UCSF

ZINC08327001

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 9th, 2006 18 Yes

Popular Name: 2-(3-Bromo-4,5-dimethoxy-benzylamino)-butan-1-ol 2-(3-Bromo-4,5-dimethoxy-benzyla…

Find On: PubMed — Wikipedia — Google

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) 2.31 -2.18 -44.56 3 4 1 55 319.219 7 ↓

Activity (Go SEA)

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