General Information of the Compound
| Compound ID |
CP0436152
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| Compound Name |
8-hydroxy-5-[1-hydroxy-2-(3-naphthalen-2-ylpropylamino)ethyl]-1H-quinolin-2-one
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| Structure |
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| Formula |
C24H24N2O3
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| Molecular Weight |
388.467
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| Canonical SMILES |
OC(CNCCCc1ccc2ccccc2c1)c1ccc(O)c2[nH]c(=O)ccc12
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| InChI |
InChI=1S/C24H24N2O3/c27-21-11-9-19(20-10-12-23(29)26-24(20)21)22(28)15-25-13-3-4-16-7-8-17-5-1-2-6-18(17)14-16/h1-2,5-12,14,22,25,27-28H,3-4,13,15H2,(H,26,29)
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| InChIKey |
DKVWUTVZDWXCEK-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
Protein ID: PT01179, Beta-1 adrenergic receptor
Protein ID: PT01494, Beta-2 adrenergic receptor