General Information of the Compound
| Compound ID |
CP0560611
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| Compound Name |
US8653125, Ia-15
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| Formula |
C24H27N3O4
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| Molecular Weight |
421.497
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| Canonical SMILES |
CC(C)n1c2ccc(NC(=O)[C@@H]3CC[C@@H](CC3)NC(=O)c3ccccc3)cc2oc1=O
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| InChI |
InChI=1S/C24H27N3O4/c1-15(2)27-20-13-12-19(14-21(20)31-24(27)30)26-23(29)17-8-10-18(11-9-17)25-22(28)16-6-4-3-5-7-16/h3-7,12-15,17-18H,8-11H2,1-2H3,(H,25,28)(H,26,29)/t17-,18+
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| InChIKey |
XTYOJYXLFHVAHM-HDICACEKSA-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