| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2008 | 20 | Yes |
Popular Name: 3-[[2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic 3-[[2-[(5-methyl-4H-1,2,4-triazo…
| 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) | 1.09 | 5.3 | -63.59 | 2 | 7 | -1 | 111 | 291.312 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.09 | 5.1 | -108.5 | 1 | 7 | -2 | 109 | 290.304 | 5 | ↓ |
