Chembase list of 866358 unique molecular structures

(2S)-1-fluoropropan-2-amine hydrochloride

$$$$ Data

M. F.

C3H9ClFN

Suppliers	Catalog Number
Enamine	EN300-102325

Database	Data ID
PubChem	11851333

M. W.

113.5616632

CAS

Similarity

N/A

ID: 235902

2-chloro-3-(pyrrolidin-1-ylmethyl)pyridine hydrochloride

$$$$ Data

M. F.

C10H14Cl2N2

Suppliers	Catalog Number
Enamine	EN300-102329

Database	Data ID
PubChem	71755596

M. W.

233.13756

CAS

Similarity

N/A

ID: 235903

1-[3-(methylsulfanyl)phenyl]-5-oxopyrrolidine-3-carboxylic acid

$$$$ Data

M. F.

C12H13NO3S

Suppliers	Catalog Number
Enamine	EN300-10233

Database	Data ID
PubChem	3859249

M. W.

251.30152

CAS

63674-52-2

Similarity

N/A

ID: 235904

7-methyl-1,2,3,4-tetrahydronaphthalen-1-one

$$$$ Data

M. F.

C11H12O

Suppliers	Catalog Number
Enamine	EN300-102330
Bide Pharmatech	BD110826

Database	Data ID
PubChem	89147

M. W.

160.21238

CAS

22009-37-6

Similarity

N/A

ID: 235905

4-(3-methoxypropyl)-1-sulfanyl-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-5-one

