ELISMETREP

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: KIB8V5UR7D

Structure
InChI Key CWEFDWIKLABKBX-UHFFFAOYSA-N
Smile O=C(O)c1ccc(S(=O)(=O)N(Cc2ccc(OC(F)(F)F)cc2)c2ncc3ccccc3c2C2CC2)cc1
InChI
InChI=1S/C27H21F3N2O5S/c28-27(29,30)37-21-11-5-17(6-12-21)16-32(38(35,36)22-13-9-19(10-14-22)26(33)34)25-24(18-7-8-18)23-4-2-1-3-20(23)15-31-25/h1-6,9-15,18H,7-8,16H2,(H,33,34)

Physicochemical Descriptors

Property Name Value
Molecular Formula C27H21F3N2O5S
Molecular Weight 542.53
AlogP 6.1
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 8.0
Polar Surface Area 96.8
Molecular species ACID
Aromatic Rings 4.0
Heavy Atoms 38.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Transient receptor potential cation channel subfamily M member 8 inhibitor Other Other

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Diabetic Neuropathies 2 D003929 ClinicalTrials
Hot Flashes 2 D019584 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL3682589
DrugBank DB15287
FDA SRS KIB8V5UR7D
Guide to Pharmacology 9774
SureChEMBL SCHEMBL12490163
ZINC ZINC000203668161
CONTENTS