General Information of the Compound
| Compound ID |
CP0902934
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| Compound Name |
N-(4-(4-(2,4-difluorophenoxy)piperidin-1-yl)-2-methoxypyrimidin-5-yl)-2-methoxy-6-methylnicotinamide
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| Structure |
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| Formula |
C24H25F2N5O4
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| Molecular Weight |
485.491
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| Canonical SMILES |
COc1ncc(NC(=O)c2ccc(C)nc2OC)c(N2CCC(Oc3ccc(F)cc3F)CC2)n1
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| InChI |
InChI=1S/C24H25F2N5O4/c1-14-4-6-17(23(28-14)33-2)22(32)29-19-13-27-24(34-3)30-21(19)31-10-8-16(9-11-31)35-20-7-5-15(25)12-18(20)26/h4-7,12-13,16H,8-11H2,1-3H3,(H,29,32)
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| InChIKey |
SMBGFNAQVSAXHV-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