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Compound Detail

CHEMBL1783630

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O=C(Nc1ccccc1)Nc1ccc(NCc2ccc(C(=O)O)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1783630
Phase Preclinical
Structure Type MOL
InChI Key AMDSPDSFYJCDDD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

361.4
MW (Da)
4.64
ALogP
3
HBA
4
HBD
90.5
PSA (Ų)
0.51
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H19N3O3
MW 361.40
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -0.97

Literature References

PubMed DOI Target Context # Activities
19435661 10.1016/j.bmcl.2009.04.122 Hypoxia-inducible factor 1-alpha 3

Data from ChEMBL 36 via Core Engine