General Information of the Compound
| Compound ID |
CP0503312
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| Compound Name |
2-(3-chlorophenoxy)-N-(1-((1-phenyl-1H-pyrrol-3-yl)methyl)piperidin-4-yl)acetamide
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| Structure |
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| Formula |
C24H26ClN3O2
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| Molecular Weight |
423.944
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| Canonical SMILES |
Clc1cccc(OCC(=O)NC2CCN(Cc3ccn(c3)-c3ccccc3)CC2)c1
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| InChI |
InChI=1S/C24H26ClN3O2/c25-20-5-4-8-23(15-20)30-18-24(29)26-21-10-12-27(13-11-21)16-19-9-14-28(17-19)22-6-2-1-3-7-22/h1-9,14-15,17,21H,10-13,16,18H2,(H,26,29)
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| InChIKey |
UQIDDUFVELLMJI-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