Chembase list of 866358 unique molecular structures

methyl 3-[4-methyl-2-(pyrrolidin-1-yl)pyrimidin-5-yl]-3-oxopropanoate

$$$$ Data

M. F.

C13H17N3O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8587

Database	Data ID
PubChem	49651992

M. W.

263.29238

CAS

Similarity

N/A

ID: 124202

11-hydroxy-4-(methoxymethyl)-2,3,5,7,11-pentaazatricyclo[7.4.0.0²,

$$$$ Data

M. F.

C10H9N5O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8590

Database	Data ID
PubChem	49651993

M. W.

247.21016

CAS

Similarity

N/A

ID: 124203

4-[benzyl(methyl)amino]butanoic acid hydrochloride

$$$$ Data

M. F.

C12H18ClNO2

Suppliers	Catalog Number
InterBioScreen	BB_SC-8591

Database	Data ID
PubChem	51051957

M. W.

243.72982

CAS

Similarity

N/A

ID: 124204

2-(4-methylpiperidin-1-yl)acetic acid hydrochloride

$$$$ Data

M. F.

C8H16ClNO2

Suppliers	Catalog Number
InterBioScreen	BB_SC-8592

Database	Data ID
PubChem	17389852

M. W.

193.67114

CAS

Similarity

N/A

ID: 124205

2-(4-methylpiperazin-1-yl)acetonitrile

$$$$ Data

M. F.

C7H13N3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8593
Enamine	EN300-31914

Database	Data ID
PubChem	10582860

M. W.

139.19822

CAS

874-77-1

Similarity

N/A

ID: 124206

2-(chloromethyl)-9-hydroxy-4H-pyrido[1,2-a]pyrimidin-4-one

$$$$ Data

M. F.

C9H7ClN2O2

Suppliers	Catalog Number
ChemBridge	4040579
InterBioScreen	BB_SC-8594

Database	Data ID
PubChem	49651994

M. W.

210.61708

CAS

162469-86-5

Similarity

N/A

ID: 124207

5-methyl-7-oxo-4H,7H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

$$$$ Data

M. F.

C8H6N4O

Suppliers	Catalog Number
InterBioScreen	BB_SC-8595

Database	Data ID
PubChem	2819027

M. W.

174.15944

CAS

Similarity

N/A

ID: 124208

5-(chloromethyl)-7-oxo-4H,7H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

