Chembase list of 866358 unique molecular structures

$$$$ Data

M. F.

C10H11FN2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00459
ChemBridge	4005770
A&J Pharmtech	AJA-O26428

Database	Data ID
PubChem	45791036

M. W.

194.2055432

CAS

Similarity

N/A

ID: 144002

3-(3-methylphenyl)propan-1-amine

$$$$ Data

M. F.

C10H15N

Suppliers	Catalog Number
Sigma Aldrich	CBR00042
ChemBridge	4028384

Database	Data ID
PubChem	12666388

M. W.

149.2328

CAS

104774-85-8

Similarity

N/A

ID: 144003

3-(4-chlorophenyl)piperidine

$$$$ Data

M. F.

C11H14ClN

Suppliers	Catalog Number
Sigma Aldrich	CBR00403
ChemBridge	4004245

Database	Data ID
PubChem	20364575

M. W.

195.68856

CAS

55989-13-4

Similarity

N/A

ID: 144004

3-[4-(propan-2-yl)phenyl]propan-1-amine

$$$$ Data More

M. F.

C12H19N

Suppliers	Catalog Number
Sigma Aldrich	CBR00007
ChemBridge	4016878
Enamine	EN300-79667

Database	Data ID
PubChem	17608819

M. W.

177.28596

CAS

165736-01-6

Similarity

N/A

ID: 144005

3-(4-methyl-1,3-thiazol-5-yl)propanoic acid

$$$$ Data

M. F.

C7H9NO2S

Suppliers	Catalog Number
Sigma Aldrich	CBR00359
ChemBridge	4003346

Database	Data ID
PubChem	80940

M. W.

171.21686

CAS

6469-32-5

Similarity

N/A

ID: 144006

3-(4-methylphenyl)propan-1-amine

$$$$ Data

M. F.

C10H15N

Suppliers	Catalog Number
Sigma Aldrich	CBR00043
ChemBridge	4016876
A&J Pharmtech	AJA-O26922

Database	Data ID
PubChem	12564270

M. W.

149.2328

CAS

54930-39-1

Similarity

N/A

ID: 144007

4-amino-N,N-dimethylbutanamide hydrochloride

$$$$ Data

M. F.

C6H15ClN2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00927
Enamine	EN300-54269

Database	Data ID
PubChem	45792288

M. W.

166.6491

CAS

Similarity

N/A

ID: 144008

4-azatricyclo[4.3.1.1³,⁸]undecane hydrochloride

$$$$ Data

M. F.

C10H18ClN

Suppliers	Catalog Number
Sigma Aldrich	CBR00756
Enamine	EN300-52257

Database	Data ID
PubChem	32271

M. W.

187.70962

CAS

Similarity

N/A

ID: 144009

4-chloro-2,5-dimethylpyrimidine

$$$$ Data

M. F.

C6H7ClN2

Suppliers	Catalog Number
Sigma Aldrich	CBR00286
ChemBridge	4026637
A&J Pharmtech	AJA-O22267

Database	Data ID
PubChem	12465381

M. W.

142.58618

CAS

75712-74-2

Similarity

N/A

ID: 144010

4-chloro-2-methyl-5-propylpyrimidine

$$$$ Data

M. F.

C8H11ClN2

Suppliers	Catalog Number
Sigma Aldrich	CBR00552
ChemBridge	4026640

Database	Data ID
PubChem	28064543

M. W.

170.63934

CAS

959239-77-1

Similarity

N/A

ID: 144011

4-chloro-6-ethyl-2-methylpyrimidine

$$$$ Data More

M. F.

C7H9ClN2

Suppliers	Catalog Number
Sigma Aldrich	CBR00125
ChemBridge	4029661
Enamine	EN300-88832

Database	Data ID
PubChem	13153403

M. W.

156.61276

CAS

89966-72-3

Similarity

N/A

ID: 144012

4-chloro-6-ethyl-2-(piperidin-1-yl)pyrimidine

$$$$ Data

M. F.

C11H16ClN3

Suppliers	Catalog Number
Sigma Aldrich	CBR00584
ChemBridge	4016000

Database	Data ID
PubChem	17750884

M. W.

225.71784

CAS

901586-58-1

Similarity

N/A

ID: 144013

4-chloro-6-ethyl-2-(pyrrolidin-1-yl)pyrimidine

$$$$ Data

M. F.

C10H14ClN3

Suppliers	Catalog Number
Sigma Aldrich	CBR00583
ChemBridge	4015989

Database	Data ID
PubChem	17750886

M. W.

211.69126

CAS

901586-62-7

Similarity

N/A

ID: 144014

4-chloro-6-ethyl-N,N-dimethylpyrimidin-2-amine

$$$$ Data

M. F.

C8H12ClN3

Suppliers	Catalog Number
Sigma Aldrich	CBR00541
ChemBridge	4015978

Database	Data ID
PubChem	20284974

M. W.

185.65398

CAS

71406-66-1

Similarity

N/A

ID: 144015

4-chloro-6-methylthieno[2,3-d]pyrimidine

$$$$ Data

M. F.

C7H5ClN2S

Suppliers	Catalog Number
Sigma Aldrich	CBR00096
ChemBridge	4031610
Enamine	EN300-71589

Database	Data ID
PubChem	2757710

M. W.

184.646

CAS

106691-21-8

Similarity

N/A

ID: 144016

4-chloro-N,N,5,6-tetramethylpyrimidin-2-amine

$$$$ Data

M. F.

C8H12ClN3

Suppliers	Catalog Number
Sigma Aldrich	CBR00582
ChemBridge	4015982

Database	Data ID
PubChem	12395349

M. W.

185.65398

CAS

65735-58-2

Similarity

N/A

ID: 144017

4-chloro-N,N-dimethyl-6-(trifluoromethyl)pyrimidin-2-amine

$$$$ Data

M. F.

C7H7ClF3N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00134
ChemBridge	4015979

Database	Data ID
PubChem	17999107

M. W.

225.5987896

CAS

915924-97-9

Similarity

N/A

ID: 144018

4-ethylpyrrolidin-2-one

$$$$ Data

M. F.

C6H11NO

Suppliers	Catalog Number
Sigma Aldrich	CBR00057
ChemBridge	4026756
Enamine	EN300-105294

Database	Data ID
PubChem	10866300

M. W.

113.15764

CAS

41819-75-4

Similarity

N/A

ID: 144019

4-ethyl-3,5-dimethyl-1H-pyrrole-2-carbaldehyde

$$$$ Data

M. F.

C9H13NO

Suppliers	Catalog Number
Sigma Aldrich	CBR00529
ChemBridge	4302234

Database	Data ID
PubChem	138703

M. W.

151.20562

CAS

6250-80-2

Similarity

N/A

ID: 144020

4-ethyl-3-methyl-1H-pyrazol-5-amine hydrochloride

$$$$ Data

M. F.

C6H12ClN3

Suppliers	Catalog Number
Sigma Aldrich	CBR00836

Database	Data ID
PubChem	53398873

M. W.

161.63258

CAS

Similarity

N/A

ID: 144021

4-ethyl-4-methylpiperidine

$$$$ Data

M. F.

C8H17N

Suppliers	Catalog Number
Sigma Aldrich	CBR00049
ChemBridge	4021540

Database	Data ID
PubChem	17750882

M. W.

127.22728

CAS

4045-31-2

Similarity

N/A

ID: 144022

4-ethylpiperazine-1-sulfonyl chloride hydrochloride

$$$$ Data

M. F.

C6H14Cl2N2O2S

Suppliers	Catalog Number
Sigma Aldrich	CBR00872
Enamine	EN300-39948

Database	Data ID
PubChem	21973140

M. W.

249.15856

CAS

Similarity

N/A

ID: 144023

4-ethylpiperidine

$$$$ Data

M. F.

C7H15N

Suppliers	Catalog Number
Sigma Aldrich	CBR00026
ChemBridge	4004580
Enamine	EN300-50348

