General Information of the Compound
| Compound ID |
CP0557254
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| Compound Name |
N-[1-[4-(azetidin-1-ylmethyl)phenyl]sulfonylpiperidin-4-yl]-5-cyclopropyl-1,2-oxazole-3-carboxamide
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| Structure |
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| Formula |
C22H28N4O4S
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| Molecular Weight |
444.557
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| Canonical SMILES |
O=C(NC1CCN(CC1)S(=O)(=O)c1ccc(CN2CCC2)cc1)c1cc(on1)C1CC1
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| InChI |
InChI=1S/C22H28N4O4S/c27-22(20-14-21(30-24-20)17-4-5-17)23-18-8-12-26(13-9-18)31(28,29)19-6-2-16(3-7-19)15-25-10-1-11-25/h2-3,6-7,14,17-18H,1,4-5,8-13,15H2,(H,23,27)
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| InChIKey |
RIGDNKZOWGMEFG-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