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Compound Detail

CHEMBL4651112

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Clc1ccc(OC[C@]23C[C@H]2CCN3)cn1

Basic Information

ChEMBL ID CHEMBL4651112
Phase Preclinical
Structure Type MOL
InChI Key XWRUJOJNEYNMNL-LDYMZIIASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

224.7
MW (Da)
1.87
ALogP
3
HBA
1
HBD
34.1
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H13ClN2O
MW 224.69
Aromatic Rings 1
Heavy Atoms 15
NP-Likeness 0.09

Data from ChEMBL 36 via Core Engine