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Compound Detail

CHEMBL1178350

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BrC1=NOC2C3CCC(CC12)N3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1178350
Phase Preclinical
Structure Type MOL
InChI Key JVMOFQGPXYZTAZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

231.1
MW (Da)
1.23
ALogP
3
HBA
1
HBD
33.6
PSA (Ų)
0.68
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H11BrN2O
MW 231.09
Aromatic Rings 0
Heavy Atoms 12
NP-Likeness 1.21

Data from ChEMBL 36 via Core Engine