In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2007 | 22 | Yes |
Popular Name: 1,3-dimethyl-6-[[5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]pyrimidine-2,4-dione 1,3-dimethyl-6-[[5-(trifluoromet…
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) | 1.89 | 1.89 | -10.72 | 0 | 5 | 0 | 56 | 331.319 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.89 | 2.04 | -52.56 | 1 | 5 | 1 | 58 | 332.327 | 4 | ↓ |