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Compound Detail

CHEMBL487848

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Cc1cnc(NC(=O)N2CCN(c3nc(-c4ccccc4)ns3)CC2)s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL487848
Phase Preclinical
Structure Type MOL
InChI Key BZNBQGZECIIUCR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

386.5
MW (Da)
3.32
ALogP
7
HBA
1
HBD
74.2
PSA (Ų)
0.75
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H18N6OS2
MW 386.51
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -2.46

Literature References

PubMed DOI Target Context # Activities
18693015 10.1016/j.bmcl.2008.07.081 Fatty-acid amide hydrolase 1 2

Data from ChEMBL 36 via Core Engine