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Compound Detail

CHEMBL5498972

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N=C(Nc1ccc(NC(=O)c2ccc(NC(=N)c3ccccn3)cn2)nc1)c1ccccn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5498972
Phase Preclinical
Structure Type MOL
InChI Key FQDUYLWYATXURF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

437.5
MW (Da)
3.39
ALogP
7
HBA
5
HBD
152.4
PSA (Ų)
0.23
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H19N9O
MW 437.47
Aromatic Rings 4
Heavy Atoms 33
NP-Likeness -1.11

Data from ChEMBL 36 via Core Engine