General Information of the Compound
| Compound ID |
CP0570670
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| Compound Name |
[4-[1-methyl-6-[5-[3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]pyrazin-2-yl]oxyindole-2-carbonyl]piperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone
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| Structure |
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| Formula |
C35H25F6N7O4
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| Molecular Weight |
721.618
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| Canonical SMILES |
Cn1c(cc2ccc(Oc3cnc(cn3)-c3nc(no3)-c3ccc(cc3)C(F)(F)F)cc12)C(=O)N1CCN(CC1)C(=O)c1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C35H25F6N7O4/c1-46-27-17-25(51-29-19-42-26(18-43-29)31-44-30(45-52-31)20-2-7-23(8-3-20)34(36,37)38)11-6-22(27)16-28(46)33(50)48-14-12-47(13-15-48)32(49)21-4-9-24(10-5-21)35(39,40)41/h2-11,16-19H,12-15H2,1H3
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| InChIKey |
RPDFNHYWZLSDTH-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