In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2006 | 17 | Yes |
Popular Name: 2-isopentylsulfanyl-6-(trifluoromethyl)-3H-pyrimidin-4-one 2-isopentylsulfanyl-6-(trifluoro…
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) | 4.40 | 3.77 | -37.76 | 0 | 3 | -1 | 49 | 265.28 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.40 | -0.43 | -9.33 | 1 | 3 | 0 | 46 | 266.288 | 5 | ↓ |