Gusperimus hydrochlorideProduct ingredient for Gusperimus
- Name
- Gusperimus hydrochloride
- Drug Entry
- Gusperimus
Gusperimus has been used in trials studying the treatment of Lupus Nephritis, Wegeners Granulomatosis, and Wegener's Granulomatosis.
- Accession Number
- DBSALT003428
- Structure
Structure for Gusperimus hydrochloride (DBSALT003428)
- Synonyms
- (±)-N-(((4-((3-AMINOPROPYL)AMINO)BUTYL)CARBAMOYL)HYDROXYMETHYL)-7-GUANIDINOHEPTANAMIDE TRIHYDROCHLORIDE / Gusperimus trihydrochloride / HEPTANAMIDE, 7-((AMINOIMINOMETHYL)AMINO)-N-(2-((4-((3-AMINOPROPYL)AMINO)BUTYL)AMINO)-1-HYDROXY-2-OXOETHYL)-, HYDROCHLORIDE (1:3) / HEPTANAMIDE, 7-((AMINOIMINOMETHYL)AMINO)-N-(2-((4-((3-AMINOPROPYL)AMINO)BUTYL)AMINO)-1-HYDROXY-2-OXOETHYL)-, TRIHYDROCHLORIDE, (±)- / SPANIDIN
- External IDs
- BMS-181173 / BMY-42215-1 / NKT-01 / NSC-356894
- UNII
- QZS4144IO0
- CAS Number
- 85468-01-5
- Weight
- Average: 496.9
Monoisotopic: 495.2258213 - Chemical Formula
- C17H40Cl3N7O3
- InChI Key
- AXSPHUWXYSZPBG-UHFFFAOYSA-N
- InChI
- InChI=1S/C17H37N7O3.3ClH/c18-9-7-11-21-10-5-6-12-22-15(26)16(27)24-14(25)8-3-1-2-4-13-23-17(19)20;;;/h16,21,27H,1-13,18H2,(H,22,26)(H,24,25)(H4,19,20,23);3*1H
- IUPAC Name
- N-[({4-[(3-aminopropyl)amino]butyl}carbamoyl)(hydroxy)methyl]-7-carbamimidamidoheptanamide trihydrochloride
- SMILES
- Cl.Cl.Cl.NCCCNCCCCNC(=O)C(O)NC(=O)CCCCCCNC(N)=N
- External Links
- ChemSpider
- 49994
- ChEBI
- 31661
- ChEMBL
- CHEMBL2356648
- Predicted Properties
Property Value Source logP -3.1 Chemaxon pKa (Strongest Acidic) 11.37 Chemaxon pKa (Strongest Basic) 12.28 Chemaxon Physiological Charge 3 Chemaxon Hydrogen Acceptor Count 8 Chemaxon Hydrogen Donor Count 8 Chemaxon Polar Surface Area 178.38 Å2 Chemaxon Rotatable Bond Count 17 Chemaxon Refractivity 115.75 m3·mol-1 Chemaxon Polarizability 45.23 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon