In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 22nd, 2009 | 24 | Yes |
Popular Name: 3-[(4-chlorophenyl)methyl]-2-(dimethylaminomethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one 3-[(4-chlorophenyl)methyl]-2-(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) | 3.59 | 11.76 | -56.94 | 1 | 4 | 1 | 39 | 362.906 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.59 | 9.31 | -11.81 | 0 | 4 | 0 | 38 | 361.898 | 4 | ↓ |