General Information of the Compound
| Compound ID |
CP0905670
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| Compound Name |
(2-chloro-4-(methylsulfonyl)phenyl)(4-(3-(cyclopropylamino)quinoxalin-2-yl)piperazin-1-yl)methanone
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| Structure |
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| Formula |
C23H24ClN5O3S
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| Molecular Weight |
485.997
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| Canonical SMILES |
CS(=O)(=O)c1ccc(C(=O)N2CCN(c3nc4ccccc4nc3NC3CC3)CC2)c(Cl)c1
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| InChI |
InChI=1S/C23H24ClN5O3S/c1-33(31,32)16-8-9-17(18(24)14-16)23(30)29-12-10-28(11-13-29)22-21(25-15-6-7-15)26-19-4-2-3-5-20(19)27-22/h2-5,8-9,14-15H,6-7,10-13H2,1H3,(H,25,26)
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| InChIKey |
NTWOEZUJSNQNNM-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