$$$$ Data

M. F.

C13H14N4O2S

Suppliers	Catalog Number
Enamine	EN300-10234

Database	Data ID
PubChem	2081017

M. W.

290.34086

CAS

Similarity

N/A

ID: 235906

N-{3-fluoro-4-[methyl(propan-2-yl)amino]phenyl}prop-2-enamide

$$$$ Data

M. F.

C13H17FN2O

Suppliers	Catalog Number
Enamine	EN300-102348

Database	Data ID
PubChem	43697236

M. W.

236.2852832

CAS

Similarity

N/A

ID: 235907

3-methanesulfonylcyclohexyl methanesulfonate

$$$$ Data

M. F.

C8H16O5S2

Suppliers	Catalog Number
Enamine	EN300-102349

Database	Data ID
PubChem	71755597

M. W.

256.33964

CAS

Similarity

N/A

ID: 235908

4-pentyl-1-sulfanyl-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-5-one

$$$$ Data

M. F.

C14H16N4OS

Suppliers	Catalog Number
Enamine	EN300-10235

Database	Data ID
PubChem	2081016

M. W.

288.36804

CAS

Similarity

N/A

ID: 235909

2-(pyridin-2-yl)imidazo[1,2-a]pyridin-3-amine

$$$$ Data

M. F.

C12H10N4

Suppliers	Catalog Number
Enamine	EN300-102350

Database	Data ID
PubChem	63618433

M. W.

210.2346

CAS

Similarity

N/A

ID: 235910

1-benzylcyclopropane-1-carboxylic acid

$$$$ Data

M. F.

C11H12O2

Suppliers	Catalog Number
Enamine	EN300-102352

Database	Data ID
PubChem	562561

M. W.

176.21178

CAS

Similarity

N/A

ID: 235911

2-(pyridin-3-yl)imidazo[1,2-a]pyridin-3-amine

$$$$ Data

M. F.

C12H10N4

Suppliers	Catalog Number
Enamine	EN300-102353

Database	Data ID
PubChem	63617576

M. W.

210.2346

CAS

Similarity

N/A

ID: 235912

N-(5-chloro-1,3,4-thiadiazol-2-yl)acetamide

$$$$ Data

M. F.

C4H4ClN3OS

Suppliers	Catalog Number
Enamine	EN300-102354

Database	Data ID
PubChem	314332

M. W.

177.61206

CAS

Similarity

N/A

ID: 235913

2-(1,2,4-oxadiazol-5-yl)ethan-1-amine hydrochloride

$$$$ Data

M. F.

C4H8ClN3O

Suppliers	Catalog Number
Enamine	EN300-102355

Database	Data ID
PubChem	71755598

M. W.

149.57882

CAS

Similarity

N/A

ID: 235914

1-ethylcyclobutane-1-carboxylic acid

$$$$ Data

M. F.

C7H12O2

Suppliers	Catalog Number
Enamine	EN300-102357

Database	Data ID
PubChem	21996033

M. W.

128.16898

CAS

Similarity

N/A

ID: 235915

3-oxaspiro[5.5]undecan-9-one

$$$$ Data

M. F.

C10H16O2

Suppliers	Catalog Number
Enamine	EN300-102358

Database	Data ID
PubChem	68765783

M. W.

168.23284

CAS

Similarity

N/A

ID: 235916

N-ethyl-N-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]acetamide

$$$$ Data

M. F.

C9H11N3OS2

Suppliers	Catalog Number
Enamine	EN300-10236

Database	Data ID
PubChem	2081015

M. W.

241.33314

CAS

Similarity

N/A

ID: 235917

3-oxaspiro[5.5]undec-7-en-9-one

$$$$ Data

M. F.

C10H14O2

Suppliers	Catalog Number
Enamine	EN300-102361

Database	Data ID
PubChem	68763689

M. W.

166.21696

CAS

Similarity

N/A

ID: 235918

methyl 2-[3,5-dimethyl-1-(pyridin-2-yl)-1H-pyrazol-4-yl]propanoate

$$$$ Data

M. F.

C14H17N3O2

Suppliers	Catalog Number
Enamine	EN300-102362

Database	Data ID
PubChem	62096545

M. W.

259.30368

CAS

Similarity

N/A

ID: 235919

3-ethylbenzene-1-sulfonyl chloride

$$$$ Data

M. F.

C8H9ClO2S

Suppliers	Catalog Number
Enamine	EN300-102363

Database	Data ID
PubChem	14574347

M. W.

204.67386

CAS

Similarity

N/A

ID: 235920

N-ethyl-4-sulfanylpyridine-2-carboxamide

$$$$ Data

M. F.

C8H10N2OS

Suppliers	Catalog Number
Enamine	EN300-102364

Database	Data ID
PubChem	43517789

M. W.

182.2428

CAS

Similarity

N/A

ID: 235921

(2-chlorophenyl)methanesulfonamide

$$$$ Data

M. F.

C7H8ClNO2S

Suppliers	Catalog Number
Enamine	EN300-102365

Database	Data ID
PubChem	146065

M. W.

205.66192

CAS

Similarity

N/A

ID: 235922

(3R)-3-amino-3-(4-fluorophenyl)propanamide hydrochloride

$$$$ Data

M. F.

C9H12ClFN2O

Suppliers	Catalog Number
Enamine	EN300-102366

Database	Data ID
PubChem	71755599

M. W.

218.6557832

CAS

Similarity

N/A

ID: 235923

2-(3-methylpyrrolidin-1-yl)pyridine-4-carboxylic acid

$$$$ Data

M. F.

C11H14N2O2

Suppliers	Catalog Number
Enamine	EN300-102368

Database	Data ID
PubChem	61224663

M. W.

206.24106

CAS

Similarity

N/A

ID: 235924

3-bromo-1-(4-methylphenyl)-4,5-dihydro-1H-pyrazole-5-carboxylic acid

$$$$ Data

M. F.

C11H11BrN2O2

Suppliers	Catalog Number
Enamine	EN300-102375

Database	Data ID
PubChem	71755600

M. W.

283.12124

CAS

Similarity

N/A

ID: 235925

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

$$$$ Data

M. F.

C7H8O3S

Suppliers	Catalog Number
ChemBridge	4009586
Enamine	EN300-10238

Database	Data ID
PubChem	2080982

M. W.

172.20162

CAS

94084-70-5

Similarity

N/A

ID: 235926

2-chloro-1-[1-(3-methylphenyl)-1H-1,2,3-triazol-4-yl]ethan-1-one

$$$$ Data

M. F.

C11H10ClN3O

Suppliers	Catalog Number
Enamine	EN300-102386

Database	Data ID
PubChem	71755601

M. W.

235.6696

CAS

Similarity

N/A

ID: 235927

2-(1,1,3-trioxo-3,4-dihydro-2H-1λ⁶,2,4-benzothiadiazin-2-yl)acetic a...

