General Information of the Compound
| Compound ID |
CP0566714
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| Compound Name |
US9199981, F30
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| Structure |
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| Formula |
C22H19N5O2
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| Molecular Weight |
385.427
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| Canonical SMILES |
Cc1ccc(cc1NC(=O)c1cnc2ccccn12)-c1noc(n1)C1CC(=C)C1
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| InChI |
InChI=1S/C22H19N5O2/c1-13-9-16(10-13)22-25-20(26-29-22)15-7-6-14(2)17(11-15)24-21(28)18-12-23-19-5-3-4-8-27(18)19/h3-8,11-12,16H,1,9-10H2,2H3,(H,24,28)
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| InChIKey |
VCGZRAXATKIMPO-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