General Information of the Compound
| Compound ID |
CP0508673
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| Compound Name |
1-[(1R,3S)-3-(3-Chloro-phenyl)-2,2-dimethyl-cyclopropyl]-2-methylsulfanyl-1H-imidazole
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| Structure |
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| Formula |
C15H17ClN2S
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| Molecular Weight |
292.835
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| Canonical SMILES |
CSc1nccn1[C@@H]1[C@@H](c2cccc(Cl)c2)C1(C)C
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| InChI |
InChI=1S/C15H17ClN2S/c1-15(2)12(10-5-4-6-11(16)9-10)13(15)18-8-7-17-14(18)19-3/h4-9,12-13H,1-3H3/t12-,13-/m1/s1
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| InChIKey |
IJTFSUUCZIZHQK-CHWSQXEVSA-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