In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2004 | 25 | Yes |
Popular Name: 2-[[3-(4-bromophenyl)-1H-1,2,4-triazol-5-yl]thio]-N-(4-ethylphenyl)acetamide 2-[[3-(4-bromophenyl)-1H-1,2,4-t…
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) | 4.95 | 9.75 | -18.7 | 2 | 5 | 0 | 71 | 417.332 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.95 | 9.59 | -44.27 | 1 | 5 | -1 | 69 | 416.324 | 6 | ↓ |