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Compound Detail

CHEMBL1186669

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NC[C@H]1C[C@@H]1c1ccc(-c2ccco2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186669
Phase Preclinical
Structure Type MOL
InChI Key JSZYANZDIBVBQR-CHWSQXEVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

213.3
MW (Da)
3.01
ALogP
2
HBA
1
HBD
39.2
PSA (Ų)
0.85
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 C14H15NO
MW 213.28
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.16

Data from ChEMBL 36 via Core Engine