General Information of the Compound
| Compound ID |
CP0540413
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| Compound Name |
6-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-5-pyridin-4-yl-1H-imidazol-4-yl]naphthalene-2-carboxylic acid
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| Structure |
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| Formula |
C29H26N4O3
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| Molecular Weight |
478.552
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| Canonical SMILES |
CN(C)CCOc1ccc(cc1)-c1nc(c([nH]1)-c1ccncc1)-c1ccc2cc(ccc2c1)C(O)=O
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| InChI |
InChI=1S/C29H26N4O3/c1-33(2)15-16-36-25-9-7-20(8-10-25)28-31-26(19-11-13-30-14-12-19)27(32-28)23-5-3-22-18-24(29(34)35)6-4-21(22)17-23/h3-14,17-18H,15-16H2,1-2H3,(H,31,32)(H,34,35)
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| InChIKey |
NALCJFRYJRGEAV-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