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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL463207
CHEMBL463207
Compound Name [3H]LSD
ChEMBL Synonyms [3H]LSD
Max Phase 0
Trade Names
Molecular Formula C20H25N3O

Additional synonyms for CHEMBL463207 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [3H]C([3H])([3H])N1C[C@@H](C=C2[C@H]1Cc3c[nH]c4cccc2c34)C(=O ...
Download SMILES
Standard InChI InChI=1S/C20H25N3O/c1-4-23(5-2)20(24)14-9-16-15-7-6-8-17-19( ...
Download InChI
Standard InChI Key VAYOSLLFUXYJDT-QZGBZKRISA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL463207

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Target Predictions

The two tables below display ChEMBL single-protein targets which are predicted to interact with CHEMBL463207. A 1uM and 10 uM cut-off have been applied to ChEMBL bioactivity data used to generate the respective models and the yellow coloured rows correspond to genuine predictions, i.e. targets not included in the original training set for this compound.


1uM


ChEMBL_ID Target Name Organism Score
CHEMBL5200 C-X-C chemokine receptor type 3 Mus musculus 1.000
CHEMBL3426 Serotonin 5a (5-HT5a) receptor Homo sapiens 1.000
CHEMBL4441 C-X-C chemokine receptor type 3 Homo sapiens 1.000
CHEMBL3459 Serotonin 1b (5-HT1b) receptor Rattus norvegicus 1.000
CHEMBL1850 Dopamine D5 receptor Homo sapiens 1.000
CHEMBL1833 Serotonin 2b (5-HT2b) receptor Homo sapiens 1.000
CHEMBL1942 Alpha-2b adrenergic receptor Homo sapiens 1.000
CHEMBL315 Alpha-1b adrenergic receptor Rattus norvegicus 1.000
CHEMBL324 Serotonin 2c (5-HT2c) receptor Rattus norvegicus 1.000
CHEMBL1867 Alpha-2a adrenergic receptor Homo sapiens 0.999
CHEMBL289 Cytochrome P450 2D6 Homo sapiens 0.997
CHEMBL1916 Alpha-2c adrenergic receptor Homo sapiens 0.997
CHEMBL1983 Serotonin 1d (5-HT1d) receptor Homo sapiens 0.994
CHEMBL273 Serotonin 1a (5-HT1a) receptor Rattus norvegicus 0.993
CHEMBL3223 Serotonin 7 (5-HT7) receptor Rattus norvegicus 0.969
CHEMBL322 Serotonin 2a (5-HT2a) receptor Rattus norvegicus 0.968
CHEMBL2056 Dopamine D1 receptor Homo sapiens 0.950
CHEMBL214 Serotonin 1a (5-HT1a) receptor Homo sapiens 0.924
CHEMBL3597 Serotonin 5a (5-HT5a) receptor Mus musculus 0.904
CHEMBL3998 Dopamine D2 receptor Bos taurus 0.721



10uM


ChEMBL_ID Target Name Organism Score
CHEMBL5200 C-X-C chemokine receptor type 3 Mus musculus 1.000
CHEMBL3426 Serotonin 5a (5-HT5a) receptor Homo sapiens 1.000
CHEMBL4441 C-X-C chemokine receptor type 3 Homo sapiens 1.000
CHEMBL2182 Serotonin 1e (5-HT1e) receptor Homo sapiens 1.000
CHEMBL3459 Serotonin 1b (5-HT1b) receptor Rattus norvegicus 1.000
CHEMBL1850 Dopamine D5 receptor Homo sapiens 1.000
CHEMBL1833 Serotonin 2b (5-HT2b) receptor Homo sapiens 1.000
CHEMBL315 Alpha-1b adrenergic receptor Rattus norvegicus 1.000
CHEMBL1942 Alpha-2b adrenergic receptor Homo sapiens 1.000
CHEMBL324 Serotonin 2c (5-HT2c) receptor Rattus norvegicus 1.000
CHEMBL1867 Alpha-2a adrenergic receptor Homo sapiens 1.000
CHEMBL2056 Dopamine D1 receptor Homo sapiens 1.000
CHEMBL1983 Serotonin 1d (5-HT1d) receptor Homo sapiens 0.996
CHEMBL1916 Alpha-2c adrenergic receptor Homo sapiens 0.996
CHEMBL214 Serotonin 1a (5-HT1a) receptor Homo sapiens 0.995
CHEMBL273 Serotonin 1a (5-HT1a) receptor Rattus norvegicus 0.989
CHEMBL3223 Serotonin 7 (5-HT7) receptor Rattus norvegicus 0.973
CHEMBL322 Serotonin 2a (5-HT2a) receptor Rattus norvegicus 0.957
CHEMBL3998 Dopamine D2 receptor Bos taurus 0.940
CHEMBL225 Serotonin 2c (5-HT2c) receptor Homo sapiens 0.927

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
323.4 323.1998 2.91 3 39.34 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 1 0 4 1 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 7.41 2.71 2.37 2 24 0.94

Structural Alerts

There are no structural alerts for CHEMBL463207

Compound Cross References

ChemSpider ChemSpider:VAYOSLLFUXYJDT-QZGBZKRISA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL463207



Guide to Pharmacology 219
PubChem 44559100

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/VAYOSLLFUXYJDT-QZGBZKRISA-N spacer
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