General Information of the Compound
| Compound ID |
CP0002464
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| Compound Name |
5-chloro-2-fluoro-4-[[(1R)-2-methoxy-1-phenylethyl]amino]-N-(1,3-thiazol-2-yl)benzenesulfonamide
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| Structure |
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| Formula |
C18H17ClFN3O3S2
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| Molecular Weight |
441.937
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| Canonical SMILES |
COC[C@H](Nc1cc(F)c(cc1Cl)S(=O)(=O)Nc1nccs1)c1ccccc1
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| InChI |
InChI=1S/C18H17ClFN3O3S2/c1-26-11-16(12-5-3-2-4-6-12)22-15-10-14(20)17(9-13(15)19)28(24,25)23-18-21-7-8-27-18/h2-10,16,22H,11H2,1H3,(H,21,23)/t16-/m0/s1
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| InChIKey |
HAHBYABDAIXZLF-INIZCTEOSA-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