Chembase list of 866358 unique molecular structures

2-methyl-1-(pyridin-2-yl)propan-1-amine dihydrochloride

$$$$ Data

M. F.

C9H16Cl2N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00662

Database	Data ID
PubChem	47000772

M. W.

223.14274

CAS

Similarity

N/A

ID: 144102

2-methyl-2,3-dihydro-1-benzofuran-5-amine hydrobromide

$$$$ Data

M. F.

C9H12BrNO

Suppliers	Catalog Number
Sigma Aldrich	CBR00712

Database	Data ID
PubChem	45595344

M. W.

230.10168

CAS

Similarity

N/A

ID: 144103

3-(2-methylphenyl)aniline hydrochloride

$$$$ Data

M. F.

C13H14ClN

Suppliers	Catalog Number
Sigma Aldrich	CBR00938

Database	Data ID
PubChem	2759821

M. W.

219.70996

CAS

Similarity

N/A

ID: 144104

2-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetaldehyde

$$$$ Data

M. F.

C9H7NO3

Suppliers	Catalog Number
Sigma Aldrich	CBR00550
ChemBridge	4025863

Database	Data ID
PubChem	22405549

M. W.

177.15678

CAS

13610-81-6

Similarity

N/A

ID: 144105

2-(2-phenyl-1H-imidazol-1-yl)acetic acid; acetic acid

$$$$ Data

M. F.

C13H14N2O4

Suppliers	Catalog Number
Sigma Aldrich	CBR00599

Database	Data ID
PubChem	47000604

M. W.

262.26126

CAS

Similarity

N/A

ID: 144106

(2-phenylethyl)(propyl)amine

$$$$ Data

M. F.

C11H17N

Suppliers	Catalog Number
Sigma Aldrich	CBR00107
ChemBridge	6382736

Database	Data ID
PubChem	3142088

M. W.

163.25938

CAS

27906-91-8

Similarity

N/A

ID: 144107

2-(2,4-dioxo-1,3-thiazolidin-5-ylidene)acetic acid

$$$$ Data

M. F.

C5H3NO4S

Suppliers	Catalog Number
Sigma Aldrich	CBR00426

Database	Data ID
PubChem	1580506

M. W.

173.14662

CAS

5374-29-8

Similarity

N/A

ID: 144108

3,4-dihydro-2H-1-benzopyran-6-ylmethanamine hydrochloride

$$$$ Data

M. F.

C10H14ClNO

Suppliers	Catalog Number
Sigma Aldrich	CBR00854

Database	Data ID
PubChem	47000745

M. W.

199.67726

CAS

Similarity

N/A

ID: 144109

1-[4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]ethan-1-amine dihydrochloride

$$$$ Data

M. F.

C7H16Cl2N4O

Suppliers	Catalog Number
Sigma Aldrich	CBR00653

Database	Data ID
PubChem	53398804

M. W.

243.13414

CAS

Similarity

N/A

ID: 144110

[4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]methanamine dihydrochloride

$$$$ Data

M. F.

C6H14Cl2N4O

Suppliers	Catalog Number
Sigma Aldrich	CBR00644

Database	Data ID
PubChem	53398800

M. W.

229.10756

CAS

Similarity

N/A

ID: 144111

{[4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]methyl}(methyl)amine dihydrochloride

$$$$ Data

M. F.

C7H16Cl2N4O

Suppliers	Catalog Number
Sigma Aldrich	CBR00652

Database	Data ID
PubChem	53398803

M. W.

243.13414

CAS

Similarity

N/A

ID: 144112

[5-(furan-2-yl)-1,2-oxazol-3-yl]methanamine hydrochloride

$$$$ Data

M. F.

C8H9ClN2O2

Suppliers	Catalog Number
Sigma Aldrich	CBR00907

Database	Data ID
PubChem	53398902

M. W.

200.62226

CAS

Similarity

N/A

ID: 144113

[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]methanamine

$$$$ Data

M. F.

C5H9N3O2

Suppliers	Catalog Number
Sigma Aldrich	CBR00369
ChemBridge	4028566

Database	Data ID
PubChem	20099236

M. W.

143.14386

CAS

893748-77-1

Similarity

N/A

ID: 144114

1-(3-aminopiperidin-1-yl)ethan-1-one hydrochloride

$$$$ Data

M. F.

C7H15ClN2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00904
Bide Pharmatech	BD171032

