|
rdf:type |
|
|
chemicalCompound:synonym |
|
|
chemicalCompound:standardIn... |
InChI=1S/C15H17FN4O3/c1-2-19-8-10(15(22)23)12(21)9-7-11(16)14(18-13(9)19)20-5-3-17-4-6-20/h7-8,17H,2-6H2,1H3,(H,22,23)
|
|
chemicalCompound:standardIn... |
IDYZIJYBMGIQMJ-UHFFFAOYSA-N
|
|
chemicalCompound:canonicalS... |
CCN1C=C(C(=O)O)C(=O)c2cc(F)c(nc12)N3CCNCC3
|
|
chemicalCompound:molecularF... |
C15H17FN4O3
|
|
chemicalCompound:moleculeId |
57175
|
|
chemicalCompound:mwFreebase |
320.319
|
|
chemicalCompound:alogp |
-1.483
|
|
chemicalCompound:hba |
7
|
|
chemicalCompound:hbd |
2
|
|
chemicalCompound:psa |
85.77
|
|
chemicalCompound:rtb |
3
|
|
chemicalCompound:ro3Pass |
N
|
|
chemicalCompound:numRo5viol... |
0
|
|
chemicalCompound:medChemFri... |
N
|
|
chemicalCompound:acdMostApk... |
6.043
|
|
chemicalCompound:acdLogP |
1.589
|
|
chemicalCompound:acdLogD |
-0.624
|
|
chemicalCompound:molecularS... |
|
|
chemicalCompound:fullMwt |
320.319
|
|
chemicalCompound:acdMostBpk... |
8.188
|
|
chemicalCompound:chemblId |
CHEMBL826
|
|
chemicalCompound:maxPhase |
4
|
|
chemicalCompound:therapeuti... |
1
|
|
chemicalCompound:dosedIngre... |
Yes
|
|
chemicalCompound:structureT... |
|
|
chemicalCompound:chebi |
|
|
chemicalCompound:moleculeTy... |
|
|
chemicalCompound:oral |
Yes
|
|
chemicalCompound:parenteral |
No
|
|
chemicalCompound:topical |
No
|
|
chemicalCompound:blackBoxWa... |
No
|
|
chemicalCompound:naturalPro... |
No
|
|
chemicalCompound:proDrug |
No
|
|
chemicalCompound:prefName |
ENOXACIN
|
|
chemicalCompound:chebiParen... |
|
|
chemicalCompound:firstAppro... |
1986
|
|
chemicalCompound:activity |
activity:161379,
activity:161380,
activity:161381,
activity:161382,
activity:161383,
activity:161384,
activity:288201,
activity:288202,
activity:288203,
activity:288204,
activity:288205,
activity:288206,
activity:308394,
activity:308395,
activity:308396,
activity:308397,
activity:308398,
activity:308399,
activity:308400,
activity:308401,
activity:308402,
activity:308403,
activity:308404,
activity:308405,
activity:308406,
activity:308407,
activity:308408,
activity:308409,
activity:308410,
activity:308411,
activity:390555,
activity:390556,
activity:390557,
activity:390558,
activity:390559,
activity:390560,
activity:390561,
activity:390562,
activity:390563,
activity:583115,
activity:583116,
activity:583117,
activity:583118,
activity:583119,
activity:583120,
activity:583121,
activity:583122,
activity:583123,
activity:583124,
activity:583125,
activity:583126,
activity:636856,
activity:682515
|
