MetaADEDB 2.0 @ LMMD
BILN 2061
(PJZPDFUUXKKDNB-KNINVFKUSA-N)
Structure
SMILES
COc1ccc2c(c1)nc(cc2O[C@@H]1C[C@@H]2N(C1)C(=O)[C@H](CCCCC/C=C\[C@H]1[C@](NC2=O)(C1)C(=O)O)NC(=O)OC1CCCC1)c1csc(n1)NC(C)C
Type(s)
Investigational
Molecular Formula:
C40H50N6O8S
Molecular Weight:
774.925
Log P:
6.7833
Hydrogen Bond Acceptor:
15
Hydrogen Bond Donor:
4
TPSA:
209.55
CAS Number(s):
300832-84-2
Synonym(s)
1.
BILN 2061
2.
BILN-2061
3.
BILN2061
External Link(s)
MeSHC479555
PubChem Compound9853710
BindingDB50142916
CHEMBLCHEMBL297884
DrugBankDB05868
Therapeutic Target DatabaseD0OZ7P
ZINC150339466
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Ventricular Dysfunction, Left21441227CTD
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