UCSF

ZINC01719652

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 25 Yes

Popular Name: Bevantolol Bevantolol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 42864-78-8 , 59170-23-9

Other Names:

(+-)-1-((3,4-dimethoxyphenethyl)amino)-3-(m-tolyloxy)-2-propanol hydrochloride; 1-(3,4-dimethoxyphenethylamino)-3-m-tolyloxy-propan-2-ol hydrochloride; N-[2-(3,4-dimethoxyphenyl)ethyl]-2-hydroxy-3-(3-methylphenoxy)propan-1-aminium chloride; bevantolol HCl

(+-)-bevantolol

(+-)-bevantolol; 1-((2-(3,4-dimethoxyphenyl)ethyl)amino)-3-(3-methylphenoxy)-2-propanol; 1-(3,4-dimethoxyphenethylamino)-3-(m-tolyloxy)-2-propanol; 1-(3,4-dimethoxyphenethylamino)-3-m-tolyloxy-propan-2-ol; 1-[2-(3,4-Dimethoxy-phenyl)-ethylamino]-3-m-tolyl

(R)-1-((2-(3,4-dimethoxyphenyl)ethyl)amino)-3-(3-methylphenoxy)-2-propanol; (R)-1-(3,4-dimethoxyphenethylamino)-3-(m-tolyloxy)-2-propanol; (R)-1-(3,4-dimethoxyphenethylamino)-3-m-tolyloxy-propan-2-ol; (R)-1-[2-(3,4-dimethoxy-phenyl)-ethylamino]-3-m-tolylo

(R)-bevantolol

olol

1-((2-(3,4-dimethoxyphenyl)ethyl)amino)- 3-(3-methylphenoxy)-2-propanol

1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(3-methylphenoxy)-2-propanol

1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(3-methylphenoxy)-2-propanol; 1-((2-(3,4-dimethoxyphenyl)ethyl)amino)- 3-(3-methylphenoxy)-2-propanol; 1-(3,4-Dimethoxyphenethylamino)-3-(m-tolyloxy)-2-propanol; 2-Propanol, 1-((2-(3,4-dimethoxyphenyl)ethyl)amino)

1-((3,4-Dimethoxyphenethyl)amino)-3-(m-tolyloxy)propan-2-ol

1-((3,4-Dimethoxyphenethyl)amino)-3-(m-tolyloxy)propan-2-ol hydrochloride

1-(3,4-Dimethoxyphenethylamino)-3-(m-tolyloxy)-2-propanol

1-(3,4-Dimethoxyphenethylamino)-3-(m-tolyloxy)-2-propanol;Bevantololum [inn-latin]

1-(3,4-dimethoxyphenethylamino)-3-m-tolyloxy-propan-2-ol

1-[2-(3,4-Dimethoxy-phenyl)-ethylamino]-3-m-tolyloxy-propan-2-ol

1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-(3-methylphenoxy)propan-2-ol

1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-(3-methylphenoxy)propan-2-ol

2-Propanol, 1-((2-(3,4-dimethoxyphenyl)ethyl)amino)-3-(3-methylphenoxy)-

42864-78-8 (hydrochloride)

42864-78-8; Bevantolol hydrochloride (JAN/USAN); Calvan (TN); D01369; Vantol (TN)

59170-23-9

AC1L1DJ8

Bevantol hydrochloride

Bevantolol (BAN

Bevantolol hydrochloride

Bevantolol [INN:BAN]

bevantolol; bevantololum

bevantololhydrochloride

Bevantololum

Bevantololum [inn-latin]

BRN 2769444

C20H27NO4

Calvan

CHEBI:238698

CHEMBL314010

CI 775

CI-775

CID2372

CL-775

DAP000897

DB01295

INN); Bevantolol HCl (JAN

INN); Bevantolol Hydrochloride (JAN

L013370

LS-122167

MFCD00864681

MFCD00941389

MolPort-005-942-286

NC-1400

NSC132348

Ranestol

UNII-34ZXW6ZV21

USAN)

Vantol

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) 2.66 -1.79 -55.11 3 5 1 64 346.447 10 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.37e-02 g/l DrugBank-approved
PUBCHEM_PATENT_ID EP0077529A2; EP0165682A1; EP0251680A2; EP0251680B1; EP0283147B1; EP0365662A1; EP0365662B1; EP0429732A1; EP0429732B1; EP0525475A2; EP0525475A3; EP0526566A1; EP0625903A1; EP0625903B1; EP0631775A1; EP0631775B1; EP0663897A1; EP0663897B1; EP0681833A3; EP073706 IBM Patent Data

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