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Compound Detail

CHEMBL36570

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Oc1ccc([C@@H]2CN3CCC[C@@H]3c3ccccc32)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL36570
Phase Preclinical
Structure Type MOL
InChI Key WIYPIUHIXZKYSL-ZWKOTPCHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

265.4
MW (Da)
3.67
ALogP
2
HBA
1
HBD
23.5
PSA (Ų)
0.85
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 C18H19NO
MW 265.36
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness 0.36

Data from ChEMBL 36 via Core Engine