General Information of the Compound
| Compound ID |
CP0433861
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| Compound Name |
(4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-(4-naphthalen-2-yloxypyridin-3-yl)methanone
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| Structure |
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| Formula |
C27H23N3O2
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| Molecular Weight |
421.5
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| Canonical SMILES |
O=C(N1CCN(C2CC2)c2ccccc12)c1cnccc1Oc1ccc2ccccc2c1
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| InChI |
InChI=1S/C27H23N3O2/c31-27(30-16-15-29(21-10-11-21)24-7-3-4-8-25(24)30)23-18-28-14-13-26(23)32-22-12-9-19-5-1-2-6-20(19)17-22/h1-9,12-14,17-18,21H,10-11,15-16H2
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| InChIKey |
QFEORMHUMOYISV-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