General Information of the Compound
| Compound ID |
CP0446476
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| Compound Name |
methyl 2-[2-oxo-1'-(4-oxo-4-phenylbutanoyl)spiro[indole-3,4'-piperidine]-1-yl]acetate
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| Structure |
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| Formula |
C25H26N2O5
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| Molecular Weight |
434.492
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| Canonical SMILES |
COC(=O)CN1C(=O)C2(CCN(CC2)C(=O)CCC(=O)c2ccccc2)c2ccccc12
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| InChI |
InChI=1S/C25H26N2O5/c1-32-23(30)17-27-20-10-6-5-9-19(20)25(24(27)31)13-15-26(16-14-25)22(29)12-11-21(28)18-7-3-2-4-8-18/h2-10H,11-17H2,1H3
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| InChIKey |
RNIKEYISRYJJBB-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