In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 32 | Yes |
Popular Name: 1-[4-(2-allylphenoxy)butyl]-2-[(1S)-1-(4-methylpiperazin-1-yl)ethyl]benzimidazole 1-[4-(2-allylphenoxy)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) | 4.86 | 13.43 | -41.95 | 1 | 5 | 1 | 35 | 433.62 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.86 | 14.11 | -85.97 | 2 | 5 | 2 | 36 | 434.628 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.86 | 13.3 | -38.51 | 1 | 5 | 1 | 35 | 433.62 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.86 | 11.07 | -10.38 | 0 | 5 | 0 | 34 | 432.612 | 10 | ↓ |