General Information of the Compound
| Compound ID |
CP0855317
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| Compound Name |
1-(4-((2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl)methyl)-1,4-diazepan-1-yl)ethanone
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| Structure |
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| Formula |
C27H27ClN4O
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| Molecular Weight |
458.993
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| Canonical SMILES |
CC(=O)N1CCCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1
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| InChI |
InChI=1S/C27H27ClN4O/c1-20(33)31-15-5-14-30(16-17-31)19-25-27(22-8-11-24(28)12-9-22)29-26-13-10-23(18-32(25)26)21-6-3-2-4-7-21/h2-4,6-13,18H,5,14-17,19H2,1H3
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| InChIKey |
HXZHNVDEFQJMLN-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