Chembase list of 866358 unique molecular structures

3-(2-amino-1,3-thiazol-4-yl)propanoic acid hydrochloride

$$$$ Data

M. F.

C6H9ClN2O2S

Suppliers	Catalog Number
Sigma Aldrich	CBR00812

Database	Data ID
PubChem	47000707

M. W.

208.66586

CAS

Similarity

N/A

ID: 143952

3-(2-aminoethyl)-1,3-oxazinan-2-one hydrochloride

$$$$ Data

M. F.

C6H13ClN2O2

Suppliers	Catalog Number
Sigma Aldrich	CBR00826

Database	Data ID
PubChem	53398872

M. W.

180.63262

CAS

Similarity

N/A

ID: 143953

3-{2-azabicyclo[2.2.1]heptan-2-yl}propanoic acid hydrochloride

$$$$ Data

M. F.

C9H16ClNO2

Suppliers	Catalog Number
Sigma Aldrich	CBR00949

Database	Data ID
PubChem	50944375

M. W.

205.68184

CAS

Similarity

N/A

ID: 143954

4-(2-methoxyphenyl)-3-methyl-1H-pyrazol-5-amine

$$$$ Data

M. F.

C11H13N3O

Suppliers	Catalog Number
Sigma Aldrich	CBR00533
ChemBridge	4006080

Database	Data ID
PubChem	16653075

M. W.

203.24042

CAS

895010-58-9

Similarity

N/A

ID: 143955

4-(2-oxopiperidin-1-yl)butanoic acid

$$$$ Data

M. F.

C9H15NO3

Suppliers	Catalog Number
Sigma Aldrich	CBR00581
ChemBridge	4014032

Database	Data ID
PubChem	12842029

M. W.

185.2203

CAS

82360-26-7

Similarity

N/A

ID: 143956

4-(3-aminopropyl)-1,3-thiazol-2-amine dihydrochloride

$$$$ Data

M. F.

C6H13Cl2N3S

Suppliers	Catalog Number
Sigma Aldrich	CBR00631

Database	Data ID
PubChem	47000672

M. W.

230.15852

CAS

Similarity

N/A

ID: 143957

4-(4-chloro-6-ethylpyrimidin-2-yl)morpholine

$$$$ Data

M. F.

C10H14ClN3O

Suppliers	Catalog Number
Sigma Aldrich	CBR00388
ChemBridge	4016008

Database	Data ID
PubChem	17750885

M. W.

227.69066

CAS

901586-60-5

Similarity

N/A

ID: 143958

4-(4-hydroxybut-1-yn-1-yl)benzaldehyde

$$$$ Data

M. F.

C11H10O2

Suppliers	Catalog Number
Sigma Aldrich	CBR00215
ChemBridge	4003414

Database	Data ID
PubChem	28063275

M. W.

174.1959

CAS

544707-13-3

Similarity

N/A

ID: 143959

4-(morpholine-4-carbonyl)benzoic acid

$$$$ Data

M. F.

C12H13NO4

Suppliers	Catalog Number
Sigma Aldrich	CBR00086
ChemBridge	6555065

Database	Data ID
PubChem	4714236

M. W.

235.23592

CAS

160816-43-3

Similarity

N/A

ID: 143960

4-(aminomethyl)-1-methylpiperidin-4-ol dihydrochloride

$$$$ Data

M. F.

C7H18Cl2N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00701

Database	Data ID
PubChem	53398825

M. W.

217.13662

CAS

Similarity

N/A

ID: 143961

4-(aminomethyl)-N,N-diethylaniline

$$$$ Data

M. F.

C11H18N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00216
ChemBridge	4027199
Enamine	EN300-43515

