Chembase list of 866358 unique molecular structures

$$$$ Data More

M. F.

C8H8N2

Suppliers	Catalog Number
Sigma Aldrich	05334
Alfa Aesar	L17794
Apollo Scientific	OR3531

Database	Data ID
PubChem	111634

M. W.

132.16252

CAS

5192-4-1

Similarity

N/A

ID: 87802

tert-butyl 5-methoxy-1H-indole-1-carboxylate

$$$$ Data

M. F.

C14H17NO3

Suppliers	Catalog Number
Sigma Aldrich	680613
Apollo Scientific	OR3532

Database	Data ID
PubChem	11831752

M. W.

247.28968

CAS

99275-47-5

Similarity

N/A

ID: 87803

tert-butyl 6-chloro-1H-indole-1-carboxylate

$$$$ Data

M. F.

C13H14ClNO2

Suppliers	Catalog Number
Apollo Scientific	OR3533

Database	Data ID
PubChem	25307160

M. W.

251.70876

CAS

323580-68-3

Similarity

N/A

ID: 87804

5-[(tert-butyldimethylsilyl)oxy]-1H-indole

$$$$ Data

M. F.

C14H21NOSi

Suppliers	Catalog Number
Apollo Scientific	OR3534

Database	Data ID
PubChem	22250817

M. W.

247.40814

CAS

106792-38-5

Similarity

N/A

ID: 87805

2-(3-bromophenyl)-N-tert-butylacetamide

$$$$ Data

M. F.

C12H16BrNO

Suppliers	Catalog Number
Apollo Scientific	OR3539

Database	Data ID
PubChem	3559735

M. W.

270.16554

CAS

883801-90-9

Similarity

N/A

ID: 87806

3-bromo-5-chlorobenzoic acid

$$$$ Data More

M. F.

C7H4BrClO2

Suppliers	Catalog Number
Apollo Scientific	OR3540
Chemik	CHB38332
Enamine	EN300-107464

Database	Data ID
PubChem	33128

M. W.

235.46246

CAS

42860-02-6

Similarity

N/A

ID: 87807

4-bromonaphthalene-1-carboxylic acid

$$$$ Data

M. F.

C11H7BrO2

Suppliers	Catalog Number
Apollo Scientific	OR3541

Database	Data ID
PubChem	282591

M. W.

251.07608

CAS

16650-55-8

Similarity

N/A

ID: 87808

5-bromo-2-hydroxypyridine-4-carboxylic acid

$$$$ Data

M. F.

C6H4BrNO3

Suppliers	Catalog Number
Apollo Scientific	OR3542

Database	Data ID
PubChem	25306962

M. W.

218.00486

CAS

913836-16-5

Similarity

N/A

ID: 87809

methyl 2-iodopyridine-3-carboxylate

$$$$ Data

M. F.

C7H6INO2

Suppliers	Catalog Number
Apollo Scientific	OR3543
Bide Pharmatech	BD159998

Database	Data ID
PubChem	14784669

M. W.

263.03251

CAS

913836-18-7

Similarity

N/A

ID: 87810

4-iodopyridine-2-carbonitrile

$$$$ Data

M. F.

C6H3IN2

Suppliers	Catalog Number
Apollo Scientific	OR3544
TRC	I719485

Database	Data ID
PubChem	23436846

M. W.

230.00589

CAS

913836-19-8

Similarity

N/A

ID: 87811

2-iodopyridine-4-carbonitrile

$$$$ Data

M. F.

C6H3IN2

Suppliers	Catalog Number
Sigma Aldrich	734713
Alfa Aesar	H31065
Apollo Scientific	OR3545

