General Information of the Compound
| Compound ID |
CP0459001
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| Compound Name |
7-(4-pyrimidin-2-ylpiperazin-1-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-8-carbonitrile
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| Structure |
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| Formula |
C18H16F3N7
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| Molecular Weight |
387.369
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| Canonical SMILES |
FC(F)(F)Cc1cnc2c(C#N)c(ccn12)N1CCN(CC1)c1ncccn1
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| InChI |
InChI=1S/C18H16F3N7/c19-18(20,21)10-13-12-25-16-14(11-22)15(2-5-28(13)16)26-6-8-27(9-7-26)17-23-3-1-4-24-17/h1-5,12H,6-10H2
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| InChIKey |
IEDYNHIHAZMUGE-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