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Compound Detail

CHEMBL5498553

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N=C(Nc1ccc(NC(=O)c2ccc(NC(=N)c3ccccn3)c(Cl)c2)c(Cl)c1)c1ccccn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5498553
Phase Preclinical
Structure Type MOL
InChI Key LMIQMLKPMZQEIF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

504.4
MW (Da)
5.91
ALogP
5
HBA
5
HBD
126.6
PSA (Ų)
0.16
QED
2
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H19Cl2N7O
MW 504.38
Aromatic Rings 4
Heavy Atoms 35
NP-Likeness -1.20

Data from ChEMBL 36 via Core Engine