| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2010 | 16 | Yes |
Popular Name: N-[(5-ethyl-2-methyl-1,2,4-triazol-3-yl)methyl]aniline N-[(5-ethyl-2-methyl-1,2,4-triaz…
| 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) | 1.48 | 5.82 | -7.4 | 1 | 4 | 0 | 43 | 216.288 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.48 | 6.25 | -32.28 | 2 | 4 | 1 | 44 | 217.296 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
