Chembase list of 866358 unique molecular structures

$$$$ Data

M. F.

C7H8BrNO

Suppliers	Catalog Number
Life Chemicals	F2147-0505

Database	Data ID
PubChem	10631926

M. W.

202.04852

CAS

89694-54-2

Similarity

N/A

ID: 116752

1-benzyl-2-methyl-1H-indole

$$$$ Data

M. F.

C16H15N

Suppliers	Catalog Number
Life Chemicals	F2147-0506

Database	Data ID
PubChem	3307151

M. W.

221.297

CAS

Similarity

N/A

ID: 116753

1-[(4-fluorophenyl)methyl]-2-methyl-1H-indole

$$$$ Data

M. F.

C16H14FN

Suppliers	Catalog Number
Life Chemicals	F2147-0507

Database	Data ID
PubChem	3272016

M. W.

239.2874632

CAS

Similarity

N/A

ID: 116754

1-(3-ethoxypyridin-2-yl)piperazine

$$$$ Data

M. F.

C11H17N3O

Suppliers	Catalog Number
Life Chemicals	F2147-0508

Database	Data ID
PubChem	10655943

M. W.

207.27218

CAS

Similarity

N/A

ID: 116755

2-chloro-3-ethoxypyridine

$$$$ Data

M. F.

C7H8ClNO

Suppliers	Catalog Number
Life Chemicals	F2147-0509

Database	Data ID
PubChem	12293475

M. W.

157.59752

CAS

63756-58-1

Similarity

N/A

ID: 116756

2-chloro-3-(propan-2-yloxy)pyridine

$$$$ Data

M. F.

C8H10ClNO

Suppliers	Catalog Number
Life Chemicals	F2147-0510

Database	Data ID
PubChem	33679089

M. W.

171.6241

CAS

Similarity

N/A

ID: 116757

1-[3-(propan-2-yloxy)pyridin-2-yl]piperazine

$$$$ Data

M. F.

C12H19N3O

Suppliers	Catalog Number
Life Chemicals	F2147-0511

Database	Data ID
PubChem	10727714

M. W.

221.29876

CAS

Similarity

N/A

ID: 116758

2-chloro-3-[(2-fluorophenyl)methoxy]pyridine

$$$$ Data

M. F.

C12H9ClFNO

Suppliers	Catalog Number
Life Chemicals	F2147-0512

Database	Data ID
PubChem	33679096

M. W.

237.6573632

CAS

Similarity

N/A

ID: 116759

2-chloro-3-[(4-fluorophenyl)methoxy]pyridine

$$$$ Data

M. F.

C12H9ClFNO

Suppliers	Catalog Number
Life Chemicals	F2147-0513

Database	Data ID
PubChem	33679098

M. W.

237.6573632

CAS

Similarity

N/A

ID: 116760

2-{4-[2-(methylsulfanyl)-6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl}ethan-...

$$$$ Data

M. F.

C12H18F3N5S

Suppliers	Catalog Number
Life Chemicals	F2147-0517

Database	Data ID
PubChem	33679103

M. W.

321.3650296

CAS

Similarity

N/A

ID: 116761

ethyl 1,3-dimethyl-2,4,7-trioxo-1H,2H,3H,4H,7H,8H-pyrido[2,3-d]pyrimidine-6-carb...

$$$$ Data

M. F.

C12H13N3O5

Suppliers	Catalog Number
Life Chemicals	F2147-0525

Database	Data ID
PubChem	12267913

M. W.

279.24872

CAS

Similarity

N/A

ID: 116762

methyl 1,3-dimethyl-2,4,7-trioxo-1H,2H,3H,4H,7H,8H-pyrido[2,3-d]pyrimidine-5-car...

$$$$ Data

M. F.

C11H11N3O5

Suppliers	Catalog Number
Life Chemicals	F2147-0526

Database	Data ID
PubChem	294685

M. W.

265.22214

CAS

Similarity

N/A

ID: 116763

ethyl 1,3,8-trimethyl-2,4,7-trioxo-1H,2H,3H,4H,7H,8H-pyrido[2,3-d]pyrimidine-6-c...

