In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 24 | Yes |
Popular Name: 2-[4-methyl-6-oxo-2-(4-pyridyl)-1H-pyrimidin-5-yl]-N-phenyl-acetamide 2-[4-methyl-6-oxo-2-(4-pyridyl)-…
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) | 1.64 | 5.84 | -17.54 | 2 | 6 | 0 | 88 | 320.352 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.09 | 3.99 | -57.49 | 1 | 6 | -1 | 91 | 319.344 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.64 | 6.3 | -52.88 | 3 | 6 | 1 | 89 | 321.36 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.