| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 16 | Yes |
Popular Name: (5-Pyridin-4-yl-4 H -[1,2,4]triazol-3-ylsulfanyl)-acetic acid (5-Pyridin-4-yl-4 H -[1,2,4]tria…
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CAS Number: 3652-29-7
(5-Pyridin-4-yl-4 H -[1,2,4]triazol-3-ylsulfanyl)-
2-{[5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
| 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) | 0.38 | -3.07 | -47.95 | 1 | 6 | -1 | 94 | 235.248 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.