General Information of the Compound
| Compound ID |
CP0405984
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| Compound Name |
4-[2-[2-(3-chlorophenyl)phenoxy]ethyl]piperidine
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| Structure |
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| Formula |
C19H22ClNO
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| Molecular Weight |
315.844
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| Canonical SMILES |
Clc1cccc(c1)-c1ccccc1OCCC1CCNCC1
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| InChI |
InChI=1S/C19H22ClNO/c20-17-5-3-4-16(14-17)18-6-1-2-7-19(18)22-13-10-15-8-11-21-12-9-15/h1-7,14-15,21H,8-13H2
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| InChIKey |
SIGGULXZWOEEQJ-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