In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2008 | 23 | No |
Popular Name: 2-(4-fluorophenyl)-4-[(3-hydroxyanilino)methylene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one 2-(4-fluorophenyl)-4-[(3-hydroxy…
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) | 2.39 | 5.83 | -17.48 | 2 | 5 | 0 | 67 | 311.316 | 3 | ↓ |
Ref Reference (pH 7) | 2.39 | 5.84 | -15.29 | 2 | 5 | 0 | 67 | 311.316 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.91 | 4.2 | -38.13 | 3 | 5 | 1 | 72 | 312.324 | 3 | ↓ |