In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 37 | Yes |
Popular Name: N-benzyl-N-[3-keto-3-(4-piperonylpiperazino)propyl]-5-methyl-pyrazinamide N-benzyl-N-[3-keto-3-(4-piperony…
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) | 2.33 | 9.58 | -14.28 | 0 | 9 | 0 | 88 | 501.587 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 11.86 | -61.16 | 1 | 9 | 1 | 89 | 502.595 | 8 | ↓ |