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Compound Detail

CHEMBL4540977

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

Basic Information

ChEMBL ID CHEMBL4540977
Phase Preclinical
Structure Type MOL
InChI Key FVQDAMVODWHNOJ-SECBINFHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

223.2
MW (Da)
0.36
ALogP
3
HBA
3
HBD
86.6
PSA (Ų)
0.65
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H13NO4
MW 223.23
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness 0.06

Literature References

PubMed DOI Target Context # Activities
30737136 10.1016/j.bmc.2019.01.018 Prolyl 4-hydroxylase 1
30737136 10.1016/j.bmc.2019.01.018 Egl nine homolog 1 1

Data from ChEMBL 36 via Core Engine