Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL5095648

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
COC1=CC(c2ccc[nH]2)=N/C1=C\c1cc(CCCCC(C)C)c(C)[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5095648
Phase Preclinical
Structure Type MOL
InChI Key GDZPBXCQLIRIMK-BKUYFWCQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

351.5
MW (Da)
5.39
ALogP
2
HBA
2
HBD
53.2
PSA (Ų)
0.62
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C22H29N3O
MW 351.49
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness 0.16

Data from ChEMBL 36 via Core Engine