Database	Data ID
PubChem	44120467

M. W.

178.6598

CAS

1018680-22-2

Similarity

N/A

ID: 144115

1-amino-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid hydrochloride

$$$$ Data

M. F.

C11H14ClNO2

Suppliers	Catalog Number
Sigma Aldrich	CBR00943

Database	Data ID
PubChem	50944370

M. W.

227.68736

CAS

Similarity

N/A

ID: 144116

1-amino-4,6-dimethyl-1,2-dihydropyridin-2-one

$$$$ Data

M. F.

C7H10N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00430
ChemBridge	4004642

Database	Data ID
PubChem	703657

M. W.

138.1671

CAS

98334-40-8

Similarity

N/A

ID: 144117

1-butyl-1H-1,2,3,4-tetrazol-5-amine

$$$$ Data

M. F.

C5H11N5

Suppliers	Catalog Number
Sigma Aldrich	CBR00570
ChemBridge	4016426

Database	Data ID
PubChem	223446

M. W.

141.17434

CAS

6280-31-5

Similarity

N/A

ID: 144118

4-hydroxy-3-(prop-2-en-1-yl)benzaldehyde

$$$$ Data

M. F.

C10H10O2

Suppliers	Catalog Number
Sigma Aldrich	CBR00234
ChemBridge	6474172

Database	Data ID
PubChem	4729014

M. W.

162.1852

CAS

41052-88-4

Similarity

N/A

ID: 144119

3-amino-N,4-dimethylbenzamide

$$$$ Data

M. F.

C9H12N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00280
ChemBridge	4027660
Enamine	EN300-33450

Database	Data ID
PubChem	12607973

M. W.

164.20438

CAS

54884-19-4

Similarity

N/A

ID: 144120

3-(azepan-1-yl)propan-1-ol

$$$$ Data

M. F.

C9H19NO

Suppliers	Catalog Number
Sigma Aldrich	CBR00469
ChemBridge	4010638

Database	Data ID
PubChem	10558885

M. W.

157.25326

CAS

29194-89-6

Similarity

N/A

ID: 144121

3-chloro-4-(pyrrolidin-1-yl)benzoic acid

$$$$ Data

M. F.

C11H12ClNO2

Suppliers	Catalog Number
Sigma Aldrich	CBR00094
ChemBridge	6606817

Database	Data ID
PubChem	4769383

M. W.

225.67148

CAS

585517-09-5

Similarity

N/A

ID: 144122

3-chloro-N-cyclopropylpropanamide

$$$$ Data

M. F.

C6H10ClNO

Suppliers	Catalog Number
Sigma Aldrich	CBR00331
ChemBridge	5694825
Enamine	EN300-32016

Database	Data ID
PubChem	4991895

M. W.

147.6027

CAS

573994-60-2

Similarity

N/A

ID: 144123

3-ethyl-1H-indole-2-carboxylic acid

$$$$ Data

M. F.

C11H11NO2

Suppliers	Catalog Number
Sigma Aldrich	CBR00410
ChemBridge	4002605

Database	Data ID
PubChem	19787139

M. W.

189.21054

CAS

92287-88-2

Similarity

N/A

ID: 144124

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

$$$$ Data

M. F.

C6H12ClN3

Suppliers	Catalog Number
Sigma Aldrich	CBR00790

Database	Data ID
PubChem	20377561

M. W.

161.63258

CAS

Similarity

N/A

ID: 144125

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

$$$$ Data

M. F.

C6H10N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00451
ChemBridge	4015308

