General Information of the Compound
| Compound ID |
CP0534901
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| Compound Name |
(4S,6S)-4-(3-chlorothiophen-2-yl)-6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-methyl-5,6-dihydro-1,3-thiazin-2-amine
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| Structure |
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| Formula |
C14H16ClN3OS2
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| Molecular Weight |
341.889
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| Canonical SMILES |
Cc1noc(C)c1[C@@H]1C[C@](C)(N=C(N)S1)c1sccc1Cl
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| InChI |
InChI=1S/C14H16ClN3OS2/c1-7-11(8(2)19-18-7)10-6-14(3,17-13(16)21-10)12-9(15)4-5-20-12/h4-5,10H,6H2,1-3H3,(H2,16,17)/t10-,14-/m0/s1
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| InChIKey |
PDCWPTMYTUVZQA-HZMBPMFUSA-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