|
rdf:type |
|
|
chemicalCompound:synonym |
|
|
chemicalCompound:standardIn... |
InChI=1S/C10H26N4/c11-5-3-9-13-7-1-2-8-14-10-4-6-12/h13-14H,1-12H2
|
|
chemicalCompound:standardIn... |
PFNFFQXMRSDOHW-UHFFFAOYSA-N
|
|
chemicalCompound:canonicalS... |
NCCCNCCCCNCCCN
|
|
chemicalCompound:molecularF... |
C10H26N4
|
|
chemicalCompound:moleculeId |
30697
|
|
chemicalCompound:mwFreebase |
202.34
|
|
chemicalCompound:alogp |
-1.504
|
|
chemicalCompound:hba |
4
|
|
chemicalCompound:hbd |
4
|
|
chemicalCompound:psa |
76.09
|
|
chemicalCompound:rtb |
11
|
|
chemicalCompound:ro3Pass |
N
|
|
chemicalCompound:numRo5viol... |
0
|
|
chemicalCompound:medChemFri... |
Y
|
|
chemicalCompound:acdLogP |
-0.543
|
|
chemicalCompound:acdLogD |
-6.292
|
|
chemicalCompound:molecularS... |
|
|
chemicalCompound:fullMwt |
202.34
|
|
chemicalCompound:acdMostBpk... |
10.88
|
|
chemicalCompound:chemblId |
CHEMBL23194
|
|
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:prefName |
SPERMINE
|
|
chemicalCompound:chebiParen... |
|
|
chemicalCompound:activity |
activity:86108,
activity:86109,
activity:86110,
activity:86111,
activity:98816,
activity:184919,
activity:222716,
activity:222717,
activity:408021,
activity:408022,
activity:541554,
activity:541555,
activity:541556,
activity:541557,
activity:541558,
activity:541559,
activity:541560,
activity:541561,
activity:541562,
activity:541563,
activity:541564,
activity:541565,
activity:541566,
activity:541567,
activity:541568,
activity:541569,
activity:541570,
activity:541571,
activity:541572,
activity:541573,
activity:541574,
activity:541575,
activity:702015,
activity:760194,
activity:869822,
activity:880687,
activity:880688,
activity:880689,
activity:880690,
activity:933498,
activity:971610,
activity:971611,
activity:971612,
activity:971613,
activity:971614,
activity:971615,
activity:971616,
activity:971617,
activity:985257,
activity:985258,
activity:985259,
activity:985260,
activity:1044037,
activity:1044038,
activity:1044039,
activity:1044040,
activity:1044041,
activity:1044042,
activity:1044043,
activity:1044044,
activity:1044045,
activity:1044046,
activity:1044047,
activity:1044048
|
