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POST
/pubchem/compounds/search

Authorizations

access-token
string
header
required

API token from the dashboard

Headers

access-token
string
required

Body

application/json
query
string
required
Minimum string length: 1
count
integer
required
Required range: x >= 1
timeout
integer
default:300
Required range: 20 <= x <= 1500
namespace
enum<string>
default:name
Available options:
name,
smiles,
inchikey
match
enum<string>
default:exact
Available options:
exact,
word

Response

Successful Response

id
integer
required
url
string
required
@type
string
default:PubchemCompound
iupac_name
string | null
molecular_formula
string | null
molecular_weight
string | null
smiles
string | null
connectivity_smiles
string | null
inchi
string | null
inchi_key
string | null
xlogp
number | null
tpsa
number | null
complexity
number | null
charge
integer | null
exact_mass
string | null
monoisotopic_mass
string | null
h_bond_donor_count
integer | null
h_bond_acceptor_count
integer | null
rotatable_bond_count
integer | null
heavy_atom_count
integer | null
covalent_unit_count
integer | null
atom_stereo_count
integer | null
defined_atom_stereo_count
integer | null
undefined_atom_stereo_count
integer | null
bond_stereo_count
integer | null
defined_bond_stereo_count
integer | null
volume_3d
number | null
conformer_count_3d
integer | null
literature_count
integer | null
patent_count
integer | null
patent_family_count
integer | null
annotation_type_count
integer | null
description_source
string | null
description_url
string | null
synonyms
string[]