In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 4th, 2011 | 22 | No |
Popular Name: (6S)-N-(4-fluorophenyl)-2,5-dimethyl-4-oxo-6H-thieno[2,3-d]pyrimidine-6-carboxamide (6S)-N-(4-fluorophenyl)-2,5-dime…
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) | 1.68 | 4.39 | -21.23 | 1 | 5 | 0 | 72 | 317.345 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.86 | 3.07 | -35.33 | 0 | 5 | -1 | 78 | 316.337 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.