Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:standardIn...
InChI=1S/C47H64N10O12/c1-24(2)38(55-43(65)33(22-37(60)61)54-46(68)39(26(4)58)56-42(64)31-16-11-17-49-31)45(67)50-23-36(59)52-34-21-30-19-29(28-14-9-6-10-15-28)20-35(57(30)47(34)69)44(66)51-25(3)41(63)53-32(40(48)62)18-27-12-7-5-8-13-27/h5-10,12-15,24-26,29-35,38-39,49,58H,11,16-23H2,1-4H3,(H2,48,62)(H,50,67)(H,51,66)(H,52,59)(H,53,63)(H,54,68)(H,55,65)(H,56,64)(H,60,61)/t25-,26+,29+,30+,31?,32-,33-,34-,35-,38-,39-/m0/s1
chemicalCompound:standardIn...
BZBVGLTZUIMUIG-SRPLRMEDSA-N
chemicalCompound:canonicalS...
CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)C1CCCN1)[C@@H](C)O)C(=O)NCC(=O)N[C@H]2C[C@H]3C[C@H](C[C@H](N3C2=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc4ccccc4)C(=O)N)c5ccccc5
chemicalCompound:molecularF...
C47 H64 N10 O12
chemicalCompound:moleculeId
370727
chemicalCompound:mwFreebase
961.071
chemicalCompound:alogp
-4.715
chemicalCompound:hba
13
chemicalCompound:hbd
11
chemicalCompound:psa
336.65
chemicalCompound:rtb
22
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
3
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
4.184
chemicalCompound:acdLogP
1.346
chemicalCompound:acdLogD
-1.178
chemicalCompound:molecularS...
chemicalCompound:fullMwt
961.071
chemicalCompound:acdMostBpk...
8.624
chemicalCompound:chemblId
CHEMBL221154
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