In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2005 | 28 | No |
Popular Name: 4-hydroxy-1-methyl-3-[5-oxo-4-(p-tolylaminoimino)-1H-pyrazol-3-yl]-quinolin-2-one 4-hydroxy-1-methyl-3-[5-oxo-4-(p…
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) | 2.57 | 3.49 | -142.67 | 1 | 8 | -2 | 118 | 373.372 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.11 | 5.03 | -54.02 | 2 | 8 | -1 | 115 | 374.38 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 218 | MolMall (formerly Molecular Diversity Preservation International) |