General Information of the Compound
| Compound ID |
CP0521190
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| Compound Name |
2-[3-(3,5-difluorophenyl)-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl]-N-[(4R)-3-methyl-2,5-dioxo-1',3'-dihydrospiro[imidazolidine-4,2'-indene]-5'-yl]acetamide
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| Structure |
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| Formula |
C27H21F2N5O4
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| Molecular Weight |
517.492
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| Canonical SMILES |
CN1C(=O)NC(=O)[C@]11Cc2ccc(NC(=O)Cn3c4ccccc4n(-c4cc(F)cc(F)c4)c3=O)cc2C1
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| InChI |
InChI=1S/C27H21F2N5O4/c1-32-25(37)31-24(36)27(32)12-15-6-7-19(8-16(15)13-27)30-23(35)14-33-21-4-2-3-5-22(21)34(26(33)38)20-10-17(28)9-18(29)11-20/h2-11H,12-14H2,1H3,(H,30,35)(H,31,36,37)/t27-/m1/s1
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| InChIKey |
MLXHPMSHFIOVTD-HHHXNRCGSA-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