General Information of the Compound
| Compound ID |
CP0954258
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| Compound Name |
O-Benzyl-N-({6-[(E)-2-(4-chlorophenyl)ethenyl]imidazo[1,2-a]pyridin-2-yl}carbonyl)tyrosine
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| Structure |
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| Formula |
C32H26ClN3O4
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| Molecular Weight |
552.03
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| Canonical SMILES |
O=C(NC(Cc1ccc(OCc2ccccc2)cc1)C(=O)O)c1cn2cc(/C=C/c3ccc(Cl)cc3)ccc2n1
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| InChI |
InChI=1S/C32H26ClN3O4/c33-26-13-8-22(9-14-26)6-7-24-12-17-30-34-29(20-36(30)19-24)31(37)35-28(32(38)39)18-23-10-15-27(16-11-23)40-21-25-4-2-1-3-5-25/h1-17,19-20,28H,18,21H2,(H,35,37)(H,38,39)/b7-6+
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| InChIKey |
YQZVKGGJYBCUIZ-VOTSOKGWSA-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