General Information of the Compound
| Compound ID |
CP0371714
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| Compound Name |
(R)-2-(4-(2-(trifluoromethyl)thiazol-4-yl)phenethylamino)-1-(pyridin-3-yl)ethanol
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| Structure |
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| Formula |
C19H18F3N3OS
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| Molecular Weight |
393.434
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| Canonical SMILES |
O[C@@H](CNCCc1ccc(cc1)-c1csc(n1)C(F)(F)F)c1cccnc1
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| InChI |
InChI=1S/C19H18F3N3OS/c20-19(21,22)18-25-16(12-27-18)14-5-3-13(4-6-14)7-9-24-11-17(26)15-2-1-8-23-10-15/h1-6,8,10,12,17,24,26H,7,9,11H2/t17-/m0/s1
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| InChIKey |
MYZUCBTUHNWFNO-KRWDZBQOSA-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