UCSF

ZINC20193045

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 19 Yes

Popular Name: (3-aminophenyl)(3,4-dihydroisoquinolin-2(1H)-yl)methanone (3-aminophenyl)(3,4-dihydroisoqu…

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) 1.35 6.43 -10.52 2 3 0 46 252.317 1 ↓

Activity (Go SEA)

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