General Information of the Compound
| Compound ID |
CP0567623
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| Compound Name |
US9278960, 2-26
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| Structure |
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| Formula |
C21H23N3O3
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| Molecular Weight |
365.433
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| Canonical SMILES |
NC(=O)c1cc(C2CCCCC2)c2ccc(CN3C(=O)CCC3=O)cc2n1
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| InChI |
InChI=1S/C21H23N3O3/c22-21(27)18-11-16(14-4-2-1-3-5-14)15-7-6-13(10-17(15)23-18)12-24-19(25)8-9-20(24)26/h6-7,10-11,14H,1-5,8-9,12H2,(H2,22,27)
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| InChIKey |
CLUOEBHFBUOQEH-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