Database	Data ID
PubChem	76704

M. W.

113.2007

CAS

3230-23-7

Similarity

N/A

ID: 144024

3-(ethylamino)-1λ⁶-thiolane-1,1-dione hydrochloride

$$$$ Data

M. F.

C6H14ClNO2S

Suppliers	Catalog Number
Sigma Aldrich	CBR00799
Enamine	EN300-10627

Database	Data ID
PubChem	16248236

M. W.

199.69886

CAS

Similarity

N/A

ID: 144025

methyl(3-methylbutan-2-yl)amine hydrochloride

$$$$ Data

M. F.

C6H16ClN

Suppliers	Catalog Number
Sigma Aldrich	CBR00876
Enamine	EN300-31095

Database	Data ID
PubChem	43810525

M. W.

137.65094

CAS

Similarity

N/A

ID: 144026

(1,3-dimethylpiperidin-3-yl)methanol

$$$$ Data

M. F.

C8H17NO

Suppliers	Catalog Number
Sigma Aldrich	CBR00480
ChemBridge	4016764

Database	Data ID
PubChem	44827703

M. W.

143.22668

CAS

915925-11-0

Similarity

N/A

ID: 144027

(adamantan-1-ylmethyl)(methyl)amine hydrochloride

$$$$ Data

M. F.

C12H22ClN

Suppliers	Catalog Number
Sigma Aldrich	CBR00755
Enamine	EN300-15303

Database	Data ID
PubChem	16269949

M. W.

215.76278

CAS

1773-99-5

Similarity

N/A

ID: 144028

(1-cyclohexyl-1H-imidazol-5-yl)methanol

$$$$ Data

M. F.

C10H16N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00479
ChemBridge	4016576

Database	Data ID
PubChem	20568533

M. W.

180.24684

CAS

80304-48-9

Similarity

N/A

ID: 144029

1-cyclohexylcyclopropan-1-amine hydrochloride

$$$$ Data

M. F.

C9H18ClN

Suppliers	Catalog Number
Sigma Aldrich	CBR00895

Database	Data ID
PubChem	53398898

M. W.

175.69892

CAS

Similarity

N/A

ID: 144030

1-cyclopentylcyclopropan-1-amine hydrochloride

$$$$ Data

M. F.

C8H16ClN

Suppliers	Catalog Number
Sigma Aldrich	CBR00892

Database	Data ID
PubChem	53398896

M. W.

161.67234

CAS

Similarity

N/A

ID: 144031

1,3-dimethyl-1,4-diazepane dihydrochloride

$$$$ Data

M. F.

C7H18Cl2N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00656

Database	Data ID
PubChem	53398805

M. W.

201.13722

CAS

Similarity

N/A

ID: 144032

1,3-oxazinan-2-one

$$$$ Data

M. F.

C4H7NO2

Suppliers	Catalog Number
Sigma Aldrich	CBR00063
ChemBridge	4035958

Database	Data ID
PubChem	641496

M. W.

101.10388

CAS

5259-97-2

Similarity

N/A

ID: 144033

1,3-thiazinane-4-carboxylic acid hydrochloride

$$$$ Data

M. F.

C5H10ClNO2S

Suppliers	Catalog Number
Sigma Aldrich	CBR00886

Database	Data ID
PubChem	53398893

M. W.

183.6564

CAS

Similarity

N/A

ID: 144034

1-(piperidin-4-yl)piperidin-4-ol

$$$$ Data

M. F.

C10H20N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00358
ChemBridge	4100008

Database	Data ID
PubChem	22061342

M. W.

184.2786

CAS

550370-19-9

Similarity

N/A

ID: 144035

1,4-dimethyl-3-phenyl-1H-pyrazol-5-amine hydrochloride

$$$$ Data

M. F.

C11H14ClN3

Suppliers	Catalog Number
Sigma Aldrich	CBR00791

Database	Data ID
PubChem	53398860

M. W.

223.70196

CAS

Similarity

N/A

ID: 144036

(1S,9aR)-octahydro-1H-quinolizin-1-ylmethanamine dihydrochloride

$$$$ Data

M. F.

C10H22Cl2N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00685

Database	Data ID
PubChem	6917135

M. W.

241.20108

CAS

Similarity

N/A

ID: 144037

hexahydro-1H-pyrrolizin-7a-ylmethanamine dihydrochloride

$$$$ Data

M. F.

C8H18Cl2N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00682

Database	Data ID
PubChem	53398819

M. W.

213.14792

CAS

Similarity

N/A

ID: 144038

1-[(diethylamino)methyl]cyclopropan-1-amine dihydrochloride

$$$$ Data

M. F.

C8H20Cl2N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00665

Database	Data ID
PubChem	53398809

M. W.

215.1638

CAS

Similarity

N/A

ID: 144039

[1-(1H-imidazol-1-ylmethyl)cyclopropyl]methanamine

$$$$ Data

M. F.

C8H13N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00278
ChemBridge	4026736

