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675714
Source:
http://linkedlifedata.com/resource/chembl/compound/675714
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Subject
(
37
)
Predicate
Object
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists as a subject.
Predicate
Object
chemicalCompound:parent
chemicalCompound:675713
chemicalCompound:synonym
synonym:675714_Clevidipine Butyrate_USAN
,
synonym:675714_Clevidipine butyrate_OTHER
chemicalCompound:standardIn...
InChI=1S/C21H23Cl2NO6.C6H12O2/c1-5-7-15(25)29-10-30-21(27)17-12(3)24-11(2)16(20(26)28-4)18(17)13-8-6-9-14(22)19(13)23;1-3-5-6(7)8-4-2/h6,8-9,18,24H,5,7,10H2,1-4H3;3-5H2,1-2H3/t18-;/m1./s1
chemicalCompound:standardIn...
NHSDHLCKVJUDFP-GMUIIQOCSA-N
chemicalCompound:canonicalS...
CCCC(=O)OCC.CCCC(=O)OCOC(=O)C1=C(C)NC(=C([C@H]1c2cccc(Cl)c2Cl)C(=O)OC)C
chemicalCompound:molecularF...
C27H35Cl2NO8
chemicalCompound:moleculeId
675714
chemicalCompound:mwFreebase
456.316
chemicalCompound:alogp
4.145
chemicalCompound:hba
7
chemicalCompound:hbd
1
chemicalCompound:psa
90.93
chemicalCompound:rtb
10
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
N
chemicalCompound:acdLogP
5.11
chemicalCompound:acdLogD
5.11
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
chemicalCompound:fullMwt
572.475
chemicalCompound:acdMostBpk...
2.452
chemicalCompound:chemblId
CHEMBL1201763
chemicalCompound:maxPhase
4
chemicalCompound:therapeuti...
1
chemicalCompound:dosedIngre...
Yes
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:775714
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
No
chemicalCompound:parenteral
Yes
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:prefName
CLEVIDIPINE BUTYRATE
chemicalCompound:firstAppro...
2008