Chembase list of 866358 unique molecular structures

2-[3-(pyrazin-2-yl)-1,2,4-oxadiazol-5-yl]acetohydrazide

$$$$ Data

M. F.

C8H8N6O2

Suppliers	Catalog Number
Apollo Scientific	OR25658

Database	Data ID
PubChem	2779273

M. W.

220.18812

CAS

175203-77-7

Similarity

N/A

ID: 82902

3-chloro-5-(4-{[(4-chlorophenyl)sulfanyl]methyl}phenyl)-1,2-thiazole-4-carbonitr...

$$$$ Data

M. F.

C17H10Cl2N2S2

Suppliers	Catalog Number
Apollo Scientific	OR25659

Database	Data ID
PubChem	616291

M. W.

377.3107

CAS

Similarity

N/A

ID: 82903

3-chloro-5-{4-[(pyridin-2-ylsulfanyl)methyl]phenyl}-1,2-thiazole-4-carbonitrile

$$$$ Data

M. F.

C16H10ClN3S2

Suppliers	Catalog Number
Apollo Scientific	OR25661

Database	Data ID
PubChem	2779277

M. W.

343.8537

CAS

Similarity

N/A

ID: 82904

(5-carboxypentyl)triphenylphosphanium bromide

$$$$ Data More

M. F.

C24H26BrO2P

Suppliers	Catalog Number
Sigma Aldrich	21935
Alfa Aesar	B20588
Maybridge	KM08684

Database	Data ID
PubChem	2779280

M. W.

457.339801

CAS

50889-29-7

Similarity

N/A

ID: 82905

methyl 2-({[4-(3-chloro-4-cyano-1,2-thiazol-5-yl)phenyl]methyl}sulfanyl)acetate

$$$$ Data

M. F.

C14H11ClN2O2S2

Suppliers	Catalog Number
Apollo Scientific	OR25663

Database	Data ID
PubChem	2779283

M. W.

338.83234

CAS

Similarity

N/A

ID: 82906

ethyl 2-(phenylsulfanyl)acetate

$$$$ Data

M. F.

C10H12O2S

Suppliers	Catalog Number
Alfa Aesar	A18664
Maybridge	KM08693
Apollo Scientific	OR25664

Database	Data ID
PubChem	97312

M. W.

196.26608

CAS

7605-25-6

Similarity

N/A

ID: 82907

(6E)-8-methylnon-6-enoic acid

$$$$ Data

M. F.

C10H18O2

Suppliers	Catalog Number
Apollo Scientific	OR25665
TRC	M325790

Database	Data ID
PubChem	5365959

M. W.

170.24872

CAS

21382-25-2

Similarity

N/A

ID: 82908

3-hydroxy-2-nitrophenyl acetate

$$$$ Data

M. F.

C8H7NO5

Suppliers	Catalog Number
Apollo Scientific	OR25666

Database	Data ID
PubChem	539881

M. W.

197.14488

CAS

Similarity

N/A

ID: 82909

2-bromo-1,1,1-triethoxypropane

$$$$ Data

M. F.

C9H19BrO3

Suppliers	Catalog Number
Apollo Scientific	OR25667

Database	Data ID
PubChem	2779285

M. W.

255.14936

CAS

42216-95-5

Similarity

N/A

ID: 82910

8-methylnonanoic acid

$$$$ Data

M. F.

C10H20O2

Suppliers	Catalog Number
Sigma Aldrich	M5153
Maybridge	KM08721
Apollo Scientific	OR25668

Database	Data ID
PubChem	111470

M. W.

172.2646

CAS

5963-14-4

Similarity

N/A

ID: 82911

ethyl 4,8-dichloro-2-(methylsulfanyl)quinoline-3-carboxylate

$$$$ Data

M. F.

C13H11Cl2NO2S

Suppliers	Catalog Number
Apollo Scientific	OR25669

Database	Data ID
PubChem	2779287

M. W.

316.20294

CAS

Similarity

N/A

ID: 82912

prop-2-yn-1-ylcyclohexane

$$$$ Data More

M. F.

C9H14

Suppliers	Catalog Number
Sigma Aldrich	632066
MP Biomedicals	05226045
Alfa Aesar	B20505

