In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 19 | Yes |
Popular Name: 2-(ethylamino)-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]acetamide 2-(ethylamino)-N-methyl-N-[(4-ox…
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) | -0.21 | 3.78 | -52.62 | 3 | 6 | 1 | 83 | 281.361 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.24 | 1.01 | -67.35 | 2 | 6 | 0 | 86 | 280.353 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.24 | -0.36 | -60.81 | 1 | 6 | -1 | 81 | 279.345 | 5 | ↓ |