Chembase list of 866358 unique molecular structures

$$$$ Data

M. F.

C9H11NO3

Suppliers	Catalog Number
Life Chemicals	F2167-0081
Enamine	EN300-70701
A&J Pharmtech	AJA-O34097

Database	Data ID
PubChem	265441

M. W.

181.18854

CAS

7314-43-4

Similarity

N/A

ID: 118002

2-amino-2-(4-methoxyphenyl)acetic acid

$$$$ Data More

M. F.

C9H11NO3

Suppliers	Catalog Number
Life Chemicals	F2167-0082
Enamine	EN300-69643
Bide Pharmatech	BD32495

Database	Data ID
PubChem	265442

M. W.

181.18854

CAS

19789-59-4

Similarity

N/A

ID: 118003

2-bromo-4-(4-fluorophenyl)-1,3-thiazole

$$$$ Data

M. F.

C9H5BrFNS

Suppliers	Catalog Number
Life Chemicals	F2167-0089
InterBioScreen	BB_SC-7644
A&J Pharmtech	AJA-O25446

Database	Data ID
PubChem	38996207

M. W.

258.1101032

CAS

412923-44-5

Similarity

N/A

ID: 118004

2-bromo-4-(4-methoxyphenyl)-1,3-thiazole

$$$$ Data

M. F.

C10H8BrNOS

Suppliers	Catalog Number
Life Chemicals	F2167-0090
A&J Pharmtech	AJA-O25448

Database	Data ID
PubChem	38996208

M. W.

270.14562

CAS

99073-84-4

Similarity

N/A

ID: 118005

N-(2,2,2-trifluoroethyl)-2H-1,3-benzodioxol-5-amine

$$$$ Data

M. F.

C9H8F3NO2

Suppliers	Catalog Number
Life Chemicals	F2167-0094

Database	Data ID
PubChem	20356992

M. W.

219.1605296

CAS

Similarity

N/A

ID: 118006

2-phenyl-N-(2,2,2-trifluoroethyl)aniline

$$$$ Data

M. F.

C14H12F3N

Suppliers	Catalog Number
Life Chemicals	F2167-0095

Database	Data ID
PubChem	29294703

M. W.

251.2469896

CAS

Similarity

N/A

ID: 118007

2-methoxy-N-(2,2,2-trifluoroethyl)aniline

$$$$ Data

M. F.

C9H10F3NO

Suppliers	Catalog Number
Life Chemicals	F2167-0096
Enamine	EN300-15430

Database	Data ID
PubChem	9118382

M. W.

205.1770096

CAS

Similarity

N/A

ID: 118008

3-methoxy-N-(2,2,2-trifluoroethyl)aniline

$$$$ Data

M. F.

C9H10F3NO

Suppliers	Catalog Number
Life Chemicals	F2167-0097

Database	Data ID
PubChem	23236498

M. W.

205.1770096

CAS

62351-58-0

Similarity

N/A

ID: 118009

{2,5-dimethyl-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-3-yl}methanamine

$$$$ Data

M. F.

C14H18N2S

Suppliers	Catalog Number
Life Chemicals	F2167-0103

Database	Data ID
PubChem	45496702

M. W.

246.37112

CAS

Similarity

N/A

ID: 118010

(1-benzyl-2,5-dimethyl-1H-pyrrol-3-yl)methanamine

$$$$ Data

M. F.

C14H18N2

Suppliers	Catalog Number
Life Chemicals	F2167-0105

Database	Data ID
PubChem	45496703

M. W.

214.30612

CAS

Similarity

N/A

ID: 118011

{1-[(4-fluorophenyl)methyl]-2,5-dimethyl-1H-pyrrol-3-yl}methanamine

$$$$ Data

M. F.

C14H17FN2

Suppliers	Catalog Number
Life Chemicals	F2167-0106

Database	Data ID
PubChem	45496704

M. W.

232.2965832

CAS

Similarity

N/A

ID: 118012

{1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-1H-pyrrol-3-yl}methanamine

$$$$ Data

M. F.

C15H20N2O

Suppliers	Catalog Number
Life Chemicals	F2167-0107

Database	Data ID
PubChem	45496705

M. W.

244.3321

CAS

Similarity

N/A

ID: 118013

{1-[(2-methoxyphenyl)methyl]-2,5-dimethyl-1H-pyrrol-3-yl}methanamine

$$$$ Data

M. F.

C15H20N2O

Suppliers	Catalog Number
Life Chemicals	F2167-0108

Database	Data ID
PubChem	45496706

M. W.

244.3321

CAS

Similarity

N/A

ID: 118014

{2,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrrol-3-yl}methanamine

$$$$ Data

M. F.

C15H20N2

Suppliers	Catalog Number
Life Chemicals	F2167-0109

Database	Data ID
PubChem	45496707

M. W.

228.3327

CAS

Similarity

N/A

ID: 118015

[2,5-dimethyl-1-(1-phenylethyl)-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C15H20N2

