smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CN1CCCc2cc(CNC(=O)Cn3ccc(=O)n(C)c3=O)ccc21 69959921 BRXRZIUOQKRSBO-UHFFFAOYSA-N 342.399 0.246 10 20 ECCD CN(C[C@@H](O)C1CC1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291626 GECLXNCUIOYOPU-QGZVFWFLSA-N 343.427 0.908 10 20 ECCD CN(C)c1ccc([C@@H](N)CNS(=O)(=O)C[C@@H]2CCOC2)cc1 842786081 YXDMVYBWCHEUPX-DOMZBBRYSA-N 327.450 0.708 10 20 ECCD COc1ccc(N2CCN(C(=O)CN[C@H]3COC[C@H]3C)CC2)cc1 932502016 RAMUUMUWAFABGN-PBHICJAKSA-N 333.432 0.968 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CC(NS(C)(=O)=O)C2)cc1 863502339 XPYDSOMDLIJVDZ-UHFFFAOYSA-N 326.422 0.196 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN(CCO)C3CC3)CC2)cc1 779218776 HEPNKODJNIXQMX-GOSISDBHSA-N 349.475 0.635 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CCN(C)C3=O)CC2)cc1F 773271900 FFTXAHBAEJATPM-CYBMUJFWSA-N 335.379 0.961 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C[C@@H]3CCC(=O)NC3)cc2)CC1 881853388 UQORQZQQLICSLI-INIZCTEOSA-N 344.459 0.971 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCn1ccnn1 787622680 CVBSVFPLAHMZIM-UHFFFAOYSA-N 345.403 0.936 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCn2cccn2)cc1F 793743729 GHFBINSHQMTEDG-UHFFFAOYSA-N 333.367 0.521 10 20 ECCD COc1ccc(CNS(=O)(=O)N(C)C2CCOCC2)c(O)c1 795357045 KQKGIQGEFCSXEF-UHFFFAOYSA-N 330.406 0.846 10 20 ECCD O=C1CCC[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)N1 799564071 SMKPIGJNJMUVRN-CQSZACIVSA-N 335.379 0.947 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@H]3CCNC3=O)CC2)n1 1089855382 IVFFEUIEPNZHKD-CQSZACIVSA-N 329.404 0.564 10 20 ECCD CN1CCN(c2ccc(CNC[C@@]3(O)CCN(C)C3)cc2F)CC1 1320222092 WXNUQNIGCMBWMH-SFHVURJKSA-N 336.455 0.734 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@H](CC(N)=O)C2)c1 1329412491 JLLVKEDDBJQXFM-VIFPVBQESA-N 341.389 0.101 10 20 ECCD COC(=O)N1CCC[C@H](NC(=O)C(=O)N(C)Cc2ccccc2O)C1 1345549957 ZWGYFKKCQTYTMM-ZDUSSCGKSA-N 349.387 0.698 10 20 ECCD COC(=O)CCN(CC(=O)O)Cc1ccc(OC)c(OC)c1O 1574061979 YWCLNZGCSHAGSW-UHFFFAOYSA-N 327.333 0.859 10 20 ECCD CN(C)c1ccc(CNC(=O)NCC(=O)N2CCOCC2)cc1F 179780271 IGPHTDQHKFGSKA-UHFFFAOYSA-N 338.383 0.550 10 20 ECCD CNC(=O)NC(=O)CCN(C)Cc1ccc(N2CCOCC2)cc1 73984878 NRLKBJQGENKDGM-UHFFFAOYSA-N 334.420 0.801 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(c2cn[nH]c2)C1 373482035 QRQWJMSGHKMBSW-CMPLNLGQSA-N 344.371 0.921 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@H](CO)C1 297798828 KCKHXAZVDMFUAF-HNNXBMFYSA-N 333.432 0.942 10 20 ECCD CC(=O)N[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 817274481 LUQLITJROLYGST-AWEZNQCLSA-N 332.404 0.106 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)CN3CCOCC3)C2)cc1 819585045 BEVBXMLVWWZVAR-OAHLLOKOSA-N 333.432 0.970 10 20 ECCD Cn1cc(/C=C\C(=O)N2CCc3ccc(S(N)(=O)=O)cc32)cn1 735810613 MGSHHKYKKSUTEX-DJWKRKHSSA-N 332.385 0.670 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(F)CCNC3)cc2)CC1 832173681 UUWYUOUAMSWCJG-SFHVURJKSA-N 348.422 0.673 10 20 ECCD Nc1ccc(CCNC(=O)COCC(=O)NCc2cccnc2)cc1 844164375 BYSBYCVSOHZPNO-UHFFFAOYSA-N 342.399 0.656 10 20 ECCD COC(=O)[C@@H]1C[C@H](O)CN(Cc2ccc(N3CCOCC3)cc2)C1 843435568 VWUSSKFGDPOLDE-WBVHZDCISA-N 334.416 0.879 10 20 ECCD CC(=O)N1CCN(C(=O)CN2CCCc3cc(CN)ccc32)CC1 843349861 KULVAYYIVKIVFX-UHFFFAOYSA-N 330.432 0.589 10 20 ECCD O=C1C[C@H](CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CN1 927517164 JBJQLNNTVQQQQV-VIFPVBQESA-N 337.763 0.946 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(=O)n(C)cn1 873862323 KZZQVTNOROZYJZ-UHFFFAOYSA-N 342.399 0.889 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NC(=O)[C@@H]3CCOC3)C2)cc(OC)n1 973081288 NWEBJAGONAPKRS-RAIGVLPGSA-N 349.387 0.512 10 20 ECCD CN1C[C@H](C(=O)NCCC2=CCN(c3nccnc3F)CC2)NC1=O 1089855653 MZLGUQIRIYGXCJ-GFCCVEGCSA-N 348.382 0.282 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@H]3CCNC(=O)C3)CC2)n1 1089820549 FEVQVNWEJAAFBF-HNNXBMFYSA-N 343.431 0.954 10 20 ECCD CCC(=O)NCC(=O)NCCC1=CCN(c2cc(C)ncn2)CC1 1089822501 GUTGJALHOSQBBO-UHFFFAOYSA-N 331.420 0.954 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnns1 1323860180 PVIOSSWKUXOTTL-VIFPVBQESA-N 337.357 0.854 10 20 ECCD O=C(NCCC1=CCN(c2cnc(F)cn2)CC1)[C@H]1C[C@H]1C(=O)O 1601785029 WXIGPEXTZDFVBO-NWDGAFQWSA-N 334.351 0.979 10 20 ECCD CN(CCCNC(=O)c1ccc(N=NC(N)=O)cc1)CC(=O)N(C)C 1752126814 WHUAKCCDTMQTLG-UHFFFAOYSA-N 348.407 0.989 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)c3cnn(C)c3)nc12 81092416 VIKZOCUMMZAFHR-UHFFFAOYSA-N 330.348 0.982 10 20 ECCD CC[C@@H]1C(=O)NCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 271252913 JKKKSTXSOUBBLW-LLVKDONJSA-N 341.389 0.114 10 20 ECCD CN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@@H]1CCOC1 288722497 ZKJCNPIAPMDWGQ-MRXNPFEDSA-N 329.400 0.926 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[S@@](C)=O 804995645 SEDVMVJVBZQHLP-HSZRJFAPSA-N 339.461 0.596 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCc4nc[nH]c4C3)nc12 821271682 SHAKNJWLVPECDJ-UHFFFAOYSA-N 342.359 0.893 10 20 ECCD C[C@H](N)[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 841729980 LKPQNFPRRYHIOL-WMLDXEAASA-N 348.447 0.781 10 20 ECCD Cc1c(S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)cnn1C 842786337 XTVWKFXBGIYSDJ-CQSZACIVSA-N 337.449 0.773 10 20 ECCD COCCn1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)n1 754929706 RPPNAQCKHNFCQG-UHFFFAOYSA-N 332.360 0.832 10 20 ECCD COc1cc(O)c(CN2CCC[C@@H](NS(C)(=O)=O)C2)cc1OC 762176341 URFUFPQAMWLNRZ-GFCCVEGCSA-N 344.433 0.923 10 20 ECCD CNC(=O)CN1C[C@H]2C[C@H]1[C@H]2NC(=O)c1ccc(N=NC(N)=O)cc1 1037738768 MZARLLDVNGOPAC-OSMZGAPFSA-N 344.375 0.398 10 20 ECCD COc1ccc(O)c([C@@H](C)NS(=O)(=O)[C@H](C)C(=O)N(C)C)c1 774884025 GMMXLTHHXIPUMB-NXEZZACHSA-N 330.406 0.858 10 20 ECCD C[C@@H](C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1)NCC(N)=O 1146662478 GZRKLGQSMSTBOW-VHSXEESVSA-N 334.380 0.821 10 20 ECCD CN[C@@H](C)CCNC(=O)C(=O)NCCCSc1nccs1 1345165822 CQHRFYKVBFFURV-JTQLQIEISA-N 330.479 0.856 10 20 ECCD O=C(COc1cccc(-c2nn[nH]n2)c1)NCc1cc(O)ccc1O 1606575659 LHMPPMGUKUYDDC-UHFFFAOYSA-N 341.327 0.973 10 20 ECCD COCCN(C(=O)Cc1ccc(N)cc1)[C@@H]1CCS(=O)(=O)C1 314161902 SYEKNIXLHBZXRE-CQSZACIVSA-N 326.418 0.473 10 20 ECCD O=C(NCc1c(O)ccc2c1CCCC2)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1 816938702 HUMZJGVVKAUTRM-BRWVUGGUSA-N 333.384 0.300 10 20 ECCD C[C@@H]1CN(c2ccc(CNC(=O)[C@@H]3CC(=O)N3)cc2F)C[C@@H](C)O1 822688085 KGGSHCDHTMYNIX-GYSYKLTISA-N 335.379 0.944 10 20 ECCD CN1CCC(CNC(=O)c2cc(O)cs2)(N2CCOCC2)CC1 839807139 BTYUCGDRARUPAS-UHFFFAOYSA-N 339.461 0.980 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H]1[C@@H]2CNC[C@@H]21 851666631 IMJVJAHZJAYSKA-FVQHAEBGSA-N 330.432 0.665 10 20 ECCD COc1ccc(N2CCN(C(=O)C[C@@H](CN)OC)CC2)c(OC)c1 877227089 CAUBAIANOXYLHB-AWEZNQCLSA-N 337.420 0.716 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C[C@H]4C[C@@]4(CO)C3)CC2)cc1 782616224 KCRLPTAGEACPDN-BEFAXECRSA-N 345.443 0.658 10 20 ECCD C[C@@H]1CN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC(=O)N1 899098784 RVQZFSHQXWFQLT-CJNGLKHVSA-N 347.463 0.885 10 20 ECCD CN(C)C(=O)CCCOC(=O)c1cc(NS(C)(=O)=O)ccc1O 795352779 MLHPKFDUUUDHQQ-UHFFFAOYSA-N 344.389 0.789 10 20 ECCD COc1ccc(CNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)c(O)c1 794373022 DXBXWRAEXFYACQ-UHFFFAOYSA-N 333.300 0.787 10 20 ECCD COc1ccc(CNC(=O)[C@H]2COCCN2CC(F)F)c(O)c1 794376710 ARWQCKPLCQGUBY-GFCCVEGCSA-N 330.331 0.983 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)c1ncnn1C 1323723358 IXTAFMBFJKLTTI-LBPRGKRZSA-N 344.419 0.683 10 20 ECCD Cn1nncc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1325891841 FJYRMMUYLVHAQR-UHFFFAOYSA-N 326.360 0.446 10 20 ECCD COc1ccc(N2CCN(C(=O)CN(C)C[C@@H](C)C(=O)O)CC2)cc1 1610339264 NNJUDMNFYBQPGU-CQSZACIVSA-N 349.431 0.996 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@](O)(C(=O)O)C1 1598518989 BOJJVAZVUAMAEG-QGZVFWFLSA-N 335.404 0.232 10 20 ECCD COc1ccc(N2CCN(C(=O)CN(C)CCC(=O)O)CC2)cc1 269280904 FRIWEWOUGBOOOQ-UHFFFAOYSA-N 335.404 0.750 10 20 ECCD Cc1nc2n(n1)CCN(CC(=O)NCc1ccc(N(C)C)cc1)C2 364648518 IMKLWPGYWMFHGZ-UHFFFAOYSA-N 328.420 0.785 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)NC[C@H](C)O)CC2)cc1 277763195 OYJOCGQNROMNLE-AWEZNQCLSA-N 336.436 0.497 10 20 ECCD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)C1COC1 276859460 GETUXRZOTZKWNE-UHFFFAOYSA-N 330.381 0.481 10 20 ECCD CCS(=O)(=O)N1CCC[C@H](C(=O)NCc2ccc(O)c(O)c2)C1 272332660 MYODQCPELHACLO-LBPRGKRZSA-N 342.417 0.776 10 20 ECCD CNS(=O)(=O)NC1CCN(Cc2ccc(N(C)C)cc2)CC1 283888372 FVYUDGNZGURYIU-UHFFFAOYSA-N 326.466 0.771 10 20 ECCD CCn1cc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)nn1 829295901 BEPUBXGQACOQEJ-UHFFFAOYSA-N 328.420 0.980 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCN2CCCC2=O)c1 846458909 HSHSVJYGBDVGMS-UHFFFAOYSA-N 341.389 0.116 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCNC1CC1 842227087 YGYLOGKRZKOYSN-UHFFFAOYSA-N 332.448 0.969 10 20 ECCD COc1ccc(O)c(CNS(=O)(=O)N(C)C2CCOCC2)c1 751415182 MGQPPZYNLZNSTB-UHFFFAOYSA-N 330.406 0.846 10 20 ECCD C[C@H]1OC(=O)N[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856213207 YHIPDESLDGOPEV-IAQYHMDHSA-N 333.388 0.761 10 20 ECCD C[C@H](C(N)=O)N1CC[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1029013810 IHJDPWNDTBPRQN-GHMZBOCLSA-N 346.391 0.775 10 20 ECCD O=C(CN1C(=O)CCC1=O)N1CCN(Cc2cc(F)ccc2O)CC1 778999252 BOESTOSNRNNJIJ-UHFFFAOYSA-N 349.362 0.325 10 20 ECCD C[C@@H]1C(=O)NCCN1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 899100987 GARHWEJUZSDZHF-CZUORRHYSA-N 347.463 0.885 10 20 ECCD NC(=O)NCCC(=O)NCCC1=CCN(c2cccc(F)n2)CC1 1089836455 VPIDZXOVTGFOGF-UHFFFAOYSA-N 335.383 0.922 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cn[nH]c3)C2)cc(OC)n1 996369666 YKALFPBXPYSVOQ-UHFFFAOYSA-N 331.332 0.076 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCN[C@@H]3C)cc2)CC1 1328206153 UXQQJMZCTVXMCJ-KDOFPFPSSA-N 344.459 0.969 10 20 ECCD COC(=O)N1CC(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 1324899301 MMKLDLIBMCQHIR-UHFFFAOYSA-N 348.403 0.244 10 20 ECCD CN1C[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1=O 1346194181 IQHBQDLMGHFQOR-CQSZACIVSA-N 342.399 0.026 10 20 ECCD C[C@H]1CN2CCN1C[C@H]2C(=O)N1CCOc2cc(N(C)C)ccc21 1347952937 YSRXXAPVBWDZEB-BBRMVZONSA-N 330.432 0.866 10 20 ECCD CN(C)c1ccc(CNc2nc3c(c(=O)[nH]c(=O)n3C)n2C)cc1F 58545376 RTDRJSFFCRCINI-UHFFFAOYSA-N 346.366 0.778 10 20 ECCD O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCc1ccc(O)c(O)c1 269138554 YZZZSJULVNSKBW-VXGBXAGGSA-N 332.356 0.889 10 20 ECCD COC(=O)C[C@H]1C(=O)NCCN1Cc1cc(Cl)cc(OC)c1O 273726037 JGJYMAMHCIPMSZ-NSHDSACASA-N 342.779 0.918 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnn(C)n1 285470903 CGKGLEDROKPBDE-UHFFFAOYSA-N 338.751 0.990 10 20 ECCD CSc1nc2nc(C)c(CC(=O)OCC(=O)C(C)=O)c(C)n2n1 808491503 OOPSMPVNIBHDDY-UHFFFAOYSA-N 336.373 0.707 10 20 ECCD COC(=O)c1cn(CCNC(=O)NCc2cc(OC)ccc2O)nn1 806809512 AWLCNDFFWBVFQC-UHFFFAOYSA-N 349.347 0.278 10 20 ECCD O=C(N[C@H]1CCOC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 804698957 XSZUCKKPDVNYOY-GJZGRUSLSA-N 348.399 0.805 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC(CO)CC3)nc12 298756047 NTJHQGQYFGDKOL-UHFFFAOYSA-N 334.376 0.816 10 20 ECCD COCCN(C)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803298808 FAKJGSIMBLLEBB-CQSZACIVSA-N 349.431 0.805 10 20 ECCD COc1cc(Cl)cc(CN[C@@H]2CS(=O)(=O)C[C@H]2OC)c1O 826985637 JEXXHCNQKODCQB-ZYHUDNBSSA-N 335.809 0.956 10 20 ECCD COc1ccc(N2CCN(C(=O)CN(C)C3CC(N)C3)CC2)cc1 844226098 ZYPFTUXBCJRAGY-UHFFFAOYSA-N 332.448 0.765 10 20 ECCD COC[C@H]1CN(C(=O)C(=O)NCCc2ccc(N)cc2)C[C@@H](C)O1 842234731 AYOFPMMIFGAHNN-IUODEOHRSA-N 335.404 0.190 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3[C@H]4CNC[C@H]43)cc2)C1 844175604 JSGPSDDEPJMQRE-SIXLDLHFSA-N 342.443 0.470 10 20 ECCD CCn1cc(CN2CC(NC(=O)c3cc(OC)nc(OC)c3)C2)nn1 1030614866 TXOWHTNGBZGEIZ-UHFFFAOYSA-N 346.391 0.324 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)[C@H]2CCc3nnn(C)c3C2)cc1 876506115 FFEHORGCDNNVMD-ZFWWWQNUSA-N 342.447 0.802 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCCCN1CCOCC1 1116976726 FHCMPZXYCDQWSA-UHFFFAOYSA-N 335.404 0.189 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNC[C@H]2CCCS2(=O)=O)c1O 775036337 FDQLOURURVHPQR-SNVBAGLBSA-N 330.362 0.976 10 20 ECCD COc1ccc(-n2nnnc2CN2C[C@H]3[C@H](CNC(C)=O)[C@H]3C2)cc1 977713542 PVEBIBUYSMOLGB-PHZGNYQRSA-N 342.403 0.485 10 20 ECCD COc1ccc(CNC2CC(N(C)C(=O)Cn3ncnn3)C2)cc1C 998773444 OHVOSXWGTQIARS-UHFFFAOYSA-N 344.419 0.769 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)CC3(O)CCC3)C2)cc(OC)n1 996367876 HHOUPHBBXMKFNG-UHFFFAOYSA-N 349.387 0.345 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@@H]3C[C@]3(CO)C2)c1 1320562619 SAOZRMAWDOSOCB-LKFCYVNXSA-N 326.374 0.218 10 20 ECCD CO[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 1322172920 YELDZSFDNVNWHY-OAHLLOKOSA-N 331.416 0.933 10 20 ECCD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(OC)cc1 1320008749 DHHIGGJSUKQDQB-GFCCVEGCSA-N 326.418 0.825 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)NCc2nnn(C)n2)N(C)C)cc1 1352054650 NTMHNFXDGGLAJU-AWEZNQCLSA-N 346.439 0.378 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@H]3C(=O)O)cc2)C1 1601144280 PFQJOGTWVNHWER-AEGPPILISA-N 345.399 0.725 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)c2coc(-c3nn[nH]n3)c2)cc1 1591031154 AQZMKEQAJYDNCP-ZDUSSCGKSA-N 341.375 0.956 10 20 ECCD O=C(NCC(=O)N1CCCC1)NCc1ccc(N2CCOCC2)cc1 54786191 BUAHETCCEPAKIB-UHFFFAOYSA-N 346.431 0.945 10 20 ECCD COC(=O)c1ncn(CN(C)Cc2ccc(N3CCOCC3)cc2)n1 66349886 TUIHMIUXCGKJAZ-UHFFFAOYSA-N 345.403 0.991 10 20 ECCD CN(Cc1cn(C)nn1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1261691181 HETOFXPVGGDBRE-UHFFFAOYSA-N 348.382 0.295 10 20 ECCD CS(=O)(=O)N1CCC[C@@H]1CNC(=O)c1c(F)ccc(O)c1O 276631053 STZAFBGQLQUWRR-MRVPVSSYSA-N 332.353 0.391 10 20 ECCD C[C@H]1COCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 371111429 VSXHZWXADMOGMI-SNVBAGLBSA-N 328.390 0.872 10 20 ECCD CNC(=O)CCN(C)C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 807672718 GQLDFKGVAJBDEZ-LBPRGKRZSA-N 334.420 0.524 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CC[C@H]1C(N)=O 816825847 OKDRRSZGGUGDLQ-HZPDHXFCSA-N 331.416 0.993 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)C(C)(C)NS(C)(=O)=O)c1 743337296 SRQOQRUKOUUHRG-VIFPVBQESA-N 330.406 0.906 10 20 ECCD CNCCCNC(=O)C(=O)N(C)CCN(C)c1ccc(OC)cc1 846342678 FRLUGQFJJXJKBL-UHFFFAOYSA-N 336.436 0.316 10 20 ECCD C[C@@H](C(=O)N1CCCC1)N1CCN(C(=O)c2cccc(O)c2O)CC1 776668380 BAZOTQHVBNFJTL-ZDUSSCGKSA-N 347.415 0.867 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NCC[S@](C)=O)cc2)CC1 883453803 FDKLRPWQVRTYIV-QHCPKHFHSA-N 338.477 0.616 10 20 ECCD O=S(=O)(CCNCc1cc2c(cc1O)OCO2)N1CCCC1 897832256 MKYJTTJKNCJUJZ-UHFFFAOYSA-N 328.390 0.636 10 20 ECCD CNS(=O)(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 795805823 KGSXGIKOUDFMFX-PHIMTYICSA-N 331.413 0.993 10 20 ECCD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccco2)cc1 797431156 IPDKIJRIUPMPNL-UHFFFAOYSA-N 331.375 0.957 10 20 ECCD COc1ccc(-n2nnnc2CN2C[C@@H]3CCN(C(C)=O)[C@@H]3C2)cc1 1075467717 YCLQOWTVTAPVBH-XJKSGUPXSA-N 342.403 0.724 10 20 ECCD O=C(CCn1ccnn1)NCCC1=CCN(c2cnc(F)cn2)CC1 1089823328 DBGIHJCHZHNJDV-UHFFFAOYSA-N 345.382 0.940 10 20 ECCD NC(=O)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1086886264 USCUTRFIKZXOBM-GXFFZTMASA-N 346.391 0.822 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)C[C@H]3CCOC3)C2)cc(OC)n1 996369201 SNPPLVQNKOJEAO-LLVKDONJSA-N 349.387 0.466 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2CN(C(=O)c3nc[nH]n3)C2)cc1 994370971 BCOIREWUPYIZRP-UHFFFAOYSA-N 342.319 0.222 10 20 ECCD CN1CCN(c2ccc(CNCCN3CCOCC3)cc2F)CC1 1318367958 OPKHASSAKPCBCS-UHFFFAOYSA-N 336.455 0.999 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCC(=O)N2CCCCC2)cc1 1321419412 GWRRWIRKTDIOHV-UHFFFAOYSA-N 346.431 0.498 10 20 ECCD C[C@@H](NC(=O)C(=O)NC[C@@H]1COCCO1)c1ccc(N(C)C)cc1 1323389826 CMPCIASMEUJVOG-IUODEOHRSA-N 335.404 0.461 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCOCC(F)F)cc1F 1257530624 WQXNQQGCOCLBEA-UHFFFAOYSA-N 347.337 0.906 10 20 ECCD Cc1nc2c(n1CCO)CC[C@@H](NC(=O)Cc1ccc(N)cc1)C2 1354168523 KEUIYTMZDPRQNC-OAHLLOKOSA-N 328.416 0.982 10 20 ECCD C[C@@H](NC(=O)[C@H]1CNCCN1C)c1ccc(N2CCOCC2)cc1 1353518233 NXLQFOZAADMAEI-RHSMWYFYSA-N 332.448 0.604 10 20 ECCD O=C(O)c1cn([C@@H]2CCN(C(=O)Cc3ccc(O)c(O)c3)C2)nn1 1602496591 RVJONODGSULLCK-SNVBAGLBSA-N 332.316 0.404 10 20 ECCD COCCNC(=O)C1(N[C@H](C)c2cccc(-c3nn[nH]n3)c2O)CC1 1605105893 GGRHRTRXIZMAHR-SNVBAGLBSA-N 346.391 0.518 10 20 ECCD NC(=O)CN1CCN(Cc2cc(Br)ccc2O)CC1 122789350 JLRKCBANWCJUKQ-UHFFFAOYSA-N 328.210 0.758 10 20 ECCD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cn[nH]c2)cc1 37791389 WZWCIBDHWSPFBQ-UHFFFAOYSA-N 330.391 0.972 10 20 ECCD CS[C@@H](CO)[C@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 269115820 CYLKZPDDYJYSNN-UFBFGSQYSA-N 348.446 0.606 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H](C)[C@@H](C)N)CC2)cc1 276948883 DLVZCIOSSBIPMA-HUUCEWRRSA-N 334.464 0.917 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CC[C@@H](S(C)(=O)=O)C2)c1O 282896489 ZVJHOQKTUBTNGZ-SNVBAGLBSA-N 330.362 0.928 10 20 ECCD CNS(=O)(=O)c1cc(NS(=O)(=O)C[C@H](C)OC)ccc1O 800842253 SHASBBXKLWJXNQ-QMMMGPOBSA-N 338.407 0.077 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N(C)C[C@@H](C)O 817860900 YSWLTBXWYVONPX-ZIAGYGMSSA-N 335.448 0.947 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NC[C@H](N)C2CC2)cc1 846345760 YKOUPUOAEMHSQI-INIZCTEOSA-N 348.447 0.443 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC[C@H]1C(=O)O 861712686 RQYHDLNEOBLDOQ-SWLSCSKDSA-N 347.415 0.938 10 20 ECCD O=C1[C@H]2[C@H](O)CCCN2C(=O)N1Cc1ccc(N2CCOCC2)cc1 761070531 VLXDPDMPRZMTOA-HZPDHXFCSA-N 345.399 0.811 10 20 ECCD NC(=O)CC(=O)N1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 950680572 HMMPWAJATWPVFG-NSHDSACASA-N 346.347 0.055 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1cc(COCCN)nn1 881083747 HBFXOXWEUKNLTQ-UHFFFAOYSA-N 346.435 0.478 10 20 ECCD Cc1nnc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)s1 785445763 YCMNJWSOYREXIN-UHFFFAOYSA-N 333.417 0.845 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@H]3CN(C)C(=O)N3)CC2)nn1 1089855060 DXPGQYUACKTSEZ-CQSZACIVSA-N 344.419 0.451 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2C[C@@H](O)C[C@@H](C(=O)O)C2)c1O 1607051168 XMCLSAUCRYJJQG-ZJUUUORDSA-N 326.305 0.576 10 20 ECCD CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](N)CC(N)=O 269655882 FJVCZEJFGMXFDZ-JTQLQIEISA-N 344.209 0.706 10 20 ECCD CNC(=O)[C@@H]1CCCCN1CC(=O)NCc1ccc(N(C)C)cc1 298080522 KBGFTOAWCHBXDN-INIZCTEOSA-N 332.448 0.969 10 20 ECCD COC(=O)Cn1cc(CN2CCOc3cc(N(C)C)ccc32)nn1 294937774 CLSGVHWBJUYWEU-UHFFFAOYSA-N 331.376 0.916 10 20 ECCD CN(C[C@@H]1CCCN1C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 817676315 DKBXFRHLQHLHQZ-LBPRGKRZSA-N 341.433 0.930 10 20 ECCD COc1cccc(CNC(=O)[C@@H]2CCCN2S(C)(=O)=O)c1O 729858808 DKJZJRIBGNOBOU-NSHDSACASA-N 328.390 0.441 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC(=O)O)CC2)cc1 820841099 IAJLLSMHWYWXGM-VOTSOKGWSA-N 347.371 0.101 10 20 ECCD COc1ccc(N2CCN(C(=O)CONC(=O)N(C)C)CC2)cc1 902608305 TZWSBXXECNKQNP-UHFFFAOYSA-N 336.392 0.547 10 20 ECCD C[C@H](C(=O)N(C)CC(=O)NCc1ccc(O)c(O)c1)n1cccn1 778922979 MWVGPWXNHPQGLK-LLVKDONJSA-N 332.360 0.630 10 20 ECCD CCN1C[C@H](C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CC1=O 881849767 IHXYGYGVRWZYTA-MRXNPFEDSA-N 344.459 0.923 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCCOCC1 788311755 ZAEQJBPJOWXOLG-UHFFFAOYSA-N 347.415 0.388 10 20 ECCD CN(CCCF)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 897475555 WKQRGGKFQIJKBI-UHFFFAOYSA-N 337.395 0.957 10 20 ECCD CN(Cc1nncn1C)C(=O)NCc1ccc(N2CCOCC2)cc1 1323087959 GWFRXUWRSUCCKX-UHFFFAOYSA-N 344.419 0.993 10 20 ECCD CCc1nncn1CCNC(=O)C(=O)N(C)Cc1ccccc1O 1326869541 ITEDELXUPVVXJY-UHFFFAOYSA-N 331.376 0.321 10 20 ECCD CCN1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1=O 1261925781 ABOYVYIRBFANSA-IUODEOHRSA-N 346.431 0.667 10 20 ECCD C[C@@H](NC(=O)[C@@H](C)n1cnc(-c2nn[nH]n2)n1)c1ccccc1O 1573741575 DCWHHPLOCZNKHV-RKDXNWHRSA-N 328.336 0.602 10 20 ECCD CN1C[C@H]2CN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)C[C@H]2C1 278968555 CBKSIWNKYYKEBF-PHIMTYICSA-N 339.417 0.397 10 20 ECCD CS(=O)(=O)CCNCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 818967896 DPZOCWKOQDJUIC-AWEZNQCLSA-N 339.461 0.523 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCN(C)C(=O)C1 839271683 KFJXGEHYBQOWDC-UHFFFAOYSA-N 333.388 0.431 10 20 ECCD Cc1nnc(N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)n1C 911908816 FHCQDZFSNULERB-XQRVVYSFSA-N 343.387 0.897 10 20 ECCD COc1ccc(N2CCN(CCCNC(=O)C3(C)CNC3)CC2)cc1 844190603 CLCYJOJQQRUPIO-UHFFFAOYSA-N 346.475 0.933 10 20 ECCD CCn1[nH]nnc1=NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 931679830 ZHTOZDXOMCLWJH-AWEZNQCLSA-N 346.439 0.605 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)CO)CC2)cc1 778233747 HUUHFDOXAUNWOM-DANTVBBOSA-N 347.415 0.397 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N3C[C@H](O)C[C@H]3CO)cc2)CC1 889665783 XPWJKVKIXMLBAP-DLBZAZTESA-N 348.447 0.076 10 20 ECCD Cc1ccc(C(=O)N2CCN(c3nc(N)ns3)CC2)c(O)c1O 780965963 UDOAHODQFVVYBB-UHFFFAOYSA-N 335.389 0.802 10 20 ECCD COCc1cc(N2CC=C(CCNC(=O)CC(N)=O)CC2)ncn1 1089822303 ZPAWQBGFOBMOEL-UHFFFAOYSA-N 333.392 0.141 10 20 ECCD CCOC(=O)[C@H](N)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1343165936 MNIMTBXHNYGEPU-HUUCEWRRSA-N 336.436 0.362 10 20 ECCD CCOc1cccc(CNCCn2cnc(-c3nn[nH]n3)n2)c1O 1604465921 WNQFCCDXCVQBAY-UHFFFAOYSA-N 330.352 0.352 10 20 ECCD C[C@@H]1SC[C@H](C(=O)NCCC(=O)O)N1C(=O)c1cc(O)cs1 1604838032 GTIJDOVUVTZAPX-IONNQARKSA-N 344.414 0.948 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCC[C@H](O)[C@H]2C(=O)O)c1O 1610278611 UPPYAOGCNQVZCS-QWRGUYRKSA-N 326.305 0.719 10 20 ECCD O=C(NC[C@H]1CC2(CCNCC2)C(=O)O1)c1c(F)ccc(O)c1O 1580644390 GPXDWZNTPOAKDM-SECBINFHSA-N 338.335 0.652 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1C[C@H]2C[C@@H](C(=O)O)C[C@@H]12 1598530420 GCJURHGXZLKPEY-SYQHCUMBSA-N 346.383 0.966 10 20 ECCD CS(=O)(=O)CCC(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1599749593 SUEUJIONCZAEMI-UHFFFAOYSA-N 349.792 0.894 10 20 ECCD O=C(O)[C@H](Cc1cnc[nH]1)NCc1ccc(N2CC[C@@H](O)C2)cc1 1777589295 VWLNQKNCBZESOJ-CVEARBPZSA-N 330.388 0.766 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)CCC(=O)NC)nc12 263902918 DHXSONONRABJDS-UHFFFAOYSA-N 335.364 0.180 10 20 ECCD CCN(CCNC(=O)C(=O)NCc1ccc(N(C)C)cc1)C1CC1 283304405 BAEDYRRFQNQJMV-UHFFFAOYSA-N 332.448 0.969 10 20 ECCD CN(C[C@@H](O)C1CC1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803689429 RHMHQKQAFIUNAG-QGZVFWFLSA-N 345.443 0.915 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H]2NCC[C@H]2C1 817917317 AXNAOCMSQTYWAO-RDJZCZTQSA-N 344.459 0.921 10 20 ECCD COCC1CN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 905972740 SSFHUVKKIXGUJN-SFHVURJKSA-N 349.475 0.756 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@@H]3C(=O)O)cc2)C1 739160856 PFQJOGTWVNHWER-SNPRPXQTSA-N 345.399 0.725 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@H]3CCOC(=O)N3)cc2)CC1 918847369 ZZPRLJQOTVIPCV-OAHLLOKOSA-N 332.404 0.553 10 20 ECCD COCCNC(=N)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 849017165 HNGGDPHIMKHXKI-AWEZNQCLSA-N 333.436 0.649 10 20 ECCD CN1CCN(c2ccc(CN(C)CCN3CCNCC3)cc2)CC1 843052466 LVIGRCKXPIGGAK-UHFFFAOYSA-N 331.508 0.775 10 20 ECCD CCNCCNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 841751361 XASUOKXVSXOQKO-UHFFFAOYSA-N 349.479 0.726 10 20 ECCD C[C@H](CN)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 842254435 IWXJFZFFSIJPLH-OCCSQVGLSA-N 335.404 0.363 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N[C@@H](C)CCN 842069866 FVJQUBWIFXNRKF-KBPBESRZSA-N 334.464 0.962 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)[C@@H]2CCCS2(=O)=O)cc1 