General Information of the Compound
| Compound ID |
CP0891142
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| Compound Name |
5-(4-((2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl)methyl)piperazine-1-carbonyl)pyrazine-2-carbonitrile
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| Structure |
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| Formula |
C30H24ClN7O
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| Molecular Weight |
534.023
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| Canonical SMILES |
N#Cc1cnc(C(=O)N2CCN(Cc3c(-c4ccc(Cl)cc4)nc4ccc(-c5ccccc5)cn34)CC2)cn1
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| InChI |
InChI=1S/C30H24ClN7O/c31-24-9-6-22(7-10-24)29-27(38-19-23(8-11-28(38)35-29)21-4-2-1-3-5-21)20-36-12-14-37(15-13-36)30(39)26-18-33-25(16-32)17-34-26/h1-11,17-19H,12-15,20H2
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| InChIKey |
XSOPXCLPEKUVFB-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