General Information of the Compound
| Compound ID |
CP0949761
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| Compound Name |
US8993565, 122
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| Structure |
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| Formula |
C19H21N5O4
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| Molecular Weight |
383.408
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| Canonical SMILES |
NC(=O)C1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)cc(=O)[nH]1
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| InChI |
InChI=1S/C19H21N5O4/c20-19(27)14-9-12-3-1-2-4-13(12)24(14)18(26)10-15-21-16(11-17(25)22-15)23-5-7-28-8-6-23/h1-4,11,14H,5-10H2,(H2,20,27)(H,21,22,25)
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| InChIKey |
BCZAGMGRZQXCFT-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