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Compound Detail

CHEMBL4595148

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CCCN(CCCCNC(=O)c1ccc2ccccc2c1)CC1CC1c1cc(F)ccc1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4595148
Phase Preclinical
Structure Type MOL
InChI Key MGGGAIHRQKOLDH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

462.6
MW (Da)
6.01
ALogP
3
HBA
1
HBD
41.6
PSA (Ų)
0.34
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H35FN2O2
MW 462.61
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -0.81

Data from ChEMBL 36 via Core Engine