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Compound Detail

CHEMBL1196354

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N=C(Nc1ccccc1/C=C/c1c(F)c(F)c(F)c(F)c1F)NC12CC3CC(CC(C3)C1)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1196354
Phase Preclinical
Structure Type MOL
InChI Key KKAWKXOIYYUHRX-AATRIKPKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

461.5
MW (Da)
6.46
ALogP
1
HBA
3
HBD
47.9
PSA (Ų)
0.12
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 C25H24F5N3
MW 461.48
Aromatic Rings 2
Heavy Atoms 33
NP-Likeness -0.33

Data from ChEMBL 36 via Core Engine