General Information of the Compound
| Compound ID |
CP0457905
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| Compound Name |
(R)-N-(5-(2-(4-(2-methylthiazol-4-yl)phenethylamino)-1-hydroxyethyl)-2-chlorophenyl)methanesulfonamide
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| Structure |
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| Formula |
C21H24ClN3O3S2
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| Molecular Weight |
466.028
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| Canonical SMILES |
Cc1nc(cs1)-c1ccc(CCNC[C@H](O)c2ccc(Cl)c(NS(C)(=O)=O)c2)cc1
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| InChI |
InChI=1S/C21H24ClN3O3S2/c1-14-24-20(13-29-14)16-5-3-15(4-6-16)9-10-23-12-21(26)17-7-8-18(22)19(11-17)25-30(2,27)28/h3-8,11,13,21,23,25-26H,9-10,12H2,1-2H3/t21-/m0/s1
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| InChIKey |
GYBRSFWAQZVMDN-NRFANRHFSA-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