General Information of the Compound
| Compound ID |
CP0350790
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| Compound Name |
N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]pyridin-2-amine
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| Structure |
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| Formula |
C20H28N4
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| Molecular Weight |
324.472
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| Canonical SMILES |
Cc1ccccc1N1CCN(CCCCNc2ccccn2)CC1
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| InChI |
InChI=1S/C20H28N4/c1-18-8-2-3-9-19(18)24-16-14-23(15-17-24)13-7-6-12-22-20-10-4-5-11-21-20/h2-5,8-11H,6-7,12-17H2,1H3,(H,21,22)
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| InChIKey |
XRDZUZLOELIAOU-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: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor