| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 21 | Yes |
Popular Name: 3-[3-(2-aminoethoxy)anilino]-1-isopropyl-pyrazin-2-one 3-[3-(2-aminoethoxy)anilino]-1-i…
| 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) | 1.44 | 4.69 | -49.54 | 4 | 6 | 1 | 84 | 289.359 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 4.31 | -10.79 | 3 | 6 | 0 | 82 | 288.351 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.44 | 4.86 | -85.89 | 5 | 6 | 2 | 85 | 290.367 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
