Chembase list of 866358 unique molecular structures

3-benzoyl-6-chloroimidazo[1,2-b]pyridazine

$$$$ Data

M. F.

C13H8ClN3O

Suppliers	Catalog Number
Apollo Scientific	OR21487

Database	Data ID
PubChem	2774636

M. W.

257.67512

CAS

Similarity

N/A

ID: 79052

6-chloro-3-(4-chlorobenzoyl)imidazo[1,2-b]pyridazine

$$$$ Data

M. F.

C13H7Cl2N3O

Suppliers	Catalog Number
Apollo Scientific	OR21488

Database	Data ID
PubChem	2774638

M. W.

292.12018

CAS

Similarity

N/A

ID: 79053

6-chloro-3-(4-chlorobenzoyl)-2-methylimidazo[1,2-b]pyridazine

$$$$ Data

M. F.

C14H9Cl2N3O

Suppliers	Catalog Number
Apollo Scientific	OR21489

Database	Data ID
PubChem	2774639

M. W.

306.14676

CAS

Similarity

N/A

ID: 79054

7-chloro-1,2-dihydroquinolin-2-one

$$$$ Data

M. F.

C9H6ClNO

Suppliers	Catalog Number
Apollo Scientific	OR2149
Bide Pharmatech	BD19499

Database	Data ID
PubChem	344137

M. W.

179.60304

CAS

22614-72-8

Similarity

N/A

ID: 79055

6-chloro-2-methyl-3-(4-methylbenzoyl)imidazo[1,2-b]pyridazine

$$$$ Data

M. F.

C15H12ClN3O

Suppliers	Catalog Number
Apollo Scientific	OR21490

Database	Data ID
PubChem	2774640

M. W.

285.72828

CAS

Similarity

N/A

ID: 79056

6-chloro-2-methyl-3-(4-nitrobenzoyl)imidazo[1,2-b]pyridazine

$$$$ Data

M. F.

C14H9ClN4O3

Suppliers	Catalog Number
Apollo Scientific	OR21491

Database	Data ID
PubChem	2774641

M. W.

316.69926

CAS

Similarity

N/A

ID: 79057

2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]aniline

$$$$ Data

M. F.

C14H9Cl2N3O

Suppliers	Catalog Number
Apollo Scientific	OR21492

Database	Data ID
PubChem	2774643

M. W.

306.14676

CAS

175135-30-5

Similarity

N/A

ID: 79058

1-(benzenesulfonyl)-1H-pyrrole

$$$$ Data More

M. F.

C10H9NO2S

Suppliers	Catalog Number
Sigma Aldrich	438839
Alfa Aesar	A11599
Maybridge	BTB07001

Database	Data ID
PubChem	140146

M. W.

207.24896

CAS

16851-82-4

Similarity

N/A

ID: 79059

2-{4-[(4-methylphenyl)methoxy]phenyl}acetonitrile

$$$$ Data

M. F.

C16H15NO

Suppliers	Catalog Number
Apollo Scientific	OR21494

Database	Data ID
PubChem	2774646

M. W.

237.2964

CAS

175135-33-8

Similarity

N/A

ID: 79060

2-{4-[(3,4-dichlorophenyl)methoxy]phenyl}acetonitrile

$$$$ Data

M. F.

C15H11Cl2NO

Suppliers	Catalog Number
Apollo Scientific	OR21495

Database	Data ID
PubChem	2774648

M. W.

292.15994

CAS

175135-34-9

Similarity

N/A

ID: 79061

2-{4-[(4-chlorophenyl)methoxy]phenyl}acetonitrile

$$$$ Data

M. F.

C15H12ClNO

Suppliers	Catalog Number
Apollo Scientific	OR21496

Database	Data ID
PubChem	2774649

M. W.

257.71488

CAS

175135-36-1

Similarity

N/A

ID: 79062

4-chlorobenzamide

$$$$ Data More

M. F.

C7H6ClNO

Suppliers	Catalog Number
Sigma Aldrich	C23802
MP Biomedicals	05206184
Alfa Aesar	A13809

Database	Data ID
PubChem	12084

M. W.

155.58164

CAS

619-56-7

Similarity

N/A

ID: 79063

benzamide

$$$$ Data More

M. F.

C7H7NO

Suppliers	Catalog Number
Sigma Aldrich	150762 399337 135828 (more...)
BioBioPha	BBP01204
Alfa Aesar	A10501

