General Information of the Compound
| Compound ID |
CP0427743
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| Compound Name |
2-{5-chloro-1'-[(4-phenoxyphenyl)methyl]-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-2,2',5'-trione}acetic acid
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| Structure |
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| Formula |
C26H19ClN2O6
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| Molecular Weight |
490.899
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| Canonical SMILES |
OC(=O)CN1C(=O)C2(CC(=O)N(Cc3ccc(Oc4ccccc4)cc3)C2=O)c2cc(Cl)ccc12
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| InChI |
InChI=1S/C26H19ClN2O6/c27-17-8-11-21-20(12-17)26(24(33)28(21)15-23(31)32)13-22(30)29(25(26)34)14-16-6-9-19(10-7-16)35-18-4-2-1-3-5-18/h1-12H,13-15H2,(H,31,32)
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| InChIKey |
KWYXKZZDLCISSC-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