APLINDORE FUMARATE

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: P13TV5A758

Structure
InChI Key GELJVTSEGKGLDF-QDSMGTAFSA-N
Smile O=C(O)/C=C/C(=O)O.O=C1Cc2c(ccc3c2O[C@@H](CNCc2ccccc2)CO3)N1
InChI
InChI=1S/C18H18N2O3.C4H4O4/c21-17-8-14-15(20-17)6-7-16-18(14)23-13(11-22-16)10-19-9-12-4-2-1-3-5-12;5-3(6)1-2-4(7)8/h1-7,13,19H,8-11H2,(H,20,21);1-2H,(H,5,6)(H,7,8)/b;2-1+/t13-;/m0./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C22H22N2O7
Molecular Weight 426.43
AlogP 2.11
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 59.59
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 23.0

Pharmacology

Action Mechanism of Action Reference
PARTIAL AGONIST Dopamine D2 receptor partial agonist PubMed

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL2104864
FDA SRS P13TV5A758
PubChem 6440763
SureChEMBL SCHEMBL1231153
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