Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 058896B00B

Structure

InChI Key VGDDOIZXGFJDRC-VJTSUQJLSA-N
Smile COc1cc(N)c(Cl)cc1C(=O)N[C@@H]1CCN(CCCCCC(=O)O[C@H]2CN3CCC2CC3)C[C@@H]1OC
InChI
InChI=1S/C27H41ClN4O5/c1-35-23-15-21(29)20(28)14-19(23)27(34)30-22-9-13-31(17-25(22)36-2)10-5-3-4-6-26(33)37-24-16-32-11-7-18(24)8-12-32/h14-15,18,22,24-25H,3-13,16-17,29H2,1-2H3,(H,30,34)/t22-,24+,25+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C27H41ClN4O5
Molecular Weight 537.1
AlogP 2.95
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 11.0
Polar Surface Area 106.36
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 37.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Serotonin 4 (5-HT4) receptor agonist PubMed

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL2103858
DrugBank DB05542
FDA SRS 058896B00B
PubChem 11237985
SureChEMBL SCHEMBL731063