| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2010 | 15 | Yes |
Popular Name: 3-(1-amino-4-ethyl-cyclohexyl)-1,4-dihydro-1,2,4-triazol-5-one 3-(1-amino-4-ethyl-cyclohexyl)-1…
| 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) | 0.95 | 0.51 | -56.67 | 5 | 5 | 1 | 89 | 211.289 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.95 | 0.56 | -6.79 | 4 | 5 | 0 | 88 | 210.281 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
