| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 16 | Yes |
Popular Name: (2S)-2-(4-isopropylpiperazine-1-carbonyl)butanenitrile (2S)-2-(4-isopropylpiperazine-1-…
| 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) | 1.26 | 3.92 | -7.27 | 0 | 4 | 0 | 47 | 223.32 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.26 | 6.06 | -39.09 | 1 | 4 | 1 | 49 | 224.328 | 3 | ↓ |
