| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2010 | 18 | Yes |
Popular Name: (1R)-2-(4-isopropyl-5-methyl-1,2,4-triazol-3-yl)-1-phenyl-ethanamine (1R)-2-(4-isopropyl-5-methyl-1,2…
| 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) | -0.31 | 7.07 | -51.56 | 3 | 4 | 1 | 58 | 245.35 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.31 | 6.74 | -11.22 | 2 | 4 | 0 | 57 | 244.342 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
