General Information of the Compound
| Compound ID |
CP0579821
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| Compound Name |
6-butyl-3-[3-(5-chloro-3-fluoropyridin-2-yl)pyrrolidine-1-carbonyl]-5-(N-ethylanilino)-4-hydroxy-1H-pyridin-2-one
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| Structure |
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| Formula |
C27H30ClFN4O3
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| Molecular Weight |
513.013
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| Canonical SMILES |
CCCCc1nc(O)c(C(=O)N2CCC(C2)c2ncc(Cl)cc2F)c(O)c1N(CC)c1ccccc1
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| InChI |
InChI=1S/C27H30ClFN4O3/c1-3-5-11-21-24(33(4-2)19-9-7-6-8-10-19)25(34)22(26(35)31-21)27(36)32-13-12-17(16-32)23-20(29)14-18(28)15-30-23/h6-10,14-15,17H,3-5,11-13,16H2,1-2H3,(H2,31,34,35)
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| InChIKey |
OGMUISOOSRJCSC-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