General Information of the Compound
| Compound ID |
CP0249536
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| Compound Name |
MLS000392330
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| Structure |
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| Formula |
C24H18N2O3
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| Molecular Weight |
382.419
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| Canonical SMILES |
Cc1cccc(NC2=C(NC(=O)c3ccccc3)C(=O)c3ccccc3C2=O)c1
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| InChI |
InChI=1S/C24H18N2O3/c1-15-8-7-11-17(14-15)25-20-21(26-24(29)16-9-3-2-4-10-16)23(28)19-13-6-5-12-18(19)22(20)27/h2-14,25H,1H3,(H,26,29)
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| InChIKey |
OKHKBUULHCBLJI-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: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06033, Microphthalmia-associated transcription factor