General Information of the Compound
| Compound ID |
CP0847328
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| Compound Name |
1-naphthyl N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]carbamate
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| Structure |
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| Formula |
C26H31N3O3
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| Molecular Weight |
433.552
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| Canonical SMILES |
COc1ccccc1N1CCN(CCCCNC(=O)Oc2cccc3ccccc23)CC1
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| InChI |
InChI=1S/C26H31N3O3/c1-31-25-13-5-4-12-23(25)29-19-17-28(18-20-29)16-7-6-15-27-26(30)32-24-14-8-10-21-9-2-3-11-22(21)24/h2-5,8-14H,6-7,15-20H2,1H3,(H,27,30)
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| InChIKey |
RLRZFXWQPQJVDA-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: PT00943, D(3) dopamine receptor
Protein ID: PT01099, Fatty-acid amide hydrolase 1