General Information of the Compound
| Compound ID |
CP0081044
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| Compound Name |
N-[4-[[5-(cyclopropylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]-propylamino]butyl]-4-phenylbenzamide
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| Structure |
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| Formula |
C34H42N2O2
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| Molecular Weight |
510.722
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| Canonical SMILES |
CCCN(CCCCNC(=O)c1ccc(cc1)-c1ccccc1)C1CCc2c(C1)cccc2OCC1CC1
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| InChI |
InChI=1S/C34H42N2O2/c1-2-22-36(31-19-20-32-30(24-31)11-8-12-33(32)38-25-26-13-14-26)23-7-6-21-35-34(37)29-17-15-28(16-18-29)27-9-4-3-5-10-27/h3-5,8-12,15-18,26,31H,2,6-7,13-14,19-25H2,1H3,(H,35,37)
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| InChIKey |
UUKCJRIPKQWEID-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