In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2011 | 27 | Yes |
Popular Name: 4-[7-(2,6-difluorophenyl)sulfonyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]morpholine 4-[7-(2,6-difluorophenyl)sulfony…
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) | 1.45 | 6.22 | -13.72 | 0 | 7 | 0 | 76 | 396.419 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.45 | 6.66 | -42.55 | 1 | 7 | 1 | 77 | 397.427 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.