Quer_ID : 1452 FORMULA : C26H43N2O9P WEIGHT : 558.6 NAME : (5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tetrahydro-2-furanyl)methyl SMILES : CCCCCCC(=O)COP(=O)(OCC1CCC(O1)N2C=C(C)C(=O)NC2=O)OCC(=O)CCCCCC ACTIVITY : Moderate *********************************************************************************************************************** RESULTS *********************************************************************************************************************** Result_ID: 16 FORMULA : C26H34O7 WEIGHT : 458.54 NAME : 10-((5-methoxy-4-(2-methyl-3-(3-methyl-2-butenyl)-2-oxiranyl)-1-oxaspiro[2.5]oct-6-yl)oxy)-10-oxo-2,4,6,8-decatetraenoic SMILES : COC1C(CCC2(CO2)C1C3(C)OC3CC=C(C)C)OC(=O)C=CC=CC=CC=CC(O)=O ACTIVITY : Active ----------------------------------------------------------------------------------------------------------------------- Result_ID: 72 FORMULA : C15H20N2OS WEIGHT : 276.4 NAME : 2-((isopentylthio)methyl)-4-methyl-2,3-dihydroquinazoline SMILES : CC(C)CCSC[C-]1N=C2C=CC=CC2=C(C)[N+]1=O ACTIVITY : Active ----------------------------------------------------------------------------------------------------------------------- Result_ID: 38142 FORMULA : C26H40O4 WEIGHT : 416.59 NAME : 1,2,3,4-tetramethoxy-5-methyl-6-(3,7,11-trimethyl-2,6,10-dodecatrienyl)benzene SMILES : COc1c(C)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(OC)c(OC)c1OC ACTIVITY : Inactive ----------------------------------------------------------------------------------------------------------------------- Result_ID: 33495 FORMULA : C19H21F6N5O4S WEIGHT : 529.46 NAME : 3-methyl-N-(2,2,2-trifluoro-1-(4-(((6-methoxy-3-pyridazinyl)amino)sulfonyl)anilino)-1-(trifluoromethyl)ethyl)butanamide SMILES : COc1ccc(NS(=O)(=O)c2ccc(NC(NC(=O)CC(C)C)(C(F)(F)F)C(F)(F)F)cc2)nn1 ACTIVITY : Inactive ----------------------------------------------------------------------------------------------------------------------- Result_ID: 28739 FORMULA : C11H17N3O4 WEIGHT : 255.27 NAME : N-(4-hydroxybutyl)-2-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)acetamide SMILES : CC1=CN(CC(=O)NCCCCO)C(=O)NC1=O ACTIVITY : Inactive ----------------------------------------------------------------------------------------------------------------------- Result_ID: 821 FORMULA : C18H30BrN5O5 WEIGHT : 476.37 NAME : Thymidine, SMILES : CCCCCCCCOC1N(C2CC(N=[N+]=[N-])C(CO)O2)C(=O)NC(=O)C1(C)Br ACTIVITY : Active ----------------------------------------------------------------------------------------------------------------------- Result_ID: 1380 FORMULA : C61H72Cl2O10 WEIGHT : 1036.12 NAME : No SMILES : CC(C)CCCC(C)C1CCC2C3CCC4CC(CCC=C(c5cc(Cl)c(OCc6ccc(cc6)C(O)=O)c(c5)C(O)=O)c7cc(Cl)c(OCc8ccc(cc8)C(O)=O)c(c7)C(O)=O)CCC4(C)C3CCC12C ACTIVITY : Active ----------------------------------------------------------------------------------------------------------------------- Result_ID: 21430 FORMULA : C18H32ClN3O8 WEIGHT : 453.91 NAME : methyl SMILES : CCCCCCCC(=O)OCC1OC(OC)C(NC(=O)N(CCCl)N=O)C(O)C1O ACTIVITY : Inactive ----------------------------------------------------------------------------------------------------------------------- Result_ID: 8440 FORMULA : C16H13ClN2O2S2 WEIGHT : 364.87 NAME : ethyl SMILES : CCOC(=O)Nc1ccc2nc(Sc3ccc(Cl)cc3)sc2c1 ACTIVITY : Inactive ----------------------------------------------------------------------------------------------------------------------- Result_ID: 42656 FORMULA : C22H37N3O5 WEIGHT : 423.55 NAME : 1-(1-hydroxy-2-undecylhexahydro-2H-furo[3,2-d][1,3]oxazin-6-yl)-5-methyl-2,4(1H,3H)-pyrimidinedione SMILES : CCCCCCCCCCCC1OCC2OC(CC2N1O)N3C=C(C)C(=O)NC3=O ACTIVITY : Inactive ----------------------------------------------------------------------------------------------------------------------- Result_ID: 1306 FORMULA : C20H21BrN2O5S2 WEIGHT : 513.43 NAME : S-(2-((4-((acetylamino)sulfonyl)anilino)carbonyl)phenyl) SMILES : CC(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2SC(=O)CCCCBr)cc1 ACTIVITY : Active ----------------------------------------------------------------------------------------------------------------------- Result_ID: 18692 FORMULA : C26H28N2O6 WEIGHT : 464.51 NAME : No SMILES : COc1ccccc1OCC(COC(=O)Nc2ccc(C)cc2)OC(=O)Nc3ccc(C)cc3 ACTIVITY : Inactive ----------------------------------------------------------------------------------------------------------------------- Result_ID: 885 FORMULA : C24H38BrN5O5 WEIGHT : 556.49 NAME : No SMILES : CCCCCCCCCCCCC(Br)C(=O)OCC1OC(CC1N=[N+]=[N-])N2C=C(C)C(=O)NC2=O ACTIVITY : Active ----------------------------------------------------------------------------------------------------------------------- Result_ID: 715 FORMULA : C26H22N4O6S4 WEIGHT : 614.74 NAME : No SMILES : NS(=O)(=O)c1ccc(NC(=O)c2ccccc2SSc3ccccc3C(=O)Nc4ccc(cc4)S(N)(=O)=O)cc1 ACTIVITY : Active ----------------------------------------------------------------------------------------------------------------------- Result_ID: 16734 FORMULA : C24H31NO3 WEIGHT : 381.51 NAME : 2-hydroxy-8-methyl-4-undecyl-3H-phenoxazin-3-one SMILES : CCCCCCCCCCCC1=C2Oc3ccc(C)cc3N=C2C=C(O)C1=O ACTIVITY : Inactive ----------------------------------------------------------------------------------------------------------------------- Result_ID: 12003 FORMULA : C22H24F3NO3 WEIGHT : 407.43 NAME : 2-hydroxy-5-octanoyl-N-(3-(trifluoromethyl)phenyl)benzamide SMILES : CCCCCCCC(=O)c1ccc(O)c(c1)C(=O)Nc2cccc(c2)C(F)(F)F ACTIVITY : Inactive ----------------------------------------------------------------------------------------------------------------------- Result_ID: 578 FORMULA : C42H68O16 WEIGHT : 828.98 NAME : 2-((2-O-acetylpentopyranosyl)oxy)-9-hydroxy-8-(5-(1-hydroxy-1-methylethyl)-2-methyltetrahydro-2-furanyl)-1,1,7a,10a-tetramethyltetradecahydro-2H-cyclopenta[1,2]phenanthro[4a,4b-b]oxiren-12-yl SMILES : CC(=O)OC1C(O)C(O)COC1OC2CCC34OC35CCC6(C)C(C(O)CC6(C)C5CC(OC7OC(CO)C(O)C(O)C7O)C4C2(C)C)C8(C)CCC(O8)C(C)(C)O ACTIVITY : Active ----------------------------------------------------------------------------------------------------------------------- Result_ID: 29814 FORMULA : C26H18ClN7O2 WEIGHT : 495.92 NAME : No SMILES : Clc1ccc(cc1)C=CC2=NNC3N4NC5(C(=O)NC4=NN3C2=O)c6ccccc6-c7ccccc57 ACTIVITY : Inactive ----------------------------------------------------------------------------------------------------------------------- Result_ID: 35657 FORMULA : C26H31N5O8 WEIGHT : 541.55 NAME : No SMILES : CCCCc1ccc(Nc2nc(O)c3ncn(C4OC(COC(C)=O)C(OC(C)=O)C4OC(C)=O)c3n2)cc1 ACTIVITY : Inactive ----------------------------------------------------------------------------------------------------------------------- Result_ID: 1455 FORMULA : C26H41N2O9P WEIGHT : 556.59 NAME : (5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2,5-dihydro-2-furanyl)methyl SMILES : CCCCCCC(=O)COP(=O)(OCC1OC(C=C1)N2C=C(C)C(=O)NC2=O)OCC(=O)CCCCCC ACTIVITY : Active ----------------------------------------------------------------------------------------------------------------------- Result_ID: 883 FORMULA : C22H34BrFN2O5 WEIGHT : 505.42 NAME : No SMILES : CC1=CN(C2CC(F)C(COC(=O)CCCCCCCCCCCBr)O2)C(=O)NC1=O ACTIVITY : Active ----------------------------------------------------------------------------------------------------------------------- Result_ID: 26211 FORMULA : C21H33BrN2O6 WEIGHT : 489.4 NAME : No SMILES : CC1=CN(C2CC(O)C(COC(=O)CCCCCCCCCCBr)O2)C(=O)NC1=O ACTIVITY : Inactive ----------------------------------------------------------------------------------------------------------------------- Result_ID: 1454 FORMULA : C22H33N2O9P WEIGHT : 500.48 NAME : bis(3,3-dimethyl-2-oxobutyl) SMILES : CC1=CN(C2OC(COP(=O)(OCC(=O)C(C)(C)C)OCC(=O)C(C)(C)C)C=C2)C(=O)NC1=O ACTIVITY : Active ----------------------------------------------------------------------------------------------------------------------- Result_ID: 890 FORMULA : C26H42N5O9P WEIGHT : 599.61 NAME : No SMILES : CCCCCCC(=O)COP(=O)(OCC1OC(CC1N=[N+]=[N-])N2C=C(C)C(=O)NC2=O)OCC(=O)CCCCCC ACTIVITY : Active