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["Mol ID","Molecule Name","MW","AlogP","Hdon","Hacc","OB (%)","Caco-2","BBB","DL","FASA-","HL","Save"]
["MOL006505","(-)-epicatechin",290.29,1.92,5,6,28.93,-0.03,-0.58,0.24,0.34]
["MOL001736","(-)-taxifolin",304.27,1.49,5,7,60.51,-0.24,-1.02,0.27,0.41,14.37]
["MOL000608","()-Terpinen-4-ol",154.28,2.55,1,1,81.41,1.36,1.66,0.03,0.25,10.81]
["MOL013129","(2R,3R)-2-(3,5-dihydroxyphenyl)-3,5,7-trihydroxychroman-4-one",304.27,1.49,5,7,63.17,-0.34,-0.92,0.27,0.39,15.14]
["MOL000730","(2S,3R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)chroman-4-one",288.27,1.75,4,6,22.73,-0.1,-0.74,0.24,0.41]
["MOL000118","(L)-alpha-Terpineol",154.28,2.42,1,1,48.8,1.39,1.72,0.03,0.27,11.35]
["MOL000198","(R)-linalool",154.28,2.74,1,1,39.8,1.33,1.36,0.02,0.32,6.48]
["MOL013121","[(2S,3S,4R,5R)-2-[(2R,3R,4S,5S,6R)-3-acetyloxy-6-(acetyloxymethyl)-4,5-dihydroxyoxan-2-yl]oxy-4-hydroxy-2,5-bis[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]oxolan-3-yl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate",954.96,3.13,6,22,3.04,-2.17,-3.26,0.2,0.31]
["MOL010505","2H-3,9a-Methano-1-benzoxepin-9-methanol, octahydro-2,2,5a-trimethyl-, (3R-(3alpha,5aalpha,9alpha,9aalpha))-",238.41,2.45,1,2,98.38,1.01,1.05,0.14,0.2,4.23]
["MOL013116","3-O-caffeoylshikimic acid",336.32,0.8,5,8,14.48,-0.81,-1.51,0.3,0.38]
["MOL013117","4,7-Dihydroxy-5-methoxyl-6-methyl-8-formyl-flavan",314.36,2.69,2,5,37.03,0.48,-0.13,0.28,0.3,2.9]
["MOL004713","alpha-Eudesmol",222.41,3.67,1,1,25.02,1.31,1.29,0.1,0.25]
["MOL004569","Aromadedrin",288.27,1.75,4,6,23.04,-0.08,-0.67,0.24,0.43]
["MOL004575","astilbin",450.43,0.63,7,11,36.46,-1.29,-1.85,0.74,0.37,15.58]
["MOL000032","beta-Eudesmol",222.41,3.72,1,1,26.09,1.32,1.38,0.1,0]
["MOL000358","beta-sitosterol",414.79,8.08,1,1,36.91,1.32,0.99,0.75,0.23,5.36]
["MOL001807","Cedar acid",198.19,1.13,2,5,47.78,0.5,0.1,0.06,0,11.1]
["MOL000875","Cedrol",222.41,3.16,1,1,16.23,1.35,1.46,0.12,0.24]
["MOL004580","cis-Dihydroquercetin",304.27,1.49,5,7,66.44,-0.34,-1.11,0.27,0.4,14.51]
["MOL000615","delta-amorphene",204.39,4.94,0,0,17.95,1.85,1.99,0.08,0.24]
["MOL001772","Dihydro-beta-ionone",194.35,3.24,0,1,26.25,1.35,1.61,0.05,0.27]
["MOL009782","Dihydroresveratrol",230.28,3.46,3,3,87.27,0.81,0.06,0.11,0.4,5.41]
["MOL002441","Dioscin",869.17,1.17,8,16,17.75,-2.19,-3.05,0.06,0.21]
["MOL000546","diosgenin",414.69,4.63,1,3,80.88,0.82,0.27,0.81,0.19,4.14]
["MOL000885","Dodekan",170.38,5.85,0,0,17.74,1.79,1.96,0.02,0.16]
["MOL000131","EIC",280.5,6.39,1,2,41.9,1.16,0.9,0.14,0.25,7.5]
["MOL004572","engeletin",434.43,0.89,6,10,2.65,-1.01,-1.45,0.7,0.37]
["MOL013119","Enhydrin",464.51,1.37,0,10,40.56,-0.36,-0.82,0.74,0.36,5.63]
["MOL000360","FER",194.2,1.62,2,4,39.56,0.47,-0.03,0.06,0.34,2.38]
["MOL000865","hexadecane",226.5,7.67,0,0,12.32,1.81,1.85,0.06,0.14]
["MOL000748","HMF",126.12,0.67,1,3,45.07,0.05,-0.27,0.02,0.22,11.73]
["MOL013128","isoastilbin",450.43,0.63,7,11,27.05,-1.19,-1.79,0.74,0.37]
["MOL004567","isoengelitin",434.43,0.89,6,10,34.65,-0.91,-1.39,0.7,0.35,15.58]
["MOL013213","Isoeruboside_B",{"v":1081.35,"d":"1,081.35"},-3.27,14,24,8.88,-3.93,-4.58,0.02,0.21]
