Chembase list of 866358 unique molecular structures

(E)-N-[1-(piperidin-1-yl)propan-2-ylidene]hydroxylamine

$$$$ Data

M. F.

C8H16N2O

Suppliers	Catalog Number
InterBioScreen	BB_SC-3919

Database	Data ID
PubChem	6273573

M. W.

156.22544

CAS

Similarity

N/A

ID: 122252

3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}propan-1-ol

$$$$ Data

M. F.

C10H14N4O

Suppliers	Catalog Number
InterBioScreen	BB_SC-3920
Enamine	EN300-12130

Database	Data ID
PubChem	4885555

M. W.

206.24436

CAS

Similarity

N/A

ID: 122253

(4-chloro-3-nitro-1H-pyrazol-1-yl)methanol

$$$$ Data

M. F.

C4H4ClN3O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3924

Database	Data ID
PubChem	7172185

M. W.

177.54586

CAS

Similarity

N/A

ID: 122254

(5-methyl-3-nitro-1H-pyrazol-1-yl)methanol

$$$$ Data

M. F.

C5H7N3O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3925

Database	Data ID
PubChem	7172182

M. W.

157.12738

CAS

Similarity

N/A

ID: 122255

2-(3-nitro-1H-pyrazol-1-yl)ethan-1-ol

$$$$ Data

M. F.

C5H7N3O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3926

Database	Data ID
PubChem	16394849

M. W.

157.12738

CAS

Similarity

N/A

ID: 122256

3-methyl-1-propyl-1H-pyrazole-5-carbohydrazide

$$$$ Data

M. F.

C8H14N4O

Suppliers	Catalog Number
InterBioScreen	BB_SC-3927

Database	Data ID
PubChem	16394850

M. W.

182.22296

CAS

Similarity

N/A

ID: 122257

3-methyl-1-propyl-1H-pyrazole

$$$$ Data

M. F.

C7H12N2

Suppliers	Catalog Number
InterBioScreen	BB_SC-3929

Database	Data ID
PubChem	16394851

M. W.

124.18358

CAS

Similarity

N/A

ID: 122258

1-(3-methyl-1-propyl-1H-pyrazol-4-yl)ethan-1-one

$$$$ Data

M. F.

C9H14N2O

Suppliers	Catalog Number
ChemBridge	4009476
InterBioScreen	BB_SC-3930

Database	Data ID
PubChem	16394852

M. W.

166.22026

CAS

933454-80-9

Similarity

N/A

ID: 122259

1-(5-methyl-1-propyl-1H-pyrazol-4-yl)ethan-1-one

$$$$ Data

M. F.

C9H14N2O

Suppliers	Catalog Number
ChemBridge	4009477
InterBioScreen	BB_SC-3931

Database	Data ID
PubChem	16394853

M. W.

166.22026

CAS

956951-04-5

Similarity

N/A

ID: 122260

2-(ethylsulfanyl)-4,6-dimethylpyrimidine

$$$$ Data

M. F.

C8H12N2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-3932

Database	Data ID
PubChem	4737970

M. W.

168.25928

CAS

Similarity

N/A

ID: 122261

4,7-diethyl-5-oxa-6-azaspiro[2.4]hept-6-en-4-ol

$$$$ Data

M. F.

C9H15NO2

Suppliers	Catalog Number
InterBioScreen	BB_SC-3933

Database	Data ID
PubChem	16394854

M. W.

169.2209

CAS

Similarity

N/A

ID: 122262

ethyl (2E)-3-(phenylcarbamoyl)prop-2-enoate

$$$$ Data

M. F.

C12H13NO3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3934

Database	Data ID
PubChem	13411557

M. W.

219.23652

CAS

Similarity

N/A

ID: 122263

(Z)-N-[1-(3-methyl-1-propyl-1H-pyrazol-4-yl)ethylidene]hydroxylamine

$$$$ Data

M. F.

C9H15N3O

Suppliers	Catalog Number
InterBioScreen	BB_SC-3935

Database	Data ID
PubChem	16394855

M. W.

181.2349

CAS

Similarity

N/A

ID: 122264

(Z)-N-[1-(5-methyl-1-propyl-1H-pyrazol-4-yl)ethylidene]hydroxylamine

$$$$ Data

M. F.

C9H15N3O

Suppliers	Catalog Number
InterBioScreen	BB_SC-3936

Database	Data ID
PubChem	16394856

M. W.

181.2349

CAS

Similarity

N/A

ID: 122265

1-(4-ethoxybenzenesulfonyl)piperazine

$$$$ Data

M. F.

C12H18N2O3S

Suppliers	Catalog Number
InterBioScreen	BB_SC-3938

Database	Data ID
PubChem	2060840

M. W.

270.34792

CAS

Similarity

N/A

ID: 122266

1-[(2,6-dichlorophenyl)methyl]-5-methyl-1H-pyrazol-3-amine

$$$$ Data

M. F.

C11H11Cl2N3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3940

Database	Data ID
PubChem	7017724

M. W.

256.13114

CAS

Similarity

N/A

ID: 122267

1-[(3,4-dichlorophenyl)methyl]-5-methyl-1H-pyrazol-3-amine

$$$$ Data

