Chembase list of 866358 unique molecular structures

(4S)-2-(2-bromophenyl)-4-tert-butyl-4,5-dihydro-1,3-oxazole

$$$$ Data

M. F.

C13H16BrNO

Suppliers	Catalog Number
Bide Pharmatech	BD48557

Database	Data ID
PubChem	10880531

M. W.

282.17624

CAS

154701-60-7

Similarity

N/A

ID: 293902

2-methyl-5-nitrobenzene-1-sulfonic acid

$$$$ Data

M. F.

C7H7NO5S

Suppliers	Catalog Number
Bide Pharmatech	BD4877

Database	Data ID
PubChem	8458

M. W.

217.19918

CAS

121-03-9

Similarity

N/A

ID: 293903

(2S)-3-(dimethylamino)-1-(3-methoxyphenyl)-2-methylpropan-1-one

$$$$ Data

M. F.

C13H19NO2

Suppliers	Catalog Number
Bide Pharmatech	BD48783

Database	Data ID
PubChem	25146676

M. W.

221.29546

CAS

850222-40-1

Similarity

N/A

ID: 293904

benzyl (3S)-3-aminopiperidine-1-carboxylate

$$$$ Data

M. F.

C13H18N2O2

Suppliers	Catalog Number
Bide Pharmatech	BD48809

Database	Data ID
PubChem	1514178

M. W.

234.29422

CAS

876461-55-1

Similarity

N/A

ID: 293905

(3S)-3-amino-3-[2-(trifluoromethyl)phenyl]propanoic acid

$$$$ Data

M. F.

C10H10F3NO2

Suppliers	Catalog Number
Bide Pharmatech	BD48832

Database	Data ID
PubChem	2060572

M. W.

233.1871096

CAS

755749-11-2

Similarity

N/A

ID: 293906

(3S)-3-amino-3-(4-cyanophenyl)propanoic acid

$$$$ Data

M. F.

C10H10N2O2

Suppliers	Catalog Number
Alfa Aesar	H52084
Bide Pharmatech	BD48847

Database	Data ID
PubChem	1491714

M. W.

190.1986

CAS

718596-77-1

Similarity

N/A

ID: 293907

(3S)-oxolan-3-amine

$$$$ Data

M. F.

C4H9NO

Suppliers	Catalog Number
Bide Pharmatech	BD48904

Database	Data ID
PubChem	14243168

M. W.

87.12036

CAS

104530-79-2

Similarity

N/A

ID: 293908

ethyl (3S)-3-cyano-3-hydroxypropanoate

$$$$ Data

M. F.

C6H9NO3

Suppliers	Catalog Number
Bide Pharmatech	BD48926

Database	Data ID
PubChem	11105478

M. W.

143.14056

CAS

132839-91-9

Similarity

N/A

ID: 293909

(3S)-3-(dimethylamino)-3-phenylpropan-1-ol

$$$$ Data

M. F.

C11H17NO

Suppliers	Catalog Number
Bide Pharmatech	BD48927

Database	Data ID
PubChem	12520912

M. W.

179.25878

CAS

82769-75-3

Similarity

N/A

ID: 293910

(3S)-N,N-dimethylpyrrolidin-3-amine dihydrochloride

$$$$ Data

M. F.

C6H16Cl2N2

Suppliers	Catalog Number
Alfa Aesar	H30661
Bide Pharmatech	BD48928

Database	Data ID
PubChem	53482061

M. W.

187.11064

CAS

144043-20-9

Similarity

N/A

ID: 293911

benzyl N-[(3S)-pyrrolidin-3-yl]carbamate

