Input interpretation
aspirin | s-(indolylmethylthiohydroximoyl)-L-cysteine
Chemical names and formulas
| aspirin | s-(indolylmethylthiohydroximoyl)-L-cysteine formula | (CH_3CO_2)C_6H_4CO_2H | Hill formula | C_9H_8O_4 | name | aspirin | s-(indolylmethylthiohydroximoyl)-L-cysteine IUPAC name | 2-acetyloxybenzoic acid | alternate names | 2-(acetyloxy)benzoic acid | acenterine | acetosal | benzoic acid, 2-(acetyloxy)- | (none) mass fractions | C (carbon) 60% | H (hydrogen) 4.48% | O (oxygen) 35.5% | C (carbon) 53.2% | H (hydrogen) 5.15% | N (nitrogen) 14.3% | O (oxygen) 16.4% | S (sulfur) 10.9%
Structure diagrams
| aspirin | s-(indolylmethylthiohydroximoyl)-L-cysteine vertex count | 13 | 20 edge count | 14 | 26 Schultz index | 981 | 3687 Wiener index | 246 | 889 Hosoya index | 335 | 12679 Balaban index | 2.462 | 1.776
3D structure
3D structure
Basic properties
| aspirin | s-(indolylmethylthiohydroximoyl)-L-cysteine molar mass | 180.16 g/mol | 293.34 g/mol phase | solid (at STP) | melting point | 140 °C | boiling point | 140 °C | density | 1.39 g/cm^3 |
Units
Hydrophobicity and permeability properties
| aspirin experimental LogP hydrophobicity | 1.4 predicted LogP hydrophobicity | 1.43 predicted LogS | -2.09 experimental Caco-2 permeability | -5.06
Drug interactions
aspirin | acenocoumarol | acetazolamide | acetohexamide | anisindione | betamethasone | chlorpropamide | cortisone acetate | dexamethasone | dichlorphenamide | dicumarol | fludrocortisone | ginkgo biloba | glyburide | gliclazide | glipizide | glisoxepide | glycodiazine | griseofulvin | heparin | hydrocortisone | ... (total: 42)