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Compound Detail

CHEMBL3139501

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N=C(N)c1cncc(-c2cc(-c3cncc(C(=N)N)c3)on2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3139501
Phase Preclinical
Structure Type MOL
InChI Key SCTOWMRMKIISLR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

307.3
MW (Da)
1.37
ALogP
6
HBA
4
HBD
151.6
PSA (Ų)
0.42
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H13N7O
MW 307.32
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -0.91

Data from ChEMBL 36 via Core Engine