In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 28 | Yes |
Popular Name: 3-[[2-(diethylaminomethyl)-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoic 3-[[2-(diethylaminomethyl)-5,6-d…
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) | 3.55 | 13.08 | -101.62 | 1 | 6 | 0 | 79 | 399.516 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.55 | 11.05 | -68.61 | 0 | 6 | -1 | 78 | 398.508 | 7 | ↓ |