Chembase list of 866358 unique molecular structures

2-(benzylamino)-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carbaldehyde

$$$$ Data

M. F.

C16H13N3O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5895

Database	Data ID
PubChem	42648470

M. W.

279.29332

CAS

Similarity

N/A

ID: 123052

2-[(furan-2-ylmethyl)amino]-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carbaldehyde

$$$$ Data

M. F.

C14H11N3O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-5896

Database	Data ID
PubChem	1083179

M. W.

269.25544

CAS

Similarity

N/A

ID: 123053

2-[(2-methoxyethyl)amino]-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carbaldehyde

$$$$ Data

M. F.

C12H13N3O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-5897

Database	Data ID
PubChem	42648471

M. W.

247.24992

CAS

Similarity

N/A

ID: 123054

4-oxo-2-[(prop-2-en-1-yl)amino]-4H-pyrido[1,2-a]pyrimidine-3-carbaldehyde

$$$$ Data

M. F.

C12H11N3O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5898

Database	Data ID
PubChem	42648472

M. W.

229.23464

CAS

Similarity

N/A

ID: 123055

3-oxo-1H,2H,3H-pyrazolo[4,3-c]quinoline-8-carboxylic acid

$$$$ Data

M. F.

C11H7N3O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-5902 STOCK1N-72805

Database	Data ID
PubChem	24220865

M. W.

229.19158

CAS

Similarity

N/A

ID: 123056

methyl 4-chloro-2-methylquinoline-6-carboxylate

$$$$ Data

M. F.

C12H10ClNO2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5903

Database	Data ID
PubChem	28284467

M. W.

235.6663

CAS

Similarity

N/A

ID: 123057

8-chloro-2-methylquinolin-4-amine

$$$$ Data

M. F.

C10H9ClN2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5904
A&J Pharmtech	AJA-O35479

