General Information of the Compound
| Compound ID |
CP0207155
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| Compound Name |
(4S)-4-[2,4-difluoro-5-[[methyl(2,2,2-trifluoroethyl)amino]methyl]phenyl]-4-methyl-5,6-dihydro-1,3-thiazin-2-amine
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| Structure |
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| Formula |
C15H18F5N3S
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| Molecular Weight |
367.387
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| Canonical SMILES |
CN(Cc1cc(c(F)cc1F)[C@]1(C)CCSC(N)=N1)CC(F)(F)F
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| InChI |
InChI=1S/C15H18F5N3S/c1-14(3-4-24-13(21)22-14)10-5-9(11(16)6-12(10)17)7-23(2)8-15(18,19)20/h5-6H,3-4,7-8H2,1-2H3,(H2,21,22)/t14-/m0/s1
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| InChIKey |
RHXHFXVYZBDQQN-AWEZNQCLSA-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