UCSF

ZINC69236370

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2011 17 Yes

Popular Name: (7-methoxy-4,5-dihydro-3H-benzo[e]benzimidazol-2-yl)methanamine (7-methoxy-4,5-dihydro-3H-benzo[…

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) 1.33 3.28 -29.58 4 4 1 65 230.291 2 ↓
Hi High (pH 8-9.5) 1.33 2.66 -7.99 3 4 0 64 229.283 2 ↓
Mid Mid (pH 6-8) 1.33 3.05 -50.33 4 4 1 66 230.291 2 ↓

Activity (Go SEA)

Rings

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

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