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Compound Detail

CHEMBL1181566

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Brc1ccc(N2CCNCC2)c2ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1181566
Phase Preclinical
Structure Type MOL
InChI Key BCQFDRDTLZIOGL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

291.2
MW (Da)
3.01
ALogP
2
HBA
1
HBD
15.3
PSA (Ų)
0.87
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H15BrN2
MW 291.19
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -1.00

Data from ChEMBL 36 via Core Engine