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Compound Detail

CHEMBL1185273

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CC(C)(C)Cn1cnc2ccc(-c3[nH]c(-c4c(F)cccc4F)nc3-c3ccc(F)cc3)nc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1185273
Phase Preclinical
Structure Type MOL
InChI Key MRTSPTRJKFTETB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

461.5
MW (Da)
6.62
ALogP
4
HBA
1
HBD
59.4
PSA (Ų)
0.33
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 C26H22F3N5
MW 461.49
Aromatic Rings 5
Heavy Atoms 34
NP-Likeness -1.29

Data from ChEMBL 36 via Core Engine