General Information of the Compound
| Compound ID |
CP0419364
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| Compound Name |
1'-(1H-Benzoimidazol-2-ylmethyl)-1',2',3',6'-tetrahydro-[2,4']bipyridinyl
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| Structure |
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| Formula |
C18H18N4
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| Molecular Weight |
290.37
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| Canonical SMILES |
C(N1CCC(=CC1)c1ccccn1)c1nc2ccccc2[nH]1
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| InChI |
InChI=1S/C18H18N4/c1-2-7-17-16(6-1)20-18(21-17)13-22-11-8-14(9-12-22)15-5-3-4-10-19-15/h1-8,10H,9,11-13H2,(H,20,21)
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| InChIKey |
PSXITITZQSEYMQ-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