Database	Data ID
PubChem	12465494

M. W.

192.64486

CAS

68017-48-1

Similarity

N/A

ID: 123058

ethyl 4-amino-6-chloroquinoline-3-carboxylate

$$$$ Data

M. F.

C12H11ClN2O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5906

Database	Data ID
PubChem	17028178

M. W.

250.68094

CAS

Similarity

N/A

ID: 123059

ethyl 4-amino-6-fluoroquinoline-3-carboxylate

$$$$ Data

M. F.

C12H11FN2O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5908

Database	Data ID
PubChem	28284468

M. W.

234.2263432

CAS

Similarity

N/A

ID: 123060

8-chloro-4-hydroxyquinoline-3-carbohydrazide

$$$$ Data

M. F.

C10H8ClN3O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5912

Database	Data ID
PubChem	28284469

M. W.

237.64242

CAS

Similarity

N/A

ID: 123061

2-amino-7-chloro-4H-[1,3]thiazino[5,6-c]quinolin-4-one

$$$$ Data

M. F.

C11H6ClN3OS

Suppliers	Catalog Number
InterBioScreen	BB_SC-5913

Database	Data ID
PubChem	28284471

M. W.

263.70284

CAS

Similarity

N/A

ID: 123062

8-fluoro-4-hydroxyquinoline-3-carbohydrazide

$$$$ Data

M. F.

C10H8FN3O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5914

Database	Data ID
PubChem	28284472

M. W.

221.1878232

CAS

Similarity

N/A

ID: 123063

4-amino-6-chloroquinoline-3-carbohydrazide

$$$$ Data

M. F.

C10H9ClN4O

Suppliers	Catalog Number
InterBioScreen	BB_SC-5915

Database	Data ID
PubChem	28284473

M. W.

236.65766

CAS

Similarity

N/A

ID: 123064

2-amino-9-chloro-4H-[1,3]thiazino[5,6-c]quinolin-4-one

$$$$ Data

M. F.

C11H6ClN3OS

Suppliers	Catalog Number
InterBioScreen	BB_SC-5916

Database	Data ID
PubChem	24220868

M. W.

263.70284

CAS

Similarity

N/A

ID: 123065

4-amino-6-fluoroquinoline-3-carbohydrazide

$$$$ Data

M. F.

C10H9FN4O

Suppliers	Catalog Number
InterBioScreen	BB_SC-5917

Database	Data ID
PubChem	28284475

M. W.

220.2030632

CAS

Similarity

N/A

ID: 123066

2-amino-9-fluoro-4H-[1,3]thiazino[5,6-c]quinolin-4-one

$$$$ Data

M. F.

C11H6FN3OS

Suppliers	Catalog Number
InterBioScreen	BB_SC-5918

Database	Data ID
PubChem	28284477

M. W.

247.2482432

CAS

Similarity

N/A

ID: 123067

3-[3,5-dimethyl-4-(2-methylprop-2-en-1-yl)-1H-pyrazol-1-yl]propanoic acid

$$$$ Data

M. F.

C12H18N2O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5920

Database	Data ID
PubChem	28284479

M. W.

222.28352

CAS

Similarity

N/A

ID: 123068

4-methyl-5-oxo-2,5-dihydro-1H-pyrazole-3-carboxylic acid

$$$$ Data

M. F.

C5H6N2O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-5925

Database	Data ID
PubChem	18183472

M. W.

142.11274

CAS

Similarity

N/A

ID: 123069

1-methyl-3-(trimethyl-1H-pyrazol-4-yl)-1H-pyrazole-5-carboxylic acid

$$$$ Data

M. F.

C11H14N4O2

Suppliers	Catalog Number
ChemBridge	4034923
InterBioScreen	BB_SC-5927

Database	Data ID
PubChem	28284482

M. W.

234.25446

CAS

1170910-12-9

Similarity

N/A

ID: 123070

1-(4-cyano-2-methyl-1,3-oxazol-5-yl)piperidine-4-carboxylic acid

$$$$ Data

M. F.

C11H13N3O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-5930

Database	Data ID
PubChem	28284484

M. W.

235.23922

CAS

Similarity

N/A

ID: 123071

5-(piperazin-1-yl)-2-(pyridin-3-yl)-1,3-oxazole-4-carbonitrile

$$$$ Data

M. F.

C13H13N5O

Suppliers	Catalog Number
InterBioScreen	BB_SC-5931

Database	Data ID
PubChem	28284486

M. W.

255.27522

CAS

Similarity

N/A

ID: 123072

5-(2-hydroxyethyl)-3-methyl-4-phenyl-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-6-one

$$$$ Data

M. F.

C14H15N3O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5932

Database	Data ID
PubChem	24206179

M. W.

257.2878

CAS

Similarity

N/A

ID: 123073

benzyl(but-2-yn-1-yl)amine hydrochloride

$$$$ Data

M. F.

C11H14ClN

Suppliers	Catalog Number
InterBioScreen	BB_SC-5933

Database	Data ID
PubChem	45598631

M. W.

195.68856

CAS

Similarity

N/A

ID: 123074

5-(iodomethyl)-4,5-dihydro-1,3-thiazol-2-amine hydroiodide

$$$$ Data

M. F.

C4H8I2N2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-5934

Database	Data ID
PubChem	44668992

M. W.

369.99366

CAS

Similarity

N/A

ID: 123075

4-phenylaniline

$$$$ Data More

M. F.

C12H11N

Suppliers	Catalog Number
Sigma Aldrich	A2898 31598
InterBioScreen	BB_SC-5935
TRC	A601781

Database	Data ID
Wikipedia	4-Aminobiphenyl
PubChem	7102

M. W.

169.22244

CAS

92-67-1

Similarity

N/A

ID: 123076

5-bromo-6-(bromomethyl)-1,3-dimethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

