In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 29 | Yes |
Popular Name: 1-[4-(4-chloro-3-methyl-phenoxy)butyl]-2-[(1S)-1-pyrrolidin-1-ylethyl]benzimidazole 1-[4-(4-chloro-3-methyl-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) | 5.65 | 14.31 | -39.16 | 1 | 4 | 1 | 31 | 412.985 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.65 | 11.9 | -10.81 | 0 | 4 | 0 | 30 | 411.977 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.65 | 12.72 | -27.66 | 1 | 4 | 1 | 32 | 412.985 | 8 | ↓ |