General Information of the Compound
| Compound ID |
CP0329644
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| Compound Name |
2-[(4-ethylphenyl)methylsulfanyl]-1-phenylimidazole
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| Structure |
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| Formula |
C18H18N2S
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| Molecular Weight |
294.423
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| Canonical SMILES |
CCc1ccc(CSc2nccn2-c2ccccc2)cc1
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| InChI |
InChI=1S/C18H18N2S/c1-2-15-8-10-16(11-9-15)14-21-18-19-12-13-20(18)17-6-4-3-5-7-17/h3-13H,2,14H2,1H3
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| InChIKey |
IUNURSMEOCMLOG-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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