CHLORQUINALDOL

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: D08AH02
UNII: D6VHC87LLS

Structure
InChI Key GPTXWRGISTZRIO-UHFFFAOYSA-N
Smile Cc1ccc2c(Cl)cc(Cl)c(O)c2n1
InChI
InChI=1S/C10H7Cl2NO/c1-5-2-3-6-7(11)4-8(12)10(14)9(6)13-5/h2-4,14H,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H7Cl2NO
Molecular Weight 228.08
AlogP 3.56
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 0.0
Polar Surface Area 33.12
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 14.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Protease Metallo protease Metallo protease MAE clan Metallo protease M27 family
- 10100 - - -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 89

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 74500
ChEMBL CHEMBL224325
DrugBank DB13306
DrugCentral 3095
EPA CompTox DTXSID3048998
FDA SRS D6VHC87LLS
PubChem 6301
SureChEMBL SCHEMBL301405
ZINC ZINC000000119403
CONTENTS