General Information of the Compound
| Compound ID |
CP0513106
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| Compound Name |
N-[4-[4-[3-cyano-5-(trifluoromethyl)phenyl]piperazin-1-yl]butyl]imidazo[1,2-a]pyridine-2-carboxamide
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| Structure |
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| Formula |
C24H25F3N6O
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| Molecular Weight |
470.499
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| Canonical SMILES |
FC(F)(F)c1cc(cc(c1)N1CCN(CCCCNC(=O)c2cn3ccccc3n2)CC1)C#N
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| InChI |
InChI=1S/C24H25F3N6O/c25-24(26,27)19-13-18(16-28)14-20(15-19)32-11-9-31(10-12-32)7-4-2-6-29-23(34)21-17-33-8-3-1-5-22(33)30-21/h1,3,5,8,13-15,17H,2,4,6-7,9-12H2,(H,29,34)
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| InChIKey |
ZGQPGQJTWRUHLR-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