General Information of the Compound
| Compound ID |
CP0416633
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| Compound Name |
2-[4-(5-chloropyridin-2-yl)piperazin-1-yl]-N-(3-methylphenyl)acetamide
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| Structure |
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| Formula |
C18H21ClN4O
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| Molecular Weight |
344.846
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| Canonical SMILES |
Cc1cccc(NC(=O)CN2CCN(CC2)c2ccc(Cl)cn2)c1
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| InChI |
InChI=1S/C18H21ClN4O/c1-14-3-2-4-16(11-14)21-18(24)13-22-7-9-23(10-8-22)17-6-5-15(19)12-20-17/h2-6,11-12H,7-10,13H2,1H3,(H,21,24)
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| InChIKey |
LNXPXCVWRDGGAX-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
Protein ID: PT01161, D(4) dopamine receptor