General Information of the Compound
| Compound ID |
CP0560049
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| Compound Name |
1-[4-[5-(4-chlorophenyl)-1,3-benzoxazol-2-yl]butyl]-3-pyridin-4-ylimidazolidin-2-one
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| Structure |
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| Formula |
C25H23ClN4O2
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| Molecular Weight |
446.938
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| Canonical SMILES |
Clc1ccc(cc1)-c1ccc2oc(CCCCN3CCN(C3=O)c3ccncc3)nc2c1
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| InChI |
InChI=1S/C25H23ClN4O2/c26-20-7-4-18(5-8-20)19-6-9-23-22(17-19)28-24(32-23)3-1-2-14-29-15-16-30(25(29)31)21-10-12-27-13-11-21/h4-13,17H,1-3,14-16H2
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| InChIKey |
WDRGAUGICGXAOS-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