In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 22 | Yes |
Popular Name: 1-[4-[(5-chloro-1-methyl-benzimidazol-2-yl)methyl]-1,4-diazepan-1-yl]ethanone 1-[4-[(5-chloro-1-methyl-benzimi…
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) | 1.58 | 9.27 | -53.35 | 1 | 5 | 1 | 43 | 321.832 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.58 | 7.35 | -17.15 | 0 | 5 | 0 | 41 | 320.824 | 2 | ↓ |