In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2011 | 29 | Yes |
Popular Name: N-(4-anilinophenyl)-2-[(6-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide N-(4-anilinophenyl)-2-[(6-methyl…
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) | 5.24 | 7.78 | -18.95 | 3 | 6 | 0 | 87 | 422.535 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.69 | 6.33 | -50.12 | 2 | 6 | -1 | 90 | 421.527 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.