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Compound Detail

CHEMBL1198350

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CNC[C@@H](O)[C@H](c1cccc(F)c1)N1CCc2cc(OCc3ccccc3)ccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1198350
Phase Preclinical
Structure Type MOL
InChI Key FUVUHZMWHNOAHJ-RPBOFIJWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

406.5
MW (Da)
4.09
ALogP
4
HBA
2
HBD
44.7
PSA (Ų)
0.59
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H27FN2O2
MW 406.50
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness -0.66

Data from ChEMBL 36 via Core Engine