General Information of the Compound
| Compound ID |
CP0468704
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| Compound Name |
4-[5-[[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]methoxy]pyridin-2-yl]-2-fluoro-N-methoxy-N-methylbenzamide
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| Structure |
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| Formula |
C26H30FN5O3
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| Molecular Weight |
479.556
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| Canonical SMILES |
CCc1cnc(nc1)N1CCC(COc2ccc(nc2)-c2ccc(C(=O)N(C)OC)c(F)c2)CC1
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| InChI |
InChI=1S/C26H30FN5O3/c1-4-18-14-29-26(30-15-18)32-11-9-19(10-12-32)17-35-21-6-8-24(28-16-21)20-5-7-22(23(27)13-20)25(33)31(2)34-3/h5-8,13-16,19H,4,9-12,17H2,1-3H3
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| InChIKey |
FMBAIPKCWKWRAK-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