In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 20 | No |
Popular Name: 5,6-dimethyl-2-sulfanyl-3-[2-[(2S)-tetrahydrofuran-2-yl]ethyl]thieno[2,3-d]pyrimidin-4-one 5,6-dimethyl-2-sulfanyl-3-[2-[(2…
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) | 2.04 | 7.77 | -10.98 | 1 | 4 | 0 | 47 | 310.444 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.50 | 6.62 | -40.44 | 0 | 4 | -1 | 50 | 309.436 | 3 | ↓ |