In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2004 | 23 | No |
Popular Name: 5-(4-butoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl hydrosulfide 5-(4-butoxyphenyl)-4-phenyl-4H-1…
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) | 5.06 | 11.52 | -49.8 | 0 | 4 | -1 | 40 | 324.429 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.33 | 11.67 | -12.15 | 1 | 4 | 0 | 43 | 325.437 | 6 | ↓ |