General Information of the Compound
| Compound ID |
CP0425450
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| Compound Name |
N-[2-(3,5-difluoroanilino)-2-oxoethyl]-N-(oxolan-3-yl)-4-pyridin-2-ylbenzamide
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| Structure |
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| Formula |
C24H21F2N3O3
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| Molecular Weight |
437.446
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| Canonical SMILES |
Fc1cc(F)cc(NC(=O)CN(C2CCOC2)C(=O)c2ccc(cc2)-c2ccccn2)c1
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| InChI |
InChI=1S/C24H21F2N3O3/c25-18-11-19(26)13-20(12-18)28-23(30)14-29(21-8-10-32-15-21)24(31)17-6-4-16(5-7-17)22-3-1-2-9-27-22/h1-7,9,11-13,21H,8,10,14-15H2,(H,28,30)
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| InChIKey |
DAFMVEZUPOFELN-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