In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2006 | 21 | Yes |
Popular Name: 6-phenyl-2-(2-pyridylmethylsulfanyl)-3H-pyrimidin-4-one 6-phenyl-2-(2-pyridylmethylsulfa…
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 | 5.43 | -53.38 | 0 | 4 | -1 | 62 | 294.359 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.71 | -3.22 | -14.91 | 1 | 4 | 0 | 58 | 295.367 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.25 | -1.65 | -44.35 | 2 | 4 | 1 | 59 | 296.375 | 4 | ↓ |