General Information of the Compound
| Compound ID |
CP0575020
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| Compound Name |
[1-methyl-6-[5-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrazin-2-yl]oxyindol-2-yl]-[4-[[4-(2,2,2-trifluoroethoxy)phenyl]methyl]piperazin-1-yl]methanone
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| Structure |
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| Formula |
C35H30F3N7O4
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| Molecular Weight |
669.664
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| Canonical SMILES |
Cn1c(cc2ccc(Oc3cnc(cn3)-c3nc(no3)-c3ccccc3)cc12)C(=O)N1CCN(Cc2ccc(OCC(F)(F)F)cc2)CC1
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| InChI |
InChI=1S/C35H30F3N7O4/c1-43-29-18-27(48-31-20-39-28(19-40-31)33-41-32(42-49-33)24-5-3-2-4-6-24)12-9-25(29)17-30(43)34(46)45-15-13-44(14-16-45)21-23-7-10-26(11-8-23)47-22-35(36,37)38/h2-12,17-20H,13-16,21-22H2,1H3
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| InChIKey |
RGJYPCHOXLONBA-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