In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2009 | 17 | Yes |
Popular Name: 2,4-dioxo-N-(4H-1,2,4-triazol-3-ylmethyl)-1H-pyrimidine-5-carboxamide 2,4-dioxo-N-(4H-1,2,4-triazol-3-…
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) | -2.76 | -1.8 | -17.28 | 4 | 9 | 0 | 136 | 236.191 | 3 | ↓ |
Mid Mid (pH 6-8) | -2.31 | -3.71 | -38.92 | 3 | 9 | -1 | 139 | 235.183 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.