General Information of the Compound
| Compound ID |
CP0493932
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| Compound Name |
5-(4-bromophenyl)-5-(cyclopentylmethyl)imidazo[2,1-a]isoindole
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| Structure |
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| Formula |
C22H21BrN2
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| Molecular Weight |
393.328
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| Canonical SMILES |
Brc1ccc(cc1)C1(CC2CCCC2)c2ccccc2-c2nccn12
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| InChI |
InChI=1S/C22H21BrN2/c23-18-11-9-17(10-12-18)22(15-16-5-1-2-6-16)20-8-4-3-7-19(20)21-24-13-14-25(21)22/h3-4,7-14,16H,1-2,5-6,15H2
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| InChIKey |
OOWKLQUZUCQUED-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