Lysergide   Click here for help

GtoPdb Ligand ID: 17

Abbreviated name: LSD
Synonyms: (+)-lysergic acid diethylamide | N,N-diethyllysergamide
PDB Ligand
Compound class: Synthetic organic
Comment: Lysergic acid diethylamide (LSD), also known colloquially as "acid", is a psychedelic drug known for its psychological effects. In 2017 LSD was crystalised in complex with the human serotonin receptor 5-HT2B [7].
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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 4
Topological polar surface area 39.34
Molecular weight 323.2
XLogP 2.42
No. Lipinski's rules broken 0
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Canonical SMILES CCN(C(=O)C1CN(C)C2C(=C1)c1cccc3c1c(C2)c[nH]3)CC
Isomeric SMILES CCN(C(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)c[nH]3)CC
InChI InChI=1S/C20H25N3O/c1-4-23(5-2)20(24)14-9-16-15-7-6-8-17-19(15)13(11-21-17)10-18(16)22(3)12-14/h6-9,11,14,18,21H,4-5,10,12H2,1-3H3/t14-,18-/m1/s1
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
729 lysergide
Synonyms Click here for help
(+)-lysergic acid diethylamide | N,N-diethyllysergamide
Database Links Click here for help
Specialist databases
GPCRdb Ligand Lysergide
Other databases
CAS Registry No. 50-37-3
ChEMBL Ligand CHEMBL263881
DrugBank Ligand DB04829
DrugCentral Ligand 1621
GtoPdb PubChem SID 135650536
PubChem CID 5761
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UniChem Compound Search for chemical match using the InChIKey VAYOSLLFUXYJDT-RDTXWAMCSA-N
UniChem Connectivity Search for chemical match using the InChIKey VAYOSLLFUXYJDT-RDTXWAMCSA-N
Wikipedia Lysergic_acid_diethylamide