General Information of the Compound
| Compound ID |
CP0438249
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| Compound Name |
US9238644, 14
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| Structure |
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| Formula |
C22H24ClN7O
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| Molecular Weight |
437.935
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| Canonical SMILES |
NC(=O)C1(CC1)c1ccccc1CCc1nc(Nc2cnn(c2)C2CNC2)ncc1Cl
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| InChI |
InChI=1S/C22H24ClN7O/c23-18-12-26-21(28-15-9-27-30(13-15)16-10-25-11-16)29-19(18)6-5-14-3-1-2-4-17(14)22(7-8-22)20(24)31/h1-4,9,12-13,16,25H,5-8,10-11H2,(H2,24,31)(H,26,28,29)
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| InChIKey |
HQRUNGNEQLUCLO-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
Protein ID: PT00864, Vascular endothelial growth factor receptor 2
Protein ID: PT00925, Vascular endothelial growth factor receptor 3