General Information of the Compound
| Compound ID |
CP0571435
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| Compound Name |
4-(azetidin-1-yl)-N-[[2-chloro-4-(methanesulfonamido)phenyl]methyl]benzamide
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| Structure |
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| Formula |
C18H20ClN3O3S
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| Molecular Weight |
393.896
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| Canonical SMILES |
CS(=O)(=O)Nc1ccc(CNC(=O)c2ccc(cc2)N2CCC2)c(Cl)c1
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| InChI |
InChI=1S/C18H20ClN3O3S/c1-26(24,25)21-15-6-3-14(17(19)11-15)12-20-18(23)13-4-7-16(8-5-13)22-9-2-10-22/h3-8,11,21H,2,9-10,12H2,1H3,(H,20,23)
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| InChIKey |
AAKFEGALHSLAOA-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