| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 35 | Yes |
Popular Name: N-[3-(4-benzylpiperazino)-3-keto-propyl]-5-methyl-N-(2-morpholinoethyl)pyrazinamide N-[3-(4-benzylpiperazino)-3-keto…
| 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) | 0.92 | 6.49 | -13.9 | 0 | 9 | 0 | 82 | 480.613 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 8.83 | -55.76 | 1 | 9 | 1 | 83 | 481.621 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 8.83 | -52.59 | 1 | 9 | 1 | 83 | 481.621 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 0.92 | 11.17 | -108.37 | 2 | 9 | 2 | 85 | 482.629 | 9 | ↓ |
