General Information of the Compound
| Compound ID |
CP0466588
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| Compound Name |
2-amino-1-[3-(4-chloro-3-fluoroanilino)-2-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone
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| Structure |
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| Formula |
C20H18ClF2N5O
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| Molecular Weight |
417.847
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| Canonical SMILES |
NCC(=O)N1CCn2c(C1)nc(c2Nc1ccc(Cl)c(F)c1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C20H18ClF2N5O/c21-15-6-5-14(9-16(15)23)25-20-19(12-1-3-13(22)4-2-12)26-17-11-27(18(29)10-24)7-8-28(17)20/h1-6,9,25H,7-8,10-11,24H2
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| InChIKey |
NFEGRCPLFOJJLU-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