General Information of the Compound
| Compound ID |
CP0519796
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| Compound Name |
2-fluoro-N-[4-[5-(3-piperidin-1-ylpropylamino)-1,3,4-oxadiazol-2-yl]-3-(trifluoromethyl)phenyl]benzamide
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| Structure |
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| Formula |
C24H25F4N5O2
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| Molecular Weight |
491.489
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| Canonical SMILES |
Fc1ccccc1C(=O)Nc1ccc(-c2nnc(NCCCN3CCCCC3)o2)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C24H25F4N5O2/c25-20-8-3-2-7-18(20)21(34)30-16-9-10-17(19(15-16)24(26,27)28)22-31-32-23(35-22)29-11-6-14-33-12-4-1-5-13-33/h2-3,7-10,15H,1,4-6,11-14H2,(H,29,32)(H,30,34)
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| InChIKey |
KVDQWUVURWICGP-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: PT01846, Neuronal acetylcholine receptor subunit alpha-7
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2