In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2009 | 26 | Yes |
Popular Name: [4-(1H-benzimidazole-5-carbonyl)-1,4-diazepan-1-yl]-phenyl-methanone [4-(1H-benzimidazole-5-carbonyl)…
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) | 1.10 | 8.88 | -16.86 | 1 | 6 | 0 | 69 | 348.406 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.10 | 9.36 | -55.56 | 2 | 6 | 1 | 71 | 349.414 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.10 | 8.89 | -18.31 | 1 | 6 | 0 | 69 | 348.406 | 2 | ↓ |