General Information of the Compound
| Compound ID |
CP0920185
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| Compound Name |
2-(3-chlorobenzyl)-N-(3-(2-methylpiperidin-1-yl)propyl)-1,3-dioxoisoindoline-5-carboxamide hydrochloride
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| Structure |
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| Formula |
C25H29Cl2N3O3
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| Molecular Weight |
490.431
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| Canonical SMILES |
CC1CCCCN1CCCNC(=O)c1ccc2c(c1)C(=O)N(Cc1cccc(Cl)c1)C2=O.Cl
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| InChI |
InChI=1S/C25H28ClN3O3.ClH/c1-17-6-2-3-12-28(17)13-5-11-27-23(30)19-9-10-21-22(15-19)25(32)29(24(21)31)16-18-7-4-8-20(26)14-18;/h4,7-10,14-15,17H,2-3,5-6,11-13,16H2,1H3,(H,27,30);1H
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| InChIKey |
XBWLHRZFKIYOAV-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