| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2009 | 15 | No |
Popular Name: 4-amino-5-[(2R)-2,4,4-trimethylpentyl]-1,2,4-triazole-3-thiol 4-amino-5-[(2R)-2,4,4-trimethylp…
| 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 | 6.6 | -9.54 | 3 | 4 | 0 | 60 | 228.365 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.56 | 6.32 | -40.88 | 2 | 4 | -1 | 57 | 227.357 | 4 | ↓ |
