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Compound Detail

CHEMBL1177937

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Cn1c(=N)n2nc(-c3ccco3)nc2c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1177937
Phase Preclinical
Structure Type MOL
InChI Key KGSMZKRLPSCYOA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

265.3
MW (Da)
1.96
ALogP
6
HBA
1
HBD
72.1
PSA (Ų)
0.57
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H11N5O
MW 265.28
Aromatic Rings 4
Heavy Atoms 20
NP-Likeness -1.57

Data from ChEMBL 36 via Core Engine