General Information of the Compound
Compound ID |
CP0540598
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Compound Name |
7-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-5-pyridin-4-yl-1H-imidazol-4-yl]naphthalen-2-ol
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Structure |
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Formula |
C28H26N4O2
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Molecular Weight |
450.542
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Canonical SMILES |
CN(C)CCOc1ccc(cc1)-c1nc(c([nH]1)-c1ccncc1)-c1ccc2ccc(O)cc2c1
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InChI |
InChI=1S/C28H26N4O2/c1-32(2)15-16-34-25-9-6-21(7-10-25)28-30-26(20-11-13-29-14-12-20)27(31-28)22-4-3-19-5-8-24(33)18-23(19)17-22/h3-14,17-18,33H,15-16H2,1-2H3,(H,30,31)
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InChIKey |
KVDLBJBQNAXWKZ-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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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