Database	Data ID
PubChem	87265

M. W.

122.20746

CAS

17715-00-3

Similarity

N/A

ID: 82913

ethyl 4,6-dichloro-2-methanesulfinylquinoline-3-carboxylate

$$$$ Data

M. F.

C13H11Cl2NO3S

Suppliers	Catalog Number
Apollo Scientific	OR25673

Database	Data ID
PubChem	2779292

M. W.

332.20234

CAS

Similarity

N/A

ID: 82914

ethyl 4,8-dichloro-2-methanesulfinylquinoline-3-carboxylate

$$$$ Data

M. F.

C13H11Cl2NO3S

Suppliers	Catalog Number
Apollo Scientific	OR25674

Database	Data ID
PubChem	2779293

M. W.

332.20234

CAS

Similarity

N/A

ID: 82915

1,4-dimethyl 2-[(propan-2-yl)amino]but-2-enedioate

$$$$ Data

M. F.

C9H15NO4

Suppliers	Catalog Number
Apollo Scientific	OR25676

Database	Data ID
PubChem	5709064

M. W.

201.2197

CAS

Similarity

N/A

ID: 82916

methyl 2-{[1-(diphenylmethyl)azetidin-3-yl]sulfanyl}acetate

$$$$ Data

M. F.

C19H21NO2S

Suppliers	Catalog Number
Apollo Scientific	OR25677

Database	Data ID
PubChem	2779298

M. W.

327.44054

CAS

Similarity

N/A

ID: 82917

3,10,12-trimethyl-3,4,8,10,11-pentaazatricyclo[7.3.0.0^{2,6}]dodeca-1,6,8,11-tet...

$$$$ Data

M. F.

C10H11N5O

Suppliers	Catalog Number
Apollo Scientific	OR25678

Database	Data ID
PubChem	2779300

M. W.

217.22724

CAS

81153-35-7

Similarity

N/A

ID: 82918

6-acetyl-1H,2H,3H-thieno[2,3-b][1,4]thiazin-2-one

$$$$ Data

M. F.

C8H7NO2S2

Suppliers	Catalog Number
Apollo Scientific	OR25679
Enamine	EN300-128211

Database	Data ID
PubChem	2779302

M. W.

213.27668

CAS

151095-12-4

Similarity

N/A

ID: 82919

N-[2,4-dichloro-5-(propan-2-yloxy)phenyl]acetamide

$$$$ Data

M. F.

C11H13Cl2NO2

Suppliers	Catalog Number
Apollo Scientific	OR2568

Database	Data ID
PubChem	2736079

M. W.

262.13242

CAS

Similarity

N/A

ID: 82920

1-[5-(3-cyclohexylprop-1-yn-1-yl)thiophen-2-yl]-3-(thiophen-2-yl)prop-2-en-1-one

$$$$ Data

M. F.

C20H20OS2

Suppliers	Catalog Number
Apollo Scientific	OR25680

Database	Data ID
PubChem	5709065

M. W.

340.5022

CAS

Similarity

N/A

ID: 82921

1-[5-(3-cyclohexylprop-1-yn-1-yl)thiophen-2-yl]-3-(4-methoxyphenyl)prop-2-en-1-o...

$$$$ Data

M. F.

C23H24O2S

Suppliers	Catalog Number
Apollo Scientific	OR25681

Database	Data ID
PubChem	5709066

M. W.

364.50046

CAS

Similarity

N/A

ID: 82922

3-(2-chlorophenyl)-1-[5-(3-cyclohexylprop-1-yn-1-yl)thiophen-2-yl]prop-2-en-1-on...

$$$$ Data

M. F.

C22H21ClOS

Suppliers	Catalog Number
Apollo Scientific	OR25682

Database	Data ID
PubChem	5709067

M. W.

368.91954

CAS

Similarity

N/A

ID: 82923

4,5-dichloro-1-[3-(4,5-dichloro-1H-imidazol-1-yl)propyl]-1H-imidazole

$$$$ Data

M. F.

C9H8Cl4N4

Suppliers	Catalog Number
Apollo Scientific	OR25683

Database	Data ID
PubChem	2779308

M. W.

313.99862

CAS

Similarity

N/A

ID: 82924

4,5-dichloro-1-[4-(4,5-dichloro-1H-imidazol-1-yl)butyl]-1H-imidazole

$$$$ Data

M. F.

C10H10Cl4N4

Suppliers	Catalog Number
Apollo Scientific	OR25684

Database	Data ID
PubChem	2779310

M. W.

328.0252

CAS

Similarity

N/A

ID: 82925

4,5-dichloro-1-[6-(4,5-dichloro-1H-imidazol-1-yl)hexyl]-1H-imidazole

$$$$ Data

M. F.

C12H14Cl4N4

Suppliers	Catalog Number
Apollo Scientific	OR25685

Database	Data ID
PubChem	2779311

M. W.

356.07836

CAS

Similarity

N/A

ID: 82926

1-[4-(2-phenylethynyl)phenyl]ethan-1-one

$$$$ Data

M. F.

C16H12O

Suppliers	Catalog Number
Alfa Aesar	A19370
Maybridge	KM08946
Apollo Scientific	OR25686

