General Information of the Compound
| Compound ID |
CP0902213
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| Compound Name |
N-cyclopropyl-3-(4-(phenylsulfonyl)piperazin-1-yl)quinoxalin-2-amine
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| Structure |
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| Formula |
C21H23N5O2S
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| Molecular Weight |
409.515
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| Canonical SMILES |
O=S(=O)(c1ccccc1)N1CCN(c2nc3ccccc3nc2NC2CC2)CC1
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| InChI |
InChI=1S/C21H23N5O2S/c27-29(28,17-6-2-1-3-7-17)26-14-12-25(13-15-26)21-20(22-16-10-11-16)23-18-8-4-5-9-19(18)24-21/h1-9,16H,10-15H2,(H,22,23)
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| InChIKey |
NUUMHCOQIZLUHS-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