General Information of the Compound
| Compound ID |
CP0481501
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| Compound Name |
5-(4-bromophenyl)-3-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-1-(2,4-dichlorophenyl)-N-phenyl-1H-pyrazole-4-carboxamide
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| Structure |
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| Formula |
C28H22BrCl2N5O2
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| Molecular Weight |
611.327
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| Canonical SMILES |
CC(C)(C)c1nnc(o1)-c1nn(c(c1C(=O)Nc1ccccc1)-c1ccc(Br)cc1)-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C28H22BrCl2N5O2/c1-28(2,3)27-34-33-26(38-27)23-22(25(37)32-19-7-5-4-6-8-19)24(16-9-11-17(29)12-10-16)36(35-23)21-14-13-18(30)15-20(21)31/h4-15H,1-3H3,(H,32,37)
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| InChIKey |
UVFWCIGTUOMCPO-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