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Compound Detail

CHEMBL3633299

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Cc1cccc(C)c1NC(=O)Nc1cccc(-c2cccc3[nH]nc(N)c23)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3633299
Phase Preclinical
Structure Type MOL
InChI Key ZESSTHJMWITPGA-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

371.4
MW (Da)
5.07
ALogP
3
HBA
4
HBD
95.8
PSA (Ų)
0.40
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H21N5O
MW 371.44
Aromatic Rings 4
Heavy Atoms 28
NP-Likeness -1.22

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
26342134 10.1016/j.ejmech.2015.08.045 Vascular endothelial growth factor receptor 2 1
26342134 10.1016/j.ejmech.2015.08.045 NON-PROTEIN TARGET 1
26342134 10.1016/j.ejmech.2015.08.045 A549 1

Data from ChEMBL 36 via Core Engine