CC-11050

Search structure
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 1Z08G7438A

Structure
InChI Key QDZOBXFRIVOQBR-LJQANCHMSA-N
Smile CCOc1cc([C@@H](CS(C)(=O)=O)N2Cc3cccc(NC(=O)C4CC4)c3C2=O)ccc1OC
InChI
InChI=1S/C24H28N2O6S/c1-4-32-21-12-16(10-11-20(21)31-2)19(14-33(3,29)30)26-13-17-6-5-7-18(22(17)24(26)28)25-23(27)15-8-9-15/h5-7,10-12,15,19H,4,8-9,13-14H2,1-3H3,(H,25,27)/t19-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H28N2O6S
Molecular Weight 472.56
AlogP 3.18
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 9.0
Polar Surface Area 102.01
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 33.0

Indications

Mesh Heading Maximum Phase Reference
Tuberculosis Phase 2 ClinicalTrials
Erythema; Erythema Nodosum; Leprosy Phase 2 ClinicalTrials
Lupus Erythematosus, Cutaneous; Lupus Erythematosus, Discoid; Lupus Erythematosus, Systemic Phase 2 ClinicalTrials

Related Entries

MCS

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL4297460
DrugBank DB16242
FDA SRS 1Z08G7438A
PubChem 10322579
SureChEMBL SCHEMBL673303
ZINC ZINC000034209670
CONTENTS