$$$$ Data

M. F.

C8H5ClN4O

Suppliers	Catalog Number
InterBioScreen	BB_SC-8596

Database	Data ID
PubChem	687424

M. W.

208.6045

CAS

Similarity

N/A

ID: 124209

7-amino-6-phenylpyrazolo[1,5-a]pyrimidine-3-carbonitrile

$$$$ Data

M. F.

C13H9N5

Suppliers	Catalog Number
InterBioScreen	BB_SC-8597

Database	Data ID
PubChem	1079885

M. W.

235.24406

CAS

Similarity

N/A

ID: 124210

1-[3-(benzylamino)propyl]pyrrolidin-2-one hydrochloride

$$$$ Data

M. F.

C14H21ClN2O

Suppliers	Catalog Number
InterBioScreen	BB_SC-8598

Database	Data ID
PubChem	17211877

M. W.

268.78234

CAS

Similarity

N/A

ID: 124211

2-{[(4-phenylphenyl)methyl]amino}acetic acid hydrochloride

$$$$ Data

M. F.

C15H16ClNO2

Suppliers	Catalog Number
InterBioScreen	BB_SC-8599

Database	Data ID
PubChem	51051958

M. W.

277.74604

CAS

Similarity

N/A

ID: 124212

3-(3-chloro-1H-1,2,4-triazol-5-yl)pyridine

$$$$ Data

M. F.

C7H5ClN4

Suppliers	Catalog Number
ChemBridge	4041115
InterBioScreen	BB_SC-8600

Database	Data ID
PubChem	49651995

M. W.

180.5944

CAS

1215295-94-5

Similarity

N/A

ID: 124213

3-amino-N-methyl-N-phenylpropanamide

$$$$ Data

M. F.

C10H14N2O

Suppliers	Catalog Number
InterBioScreen	BB_SC-8601

Database	Data ID
PubChem	16789981

M. W.

178.23096

CAS

Similarity

N/A

ID: 124214

3-amino-N-(4-bromophenyl)propanamide hydrochloride

$$$$ Data

M. F.

C9H12BrClN2O

Suppliers	Catalog Number
InterBioScreen	BB_SC-8603
Enamine	EN300-51099

Database	Data ID
PubChem	45791833

M. W.

279.56138

CAS

Similarity

N/A

ID: 124215

3-amino-N-(pyridin-3-yl)propanamide dihydrochloride

$$$$ Data

M. F.

C8H13Cl2N3O

Suppliers	Catalog Number
InterBioScreen	BB_SC-8606
Enamine	EN300-62273

Database	Data ID
PubChem	47002948

M. W.

238.11432

CAS

Similarity

N/A

ID: 124216

3-amino-N-(pyridin-4-yl)propanamide dihydrochloride

$$$$ Data

M. F.

C8H13Cl2N3O

Suppliers	Catalog Number
InterBioScreen	BB_SC-8607
Enamine	EN300-61974

Database	Data ID
PubChem	47002894

M. W.

238.11432

CAS

Similarity

N/A

ID: 124217

4-oxo-4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)butanoic acid

$$$$ Data

M. F.

C12H11NO5

Suppliers	Catalog Number
InterBioScreen	BB_SC-8609

Database	Data ID
PubChem	4308454

M. W.

249.21944

CAS

Similarity

N/A

ID: 124218

2-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)acetic acid

$$$$ Data

M. F.

C11H12N2O2

Suppliers	Catalog Number
Alfa Aesar	H50893
InterBioScreen	BB_SC-8610

Database	Data ID
PubChem	424323

M. W.

204.22518

CAS

500872-62-8

Similarity

N/A

ID: 124219

2-sulfanylidene-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylic acid

$$$$ Data

M. F.

C8H6N2O2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-8611
Enamine	EN300-43832

Database	Data ID
PubChem	703333

M. W.

194.21044

CAS

58089-25-1

Similarity

N/A

ID: 124220

2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylic acid

$$$$ Data More

M. F.

C8H6N2O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8612
Enamine	EN300-35411
Bide Pharmatech	BD77925

Database	Data ID
PubChem	780757

M. W.

178.14484

CAS

23814-14-4

Similarity

N/A

ID: 124221

5-chloro-2-(1H-1,2,4-triazol-1-yl)aniline

$$$$ Data More

M. F.

C8H7ClN4

Suppliers	Catalog Number
Sigma Aldrich	CBR00446
ChemBridge	4012428
InterBioScreen	BB_SC-8613

