General Information of the Compound
| Compound ID |
CP0953092
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| Compound Name |
4-fluoro-N-{2-[7-(2-phenylethyl)-9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl]ethyl}benzenesulfonamide
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| Structure |
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| Formula |
C22H28FN3O3S
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| Molecular Weight |
433.549
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| Canonical SMILES |
O=S(=O)(NCCN1CC2CN(CCc3ccccc3)CC(C1)O2)c1ccc(F)cc1
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| InChI |
InChI=1S/C22H28FN3O3S/c23-19-6-8-22(9-7-19)30(27,28)24-11-13-26-16-20-14-25(15-21(17-26)29-20)12-10-18-4-2-1-3-5-18/h1-9,20-21,24H,10-17H2
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| InChIKey |
OWSPEALEKGPJMA-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