|
rdf:type |
|
|
chemicalCompound:parent |
|
|
chemicalCompound:synonym |
|
|
chemicalCompound:standardIn... |
InChI=1S/C27H42NO2.ClH/c1-26(2,3)22-27(4,5)24-13-15-25(16-14-24)30-20-19-29-18-17-28(6,7)21-23-11-9-8-10-12-23;/h8-16H,17-22H2,1-7H3;1H/q+1;/p-1
|
|
chemicalCompound:standardIn... |
UREZNYTWGJKWBI-UHFFFAOYSA-M
|
|
chemicalCompound:canonicalS... |
[Cl-].CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1
|
|
chemicalCompound:molecularF... |
C27 H42 N O2 . Cl
|
|
chemicalCompound:moleculeId |
368083
|
|
chemicalCompound:mwFreebase |
412.628
|
|
chemicalCompound:fullMwt |
448.081
|
|
chemicalCompound:chemblId |
CHEMBL221753
|
|
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 |
BENZETHONIUM CHLORIDE
|
|
chemicalCompound:activity |
activity:1816701,
activity:1816702,
activity:3607211,
activity:3607752,
activity:3634553,
activity:3658579,
activity:3698475,
activity:3737645,
activity:3768727,
activity:3769521,
activity:3773607,
activity:3774845,
activity:3777933,
activity:3778946,
activity:3806872,
activity:3869338,
activity:3884210,
activity:3894630,
activity:3895567,
activity:3902902,
activity:3904812,
activity:3919756,
activity:3933801,
activity:3937162,
activity:3950122,
activity:3951382,
activity:4029214,
activity:4057264,
activity:4078802,
activity:4083864,
activity:4085407,
activity:4106428,
activity:4114107,
activity:4127630,
activity:4139102,
activity:4189269,
activity:4236042,
activity:4291505,
activity:4302711,
activity:4360063,
activity:4371330,
activity:4388892,
activity:4394516,
activity:4410239,
activity:4470676,
activity:4553190,
activity:4584530,
activity:4587261,
activity:4674495,
activity:4675070,
activity:4682415,
activity:4690495,
activity:4717897,
activity:4723539,
activity:4749390,
activity:4783696,
activity:4806753,
activity:4858042,
activity:4865174,
activity:4872708,
activity:4876652,
activity:4896457,
activity:4901641,
activity:4902118,
activity:4976550,
activity:4984483,
activity:4992823,
activity:4998119,
activity:5016844,
activity:5019250,
activity:5019639,
activity:5020122,
activity:5022747,
activity:5066871,
activity:5069043,
activity:5078281
|