M. F.

C11H11Cl2N3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3942

Database	Data ID
PubChem	7017726

M. W.

256.13114

CAS

Similarity

N/A

ID: 122268

5-methyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-3-amine

$$$$ Data

M. F.

C12H15N3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3943

Database	Data ID
PubChem	7017840

M. W.

201.2676

CAS

Similarity

N/A

ID: 122269

4-chloro-1-[(4-methylphenyl)methyl]-1H-pyrazol-3-amine

$$$$ Data

M. F.

C11H12ClN3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3944

Database	Data ID
PubChem	7022265

M. W.

221.68608

CAS

Similarity

N/A

ID: 122270

4-(1,3-dimethyl-1H-pyrazol-4-yl)-1,3-thiazol-2-amine

$$$$ Data

M. F.

C8H10N4S

Suppliers	Catalog Number
InterBioScreen	BB_SC-3949

Database	Data ID
PubChem	6485390

M. W.

194.2568

CAS

Similarity

N/A

ID: 122271

6-amino-4-(4-methoxyphenyl)-3-methyl-1H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

$$$$ Data

M. F.

C15H14N4O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-3952

Database	Data ID
PubChem	2865146

M. W.

282.29726

CAS

Similarity

N/A

ID: 122272

(5-methyl-1-propyl-1H-pyrazol-4-yl)methanamine

$$$$ Data

M. F.

C8H15N3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3953

Database	Data ID
PubChem	16394857

M. W.

153.2248

CAS

Similarity

N/A

ID: 122273

1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazol-3-amine

$$$$ Data

M. F.

C11H10F3N3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3955

Database	Data ID
PubChem	7022256

M. W.

241.2124096

CAS

Similarity

N/A

ID: 122274

4-chloro-1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrazol-3-amine

$$$$ Data

M. F.

C10H8Cl2FN3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3956

Database	Data ID
PubChem	7022262

M. W.

260.0950232

CAS

Similarity

N/A

ID: 122275

4-chloro-1-[(3-methylphenyl)methyl]-1H-pyrazol-3-amine

$$$$ Data

M. F.

C11H12ClN3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3957

Database	Data ID
PubChem	7022260

M. W.

221.68608

CAS

Similarity

N/A

ID: 122276

1-ethyl-3-methyl-1H-pyrazol-4-amine

$$$$ Data

M. F.

C6H11N3

Suppliers	Catalog Number
ChemBridge	4031554
InterBioScreen	BB_SC-3959
Beijing Advanced Technology	CK-06-011

Database	Data ID
PubChem	6485354

M. W.

125.17164

CAS

947763-34-0

Similarity

N/A

ID: 122277

methyl 1-({[4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1...

$$$$ Data

M. F.

C9H9F3N6O2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-3961

Database	Data ID
PubChem	7018642

M. W.

322.2669696

CAS

Similarity

N/A

ID: 122278

methyl 1-{[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-pyrazole-...

$$$$ Data

M. F.

C9H12N6O2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-3962

Database	Data ID
PubChem	7018679

M. W.

268.29558

CAS

Similarity

N/A

ID: 122279

3-{[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-5-(trifluoromethyl)-4...

$$$$ Data

M. F.

C9H10F3N7O2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-3964

Database	Data ID
PubChem	7018680

M. W.

337.2816096

CAS

Similarity

N/A

ID: 122280

3-{[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-4H-1,2,4-triazol-4-am...

$$$$ Data

M. F.

C8H11N7O2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-3965

Database	Data ID
PubChem	7018683

M. W.

269.28364

CAS

Similarity

N/A

ID: 122281

methyl 1-({[4-amino-5-(difluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1H...

$$$$ Data

M. F.

C9H10F2N6O2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-3966

Database	Data ID
PubChem	7018682

M. W.

304.2765064

CAS

Similarity

N/A

ID: 122282

methyl 1-{[(4-amino-5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-pyrazole-3...

