General Information of the Compound
| Compound ID |
CP0573805
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| Compound Name |
1-[3-(4,6-dimethyl-1H-benzimidazol-2-yl)-5-(3,5-dimethylphenyl)pyridin-4-yl]piperidin-4-amine
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| Structure |
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| Formula |
C27H31N5
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| Molecular Weight |
425.58
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| Canonical SMILES |
Cc1cc(C)cc(c1)-c1cncc(-c2nc3cc(C)cc(C)c3[nH]2)c1N1CCC(N)CC1
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| InChI |
InChI=1S/C27H31N5/c1-16-9-17(2)12-20(11-16)22-14-29-15-23(26(22)32-7-5-21(28)6-8-32)27-30-24-13-18(3)10-19(4)25(24)31-27/h9-15,21H,5-8,28H2,1-4H3,(H,30,31)
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| InChIKey |
SGUMFQAXVXTERN-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