General Information of the Compound
| Compound ID |
CP0243637
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| Compound Name |
US9340555, 66
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| Structure |
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| Formula |
C30H32FN5O3S
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| Molecular Weight |
561.683
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| Canonical SMILES |
Cc1ccc(F)c(NC(=O)Nc2ccc(Oc3ccnc4cc(sc34)C(=O)NCCCN3CCCCC3)cc2)c1
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| InChI |
InChI=1S/C30H32FN5O3S/c1-20-6-11-23(31)24(18-20)35-30(38)34-21-7-9-22(10-8-21)39-26-12-14-32-25-19-27(40-28(25)26)29(37)33-13-5-17-36-15-3-2-4-16-36/h6-12,14,18-19H,2-5,13,15-17H2,1H3,(H,33,37)(H2,34,35,38)
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| InChIKey |
LIRCRNNNGSPSBY-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: PT01142, Vascular endothelial growth factor receptor 1
Protein ID: PT00864, Vascular endothelial growth factor receptor 2