$$$$ Data

M. F.

C7H8Br2N2O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5937

Database	Data ID
PubChem	820633

M. W.

311.95862

CAS

Similarity

N/A

ID: 123077

2-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}acetic acid

$$$$ Data

M. F.

C11H10N2O3S

Suppliers	Catalog Number
InterBioScreen	BB_SC-5946

Database	Data ID
PubChem	7152097

M. W.

250.2737

CAS

Similarity

N/A

ID: 123078

3-(2-fluoro-4-methoxyphenyl)thiomorpholine

$$$$ Data

M. F.

C11H14FNOS

Suppliers	Catalog Number
InterBioScreen	BB_SC-5948

Database	Data ID
PubChem	42648473

M. W.

227.2983632

CAS

Similarity

N/A

ID: 123079

5-{[(4-chlorophenyl)sulfanyl]methyl}furan-2-carboxylic acid

$$$$ Data

M. F.

C12H9ClO3S

Suppliers	Catalog Number
InterBioScreen	BB_SC-5953

Database	Data ID
PubChem	2804168

M. W.

268.71606

CAS

Similarity

N/A

ID: 123080

5-(phenylmethanesulfonylmethyl)furan-2-carboxylic acid

$$$$ Data

M. F.

C13H12O5S

Suppliers	Catalog Number
InterBioScreen	BB_SC-5954

Database	Data ID
PubChem	737811

M. W.

280.29638

CAS

Similarity

N/A

ID: 123081

3-(3,4-dimethoxybenzenesulfonyl)propanenitrile

$$$$ Data

M. F.

C11H13NO4S

Suppliers	Catalog Number
InterBioScreen	BB_SC-5958

Database	Data ID
PubChem	28284493

M. W.

255.29022

CAS

Similarity

N/A

ID: 123082

2-(3,4-dimethoxybenzenesulfonyl)acetic acid

$$$$ Data

M. F.

C10H12O6S

Suppliers	Catalog Number
InterBioScreen	BB_SC-5959

Database	Data ID
PubChem	18790173

M. W.

260.26368

CAS

Similarity

N/A

ID: 123083

ethyl 4-amino-8-fluoroquinoline-3-carboxylate

$$$$ Data

M. F.

C12H11FN2O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5960

Database	Data ID
PubChem	17028187

M. W.

234.2263432

CAS

Similarity

N/A

ID: 123084

4-amino-6-methoxyquinoline-3-carbohydrazide

$$$$ Data

M. F.

C11H12N4O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5961

Database	Data ID
PubChem	17028194

M. W.

232.23858

CAS

Similarity

N/A

ID: 123085

4-hydroxy-8-methoxyquinoline-3-carbohydrazide

$$$$ Data

M. F.

C11H11N3O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-5962

Database	Data ID
PubChem	12438330

M. W.

233.22334

CAS

Similarity

N/A

ID: 123086

4-(2-methyl-1,3-thiazol-4-yl)benzene-1,3-diol

$$$$ Data

M. F.

C10H9NO2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-5969

Database	Data ID
PubChem	25130510

M. W.

207.24896

CAS

Similarity

N/A

ID: 123087

2,2,4,7-tetramethyl-1,2-dihydroquinoline-8-carboxylic acid

$$$$ Data

M. F.

C14H17NO2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5971

Database	Data ID
PubChem	17229221

M. W.

231.29028

CAS

Similarity

N/A

ID: 123088

3-[5-methyl-7-oxo-2-(pyridin-4-yl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]pr...

$$$$ Data

M. F.

C14H13N5O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-5972

Database	Data ID
PubChem	28284497

M. W.

299.28472

CAS

Similarity

N/A

ID: 123089

3-(4-phenylphenyl)-1H-pyrazole hydrochloride

$$$$ Data

M. F.

C15H13ClN2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5974

Database	Data ID
PubChem	45598808

M. W.

256.73012

CAS

Similarity

N/A

ID: 123090

3-(naphthalen-1-yl)-1H-pyrazole hydrochloride

$$$$ Data

M. F.

C13H11ClN2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5975

Database	Data ID
PubChem	45598763

M. W.

230.69284

CAS

Similarity

N/A

ID: 123091

4-[(1E)-1-(hydroxyimino)-2-(2-methoxyphenyl)ethyl]benzene-1,3-diol

$$$$ Data

M. F.

C15H15NO4

Suppliers	Catalog Number
InterBioScreen	BB_SC-5981

Database	Data ID
PubChem	42648474

M. W.

273.2839

CAS

Similarity

N/A

ID: 123092

4-[(1E)-2-(4-chlorophenyl)-1-(hydroxyimino)ethyl]benzene-1,3-diol

$$$$ Data

M. F.

C14H12ClNO3

Suppliers	Catalog Number
InterBioScreen	BB_SC-5982

Database	Data ID
PubChem	42648475

M. W.

277.70298

CAS

Similarity

N/A

ID: 123093

3-[(4-chlorophenyl)methyl]-1,2-benzoxazol-6-ol

$$$$ Data

M. F.

C14H10ClNO2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5985

Database	Data ID
PubChem	24280341

M. W.

259.6877

CAS

Similarity

N/A

ID: 123094

1-[3-(propan-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxylic ...

$$$$ Data

M. F.

C14H19N5O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5986

Database	Data ID
PubChem	28284502

M. W.

289.33296

CAS

Similarity

N/A

ID: 123095

4-(1H-pyrazol-3-yl)pyridine

$$$$ Data More

M. F.

C8H7N3

Suppliers	Catalog Number
ChemBridge	4032048
InterBioScreen	BB_SC-5991
Enamine	EN300-69165

Database	Data ID
PubChem	16412755

M. W.

145.16128

CAS

17784-60-0

Similarity

N/A

ID: 123096

(2E)-3-(dimethylamino)-1-(5-methylfuran-2-yl)prop-2-en-1-one

$$$$ Data

M. F.

C10H13NO2

Suppliers	Catalog Number
InterBioScreen	BB_SC-5992

Database	Data ID
PubChem	5707484

M. W.

179.21572

CAS

Similarity

N/A

ID: 123097

3-[(dimethylamino)methyl]-1H-indole-4-carboxylic acid

$$$$ Data

M. F.

C12H14N2O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-6000

Database	Data ID
PubChem	22014775

M. W.

218.25176

CAS

Similarity

N/A

ID: 123098

3-(morpholin-4-ylmethyl)-1H-indole-4-carboxylic acid

$$$$ Data

M. F.

C14H16N2O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-6001

Database	Data ID
PubChem	28284505

M. W.

260.28844

CAS

Similarity

N/A

ID: 123099

3-(pyrrolidin-1-ylmethyl)-1H-indole-5-carboxylic acid

$$$$ Data

M. F.

C14H16N2O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-6002

Database	Data ID
PubChem	42580962

M. W.

244.28904

CAS

Similarity

N/A

ID: 123100

3-(pyrrolidin-1-ylmethyl)-1H-indole-6-carboxylic acid

$$$$ Data

M. F.

C14H16N2O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-6003

Database	Data ID
PubChem	28284507

M. W.

244.28904

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