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Compound Detail

CHEMBL42380

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O=C(O)[C@@H]1Nc2cc(Cl)ccc2[C@H]1CO
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL42380
Phase Preclinical
Structure Type MOL
InChI Key XODRHYQQPZDNKG-VXNVDRBHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

227.7
MW (Da)
1.29
ALogP
3
HBA
3
HBD
69.6
PSA (Ų)
0.71
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 C10H10ClNO3
MW 227.65
Aromatic Rings 1
Heavy Atoms 15
NP-Likeness 0.40

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(00)80444-8 Glutamate receptor ionotropic, NMDA 1 1

Data from ChEMBL 36 via Core Engine