In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 31 | Yes |
Popular Name: N-[3-(4-benzylpiperazin-1-yl)-3-oxo-propyl]-N-cyclohexyl-hexanamide N-[3-(4-benzylpiperazin-1-yl)-3-…
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) | 4.93 | 12.61 | -9.78 | 0 | 5 | 0 | 44 | 427.633 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.93 | 14.82 | -51.68 | 1 | 5 | 1 | 45 | 428.641 | 10 | ↓ |