In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2009 | 27 | No |
Popular Name: 2-[[4-phenyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4H-1,2,4-triazol-3-yl)acetamide 2-[[4-phenyl-5-(3-pyridyl)-1,2,4…
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) | 1.46 | 9.3 | -47.73 | 1 | 9 | -1 | 121 | 377.413 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.45 | 10.05 | -16.77 | 2 | 9 | 0 | 118 | 378.421 | 5 | ↓ |