$$$$ Data

M. F.

C9H8N2O5S

Suppliers	Catalog Number
Enamine	EN300-102387

Database	Data ID
PubChem	12487129

M. W.

256.23522

CAS

Similarity

N/A

ID: 235928

2-(2-aminoethyl)-3,4-dihydro-2H-1λ⁶,2,4-benzothiadiazine-1,1,3-trion...

$$$$ Data

M. F.

C9H11N3O3S

Suppliers	Catalog Number
Enamine	EN300-102389

Database	Data ID
PubChem	71755602

M. W.

241.26694

CAS

Similarity

N/A

ID: 235929

5-(4-chlorophenyl)-4-hydrazinylthieno[2,3-d]pyrimidine

$$$$ Data

M. F.

C12H9ClN4S

Suppliers	Catalog Number
Enamine	EN300-10239

Database	Data ID
PubChem	853203

M. W.

276.74466

CAS

Similarity

N/A

ID: 235930

5-methyl-4-phenyl-1H-imidazole-2-thiol

$$$$ Data

M. F.

C10H10N2S

Suppliers	Catalog Number
Enamine	EN300-102391

Database	Data ID
PubChem	16763414

M. W.

190.2648

CAS

Similarity

N/A

ID: 235931

1-(3-chloropropanoyl)-3-(2,2,2-trifluoroethyl)urea

$$$$ Data

M. F.

C6H8ClF3N2O2

Suppliers	Catalog Number
Enamine	EN300-102394

Database	Data ID
PubChem	43089771

M. W.

232.5881296

CAS

Similarity

N/A

ID: 235932

2,6-dibromo-4-fluorobenzene-1-sulfonamide

$$$$ Data

M. F.

C6H4Br2FNO2S

Suppliers	Catalog Number
Enamine	EN300-102395

Database	Data ID
PubChem	43173619

M. W.

332.9728632

CAS

Similarity

N/A

ID: 235933

7-chloro-1-methyl-1H-pyrrolo[2,3-c]pyridine

$$$$ Data

M. F.

C8H7ClN2

Suppliers	Catalog Number
Enamine	EN300-102397

Database	Data ID
PubChem	59424476

M. W.

166.60758

CAS

Similarity

N/A

ID: 235934

N-[3-(trifluoromethyl)phenyl]prop-2-enamide

$$$$ Data

M. F.

C10H8F3NO

Suppliers	Catalog Number
Enamine	EN300-102398

Database	Data ID
PubChem	13723644

M. W.

215.1718296

CAS

Similarity

N/A

ID: 235935

[4-(5,6-dimethyl-1H-1,3-benzodiazol-2-yl)phenyl]methanamine dihydrochloride

$$$$ Data

M. F.

C16H19Cl2N3

Suppliers	Catalog Number
Enamine	EN300-102399

Database	Data ID
PubChem	71755603

M. W.

324.24816

CAS

Similarity

N/A

ID: 235936

N,2-dimethyl-1,3-benzothiazol-6-amine

$$$$ Data

M. F.

C9H10N2S

Suppliers	Catalog Number
Enamine	EN300-102400

Database	Data ID
PubChem	23544370

M. W.

178.2541

CAS

Similarity

N/A

ID: 235937

1-(3-{[(tert-butoxy)carbonyl]amino}propyl)-1H-indole-5-carboxylic acid

$$$$ Data

M. F.

C17H22N2O4

Suppliers	Catalog Number
Enamine	EN300-102402

Database	Data ID
PubChem	71755604

M. W.

318.36758

CAS

Similarity

N/A

ID: 235938

2-nitro-4-(1,3-thiazol-2-yloxy)phenol

$$$$ Data

M. F.

C9H6N2O4S

Suppliers	Catalog Number
Enamine	EN300-102403

Database	Data ID
PubChem	71755605

M. W.

238.21994

CAS

Similarity

N/A

ID: 235939

