General Information of the Compound
| Compound ID |
CP0442424
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| Compound Name |
2-[3-(1,1-dioxo-1-thiolan-3-yl)-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 |
C25H25N5O6S
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| Molecular Weight |
523.571
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| Canonical SMILES |
CN1C(=O)NC(=O)[C@]11Cc2ccc(NC(=O)Cn3c4ccccc4n(C4CCS(=O)(=O)C4)c3=O)cc2C1
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| InChI |
InChI=1S/C25H25N5O6S/c1-28-23(33)27-22(32)25(28)11-15-6-7-17(10-16(15)12-25)26-21(31)13-29-19-4-2-3-5-20(19)30(24(29)34)18-8-9-37(35,36)14-18/h2-7,10,18H,8-9,11-14H2,1H3,(H,26,31)(H,27,32,33)/t18?,25-/m1/s1
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| InChIKey |
MUJODSURWGPHBP-IXXGTQFESA-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