| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2009 | 21 | No |
Popular Name: 5,6-dimethyl-3-[(1S)-1-(3-pyridyl)ethyl]-2-sulfanyl-thieno[2,3-d]pyrimidin-4-one 5,6-dimethyl-3-[(1S)-1-(3-pyridy…
| 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) | 2.12 | 8.13 | -10.46 | 1 | 4 | 0 | 51 | 317.439 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.58 | 7.33 | -37.89 | 0 | 4 | -1 | 54 | 316.431 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.12 | 8.63 | -32.98 | 2 | 4 | 1 | 52 | 318.447 | 2 | ↓ |
