| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 19 | Yes |
Popular Name: 2-[4-[[3-(1-amino-1-methyl-ethyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]ethanol 2-[4-[[3-(1-amino-1-methyl-ethyl…
| 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) | -0.71 | -4.91 | -43.95 | 4 | 7 | 1 | 93 | 270.357 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.71 | -5.15 | -8.84 | 3 | 7 | 0 | 92 | 269.349 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.71 | -2.63 | -102.12 | 5 | 7 | 2 | 94 | 271.365 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.71 | -2.57 | -91.62 | 5 | 7 | 2 | 94 | 271.365 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
