General Information of the Compound
| Compound ID |
CP0460338
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| Compound Name |
1-[4-[(4S,6S)-2-amino-4-(2,4-difluorophenyl)-4-methyl-5,6-dihydro-1,3-thiazin-6-yl]-3-methyl-1,2-oxazol-5-yl]-2-methylpropan-2-ol
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| Structure |
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| Formula |
C19H23F2N3O2S
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| Molecular Weight |
395.475
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| Canonical SMILES |
Cc1noc(CC(C)(C)O)c1[C@@H]1C[C@](C)(N=C(N)S1)c1ccc(F)cc1F
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| InChI |
InChI=1S/C19H23F2N3O2S/c1-10-16(14(26-24-10)8-18(2,3)25)15-9-19(4,23-17(22)27-15)12-6-5-11(20)7-13(12)21/h5-7,15,25H,8-9H2,1-4H3,(H2,22,23)/t15-,19-/m0/s1
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| InChIKey |
ACFHKZODPNAMLG-KXBFYZLASA-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