General Information of the Compound
| Compound ID |
CP0486646
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| Compound Name |
methyl 2-[1'-[(4-chlorophenyl)methyl]-2-oxospiro[indole-3,4'-piperidine]-1-yl]acetate
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| Structure |
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| Formula |
C22H23ClN2O3
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| Molecular Weight |
398.89
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| Canonical SMILES |
COC(=O)CN1C(=O)C2(CCN(Cc3ccc(Cl)cc3)CC2)c2ccccc12
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| InChI |
InChI=1S/C22H23ClN2O3/c1-28-20(26)15-25-19-5-3-2-4-18(19)22(21(25)27)10-12-24(13-11-22)14-16-6-8-17(23)9-7-16/h2-9H,10-15H2,1H3
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| InChIKey |
OPEWYHQKYXJQHX-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