| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 15 | No |
Popular Name: 4-Amino-5-(5-chloro-2-fluorophenyl)-4H-1,2,4-triazole-3-thiol 4-Amino-5-(5-chloro-2-fluorophen…
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CAS Numbers: , 1152520-62-1
4H-1,2,4-triazole-3-thiol, 4-amino-5-(5-chloro-2-fluorophenyl)-
| 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) | 2.44 | 5.82 | -42.44 | 2 | 4 | -1 | 57 | 243.674 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.72 | 5.79 | -9.37 | 3 | 4 | 0 | 60 | 244.682 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
