| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2010 | 17 | Yes |
Popular Name: 1-(4-isopropyl-5-methyl-1,2,4-triazol-3-yl)cycloheptanamine 1-(4-isopropyl-5-methyl-1,2,4-tr…
| 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) | 2.25 | 5.98 | -35.93 | 3 | 4 | 1 | 58 | 237.371 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 5.76 | -8.07 | 2 | 4 | 0 | 57 | 236.363 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
