In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 23 | Yes |
Popular Name: 5-(4-chlorophenyl)-2-[(2-methoxyethylamino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one 5-(4-chlorophenyl)-2-[(2-methoxy…
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) | 2.79 | 4.48 | -20.26 | 2 | 5 | 0 | 67 | 349.843 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.79 | 4.94 | -11.31 | 2 | 5 | 0 | 67 | 349.843 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.79 | 5.87 | -58.61 | 3 | 5 | 1 | 72 | 350.851 | 6 | ↓ |