| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 5th, 2008 | 27 | Yes |
Popular Name: 4-[[4-(quinoline-5-carbonyl)piperazin-1-yl]methyl]benzonitrile 4-[[4-(quinoline-5-carbonyl)pipe…
| 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) | 2.21 | 8.41 | -13.96 | 0 | 5 | 0 | 60 | 356.429 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.21 | 10.93 | -102.94 | 2 | 5 | 2 | 63 | 358.445 | 3 | ↓ |
