In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 24 | Yes |
Popular Name: 2-(diethylaminomethyl)-5-(2,4-dimethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one 2-(diethylaminomethyl)-5-(2,4-di…
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) | 3.95 | 10.51 | -47.29 | 2 | 4 | 1 | 50 | 342.488 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.41 | 8.12 | -40.08 | 1 | 4 | 0 | 53 | 341.48 | 5 | ↓ |