General Information of the Compound
| Compound ID |
CP0432072
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| Compound Name |
6-chloro-3-(pyrrolidin-1-ylmethylamino)-1H-quinoxalin-2-one
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| Structure |
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| Formula |
C13H15ClN4O
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| Molecular Weight |
278.743
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| Canonical SMILES |
Clc1ccc2[nH]c(=O)c(NCN3CCCC3)nc2c1
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| InChI |
InChI=1S/C13H15ClN4O/c14-9-3-4-10-11(7-9)16-12(13(19)17-10)15-8-18-5-1-2-6-18/h3-4,7H,1-2,5-6,8H2,(H,15,16)(H,17,19)
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| InChIKey |
XYPHSYGSRMVMNJ-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