General Information of the Compound
| Compound ID |
CP0536028
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| Compound Name |
4-(2-Phenyl-3H-imidazol-4-ylmethyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl
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| Structure |
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| Formula |
C18H20N6
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| Molecular Weight |
320.4
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| Canonical SMILES |
C(N1CCN(CC1)c1cnccn1)c1cnc([nH]1)-c1ccccc1
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| InChI |
InChI=1S/C18H20N6/c1-2-4-15(5-3-1)18-21-12-16(22-18)14-23-8-10-24(11-9-23)17-13-19-6-7-20-17/h1-7,12-13H,8-11,14H2,(H,21,22)
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| InChIKey |
GRRGOFXERNJCAY-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: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor
Protein ID: PT01161, D(4) dopamine receptor