In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2009 | 26 | Yes |
Popular Name: 2-[(4-benzyl-1-piperidyl)methyl]-5,6-dimethyl-3H-thieno[3,2-e]pyrimidin-4-one 2-[(4-benzyl-1-piperidyl)methyl]…
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) | 3.83 | 12.13 | -54.46 | 2 | 4 | 1 | 50 | 368.526 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.29 | 11.09 | -43.37 | 1 | 4 | 0 | 53 | 367.518 | 4 | ↓ |