In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 16 | No |
Popular Name: 3-ethyl-2-sulfanyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one 3-ethyl-2-sulfanyl-3,5,6,7-tetra…
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) | 1.83 | 7.33 | -10.84 | 1 | 3 | 0 | 38 | 252.364 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.29 | 6.87 | -38.61 | 0 | 3 | -1 | 41 | 251.356 | 1 | ↓ |