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Compound Detail

CHEMBL92874

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CC(C)N1CCN(CCN2CCN(C3CC(c4ccc(F)cc4)c4cc(Br)ccc43)CC2)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL92874
Phase Preclinical
Structure Type MOL
InChI Key JOAAFQMXBGOANP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

529.5
MW (Da)
4.93
ALogP
3
HBA
0
HBD
30.0
PSA (Ų)
0.53
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H34BrFN4O
MW 529.50
Aromatic Rings 2
Heavy Atoms 34
NP-Likeness -0.64

Data from ChEMBL 36 via Core Engine