In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2010 | 32 | Yes |
Popular Name: [4-[(1-benzylbenzimidazol-2-yl)methyl]piperazin-1-yl]-(5-bromo-3-pyridyl)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) | 3.17 | 10.66 | -14.45 | 0 | 6 | 0 | 54 | 490.405 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 12.72 | -56.26 | 1 | 6 | 1 | 55 | 491.413 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 10.9 | -36.98 | 1 | 6 | 1 | 56 | 491.413 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.17 | 13.01 | -133.28 | 2 | 6 | 2 | 57 | 492.421 | 5 | ↓ |