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16847
Source:
http://linkedlifedata.com/resource/chembl/compound/16847
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Subject
(
100
of
many
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:synonym
synonym:16847_Enalapril_FDA_ALTERNATIVE_NAME
,
synonym:16847_Enalapril_INN
,
synonym:16847_Lexxel_OTHER
,
synonym:16847_Vaseretic_OTHER
,
synonym:16847_Vasotec_OTHER
,
synonym:16847_Vasotec_TRADE_NAME
chemicalCompound:standardIn...
InChI=1S/C20H28N2O5/c1-3-27-20(26)16(12-11-15-8-5-4-6-9-15)21-14(2)18(23)22-13-7-10-17(22)19(24)25/h4-6,8-9,14,16-17,21H,3,7,10-13H2,1-2H3,(H,24,25)/t14-,16-,17-/m0/s1
chemicalCompound:standardIn...
GBXSMTUPTTWBMN-XIRDDKMYSA-N
chemicalCompound:canonicalS...
CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)O
chemicalCompound:molecularF...
C20H28N2O5
chemicalCompound:moleculeId
16847
chemicalCompound:mwFreebase
376.447
chemicalCompound:alogp
-0.541
chemicalCompound:hba
6
chemicalCompound:hbd
2
chemicalCompound:psa
95.94
chemicalCompound:rtb
10
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
3.148
chemicalCompound:acdLogP
3.247
chemicalCompound:acdLogD
-0.321
chemicalCompound:molecularS...
molecularSpecies:ACID
chemicalCompound:fullMwt
376.447
chemicalCompound:acdMostBpk...
5.427
chemicalCompound:chemblId
CHEMBL578
chemicalCompound:maxPhase
4
chemicalCompound:therapeuti...
1
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:116847
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
Yes
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:prefName
ENALAPRIL
chemicalCompound:chebiParen...
https://linkedlifedata.com/resource/chebi/id/CHEBI:4784
chemicalCompound:firstAppro...
1984
chemicalCompound:activity
activity:92112
,
activity:92113
,
activity:92114
,
activity:92115
,
activity:92116
,
activity:92117
,
activity:92118
,
activity:92119
,
activity:92120
,
activity:92121
,
activity:92122
,
activity:92123
,
activity:92124
,
activity:92125
,
activity:92126
,
activity:92127
,
activity:92128
,
activity:92129
,
activity:92130
,
activity:92131
,
activity:92132
,
activity:92133
,
activity:92134
,
activity:92135
,
activity:92136
,
activity:92137
,
activity:92138
,
activity:92139
,
activity:92140
,
activity:92141
,
activity:92142
,
activity:92143
,
activity:92144
,
activity:92145
,
activity:291875
,
activity:291876
,
activity:291877
,
activity:291878
,
activity:291879
,
activity:291880
,
activity:291881
,
activity:291882
,
activity:291883
,
activity:307966
,
activity:307967
,
activity:307968
,
activity:313336
,
activity:347039
,
activity:347040
,
activity:347041
,
activity:347042
,
activity:347043
,
activity:347044
,
activity:347045
,
activity:347046
,
activity:347047
,
activity:459348
More...