| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 26 | Yes |
Popular Name: 5-(5-isoquinolyloxymethyl)-N-[(2S)-2-methoxybutyl]isoxazole-3-carboxamide 5-(5-isoquinolyloxymethyl)-N-[(2…
| 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) | 2.66 | 5.21 | -12.47 | 1 | 7 | 0 | 86 | 355.394 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.66 | 5.48 | -39.92 | 2 | 7 | 1 | 88 | 356.402 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
