General Information of the Compound
| Compound ID |
CP0389058
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| Compound Name |
3,5-bis[(4-methoxyphenyl)methyl]-2-phenylimidazo[4,5-c]quinolin-5-ium
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| Structure |
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| Formula |
C32H28N3O2+
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| Molecular Weight |
486.595
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| Canonical SMILES |
COc1ccc(Cn2c(nc3c2c[n+](Cc2ccc(OC)cc2)c2ccccc32)-c2ccccc2)cc1
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| InChI |
InChI=1S/C32H28N3O2/c1-36-26-16-12-23(13-17-26)20-34-22-30-31(28-10-6-7-11-29(28)34)33-32(25-8-4-3-5-9-25)35(30)21-24-14-18-27(37-2)19-15-24/h3-19,22H,20-21H2,1-2H3/q+1
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| InChIKey |
OSJMRPOAWOZTJC-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