674691

Source:http://linkedlifedata.com/resource/chembl/compound/674691

Download in:

Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:675145
chemicalCompound:synonym	synonym:674691_Agri-Strep_TRADE_NAME, synonym:674691_Streptomycin Sulfate_JAN, synonym:674691_Streptomycin_BAN, synonym:674691_Streptomycin_INN, synonym:674691_Streptorex_TRADE_NAME, synonym:674691_Vetstrep_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C21H39N7O12.H2O4S/c1-5-21(36,4-30)16(40-17-9(26-2)13(34)10(31)6(3-29)38-17)18(37-5)39-15-8(28-20(24)25)11(32)7(27-19(22)23)12(33)14(15)35;1-5(2,3)4/h4-18,26,29,31-36H,3H2,1-2H3,(H4,22,23,27)(H4,24,25,28);(H2,1,2,3,4)/t5-,6-,7-,8+,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,21+;/m0./s1
chemicalCompound:standardIn...	CFCMMYICHMLDCC-QXQFOYBSSA-N
chemicalCompound:canonicalS...	CN[C@H]1[C@H](O)[C@@H](O)[C@H](CO)O[C@H]1O[C@H]2[C@H](O[C@@H]3[C@@H](O)[C@H](O)[C@@H](NC(=N)N)[C@H](O)[C@H]3NC(=N)N)O[C@@H](C)[C@]2(O)C=O.OS(=O)(=O)O
chemicalCompound:molecularF...	C21H41N7O16S
chemicalCompound:moleculeId	674691
chemicalCompound:mwFreebase	581.574
chemicalCompound:alogp	-6.291
chemicalCompound:hba	19
chemicalCompound:hbd	12
chemicalCompound:psa	336.42
chemicalCompound:rtb	9
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	3
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	11.505
chemicalCompound:acdLogP	-1.746
chemicalCompound:acdLogD	-5.65
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	679.653
chemicalCompound:acdMostBpk...	10.951
chemicalCompound:chemblId	CHEMBL1200740
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:774691
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	Yes
chemicalCompound:proDrug	No
chemicalCompound:prefName	STREPTOMYCIN SULFATE
chemicalCompound:activity	activity:1684961, activity:1684962, activity:1684963, activity:2176796, activity:2176797, activity:2198685, activity:2198686, activity:2198687, activity:2198694, activity:2198702, activity:2198708, activity:2198715, activity:2198716, activity:2198717, activity:2198725, activity:2322642, activity:2322643, activity:2322644, activity:2322645, activity:2322646, activity:2322647, activity:2322648, activity:2329207, activity:2329219, activity:2329220, activity:2329241, activity:2329249, activity:2329260, activity:2331462, activity:2331463, activity:2430311, activity:2430314, activity:2430317, activity:2430320, activity:2430323, activity:2430326, activity:2430329, activity:2432401, activity:2432402, activity:2432403, activity:2432404, activity:2432405, activity:2432406, activity:2432407, activity:2432408, activity:2432409, activity:2432410, activity:2432412, activity:2433227, activity:2433228, activity:2433229, activity:2433230, activity:2433231, activity:2433232, activity:2433233, activity:2435969, activity:2435970, activity:2438522