General Information of the Compound
| Compound ID |
CP0485791
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| Compound Name |
1-[4-(4-chloro-2-methylphenoxy)pyridin-3-yl]-N-methylmethanamine
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| Structure |
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| Formula |
C14H15ClN2O
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| Molecular Weight |
262.74
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| Canonical SMILES |
CNCc1cnccc1Oc1ccc(Cl)cc1C
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| InChI |
InChI=1S/C14H15ClN2O/c1-10-7-12(15)3-4-13(10)18-14-5-6-17-9-11(14)8-16-2/h3-7,9,16H,8H2,1-2H3
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| InChIKey |
IGNDYXSKELQDJB-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: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter