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Compound Detail

CHEMBL1185949

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CC(C)Cn1c(N)nc2ccc(-c3[nH]c(-c4c(F)cccc4F)nc3-c3ccccc3)nc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1185949
Phase Preclinical
Structure Type MOL
InChI Key SYCOWGUWYABYOT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

444.5
MW (Da)
5.67
ALogP
5
HBA
2
HBD
85.4
PSA (Ų)
0.37
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H22F2N6
MW 444.49
Aromatic Rings 5
Heavy Atoms 33
NP-Likeness -1.16

Data from ChEMBL 36 via Core Engine