General Information of the Compound
| Compound ID |
CP0421046
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| Compound Name |
7-chloro-6-[6-chloro-4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]oxy-4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine
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| Structure |
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| Formula |
C24H17Cl3N4O5S
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| Molecular Weight |
579.849
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| Canonical SMILES |
Clc1ccc(cc1)S(=O)(=O)N1CCOc2cc(Cl)c(Oc3cc(cc(Cl)n3)-c3nc(no3)C3CC3)cc12
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| InChI |
InChI=1S/C24H17Cl3N4O5S/c25-15-3-5-16(6-4-15)37(32,33)31-7-8-34-20-11-17(26)19(12-18(20)31)35-22-10-14(9-21(27)28-22)24-29-23(30-36-24)13-1-2-13/h3-6,9-13H,1-2,7-8H2
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| InChIKey |
SCMOUJFEKMABPA-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