General Information of the Compound
| Compound ID |
CP0878896
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| Compound Name |
3-(4-(benzofuran-3-ylmethyl)piperazin-1-yl)-N-cyclopropylquinoxalin-2-amine
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| Structure |
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| Formula |
C24H25N5O
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| Molecular Weight |
399.498
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| Canonical SMILES |
c1ccc2nc(N3CCN(Cc4coc5ccccc45)CC3)c(NC3CC3)nc2c1
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| InChI |
InChI=1S/C24H25N5O/c1-4-8-22-19(5-1)17(16-30-22)15-28-11-13-29(14-12-28)24-23(25-18-9-10-18)26-20-6-2-3-7-21(20)27-24/h1-8,16,18H,9-15H2,(H,25,26)
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| InChIKey |
WJRGQHVBSACXRD-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