In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 27th, 2007 | 25 | Yes |
Popular Name: (3-methyl-1-piperidyl)-[2-(4-pyridyl)-4-quinolyl]-methanone (3-methyl-1-piperidyl)-[2-(4-pyr…
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) | 2.89 | -0.54 | -11.31 | 0 | 4 | 0 | 46 | 331.419 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.89 | -0.43 | -45.83 | 1 | 4 | 1 | 47 | 332.427 | 2 | ↓ |