molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL4462423 |
|
IC50 |
= |
54.0 |
nM |
384.89 |
CN(C(=O)CNC(=O)/C=C/c1cccc(Cl)c1)C1CCS(=O)(=O)CC1 |
Homo sapiens |
CHEMBL4418633 |
cell-based format |
CHEMBL4544912 |
OBDepict
CH
3
N
O
HN
S
O
O
O
Cl
|
IC50 |
= |
72.0 |
nM |
398.91 |
CCN(C(=O)CNC(=O)/C=C/c1cccc(Cl)c1)C1CCS(=O)(=O)CC1 |
Homo sapiens |
CHEMBL4418633 |
cell-based format |
CHEMBL1330145 |
OBDepict
O
O
N
O
H
3
C
+
N
O
_
O
S
O
O
|
IC50 |
= |
270.0 |
nM |
382.39 |
CN(C(=O)COC(=O)/C=C/c1cccc([N+](=O)[O-])c1)C1CCS(=O)(=O)C1 |
Homo sapiens |
CHEMBL4418633 |
cell-based format |