General Information of the Compound
| Compound ID |
CP0935413
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| Compound Name |
N-(7-((2-(4-Phenylpiperazin-1-yl)ethyl)(propyl)amino)-5,6,7,8-tetrahydronaphthalen-2-yl)benzamide
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| Structure |
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| Formula |
C32H40N4O
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| Molecular Weight |
496.699
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| Canonical SMILES |
CCCN(CCN1CCN(c2ccccc2)CC1)C1CCc2ccc(NC(=O)c3ccccc3)cc2C1
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| InChI |
InChI=1S/C32H40N4O/c1-2-17-35(21-18-34-19-22-36(23-20-34)30-11-7-4-8-12-30)31-16-14-26-13-15-29(24-28(26)25-31)33-32(37)27-9-5-3-6-10-27/h3-13,15,24,31H,2,14,16-23,25H2,1H3,(H,33,37)
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| InChIKey |
BHBAIXGPPLACOR-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: PT00957, D(2) dopamine receptor
Protein ID: PT01366, D(3) dopamine receptor