458912

Source:http://linkedlifedata.com/resource/chembl/compound/458912

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Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:921
chemicalCompound:synonym	synonym:458912_Dilantin_TRADE_NAME, synonym:458912_Diphenylan sodium_TRADE_NAME, synonym:458912_Diphenylhydantoin Sodium_OTHER, synonym:458912_Extended phenytoin sodium_TRADE_NAME, synonym:458912_Phenytek_TRADE_NAME, synonym:458912_Phenytex_TRADE_NAME, synonym:458912_Phenytoin Sodium_JAN, synonym:458912_Phenytoin Sodium_USAN, synonym:458912_Phenytoin Sodium_USP, synonym:458912_Phenytoin sodium_FDA_ALTERNATIVE_NAME, synonym:458912_Phenytoin sodium_TRADE_NAME, synonym:458912_Prompt phenytoin sodium_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C15H12N2O2.Na/c18-13-15(17-14(19)16-13,11-7-3-1-4-8-11)12-9-5-2-6-10-12;/h1-10H,(H2,16,17,18,19);/q;+1/p-1
chemicalCompound:standardIn...	FJPYVLNWWICYDW-UHFFFAOYSA-M
chemicalCompound:canonicalS...	[Na+].[O-]C1=NC(=O)C(N1)(c2ccccc2)c3ccccc3
chemicalCompound:molecularF...	C15H11N2NaO2
chemicalCompound:moleculeId	458912
chemicalCompound:mwFreebase	252.268
chemicalCompound:alogp	2.105
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	58.2
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	8.278
chemicalCompound:acdLogP	1.421
chemicalCompound:acdLogD	1.384
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	274.25
chemicalCompound:chemblId	CHEMBL1611
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:558912
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	PHENYTOIN SODIUM
chemicalCompound:activity	activity:386383, activity:386384, activity:386385, activity:386386, activity:386387, activity:386388, activity:386389, activity:2283543, activity:2283544, activity:2283545, activity:2716389, activity:3268984, activity:3351039, activity:3472851, activity:3644843, activity:3782848, activity:3940435, activity:3996943, activity:4358632, activity:4437145, activity:4671043, activity:4741973, activity:4807483, activity:4857802, activity:4876864, activity:4913844, activity:4963837, activity:5025559, activity:5724071, activity:6001594, activity:6029281, activity:6032571, activity:6034928, activity:6035833, activity:6958615, activity:7079280, activity:7367093, activity:8009591, activity:8019210