General Information of the Compound
| Compound ID |
CP0553250
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| Compound Name |
6-(4-ethylpiperazin-1-yl)-2-oxo-N-(4-phenylbutyl)-1,3-benzoxazole-3-carboxamide
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| Structure |
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| Formula |
C24H30N4O3
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| Molecular Weight |
422.529
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| Canonical SMILES |
CCN1CCN(CC1)c1ccc2n(C(=O)NCCCCc3ccccc3)c(=O)oc2c1
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| InChI |
InChI=1S/C24H30N4O3/c1-2-26-14-16-27(17-15-26)20-11-12-21-22(18-20)31-24(30)28(21)23(29)25-13-7-6-10-19-8-4-3-5-9-19/h3-5,8-9,11-12,18H,2,6-7,10,13-17H2,1H3,(H,25,29)
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| InChIKey |
ZMXGDZLUFFFOLR-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