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Compound Detail

CHEMBL2010874

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Cc1cc(C)nc(Nc2ccc3c(c2)c2c4c(c5c(c2n3CC(C)C)CCc2nn(C)cc2-5)C(=O)NC4)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2010874
Phase Preclinical
Structure Type MOL
InChI Key SBMPBBDLMGFERB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

505.6
MW (Da)
5.34
ALogP
7
HBA
2
HBD
89.7
PSA (Ų)
0.34
QED
2
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H31N7O
MW 505.63
Aromatic Rings 5
Heavy Atoms 38
NP-Likeness -0.83

Literature References

PubMed DOI Target Context # Activities
22148921 10.1021/jm201449n Vascular endothelial growth factor receptor 2 2
22148921 10.1021/jm201449n Angiopoietin-1 receptor 1

Data from ChEMBL 36 via Core Engine