| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2011 | 25 | Yes |
Popular Name: N-[(3R)-3-hydroxybutyl]-5-(5-isoquinolyloxymethyl)isoxazole-3-carboxamide N-[(3R)-3-hydroxybutyl]-5-(5-iso…
| 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) | 1.45 | 2.7 | -13.8 | 2 | 7 | 0 | 97 | 341.367 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.45 | 3.17 | -41.15 | 3 | 7 | 1 | 99 | 342.375 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
