In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 25 | Yes |
Popular Name: 5-(2-fluorophenyl)-2-[(4-methyl-1-piperidyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one 5-(2-fluorophenyl)-2-[(4-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) | 3.64 | 10.68 | -51.7 | 2 | 4 | 1 | 50 | 358.462 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.10 | 8.25 | -44.66 | 1 | 4 | 0 | 53 | 357.454 | 3 | ↓ |