Database	Data ID
PubChem	13710454

M. W.

178.27402

CAS

40336-81-0

Similarity

N/A

ID: 143962

4-(chloromethyl)-5-methyl-2-(4-methylphenyl)-1,3-oxazole

$$$$ Data

M. F.

C12H12ClNO

Suppliers	Catalog Number
Sigma Aldrich	CBR00539
ChemBridge	4013762

Database	Data ID
PubChem	5076485

M. W.

221.68278

CAS

137090-44-9

Similarity

N/A

ID: 143963

4-(ethylsulfanyl)aniline hydrochloride

$$$$ Data

M. F.

C8H12ClNS

Suppliers	Catalog Number
Sigma Aldrich	CBR00879

Database	Data ID
PubChem	18950019

M. W.

189.70558

CAS

Similarity

N/A

ID: 143964

4-(hydroxymethyl)-1-(2-methoxyethyl)pyrrolidin-2-one

$$$$ Data

M. F.

C8H15NO3

Suppliers	Catalog Number
Sigma Aldrich	CBR00259
ChemBridge	4015572

Database	Data ID
PubChem	24275517

M. W.

173.2096

CAS

915922-31-5

Similarity

N/A

ID: 143965

1-(6-chloro-9-methyl-9H-carbazol-3-yl)ethan-1-one

$$$$ Data

M. F.

C15H12ClNO

Suppliers	Catalog Number
Sigma Aldrich	CBR00510
ChemBridge	4300409

Database	Data ID
PubChem	2842796

M. W.

257.71488

CAS

33107-73-2

Similarity

N/A

ID: 143966

1-(6-methoxynaphthalen-2-yl)ethan-1-amine hydrochloride

$$$$ Data

M. F.

C13H16ClNO

Suppliers	Catalog Number
Sigma Aldrich	CBR00766

Database	Data ID
PubChem	45595268

M. W.

237.72524

CAS

Similarity

N/A

ID: 143967

1-(6-methylpyridin-2-yl)propan-2-one

$$$$ Data

M. F.

C9H11NO

Suppliers	Catalog Number
Sigma Aldrich	CBR00392
ChemBridge	4000002

Database	Data ID
PubChem	571953

M. W.

149.18974

CAS

65702-08-1

Similarity

N/A

ID: 143968

1-(aminomethyl)-N,N-dimethylcyclohexan-1-amine dihydrochloride

$$$$ Data

M. F.

C9H22Cl2N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00640

Database	Data ID
PubChem	21409922

M. W.

229.19038

CAS

Similarity

N/A

ID: 143969

3-(2-hydroxyethyl)piperazin-2-one

$$$$ Data

M. F.

C6H12N2O2

Suppliers	Catalog Number
Sigma Aldrich	CBR00279
ChemBridge	4016235

Database	Data ID
PubChem	23008991

M. W.

144.17168

CAS

936940-62-4

Similarity

N/A

ID: 143970

3-(2-methylphenyl)pyrrolidin-3-ol hydrochloride

$$$$ Data

M. F.

C11H16ClNO

Suppliers	Catalog Number
Sigma Aldrich	CBR00824

Database	Data ID
PubChem	47000719

M. W.

213.70384

CAS

Similarity

N/A

ID: 143971

3-(naphthalen-2-yl)prop-2-ynoic acid

$$$$ Data

M. F.

C13H8O2

Suppliers	Catalog Number
Sigma Aldrich	CBR00186
ChemBridge	5217434

Database	Data ID
PubChem	2834388

M. W.

196.20142

CAS

4843-43-0

Similarity

N/A

ID: 143972

3-[2-(piperidin-2-yl)ethyl]phenol

$$$$ Data

M. F.

C13H19NO

Suppliers	Catalog Number
Sigma Aldrich	CBR00578
ChemBridge	4011370

Database	Data ID
PubChem	43146757

M. W.

205.29606

CAS

915921-63-0

Similarity

N/A

ID: 143973

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

$$$$ Data

M. F.

C9H17N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00245
ChemBridge	4003750

Database	Data ID
PubChem	28063294

M. W.

167.25138

CAS

936939-86-5

Similarity

N/A

ID: 143974

3-(3,5-dimethylphenyl)propanoic acid

$$$$ Data

M. F.

C11H14O2

Suppliers	Catalog Number
Sigma Aldrich	CBR00487
ChemBridge	4003119
Enamine	EN300-108381

