General Information of the Compound
| Compound ID |
CP0464711
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| Compound Name |
6-[2-(5-phenyl-2,3-dihydro-1H-indene-2-carbonyl)-1,3-oxazol-5-yl]pyridine-2-carboxylic acid
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| Structure |
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| Formula |
C25H18N2O4
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| Molecular Weight |
410.429
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| Canonical SMILES |
OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)C1Cc2ccc(cc2C1)-c1ccccc1
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| InChI |
InChI=1S/C25H18N2O4/c28-23(24-26-14-22(31-24)20-7-4-8-21(27-20)25(29)30)19-12-17-10-9-16(11-18(17)13-19)15-5-2-1-3-6-15/h1-11,14,19H,12-13H2,(H,29,30)
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| InChIKey |
VSZPRUWZAVPUOL-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