Ketorolac tromethamineProduct ingredient for Ketorolac

Name
Ketorolac tromethamine
Drug Entry
Ketorolac

Ketorolac is a Non-steroidal anti-inflammatory drug (NSAID) and is commercially available as an oral tablet, injectable, nasal spray and as an ophthalmic solution.910131415

It's analgesic properties make it a useful pain management tool across many settings including postoperative pain, rheumatoid arthritis, osteoarthritis, menstrual disorders, headaches, spinal and soft tissue pain, and ankylosing spondylitis.12 Impressively, ketorolac has a similar efficacy to standard doses of morphine and meperidine making it a useful opioid sparing agent.11

Accession Number
DBSALT001045
Structure
Thumb
Synonyms
Ketorolac (+/-)-form tromethamine salt / Ketorolac trometamol
UNII
4EVE5946BQ
CAS Number
74103-07-4
Weight
Average: 376.409
Monoisotopic: 376.163436501
Chemical Formula
C19H24N2O6
InChI Key
BWHLPLXXIDYSNW-UHFFFAOYSA-N
InChI
InChI=1S/C15H13NO3.C4H11NO3/c17-14(10-4-2-1-3-5-10)13-7-6-12-11(15(18)19)8-9-16(12)13;5-4(1-6,2-7)3-8/h1-7,11H,8-9H2,(H,18,19);6-8H,1-3,5H2
IUPAC Name
1,3-dihydroxy-2-(hydroxymethyl)propan-2-aminium 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate
SMILES
[NH3+]C(CO)(CO)CO.[O-]C(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1
External Links
KEGG Drug
D00813
ChemSpider
75795
ChEBI
6130
ChEMBL
CHEMBL1201124
Wikipedia
Ketorolac
Predicted Properties
PropertyValueSource
Water Solubility0.861 mg/mLALOGPS
logP-0.92ALOGPS
logP2.28ChemAxon
logS-2.6ALOGPS
pKa (Strongest Acidic)3.84ChemAxon
pKa (Strongest Basic)-7.8ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count3ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area62.13 Å2ChemAxon
Rotatable Bond Count6ChemAxon
Refractivity81.03 m3·mol-1ChemAxon
Polarizability26.42 Å3ChemAxon
Number of Rings3ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon