In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2008 | 31 | Yes |
Popular Name: N-methyl-N-[2-oxo-2-(p-tolylamino)ethyl]-2-(4-pyridyl)quinoline-4-carboxamide N-methyl-N-[2-oxo-2-(p-tolylamin…
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) | 3.36 | 9.93 | -18.52 | 1 | 6 | 0 | 75 | 410.477 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.36 | 10.21 | -47.77 | 2 | 6 | 1 | 76 | 411.485 | 5 | ↓ |