General Information of the Compound
| Compound ID |
CP0915212
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| Compound Name |
4-{[6-(4-Amino-3,5-dimethylphenoxy)-1-methyl-1Hbenzimidazol-2-yl]methoxy}benzonitrile dihydrochloride
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| Structure |
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| Formula |
C24H24Cl2N4O2
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| Molecular Weight |
471.388
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| Canonical SMILES |
Cc1cc(Oc2ccc3nc(COc4ccc(C#N)cc4)n(C)c3c2)cc(C)c1N.Cl.Cl
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| InChI |
InChI=1S/C24H22N4O2.2ClH/c1-15-10-20(11-16(2)24(15)26)30-19-8-9-21-22(12-19)28(3)23(27-21)14-29-18-6-4-17(13-25)5-7-18;;/h4-12H,14,26H2,1-3H3;2*1H
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| InChIKey |
FUUFTUIUTKRXNP-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