General Information of the Compound
| Compound ID |
CP0918063
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| Compound Name |
1-(4-chlorophenyl)-3-(4-(3-(piperidin-1-yl)propoxy)phenyl)urea
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| Structure |
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| Formula |
C21H26ClN3O2
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| Molecular Weight |
387.911
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| Canonical SMILES |
O=C(Nc1ccc(Cl)cc1)Nc1ccc(OCCCN2CCCCC2)cc1
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| InChI |
InChI=1S/C21H26ClN3O2/c22-17-5-7-18(8-6-17)23-21(26)24-19-9-11-20(12-10-19)27-16-4-15-25-13-2-1-3-14-25/h5-12H,1-4,13-16H2,(H2,23,24,26)
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| InChIKey |
ZXMMHDYMQYJAGB-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