$$$$ Data

M. F.

C13H15N3O5

Suppliers	Catalog Number
Life Chemicals	F2147-0527

Database	Data ID
PubChem	13925378

M. W.

293.2753

CAS

Similarity

N/A

ID: 116764

1,3,8-trimethyl-2,4,7-trioxo-1H,2H,3H,4H,7H,8H-pyrido[2,3-d]pyrimidine-6-carboxy...

$$$$ Data

M. F.

C11H11N3O5

Suppliers	Catalog Number
Life Chemicals	F2147-0528

Database	Data ID
PubChem	33679111

M. W.

265.22214

CAS

Similarity

N/A

ID: 116765

methyl 1,3,8-trimethyl-2,4,7-trioxo-1H,2H,3H,4H,7H,8H-pyrido[2,3-d]pyrimidine-5-...

$$$$ Data

M. F.

C12H13N3O5

Suppliers	Catalog Number
Life Chemicals	F2147-0529

Database	Data ID
PubChem	13626620

M. W.

279.24872

CAS

Similarity

N/A

ID: 116766

1,3,8-trimethyl-2,4,7-trioxo-1H,2H,3H,4H,7H,8H-pyrido[2,3-d]pyrimidine-5-carboxy...

$$$$ Data

M. F.

C11H11N3O5

Suppliers	Catalog Number
Life Chemicals	F2147-0530

Database	Data ID
PubChem	22334991

M. W.

265.22214

CAS

Similarity

N/A

ID: 116767

1,3-dimethyl-2,4,7-trioxo-1H,2H,3H,4H,7H,8H-pyrido[2,3-d]pyrimidine-6-carboxylic...

