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Compound Detail

CHEMBL4117262

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COc1ccc(F)cc1[C@@H]1C[C@H]1CNCc1ccccc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4117262
Phase Preclinical
Structure Type MOL
InChI Key IVWOIKUMUJRGBV-DZGCQCFKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

319.8
MW (Da)
4.38
ALogP
2
HBA
1
HBD
21.3
PSA (Ų)
0.85
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H19ClFNO
MW 319.81
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.80

Data from ChEMBL 36 via Core Engine