| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 22 | Yes |
Popular Name: 4-(3-chlorophenyl)-5-[(4-methylbenzyl)thio]-4H-1,2,4-triazol-3-ol 4-(3-chlorophenyl)-5-[(4-methylb…
None
| 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) | 4.66 | 9.46 | -49.28 | 0 | 4 | -1 | 54 | 330.82 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.21 | 10.3 | -10.57 | 1 | 4 | 0 | 51 | 331.828 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.