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Compound Detail

CHEMBL6035497

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O=C(Oc1coc(CO)cc1=O)c1ccc[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6035497
Phase Preclinical
Structure Type MOL
InChI Key NIDSEHDXNYYRQG-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

235.2
MW (Da)
0.68
ALogP
5
HBA
2
HBD
92.5
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H9NO5
MW 235.19
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness 0.22

Activity Summary

IC50 2 meas.

Data from ChEMBL 36 via Core Engine