General Information of the Compound
| Compound ID |
CP0845573
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| Compound Name |
(R)-2-(N-(4-(5-(3-cyano-4-isopropoxyphenyl)-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl)sulfamoyl)acetic acid
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| Structure |
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| Formula |
C23H22N4O6S
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| Molecular Weight |
482.518
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| Canonical SMILES |
CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@H]4NS(=O)(=O)CC(=O)O)no2)cc1C#N
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| InChI |
InChI=1S/C23H22N4O6S/c1-13(2)32-20-9-6-14(10-15(20)11-24)23-25-22(26-33-23)18-5-3-4-17-16(18)7-8-19(17)27-34(30,31)12-21(28)29/h3-6,9-10,13,19,27H,7-8,12H2,1-2H3,(H,28,29)/t19-/m1/s1
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| InChIKey |
WHWVBRZUGHVNRS-LJQANCHMSA-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