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Compound Detail

CHEMBL1513985

ANTHRACENE-9-CARBOXYLIC ACID
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O=C(O)c1c2ccccc2cc2ccccc12

Basic Information

ChEMBL ID CHEMBL1513985
Name ANTHRACENE-9-CARBOXYLIC ACID
Phase Preclinical
Structure Type MOL
InChI Key XGWFJBFNAQHLEF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
11
Publications
0
Known Names

Molecular Properties

222.2
MW (Da)
3.69
ALogP
1
HBA
1
HBD
37.3
PSA (Ų)
0.64
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C15H10O2
MW 222.24
Aromatic Rings 3
Heavy Atoms 17
NP-Likeness 0.02

Literature References

PubMed DOI Target Context # Activities
18407564 10.1002/ps.1591 Caenorhabditis elegans 9
18407564 10.1002/ps.1591 Meloidogyne incognita 7
- 10.6019/CHEMBL4495565 SARS-CoV-2 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
10417314 10.1042/0264-6021:3410529 Monocarboxylate transporter 1 1
10417314 10.1042/0264-6021:3410529 Monocarboxylate transporter 2 1
18407564 10.1002/ps.1591 Heterorhabditis bacteriophora 1
23571415 10.1124/mol.112.084152 Solute carrier organic anion transporter family member 1B3 1
23571415 10.1124/mol.112.084152 Solute carrier organic anion transporter family member 1B1 1
- 10.21203/rs.3.rs-23951/v1 SARS-CoV-2 1
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 1

Data from ChEMBL 36 via Core Engine