General Information of the Compound
| Compound ID |
CP0409746
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| Compound Name |
1-[1-(2-fluorophenyl)-1H-indazol-4-yl]-3-[(6-methylpyrazin-2-yl)methyl]imidazolidin-2-one
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| Structure |
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| Formula |
C22H19FN6O
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| Molecular Weight |
402.433
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| Canonical SMILES |
Cc1cncc(CN2CCN(C2=O)c2cccc3n(ncc23)-c2ccccc2F)n1
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| InChI |
InChI=1S/C22H19FN6O/c1-15-11-24-12-16(26-15)14-27-9-10-28(22(27)30)19-7-4-8-20-17(19)13-25-29(20)21-6-3-2-5-18(21)23/h2-8,11-13H,9-10,14H2,1H3
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| InChIKey |
WSFXDIIZYMRFBH-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: PT01105, Sodium channel protein type 5 subunit alpha
Protein ID: PT01000, Sodium channel protein type 9 subunit alpha