In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 21st, 2010 | 25 | No |
Popular Name: (5Z)-5-[[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylene]-2-(1-piperidyl)thiazol-4-one (5Z)-5-[[3-(4-fluorophenyl)-1H-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) | 3.32 | 7.59 | -16.35 | 1 | 5 | 0 | 62 | 356.426 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.32 | 8.47 | -29.65 | 2 | 5 | 1 | 63 | 357.434 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.