General Information of the Compound
Compound ID |
CP0439116
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Compound Name |
phenyl-(4-piperazin-1-yl-1H-benzimidazol-2-yl)methanone
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Structure |
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Formula |
C18H18N4O
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Molecular Weight |
306.369
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Canonical SMILES |
O=C(c1nc2c(cccc2[nH]1)N1CCNCC1)c1ccccc1
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InChI |
InChI=1S/C18H18N4O/c23-17(13-5-2-1-3-6-13)18-20-14-7-4-8-15(16(14)21-18)22-11-9-19-10-12-22/h1-8,19H,9-12H2,(H,20,21)
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InChIKey |
FZBMMXWYKQENCZ-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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: PT01354, 5-hydroxytryptamine receptor 6
Protein ID: PT00941, 5-hydroxytryptamine receptor 7