General Information of the Compound
| Compound ID |
CP0513619
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| Compound Name |
(4S)-3-[2-[[(1S)-1-[1-(4-chlorophenyl)imidazol-4-yl]ethyl]amino]-5-fluoropyrimidin-4-yl]-4-methyl-1,3-oxazolidin-2-one
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| Structure |
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| Formula |
C19H18ClFN6O2
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| Molecular Weight |
416.844
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| Canonical SMILES |
C[C@H](Nc1ncc(F)c(n1)N1[C@@H](C)COC1=O)c1cn(cn1)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C19H18ClFN6O2/c1-11-9-29-19(28)27(11)17-15(21)7-22-18(25-17)24-12(2)16-8-26(10-23-16)14-5-3-13(20)4-6-14/h3-8,10-12H,9H2,1-2H3,(H,22,24,25)/t11-,12-/m0/s1
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| InChIKey |
DAWINSQXUWPTBL-RYUDHWBXSA-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