EGIS-11150   Click here for help

GtoPdb Ligand ID: 11959

Synonyms: EGIS11150 | S 36549 | S-36549 | S36549
Compound class: Synthetic organic
Comment: EGIS-11150 is an antipsychotic compound that has demonstrated procognitive efficacy in preclinical models [1-2]. It has an 'atypical' antipsychotic drug profile, with effects on several GPCR receptor pathways within the hippocampal-prefrontal cortex circuit. It has been proposed as a modulator of psychosis and cognitive dysfunction in schizophrenia [2].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 76.19
Molecular weight 405.14
XLogP 3.25
No. Lipinski's rules broken 0
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Canonical SMILES Fc1ccc2c(c1)onc2C1CCN(CC1)CCNc1cnn(c(=O)c1Cl)C
Isomeric SMILES Cn1c(=O)c(c(cn1)NCCN1CCC(CC1)c1noc2c1ccc(c2)F)Cl
InChI InChI=1S/C19H21ClFN5O2/c1-25-19(27)17(20)15(11-23-25)22-6-9-26-7-4-12(5-8-26)18-14-3-2-13(21)10-16(14)28-24-18/h2-3,10-12,22H,4-9H2,1H3
Classification Click here for help
Compound class Synthetic organic
Synonyms Click here for help
EGIS11150 | S 36549 | S-36549 | S36549
Database Links Click here for help
Specialist databases
GPCRdb Ligand EGIS-11150
Other databases
CAS Registry No. 494861-87-9 (source: PubChem)
GtoPdb PubChem SID 464244100
PubChem CID 9909267
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