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Compound Detail

CHEMBL4302330

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NCc1ccc(-c2cnccc2-c2cncnc2)o1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4302330
Phase Preclinical
Structure Type MOL
InChI Key UNMBMURORYBKFF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

252.3
MW (Da)
2.26
ALogP
5
HBA
1
HBD
77.8
PSA (Ų)
0.77
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H12N4O
MW 252.28
Aromatic Rings 3
Heavy Atoms 19
NP-Likeness -0.66

Data from ChEMBL 36 via Core Engine