| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2011 | 18 | Yes |
Popular Name: (1S)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]ethanamine (1S)-1-(3-ethyl-1,2,4-oxadiazol-…
| 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) | 0.57 | 0.35 | -42.56 | 2 | 6 | 1 | 68 | 255.342 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.57 | -0.84 | -7.14 | 1 | 6 | 0 | 63 | 254.334 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.57 | 2.78 | -106.33 | 3 | 6 | 2 | 69 | 256.35 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.57 | 1.58 | -41.55 | 2 | 6 | 1 | 65 | 255.342 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
