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Compound Detail

CHEMBL35233

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Brc1ccccc1[C@@H]1CN2CCC[C@@H]2c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL35233
Phase Preclinical
Structure Type MOL
InChI Key OZQPALZNLAIXSQ-SJLPKXTDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

328.2
MW (Da)
4.73
ALogP
1
HBA
0
HBD
3.2
PSA (Ų)
0.73
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 C18H18BrN
MW 328.25
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.02

Data from ChEMBL 36 via Core Engine