In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2007 | 32 | Yes |
Popular Name: phenyl-[4-[[2-(4-pyridyl)-4-quinolyl]carbonyl]piperazin-1-yl]-methanone phenyl-[4-[[2-(4-pyridyl)-4-quin…
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) | 2.19 | -1.32 | -16.01 | 0 | 6 | 0 | 66 | 422.488 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.19 | -1.21 | -52.16 | 1 | 6 | 1 | 67 | 423.496 | 3 | ↓ |