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Compound Detail

CHEMBL5028315

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CC(CCc1cccc(Cl)c1)NCC(O)c1ccc(O)c2[nH]c(=O)ccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5028315
Phase Preclinical
Structure Type MOL
InChI Key CQQZVOPQWOJEFX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

386.9
MW (Da)
3.53
ALogP
4
HBA
4
HBD
85.3
PSA (Ų)
0.50
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H23ClN2O3
MW 386.88
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -0.08

Data from ChEMBL 36 via Core Engine