General Information of the Compound
| Compound ID |
CP0444516
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| Compound Name |
5-chloro-2-methoxy-N-[4-[(1-propan-2-yl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)oxy]phenyl]benzenesulfonamide
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| Formula |
C25H22ClN5O4S
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| Molecular Weight |
524.002
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| Canonical SMILES |
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(Oc2nc3ccccc3n3c(nnc23)C(C)C)cc1
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| InChI |
InChI=1S/C25H22ClN5O4S/c1-15(2)23-28-29-24-25(27-19-6-4-5-7-20(19)31(23)24)35-18-11-9-17(10-12-18)30-36(32,33)22-14-16(26)8-13-21(22)34-3/h4-15,30H,1-3H3
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| InChIKey |
QDDMJURMBLDTJO-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