UCSF

ZINC69236378

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2011 18 Yes

Popular Name: 1-(7-methoxy-4,5-dihydro-3H-benzo[e]benzimidazol-2-yl)-N-methyl-methanamine 1-(7-methoxy-4,5-dihydro-3H-benz…

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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) 1.71 4.19 -30.05 3 4 1 51 244.318 3 ↓
Hi High (pH 8-9.5) 1.71 3.5 -7.46 2 4 0 50 243.31 3 ↓
Mid Mid (pH 6-8) 1.71 4.93 -44.57 3 4 1 55 244.318 3 ↓

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

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