In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2008 | 26 | No |
Popular Name: 2-[[5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-nitrophenyl)acetamide 2-[[5-(4-chlorophenyl)-4H-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) | 3.84 | 8.93 | -29.8 | 2 | 8 | 0 | 116 | 389.824 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.84 | 8.77 | -51.45 | 1 | 8 | -1 | 115 | 388.816 | 6 | ↓ |