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Compound Detail

CHEMBL3919333

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Cc1cc(OC2CCN(C)CC2)ccc1Nc1nccc(-c2c(-c3cccc(C(=O)Nc4c(F)cccc4F)c3)nc3ccccn23)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3919333
Phase Preclinical
Structure Type MOL
InChI Key DKRYPHFBCYWHAB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

645.7
MW (Da)
7.51
ALogP
8
HBA
2
HBD
96.7
PSA (Ų)
0.18
QED
2
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C37H33F2N7O2
MW 645.71
Aromatic Rings 6
Heavy Atoms 48
NP-Likeness -1.62

Data from ChEMBL 36 via Core Engine