General Information of the Compound
| Compound ID |
CP0566442
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| Compound Name |
2-[5'-chloro-3-methyl-1-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methyl]-2,2',5-trioxospiro[imidazolidine-4,3'-indole]-1'-yl]acetic acid
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| Structure |
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| Formula |
C24H19ClN4O6
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| Molecular Weight |
494.891
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| Canonical SMILES |
CN1C(=O)N(Cc2c(C)onc2-c2ccccc2)C(=O)C11C(=O)N(CC(O)=O)c2ccc(Cl)cc12
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| InChI |
InChI=1S/C24H19ClN4O6/c1-13-16(20(26-35-13)14-6-4-3-5-7-14)11-29-22(33)24(27(2)23(29)34)17-10-15(25)8-9-18(17)28(21(24)32)12-19(30)31/h3-10H,11-12H2,1-2H3,(H,30,31)
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| InChIKey |
RMADDVYTNGVQCK-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