General Information of the Compound
| Compound ID |
CP0008229
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| Compound Name |
(4-chlorophenyl)-[4-(4-methylanilino)piperidin-1-yl]methanone
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| Structure |
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| Formula |
C19H21ClN2O
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| Molecular Weight |
328.843
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| Canonical SMILES |
Cc1ccc(NC2CCN(CC2)C(=O)c2ccc(Cl)cc2)cc1
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| InChI |
InChI=1S/C19H21ClN2O/c1-14-2-8-17(9-3-14)21-18-10-12-22(13-11-18)19(23)15-4-6-16(20)7-5-15/h2-9,18,21H,10-13H2,1H3
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| InChIKey |
IYUZMNYQASZUFK-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
Protein ID: PT06098, Ecdysone receptor
Protein ID: PT00632, Ecdysone receptor