| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 22 | Yes |
Popular Name: 2-[(3-butoxypropylamino)methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[(3-butoxypropylamino)methyl]-…
| 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) | 2.70 | 6.84 | -59.19 | 3 | 5 | 1 | 72 | 324.47 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 5.77 | -47.53 | 2 | 5 | 0 | 75 | 323.462 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.70 | 5.41 | -13.4 | 2 | 5 | 0 | 67 | 323.462 | 9 | ↓ |