Database	Data ID
PubChem	25307106

M. W.

230.00589

CAS

114821-24-8

Similarity

N/A

ID: 87812

5-bromo-N-tert-butylpyridine-3-carboxamide

$$$$ Data

M. F.

C10H13BrN2O

Suppliers	Catalog Number
Apollo Scientific	OR3546

Database	Data ID
PubChem	4806816

M. W.

257.12702

CAS

342013-78-9

Similarity

N/A

ID: 87813

6-iodopyridine-3-carbonitrile

$$$$ Data

M. F.

C6H3IN2

Suppliers	Catalog Number
Apollo Scientific	OR3547

Database	Data ID
PubChem	15765965

M. W.

230.00589

CAS

289470-22-0

Similarity

N/A

ID: 87814

N-methoxy-N-methyl-1,3-thiazole-5-carboxamide

$$$$ Data

M. F.

C6H8N2O2S

Suppliers	Catalog Number
Apollo Scientific	OR3550

Database	Data ID
PubChem	25307138

M. W.

172.20492

CAS

898825-89-3

Similarity

N/A

ID: 87815

(methylsulfanyl)(1,3-thiazol-4-yl)methanone

$$$$ Data

M. F.

C5H5NOS2

Suppliers	Catalog Number
Apollo Scientific	OR3551

Database	Data ID
PubChem	25307150

M. W.

159.2293

CAS

913836-23-4

Similarity

N/A

ID: 87816

ethyl 1,3-oxazole-5-carboxylate

$$$$ Data More

M. F.

C6H7NO3

Suppliers	Catalog Number
Sigma Aldrich	720763
Apollo Scientific	OR3553
Bide Pharmatech	BD26845

Database	Data ID
PubChem	10964603

M. W.

141.12468

CAS

118994-89-1

Similarity

N/A

ID: 87817

methyl 5-methyl-1,3-oxazole-4-carboxylate

$$$$ Data

M. F.

C6H7NO3

Suppliers	Catalog Number
Apollo Scientific	OR3554
Bide Pharmatech	BD158406
A&J Pharmtech	AJA-O3996

Database	Data ID
PubChem	12627321

M. W.

141.12468

CAS

41172-57-0

Similarity

N/A

ID: 87818

N-(1,3-thiazol-2-yl)acetamide

$$$$ Data More

M. F.

C5H6N2OS

Suppliers	Catalog Number
Sigma Aldrich	648388
MP Biomedicals	05206430
Alfa Aesar	B23873

Database	Data ID
PubChem	17625

M. W.

142.17894

CAS

2719-23-5

Similarity

N/A

ID: 87819

4-sulfamoylbenzoyl chloride; N,N-dimethylformamide

$$$$ Data

M. F.

C10H13ClN2O4S

Suppliers	Catalog Number
Alfa Aesar	L18428
Apollo Scientific	OR3557

Database	Data ID
PubChem	44119145

M. W.

292.73922

CAS

1172493-99-0

Similarity

N/A

ID: 87820

2,4-dimethoxy-1-nitrobenzene

$$$$ Data More

M. F.

C8H9NO4

Suppliers	Catalog Number
Sigma Aldrich	512923
MP Biomedicals	05215059
Alfa Aesar	B25353

Database	Data ID
PubChem	78633

M. W.

183.16136

CAS

4920-84-7

Similarity

N/A

ID: 87821

4-amino-5-(3,4-dichlorophenyl)-4H-1,2,4-triazole-3-thiol

$$$$ Data

M. F.

C8H6Cl2N4S

Suppliers	Catalog Number
Apollo Scientific	OR3562

Database	Data ID
PubChem	2735319

M. W.

261.13104

CAS

Similarity

N/A

ID: 87822

2-amino-3-{1H-pyrrolo[2,3-b]pyridin-3-yl}propanoic acid

$$$$ Data More

M. F.

C10H11N3O2

Suppliers	Catalog Number
MP Biomedicals	02100844
Apollo Scientific	OR3563
InterBioScreen	BB_NC-2647

Database	Data ID
PubChem	5354789

M. W.

205.21324

CAS

1137-00-4

Similarity

N/A

ID: 87823

2-methoxy-5-sulfamoylbenzoic acid

$$$$ Data More

M. F.

C8H9NO5S

Suppliers	Catalog Number
Alfa Aesar	B23698
Apollo Scientific	OR3567
InterBioScreen	BB_SC-8765

Database	Data ID
PubChem	89601

M. W.

231.22576

CAS

22117-85-7

Similarity

N/A

ID: 87824

methyl 2-methoxy-5-sulfamoylbenzoate

$$$$ Data More

M. F.

C9H11NO5S

Suppliers	Catalog Number
Sigma Aldrich	522279
Apollo Scientific	OR3568
Bide Pharmatech	BD6866

Database	Data ID
PubChem	118390

M. W.

245.25234

CAS

33045-52-2

Similarity

N/A

ID: 87825

5-methanesulfonyl-2-methoxybenzoic acid

$$$$ Data More

M. F.

C9H10O5S

Suppliers	Catalog Number
Apollo Scientific	OR3569
Enamine	EN300-121580
Bide Pharmatech	BD6744

