General Information of the Compound
| Compound ID |
CP0500559
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| Compound Name |
N-[4-chloro-2-[(4,5-dimethoxy-1,3-dioxoisoindol-2-yl)methyl]phenyl]pyridine-2-carboxamide
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| Structure |
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| Formula |
C23H18ClN3O5
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| Molecular Weight |
451.866
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| Canonical SMILES |
COc1ccc2C(=O)N(Cc3cc(Cl)ccc3NC(=O)c3ccccn3)C(=O)c2c1OC
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| InChI |
InChI=1S/C23H18ClN3O5/c1-31-18-9-7-15-19(20(18)32-2)23(30)27(22(15)29)12-13-11-14(24)6-8-16(13)26-21(28)17-5-3-4-10-25-17/h3-11H,12H2,1-2H3,(H,26,28)
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| InChIKey |
SJHOBQFHMCXFIG-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