674729

Source:http://linkedlifedata.com/resource/chembl/compound/674729

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:parent	chemicalCompound:567195
chemicalCompound:standardIn...	InChI=1S/C11H16N4O4.ClH/c1-7(15-5-10(18)13-11(19)6-15)2-14-3-8(16)12-9(17)4-14;/h7H,2-6H2,1H3,(H,12,16,17)(H,13,18,19);1H/t7-;/m0./s1
chemicalCompound:standardIn...	BIFMNMPSIYHKDN-FJXQXJEOSA-N
chemicalCompound:canonicalS...	Cl.C[C@@H](CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2
chemicalCompound:molecularF...	C11H17ClN4O4
chemicalCompound:moleculeId	674729
chemicalCompound:mwFreebase	268.269
chemicalCompound:alogp	-2.104
chemicalCompound:hba	6
chemicalCompound:hbd	2
chemicalCompound:psa	98.82
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	10.998
chemicalCompound:acdLogP	-0.914
chemicalCompound:acdLogD	-0.914
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	304.73
chemicalCompound:acdMostBpk...	2.619
chemicalCompound:chemblId	CHEMBL1200778
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:774729
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	DEXRAZOXANE HYDROCHLORIDE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:50224
chemicalCompound:firstAppro...	1995