Rivipansel sodiumProduct ingredient for Rivipansel
- Name
- Rivipansel sodium
- Drug Entry
- Rivipansel
Rivipansel has been used in trials studying the other, basic science, and treatment of Pain Crisis, Renal impairment, Anemia, Sickle Cell, Sickle Cell Disease, and Sickle Cell Disorders, among others.
- Accession Number
- DBSALT002408
- Structure
- Synonyms
- Not Available
- External IDs
- GMI 1070 / GMI-1070 / PF-06460031-02 / PF-0646003102
- UNII
- 11AEN6VWDN
- CAS Number
- 1189037-60-2
- Weight
- Average: 1535.35
Monoisotopic: 1534.28384014 - Chemical Formula
- C58H70N6Na4O31S3
- InChI Key
- QQDCIMVGFXSAJH-DJFGCAFRSA-J
- InChI
- InChI=1S/C58H74N6O31S3.4Na/c1-27-45(69)47(71)48(72)56(90-27)95-49-35(62-53(74)36-23-41(66)64-58(78)63-36)19-31(20-37(49)92-57-51(94-55(77)29-10-6-3-7-11-29)50(46(70)39(24-65)93-57)91-38(54(75)76)16-28-8-4-2-5-9-28)52(73)60-13-12-59-42(67)25-88-14-15-89-26-43(68)61-34-21-32(96(79,80)81)17-30-18-33(97(82,83)84)22-40(44(30)34)98(85,86)87;;;;/h3,6-7,10-11,17-18,21-23,27-28,31,35,37-39,45-51,56-57,65,69-72H,2,4-5,8-9,12-16,19-20,24-26H2,1H3,(H,59,67)(H,60,73)(H,61,68)(H,62,74)(H,75,76)(H,79,80,81)(H,82,83,84)(H,85,86,87)(H2,63,64,66,78);;;;/q;4*+1/p-4/t27-,31+,35-,37+,38-,39+,45+,46-,47+,48-,49+,50-,51+,56-,57+;;;;/m0..../s1
- IUPAC Name
- tetrasodium (2S)-2-{[(2R,3R,4S,5S,6R)-3-(benzoyloxy)-2-{[(1R,2R,3S,5R)-3-(2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-amido)-2-{[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-5-({2-[2-(2-{[(3,6,8-trisulfonatonaphthalen-1-yl)carbamoyl]methoxy}ethoxy)acetamido]ethyl}carbamoyl)cyclohexyl]oxy}-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-3-cyclohexylpropanoate
- SMILES
- [Na+].[Na+].[Na+].[Na+].[H][C@@](CC1CCCCC1)(O[C@H]1[C@@H](O)[C@@H](CO)O[C@@H](O[C@@H]2C[C@@H](C[C@H](NC(=O)C3=CC(=O)NC(=O)N3)[C@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)C(=O)NCCNC(=O)COCCOCC(=O)NC2=C3C(=CC(=C2)S([O-])(=O)=O)C=C(C=C3S([O-])(=O)=O)S([O-])(=O)=O)[C@@H]1OC(=O)C1=CC=CC=C1)C([O-])=O
- External Links
- ChemSpider
- 28540485
- ChEMBL
- CHEMBL3833316
- Predicted Properties
Property Value Source Water Solubility 2.2 mg/mL ALOGPS logP 1.36 ALOGPS logP -8.8 Chemaxon logS -2.8 ALOGPS pKa (Strongest Acidic) -3.1 Chemaxon pKa (Strongest Basic) -3.9 Chemaxon Physiological Charge -4 Chemaxon Hydrogen Acceptor Count 30 Chemaxon Hydrogen Donor Count 11 Chemaxon Polar Surface Area 578.39 Å2 Chemaxon Rotatable Bond Count 30 Chemaxon Refractivity 335.84 m3·mol-1 Chemaxon Polarizability 138.73 Å3 Chemaxon Number of Rings 8 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon