INE-963

Highest phase reached
Drug type
Small molecule

Listing at source
Listed
Highest phase reached

Drug type
Small molecule
Drug name
Molecular weight
Structure (SMILES)
COc1nc(C(C)C)ccc1-c1cnc2sc(N3CCC(O)(CN)CC3)nn12

  • ine 963
  • INE 963
  • Ine-963
  • ine963
  • Ine963
  • INE963

CAS registry numbers
  • 2640567-43-5
ChEMBL ID
CHEMBL5173264
InChIKey
JYHSRMKXBAPFST-UHFFFAOYSA-N
PubChem compound IDs
  • 156274257
FDA ingredient codes (UNII)
  • 4HRQ96CC7C

First in class
No
Orphan designation
No

Pharmacology name
INE963
Type
Synthetic organic

Investigated indications

  • Condition
    Malaria, Falciparum
    Highest recorded phase
    2
    Condition identifier
    EFO:0007444
    Subject identifier
    D016778

Open Targets indications

  • Condition identifier
    MONDO_0005920
    Highest recorded phase
    2

Trial references

Hydrogen bond acceptors
9
Hydrogen bond donors
2
Polar surface area
101.8
Calculated partition coefficient (ALogP)
2.27
Calculated partition coefficient (XLogP)
2.1
Prodrug
No
Chirality
Achiral
Inorganic
No
Rule-of-five violations
0
Rotatable bonds
5
Heavy atoms
28
Molecular formula
C19H26N6O2S
Monoisotopic mass
402.18379527
Natural product
No

Recorded assays
115
Active assays
15

Active assay types

  • Confirmatory

These details could not be displayed.

Related records

Trials (3)

In development for (1)