In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 5th, 2005 | 24 | Yes |
Popular Name: 2-[[4-(3,4-dimethylphenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile 2-[[4-(3,4-dimethylphenyl)-5-(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) | 3.66 | 3.21 | -8.98 | 0 | 5 | 0 | 67 | 335.436 | 4 | ↓ |