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Compound Detail

CHEMBL1179717

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Brc1cc(CO/N=C2\CN3CCC2CC3)on1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1179717
Phase Preclinical
Structure Type MOL
InChI Key YOXRARLNVONWJD-JLHYYAGUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

300.2
MW (Da)
2.04
ALogP
5
HBA
0
HBD
50.9
PSA (Ų)
0.80
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 C11H14BrN3O2
MW 300.16
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness -0.75

Data from ChEMBL 36 via Core Engine