$$$$ Data

M. F.

C10H14N6O2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-3967

Database	Data ID
PubChem	7018681

M. W.

282.32216

CAS

Similarity

N/A

ID: 122283

1-(2,4-difluorophenoxymethyl)-3,5-dimethyl-1H-pyrazol-4-amine

$$$$ Data

M. F.

C12H13F2N3O

Suppliers	Catalog Number
InterBioScreen	BB_SC-3968

Database	Data ID
PubChem	7017262

M. W.

253.2479264

CAS

Similarity

N/A

ID: 122284

1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-amine

$$$$ Data

M. F.

C10H6F5N3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3969

Database	Data ID
PubChem	7176040

M. W.

263.166756

CAS

Similarity

N/A

ID: 122285

[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-amine

$$$$ Data

M. F.

C3H3N5S

Suppliers	Catalog Number
InterBioScreen	BB_SC-3972
Enamine	EN300-08602

Database	Data ID
PubChem	254565

M. W.

141.15442

CAS

3176-50-9

Similarity

N/A

ID: 122286

(3-methyl-1-propyl-1H-pyrazol-4-yl)methanamine

$$$$ Data

M. F.

C8H15N3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3973

Database	Data ID
PubChem	16394858

M. W.

153.2248

CAS

Similarity

N/A

ID: 122287

1-(4-chloro-3-methylphenoxymethyl)-3,5-dimethyl-1H-pyrazol-4-amine

$$$$ Data

M. F.

C13H16ClN3O

Suppliers	Catalog Number
InterBioScreen	BB_SC-3975

Database	Data ID
PubChem	7017261

M. W.

265.73864

CAS

Similarity

N/A

ID: 122288

3,5-dimethyl-1-[(trimethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-amine

$$$$ Data

M. F.

C12H19N5

Suppliers	Catalog Number
InterBioScreen	BB_SC-3977

Database	Data ID
PubChem	7017746

M. W.

233.31276

CAS

Similarity

N/A

ID: 122289

1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine

$$$$ Data

M. F.

C12H19N5

Suppliers	Catalog Number
InterBioScreen	BB_SC-3978

Database	Data ID
PubChem	7017745

M. W.

233.31276

CAS

Similarity

N/A

ID: 122290

1-[(1-ethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-amine

$$$$ Data

M. F.

C9H13N5

Suppliers	Catalog Number
InterBioScreen	BB_SC-3979

Database	Data ID
PubChem	7022253

M. W.

191.23302

CAS

Similarity

N/A

ID: 122291

1-[(4-bromophenyl)methyl]-5-methyl-1H-pyrazol-3-amine

$$$$ Data

M. F.

C11H12BrN3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3982

Database	Data ID
PubChem	7176035

M. W.

266.13708

CAS

Similarity

N/A

ID: 122292

N-ethyl-3-methyl-1-propyl-1H-pyrazole-5-carboxamide

$$$$ Data

M. F.

C10H17N3O

Suppliers	Catalog Number
InterBioScreen	BB_SC-3987

Database	Data ID
PubChem	16394862

M. W.

195.26148

CAS

Similarity

N/A

ID: 122293

5-methyl-1-(propan-2-yl)-1H-pyrazol-3-amine

$$$$ Data

M. F.

C7H13N3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3989

Database	Data ID
PubChem	7176029

M. W.

139.19822

CAS

Similarity

N/A

ID: 122294

1-(4-fluorophenyl)-6-methoxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

$$$$ Data

M. F.

C18H17FN2O

Suppliers	Catalog Number
InterBioScreen	BB_SC-3994

Database	Data ID
PubChem	4563434

M. W.

296.3387832

CAS

Similarity

N/A

ID: 122295

1-(4-methoxyphenyl)-6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

$$$$ Data

M. F.

C19H20N2O

Suppliers	Catalog Number
InterBioScreen	BB_SC-3995

Database	Data ID
PubChem	3967604

M. W.

292.3749

CAS

Similarity

N/A

ID: 122296

4-(4-chloro-1H-pyrazol-1-yl)aniline

$$$$ Data

M. F.

C9H8ClN3

Suppliers	Catalog Number
InterBioScreen	BB_SC-3998

Database	Data ID
PubChem	4913023

M. W.

193.63292

CAS

Similarity

N/A

ID: 122297

ethyl 2-amino-5-methyl-1,3-thiazole-4-carboxylate

$$$$ Data

M. F.

C7H10N2O2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-4002
Bide Pharmatech	BD137984

Database	Data ID
PubChem	766578

M. W.

186.2315

CAS

72054-60-5

Similarity

N/A

ID: 122298

bis(trifluoromethyl)mercury

$$$$ Data

M. F.

C2F6Hg

Suppliers	Catalog Number
InterBioScreen	BB_SC-4007

Database	Data ID
PubChem	550525

M. W.

338.6018192

CAS

Similarity

N/A

ID: 122299

3-(2,4-dichlorophenoxymethyl)-4-methoxybenzaldehyde

$$$$ Data

M. F.

C15H12Cl2O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-4013

Database	Data ID
PubChem	590871

M. W.

311.15998

CAS

Similarity

N/A

ID: 122300

3-(trifluoromethyl)-1H,4H,5H,6H-cyclopenta[c]pyrazole

$$$$ Data

M. F.

C7H7F3N2

Suppliers	Catalog Number
InterBioScreen	BB_SC-4017

Database	Data ID
PubChem	1503280

M. W.

176.1390896

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