848393403 BMGAGHKMWPZMLA-KGLIPLIRSA-N 325.434 0.446 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@@H](N)C3)CC2)cc1 923278217 RAUIGHHFPLOOJT-NVXWUHKLSA-N 334.464 0.211 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)CC[C@@H]1C(=O)O 863749145 WYUVNIGNBXYVHG-AAEUAGOBSA-N 334.372 0.920 10 20 ECCD CO[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 1117137338 YELDZSFDNVNWHY-HNNXBMFYSA-N 331.416 0.933 10 20 ECCD CCC(=O)N1CC2(C[C@@H](NC(=O)c3cc(OC)nc(OC)c3)CO2)C1 965753083 HDAOXDUOXDDLQT-GFCCVEGCSA-N 349.387 0.609 10 20 ECCD CCS(=O)(=O)N1CCC(CNC(=O)c2cccc(O)c2O)CC1 790932813 RFPGDFULTFADGA-UHFFFAOYSA-N 342.417 0.889 10 20 ECCD COc1ccc(CNC(=O)CN(C)[C@H]2CCS(=O)(=O)C2)c(O)c1 794381660 QPPVZLOTTIYVEU-LBPRGKRZSA-N 342.417 0.136 10 20 ECCD Cc1nc(Cl)cc(N2CC=C(CCNC(=O)CC(N)=O)CC2)n1 1089821926 DLOZOLBGTHCNOB-UHFFFAOYSA-N 337.811 0.957 10 20 ECCD COC(=O)[C@H]1C[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 1328251765 USTMIQISVWEGFF-UBHSHLNASA-N 347.415 0.998 10 20 ECCD COc1cc(C)cc(CNCC2(O)CCS(=O)(=O)CC2)c1O 1333705723 SOLIIUNVXVEREQ-UHFFFAOYSA-N 329.418 0.739 10 20 ECCD NS(=O)(=O)C1CN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])C1 1601193785 IAIKGJBBIMOZSB-DUXPYHPUSA-N 327.318 0.170 10 20 ECCD COc1ccc(CNS(=O)(=O)c2cccnc2C(=O)O)c(O)c1 1599573861 PNXDWLKUQZBAFE-UHFFFAOYSA-N 338.341 0.973 10 20 ECCD CC(=O)NCCCNC(=O)NCc1ccc(N2CCOCC2)cc1 54786268 UWAABXMVKCXSOH-UHFFFAOYSA-N 334.420 0.849 10 20 ECCD CN(Cc1ccccc1O)C(=O)C1=CC=CN2CCS(=O)(=O)N=C12 53915209 RXCZNCCMVGLINX-UHFFFAOYSA-N 347.396 0.848 10 20 ECCD NCCn1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)nn1 327023792 JCWHZKBWRNABQM-UHFFFAOYSA-N 348.382 0.143 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC(O)(C3CC3)C2)c1 365029497 YPVFCEIFGMAHOO-UHFFFAOYSA-N 326.374 0.361 10 20 ECCD COC(=O)[C@]1(NCC(=O)N(C)Cc2ccc(N(C)C)cc2)CCOC1 271257627 TYWODBYDYXLGPB-SFHVURJKSA-N 349.431 0.633 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ncn(C)n2)cc1 293247255 YXSFJRGIZSCPAM-UHFFFAOYSA-N 330.392 0.916 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cn(C)c(=O)n(C)c1=O 735040156 YQQPLGXQMARDJY-UHFFFAOYSA-N 344.415 0.812 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N2CC(=O)N[C@@H]3CCCC[C@H]32)cc1 842235884 KPPOZTRQTXUERW-HUUCEWRRSA-N 344.415 0.197 10 20 ECCD C[C@@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CN1C(=O)C(N)=O 1013985124 ZBIUFCROQOIKCT-LDYMZIIASA-N 346.347 0.054 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@]1(O)CCOC1 840694809 XOVMSVHKMJIMRL-QGZVFWFLSA-N 336.388 0.406 10 20 ECCD C[C@H](NC(=O)C(=O)N[C@H]1CCNC1)c1ccc(N2CCOCC2)cc1 851685828 SQPOOHRXZWBROS-ZFWWWQNUSA-N 346.431 0.179 10 20 ECCD COc1cc(N2CCN(Cc3nnnn3C)CC2)cc(OC)c1OC 759886930 RGDIDGZEDQMCPO-UHFFFAOYSA-N 348.407 0.558 10 20 ECCD COC(=O)[C@](C)(CO)NCc1ccc(N2CCOCC2)c(F)c1 894974390 CWWGQZIBZOLGLJ-INIZCTEOSA-N 326.368 0.676 10 20 ECCD CCn1ncc(CNCCNC(=O)c2ccc(N=NC(N)=O)cc2)n1 1153047417 DCXKZCBLTXHVHZ-UHFFFAOYSA-N 344.379 0.980 10 20 ECCD COCCCN1C[C@H](O)[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1221127769 DLAWZPGWDFEWSH-KGLIPLIRSA-N 349.391 0.660 10 20 ECCD CC1(C)CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCN1 1328745890 JAVYCKHLCMMEKE-UHFFFAOYSA-N 342.443 0.889 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1C[C@H]2C[C@]2(CO)C1 1346592433 YUTOZODZOAMFJA-DNVCBOLYSA-N 341.411 0.520 10 20 ECCD Cc1c(CNC(=O)C(=O)NC[C@@H]2CCNC2)n(C)c2ccccc12 419705684 JIEQVIHFHSSSMC-CYBMUJFWSA-N 328.416 0.829 10 20 ECCD CNS(=O)(=O)CC(=O)NCc1cccc(Br)c1O 277619530 WDRAVRNQNVGMLE-UHFFFAOYSA-N 337.195 0.320 10 20 ECCD O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NCc1ccc(O)c(O)c1 272267189 COWWXLUTEVLBQM-DPDCMNJDSA-N 342.351 0.521 10 20 ECCD CCN1CCN(c2ccc(CNS(=O)(=O)NC)cc2F)CC1 285051299 CUXYQSDPAIVYBK-UHFFFAOYSA-N 330.429 0.521 10 20 ECCD COC(=O)COCC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 806614652 ZRVCPJNTMBPYKT-CYBMUJFWSA-N 336.388 0.890 10 20 ECCD CCOC(=O)[C@@H]1NCC[C@@H]1NCc1ccc(N2CCOCC2)cc1 817894508 LPHOQHVTIYTJLC-DLBZAZTESA-N 333.432 0.906 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cn3cccn3)nc12 918922749 VFUGOZSOQKEYDR-UHFFFAOYSA-N 345.315 0.552 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCN([C@H]3CCNC3=O)C2)cc1 1016379876 ATZPFFDCPIXGNU-STQMWFEESA-N 344.375 0.542 10 20 ECCD CCNC(=O)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851921679 YPKZHENDHGCMDB-UHFFFAOYSA-N 334.420 0.583 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](N[C@H]3CCN(C)C3=O)C2)cc(OC)n1 1022367352 BJJOHUZNUILRNP-XQQFMLRXSA-N 348.403 0.180 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1(NC(N)=O)CC1 767207143 XURBXRCLUBWSSM-UHFFFAOYSA-N 332.404 0.683 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)N(C)CC(=O)NC2CC2)cc1 872888932 UFSUILOZIOTRMP-UHFFFAOYSA-N 349.387 0.323 10 20 ECCD CC[C@]1(O)CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 779336469 RCLIQYGKUXWCJP-AWEZNQCLSA-N 328.390 0.751 10 20 ECCD C[C@H](N)CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1119295845 YNDCYXRCXQJEFX-ZFWWWQNUSA-N 349.431 0.753 10 20 ECCD COC(=O)C[C@H]1C(=O)NCCN1C(=O)/C=C\c1ccc(O)c(O)c1 779499943 NFQGSGHUMUCIRD-MZBZXASESA-N 334.328 0.001 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3ccc(=O)n(C)n3)cc2)CC1 881848883 CUDXBTGICIAYTN-UHFFFAOYSA-N 341.415 0.462 10 20 ECCD CCS(=O)(=O)CC(=O)NCc1ccc(N2CCN(C)CC2)cc1 881852258 ZUVGYFSPULFKDT-UHFFFAOYSA-N 339.461 0.489 10 20 ECCD COC(=O)COc1ccc(N(C)CC(=O)N2CCO[C@@H](C)C2)cc1 784559042 ZHQZUWONFJVBNU-ZDUSSCGKSA-N 336.388 0.922 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@H]3CC[C@H]3C(N)=O)CC2)nn1 1089855673 NXNGMOALRYXCPK-CABCVRRESA-N 343.431 0.939 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3coc(C)n3)C2)cc(OC)n1 996369303 UKZNDOLRSOAKBZ-UHFFFAOYSA-N 346.343 0.650 10 20 ECCD COc1ccc(O)c(CNC(=O)c2cc(-c3nn[nH]n3)ccn2)c1 1609358194 GKZSQMYPMTZVTG-UHFFFAOYSA-N 326.316 0.906 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNC[C@H]2CCO[C@H]2C(=O)O)c1O 1607051189 YOODWNDJTSZJEF-BXKDBHETSA-N 326.305 0.888 10 20 ECCD C[C@H](C(=O)NCc1ccc(N)cc1)S(=O)(=O)C1CCOCC1 1575070343 XZFSJBYUCSZSLF-LLVKDONJSA-N 326.418 0.867 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1([S@](C)=O)CCNCC1 1576053057 SBSICECAIOYGHM-BGJPBQGDSA-N 340.445 0.646 10 20 ECCD CN(Cc1cn(C)c(=O)n(C)c1=O)c1ccc(OCC(=O)O)cc1 1598534148 RHIQTUUTYPBKFG-UHFFFAOYSA-N 333.344 0.184 10 20 ECCD C[C@@H](CNCC(=O)NC1CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1754298041 WQBALKHSKMFSMV-JTQLQIEISA-N 346.391 0.836 10 20 ECCD CC(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1 1796137922 YFIGWHAOSNGBRF-JJLQDPRZSA-N 349.387 0.352 10 20 ECCD COC(=O)CNC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 16387249 AKHSOKYHILOKHT-UHFFFAOYSA-N 335.404 0.244 10 20 ECCD CN(CC(=O)NC1CC1)CC(=O)N(C)Cc1ccc(N(C)C)cc1 50274515 QYNMLTUCHVHYRT-UHFFFAOYSA-N 332.448 0.921 10 20 ECCD NC[C@H](O)CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1340171657 FPYMXNZIRPQTAJ-CYBMUJFWSA-N 325.384 0.113 10 20 ECCD COc1ccc(N(C)CC(=O)N2CCN(C(C)=O)CC2)c(OC)c1 269836402 UDJGAZKKETVAHZ-UHFFFAOYSA-N 335.404 0.831 10 20 ECCD COC(=O)[C@@H](NC(=O)/C=C/c1ccc(N2CCOCC2)cc1)[C@@H](C)O 274519160 RXLNYBOXBIUJRL-GBFFFSQQSA-N 348.399 0.575 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@H](CC(N)=O)C1 377608279 RFSHRPMEDZLHHR-HNNXBMFYSA-N 332.448 0.908 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=S)NCCNS(C)(=O)=O 727068411 CIPKZEUTGLLZSP-UHFFFAOYSA-N 344.506 0.608 10 20 ECCD NC(=O)[C@@H]1C[C@@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 900756278 SDOMBNGQXQFSQP-CVEARBPZSA-N 331.416 0.633 10 20 ECCD CNCCCN(C)C(=O)C(=O)NCCCSc1nccs1 842092053 KCKNAMZNMFEPKY-UHFFFAOYSA-N 330.479 0.809 10 20 ECCD COc1ccc(N2CCN(C(=O)Cc3noc([C@H](C)N)n3)CC2)cc1 843218417 YEUYMDDNJTWSDV-LBPRGKRZSA-N 345.403 0.989 10 20 ECCD COCCS(=O)(=O)CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773008815 NUDXBOHJQDMODO-LBPRGKRZSA-N 328.434 0.991 10 20 ECCD O=C(N[C@H]1CCN(C2CCOCC2)C1=O)c1c(F)ccc(O)c1O 881061892 AXZGSLDPPCJIJC-NSHDSACASA-N 338.335 0.747 10 20 ECCD COc1ccc(CNC(=O)CCCN2C(=O)CN(C)C2=O)c(O)c1 794387528 KIUGUJMWFJMARY-UHFFFAOYSA-N 335.360 0.691 10 20 ECCD CC(C)(O)CC(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089827667 QQULTODKEDZCLT-UHFFFAOYSA-N 345.407 0.323 10 20 ECCD COC(=O)N1CCCN(C(=O)C(=O)N(C)Cc2ccccc2O)CC1 1331044511 KNFXNNGSVAQQNK-UHFFFAOYSA-N 349.387 0.651 10 20 ECCD COc1ccc(N2CC[C@H](NC(=O)N3CCO[C@H](C(=O)O)C3)C2)cc1 1341340852 AFVZSCAYXYCGGD-WFASDCNBSA-N 349.387 0.769 10 20 ECCD C[C@@H](O)C(=O)N1CCN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])CC1 1593428281 YXGUBVBWJUNIEN-JOAKQRRISA-N 349.343 0.722 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1nc2ccccn2c1=O 183456895 RUXKYEIRFGIGLA-LLVKDONJSA-N 342.355 0.655 10 20 ECCD COC(=O)CNC(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(O)c(O)c1 841461105 QOTUOQWAWHMBCE-HWPRWLFBSA-N 348.355 0.391 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN(C)C[C@@H](C)N)CC2)cc1 923408931 KRFMTKLXVMVJHL-NVXWUHKLSA-N 336.480 0.457 10 20 ECCD CCN1CCN(c2ccc(CNc3nc(N)nc(N)n3)cc2F)CC1 858399320 BAOQPUPCEZAFNI-UHFFFAOYSA-N 346.414 0.929 10 20 ECCD COc1cccc(CNC(=O)[C@H]2CC(=O)N(c3cnn(C)c3)C2)c1O 860241509 SDFVKROUOUHMDT-LBPRGKRZSA-N 344.371 0.804 10 20 ECCD CS(=O)(=O)NC1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 862484812 BJCWDXJIHPNAJM-UHFFFAOYSA-N 335.769 0.687 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@H]2C[C@@]2(CO)C1 1117976726 UXEXAFANPGWQSZ-KDOFPFPSSA-N 331.416 0.552 10 20 ECCD CNC(=O)CN[C@@H](C)C[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1134872448 LDCQEKKNDSBXCM-WDEREUQCSA-N 338.408 0.331 10 20 ECCD COc1ccc(CN[C@@H]2CCN(C(=O)[C@H](C)NC(N)=O)C2)cc1C 1182193757 CEDOLGWOOZOIST-GXTWGEPZSA-N 334.420 0.751 10 20 ECCD Oc1ccc(Cl)c(F)c1CNCCn1cnc(-c2nn[nH]n2)n1 1607110659 ICVWTPJJDQVAPW-UHFFFAOYSA-N 338.734 0.746 10 20 ECCD COC[C@@]1(C(=O)O)CN(C(=O)c2c(F)ccc(O)c2O)CCO1 1604557854 RPEINNLTBLOVHM-CQSZACIVSA-N 329.280 0.179 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2cnc3c(cnn3C)c2=O)cc1 10433374 GGDIQSAMJIGAKL-UHFFFAOYSA-N 340.387 0.512 10 20 ECCD CNC(=O)[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 291598977 IIOOKQQNFCPDIM-NSHDSACASA-N 338.383 0.596 10 20 ECCD CN(Cc1ccccc1O)C(=O)[C@H]1CCCN(S(N)(=O)=O)C1 816889091 MCCCHERNKDOZPX-LBPRGKRZSA-N 327.406 0.266 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN[C@H]2CS(=O)(=O)C[C@H]2OC)c1O 826985112 BSJIPFUKUMVNTC-GXSJLCMTSA-N 346.361 0.211 10 20 ECCD CN1CCN(C(=O)CN(C)C(=O)/C=C\c2ccc(O)c(O)c2)CC1 825293994 XVUQMNXLEBFGCW-XQRVVYSFSA-N 333.388 0.343 10 20 ECCD CCN(CC)[C@@H]1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 842242122 OGKVVKVQDLXNFF-MRXNPFEDSA-N 332.448 0.870 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCCN2)cc1F 842148787 PHGPLMXHEIWCOY-CYBMUJFWSA-N 336.411 0.766 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)[C@@H]3CCNC3=O)C2)cc1C 1019239142 GNHVOJJABYHKCD-LSDHHAIUSA-N 331.416 0.830 10 20 ECCD CC(=O)N[C@@H](CC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)C(N)=O 742245450 IUAKTVRQQLDOQX-INIZCTEOSA-N 348.447 0.870 10 20 ECCD O=C1NC(=O)N2CCN(Cc3c(O)cccc3Br)C[C@H]12 862300402 OLJONMJDNXHAKO-SNVBAGLBSA-N 340.177 0.891 10 20 ECCD NC(=O)CN1CCN(Cc2ccc(N3CCC(O)CC3)cc2)CC1 876554694 FIKVNOGSTSNTHU-UHFFFAOYSA-N 332.448 0.251 10 20 ECCD COC(=O)[C@H]1C[C@H](O)CN(Cc2ccc(OC)c(OC)c2O)C1 895126038 UPVAKIPPWAQSIJ-RYUDHWBXSA-N 325.361 0.765 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)Cn2cnc(N)n2)N(C)C)cc1 891248369 LVJCSXLJMSULTO-AWEZNQCLSA-N 331.424 0.345 10 20 ECCD Cn1nnnc1CNCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1177237462 AQNFHDHPMFCZFF-UHFFFAOYSA-N 345.367 0.282 10 20 ECCD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)C(=O)N(C)Cc1ccccc1O 1325447379 YOEXAPITRBNJFA-CHWSQXEVSA-N 333.388 0.382 10 20 ECCD COc1cccc(CNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c1O 1320009206 HSXIOBVKCQZBCJ-UHFFFAOYSA-N 333.300 0.787 10 20 ECCD CNC[C@H](O)[C@@H](C)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1343721263 FOWHQHQGLWBYQA-KEYYUXOJSA-N 335.448 0.854 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C(F)F)C1 1842666232 RQHSMMJSCABBDB-UHFFFAOYSA-N 327.287 0.575 10 20 ECCD COc1ccc(CNCCN(CCO)C(=O)[C@H]2CCNC2=O)cc1C 1754888852 HKBPGTAFZIBHMI-HNNXBMFYSA-N 349.431 0.050 10 20 ECCD CC(=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796599242 IKCPMCIQJDLIOH-ZSBIGDGJSA-N 333.344 0.334 10 20 ECCD CNS(=O)(=O)CCN[C@H](C)c1ccc(N2CCOCC2)cc1 187200265 YHYIRVLPBVTPGS-CYBMUJFWSA-N 327.450 0.723 10 20 ECCD CC(=O)NCCCNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 807671978 VZHXWGXXIJEXTM-LBPRGKRZSA-N 334.420 0.572 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCNC(=O)O)cc2)C1 739160150 MEGBBELIJUOONT-ZDUSSCGKSA-N 348.403 0.662 10 20 ECCD O=C(Cn1cc(C(=O)O)cn1)NCc1ccc(N2CCOCC2)cc1 911210520 VJFBCUHBJMWQAE-UHFFFAOYSA-N 344.371 0.734 10 20 ECCD Cc1cc(C(=O)NS(=O)(=O)CC(N)=O)c(C)n1-c1ccccn1 766928537 GQOCAFXBWCLFLD-UHFFFAOYSA-N 336.373 0.034 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)CN2CCNCC2)N(C)C)cc1 1122328653 RHVFIHTXOGHKGX-QGZVFWFLSA-N 333.480 0.377 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cc([C@@H](C)N)nn3)CC2)cc1 881023532 NBYIKJAWXIPBCQ-CYBMUJFWSA-N 344.419 0.655 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2C[C@@H]3CN(CCO)C[C@@H]3C2)cc1 1049242984 DXINXQWJOANSIT-BETUJISGSA-N 331.376 0.845 10 20 ECCD C[C@H]1CN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CC(=O)N1 889663631 SPPIYBBHBOIXLL-AWEZNQCLSA-N 345.447 0.468 10 20 ECCD COc1ccc(CNCC2CC(NC(=O)[C@H]3CNC(=O)N3)C2)cc1C 962245922 LUTPDAJOELYAPU-YMAMQOFZSA-N 346.431 0.669 10 20 ECCD CCOc1ccc(N2CCN(C(=O)CS(C)(=O)=O)CC2)cc1 1319734299 VTYQJAREZFQTPP-UHFFFAOYSA-N 326.418 0.779 10 20 ECCD Cn1nncc1CNCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1177238409 VFQOLKONHXWGMQ-UHFFFAOYSA-N 344.379 0.887 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C[C@@]1(C)CO 1330821455 CRNSDMYSZWCFIO-UGSOOPFHSA-N 333.432 0.846 10 20 ECCD CCOC(=O)[C@@H](CO)NC(=O)c1csc(Cc2ccc(N)cc2)n1 1577914743 VPIFHFRNLFXHOQ-GFCCVEGCSA-N 349.412 0.970 10 20 ECCD COc1ccc(CN[C@H](CC(N)=O)C(=O)O)cc1Cn1cccn1 1777364725 PGCYTUYUAXEJIA-CYBMUJFWSA-N 332.360 0.358 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)c1cn(CC(=O)N(C)C)nn1 115280478 QHBOHKOLOAVECV-UHFFFAOYSA-N 344.419 0.671 10 20 ECCD Cc1cc(N2CC[C@@H](NC(=O)c3cccc(O)c3O)C2=O)n(C)n1 279075529 DKANTAYVVNASDJ-LLVKDONJSA-N 330.344 0.675 10 20 ECCD COCC(=O)N[C@H](C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)C(C)C 273136641 CXUPOYYYKVVYKB-ZBEGNZNMSA-N 338.404 0.932 10 20 ECCD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H]1CO 288658216 VIRUCQCNXUYMBW-RHSMWYFYSA-N 343.427 0.908 10 20 ECCD C[C@H](O)CN(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 830620214 QAMGIAKJNXZVMV-ZDUSSCGKSA-N 349.431 0.103 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H]2CCNC[C@@H]2C1 911124965 NEYYUGAZARHXMJ-JKSUJKDBSA-N 344.459 0.745 10 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ECCD COc1ccc(-n2nnnc2CN[C@@H]2CN(C(C)=O)C[C@@H]2C)cc1 1054304411 ZEJBGVDZIZQSCN-XHDPSFHLSA-N 330.392 0.627 10 20 ECCD COc1ncncc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785296790 HVSIUNKKIHZUAA-SECBINFHSA-N 346.343 0.582 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CN(CCO)CCCO2)cc1 1073903988 AGNAREGCBABPIQ-AWEZNQCLSA-N 349.391 0.662 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)CC(N)=O)CC2)ncc1[N+](=O)[O-] 1089822282 YKNJOBCPVRABGT-UHFFFAOYSA-N 347.375 0.816 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@@H]3CCC(=O)N3)CC2)nn1 1089835575 ZXJIDJLDPWCXFA-AWEZNQCLSA-N 329.404 0.706 10 20 ECCD O=C(NCc1ccccc1O)C(=O)Nc1ccc(-n2cncn2)nc1 1339327734 OXRZHUXTAKRPDG-UHFFFAOYSA-N 338.327 0.623 10 20 ECCD O=C(C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)C1CC1 1841305144 XYZKCMMJJKRYHF-UHFFFAOYSA-N 345.355 0.289 10 20 ECCD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)N(C)C)cc1OC 266052780 SCVVAAXSCQJJQB-UHFFFAOYSA-N 337.423 0.675 10 20 ECCD CN(C[C@H]1CCC[C@@H]1O)C(=O)c1cc(NS(C)(=O)=O)ccc1O 270056804 BPLIHYJKEZUSQL-MFKMUULPSA-N 342.417 0.997 10 20 ECCD C[C@H](NC(=O)C(=O)N[C@H](C)C[S@@](C)=O)c1ccc(N(C)C)cc1 807673679 XMNBXMZIIJIKIN-YCDSQXFLSA-N 339.461 0.813 10 20 ECCD O=c1[nH]c2ccc(S(=O)(=O)Nc3ccc(O)cc3)cc2[nH]c1=O 914688903 KVFUPVBKZJSKDZ-UHFFFAOYSA-N 333.325 0.723 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3[C@H](N)CCC[C@H]3C2)cc1 842037347 ZCQHKHVOOUZPFP-USXIJHARSA-N 344.459 0.955 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(Cc3cnns3)C2)cc(OC)n1 1015102825 MBRFILPWBBGWSV-NSHDSACASA-N 349.416 0.955 10 20 ECCD CCn1nncc1CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 859276067 FJWPLGQXMDNHKI-UHFFFAOYSA-N 344.419 0.639 10 20 ECCD Nc1ccc(CNS(=O)(=O)N2CCC3(CC2)OCCO3)cc1 1120770914 IKGBGQLEZWYNTI-UHFFFAOYSA-N 327.406 0.442 10 20 ECCD C[C@H](NCCN1CCN(S(C)(=O)=O)CC1)c1ccccc1O 783509930 WJDLKRGJWBMNSC-ZDUSSCGKSA-N 327.450 0.620 10 20 ECCD CN1CCN(CC(=O)NCCCSc2nccs2)CC1=O 780680049 DGJSYZBUMGIKSL-UHFFFAOYSA-N 328.463 0.516 10 20 ECCD COC(=O)CNC(=O)[C@H]1CCCN1Cc1cc(F)cc(F)c1O 895026427 WIHOEBRVRINEBM-GFCCVEGCSA-N 328.315 0.924 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCC(=O)N3)cc2)CC1 787321025 ZGZKLONJJVIMND-MRXNPFEDSA-N 344.415 0.250 10 20 ECCD COC(=O)c1nccc(N2CC=C(CCNC(=O)[C@H](C)OC)CC2)n1 1089810735 WTNNUZUQSDDZGS-LBPRGKRZSA-N 348.403 0.941 10 20 ECCD Cn1cnc(-c2nnc3n2CCN(C(=O)Cc2ccc(N)cc2)C3)c1 1330036738 WZICTNRBWQZRCH-UHFFFAOYSA-N 337.387 0.846 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCO[C@H]2CN)N(C)C)cc1 1342290722 BTKUZFUHALZOAZ-ULQDDVLXSA-N 334.464 0.835 10 20 ECCD C[C@@H]1CN2CCN1C[C@@H]2C(=O)NCc1ccc(N2CCOCC2)cc1 1519019550 HXNLPWPBGLYEJX-CRAIPNDOSA-N 344.459 0.528 10 20 ECCD Cc1nc(S(=O)(=O)NCC(=O)N(C)c2ccc(N)cc2)cn1C 1579867041 PTGMUCFOPTUAIF-UHFFFAOYSA-N 337.405 0.252 10 20 ECCD COCCNC(=O)Cn1cc(NC(=O)NCc2ccccc2O)cn1 267032895 DKZQRNZWKXSPOL-UHFFFAOYSA-N 347.375 0.673 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@](C)(C(N)=O)C1 280521692 DXTAJCQOJYOALZ-SFHVURJKSA-N 332.448 0.908 10 20 ECCD CN(C)C(=O)CNC(=O)C(=O)NCc1cc(Cl)cc(Cl)c1O 807511842 XUYKDPPGLOGVTM-UHFFFAOYSA-N 348.186 0.520 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)C(C)(C)NS(C)(=O)=O 565014463 KBMJHELRVGARSA-UHFFFAOYSA-N 341.433 0.806 10 20 ECCD COc1ccc(N2CCN(C(=O)Cc3noc(CN)n3)CC2)cc1 823048185 QGRPCMOSHPHGQW-UHFFFAOYSA-N 331.376 0.428 10 20 ECCD CN1CC(=O)N(CC(=O)NCCCSc2nccs2)C1=O 733972201 BIUZOXVORPZSFZ-UHFFFAOYSA-N 328.419 0.636 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(C)CCNC3)cc2)CC1 832172872 MKQGFSHGWXOKFW-LJQANCHMSA-N 344.459 0.971 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@H]1CCCNC1=O 837816066 CQOQSXCQLVVHFM-OAHLLOKOSA-N 346.431 0.849 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN(C)C[C@H](C)N)CC2)cc1 923408932 KRFMTKLXVMVJHL-RDJZCZTQSA-N 336.480 0.457 10 20 ECCD COc1ccc(CNC(=O)[C@H](CCSC)NC(N)=O)c(O)c1 861489860 KPTQGMVONJCUPR-NSHDSACASA-N 327.406 0.807 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@@H]1COCCN1 861765324 AGFFALANNRBLCW-OAHLLOKOSA-N 346.431 0.008 10 20 ECCD CCN(C(=O)c1ccc(N=NC(N)=O)cc1)C1CN(C(=O)C(N)=O)C1 968064935 CEYQXDBWZXSFRN-UHFFFAOYSA-N 346.347 0.007 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3ccncc3=O)CC2)cc1 794522957 GUCSDSXIEIDERH-UHFFFAOYSA-N 328.372 0.601 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2C[C@H]3CCN(CCO)C[C@H]32)cc1 1084861914 LYSABZPWDXUVPH-TZMCWYRMSA-N 331.376 0.988 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H]2NC(=O)CC[C@H]2C1 1327316491 KLCOIYWVTNALGZ-JSGCOSHPSA-N 345.399 0.478 10 20 ECCD CNC(=O)Cc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 1325377778 PNJPYNYGEVLZRW-UHFFFAOYSA-N 326.334 0.102 10 20 ECCD COc1ccc(O)c([C@@H](C)NCc2nnc3c(=O)n(C)ccn23)c1 1331257760 PTAQQHJSMZEWAN-SNVBAGLBSA-N 329.360 0.993 10 20 ECCD C[C@H](NCc1cc(=O)n2nc(N)[nH]c2n1)c1ccc(N(C)C)cc1 1261762219 KVNKBPJOADZXLG-JTQLQIEISA-N 327.392 0.917 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](CCC1OCCO1)C(=O)O 1601238618 MBBUEAVIJQTMRR-DGXRNCNBSA-N 337.328 0.834 10 20 ECCD Cc1cc(C(=O)NC[C@@H]2CC(C(N)=O)=NO2)c(C)n1-c1ccccn1 189867205 ONHRWBWSAJXOLQ-LBPRGKRZSA-N 341.371 0.849 10 20 ECCD Cc1c(CNC(=O)C(=O)NC[C@@H]2COCCO2)n(C)c2ccccc12 342673022 VHAPUYLMLFKCNJ-CYBMUJFWSA-N 345.399 0.635 10 20 ECCD Cc1cc(C(=O)N2CCO[C@H](C(N)=O)C2)c(C)n1-c1ccccn1 363268699 FDLCTIZITYFNAT-AWEZNQCLSA-N 328.372 0.815 10 20 ECCD CC(C)[C@H](CCO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 270430882 MIUHNKFGRBQCOY-LBPRGKRZSA-N 330.406 0.901 10 20 ECCD CCNS(=O)(=O)[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 272675754 QZUVNXSIDKGNKL-FUEXJSSKSA-N 340.401 0.651 10 20 ECCD C[C@H]1C(=O)NCCN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 298583339 GGJNICHMVVONTI-LBPRGKRZSA-N 332.404 0.058 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H](C(=O)O)C1 817890833 ZZXVBVOHYFSFRO-CYBMUJFWSA-N 333.388 0.644 10 20 ECCD CN(C)C(=O)COC1CN(Cc2ccc(N3CCOCC3)cc2)C1 839137150 ASJXTMVFUAIQDC-UHFFFAOYSA-N 333.432 0.812 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)C2CCC2)c1 837113789 JNEIPZIEBBLURI-ZDUSSCGKSA-N 328.390 0.655 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CC[C@@H](CN)C2)cc1F 842148317 MCSMHXKZMCZPPZ-YPMHNXCESA-N 336.411 0.752 10 20 ECCD CCN[C@H](C)CNC(=O)C(=O)NCCCSc1nccs1 842092262 KQVDHFQIGGRFQF-SNVBAGLBSA-N 330.479 0.856 10 20 ECCD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CN1CCNCC1=O 843485411 LFKDBAFQGDNPCB-UHFFFAOYSA-N 332.448 0.921 10 20 ECCD CN1C(=O)N[C@]2(CCC[C@H]2CNC(=O)NCc2ccccc2O)C1=O 752025695 ZGIYPYMNZBSWJW-SJCJKPOMSA-N 346.387 0.912 10 20 ECCD COc1ccc(O)c(CNC(=O)C(=O)Nc2cncnc2N(C)C)c1 761058322 ONVTXAZBWJHLCV-UHFFFAOYSA-N 345.359 0.512 10 20 ECCD COc1ccc(-n2nnnc2CN2CC(NC(=O)C(C)C)C2)cc1 1030113382 RNHVPNCYIWDJGP-UHFFFAOYSA-N 330.392 0.627 10 20 ECCD CN1CC[C@@](O)(CNC(=O)NCc2ccc(N3CC=CC3)cc2)C1 763092891 YDHRHGPIBXQIDR-GOSISDBHSA-N 330.432 0.929 10 20 ECCD O=C(Cn1cnnn1)N1CCN(Cc2cc(F)cc(F)c2O)CC1 894767365 WNDBOIIUWFUXOF-UHFFFAOYSA-N 338.318 0.001 10 20 ECCD COc1cccc(CN2CCS(=O)(=NS(C)(=O)=O)CC2)c1O 894826390 SYOHPVRJCGQRKJ-UHFFFAOYSA-N 348.446 0.644 10 20 ECCD CC(=O)N[C@H](C)C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089799643 LKTJMQKMRWVKBQ-LLVKDONJSA-N 335.383 0.783 10 20 ECCD COc1ccc(-n2nnnc2CN2C[C@@H](C)[C@H](CNC(C)=O)C2)cc1 1092419726 XESMGLPNJPKZCP-TZMCWYRMSA-N 344.419 0.875 10 20 ECCD COCC(=O)NCCC(=O)N1CCN(c2ccc(OC)cc2)CC1 1319277915 KKMQRPMFXJWJIT-UHFFFAOYSA-N 335.404 0.497 10 20 ECCD CCOC[C@@H]1CN(Cc2cc(O)n3ncc(C(=O)O)c3n2)CCO1 1329134933 KWHDDXYLBHQPOP-NSHDSACASA-N 336.348 0.370 10 20 ECCD O=C(CC[C@@H]1NC(=O)NC1=O)NCc1ccc(N2CCOCC2)cc1 1321946922 QWQDYRZYWZBBFR-AWEZNQCLSA-N 346.387 0.128 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1csnn1 1342915738 KNYZQISDMMCSLZ-VIFPVBQESA-N 337.357 0.854 10 20 ECCD COC(=O)c1cn(CC(=O)NCc2ccc3c(c2)CCCN3C)nn1 81617177 RBYSNKDWJKSCPP-UHFFFAOYSA-N 343.387 0.764 10 20 ECCD CN(CCn1cccn1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 264946279 SGODQDVCTWXVDK-UHFFFAOYSA-N 338.389 0.732 10 20 ECCD C[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H]1CO 275950710 DYKPMDIUMREPFV-BXKDBHETSA-N 328.390 0.607 10 20 ECCD CCN1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H](C)C1 288215953 COYKGTBYBCBCIE-NSHDSACASA-N 341.433 0.930 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN[C@](C)(C(N)=O)C(C)C)nc12 289413938 TYPYIAKTIWGIMP-INIZCTEOSA-N 349.391 0.601 10 20 ECCD CCCN(CC(=O)O)Cc1cc(O)n2ncc(C(=O)OCC)c2n1 829472815 ANUMCBHKDXWNCQ-UHFFFAOYSA-N 336.348 0.908 10 20 ECCD CS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccccc2O)cn1 748481775 NBSIJKWFYSKOCS-UHFFFAOYSA-N 349.368 0.446 10 20 ECCD CC[C@H](O)CNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 843079929 NQILNHXDFQHDRW-IRXDYDNUSA-N 337.464 0.539 10 20 ECCD