General Information of the Compound
| Compound ID |
CP0497384
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| Compound Name |
3-Butyl-2-phenyl-quinoline-4-carboxylic acid (1-phenyl-propyl)-amide
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| Structure |
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| Formula |
C29H30N2O
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| Molecular Weight |
422.572
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| Canonical SMILES |
CCCCc1c(nc2ccccc2c1C(=O)NC(CC)c1ccccc1)-c1ccccc1
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| InChI |
InChI=1S/C29H30N2O/c1-3-5-18-24-27(29(32)31-25(4-2)21-14-8-6-9-15-21)23-19-12-13-20-26(23)30-28(24)22-16-10-7-11-17-22/h6-17,19-20,25H,3-5,18H2,1-2H3,(H,31,32)
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| InChIKey |
RBDFPECNPXDUQF-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