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Compound Detail

CHEMBL1877571

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COc1cc2c(cc1OC)-c1cc(NCc3cccnc3)nc(=O)n1CC2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1877571
Phase Preclinical
Structure Type MOL
InChI Key BHURQWPYKBQXAO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

364.4
MW (Da)
2.49
ALogP
7
HBA
1
HBD
78.3
PSA (Ų)
0.75
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C20H20N4O3
MW 364.41
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -0.74

Data from ChEMBL 36 via Core Engine