General Information of the Compound
| Compound ID |
CP0563345
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| Compound Name |
US8637502, 85
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| Structure |
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| Formula |
C24H33N3O4
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| Molecular Weight |
427.545
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| Canonical SMILES |
COC(=O)c1ccc2NC(=O)CC(=O)N(C3CCN(CC3)C3CCCCCCC3)c2c1
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| InChI |
InChI=1S/C24H33N3O4/c1-31-24(30)17-9-10-20-21(15-17)27(23(29)16-22(28)25-20)19-11-13-26(14-12-19)18-7-5-3-2-4-6-8-18/h9-10,15,18-19H,2-8,11-14,16H2,1H3,(H,25,28)
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| InChIKey |
CKQQEQPCLLSEQM-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