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Compound Detail

CHEMBL290645

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O=C(O)CCN1CCN(CCOC(c2ccccc2)c2ccc(F)cc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL290645
Phase Preclinical
Structure Type MOL
InChI Key YHKKVXZGTGCXTP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

386.5
MW (Da)
3.02
ALogP
4
HBA
1
HBD
53.0
PSA (Ų)
0.72
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H27FN2O3
MW 386.47
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -0.88

Data from ChEMBL 36 via Core Engine