General Information of the Compound
| Compound ID |
CP0509785
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| Compound Name |
2-(1-Naphthylmethyl)-4-piperazin-1-yl-1H-benzimidazole
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| Structure |
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| Formula |
C22H22N4
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| Molecular Weight |
342.446
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| Canonical SMILES |
C(c1nc2c(cccc2[nH]1)N1CCNCC1)c1cccc2ccccc12
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| InChI |
InChI=1S/C22H22N4/c1-2-8-18-16(5-1)6-3-7-17(18)15-21-24-19-9-4-10-20(22(19)25-21)26-13-11-23-12-14-26/h1-10,23H,11-15H2,(H,24,25)
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| InChIKey |
QGBIJZJXSDKKSW-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: PT01354, 5-hydroxytryptamine receptor 6
Protein ID: PT00941, 5-hydroxytryptamine receptor 7