General Information of the Compound
| Compound ID |
CP0426947
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| Compound Name |
N-[4-[5-[3-[(1S,4R)-2-azabicyclo[2.2.1]heptan-2-yl]propylamino]-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide
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| Structure |
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| Formula |
C24H26FN5O2
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| Molecular Weight |
435.503
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| Canonical SMILES |
Fc1ccccc1C(=O)Nc1ccc(cc1)-c1nnc(NCCCN2C[C@@H]3CC[C@H]2C3)o1
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| InChI |
InChI=1S/C24H26FN5O2/c25-21-5-2-1-4-20(21)22(31)27-18-9-7-17(8-10-18)23-28-29-24(32-23)26-12-3-13-30-15-16-6-11-19(30)14-16/h1-2,4-5,7-10,16,19H,3,6,11-15H2,(H,26,29)(H,27,31)/t16-,19+/m1/s1
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| InChIKey |
ZZEZKGRHVIQWTI-APWZRJJASA-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