| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 17 | Yes |
Popular Name: (2S)-2-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]pentan-2-amine (2S)-2-[3-(4-pyridyl)-1,2,4-oxad…
| 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) | 2.01 | 1.89 | -47.69 | 3 | 5 | 1 | 79 | 233.295 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 1.64 | -7 | 2 | 5 | 0 | 78 | 232.287 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.01 | 2.35 | -95.03 | 4 | 5 | 2 | 81 | 234.303 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
