General Information of the Compound
| Compound ID |
CP0528535
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| Compound Name |
(4S,6S)-4-(2,4-difluorophenyl)-4-methyl-6-(2-methylpyrazol-3-yl)-5,6-dihydro-1,3-thiazin-2-amine
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| Structure |
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| Formula |
C15H16F2N4S
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| Molecular Weight |
322.384
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| Canonical SMILES |
Cn1nccc1[C@@H]1C[C@](C)(N=C(N)S1)c1ccc(F)cc1F
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| InChI |
InChI=1S/C15H16F2N4S/c1-15(10-4-3-9(16)7-11(10)17)8-13(22-14(18)20-15)12-5-6-19-21(12)2/h3-7,13H,8H2,1-2H3,(H2,18,20)/t13-,15-/m0/s1
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| InChIKey |
AQTZKSPPMGVOHN-ZFWWWQNUSA-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