In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2010 | 32 | Yes |
Popular Name: [4-[(1-benzylbenzimidazol-2-yl)methyl]piperazin-1-yl]-(3-bromophenyl)methanone [4-[(1-benzylbenzimidazol-2-yl)m…
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) | 4.24 | 12.11 | -14.35 | 0 | 5 | 0 | 41 | 489.417 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.24 | 14.3 | -54.12 | 1 | 5 | 1 | 43 | 490.425 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.24 | 14.13 | -38.64 | 1 | 5 | 1 | 43 | 490.425 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.24 | 14.95 | -131.16 | 2 | 5 | 2 | 44 | 491.433 | 5 | ↓ |