In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 30 | Yes |
Popular Name: 1-[4-(3,5-dimethylphenoxy)butyl]-2-[(4-methylpiperazin-1-yl)methyl]benzimidazole 1-[4-(3,5-dimethylphenoxy)butyl]…
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) | 4.35 | 12.31 | -45.95 | 1 | 5 | 1 | 35 | 407.582 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.35 | 9.96 | -10.85 | 0 | 5 | 0 | 34 | 406.574 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.35 | 13.09 | -89.92 | 2 | 5 | 2 | 36 | 408.59 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.35 | 12.2 | -43.07 | 1 | 5 | 1 | 35 | 407.582 | 8 | ↓ |