General Information of the Compound
| Compound ID |
CP0173674
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| Compound Name |
US9233968, 12
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| Structure |
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| Formula |
C26H22N6O2
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| Molecular Weight |
450.502
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| Canonical SMILES |
Cc1cccc(NC(=O)Nc2ccc(cc2)C#Cc2ccc3nc(NC(=O)C4CC4)cn3n2)c1
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| InChI |
InChI=1S/C26H22N6O2/c1-17-3-2-4-22(15-17)28-26(34)27-20-10-5-18(6-11-20)7-12-21-13-14-24-29-23(16-32(24)31-21)30-25(33)19-8-9-19/h2-6,10-11,13-16,19H,8-9H2,1H3,(H,30,33)(H2,27,28,34)
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| InChIKey |
POLGOZRSBQTGFR-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: PT00844, Platelet-derived growth factor receptor beta
Protein ID: PT00864, Vascular endothelial growth factor receptor 2