In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 37 | Yes |
Popular Name: N-[3-[4-[(E)-cinnamyl]piperazino]-3-keto-propyl]-5-methyl-N-phenethyl-pyrazinamide N-[3-[4-[(E)-cinnamyl]piperazino…
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) | 3.80 | 13.21 | -12.09 | 0 | 7 | 0 | 70 | 497.643 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.80 | 15.53 | -56.35 | 1 | 7 | 1 | 71 | 498.651 | 10 | ↓ |