In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 31 | Yes |
Popular Name: 1-[4-(4-methoxyphenoxy)butyl]-2-[(1S)-1-(4-methylpiperazin-1-yl)ethyl]benzimidazole 1-[4-(4-methoxyphenoxy)butyl]-2-…
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) | 4.14 | 10.66 | -43.48 | 1 | 6 | 1 | 44 | 423.581 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.14 | 11.34 | -87.43 | 2 | 6 | 2 | 45 | 424.589 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.14 | 10.53 | -40.12 | 1 | 6 | 1 | 44 | 423.581 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.14 | 8.29 | -11.79 | 0 | 6 | 0 | 43 | 422.573 | 9 | ↓ |