General Information of the Compound
| Compound ID |
CP0156136
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| Compound Name |
N-[4-[4-(2-chloro-5-methylphenyl)piperazin-1-yl]butyl]-2-oxo-3H-1,3-benzoxazole-5-carboxamide
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| Structure |
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| Formula |
C23H27ClN4O3
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| Molecular Weight |
442.947
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| Canonical SMILES |
Cc1ccc(Cl)c(c1)N1CCN(CCCCNC(=O)c2ccc3oc(=O)[nH]c3c2)CC1
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| InChI |
InChI=1S/C23H27ClN4O3/c1-16-4-6-18(24)20(14-16)28-12-10-27(11-13-28)9-3-2-8-25-22(29)17-5-7-21-19(15-17)26-23(30)31-21/h4-7,14-15H,2-3,8-13H2,1H3,(H,25,29)(H,26,30)
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| InChIKey |
DMKAPLAWGQGMFL-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