In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 23 | Yes |
Popular Name: 5-[(4-fluorophenyl)methylamino]-1,3-dimethyl-pyrido[3,2-e]pyrimidine-2,4-dione 5-[(4-fluorophenyl)methylamino]-…
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) | 1.21 | 7.27 | -9.62 | 1 | 6 | 0 | 69 | 314.32 | 3 | ↓ |
Mid Mid (pH 6-8) | -2.52 | 7.56 | -46.27 | 2 | 6 | 1 | 71 | 315.328 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.