| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 3rd, 2011 | 22 | Yes |
Popular Name: 2-[[2-(1H-triazol-5-ylsulfanyl)acetyl]amino]terephthalic 2-[[2-(1H-triazol-5-ylsulfanyl)a…
| 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) | 1.24 | 4.2 | -100.59 | 2 | 9 | -2 | 151 | 320.286 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.24 | 4.19 | -157.9 | 1 | 9 | -3 | 149 | 319.278 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.