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Compound Detail

CHEMBL4436632

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N=C(NO)c1cccc(C(Nc2ncccn2)P(=O)(Oc2ccccc2)Oc2ccccc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4436632
Phase Preclinical
Structure Type MOL
InChI Key GZZGNBSXAZDALK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

475.4
MW (Da)
5.24
ALogP
8
HBA
4
HBD
129.4
PSA (Ų)
0.11
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H22N5O4P
MW 475.45
Aromatic Rings 4
Heavy Atoms 34
NP-Likeness -0.44

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