Chembase list of 866358 unique molecular structures

[4-(dimethylsulfamoyl)-2-methylphenyl]boronic acid

$$$$ Data

M. F.

C9H14BNO4S

Suppliers	Catalog Number
Apollo Scientific	OR11416
Bide Pharmatech	BD225660

Database	Data ID
PubChem	44118775

M. W.

243.08776

CAS

957034-82-1

Similarity

N/A

ID: 75452

4-(dihydroxyboranyl)naphthalene-1-carboxylic acid

$$$$ Data

M. F.

C11H9BO4

Suppliers	Catalog Number
Apollo Scientific	OR11417
A&J Pharmtech	AJA-O30655

Database	Data ID
PubChem	22711863

M. W.

215.99776

CAS

332398-57-9

Similarity

N/A

ID: 75453

3,6-bis(1H-imidazol-1-yl)pyridazine

$$$$ Data

M. F.

C10H8N6

Suppliers	Catalog Number
Apollo Scientific	OR11418
A&J Pharmtech	AJA-O3470

Database	Data ID
PubChem	12698878

M. W.

212.21072

CAS

177648-99-6

Similarity

N/A

ID: 75454

5-chloro-3,4-dihydroquinazolin-4-one

$$$$ Data

M. F.

C8H5ClN2O

Suppliers	Catalog Number
Apollo Scientific	OR11419
Enamine	EN300-90108
Bide Pharmatech	BD40398

Database	Data ID
PubChem	353383

M. W.

180.5911

CAS

60233-66-1

Similarity

N/A

ID: 75455

6-chloro-7-methyl-4-oxo-4H-chromene-3-carbaldehyde

$$$$ Data

M. F.

C11H7ClO3

Suppliers	Catalog Number
Sigma Aldrich	402184
Apollo Scientific	OR1142

Database	Data ID
PubChem	606638

M. W.

222.62448

CAS

64481-12-5

Similarity

N/A

ID: 75456

6,7-dimethoxyisoquinoline

$$$$ Data

M. F.

C11H11NO2

Suppliers	Catalog Number
Apollo Scientific	OR11421
A&J Pharmtech	AJA-O2426

Database	Data ID
PubChem	177578

M. W.

189.21054

CAS

15248-39-2

Similarity

N/A

ID: 75457

6-hydroxy-3,4-dihydroquinazolin-4-one

$$$$ Data

M. F.

C8H6N2O2

Suppliers	Catalog Number
Apollo Scientific	OR11423

Database	Data ID
PubChem	3031697

M. W.

162.14544

CAS

16064-10-1

Similarity

N/A

ID: 75458

4-[(2-chloropyridin-3-yl)sulfonyl]morpholine

$$$$ Data

M. F.

C9H11ClN2O3S

Suppliers	Catalog Number
Apollo Scientific	OR11424

Database	Data ID
PubChem	12286953

M. W.

262.71324

CAS

60597-72-0

Similarity

N/A

ID: 75459

6-methyl-3,4-dihydroquinazolin-4-one

$$$$ Data

M. F.

C9H8N2O

Suppliers	Catalog Number
Apollo Scientific	OR11427

Database	Data ID
PubChem	305214

M. W.

160.17262

CAS

19181-53-4

Similarity

N/A

ID: 75460

7-chloro-4-methyl-1H-indole

$$$$ Data

M. F.

C9H8ClN

Suppliers	Catalog Number
Apollo Scientific	OR11428
Bide Pharmatech	BD231518

Database	Data ID
PubChem	26369814

M. W.

165.61952

CAS

941294-27-5

Similarity

N/A

ID: 75461

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

$$$$ Data More

M. F.

C8H5BrN2O

Suppliers	Catalog Number
ChemBridge	4002728
Apollo Scientific	OR11429
InterBioScreen	BB_SC-7864

Database	Data ID
PubChem	699754

M. W.

225.0421

CAS

32084-59-6

Similarity

N/A

ID: 75462

3-bromo-5-methylaniline hydrochloride

$$$$ Data

M. F.

C7H9BrClN

Suppliers	Catalog Number
Apollo Scientific	OR11430

Database	Data ID
PubChem	44118557

M. W.

222.51006

CAS

957034-79-6

Similarity

N/A

ID: 75463

{4-[(3-methoxy-3-oxopropyl)carbamoyl]phenyl}boronic acid

$$$$ Data

M. F.

C11H14BNO5

Suppliers	Catalog Number
Apollo Scientific	OR11431

Database	Data ID
PubChem	44118558

M. W.

251.04356

CAS

Similarity

N/A

ID: 75464

2-chloro-3-(pyrrolidine-1-sulfonyl)pyridine

$$$$ Data

M. F.

C9H11ClN2O2S

Suppliers	Catalog Number
Apollo Scientific	OR11432
Bide Pharmatech	BD72662
A&J Pharmtech	AJA-O647

Database	Data ID
PubChem	12286951

M. W.

246.71384

CAS

60597-70-8

Similarity

N/A

ID: 75465

{3-[(3-methoxy-3-oxopropyl)carbamoyl]phenyl}boronic acid

$$$$ Data

M. F.

C11H14BNO5

Suppliers	Catalog Number
Apollo Scientific	OR11433

Database	Data ID
PubChem	44118559

M. W.

251.04356

CAS

Similarity

N/A

ID: 75466

1-bromo-2-(methoxymethyl)benzene

$$$$ Data

M. F.

C8H9BrO

Suppliers	Catalog Number
Apollo Scientific	OR11434

Database	Data ID
PubChem	12927162

M. W.

201.06046

CAS

52711-30-5

Similarity

N/A

ID: 75467

[4-(methoxycarbonyl)naphthalen-1-yl]boronic acid

$$$$ Data

M. F.

C12H11BO4

Suppliers	Catalog Number
Apollo Scientific	OR11435

Database	Data ID
PubChem	44118776

M. W.

230.02434

CAS

957034-67-2

Similarity

N/A

ID: 75468

1,3-dibromo-5-nitrobenzene

$$$$ Data

M. F.

C6H3Br2NO2

Suppliers	Catalog Number
Apollo Scientific	OR11436
A&J Pharmtech	AJA-O9288

Database	Data ID
PubChem	238711

M. W.

280.90152

CAS

6311-60-0

Similarity

N/A

ID: 75469

{3-[(4-chlorophenyl)carbamoyl]phenyl}boronic acid

$$$$ Data

M. F.

C13H11BClNO3

Suppliers	Catalog Number
Apollo Scientific	OR11437

Database	Data ID
PubChem	44118560

M. W.

275.49534

CAS

874288-31-0

Similarity

N/A

ID: 75470

1-{3-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]propyl}piperidine

$$$$ Data

M. F.

C20H32BNO3

Suppliers	Catalog Number
Apollo Scientific	OR11438

Database	Data ID
PubChem	44118777

M. W.

345.28398

CAS

Similarity

N/A

ID: 75471

cyclopent-3-ene-1-carboxamide

$$$$ Data

M. F.

C6H9NO

Suppliers	Catalog Number
Apollo Scientific	OR11439

Database	Data ID
PubChem	26369821

M. W.

111.14176

CAS

50494-42-3

Similarity

N/A

ID: 75472

4-chloro-3-nitro-2H-chromen-2-one

$$$$ Data More

M. F.

C9H4ClNO4

Suppliers	Catalog Number
Sigma Aldrich	513083
Alfa Aesar	L07908
Apollo Scientific	OR1144

Database	Data ID
PubChem	688979

M. W.

225.58536

CAS

38464-20-9

Similarity

N/A

ID: 75473

3-bromo-5-[1-(2,2-diethoxyethyl)-1H-imidazol-2-yl]pyridine

$$$$ Data

M. F.

C14H18BrN3O2

Suppliers	Catalog Number
Apollo Scientific	OR11441
Bide Pharmatech	BD229865

Database	Data ID
PubChem	26369822

M. W.

340.21562

CAS

941294-55-9

Similarity

N/A

ID: 75474

4-bromo-N,N,3-trimethylbenzene-1-sulfonamide

$$$$ Data

M. F.

C9H12BrNO2S

Suppliers	Catalog Number
Apollo Scientific	OR11443

Database	Data ID
PubChem	7938085

M. W.

278.16608

CAS

849532-31-6

Similarity

N/A

ID: 75475

3-amino-5-bromobenzoic acid

$$$$ Data More

M. F.

C7H6BrNO2

Suppliers	Catalog Number
Sigma Aldrich	686425
Apollo Scientific	OR11444
Enamine	EN300-100547

