Chembase list of 866358 unique molecular structures

2-(aminomethyl)-N,N-dimethylpyrimidin-4-amine hydrochloride

$$$$

M. F.

C7H13ClN4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37879

Database

Data ID

M. W.

188.65792

CAS

1196146-21-0

Similarity

N/A

ID: 815552

ethyl 2-(aminomethyl)pyrimidine-4-carboxylate hydrochloride

$$$$

M. F.

C8H12ClN3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37880

Database

Data ID

M. W.

217.65278

CAS

1196146-89-0

Similarity

N/A

ID: 815553

ethyl 4-amino-2-(aminomethyl)pyrimidine-5-carboxylate hydrochloride

$$$$

M. F.

C8H13ClN4O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37881

Database

Data ID

M. W.

232.66742

CAS

1196147-29-1

Similarity

N/A

ID: 815554

ethyl 2-(aminomethyl)-4-chloropyrimidine-5-carboxylate hydrochloride

$$$$

M. F.

C8H11Cl2N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37882

Database

Data ID

M. W.

252.09784

CAS

1196145-23-9

Similarity

N/A

ID: 815555

ethyl 2-(aminomethyl)-6-chloropyrimidine-4-carboxylate hydrochloride

$$$$

M. F.

C8H11Cl2N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37883

Database

Data ID

M. W.

252.09784

CAS

1196153-17-9

Similarity

N/A

ID: 815556

[5-(4-fluorophenyl)pyrimidin-2-yl]methanamine hydrochloride

$$$$

M. F.

C11H11ClFN3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37885

Database

Data ID

M. W.

239.6765432

CAS

1196153-14-6

Similarity

N/A

ID: 815557

2-(aminomethyl)-N,N-dimethylpyrimidin-5-amine hydrochloride

$$$$

M. F.

C7H13ClN4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37886

Database

Data ID

M. W.

188.65792

CAS

944902-83-4

Similarity

N/A

ID: 815558

ethyl 2-(aminomethyl)-4-hydroxypyrimidine-5-carboxylate hydrochloride

$$$$

M. F.

C8H12ClN3O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37887

Database

Data ID

M. W.

233.65218

CAS

1196154-22-9

Similarity

N/A

ID: 815559

ethyl 2-(aminomethyl)pyrimidine-5-carboxylate hydrochloride

$$$$

M. F.

C8H12ClN3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37888

Database

Data ID

M. W.

217.65278

CAS

1196155-26-6

Similarity

N/A

ID: 815560

2-fluoro-3-hydroxybenzaldehyde

$$$$

M. F.

C7H5FO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37890

Database

Data ID

M. W.

140.1118032

CAS

103438-86-4

Similarity

N/A

ID: 815561

(1,4-dimethyl-1H-imidazol-2-yl)methanol

$$$$

M. F.

C6H10N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37891

Database

Data ID

M. W.

126.1564

CAS

59608-81-0

Similarity

N/A

ID: 815562

(1,4-dimethyl-1H-pyrazol-3-yl)methanol

$$$$

M. F.

C6H10N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37892

Database

Data ID

M. W.

126.1564

CAS

881008-97-5

Similarity

N/A

ID: 815563

(2-ethyl-5-methyl-1,3-oxazol-4-yl)methanol

$$$$

M. F.

C7H11NO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37893

Database

Data ID

M. W.

141.16774

CAS

675149-60-7

Similarity

N/A

ID: 815564

(2-ethyl-5-methyl-1,3-thiazol-4-yl)methanol

$$$$

M. F.

C7H11NOS

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37894

Database

Data ID

M. W.

157.23334

CAS

1008795-40-1

Similarity

N/A

ID: 815565

2-(3-amino-2-hydroxypyridin-4-yl)acetic acid

$$$$

M. F.

C7H8N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37895

Database

Data ID

M. W.

168.15002

CAS

34040-88-5

Similarity

N/A

ID: 815566

N2,N4-dimethylpyrimidine-2,4-diamine

$$$$

M. F.

C6H10N4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37896

Database

Data ID

