In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2011 | 24 | Yes |
Popular Name: N-methyl-2-(4-oxo-1-quinolyl)-N-[(1R)-1-(3-pyridyl)ethyl]acetamide N-methyl-2-(4-oxo-1-quinolyl)-N-…
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) | 0.69 | 8.71 | -26.7 | 0 | 5 | 0 | 55 | 321.38 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.69 | 9.16 | -57.15 | 1 | 5 | 1 | 56 | 322.388 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.