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Compound Detail

CHEMBL118854

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CC(C)(C)Cc1cncn1C1CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL118854
Phase Preclinical
Structure Type MOL
InChI Key XBPKLOZDDQHUIA-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

178.3
MW (Da)
2.81
ALogP
2
HBA
0
HBD
17.8
PSA (Ų)
0.68
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H18N2
MW 178.28
Aromatic Rings 1
Heavy Atoms 13
NP-Likeness -0.58

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
15214784 10.1021/jm030608t Camphor 5-monooxygenase 2

Data from ChEMBL 36 via Core Engine