| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2005 | 15 | No |
Popular Name: 4-amino-5-(2-cyclohexylethyl)-4H-1,2,4-triazole-3-thiol 4-amino-5-(2-cyclohexylethyl)-4H…
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CAS Number: 854036-02-5
| 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) | 1.86 | 6.9 | -9.81 | 3 | 4 | 0 | 60 | 226.349 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.58 | 6.75 | -40.17 | 2 | 4 | -1 | 57 | 225.341 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
