General Information of the Compound
| Compound ID |
CP0412715
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| Compound Name |
(R)-N-(5-(2-(4-(2-phenylthiazol-4-yl)phenethylamino)-1-hydroxyethyl)-2-methylphenyl)methanesulfonamide
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| Structure |
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| Formula |
C27H29N3O3S2
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| Molecular Weight |
507.681
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| Canonical SMILES |
Cc1ccc(cc1NS(C)(=O)=O)[C@@H](O)CNCCc1ccc(cc1)-c1csc(n1)-c1ccccc1
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| InChI |
InChI=1S/C27H29N3O3S2/c1-19-8-11-23(16-24(19)30-35(2,32)33)26(31)17-28-15-14-20-9-12-21(13-10-20)25-18-34-27(29-25)22-6-4-3-5-7-22/h3-13,16,18,26,28,30-31H,14-15,17H2,1-2H3/t26-/m0/s1
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| InChIKey |
ORADEIWFZAHOJV-SANMLTNESA-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