Database	Data ID
PubChem	170840

M. W.

230.2377

CAS

50390-76-6

Similarity

N/A

ID: 87826

methyl 5-methanesulfonyl-2-methoxybenzoate

$$$$ Data

M. F.

C10H12O5S

Suppliers	Catalog Number
Apollo Scientific	OR3570
Bide Pharmatech	BD12080
A&J Pharmtech	AJA-O40501

Database	Data ID
PubChem	6454622

M. W.

244.26428

CAS

63484-12-8

Similarity

N/A

ID: 87827

methyl 5-(ethanesulfonyl)-2-methoxybenzoate

$$$$ Data

M. F.

C11H14O5S

Suppliers	Catalog Number
Apollo Scientific	OR3571
Bide Pharmatech	BD13287
A&J Pharmtech	AJA-O40502

Database	Data ID
PubChem	6454351

M. W.

258.29086

CAS

62140-67-4

Similarity

N/A

ID: 87828

methyl 4-amino-5-(ethanesulfonyl)-2-methoxybenzoate

$$$$ Data

M. F.

C11H15NO5S

Suppliers	Catalog Number
Apollo Scientific	OR3572
Bide Pharmatech	BD22660
A&J Pharmtech	AJA-O104

Database	Data ID
PubChem	12906443

M. W.

273.3055

CAS

80036-89-1

Similarity

N/A

ID: 87829

2,4,6-trimethylbenzene-1-sulfonyl chloride

$$$$ Data More

M. F.

C9H11ClO2S

Suppliers	Catalog Number
Sigma Aldrich	M7707 63932
MP Biomedicals	02151610
Alfa Aesar	A11775

Database	Data ID
PubChem	13046

M. W.

218.70044

CAS

773-64-8

Similarity

N/A

ID: 87830

2-bromo-5-ethoxypyridine

$$$$ Data

M. F.

C7H8BrNO

Suppliers	Catalog Number
Apollo Scientific	OR3575

Database	Data ID
PubChem	23436892

M. W.

202.04852

CAS

42834-01-5

Similarity

N/A

ID: 87831

1-isothiocyanato-2-phenylbenzene

$$$$ Data

M. F.

C13H9NS

Suppliers	Catalog Number
Apollo Scientific	OR3577

Database	Data ID
PubChem	519659

M. W.

211.28226

CAS

Similarity

N/A

ID: 87832

sodium 4-(pyridin-4-yl)benzoate

$$$$ Data

M. F.

C12H8NNaO2

Suppliers	Catalog Number
Apollo Scientific	OR3582

Database	Data ID
PubChem	23673507

M. W.

221.18719

CAS

207798-97-8

Similarity

N/A

ID: 87833

4-(4-phenylphenyl)pyridine

$$$$ Data

M. F.

C17H13N

Suppliers	Catalog Number
Apollo Scientific	OR3583

Database	Data ID
PubChem	26966675

M. W.

231.29182

CAS

Similarity

N/A

ID: 87834

[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]boronic acid

$$$$ Data

M. F.

C9H9BN2O3

Suppliers	Catalog Number
Alfa Aesar	H52505
Apollo Scientific	OR3585
Bide Pharmatech	BD221155

Database	Data ID
PubChem	44119380

M. W.

203.99036

CAS

913836-04-1

Similarity

N/A

ID: 87835

tert-butyl 4-nitro-1H-indole-1-carboxylate

$$$$ Data

M. F.

C13H14N2O4

Suppliers	Catalog Number
Apollo Scientific	OR3588

Database	Data ID
PubChem	25307166

M. W.

262.26126

CAS

913836-24-5

Similarity

N/A

ID: 87836

1,3-oxazole-5-carboxylic acid

$$$$ Data More

M. F.

C4H3NO3

Suppliers	Catalog Number
Sigma Aldrich	722111
Alfa Aesar	H30179
Apollo Scientific	OR3589

