In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 35 | Yes |
Popular Name: N-benzyl-N-[3-[4-[(E)-cinnamyl]piperazino]-3-keto-propyl]pyrazinamide N-benzyl-N-[3-[4-[(E)-cinnamyl]p…
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) | 3.17 | 11.58 | -11.24 | 0 | 7 | 0 | 70 | 469.589 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 13.91 | -55.64 | 1 | 7 | 1 | 71 | 470.597 | 9 | ↓ |