GIRIPLADIB

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 1W10Q5H7WD

Structure
InChI Key NHHBNHIPCSPSHQ-UHFFFAOYSA-N
Smile O=C(O)c1ccc(CCCc2c(CCNS(=O)(=O)Cc3ccccc3C(F)(F)F)n(C(c3ccccc3)c3ccccc3)c3ccc(Cl)cc23)cc1
InChI
InChI=1S/C41H36ClF3N2O4S/c42-33-22-23-37-35(26-33)34(16-9-10-28-18-20-31(21-19-28)40(48)49)38(47(37)39(29-11-3-1-4-12-29)30-13-5-2-6-14-30)24-25-46-52(50,51)27-32-15-7-8-17-36(32)41(43,44)45/h1-8,11-15,17-23,26,39,46H,9-10,16,24-25,27H2,(H,48,49)

Physicochemical Descriptors

Property Name Value
Molecular Formula C41H36ClF3N2O4S
Molecular Weight 745.26
AlogP 9.49
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 14.0
Polar Surface Area 88.4
Molecular species ACID
Aromatic Rings 6.0
Heavy Atoms 52.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Cytosolic phospholipase A2 inhibitor PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Osteoarthritis 2 D010003 ClinicalTrials
Arthritis, Rheumatoid 1 D001172 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL2104969
DrugBank DB15426
EPA CompTox DTXSID00471130
FDA SRS 1W10Q5H7WD
PubChem 11721842
SureChEMBL SCHEMBL2885811
ZINC ZINC000085537113
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