In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 22 | Yes |
Popular Name: 5,6-dimethyl-2-[(2-morpholinoethylamino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one 5,6-dimethyl-2-[(2-morpholinoeth…
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) | 0.88 | 2.97 | -61.7 | 3 | 6 | 1 | 75 | 323.442 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.34 | 1.92 | -48.61 | 2 | 6 | 0 | 78 | 322.434 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.88 | 1.56 | -13.69 | 2 | 6 | 0 | 70 | 322.434 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.88 | 3.88 | -51.69 | 3 | 6 | 1 | 71 | 323.442 | 5 | ↓ |