General Information of the Compound
| Compound ID |
CP0409195
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| Compound Name |
N-[4-(4-chlorophenyl)-1-(1H-indol-3-ylmethyl)piperidin-4-yl]acetamide
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| Structure |
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| Formula |
C22H24ClN3O
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| Molecular Weight |
381.907
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| Canonical SMILES |
CC(=O)NC1(CCN(Cc2c[nH]c3ccccc23)CC1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C22H24ClN3O/c1-16(27)25-22(18-6-8-19(23)9-7-18)10-12-26(13-11-22)15-17-14-24-21-5-3-2-4-20(17)21/h2-9,14,24H,10-13,15H2,1H3,(H,25,27)
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| InChIKey |
IPQCNTXEUDGNJY-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