$$$$ Data

M. F.

C10H9N3O5

Suppliers	Catalog Number
Life Chemicals	F2147-0531

Database	Data ID
PubChem	12267914

M. W.

251.19556

CAS

Similarity

N/A

ID: 116768

2-[2-(4-methoxyphenyl)pyrrolidin-1-yl]acetamide

$$$$ Data

M. F.

C13H18N2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0534

Database	Data ID
PubChem	45496508

M. W.

234.29422

CAS

Similarity

N/A

ID: 116769

4-{[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonyl}aniline

$$$$ Data

M. F.

C18H22N2O4S

Suppliers	Catalog Number
Life Chemicals	F2147-0535

Database	Data ID
PubChem	44116794

M. W.

362.44328

CAS

Similarity

N/A

ID: 116770

ethyl 3-(pyrazin-2-yl)-1,2,4-oxadiazole-5-carboxylate

$$$$ Data

M. F.

C9H8N4O3

Suppliers	Catalog Number
Life Chemicals	F2147-0541

Database	Data ID
PubChem	33679128

M. W.

220.18482

CAS

Similarity

N/A

ID: 116771

3-(pyrazin-2-yl)-1,2,4-oxadiazole-5-carboxylate

$$$$ Data

M. F.

C7H3N4O3-

Suppliers	Catalog Number
Life Chemicals	F2147-0542

Database	Data ID
PubChem	33679131

M. W.

191.12372

CAS

Similarity

N/A

ID: 116772

1-{3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}piperazine

$$$$ Data

M. F.

C9H13N7

Suppliers	Catalog Number
Life Chemicals	F2147-0543

Database	Data ID
PubChem	33679137

M. W.

219.24642

CAS

Similarity

N/A

ID: 116773

3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine-7-thiol

$$$$ Data

M. F.

C5H5N5S

Suppliers	Catalog Number
Life Chemicals	F2147-0544

Database	Data ID
PubChem	33679140

M. W.

167.1917

CAS

Similarity

N/A

ID: 116774

1-{3-ethyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}piperazine

$$$$ Data

M. F.

C10H15N7

Suppliers	Catalog Number
Life Chemicals	F2147-0545

Database	Data ID
PubChem	33679145

M. W.

233.273

CAS

Similarity

N/A

ID: 116775

3-ethyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine-7-thiol

$$$$ Data

M. F.

C6H7N5S

Suppliers	Catalog Number
Life Chemicals	F2147-0546

Database	Data ID
PubChem	33679148

M. W.

181.21828

CAS

Similarity

N/A

ID: 116776

2-[2-(4-methoxyphenyl)pyrrolidin-1-yl]ethan-1-amine

$$$$ Data

M. F.

C13H20N2O

Suppliers	Catalog Number
Life Chemicals	F2147-0549

Database	Data ID
PubChem	44116797

M. W.

220.3107

CAS

Similarity

N/A

ID: 116777

5-amino-1-[(2-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide

$$$$ Data

M. F.

C10H10FN5O

Suppliers	Catalog Number
Life Chemicals	F2147-0552

Database	Data ID
PubChem	10823631

M. W.

235.2177032

CAS

Similarity

N/A

ID: 116778

3-[(2-fluorophenyl)methyl]-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

$$$$ Data

M. F.

C11H8FN5O

Suppliers	Catalog Number
Life Chemicals	F2147-0553

Database	Data ID
PubChem	3231164

M. W.

245.2125232

CAS

Similarity

N/A

ID: 116779

3-[(2-fluorophenyl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine-7-thiol

$$$$ Data

M. F.

C11H8FN5S

Suppliers	Catalog Number
Life Chemicals	F2147-0554

Database	Data ID
PubChem	10945207

M. W.

261.2781232

CAS

Similarity

N/A

ID: 116780

8-nitro-5-(piperazin-1-yl)isoquinoline

$$$$ Data

M. F.

C13H14N4O2

Suppliers	Catalog Number
Life Chemicals	F2147-0556
Enamine	EN300-25506

Database	Data ID
PubChem	16227284

M. W.

258.27586

CAS

Similarity

N/A

ID: 116781

tert-butyl 4-(8-aminoisoquinolin-5-yl)piperazine-1-carboxylate

$$$$ Data

M. F.

C18H24N4O2

Suppliers	Catalog Number
Life Chemicals	F2147-0557

Database	Data ID
PubChem	33679166

M. W.

328.40876

CAS

Similarity

N/A

ID: 116782

1-(4-methylphenyl)-6-sulfanylidene-1H,4H,5H,6H,7H-pyrazolo[3,4-d]pyrimidin-4-one

$$$$ Data

M. F.

C12H10N4OS

Suppliers	Catalog Number
Life Chemicals	F2147-0562

Database	Data ID
PubChem	9506850

M. W.

258.299

CAS

Similarity

N/A

ID: 116783

5-amino-4-phenyl-1,3-thiazole-2-thiol

$$$$ Data

M. F.

C9H8N2S2

Suppliers	Catalog Number
Life Chemicals	F2147-0563

Database	Data ID
PubChem	3001791

M. W.

208.30322

CAS

Similarity

N/A

ID: 116784

2-{[(4-bromophenyl)methyl]sulfanyl}-4,5-dihydro-1H-imidazole

$$$$ Data

M. F.

C10H11BrN2S

Suppliers	Catalog Number
Life Chemicals	F2147-0564

Database	Data ID
PubChem	1711664

M. W.

271.17674

CAS

Similarity

N/A

ID: 116785

2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4,5-dihydro-1H-imidazole

$$$$ Data

M. F.

C10H10ClFN2S

Suppliers	Catalog Number
Life Chemicals	F2147-0565

Database	Data ID
PubChem	724187

M. W.

244.7162032

CAS

Similarity

N/A

ID: 116786

1-(3-methoxyphenyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C10H10N2OS

Suppliers	Catalog Number
Life Chemicals	F2147-0566
Enamine	EN300-11794

Database	Data ID
PubChem	4961705

M. W.

206.2642

CAS

51581-49-8

Similarity

N/A

ID: 116787

1-(4-ethoxyphenyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C11H12N2OS

Suppliers	Catalog Number
Life Chemicals	F2147-0567

Database	Data ID
PubChem	33679172

M. W.

220.29078

CAS

Similarity

N/A

ID: 116788

2-{[(3-nitrophenyl)methyl]sulfanyl}-4,5-dihydro-1H-imidazole

$$$$ Data

M. F.

C10H11N3O2S

Suppliers	Catalog Number
Life Chemicals	F2147-0568

Database	Data ID
PubChem	16362746

M. W.

237.27824

CAS

Similarity

N/A

ID: 116789

1-(2,3-dimethylphenyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C11H12N2S

