| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2011 | 17 | Yes |
Popular Name: 3-isopropyl-5-[(1S)-1-(4-methylpiperazin-1-yl)ethyl]-1,2,4-oxadiazole 3-isopropyl-5-[(1S)-1-(4-methylp…
| 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) | 1.33 | 2.89 | -39.58 | 1 | 5 | 1 | 47 | 239.343 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.33 | 0.5 | -6.29 | 0 | 5 | 0 | 45 | 238.335 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
