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Compound Detail

CHEMBL4546615

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CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NC(Cc1ccc(O)cc1)P(=O)(Oc1ccccc1)Oc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4546615
Phase Preclinical
Structure Type MOL
InChI Key FOLSRLGRNOYSIZ-CYZZXXEPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

616.6
MW (Da)
7.07
ALogP
7
HBA
3
HBD
123.2
PSA (Ų)
0.13
QED
2
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H37N2O7P
MW 616.65
Aromatic Rings 4
Heavy Atoms 44
NP-Likeness -0.06

Literature References

PubMed DOI Target Context # Activities
30571121 10.1021/acs.jmedchem.8b01466 ATP-dependent Clp protease proteolytic subunit 2

Data from ChEMBL 36 via Core Engine