In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 31 | Yes |
Popular Name: 1-benzyl-2-[(4-benzyl-1-piperazinyl)methyl]-5-chloro-1H-benzimidazole 1-benzyl-2-[(4-benzyl-1-piperazi…
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) | 4.95 | 14.1 | -46.67 | 1 | 4 | 1 | 26 | 431.991 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.95 | 11.72 | -9.36 | 0 | 4 | 0 | 24 | 430.983 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.95 | 13.98 | -49.72 | 1 | 4 | 1 | 26 | 431.991 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.95 | 14.49 | -98.57 | 2 | 4 | 2 | 27 | 432.999 | 6 | ↓ |