General Information of the Compound
| Compound ID |
CP0503252
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| Compound Name |
1-chloro-3-[(1R)-2-[2-[4-(dimethylsulfamoylamino)phenyl]ethylamino]-1-hydroxyethyl]benzene
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| Structure |
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| Formula |
C18H24ClN3O3S
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| Molecular Weight |
397.928
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| Canonical SMILES |
CN(C)S(=O)(=O)Nc1ccc(CCNC[C@H](O)c2cccc(Cl)c2)cc1
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| InChI |
InChI=1S/C18H24ClN3O3S/c1-22(2)26(24,25)21-17-8-6-14(7-9-17)10-11-20-13-18(23)15-4-3-5-16(19)12-15/h3-9,12,18,20-21,23H,10-11,13H2,1-2H3/t18-/m0/s1
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| InChIKey |
UBXCXOLZLXDFSH-SFHVURJKSA-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