In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 33 | No |
Popular Name: (2R)-2-(4-benzhydrylpiperazin-1-yl)-N-(cyclohexylcarbamoyl)propanamide (2R)-2-(4-benzhydrylpiperazin-1-…
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) | 4.40 | 12.55 | -49.79 | 3 | 6 | 1 | 66 | 449.619 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.40 | 10.25 | -18.58 | 2 | 6 | 0 | 65 | 448.611 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.40 | 11.86 | -44.9 | 3 | 6 | 1 | 66 | 449.619 | 6 | ↓ |