General Information of the Compound
| Compound ID |
CP0378254
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| Compound Name |
3-[5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-yl]-1-(2-ethylpiperidin-1-yl)propan-1-one
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| Structure |
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| Formula |
C26H28ClN3O
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| Molecular Weight |
433.983
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| Canonical SMILES |
CCC1CCCCN1C(=O)CCC1(c2ccccc2-c2nccn12)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C26H28ClN3O/c1-2-21-7-5-6-17-29(21)24(31)14-15-26(19-10-12-20(27)13-11-19)23-9-4-3-8-22(23)25-28-16-18-30(25)26/h3-4,8-13,16,18,21H,2,5-7,14-15,17H2,1H3
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| InChIKey |
ILJUSKJAQXDWAU-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