In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 28 | Yes |
Popular Name: 2-(diethylaminomethyl)-5,6-dimethyl-3-[2-(3-methylphenoxy)ethyl]thieno[2,3-d]pyrimidin-4-one 2-(diethylaminomethyl)-5,6-dimet…
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) | 4.18 | 13.45 | -55.42 | 1 | 5 | 1 | 49 | 400.568 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.18 | 11.3 | -16.48 | 0 | 5 | 0 | 47 | 399.56 | 8 | ↓ |