General Information of the Compound
| Compound ID |
CP0425772
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| Compound Name |
9b-(4-chloro-3-methoxyphenyl)-1-(4-propan-2-yloxybenzoyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one
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| Structure |
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| Formula |
C27H25ClN2O4
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| Molecular Weight |
476.96
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| Canonical SMILES |
COc1cc(ccc1Cl)C12N(CCN1C(=O)c1ccccc21)C(=O)c1ccc(OC(C)C)cc1
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| InChI |
InChI=1S/C27H25ClN2O4/c1-17(2)34-20-11-8-18(9-12-20)25(31)29-14-15-30-26(32)21-6-4-5-7-22(21)27(29,30)19-10-13-23(28)24(16-19)33-3/h4-13,16-17H,14-15H2,1-3H3
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| InChIKey |
MTCUMONBUKWVQR-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