Database	Data ID
PubChem	11569604

M. W.

216.03204

CAS

42237-85-4

Similarity

N/A

ID: 75476

[3-chloro-4-(cyclohexylcarbamoyl)phenyl]boronic acid

$$$$ Data

M. F.

C13H17BClNO3

Suppliers	Catalog Number
Alfa Aesar	H54149
Apollo Scientific	OR11445
Bide Pharmatech	BD231324

Database	Data ID
PubChem	44118561

M. W.

281.54298

CAS

957034-65-0

Similarity

N/A

ID: 75477

4-{2-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethyl}morpholine

$$$$ Data

M. F.

C18H28BNO4

Suppliers	Catalog Number
Apollo Scientific	OR11446

Database	Data ID
PubChem	4625910

M. W.

333.23022

CAS

690636-28-3

Similarity

N/A

ID: 75478

1-(2-bromoethoxy)-4-nitrobenzene

$$$$ Data More

M. F.

C8H8BrNO3

Suppliers	Catalog Number
Apollo Scientific	OR11447
TRC	B684260
Enamine	EN300-49340

Database	Data ID
PubChem	235987

M. W.

246.05802

CAS

13288-06-7

Similarity

N/A

ID: 75479

{3-[(4-bromophenyl)carbamoyl]phenyl}boronic acid

$$$$ Data

M. F.

C13H11BBrNO3

Suppliers	Catalog Number
Apollo Scientific	OR11448

Database	Data ID
PubChem	44118562

M. W.

319.94634

CAS

874288-28-5

Similarity

N/A

ID: 75480

methyl 4-bromonaphthalene-1-carboxylate

$$$$ Data

M. F.

C12H9BrO2

Suppliers	Catalog Number
Apollo Scientific	OR11449
Bide Pharmatech	BD138921

Database	Data ID
PubChem	22711886

M. W.

265.10266

CAS

35615-97-5

Similarity

N/A

ID: 75481

2-[2-(bromomethyl)-4-chlorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

$$$$ Data

M. F.

C13H17BBrClO2

Suppliers	Catalog Number
Apollo Scientific	OR11450
Bide Pharmatech	BD230067

Database	Data ID
PubChem	44118563

M. W.

331.44088

CAS

957034-64-9

Similarity

N/A

ID: 75482

1,3-dimethyl 2-(5-methyl-2,4-dinitrophenyl)propanedioate

$$$$ Data

M. F.

C12H12N2O8

Suppliers	Catalog Number
Apollo Scientific	OR11451

Database	Data ID
PubChem	26369828

M. W.

312.23228

CAS

Similarity

N/A

ID: 75483

tert-butyl 4-bromo-2-nitrobenzoate

$$$$ Data

M. F.

C11H12BrNO4

Suppliers	Catalog Number
Apollo Scientific	OR11452
Bide Pharmatech	BD152919

Database	Data ID
PubChem	26369829

M. W.

302.12128

CAS

890315-72-7

Similarity

N/A

ID: 75484

ethyl 2-(oxan-4-ylidene)acetate

$$$$ Data

M. F.

C9H14O3

Suppliers	Catalog Number
Apollo Scientific	OR11453

Database	Data ID
PubChem	11105795

M. W.

170.20566

CAS

130312-00-4

Similarity

N/A

ID: 75485

[2-amino-4-(ethoxycarbonyl)phenyl]boronic acid hydrochloride

$$$$ Data

M. F.

C9H13BClNO4

Suppliers	Catalog Number
Apollo Scientific	OR11454

Database	Data ID
PubChem	44118564

M. W.

245.46782

CAS

Similarity

N/A

ID: 75486

{4-[2-(1H-imidazol-1-yl)ethoxy]phenyl}boronic acid

$$$$ Data

M. F.

C11H13BN2O3

Suppliers	Catalog Number
Apollo Scientific	OR11455
Bide Pharmatech	BD230809

Database	Data ID
PubChem	44118566

M. W.

232.04352

CAS

957034-56-9

Similarity

N/A

ID: 75487

oxan-4-ylmethyl 4-methylbenzene-1-sulfonate

$$$$ Data

M. F.

C13H18O4S

Suppliers	Catalog Number
Apollo Scientific	OR11456

Database	Data ID
PubChem	19077576

M. W.

270.34462

CAS

101691-65-0

Similarity

N/A

ID: 75488

