| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 21 | Yes |
Popular Name: 2-[(2-phenylsulfanylethylamino)methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[(2-phenylsulfanylethylamino)m…
| 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) | 2.92 | 4.55 | -52.91 | 2 | 4 | 0 | 65 | 317.439 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.92 | 3.21 | -48.8 | 1 | 4 | -1 | 61 | 316.431 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 5.28 | -23.03 | 2 | 4 | 0 | 58 | 317.439 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 7.18 | -61.25 | 3 | 4 | 1 | 62 | 318.447 | 6 | ↓ |
