In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 26th, 2011 | 19 | Yes |
Popular Name: 6-methyl-4-oxo-N-(4H-1,2,4-triazol-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide 6-methyl-4-oxo-N-(4H-1,2,4-triaz…
None
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) | -1.08 | 2.8 | -27.72 | 3 | 9 | 0 | 130 | 260.213 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.62 | 0.48 | -112.03 | 1 | 9 | -2 | 131 | 258.197 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.56 | -1.01 | -118.78 | 1 | 9 | -2 | 139 | 258.197 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.62 | 0.65 | -47.45 | 2 | 9 | -1 | 133 | 259.205 | 2 | ↓ |
Mid Mid (pH 6-8) | -1.01 | 1.12 | -63.03 | 2 | 9 | -1 | 136 | 259.205 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.