In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2006 | 21 | Yes |
Popular Name: 2-phenacylsulfanyl-6-(trifluoromethyl)-3H-pyrimidin-4-one 2-phenacylsulfanyl-6-(trifluorom…
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) | 3.89 | 4.56 | -38.85 | 0 | 4 | -1 | 66 | 313.28 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.89 | -0.69 | -13.37 | 1 | 4 | 0 | 63 | 314.288 | 5 | ↓ |