General Information of the Compound
| Compound ID |
CP0486917
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| Compound Name |
N-[4-chloro-3-(5-phenyl-1H-imidazol-2-yl)phenyl]isoquinolin-1-amine
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| Structure |
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| Formula |
C24H17ClN4
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| Molecular Weight |
396.881
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| Canonical SMILES |
Clc1ccc(Nc2nccc3ccccc23)cc1-c1nc(c[nH]1)-c1ccccc1
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| InChI |
InChI=1S/C24H17ClN4/c25-21-11-10-18(28-23-19-9-5-4-6-16(19)12-13-26-23)14-20(21)24-27-15-22(29-24)17-7-2-1-3-8-17/h1-15H,(H,26,28)(H,27,29)
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| InChIKey |
USCUNZFONNHOGC-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