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

CHEMBL4594676

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
N=C(N)c1ccc(CNC(=O)[C@@H]2Cc3ccc(cc3)NC(=O)CCN3CCN(CCC(=O)Nc4ccc(cc4)C[C@@H](N)C(=O)N2)CC3)cc1

Basic Information

ChEMBL ID CHEMBL4594676
Phase Preclinical
Structure Type MOL
InChI Key VKWOZUGVWLSLQY-JSOSNVBQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

667.8
MW (Da)
1.17
ALogP
8
HBA
7
HBD
198.8
PSA (Ų)
0.16
QED
2
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C36H45N9O4
MW 667.81
Aromatic Rings 3
Heavy Atoms 49
NP-Likeness 0.09

Data from ChEMBL 36 via Core Engine