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Compound Detail

CHEMBL89046

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C[C@]1(c2ccncc2)CCC(=O)NC1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL89046
Phase Preclinical
Structure Type MOL
InChI Key LCPRNUDICYLXER-LLVKDONJSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

204.2
MW (Da)
0.78
ALogP
3
HBA
1
HBD
59.1
PSA (Ų)
0.69
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H12N2O2
MW 204.23
Aromatic Rings 1
Heavy Atoms 15
NP-Likeness 0.24

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
2391706 10.1021/jm00171a052 Aromatase 1

Data from ChEMBL 36 via Core Engine