Database	Data ID
PubChem	4737032

M. W.

126.1564

CAS

153458-34-5

Similarity

N/A

ID: 144126

5,6-diamino-2,3-dihydro-1H-1,3-benzodiazol-2-one

$$$$ Data More

M. F.

C7H8N4O

Suppliers	Catalog Number
Sigma Aldrich	CBR00196
ChemBridge	4012327
TRC	D416340 D416341

Database	Data ID
PubChem	727371

M. W.

164.16462

CAS

55621-49-3

Similarity

N/A

ID: 144127

5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-amine

$$$$ Data

M. F.

C8H10N4

Suppliers	Catalog Number
Sigma Aldrich	CBR00489
ChemBridge	4013434

Database	Data ID
PubChem	28063903

M. W.

162.1918

CAS

1605-78-3

Similarity

N/A

ID: 144128

5-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]furan-2-carbaldehyde

$$$$ Data

M. F.

C8H7N3O2S

Suppliers	Catalog Number
Sigma Aldrich	CBR00548
ChemBridge	4302969

Database	Data ID
PubChem	28065303

M. W.

209.22508

CAS

938459-16-6

Similarity

N/A

ID: 144129

5-[2-(dimethylamino)ethyl]-1,3,4-thiadiazol-2-amine

$$$$ Data

M. F.

C6H12N4S

Suppliers	Catalog Number
Sigma Aldrich	CBR00272
ChemBridge	6038299

Database	Data ID
PubChem	28065408

M. W.

172.25128

CAS

14068-78-1

Similarity

N/A

ID: 144130

5-amino-1H-pyrazole-3-carboxamide hydrochloride

$$$$ Data

M. F.

C4H7ClN4O

Suppliers	Catalog Number
Sigma Aldrich	CBR00929

Database	Data ID
PubChem	53398907

M. W.

162.57758

CAS

Similarity

N/A

ID: 144131

5-amino-1-methyl-2-sulfanyl-1H-imidazole-4-carboxamide

$$$$ Data

M. F.

C5H8N4OS

Suppliers	Catalog Number
Sigma Aldrich	CBR00498
ChemBridge	4025839

Database	Data ID
PubChem	3005023

M. W.

172.20822

CAS

52868-67-4

Similarity

N/A

ID: 144132

(trimethylpyrazin-2-yl)methanol

$$$$ Data

M. F.

C8H12N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00478
ChemBridge	4014671

Database	Data ID
PubChem	12629702

M. W.

152.19368

CAS

75907-74-3

Similarity

N/A

ID: 144133

(3-amino-2-methylpropyl)dimethylamine

$$$$ Data

M. F.

C6H16N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00154
ChemBridge	4027503

Database	Data ID
PubChem	110778

M. W.

116.20464

CAS

6105-72-2

Similarity

N/A

ID: 144134

3-[(diethylamino)methyl]aniline

$$$$ Data

M. F.

C11H18N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00121
ChemBridge	4027899
Enamine	EN300-33517

Database	Data ID
PubChem	3359246

M. W.

178.27402

CAS

27958-97-0

Similarity

N/A

ID: 144135

(3-chloro-4-ethoxyphenyl)methanol

$$$$ Data

M. F.

C9H11ClO2

Suppliers	Catalog Number
Sigma Aldrich	CBR00273
ChemBridge	7265027

Database	Data ID
PubChem	19354063

M. W.

186.63544

CAS

915922-38-2

Similarity

N/A

ID: 144136

N-[(3-chlorophenyl)methyl]cyclopropanamine hydrochloride

$$$$ Data

M. F.

C10H13Cl2N

Suppliers	Catalog Number
Sigma Aldrich	CBR00952

Database	Data ID
PubChem	45596037

M. W.

218.12292

CAS

Similarity

N/A

ID: 144137

[(3-chlorophenyl)methyl]hydrazine hydrochloride

$$$$ Data

M. F.

C7H10Cl2N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00830
Enamine	EN300-103062

