In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 34 | Yes |
Popular Name: 1-[4-(4-allyl-2-methoxy-phenoxy)butyl]-2-[(1R)-1-(4-methylpiperazin-1-yl)ethyl]benzimidazole 1-[4-(4-allyl-2-methoxy-phenoxy)…
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) | 4.49 | 13.26 | -45.03 | 1 | 6 | 1 | 44 | 463.646 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.49 | 14.13 | -89.38 | 2 | 6 | 2 | 45 | 464.654 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.49 | 13.16 | -40.47 | 1 | 6 | 1 | 44 | 463.646 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.49 | 10.9 | -12.43 | 0 | 6 | 0 | 43 | 462.638 | 11 | ↓ |