General Information of the Compound
| Compound ID |
CP0494668
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| Compound Name |
N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-4-[3-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide
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| Structure |
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| Formula |
C21H22F3N5O2
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| Molecular Weight |
433.434
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| Canonical SMILES |
Oc1ccc2[nH]cc(CCNC(=O)N3CCN(CC3)c3ncccc3C(F)(F)F)c2c1
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| InChI |
InChI=1S/C21H22F3N5O2/c22-21(23,24)17-2-1-6-25-19(17)28-8-10-29(11-9-28)20(31)26-7-5-14-13-27-18-4-3-15(30)12-16(14)18/h1-4,6,12-13,27,30H,5,7-11H2,(H,26,31)
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| InChIKey |
FEYCSGXJKLRPJH-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: PT02149, Transient receptor potential cation channel subfamily A member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1