General Information of the Compound
| Compound ID |
CP0501956
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| Compound Name |
methyl 2-[1'-(1,2-dihydroacenaphthylen-5-yl)-2-oxospiro[indole-3,4'-piperidine]-1-yl]acetate
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| Structure |
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| Formula |
C27H26N2O3
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| Molecular Weight |
426.516
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| Canonical SMILES |
COC(=O)CN1C(=O)C2(CCN(CC2)c2ccc3CCc4cccc2c34)c2ccccc12
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| InChI |
InChI=1S/C27H26N2O3/c1-32-24(30)17-29-23-8-3-2-7-21(23)27(26(29)31)13-15-28(16-14-27)22-12-11-19-10-9-18-5-4-6-20(22)25(18)19/h2-8,11-12H,9-10,13-17H2,1H3
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| InChIKey |
WKJSHBYKAXVOOR-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