In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2010 | 31 | Yes |
Popular Name: (1S,6R)-6-(4-benzylpiperazine-1-carbonyl)-N-(cyclohexylmethyl)cyclohex-3-ene-1-carboxamide (1S,6R)-6-(4-benzylpiperazine-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) | 4.01 | 10.26 | -9.78 | 1 | 5 | 0 | 53 | 423.601 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.01 | 12.46 | -42.61 | 2 | 5 | 1 | 54 | 424.609 | 6 | ↓ |