General Information of the Compound
| Compound ID |
CP0514102
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| Compound Name |
5-[1-[2-(4-aminophenyl)ethylamino]-2-hydroxyethyl]-8-hydroxy-1H-quinolin-2-one
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| Structure |
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| Formula |
C19H21N3O3
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| Molecular Weight |
339.395
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| Canonical SMILES |
Nc1ccc(CCNC(CO)c2ccc(O)c3[nH]c(=O)ccc23)cc1
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| InChI |
InChI=1S/C19H21N3O3/c20-13-3-1-12(2-4-13)9-10-21-16(11-23)14-5-7-17(24)19-15(14)6-8-18(25)22-19/h1-8,16,21,23-24H,9-11,20H2,(H,22,25)
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| InChIKey |
QHTCXINUJQYURQ-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