BMS-903452

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 49731B9ULN

Structure
InChI Key OGIAVRWXUPYGGC-UHFFFAOYSA-N
Smile CS(=O)(=O)c1ccc(-n2cc(Cl)c(OC3CCN(c4ncc(Cl)cn4)CC3)cc2=O)c(F)c1
InChI
InChI=1S/C21H19Cl2FN4O4S/c1-33(30,31)15-2-3-18(17(24)8-15)28-12-16(23)19(9-20(28)29)32-14-4-6-27(7-5-14)21-25-10-13(22)11-26-21/h2-3,8-12,14H,4-7H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H19Cl2FN4O4S
Molecular Weight 513.38
AlogP 3.52
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 5.0
Polar Surface Area 94.39
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 33.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Ion channel Voltage-gated ion channel Potassium channels Voltage-gated potassium channel
- 1400 - - -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Lipid-like ligand receptor (family A GPCR)
14 - - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Diabetes Mellitus 1 D003920 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 1339944-47-6
ChEMBL CHEMBL3338194
DrugBank DB11773
FDA SRS 49731B9ULN
PubChem 53477157
SureChEMBL SCHEMBL2518877
CONTENTS