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Compound Detail

CHEMBL5221378

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O=C(O)C1CN(Cc2ccc(-n3cc(-c4ccc(Br)cc4)nn3)cc2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5221378
Phase Preclinical
Structure Type MOL
InChI Key RASSQMWMWPADJK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

413.3
MW (Da)
3.21
ALogP
5
HBA
1
HBD
71.2
PSA (Ų)
0.70
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H17BrN4O2
MW 413.28
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.66

Data from ChEMBL 36 via Core Engine