General Information of the Compound
| Compound ID |
CP0531376
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| Compound Name |
1-([1,3]oxazolo[4,5-c]pyridin-2-yl)-6-phenylhexan-1-one
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| Structure |
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| Formula |
C18H18N2O2
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| Molecular Weight |
294.354
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| Canonical SMILES |
O=C(CCCCCc1ccccc1)c1nc2cnccc2o1
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| InChI |
InChI=1S/C18H18N2O2/c21-16(18-20-15-13-19-12-11-17(15)22-18)10-6-2-5-9-14-7-3-1-4-8-14/h1,3-4,7-8,11-13H,2,5-6,9-10H2
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| InChIKey |
TTZSFRQMCLSOMH-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