C[C@@H](N[C@@H]1CCN(S(C)(=O)=O)C1)c1cc([N+](=O)[O-])ccc1O 846190653 UWJPIEQFPABNQW-NXEZZACHSA-N 329.378 0.985 10 20 ECCD COC[C@H](CS(=O)(=O)NCc1ccc(N(C)C)c(F)c1)OC 881842780 YYQNATIDLVNFGO-GFCCVEGCSA-N 334.413 0.973 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCN(C)C3)cc2)CC1 787325578 OFHSWAMDWWPQSI-QGZVFWFLSA-N 344.459 0.923 10 20 ECCD NC(=O)CCCC(=O)NCCC1=CCN(c2nccnc2F)CC1 1089836345 RPVAWZUTOKUQNP-UHFFFAOYSA-N 335.383 0.914 10 20 ECCD O=C1C[C@@H](CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CN1 1327551295 JMYOYAXSRCKPDO-CQSZACIVSA-N 346.431 0.583 10 20 ECCD COC[C@@H](O)CNCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1177237568 FCJNWQMMLDTJQB-ZDUSSCGKSA-N 337.380 0.566 10 20 ECCD COC(=O)C[C@@H]1CCCN1C(=O)C(=O)N(C)Cc1ccccc1O 1325019213 RMYDKWWPDKSWHV-ZDUSSCGKSA-N 334.372 0.905 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2[C@H]3CC[C@H]2CC(=O)NC3)cc1 1330939952 DIDIYDTYWHCLOC-GJZGRUSLSA-N 344.415 0.248 10 20 ECCD O=C(CCn1cnnn1)N(Cc1ccccc1O)C[C@H]1CCCO1 1332099112 HXRPTDXIFMHCQV-CQSZACIVSA-N 331.376 0.977 10 20 ECCD O=C(C[C@@H]1CS(=O)(=O)[C@H]2CNC[C@H]12)N1Cc2cccc(O)c2C1 1580517401 HDZXEQLYRVNYTK-JMSVASOKSA-N 336.413 0.257 10 20 ECCD COc1ccc(CN[C@@H](C)CNC(=O)[C@H]2CC[C@@H](C(N)=O)O2)cc1C 1752900910 MMAPMRYVTHBNGG-VBNZEHGJSA-N 349.431 0.631 10 20 ECCD O=S(=O)(NCc1ccccc1O)c1ccc(-c2nn[nH]n2)cn1 1593442506 AJTKYDLYEYWAPL-UHFFFAOYSA-N 332.345 0.446 10 20 ECCD COc1ccc(O)c(CNC(=O)Cn2nc3ccccn3c2=O)c1 155960431 HXKFPEINZRJOEY-UHFFFAOYSA-N 328.328 0.527 10 20 ECCD CN(C)S(=O)(=O)CCNCc1ccc(N2CCOCC2)cc1 388909445 NOFZPZVWQAFCFJ-UHFFFAOYSA-N 327.450 0.504 10 20 ECCD CCN(CCO)C(=O)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 817862010 MWSTULVIWVSEAL-CQSZACIVSA-N 335.448 0.949 10 20 ECCD CC(=O)N[C@H]1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 817833003 IVPMDMSNYZYAKZ-DOMZBBRYSA-N 346.431 0.667 10 20 ECCD CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 728459273 AHUKHPHLJKBYOX-MRXNPFEDSA-N 346.431 0.496 10 20 ECCD COCC1CN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 905972739 SSFHUVKKIXGUJN-GOSISDBHSA-N 349.475 0.756 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCO[C@@H](C(=O)O)C1 737476647 LZYPKWZYFHTFIA-OAHLLOKOSA-N 335.404 0.496 10 20 ECCD CC(=O)N[C@@H](C)C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 833395601 PXFTYTUKWGYKDT-QMMMGPOBSA-N 328.752 0.983 10 20 ECCD C[C@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCN1 842265019 ATWILZSTERUVSF-DZGCQCFKSA-N 332.448 0.968 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NC2CCNCC2)cc1 846343776 MPANPXYKVCTBBX-UHFFFAOYSA-N 348.447 0.458 10 20 ECCD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnn(C)n1 925055485 NCARGYCMAGZSRU-ZDUSSCGKSA-N 349.460 0.901 10 20 ECCD CC[C@@H](N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1)C(N)=O 1020352213 DAIGRIGSYOFSEO-IJLUTSLNSA-N 336.392 0.213 10 20 ECCD COc1ccc(CNC[C@H]2CCN(C(=O)c3nnn(C)n3)C2)cc1C 1027001585 LOZAGXDRCQWGME-CQSZACIVSA-N 344.419 0.779 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCO[C@@H]3COCC[C@@H]32)cc1 933968676 JGVJGEPKMNGGDF-DLBZAZTESA-N 333.432 0.859 10 20 ECCD CN1CCN(c2ccc(CNC(=O)CCS(C)(=O)=O)cc2)CC1 881849149 ARWUZFNQWUCDDY-UHFFFAOYSA-N 339.461 0.489 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1cc(CCCN)nn1 881083916 NAGVQHXEWRFBRX-UHFFFAOYSA-N 330.436 0.894 10 20 ECCD COc1cccc(CNC(=O)NCC2CN(S(C)(=O)=O)C2)c1O 779696177 DGBJGLPYTOKEBH-UHFFFAOYSA-N 343.405 0.091 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1C[C@@H]2CC[C@H](C1)N2 884567026 ZRJJVNVEYSFGHN-IYBDPMFKSA-N 340.427 0.642 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C[C@@H]4C[C@@]4(CO)C3)CC2)cc1 782616248 KCRLPTAGEACPDN-KXBFYZLASA-N 345.443 0.658 10 20 ECCD CCc1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)n[nH]1 785421473 CPZYYCWVLXUILH-UHFFFAOYSA-N 329.404 0.971 10 20 ECCD CNC(=O)C1(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC1 891253356 RMZJAYJMBPZINV-HNNXBMFYSA-N 332.448 0.998 10 20 ECCD O=C(NCCC1=CCN(c2nccn3nnnc23)CC1)[C@H]1CCCO1 1089799190 BIUFMNRWCOINGS-CYBMUJFWSA-N 343.391 0.341 10 20 ECCD CC(C)NC(=O)CNCCNC(=O)c1ccc(N=NC(N)=O)cc1 1153048058 SHIRZQHKQCHLMG-UHFFFAOYSA-N 334.380 0.693 10 20 ECCD Nc1ccc(CNC(=O)N2CCN(C(=O)N3CCOCC3)CC2)cc1 1335732543 ZUOKXMVHFWITCE-UHFFFAOYSA-N 347.419 0.548 10 20 ECCD COC(=O)c1cn([C@@H]2CCN(C(=O)NCc3ccc(N)cc3)C2)nn1 1578881001 ZNTBUJXJOLFWRD-CYBMUJFWSA-N 344.375 0.804 10 20 ECCD C[C@H](NCc1nnnn1C1CC1)c1cccc(-c2nn[nH]n2)c1O 1589975662 FKCZSGXYSHJITF-QMMMGPOBSA-N 327.352 0.745 10 20 ECCD Cc1ccc(C(=O)NC2CCN(CC(=O)N(C)C)CC2)c(O)c1O 272722213 FMVORJJLVJQFMG-UHFFFAOYSA-N 335.404 0.689 10 20 ECCD O=C(CN1C(=O)NC2(CCCC2)C1=O)NCCc1ccc(O)c(O)c1 298758180 ISTJJUGWEAKDNG-UHFFFAOYSA-N 347.371 0.621 10 20 ECCD O=C(COC(=O)c1cc(O)cs1)NCCCN1CCCC1=O 732354612 XFTJEXUVFNQPGH-UHFFFAOYSA-N 326.374 0.739 10 20 ECCD CN(CCCS(N)(=O)=O)Cc1ccc(N2CCOCC2)cc1 738298227 FLVJQCHMUMDUIF-UHFFFAOYSA-N 327.450 0.634 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CNCCCO1 842273583 KLUZWKNPHCOIDW-INIZCTEOSA-N 348.447 0.206 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(C(=O)CSC)C2)cc(OC)n1 938308497 RLHYPRWAJPHLEW-NSHDSACASA-N 339.417 0.793 10 20 ECCD C[C@H](N)CN(C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 861564282 JWCOKEDSZQOKHO-DZGCQCFKSA-N 347.463 0.877 10 20 ECCD COc1ccc(N2CCN(C(=O)C[C@H]3COCCN3)CC2)c(OC)c1 877228282 XRQPYAFVRIMTTN-AWEZNQCLSA-N 349.431 0.731 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1nonc1C 1118247120 XQDSCXCOEHFOGZ-LBPRGKRZSA-N 349.343 0.622 10 20 ECCD COC[C@H](O)CNC(=O)NCc1ccc(N2CCN(C)CC2)cc1 889662470 DXWJNPPZDKXCCT-MRXNPFEDSA-N 336.436 0.245 10 20 ECCD Cc1ccc(C(=O)Nc2ccn(CCS(C)(=O)=O)n2)c(O)c1O 780954003 MISMTXQYIOLCJN-UHFFFAOYSA-N 339.373 0.900 10 20 ECCD COc1ccc(CNCCNC(=O)[C@H]2CN(C(C)=O)CCO2)cc1C 1149530762 ORTPKERMWZOFMQ-QGZVFWFLSA-N 349.431 0.457 10 20 ECCD CN(C)C(=O)O[C@@H]1CCN(C(=O)C(=O)N(C)Cc2ccccc2O)C1 1325151150 NXWAZJIQQBNOKW-CYBMUJFWSA-N 349.387 0.650 10 20 ECCD COCCn1c(-c2sccc2O)nnc1N1CCN(C)C(=O)C1 1342393810 LRUZMYRDJWGSOK-UHFFFAOYSA-N 337.405 0.637 10 20 ECCD COCCOC1CN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 1261113347 UMUQPZXDRFEPHS-ZDUSSCGKSA-N 349.431 0.804 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C[C@H]1CC(=O)O 1607427530 CCXVXBMFHLRXJQ-TZMCWYRMSA-N 347.415 0.938 10 20 ECCD CNC[C@H](O)CN(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1578647794 VHRLFANBTQGHFE-KRWDZBQOSA-N 349.479 0.160 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cnc([N+](=O)[O-])n3)CC2)cc1 53835218 PBJDFUCZCPEIAI-UHFFFAOYSA-N 346.347 0.544 10 20 ECCD CN(C)c1ccc(CNC(=O)CCN2CCCS2(=O)=O)cc1 194478820 DIOVLPBPNWVPEG-UHFFFAOYSA-N 325.434 0.794 10 20 ECCD COC(=O)C1CCN(S(=O)(=O)N(C)Cc2ccccc2O)CC1 269827037 TZZAJIPUXNJCOF-UHFFFAOYSA-N 342.417 0.954 10 20 ECCD COC(=O)COc1ccc(N(C)Cc2cc(=O)n(C)c(=O)n2C)cc1 273049889 GDCODIJLBPBVFA-UHFFFAOYSA-N 347.371 0.272 10 20 ECCD C[C@H](O)[C@@H](NC(=O)C1CC1)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 274893193 DIENFNPNAKCUQX-HFBDOXOYSA-N 336.388 0.421 10 20 ECCD Cc1cccnc1N(C)C(=O)C1=CC=CN2CCS(=O)(=O)N=C12 279487686 OUDOLIUFTQIXHO-UHFFFAOYSA-N 332.385 0.850 10 20 ECCD CC[C@H](COC)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 284123424 NMGQRTRYWBBCSK-OAHLLOKOSA-N 349.431 0.681 10 20 ECCD CCN1CCC(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 283385213 JFVAXVQKGQTSHJ-UHFFFAOYSA-N 332.448 0.969 10 20 ECCD COC(=O)c1cc(O)ccc1NS(=O)(=O)c1c(N)noc1C 821190528 ABXTVAJAHWTRLZ-UHFFFAOYSA-N 327.318 0.858 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](C(=O)O)C3)nc12 737154686 HZBHFMSBZOXSLJ-JTQLQIEISA-N 348.359 0.908 10 20 ECCD COc1ccc(O)c(CNC(=O)CCCN2C(=O)CN(C)C2=O)c1 734015449 KPZSJYSZEMRNIC-UHFFFAOYSA-N 335.360 0.691 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)[C@@H]2CCCS2(=O)=O)cc1 848393402 BMGAGHKMWPZMLA-KBPBESRZSA-N 325.434 0.446 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](N[C@@H]3CCNC3=O)C2)cc1 1019854327 XQJADHMLRAOQPU-QWHCGFSZSA-N 344.375 0.542 10 20 ECCD CO[C@@]1(C(=O)N(C)Cc2ccc(N(C)C)cc2)CCS(=O)(=O)C1 895485348 RASUPSMDBHSPQJ-INIZCTEOSA-N 340.445 0.915 10 20 ECCD O=C1N[C@H](C(=O)NCCC2=CCN(c3cccc(F)n3)CC2)CO1 1089829872 YYRVWXIATDPINV-LBPRGKRZSA-N 334.351 0.972 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)[C@H]2CC(C(=O)O)=NO2)N(C)C)cc1 1604083587 QRHXSGSMRFFYRH-LSDHHAIUSA-N 348.403 0.701 10 20 ECCD COC[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 266773883 QHZGTCBQAVSGOR-NSHDSACASA-N 344.389 0.251 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1CCCS1(=O)=O 273170121 MHRVTNAIOXTDIO-JTQLQIEISA-N 328.390 0.181 10 20 ECCD COc1cccc(CN2CCN(C(=O)C(=O)N3CCCC3)CC2)c1O 271087060 DDLUCNFPDRUNEL-UHFFFAOYSA-N 347.415 0.667 10 20 ECCD COCCNC(=O)CN1CCN(Cc2cc(OC)ccc2O)CC1 271856675 XOTWDYOTKKKROD-UHFFFAOYSA-N 337.420 0.281 10 20 ECCD CN(Cc1nccn1C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 283329194 CLDLPEBRSWQFOW-UHFFFAOYSA-N 329.404 0.761 10 20 ECCD COc1cc(N2CCC(O)(C(N)=O)CC2)c([N+](=O)[O-])cc1OC 285673777 PPGJGJXXIJQRRA-UHFFFAOYSA-N 325.321 0.429 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1CC[C@H](CO)C1 817861736 LCZTUFVDJYUFRG-CABCVRRESA-N 347.459 0.949 10 20 ECCD C[C@@H](CN1C(=O)CN(Cc2ccccc2O)C1=O)S(C)(=O)=O 819167420 CUMOTFCJWHCPKB-JTQLQIEISA-N 326.374 0.590 10 20 ECCD COc1ccc(-n2nnnc2CN2CC[C@H](NC(=O)C3CC3)C2)cc1 1009830302 HBYSGPJURYRGGQ-ZDUSSCGKSA-N 342.403 0.771 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN3)cc2)C1 844176327 QMCXYDIFBGKYLX-GOEBONIOSA-N 330.432 0.757 10 20 ECCD COc1cc(O)c(CN2CCC[C@H](C(=O)NCCN)C2)cc1OC 843048094 MSACJGSWVDYNLQ-LBPRGKRZSA-N 337.420 0.696 10 20 ECCD Cc1onc(N)c1S(=O)(=O)NC[C@H](N)c1ccc(N(C)C)cc1 842785380 LVRUBWIFYGTFCV-LBPRGKRZSA-N 339.421 0.610 10 20 ECCD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCS(=O)(=O)N2)cc1F 845467832 JHNVFMPEVKJOTD-ZDUSSCGKSA-N 343.424 0.980 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)[C@H]2CCCN(C(N)=O)C2)cc1 843296705 DVUWZOBVWLNEFB-ZFWWWQNUSA-N 333.436 0.659 10 20 ECCD NC[C@@H]1OCC[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 852860791 VCAASGCVFYGFIS-MSOLQXFVSA-N 347.459 0.875 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](COC)OC 854988518 YUBLKDYFRSXTEV-AWEZNQCLSA-N 325.361 0.945 10 20 ECCD CNS(=O)(=O)CC(=O)NC1CCN(c2ccc(OC)cc2)CC1 751462618 DIEOXIIJENLGCP-UHFFFAOYSA-N 341.433 0.329 10 20 ECCD Cn1nc(NC(=O)NCc2ccc(N3CCOCC3)cc2)ccc1=O 879896325 SIDAVPBHKDLTEL-UHFFFAOYSA-N 343.387 0.939 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N[C@H]3CCN(C)C3=O)cc2)CC1 883441387 NGSYLFMNWZHLGF-INIZCTEOSA-N 345.447 0.468 10 20 ECCD COCC(=O)N1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 954574787 XPAVKPOPQHXNIC-UHFFFAOYSA-N 333.348 0.778 10 20 ECCD CNC(=O)C1(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCC1 881851031 BCHCQUBAEIEOIZ-UHFFFAOYSA-N 344.459 0.971 10 20 ECCD O=C1CN(c2ccnc(C(=O)NCc3ccccc3O)c2)CCN1 787131907 UGSZYDIUNXMTIH-UHFFFAOYSA-N 326.356 0.653 10 20 ECCD Cn1cnc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)n1 1324784766 MUXLFZSEUSYUGU-UHFFFAOYSA-N 342.403 0.348 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1CCS(=O)(=O)C1 1342327449 VFZGMLXROUMLPF-CMPLNLGQSA-N 327.402 0.970 10 20 ECCD COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cnnn2C)cc1C 1755776681 CELIVPSSBYRQRU-AWEZNQCLSA-N 347.419 0.355 10 20 ECCD C[C@@H](NCC(=O)NCCC(=O)O)c1ccc(N2CCOCC2)cc1 1593230855 LOQASHXDBWTERK-CYBMUJFWSA-N 335.404 0.765 10 20 ECCD CNC(=O)C1(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 106016113 UKWSCPLOIYZFJM-UHFFFAOYSA-N 335.379 0.805 10 20 ECCD NS(=O)(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 79273459 MCSQUVRXLSWVAO-UHFFFAOYSA-N 339.339 0.835 10 20 ECCD O=C1NC[C@H]2CN(Cc3ccc(N4CCCCC4)cc3)CCN2C1=O 91865949 WDJRWGQLWQXZCE-KRWDZBQOSA-N 342.443 0.820 10 20 ECCD CN(CC(=O)NCCc1ccc(N)cc1)S(=O)(=O)c1cccnc1 237061143 AWZNOYMIJMOMPQ-UHFFFAOYSA-N 348.428 0.643 10 20 ECCD Cc1ccc(C(=O)N[C@H]2CCN(c3cnn(C)c3)C2=O)c(O)c1O 271258128 IWYXDQYUNJZLSC-LBPRGKRZSA-N 330.344 0.675 10 20 ECCD O=C(NCCn1ccnc1)C(=O)NCc1ccc(N2CCCC2)cc1 283902013 KTZKGOJZGPUKAC-UHFFFAOYSA-N 341.415 0.916 10 20 ECCD COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCOC3)CC2)cc1 804316836 KUOFANMUBDYUQI-CQSZACIVSA-N 347.415 0.685 10 20 ECCD NC(=O)[C@@H]1CCCN(CCCNC(=O)c2c(F)ccc(O)c2O)C1 825688268 GXIJGMFEVFQFTH-SNVBAGLBSA-N 339.367 0.554 10 20 ECCD CCOC(=O)N[C@H]1CCCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841017442 USQUTYRRDMPWPW-ZDUSSCGKSA-N 334.376 0.944 10 20 ECCD COc1cccc(CNC(=O)N[C@H]2CCN(S(C)(=O)=O)C2)c1O 845421025 ZEDZASDYCOHJLR-NSHDSACASA-N 343.405 0.234 10 20 ECCD CS(=O)(=O)N1CCC(CC(=O)NCc2ccc(O)c(O)c2)CC1 847590752 GJXORFSHQYFWOY-UHFFFAOYSA-N 342.417 0.776 10 20 ECCD COCC(=O)N1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C[C@H]1C 1012164038 HNDXLKMKIAHTEH-PWSUYJOCSA-N 337.376 0.464 10 20 ECCD CC[C@H](N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 1019853926 FOYFNPSRVHOCMW-STQMWFEESA-N 346.391 0.917 10 20 ECCD CNS(=O)(=O)NC1CCN(C(=O)c2ccc(C)c(O)c2O)CC1 846056421 OZZOKNQROABYEK-UHFFFAOYSA-N 343.405 0.065 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NC1CCNCC1 842070713 RFWDTOWDXNNMAD-AWEZNQCLSA-N 346.475 0.976 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(O)nc2)c1 769883306 WYJPVNIGWUKSIP-UHFFFAOYSA-N 337.357 0.794 10 20 ECCD CN(C)S(=O)(=O)CCCOC(=O)/C=C\c1ccc(O)c(O)c1 784286753 NAOUKSVEYNDZNN-ALCCZGGFSA-N 329.374 0.936 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3cc[nH]n3)C2)cc(OC)n1 973894723 CKFUJUAUFUWKBV-PHIMTYICSA-N 345.359 0.513 10 20 ECCD 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Cn1nnc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 932276127 WJKMRZYFGOUPLO-UHFFFAOYSA-N 335.343 0.508 10 20 ECCD CC(=O)N1CCO[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 944643498 WSYYFZKVWSUBNT-CYBMUJFWSA-N 333.348 0.826 10 20 ECCD C[C@@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)n1cncn1 881849912 LRUVZYCBKJUSHO-AWEZNQCLSA-N 328.420 0.907 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@@H]3CNC(=O)N3)CC2)nn1 1089861446 WQQIRHUCCATTQR-ZDUSSCGKSA-N 330.392 0.109 10 20 ECCD COc1ccc(CNCCCNC(=O)[C@@H]2CN(C)C(=O)N2)cc1C 1163958473 VMXRYCHOPIXUSW-AWEZNQCLSA-N 334.420 0.623 10 20 ECCD CN(Cc1nc(Cc2ccc(N)cc2)no1)[C@H]1CCS(=O)(=O)C1 1326200530 CPQSQUPLCHONFM-ZDUSSCGKSA-N 336.417 0.862 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)NCCCCN)C2)cc1 1326583508 IRWLWCKKGOXLKE-CQSZACIVSA-N 348.447 0.493 10 20 ECCD COCCn1c([C@H](O)COC)nnc1N(C)Cc1ccccc1O 1523681209 ZKSGEVYFXMRPNK-CQSZACIVSA-N 336.392 0.946 10 20 ECCD O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CCC(=O)N1 1602057333 VTWJOHMPJXYCAO-SNVBAGLBSA-N 326.736 0.737 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)C(=O)N(C)C1=O 7094187 XUYDRXAKAOFWMR-UHFFFAOYSA-N 332.360 0.132 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CN(C)CCO3)CC2)cc1F 177288410 PICLAVLKCRWWGR-INIZCTEOSA-N 337.395 0.814 10 20 ECCD CC[C@H](C)[C@H](O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 269388121 WSHBFXDOUWWWIS-TVQRCGJNSA-N 330.406 0.901 10 20 ECCD CCNC(=O)NC(=O)CN(C)c1cc(OC)c(OC)c(OC)c1 266005665 KOTGKEWLGDCWIH-UHFFFAOYSA-N 325.365 0.994 10 20 ECCD CCOc1ccc(CN2CCN(C(=O)Cn3cnnn3)CC2)c(O)c1 809734122 WKUQZDXLZNWUDE-UHFFFAOYSA-N 346.391 0.122 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCC(=O)N3)cc2)C1 729842340 VCQGBKIOQJPKJM-DZGCQCFKSA-N 344.415 0.283 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=S)NCCS(C)(=O)=O)c1 729158245 MJIDEBDDCPRJIG-VIFPVBQESA-N 332.447 0.971 10 20 ECCD CC(C)OC(=O)[C@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 837028221 SKLLGGQXMMFFDH-VIFPVBQESA-N 344.389 0.834 10 20 ECCD C[C@H]1C[C@H](CN)CN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 842147601 HACAITBUDGLPRW-WCQYABFASA-N 336.411 0.704 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNCCCCO)CC2)cc1 843061034 DTVDMLHPTHFHSB-QGZVFWFLSA-N 337.464 0.540 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cc(C(=O)O)cn3)CC2)cc1 911094083 IGKLMQOGWICXHC-UHFFFAOYSA-N 344.371 0.939 10 20 ECCD CNCC1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 842036856 SDTIDDVFXMKZGZ-UHFFFAOYSA-N 332.448 0.827 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)NCCN2CCNCC2)cc1 846172241 XOCQOLCIFNOPDL-UHFFFAOYSA-N 349.479 0.678 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCOCC2)cc1 846234301 NMPURLGOXMNSLG-UHFFFAOYSA-N 335.404 0.449 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN[C@H]3C[C@H](O)C3)CC2)cc1 853130979 MQJMBQFTTRBXPR-XIRDDKMYSA-N 335.448 0.291 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC(=O)N(C)CC3)nc12 852577895 LBBVCQASQXUDEL-UHFFFAOYSA-N 347.375 0.276 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CC[C@H](N3CCOC3=O)C2)cc1 852435196 JSLXVEPPGPXELQ-INIZCTEOSA-N 346.431 0.895 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C[C@H](O)C[C@@H]3C)CC2)cc1 761111765 DCDFXKLBVNEBOR-GOEBONIOSA-N 333.432 0.799 10 20 ECCD C[C@@H]1COCCN1CCNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785439258 NCTDOKHRNGCESQ-CQSZACIVSA-N 348.447 0.206 10 20 ECCD O=C(O)C1=NO[C@]2(CCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)C1 1608588340 DLCFKAQQTNBEJD-ZENLRNHISA-N 332.312 0.943 10 20 ECCD Cc1ccc(O)c(CNC(=O)N[C@@H]2CCCCN(CC(=O)O)C2=O)c1 1594373416 YYRIYJLPKBMUHR-CYBMUJFWSA-N 349.387 0.966 10 20 ECCD CN(C)c1ccc(CNC(=O)NCC2CN(S(C)(=O)=O)C2)cc1 188564040 VZCJAQJXQUBUHL-UHFFFAOYSA-N 340.449 0.443 10 20 ECCD COc1cccc(CNC(=O)NCCS(=O)(=O)NC(C)C)c1O 266750641 NRBDLSBFPHDATH-UHFFFAOYSA-N 345.421 0.528 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CC[C@@H](C(N)=O)O1 276547373 FRNJSKPSWDFYDX-JKSUJKDBSA-N 347.415 0.515 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCS(C)(=O)=O 283975291 IWBLFUHJDCOXLO-UHFFFAOYSA-N 342.417 0.292 10 20 ECCD NC(=O)[C@H]1CC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 816891083 IAARNFJMPWXOPP-STQMWFEESA-N 335.379 0.790 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3CCC[C@@]3(N)C2)cc1 857100808 NNYQLNVNPGRAKQ-KBXCAEBGSA-N 330.432 0.709 10 20 ECCD 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ECCD O=C(O)[C@H]1CC(=O)N(C2CCN(C(=O)c3cccc(O)c3O)CC2)C1 1594898195 YYJHPXYPFDJHOL-JTQLQIEISA-N 348.355 0.636 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@H]1CC[C@@H](C(N)=O)O1 125867608 UKGQPMOLDJFEFL-GJZGRUSLSA-N 334.420 0.893 10 20 ECCD COc1ccc(CNC(=O)[C@H]2CC(=O)N(c3cn[nH]c3)C2)c(O)c1 373657146 ANJYSRNMFRSHEN-NSHDSACASA-N 330.344 0.793 10 20 ECCD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc3n(n2)CCCC3)c1 376702888 YGFLBPFZJHXPFK-UHFFFAOYSA-N 344.371 1.189 10 20 ECCD Cc1nccn1CCNC(=O)C(=O)NCc1ccc(N(C)C)cc1 283571141 RXCCVRCXEIOOFP-UHFFFAOYSA-N 329.404 0.690 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)N3CC[C@H](N)C3)CC2)cc1 817934463 IWQAGAHYGYTUFL-AWEZNQCLSA-N 346.431 0.294 10 20 ECCD Cc1nc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)nn1C 815351989 WXRSSSLIOBPKPT-UHFFFAOYSA-N 342.403 0.979 10 20 ECCD CCOC(=O)[C@H]1NCC[C@@H]1NCc1ccc(N2CCOCC2)cc1 817894510 LPHOQHVTIYTJLC-IRXDYDNUSA-N 333.432 0.906 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCNC3=O)CC2)cc1 824285662 SEFUVJARCOEWLM-MRXNPFEDSA-N 346.431 0.070 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)CCNC(=O)[C@@H]2CCCN2)cc1 832274632 WIOIBJMQACZWGO-CVEARBPZSA-N 347.463 0.127 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@H]3CCCC(=O)N3)cc2)CC1 918852382 MFLOUSZMKIBVGA-MRXNPFEDSA-N 330.432 0.723 10 20 ECCD CC(C)(N)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 842257464 JYIFRCKMAIMYPO-CQSZACIVSA-N 349.431 0.753 10 20 ECCD COCCN1CC[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1 924601998 ZGSLRVRGLUIWHA-AWEZNQCLSA-N 333.388 0.877 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C[C@@H](O)[C@H](C)C3)CC2)cc1 768772597 ZZRYAEPKEHKXGB-RHSMWYFYSA-N 333.432 0.656 10 20 ECCD C[C@@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CCN1CC(N)=O 948075023 WJXMROPEYNVBBB-ZWNOBZJWSA-N 346.391 0.917 10 20 ECCD CN1C(=O)CS/C1=C\C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 876507211 YBEWVRZRNXDHGQ-TUTDSIAXSA-N 334.445 0.915 10 20 ECCD CC[C@H](C(N)=O)N1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1044355133 PYFYUZFMIFOKAK-CYBMUJFWSA-N 346.391 0.869 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CCNC3=O)CC2)c(OC)c1 870165916 PKOVGUDZXYTMNR-ZDUSSCGKSA-N 333.388 0.489 10 20 ECCD 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CC[C@H](CO)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 787321610 HVJHFRHBJHUZJW-MRXNPFEDSA-N 333.432 0.990 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@@H]2COC3(C2)CN(CCO)C3)cc1 1054020526 OKQCYYXPCKAISI-ZDUSSCGKSA-N 347.375 0.414 10 20 ECCD COc1ccc(CNC(=O)C(=O)Nc2cccc(C(N)=O)n2)c(O)c1 797388470 ZQPXHHFGNYRCGG-UHFFFAOYSA-N 344.327 0.150 10 20 ECCD CNC(=O)NCCC(=O)NCCC1=CCN(c2ccc(C)nn2)CC1 1089829494 PTVBWJWEELEMAY-UHFFFAOYSA-N 346.435 0.747 10 20 ECCD O=C(NCCC1=CCN(c2nccn3nnnc23)CC1)C1(CF)CC1 1089861749 DSVYMRUGAJPUJJ-UHFFFAOYSA-N 345.382 0.912 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCc1cnn(C)c1 1321838021 SKKLLFXIVXOFIX-UHFFFAOYSA-N 343.431 0.770 10 20 ECCD C[C@@H](NC(=O)[C@@H]1CNCCN1C)c1ccc(N2CCOCC2)cc1 1353518231 NXLQFOZAADMAEI-PBHICJAKSA-N 332.448 0.604 10 20 ECCD C[C@H](NC(=O)NCC(=O)N(C)C)c1ccc(N2CCOCC2)cc1 68548924 HWIBIHOTUQSYBV-ZDUSSCGKSA-N 334.420 0.972 10 20 ECCD CC(=O)C(=O)Cn1cnc2c(cnn2-c2ccccc2[N+](=O)[O-])c1=O 808023305 FQVSFKAEUZECFZ-UHFFFAOYSA-N 341.283 0.649 10 20 ECCD 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CN1CCC[C@H](NCCNC(=O)c2ccc(N=NC(N)=O)cc2)C1=O 1153048044 RNMSGSHZNGKJTH-ZDUSSCGKSA-N 346.391 0.789 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCn1cncn1 1258140372 ULZKRPHOHGVOIQ-UHFFFAOYSA-N 330.392 0.119 10 20 ECCD C[C@H]1CN(c2ccc(CNC(=O)CNCCN)cc2F)C[C@@H](C)O1 1263096318 NJMKONUEPSWKRO-BETUJISGSA-N 338.427 0.604 10 20 ECCD COCCCNC(=O)[C@@H](C)N1CCN(Cc2ccc(N)cc2)CC1 1352788577 PUVVBJJEFYCRAI-OAHLLOKOSA-N 334.464 0.928 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)C(=O)O 1610330859 JBSSYYQCTMNWHX-WPRPVWTQSA-N 325.317 0.409 10 20 ECCD CN(CC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O)Cc1ccccc1O 109772152 BTNYFRGMAPWSQL-UHFFFAOYSA-N 344.371 0.474 10 20 ECCD CCNS(=O)(=O)[C@@H]1CCN(C(=O)c2ccc(C)c(O)c2O)C1 272905319 CJURGDGQZWSWCI-SNVBAGLBSA-N 328.390 0.560 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N[C@H](C)CCN)C2)cc1 818676683 PHHXRWWSLIXBCZ-KGLIPLIRSA-N 348.447 0.491 10 20 ECCD CC(=O)NCCN(C)C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 834786012 KLVUAUCWKXJOHX-LBPRGKRZSA-N 334.420 0.524 10 20 ECCD 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COc1ncncc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785296791 HVSIUNKKIHZUAA-VIFPVBQESA-N 346.343 0.582 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)[C@@H]2CC23CC3)cc1 1134309874 WIYVYGQCDZQBTJ-AWEZNQCLSA-N 342.403 0.677 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCCNCC(=O)NC2CC2)cc1 1153048205 VSPQFLKRGOAGER-UHFFFAOYSA-N 332.364 0.447 10 20 ECCD O=C(c1cn[nH]c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249901 NXHWTZZTHDDLOH-UHFFFAOYSA-N 343.343 0.347 10 20 ECCD CN1CCN(c2ccc(CN3CCC[C@H](O)[C@H]3C(=O)O)cc2)CC1 1598622799 ZNMNQCUZDVXEAX-IRXDYDNUSA-N 333.432 0.848 10 20 ECCD CN(C)C(=O)CCNC(=O)NCc1ccc(N2CCOCC2)cc1 54787128 ACRWXAJAUDPIGS-UHFFFAOYSA-N 334.420 0.801 10 20 ECCD CCc1ccc([C@H](CNC=C2C(=O)NC(=S)NC2=O)N(C)C)cc1 29006329 JVEVRRFIVZIJFG-AWEZNQCLSA-N 346.456 0.856 10 20 ECCD O=C(N[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(O)c1O 365996936 LIMQJZXDYOVQMA-CYBMUJFWSA-N 335.404 0.234 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCN(C(=O)[C@@H](C)O)CC2)c1O 278334829 ZRURSWIAPIRJDH-SNVBAGLBSA-N 339.348 0.334 10 20 ECCD 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CNC(=O)NCC(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1598650431 BBRHXASTHSZGEO-UHFFFAOYSA-N 329.740 0.388 10 20 ECCD