General Information of the Compound
| Compound ID |
CP0462319
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| Compound Name |
5-[2-[[1-(4-chlorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]oxy]-6-methylpyridin-4-yl]-3-cyclopropyl-1,2,4-oxadiazole
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| Structure |
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| Formula |
C26H23ClN4O4S
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| Molecular Weight |
523.014
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| Canonical SMILES |
Cc1cc(cc(Oc2ccc3CCCN(c3c2)S(=O)(=O)c2ccc(Cl)cc2)n1)-c1nc(no1)C1CC1
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| InChI |
InChI=1S/C26H23ClN4O4S/c1-16-13-19(26-29-25(30-35-26)18-4-5-18)14-24(28-16)34-21-9-6-17-3-2-12-31(23(17)15-21)36(32,33)22-10-7-20(27)8-11-22/h6-11,13-15,18H,2-5,12H2,1H3
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| InChIKey |
UTWCXWCVPJBVKV-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