General Information of the Compound
| Compound ID |
CP0564523
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| Compound Name |
4-(3-ethenyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-propan-2-ylpyrido[2,3-d]pyrimidin-2-one
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| Structure |
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| Formula |
C24H22F2N6O2
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| Molecular Weight |
464.476
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| Canonical SMILES |
CC(C)n1c2nc(c(F)cc2c(nc1=O)N1CCn2c(C1)cnc2C=C)-c1c(O)cccc1F
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| InChI |
InChI=1S/C24H22F2N6O2/c1-4-19-27-11-14-12-30(8-9-31(14)19)22-15-10-17(26)21(20-16(25)6-5-7-18(20)33)28-23(15)32(13(2)3)24(34)29-22/h4-7,10-11,13,33H,1,8-9,12H2,2-3H3
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| InChIKey |
WBMLTPYQIMMAFA-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