ARTEFENOMEL

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: RIK029813G

Structure
InChI Key XLCNVWUKICLURR-NTNLSYPKSA-N
Smile c1cc([C@H]2CC[C@]3(CC2)OO[C@]2(O3)C3CC4CC(C3)CC2C4)ccc1OCCN1CCOCC1
InChI
InChI=1S/C28H39NO5/c1-3-26(31-14-11-29-9-12-30-13-10-29)4-2-22(1)23-5-7-27(8-6-23)32-28(34-33-27)24-16-20-15-21(18-24)19-25(28)17-20/h1-4,20-21,23-25H,5-19H2/t20?,21?,23-,24?,25?,27+,28-

Physicochemical Descriptors

Property Name Value
Molecular Formula C28H39NO5
Molecular Weight 469.62
AlogP 4.88
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 5.0
Polar Surface Area 49.39
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 34.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Malaria 2 D008288 ClinicalTrials
Malaria, Falciparum 2 D016778 ClinicalTrials
Malaria, Vivax 2 D016780 ClinicalTrials
Schistosomiasis haematobia 2 D012553 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 1029939-86-3
ChEMBL CHEMBL1828820
FDA SRS RIK029813G
Guide to Pharmacology 9971
PubChem 24999143
SureChEMBL SCHEMBL12137235
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