General Information of the Compound
| Compound ID |
CP0474089
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| Compound Name |
2-(3-chlorophenoxy)-N-[1-(1H-indol-5-ylmethyl)piperidin-4-yl]acetamide
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| Structure |
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| Formula |
C22H24ClN3O2
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| Molecular Weight |
397.906
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| Canonical SMILES |
Clc1cccc(OCC(=O)NC2CCN(Cc3ccc4[nH]ccc4c3)CC2)c1
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| InChI |
InChI=1S/C22H24ClN3O2/c23-18-2-1-3-20(13-18)28-15-22(27)25-19-7-10-26(11-8-19)14-16-4-5-21-17(12-16)6-9-24-21/h1-6,9,12-13,19,24H,7-8,10-11,14-15H2,(H,25,27)
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| InChIKey |
UWLYGOUWVQJEGP-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