Database	Data ID
PubChem	2779313

M. W.

220.26588

CAS

1942-31-0

Similarity

N/A

ID: 82927

3-phenyl-1-[4-(2-phenylethynyl)phenyl]prop-2-en-1-one

$$$$ Data

M. F.

C23H16O

Suppliers	Catalog Number
Apollo Scientific	OR25688

Database	Data ID
PubChem	5709068

M. W.

308.37254

CAS

Similarity

N/A

ID: 82928

1-[4-(2-phenylethynyl)phenyl]-3-(thiophen-3-yl)prop-2-en-1-one

$$$$ Data

M. F.

C21H14OS

Suppliers	Catalog Number
Apollo Scientific	OR25689

Database	Data ID
PubChem	5709069

M. W.

314.40026

CAS

Similarity

N/A

ID: 82929

3-(4-methoxyphenyl)-1-[4-(2-phenylethynyl)phenyl]prop-2-en-1-one

$$$$ Data

M. F.

C24H18O2

Suppliers	Catalog Number
Apollo Scientific	OR25690

Database	Data ID
PubChem	5709070

M. W.

338.39852

CAS

Similarity

N/A

ID: 82930

3-(2-chlorophenyl)-1-[4-(2-phenylethynyl)phenyl]prop-2-en-1-one

$$$$ Data

M. F.

C23H15ClO

Suppliers	Catalog Number
Apollo Scientific	OR25691

Database	Data ID
PubChem	5709071

M. W.

342.8176

CAS

Similarity

N/A

ID: 82931

3-phenylcinnoline-4-carboxylic acid

$$$$ Data

M. F.

C15H10N2O2

Suppliers	Catalog Number
Maybridge	KM09072
Apollo Scientific	OR25692

Database	Data ID
PubChem	5709072

M. W.

250.2521

CAS

10604-21-4

Similarity

N/A

ID: 82932

3-(cyclopentyloxy)-4-methoxybenzoic acid

$$$$ Data

M. F.

C13H16O4

Suppliers	Catalog Number
Maybridge	KM09079
Apollo Scientific	OR25693

Database	Data ID
PubChem	2779323

M. W.

236.26374

CAS

144036-17-9

Similarity

N/A

ID: 82933

1-acetyl-1-benzyl-3-(2,6-dichloropyridin-4-yl)urea

$$$$ Data

M. F.

C15H13Cl2N3O2

Suppliers	Catalog Number
Apollo Scientific	OR25694

Database	Data ID
PubChem	2779325

M. W.

338.18862

CAS

Similarity

N/A

ID: 82934

N-(1,2,3,4-tetrahydronaphthalen-1-ylidene)hydroxylamine

$$$$ Data

M. F.

C10H11NO

Suppliers	Catalog Number
Apollo Scientific	OR25695
Bide Pharmatech	BD11920

Database	Data ID
PubChem	5483123

M. W.

161.20044

CAS

3349-64-2

Similarity

N/A

ID: 82935

3-(cyclopentyloxy)-4-methoxybenzamide

$$$$ Data

M. F.

C13H17NO3

Suppliers	Catalog Number
Apollo Scientific	OR25698

Database	Data ID
PubChem	2779330

M. W.

235.27898

CAS

158429-58-4

Similarity

N/A

ID: 82936

ethyl 3-[N-(furan-2-ylmethyl)3,4-dimethoxybenzenesulfonamido]propanoate

$$$$ Data

M. F.

C18H23NO7S

Suppliers	Catalog Number
Apollo Scientific	OR25699

Database	Data ID
PubChem	2779331

M. W.

397.44272

CAS

Similarity

N/A

ID: 82937

2-(4-chloro-1H-indol-3-yl)ethan-1-ol

$$$$ Data

M. F.

C10H10ClNO

Suppliers	Catalog Number
Apollo Scientific	OR2570

Database	Data ID
PubChem	12230411

M. W.

195.6455

CAS

41340-30-1

Similarity

N/A

ID: 82938

3-[(2-carbamoylethyl)sulfanyl]propanamide

$$$$ Data

M. F.

C6H12N2O2S

Suppliers	Catalog Number
Apollo Scientific	OR25700

Database	Data ID
PubChem	79567

M. W.

176.23668

CAS

5459-10-9

Similarity

