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675700
Source:
http://linkedlifedata.com/resource/chembl/compound/675700
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Subject
(
50
)
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Inference
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Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:synonym
synonym:675700_Difluprednate_INN
,
synonym:675700_Difluprednate_USAN
chemicalCompound:standardIn...
InChI=1S/C27H34F2O7/c1-5-6-23(34)36-26(22(33)14-35-15(2)30)10-8-17-18-12-20(28)19-11-16(31)7-9-24(19,3)27(18,29)21(32)13-25(17,26)4/h7,9,11,17-18,20-21,32H,5-6,8,10,12-14H2,1-4H3/t17-,18-,20-,21-,24-,25-,26-,27-/m0/s1
chemicalCompound:standardIn...
WYQPLTPSGFELIB-JTQPXKBDSA-N
chemicalCompound:canonicalS...
CCCC(=O)O[C@@]1(CC[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)COC(=O)C
chemicalCompound:molecularF...
C27H34F2O7
chemicalCompound:moleculeId
675700
chemicalCompound:mwFreebase
508.551
chemicalCompound:alogp
3.108
chemicalCompound:hba
7
chemicalCompound:hbd
1
chemicalCompound:psa
106.97
chemicalCompound:rtb
8
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
1
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
12.559
chemicalCompound:acdLogP
2.936
chemicalCompound:acdLogD
2.936
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
chemicalCompound:fullMwt
508.551
chemicalCompound:chemblId
CHEMBL1201749
chemicalCompound:maxPhase
4
chemicalCompound:therapeuti...
1
chemicalCompound:dosedIngre...
Yes
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:775700
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
Yes
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
Yes
chemicalCompound:proDrug
Yes
chemicalCompound:prefName
DIFLUPREDNATE
chemicalCompound:firstAppro...
2008
chemicalCompound:activity
activity:3638698
,
activity:3818057
,
activity:4000648
,
activity:4117673
,
activity:4473300
,
activity:4519724
,
activity:4901143
,
activity:4935218
,
activity:5574359
,
activity:6570045
,
activity:6725435
,
activity:7165366
,
activity:7362963