$$$$ Data

M. F.

C12H16N2O2

Suppliers	Catalog Number
Bide Pharmatech	BD48962

Database	Data ID
PubChem	40425231

M. W.

220.26764

CAS

176970-12-0

Similarity

N/A

ID: 293912

(2S)-2-(aminomethyl)-3,3-dimethylbutanoic acid

$$$$ Data

M. F.

C7H15NO2

Suppliers	Catalog Number
Bide Pharmatech	BD48974

Database	Data ID
PubChem	66570655

M. W.

145.1995

CAS

367278-48-6

Similarity

N/A

ID: 293913

(6S)-3-benzyl-3H,4H,5H,6H,7H-imidazo[4,5-c]pyridine-6-carboxylic acid

$$$$ Data

M. F.

C14H15N3O2

Suppliers	Catalog Number
Bide Pharmatech	BD49001

Database	Data ID
PubChem	14457612

M. W.

257.2878

CAS

768322-42-5

Similarity

N/A

ID: 293914

(2S)-2-(4-chlorophenyl)-2-hydroxyacetic acid

$$$$ Data

M. F.

C8H7ClO3

Suppliers	Catalog Number
Bide Pharmatech	BD49030

Database	Data ID
PubChem	785083

M. W.

186.59238

CAS

76496-63-4

Similarity

N/A

ID: 293915

(4S)-6-chloro-4-hydroxy-2H,3H,4H-1λ⁶,7,2-thieno[3,2-e][1λ⁶

$$$$ Data

M. F.

C6H6ClNO3S2

Suppliers	Catalog Number
Bide Pharmatech	BD49081

Database	Data ID
PubChem	11746721

M. W.

239.69974

CAS

160982-16-1

Similarity

N/A

ID: 293916

(2S)-2-[(1R,2S,6R,8R)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0²

$$$$ Data

M. F.

C14H25BClNO2

Suppliers	Catalog Number
Bide Pharmatech	BD49146

Database	Data ID
PubChem	73553232

M. W.

285.6178

CAS

149716-73-4

Similarity

N/A

ID: 293917

(2S)-4-bromo-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}butanoic acid

$$$$ Data

M. F.

C19H18BrNO4

Suppliers	Catalog Number
Bide Pharmatech	BD49159

Database	Data ID
PubChem	10971468

M. W.

404.25452

CAS

172169-88-9

Similarity

N/A

ID: 293918

(3S)-3-amino-4-methylpentanoic acid

$$$$ Data

M. F.

C6H13NO2

Suppliers	Catalog Number
Bide Pharmatech	BD49169

Database	Data ID
PubChem	439734

M. W.

131.17292

CAS

40469-85-0

Similarity

N/A

ID: 293919

methyl 2-[(3S)-piperidin-3-yl]acetate hydrochloride

$$$$ Data

M. F.

C8H16ClNO2

Suppliers	Catalog Number
Bide Pharmatech	BD49180

Database	Data ID
PubChem	45073966

M. W.

193.67114

CAS

957471-98-6

Similarity

N/A

ID: 293920

(trichloromethoxy)benzene

$$$$ Data

M. F.

C7H5Cl3O

Suppliers	Catalog Number
Bide Pharmatech	BD49359

Database	Data ID
PubChem	40773

M. W.

211.473

CAS

34888-05-6

Similarity

N/A

ID: 293921

2-{[(benzyloxy)carbonyl]amino}-3-{[(2R)-2-{[(benzyloxy)carbonyl]amino}-2-carboxy...

