General Information of the Compound
| Compound ID |
CP0428629
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| Compound Name |
(1-(4-chlorobenzyl)-2-methyl-5-phenyl-1H-pyrrol-3-yl)(phenyl)methanone
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| Structure |
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| Formula |
C25H20ClNO
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| Molecular Weight |
385.894
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| Canonical SMILES |
Cc1c(cc(-c2ccccc2)n1Cc1ccc(Cl)cc1)C(=O)c1ccccc1
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| InChI |
InChI=1S/C25H20ClNO/c1-18-23(25(28)21-10-6-3-7-11-21)16-24(20-8-4-2-5-9-20)27(18)17-19-12-14-22(26)15-13-19/h2-16H,17H2,1H3
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| InChIKey |
UUBMXYXJLNBFCN-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