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

CHEMBL4595363

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
CN1CCN(Cc2ccc(C(=O)Nc3ncc(-c4cccnc4)s3)cc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4595363
Phase Preclinical
Structure Type MOL
InChI Key BWCDBSFFLWYXML-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

393.5
MW (Da)
3.20
ALogP
6
HBA
1
HBD
61.4
PSA (Ų)
0.72
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H23N5OS
MW 393.52
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -1.82

Data from ChEMBL 36 via Core Engine