In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2011 | 21 | Yes |
Popular Name: 3-tert-butyl-5-[[4-(2-ethoxyethyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole 3-tert-butyl-5-[[4-(2-ethoxyethy…
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) | 1.80 | 4.01 | -37.99 | 1 | 6 | 1 | 56 | 297.423 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.80 | 1.7 | -7.37 | 0 | 6 | 0 | 55 | 296.415 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.80 | 3.96 | -40.74 | 1 | 6 | 1 | 56 | 297.423 | 7 | ↓ |