Id |
Subject |
Object |
Predicate |
Lexical cue |
T118 |
0-130 |
Sentence |
denotes |
Compound Name and PubChem ID SMW D QPlogP LogKhsa Log BB PM Caco Rule of 5 OA Similar compounds and similarity index (%) |
T119 |
131-294 |
Sentence |
denotes |
Alpha-Pinene(6654) 136.236 0.048 3.618 0.343 0.865 3 9906 0 100 Pempidine 78.80Clomethiazole 76.61Tranylcypromine 74.79Levamisole 72.26Mecamylamine 70.18 |
T120 |
295-454 |
Sentence |
denotes |
P-CYMENE (7463) 134.221 0.063 3.657 0.344 0.699 2 9906 0 100 Clomethiazole 89.85Phenylpropanol 84.91Isaxonine 84.31Mephentermine 82.16Pempidine 81.71 |
T121 |
455-613 |
Sentence |
denotes |
Thymoquinone (10281) 164.204 0.146 0.754 −0.635 −0.322 2 1091 0 86 Ethadione 91.24Paramethadione 91.07Acipimox 90.18Metacetamol 90.04Menadione 88.99 |
T122 |
614-780 |
Sentence |
denotes |
CARVACROL(10364) 150.220 1.514 3.298 0.056 0.073 3 3697 0 100 Mephentermine 91.54Phenylpropanol 91.35Isaxonine 90.81Paroxypropione 88.74Etilamfetamine 88.69 |
T123 |
781-938 |
Sentence |
denotes |
Terpinen-4-ol (11230) 154.252 1.902 2.950 0.101 0.224 4 5373 0 100 Sobrerol 88.09Aptrol 85.79Mephentermine 85.24Pempidine 84.79Phenylpropanol 84.79 |
T124 |
939-1103 |
Sentence |
denotes |
alpha-Hederin (73296) 750.965 13.055 2.210 −0.287 −3.032 8 7M 3 16M Azithromycin 68.93Flurithromycin 67.56Metildigoxin 66.53Clarithromycin 64.48beta 61.13 |
T125 |
1104-1264 |
Sentence |
denotes |
Thymohydroquinone (95779) 166.219 2.985 1.919 −0.171 −0.357 4 1396 0 94 Aptrol 95.09Sobrerol 93.88Prothionamide 93.02Bethanidine 91.64Mexiletine 91.28 |
T126 |
1265-1423 |
Sentence |
denotes |
Dithymoquinone (398941) 328.407 0.713 1.531 −0.527 −0.598 4 714 0 87 Nitisinone 81.63Trimetozine 80.19Fropenem 78.15Carboquone 78.13Emorfazone 77.37 |
T127 |
1424-1592 |
Sentence |
denotes |
trans-Anethole (637563) 148.204 1.354 3.167 0.120 0.284 2 9906 0 100 Clomethiazole 91.29Mephentermine 89.60Phenylpropanol 89.55Isaxonine 89.01Fenipentol 87.70 |
T128 |
1593-1753 |
Sentence |
denotes |
LONGIFOLENE (1796220) 204.355 0.434 4.846 0.857 1.028 1 9906 0 100 Chlornaphazine 79.84Levamisole 78.13Medazepam 78.10Pyrantel 77.74Methsuximide 77.61 |
T129 |
1754-1924 |
Sentence |
denotes |
Nigellidine (136828302) 294.352 7.916 3.728 0.666 −0.379 3 1219 0 100 Mesterolone 90.40Ondansetron 89.21Mazindol 88.92Metandienone 88.84Methandrostenolone 88.77 |
T130 |
1925-2083 |
Sentence |
denotes |
Nigellicine (11402337) 246.265 0.873 2.748 −0.597 −0.053 2 1794 0 88 Flumequine 91.32Ketorolac 88.64Oxolinic 86.54Anagrelide 85.98Glutethimide 85.82 |