In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2006 | 28 | Yes |
Popular Name: 2-[[4-benzyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile 2-[[4-benzyl-5-(4-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) | 4.10 | 2.38 | -15.08 | 0 | 5 | 0 | 67 | 383.48 | 6 | ↓ |