["MOL013214","Isoeruboside_B_qt",432.71,3.72,2,4,13.34,0.12,-0.61,0.79,0.22]
["MOL000071","Istidina",155.18,-1.01,4,4,53.18,-0.25,-0.4,0.03,0,-5.72]
["MOL000196","L-Bornyl acetate",196.32,2.35,0,2,65.52,1.29,1.59,0.08,0.23,6.94]
["MOL001398","Methyllinolenate",292.51,6.2,0,2,46.15,1.48,1.09,0.17,0.24,5.95]
["MOL001393","myristic acid",228.42,5.46,1,2,21.18,1.07,0.99,0.07,0.19]
["MOL000864","MYS",212.47,7.22,0,0,13.98,1.81,1.92,0.05,0.15]
["MOL004328","naringenin",272.27,2.3,3,5,59.29,0.28,-0.37,0.21,0.4,16.98]
["MOL009778","n-butyl-α-D-fructoufranoside",236.3,-0.83,4,6,8.53,-0.85,-1.45,0.08,0.21]
["MOL001836","n-butyl-β-D-fructopyronoside",236.3,-0.83,4,6,18.17,-0.56,-0.88,0.08,0.21]
["MOL001947","n-butyl-β-D-fructoufranoside",236.3,-0.83,4,6,9.94,-0.78,-1.26,0.08,0.25]
["MOL000857","NCA",122.14,-0.32,2,3,71.13,0.44,0.2,0.02,0.33,11.89]
["MOL013118","Neoastilbin",450.43,0.63,7,11,40.54,-1.07,-1.57,0.74,0.34,17.65]
["MOL004783","nonane",128.29,4.48,0,0,29.23,1.75,1.95,0.01,0.19]
["MOL013120","octacosanal",408.84,11.89,0,1,12.19,1.56,1.02,0.42,0.14]
["MOL000675","oleic acid",282.52,6.84,1,2,33.13,1.17,0.78,0.14,0.2,4.99]
["MOL000069","palmitic acid",256.48,6.37,1,2,19.3,1.09,1,0.1,0]
["MOL005644","Palmitone",450.93,12.95,0,1,11.85,1.57,0.99,0.48,0.16]
["MOL000098","quercetin",302.25,1.5,5,7,46.43,0.05,-0.77,0.28,0.38,14.4]
["MOL012744","resveratrol",228.26,3.01,3,3,19.07,0.8,-0.01,0.11,0.49]
["MOL000357","Sitogluside",576.95,6.34,4,6,20.63,-0.14,-0.93,0.62,0.23]
["MOL000359","sitosterol",414.79,8.08,1,1,36.91,1.32,0.87,0.75,0.22,5.37]
["MOL005074","SKM",174.17,-1.18,4,5,46.24,-1.16,-1.56,0.04,0.32,11.18]
["MOL013122","Smiglaside C",820.82,1.28,5,20,4.21,-1.86,-2.76,0.31,0.27]
["MOL013123","Smiglaside D",966.97,3.53,5,22,3.05,-1.93,-2.81,0.19,0.32]
["MOL013124","Smiglaside E",924.93,3.15,6,21,3.17,-2.06,-3.07,0.22,0.33]
["MOL003894","Smilagenin",416.71,4.88,1,3,14.15,0.73,0.1,0.81,0.19]
["MOL013126","Sodium tauropythocholate",514.78,1.19,4,8,15.2,-0.68,-1.54,0.86,0.05]
["MOL000860","stearic acid",284.54,7.28,1,2,17.83,1.15,1.22,0.14,0.19]
["MOL000449","Stigmasterol",412.77,7.64,1,1,43.83,1.44,1,0.76,0.22,5.57]
["MOL000346","succinic acid",118.1,-0.41,2,4,29.62,-0.44,-0.71,0.01,0.42]
["MOL004107","Syrionylglycerol-beta-syringaresinol",969.05,-1.2,10,23,3.01,-2.86,-4.15,0.09,0]
["MOL004108","Syrionylglycerol-beta-syringaresinol_qt",644.73,2.61,4,13,8.4,-0.56,-1.54,0.6,0]
["MOL010175","Tannin",{"v":1701.27,"d":"1,701.27"},8.18,25,46,7.89,-6.1,-7.29,0.03,0.49]
["MOL004576","taxifolin",304.27,1.49,5,7,57.84,-0.23,-0.8,0.27,0.39,14.41]
["MOL000723","trans-2,4-decadienal",152.26,3.21,0,1,51.03,1.4,1.49,0.02,0.32,7.44]
["MOL000880","Tricosane",324.71,10.86,0,0,8.33,1.85,1.68,0.21,0.13]
["MOL013127","Tulipane",98.11,0.75,0,2,75.16,1.1,1.53,0.01,0.34,11.7]
["MOL001399","TWT",310.68,10.41,0,0,8.37,1.85,1.64,0.18,0.13]
["MOL002023","ZINC00968101",154.28,1.98,1,1,88.03,1.27,1.53,0.05,0.24,11.34]
["MOL006868","β-terpineol",154.28,2.47,1,1,47.97,1.19,1.34,0.03,0.29,11.28]

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