Database	Data ID
PubChem	17903314

M. W.

193.0737

CAS

Similarity

N/A

ID: 144138

2-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)acetic acid hydrochloride

$$$$ Data

M. F.

C6H9ClN2O3

Suppliers	Catalog Number
Sigma Aldrich	CBR00789

Database	Data ID
PubChem	53398859

M. W.

192.60026

CAS

Similarity

N/A

ID: 144139

[(3-methylphenyl)methyl]hydrazine hydrochloride

$$$$ Data

M. F.

C8H13ClN2

Suppliers	Catalog Number
Sigma Aldrich	CBR00827
Enamine	EN300-111151

Database	Data ID
PubChem	50999444

M. W.

172.65522

CAS

Similarity

N/A

ID: 144140

3-methylpentan-1-amine

$$$$ Data

M. F.

C6H15N

Suppliers	Catalog Number
Sigma Aldrich	CBR00385
ChemBridge	4015078

Database	Data ID
PubChem	3055957

M. W.

101.19

CAS

42245-37-4

Similarity

N/A

ID: 144141

1-cyclohexyl-3-methyl-1H-pyrazol-5-amine

$$$$ Data

M. F.

C10H17N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00567
ChemBridge	4013079

Database	Data ID
PubChem	4571951

M. W.

179.26208

CAS

56547-82-1

Similarity

N/A

ID: 144142

1-cyclohexylpiperazin-2-one; trifluoroacetic acid

$$$$ Data

M. F.

C12H19F3N2O3

Suppliers	Catalog Number
Sigma Aldrich	CBR00725

Database	Data ID
PubChem	53398839

M. W.

296.2860696

CAS

Similarity

N/A

ID: 144143

1-cyclopentyl-1,4-diazepane; bis(4-methylbenzene-1-sulfonic acid)

$$$$ Data

M. F.

C24H36N2O6S2

Suppliers	Catalog Number
Sigma Aldrich	CBR00608

Database	Data ID
PubChem	53398786

M. W.

512.68244

CAS

Similarity

N/A

ID: 144144

1-cyclopentylpropan-1-one

$$$$ Data

M. F.

C8H14O

Suppliers	Catalog Number
Sigma Aldrich	CBR00350
ChemBridge	4026118

Database	Data ID
PubChem	243074

M. W.

126.19616

CAS

6635-67-2

Similarity

N/A

ID: 144145

cyclopropyl(6-methylpyridin-2-yl)methanamine dihydrochloride

$$$$ Data

M. F.

C10H16Cl2N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00678

Database	Data ID
PubChem	50944253

M. W.

235.15344

CAS

Similarity

N/A

ID: 144146

1-ethyl-1H-1,2,4-triazol-5-amine hydrochloride

$$$$ Data

M. F.

C4H9ClN4

Suppliers	Catalog Number
Sigma Aldrich	CBR00782

Database	Data ID
PubChem	53398856

M. W.

148.59406

CAS

Similarity

N/A

ID: 144147

1-ethyl-1H-1,2,4-triazole-5-carbaldehyde

$$$$ Data

M. F.

C5H7N3O

Suppliers	Catalog Number
Sigma Aldrich	CBR00310
ChemBridge	4028391

Database	Data ID
PubChem	28064945

M. W.

125.12858

CAS

675617-95-5

Similarity

N/A

ID: 144148

1-ethyl-1H-imidazole-5-carbaldehyde

$$$$ Data

M. F.

C6H8N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00006
ChemBridge	4013830
A&J Pharmtech	AJA-O28971

Database	Data ID
PubChem	3159672

M. W.

124.14052

CAS

842972-42-3

Similarity

N/A

ID: 144149

1-ethyl-2,2-dimethylpiperazine dihydrochloride

$$$$ Data

M. F.

C8H20Cl2N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00670

Database	Data ID
PubChem	53398810

M. W.

215.1638

CAS

Similarity

N/A

ID: 144150

3-ethylpiperidin-3-ol

$$$$ Data

M. F.

C7H15NO

Suppliers	Catalog Number
Sigma Aldrich	CBR00014
ChemBridge	4016061

Database	Data ID
PubChem	45791114

M. W.

129.2001

CAS

1177299-74-9

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