| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 18 | Yes |
Popular Name: (1S)-1-[5-(8-quinolyl)-1,2,4-oxadiazol-3-yl]ethanamine (1S)-1-[5-(8-quinolyl)-1,2,4-oxa…
| 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) | -0.46 | 2.18 | -46.32 | 3 | 5 | 1 | 79 | 241.274 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.46 | 1.86 | -14.28 | 2 | 5 | 0 | 78 | 240.266 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
