Synonyms:
Status: Approved (2015)
Entry Type: Small molecule
Molecule Category: Salt Prodrug
UNII: TFT5IM1KGB
Parent Compound: PERINDOPRIL

Structure

InChI Key RYCSJJXKEWBUTI-YDYAIEMNSA-N
Smile 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.N=C(N)NCCC[C@H](N)C(=O)O
InChI
InChI=1S/C19H32N2O5.C6H14N4O2/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;7-4(5(11)12)2-1-3-10-6(8)9/h12-16,20H,4-11H2,1-3H3,(H,23,24);4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t12-,13-,14-,15-,16-;4-/m00/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C25H46N6O7
Molecular Weight 542.68
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

Action Mechanism of Action Reference
INHIBITOR Angiotensin-converting enzyme inhibitor FDA

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Parent
Mixture

Cross References

Resources Reference
ChEBI 77655
ChEMBL CHEMBL3544986
EPA CompTox DTXSID70210159
FDA SRS TFT5IM1KGB
PubChem 12068809
SureChEMBL SCHEMBL15090777