| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 17 | Yes |
Popular Name: (2S)-2-(4-cyclopropylpiperazine-1-carbonyl)-3-methyl-butanenitrile (2S)-2-(4-cyclopropylpiperazine-…
| 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) | 1.95 | 4.67 | -6.6 | 0 | 4 | 0 | 47 | 235.331 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.95 | 6.86 | -38.69 | 1 | 4 | 1 | 49 | 236.339 | 3 | ↓ |
