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Compound Detail

CHEMBL98183

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CCC(CC)N1CCN(C(=O)CCC(=O)c2ccc(C(F)(F)F)cc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL98183
Phase Preclinical
Structure Type MOL
InChI Key OPKPBHGRCGXRNB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

384.4
MW (Da)
4.00
ALogP
3
HBA
0
HBD
40.6
PSA (Ų)
0.67
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H27F3N2O2
MW 384.44
Aromatic Rings 1
Heavy Atoms 27
NP-Likeness -1.35

Data from ChEMBL 36 via Core Engine