Description:
Dolutegravir is a two-metal-binding HIV-1 integrase inhibitor with IC50 of 2.7 nM, with modest activity against raltegravir-resistant signature mutants Y143R, Q148K, N155H, and G140S/Q148H. It blocks the strand transfer step of the integration of the viral genome into the host cell (INSTI).
- Molecular Weight: 419.38
- Molecular Formula: C20H19F2N3O5
Purity: ≥98%
Canonical SMILES:
CC1CCOC2N1C(=O)C3=C(C(=O)C(=CN3C2)C(=O)NCC4=C(C=C(C=C4)F)F)O
InChI:
InChI=1S/C20H19F2N3O5/c1-10-4-5-30-15-9-24-8-13(17(26)18(27)16(24)20(29)25(10)15)19(28)23-7-11-2-3-12(21)6-14(11)22/h2-3,6,8,10,15,27H,4-5,7,9H2,1H3,(H,23,28)/t10-,15+/m1/s1
InChIKey: RHWKPHLQXYSBKR-BMIGLBTASA-N
- Boiling Point: 669.0±55.0 °C at 760 mmHg
- Solubility: In Vitro: DMSO : 10 mg/mL(23.84 mM;Need ultrasonic and warming)In Vivo: 1.Add each solvent one by one: 5% DMSO >> 95% (20%SBE-β-CDin saline)Solubility: ≥ 2.62 mg/mL (6.25 mM); Clear solution2.Add each solvent one by one: 10% DMSO >> 40%PEG300 >> 5%Tween-80 >> 45% salineSolubility: ≥ 2.5 mg/mL (5.96 mM); Clear solution3.Add each solvent one by one: 10% DMSO >> 90% (20%SBE-β-CDin saline)Solubility: ≥ 2.5 mg/mL (5.96 mM); Clear solution4.Add each solvent one by one: 10% DMSO >> 90%corn oilSolubility: ≥ 2.5 mg/mL (5.96 mM); Clear solution
- Appearance: White to off-white (Solid)
- Storage: 2-8°C
Synonyms:
GSK-1349572; GSK 1349572; GSK1349572; Tivicay
More details are to be found on supplier website
