General Information of the Compound
| Compound ID |
CP0057474
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| Compound Name |
(2S,4R)-4-Mercapto-2-(2,4,5-trifluoro-benzyloxymethyl)-pyrrolidine-1-carboxylic acid 2-methoxycarbonyl-phenyl ester
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| Synonyms |
130735-56-7
2-(4-Morpholinyl)-4H-1-benzopyran-4-one
2-(4-Morpholinyl)-4H-benzopyran-4-one
2-Morpholin-4-yl-chromen-4-one
2-morpholin-4-ylchromen-4-one
2-morpholino-4H-chromen-4-one
2-morpholinochromone
4H-1-Benzopyran-4-one, 2-(4-morpholinyl)-
AC1L2YUR
BDBM50098118
CHEMBL367315
DTXSID30156701
LY-292223
QNFWERYZJLBANZ-UHFFFAOYSA-N
SCHEMBL3361567
U-67154
U67154
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| Structure |
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| Formula |
C13H13NO3
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| Molecular Weight |
231.251
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| Canonical SMILES |
O=c1cc(oc2ccccc12)N1CCOCC1
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| InChI |
InChI=1S/C13H13NO3/c15-11-9-13(14-5-7-16-8-6-14)17-12-4-2-1-3-10(11)12/h1-4,9H,5-8H2
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| InChIKey |
QNFWERYZJLBANZ-UHFFFAOYSA-N
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| CAS |
130735-56-7
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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
Clinical Information about the Compound
Drug 1 ( LY-292223 )
| Drug Name | LY-292223 | ||
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