LOTEPREDNOL

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: Parent
ATC: S01BA14
UNII: I3T12NR296

Structure
InChI Key MCKJPJYRCPANCC-XLXYOEISSA-N
Smile C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)O
InChI
InChI=1S/C20H26O5/c1-18-7-5-12(21)9-11(18)3-4-13-14-6-8-20(25,17(23)24)19(14,2)10-15(22)16(13)18/h5,7,9,13-16,22,25H,3-4,6,8,10H2,1-2H3,(H,23,24)/t13-,14-,15-,16+,18-,19-,20-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H26O5
Molecular Weight 346.42
AlogP 2.08
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 1.0
Polar Surface Area 94.83
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 25.0

Indications

Mesh Heading Maximum Phase Reference
Blepharitis; Inflammation Phase 4 ClinicalTrials

Related Entries

Scaffolds

Salt

Cross References

Resources Reference
CAS NUMBER 129260-79-3
ChEMBL CHEMBL1201389
EPA CompTox DTXSID50191356
FDA SRS I3T12NR296
PubChem 9865442
SureChEMBL SCHEMBL1685771
ZINC ZINC000004081855
CONTENTS