COC(=O)C[C@H](CC(=O)O)NCc1ccc(N2CC[C@@H](O)C2)cc1 1777108114 IVYNEWUIDAWOAH-DZGCQCFKSA-N 336.388 0.754 10 20 ECCD O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NCCc1ccc(O)c(O)c1 298769378 PURZVBXQASJITB-BETUJISGSA-N 346.383 0.932 10 20 ECCD C[C@@H](NC(=O)C(=O)N[C@H]1CCOC1)c1ccc(N2CCOCC2)cc1 803304171 DQOMKBFNDYHPKV-HIFRSBDPSA-N 347.415 0.606 10 20 ECCD COC(=O)[C@H](N/C=C1/C(=O)NC(=S)N(CC(C)C)C1=O)C(C)C 293206310 ZUMBRNCYGCPFCT-SDKXAQGSSA-N 341.433 0.557 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)C[C@@H]3CC(=O)N3)cc2F)CC1 826719119 GKWMBUILPCQYFO-CQSZACIVSA-N 348.422 0.862 10 20 ECCD C/C=C/[C@H](O)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 907640372 OFZIISVQBIRQLI-IDOMTICXSA-N 331.416 0.908 10 20 ECCD CC(C)(C)OC(=O)N1CC(O)(C(=O)NCc2ccc(O)c(O)c2)C1 847591340 STVIMQMQCBPTOD-UHFFFAOYSA-N 338.360 0.696 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NCC(C)(C)N)cc1 846344267 RVQRGAPLPQQDSQ-UHFFFAOYSA-N 336.436 0.443 10 20 ECCD 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YRPKTKDYOJUAMO-OAHLLOKOSA-N 349.431 0.573 10 20 ECCD COc1cccc(CNS(=O)(=O)N2CCC(OC)CC2)c1O 849377654 ZRYHTGQMPRFODT-UHFFFAOYSA-N 330.406 0.846 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H](OC)C3)CC2)cc1 754052189 XMXUWSMLDLIXEN-HKUYNNGSSA-N 349.475 0.899 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC/C=C\CO)cc2)C1 853466311 YNGAKXYVZZIPLB-DJYNDVHFSA-N 346.431 0.736 10 20 ECCD CN(C)C[C@](C)(O)CNCc1ccc(N2CCN(C)CC2)c(F)c1 1116361535 VWYKBVWZBVRGEY-GOSISDBHSA-N 338.471 0.980 10 20 ECCD CC(C)(N)CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 884613648 RNPKBUMEFIKMNV-UHFFFAOYSA-N 348.447 0.383 10 20 ECCD CNS(=O)(=O)CCNCc1cc(Br)cc(F)c1O 715765559 HFCFZSNZZAOBDU-UHFFFAOYSA-N 341.202 0.933 10 20 ECCD COc1ccc(-n2nnnc2CN[C@H]2C[C@@H](CNC(C)=O)C2)cc1 1086008062 AKNIWHWYZNVAIU-BETUJISGSA-N 330.392 0.675 10 20 ECCD COC(=O)CCCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1321393429 FSNOPGWGDDZWTM-UHFFFAOYSA-N 335.404 0.780 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C(=O)CCC3=O)CC2)cc1F 1346623038 IWCLPQOWLXYYSI-UHFFFAOYSA-N 349.362 0.632 10 20 ECCD CSCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1350562637 KZCHWCSASKMBKC-UHFFFAOYSA-N 337.445 0.619 10 20 ECCD CN1C(=O)C(=Cc2ccc(C(=O)O)cc2[N+](=O)[O-])C(=O)N(C)C1=O 1776115917 MUDXAAYSRTXPSG-UHFFFAOYSA-N 333.256 0.727 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@H]2C[C@@H](N[C@@H]3CCNC3=O)C2)cc1 1023149855 LIVIVCXJYYCQNH-FRRDWIJNSA-N 344.375 0.588 10 20 ECCD COc1ccc(N2CCCN(CCNS(C)(=O)=O)CC2)cc1 170958393 IJPQWSBNTWTCLZ-UHFFFAOYSA-N 327.450 0.757 10 20 ECCD COc1ccc(N2CCN(C(=O)C[C@@H](CN)OC)CC2)cc1F 278251633 MPTYSOZAUSQQRO-ZDUSSCGKSA-N 325.384 0.847 10 20 ECCD COc1cc(Cl)cc(CNCCNS(=O)(=O)N(C)C)c1O 298017012 DBPLQEXZLSBDSA-UHFFFAOYSA-N 337.829 0.540 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)[C@@H](CN)OC)cc2F)CC1 290250148 WHYGBDPWKBPSPY-MRXNPFEDSA-N 338.427 0.558 10 20 ECCD C[C@@H]1[C@@H](C)[S@](=O)CCN1Cc1cc(O)n2ncc(C(=O)O)c2n1 737746708 YFIPRLTYBGICRA-DNKNOMGSSA-N 338.389 0.474 10 20 ECCD C[C@@H](C(=O)NCCc1ccc(O)c(O)c1)n1cnc2c(N)ncnc21 830531925 OSPSNQPQPBBACC-VIFPVBQESA-N 342.359 0.740 10 20 ECCD CCOC(=O)[C@H]1CCCN(CC(=O)NCc2ccc(O)cc2O)C1 910957697 VNVULXBLOWIXFA-ZDUSSCGKSA-N 336.388 0.989 10 20 ECCD CN1CCN(c2ccc(CN3CCN([C@H]4CCNC4)CC3)cc2)CC1 843124451 AZKIHGKMAQXKJO-FQEVSTJZSA-N 343.519 0.918 10 20 ECCD CN(CC(C)(C)N)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 851684219 CDHMNCYJVIRXQF-UHFFFAOYSA-N 330.432 0.875 10 20 ECCD C[C@@H](NCCN1CCN(S(C)(=O)=O)CC1)c1ccc(F)cc1O 756536969 YANIYXFDEPIVMV-GFCCVEGCSA-N 345.440 0.759 10 20 ECCD COc1ccc(-n2nnnc2CN2CC[C@@H](CNC(C)=O)C2)cc1 1028363305 PNIRQAOZMJFXAV-ZDUSSCGKSA-N 330.392 0.629 10 20 ECCD COc1ccc(O)c([C@@H](C)NCC2(O)CCS(=O)(=O)CC2)c1 1116477946 QTFYGBZFVLKDCF-LLVKDONJSA-N 329.418 0.991 10 20 ECCD CNS(=O)(=O)[C@@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 779518911 ACSUKHWEQJLOJC-SMYYYNMVSA-N 340.401 0.651 10 20 ECCD COC[C@H](CO)NC(=O)NCc1ccc(N2CCN(C)CC2)cc1 889662489 FLNBTZRPEZVQSP-HNNXBMFYSA-N 336.436 0.245 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3c(C)cncc3=O)CC2)cc1 794531633 STXXLSFDEBUJBD-UHFFFAOYSA-N 342.399 0.909 10 20 ECCD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cn(C)cn2)cc1 797432581 JOCFUTFRUOKEDS-UHFFFAOYSA-N 345.406 0.097 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCN2CC=CC2)c1 1330804740 ALWFJEAPVIUIGG-UHFFFAOYSA-N 325.390 0.365 10 20 ECCD COc1cccc(CNC(=O)NC[C@@H](C)N2CCN(C)CC2)c1O 1346998377 WRRGDUXOHLSGCY-CYBMUJFWSA-N 336.436 0.836 10 20 ECCD Nc1ccc(CNC(=O)N2CCC[C@@H](N3CCNCC3=O)C2)cc1 1353540861 YOZGQVHBEXWDOM-OAHLLOKOSA-N 331.420 0.375 10 20 ECCD COc1ccc(CNC(=O)Nc2nn(C)cc2-c2nn[nH]n2)c(O)c1 1609355644 VVPZDMVLXVGHDJ-UHFFFAOYSA-N 344.335 0.636 10 20 ECCD COCCN1C(=O)/C(=C\Nc2ccc3c(c2)OCO3)C(=O)NC1=S 60860744 GMYPGDWUJDYUON-YFHOEESVSA-N 349.368 0.601 10 20 ECCD COC(=O)[C@H](C)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 271274870 NACOHJQGBAXZLL-MRVPVSSYSA-N 330.362 0.303 10 20 ECCD CC(C)[C@@H](CCO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 270430881 MIUHNKFGRBQCOY-GFCCVEGCSA-N 330.406 0.901 10 20 ECCD C[C@@H](NC(=O)C(=O)NCC[S@](C)=O)c1ccc(N(C)C)cc1 804999095 CYTGRDAXRTXSSC-XFNZEKPQSA-N 325.434 0.425 10 20 ECCD COc1cccc(CNC(=O)CN(C)[C@@H]2CCS(=O)(=O)C2)c1O 729858868 FTRNYGHQGRRPID-GFCCVEGCSA-N 342.417 0.136 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=S)NCCNS(C)(=O)=O 734385512 NYZJGJDLPJFEKG-UHFFFAOYSA-N 344.506 0.574 10 20 ECCD COC(=O)[C@H]1C[C@H](O)CN(CC(=O)NCc2ccc(N(C)C)cc2)C1 830880955 FSVCDFLXVPPIAZ-HOCLYGCPSA-N 349.431 0.225 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N[C@H]1CCNC1 842070389 OLXAQNDDRCKZRL-HIFRSBDPSA-N 332.448 0.586 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H](CN)C1 842151882 DGGIRNIJDWQBGU-AWEZNQCLSA-N 332.448 0.875 10 20 ECCD CC[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1N 842036833 QZZXNBWLDQRWEM-HOCLYGCPSA-N 332.448 0.955 10 20 ECCD CC(C)NCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 851641129 GFLDJSUVKQWRJK-UHFFFAOYSA-N 339.461 0.536 10 20 ECCD C[C@H](N)CN(C)C(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 863753435 UMHSEXDKQAHQIV-AWEZNQCLSA-N 348.447 0.287 10 20 ECCD COc1ccc(N2CCN(C(=O)c3cnn(C)c3N)CC2)c(OC)c1 870168165 ZQVJUNIPXRNDDP-UHFFFAOYSA-N 345.403 0.982 10 20 ECCD 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CN1C(=O)C(=Cc2ccccc2OCCC(=O)O)C(=O)N(C)C1=O 1776115420 XZHCAXCLRHWSNK-UHFFFAOYSA-N 332.312 0.974 10 20 ECCD C[S@](=O)CCNC(=O)C(=O)NCCCSc1nccs1 804997763 RAORARBVCCUFPI-FQEVSTJZSA-N 335.476 0.236 10 20 ECCD CN1C(=O)CC[C@H](NCc2ccc(N3CCOCC3)c(F)c2)C1=O 818234339 XQMSUTUZMDSLTR-AWEZNQCLSA-N 335.379 0.899 10 20 ECCD Nc1ccc(NC(=O)C(=O)N[C@@H]2CCCC[C@H]2N2CCOCC2)cc1 841072121 HDTYTIQXXGKAOQ-HZPDHXFCSA-N 346.431 0.967 10 20 ECCD COc1ccc(N2CCCN(C(=O)C[C@H]3CC(=O)NC3=O)CC2)cc1 930309964 PJUVWLVHZAINIV-CYBMUJFWSA-N 345.399 0.787 10 20 ECCD COc1cc(C(=O)NC2CN(CCn3cccn3)C2)cc(OC)n1 1030614304 GUDMWLCTPKAAID-UHFFFAOYSA-N 331.376 0.410 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1ccncc1 773739264 DDYJRLSLLHDSAX-NSHDSACASA-N 329.356 0.970 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N[C@H](CN)C3CC3)cc2)CC1 892025916 BAASWWJDPNXTJR-QGZVFWFLSA-N 331.464 0.975 10 20 ECCD C[C@H](CO)N(C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 891087426 RCEVSQVWOJKIAF-CYBMUJFWSA-N 348.447 0.911 10 20 ECCD 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CLQLXHNOOOAEQZ-UHFFFAOYSA-N 343.347 0.179 10 20 ECCD NC(=O)NCC(=O)NCCC1=CCN(c2ccc([N+](=O)[O-])cn2)CC1 1089804606 OOUFKERHINHZLV-UHFFFAOYSA-N 348.363 0.301 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)NCC1(O)CCS(=O)(=O)CC1 1321924968 USDAUYWZPWBTRV-DUXPYHPUSA-N 341.385 0.167 10 20 ECCD COc1cccc(CNC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)c1O 1607323262 GHCMBCRYGFJSJO-IUCAKERBSA-N 339.348 0.178 10 20 ECCD CN(C)c1cc(F)c(CNCCn2cnc(-c3nn[nH]n3)n2)cc1F 1604697012 MJSLLTOPMXWCLT-UHFFFAOYSA-N 349.349 0.592 10 20 ECCD O=C(O)/C=C/c1ccc(N2CC[C@@H]3OCC(=O)N[C@H]3C2)c([N+](=O)[O-])c1 1610750450 KMUOLGRCSJQVDQ-VBCBYMQESA-N 347.327 0.786 10 20 ECCD COc1ccc(N2CCN(S(=O)(=O)N(C)C)CC2)c(OC)c1 243848632 RFAGMXGOXSSAAK-UHFFFAOYSA-N 329.422 0.632 10 20 ECCD CCS(=O)(=O)NCCNC(=O)NCc1cccc(OC)c1O 266664853 LDBDTCNESNKRLA-UHFFFAOYSA-N 331.394 0.139 10 20 ECCD C[C@@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C(=O)O1 293981949 RJPPUJXZJNWLLZ-GMSGAONNSA-N 328.346 0.198 10 20 ECCD O=C1CN(Cc2ccccc2O)C(=O)N1CCCN1CCOCC1 819166193 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CNS(=O)(=O)[C@@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 92067920 GIKPBUWWVVQTFW-MRXNPFEDSA-N 339.461 0.647 10 20 ECCD COc1cccnc1N(C)C(=O)C1=CC=CN2CCS(=O)(=O)N=C12 269869970 SCKOMZBGMGVFGJ-UHFFFAOYSA-N 348.384 0.551 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCN([C@@H]3CCOC3)CC2)cc1 366517888 SQNPKVBJXUIITR-GOSISDBHSA-N 346.475 0.775 10 20 ECCD C[C@H](NC(=O)C(=O)N1C[C@@H](C)O[C@@H](CO)C1)c1ccc(N(C)C)cc1 807672076 WISHIDMHZJCTSU-DVOMOZLQSA-N 349.431 0.538 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N(CCO)C3CC3)ccc21 803687273 APPBHSSYQDQHJK-UHFFFAOYSA-N 331.416 0.669 10 20 ECCD O=C(N[C@@H]1CCOC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 804698956 XSZUCKKPDVNYOY-CABCVRRESA-N 348.399 0.805 10 20 ECCD C[C@@H]1C[C@H](C(=O)O)CN(C(=O)C(=O)N(C)Cc2ccccc2O)C1 817896605 LTZMDMNZKYQDPR-YPMHNXCESA-N 334.372 0.920 10 20 ECCD C[C@H](NC(=O)C1(n2cnnn2)CC1)c1ccc(N2CCOCC2)cc1 823835337 XGGQOMKRQWJRKX-ZDUSSCGKSA-N 342.403 0.876 10 20 ECCD CO[C@H]1CS(=O)(=O)C[C@H]1NC(=O)NCc1cc(Cl)ccc1O 821141212 IRDJZFVQWXXGPE-PWSUYJOCSA-N 348.808 0.657 10 20 ECCD 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CN(CCS(N)(=O)=O)C(=O)NCc1ccc(N2CCCC2)cc1 872845236 ZUNUXORBXXMMIS-UHFFFAOYSA-N 340.449 0.717 10 20 ECCD COc1ccc(O)c([C@@H](C)NS(=O)(=O)[C@@H](C)C(=O)N(C)C)c1 774884031 GMMXLTHHXIPUMB-ZJUUUORDSA-N 330.406 0.858 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@@H](N)C3CC3)cc2)CC1 892051422 RWTFXKVFWSJHKR-QGZVFWFLSA-N 331.464 0.975 10 20 ECCD CCC(=O)N[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1O 961067672 OBMHGZPPIZRSAK-NEPJUHHUSA-N 333.348 0.561 10 20 ECCD O=C(Cn1cnnc1O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089827361 IPFSILNQCFARHA-UHFFFAOYSA-N 347.354 0.256 10 20 ECCD CN1CC[C@@H](NCCCNC(=O)c2ccc(N=NC(N)=O)cc2)C1=O 1177238476 YHPJHIQQXJSKGO-CYBMUJFWSA-N 346.391 0.789 10 20 ECCD C[C@@H](NC(=O)C(=O)N(C)C[C@@H]1COCCO1)c1ccc(N(C)C)cc1 1328097388 MZBPUTIJRYSWJP-CZUORRHYSA-N 349.431 0.804 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3cnc(N)cn3)cc2)CC1 1331419695 NXSVIURQPFUKAQ-UHFFFAOYSA-N 326.404 0.741 10 20 ECCD CN1CCN(c2ccc(CNC(=O)CO[C@@H]3CCCNC3)cc2)CC1 1333731700 VBUPBIAFBWFSQW-GOSISDBHSA-N 346.475 0.823 10 20 ECCD 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C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NCc1ccccc1O 755769723 QPYKIMMUKGKACF-SNVBAGLBSA-N 338.389 0.109 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1COCCN1 861801052 FGBPTGHADMRAMA-OAHLLOKOSA-N 348.447 0.206 10 20 ECCD COc1ccc(-n2nnnc2CN2CC(CNC(=O)C3CC3)C2)cc1 1031508142 ORXTUKSGMGHMGO-UHFFFAOYSA-N 342.403 0.629 10 20 ECCD COC(=O)NC1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)CC1 1118530021 YBMGRUSBANULIW-UHFFFAOYSA-N 348.403 0.275 10 20 ECCD C[C@@H](O)C(=O)N1CCN(Cc2ccc(N3CCN(C)CC3)cc2)CC1 775726769 WDAVFEAHHBCJJN-MRXNPFEDSA-N 346.475 0.463 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@H](OC)C3)nc12 878970320 NMCWCPKOBLEBBZ-ZDUSSCGKSA-N 336.348 0.416 10 20 ECCD CN1CCN(c2ccc(CNS(=O)(=O)c3cnn(C)c3)cc2)CC1 882664213 OOQIYTJMNWGDDN-UHFFFAOYSA-N 349.460 0.650 10 20 ECCD C[C@@H](C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)S(C)(=O)=O 891256262 WPBLPFIBYZSEIE-SWLSCSKDSA-N 341.477 0.905 10 20 ECCD COCCOCCNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 789913237 CKOXXUYXSSGCNO-CYBMUJFWSA-N 337.420 0.709 10 20 ECCD COC(=O)NCC(=O)NCCC1=CCN(c2ccnc(C)n2)CC1 1089808717 ONQCBYUOFVHQDF-UHFFFAOYSA-N 333.392 0.784 10 20 ECCD CN(C)C(=O)CC(=O)NCCC1=CCN(c2nccnc2F)CC1 1089867842 SKJMRDBSTVMDCL-UHFFFAOYSA-N 335.383 0.737 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@H]3CO[C@H](C)C3)C2)cc(OC)n1 996379414 RKGDYDSFXZWKQW-ZYHUDNBSSA-N 349.387 0.464 10 20 ECCD CC[C@@H](NC[C@@H]1COCCN1C)c1cccc(-c2nn[nH]n2)c1O 1604054706 JCDYQJHFNREIBJ-BXUZGUMPSA-N 332.408 0.944 10 20 ECCD CC(C)C(=O)NCCC1=CCN(c2cncc(-c3nn[nH]n3)n2)CC1 1573965569 XQHVJKRFVWJKRY-UHFFFAOYSA-N 342.407 0.956 10 20 ECCD C[C@@H](CC(N)=O)C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1592453031 DOIASQQMKCXHKC-QMMMGPOBSA-N 328.752 0.970 10 20 ECCD CN(C)C(=O)CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 187925149 XFHAHLRLTNUIQN-UHFFFAOYSA-N 332.404 0.107 10 20 ECCD COc1cccc(NN/C=C2/C(=O)NC(=S)N(CC(C)C)C2=O)n1 272345956 BMBUWAYMHHKFLH-YFHOEESVSA-N 349.416 0.790 10 20 ECCD CC(C)C[C@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 271397820 JVJPOAJMKAHHRC-LLVKDONJSA-N 330.406 0.901 10 20 ECCD COc1ccc(N2CCC(NC(=O)C(=O)N(C)C[C@H](C)O)CC2)cc1 804317260 XVXNKQZAJQHCIJ-ZDUSSCGKSA-N 349.431 0.619 10 20 ECCD CCN1CCN(CC(=O)NCc2ccc(N(C)C)cc2)C(=O)C1=O 298759685 XVCMXEMDYUZPAW-UHFFFAOYSA-N 332.404 0.060 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCN[C@@H]3C)CC2)cc1 829507020 ZWFXMRQIFXRVEQ-QAPCUYQASA-N 346.475 0.931 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)c2cnn(C[C@@H](O)CO)c2)c1 830541521 ZGUZKVBMMHETQJ-CMPLNLGQSA-N 335.360 0.442 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C3(CO)CCOCC3)cc2)CC1 918844470 FESORDJIHJRXAD-UHFFFAOYSA-N 347.459 0.844 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCNC[C@H]2C)cc1 846361578 GDXIGEBIMQPXJK-CQSZACIVSA-N 348.447 0.410 10 20 ECCD CN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)[C@@H](CN)C1 841730059 NDTYSAJEYHUKOZ-KRWDZBQOSA-N 347.463 0.308 10 20 ECCD Oc1cccc(Br)c1CNC[C@H](O)Cn1ccnn1 858177507 MYIHAQAQZVPCGN-VIFPVBQESA-N 327.182 0.897 10 20 ECCD Cc1cc(C(=O)NN2CCS(=O)(=O)CC2)c(C)n1-c1ccccn1 862738557 ZYVJEPMGTWJKBK-UHFFFAOYSA-N 348.428 0.864 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@H]2COCCN2CCCO)cc1 1051263901 NFHNZSUDANFDQZ-AWEZNQCLSA-N 349.391 0.662 10 20 ECCD COC[C@@H](CO)NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 899103410 LOETWRHBPSEXQQ-ZBFHGGJFSA-N 338.452 0.662 10 20 ECCD O=C(CN1C(=O)CNC1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1318627104 XTHSWFAVIQRQGD-CYBMUJFWSA-N 347.371 0.452 10 20 ECCD COC[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)OC 1325140636 DDEYROMQLCJBOY-DOMZBBRYSA-N 337.420 0.707 10 20 ECCD O=C(N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)c1cc(O)cs1 1330736913 JYKMZRQILHRNHE-TVQRCGJNSA-N 331.415 0.920 10 20 ECCD COC[C@]1(C(=O)O)CN(C(=O)c2c(F)ccc(O)c2O)CCO1 1604557853 RPEINNLTBLOVHM-AWEZNQCLSA-N 329.280 0.179 10 20 ECCD COc1ccc(CN[C@@H](C)CNC(=O)C2CS(=O)(=O)C2)cc1C 1752875912 ZAHAIKOQRIHVCT-LBPRGKRZSA-N 340.445 0.643 10 20 ECCD O=C(C[C@H]1CNCCO1)NCc1ccc(N2CCOCC2)c(F)c1 269242254 JVKGYUSJLZJPER-AWEZNQCLSA-N 337.395 0.657 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCCCNC2=O)c1 271224968 HASHJESAPCAPBF-NSHDSACASA-N 341.389 0.162 10 20 ECCD Cn1cc(N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2=O)cn1 368022751 VWNZOXYFONVMOQ-HWKANZROSA-N 342.355 0.720 10 20 ECCD Cc1cccc(=O)n1C[C@](C)(O)C(=O)NCc1ccc(O)c(O)c1 281588513 NNDDTBZURKSTDP-KRWDZBQOSA-N 332.356 0.635 10 20 ECCD C[C@@H](NC(=O)C(=O)N1CCn2ncnc2C1)c1ccc(N(C)C)cc1 807674659 OTAPGLJIBZQEMU-GFCCVEGCSA-N 342.403 0.564 10 20 ECCD CN1C(=O)CC[C@@H](NC(=O)NCc2cc(Cl)ccc2O)C1=O 845269361 FIZPEKWEYLJCFU-SNVBAGLBSA-N 325.752 0.992 10 20 ECCD O=C(N[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(O)cs1 743418049 LIMXGBAADAYXCE-LLVKDONJSA-N 339.417 0.117 10 20 ECCD CC(C)N[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 842235187 DZJJNHRHXAHJRA-MRXNPFEDSA-N 332.448 0.917 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2C[C@@H]3C[C@H]2CN3)cc1 868394477 ZXAQAUCQGPAOOJ-ZFWWWQNUSA-N 346.431 0.163 10 20 ECCD CNC(=O)Cn1nc(NC(=O)NCc2cccc(OC)c2O)cc1C 767966027 OAAGLUQMLRLKFV-UHFFFAOYSA-N 347.375 0.973 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cnn(C(F)F)c1 768221435 BISMYNXQOZYJFM-UHFFFAOYSA-N 340.286 0.987 10 20 ECCD COc1cccc(CN2CCN(S(=O)(=O)N(C)C)CC2)c1O 768250602 WGTKGJWFYVGCLA-UHFFFAOYSA-N 329.422 0.325 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1CSC1 864937908 NKAFOPOZIOLPGR-UHFFFAOYSA-N 340.470 0.901 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCCCS2(=O)=O)cc1F 878531073 FOXPWFGQIRFJNZ-UHFFFAOYSA-N 343.424 0.934 10 20 ECCD COC(=O)CN(CCN1CCOCC1)Cc1cc(F)cc(F)c1O 894018239 YAXGRPGWBHYKLB-UHFFFAOYSA-N 344.358 0.978 10 20 ECCD C[C@H]1C[C@@H](NCC(N)=O)CN1C(=O)c1ccc(N=NC(N)=O)cc1 989839015 SOCGVWLUKUAKMK-JOYOIKCWSA-N 332.364 0.527 10 20 ECCD C[C@@H]1C[C@@H]1C(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089802856 ZLJAAUCZWAUJDK-YPMHNXCESA-N 327.392 0.818 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCC1(S(C)(=O)=O)CC1 1329755684 QOEWQDDOLLAHFJ-UHFFFAOYSA-N 340.401 0.044 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1C[C@H]2C[C@@]2(CO)C1 1346592431 YUTOZODZOAMFJA-BEFAXECRSA-N 341.411 0.520 10 20 ECCD CNC[C@@H](O)[C@@H](C)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 1341569100 HMWDRJGHWNIERI-RHSMWYFYSA-N 335.448 0.950 10 20 ECCD Cc1cc(N2CC[C@@H](NC(=O)c3ccc(C)c(O)c3O)C2=O)n(C)n1 272723090 HUXVDNJJTRVBTO-GFCCVEGCSA-N 344.371 0.983 10 20 ECCD CN1CCN(c2ccc(CN[C@@H]3CCc4nnnn4CC3)cc2)CC1 817419034 OKXMZDOQZAQQLC-MRXNPFEDSA-N 341.463 0.920 10 20 ECCD O=C(Nc1ccc(-c2ncon2)cc1)C1=S=C(c2nn[nH]n2)C=C1 823303092 DCPAHVFEAARGPF-UHFFFAOYSA-N 339.340 0.884 10 20 ECCD CN(Cc1cc(=O)n(C)c(=O)n1C)c1ccc(OCC(=O)O)cc1 833694524 KXJFDKUALZNOGX-UHFFFAOYSA-N 333.344 0.184 10 20 ECCD COCCN(C)S(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 732215529 QQMCXGUTQNNGNP-UHFFFAOYSA-N 343.449 0.640 10 20 ECCD CN(CCO)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 838738997 IFEYPGVYKUEBRU-UHFFFAOYSA-N 329.347 0.935 10 20 ECCD C[C@@H](C(N)=O)N1CCC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1009675981 VAYHJFYCWSDHAF-GXFFZTMASA-N 346.391 0.917 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)c2ccn3nnnc3c2)cc1 852791250 FHBRUBVGUKJBPV-AWEZNQCLSA-N 325.376 0.620 10 20 ECCD CNS(=O)(=O)CCCNC(=O)N(C)Cc1ccc(N(C)C)cc1 868938801 ZGDMTRJKCMVJAY-UHFFFAOYSA-N 342.465 0.833 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)NC[C@H](C)OC)C2)cc1 1118718761 PNEDISPZTWMBAH-KBPBESRZSA-N 349.431 0.789 10 20 ECCD O=C(C[C@H]1CCCS(=O)(=O)C1)NCCc1ccc(O)c(O)c1 1117755445 OZYDAUVHEDMWHE-GFCCVEGCSA-N 327.402 0.971 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)/C=C/CN2CCOCC2)cc1 876505886 BYZVYZWTVRUFSA-IDOMTICXSA-N 332.448 0.757 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)c3nonc3C)cc2)CC1 786656654 PNCMFHYUVZRJAF-UHFFFAOYSA-N 343.387 0.977 10 20 ECCD CO[C@H](C)C(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089810058 FUHKZDMKIWPIGF-LLVKDONJSA-N 331.380 0.197 10 20 ECCD COC[C@H]1C[C@@H](O)CN1C(=O)C(=O)NCc1ccc(N(C)C)cc1C 1326645113 FDXWYARPPSCWJM-HZPDHXFCSA-N 349.431 0.285 10 20 ECCD CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804331709 JPOMRHZZUWBFNY-JGPRNRPPSA-N 341.458 0.505 10 20 ECCD COC(=O)c1cn(CCN[C@H](C)c2cc(C(=O)O)ccc2O)nn1 1599008198 FQKKHBIATGQXSK-SECBINFHSA-N 334.332 0.819 10 20 ECCD Nc1ccc(NC(=O)CNC2=NS(=O)(=O)c3ccccc32)cc1 237978878 XSPJTQZZGWPODO-UHFFFAOYSA-N 330.369 0.946 10 20 ECCD CS(=O)(=O)CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 265440402 UQJUIEVLLYFRPO-CYBMUJFWSA-N 327.402 0.944 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@](O)(C4CC4)C3)nc12 373279737 UMJNBXQXSUADHR-KRWDZBQOSA-N 346.387 0.958 10 20 ECCD Cc1ccc(C(=O)NC[C@H]2CCC[C@H]2NS(C)(=O)=O)c(O)c1O 272774428 SZKFQNZVHNERAR-ZYHUDNBSSA-N 342.417 0.854 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@](C)(C(N)=O)C3)nc12 280753976 NNFBVZYOYOCZBL-INIZCTEOSA-N 347.375 0.309 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cnc(C(=O)O)n3)CC2)cc1 738020423 DIDZIBHXJQYZLA-UHFFFAOYSA-N 345.359 0.334 10 20 ECCD NC(=O)CN[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1001033563 YIUFORNLNCFBQX-LBPRGKRZSA-N 332.364 0.529 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H](N)C3CC3)ccc21 842149970 IUWOXJLNEHDHNI-OAHLLOKOSA-N 330.432 0.539 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN(C)CC(=O)O)CC2)cc1 846263285 SWQBHVZSGNJUFT-OAHLLOKOSA-N 337.420 0.195 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H]3CNC[C@@H]3C2)cc1 842206357 DUVJKQAQUIKQHK-IYBDPMFKSA-N 344.459 0.827 10 20 ECCD CC(=O)N1CCN(C(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)CC1 759595137 IKKKWZFICWHOSX-HYXAFXHYSA-N 348.355 0.345 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2CCO)cc1F 1118063303 JUKSDDVWCIAYLO-CYBMUJFWSA-N 337.395 0.881 10 20 ECCD CN(C)c1nc(N)nc(COC(=O)/C=C/c2ccc(O)c(O)c2)n1 772774906 LHGQBBKVNBQDIF-GQCTYLIASA-N 331.332 0.688 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3NC(=O)O[C@@H]3C)CC2)c(OC)c1 870167294 DWXCVGWNHQLUJL-IAQYHMDHSA-N 349.387 0.849 10 20 ECCD O=C(COC(F)F)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 795367542 OWJCGSWJLWGSOP-UHFFFAOYSA-N 348.371 0.777 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCC2[C@@H]3CN(CCO)C[C@@H]23)cc1 979159577 PAGNTXURVBAKRJ-KBPBESRZSA-N 331.376 0.749 10 20 ECCD COc1ccc(CNC(=O)c2cn(Cc3noc(C)n3)nn2)c(O)c1 794390064 GJYUOOARPMAABL-UHFFFAOYSA-N 344.331 0.662 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)Cn3ncnn3)CC2)nn1 1089844938 LPLSKRBIQPQECC-UHFFFAOYSA-N 328.380 0.115 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CNCCN3C)CC2)cc1F 1343445715 WUDDMOGPPFSXLN-HNNXBMFYSA-N 336.411 0.387 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@@H]3CC[C@@H](C(=O)O)O3)cc2)CC1 1331263428 VUHSGKJCHLNKDO-HOTGVXAUSA-N 347.415 0.687 10 20 ECCD CN1CCN(c2ccc(CNCCN3CCNC3=O)cc2F)CC1 1262107343 KGBFFSJKCPVWAT-UHFFFAOYSA-N 335.427 0.692 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2C[C@@H](C(=O)O)C2)c1 1604931625 AVPGOPRCZLEAQH-OTSSQURYSA-N 328.346 0.357 10 20 ECCD NCC(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810543523 HVELJCZVKUJYOL-UHFFFAOYSA-N 348.403 0.296 10 20 ECCD C[C@H](NCCC1CS(=O)(=O)C1)c1cccc(-c2nn[nH]n2)c1O 1589962353 SILUKYGPPBYGSI-VIFPVBQESA-N 337.405 0.658 10 20 ECCD COCCN(CC(=O)NCc1ccc(N(C)C)cc1)CC(=O)OC 299439903 YDMJWPZJMAFORA-UHFFFAOYSA-N 337.420 0.490 10 20 ECCD CN(C)S(=O)(=O)c1ccc(C(=O)NCCc2ccc(N)cc2)cn1 818545188 NJMZLVSSBQTMMH-UHFFFAOYSA-N 348.428 0.887 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@@H](O)[C@H]3C)CC2)cc1 832220599 YZSGBYULOPSUHH-SZVBFZGTSA-N 349.475 0.633 10 20 ECCD O=C(NCc1ccccc1O)C(=O)Nc1ccc2c(c1)C(=O)NCC2 735394455 LXXZRJHSOWBNMD-UHFFFAOYSA-N 339.351 0.933 10 20 ECCD 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CCN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCNC1=O 282253626 GSTIXZDFXOOPKT-INIZCTEOSA-N 332.448 0.921 10 20 ECCD CCN(CCO)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 803303288 KJFNQBRNYIKKQA-AWEZNQCLSA-N 349.431 0.541 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CC(OCC(=O)N(C)C)C2)c1O 839139071 SVVQWCCVPNURAG-UHFFFAOYSA-N 339.348 0.598 10 20 ECCD CN(C)S(=O)(=O)NCCNCc1cc(Cl)cc(F)c1O 839090969 LNJPOBXVXQMCAE-UHFFFAOYSA-N 325.793 0.670 10 20 ECCD CNC[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 842170503 HKOGCZSKIXAPJU-QGZVFWFLSA-N 342.443 0.889 10 20 ECCD CC[C@@H](C(N)=O)N1CC(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1032215691 MAUDSUQNJIQSES-ZDUSSCGKSA-N 346.391 0.775 10 20 ECCD CCn1nncc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 862362040 RFRMWJLVJVRLMF-UHFFFAOYSA-N 339.377 0.305 10 20 ECCD CCn1ncnc1CN1CC(NC(=O)c2cc(OC)nc(OC)c2)C1 1030612238 IOMTWHWRHCOCOT-UHFFFAOYSA-N 346.391 0.324 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CN(C)CCO3)CC2)c(OC)c1 870165366 WIKJIYSPJASBOS-QGZVFWFLSA-N 349.431 