In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2011 | 20 | Yes |
Popular Name: 3-tert-butyl-5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole 3-tert-butyl-5-[[4-(2-methoxyeth…
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) | 1.42 | 3.06 | -37.9 | 1 | 6 | 1 | 56 | 283.396 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.42 | 0.73 | -7.44 | 0 | 6 | 0 | 55 | 282.388 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.42 | 2.99 | -40.87 | 1 | 6 | 1 | 56 | 283.396 | 6 | ↓ |