| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 18 | Yes |
Popular Name: 3-[(1S)-1-ethylpentyl]-4-(2-thienyl)isoxazol-5-amine 3-[(1S)-1-ethylpentyl]-4-(2-thie…
| 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) | 4.57 | 6.03 | -5.7 | 2 | 3 | 0 | 52 | 264.394 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.57 | 5.96 | -26.43 | 3 | 3 | 1 | 53 | 265.402 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
