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Compound Detail

CHEMBL318266

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O=C(O)[C@@H](Cc1ccccc1)[C@H]1CN1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL318266
Phase Preclinical
Structure Type MOL
InChI Key DYSKIYNLUZTAPM-VHSXEESVSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

191.2
MW (Da)
0.90
ALogP
2
HBA
2
HBD
59.2
PSA (Ų)
0.70
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H13NO2
MW 191.23
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness 0.83

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
11677137 10.1016/s0960-894x(01)00592-3 Unchecked 1

Data from ChEMBL 36 via Core Engine