REBAMIPIDE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: A02BX14
UNII: LR583V32ZR

Structure
InChI Key ALLWOAVDORUJLA-UHFFFAOYSA-N
Smile O=C(NC(Cc1cc(=O)[nH]c2ccccc12)C(=O)O)c1ccc(Cl)cc1
InChI
InChI=1S/C19H15ClN2O4/c20-13-7-5-11(6-8-13)18(24)22-16(19(25)26)9-12-10-17(23)21-15-4-2-1-3-14(12)15/h1-8,10,16H,9H2,(H,21,23)(H,22,24)(H,25,26)

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H15ClN2O4
Molecular Weight 370.79
AlogP 2.61
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 5.0
Polar Surface Area 99.26
Molecular species ACID
Aromatic Rings 3.0
Heavy Atoms 26.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 109

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Arthritis, Rheumatoid 3 D001172 ClinicalTrials
Stomach Ulcer 3 D013276 ClinicalTrials
Dry Eye Syndromes 3 D015352 ClinicalTrials
Gastritis 3 D005756 ClinicalTrials
Gastritis 3 D005756 ClinicalTrials
Osteoarthritis 3 D010003 ClinicalTrials
Spondylitis, Ankylosing 3 D013167 ClinicalTrials
Colitis, Ulcerative 2 D003093 ClinicalTrials
Head and Neck Neoplasms 2 D006258 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 90098-04-7
ChEBI 93814
ChEMBL CHEMBL1697771
DrugBank DB11656
DrugCentral 2360
EPA CompTox DTXSID8045937
FDA SRS LR583V32ZR
Guide to Pharmacology 871
PubChem 5042
SureChEMBL SCHEMBL221527
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