General Information of the Compound
| Compound ID |
CP0285166
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| Compound Name |
[3-[(4-chlorophenyl)-(2-chloropyridin-3-yl)methoxy]azetidin-1-yl]-(4-methylpiperazin-1-yl)methanone
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| Structure |
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| Formula |
C21H24Cl2N4O2
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| Molecular Weight |
435.355
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| Canonical SMILES |
CN1CCN(CC1)C(=O)N1CC(C1)OC(c1ccc(Cl)cc1)c1cccnc1Cl
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| InChI |
InChI=1S/C21H24Cl2N4O2/c1-25-9-11-26(12-10-25)21(28)27-13-17(14-27)29-19(15-4-6-16(22)7-5-15)18-3-2-8-24-20(18)23/h2-8,17,19H,9-14H2,1H3
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| InChIKey |
XFOVJUTVLYZJKU-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