| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 18 | Yes |
Popular Name: (2S)-2-[4-(cyclopropylmethyl)piperazine-1-carbonyl]-3-methyl-butanenitrile (2S)-2-[4-(cyclopropylmethyl)pip…
| 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) | 2.46 | 5.46 | -6.49 | 0 | 4 | 0 | 47 | 249.358 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 7.66 | -41.47 | 1 | 4 | 1 | 49 | 250.366 | 4 | ↓ |