Suppliers	Catalog Number
Life Chemicals	F2167-0110

Database	Data ID
PubChem	45496708

M. W.

228.3327

CAS

Similarity

N/A

ID: 118016

[2,5-dimethyl-1-(pyridin-3-ylmethyl)-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C13H17N3

Suppliers	Catalog Number
Life Chemicals	F2167-0111

Database	Data ID
PubChem	45496709

M. W.

215.29418

CAS

Similarity

N/A

ID: 118017

[2,5-dimethyl-1-(pyridin-2-ylmethyl)-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C13H17N3

Suppliers	Catalog Number
Life Chemicals	F2167-0112

Database	Data ID
PubChem	45496710

M. W.

215.29418

CAS

Similarity

N/A

ID: 118018

(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methanamine

$$$$ Data

M. F.

C13H16N2

Suppliers	Catalog Number
Life Chemicals	F2167-0113

Database	Data ID
PubChem	20983254

M. W.

200.27954

CAS

Similarity

N/A

ID: 118019

[2,5-dimethyl-1-(2-methylphenyl)-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C14H18N2

Suppliers	Catalog Number
Life Chemicals	F2167-0114

Database	Data ID
PubChem	20983255

M. W.

214.30612

CAS

Similarity

N/A

ID: 118020

[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C14H18N2

Suppliers	Catalog Number
Life Chemicals	F2167-0115

Database	Data ID
PubChem	20983256

M. W.

214.30612

CAS

Similarity

N/A

ID: 118021

[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C14H18N2

Suppliers	Catalog Number
Life Chemicals	F2167-0116

Database	Data ID
PubChem	20888477

M. W.

214.30612

CAS

Similarity

N/A

ID: 118022

[1-(4-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C15H20N2

Suppliers	Catalog Number
Life Chemicals	F2167-0117

Database	Data ID
PubChem	20983257

M. W.

228.3327

CAS

Similarity

N/A

ID: 118023

{2,5-dimethyl-1-[4-(propan-2-yl)phenyl]-1H-pyrrol-3-yl}methanamine

$$$$ Data

M. F.

C16H22N2

Suppliers	Catalog Number
Life Chemicals	F2167-0118

Database	Data ID
PubChem	45496711

M. W.

242.35928

CAS

Similarity

N/A

ID: 118024

[1-(3-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C13H15FN2

Suppliers	Catalog Number
Life Chemicals	F2167-0119

Database	Data ID
PubChem	45496712

M. W.

218.2700032

CAS

Similarity

N/A

ID: 118025

[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C13H15FN2

Suppliers	Catalog Number
Life Chemicals	F2167-0120

Database	Data ID
PubChem	20983266

M. W.

218.2700032

CAS

Similarity

N/A

ID: 118026

{2,5-dimethyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}methanamine

$$$$ Data

M. F.

C14H15F3N2

Suppliers	Catalog Number
Life Chemicals	F2167-0121

Database	Data ID
PubChem	45496713

M. W.

268.2775096

CAS

Similarity

N/A

ID: 118027

{2,5-dimethyl-1-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}methanamine

$$$$ Data

M. F.

C14H15F3N2

Suppliers	Catalog Number
Life Chemicals	F2167-0122

Database	Data ID
PubChem	45496714

M. W.

268.2775096

CAS

Similarity

N/A

ID: 118028

[1-(3-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C14H18N2O

Suppliers	Catalog Number
Life Chemicals	F2167-0123

Database	Data ID
PubChem	20983278

M. W.

230.30552

CAS

Similarity

N/A

ID: 118029

[1-(4-ethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C15H20N2O

Suppliers	Catalog Number
Life Chemicals	F2167-0124

Database	Data ID
PubChem	20983280

M. W.

244.3321

CAS

Similarity

N/A

ID: 118030

{2,5-dimethyl-1-[4-(trifluoromethoxy)phenyl]-1H-pyrrol-3-yl}methanamine

$$$$ Data

M. F.

C14H15F3N2O

Suppliers	Catalog Number
Life Chemicals	F2167-0125

Database	Data ID
PubChem	45496715

M. W.

284.2769096

CAS

Similarity

N/A

ID: 118031

4-[3-(aminomethyl)-2,5-dimethyl-1H-pyrrol-1-yl]-N,N-dimethylaniline

$$$$ Data

M. F.

C15H21N3

Suppliers	Catalog Number
Life Chemicals	F2167-0126

Database	Data ID
PubChem	45496716

M. W.

243.34734

CAS

Similarity

N/A

ID: 118032

[2,5-dimethyl-1-(4-phenoxyphenyl)-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C19H20N2O

Suppliers	Catalog Number
Life Chemicals	F2167-0127

Database	Data ID
PubChem	45496717

M. W.

292.3749

CAS

Similarity

N/A

ID: 118033

[2,5-dimethyl-1-(naphthalen-1-yl)-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C17H18N2

