In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 24 | No |
Popular Name: 6-oxo-1-phenyl-N-[(1R)-1-(2-pyridyl)ethyl]-4,5-dihydro-1,2,4-triazine-3-carboxamide 6-oxo-1-phenyl-N-[(1R)-1-(2-pyri…
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) | 0.80 | 5 | -11.07 | 2 | 7 | 0 | 87 | 323.356 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.80 | 5.19 | -41.4 | 3 | 7 | 1 | 88 | 324.364 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.