0.683 10 20 ECCD 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O=C1NC(=S)NC(=O)C1=CNc1ccccc1C(=O)N1CCCC1 60864417 PRBVDESQUVKNDF-UHFFFAOYSA-N 344.396 0.749 10 20 ECCD CCc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)n(C)n1 271871134 QCNPXJSNXVKUNO-UHFFFAOYSA-N 332.360 0.691 10 20 ECCD Cn1ccnc1CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 286767157 SUHFKPAWTZGNKY-UHFFFAOYSA-N 339.399 0.729 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)C[C@H](C)C(=O)O 817116333 SORRTIQPYSXTIW-LBPRGKRZSA-N 335.404 0.856 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)N=c3nc[nH]n3C)C2)cc1 824247528 RHYPTSKQPNEOJF-GFCCVEGCSA-N 330.392 0.894 10 20 ECCD CN1C(=O)C(=O)N(CC(=O)NCCCSc2nccs2)C1=O 733974318 MRQFFWCHTVCNTA-UHFFFAOYSA-N 342.402 0.162 10 20 ECCD C[C@H](N)CN(C)C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 911578192 KDHAGTSQFQQQQV-BBRMVZONSA-N 349.479 0.277 10 20 ECCD COc1cccc([C@H](C)NCCNS(=O)(=O)NC(C)C)c1O 846163460 AOQPEJXJUVVCAV-NSHDSACASA-N 331.438 0.884 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)c2nccnc2C(N)=O)cc1 844162971 QEWHQSIJAGAORF-GFCCVEGCSA-N 328.376 0.071 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@H]2C[C@H](N[C@H]3CCNC3=O)C2)cc1 1021116650 LIVIVCXJYYCQNH-AVGNSLFASA-N 344.375 0.588 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1C[C@@H]1F 1123826410 RTPFXKBYPWNXHD-KGLIPLIRSA-N 326.393 0.896 10 20 ECCD COc1ccc(CN[C@@H]2CCN(C(=O)[C@H]3CN(C)C(=O)N3)C2)cc1C 969584788 MRBBDALRTAARLL-HUUCEWRRSA-N 346.431 0.718 10 20 ECCD O=S(=O)(c1cc[nH]n1)N1CCN(Cc2cc(F)ccc2O)CC1 894978481 MFSQWVQKWPCOTJ-UHFFFAOYSA-N 340.380 0.761 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)NCC(=O)NC2CC2)N(C)C)cc1 891622584 YVWGVFDRCOSMCX-MRXNPFEDSA-N 347.463 0.933 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)c3[nH]nnc3C)cc2)CC1 790046073 OFTUANQATBBIOL-UHFFFAOYSA-N 342.403 0.712 10 20 ECCD COc1ccc(CNC(=O)c2cn(CC(=O)N(C)C)nn2)c(O)c1 794384325 ZQBZPKBMVDYYTJ-UHFFFAOYSA-N 333.348 0.011 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@H](C)NC(N)=O)CC2)n1 1089827426 LHTIRMQKVSROJI-NSHDSACASA-N 332.408 0.485 10 20 ECCD Cn1nnc2c(N3CC=C(CCNC(=O)C4CC4)CC3)ncnc21 1089803240 DNMKUMFAIHALKU-UHFFFAOYSA-N 327.392 0.811 10 20 ECCD CN1CCN(C(=O)NCc2ccc(N(C)C)cc2)C[C@@H](C(=O)O)C1 1606234150 GBRWORCDRVCSJG-AWEZNQCLSA-N 334.420 0.910 10 20 ECCD O=C(Cc1ccc(O)c(O)c1)NC[C@@H](N1CCNCC1)C(F)(F)F 1580570252 UJPFMGGRESOCLI-CYBMUJFWSA-N 347.337 0.593 10 20 ECCD C[C@H](CN1CCOCC1)N[C@H](C)c1cccc(-c2nn[nH]n2)c1O 1589848288 QCOAGURKIWIDHL-VXGBXAGGSA-N 332.408 0.944 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCN(C)C[C@H](C(=O)O)C2)c1O 1599345225 SKAOHOSUXAPJGU-NSHDSACASA-N 339.348 0.757 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CN1CCCC1=O 7098543 SGLUPSACMGCLEG-UHFFFAOYSA-N 347.415 0.877 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CCS(=O)(=O)C3)CC2)cc1 7850535 RTCPGUCOHULTQJ-CYBMUJFWSA-N 338.429 0.779 10 20 ECCD Nc1ccc(CCNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1 237952891 KZJAOEXJYJIDOF-UHFFFAOYSA-N 346.412 0.425 10 20 ECCD CCOC(=O)[C@H]1CCCN1S(=O)(=O)NCc1ccccc1O 269661886 BKFTZEOIUBAQKM-GFCCVEGCSA-N 328.390 0.754 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2=CCCOC2)c1 288030354 KTANEWOWHPTRPQ-UHFFFAOYSA-N 326.374 0.840 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CCCOCC3)ccc21 803685650 HKAPTQAVNUYHOR-UHFFFAOYSA-N 331.416 0.934 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N(C)[C@@H]3CCOC3)ccc21 803686802 QOTPCQNHOJDBCL-OAHLLOKOSA-N 331.416 0.933 10 20 ECCD CC1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CNC1 827469306 UPWJJFBXHXIVMZ-AWEZNQCLSA-N 330.432 0.614 10 20 ECCD COc1ccc(O)c(CNC(=O)NCC(C)(C)NS(C)(=O)=O)c1 734069743 NXFXFUJWXJJUED-UHFFFAOYSA-N 345.421 0.528 10 20 ECCD CC1(C)COC(=O)[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 837635138 VLAJHTAEJVARLL-LLVKDONJSA-N 342.373 0.445 10 20 ECCD CC(C)(C)[C@@H](NS(C)(=O)=O)C(=O)NCCc1ccc(N)cc1 832659091 LDXJZNIWITUSKV-ZDUSSCGKSA-N 327.450 0.891 10 20 ECCD COC[C@@H](C)NC(=O)NC(=O)CN1CCCc2cc(CN)ccc21 843349936 NBVIJXYXGLDWSP-GFCCVEGCSA-N 334.420 0.759 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC[C@@H]1N 842170560 IRVGNEQVSAMZSN-YOEHRIQHSA-N 342.443 0.875 10 20 ECCD COC[C@@](C)(O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 754989656 NTIZDPSHQUNDNV-MRXNPFEDSA-N 326.368 0.676 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC[C@H]1COCCO1 851992818 IZAVDSXNYUKUFB-KRWDZBQOSA-N 349.431 0.862 10 20 ECCD COC(=O)Cn1cc(S(=O)(=O)Nc2ccc(O)cc2F)cn1 758171586 VWPCGOAWXMXPPO-UHFFFAOYSA-N 329.309 0.702 10 20 ECCD CCN(CC)S(=O)(=O)CC(=O)NCc1cccc(OC)c1O 769508471 VPFKEQFCUKWFOA-UHFFFAOYSA-N 330.406 0.689 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(O)C3)CC2)cc1 778326915 ZMLNMINKUMGOFU-VOTSOKGWSA-N 345.399 0.103 10 20 ECCD C[C@H](NC(=O)c1cn(C)c(=O)n(C)c1=O)c1ccc(N(C)C)cc1 772997268 FINBZLVNIVGWAH-NSHDSACASA-N 330.388 0.641 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCSc1nnnn1C 773757492 UFVQKTDMQVQSRY-SECBINFHSA-N 337.405 0.851 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3cc(C(N)=O)c[nH]3)cc2)CC1 881850859 ISWBBOFDXYEUNA-UHFFFAOYSA-N 341.415 0.795 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCOCCN1 895880708 YNGMIWHUMLFCLK-UHFFFAOYSA-N 334.420 0.694 10 20 ECCD CN1CCN(c2ccc(CNCCN3CCNCC3)cc2F)CC1 1325274709 ZBFDNDRCTLBUCU-UHFFFAOYSA-N 335.471 0.572 10 20 ECCD C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CO1 1326402927 SGAWTBRXDIHTQF-SWLSCSKDSA-N 331.416 0.979 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1C[C@@H]2C[C@H]1CN2 1353272886 PLGPUEVIPFIVHC-KMFMINBZSA-N 344.459 0.681 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](CC(=O)O)C2)cc1 1610105519 UAWSQXSPQAYTRU-AWEZNQCLSA-N 349.387 0.071 10 20 ECCD O=C(C[C@]1(O)CCNC1)NCc1cccc(Br)c1O 1580501175 RHIOTVHOJPKLCG-CYBMUJFWSA-N 329.194 0.885 10 20 ECCD CCOCC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249573 AAXBPKIUPORPPL-UHFFFAOYSA-N 335.360 0.346 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]2F)C1 1841791648 IIUKYJCHAYKBJR-MNOVXSKESA-N 335.335 0.668 10 20 ECCD C[C@@H](NC(=O)C(=O)N[C@@H]1CCOC1)c1ccc(N2CCOCC2)cc1 803304173 DQOMKBFNDYHPKV-UKRRQHHQSA-N 347.415 0.606 10 20 ECCD O=C1C[C@H](N[C@H]2CCc3cccc(O)c32)CN1CCN1CCOCC1 296986352 SCLGMRGAGXSLOM-HOTGVXAUSA-N 345.443 0.902 10 20 ECCD CCCc1nnc(SCC(=O)NCc2ccc(O)c(O)c2)n1N 292161477 NGASMQWPXHLPFF-UHFFFAOYSA-N 337.405 0.764 10 20 ECCD CC[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)C(=O)NC 836250862 YQYBYJFQRVXSAO-HNNXBMFYSA-N 334.420 0.847 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)c2n[nH]c3c2CNCC3)cc1 841846680 RZKNISVGZNRVAN-AWEZNQCLSA-N 328.420 0.551 10 20 ECCD Cc1cc(N(C)C)ccc1CNCCNS(=O)(=O)NC(C)C 840941438 AKQKKKRKSKULON-UHFFFAOYSA-N 328.482 0.983 10 20 ECCD C[C@H](N)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 842170472 GULIBYXKDUFVGB-GOEBONIOSA-N 342.443 0.875 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(Cc3nc(C)no3)C2)cc(OC)n1 1015104826 STSSRYMHDYQPQA-GFCCVEGCSA-N 347.375 0.795 10 20 ECCD COC[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 929238600 PXMWWWHYHAPKSL-OAHLLOKOSA-N 335.404 0.243 10 20 ECCD COc1ccc(O)c(CNC(=O)CN(C)C(=O)[C@H](C)n2cccn2)c1 769539722 UTDQKXZXSUWKGX-LBPRGKRZSA-N 346.387 0.933 10 20 ECCD C[C@H](NC(=O)N1CC[C@@H](S(N)(=O)=O)C1)c1ccc(N(C)C)cc1 774972998 GYPAILIFWAIDNS-SMDDNHRTSA-N 340.449 0.886 10 20 ECCD COC(=O)CNC(=O)CCN[C@@H](C)c1ccc(N2CCOCC2)cc1 775258408 ZPZREZJVRWLHDE-AWEZNQCLSA-N 349.431 0.853 10 20 ECCD CC(C)[C@H](NS(C)(=O)=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773739685 ISFGJGCJVIZGGG-HZMBPMFUSA-N 344.433 0.719 10 20 ECCD COC(=O)C[C@@H]1C(=O)NCCN1Cc1ccc(OC)c(OC)c1O 891466622 QNLCIRDTWINFNU-LLVKDONJSA-N 338.360 0.273 10 20 ECCD COc1cccc(CNC(=O)c2cc(S(N)(=O)=O)oc2C)c1O 798334252 SJYWSJRWSYCTFW-UHFFFAOYSA-N 340.357 0.880 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)CC(=O)N(C)C)CC2)n1 1089867844 SLOQEXZRQBRRDN-UHFFFAOYSA-N 331.420 0.906 10 20 ECCD COCC(=O)NCCC1=CCN(c2ccnc(C(=O)OC)n2)CC1 1089797965 OMXHNJAVBHEIAK-UHFFFAOYSA-N 334.376 0.552 10 20 ECCD C[C@H](CN1CCOCC1)NC(=O)C(=O)N(C)Cc1ccccc1O 1327501957 AHKUJNVDFYHFOR-CYBMUJFWSA-N 335.404 0.188 10 20 ECCD COC(=O)Cn1cc(S(=O)(=O)NCc2cc(C)ccc2O)cn1 1334975915 QEADHVGOJJSKJF-UHFFFAOYSA-N 339.373 0.549 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)CN3C(=O)CCC3=O)C2)cc1 1346795712 HQXQQXSBTFMODT-CYBMUJFWSA-N 345.399 0.787 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)N2CCO[C@H](CN)C2)N(C)C)cc1 1353529855 YRPWGYJCVDGJMQ-IAGOWNOFSA-N 349.479 0.724 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cc(CCO)cn3)CC2)cc1 183305270 JGICWAPDZJQLIY-UHFFFAOYSA-N 344.415 0.775 10 20 ECCD COc1ccc(N2CCN(C(=O)CSCC(N)=O)CC2)cc1F 267852108 ASQSWRKSMOXTHB-UHFFFAOYSA-N 341.408 0.701 10 20 ECCD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)[C@@H]1CO 285675094 IZLZWWPCMLBUOR-XHDPSFHLSA-N 337.395 0.737 10 20 ECCD CN1CCC(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 284804075 LDWOIXWLQYKLFH-UHFFFAOYSA-N 336.411 0.718 10 20 ECCD CC(=O)C(=O)Cn1cnc2c(cnn2CCOc2ccccc2)c1=O 808026486 ZNXQTEPVOAKFCK-UHFFFAOYSA-N 340.339 0.830 10 20 ECCD CC(C)n1[nH]cnc1=NC(=O)c1cc(NS(C)(=O)=O)ccc1O 839927840 SVEYMDGGEFCOPI-UHFFFAOYSA-N 339.377 0.610 10 20 ECCD CNCCNC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 842231510 KNNSFFYOVCVCGX-UHFFFAOYSA-N 331.372 0.850 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCS(=O)(=O)N1 845310670 OIKWYHLXHMTBAD-CQSZACIVSA-N 325.434 0.793 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N(C)CCNC(C)=O 843246291 PQERKUCEVDTZBE-UHFFFAOYSA-N 335.404 0.725 10 20 ECCD CN(CC(N)=O)[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1027698446 JXWPAEQNRSCDFN-ZDUSSCGKSA-N 346.391 0.871 10 20 ECCD COc1cc(C(=O)NC2CN(C[C@@H]3C[C@@]34CCOC4)C2)cc(OC)n1 1030615010 VLWHVFOYRQKLOZ-SCLBCKFNSA-N 347.415 0.939 10 20 ECCD CN(CCO)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789856220 QNINYXKNKTYJFB-UHFFFAOYSA-N 337.445 0.307 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)C2CCC2)cc1 1122462809 YVSIPKAHRGKLAQ-UHFFFAOYSA-N 330.392 0.677 10 20 ECCD O=C(CN1CCOCC1)NCCC1=CCN(c2cc(F)ncn2)CC1 1089818792 CCRWOPNCDPZGNQ-UHFFFAOYSA-N 349.410 0.591 10 20 ECCD O=C(O)C1=NO[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 1594889954 OMGBIEPEBMTNNY-HNNXBMFYSA-N 347.371 0.493 10 20 ECCD O=C(CN1CCOCC1)NCc1ccc(N2CCC(CO)CC2)cc1 156215353 JRIHGWZRIKRFHG-UHFFFAOYSA-N 347.459 0.844 10 20 ECCD C[C@H](Sc1nccs1)C(=O)c1c(N)n(C)c(=O)n(C)c1=O 52913960 ZFRRWURKOCBHOW-LURJTMIESA-N 326.403 0.486 10 20 ECCD COCCN(CC(=O)N(C)C)Cc1ccc([N+](=O)[O-])c(OC)c1O 278186756 HJMFBSQNLHKGSN-UHFFFAOYSA-N 341.364 0.846 10 20 ECCD COC(=O)COCC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 287704495 KMFDRZRMOXZQCF-UHFFFAOYSA-N 340.351 0.673 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H](C)O[C@@H](CO)C1 807096038 RNLUXVQLZBSARB-XJKSGUPXSA-N 349.431 0.285 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N(C)CCN)C2)cc1 818678228 WYWKRCQCYWFRBA-ZDUSSCGKSA-N 334.420 0.055 10 20 ECCD O=C(O)CN(CCN1CCOCC1)Cc1cc2c(cc1O)OCO2 833248526 OUZGSJJYMAOIKV-UHFFFAOYSA-N 338.360 0.340 10 20 ECCD NS(=O)(=O)c1ccc2c(c1)/C(=C/c1c[nH]c(C(=O)O)c1)C(=O)N2 833089235 NUIJBAPBLOTFBQ-KMKOMSMNSA-N 333.325 0.853 10 20 ECCD C[C@H](O)CN(C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)C1CC1 848932346 NXURKEWAGDLMDG-NSHDSACASA-N 337.395 0.880 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(CC(=O)N3CCC3)C2)cc(OC)n1 1015109968 YANOCJFULGXXAU-CYBMUJFWSA-N 348.403 0.135 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)N[C@H]2CCCN(C)C2=O)cc1 853005322 GZKGUWIWQIBGON-AWEZNQCLSA-N 349.387 0.323 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2C[C@@](C)(CO)[C@@](C)(CO)C2)cc1 859822527 RPVTWQCIBNHCHS-KDURUIRLSA-N 349.475 0.682 10 20 ECCD COc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)[nH]n1 861728109 CPGDANWHJJYTDK-UHFFFAOYSA-N 335.339 0.878 10 20 ECCD C[C@@H](NC(=O)N[C@H]1CCN(S(C)(=O)=O)C1)c1ccccc1O 868743892 NIGQWUGBVFZCMS-MNOVXSKESA-N 327.406 0.786 10 20 ECCD CNC(=O)[C@H](C)N1CC(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1032215706 MNOGGWFCSDRVKH-JTQLQIEISA-N 346.391 0.645 10 20 ECCD O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(CCn2cncn2)CC1 779520065 OATFLSABEIPMRY-RQOWECAXSA-N 343.387 0.547 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CC(=O)NC(=O)N2)N(C)C)cc1 891248920 OPRBDCXOEDNXCT-KBPBESRZSA-N 347.419 0.070 10 20 ECCD C[C@H]1CN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC(=O)N1 899098783 RVQZFSHQXWFQLT-BBRMVZONSA-N 347.463 0.885 10 20 ECCD COC(=O)[C@@H]1C[C@@H](O)CN(Cc2ccc(OC)c(OC)c2O)C1 895126039 UPVAKIPPWAQSIJ-VXGBXAGGSA-N 325.361 0.765 10 20 ECCD COc1ccc(CN[C@@H]2CCN(C(=O)Cn3cnnn3)[C@@H]2C)cc1C 985954637 IKHWCTMYRYCBSB-UKRRQHHQSA-N 344.419 0.769 10 20 ECCD CS(=O)(=O)CC(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089810619 UPYFTNWVXZEYCK-UHFFFAOYSA-N 342.396 0.303 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)C3(C(N)=O)CC3)CC2)n1 1089862194 PNNNGNXQNOUVLG-UHFFFAOYSA-N 329.404 0.693 10 20 ECCD Cn1[nH]cc2c(=NC(=O)C(=O)NCc3ccccc3O)ccnc1-2 1329047694 MTSKIVKVYUQOKY-UHFFFAOYSA-N 325.328 0.302 10 20 ECCD CC1(C)[C@@H](O)C[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 275236909 KKSDQPCCDBGATR-NEPJUHHUSA-N 328.390 0.653 10 20 ECCD C[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)[C@H]1CO 285756979 QQCMZYLLTGJCPY-GUYCJALGSA-N 345.443 0.915 10 20 ECCD C[C@@H](O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 283376279 YVFMEFVBFWUBFE-YPMHNXCESA-N 337.395 0.737 10 20 ECCD COC(=O)CN(CCN1CCN(C)CC1)Cc1cc(C)ccc1O 281402526 XQJQBGCHQGMQAJ-UHFFFAOYSA-N 335.448 0.923 10 20 ECCD CCN(C)C(=O)CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 285827492 YMNKZTBXBPCOSN-UHFFFAOYSA-N 346.431 0.280 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)N(C)C)cc2)CC1 822320712 OQLKUCUFEBZFOS-CQSZACIVSA-N 332.448 0.921 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@H]2C(=O)O)c1 820894604 YXEWTHODOWQNAZ-NSHDSACASA-N 342.373 0.843 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN[C@](C)(CC)C(=O)O)nc12 737155478 XAGROVRTKGEUFY-OAHLLOKOSA-N 336.348 0.955 10 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NOTMRRMKRNDRAP-MRXNPFEDSA-N 348.359 0.908 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H](C(=O)O)C2)c1 738164266 QRCVRHKAIZDAFS-SECBINFHSA-N 342.373 0.701 10 20 ECCD Cc1nnc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1C 733364852 REXWPHPUDVWVIS-UHFFFAOYSA-N 339.377 0.131 10 20 ECCD CN(CCCO)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 830620850 ZAJSTJXZBRIEJE-UHFFFAOYSA-N 349.431 0.105 10 20 ECCD O=C(COC(=O)c1cc(O)cs1)NC(=O)NCC(F)(F)F 731909575 FEEOFMSTDIGYQW-UHFFFAOYSA-N 326.252 0.999 10 20 ECCD O=C(NCCN1CCCS1(=O)=O)NCc1cc(Cl)ccc1O 844933394 FFALHVADGYYFNJ-UHFFFAOYSA-N 347.824 0.880 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](CN)C1CC1 842256082 JUTHWSRNRHSBBX-INIZCTEOSA-N 332.448 0.955 10 20 ECCD COc1ccc(-n2nnnc2CN2C[C@@H]3CC[C@H](C2)N3C(C)=O)cc1 1017280222 WECMBRYVRNXUOR-GASCZTMLSA-N 342.403 0.866 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CSCC(N)=O)CC2)cc1 840778829 GIFZQYBTXZJDGQ-CQSZACIVSA-N 339.461 0.397 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(Cc3nncs3)C2)cc(OC)n1 1015101303 FFOCGYLTKCGBGS-NSHDSACASA-N 349.416 0.955 10 20 ECCD O=C(c1cccc(O)c1O)N1CCN([C@H]2CCS(=O)(=O)C2)CC1 776603223 JBGFYUCWDXRKDB-NSHDSACASA-N 340.401 0.043 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N3C[C@@H]4C[C@H]3CN4)cc2)CC1 892939413 KAWOSEJWCVPORL-RDJZCZTQSA-N 329.448 0.694 10 20 ECCD COc1ccc(CNC2CC(N(C)C(=O)Cn3cnnn3)C2)cc1C 998425662 FVNSDRKXABGOOF-UHFFFAOYSA-N 344.419 0.769 10 20 ECCD COC1(CNC(=O)C(=O)N(C)Cc2ccccc2O)CCOCC1 1329109239 HKVYANLWUJISSE-UHFFFAOYSA-N 336.388 0.662 10 20 ECCD Cc1noc(CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 1321758337 GUXCVMHKPHMWKI-SNVBAGLBSA-N 331.376 0.938 10 20 ECCD CNC(=O)C1CCC(NC(=O)C(=O)N(C)Cc2ccccc2O)CC1 1321877715 NVTPGVPEWBJQCK-UHFFFAOYSA-N 347.415 0.772 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H]3CC(=O)N3)cc2)CC1 1334389646 LCIGMCFBSUJGTE-OAHLLOKOSA-N 344.415 0.250 10 20 ECCD O=C(C[C@H]1CC(=O)NC1=O)NCc1ccc(N2CCC(O)CC2)cc1 1333526122 VPPNFOLPFICHKK-ZDUSSCGKSA-N 345.399 0.317 10 20 ECCD CC(C)[C@H](N)C(=O)NCCC(=O)NCc1ccc(N(C)C)c(F)c1 1340190313 JUVSWMUYYNFWTE-INIZCTEOSA-N 338.427 0.998 10 20 ECCD Cc1ccc(C(=O)N2CC[C@@H](n3cc(C(=O)O)nn3)C2)c(O)c1O 1610483998 OFHPRLBXJDDNOH-SECBINFHSA-N 332.316 0.783 10 20 ECCD O=C(O)CN1CCCC[C@@H](NC(=O)c2c(F)ccc(O)c2O)C1=O 1574723403 HANRFWVUSFHRTQ-SECBINFHSA-N 340.307 0.432 10 20 ECCD COC(=O)CCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 55092080 CBWRADOJSMESGN-UHFFFAOYSA-N 330.362 0.447 10 20 ECCD CN1C(=O)C(=CNCCCn2cnc3ccccc32)C(=O)N(C)C1=O 52529254 QXOVIDREBQWNAD-UHFFFAOYSA-N 341.371 0.950 10 20 ECCD CCCOc1ccc(CN2CCN3C(=O)C(=O)NC[C@H]3C2)c(O)c1 271276526 OMDXWYSMWPNQEN-ZDUSSCGKSA-N 333.388 0.324 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCSC1 283943708 HNDKKQTVINXGSM-CQSZACIVSA-N 349.456 0.761 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC1CCOCC1 284137644 QPRXDPHFXWIXNX-UHFFFAOYSA-N 329.400 0.974 10 20 ECCD CCN1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 288490063 INEQQUTYAHIKOH-UHFFFAOYSA-N 342.443 0.843 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](C(=O)O)C3)nc12 818229380 NGTJTFNWTIFBEV-VIFPVBQESA-N 334.332 0.518 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N(C)C[C@H](C)O 817860898 YSWLTBXWYVONPX-KGLIPLIRSA-N 335.448 0.947 10 20 ECCD C[C@H](OC(=O)c1cc(O)cs1)C(=O)N1CCC(C(N)=O)CC1 732353493 RGJUINFJOOSBPG-QMMMGPOBSA-N 326.374 0.723 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)C3=NNC(=O)C3)cc2F)CC1 732289869 YILBMHVOLSYXOV-UHFFFAOYSA-N 347.394 0.460 10 20 ECCD C[C@@H](NC(=O)NCC(=O)N1CCNCC1)c1ccc(N(C)C)cc1 841883230 SUUXXBYTTCTNIG-CYBMUJFWSA-N 333.436 0.545 10 20 ECCD C[C@@H](CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)C(=O)O 848607983 NLPQYIMNLISMPZ-NSHDSACASA-N 333.388 0.522 10 20 ECCD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H]2CCN(S(C)(=O)=O)C2)c1 846185755 DDBLUAWOJOAOQZ-ZYHUDNBSSA-N 342.417 0.863 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)N[C@@H]2COC(=O)C2)N(C)C)cc1 1119978266 ZISVBJBRKAZDLY-DZGCQCFKSA-N 334.420 0.970 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)N(C)C)CC2)cc1 874242966 KTMVNGSFAXOZOQ-OAHLLOKOSA-N 334.464 0.884 10 20 ECCD O=C(NCc1ccc(O)c(O)c1)c1cnc2nc(O)nc(O)c2c1 778926172 SXUMBWCLBJHEKD-UHFFFAOYSA-N 328.284 0.777 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1(CN)CC(O)C1 1121980385 AFLFQYZLSNTFBN-UHFFFAOYSA-N 333.432 0.581 10 20 ECCD C[C@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)n1cncn1 881849915 LRUVZYCBKJUSHO-CQSZACIVSA-N 328.420 0.907 10 20 ECCD COc1ccc(CN[C@H](C)[C@@H]2CN(C(=O)C(N)=O)CCO2)cc1C 979352289 BKPBTZDNQGMPRG-DOMZBBRYSA-N 335.404 0.194 10 20 ECCD NC(=O)C(=O)NCCC1=CCN(c2ccc([N+](=O)[O-])cc2F)CC1 1089861848 HNCHBGZUWSBGRP-UHFFFAOYSA-N 336.323 0.862 10 20 ECCD CC(C)(C(N)=O)C(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089848931 PZLTVPVDASFFCV-UHFFFAOYSA-N 335.383 0.770 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1ncn2nccc2c1=O 1322757023 KNKAUTCGINRELW-UHFFFAOYSA-N 340.387 0.616 10 20 ECCD COC(=O)[C@@H]1C[C@@H](O)CN1Cc1ccc(N2CCN(C)CC2)cc1 1337239482 OZJYYKSUKSLDRY-SJORKVTESA-N 333.432 0.547 10 20 ECCD CC[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)O 1605100587 QTGBDZJLMIOGTD-CQSZACIVSA-N 326.418 0.874 10 20 ECCD CCOc1ccc(N2CCN(C(=O)CN3CCNCC3)CC2)cc1 1578181588 JPZFXEXNYOZNFV-UHFFFAOYSA-N 332.448 0.639 10 20 ECCD CC(C)(C)OC(=O)N(CCN)CC(=O)NCc1cccc(O)c1O 1575163704 WTSPCVNNBIUNJN-UHFFFAOYSA-N 339.392 0.910 10 20 ECCD CNCCCC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249706 NVKVTOOIVWEYIK-UHFFFAOYSA-N 348.403 0.309 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCN3)CC2)cc1 269314260 YMBAQNDQDLLCHP-KRWDZBQOSA-N 332.448 0.685 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)CCNC(=O)[C@H]1CCCN1 354751681 QLBRXSZLOONIFP-CQSZACIVSA-N 346.431 0.736 10 20 ECCD COc1ccc(N2CCN(C(=O)C[C@H]3COCCN3)CC2)cc1F 367645007 WKNROJOOXPSISU-ZDUSSCGKSA-N 337.395 0.861 10 20 ECCD CC(=O)C(=O)COC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1 808492170 XUPFWWMDIVNMGI-UHFFFAOYSA-N 325.342 0.442 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)S(=O)(=O)N(C)C 816822887 ZDOYUTLJDAPWIZ-UHFFFAOYSA-N 342.465 0.449 10 20 ECCD C[C@@H]1C[C@H](CN)CN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 817991261 OFIGJRUCCWDLIM-UKRRQHHQSA-N 332.448 0.907 10 20 ECCD CN1C(=O)CC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 826531032 OQNRZILMLWSENV-MRXNPFEDSA-N 331.416 0.885 10 20 ECCD CS(=O)(=O)N1CC(C(=O)NCc2ccc(N3CCCC3)cc2)C1 900187655 ISDMLIHRZXRZPY-UHFFFAOYSA-N 337.445 0.794 10 20 ECCD CCO[C@@H]1COC[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 837093368 ZMHFGIPNSHFKTP-DGCLKSJQSA-N 344.389 0.297 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)[C@@H]2CCCN(C(N)=O)C2)cc1 843296703 DVUWZOBVWLNEFB-UKRRQHHQSA-N 333.436 0.659 10 20 ECCD CC(C)[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1 856488904 HABUPKAEAPZGPM-CYBMUJFWSA-N 341.433 0.834 10 20 ECCD COc1ccc(CNC(=O)[C@H]2CC(=O)N(c3cnn(C)c3)C2)c(O)c1 861490109 PQNRWHBCVBGJHR-LBPRGKRZSA-N 344.371 0.804 10 20 ECCD CN(C(=O)CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)c1ccc(N)cc1 877077656 QJZPDDDRPHQLRS-VDERGJSUSA-N 343.383 0.784 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCCN(C(=O)C(N)=O)C2)cc1 951860858 QHIJWEBAIXLIAJ-LLVKDONJSA-N 346.347 0.055 10 20 ECCD COc1ccc(CNCCNC(=O)c2c[nH]c(C(N)=O)c2)cc1C 1151179627 YRZKUKSYDPNSSC-UHFFFAOYSA-N 330.388 0.950 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC([C@@H]3CCOC3)C2)cc1 1321593935 QUJFAZVMGCXOAG-CQSZACIVSA-N 331.416 0.864 10 20 ECCD COC[C@@H](C)NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 1326184519 YTBQYANIIQSAID-CYBMUJFWSA-N 349.431 0.931 10 20 ECCD O=C(Nc1cccc2nsnc12)C1=S=C(c2nn[nH]n2)C=C1 1606938645 XXEYEVCGYVNHDG-UHFFFAOYSA-N 329.370 0.839 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)c2cn(CC(=O)O)nn2)cc1 1574217023 JFAKAPFOPFPKIV-UHFFFAOYSA-N 347.375 0.580 10 20 ECCD CO[C@@H](C)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1846402778 DHNAKLUUUXTFAY-JTQLQIEISA-N 335.360 0.345 10 20 ECCD C[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCOCC2)cc1 106543252 JHWATSGGJRKYAY-ZDUSSCGKSA-N 332.404 0.553 10 20 ECCD O=C1C[C@@H](NCc2cc(F)ccc2O)CN1CCN1CCOCC1 180924324 KVBRUYKOLGDNLV-OAHLLOKOSA-N 337.395 0.554 10 20 ECCD Cc1c(CNC(=O)C(=O)N2CCN[C@H](C)C2)n(C)c2ccccc12 419706063 JRDSYZIUYQODNF-GFCCVEGCSA-N 328.416 0.923 10 20 ECCD NC[C@H]1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)CCO1 274779189 LAEORCOWLJWYAW-ZVVFDCPKSA-N 331.416 0.723 10 20 ECCD Cc1ccc(C(=O)N2CCC(N3CCC[C@@H]3C(N)=O)CC2)c(O)c1O 368436806 ZPIXVKLTDJKKFR-CQSZACIVSA-N 347.415 0.961 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ncc[nH]1 822759602 UTAGSLLRLNVEDD-UHFFFAOYSA-N 334.401 0.575 10 20 ECCD CCN1C[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)CC1=O 836247632 AYLXSBYPSXKUMX-OAHLLOKOSA-N 346.431 0.943 10 20 ECCD Cc1nc2nc(N)nn2c(C)c1CC(=O)NCCc1ccc(N)cc1 832653018 PBNGUFOIJLIFJR-UHFFFAOYSA-N 339.403 0.807 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3nc(C)no3)nc12 847094695 YAQWJWFSCDDBJF-UHFFFAOYSA-N 346.347 0.935 10 20 ECCD COc1ccc(-n2nnnc2CN2CC[C@H](N(C)C(C)=O)C2)cc1 1032853785 VGJDGWXKLMPDDJ-AWEZNQCLSA-N 330.392 0.724 10 20 ECCD COc1cccc(O)c1CN1CCN(C(=O)C(=O)N2CCCC2)CC1 768862048 SNXSOUTVBOALBN-UHFFFAOYSA-N 347.415 0.667 10 20 ECCD NC(=O)C1=NO[C@@H](CNCc2c(O)cccc2Br)C1 1118804703 OVQMFKBZAROGOT-SSDOTTSWSA-N 328.166 0.875 10 20 ECCD COc1ccc(N2CCN(S(=O)(=O)N3CCC3)CC2)c(OC)c1 867731971 UTAVDSNFNGLQBT-UHFFFAOYSA-N 341.433 0.776 10 20 ECCD COC(=O)[C@@H]1COCCN1Cc1ccc(N2CCN(C)CC2)cc1 775695386 WXNHVFCZEVZYBI-KRWDZBQOSA-N 333.432 0.812 10 20 ECCD