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Compound Detail

CHEMBL4301640

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N=C(N)c1ccc(-c2nc(-c3ccccc3)c[nH]2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4301640
Phase Preclinical
Structure Type MOL
InChI Key LRBJDLAEXJDCAH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

262.3
MW (Da)
3.03
ALogP
2
HBA
3
HBD
78.5
PSA (Ų)
0.50
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 C16H14N4
MW 262.32
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -0.56

Data from ChEMBL 36 via Core Engine