| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2010 | 17 | Yes |
Popular Name: 2-chloro-4-(5-ethyl-1H-1,2,4-triazol-3-yl)-5-methoxy-aniline 2-chloro-4-(5-ethyl-1H-1,2,4-tri…
| 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) | 2.24 | 3.96 | -8.96 | 3 | 5 | 0 | 77 | 252.705 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.24 | 4.3 | -29.93 | 4 | 5 | 1 | 78 | 253.713 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.24 | 4.08 | -25.92 | 4 | 5 | 1 | 78 | 253.713 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
