MetaADEDB 2.0 @ LMMD
CB-839
(PRAAPINBUWJLGA-UHFFFAOYSA-N)
Structure
SMILES
O=C(Nc1ccc(nn1)CCCCc1nnc(s1)NC(=O)Cc1ccccn1)Cc1cccc(c1)OC(F)(F)F
Type(s)
Investigational
Molecular Formula:
C26H24F3N7O3S
Molecular Weight:
571.574
Log P:
4.6955
Hydrogen Bond Acceptor:
11
Hydrogen Bond Donor:
2
TPSA:
160.12
CAS Number(s):
1439399-58-2
Synonym(s)
1.
CB-839
External Link(s)
MeSHC000593334
PubChem Compound71577426
BindingDB109086
CHEMBLCHEMBL3639788
DrugBankDB15232
IUPHAR/BPS Guide to PHARMACOLOGY9053
ZINC169698697
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Triple Negative Breast Neoplasms31040181CTD
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