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Compound Detail

CHEMBL214093

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N#Cc1cc2c(NCc3ccccc3)c(-c3ccccc3)c(O)nc2cc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL214093
Phase Preclinical
Structure Type MOL
InChI Key CRUMIGXKRVUKAN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

385.9
MW (Da)
5.74
ALogP
4
HBA
2
HBD
68.9
PSA (Ų)
0.47
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H16ClN3O
MW 385.85
Aromatic Rings 4
Heavy Atoms 28
NP-Likeness -1.18

Literature References

PubMed DOI Target Context # Activities
16784844 10.1016/j.bmcl.2006.06.014 Fatty acid synthase 1

Data from ChEMBL 36 via Core Engine