In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 26 | Yes |
Popular Name: 5-(3,4-dimethylphenyl)-2-[(4-methyl-1-piperidyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one 5-(3,4-dimethylphenyl)-2-[(4-met…
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) | 4.35 | 11.85 | -50.65 | 2 | 4 | 1 | 50 | 368.526 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.81 | 9.32 | -42.95 | 1 | 4 | 0 | 53 | 367.518 | 3 | ↓ |