In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2011 | 22 | Yes |
Popular Name: N-cyclohexyl-2-[(6-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide N-cyclohexyl-2-[(6-methyl-4-oxo-…
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) | 3.45 | 5.28 | -16.34 | 2 | 5 | 0 | 75 | 337.47 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.91 | 3.81 | -48.14 | 1 | 5 | -1 | 78 | 336.462 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.