| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 27 | Yes |
Popular Name: N-[2-(isopropylamino)-2-oxo-ethyl]-5-(5-isoquinolyloxymethyl)isoxazole-3-carboxamide N-[2-(isopropylamino)-2-oxo-ethy…
| 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) | 2.09 | 3.78 | -15.83 | 2 | 8 | 0 | 106 | 368.393 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.09 | 4.24 | -43.18 | 3 | 8 | 1 | 108 | 369.401 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
