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Compound Detail

CHEMBL3731436

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Fc1cccc(F)c1CNc1ccc(-c2cc3c(cc2Cl)OCCO3)cn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3731436
Phase Preclinical
Structure Type MOL
InChI Key GLYLTGABZNXPCI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

388.8
MW (Da)
5.06
ALogP
4
HBA
1
HBD
43.4
PSA (Ų)
0.68
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H15ClF2N2O2
MW 388.80
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -1.32

Data from ChEMBL 36 via Core Engine