M. W.

138.1704

CAS

856289-68-4

Similarity

N/A

ID: 815567

N-(1-benzofuran-2-yl)acetamide

$$$$

M. F.

C10H9NO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37897

Database

Data ID

M. W.

175.18396

CAS

65847-73-6

Similarity

N/A

ID: 815568

1H-1,2,4-triazole-3-carbaldehyde

$$$$

M. F.

C3H3N3O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37899

Database

Data ID

M. W.

97.07542

CAS

31708-25-5

Similarity

N/A

ID: 815569

2-acetamido-4-methylbenzoic acid

$$$$

M. F.

C10H11NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37900

Database

Data ID

M. W.

193.19924

CAS

81115-52-8

Similarity

N/A

ID: 815570

2,7-dimethylquinazolin-4-ol

$$$$

M. F.

C10H10N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37901

Database

Data ID

M. W.

174.1992

CAS

194473-09-1

Similarity

N/A

ID: 815571

N-(2-bromo-4-methoxyphenyl)acetamide

$$$$

M. F.

C9H10BrNO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37902

Database

Data ID

M. W.

244.0852

CAS

79069-37-7

Similarity

N/A

ID: 815572

2-amino-6,7-dimethoxyquinazolin-4-ol

$$$$

M. F.

C10H11N3O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37904

Database

Data ID

M. W.

221.21264

CAS

16175-67-0

Similarity

N/A

ID: 815573

2,8-dimethylquinazolin-4-ol

$$$$

M. F.

C10H10N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37905

Database

Data ID

M. W.

174.1992

CAS

172462-90-7

Similarity

N/A

ID: 815574

2-methyl-7-nitroquinazolin-4-ol

$$$$

M. F.

C9H7N3O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37906

Database

Data ID

M. W.

205.17018

CAS

24688-29-7

Similarity

N/A

ID: 815575

6,8-dibromo-2-methylquinazolin-4-ol

$$$$

M. F.

C9H6Br2N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37907

Database

Data ID

M. W.

317.96474

CAS

82326-77-0

Similarity

N/A

ID: 815576

2,5-dimethylquinazolin-4-ol

$$$$

M. F.

C10H10N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37908

Database

Data ID

M. W.

174.1992

CAS

147006-56-2

Similarity

N/A

ID: 815577

5-(hydroxymethyl)pyrimidin-2-ol

$$$$

M. F.

C5H6N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37910

Database

Data ID

M. W.

126.11334

CAS

69849-31-6

Similarity

N/A

ID: 815578

(3S)-1-tert-butylpyrrolidin-3-amine

$$$$

M. F.

C8H18N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37912

Database

Data ID

M. W.

142.24192

CAS

348165-30-0

Similarity

N/A

ID: 815579

(3S)-1-methylpyrrolidin-3-amine hydrochloride

$$$$

M. F.

C5H13ClN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37913

Database

Data ID

M. W.

136.62312

CAS

852874-61-4

Similarity

N/A

ID: 815580

4-fluoro-3-nitrobenzamide

$$$$

M. F.

C7H5FN2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37914

Database

Data ID

M. W.

184.1246032

CAS

349-02-0

Similarity

N/A

ID: 815581

4-fluoro-N-methoxy-3-nitrobenzamide

$$$$

M. F.

C8H7FN2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37915

Database

Data ID

M. W.

214.1505832

CAS

348165-46-8

Similarity

N/A

ID: 815582

3-amino-4-fluoro-N-methoxybenzamide

$$$$

M. F.

C8H9FN2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37916

Database

Data ID

M. W.

184.1676632

CAS

348165-47-9

Similarity

N/A

ID: 815583

3-hydroxy-N,4-dimethylbenzamide

$$$$

M. F.

C9H11NO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37918

Database

Data ID

M. W.

165.18914

CAS

348165-50-4

Similarity

N/A

ID: 815584

3-hydroxy-N-methoxy-4-methylbenzamide

$$$$

M. F.

