General Information of the Compound
| Compound ID |
CP0384448
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| Compound Name |
N-[4-(4-chloro-3-methylphenoxy)butyl]-5-methyl-1,3-thiazol-2-amine
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| Structure |
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| Formula |
C15H19ClN2OS
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| Molecular Weight |
310.85
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| Canonical SMILES |
Cc1cnc(NCCCCOc2ccc(Cl)c(C)c2)s1
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| InChI |
InChI=1S/C15H19ClN2OS/c1-11-9-13(5-6-14(11)16)19-8-4-3-7-17-15-18-10-12(2)20-15/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,17,18)
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| InChIKey |
OBVLZUKCGOFSJH-UHFFFAOYSA-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