General Information of the Compound
| Compound ID |
CP0548003
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| Compound Name |
N-[4-[2-[[2-hydroxy-1-(8-hydroxy-2-oxo-1H-quinolin-5-yl)ethyl]amino]ethyl]phenyl]-3-methylbutanamide
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| Structure |
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| Formula |
C24H29N3O4
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| Molecular Weight |
423.513
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| Canonical SMILES |
CC(C)CC(=O)Nc1ccc(CCNC(CO)c2ccc(O)c3[nH]c(=O)ccc23)cc1
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| InChI |
InChI=1S/C24H29N3O4/c1-15(2)13-23(31)26-17-5-3-16(4-6-17)11-12-25-20(14-28)18-7-9-21(29)24-19(18)8-10-22(30)27-24/h3-10,15,20,25,28-29H,11-14H2,1-2H3,(H,26,31)(H,27,30)
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| InChIKey |
ROMHRMAOWCDPJQ-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