In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 25th, 2008 | 21 | No |
Popular Name: (5Z)-5-[(3-fluorophenyl)methylene]-2-(3-pyridylamino)thiazol-4-one (5Z)-5-[(3-fluorophenyl)methylen…
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) | 3.71 | 6.36 | -10.75 | 1 | 4 | 0 | 58 | 299.33 | 2 | ↓ |
Ref Reference (pH 7) | 3.22 | 5.93 | -41.66 | 0 | 4 | -1 | 57 | 298.322 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.17 | 4.67 | -45.55 | 0 | 4 | -1 | 61 | 298.322 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.22 | 6.38 | -36.29 | 1 | 4 | 0 | 58 | 299.33 | 3 | ↓ |