| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 21 | Yes |
Popular Name: 2-[(3-isopropoxypropylamino)methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[(3-isopropoxypropylamino)meth…
| 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) | 2.00 | 6.03 | -59.38 | 3 | 5 | 1 | 72 | 310.443 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.46 | 4.98 | -47.61 | 2 | 5 | 0 | 75 | 309.435 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 4.6 | -13.61 | 2 | 5 | 0 | 67 | 309.435 | 7 | ↓ |
