General Information of the Compound
| Compound ID |
CP0540380
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| Compound Name |
1-[3-(1H-benzimidazol-2-yl)-5-(3,5-dimethylphenyl)pyridin-4-yl]piperidin-4-amine
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| Structure |
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| Formula |
C25H27N5
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| Molecular Weight |
397.526
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| Canonical SMILES |
Cc1cc(C)cc(c1)-c1cncc(-c2nc3ccccc3[nH]2)c1N1CCC(N)CC1
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| InChI |
InChI=1S/C25H27N5/c1-16-11-17(2)13-18(12-16)20-14-27-15-21(24(20)30-9-7-19(26)8-10-30)25-28-22-5-3-4-6-23(22)29-25/h3-6,11-15,19H,7-10,26H2,1-2H3,(H,28,29)
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| InChIKey |
RHJMIVINEWJUHG-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: PT00897, Potassium voltage-gated channel subfamily H member 2
Protein ID: PT01505, Somatostatin receptor type 2