In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2010 | 29 | Yes |
Popular Name: (1S,2R)-N-cyclohexyl-2-[4-(2-pyridyl)piperazine-1-carbonyl]cyclohexanecarboxamide (1S,2R)-N-cyclohexyl-2-[4-(2-pyr…
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) | 3.52 | 11.06 | -39.22 | 2 | 6 | 1 | 67 | 399.559 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.52 | 10.62 | -15.74 | 1 | 6 | 0 | 66 | 398.551 | 4 | ↓ |