Database	Data ID
PubChem	16340557

M. W.

113.07152

CAS

118994-90-4

Similarity

N/A

ID: 87837

2-bromo-N-(propan-2-yl)benzamide

$$$$ Data

M. F.

C10H12BrNO

Suppliers	Catalog Number
ChemBridge	5328478
Apollo Scientific	OR3590

Database	Data ID
PubChem	2057512

M. W.

242.11238

CAS

64141-90-8

Similarity

N/A

ID: 87838

N-(4-bromonaphthalen-1-yl)acetamide

$$$$ Data

M. F.

C12H10BrNO

Suppliers	Catalog Number
Apollo Scientific	OR3591
A&J Pharmtech	AJA-O953

Database	Data ID
PubChem	236431

M. W.

264.1179

CAS

91394-66-0

Similarity

N/A

ID: 87839

(3-{[(4-methoxyphenyl)methyl]sulfamoyl}phenyl)boronic acid

$$$$ Data

M. F.

C14H16BNO5S

Suppliers	Catalog Number
Alfa Aesar	H52494
Apollo Scientific	OR3592

Database	Data ID
PubChem	44119150

M. W.

321.15654

CAS

913836-05-2

Similarity

N/A

ID: 87840

2-bromo-N-ethylbenzamide

$$$$ Data

M. F.

C9H10BrNO

Suppliers	Catalog Number
ChemBridge	5348641
Apollo Scientific	OR3593

Database	Data ID
PubChem	3450992

M. W.

228.0858

CAS

80031-02-3

Similarity

N/A

ID: 87841

N-benzyl-2-bromobenzamide

$$$$ Data

M. F.

C14H12BrNO

Suppliers	Catalog Number
Apollo Scientific	OR3595

Database	Data ID
PubChem	687458

M. W.

290.15518

CAS

82082-50-6

Similarity

N/A

ID: 87842

[5-(methylsulfanyl)pyridin-3-yl]boronic acid

$$$$ Data

M. F.

C6H8BNO2S

Suppliers	Catalog Number
Alfa Aesar	H52463
Apollo Scientific	OR3596

Database	Data ID
PubChem	22392014

M. W.

169.00922

CAS

477251-98-2

Similarity

N/A

ID: 87843

(5-methanesulfonylpyridin-3-yl)boronic acid

$$$$ Data

M. F.

C6H8BNO4S

Suppliers	Catalog Number
Alfa Aesar	H53133
Apollo Scientific	OR3598
Bide Pharmatech	BD101330

Database	Data ID
PubChem	44119381

M. W.

201.00802

CAS

913836-01-8

Similarity

N/A

ID: 87844

3-(2-methylphenyl)-1H-pyrazole

$$$$ Data

M. F.

C10H10N2

Suppliers	Catalog Number
Apollo Scientific	OR36

Database	Data ID
PubChem	2736932

M. W.

158.1998

CAS

Similarity

N/A

ID: 87845

3-bromo-5-(methylsulfanyl)pyridine

$$$$ Data

M. F.

C6H6BrNS

Suppliers	Catalog Number
Apollo Scientific	OR3600

Database	Data ID
PubChem	22390359

M. W.

204.08754

CAS

142137-18-6

Similarity

N/A

ID: 87846

(2S,3S,4R,5S)-2-methylpiperidine-3,4,5-triol hydrochloride

$$$$ Data

M. F.

C6H14ClNO3

Suppliers	Catalog Number
Apollo Scientific	OR3600T

Database	Data ID
PubChem	71299527

M. W.

183.63326

CAS

210174-73-5

Similarity

N/A

ID: 87847

{1-[(tert-butoxy)carbonyl]-7-methoxy-1H-indol-2-yl}boronic acid

$$$$ Data

M. F.

C14H18BNO5

Suppliers	Catalog Number
Alfa Aesar	H53063
Apollo Scientific	OR3602
Bide Pharmatech	BD229984

Database	Data ID
PubChem	44119382

M. W.

291.10742

CAS

913835-81-1

Similarity

N/A

ID: 87848

4-(dihydroxyboranyl)benzene-1-sulfonic acid

$$$$ Data

M. F.

C6H7BO5S

Suppliers	Catalog Number
Alfa Aesar	H52894
Apollo Scientific	OR3603

Database	Data ID
PubChem	20207836

M. W.

201.99278

CAS

913836-00-7

Similarity

N/A

ID: 87849

2,1,3-benzoxadiazole-5-carbonyl chloride

$$$$ Data

M. F.

C7H3ClN2O2

Suppliers	Catalog Number
Maybridge	CC09702
Apollo Scientific	OR3608

Database	Data ID
PubChem	2735453

M. W.

182.56392

CAS

126147-86-2

Similarity

N/A

ID: 87850

2,1,3-benzoxadiazole-5-carbohydrazide

$$$$ Data

M. F.

C7H6N4O2

Suppliers	Catalog Number
Apollo Scientific	OR3609

Database	Data ID
PubChem	2735455

M. W.

178.14814

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