In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 21 | No |
Popular Name: 2-sulfanyl-3-[3-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-4-one 2-sulfanyl-3-[3-(trifluoromethyl…
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) | 3.16 | 8.69 | -13.87 | 1 | 3 | 0 | 38 | 328.34 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 7.38 | -40.99 | 0 | 3 | -1 | 41 | 327.332 | 2 | ↓ |