| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2010 | 18 | No |
Popular Name: 4-(5-ethyl-2-methyl-1,2,4-triazol-3-yl)-2-nitro-aniline 4-(5-ethyl-2-methyl-1,2,4-triazo…
| 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) | 1.60 | 5.47 | -9.99 | 2 | 7 | 0 | 103 | 247.258 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.60 | 5.95 | -35 | 3 | 7 | 1 | 104 | 248.266 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
