| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2010 | 20 | Yes |
Popular Name: 3-methyl-4-(2-methyl-5-phenyl-1,2,4-triazol-3-yl)aniline 3-methyl-4-(2-methyl-5-phenyl-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) | 3.14 | 7.6 | -10.39 | 2 | 4 | 0 | 57 | 264.332 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.14 | 8.05 | -24.42 | 3 | 4 | 1 | 58 | 265.34 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
