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

CHEMBL5517860

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
C[C@]12CC[C@H](OC(=O)CNC(=O)CN)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(c3cccnc3)=CC[C@@H]12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5517860
Phase Preclinical
Structure Type MOL
InChI Key MHNPCMTWFONBPS-QSAXURPMSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

463.6
MW (Da)
4.02
ALogP
5
HBA
2
HBD
94.3
PSA (Ų)
0.51
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H37N3O3
MW 463.62
Aromatic Rings 1
Heavy Atoms 34
NP-Likeness 1.05

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
38467086 10.1016/j.ejmech.2024.116296 B16 1

Data from ChEMBL 36 via Core Engine