General Information of the Compound
| Compound ID |
CP0556929
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| Compound Name |
US8772323, 254
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| Structure |
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| Formula |
C20H15N3O4
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| Molecular Weight |
361.357
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| Canonical SMILES |
COC(=O)c1cccc(c1)-c1nc2ccc(cc2o1)-c1n[nH]c(=O)cc1C
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| InChI |
InChI=1S/C20H15N3O4/c1-11-8-17(24)22-23-18(11)12-6-7-15-16(10-12)27-19(21-15)13-4-3-5-14(9-13)20(25)26-2/h3-10H,1-2H3,(H,22,24)
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| InChIKey |
KMODMXXEOFIHGF-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