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Compound Detail

CHEMBL2109725

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CCCC[C@@H](c1ccc(F)cc1)N(CCC)c1nc(-c2ccc(Cl)cc2OC)n(C)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2109725
Phase Preclinical
Structure Type MOL
InChI Key SYBPBURKXDRONN-NRFANRHFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

445.0
MW (Da)
6.43
ALogP
5
HBA
0
HBD
43.2
PSA (Ų)
0.36
QED
1
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H30ClFN4O
MW 444.98
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -1.09

Data from ChEMBL 36 via Core Engine