In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 26 | Yes |
Popular Name: 2-(diethylaminomethyl)-3-[(2-fluorophenyl)methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one 2-(diethylaminomethyl)-3-[(2-flu…
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) | 3.78 | 12.87 | -56.18 | 1 | 4 | 1 | 39 | 374.505 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.78 | 10.66 | -15.62 | 0 | 4 | 0 | 38 | 373.497 | 6 | ↓ |