General Information of the Compound
| Compound ID |
CP0431237
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| Compound Name |
4-(4-chlorophenyl)-2-(2-propyl-4-pyridinyl)thiazole;hydrobromide
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| Structure |
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| Formula |
C17H15ClN2S
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| Molecular Weight |
314.841
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| Canonical SMILES |
CCCc1cc(ccn1)-c1nc(cs1)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C17H15ClN2S/c1-2-3-15-10-13(8-9-19-15)17-20-16(11-21-17)12-4-6-14(18)7-5-12/h4-11H,2-3H2,1H3
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| InChIKey |
QAIDAYZZJYOOJH-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