| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 22nd, 2010 | 17 | Yes |
Popular Name: (2S)-3-methyl-2-(4-propylpiperazine-1-carbonyl)butanenitrile (2S)-3-methyl-2-(4-propylpiperaz…
| 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) | 2.47 | 4.66 | -6.58 | 0 | 4 | 0 | 47 | 237.347 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 6.86 | -41.01 | 1 | 4 | 1 | 49 | 238.355 | 4 | ↓ |