Suppliers	Catalog Number
Life Chemicals	F2167-0128

Database	Data ID
PubChem	45496718

M. W.

250.33822

CAS

Similarity

N/A

ID: 118034

[1-(3,4-difluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C13H14F2N2

Suppliers	Catalog Number
Life Chemicals	F2167-0129

Database	Data ID
PubChem	45496719

M. W.

236.2604664

CAS

Similarity

N/A

ID: 118035

[1-(3,4-dimethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C15H20N2O2

Suppliers	Catalog Number
Life Chemicals	F2167-0130

Database	Data ID
PubChem	45496720

M. W.

260.3315

CAS

Similarity

N/A

ID: 118036

[1-(2,4-dimethoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C15H20N2O2

Suppliers	Catalog Number
Life Chemicals	F2167-0131

Database	Data ID
PubChem	45496721

M. W.

260.3315

CAS

Similarity

N/A

ID: 118037

[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C15H18N2O2

Suppliers	Catalog Number
Life Chemicals	F2167-0132

Database	Data ID
PubChem	45496722

M. W.

258.31562

CAS

Similarity

N/A

ID: 118038

[1-(3-fluoro-4-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C14H17FN2

Suppliers	Catalog Number
Life Chemicals	F2167-0133

Database	Data ID
PubChem	45496723

M. W.

232.2965832

CAS

Similarity

N/A

ID: 118039

{1-[4-fluoro-3-(trifluoromethyl)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}methanamine

$$$$ Data

M. F.

C14H14F4N2

Suppliers	Catalog Number
Life Chemicals	F2167-0134

Database	Data ID
PubChem	45496724

M. W.

286.2679728

CAS

Similarity

N/A

ID: 118040

[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C12H15N3

Suppliers	Catalog Number
Life Chemicals	F2167-0135

Database	Data ID
PubChem	45496725

M. W.

201.2676

CAS

Similarity

N/A

ID: 118041

{1-[(3-methoxyphenyl)methyl]-2,5-dimethyl-1H-pyrrol-3-yl}methanamine

$$$$ Data

M. F.

C15H20N2O

Suppliers	Catalog Number
Life Chemicals	F2167-0137

Database	Data ID
PubChem	45496726

M. W.

244.3321

CAS

Similarity

N/A

ID: 118042

[2,5-dimethyl-1-(pyridin-4-ylmethyl)-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C13H17N3

Suppliers	Catalog Number
Life Chemicals	F2167-0138

Database	Data ID
PubChem	45496727

M. W.

215.29418

CAS

Similarity

N/A

ID: 118043

[2,5-dimethyl-1-(3,4,5-trimethoxyphenyl)-1H-pyrrol-3-yl]methanamine

$$$$ Data

M. F.

C16H22N2O3

Suppliers	Catalog Number
Life Chemicals	F2167-0139

Database	Data ID
PubChem	45496728

M. W.

290.35748

CAS

Similarity

N/A

ID: 118044

2-(4H-1,2,4-triazol-4-yl)acetic acid

$$$$ Data

M. F.

C4H5N3O2

Suppliers	Catalog Number
ChemBridge	4042349
Life Chemicals	F2167-0141
Enamine	EN300-66263

Database	Data ID
PubChem	12888432

M. W.

127.1014

CAS

110822-97-4

Similarity

N/A

ID: 118045

(2-methylindolizin-3-yl)methanamine

$$$$ Data

M. F.

C10H12N2

Suppliers	Catalog Number
Life Chemicals	F2167-0142

Database	Data ID
PubChem	45496729

M. W.

160.21568

CAS

Similarity

N/A

ID: 118046

(2-phenylindolizin-3-yl)methanamine

$$$$ Data

M. F.

C15H14N2

Suppliers	Catalog Number
Life Chemicals	F2167-0143

Database	Data ID
PubChem	45496730

M. W.

222.28506

CAS

Similarity

N/A

ID: 118047

[2-(4-methylphenyl)indolizin-3-yl]methanamine

$$$$ Data

M. F.

C16H16N2

Suppliers	Catalog Number
Life Chemicals	F2167-0144

Database	Data ID
PubChem	45496731

M. W.

236.31164

CAS

Similarity

N/A

ID: 118048

[2-(4-chlorophenyl)indolizin-3-yl]methanamine

$$$$ Data

M. F.

C15H13ClN2

Suppliers	Catalog Number
Life Chemicals	F2167-0145

Database	Data ID
PubChem	45496732

M. W.

256.73012

CAS

Similarity

N/A

ID: 118049

[2-(4-methoxyphenyl)indolizin-3-yl]methanamine

$$$$ Data

M. F.

C16H16N2O

Suppliers	Catalog Number
Life Chemicals	F2167-0146

Database	Data ID
PubChem	45496733

M. W.

252.31104

CAS

Similarity

N/A

ID: 118050

{6-methylimidazo[2,1-b][1,3]thiazol-5-yl}methanamine

$$$$ Data

M. F.

C7H9N3S

Suppliers	Catalog Number
Life Chemicals	F2167-0147

Database	Data ID
PubChem	43754770

M. W.

167.23146

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