General Information of the Compound
| Compound ID |
CP0188439
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| Compound Name |
4-(4-Benzyl-piperazin-1-yl)-5-chloro-1,3-dihydro-indol-2-one
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| Structure |
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| Formula |
C19H20ClN3O
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| Molecular Weight |
341.842
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| Canonical SMILES |
Clc1ccc2NC(=O)Cc2c1N1CCN(Cc2ccccc2)CC1
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| InChI |
InChI=1S/C19H20ClN3O/c20-16-6-7-17-15(12-18(24)21-17)19(16)23-10-8-22(9-11-23)13-14-4-2-1-3-5-14/h1-7H,8-13H2,(H,21,24)
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| InChIKey |
PIPVZEXRFVHTJJ-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