Database	Data ID
PubChem	11701066

M. W.

151.20892

CAS

877204-21-2

Similarity

N/A

ID: 144040

[1-(2-methylphenyl)-1H-pyrazol-4-yl]methanamine

$$$$ Data

M. F.

C11H13N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00115
ChemBridge	4003925

Database	Data ID
PubChem	24704103

M. W.

187.24102

CAS

400756-82-3

Similarity

N/A

ID: 144041

[1-(4-chlorophenyl)cyclopropyl]methanamine

$$$$ Data More

M. F.

C10H12ClN

Suppliers	Catalog Number
Sigma Aldrich	CBR00039
ChemBridge	4028379
Enamine	EN300-66661

Database	Data ID
PubChem	4120166

M. W.

181.66198

CAS

69385-29-1

Similarity

N/A

ID: 144042

3-(5-methyl-1H-1,3-benzodiazol-2-yl)propan-1-ol

$$$$ Data

M. F.

C11H14N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00449
ChemBridge	4003320

Database	Data ID
PubChem	4697731

M. W.

190.24166

CAS

13395-19-2

Similarity

N/A

ID: 144043

3-(carboxymethyl)-1,2,3-oxadiazol-3-ium-5-olate

$$$$ Data

M. F.

C4H4N2O4

Suppliers	Catalog Number
Sigma Aldrich	CBR00463
ChemBridge	4001601

Database	Data ID
PubChem	541944

M. W.

144.08556

CAS

26537-53-1

Similarity

N/A

ID: 144044

3-(chloromethyl)-1-ethylpyrrolidine

$$$$ Data

M. F.

C7H14ClN

Suppliers	Catalog Number
Sigma Aldrich	CBR00305
ChemBridge	4028189

Database	Data ID
PubChem	45157109

M. W.

147.64576

CAS

98338-34-2

Similarity

N/A

ID: 144045

3-(hydroxyamino)-1λ⁶-thiolane-1,1-dione hydrochloride

$$$$ Data

M. F.

C4H10ClNO3S

Suppliers	Catalog Number
Sigma Aldrich	CBR00743

Database	Data ID
PubChem	47000585

M. W.

187.6451

CAS

Similarity

N/A

ID: 144046

3,3-dimethyl-1-(pyridin-3-yl)butan-1-amine

$$$$ Data

M. F.

C11H18N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00501
ChemBridge	4026609

Database	Data ID
PubChem	45490108

M. W.

178.27402

CAS

959239-41-9

Similarity

N/A

ID: 144047

3,4-diethyl-1H-pyrazol-5-amine

$$$$ Data

M. F.

C7H13N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00386
ChemBridge	4015277

Database	Data ID
PubChem	19002169

M. W.

139.19822

CAS

Similarity

N/A

ID: 144048

3,5-dichloro-4-(prop-2-yn-1-yloxy)benzaldehyde

$$$$ Data

M. F.

C10H6Cl2O2

Suppliers	Catalog Number
Sigma Aldrich	CBR00206
ChemBridge	4022593

Database	Data ID
PubChem	2162038

M. W.

229.05944

CAS

426229-84-7

Similarity

N/A

ID: 144049

4-methyl-1H-indazole

$$$$ Data

M. F.

C8H8N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00232
ChemBridge	4028681
Bide Pharmatech	BD98646

Database	Data ID
PubChem	820806

M. W.

132.16252

CAS

3176-63-4

Similarity

N/A

ID: 144050

4-methyl-3-phenyl-1,2-oxazol-5-amine

$$$$ Data

M. F.

C10H10N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00118
ChemBridge	4010205

Database	Data ID
PubChem	570558

M. W.

174.1992

CAS

4320-84-7

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