General Information of the Compound
| Compound ID |
CP0556292
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| Compound Name |
1-[6-(3-ethoxyphenyl)-3-methyl-6-bicyclo[3.1.0]hexanyl]-4-(6-methoxypyridin-2-yl)piperazine
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| Structure |
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| Formula |
C25H33N3O2
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| Molecular Weight |
407.558
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| Canonical SMILES |
CCOc1cccc(c1)C1(C2CC(C)CC12)N1CCN(CC1)c1cccc(OC)n1
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| InChI |
InChI=1S/C25H33N3O2/c1-4-30-20-8-5-7-19(17-20)25(21-15-18(2)16-22(21)25)28-13-11-27(12-14-28)23-9-6-10-24(26-23)29-3/h5-10,17-18,21-22H,4,11-16H2,1-3H3
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| InChIKey |
TUAILPCAUJWQFS-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound