DAGLUTRIL

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: KKV299446X

Structure
InChI Key FVWPYVZWVOLAOP-DQEYMECFSA-N
Smile CCOC(=O)[C@H](CCCc1ccccc1)C1(C(=O)N[C@H]2CCc3ccccc3N(CC(=O)O)C2=O)CCCC1
InChI
InChI=1S/C31H38N2O6/c1-2-39-29(37)24(15-10-13-22-11-4-3-5-12-22)31(19-8-9-20-31)30(38)32-25-18-17-23-14-6-7-16-26(23)33(28(25)36)21-27(34)35/h3-7,11-12,14,16,24-25H,2,8-10,13,15,17-21H2,1H3,(H,32,38)(H,34,35)/t24-,25-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C31H38N2O6
Molecular Weight 534.65
AlogP 4.3
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 11.0
Polar Surface Area 113.01
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 39.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Endothelin-converting enzyme 1 inhibitor PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Hypertension 2 D006973 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 182821-27-8
ChEMBL CHEMBL3989794
FDA SRS KKV299446X
Guide to Pharmacology 6506
PubChem 3038505
ZINC ZINC000084758960
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