In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 9th, 2010 | 20 | Yes |
Popular Name: 1-piperazinepropanenitrile, 4-[[4-(1-methylethyl)phenyl]methyl]- 1-piperazinepropanenitrile, 4-[[…
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) | 2.60 | 8.9 | -44.09 | 1 | 3 | 1 | 31 | 272.416 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 6.63 | -6.79 | 0 | 3 | 0 | 30 | 271.408 | 5 | ↓ |