In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: 2-(4-chloro-3-fluoro-phenyl)-4-phenyl-1H-pyrimidin-6-one 2-(4-chloro-3-fluoro-phenyl)-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) | 4.24 | 8.62 | -9.89 | 1 | 3 | 0 | 46 | 300.72 | 2 | ↓ |
Hi High (pH 8-9.5) | 4.69 | 6.75 | -48.58 | 0 | 3 | -1 | 49 | 299.712 | 2 | ↓ |