In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 16 | Yes |
Popular Name: 2-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]ethanol 2-[4-[(3-methyl-1,2,4-oxadiazol-…
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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) | -0.92 | -1.04 | -41.78 | 2 | 6 | 1 | 67 | 227.288 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.92 | -0.97 | -38.62 | 2 | 6 | 1 | 67 | 227.288 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.92 | -3.3 | -8.84 | 1 | 6 | 0 | 66 | 226.28 | 4 | ↓ |