General Information of the Compound
| Compound ID |
CP0207008
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| Compound Name |
N,N-dimethyl-1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]piperidin-4-amine
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| Structure |
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| Formula |
C22H28N4
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| Molecular Weight |
348.494
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| Canonical SMILES |
CN(C)C1CCN(CC1)c1nc2ccccc2n1Cc1ccc(C)cc1
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| InChI |
InChI=1S/C22H28N4/c1-17-8-10-18(11-9-17)16-26-21-7-5-4-6-20(21)23-22(26)25-14-12-19(13-15-25)24(2)3/h4-11,19H,12-16H2,1-3H3
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| InChIKey |
AVFYUSOOXDDQAW-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: PT01206, Histamine H1 receptor
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2