2-bromo-4-(1,3-thiazol-2-yloxy)phenol

$$$$ Data

M. F.

C9H6BrNO2S

Suppliers	Catalog Number
Enamine	EN300-102405

Database	Data ID
PubChem	71755606

M. W.

272.11844

CAS

Similarity

N/A

ID: 235940

2-amino-4-(1,3-thiazol-2-yloxy)phenol

$$$$ Data

M. F.

C9H8N2O2S

Suppliers	Catalog Number
Enamine	EN300-102406

Database	Data ID
PubChem	71755607

M. W.

208.23702

CAS

Similarity

N/A

ID: 235941

2-chloro-1-[2-hydroxy-5-(1,3-thiazol-2-yloxy)phenyl]ethan-1-one

$$$$ Data

M. F.

C11H8ClNO3S

Suppliers	Catalog Number
Enamine	EN300-102407

Database	Data ID
PubChem	71755608

M. W.

269.70412

CAS

Similarity

N/A

ID: 235942

N-(3,3,3-trifluoropropyl)aniline

$$$$ Data

M. F.

C9H10F3N

Suppliers	Catalog Number
Enamine	EN300-102408

Database	Data ID
PubChem	60679594

M. W.

189.1776096

CAS

Similarity

N/A

ID: 235943

{[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]methyl}(oxolan-2-ylmethyl)amine hydrochl...

$$$$ Data

M. F.

C16H24ClNO3

Suppliers	Catalog Number
Enamine	EN300-10241

Database	Data ID
PubChem	6458928

M. W.

313.81966

CAS

Similarity

N/A

ID: 235944

potassium 2-(quinolin-2-yl)acetate

$$$$ Data

M. F.

C11H8KNO2

Suppliers	Catalog Number
Enamine	EN300-102410

Database	Data ID
PubChem	71755609

M. W.

225.28502

CAS

Similarity

N/A

ID: 235945

5-methylthieno[2,3-d][1,3]thiazol-2-amine

$$$$ Data

M. F.

C6H6N2S2

Suppliers	Catalog Number
Enamine	EN300-102412

Database	Data ID
PubChem	598456

M. W.

170.25524

CAS

Similarity

N/A

ID: 235946

5-bromo-4-methylthiophene-2-carboxylic acid

$$$$ Data

M. F.

C6H5BrO2S

Suppliers	Catalog Number
Enamine	EN300-102413

Database	Data ID
PubChem	21899459

M. W.

221.0717

CAS

Similarity

N/A

ID: 235947

6-bromo-2,7-dimethyl-3,4-dihydro-2H-1,4-benzoxazine

$$$$ Data

M. F.

C10H12BrNO

Suppliers	Catalog Number
Enamine	EN300-102414

Database	Data ID
PubChem	71755610

M. W.

242.11238

CAS

Similarity

N/A

ID: 235948

methyl 1-amino-4-ethylcyclohexane-1-carboxylate

$$$$ Data

M. F.

C10H19NO2

Suppliers	Catalog Number
Enamine	EN300-102415

Database	Data ID
PubChem	43162944

M. W.

185.26336

CAS

Similarity

N/A

ID: 235949

2H,3H,4H-pyrido[4,3-b][1,4]thiazin-3-one

$$$$ Data

M. F.

C7H6N2OS

Suppliers	Catalog Number
Enamine	EN300-102417

Database	Data ID
PubChem	373078

M. W.

166.20034

CAS

Similarity

N/A

ID: 235950

1-benzyl-4-methylpyrrolidin-3-one

$$$$ Data

M. F.

C12H15NO

Suppliers	Catalog Number
Enamine	EN300-102419

Database	Data ID
PubChem	12430980

M. W.

189.2536

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