General Information of the Compound
| Compound ID |
CP0415787
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| Compound Name |
N-[4-[5-[3-[(2R,5R)-2,5-dimethylpyrrolidin-1-yl]propylamino]-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide
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| Structure |
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| Formula |
C24H28FN5O2
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| Molecular Weight |
437.519
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| Canonical SMILES |
C[C@@H]1CC[C@@H](C)N1CCCNc1nnc(o1)-c1ccc(NC(=O)c2ccccc2F)cc1
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| InChI |
InChI=1S/C24H28FN5O2/c1-16-8-9-17(2)30(16)15-5-14-26-24-29-28-23(32-24)18-10-12-19(13-11-18)27-22(31)20-6-3-4-7-21(20)25/h3-4,6-7,10-13,16-17H,5,8-9,14-15H2,1-2H3,(H,26,29)(H,27,31)/t16-,17-/m1/s1
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| InChIKey |
BHOFLUAFALWPKK-IAGOWNOFSA-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