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Namespace Prefixes
Prefix | IRI |
rdf | http://www.w3.org/1999/02/22-rdf-syntax-ns# |
n3 | http://linked.opendata.cz/ontology/drugbank/ |
n2 | http://linked.opendata.cz/resource/drugbank/property/ |
xsdh | http://www.w3.org/2001/XMLSchema# |
Statements
- Subject Item
- n2:271B6107-363D-11E5-9242-09173F13E4C5
- n3:propertySource
-
ChemAxon
ADME Research, USCD
ALOGPS
PhysProp
- n3:propertyValue
-
101.47
46.25
-0.6
4-(7-benzyl-1,3-dimethyl-2,6-dioxopurin-8-yl)piperazin-1-ium
1
(3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl N-[(2S,3R)-3-hydroxy-4-[N-(2-methylpropyl)4-aminobenzenesulfonamido]-1-phenylbutan-2-yl]carbamate
O[C@H](COP(O)(O)=O)[C@@H]1O[C@H](O)[C@@H](O)[C@H](O)[C@H]1O
-3.5
CC(C)(CO[P@](O)(=O)O[P@@](O)(=O)OC[C@@H]1O[C@H]([C@H](O)[C@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CCC(O)=O
2
75.5 °C
InChI=1S/C15H12O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-9,16-17,19H/b8-3+
-0.51
0
49.87