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Compound Detail

CHEMBL112270

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COc1ccccc1N1CCN(CC(O)c2ccc(O)c(C(N)=O)c2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL112270
Phase Preclinical
Structure Type MOL
InChI Key SFQIAYQAAHHNIZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

371.4
MW (Da)
1.36
ALogP
6
HBA
3
HBD
99.3
PSA (Ų)
0.71
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H25N3O4
MW 371.44
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -0.96

Data from ChEMBL 36 via Core Engine