General Information of the Compound
| Compound ID |
CP0436134
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| Compound Name |
5-(furan-2-yl)-N-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butyl)-1H-pyrazole-3-carboxamide
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| Structure |
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| Formula |
C23H29N5O3
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| Molecular Weight |
423.517
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| Canonical SMILES |
COc1ccccc1N1CCN(CCCCNC(=O)c2cc(n[nH]2)-c2ccco2)CC1
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| InChI |
InChI=1S/C23H29N5O3/c1-30-22-8-3-2-7-20(22)28-14-12-27(13-15-28)11-5-4-10-24-23(29)19-17-18(25-26-19)21-9-6-16-31-21/h2-3,6-9,16-17H,4-5,10-15H2,1H3,(H,24,29)(H,25,26)
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| InChIKey |
LPYJYJNIIRKQSC-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