General Information of the Compound
| Compound ID |
CP0573493
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| Compound Name |
(5-chloro-2,3-dihydroindol-1-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone
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| Formula |
C20H22ClN3O
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| Molecular Weight |
355.869
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| Canonical SMILES |
Cc1ccccc1N1CCN(CC1)C(=O)N1CCc2cc(Cl)ccc12
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| InChI |
InChI=1S/C20H22ClN3O/c1-15-4-2-3-5-18(15)22-10-12-23(13-11-22)20(25)24-9-8-16-14-17(21)6-7-19(16)24/h2-7,14H,8-13H2,1H3
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| InChIKey |
XYFNATWVEOFZTG-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