|
rdf:type |
|
|
chemicalCompound:synonym |
|
|
chemicalCompound:standardIn... |
InChI=1S/C19H21N5O4/c1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h3-4,9-11H,5-8H2,1-2H3,(H2,20,21,22)
|
|
chemicalCompound:standardIn... |
IENZQIKPVFGBNW-UHFFFAOYSA-N
|
|
chemicalCompound:canonicalS... |
COc1cc2nc(nc(N)c2cc1OC)N3CCN(CC3)C(=O)c4occc4
|
|
chemicalCompound:molecularF... |
C19H21N5O4
|
|
chemicalCompound:moleculeId |
97
|
|
chemicalCompound:mwFreebase |
383.401
|
|
chemicalCompound:alogp |
1.487
|
|
chemicalCompound:hba |
7
|
|
chemicalCompound:hbd |
1
|
|
chemicalCompound:psa |
106.95
|
|
chemicalCompound:rtb |
4
|
|
chemicalCompound:ro3Pass |
N
|
|
chemicalCompound:numRo5viol... |
0
|
|
chemicalCompound:medChemFri... |
Y
|
|
chemicalCompound:acdLogP |
2.139
|
|
chemicalCompound:acdLogD |
2.085
|
|
chemicalCompound:molecularS... |
|
|
chemicalCompound:fullMwt |
383.401
|
|
chemicalCompound:acdMostBpk... |
6.524
|
|
chemicalCompound:chemblId |
CHEMBL2
|
|
chemicalCompound:maxPhase |
4
|
|
chemicalCompound:therapeuti... |
1
|
|
chemicalCompound:dosedIngre... |
No
|
|
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 |
PRAZOSIN
|
|
chemicalCompound:chebiParen... |
|
|
chemicalCompound:activity |
activity:33093,
activity:33094,
activity:33095,
activity:34164,
activity:34165,
activity:40935,
activity:56881,
activity:58305,
activity:58306,
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activity:140968,
activity:160411,
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activity:160415,
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activity:173832,
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activity:173835,
activity:192615,
activity:248358,
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activity:248360,
activity:284530,
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activity:284533,
activity:284534,
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activity:309443,
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activity:313856,
activity:313857,
activity:313858,
activity:313859,
activity:313860,
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activity:314928,
activity:314929,
activity:323049,
activity:323050,
activity:323051,
activity:323052,
activity:323053,
activity:323054,
activity:323055,
activity:323056,
activity:323057,
activity:323058,
activity:323059,
activity:323060,
activity:323061,
activity:323062,
activity:323063,
activity:323064,
activity:323065,
activity:323066,
activity:323067,
activity:323068,
activity:323069,
activity:323070,
activity:323071,
activity:323072,
activity:323073,
activity:323074,
activity:323075,
activity:323076,
activity:323077,
activity:323078,
activity:323079,
activity:323080,
activity:323081,
activity:323082,
activity:323083,
activity:324786,
activity:324787,
activity:324788,
activity:339836,
activity:346848,
activity:346849,
activity:346850,
activity:346851,
activity:346852,
activity:346853,
activity:346854,
activity:346855,
activity:346856,
activity:346857,
activity:346858,
activity:358251,
activity:358252,
activity:371673,
activity:371674,
activity:371675,
activity:377998,
activity:377999,
activity:378000,
activity:378001,
activity:378002,
activity:378003,
activity:378751,
activity:378752,
activity:378753,
activity:399358,
activity:399359,
activity:399360,
activity:399361,
activity:399362,
activity:399363,
activity:399364,
activity:399365,
activity:399366,
activity:399367,
activity:451135,
activity:451136,
activity:451137,
activity:451138,
activity:451139,
activity:451140,
activity:459182,
activity:459183,
activity:459184,
activity:459185,
activity:459186,
activity:459187,
activity:459188,
activity:459189,
activity:465403,
activity:465404,
activity:465405,
activity:465406,
activity:465407,
activity:465408,
activity:465409,
activity:465410,
activity:465411,
activity:465412,
activity:491739,
activity:491740,
activity:491741,
activity:491742,
activity:491743,
activity:497907,
activity:499411,
activity:499412,
activity:499413,
activity:499414,
activity:510915,
activity:510916,
activity:510917,
activity:510918
|
