General Information of the Compound
Compound ID |
CP0557115
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Compound Name |
(4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone
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Structure |
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Formula |
C23H24N4O
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Molecular Weight |
372.472
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Canonical SMILES |
C[C@H](c1ccccc1)n1cncc1C(=O)N1CCN(C2CC2)c2ccccc12
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InChI |
InChI=1S/C23H24N4O/c1-17(18-7-3-2-4-8-18)27-16-24-15-22(27)23(28)26-14-13-25(19-11-12-19)20-9-5-6-10-21(20)26/h2-10,15-17,19H,11-14H2,1H3/t17-/m1/s1
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InChIKey |
LRVQGFKSRFYBMY-QGZVFWFLSA-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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