Database	Data ID
Wikipedia	Benzamide
PubChem	2331

M. W.

121.13658

CAS

55-21-0

Similarity

N/A

ID: 79064

dimethylpyridazine-3,6-diol

$$$$ Data

M. F.

C6H8N2O2

Suppliers	Catalog Number
Apollo Scientific	OR21499
Enamine	EN300-69700

Database	Data ID
PubChem	242280

M. W.

140.13992

CAS

5754-17-6

Similarity

N/A

ID: 79065

4,9-dimethyltricyclo[5.2.1.0^{2,6}]deca-3,8-diene

$$$$ Data

M. F.

C12H16

Suppliers	Catalog Number
Apollo Scientific	OR2150

Database	Data ID
PubChem	3437714

M. W.

160.25544

CAS

26472-00-4

Similarity

N/A

ID: 79066

4-(cyanomethyl)phenyl 2-chloropyridine-3-carboxylate

$$$$ Data

M. F.

C14H9ClN2O2

Suppliers	Catalog Number
Apollo Scientific	OR21500

Database	Data ID
PubChem	2774650

M. W.

272.68646

CAS

Similarity

N/A

ID: 79067

6-oxo-1,6-dihydropyridazine-3-carboxylic acid hydrate

$$$$ Data

M. F.

C5H6N2O4

Suppliers	Catalog Number
Apollo Scientific	OR21502

Database	Data ID
PubChem	2774651

M. W.

158.11214

CAS

306934-80-5

Similarity

N/A

ID: 79068

N'-(6-chloro-4,5-dimethylpyridazin-3-yl)-N,N-dimethylmethanimidamide

$$$$ Data

M. F.

C9H13ClN4

Suppliers	Catalog Number
Apollo Scientific	OR21503

Database	Data ID
PubChem	6823747

M. W.

212.67932

CAS

Similarity

N/A

ID: 79069

N-(6-chloro-4,5-dimethylpyridazin-3-yl)-N'-hydroxymethanimidamide

$$$$ Data

M. F.

C7H9ClN4O

Suppliers	Catalog Number
Apollo Scientific	OR21504

Database	Data ID
PubChem	9582107

M. W.

200.62556

CAS

Similarity

N/A

ID: 79070

ethyl 2-[2-(6-chloropyridazin-3-yl)hydrazin-1-ylidene]propanoate

$$$$ Data

M. F.

C9H11ClN4O2

Suppliers	Catalog Number
Apollo Scientific	OR21505

Database	Data ID
PubChem	9582108

M. W.

242.66224

CAS

Similarity

N/A

ID: 79071

4-(cyanomethyl)phenyl N-phenylcarbamate

$$$$ Data

M. F.

C15H12N2O2

Suppliers	Catalog Number
Apollo Scientific	OR21506

Database	Data ID
PubChem	2774655

M. W.

252.26798

CAS

175135-37-2

Similarity

N/A

ID: 79072

4-(cyanomethyl)phenyl 4-chlorobenzene-1-sulfonate

$$$$ Data

M. F.

C14H10ClNO3S

Suppliers	Catalog Number
Apollo Scientific	OR21507

Database	Data ID
PubChem	2774657

M. W.

307.7521

CAS

175135-38-3

Similarity

N/A

ID: 79073

4-(cyanomethyl)phenyl 4-methylbenzene-1-sulfonate

$$$$ Data

M. F.

C15H13NO3S

Suppliers	Catalog Number
Apollo Scientific	OR21508

Database	Data ID
PubChem	2774659

M. W.

287.33362

CAS

175135-39-4

Similarity

N/A

ID: 79074

4-(cyanomethyl)phenyl 3,5-dichlorobenzene-1-sulfonate

$$$$ Data

M. F.

C14H9Cl2NO3S

Suppliers	Catalog Number
Apollo Scientific	OR21509

Database	Data ID
PubChem	2774660

M. W.

342.19716

CAS

175135-40-7

Similarity

N/A

ID: 79075

1-(4-chlorobenzenesulfonyl)-1H-pyrrole

$$$$ Data

M. F.

C10H8ClNO2S

Suppliers	Catalog Number
Maybridge	BTB07116
Apollo Scientific	OR21510

Database	Data ID
PubChem	706366

M. W.

241.69402

CAS

16851-83-5

Similarity

N/A

ID: 79076

2,6-dimethoxybenzamide

