| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 22nd, 2011 | 21 | No |
Popular Name: N-[(E)-(2,4-dimethoxyphenyl)methyleneamino]-5-ethylsulfanyl-4H-1,2,4-triazol-3-amine N-[(E)-(2,4-dimethoxyphenyl)meth…
| 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) | 2.34 | 7.6 | -16.27 | 2 | 7 | 0 | 84 | 307.379 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.34 | 7.11 | -52.03 | 1 | 7 | -1 | 83 | 306.371 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
