General Information of the Compound
| Compound ID |
CP0521321
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| Compound Name |
4-[(Z)-4-amino-2-fluorobut-2-enoxy]-N-[(1S)-1-phenylethyl]benzenesulfonamide;hydrochloride
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| Structure |
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| Formula |
C18H22ClFN2O3S
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| Molecular Weight |
400.903
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| Canonical SMILES |
Cl.C[C@H](NS(=O)(=O)c1ccc(OC\C(F)=C\CN)cc1)c1ccccc1
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| InChI |
InChI=1S/C18H21FN2O3S.ClH/c1-14(15-5-3-2-4-6-15)21-25(22,23)18-9-7-17(8-10-18)24-13-16(19)11-12-20;/h2-11,14,21H,12-13,20H2,1H3;1H/b16-11-;/t14-;/m0./s1
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| InChIKey |
KIFNERWFYOPRCT-TZLGVYDDSA-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