General Information of the Compound
| Compound ID |
CP0410933
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| Compound Name |
N-[3-[(4S)-2-amino-6-(fluoromethyl)-4-methyl-1,3-oxazin-4-yl]-4-fluorophenyl]-3-chloro-5-cyanopyridine-2-carboxamide
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| Structure |
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| Formula |
C19H14ClF2N5O2
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| Molecular Weight |
417.803
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| Canonical SMILES |
C[C@]1(C=C(CF)OC(N)=N1)c1cc(NC(=O)c2ncc(cc2Cl)C#N)ccc1F
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| InChI |
InChI=1S/C19H14ClF2N5O2/c1-19(6-12(7-21)29-18(24)27-19)13-5-11(2-3-15(13)22)26-17(28)16-14(20)4-10(8-23)9-25-16/h2-6,9H,7H2,1H3,(H2,24,27)(H,26,28)/t19-/m0/s1
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| InChIKey |
IVXNPNJKLCMFDG-IBGZPJMESA-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