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Compound Detail

CHEMBL228081

GONIOTHALACTAM
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COc1cc2c3c(cc4ccc(O)cc4c3c1OC)NC2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL228081
Name GONIOTHALACTAM
Phase Preclinical
Structure Type MOL
InChI Key UDPCZNQWXHKYPJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

295.3
MW (Da)
3.28
ALogP
4
HBA
2
HBD
67.8
PSA (Ų)
0.71
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C17H13NO4
MW 295.29
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness 1.24

Literature References

PubMed DOI Target Context # Activities
10978218 10.1021/np000063v Platelet 10
17081761 10.1016/j.bmc.2006.10.034 ADMET 1
17081761 10.1016/j.bmc.2006.10.034 T-cell 1
17081761 10.1016/j.bmc.2006.10.034 B-cell 1

Data from ChEMBL 36 via Core Engine