Solid dispersion database

Total 58 polymers are available. Each polymer is calulated using DFT at the level of B3LYP(D3)/6-31G*. Bonded and nonbonded parameters of polymer were described with RESP charge and GAFF forcefield. N, M, L indicate the multiple unit, you can check it with the structure figure.

  • POLOXAMER: Poloxamers are polyoxyethylene–polyoxypropylene copolymer. These macromolecule surfactants have the general formula EaPbEa, where a is a hydrophilic polyoxyethylene chain and b is a hydrophobic polyoxypropylene chain.

    图片示例
  • PVP: Polyvinylpyrrolidone (PVP), commonly called polyvidone or povidone, is a water-soluble polymer made from the monomer N-vinylpyrrolidone.

    图片示例
  • HPMCAS: Hydroxypropyl methylcellulose acetate succinate.

    HPMCAS_L:

    图片示例

    HPMCAS_M:

    图片示例

    HPMCAS_H:

    图片示例
  • SOLUPLUS: Soluplus is a polymeric solubilizer with an amphiphilic chemical structure, which was particularly developed for solid solutions.

    图片示例
  • PVPVA64: PVPVA64 is a 6:4 linear random copolymer of N-vinylpyrrolidone and vinyl acetate.

    图片示例
  • PVA: Polyvinyl alcohol (PVOH, PVA, or PVAl) is a water-soluble synthetic polymer.

    图片示例
  • Eudragit_L_100: Eudragit_L_100 contains an anionic copolymer based on methacrylic acid and ethyl acrylate. The ratio of the free carboxyl groups to the ester groups is approximately 1:1.

    图片示例
  • Eudragit_E_100: Eudragit_E_100 is a cationic copolymer based on dimethylaminoethyl methacrylate, butyl methacrylate, and methyl methacrylate with a ratio of 2:1:1.

    图片示例
  • GELUCIRE: Gelucire surfactants result from an esterification reaction between a polar moiety (PEG 32, molecular weight 1500) and an apolar moiety (vegetable oils or fatty acids). The final product is a mixture of PEG esters and mono-, di- and triglycerides (Gelucire® 44/14 and Gelucire® 50/13).

    图片示例
  • PEG: PEG is also known as polyethylene oxide (PEO) or polyoxyethylene (POE), depending on its molecular weight. The structure of PEG is commonly expressed as H−(O−CH2−CH2)n−OH.

    图片示例
  • PAA: Poly(acrylic acid) (PAA; trade name Carbomer) is a polymer with the formula (CH2-CHCO2H)n.

    图片示例
  • HPMC: Hydroxypropyl methylcellulose (HPMC) belongs to the group of cellulose ethers in which hydroxyl groups have been substituted with one or more of the three hydroxyl groups present in the cellulose ring.

    图片示例
Name Description
POLOXAMER POLOXAMER407  
  POLOXAMER338  
  POLOXAMER237  
  POLOXAMER188  
  POLOXAMER124  
PVP PVP_24N_5000  
  PVP_72N_15000  
  PVP_5N_1000  
  PVP_144N_30000  
HPMCAS_M HPMCAS_M_5N  
  HPMCAS_M_2N  
  HPMCAS_M_1N  
  HPMCAS_M_10N  
SOLUPLUS SOLUPLUS_16N_32M_64L  
  SOLUPLUS_2N_4M_8L  
  SOLUPLUS_8N_16M_32L  
  SOLUPLUS_1N_2M_4L  
PVPVA64 PVP60VA50  
  PVP6VA5  
  PVP12VA10  
  PVP24VA20  
PVA PVA_2M  
  PVA_4M  
  PVA_10M  
  PVA_20M  
  PVA_454M  
Eudragit_L_100 MA20EA20  
  MA10EA10  
  MA5EA5  
  MA1EA1  
HPMCAS_H HPMCAS_H_1N  
  HPMCAS_H_2N  
  HPMCAS_H_5N  
  HPMCAS_H_10N  
GELUCIRE GELUCIRE_50_13  
  GELUCIRE_44_14  
PEG PEG200_4M  
  PEG300_6M  
  PEG1000_22M  
  PEG2000_45M  
  PEG4000_76M  
  PEG8000_181M  
HPMCAS_L HPMCAS_L_2N  
  HPMCAS_L_5N  
  HPMCAS_L_1N  
  HPMCAS_L_10N  
PAA PAA_10M  
  PAA_4M  
  PAA_2M  
  PAA_20M  
Eudragit_L_100 DMA20BMA10MMA10  
  DMA5BMA5MMA5  
  DMA4BMA2MMA2  
  DMA2BMA1MMA1  
HPMC HPMC5N  
  HPMC10N  
  HPMC1N  
  HPMC2N