| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2008 | 28 | No |
Popular Name: 3-nitro-5-[[2-[[5-(4-pyridyl)-4H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic 3-nitro-5-[[2-[[5-(4-pyridyl)-4H…
| 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) | 1.74 | 7.26 | -56.48 | 2 | 11 | -1 | 170 | 399.368 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.74 | 7.06 | -97.4 | 1 | 11 | -2 | 168 | 398.36 | 7 | ↓ |