Nc1ccc(CNC(=O)N[C@H]2CCN(C3CCOCC3)C2=O)cc1 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344.433 0.923 10 20 ECCD NC(=O)CNC(=O)c1ccc(NC(=O)c2cccc(O)c2O)cc1 790597971 HZNBKSXPLLDJJA-UHFFFAOYSA-N 329.312 0.565 10 20 ECCD CC1=c2c(=N)nc(C)[nH]c2=S=C1C(=O)Nc1cccc2nonc12 1140445910 QRRUKYOHCGZSSR-UHFFFAOYSA-N 340.368 0.713 10 20 ECCD O=C(NCCC1=CCN(c2ccc3nnnn3n2)CC1)c1ccc[nH]1 1089813540 UBRXACNAXJSLHS-UHFFFAOYSA-N 338.375 0.804 10 20 ECCD CC(C)C(=O)NCCCNC(=O)C(=O)NCc1ccc(N(C)C)cc1 1261170386 KFRLRWYZKRULCC-UHFFFAOYSA-N 348.447 0.647 10 20 ECCD COC[C@@H](C)OC[C@H](O)CN(C)c1ccc(OCC(=O)O)cc1 1777181541 XHQXQDQADUDSPV-TZMCWYRMSA-N 327.377 0.999 10 20 ECCD C[C@@H](C(=O)c1c(N)n(C)c(=O)n(C)c1=O)N(C)Cc1ccccc1O 109771866 VZPZXTBCNQYCNK-JTQLQIEISA-N 346.387 0.075 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCN2CCCCC2)c1 55254903 DFBCNRSTSUPFAH-UHFFFAOYSA-N 341.433 0.979 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3cnn(C)c3)nc12 79866619 PUSORYNLOCUAJN-UHFFFAOYSA-N 344.375 0.977 10 20 ECCD C[C@@H](NC(=O)Cn1cccnc1=O)c1ccc(N2CCOCC2)cc1 148480423 ZKLFFIRBXMWTCI-CQSZACIVSA-N 342.399 0.957 10 20 ECCD COc1ccc(N2CCN(C(=O)CN(C)[C@@H](C)C(=O)O)CC2)cc1 269306694 ULNHVAQYDHDKIW-ZDUSSCGKSA-N 335.404 0.749 10 20 ECCD NC(=O)[C@H]1COCCN1C(=O)/C=C/c1ccc(N2CCOCC2)cc1 271425114 NXARDLLODNNNLN-WUTVXBCWSA-N 345.399 0.249 10 20 ECCD Cc1ccc(C(=O)N2C[C@@H](CO)[C@H](c3cnn(C)c3)C2)c(O)c1O 278117992 LKMLOMCBCFAIQL-JSGCOSHPSA-N 331.372 0.988 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)CCNC(=O)[C@H]2CCCN2)c1 828668000 XQHXHFJYPYQFDQ-SMDDNHRTSA-N 335.404 0.836 10 20 ECCD CC[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)C(=O)NC 836250866 YQYBYJFQRVXSAO-OAHLLOKOSA-N 334.420 0.847 10 20 ECCD O[C@H](CNCc1ccc(N2CCOCC2)cc1)C[C@@]1(O)CCOC1 905062747 NZQYVCONLPSTLO-ROUUACIJSA-N 336.432 0.515 10 20 ECCD CC(C)CS(=O)(=O)CC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832273849 QYRFJIAVSQRTIW-OAHLLOKOSA-N 341.477 0.939 10 20 ECCD COc1ccc(CN[C@@H]2CCCN(C(=O)[C@@H]3CNC(=O)N3)C2)cc1C 1000049000 MFMJHUMSCYHYIS-CABCVRRESA-N 346.431 0.766 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CC[C@H](CN)C2)cc1F 842148314 MCSMHXKZMCZPPZ-AAEUAGOBSA-N 336.411 0.752 10 20 ECCD CCn1ncc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 850356225 QOBPSCGDUGUJTN-UHFFFAOYSA-N 349.460 0.823 10 20 ECCD COc1ccc(N2CCC(NC(=O)C(=O)N(C)CCCN)CC2)cc1 851685943 IFSXHZYQMKQTEH-UHFFFAOYSA-N 348.447 0.587 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCN(C)[C@@H](C)C3)CC2)cc1 761079257 SAWDLOLWTFSTEA-INIZCTEOSA-N 346.475 0.980 10 20 ECCD NC(=O)NC1(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1 767545811 BDZATOOSOCXOSY-UHFFFAOYSA-N 346.431 0.712 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CCO)C2CC2)c1 764699251 ICKGIDAMWUMNTC-GFCCVEGCSA-N 328.390 0.655 10 20 ECCD NS(=O)(=O)C[C@@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 779515319 RJPOXCNQVQFDNB-TXNVCOODSA-N 340.401 0.638 10 20 ECCD CN1CCN(c2ccc(CN(C)CCS(C)(=O)=O)cc2)CC1 775651075 KHPDQVTVYGGNQY-UHFFFAOYSA-N 325.478 0.915 10 20 ECCD CCn1[nH]nnc1=NC(=O)NC1CCN(c2ccc(OC)cc2)CC1 888339525 FRRJLYYCFMQTDI-UHFFFAOYSA-N 345.407 0.914 10 20 ECCD O=C1NC(=O)N2CCN(Cc3ccc(N4CCOCC4)c(F)c3)C[C@H]12 779432586 HASMNPXDQKNZOV-OAHLLOKOSA-N 348.378 0.398 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)OC)CC2)cc1 778224062 PTDNMEAHSAEFPQ-CMDGGOBGSA-N 333.388 0.920 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCC(=O)NC2)N(C)C)cc1 891255946 SZUZKOZBQIUVOV-HOCLYGCPSA-N 332.448 0.998 10 20 ECCD COCCC(=O)NCCCNCc1nnnn1-c1ccc(OC)cc1 1154028861 ZOTQHXBJVJSUFX-UHFFFAOYSA-N 348.407 0.303 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@]3(C)CNC(=O)C3)CC2)ncn1 1089851427 QIMVJWXVOHIPOW-SFHVURJKSA-N 343.431 0.954 10 20 ECCD CCN1CC(N2C[C@H](NC(=O)c3cc(OC)nc(OC)c3)CC2=O)C1 1094756594 XEZXYODIDVXIDY-GFCCVEGCSA-N 348.403 0.134 10 20 ECCD CC(C)N1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1=O 1327318762 LZOHLWDHZLKYFI-CQSZACIVSA-N 346.431 0.494 10 20 ECCD COc1ccc(CNC(=O)c2cc(-c3nn[nH]n3)cn2C)c(O)c1 1609355545 OIPZYPRESPVKPZ-UHFFFAOYSA-N 328.332 0.849 10 20 ECCD O=C(O)/C=C/c1ccc(N2CCN3C[C@H](O)C[C@H]3C2)c([N+](=O)[O-])c1 1608660872 DVZXEVXJGKFTHZ-YLGNMVSYSA-N 333.344 0.948 10 20 ECCD COc1ccc(O)c(CNC(=O)NCCn2cc(C(=O)O)nn2)c1 1610344750 UDQYTDDAWIOMMY-UHFFFAOYSA-N 335.320 0.190 10 20 ECCD CCN(CC)C(=O)c1ccc(NC=C2C(=O)NC(=S)NC2=O)cc1 60864542 BJSXWJQOJGIFHB-UHFFFAOYSA-N 346.412 0.995 10 20 ECCD C[C@@H](O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 283255208 QQHJLKUFCORGSO-CZUORRHYSA-N 345.443 0.915 10 20 ECCD C[C@H]1CN(C[C@@H](C)O)CCN1CC(=O)NCc1ccc(N(C)C)cc1 299484432 ZRNVLDBTTMGMBW-JKSUJKDBSA-N 348.491 0.756 10 20 ECCD CS(=O)(=O)NC1CCN(Cc2cc3c(cc2O)OCO3)CC1 813147785 BBGIPLVELXIKPO-UHFFFAOYSA-N 328.390 0.635 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)CCN1CC(C)(C)O 841095771 KUMKIQFSOGZYEW-GFCCVEGCSA-N 334.420 0.511 10 20 ECCD C[C@@H](NC(=O)C(=O)NCC(F)(F)CN)c1ccc(N(C)C)cc1 842203831 XKGLODFDCOCVTR-SNVBAGLBSA-N 328.363 0.640 10 20 ECCD CS(=O)(=O)NC[C@H]1COCCN1C(=O)Nc1ccc(N)cc1 859698539 YONXYMUQBQMIGJ-LBPRGKRZSA-N 328.394 0.051 10 20 ECCD COc1ccc(N2CCCN(C(=O)c3nnc(O)nc3O)CC2)cc1 765474525 RUDMSQYYMVYARK-UHFFFAOYSA-N 345.359 0.644 10 20 ECCD CCN(CCN)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 861786547 LNHRMWJPGXVOTI-UHFFFAOYSA-N 348.447 0.071 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CN(CCCO)C[C@H]2O)cc1 958732507 NYWUVVIJKRFLLN-GXTWGEPZSA-N 349.391 0.254 10 20 ECCD Cc1nonc1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788940593 XXJYVPKWBPWLLW-UHFFFAOYSA-N 343.387 0.911 10 20 ECCD COC(=O)[C@H]1[C@H](O)CCCN1Cc1ccc(OC)c(OC)c1O 893868945 XRSUNPRANNQLHG-DGCLKSJQSA-N 325.361 0.908 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H]2CCC[C@]2(CN)C1 1328813997 OYLYEMWIABNTEA-KSSFIOAISA-N 331.416 0.938 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)CO 1346465228 ZDLGTHBHDNIDGN-NSHDSACASA-N 325.361 0.707 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2C[C@@H]3C[C@]3(C(=O)O)C2)cc1 1606053895 GAVHHKSKDKUIFI-VBHSOAQHSA-N 345.399 0.738 10 20 ECCD C[C@@H](N[C@H]1CCC(=O)N(C)C1=O)c1cccc(-c2nn[nH]n2)c1O 1589955929 NRAMLRIPLYOOAI-KCJUWKMLSA-N 330.348 0.370 10 20 ECCD NC(=O)[C@@H]1CC[C@@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)O1 276497217 VZRLCLVMPIMTRD-KBMXLJTQSA-N 348.399 0.933 10 20 ECCD C/C=C/C[C@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 274591577 JGRJSPOBPRCYFK-PGLGOXFNSA-N 328.390 0.821 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N(CCO)CC(F)F)cc1F 285710674 MEZRETMJZWRESZ-UHFFFAOYSA-N 347.337 0.594 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cn(C)nn1 291726500 RLRGCOOCLZINEQ-UHFFFAOYSA-N 338.751 0.990 10 20 ECCD C[C@@H](CCN1CCN(C)CC1)NC(=O)c1c(F)ccc(O)c1O 294997808 NWHDTEHWKFNYOE-NSHDSACASA-N 325.384 0.993 10 20 ECCD Cc1onc(CC(=O)NCc2ccc(O)c(O)c2)c1-c1nn[nH]n1 826348190 ZNCCIXIOTOEORO-UHFFFAOYSA-N 330.304 0.433 10 20 ECCD CN1CCC[C@@H](CN(C)C(=O)C(=O)NCCc2ccc(N)cc2)C1 842235157 DQGRFMFBLWMFSW-OAHLLOKOSA-N 332.448 0.728 10 20 ECCD CS(=O)(=O)N1CCC(NC(=O)CSc2nccs2)CC1 918011075 PAUQUYWCKBPONN-UHFFFAOYSA-N 335.476 0.775 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(Cc3cnsn3)C2)cc(OC)n1 1015101394 GFZQEZJOUBLVDO-LLVKDONJSA-N 349.416 0.955 10 20 ECCD COCC(=O)N(C)CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 758721389 IXRMOQMXJYYJEM-CQSZACIVSA-N 349.431 0.805 10 20 ECCD CCCN1CC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 856073369 OHORSKTXLGSJAL-GFCCVEGCSA-N 341.433 0.978 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NCc3ncccn3)C2)cc(OC)n1 1022368287 SXCZCVPJCBIPBE-BETUJISGSA-N 343.387 0.939 10 20 ECCD CCN(CCN)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 861565782 ZWKQQNZXTANJTQ-OAHLLOKOSA-N 347.463 0.879 10 20 ECCD COc1ccc(CN[C@H]2C[C@H](NC(=O)[C@@H]3CN(C)C(=O)N3)C2)cc1C 1020471002 SQFUTYDNUFNQDD-KKUMJFAQSA-N 346.431 0.764 10 20 ECCD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1cc(C)ccc1O 768160017 KTBVPGRKGJPBAS-CQSZACIVSA-N 340.445 0.826 10 20 ECCD O=C(Cc1nc2ncccn2n1)OCC(=O)c1ccc(O)c(O)c1 782883869 LVEUGYBITYTBIT-UHFFFAOYSA-N 328.284 0.504 10 20 ECCD Cn1cc(/C=C/C(=O)N2CCc3ccc(S(N)(=O)=O)cc32)cn1 118654604 MGSHHKYKKSUTEX-GORDUTHDSA-N 332.385 0.670 10 20 ECCD CN(CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 66923863 LWCHKLKDHNYXGP-UHFFFAOYSA-N 327.406 0.588 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](CO)C3)nc12 267154108 NPOKPYFIPBCSTJ-NSHDSACASA-N 334.376 0.816 10 20 ECCD O=C(Nc1ccnn1[C@@H]1CCS(=O)(=O)C1)c1cccc(O)c1O 275082945 FEBFXXVGSWBUQX-SECBINFHSA-N 337.357 0.906 10 20 ECCD COC(=O)[C@H](C)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 281934166 WDZXUBJZHJEDHU-QMMMGPOBSA-N 330.362 0.397 10 20 ECCD CCn1ncnc1CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807673964 CUGLULLQCZCBTO-GFCCVEGCSA-N 344.419 0.858 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)NC[C@@H](C)N)C2)cc1 818676400 NMROYVNRYSJGMB-CHWSQXEVSA-N 334.420 0.101 10 20 ECCD C[C@@H](CC(=O)O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 820084637 NPPPQGMEJFEXLZ-LBPRGKRZSA-N 326.418 0.874 10 20 ECCD COc1ccc(N2CCC(NC(=O)[C@H]3OCCN(C)C3=O)CC2)cc1 900508276 LTCIABWRFNEHJU-MRXNPFEDSA-N 347.415 0.637 10 20 ECCD COC(=O)C[C@@H]1COCCN1CC(=O)NCc1ccc(N(C)C)cc1 839604311 MANDHCQNDSDPQL-MRXNPFEDSA-N 349.431 0.633 10 20 ECCD CN(C)c1ccc(CNC(=O)CN(C)[C@@H]2CCCCNC2=O)cc1 839481608 RUJZNFMFSBYKAB-MRXNPFEDSA-N 332.448 0.969 10 20 ECCD CN(C)c1ccc(CNC(=O)c2cn(C)c(=O)n(C)c2=O)cc1F 735008137 SMVZNGDSGIUKFQ-UHFFFAOYSA-N 334.351 0.219 10 20 ECCD C[C@H](NC(=O)NC[C@H](O)Cn1ccnn1)c1ccc(N(C)C)cc1 838560840 ZQXJTADMDCAOOC-WFASDCNBSA-N 332.408 0.765 10 20 ECCD 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ECCD COc1ccc(-n2nnnc2CNCCNC(=O)[C@H]2CCCO2)cc1 1123117088 BVWCLZIMYIWNQW-CQSZACIVSA-N 346.391 0.056 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)C(=O)NCC3CC3)CC2)nn1 1089840413 PMKHDMVXGWWTKU-UHFFFAOYSA-N 343.431 0.954 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnsn1 1325382395 NFHHQXAIICJPIX-VIFPVBQESA-N 337.357 0.854 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1C[C@@H](C(=O)O)C1 1337168841 CSUAGGCINGJNKL-OKILXGFUSA-N 345.399 0.882 10 20 ECCD Oc1c(F)cc(Cl)cc1CNCCn1cnc(-c2nn[nH]n2)n1 1609611342 ZEFZHCFUSDTZND-UHFFFAOYSA-N 338.734 0.746 10 20 ECCD CSCC[C@H](NC(N)=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 273138637 DJGMWLUUTCBXGT-KOLCDFICSA-N 341.433 0.935 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)[C@@H](C)N)CC2)cc1 276948887 DLVZCIOSSBIPMA-LSDHHAIUSA-N 334.464 0.917 10 20 ECCD C[C@@H](O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 283223217 OOSFHCRQCRPNPN-GDBMZVCRSA-N 343.427 0.908 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N=c1ccnc2n(C)[nH]cc1-2 806855586 RXAUFHSLCICIKH-UHFFFAOYSA-N 339.355 0.645 10 20 ECCD 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ECCD COCCS(=O)(=O)CC(=O)N1CCOc2cc(N(C)C)ccc21 266360704 RSYYRSPPSGQBFG-UHFFFAOYSA-N 342.417 0.539 10 20 ECCD C[C@@H](C[S@](C)=O)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 273117864 DJDONJJIIHBWKU-FHZGZLOMSA-N 334.419 0.261 10 20 ECCD CO[C@@H](CN)CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 278231366 KKVWDHMAZHFFIB-CQSZACIVSA-N 339.411 0.767 10 20 ECCD CCOC(=O)CN(Cc1cn(CC(N)=O)nn1)Cc1ccccc1O 822512236 YOKAKGIHYJJHOV-UHFFFAOYSA-N 347.375 0.034 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H]3C(N)=O)nc12 831852541 CQZRHCRNCIKNFM-LLVKDONJSA-N 333.348 0.061 10 20 ECCD O=C1CC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CN1 919970525 ISCUXUPGPIGJDL-CYBMUJFWSA-N 349.406 0.929 10 20 ECCD CCO[C@H]1C[C@@](O)(CNC(=O)C(=O)Nc2ccc(N)cc2)C1(C)C 841115023 XQEDFQBIFKVFNK-SUMWQHHRSA-N 335.404 0.890 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N(C)[C@@H](C)CN 842071230 WYOBQMYADCASMS-KBPBESRZSA-N 334.464 0.914 10 20 ECCD CCS(=O)(=O)NCCCOC(=O)/C=C\c1ccc(O)c(O)c1 759578702 IXPBRWRUBOIBIU-ALCCZGGFSA-N 329.374 0.984 10 20 ECCD COC(=O)COCCNC(=O)N[C@@H](C)c1cc(OC)ccc1O 858833443 KDXPFSOZOYNYJZ-JTQLQIEISA-N 326.349 0.951 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1COCCN1 861802286 IFJQHYATVYXHKQ-HNNXBMFYSA-N 349.431 0.626 10 20 ECCD COc1cccc(CNC(=O)C(=O)Nc2c3c(nn2C)CCC3)c1O 761959634 FEFGAQAZJZUOLC-UHFFFAOYSA-N 344.371 0.878 10 20 ECCD Cc1cc(C(=O)N[C@@H]2CC(=O)N(C)C2=O)c(C)n1-c1ccccn1 773660529 ZAJOFHKZLODGNG-CYBMUJFWSA-N 326.356 0.976 10 20 ECCD CO[C@@H](CN)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 884194880 UVTCRGBBJCSJHM-HNNXBMFYSA-N 325.384 0.377 10 20 ECCD CCN(C(=O)c1ccc(N=NC(N)=O)cc1)C1CN(CC(=O)NC)C1 957442852 JGGCIQYRTIIPHF-UHFFFAOYSA-N 346.391 0.741 10 20 ECCD CCCOCC(=O)NCCNCc1nnnn1-c1ccc(OC)cc1 1124449922 QBOONRSJPXGBGE-UHFFFAOYSA-N 348.407 0.303 10 20 ECCD CCN1CCOC[C@@H]1C(=O)NCCNCc1ccc(OC)c(C)c1 1130614598 BBKGLEQGIGOFJV-MRXNPFEDSA-N 335.448 0.930 10 20 ECCD CCOc1ccc(N2CCN(CCNS(C)(=O)=O)CC2)cc1 1319611657 HEXXKFMPNLXURM-UHFFFAOYSA-N 327.450 0.757 10 20 ECCD C[C@@H](NC(=O)C(=O)N[C@@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 1329304810 XLNPLWMEEPSVBD-DGCLKSJQSA-N 332.404 0.277 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1 1323750444 DPCNVEHTSDPERF-HUUCEWRRSA-N 347.415 0.330 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(CC(F)F)C1 1329019423 KQKDFCSNKWSHKE-LBPRGKRZSA-N 341.358 0.806 10 20 ECCD COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H](C)OC)CC2)cc1 1334060771 HSYDYUVADLRHTM-CYBMUJFWSA-N 349.431 0.931 10 20 ECCD Cn1cc(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)nn1 1333675184 QQGYSGHSAPCDQY-UHFFFAOYSA-N 344.419 0.776 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)N[C@H]2CCOC2=O)N(C)C)cc1 1521088900 QTKWFLDMNDCOLD-GJZGRUSLSA-N 334.420 0.970 10 20 ECCD COc1cc(N2CCN(C(=O)CON)CC2)cc(OC)c1OC 1579160211 LWJNJXMYKQNVSJ-UHFFFAOYSA-N 325.365 0.251 10 20 ECCD C[C@@]1(C(=O)O)CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 1593765283 PSFPHWVGNPGIHS-QGZVFWFLSA-N 333.388 0.641 10 20 ECCD CN(CCN1CCOCC1)CC(=O)N(C)Cc1ccc(N(C)C)cc1 78671246 LVFHUKZOQOPYBQ-UHFFFAOYSA-N 348.491 0.975 10 20 ECCD CN1CCN(C(=O)CCNC(=O)N(C)Cc2ccccc2O)CC1 193421717 KSPFVOMUMIDROS-UHFFFAOYSA-N 334.420 0.698 10 20 ECCD COC(=O)C[C@H]1C(=O)NCCN1Cc1cc(OC)c(OC)cc1O 271827738 QEUQKOYWIMWWLC-NSHDSACASA-N 338.360 0.273 10 20 ECCD CNS(=O)(=O)NC1CCN(Cc2cc(OC)ccc2O)CC1 291654311 UUQKCKGKNOYBHT-UHFFFAOYSA-N 329.422 0.419 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H](C)N1 817919443 SOCNOBNABZWRKZ-KBPBESRZSA-N 332.448 0.920 10 20 ECCD COC(=O)C[C@H](N)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 826030760 NUFCAMGYILCFNS-HNNXBMFYSA-N 335.404 0.372 10 20 ECCD CCC(=O)N[C@@H]1CCN(Cc2nnnn2-c2ccc(OC)cc2)C1 1009816214 PQVRWCNFGPUDMB-GFCCVEGCSA-N 330.392 0.771 10 20 ECCD NC(=O)CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918117551 NUHIJSZGXOIVEA-CYBMUJFWSA-N 347.419 0.063 10 20 ECCD COc1ccc(N2CCCN(C(=O)CS(C)(=O)=O)CC2)cc1 919691290 JQFRFFVBMLYSFW-UHFFFAOYSA-N 326.418 0.779 10 20 ECCD CCN1C[C@@H](C)N(C(=O)C(=O)NCCc2ccc(N)cc2)C[C@@H]1C 842242630 UFYVBHXCKLVCBK-UONOGXRCSA-N 332.448 0.869 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@@H](N)C3)ccc21 842150690 VSMIVEYGCUBTAA-OAHLLOKOSA-N 330.432 0.635 10 20 ECCD C[C@H](NCC(=O)N1CCNC1=O)c1ccc(N2CCOCC2)cc1 775253993 FDVFLAGOQBWQJI-ZDUSSCGKSA-N 332.404 0.726 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@H](CO)C1 774207641 NKZZWLMWNGDCDA-AWEZNQCLSA-N 333.432 0.908 10 20 ECCD COc1ccc(CNCCNC(=O)C2CS(=O)(=O)C2)cc1C 1128104480 LTDKRPZLLPVACX-UHFFFAOYSA-N 326.418 0.254 10 20 ECCD NC(=O)CCCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 787112298 RLXDWEULRDJZPZ-AWEZNQCLSA-N 346.431 0.660 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2[C@H]3CN(CCCO)C[C@H]23)cc1 962968142 ACBJVEWDOUKIGP-STQMWFEESA-N 331.376 0.891 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)Cn3cc(C)nn3)CC2)cc1 899901033 AVPJLRHYQVTJEA-MRXNPFEDSA-N 331.420 0.778 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)Cn3ncnn3)[C@H]2C)cc1C 986290953 SISCPPRZZJCXRJ-ZFWWWQNUSA-N 344.419 0.769 10 20 ECCD CNC(=O)CCCNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 1321727981 NPGGQBYXJYBPSQ-UHFFFAOYSA-N 334.420 0.320 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)NC[C@H]2COCCO2)cc1 1335925130 UNWOFQSRCUGYPF-AWEZNQCLSA-N 338.360 0.118 10 20 ECCD O=C(O)CC1(NC(=O)c2cc(O)cs2)CCS(=O)(=O)CC1 1608685425 RDZPIKPEVURIQO-UHFFFAOYSA-N 333.387 0.606 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CC(C(=O)O)=NO2)N(C)C)cc1 1604083582 QRHXSGSMRFFYRH-CABCVRRESA-N 348.403 0.701 10 20 ECCD O=S(=O)(NCc1ccc(O)cc1O)c1ccccc1-c1nn[nH]n1 1582797007 ASOIWCFQUXIGBH-UHFFFAOYSA-N 347.356 0.756 10 20 ECCD O=C(Cc1ccc(-n2cnnn2)cc1)NCCc1ccc(O)c(O)c1 156590119 AGRQBDDWQYZPQJ-UHFFFAOYSA-N 339.355 0.975 10 20 ECCD COCCn1cc(S(=O)(=O)NCc2cccc(OC)c2O)cn1 269783410 LCBHOLAXBVXUCK-UHFFFAOYSA-N 341.389 0.722 10 20 ECCD COC(=O)c1ccc(O)c([C@H](C)NCCN2CCN(C(C)=O)CC2)c1 273386030 JNXCRAPMKZIXDU-ZDUSSCGKSA-N 349.431 0.994 10 20 ECCD C[C@@H](C[S@](C)=O)NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 285620597 DJQSWDJQKMRKKY-VCGICTTQSA-N 343.424 0.391 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CCNCC3)C2)cc1 818677991 VUGJYCFGPMGYAA-AWEZNQCLSA-N 346.431 0.070 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)c1nnc(O)nc1O 819697734 ZUQAJEXQYPYIBJ-UHFFFAOYSA-N 348.315 0.194 10 20 ECCD CCN(CC)S(=O)(=O)N1CCN(C(=O)c2cc(O)cs2)CC1 731866082 FIVDHRQIQUIYSX-UHFFFAOYSA-N 347.462 0.798 10 20 ECCD C[C@@H]1OC(=O)N[C@@H]1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 918852476 OXDSOQXXPIMZCW-WFASDCNBSA-N 332.404 0.552 10 20 ECCD CCNCCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 842233171 ZGICLXRQQRURKP-UHFFFAOYSA-N 348.447 0.207 10 20 ECCD COC(=O)CCN(C)S(=O)(=O)N[C@@H](C)c1cc(OC)ccc1O 751318744 PUKAXAQVHSNXRJ-JTQLQIEISA-N 346.405 0.791 10 20 ECCD CNC[C@H](C)NC(=O)C(=O)N(C)CCN(C)c1ccc(OC)cc1 851690790 BKFPMRBXBXAHCC-ZDUSSCGKSA-N 336.436 0.314 10 20 ECCD COc1ccc(N2CCC(NC(=O)C[C@@H]3CC(=O)NC3=O)CC2)cc1 931578521 XXPRREHDWTVPSS-GFCCVEGCSA-N 345.399 0.833 10 20 ECCD COCCCS(=O)(=O)N1CCN(C(=O)c2cc(O)cs2)CC1 771090408 FOIMCWINLSQACD-UHFFFAOYSA-N 348.446 0.578 10 20 ECCD NCCNCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1121989342 ROOWFDVWMNSDLQ-UHFFFAOYSA-N 342.390 0.921 10 20 ECCD CNC(=O)CN1CCC(NCc2ccc(OC)c(OC)c2O)CC1 892559766 AFEZALGKAGUPPX-UHFFFAOYSA-N 337.420 0.709 10 20 ECCD COc1ccc(CNCCNC(=O)CCN2CCOCC2)cc1C 1135352163 BXRWXHNMHUNZRU-UHFFFAOYSA-N 335.448 0.932 10 20 ECCD CC(=O)NCC(=O)NCCC1=CCN(c2cc(C)nc(CO)n2)CC1 1089807368 LGVSYLPKXREMRN-UHFFFAOYSA-N 347.419 0.056 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cccn3C)C2)cc(OC)n1 996369235 TYKAARHYVJJDDW-UHFFFAOYSA-N 344.371 0.692 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(C)(O)CC2)cc1F 1327970054 XAMHBEHGORCSHI-UHFFFAOYSA-N 337.395 0.881 10 20 ECCD CN(C)C(=O)Cn1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)nn1 58734259 BTTBLPKFZFQBCE-UHFFFAOYSA-N 348.382 0.501 10 20 ECCD COc1cccc([C@@H](C)NCC2(O)CCS(=O)(=O)CC2)c1O 1346206069 CLERBYFFOYOHMD-LLVKDONJSA-N 329.418 0.991 10 20 ECCD Nc1nc(N)nc(CN(Cc2ccccc2O)C[C@@H]2CCCO2)n1 123509159 QBIOSGAYDHKASE-LBPRGKRZSA-N 330.392 0.923 10 20 ECCD C[C@@]1(C2CC2)NC(=O)N(CC(=O)NCCc2ccc(O)c(O)c2)C1=O 269178055 HILJCXKWMDAVHM-KRWDZBQOSA-N 347.371 0.477 10 20 ECCD CS(=O)(=O)N1CCCN(C(=O)c2c(F)ccc(O)c2O)CC1 276506845 INPZICWVTULMHP-UHFFFAOYSA-N 332.353 0.344 10 20 ECCD COc1ccc(CNC(=O)c2cn(CC3(C)COC3)nn2)c(O)c1 373703547 VYSJLDIMKAPMJJ-UHFFFAOYSA-N 332.360 0.959 10 20 ECCD COCCS(=O)(=O)CC(=O)NCc1ccc(N(C)C)c(F)c1 299317214 HNOQFZODCAEARD-UHFFFAOYSA-N 332.397 0.569 10 20 ECCD COC(=O)CC[C@@H](N)C(=O)NCc1ccc(N2CCOCC2)cc1 290080506 WOMBAPAQPHDTRZ-OAHLLOKOSA-N 335.404 0.420 10 20 ECCD CN1CCCc2cc(CNC(=O)NC[C@@H](O)Cn3ccnn3)ccc21 838031702 NBYSYMOXHDIVII-OAHLLOKOSA-N 344.419 0.521 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)NCCN2CCSCC2)cc1 842234775 BYSKUBCWPUETKX-UHFFFAOYSA-N 336.461 0.093 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCC[C@H]3CCNC3)ccc21 842150384 QNMQPBROTCKGBM-CQSZACIVSA-N 344.459 0.801 10 20 ECCD COc1cc(O)c(CN2CCC(NS(C)(=O)=O)CC2)cc1OC 768442049 OASDJERETGDPDD-UHFFFAOYSA-N 344.433 0.923 10 20 ECCD COc1ccc(N2CCC(NC(=O)N3C[C@H](O)C[C@H]3CO)CC2)cc1 776131817 MUDULMPZBNRTFC-JKSUJKDBSA-N 349.431 0.801 10 20 ECCD COc1ccc(CN[C@@H]2CCCN(C(=O)Cn3cnnn3)C2)cc1C 998496520 PAGJLKAHCPHBDL-OAHLLOKOSA-N 344.419 0.771 10 20 ECCD CCC(=O)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1O 991139606 SLOZOLLMEHPBPQ-STQMWFEESA-N 347.375 0.951 10 20 ECCD COc1ccc(N2CCN(C(=O)NCCCON)CC2)c(OC)c1 1262598195 LNNBXFKKUBUTTP-UHFFFAOYSA-N 338.408 0.816 10 20 ECCD CCN(CC)C(=O)CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1261998830 UOZCJSPZWNOPJT-ZDUSSCGKSA-N 348.447 0.914 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(-c2nn[nH]n2)cn1C 1603577684 JDHLNSIEVFZUNS-VIFPVBQESA-N 342.359 0.977 10 20 ECCD CN(Cc1ccccc1O)C(=O)N[C@@H]1CCCCN(CC(=O)O)C1=O 1574020256 YEZVZPUZMCZFHZ-CYBMUJFWSA-N 349.387 0.999 10 20 ECCD COCCS(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 101573136 CXIUSVZFABPBBC-UHFFFAOYSA-N 332.397 0.728 10 20 ECCD CCN(C)C(=O)CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803661182 SIPPKMLAPVSQIL-UHFFFAOYSA-N 338.383 0.102 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCN[C@H]3C)CC2)cc1 829507021 ZWFXMRQIFXRVEQ-YJBOKZPZSA-N 346.475 0.931 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@]1(O)CCOC1 840694806 XOVMSVHKMJIMRL-KRWDZBQOSA-N 336.388 0.406 10 20 ECCD 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COc1ccc(O)c([C@H](C)NC(=O)Cn2cnc(-c3nn[nH]n3)n2)c1 826210245 JZOIUODKFUDQJX-QMMMGPOBSA-N 344.335 0.050 10 20 ECCD O=C1NC(=O)[C@H]2CN(Cc3ccc(Br)cc3O)C[C@@H]12 826065552 ZKLDOFWXPVRXCO-AOOOYVTPSA-N 325.162 0.859 10 20 ECCD COc1ccc(O)c(CNC(=O)CN(C)c2ncnc3[nH]cnc23)c1 734015076 YJZBEDWKRSCJPT-UHFFFAOYSA-N 342.359 0.820 10 20 ECCD C[C@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@H]1CCC(=O)N1 918845315 KQKCINONZUJXRS-WMLDXEAASA-N 344.459 0.969 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NCC(F)(F)CN)cc1 842206070 AYYXXSWHFKAVJN-UHFFFAOYSA-N 342.390 0.859 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NCCCON)cc1F 911236323 PMSBSJUGCIYZJK-UHFFFAOYSA-N 340.399 0.685 10 20 ECCD O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1cc(O)cs1 755863457 ABVHMDYYTFKLBH-RBJBARPLSA-N 332.381 0.991 10 20 ECCD C[C@@H](CNCc1ccc(N2CCN(C)CC2)cc1)S(C)(=O)=O 771857544 JFZDIQPHVPLPML-AWEZNQCLSA-N 325.478 0.961 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@@H]3CC[C@@H]3C(N)=O)cc2)CC1 881853121 JVUOPESJPZBOHX-JKSUJKDBSA-N 330.432 0.566 10 20 ECCD 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O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1COC[C@H]1O 823524122 OLRZIINGFFWKNV-HZPDHXFCSA-N 335.404 0.207 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3C[C@@H]3C(=O)O)nc12 737154642 GDWAUKRNXVVJTC-IUCAKERBSA-N 349.299 0.376 10 20 ECCD CN1C[C@H](N(C)CC(=O)NCc2ccc(N(C)C)cc2)CCC1=O 846920696 NBRPGVUISHYILD-MRXNPFEDSA-N 332.448 0.921 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)NC[C@@H]1CCCNC1 842092306 KWQRWQXJMCCYKO-LLVKDONJSA-N 342.490 0.857 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N[C@@H]2CCN3CCCC[C@H]23)cc1 842227218 SQSQHHMONKKAQB-HZPDHXFCSA-N 330.432 0.671 10 20 ECCD COc1ccc(N2CCN(CCNc3nc(N)nc(N)n3)CC2)cc1 858367880 YVEKSMGRDSOZHF-UHFFFAOYSA-N 344.423 0.279 10 20 ECCD C[C@@H](NC(=O)[C@@H]1CC[C@H](C(N)=O)O1)c1ccc(N2CCOCC2)cc1 858786064 MSODJXMOKZXBLK-WQVCFCJDSA-N 347.415 0.733 10 20 ECCD C[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)S(C)(=O)=O 856210113 NRKVRXLMWHHLDN-GFCCVEGCSA-N 340.445 0.697 10 20 ECCD CC(C)(C(N)=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 767981594 ROJQBGVQNLQYDI-UHFFFAOYSA-N 337.395 0.915 10 20 ECCD 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COc1c([N+](=O)[O-])ccc(CN2CCO[C@@H](CNC(C)=O)C2)c1O 278168526 FMVGMIJQWSKVJR-LBPRGKRZSA-N 339.348 