In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 32 | Yes |
Popular Name: 1-[4-(2-isopropyl-5-methyl-phenoxy)butyl]-2-[(4-methylpiperazin-1-yl)methyl]benzimidazole 1-[4-(2-isopropyl-5-methyl-pheno…
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) | 4.94 | 13.99 | -41.77 | 1 | 5 | 1 | 35 | 435.636 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.94 | 11.64 | -9.91 | 0 | 5 | 0 | 34 | 434.628 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.94 | 14.43 | -88.37 | 2 | 5 | 2 | 36 | 436.644 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.94 | 13.85 | -43.7 | 1 | 5 | 1 | 35 | 435.636 | 9 | ↓ |