General Information of the Compound
| Compound ID |
CP0468510
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| Compound Name |
(2-(3,4-dichlorobenzyl)phenyl)-N,N-dimethylmethanamine
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| Structure |
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| Formula |
C16H17Cl2N
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| Molecular Weight |
294.225
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| Canonical SMILES |
CN(C)Cc1ccccc1Cc1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C16H17Cl2N/c1-19(2)11-14-6-4-3-5-13(14)9-12-7-8-15(17)16(18)10-12/h3-8,10H,9,11H2,1-2H3
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| InChIKey |
RVVDMQMBQDIWKD-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: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter