K-134

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: J9J6NK6W4U

Structure
InChI Key ULGNGSQNNMKROG-WOJBJXKFSA-N
Smile O=C(NCCCOc1ccc2[nH]c(=O)ccc2c1)N(C1CC1)[C@@H]1CCCC[C@H]1O
InChI
InChI=1S/C22H29N3O4/c26-20-5-2-1-4-19(20)25(16-7-8-16)22(28)23-12-3-13-29-17-9-10-18-15(14-17)6-11-21(27)24-18/h6,9-11,14,16,19-20,26H,1-5,7-8,12-13H2,(H,23,28)(H,24,27)/t19-,20-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C22H29N3O4
Molecular Weight 399.49
AlogP 2.77
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 7.0
Polar Surface Area 94.66
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 29.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Phosphodiesterase 3 inhibitor Other

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Intermittent Claudication 2 D007383 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 189362-06-9
ChEMBL CHEMBL284838
DrugBank DB12685
EPA CompTox DTXSID90172346
FDA SRS J9J6NK6W4U
PubChem 9908900
SureChEMBL SCHEMBL5383733
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