General Information of the Compound
| Compound ID |
CP0574434
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| Compound Name |
N-[2-[acetyl(1,3-benzoxazol-6-yl)amino]pyridin-4-yl]-2-(2-chloro-3-fluorophenyl)acetamide
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| Structure |
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| Formula |
C22H16ClFN4O3
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| Molecular Weight |
438.846
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| Canonical SMILES |
CC(=O)N(c1ccc2ncoc2c1)c1cc(NC(=O)Cc2cccc(F)c2Cl)ccn1
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| InChI |
InChI=1S/C22H16ClFN4O3/c1-13(29)28(16-5-6-18-19(11-16)31-12-26-18)20-10-15(7-8-25-20)27-21(30)9-14-3-2-4-17(24)22(14)23/h2-8,10-12H,9H2,1H3,(H,25,27,30)
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| InChIKey |
HNSUJQJYBMBJCE-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