PERINDOPRIL

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Synonyms
Status
Molecule Category Free-form
ATC C09AA04
UNII Y5GMK36KGY
EPA CompTox DTXSID6023440

Structure

InChI Key IPVQLZZIHOAWMC-QXKUPLGCSA-N
Smiles CCC[C@H](N[C@@H](C)C(=O)N1[C@H](C(=O)O)C[C@@H]2CCCC[C@@H]21)C(=O)OCC
InChI
InChI=1S/C19H32N2O5/c1-4-8-14(19(25)26-5-2)20-12(3)17(22)21-15-10-7-6-9-13(15)11-16(21)18(23)24/h12-16,20H,4-11H2,1-3H3,(H,23,24)/t12-,13-,14-,15-,16-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H32N2O5
Molecular Weight 368.47
AlogP 1.94
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 8.0
Polar Surface Area 95.94
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 26.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Protease Metallo protease Metallo protease MAE clan Metallo protease M2 family
- 1.5 - - -
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
- 1.5 - - -

Cross References

Resources Reference
ChEBI 8024
ChEMBL CHEMBL1581
DrugBank DB00790
DrugCentral 2108
FDA SRS Y5GMK36KGY
Human Metabolome Database HMDB0014928
Guide to Pharmacology 6367
KEGG C07706
PharmGKB PA450877
PubChem 107807
SureChEMBL SCHEMBL16205
ZINC ZINC000003812867
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