| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2004 | 14 | No |
Popular Name: 4-Amino-5-(2-fluoro-phenyl)-4H-[1,2,4]triazole-3-thiol 4-Amino-5-(2-fluoro-phenyl)-4H-[…
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 565174-22-3 , [565174-22-3]
4-amino-5-(2-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) | 1.79 | 4.84 | -50.28 | 2 | 4 | -1 | 57 | 209.229 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 4.99 | -14.56 | 3 | 4 | 0 | 60 | 210.237 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 173 - 175 | Enamine Building Blocks |
| MP | 173...175 | Enamine Building Blocks |
| MP | 184 - 186 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
