General Information of the Compound
| Compound ID |
CP0121086
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| Compound Name |
6-(1-phenylethyl)-1,2-dihydropyridazine-3,4-dione
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| Structure |
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| Formula |
C12H12N2O2
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| Molecular Weight |
216.24
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| Canonical SMILES |
CC(c1ccccc1)c1cc(O)c(=O)[nH]n1
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| InChI |
InChI=1S/C12H12N2O2/c1-8(9-5-3-2-4-6-9)10-7-11(15)12(16)14-13-10/h2-8H,1H3,(H,13,15)(H,14,16)
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| InChIKey |
XKZZYQUOKITTMO-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: PT06971, D-amino-acid oxidase
Protein ID: PT03113, D-amino-acid oxidase
Protein ID: PT02547, D-amino-acid oxidase