General Information of the Compound
| Compound ID |
CP0381349
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| Compound Name |
2,3-difluoro-N-[1-[2-(2-phenylphenoxy)ethyl]pyrrolidin-3-yl]benzamide
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| Structure |
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| Formula |
C25H24F2N2O2
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| Molecular Weight |
422.475
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| Canonical SMILES |
Fc1cccc(C(=O)NC2CCN(CCOc3ccccc3-c3ccccc3)C2)c1F
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| InChI |
InChI=1S/C25H24F2N2O2/c26-22-11-6-10-21(24(22)27)25(30)28-19-13-14-29(17-19)15-16-31-23-12-5-4-9-20(23)18-7-2-1-3-8-18/h1-12,19H,13-17H2,(H,28,30)
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| InChIKey |
FNXIHIMNVBDVAC-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT01354, 5-hydroxytryptamine receptor 6
Protein ID: PT00941, 5-hydroxytryptamine receptor 7
Protein ID: PT01005, D(2) dopamine receptor