Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:parent
chemicalCompound:standardIn...
InChI=1S/C13H20N2.C2H2O4/c1-2-7-15-8-3-4-12-9-11(10-14)5-6-13(12)15;3-1(4)2(5)6/h5-6,9H,2-4,7-8,10,14H2,1H3;(H,3,4)(H,5,6)
chemicalCompound:standardIn...
QDBRBZWCXUODAF-UHFFFAOYSA-N
chemicalCompound:canonicalS...
CCCN1CCCc2cc(CN)ccc12.OC(=O)C(=O)O
chemicalCompound:molecularF...
C15H22N2O4
chemicalCompound:moleculeId
788613
chemicalCompound:mwFreebase
204.311
chemicalCompound:alogp
2.501
chemicalCompound:hba
2
chemicalCompound:hbd
1
chemicalCompound:psa
29.26
chemicalCompound:rtb
3
chemicalCompound:ro3Pass
Y
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdLogP
2.585
chemicalCompound:acdLogD
0.326
chemicalCompound:molecularS...
chemicalCompound:fullMwt
294.346
chemicalCompound:acdMostBpk...
9.425
chemicalCompound:chemblId
CHEMBL1364729
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
chemicalCompound:chebi
chemicalCompound:moleculeTy...
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:activity
activity:3615203, activity:3641940, activity:3690657, activity:3723071, activity:3763482, activity:3778632, activity:3796652, activity:3803403, activity:3973693, activity:4039114, activity:4089594, activity:4106081, activity:4177126, activity:4257979, activity:4291205, activity:4320631, activity:4341817, activity:4356917, activity:4373041, activity:4388364, activity:4575011, activity:4587408, activity:4597863, activity:4613425, activity:4676858, activity:4827649, activity:4838198, activity:4846950, activity:4942395, activity:5021962, activity:5383476, activity:5448240, activity:5503950, activity:5712372, activity:5813305, activity:5901655, activity:6427312, activity:6475784, activity:6549766, activity:6630994, activity:6768258, activity:6773406, activity:6801132, activity:6883836, activity:6896037, activity:6970164, activity:7049369, activity:7148467, activity:7200601, activity:7287365, activity:7338041