In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 21 | No |
Popular Name: 3-(5-quinolyl)-2-sulfanyl-thieno[2,3-d]pyrimidin-4-one 3-(5-quinolyl)-2-sulfanyl-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) | 2.54 | 8.39 | -17.03 | 1 | 4 | 0 | 51 | 311.391 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.00 | 7.08 | -45.97 | 0 | 4 | -1 | 54 | 310.383 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.54 | 8.82 | -39.69 | 2 | 4 | 1 | 52 | 312.399 | 1 | ↓ |