Database	Data ID
PubChem	17908628

M. W.

178.22766

CAS

42287-87-6

Similarity

N/A

ID: 143975

4-(piperidin-3-ylmethyl)morpholine hydrate dihydrochloride

$$$$ Data

M. F.

C10H24Cl2N2O2

Suppliers	Catalog Number
Sigma Aldrich	CBR00614

Database	Data ID
PubChem	45595287

M. W.

275.21576

CAS

Similarity

N/A

ID: 143976

4-(pyrrolidine-1-carbonyl)piperidine; nitric acid

$$$$ Data

M. F.

C10H19N3O4

Suppliers	Catalog Number
Sigma Aldrich	CBR00708

Database	Data ID
PubChem	45595792

M. W.

245.27556

CAS

Similarity

N/A

ID: 143977

4-(oxan-2-ylmethoxy)aniline hydrochloride

$$$$ Data

M. F.

C12H18ClNO2

Suppliers	Catalog Number
Sigma Aldrich	CBR00762

Database	Data ID
PubChem	45926160

M. W.

243.72982

CAS

Similarity

N/A

ID: 143978

4,6-dimethylfuro[2,3-d]pyrimidin-2-amine

$$$$ Data

M. F.

C8H9N3O

Suppliers	Catalog Number
Sigma Aldrich	CBR00422
ChemBridge	4001931
InterBioScreen	STOCK1N-28318

Database	Data ID
PubChem	595850

M. W.

163.17656

CAS

22727-43-1

Similarity

N/A

ID: 143979

4-[(1-methylpiperidin-4-yl)oxy]aniline

$$$$ Data

M. F.

C12H18N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00034
ChemBridge	4010410

Database	Data ID
PubChem	16765164

M. W.

206.28412

CAS

358789-72-7

Similarity

N/A

ID: 143980

4-[(2-methylphenyl)sulfanyl]piperidine hydrochloride

$$$$ Data

M. F.

C12H18ClNS

Suppliers	Catalog Number
Sigma Aldrich	CBR00773

Database	Data ID
PubChem	47000645

M. W.

243.79602

CAS

Similarity

N/A

ID: 143981

4-[(5-methyl-4H-1,2,4-triazol-3-yl)methyl]aniline dihydrochloride

$$$$ Data

M. F.

C10H14Cl2N4

Suppliers	Catalog Number
Sigma Aldrich	CBR00697

Database	Data ID
PubChem	44827715

M. W.

261.15096

CAS

Similarity

N/A

ID: 143982

4-[5-(chloromethyl)-1,2-oxazol-3-yl]pyridine hydrochloride

$$$$ Data

M. F.

C9H8Cl2N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00845

Database	Data ID
PubChem	53398876

M. W.

231.07862

CAS

Similarity

N/A

ID: 143983

4-amino-1-ethylpyrrolidin-2-one hydrochloride

$$$$ Data

M. F.

C6H13ClN2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00819

Database	Data ID
PubChem	53398869

M. W.

164.63322

CAS

Similarity

N/A

ID: 143984

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

$$$$ Data

M. F.

C4H7ClN4O

Suppliers	Catalog Number
Sigma Aldrich	CBR00702

Database	Data ID
PubChem	53398826

M. W.

162.57758

CAS

Similarity

N/A

ID: 143985

4-amino-1-propylpyrrolidin-2-one hydrochloride

$$$$ Data

M. F.

C7H15ClN2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00820

Database	Data ID
PubChem	53398870

M. W.

178.6598

CAS

Similarity

N/A

ID: 143986

{1-[(2-methyl-1H-imidazol-1-yl)methyl]cyclopropyl}methanamine

$$$$ Data

M. F.

C9H15N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00299
ChemBridge	4026737

Database	Data ID
PubChem	28064579

M. W.

165.2355

CAS

959239-97-5

Similarity

N/A

ID: 143987

{1-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]cyclopropyl}methanamine

$$$$ Data

M. F.

C10H17N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00503
ChemBridge	4026735