Database	Data ID
PubChem	5019940

M. W.

194.62098

CAS

450399-92-5

Similarity

N/A

ID: 124222

1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperazine hydrochloride

$$$$ Data

M. F.

C9H17ClN4O2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-8615

Database	Data ID
PubChem	24281259

M. W.

280.77488

CAS

Similarity

N/A

ID: 124223

3-(3-oxo-4-phenyl-3,4-dihydroquinoxalin-2-yl)propanoic acid

$$$$ Data

M. F.

C17H14N2O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8617

Database	Data ID
PubChem	19623156

M. W.

294.30466

CAS

Similarity

N/A

ID: 124224

1-(1,3-benzothiazol-2-yl)-5-(propan-2-yl)-1H-pyrazole-3-carboxylic acid

$$$$ Data

M. F.

C14H13N3O2S

Suppliers	Catalog Number
InterBioScreen	BB_SC-8618

Database	Data ID
PubChem	24271298

M. W.

287.33692

CAS

Similarity

N/A

ID: 124225

3-(3-chloro-6-oxo-1,6-dihydropyridazin-1-yl)-1λ⁶-thiolane-1,1-dione

$$$$ Data

M. F.

C8H9ClN2O3S

Suppliers	Catalog Number
InterBioScreen	BB_SC-8619

Database	Data ID
PubChem	49651996

M. W.

248.68666

CAS

Similarity

N/A

ID: 124226

5-bromo-7-chloro-2,3-dihydro-1H-indole-2,3-dione

$$$$ Data

M. F.

C8H3BrClNO2

Suppliers	Catalog Number
ChemBridge	4030704
InterBioScreen	BB_SC-8623
Enamine	EN300-80727

