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

CHEMBL4595614

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)CN3CCN(CC3)CC(=O)Nc3ccc(cc3)C[C@@H](NS(=O)(=O)NC3CCCCC3)C(=O)N2)cc1

Basic Information

ChEMBL ID CHEMBL4595614
Phase Preclinical
Structure Type MOL
InChI Key QAUGEAIVNJDVPC-OIDHKYIRSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

801.0
MW (Da)
1.19
ALogP
9
HBA
8
HBD
230.9
PSA (Ų)
0.12
QED
2
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C40H52N10O6S
MW 800.99
Aromatic Rings 3
Heavy Atoms 57
NP-Likeness -0.12

Data from ChEMBL 36 via Core Engine