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Compound Detail

CHEMBL137114

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N=c1oc2cc(O)ccc2cc1C(N)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL137114
Phase Preclinical
Structure Type MOL
InChI Key HUDOTUMVHSZQHK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

204.2
MW (Da)
0.72
ALogP
4
HBA
3
HBD
100.3
PSA (Ų)
0.64
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H8N2O3
MW 204.19
Aromatic Rings 2
Heavy Atoms 15
NP-Likeness 0.16

Literature References

PubMed DOI Target Context # Activities
8474097 10.1021/jm00056a001 Tyrosine-protein kinase Lck 1

Data from ChEMBL 36 via Core Engine