Database	Data ID
PubChem	4659218

M. W.

260.47192

CAS

613656-97-6

Similarity

N/A

ID: 124227

8-amino-1H,2H,3H-pyrazolo[4,3-c]quinolin-3-one

$$$$ Data

M. F.

C10H8N4O

Suppliers	Catalog Number
InterBioScreen	BB_SC-8624

Database	Data ID
PubChem	39734350

M. W.

200.19672

CAS

Similarity

N/A

ID: 124228

methyl 2-(6-fluoro-2-methyl-4-oxo-1,4-dihydroquinolin-1-yl)acetate

$$$$ Data

M. F.

C13H12FNO3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8625

Database	Data ID
PubChem	39890562

M. W.

249.2376832

CAS

Similarity

N/A

ID: 124229

methyl 5-[(phenylamino)methyl]furan-2-carboxylate

$$$$ Data

M. F.

C13H13NO3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8626

Database	Data ID
PubChem	751547

M. W.

231.24722

CAS

Similarity

N/A

ID: 124230

ethyl 5,7-difluoro-4-hydroxyquinoline-3-carboxylate

$$$$ Data

M. F.

C12H9F2NO3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8627

Database	Data ID
PubChem	3724405

M. W.

253.2015664

CAS

Similarity

N/A

ID: 124231

6,8-difluoro-4-hydroxyquinoline-3-carboxylic acid

$$$$ Data

M. F.

C10H5F2NO3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8629

Database	Data ID
PubChem	5107860

M. W.

225.1484064

CAS

Similarity

N/A

ID: 124232

ethyl 4-amino-6,8-difluoroquinoline-3-carboxylate

$$$$ Data

M. F.

C12H10F2N2O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-8630

Database	Data ID
PubChem	45588950

M. W.

252.2168064

CAS

Similarity

N/A

ID: 124233

6,8-difluoro-1-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

$$$$ Data

M. F.

C11H7F2NO3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8631

Database	Data ID
PubChem	46397793

M. W.

239.1749864

CAS

Similarity

N/A

ID: 124234

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

$$$$ Data

M. F.

C13H11N5

Suppliers	Catalog Number
InterBioScreen	BB_SC-8633

Database	Data ID
PubChem	21823623

M. W.

237.25994

CAS

Similarity

N/A

ID: 124235

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

$$$$ Data

M. F.

C14H11FN4

Suppliers	Catalog Number
InterBioScreen	BB_SC-8634

Database	Data ID
PubChem	14031868

M. W.

254.2623432

CAS

Similarity

N/A

ID: 124236

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

$$$$ Data

M. F.

C14H11FN4

Suppliers	Catalog Number
InterBioScreen	BB_SC-8635

Database	Data ID
PubChem	46398036

M. W.

254.2623432

CAS

Similarity

N/A

ID: 124237

methyl 2-[(3-methoxyphenyl)amino]acetate

$$$$ Data

M. F.

C10H13NO3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8636

Database	Data ID
PubChem	22669248

M. W.

195.21512

CAS

Similarity

N/A

ID: 124238

5-[(phenylamino)methyl]furan-2-carboxylic acid

$$$$ Data

M. F.

C12H11NO3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8637

Database	Data ID
PubChem	17605205

M. W.

217.22064

CAS

Similarity

N/A

ID: 124239

4-amino-7-(trifluoromethyl)quinoline-3-carboxylic acid

$$$$ Data

M. F.

C11H7F3N2O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-8638

Database	Data ID
PubChem	45588807

M. W.

256.1806896

CAS

Similarity

N/A

ID: 124240

4-chloro-8-fluoro-2-methylquinoline

$$$$ Data More

M. F.

C10H7ClFN

Suppliers	Catalog Number
Alfa Aesar	H50556
InterBioScreen	BB_SC-8641
Enamine	EN300-110479

Database	Data ID
PubChem	12322579

M. W.

195.6206832

CAS

18615-59-3

Similarity

N/A

ID: 124241

methyl 2-[(4-fluorophenyl)amino]acetate

$$$$ Data

M. F.

C9H10FNO2

Suppliers	Catalog Number
InterBioScreen	BB_SC-8642

Database	Data ID
PubChem	18792818

M. W.

183.1796032

CAS

Similarity

N/A

ID: 124242

methyl 2-[(4-methoxyphenyl)amino]acetate

$$$$ Data

M. F.

C10H13NO3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8643

Database	Data ID
PubChem	22669309

M. W.

195.21512

CAS

Similarity

N/A

ID: 124243

methyl 3-hydroxythieno[3,2-c]quinoline-2-carboxylate

$$$$ Data

M. F.

C13H9NO3S

Suppliers	Catalog Number
InterBioScreen	BB_SC-8644

Database	Data ID
PubChem	54732802

M. W.

259.28046

CAS

Similarity

N/A

ID: 124244

2-(1H-1,3-benzodiazol-2-ylmethoxy)acetic acid hydrochloride

$$$$ Data

M. F.

C10H11ClN2O3

Suppliers	Catalog Number
InterBioScreen	BB_SC-8647

Database	Data ID
PubChem	51051960

M. W.

242.65894

CAS

Similarity

N/A

ID: 124245

3-(methylamino)-N-phenylpropanamide hydrochloride

$$$$ Data

M. F.

C10H15ClN2O

Suppliers	Catalog Number
InterBioScreen	BB_SC-8649

Database	Data ID
PubChem	51051961

M. W.

214.6919

CAS

Similarity

N/A

ID: 124246

4-[(4-methylpiperazin-1-yl)sulfonyl]benzoic acid hydrochloride

$$$$ Data

M. F.

C12H17ClN2O4S

Suppliers	Catalog Number
InterBioScreen	BB_SC-8650

Database	Data ID
PubChem	51051962

M. W.

320.79238

CAS

Similarity

N/A

ID: 124247

2-(methylamino)-N-(2-phenylethyl)acetamide hydrochloride

$$$$ Data

M. F.

C11H17ClN2O

Suppliers	Catalog Number
InterBioScreen	BB_SC-8655

Database	Data ID
PubChem	51051963

M. W.

228.71848

CAS

Similarity

N/A

ID: 124248

2-amino-N-(2-chlorophenyl)acetamide hydrochloride

$$$$ Data

M. F.

C8H10Cl2N2O

Suppliers	Catalog Number
InterBioScreen	BB_SC-8656

Database	Data ID
PubChem	51051964

M. W.

221.0838

CAS

Similarity

N/A

ID: 124249

2-amino-N-(naphthalen-1-yl)acetamide hydrochloride

$$$$ Data

M. F.

C12H13ClN2O

Suppliers	Catalog Number
InterBioScreen	BB_SC-8657
Enamine	EN300-63978

Database	Data ID
PubChem	47003070

M. W.

236.69742

CAS

Similarity

N/A

ID: 124250

4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)phenol

$$$$ Data

M. F.

C11H10N2O2

Suppliers	Catalog Number
InterBioScreen	BB_SC-8659
Enamine	EN300-69906

Database	Data ID
PubChem	28942012

M. W.

202.2093

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