General Information of the Compound
| Compound ID |
CP0459152
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| Compound Name |
8-hydroxy-5-[2-hydroxy-1-[2-(3-methoxyphenyl)ethylamino]ethyl]-1H-quinolin-2-one
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| Structure |
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| Formula |
C20H22N2O4
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| Molecular Weight |
354.406
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| Canonical SMILES |
COc1cccc(CCNC(CO)c2ccc(O)c3[nH]c(=O)ccc23)c1
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| InChI |
InChI=1S/C20H22N2O4/c1-26-14-4-2-3-13(11-14)9-10-21-17(12-23)15-5-7-18(24)20-16(15)6-8-19(25)22-20/h2-8,11,17,21,23-24H,9-10,12H2,1H3,(H,22,25)
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| InChIKey |
YCKZXQWAUYNOTL-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