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

CHEMBL2371458

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
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCN=C(N)N)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

Basic Information

ChEMBL ID CHEMBL2371458
Phase Preclinical
Structure Type BOTH
InChI Key TUANDQVQWBYXDD-WPIPJUEPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

984.2
MW (Da)
0.51
ALogP
11
HBA
11
HBD
347.2
PSA (Ų)
0.02
QED
3
Ro5 Violations
26
Rot. Bonds

Drug Information

Molecule Type Protein
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C49H69N13O9
MW 984.17
Aromatic Rings 4
Heavy Atoms 71
NP-Likeness 0.08

Literature References

PubMed DOI Target Context # Activities
4009600 10.1021/jm00383a015 Rattus norvegicus 2

Data from ChEMBL 36 via Core Engine