| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 15 | No |
Popular Name: 4-Amino-5-(2,3-dichlorophenyl)-4H-1,2,4-triazole-3-thiol 4-Amino-5-(2,3-dichlorophenyl)-4…
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CAS Numbers: , 1152598-94-1
4H-1,2,4-triazole-3-thiol, 4-amino-5-(2,3-dichlorophenyl)-
| 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) | 2.93 | 5.93 | -42.27 | 2 | 4 | -1 | 57 | 260.129 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 6.26 | -10.97 | 3 | 4 | 0 | 60 | 261.137 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
