Statements in which the resource exists as a subject.
PredicateObject
chemicalCompound:standardIn...
InChI=1S/C27H25FNO5P/c1-16(2)26-22(11-12-35(33,34)15-20(30)14-24(31)32)25(17-7-9-19(28)10-8-17)23-13-18-5-3-4-6-21(18)27(23)29-26/h3-10,16,20,30H,13-15H2,1-2H3,(H,31,32)(H,33,34)/t20-/m1/s1
chemicalCompound:standardIn...
CRNIQHGKEZGLST-HXUWFJFHSA-N
chemicalCompound:canonicalS...
CC(C)c1nc2c(Cc3ccccc23)c(c4ccc(F)cc4)c1C#CP(=O)(O)C[C@H](O)CC(=O)O
chemicalCompound:molecularF...
C27H25FNO5P
chemicalCompound:moleculeId
678513
chemicalCompound:mwFreebase
493.463
chemicalCompound:alogp
4.773
chemicalCompound:hba
6
chemicalCompound:hbd
3
chemicalCompound:psa
117.53
chemicalCompound:rtb
8
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
N
chemicalCompound:acdMostApk...
0.979
chemicalCompound:acdLogP
4.744
chemicalCompound:acdLogD
0
chemicalCompound:molecularS...
chemicalCompound:fullMwt
493.463
chemicalCompound:acdMostBpk...
3.909
chemicalCompound:chemblId
CHEMBL1204562
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
chemicalCompound:chebi
chemicalCompound:moleculeTy...
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No