In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 30 | Yes |
Popular Name: 2-[3-(4-methylpiperazin-1-yl)propyl]-1-[[4-[(1S)-1-methylpropyl]phenyl]methyl]benzimidazole 2-[3-(4-methylpiperazin-1-yl)pro…
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) | 5.42 | 14.08 | -42.6 | 1 | 4 | 1 | 26 | 405.61 | 8 | ↓ |
Hi High (pH 8-9.5) | 5.42 | 11.71 | -9.51 | 0 | 4 | 0 | 24 | 404.602 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.42 | 13.96 | -46.81 | 1 | 4 | 1 | 26 | 405.61 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.42 | 14.34 | -78.19 | 2 | 4 | 2 | 27 | 406.618 | 8 | ↓ |