2-dihydropyridin-2-one

$$$$ Data

M. F.

C6H8N2O

Suppliers	Catalog Number
Matrix Scientific	068406

Database	Data ID
PubChem	13378000

M. W.

124.14052

CAS

952182-01-3

Similarity

N/A

ID: 63095

1,1,1-trifluoropropan-2-one; 4-aminopiperidin-2-one

$$$$ Data

M. F.

C8H13F3N2O2

Suppliers	Catalog Number
Matrix Scientific	068407

Database	Data ID
PubChem	71299012

M. W.

226.1962296

CAS

5513-66-6

Similarity

N/A

ID: 63096

1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid

$$$$ Data More

M. F.

C8H6N2O2

Suppliers	Catalog Number
Matrix Scientific	068408
Apollo Scientific	OR46104
Enamine	EN300-33541

Database	Data ID
PubChem	7144623

M. W.

162.14544

CAS

136818-50-3

Similarity

N/A

ID: 63097

1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

$$$$ Data

M. F.

C7H5N3O2

Suppliers	Catalog Number
Matrix Scientific	068409
Adesis	13-116

Database	Data ID
PubChem	21408148

M. W.

163.1335

CAS

952182-02-4

Similarity

N/A

ID: 63098

5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazolo[3,4-b]pyridine

$$$$ Data

M. F.

C12H16BN3O2

Suppliers	Catalog Number
Matrix Scientific	068410

Database	Data ID
PubChem	51051672

M. W.

245.08534

CAS

1093819-50-1

Similarity

N/A

ID: 63099

2-{1-[(tert-butoxy)carbonyl]azetidin-3-yl}acetic acid

$$$$ Data More

M. F.

C10H17NO4

Suppliers	Catalog Number
Matrix Scientific	068411
Enamine	EN300-83201
Bide Pharmatech	BD143608

Database	Data ID
PubChem	11095989

M. W.

215.24628

CAS

183062-96-6

Similarity

N/A

ID: 63100

6-bromopyrazolo[1,5-a]pyrimidine

$$$$ Data

M. F.

C6H4BrN3

Suppliers	Catalog Number
Alfa Aesar	H33855
Matrix Scientific	068412
Bide Pharmatech	BD167675

Database	Data ID
PubChem	22236701

M. W.

198.02006

CAS

705263-10-1

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