C9H11NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37919

Database

Data ID

M. W.

181.18854

CAS

348165-51-5

Similarity

N/A

ID: 815585

4,5-dimethyl-1,3-oxazole

$$$$

M. F.

C5H7NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37921

Database

Data ID

M. W.

97.11518

CAS

20662-83-3

Similarity

N/A

ID: 815586

2-(4-chlorophenyl)-4-methyl-1,3-thiazole

$$$$

M. F.

C10H8ClNS

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37924

Database

Data ID

M. W.

209.69522

CAS

25100-91-8

Similarity

N/A

ID: 815587

6-methylisoquinolin-1-amine

$$$$

M. F.

C10H10N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37926

Database

Data ID

M. W.

158.1998

CAS

42398-74-3

Similarity

N/A

ID: 815588

ethyl 2-ethyl-5-methyl-1,3-oxazole-4-carboxylate

$$$$

M. F.

C9H13NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37933

Database

Data ID

M. W.

183.20442

CAS

137267-49-3

Similarity

N/A

ID: 815589

ethyl 2-ethyl-5-methyl-1,3-thiazole-4-carboxylate

$$$$

M. F.

C9H13NO2S

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37934

Database

Data ID

M. W.

199.27002

CAS

334017-25-3

Similarity

N/A

ID: 815590

3-{[(tert-butoxy)carbonyl]amino}furan-2-carboxylic acid

$$$$

M. F.

C10H13NO5

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37935

Database

Data ID

M. W.

227.21392

CAS

655255-06-4

Similarity

N/A

ID: 815591

tert-butyl N-(2-carbamoylfuran-3-yl)carbamate

$$$$

M. F.

C10H14N2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37936

Database

Data ID

M. W.

226.22916

CAS

655255-07-5

Similarity

N/A

ID: 815592

ethyl 2-(3-amino-2-hydroxypyridin-4-yl)acetate

$$$$

M. F.

C9H12N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37937

Database

Data ID

M. W.

196.20318

CAS

1196154-99-0

Similarity

N/A

ID: 815593

tert-butyl N-(2-formylfuran-3-yl)carbamate

$$$$

M. F.

C10H13NO4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37938

Database

Data ID

M. W.

211.21452

CAS

889088-96-4

Similarity

N/A

ID: 815594

bis(3-amino-1λ⁴-thiophen-1-yl) oxalate

$$$$

M. F.

C10H10N2O4S2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37939

Database

Data ID

M. W.

286.3274

CAS

861965-63-1

Similarity

N/A

ID: 815595

methyl 6-amino-2,3-dimethoxybenzoate

$$$$

M. F.

C10H13NO4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37942

Database

Data ID

M. W.

211.21452

CAS

128823-83-6

Similarity

N/A

ID: 815596

methyl 6-amino-4-chloropyridine-2-carboxylate

$$$$

M. F.

C7H7ClN2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37944

Database

Data ID

M. W.

186.59568

CAS

179555-07-8

Similarity

N/A

ID: 815597

benzyl N-[(3S)-1-tert-butyl-2,5-dioxopyrrolidin-3-yl]carbamate

$$$$

M. F.

C16H20N2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37945

Database

Data ID

M. W.

304.341

CAS

348165-28-6

Similarity

N/A

ID: 815598

benzyl N-[(3S)-1-tert-butylpyrrolidin-3-yl]carbamate

$$$$

M. F.

C16H24N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37946

Database

Data ID

M. W.

276.37396

CAS

348265-29-7

Similarity

N/A

ID: 815599

tert-butyl N-[1-(propan-2-yl)pyrrolidin-3-yl]carbamate

$$$$

M. F.

C12H24N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37947

Database

Data ID

M. W.

228.33116

CAS

937166-84-2

Similarity

N/A

ID: 815600

(3S)-1-(propan-2-yl)pyrrolidin-3-amine

$$$$

M. F.

C7H16N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O37948

Database

Data ID

M. W.

128.21534

CAS

914603-85-3

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