N/A

ID: 82939

3-(cyclopentyloxy)-4-methoxyaniline

$$$$ Data

M. F.

C12H17NO2

Suppliers	Catalog Number
Apollo Scientific	OR25701

Database	Data ID
PubChem	2779334

M. W.

207.26888

CAS

154464-26-3

Similarity

N/A

ID: 82940

3-(cyclopentyloxy)-4-methoxybenzonitrile

$$$$ Data

M. F.

C13H15NO2

Suppliers	Catalog Number
Maybridge	KM09290
Apollo Scientific	OR25702

Database	Data ID
PubChem	2779335

M. W.

217.2637

CAS

159783-16-1

Similarity

N/A

ID: 82941

N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-3,4-dimethoxybenzamide

$$$$ Data

M. F.

C17H18N2O4

Suppliers	Catalog Number
Apollo Scientific	OR25703

Database	Data ID
PubChem	2779337

M. W.

314.33582

CAS

Similarity

N/A

ID: 82942

methyl 3,4-dimethylbenzoate

$$$$ Data

M. F.

C10H12O2

Suppliers	Catalog Number
Alfa Aesar	B20024
Apollo Scientific	OR25704
Bide Pharmatech	BD12034

Database	Data ID
PubChem	520902

M. W.

164.20108

CAS

38404-42-1

Similarity

N/A

ID: 82943

3-[(thiophen-2-ylmethyl)amino]propanenitrile

$$$$ Data

M. F.

C8H10N2S

Suppliers	Catalog Number
Apollo Scientific	OR25706

Database	Data ID
PubChem	2779341

M. W.

166.2434

CAS

Similarity

N/A

ID: 82944

5-cyclopropyl-1H-pyrazole-4-carbonitrile

$$$$ Data

M. F.

C7H7N3

Suppliers	Catalog Number
Apollo Scientific	OR25707

Database	Data ID
PubChem	2779342

M. W.

133.15058

CAS

Similarity

N/A

ID: 82945

methyl 3-[N-(furan-2-ylmethyl)2,1,3-benzothiadiazole-4-sulfonamido]propanoate

$$$$ Data

M. F.

C15H15N3O5S2

Suppliers	Catalog Number
Apollo Scientific	OR25708

Database	Data ID
PubChem	2779344

M. W.

381.4267

CAS

Similarity

N/A

ID: 82946

tert-butyl 4-chloro-3-(2-hydroxyethyl)-1H-indole-1-carboxylate

$$$$ Data

M. F.

C15H18ClNO3

Suppliers	Catalog Number
Apollo Scientific	OR2571

Database	Data ID
PubChem	24728898

M. W.

295.76132

CAS

Similarity

N/A

ID: 82947

(propan-2-yloxy)benzene

$$$$ Data

M. F.

C9H12O

Suppliers	Catalog Number
Apollo Scientific	OR25710
Enamine	EN300-35881
Bide Pharmatech	BD59159

Database	Data ID
PubChem	75966

M. W.

136.19098

CAS

2741-16-4

Similarity

N/A

ID: 82948

2,5-diethyl 1-benzylpyrrolidine-2,5-dicarboxylate

$$$$ Data

M. F.

C17H23NO4

Suppliers	Catalog Number
Apollo Scientific	OR25711
Bide Pharmatech	BD124537
A&J Pharmtech	AJA-O13859 AJA-O40174

Database	Data ID
PubChem	286120

M. W.

305.36882

CAS

17740-40-8

Similarity

N/A

ID: 82949

ethyl 5-(hex-1-yn-1-yl)pyridine-3-carboxylate

$$$$ Data

M. F.

C14H17NO2

Suppliers	Catalog Number
Apollo Scientific	OR25712

Database	Data ID
PubChem	2779347

M. W.

231.29028

CAS

Similarity

N/A

ID: 82950

ethyl 5-(oct-1-yn-1-yl)pyridine-3-carboxylate

$$$$ Data

M. F.

C16H21NO2

Suppliers	Catalog Number
Apollo Scientific	OR25713

Database	Data ID
PubChem	2779348

M. W.

259.34344

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