Database	Data ID
PubChem	28064576

M. W.

179.26208

CAS

Similarity

N/A

ID: 143988

{1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl}methanamine

$$$$ Data

M. F.

C10H21N3

Suppliers	Catalog Number
Sigma Aldrich	CBR00307
ChemBridge	4027509

Database	Data ID
PubChem	45791164

M. W.

183.29384

CAS

1015846-52-2

Similarity

N/A

ID: 143989

1-(hydroxymethyl)cyclopropane-1-carboxamide

$$$$ Data

M. F.

C5H9NO2

Suppliers	Catalog Number
Sigma Aldrich	CBR00174
ChemBridge	4029970

Database	Data ID
PubChem	37134563

M. W.

115.13046

CAS

1123169-27-6

Similarity

N/A

ID: 143990

1-(methoxymethyl)-1H-1,2,4-triazol-3-amine

$$$$ Data

M. F.

C4H8N4O

Suppliers	Catalog Number
Sigma Aldrich	CBR00253
ChemBridge	4006205

Database	Data ID
PubChem	26722484

M. W.

128.13252

CAS

915923-88-5

Similarity

N/A

ID: 143991

1-(methoxymethyl)cyclobutane-1-carboxylic acid

$$$$ Data

M. F.

C7H12O3

Suppliers	Catalog Number
Sigma Aldrich	CBR00313
ChemBridge	4031217

Database	Data ID
PubChem	29893137

M. W.

144.16838

CAS

1082766-22-0

Similarity

N/A

ID: 143992

1-(methoxymethyl)-N-methylcyclopropan-1-amine hydrochloride

$$$$ Data

M. F.

C6H14ClNO

Suppliers	Catalog Number
Sigma Aldrich	CBR00893
Enamine	EN300-110449

Database	Data ID
PubChem	53398897

M. W.

151.63446

CAS

Similarity

N/A

ID: 143993

1-(piperidin-4-ylmethyl)piperidine hydrate dihydrochloride

$$$$ Data

M. F.

C11H26Cl2N2O

Suppliers	Catalog Number
Sigma Aldrich	CBR00613

Database	Data ID
PubChem	47000678

M. W.

273.24294

CAS

Similarity

N/A

ID: 143994

1-(pyridin-2-ylmethyl)-1,4-diazepane; tris(4-methylbenzene-1-sulfonic acid)

$$$$ Data

M. F.

C32H41N3O9S3

Suppliers	Catalog Number
Sigma Aldrich	CBR00736

Database	Data ID
PubChem	45595274

M. W.

707.87764

CAS

Similarity

N/A

ID: 143995

1-(pyridin-3-ylmethyl)-1,4-diazepane; tris(4-methylbenzene-1-sulfonic acid)

$$$$ Data

M. F.

C32H41N3O9S3

Suppliers	Catalog Number
Sigma Aldrich	CBR00738

Database	Data ID
PubChem	45595276

M. W.

707.87764

CAS

Similarity

N/A

ID: 143996

1-(pyridin-4-ylmethyl)-1,4-diazepane; tris(4-methylbenzene-1-sulfonic acid)

$$$$ Data

M. F.

C32H41N3O9S3

Suppliers	Catalog Number
Sigma Aldrich	CBR00737

Database	Data ID
PubChem	45595275

M. W.

707.87764

CAS

Similarity

N/A

ID: 143997

1-(tert-butyldimethylsilyl)-7-methyl-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-...

$$$$ Data

M. F.

C21H34BNO2Si

Suppliers	Catalog Number
Sigma Aldrich	CBR00384
ChemBridge	4014478

Database	Data ID
PubChem	45791093

M. W.

371.39666

CAS

1263986-66-8

Similarity

N/A

ID: 143998

1-(tert-butyldimethylsilyl)-5-methyl-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-...

$$$$ Data

M. F.

C21H34BNO2Si

Suppliers	Catalog Number
Sigma Aldrich	CBR00477
ChemBridge	4014477

Database	Data ID
PubChem	45791092

M. W.

371.39666

CAS

1263987-17-2

Similarity

N/A

ID: 143999

1,2,4-oxadiazole-3-carbothioamide

$$$$ Data

M. F.

C3H3N3OS

Suppliers	Catalog Number
Sigma Aldrich	CBR00421
ChemBridge	4016419

Database	Data ID
PubChem	3099489

M. W.

129.14042

CAS

39512-80-6

Similarity

N/A

ID: 144000

1,3,3-trimethylpiperazine dihydrochloride

$$$$ Data

M. F.

C7H18Cl2N2

Suppliers	Catalog Number
Sigma Aldrich	CBR00658

Database	Data ID
PubChem	53398806

M. W.

201.13722

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