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Compound Detail

CHEMBL5766821

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O=C([C@@H]1CCCCN1)N1Cc2ccc(F)cc2C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5766821
Phase Preclinical
Structure Type MOL
InChI Key KVKQWBRBHQQTAK-ZDUSSCGKSA-N
0
Targets
6
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

248.3
MW (Da)
1.81
ALogP
2
HBA
1
HBD
32.3
PSA (Ų)
0.82
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H17FN2O
MW 248.30
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -0.98

Activity Summary

IC50 6 meas.

Data from ChEMBL 36 via Core Engine