ALEPLASININ

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: LL56J87F3X

Structure
InChI Key HSXLMAFNWCSZGP-UHFFFAOYSA-N
Smile Cc1cccc(-c2ccc3c(c2)c(C(=O)C(=O)O)cn3Cc2ccc(C(C)(C)C)cc2)c1
InChI
InChI=1S/C28H27NO3/c1-18-6-5-7-20(14-18)21-10-13-25-23(15-21)24(26(30)27(31)32)17-29(25)16-19-8-11-22(12-9-19)28(2,3)4/h5-15,17H,16H2,1-4H3,(H,31,32)

Physicochemical Descriptors

Property Name Value
Molecular Formula C28H27NO3
Molecular Weight 425.53
AlogP 6.23
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 59.3
Molecular species ACID
Aromatic Rings 4.0
Heavy Atoms 32.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Plasminogen activator inhibitor-1 inhibitor PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Secreted protein
- 8600 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Alzheimer Disease 1 D000544 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL325424
DrugBank DB12635
EPA CompTox DTXSID80197447
FDA SRS LL56J87F3X
PubChem 10224267
SureChEMBL SCHEMBL3861891
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