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Compound Detail

CHEMBL3732413

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Fc1cccc(CNc2ccc(-c3cc4c(cc3Cl)OC(F)(F)O4)cn2)c1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3732413
Phase Preclinical
Structure Type MOL
InChI Key VNKRULBLDZWQMS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

427.2
MW (Da)
6.13
ALogP
4
HBA
1
HBD
43.4
PSA (Ų)
0.54
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 C19H11Cl2F3N2O2
MW 427.21
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -1.19

Data from ChEMBL 36 via Core Engine