General Information of the Compound
| Compound ID |
CP0567326
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| Compound Name |
5-[2-[[4,4-bis(4-fluorophenyl)-2-methylbutan-2-yl]amino]-1-hydroxyethyl]-8-hydroxy-1H-quinolin-2-one
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| Structure |
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| Formula |
C28H28F2N2O3
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| Molecular Weight |
478.539
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| Canonical SMILES |
CC(C)(CC(c1ccc(F)cc1)c1ccc(F)cc1)NCC(O)c1ccc(O)c2[nH]c(=O)ccc12
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| InChI |
InChI=1S/C28H28F2N2O3/c1-28(2,15-23(17-3-7-19(29)8-4-17)18-5-9-20(30)10-6-18)31-16-25(34)21-11-13-24(33)27-22(21)12-14-26(35)32-27/h3-14,23,25,31,33-34H,15-16H2,1-2H3,(H,32,35)
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| InChIKey |
PBWAFYKWWMLLGW-UHFFFAOYSA-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