Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:standardIn...
InChI=1S/C43H62N8O11S2/c1-6-23(3)34-41(60)46-30(17-18-63-5)43(62)64-22-33(40(59)45-29(7-2)37(56)47-31(38(57)50-34)20-25-11-9-8-10-12-25)49-42(61)35(24(4)53)51-39(58)32(21-52)48-36(55)28(44)19-26-13-15-27(54)16-14-26/h8-16,23-24,28-35,52-54H,6-7,17-22,44H2,1-5H3,(H,45,59)(H,46,60)(H,47,56)(H,48,55)(H,49,61)(H,50,57)(H,51,58)/t23-,24+,28-,29?,30+,31+,32-,33-,34-,35-/m0/s1
chemicalCompound:standardIn...
BOWAMPLNHPWOMR-SRJDLDIISA-N
chemicalCompound:canonicalS...
CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)C(CC)NC(=O)[C@H](CSC(=O)[C@@H](CCSC)NC1=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc3ccc(O)cc3)[C@@H](C)O
chemicalCompound:molecularF...
C43 H62 N8 O11 S2
chemicalCompound:moleculeId
305613
chemicalCompound:mwFreebase
931.129
chemicalCompound:alogp
0
chemicalCompound:hba
14
chemicalCompound:hbd
11
chemicalCompound:psa
358.08
chemicalCompound:rtb
18
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
3
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
9.967
chemicalCompound:acdLogP
3.091
chemicalCompound:acdLogD
2.916
chemicalCompound:molecularS...
chemicalCompound:fullMwt
931.129
chemicalCompound:acdMostBpk...
7.092
chemicalCompound:chemblId
CHEMBL183830
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
chemicalCompound:activity