$$$$ Data

M. F.

C22H24N2O8S2

Suppliers	Catalog Number
Bide Pharmatech	BD49438

Database	Data ID
PubChem	20653698

M. W.

508.56456

CAS

6968-11-2

Similarity

N/A

ID: 293922

1-(1H-indazol-3-yl)ethan-1-one

$$$$ Data

M. F.

C9H8N2O

Suppliers	Catalog Number
Bide Pharmatech	BD49569
A&J Pharmtech	AJA-O1825

Database	Data ID
PubChem	15684169

M. W.

160.17262

CAS

4498-72-0

Similarity

N/A

ID: 293923

1-(cyclohex-1-en-1-yl)piperidine

$$$$ Data

M. F.

C11H19N

Suppliers	Catalog Number
Alfa Aesar	L00335
Bide Pharmatech	BD49605

Database	Data ID
PubChem	18118

M. W.

165.27526

CAS

2981-10-4

Similarity

N/A

ID: 293924

1-(2-bromophenyl)-5-ethyl-3,4-diphenyl-1H-pyrazole

$$$$ Data

M. F.

C23H19BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD49906

Database	Data ID
PubChem	20577213

M. W.

403.31436

CAS

300658-42-8

Similarity

N/A

ID: 293925

1-(2-chloro-4-nitrophenyl)ethan-1-one

$$$$ Data

M. F.

C8H6ClNO3

Suppliers	Catalog Number
Bide Pharmatech	BD49925

Database	Data ID
PubChem	314302

M. W.

199.59114

CAS

67818-41-1

Similarity

N/A

ID: 293926

methyl[1-(2-phenyladamantan-1-yl)propan-2-yl]amine hydrochloride

$$$$ Data

M. F.

C20H30ClN

Suppliers	Catalog Number
Bide Pharmatech	BD50209

Database	Data ID
PubChem	35973

M. W.

319.9119

CAS

31897-80-0

Similarity

N/A

ID: 293927

1-(2-nitrophenyl)azetidine-3-carboxylic acid

$$$$ Data

M. F.

C10H10N2O4

Suppliers	Catalog Number
Bide Pharmatech	BD50246

Database	Data ID
PubChem	53402651

M. W.

222.1974

CAS

887595-94-0

Similarity

N/A

ID: 293928

3-[4-(2-ethoxy-2-phenylethyl)piperazin-1-yl]-2-methyl-1-phenylpropan-1-one

$$$$ Data

M. F.

C24H32N2O2

Suppliers	Catalog Number
Bide Pharmatech	BD50265

Database	Data ID
PubChem	3245

M. W.

380.52308

CAS

10402-90-1

Similarity

N/A

ID: 293929

tert-butyl 4-(1,3-thiazol-2-yl)piperazine-1-carboxylate

$$$$ Data

M. F.

C12H19N3O2S

Suppliers	Catalog Number
Bide Pharmatech	BD50298

Database	Data ID
PubChem	21925505

M. W.

269.36316

CAS

474417-23-7

Similarity

N/A

ID: 293930

1-(3,5-dimethoxyphenyl)heptan-1-one

$$$$ Data

M. F.

C15H22O3

Suppliers	Catalog Number
Bide Pharmatech	BD50313
A&J Pharmtech	AJA-O3274

Database	Data ID
PubChem	3522587

M. W.

250.33338

CAS

39192-51-3

Similarity

N/A

ID: 293931

[1-(3-methylbutyl)-1H-pyrazol-4-yl]boronic acid

$$$$ Data

M. F.

C8H15BN2O2

Suppliers	Catalog Number
Bide Pharmatech	BD50671

Database	Data ID
PubChem	11423941

M. W.

182.0279

CAS

847818-58-0

Similarity

N/A

ID: 293932

5-ethylpyridin-2-ol

$$$$ Data

M. F.

C7H9NO

Suppliers	Catalog Number
Bide Pharmatech	BD5072
A&J Pharmtech	AJA-O13641

Database	Data ID
PubChem	19365871

M. W.

123.15246

CAS

53428-03-8

Similarity

N/A

ID: 293933

1-(4-amino-3-bromophenyl)ethan-1-one

$$$$ Data

M. F.

C8H8BrNO

Suppliers	Catalog Number
Bide Pharmatech	BD50792
A&J Pharmtech	AJA-O9745

Database	Data ID
PubChem	1515281

M. W.

214.05922

CAS

56759-32-1

Similarity

N/A

ID: 293934

1-(4-chlorophenyl)piperazine hydrochloride

$$$$ Data

M. F.

C10H14Cl2N2

Suppliers	Catalog Number
Bide Pharmatech	BD51045
A&J Pharmtech	AJA-O2594

Database	Data ID
PubChem	3084720

M. W.

233.13756

CAS

13078-12-1

Similarity

N/A

ID: 293935

4-chloro-2,6-dimethylaniline hydrochloride

$$$$ Data

M. F.

C8H11Cl2N

Suppliers	Catalog Number
Alfa Aesar	A19362
Bide Pharmatech	BD5140
A&J Pharmtech	AJA-O2738

