430522

Source:http://linkedlifedata.com/resource/chembl/compound/430522

Download in:

Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:430522_Tenofovir disoproxil_FDA_ALTERNATIVE_NAME, synonym:430522_Tenofovir disoproxil_INN
chemicalCompound:standardIn...	InChI=1S/C19H30N5O10P/c1-12(2)33-18(25)28-9-31-35(27,32-10-29-19(26)34-13(3)4)11-30-14(5)6-24-8-23-15-16(20)21-7-22-17(15)24/h7-8,12-14H,6,9-11H2,1-5H3,(H2,20,21,22)/t14-/m1/s1
chemicalCompound:standardIn...	JFVZFKDSXNQEJW-CQSZACIVSA-N
chemicalCompound:canonicalS...	CC(C)OC(=O)OCOP(=O)(CO[C@H](C)Cn1cnc2c(N)ncnc12)OCOC(=O)OC(C)C
chemicalCompound:molecularF...	C19H30N5O10P
chemicalCompound:moleculeId	430522
chemicalCompound:mwFreebase	519.443
chemicalCompound:alogp	1.69
chemicalCompound:hba	14
chemicalCompound:hbd	1
chemicalCompound:psa	195.24
chemicalCompound:rtb	17
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	2
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	1.605
chemicalCompound:acdLogD	1.604
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	519.443
chemicalCompound:acdMostBpk...	4.196
chemicalCompound:chemblId	CHEMBL1538
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:530522
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	Yes
chemicalCompound:proDrug	No
chemicalCompound:prefName	TENOFOVIR DISOPROXIL
chemicalCompound:firstAppro...	2001
chemicalCompound:activity	activity:2602252, activity:3496377, activity:3496395, activity:3496413