General Information of the Compound
| Compound ID |
CP0183014
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| Compound Name |
2'-(3-chloro-2-fluorophenyl)-7'-methoxyspiro[5H-1,3-oxazole-4,9'-xanthene]-2-amine
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| Structure |
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| Formula |
C22H16ClFN2O3
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| Molecular Weight |
410.832
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| Canonical SMILES |
COc1ccc2Oc3ccc(cc3C3(COC(N)=N3)c2c1)-c1cccc(Cl)c1F
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| InChI |
InChI=1S/C22H16ClFN2O3/c1-27-13-6-8-19-16(10-13)22(11-28-21(25)26-22)15-9-12(5-7-18(15)29-19)14-3-2-4-17(23)20(14)24/h2-10H,11H2,1H3,(H2,25,26)
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| InChIKey |
HPIQWCZVOWLGJL-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