In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 35 | Yes |
Popular Name: 1-[4-(4-allyl-2-methoxy-phenoxy)butyl]-2-[3-(4-methylpiperazin-1-yl)propyl]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) | 4.61 | 14.71 | -45.35 | 1 | 6 | 1 | 44 | 477.673 | 13 | ↓ |
Hi High (pH 8-9.5) | 4.61 | 12.33 | -13.44 | 0 | 6 | 0 | 43 | 476.665 | 13 | ↓ |
Mid Mid (pH 6-8) | 4.61 | 14.59 | -48.64 | 1 | 6 | 1 | 44 | 477.673 | 13 | ↓ |
Lo Low (pH 4.5-6) | 4.61 | 15 | -82.67 | 2 | 6 | 2 | 45 | 478.681 | 13 | ↓ |