In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2005 | 29 | Yes |
Popular Name: 2-[[5-(4-pyridyl)-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine 2-[[5-(4-pyridyl)-4-[3-(trifluor…
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) | 3.99 | 2.61 | -12.5 | 0 | 5 | 0 | 56 | 413.428 | 6 | ↓ |