TERAZOSIN

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Synonyms
Status
Molecule Category Free-form
ATC G04CA03
UNII 8L5014XET7
EPA CompTox DTXSID3023639

Structure

InChI Key VCKUSRYTPJJLNI-UHFFFAOYSA-N
Smiles COc1cc2nc(N3CCN(C(=O)C4CCCO4)CC3)nc(N)c2cc1OC
InChI
InChI=1S/C19H25N5O4/c1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h10-11,14H,3-9H2,1-2H3,(H2,20,21,22)

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H25N5O4
Molecular Weight 387.44
AlogP 1.06
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 103.04
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 28.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Adrenergic receptor
0.5-51.89 - 1.479-39.81 0.69-550 -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC22 family of organic cation and anion transporters
- - - - 77
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Bos taurus
- - - 26 -
Canis lupus familiaris
- - 36.31-95.5 2-32 -
Cricetulus griseus
- - - 0.69 -
Homo sapiens
0.5-51.89 - 0.1585 2.2-418 77
Mus musculus
- - - - 41
Oryctolagus cuniculus
- - 19.95 - -
Rattus norvegicus
- - 0.1-407.38 35 -
hamster
- - - 30 -

Related Entries

Cross References

Resources Reference
ChEBI 9445
ChEMBL CHEMBL611
DrugBank DB01162
DrugCentral 3584
FDA SRS 8L5014XET7
Human Metabolome Database HMDB0015293
Guide to Pharmacology 7302
KEGG C07127
PharmGKB PA451612
PubChem 5401
SureChEMBL SCHEMBL6528
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