In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 21 | Yes |
Popular Name: 6-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methylsulfanyl]pyridine-3-carboxylic 6-[(4-oxo-3H-thieno[3,2-d]pyrimi…
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) | 1.72 | 5.84 | -51.16 | 1 | 6 | -1 | 99 | 318.359 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.18 | 3.34 | -99.1 | 0 | 6 | -2 | 102 | 317.351 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.