In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2004 | 32 | Yes |
Popular Name: 2-[[4-keto-5-(p-tolyl)-1H-thieno[2,3-d]pyrimidin-2-yl]thio]-N-(1-naphthyl)acetamide 2-[[4-keto-5-(p-tolyl)-1H-thieno…
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) | 6.35 | 11.36 | -19.36 | 2 | 5 | 0 | 75 | 457.58 | 5 | ↓ |
Hi High (pH 8-9.5) | 6.81 | 10.13 | -49.38 | 1 | 5 | -1 | 78 | 456.572 | 5 | ↓ |