Database	Data ID
PubChem	18406981

M. W.

192.08564

CAS

5769-32-4

Similarity

N/A

ID: 293936

1-(4-tert-butylphenyl)-3-(4-methoxyphenyl)propane-1,3-diol

$$$$ Data

M. F.

C20H26O3

Suppliers	Catalog Number
Bide Pharmatech	BD51410

Database	Data ID
PubChem	12091724

M. W.

314.41864

CAS

70356-09-1

Similarity

N/A

ID: 293937

1-(5-bromopyrimidin-2-yl)pyrrolidin-3-ol

$$$$ Data

M. F.

C8H10BrN3O

Suppliers	Catalog Number
Bide Pharmatech	BD51473
A&J Pharmtech	AJA-O1822

Database	Data ID
PubChem	44558606

M. W.

244.0885

CAS

914347-70-9

Similarity

N/A

ID: 293938

1-(5-chloro-1H-indol-3-yl)ethan-1-one

$$$$ Data

M. F.

C10H8ClNO

Suppliers	Catalog Number
Bide Pharmatech	BD51482
A&J Pharmtech	AJA-O777

Database	Data ID
PubChem	2762971

M. W.

193.62962

CAS

51843-24-4

Similarity

N/A

ID: 293939

1-(5-fluoro-2-nitrophenyl)ethan-1-one

$$$$ Data

M. F.

C8H6FNO3

Suppliers	Catalog Number
Bide Pharmatech	BD51508

Database	Data ID
PubChem	13295028

M. W.

183.1365432

CAS

2250-48-8

Similarity

N/A

ID: 293940

2-(piperazin-1-yl)pyrimidin-5-ol

$$$$ Data

M. F.

C8H12N4O

Suppliers	Catalog Number
Bide Pharmatech	BD51510

Database	Data ID
PubChem	34180809

M. W.

180.20708

CAS

55745-85-2

Similarity

N/A

ID: 293941

4-{1,4-dioxaspiro[4.5]decan-8-yl}cyclohexan-1-one

$$$$ Data

M. F.

C14H22O3

Suppliers	Catalog Number
Bide Pharmatech	BD52268

Database	Data ID
PubChem	810913

M. W.

238.32268

CAS

56309-94-5

Similarity

N/A

ID: 293942

(4-methylbenzenesulfonyl)urea

$$$$ Data

M. F.

C8H10N2O3S

Suppliers	Catalog Number
Bide Pharmatech	BD5213
A&J Pharmtech	AJA-O5567

Database	Data ID
PubChem	74327

M. W.

214.2416

CAS

1694-06-0

Similarity

N/A

ID: 293943

2-ethylbenzene-1,4-diol

$$$$ Data

M. F.

C8H10O2

Suppliers	Catalog Number
Bide Pharmatech	BD5231

Database	Data ID
PubChem	3083760

M. W.

138.1638

CAS

2349-70-4

Similarity

N/A

ID: 293944

1-(4-methoxyphenyl)-3-nitrobenzene

$$$$ Data

M. F.

C13H11NO3

Suppliers	Catalog Number
Bide Pharmatech	BD52277

Database	Data ID
PubChem	11138924

M. W.

229.23134

CAS

53059-31-7

Similarity

N/A

ID: 293945

1-(4-methylphenyl)-3-nitrobenzene

$$$$ Data

M. F.

C13H11NO2

Suppliers	Catalog Number
Bide Pharmatech	BD52278

Database	Data ID
PubChem	643523

M. W.

213.23194

CAS

53812-68-3

Similarity

N/A

ID: 293946

1-(4-methylphenyl)-4-nitrobenzene

$$$$ Data

M. F.

C13H11NO2

Suppliers	Catalog Number
Bide Pharmatech	BD52279

Database	Data ID
PubChem	9813171

M. W.

213.23194

CAS

2143-88-6

Similarity

N/A

ID: 293947

1-{6-chloroimidazo[1,2-b]pyridazin-3-yl}ethan-1-one

$$$$ Data

M. F.

C8H6ClN3O

Suppliers	Catalog Number
Bide Pharmatech	BD51553

Database	Data ID
PubChem	13248805

M. W.

195.60574

CAS

90734-71-7

Similarity

N/A

ID: 293948

9H-fluoren-9-ylmethyl N-(8-amino-3,6-dioxooctyl)carbamate hydrochloride

$$$$ Data

M. F.

C23H27ClN2O4

Suppliers	Catalog Number
Bide Pharmatech	BD51599

Database	Data ID
PubChem	70700199

M. W.

430.92448

CAS

868599-73-9

Similarity

N/A

ID: 293949

1-(aminomethyl)cyclopropan-1-ol

$$$$ Data

M. F.

C4H9NO

Suppliers	Catalog Number
Bide Pharmatech	BD51617
A&J Pharmtech	AJA-O32218

Database	Data ID
PubChem	12609623

M. W.

87.12036

CAS

74592-33-9

Similarity

N/A

ID: 293950

1-(chloromethyl)-2,3,4-trifluorobenzene

$$$$ Data

M. F.

C7H4ClF3

Suppliers	Catalog Number
Bide Pharmatech	BD51674
A&J Pharmtech	AJA-O6690

Database	Data ID
PubChem	17750844

M. W.

180.5548696

CAS

292621-60-4

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