UCSF

ZINC06883656

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 30th, 2006 13 Yes

Popular Name: (2-chlorobenzyl)isobutylamine (2-chlorobenzyl)isobutylamine

Find On: PubMed — Wikipedia — Google

CAS Number: 893575-69-4

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) 3.25 0.47 -33.96 2 1 1 16 198.717 4 ↓

Activity (Go SEA)

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