0.646 10 20 ECCD CN(C)C[C@@H]1NC(=O)N(C[C@@H](c2ccc(N(C)C)cc2)N(C)C)C1=O 900186315 XHXRAIYOMIPQEC-HOTGVXAUSA-N 347.463 0.837 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)CCCS(N)(=O)=O 906856918 SGUZPYFWEQDJNF-UHFFFAOYSA-N 327.406 0.547 10 20 ECCD C[C@]1(CNC(=O)NCc2ccc(N3CCOCC3)cc2)CCC(=O)N1 836250404 WCELEXKFRPCLMP-GOSISDBHSA-N 346.431 0.991 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@@H](O)C3)cc2)C1 837770208 XJZJVPODVWPESS-OFQRWUPVSA-N 346.431 0.711 10 20 ECCD COCCOCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917833490 PBBKSYSSYMKXFO-HNNXBMFYSA-N 349.431 0.668 10 20 ECCD C[C@@H](N)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 842036670 QMQYVDDPBIFATR-HIFRSBDPSA-N 332.448 0.955 10 20 ECCD C[C@@H](N[C@H]1CCN(S(C)(=O)=O)C1)c1cc([N+](=O)[O-])ccc1O 846190659 UWJPIEQFPABNQW-ZJUUUORDSA-N 329.378 0.985 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CN(C)S(C)(=O)=O)cc1 844853027 RBAQBYYNFCGCSF-UHFFFAOYSA-N 343.449 0.481 10 20 ECCD NCCn1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nn1 852805240 SZWUPJGJYRIKJQ-AWEZNQCLSA-N 345.403 0.764 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)N=c2nc[nH]n2C)N(C)C)cc1 930506720 SUGORZFKVWKSDU-AWEZNQCLSA-N 331.424 0.727 10 20 ECCD NC(=O)CN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N=NC(N)=O)cc1 1032810177 VQQSALLIPCMONT-RYUDHWBXSA-N 330.348 0.233 10 20 ECCD O=C1C[C@H](CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C(=O)N1 935033118 AVYCJBIYABYAQZ-KGLIPLIRSA-N 346.383 0.953 10 20 ECCD COc1ccc(N2CCN([C@@H](C)C(=O)NC(N)=O)CC2)c(OC)c1 879463860 SMYSJSFTOUTGQD-NSHDSACASA-N 336.392 0.409 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@H]2[C@@H]3CN(CCCO)C[C@@H]32)cc1 962968205 ACBJVEWDOUKIGP-WDNDVIMCSA-N 331.376 0.891 10 20 ECCD O=C(Nc1ccn(CCN2CCOCC2)n1)c1cccc(O)c1O 790667533 BUJJNSXLERZHLZ-UHFFFAOYSA-N 332.360 0.879 10 20 ECCD C[C@H](C(N)=O)N1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 989760909 IGTUHMFCADQWNW-LLVKDONJSA-N 346.391 0.871 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)C[C@H](C)NC(N)=O)CC2)nn1 1089843323 CZUOJTKEUUIXHG-ZDUSSCGKSA-N 346.435 0.875 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3nocc3C)C2)cc(OC)n1 996369124 RHNWCIWHIGDSLA-UHFFFAOYSA-N 346.343 0.650 10 20 ECCD C[C@H](C(=O)NCc1ccc(O)c(O)c1)S(=O)(=O)C1CCOCC1 1320026726 WLEOEUPTTXTJSY-SNVBAGLBSA-N 343.401 0.696 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)OC 1320148144 PXGKYOCNAUGCNY-JTQLQIEISA-N 340.332 0.044 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc[n+]([O-])c1 1320147635 KHQARIAXNCHVGE-ZDUSSCGKSA-N 346.339 0.635 10 20 ECCD CCOc1ccc(N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 1333038990 UDLKHYFPMJPAMM-GFCCVEGCSA-N 326.418 0.825 10 20 ECCD CN(C)c1ccc(CNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1F 69632385 BLMNNWIFYRTMJW-LLVKDONJSA-N 329.397 0.878 10 20 ECCD Cc1ccc(C)n1-c1ccc(C(=O)N(CC(N)=O)CC(N)=O)cc1 78693062 JLKGJDKQEPQDEA-UHFFFAOYSA-N 328.372 0.507 10 20 ECCD CCNS(=O)(=O)[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)C1 271246685 GOESPLAZLRHFPQ-LLVKDONJSA-N 328.390 0.635 10 20 ECCD COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](CO)C(N)=O)CCCC1 652098224 PUJBEYKKKYYRHY-AWEZNQCLSA-N 345.399 0.491 10 20 ECCD COCCN(C)CCN1C[C@@H](NC(=O)c2cc(O)cs2)CC1=O 820848504 UKRVBJXFMWVVFK-NSHDSACASA-N 341.433 0.363 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)N)CC2)cc1 842230573 VWVDFNQOZIUMHM-CYBMUJFWSA-N 334.420 0.197 10 20 ECCD C[C@H]1CNCCN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 842150979 YUXWUALKOFFQOR-ZDUSSCGKSA-N 330.432 0.506 10 20 ECCD O=C1[C@@H]2[C@@H](O)CCCN2C(=O)N1Cc1ccc(N2CCOCC2)cc1 761070530 VLXDPDMPRZMTOA-HOTGVXAUSA-N 345.399 0.811 10 20 ECCD COc1ccc(-n2nnnc2CN2CC(NC(=O)C3(C)CC3)C2)cc1 1030352593 RLMDWYFCRXMEHH-UHFFFAOYSA-N 342.403 0.771 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)OC)CC2)cc1 778224063 PTDNMEAHSAEFPQ-HJWRWDBZSA-N 333.388 0.920 10 20 ECCD COc1ccc(CN2CCC(C(=O)NCCO)CC2)c(O)c1OC 891615573 XEQQJBFONOAMKG-UHFFFAOYSA-N 338.404 0.730 10 20 ECCD CC(=O)NCC(=O)NCCC1=CCN(c2ccc([N+](=O)[O-])cn2)CC1 1089806971 BRTJPIAQSGRNRE-UHFFFAOYSA-N 347.375 0.769 10 20 ECCD O=C(NCc1ccc(O)c(O)c1)[C@H]1Nc2ccccc2S(=O)(=O)N1 1254313508 KMDKCPQEUQZERF-AWEZNQCLSA-N 349.368 0.444 10 20 ECCD NC(=O)[C@@H]1CC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)O1 1348377979 KDXULGGEDSQUQI-JKSUJKDBSA-N 347.415 0.297 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@H](F)C(=O)O 1601539168 NSIIUINXEJNYCA-ZDUSSCGKSA-N 337.351 0.442 10 20 ECCD O=C(N[C@H]1C[C@H]2C[C@H](C(=O)O)C[C@@H]12)C(=O)N1Cc2cccc(O)c2C1 1608492660 OCCWETKLSJLOOK-CZXHOFHRSA-N 344.367 0.850 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2nn[nH]n2)n1C 1609115752 JIJBOUZVCSYMSK-VIFPVBQESA-N 342.359 0.977 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCN(C)C[C@@H](C(=O)O)C2)c1O 1599345223 SKAOHOSUXAPJGU-LLVKDONJSA-N 339.348 0.757 10 20 ECCD CN1CCO[C@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 175003612 OPMQJNBNJSKDPP-SFHVURJKSA-N 347.459 0.842 10 20 ECCD Cn1cc(N2CCC[C@@H](NC(=O)Cc3ccc(N)cc3)C2=O)cn1 269209388 GLTAKNROLJKUMT-OAHLLOKOSA-N 327.388 0.857 10 20 ECCD Cc1ccc(C(=O)NC[C@@H]2CCC[C@@]23NC(=O)NC3=O)c(O)c1O 272740548 MBHCJOPLMVYJOZ-XXFAHNHDSA-N 333.344 0.514 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H](C)CN1 817991167 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ECCD COc1ccc(N2CCN(C(=O)[C@H]3CN4CCN3C[C@@H]4C)CC2)cc1 1263764043 XNYYVGAJAZFXLV-MAUKXSAKSA-N 344.459 0.732 10 20 ECCD CC(C)C(=O)NCCC1=CCN(c2ccc(-c3nn[nH]n3)nn2)CC1 1603197076 UDKIKBMTSXLTTL-UHFFFAOYSA-N 342.407 0.956 10 20 ECCD CN1CCNC[C@H]1C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1606247840 UJUBLIZSRQSFNQ-LBPRGKRZSA-N 341.795 0.362 10 20 ECCD CC(C)(CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)O 1603607590 JGOCJOLTGYZTHC-UHFFFAOYSA-N 344.389 0.994 10 20 ECCD Cc1onc(CC(=O)NCc2cc(O)ccc2O)c1-c1nn[nH]n1 1606180258 PKCWNKJWUPDQDI-UHFFFAOYSA-N 330.304 0.433 10 20 ECCD CN(Cc1ccccc1O)C(=O)NCCOCCOCC(=O)O 1574019938 PLKXXBHYCGFECN-UHFFFAOYSA-N 326.349 0.651 10 20 ECCD C[C@@H](NCCS(=O)(=O)N(C)C)c1cccc(-c2nn[nH]n2)c1O 1589964082 RGEPGJMTCCWDIF-SECBINFHSA-N 340.409 0.114 10 20 ECCD COc1ccc(-n2nnnc2CNC[C@@H](C)NC(=O)C(C)C)cc1 1754218408 YKDYJGLNUVQPQD-GFCCVEGCSA-N 332.408 0.921 10 20 ECCD C[C@@H](NCCNS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 158236378 PPRDPKVWKUKCEK-CYBMUJFWSA-N 327.450 0.723 10 20 ECCD O=C(Cn1nc2ccccn2c1=O)NCCc1ccc(O)c(O)c1 156670788 RSSQZWFMJAVBRY-UHFFFAOYSA-N 328.328 0.266 10 20 ECCD CN(C)c1ccc(CNC(=O)NCCN2CCCS2(=O)=O)cc1 60975752 IEWITESOFVZEET-UHFFFAOYSA-N 340.449 0.587 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(=O)n(C)c2)cc1F 183024238 YTFJMTDIMOOXRR-UHFFFAOYSA-N 346.362 0.845 10 20 ECCD C[C@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@@H]1CN(C)CCO1 1343130718 LGJVIKSDEGFFKI-WFASDCNBSA-N 335.404 0.186 10 20 ECCD C[C@H](C(=O)N(C)C)S(=O)(=O)N1CCOc2cc(N(C)C)ccc21 340633823 ABJLZJOAOUGQDJ-LLVKDONJSA-N 341.433 0.758 10 20 ECCD COC(=O)[C@@H]1C[C@@H](O)CN(Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 843434117 RIQUMAXTDPLWLZ-GHMZBOCLSA-N 340.332 0.665 10 20 ECCD CCN1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H]1C 754505534 BOJJKWKXNMZNML-NSHDSACASA-N 341.433 0.930 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)NCCCn2cccn2)cc1 872895230 VAZIKAHRHTUXJX-UHFFFAOYSA-N 346.387 0.989 10 20 ECCD COCCO[C@H]1COCC[C@H]1NC(=O)c1ccc(C)c(O)c1O 777394729 NUVWQPULKHGIPA-OLZOCXBDSA-N 325.361 0.957 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3cc(=O)n(C)cn3)cc2)CC1 881854577 HFUYMGFJPDBEIC-UHFFFAOYSA-N 341.415 0.462 10 20 ECCD CC(=O)NC[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)cc2)CCO1 775700139 GGMSMINMUIHAAO-LJQANCHMSA-N 346.475 0.775 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)NCCNC(=O)c2cc[nH]n2)c1 780051006 QASNWOBBSQQWPQ-JTQLQIEISA-N 347.375 0.914 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@H]3CCOC3)CC2)nc(CO)n1 1089812203 BVQRKSQEEZMPQD-HNNXBMFYSA-N 346.431 0.957 10 20 ECCD Cc1nc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)nn1C 1326273696 FATFTSCLXMFMDU-UHFFFAOYSA-N 340.387 0.755 10 20 ECCD O=C(O)CN1CCCC[C@@H](NCc2cc([N+](=O)[O-])ccc2O)C1=O 1606258661 GILXKRQODDTMTN-GFCCVEGCSA-N 337.332 0.856 10 20 ECCD CC[C@@H](NC)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1843003138 KWJOIWRPFJLTMP-GFCCVEGCSA-N 348.403 0.308 10 20 ECCD C[C@H](C(=O)NC1CC1)N1CCN(C(=O)Cc2ccc(N)cc2)CC1 237422216 YALVZEJMNKOFIS-CYBMUJFWSA-N 330.432 0.623 10 20 ECCD O=C(NCc1cccc(Br)c1O)NC[C@H]1COCCN1 529373888 BRCQAQVQWGNPAL-JTQLQIEISA-N 344.209 0.942 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](C)[C@@H]3CO)nc12 276024291 KWUSZQPNRCOVFB-MFKMUULPSA-N 334.376 0.814 10 20 ECCD CC(C)(CN1C(=O)CN(Cc2ccccc2O)C1=O)S(C)(=O)=O 819168114 MXAIHFHOUUMVKE-UHFFFAOYSA-N 340.401 0.980 10 20 ECCD NCC[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 911158479 LCQSHOHSYXREQZ-INIZCTEOSA-N 342.443 0.876 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN(C)[C@H](C)CO)CC2)cc1 754069984 JDNCHUUCSADBJS-NVXWUHKLSA-N 337.464 0.491 10 20 ECCD CCOC(=O)[C@H](N)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 852916494 KPCLWEYOCXYYBL-OAHLLOKOSA-N 335.404 0.154 10 20 ECCD COc1ccc(N2CCN(C(=O)c3ncnn3C)CC2)c(OC)c1 866128115 VUSLTWUFMVCOOB-UHFFFAOYSA-N 331.376 0.795 10 20 ECCD NS(=O)(=O)c1ccc(CC(=O)NCc2ccc(O)c(O)c2)s1 778925656 NFWIGIXPBHCUFD-UHFFFAOYSA-N 342.398 0.666 10 20 ECCD CC(C)[C@@H](NC(=O)NCc1ccc(N2CCN(C)CC2)cc1)C(N)=O 889662254 ATCKABUTLFGQAP-MRXNPFEDSA-N 347.463 0.748 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)C2(CF)CC2)cc1 1133635792 RZSUUAVOUDFZPJ-UHFFFAOYSA-N 348.382 0.626 10 20 ECCD O=C(Cn1cnnn1)NCCC1=CCN(c2cccc(F)n2)CC1 1089799897 FUQQATKFRRMYDC-UHFFFAOYSA-N 331.355 0.550 10 20 ECCD COCCN(C)CCCNC(=O)C(=O)N(C)Cc1ccccc1O 1327621163 OYTNLLXOHCCIAG-UHFFFAOYSA-N 337.420 0.435 10 20 ECCD NOCCCNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1335570639 QANFLMHJMHHNDU-UHFFFAOYSA-N 344.362 0.881 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H]2C[C@]2(CO)C1 1346556291 WTNMNEBGJVQWIL-KBXCAEBGSA-N 331.416 0.518 10 20 ECCD C[C@H](CNCc1nncn1C)NC(=O)c1ccc(N=NC(N)=O)cc1 1754255925 FWBWIXQPAIASRB-SNVBAGLBSA-N 344.379 0.886 10 20 ECCD CC(=O)NC1(CCO)CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1756073342 LKEXAWRVQYLGNZ-UHFFFAOYSA-N 333.348 0.562 10 20 ECCD COc1ccc(CNC=C2C(=O)N(C)C(=O)N(C)C2=O)cc1C(=O)O 1599572851 USNOLBKVJNXUOE-UHFFFAOYSA-N 347.327 0.417 10 20 ECCD COc1ccc(-n2nnnc2CN[C@@H]2CN(C(C)=O)C[C@H]2C)cc1 1054304409 ZEJBGVDZIZQSCN-IAQYHMDHSA-N 330.392 0.627 10 20 ECCD CCN(C(=O)C1=CC=CN2CCS(=O)(=O)N=C12)c1cccnc1 105372826 YZWQGNBZKYDMOK-UHFFFAOYSA-N 332.385 0.932 10 20 ECCD COCCN1C(=O)/C(=C\Nc2ccc(OC)cc2)C(=O)NC1=S 60861067 WQGJZJLCBMQZBL-XFXZXTDPSA-N 335.385 0.881 10 20 ECCD Nc1ccc(CCNC(=O)CCNS(=O)(=O)c2cccnc2)cc1 262587970 XURJRQBXBRGNOW-UHFFFAOYSA-N 348.428 0.691 10 20 ECCD CN1CC[C@@H](OC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 734892412 AQUNOHDTYHQRFU-LLVKDONJSA-N 328.346 0.151 10 20 ECCD O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)C(=O)NC1CC1 837709579 JJYQDCRFNVGEND-UHFFFAOYSA-N 339.342 0.696 10 20 ECCD CC(C)CN1C(=O)/C(=C/NNc2ccc(F)cn2)C(=O)NC1=S 731371810 NHQUCRIJCJFFLD-UXBLZVDNSA-N 337.380 0.920 10 20 ECCD C[C@@H](NC(=O)NC[C@H](O)Cn1ccnn1)c1ccc(N(C)C)cc1 838560835 ZQXJTADMDCAOOC-DOMZBBRYSA-N 332.408 0.765 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CC[C@@H](CN)C1 842275061 ZBYZJDCEXVOORC-CABCVRRESA-N 332.448 0.955 10 20 ECCD NC(=O)Cc1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1 748481835 ORFHYXAUZKSORE-UHFFFAOYSA-N 327.340 0.675 10 20 ECCD CNC[C@@H](C)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 851690919 NGWYMJWQSSKIHY-CYBMUJFWSA-N 332.448 0.968 10 20 ECCD Cc1ccc(O)c(CNC(=O)C2(S(C)(=O)=O)CCOCC2)c1 862756133 QWDRBDREAKHLFV-UHFFFAOYSA-N 327.402 0.911 10 20 ECCD COc1cc(C(=O)NC2CN(Cc3cn(C)nc3C)C2)cc(OC)n1 1030611996 DPMPHQHRLMTYTD-UHFFFAOYSA-N 345.403 0.755 10 20 ECCD COC(=O)CNC(=O)CNCc1cc(Br)cc(C)c1O 877706963 VWKJHYPRDWSPGO-UHFFFAOYSA-N 345.193 0.842 10 20 ECCD C[C@]1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCN(CC(N)=O)C1 1046863753 IEDPSJFAINSPPA-HNNXBMFYSA-N 332.364 0.529 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc[n+]1[O-] 1116570677 GBUJXEPLZVKZEB-LBPRGKRZSA-N 346.339 0.635 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)NCc2cn(C)nn2)N(C)C)cc1 894121050 WBFZANDMZZCLBE-MRXNPFEDSA-N 345.451 0.983 10 20 ECCD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnn(C)c2)cc1 797431628 USDFOWSEDNXULC-UHFFFAOYSA-N 345.406 0.097 10 20 ECCD Cc1nc2c(c(N3CC=C(CCNC(=O)C(N)=O)CC3)n1)CCCC2 1089861604 BHPJAXHYROIVPB-UHFFFAOYSA-N 343.431 0.792 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NOC[C@H]1CCOC1 1323723715 KIULWNMSUBDSCR-ZDUSSCGKSA-N 335.404 0.762 10 20 ECCD Nc1ccc(CNC(=O)N2CCN(S(=O)(=O)C3CC3)CC2)cc1 1337018986 OBUXSGOGMNZWOQ-UHFFFAOYSA-N 338.433 0.588 10 20 ECCD CC(C)[C@@H](N)C(=O)NCCC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1576052114 GZBXKMIVZOZERH-BDJLRTHQSA-N 337.420 0.635 10 20 ECCD CCS(=O)(=O)N1CCC(NC(=O)Cc2ccc(N)cc2)CC1 261919420 HNQJDQJMHLLPDC-UHFFFAOYSA-N 325.434 0.742 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@@H]3CO)ccc21 285596379 BGJGKVIRYUECAW-OAHLLOKOSA-N 331.416 0.669 10 20 ECCD CC(=O)N[C@@H]1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 817833005 IVPMDMSNYZYAKZ-SWLSCSKDSA-N 346.431 0.667 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)N3CCO[C@H](CN)C3)C2)cc1 818654473 BKGINDQSDSAAAY-RHSMWYFYSA-N 348.447 0.891 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N(C)C[C@H](C)O)C2)cc1 824980505 DGUZSEJDPNBHSM-UONOGXRCSA-N 349.431 0.477 10 20 ECCD Cc1cc(N2CC[C@H](NC(=O)Cc3ccc(N)cc3)C2=O)n(C)n1 830659788 YZFIJFFDZKYDDY-AWEZNQCLSA-N 327.388 0.775 10 20 ECCD CN(C)[C@@H](CNC(=O)C(=O)NCCc1ccc(N)cc1)c1ccco1 842024011 LBIDQJPIBKBFFW-HNNXBMFYSA-N 344.415 0.940 10 20 ECCD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCCNC1 842036218 LSBBHGTWVCNWKJ-DZGCQCFKSA-N 332.448 0.873 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)N(C)C[C@@H](C)N)CC2)cc1 863750906 YXLWPGIGWSNZTD-CQSZACIVSA-N 348.447 0.540 10 20 ECCD NCc1nccn1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 864620555 SKQJJLMHDWNCOB-UHFFFAOYSA-N 347.394 0.634 10 20 ECCD CS(=O)(=O)N1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768441810 NSDBHXSKXMYSDP-CQSZACIVSA-N 342.417 0.285 10 20 ECCD Cn1nccc1CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 762717613 YIOXFQVNXAGLPA-UHFFFAOYSA-N 338.389 0.470 10 20 ECCD C[C@@]1(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCNC1=O 874092698 AHYOHABUSZWNPH-QGZVFWFLSA-N 335.379 0.805 10 20 ECCD C[C@@H](NC(=O)N(C)[C@@H]1COC[C@H]1O)c1ccc(N2CCOCC2)cc1 887931167 LHLKLIBYQMYYAU-KBRIMQKVSA-N 349.431 0.985 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)C[C@@H](C)NC(N)=O)CC2)ncn1 1089843480 IJNFERVUVMICSB-CYBMUJFWSA-N 346.435 0.875 10 20 ECCD CCn1cc(CNCCNC(=O)c2ccc(N=NC(N)=O)cc2)nn1 1153037046 DIZIXRGYZPGUOQ-UHFFFAOYSA-N 344.379 0.980 10 20 ECCD CCOc1ccc(N2CCN(CC(=O)N3CCNC3=O)CC2)cc1 1319714083 DHPZRRJUNYCCIK-UHFFFAOYSA-N 332.404 0.759 10 20 ECCD CC1(C)CN(C(=O)C(=O)NCCCSc2nccs2)CCN1 1325347337 ZKRUBWNUOPUIRU-UHFFFAOYSA-N 342.490 0.952 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cn(C)nn1 1329779905 OIWARFDRBIGMAY-UHFFFAOYSA-N 330.392 0.156 10 20 ECCD CC(C)(C)N1C[C@@H](NC(=O)C(=O)NCCc2ccc(N)cc2)CC1=O 1328744879 CRNNCYQQERAEMP-AWEZNQCLSA-N 346.431 0.443 10 20 ECCD COc1ccc(CNCCS(=O)(=O)NC(C)C)c(O)c1OC 1335441789 UDLTXYPNGBGGFR-UHFFFAOYSA-N 332.422 0.827 10 20 ECCD CCNC(=O)C1(CNC(=O)C(=O)N(C)Cc2ccccc2O)CCC1 1347211952 OEFMACVGCUZUHD-UHFFFAOYSA-N 347.415 0.773 10 20 ECCD CN(CCS(N)(=O)=O)c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 1606138977 SKEGAMDRFZKDIP-HWKANZROSA-N 329.334 0.417 10 20 ECCD COC1CCN(c2ccc(CN(CCN)C[C@@H](O)CO)cc2)CC1 1578941497 UJJSQSNYLLWEPH-QGZVFWFLSA-N 337.464 0.416 10 20 ECCD COC(=O)[C@H]1[C@H](C(=O)O)[C@H]2CC[C@H]1N2C(=O)c1ccc(C)c(O)c1O 1598742234 YSNCMUOURWDJCV-DDHJBXDOSA-N 349.339 0.883 10 20 ECCD CCCC(=O)N1CC(O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1043559020 DDZUUEHEYPTUHC-UHFFFAOYSA-N 347.375 0.952 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CC(=O)N(C)C3)CC2)cc1F 177272247 SCUMOJSCAANROU-LBPRGKRZSA-N 335.379 0.961 10 20 ECCD O=C1C[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN1 127559298 RWICZRMTRBUEBT-CYBMUJFWSA-N 335.379 0.805 10 20 ECCD COCCNCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 237202890 CXBDSCVEZUPFLX-UHFFFAOYSA-N 335.448 0.748 10 20 ECCD CSC[C@](C)(O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 266455297 DZRGYWYMFWYRHQ-CYBMUJFWSA-N 348.446 0.608 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@](O)(C3CC3)C2)c1 366927534 YMSZNPNUVNJTAQ-HNNXBMFYSA-N 340.401 0.751 10 20 ECCD CCS(=O)(=O)N1CCN(C(=O)c2cccc(O)c2O)[C@H](C)C1 805363770 FIJDVTKLLHKORQ-SNVBAGLBSA-N 328.390 0.594 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C(=O)N1CCN(C)C(=O)C1 839338689 AMGDREOXUCVLJO-UHFFFAOYSA-N 347.415 0.822 10 20 ECCD CN[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 842150234 PDGDOXHHDCTEIR-OAHLLOKOSA-N 330.432 0.506 10 20 ECCD 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0.524 10 20 ECCD CC(=O)NCCN(C)C(=O)C(=O)NCc1c(C)c2ccccc2n1C 575801694 CLSWSYLIPOXNOO-UHFFFAOYSA-N 344.415 0.697 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1COC(=O)C1 914242926 YTQUWYXAGFRNCT-LBPRGKRZSA-N 337.351 0.777 10 20 ECCD CO[C@H](C)CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 749573738 ZKUXTYBQJRDURM-CYBMUJFWSA-N 340.445 0.963 10 20 ECCD COc1ccc(N2CCC(NC(=O)NC[C@H]3CNCCO3)CC2)cc1 841779006 KEYNLOHFTFVIQK-QGZVFWFLSA-N 348.447 0.952 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@]3(CCNC3)C2)cc1 842036375 QCRVTRBNLUKPGW-GOSISDBHSA-N 330.432 0.581 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NC2CCC(N)CC2)cc1F 842148720 NWTASWIIMWOHOV-UHFFFAOYSA-N 336.411 0.894 10 20 ECCD Nc1ccc(CC(=O)N2CCC(N3C[C@H](C(=O)O)CC3=O)CC2)cc1 849366140 MFCRBLFTJICIFJ-CYBMUJFWSA-N 345.399 0.735 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CCO[C@H]1CN 852857133 JTNGFXDKTAQCEM-IRXDYDNUSA-N 333.432 0.845 10 20 ECCD COc1ccc(N2CCN(C(=O)CSCCC(N)=O)CC2)cc1 863383513 TXYUMKWOQRRMRY-UHFFFAOYSA-N 337.445 0.952 10 20 ECCD COc1ccc(N2CC[C@@H](NC(=O)N3CCO[C@@H](C(=O)O)C3)C2)cc1 1341340849 AFVZSCAYXYCGGD-IUODEOHRSA-N 349.387 0.769 10 20 ECCD C[C@@H]1CN2CCN1C[C@H]2C(=O)NCc1ccc2cccnc2c1O 1348747281 RIRDVOUYGDMUOJ-DOMZBBRYSA-N 326.400 0.945 10 20 ECCD CCN(CC)C(=O)CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1352772920 PCRCLKBWJOAFTH-UHFFFAOYSA-N 348.447 0.696 10 20 ECCD CN(C)c1ccc(CN2CCC[C@@H](CNS(N)(=O)=O)C2)cc1 158902504 YGWHYBBELSPNRB-AWEZNQCLSA-N 326.466 0.758 10 20 ECCD COc1ccc(N2CCN(Cc3nc(N)nc(N)n3)CC2)cc1F 122104697 JCINQCARVUCQNE-UHFFFAOYSA-N 333.371 0.506 10 20 ECCD Cn1cc(N2CC[C@@H](NC(=O)NCc3ccccc3O)C2=O)cn1 265375223 HYALVOCGUIINHF-CYBMUJFWSA-N 329.360 0.730 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCOC[C@]23CCOC3)cc1 298584311 RGAVQEHHBNCWHF-GOSISDBHSA-N 333.432 0.860 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NCC[S@@](C)=O 804999467 GKVJGYLIMDLLCF-JOCHJYFZSA-N 326.418 0.626 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)NCCS(=O)(=O)N(C)C)c1 811976607 DHIVGENVRRKFQX-SNVBAGLBSA-N 345.421 0.652 10 20 ECCD 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CVEBLWKWVMSDQT-UHFFFAOYSA-N 326.316 0.954 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CC[C@](C)(O)C3)CC2)cc1 177975336 SSRROWCMSYFSHL-SFHVURJKSA-N 333.432 0.801 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnnn1C 282250850 ILUCUHFKPDTMJP-UHFFFAOYSA-N 338.751 0.990 10 20 ECCD COCCN1CN(Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1=O 283166987 YRZYATDHIXRRAP-UHFFFAOYSA-N 325.321 0.557 10 20 ECCD CCOC[C@H](O)CNc1ccccc1OCC(=O)N1CCOCC1 819455353 QMLQHXGHGDDHFC-CQSZACIVSA-N 338.404 0.734 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)CCn1cncn1 819693799 UJIALLKCZIPNFE-UHFFFAOYSA-N 332.360 0.966 10 20 ECCD C/C=C/[C@@H](O)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 907640376 OFZIISVQBIRQLI-REMYHPOOSA-N 331.416 0.908 10 20 ECCD COCCNC(=O)C1(NCc2ccc(N3CCOCC3)cc2)CC1 839193155 PWEFWUSJBSEXCR-UHFFFAOYSA-N 333.432 0.908 10 20 ECCD Nc1ccc(CCNC(=O)N2CCN(C(=O)[C@@H]3CCCO3)CC2)cc1 841962777 SANQVJWQDHPKII-INIZCTEOSA-N 346.431 0.844 10 20 ECCD O=C(NCc1ccccc1O)C(=O)Nc1ccc(-n2nccn2)nc1 748481837 OTCWHUTYQOYYLQ-UHFFFAOYSA-N 338.327 0.623 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CC[C@H](CN)C3)CC2)cc1 844219578 LDWZFUQSAXDAMS-OAHLLOKOSA-N 332.448 0.624 10 20 ECCD C[C@@H](N)CN(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 861564284 JWCOKEDSZQOKHO-HIFRSBDPSA-N 347.463 0.877 10 20 ECCD Cn1ncc(CN2CC(NC(=O)c3ccc(N=NC(N)=O)cc3)C2)n1 1031464292 MSJMMNRBFPZTTG-UHFFFAOYSA-N 342.363 0.592 10 20 ECCD C[C@@H](CN1CCOCC1)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785428834 SWYYPVWQUWELFX-AWEZNQCLSA-N 348.447 0.206 10 20 ECCD COCc1noc(CN2CCN(C(=O)c3cc(O)cs3)CC2)n1 782034143 ILSPKBWDCDBZPY-UHFFFAOYSA-N 338.389 0.941 10 20 ECCD COc1ccc(CNCCNC(=O)CN2CCC(=O)NC2=O)cc1C 1146878553 JOODFXVFDNYYCQ-UHFFFAOYSA-N 348.403 0.151 10 20 ECCD NC(=O)[C@@H]1CC[C@H]1C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089854967 BGZKLWPQAYFAAH-CHWSQXEVSA-N 347.394 0.770 10 20 ECCD C[C@H](NC(=O)C(=O)NCCCSc1nccs1)C(=O)N(C)C 1325157747 BVOBMIDHIVWZDI-VIFPVBQESA-N 344.462 0.334 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CC(=O)N(C3CC3)C2)cc1 1321593018 JBIINLAJGYOWEL-CYBMUJFWSA-N 344.415 0.248 10 20 ECCD 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Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H](CCN)C1 911127279 XCLVAGMBNPTCKR-AWEZNQCLSA-N 332.448 0.875 10 20 ECCD COC(=O)c1cn(CCNC(=O)NCc2cc(C)ccc2O)nn1 858434527 JBNFBVBRFORYNM-UHFFFAOYSA-N 333.348 0.578 10 20 ECCD CCN(CCN)C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 923400412 AKNIVQKFQBTURQ-KRWDZBQOSA-N 336.480 0.459 10 20 ECCD Oc1cccc(Br)c1CNC[C@@H](O)Cn1ccnn1 858177505 MYIHAQAQZVPCGN-SECBINFHSA-N 327.182 0.897 10 20 ECCD COc1cccc(O)c1CN1CCCN(C(=O)CNC(C)=O)CC1 862503998 NSNJYDAAABAJBW-UHFFFAOYSA-N 335.404 0.571 10 20 ECCD CSC[C@@H](CCO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 763237997 WXRJDOTYDKPIOQ-SNVBAGLBSA-N 348.446 0.608 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CC[C@@H](S(N)(=O)=O)C2)cc1F 770434025 KHNPAUHFVWBCFW-LLVKDONJSA-N 344.412 0.464 10 20 ECCD COC(=O)N(C)CC(=O)NCc1ccc(N2CCN(C)CC2)cc1 881850112 NZJWTJWLZYMXMU-UHFFFAOYSA-N 334.420 0.753 10 20 ECCD C[C@@H]1CS(=O)(=O)C[C@@H]1NCc1ccc(N2CCN(C)CC2)cc1 886294716 KKFZIQZUTARQQJ-PBHICJAKSA-N 337.489 0.961 10 20 ECCD CC(=O)N[C@H](C)C(=O)NCCC1=CCN(c2cc(C)ncn2)CC1 1089799614 LDQDYBKREWEYMY-CYBMUJFWSA-N 331.420 0.952 10 20 ECCD COc1ccc(CNCCCNC(=O)CN2CCOCC2)cc1C 1156759744 LERJXFDRSOYHMS-UHFFFAOYSA-N 335.448 0.932 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCN(C)C1=O 1331026051 LPABXAWZJVXQTI-AWEZNQCLSA-N 347.415 0.868 10 20 ECCD CCN(CC)C(=O)CN1CCN(C(=O)NCc2ccc(N)cc2)CC1 1346739668 SNBUDUXJWPFHCN-UHFFFAOYSA-N 347.463 0.964 10 20 ECCD COC(=O)[C@H]1[C@H](C(=O)O)[C@H]2CC[C@H]1N2C(=O)c1cc(O)cs1 1606363178 CJGMNTHJCTWUED-YJFSRANCSA-N 325.342 0.931 10 20 ECCD CCS(=O)(=O)CC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 177281849 SPWJRBCPIDEETR-UHFFFAOYSA-N 344.408 0.918 10 20 ECCD CC[C@@H](C)[C@@H](O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 269388118 WSHBFXDOUWWWIS-RNCFNFMXSA-N 330.406 0.901 10 20 ECCD C[C@H](O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 283376274 YVFMEFVBFWUBFE-WCQYABFASA-N 337.395 0.737 10 20 ECCD COCC1(O)CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 297063184 XIWYZVMVRHHKHR-QPJJXVBHSA-N 332.400 0.756 10 20 ECCD CCOC[C@H](O)CNCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 818968794 XLKLXMPUAPCBDY-NVXWUHKLSA-N 335.448 0.875 