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Compound Detail

CHEMBL5095671

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C[C@@H]1CCC[C@H](C)N1CCCOc1ccc(Cl)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5095671
Phase Preclinical
Structure Type MOL
InChI Key HXEMCJBQBZPVIW-OKILXGFUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

281.8
MW (Da)
4.37
ALogP
2
HBA
0
HBD
12.5
PSA (Ų)
0.74
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H24ClNO
MW 281.83
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -1.12

Data from ChEMBL 36 via Core Engine