General Information of the Compound
| Compound ID |
CP0911778
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| Compound Name |
2-(4-chlorophenyl)-3-((4-(cyclopropylsulfonyl)piperidin-1-yl)methyl)-6-phenylimidazo[1,2-a]pyridine
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| Structure |
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| Formula |
C28H28ClN3O2S
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| Molecular Weight |
506.071
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| Canonical SMILES |
O=S(=O)(C1CC1)C1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1
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| InChI |
InChI=1S/C28H28ClN3O2S/c29-23-9-6-21(7-10-23)28-26(19-31-16-14-25(15-17-31)35(33,34)24-11-12-24)32-18-22(8-13-27(32)30-28)20-4-2-1-3-5-20/h1-10,13,18,24-25H,11-12,14-17,19H2
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| InChIKey |
OIPKWVSTMOZCTQ-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