| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 26th, 2010 | 17 | Yes |
Popular Name: 5-[(4-ethylpiperazin-1-yl)methyl]-3-isopropyl-1,2,4-oxadiazole 5-[(4-ethylpiperazin-1-yl)methyl…
| 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) | 1.15 | 3.33 | -38.35 | 1 | 5 | 1 | 47 | 239.343 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.15 | 3.35 | -39.7 | 1 | 5 | 1 | 47 | 239.343 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.15 | 1.07 | -6.25 | 0 | 5 | 0 | 45 | 238.335 | 4 | ↓ |
