General Information of the Compound
| Compound ID |
CP0378286
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| Compound Name |
(R)-2-(4-(2-phenylthiazol-4-yl)phenethylamino)-1-(pyridin-3-yl)ethanol
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| Structure |
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| Formula |
C24H23N3OS
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| Molecular Weight |
401.535
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| Canonical SMILES |
O[C@@H](CNCCc1ccc(cc1)-c1csc(n1)-c1ccccc1)c1cccnc1
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| InChI |
InChI=1S/C24H23N3OS/c28-23(21-7-4-13-25-15-21)16-26-14-12-18-8-10-19(11-9-18)22-17-29-24(27-22)20-5-2-1-3-6-20/h1-11,13,15,17,23,26,28H,12,14,16H2/t23-/m0/s1
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| InChIKey |
IVYVLKJUKLKWIR-QHCPKHFHSA-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