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Compound Detail

CHEMBL115893

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O=C(NCCc1ccc(O)cc1)c1c(O)nc2cc(Cl)ccc2c1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL115893
Phase Preclinical
Structure Type MOL
InChI Key UQPWOHIZEBRCGX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

358.8
MW (Da)
2.98
ALogP
5
HBA
4
HBD
102.7
PSA (Ų)
0.57
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 C18H15ClN2O4
MW 358.78
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -0.62

Literature References

PubMed DOI Target Context # Activities
8230129 10.1021/jm00074a020 Glutamate NMDA receptor 1

Data from ChEMBL 36 via Core Engine