General Information of the Compound
| Compound ID |
CP0570366
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| Compound Name |
ethyl 8-methoxy-4-[6-(2-methoxyphenyl)-6-azabicyclo[3.1.1]heptan-3-yl]quinoline-3-carboxylate
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| Formula |
C26H28N2O4
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| Molecular Weight |
432.52
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| Canonical SMILES |
CCOC(=O)c1cnc2c(OC)cccc2c1C1CC2CC(C1)N2c1ccccc1OC
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| InChI |
InChI=1S/C26H28N2O4/c1-4-32-26(29)20-15-27-25-19(8-7-11-23(25)31-3)24(20)16-12-17-14-18(13-16)28(17)21-9-5-6-10-22(21)30-2/h5-11,15-18H,4,12-14H2,1-3H3
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| InChIKey |
KOJJJUABEXCEIC-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