In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 30 | Yes |
Popular Name: 1-[3-(2-chlorophenoxy)propyl]-2-[3-(4-methylpiperazin-1-yl)propyl]benzimidazole 1-[3-(2-chlorophenoxy)propyl]-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) | 4.56 | 12.59 | -48.03 | 1 | 5 | 1 | 35 | 428 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.56 | 10.22 | -13.66 | 0 | 5 | 0 | 34 | 426.992 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.56 | 12.48 | -50.93 | 1 | 5 | 1 | 35 | 428 | 9 | ↓ |
Lo Low (pH 4.5-6) | 4.56 | 12.89 | -80.38 | 2 | 5 | 2 | 36 | 429.008 | 9 | ↓ |