Statements in which the resource exists as a subject.
PredicateObject
chemicalCompound:standardIn...
InChI=1S/C20H23N7O7/c21-20-25-16-15(18(32)26-20)27(9-28)12(8-23-16)7-22-11-3-1-10(2-4-11)17(31)24-13(19(33)34)5-6-14(29)30/h1-4,9,12-13,22H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,23,25,26,32)/t12-,13-/m0/s1
chemicalCompound:standardIn...
VVIAGPKUTFNRDU-STQMWFEESA-N
chemicalCompound:canonicalS...
NC1=NC(=O)C2=C(NC[C@H](CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)N2C=O)N1
chemicalCompound:molecularF...
C20H23N7O7
chemicalCompound:moleculeId
1248760
chemicalCompound:mwFreebase
473.439
chemicalCompound:alogp
-1.613
chemicalCompound:hba
12
chemicalCompound:hbd
7
chemicalCompound:psa
215.55
chemicalCompound:rtb
9
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
2
chemicalCompound:medChemFri...
N
chemicalCompound:acdMostApk...
3.509
chemicalCompound:acdLogP
-1.429
chemicalCompound:acdLogD
-6.048
chemicalCompound:molecularS...
chemicalCompound:fullMwt
473.439
chemicalCompound:acdMostBpk...
5.66
chemicalCompound:chemblId
CHEMBL1908841
chemicalCompound:maxPhase
4
chemicalCompound:therapeuti...
1
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
chemicalCompound:chebi
chemicalCompound:moleculeTy...
chemicalCompound:oral
No
chemicalCompound:parenteral
Yes
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:firstAppro...
2008