UCSF

ZINC00001028

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2005 8 Yes

Popular Name: Betazole hydrochloride Betazole hydrochloride

Find On: PubMed — Wikipedia — Google

CAS Numbers: 105-20-4 , 138-92-1 , [138-92-1]

Other Names:

138-92-1 (di-hydrochloride)

138-92-1; Betazole hydrochloride (JAN); D01187; Histalog (TN)

1H-Pyrazole-3-ethanamine

1H-pyrazole-3-ethanamine dihydrochloride

1H-pyrazole-3-ethanamine, dihydrochloride

1H-Pyrazole-3-ethanamine, dihydrochloride; 2-(3-Pyrazolyl)ethylamine dihydrochloride; 3,5-beta-Pyrazoleethylamine dihydrochloride; 3-(2-Aminoethyl)pyrazole dihydrochloride; 3-beta-Aminoethylpyrazole dihydrochloride; Ametazole dihydrochloride; BETAZOLE HYD

1H-pyrazole-3-ethanamine; 2-(1H-pyrazol-5-yl)ethanamine; 2-(3-pyrazolyl)ethylamine; 3-(2-aminoethyl)pyrazole; 3-(beta-aminoethyl)pyrazole; ametazole

1H-Pyrazole-3-ethanamine; 2-(3-Pyrazolyl)ethylamine; 3-(2-Aminoethyl)pyrazole; Ametazole; Betazol [INN-Spanish]; Betazole; Betazole [INN]; Betazolo [DCIT]; Betazolum [INN-Latin]; C5H9N3; EINECS 203-278-3; Histalog; LS-171948; Lilly 96791

1h-pyrazole-3-ethanaminedihydrochloride

2-(1H-Pyrazol-3-yl)ethanamine

2-(1H-pyrazol-3-yl)ethanamine dihydrochloride

2-(1H-pyrazol-5-yl)ethanamine

2-(1H-pyrazol-5-yl)ethanamine dihydrochloride; 2-(3-pyrazolyl)ethylamine dihydrochloride; 3-(2-aminoethyl)pyrazole dihydrochloride; 3-beta-aminoethylpyrazole dihydrochloride; ametazole dihydrochloride; betazole hydrochloride

2-(3-Pyrazolyl)ethylamine

3-(2-Aminoethyl)pyrazole

3-(beta-aminoethyl)pyrazole

AB00514680

AC1L1PG3

AC1Q4WVG

Ametazole

Ametazole;Betazol [INN-Spanish];Betazolo [DCIT];Betazolum [INN-Latin]

AR-1H9721

Betazol

Betazol [INN-Spanish]

betazol; betazole; betazolum

Betazole

Betazole (INN); Ametazole (BAN); Betazole HCl (FDA

Betazole (INN); Ametazole (BAN); Betazole Hydrochloride (FDA

betazole dihydrochloride

Betazole [INN]

Betazolo

Betazolo [DCIT]

Betazolum

Betazolum [INN-Latin]

BPBio1_000183

BSPBio_000165

CHEBI:59170

CID7741

DAP001081

DB00272

EINECS 203-278-3

Histalog

JAN

JAN)

L000831

Lilly 96791

LS-171948

MFCD00867261

MFCD01693704

MFCD10697816

MI

MolPort-001-787-387

NCGC00016995-01

NCGC00016995-02

Prestwick-01E04

Prestwick0_000043

Prestwick1_000043

Prestwick2_000043

Prestwick3_000043

SPBio_002086

UNII-1C065P542O

USP

USP)

[2-(1H-pyrazol-3-yl)ethyl]amine dihydrochloride

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.46 -0.32 -43.49 4 3 1 56 112.156 2 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.56e+02 g/l DrugBank-approved
Purity 95% Fluorochem
Therapy gastric secretion stimulant SMDC Pharmakon

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.