| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2008 | 14 | No |
Popular Name: 4-amino-5-(4-fluorophenyl)-4H-1,2,4-triazole-3-thiol 4-amino-5-(4-fluorophenyl)-4H-1,…
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 61019-25-8
4-Amino-3-(4-fluorophenyl)-5-Mercapto-4H-1,2,4-Triazole
4-Amino-3-(4-fluorophenyl)-5-mercapto-4H-[1,2,4]TRIAZOLE
4-Amino-5-(4-fluoro-phenyl)-4H-[1,2,4]triazole-3-thiol
4-amino-5-(4-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-amino-5-(4-fluorophenyl)-4H-[1,2,4]TRIAZOLE-3-thiol
| 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) | 1.84 | 5.25 | -43.33 | 2 | 4 | -1 | 57 | 209.229 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 5.4 | -14.15 | 3 | 4 | 0 | 60 | 210.237 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
