| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 19 | Yes |
Popular Name: 5,6-dimethyl-2-[(pentylamino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one 5,6-dimethyl-2-[(pentylamino)met…
| 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) | 2.95 | 6.78 | -56.73 | 3 | 4 | 1 | 62 | 280.417 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 5.36 | -11.43 | 2 | 4 | 0 | 58 | 279.409 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 5.72 | -45.62 | 2 | 4 | 0 | 65 | 279.409 | 6 | ↓ |
