General Information of the Compound
| Compound ID |
CP0422308
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| Compound Name |
3-[5-(4-phenylpiperazin-1-yl)pentanoylamino]thiophene-2-carboxamide
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| Structure |
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| Formula |
C20H26N4O2S
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| Molecular Weight |
386.521
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| Canonical SMILES |
NC(=O)c1sccc1NC(=O)CCCCN1CCN(CC1)c1ccccc1
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| InChI |
InChI=1S/C20H26N4O2S/c21-20(26)19-17(9-15-27-19)22-18(25)8-4-5-10-23-11-13-24(14-12-23)16-6-2-1-3-7-16/h1-3,6-7,9,15H,4-5,8,10-14H2,(H2,21,26)(H,22,25)
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| InChIKey |
CKWRIKJZKDOTMM-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00941, 5-hydroxytryptamine receptor 7