| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 22nd, 2010 | 18 | Yes |
Popular Name: 2-(4-methylpiperazine-1-carbonyl)-2-propyl-pentanenitrile 2-(4-methylpiperazine-1-carbonyl…
| 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) | 2.29 | 4.71 | -5.97 | 0 | 4 | 0 | 47 | 251.374 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.29 | 7.08 | -41.19 | 1 | 4 | 1 | 49 | 252.382 | 5 | ↓ |
