General Information of the Compound
| Compound ID |
CP0207108
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| Compound Name |
(4S)-4-[2,4-difluoro-5-[[[(2R)-1,1,1-trifluoropropan-2-yl]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 |
C[C@@H](NCc1cc(c(F)cc1F)[C@]1(C)CCSC(N)=N1)C(F)(F)F
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| InChI |
InChI=1S/C15H18F5N3S/c1-8(15(18,19)20)22-7-9-5-10(12(17)6-11(9)16)14(2)3-4-24-13(21)23-14/h5-6,8,22H,3-4,7H2,1-2H3,(H2,21,23)/t8-,14+/m1/s1
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| InChIKey |
STUTWXRFWQRASH-CLAHSXSESA-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