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Compound Detail

CHEMBL1557889

PINOKALANT
🧪 Phase II
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🧪 Phase II
COc1cc2c(cc1OC)C(C(C(=O)N(CCc1ccc(OC)c(OC)c1OC)CCc1ccc(OC)c(OC)c1OC)c1ccccc1)=NCC2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1557889
Name PINOKALANT
Phase Phase II
Structure Type MOL
InChI Key PYWYBTRACMRUQV-UHFFFAOYSA-N

Known Names

LOE-908 Pinokalant
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
2
Known Names

Molecular Properties

712.8
MW (Da)
6.20
ALogP
10
HBA
0
HBD
106.5
PSA (Ų)
0.13
QED
2
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Racemic
USAN Stem -kalant

Extended Properties

Molecular Formula C41H48N2O9
MW 712.84
Aromatic Rings 4
Heavy Atoms 52
NP-Likeness -0.07

Data from ChEMBL 36 via Core Engine