$$$$ Data

M. F.

C9H11NO3

Suppliers	Catalog Number
Apollo Scientific	OR21511

Database	Data ID
PubChem	89078

M. W.

181.18854

CAS

Similarity

N/A

ID: 79077

N-{1-[1-(benzenesulfonyl)-1H-pyrrol-3-yl]ethylidene}hydroxylamine

$$$$ Data

M. F.

C12H12N2O3S

Suppliers	Catalog Number
Apollo Scientific	OR21512

Database	Data ID
PubChem	5912440

M. W.

264.30028

CAS

175135-42-9

Similarity

N/A

ID: 79078

1-[1-(benzenesulfonyl)-1H-pyrrol-2-yl]ethan-1-one

$$$$ Data

M. F.

C12H11NO3S

Suppliers	Catalog Number
Sigma Aldrich	438812
Maybridge	BTB07161
Apollo Scientific	OR21514

Database	Data ID
PubChem	706406

M. W.

249.28564

CAS

86688-88-2

Similarity

N/A

ID: 79079

2-(4-chlorobenzenesulfonyl)-5-nitropyridin-1-ium-1-olate

$$$$ Data

M. F.

C11H7ClN2O5S

Suppliers	Catalog Number
Apollo Scientific	OR21515

Database	Data ID
PubChem	2774667

M. W.

314.70168

CAS

Similarity

N/A

ID: 79080

2-(4-methylbenzenesulfonyl)-5-nitropyridin-1-ium-1-olate

$$$$ Data

M. F.

C12H10N2O5S

Suppliers	Catalog Number
Apollo Scientific	OR21516

Database	Data ID
PubChem	2774668

M. W.

294.2832

CAS

Similarity

N/A

ID: 79081

N-[1-(1H-pyrrol-3-yl)ethylidene]hydroxylamine

$$$$ Data

M. F.

C6H8N2O

Suppliers	Catalog Number
Apollo Scientific	OR21517

Database	Data ID
PubChem	5708484

M. W.

124.14052

CAS

Similarity

N/A

ID: 79082

N-(3-methylphenyl)acetamide

$$$$ Data More

M. F.

C9H11NO

Suppliers	Catalog Number
Sigma Aldrich	273244
Apollo Scientific	OR21518
TRC	A168335

Database	Data ID
PubChem	10843

M. W.

149.18974

CAS

537-92-8

Similarity

N/A

ID: 79083

1-(1H-pyrrol-2-yl)ethan-1-one

$$$$ Data More

M. F.

C6H7NO

Suppliers	Catalog Number
Sigma Aldrich	W320218 247359 01455
Alfa Aesar	A14593
Maybridge	BTB07247

Database	Data ID
PubChem	14079

M. W.

109.12588

CAS

1072-83-9

Similarity

N/A

ID: 79084

N-[1-(1H-pyrrol-2-yl)ethylidene]hydroxylamine

$$$$ Data

M. F.

C6H8N2O

Suppliers	Catalog Number
Apollo Scientific	OR21520

Database	Data ID
PubChem	5380975

M. W.

124.14052

CAS

Similarity

N/A

ID: 79085

4,5-dichloro-2-[(2,6-dichlorophenyl)methyl]-2,3-dihydropyridazin-3-one

$$$$ Data

M. F.

C11H6Cl4N2O

Suppliers	Catalog Number
Apollo Scientific	OR21521

Database	Data ID
PubChem	2774676

M. W.

323.99014

CAS

175135-43-0

Similarity

N/A

ID: 79086

3-cyano-2-{[(dimethylamino)methylidene]amino}-5-{[(4-methylphenyl)sulfanyl]methy...

$$$$ Data

M. F.

C16H17N5OS

Suppliers	Catalog Number
Apollo Scientific	OR21522

Database	Data ID
PubChem	2774678

M. W.

327.40408

CAS

Similarity

N/A

ID: 79087

2-benzyl-4,5-dichloro-2,3-dihydropyridazin-3-one

$$$$ Data

M. F.

C11H8Cl2N2O

Suppliers	Catalog Number
Apollo Scientific	OR21523
Enamine	EN300-15473
Bide Pharmatech	BD71177

Database	Data ID
PubChem	722438

M. W.

255.10002

CAS

41933-33-9

Similarity

N/A

ID: 79088

2-amino-3-cyano-5-{[(2,4-dichloro-5-methylphenyl)sulfanyl]methyl}pyrazin-1-ium-1...

