General Information of the Compound
| Compound ID |
CP0677770
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| Compound Name |
(2-Chlorophenyl)-[5-(2-methylisoindolin-5-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanone
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| Structure |
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| Formula |
C23H18ClN3O
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| Molecular Weight |
387.87
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| Canonical SMILES |
CN1Cc2ccc(-c3cnc4[nH]cc(C(=O)c5ccccc5Cl)c4c3)cc2C1
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| InChI |
InChI=1S/C23H18ClN3O/c1-27-12-15-7-6-14(8-17(15)13-27)16-9-19-20(11-26-23(19)25-10-16)22(28)18-4-2-3-5-21(18)24/h2-11H,12-13H2,1H3,(H,25,26)
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| InChIKey |
GYOYJIDGMCNEHB-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