4-{3-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]propyl}morpholine

$$$$ Data

M. F.

C19H30BNO4

Suppliers	Catalog Number
Apollo Scientific	OR11457

Database	Data ID
PubChem	4649072

M. W.

347.2568

CAS

Similarity

N/A

ID: 75489

6-bromoimidazo[1,2-a]pyridine hydrochloride

$$$$ Data

M. F.

C7H6BrClN2

Suppliers	Catalog Number
Apollo Scientific	OR11458

Database	Data ID
PubChem	44118567

M. W.

233.49294

CAS

Similarity

N/A

ID: 75490

4-chloro-6-(4-iodo-1H-pyrazol-1-yl)pyrimidine

$$$$ Data

M. F.

C7H4ClIN4

Suppliers	Catalog Number
Apollo Scientific	OR11459

Database	Data ID
PubChem	26369834

M. W.

306.49093

CAS

Similarity

N/A

ID: 75491

tert-butyl 4-bromobutanoate

$$$$ Data

M. F.

C8H15BrO2

Suppliers	Catalog Number
Apollo Scientific	OR11460

Database	Data ID
PubChem	2757253

M. W.

223.1075

CAS

110611-91-1

Similarity

N/A

ID: 75492

6-bromo-7-methylimidazo[1,2-a]pyridine hydrochloride

$$$$ Data

M. F.

C8H8BrClN2

Suppliers	Catalog Number
Apollo Scientific	OR11461

Database	Data ID
PubChem	44118568

M. W.

247.51952

CAS

Similarity

N/A

ID: 75493

4-chloro-6-(2-methyl-1H-imidazol-1-yl)pyrimidine

$$$$ Data

M. F.

C8H7ClN4

Suppliers	Catalog Number
Apollo Scientific	OR11462
A&J Pharmtech	AJA-O21980

Database	Data ID
PubChem	26369835

M. W.

194.62098

CAS

941294-31-1

Similarity

N/A

ID: 75494

4-chloro-6-(4-methyl-1H-imidazol-1-yl)pyrimidine

$$$$ Data

M. F.

C8H7ClN4

Suppliers	Catalog Number
Apollo Scientific	OR11463

Database	Data ID
PubChem	26369838

M. W.

194.62098

CAS

941294-32-2

Similarity

N/A

ID: 75495

6-chloroimidazo[1,2-a]pyridine hydrochloride

$$$$ Data

M. F.

C7H6Cl2N2

Suppliers	Catalog Number
Apollo Scientific	OR11464

Database	Data ID
PubChem	44118778

M. W.

189.04194

CAS

957035-24-4

Similarity

N/A

ID: 75496

4-chloro-2-methyl-6-(1H-pyrazol-1-yl)pyrimidine

$$$$ Data

M. F.

C8H7ClN4

Suppliers	Catalog Number
ChemBridge	5339707
Apollo Scientific	OR11465

Database	Data ID
PubChem	26369841

M. W.

194.62098

CAS

957035-38-0

Similarity

N/A

ID: 75497

3-chloro-6-(1H-pyrazol-1-yl)pyridazine

$$$$ Data

M. F.

C7H5ClN4

Suppliers	Catalog Number
Apollo Scientific	OR11467
Enamine	EN300-41231
A&J Pharmtech	AJA-O21818

Database	Data ID
PubChem	12562845

M. W.

180.5944

CAS

29334-66-5

Similarity

N/A

ID: 75498

4-chloro-6-(1H-pyrazol-1-yl)pyrimidine

$$$$ Data

M. F.

C7H5ClN4

Suppliers	Catalog Number
ChemBridge	5339669
Apollo Scientific	OR11468
A&J Pharmtech	AJA-O39752

Database	Data ID
PubChem	10631239

M. W.

180.5944

CAS

114833-95-3

Similarity

N/A

ID: 75499

3-chloro-6-(4-iodo-1H-pyrazol-1-yl)pyridazine

$$$$ Data

M. F.

C7H4ClIN4

Suppliers	Catalog Number
Apollo Scientific	OR11469

Database	Data ID
PubChem	26369846

M. W.

306.49093

CAS

Similarity

N/A

ID: 75500

4-hydroxy-2H-chromen-2-one

$$$$ Data More

M. F.

C9H6O3

Suppliers	Catalog Number
Sigma Aldrich	H23805 55150
MP Biomedicals	05201934 02151287
Alfa Aesar	A14394

Database	Data ID
PubChem	54682930

M. W.

162.14214

CAS

1076-38-6

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