$$$$ Data

M. F.

C13H10Cl2N4OS

Suppliers	Catalog Number
Apollo Scientific	OR21524

Database	Data ID
PubChem	2774679

M. W.

341.2157

CAS

Similarity

N/A

ID: 79089

2-benzyl-4-chloro-5-sulfanyl-2,3-dihydropyridazin-3-one

$$$$ Data

M. F.

C11H9ClN2OS

Suppliers	Catalog Number
Apollo Scientific	OR21525

Database	Data ID
PubChem	2774680

M. W.

252.71996

CAS

Similarity

N/A

ID: 79090

N-(2-chloroethyl)-2H,3H-imidazo[1,2-b]pyridazin-6-amine hydrochloride

$$$$ Data

M. F.

C8H12Cl2N4

Suppliers	Catalog Number
Apollo Scientific	OR21526

Database	Data ID
PubChem	2774681

M. W.

235.11368

CAS

Similarity

N/A

ID: 79091

4,5-dichloro-2-[(4-chlorophenyl)methyl]-2,3-dihydropyridazin-3-one

$$$$ Data

M. F.

C11H7Cl3N2O

Suppliers	Catalog Number
Apollo Scientific	OR21527

Database	Data ID
PubChem	735799

M. W.

289.54508

CAS

173843-85-1

Similarity

N/A

ID: 79092

4,5-dichloro-2-[(4-methylphenyl)methyl]-2,3-dihydropyridazin-3-one

$$$$ Data

M. F.

C12H10Cl2N2O

Suppliers	Catalog Number
Apollo Scientific	OR21528

Database	Data ID
PubChem	728292

M. W.

269.1266

CAS

173843-86-2

Similarity

N/A

ID: 79093

6-methyl-2-nitropyridin-3-yl 2-chloropyridine-3-carboxylate

$$$$ Data

M. F.

C12H8ClN3O4

Suppliers	Catalog Number
Apollo Scientific	OR21529

Database	Data ID
PubChem	2774686

M. W.

293.66262

CAS

Similarity

N/A

ID: 79094

4-chloro-2-methyl-5-(morpholin-4-yl)-2,3-dihydropyridazin-3-one

$$$$ Data

M. F.

C9H12ClN3O2

Suppliers	Catalog Number
Maybridge	BTB07325
Apollo Scientific	OR21530

Database	Data ID
PubChem	120991

M. W.

229.66348

CAS

1080-85-9

Similarity

N/A

ID: 79095

6-methyl-2-nitropyridin-3-yl 5-chloro-1,3-dimethyl-1H-pyrazole-4-sulfonate

$$$$ Data

M. F.

C11H11ClN4O5S

Suppliers	Catalog Number
Apollo Scientific	OR21531

Database	Data ID
PubChem	2774687

M. W.

346.74684

CAS

Similarity

N/A

ID: 79096

N-(2,2-dimethoxyethyl)ethanediamide

$$$$ Data

M. F.

C6H12N2O4

Suppliers	Catalog Number
Apollo Scientific	OR21532

Database	Data ID
PubChem	2774688

M. W.

176.17048

CAS

Similarity

N/A

ID: 79097

4-chloro-2-methyl-5-(1-methylhydrazin-1-yl)-2,3-dihydropyridazin-3-one

$$$$ Data

M. F.

C6H9ClN4O

Suppliers	Catalog Number
Maybridge	BTB07331
Apollo Scientific	OR21533
Enamine	EN300-50650

Database	Data ID
PubChem	2774689

M. W.

188.61486

CAS

96017-23-1

Similarity

N/A

ID: 79098

2-{4-[(4-methoxyphenyl)methoxy]phenyl}acetonitrile

$$$$ Data

M. F.

C16H15NO2

Suppliers	Catalog Number
Apollo Scientific	OR21534

Database	Data ID
PubChem	2774690

M. W.

253.2958

CAS

175135-47-4

Similarity

N/A

ID: 79099

2-(2,5-dimethyl-1H-pyrrol-1-yl)pyridin-3-ol

$$$$ Data

M. F.

C11H12N2O

Suppliers	Catalog Number
ChemBridge	4031461
Apollo Scientific	OR21535

Database	Data ID
PubChem	2774691

M. W.

188.22578

CAS

175135-48-5

Similarity

N/A

ID: 79100

N'-hydroxy-2-(4-hydroxyphenyl)ethanimidamide

$$$$ Data

M. F.

C8H10N2O2

Suppliers	Catalog Number
Apollo Scientific	OR21536

Database	Data ID
PubChem	9582109

M. W.

166.1772

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