In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2008 | 20 | No |
Popular Name: 5-phenyl-4-[(3R)-quinuclidin-3-yl]-1,2,4-triazole-3-thiol 5-phenyl-4-[(3R)-quinuclidin-3-y…
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) | 2.94 | 8.76 | -43.39 | 1 | 4 | 0 | 35 | 286.404 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.21 | 8.92 | -36.45 | 2 | 4 | 1 | 38 | 287.412 | 2 | ↓ |