Suppliers	Catalog Number
Life Chemicals	F2147-0569
Enamine	EN300-12026

Database	Data ID
PubChem	4961772

M. W.

204.29138

CAS

17452-16-3

Similarity

N/A

ID: 116790

3-(3-methoxyphenyl)-2-sulfanylidene-1H,2H,3H,4H,5H-pyrimido[5,4-b]indol-4-one

$$$$ Data

M. F.

C17H13N3O2S

Suppliers	Catalog Number
Life Chemicals	F2147-0579

Database	Data ID
PubChem	2049510

M. W.

323.36902

CAS

Similarity

N/A

ID: 116791

2-(ethylsulfanyl)-4-phenyl-1,3-thiazol-5-amine

$$$$ Data

M. F.

C11H12N2S2

Suppliers	Catalog Number
Life Chemicals	F2147-0581

Database	Data ID
PubChem	25808448

M. W.

236.35638

CAS

Similarity

N/A

ID: 116792

2-[(5-amino-4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-cyclopropylacetamide

$$$$ Data

M. F.

C14H15N3OS2

Suppliers	Catalog Number
Life Chemicals	F2147-0582

Database	Data ID
PubChem	33679174

M. W.

305.4184

CAS

Similarity

N/A

ID: 116793

3-[3-(benzenesulfonyl)-1H-indol-1-yl]propanoyl chloride

$$$$ Data

M. F.

C17H14ClNO3S

Suppliers	Catalog Number
Life Chemicals	F2147-0583

Database	Data ID
PubChem	33679178

M. W.

347.81596

CAS

Similarity

N/A

ID: 116794

3-amino-N-(4-ethylphenyl)-1-benzofuran-2-carboxamide

$$$$ Data

M. F.

C17H16N2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0584

Database	Data ID
PubChem	28289594

M. W.

280.32114

CAS

Similarity

N/A

ID: 116795

2-(2-methoxybenzoyl)furo[3,2-b]pyridin-3-amine

$$$$ Data

M. F.

C15H12N2O3

Suppliers	Catalog Number
Life Chemicals	F2147-0585

Database	Data ID
PubChem	33679180

M. W.

268.26738

CAS

Similarity

N/A

ID: 116796

1-acetyl-4-phenylpiperidine-4-carboxylic acid

$$$$ Data

M. F.

C14H17NO3

Suppliers	Catalog Number
Life Chemicals	F2147-0586
Enamine	EN300-18575

Database	Data ID
PubChem	4780578

M. W.

247.28968

CAS

Similarity

N/A

ID: 116797

2-[5-(hydroxymethyl)-2-sulfanyl-1H-imidazol-1-yl]-N-(prop-2-en-1-yl)acetamide

$$$$ Data

M. F.

C9H13N3O2S

Suppliers	Catalog Number
Life Chemicals	F2147-0587

Database	Data ID
PubChem	33679184

M. W.

227.28342

CAS

Similarity

N/A

ID: 116798

2-[5-(hydroxymethyl)-2-sulfanyl-1H-imidazol-1-yl]-N-(propan-2-yl)acetamide

$$$$ Data

M. F.

C9H15N3O2S

Suppliers	Catalog Number
Life Chemicals	F2147-0588

Database	Data ID
PubChem	33679187

M. W.

229.2993

CAS

Similarity

N/A

ID: 116799

N-cyclopentyl-2-[5-(hydroxymethyl)-2-sulfanyl-1H-imidazol-1-yl]acetamide

$$$$ Data

M. F.

C11H17N3O2S

Suppliers	Catalog Number
Life Chemicals	F2147-0589

Database	Data ID
PubChem	33679190

M. W.

255.33658

CAS

Similarity

N/A

ID: 116800

N-(4-fluorophenyl)-2-[5-(hydroxymethyl)-2-sulfanyl-1H-imidazol-1-yl]acetamide

$$$$ Data

M. F.

C12H12FN3O2S

Suppliers	Catalog Number
Life Chemicals	F2147-0590

Database	Data ID
PubChem	33679193

M. W.

281.3059832

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