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CC[C@H]3O)cc2)C1 824219732 VSWWIFPFXKBREP-FVQBIDKESA-N 346.431 0.711 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H](O)C[C@H]1C(=O)O 737477361 RAJGBNPSGZPORV-CABCVRRESA-N 335.404 0.231 10 20 ECCD C[C@@H](O)CNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 838739488 NNTIAGCCYLOXRC-SNVBAGLBSA-N 329.347 0.981 10 20 ECCD CNC[C@H](C)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 832172155 DHJYAOZKDPFASK-AWEZNQCLSA-N 332.448 0.827 10 20 ECCD Nc1ccc(NC(=O)C(=O)N2CCC[C@@H](C(=O)NCC3CC3)C2)cc1 841009796 VOBZURCYGBKRQY-CYBMUJFWSA-N 344.415 0.972 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H](O)[C@H](C)C3)CC2)cc1 754097199 MHLFRDJVDLTCCV-HHXXYDBFSA-N 349.475 0.491 10 20 ECCD COCCN(CC(=O)O)CC(=O)N(C)Cc1ccc(N(C)C)cc1 771202820 AZDHDDWRBLXSNC-UHFFFAOYSA-N 337.420 0.744 10 20 ECCD COC[C@@H](O)CNC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 899095199 HVSPRCRKLUZICG-JKSUJKDBSA-N 338.452 0.662 10 20 ECCD COc1ccc(CNC(=O)NCCCN(C)S(C)(=O)=O)c(O)c1 792832842 PPNNFOKCILDKMC-UHFFFAOYSA-N 345.421 0.482 10 20 ECCD C[C@@H]1C[C@H]1C(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089802854 ZLJAAUCZWAUJDK-DGCLKSJQSA-N 327.392 0.818 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1C[C@@H]2C[C@]2(CO)C1 1327620768 MNSMKRCPRQVHEW-HNAYVOBHSA-N 343.427 0.744 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC=CCC1 1321612671 VJBNPNVLAHYKDE-UHFFFAOYSA-N 329.400 0.928 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1COCCO1 1321932909 JNZRTZKWNTWBKU-CQSZACIVSA-N 336.388 0.662 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H](COC)OC 1261182659 VWJLWPCWOQXYFV-AWEZNQCLSA-N 338.404 0.908 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@H]3C[C@@H](C(=O)O)C3)nc12 1605580532 YDZLLPIIPQXATK-JGZJWPJOSA-N 348.359 0.907 10 20 ECCD O=C(O)C1CCN(S(=O)(=O)NCc2ccc(O)cc2O)CC1 1606022949 IEMFENKTFXCRFV-UHFFFAOYSA-N 330.362 0.229 10 20 ECCD COc1cc(Cl)cc(CN2CCN3C(=O)C(=O)NC[C@@H]3C2)c1O 363905731 DJMGHMIBXRVRFO-LLVKDONJSA-N 339.779 0.197 10 20 ECCD CN(C)c1ccc(CNC(=O)CNS(=O)(=O)c2cccnc2)cc1 289302366 CUJFSFVLCUKZGX-UHFFFAOYSA-N 348.428 0.742 10 20 ECCD NC(=O)[C@@H]1CCCN1CCCNC(=O)c1c(F)ccc(O)c1O 295295385 QNWFKAOYYRRLIO-JTQLQIEISA-N 325.340 0.307 10 20 ECCD CS(=O)(=O)CCNCc1ccc(N2CCC(O)CC2)c(F)c1 819122176 SAUJVBWMYDUQOY-UHFFFAOYSA-N 330.425 0.921 10 20 ECCD NC(=O)COc1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1 748480890 FGEKZKGOASNIRW-UHFFFAOYSA-N 343.339 0.511 10 20 ECCD C[C@@H]1C[C@@H](NC(=O)C(=O)NCCc2ccc(N)cc2)CN1C1CC1 842165807 HUMHUTQFYWQXOF-IUODEOHRSA-N 330.432 0.669 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2C(=O)[C@H]3CSCN3C2=O)cc1 842572074 ATKFFPATEXNZEM-CYBMUJFWSA-N 348.428 0.706 10 20 ECCD COc1ccc(N2CCN(C(=O)CN(C)C3CC(O)C3)CC2)cc1 759870102 PGSHKHFHSYKTDD-UHFFFAOYSA-N 333.432 0.799 10 20 ECCD CCC(=O)N[C@@H]1[C@H]2C[C@H]1N(Cc1nnnn1-c1ccc(OC)cc1)C2 1037256446 OKICKHVPHNSJBI-FABXCBLPSA-N 342.403 0.770 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3NC(=O)O[C@H]3C)CC2)c(OC)c1 870167295 DWXCVGWNHQLUJL-NHYWBVRUSA-N 349.387 0.849 10 20 ECCD CCn1nncc1CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 875284144 FNRHTBJZGIZAEM-LBPRGKRZSA-N 344.419 0.858 10 20 ECCD c1nc(CN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)n[nH]1 1119712689 CXMWJLZLFVFOPC-UHFFFAOYSA-N 342.447 0.959 10 20 ECCD CC(=O)NC[C@@H]1CCCCN1C(=O)C(=O)NCCc1ccc(N)cc1 1118923999 DMZSVGVCSSORHH-INIZCTEOSA-N 346.431 0.445 10 20 ECCD CN1CCN(c2ccc(CNCC3(O)CCN(C)CC3)cc2)CC1 771843656 UMLNTXPXISBGRK-UHFFFAOYSA-N 332.492 0.985 10 20 ECCD CO[C@H](C)CS(=O)(=O)NCc1ccc(N2CCN(C)CC2)cc1 882662908 OCYSUPSDNWYIFU-CQSZACIVSA-N 341.477 0.893 10 20 ECCD CS(=O)(=O)NC1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779493722 NZJAGCQOMMHANA-HYXAFXHYSA-N 340.401 0.651 10 20 ECCD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CN(C)CCO1 785432687 HJYVSYJUSVQILT-XJKSGUPXSA-N 348.447 0.204 10 20 ECCD CN1CCN(c2ccc(CNCC(=O)NCC(F)F)cc2)CC1 795596368 GEOYMTMUJLEXGW-UHFFFAOYSA-N 326.391 0.909 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3COCCN3C)CC2)ncn1 1089818926 FWHNPTKEYLWHOV-INIZCTEOSA-N 345.447 0.758 10 20 ECCD COC[C@@H](OC)C(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089860843 NCUYRFOIBOSTFO-CYBMUJFWSA-N 338.383 0.920 10 20 ECCD CC(=O)N1CC(C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)C1 1089823383 FSAXKMLEEVJZJD-UHFFFAOYSA-N 347.394 0.737 10 20 ECCD CC(=O)N1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@H](O)C1 991567405 WZIVOTNYZZICGL-CHWSQXEVSA-N 333.348 0.561 10 20 ECCD CCOC(=O)N1CC[C@H](NC(=O)C(=O)NCCc2ccc(N)cc2)C1 1325729867 OOMYORHQFDOJJV-AWEZNQCLSA-N 348.403 0.275 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCCC(=O)NC 1321899182 IKZIJXMYYRXDKI-UHFFFAOYSA-N 335.404 0.773 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CC(C(=O)O)=NO1 1604188859 YDGRAYMUKJWTKQ-HNNXBMFYSA-N 347.371 0.711 10 20 ECCD O=C(COC(=O)c1ccc(-c2nn[nH]n2)cn1)c1ccc(O)c(O)c1 1592881798 MHPZBFLHKVWCAB-UHFFFAOYSA-N 341.283 0.713 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)N(C)CCO)CC2)cc1 271072271 OMIQJBLBFHBCFP-UHFFFAOYSA-N 336.436 0.451 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN[C@H]2CCc3nnnn3CC2)c1O 817418665 BBGDOXQPBNYBNG-JTQLQIEISA-N 334.336 0.790 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@@H](N)C3)cc2)C1 844174924 DQFDQPQCTXTGSP-KFWWJZLASA-N 330.432 0.742 10 20 ECCD Cc1ccc(O)c(CNC(=O)NCCS(=O)(=O)NC(C)C)c1 858191925 FJAANRNTSXVOKI-UHFFFAOYSA-N 329.422 0.828 10 20 ECCD COc1cc(C(=O)NC2C[C@@H]3CC[C@H](C2)N3CCO)cc(OC)n1 1021311478 FXJPJVTYLKLRSM-AGUYFDCRSA-N 335.404 0.816 10 20 ECCD C[C@@H](NC(=O)C(=O)N(C)CCOCCN)c1ccc(N(C)C)cc1 861768083 WLTQZNIJHODSND-CYBMUJFWSA-N 336.436 0.364 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@H](CCSC)NC(N)=O)c1 860241317 IMWQKQNMUXQDSA-NSHDSACASA-N 327.406 0.807 10 20 ECCD COc1ccc(CNC[C@H]2CCCN2C(=O)c2nnn(C)n2)cc1C 1035019058 OLLSXSHJUHHSDY-CQSZACIVSA-N 344.419 0.922 10 20 ECCD O=C1CN(c2ccc(NC(=O)c3cccc(O)c3O)cn2)CCN1 776331814 ZOQJTPNKWWHWOU-UHFFFAOYSA-N 328.328 0.681 10 20 ECCD Cc1ccc(C(=O)N2CCC[C@@H](CS(N)(=O)=O)C2)c(O)c1O 780931856 GKMVMHSTCFUHFV-SNVBAGLBSA-N 328.390 0.547 10 20 ECCD CCO[C@H]1COCC[C@@H]1NC(=O)C(=O)N(C)Cc1ccccc1O 1329117628 HLNUINHJUMIJDD-ZFWWWQNUSA-N 336.388 0.661 10 20 ECCD CCN1CCN(CCCNC(=O)c2c(F)ccc(O)c2O)CC1 276552904 HXGDAXRABLEASU-UHFFFAOYSA-N 325.384 0.994 10 20 ECCD COc1ccc(N2CCC(NC(=O)CN3CCNC(=O)C3)CC2)cc1 900509855 ZXDIFUWRYBLHIP-UHFFFAOYSA-N 346.431 0.212 10 20 ECCD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCNC(=O)C1 839241947 FIQAGZQGGKEKPY-UHFFFAOYSA-N 346.431 0.448 10 20 ECCD C[C@H](CN)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 842250584 WBLJVTPOGUMOHG-HIFRSBDPSA-N 349.431 0.611 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)Cn2cnc([N+](=O)[O-])n2)cc1 843299885 YUQPUJYDLHXVBU-LBPRGKRZSA-N 333.352 0.069 10 20 ECCD CN(C)C[C@H]1NC(=O)N(Cc2ccc(N3CCC(O)CC3)cc2)C1=O 924997773 CQAUNEMKRQCGLT-MRXNPFEDSA-N 346.431 0.630 10 20 ECCD Nc1ccc(NC(=O)C(=O)N2CC[C@@H](CN3CCCC3=O)C2)cc1 850854087 JTMMVOZSJVEJOB-LBPRGKRZSA-N 330.388 0.678 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)N(C)C[C@H](C)N)CC2)cc1 861567844 QFNUSOXBHPRIDD-HNNXBMFYSA-N 349.479 0.806 10 20 ECCD Cc1ccc(CN[C@@H]2CS(=O)(=O)C[C@@H]2N2CCOCC2)c(O)c1 877037398 PSFCQZRCTRXEQB-CABCVRRESA-N 340.445 0.288 10 20 ECCD NC(=O)[C@H]1CCCN(CCCNC(=O)/C=C/c2ccc(O)c(O)c2)C1 779511597 RZJKYOPGTLFFCK-DYLGSBMWSA-N 347.415 0.815 10 20 ECCD CNS(=O)(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 795805824 KGSXGIKOUDFMFX-QWRGUYRKSA-N 331.413 0.993 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3cnco3)C2)cc(OC)n1 974323684 NPEYQQPMNAUUTO-PHIMTYICSA-N 346.343 0.778 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)CC(=O)N(C)C)CC2)ncn1 1089867622 PTYWONGZNOYXSS-UHFFFAOYSA-N 331.420 0.906 10 20 ECCD CCN1CCN(CCC(=O)N(CC(=O)O)Cc2ccccc2O)CC1 1354082255 BYHDEHHVRGKENN-UHFFFAOYSA-N 349.431 0.833 10 20 ECCD CN1C[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1=O 55524087 KACFHNBBRSIAKF-CYBMUJFWSA-N 335.379 0.757 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1COCCO1 57176584 DJOVDAFWNPEMPC-MRXNPFEDSA-N 338.379 0.818 10 20 ECCD COCc1nn(CN(C)Cc2ccc(N3CCOCC3)cc2)c(=O)o1 119125183 LFMKCMUFGPNJAK-UHFFFAOYSA-N 348.403 0.909 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@@H](CO)c1cnn(C)c1 274076203 QGKRWFHOFJKIGP-KRWDZBQOSA-N 345.447 0.768 10 20 ECCD CC(=O)C(=O)COC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 808489288 LBFWGMITMVJOFJ-UHFFFAOYSA-N 339.369 0.786 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)NC[C@H]1CC(C(N)=O)=NO1 297894663 HNRRMJKBXXOPIO-GFCCVEGCSA-N 334.376 0.944 10 20 ECCD C[C@@H](NC(=O)C(=O)N1CC[C@H](C(=O)O)C1)c1ccc(N(C)C)cc1 817113209 ACASPMMCNCDOKG-YPMHNXCESA-N 333.388 0.863 10 20 ECCD CC(C)[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)C(N)=O 823524355 RKFOPGATCLPJGM-MRXNPFEDSA-N 348.447 0.957 10 20 ECCD C[C@@H](NC(=O)CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)c1ccccc1O 827937453 XECSDBWDKIXPEO-YUHPLZMDSA-N 344.367 0.732 10 20 ECCD O=C(Cn1ccc(C(=O)O)n1)NCc1ccc(N2CCOCC2)cc1 911208744 KGRJTLAZPFIQQK-UHFFFAOYSA-N 344.371 0.734 10 20 ECCD C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)C(=O)O 848607827 JXHCLIQKSCANAK-SECBINFHSA-N 325.340 0.345 10 20 ECCD CN(C)CCNC(=O)Cn1cc(NC(=O)c2cc(O)cs2)cn1 743618060 FEPXNUYJEJLVRU-UHFFFAOYSA-N 337.405 0.580 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CNCCO1 843489216 JDLLUHONFPTULM-CYBMUJFWSA-N 342.779 0.536 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NCCNC2CC2)cc1 846342087 ABUYFCNNSPRAOD-UHFFFAOYSA-N 348.447 0.458 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3cn(C)nn3)nc12 852553387 QJIBBDPYOFRPBC-UHFFFAOYSA-N 345.363 0.372 10 20 ECCD Cc1ccc(C(=O)NCc2cccc(S(N)(=O)=O)c2)c(O)c1O 751533600 OUWHHKPWQDFAIC-UHFFFAOYSA-N 336.369 0.984 10 20 ECCD CNC[C@H](C)NC(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 851690130 ZNYIEHMEMOPTIE-UONOGXRCSA-N 348.447 0.362 10 20 ECCD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(OC)ncn2)c1 763400427 SONLNCHHWJHCIK-UHFFFAOYSA-N 332.316 0.454 10 20 ECCD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1ccccc1O 770510140 YSNXEMVEWCDLHI-ZDUSSCGKSA-N 326.418 0.517 10 20 ECCD NC(=O)[C@@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 893988168 ZSRPCOOBZZCZFG-JTQLQIEISA-N 333.157 0.980 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCC1([S@](C)=O)CCC1 1323903156 XYTYNHOBRFCFLD-QHCPKHFHSA-N 338.429 0.768 10 20 ECCD Cc1noc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)n1 1327785072 SCQWNSKBWGRZJK-UHFFFAOYSA-N 331.376 0.685 10 20 ECCD C[C@H]1CN(c2ccc(CNC(=O)Cn3ncnn3)cc2F)C[C@@H](C)O1 1337366670 VKWTYDGQJNUXKT-TXEJJXNPSA-N 348.382 0.742 10 20 ECCD CC[C@H](NC[C@]1(O)CCN(C)C1)c1cccc(-c2nn[nH]n2)c1O 1604052973 AEHWOHYGQWJSTN-XJKSGUPXSA-N 332.408 0.680 10 20 ECCD CNC(=O)C1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 29164744 YDNHKBDUYKMNSK-UHFFFAOYSA-N 332.448 0.827 10 20 ECCD CN1C(=O)C(=CNC[C@H](Cc2ccccc2)N(C)C)C(=O)N(C)C1=O 29006132 YINBDLWHQWMJCG-AWEZNQCLSA-N 344.415 0.683 10 20 ECCD CC(C)NC(=O)CN1CCN(Cc2cc3c(cc2O)OCO3)CC1 22280957 MXAFUEUJKAWSFP-UHFFFAOYSA-N 335.404 0.763 10 20 ECCD CN(C)C(=O)CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 279912340 LSLHOQSPVIMUIP-UHFFFAOYSA-N 325.752 0.898 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2C[C@H]3CC[C@@H]2O3)cc1F 285610846 CMTWDEZXZGHQGK-KYOSRNDESA-N 335.379 0.944 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H]1CCOC1 282968388 CLMUEHKPQOSQFK-HNNXBMFYSA-N 329.400 0.832 10 20 ECCD O=C(NCCn1ccnc1)C(=O)NCc1ccc(N2CC=CC2)cc1 284127208 WSRMFHJMGMBJHY-UHFFFAOYSA-N 339.399 0.692 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@@H]1CO 288617684 RHRYSDJFKUACAN-MRXNPFEDSA-N 329.400 0.662 10 20 ECCD COC(=O)[C@H](CNC(=O)/C=C/c1ccc(N2CCOCC2)cc1)OC 294115869 SMTYLOKKQCZBCM-WHWKNOJMSA-N 348.399 0.841 10 20 ECCD CC(=O)CCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 800436581 HSJOWOKEXFEKEM-UHFFFAOYSA-N 338.429 0.907 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)CCC3=O)CC2)cc1 732408564 OMNJNIWQCNFHCJ-OAHLLOKOSA-N 347.415 0.327 10 20 ECCD NC(=O)C1=NO[C@@H](CNC(=O)NCc2cc(Cl)ccc2O)C1 845181367 IEFCNCLFOPJVHD-SECBINFHSA-N 326.740 0.475 10 20 ECCD COc1cccc(CNC(=O)Cn2nc3n(c2=O)CCCC3)c1O 845832878 HPVPNWLEPNWWOR-UHFFFAOYSA-N 332.360 0.412 10 20 ECCD Cc1nn(CC(=O)NCCCSc2nccs2)c(=O)n1C 847487422 FUYYAWLUFSATGY-UHFFFAOYSA-N 327.435 0.645 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN(C)C[C@H](C)N)CC2)cc1 923408930 KRFMTKLXVMVJHL-DOTOQJQBSA-N 336.480 0.457 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C(C)(CO)CO 759840771 QPAAEJLHNVZMOG-UHFFFAOYSA-N 338.404 0.245 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H](C)[C@@H](O)C3)CC2)cc1 754097196 MHLFRDJVDLTCCV-AYBZRNKSSA-N 349.475 0.491 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CCO[C@@H]1CN 852857131 JTNGFXDKTAQCEM-DLBZAZTESA-N 333.432 0.845 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCN(C)C(=O)[C@H]1C)c1ccc(N(C)C)cc1 1117504434 GUSGHXHANHZBRZ-QWHCGFSZSA-N 346.431 0.619 10 20 ECCD O=C(CN1CCNCC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 876873054 VADXTQYSHCPPTI-INIZCTEOSA-N 333.432 0.805 10 20 ECCD C[C@H](NC(=O)Cn1ccc(=O)n(C)c1=O)c1ccc(N(C)C)cc1 773028112 XWXKHZXBPLCSLQ-LBPRGKRZSA-N 330.388 0.490 10 20 ECCD C[C@H]1C[C@H](NCC(N)=O)CN1C(=O)c1ccc(N=NC(N)=O)cc1 989839014 SOCGVWLUKUAKMK-CABZTGNLSA-N 332.364 0.527 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1C[C@@H](F)CN1 1574330878 BWUREQRUAYAISK-TZMCWYRMSA-N 325.359 0.979 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCN(C)C(=O)C3)CC2)cc1 172659968 KGFPKIBGVXNERJ-UHFFFAOYSA-N 346.431 0.118 10 20 ECCD C[C@@H](O)CN(C)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803304398 BEYBNIWUGPAELE-ZIAGYGMSSA-N 349.431 0.540 10 20 ECCD O=C(Cc1cnc[nH]1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 900278304 LXNAPWRCAQUSAV-UHFFFAOYSA-N 348.428 0.503 10 20 ECCD CC(=O)NCCN(C)C(=O)C(=O)NCCCSc1nccs1 834746243 CCAVULJIRIUWJJ-UHFFFAOYSA-N 344.462 0.336 10 20 ECCD Cc1cc(C(=O)Cn2nnnc2CN)c(C)n1-c1ccc(F)cn1 830463345 PTVOMCXYRGHUBD-UHFFFAOYSA-N 329.339 0.956 10 20 ECCD CS(=O)(=O)c1ccc(C(=O)Nc2nc(C3=S=CC=C3)n[nH]2)o1 733146932 RFZHCPLTSBVVCM-UHFFFAOYSA-N 338.370 0.679 10 20 ECCD NC(=O)CNC(=O)c1ccc(CNC(=O)Cc2ccc(N)cc2)cc1 746307221 SSMYUKIVDWLEIH-UHFFFAOYSA-N 340.383 0.343 10 20 ECCD C[C@H]1CCN(S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)C1 842784846 MMJDLHBPGNSZOH-WFASDCNBSA-N 326.466 0.929 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CC[C@H]3NC(=O)CC[C@@H]3C2)cc1 852497122 UAUQIRURUFJMBV-NVXWUHKLSA-N 344.459 0.969 10 20 ECCD COCCOC[C@@H](O)CNCc1ccc(N2CCC(O)CC2)cc1 853122578 QMWVOVCLKCZXNN-SFHVURJKSA-N 338.448 0.761 10 20 ECCD Cn1ncnc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 853797697 AGPIMNURJIBMGH-ZDUSSCGKSA-N 342.403 0.447 10 20 ECCD CN1CCO[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 856211380 NWTNILZAEXISAY-QGZVFWFLSA-N 333.432 0.595 10 20 ECCD COC(=O)CN(CCN1CCOCC1)Cc1cc(OC)ccc1O 775690177 DPVAWFGRXYNZQZ-UHFFFAOYSA-N 338.404 0.708 10 20 ECCD CC[C@@H](C)C(=O)NCCNCc1nnnn1-c1ccc(OC)cc1 1123739367 TYAFWKNXDFFKDS-GFCCVEGCSA-N 332.408 0.923 10 20 ECCD COCCNC(=O)CN1CCN(Cc2cc(F)cc(F)c2O)CC1 893910583 MDOANIUYLQAGTN-UHFFFAOYSA-N 343.374 0.551 10 20 ECCD CO[C@H](C)CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1328315035 LDTUFXZKQUMNSL-KGLIPLIRSA-N 349.431 0.852 10 20 ECCD C[C@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@H](C)N1CCOCC1 1322584229 XQTWPOMTTFYFAC-KBPBESRZSA-N 349.431 0.576 10 20 ECCD COCc1nccc(NC(=O)C(=O)N(C)Cc2ccccc2O)n1 1327583750 VAOCZIGQYLTCTN-UHFFFAOYSA-N 330.344 0.926 10 20 ECCD N[C@H](Cc1cn(Cc2ccc(N3CCOCC3)cc2)nn1)C(=O)O 1601175724 JECUQFUJWKLFDJ-OAHLLOKOSA-N 331.376 0.117 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)CN1CC(=O)N(C)C1=O 182264668 NYKXNNZHCIZJIB-UHFFFAOYSA-N 332.404 0.807 10 20 ECCD CC(=O)c1cc(F)cc(CN2CCC(S(N)(=O)=O)CC2)c1O 367097254 YYAIOJGEZRUMKK-UHFFFAOYSA-N 330.381 0.987 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCn3cnnc3C2)cc1F 285653422 HBVVWOBNENRJRI-UHFFFAOYSA-N 346.366 0.142 10 20 ECCD CC(C)OC(=O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 729536124 FZFMHZZTTVTBRO-UHFFFAOYSA-N 330.362 0.445 10 20 ECCD COc1ccc(-n2nnnc2CN2CCC[C@@H](NC(C)=O)C2)cc1 1006499691 PTANRQPIXBXGMW-CYBMUJFWSA-N 330.392 0.771 10 20 ECCD CC1(C)CN(Cc2cc(O)n3ncc(C(=O)O)c3n2)[C@@H]2COC[C@@H]21 846261298 PRFDSCKQDQYZBH-NWDGAFQWSA-N 332.360 0.990 10 20 ECCD C[C@@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@H]1CCC(=O)N1 918845313 KQKCINONZUJXRS-RHSMWYFYSA-N 344.459 0.969 10 20 ECCD CCN1CCOC[C@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 767172747 DTCIGGICVHNWAW-KRWDZBQOSA-N 333.432 0.860 10 20 ECCD C[C@@H](NC(=O)N1C[C@@H](O)C[C@H]1CO)c1ccc(N2CCOCC2)cc1 776120074 REALYOBICJBQOS-COXVUDFISA-N 349.431 0.721 10 20 ECCD CC1(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)COC1 875127358 CTUFEOJBBUFBCD-AWEZNQCLSA-N 346.431 0.976 10 20 ECCD CC(C)NC(=O)C(=O)N1CCN(Cc2cc(F)cc(F)c2O)CC1 893915017 PLNHZLRATZTBGU-UHFFFAOYSA-N 341.358 0.839 10 20 ECCD CS(=O)(=O)CC[C@H](N)C(=O)NCc1ccc(N2CCCC2)cc1 1330866480 JCEJSXXGECORNV-HNNXBMFYSA-N 339.461 0.665 10 20 ECCD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ncn(C)n1 1341090318 IDXZZWQHCFYIRN-SNVBAGLBSA-N 348.382 0.514 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)N1CCC1 1340673227 NAZKGLYGVZZYJR-UHFFFAOYSA-N 335.379 0.635 10 20 ECCD O=C(O)[C@@]12CCOC[C@@H]1CN(Cc1cc3c(cc1O)OC[C@@H]3O)C2 1608817698 RNJHEIOPDFWVAO-PZSREKOKSA-N 335.356 0.741 10 20 ECCD COC(=O)[C@@H]1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)[C@H](C(=O)O)C1 1610164203 CFRKBEMUFHLOQL-MEPZIYLKSA-N 349.339 0.976 10 20 ECCD CCNC(=O)CN[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1752691852 MXEQAVJKEBNOJS-JOCQHMNTSA-N 346.391 0.836 10 20 ECCD Cc1cc(-c2nn[nH]n2)cc(C)c1C=C1C(=O)N(C)C(=O)N(C)C1=O 1591840532 ZHDMYDZRAQGWMD-UHFFFAOYSA-N 340.343 0.917 10 20 ECCD O=C(CN1CC[C@H](O)C1)NCc1ccc(N2CCOCC2)c(F)c1 113502633 ZDXMDIMBADXLAU-AWEZNQCLSA-N 337.395 0.345 10 20 ECCD CCN(C)C(=O)[C@@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 276592717 LAFWLSJNWUPDCF-SECBINFHSA-N 343.405 0.360 10 20 ECCD C[C@H](N)C[C@H](C)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 843263835 ZXMXJOJQIKAVFZ-STQMWFEESA-N 332.448 0.927 10 20 ECCD CCn1ccc(CN2CC(NC(=O)c3cc(OC)nc(OC)c3)C2)n1 1030614522 JYZPXMOELFJPQY-UHFFFAOYSA-N 345.403 0.929 10 20 ECCD COc1ccc(CNC[C@@H]2CCCN2C(=O)[C@@H]2CNC(=O)N2)cc1C 1045175179 BVKGLNGMCNKMRW-GJZGRUSLSA-N 346.431 0.766 10 20 ECCD C[C@H](NC(=O)NCC(=O)N1CCOCC1)c1ccc(N(C)C)cc1 773434450 BPRXIAGHNGXNJD-ZDUSSCGKSA-N 334.420 0.972 10 20 ECCD CNS(=O)(=O)c1ccc(C(=O)NCc2ccc(OC)cc2O)o1 794376175 CEEHUOGKAZQOOX-UHFFFAOYSA-N 340.357 0.832 10 20 ECCD COc1ccc(CNC(=O)CCc2nc(-c3nc[nH]n3)no2)c(O)c1 794380723 HUJMVCRMOPBASF-UHFFFAOYSA-N 344.331 0.818 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)NC[C@H]2CNCCO2)N(C)C)cc1 1336910658 WLVNRNIKSWPVIF-IAGOWNOFSA-N 349.479 0.643 10 20 ECCD CC(C)(C(=O)NCc1ccc(N2CCOCC2)cc1)S(C)(=O)=O 264807604 BJELXEZGTKCRDW-UHFFFAOYSA-N 340.445 0.963 10 20 ECCD CCS(=O)(=O)N1CCC(NC(=O)c2ccc(C)c(O)c2O)CC1 272524140 AAJBZPFTPYYFGA-UHFFFAOYSA-N 342.417 0.950 10 20 ECCD CNS(=O)(=O)[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 361123398 NMUYRNZEGYVTBB-JOAKQRRISA-N 326.374 0.261 10 20 ECCD CCS(=O)(=O)NC1CCN(C(=O)c2cccc(O)c2O)CC1 279646872 WIHMWMJKQJUMIJ-UHFFFAOYSA-N 328.390 0.642 10 20 ECCD CC[C@@H](CNS(C)(=O)=O)NC(=O)NCc1cccc(OC)c1O 298041985 HWXDKJOJYXIIKJ-NSHDSACASA-N 345.421 0.528 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N(C)CCCO 817859567 HZWCNLWGNJFKOU-AWEZNQCLSA-N 335.448 0.949 10 20 ECCD CN(Cc1ccccc1O)S(=O)(=O)c1ccc(-c2nn[nH]n2)nc1 825981088 OLTMGKPQGIMGJS-UHFFFAOYSA-N 346.372 0.788 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@]3(F)CCNC3)cc2)C1 827468578 AGJMNQPFVYDLHU-RDTXWAMCSA-N 348.422 0.706 10 20 ECCD CC(C)NC(=O)CN1CCN(C(=O)NCCc2ccc(N)cc2)CC1 841962021 LEKILZXKIOGNNV-UHFFFAOYSA-N 347.463 0.663 10 20 ECCD CCOC(=O)CCN(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 920863952 YYKDQIQHXPKLDN-UHFFFAOYSA-N 344.389 0.789 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)c3cn(CCN)nn3)C2)cc1 851642485 XGOOISUJQDPPOB-CYBMUJFWSA-N 344.419 0.502 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](N[C@H]3CCN(C)C3=O)C2)cc(OC)n1 1020352180 BJJOHUZNUILRNP-AVGNSLFASA-N 348.403 0.180 10 20 ECCD O=C1[C@@H]2C[C@@H](O)CN2C(=O)N1Cc1ccc(N2CCOCC2)cc1 761070324 RMVKQLUXRQCGRA-CABCVRRESA-N 331.372 0.421 10 20 ECCD NS(=O)(=O)c1ccc(C(=O)NCCc2ccc(O)c(O)c2)cn1 764848836 LKMIWSFFQPZWEM-UHFFFAOYSA-N 337.357 0.113 10 20 ECCD CN1C(=O)NC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)C1=O 779523437 BORIEHYFODWHMR-HWKANZROSA-N 345.355 0.654 10 20 ECCD C[C@@H]1C[C@@H](NCC(N)=O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1044876006 CAPZJLAPRSZXLD-MFKMUULPSA-N 346.391 0.917 10 20 ECCD COc1cc(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(CC(N)=O)C3)cc(OC)n1 1047104312 SEMQJMAAYNBWMI-UHTWSYAYSA-N 348.403 0.167 10 20 ECCD COc1ccc(CN(C)[C@@H]2CCN(S(C)(=O)=O)C2)c(O)c1OC 894583965 DJHKXOQISBNXJP-GFCCVEGCSA-N 344.433 0.875 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H]3CO)CC2)cc1 892429963 WMXFXWKVUUFSKO-MRXNPFEDSA-N 348.447 0.593 10 20 ECCD COc1cc(C(=O)N[C@@H](C)CCNC(=O)c2cn[nH]c2)cc(OC)n1 1075732939 MOKSOJXLINULOZ-JTQLQIEISA-N 347.375 0.760 10 20 ECCD CN(C)c1cc(F)c(CN[C@H](Cn2cncn2)C(=O)O)cc1F 1262164633 PHCPRBDCAVUAJF-GFCCVEGCSA-N 325.319 0.865 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CN4CCN3C[C@@H]4C)CC2)cc1 1263764045 XNYYVGAJAZFXLV-YJBOKZPZSA-N 344.459 0.732 10 20 ECCD COc1ccc(N2CC[C@@H](NC(=O)NC[C@]3(C)CNCCO3)C2)cc1 1579224482 LIVLAMYMVKCHIW-KDOFPFPSSA-N 348.447 0.952 10 20 ECCD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)C3CC3)cc2)CC1 188131149 FEIRKZIDNBLXIN-UHFFFAOYSA-N 337.445 0.937 10 20 ECCD C[C@H](C(=O)N(C)CC(=O)NCCc1ccc(N)cc1)n1cccn1 237397697 FLPIVVDHZLENSZ-CYBMUJFWSA-N 329.404 0.844 10 20 ECCD CCC(=O)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 283494417 NCKKVOOYGAGXIW-CQSZACIVSA-N 346.431 0.496 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](CO)C2)cc1 283915442 GWPKGSPVRUCIBA-OAHLLOKOSA-N 333.432 0.990 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CC[C@@H]1C(N)=O 816825848 OKDRRSZGGUGDLQ-JKSUJKDBSA-N 331.416 0.993 10 20 ECCD C[C@@H](OC(=O)c1cc(O)cs1)C(=O)N1CCC[C@@H](C(N)=O)C1 732352999 JVTBJPLEMRNWEY-RKDXNWHRSA-N 326.374 0.723 10 20 ECCD C[C@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)CCN1CC(C)(C)O 841095772 KUMKIQFSOGZYEW-LBPRGKRZSA-N 334.420 0.511 10 20 ECCD O=C(C[C@@H]1CC(=O)NC1=O)NCc1ccc(N2CCOCC2)cc1 930520911 VMYVPXMQQDQUNE-CYBMUJFWSA-N 331.372 0.192 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)NCCC[S@@](C)=O)cc1 872928517 JREOUPBBLLUEHB-HSZRJFAPSA-N 342.417 0.471 10 20 ECCD COCC(=O)NC1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779500689 NBCZCJJHOSYIBV-HYXAFXHYSA-N 334.372 0.865 10 20 ECCD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1cc(F)ccc1O 778992975 NOCSHANOHVAVJO-CYBMUJFWSA-N 344.408 0.657 10 20 ECCD C[C@H]1C[C@H](N)CN1C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 884638287 SBKWGOWRNGIVOE-ZFWWWQNUSA-N 330.432 0.851 10 20 ECCD COCCOC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 884997438 TUFRBTOVBGLGIP-UHFFFAOYSA-N 342.417 0.794 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC(=O)N(C)C[C@H]3C)nc12 782586153 LVZDQFVNOGWOQY-SNVBAGLBSA-N 347.375 0.274 10 20 ECCD COC(=O)CCCNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1327296187 RYAQWPMWDCZBGU-LBPRGKRZSA-N 335.404 0.999 10 20 ECCD CO[C@@H](C)CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1327256549 VSUYIIFUQUTIJG-AWEZNQCLSA-N 349.431 0.633 10 20 ECCD COC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2CC[C@H]1N2C(=O)c1cc(O)cs1 1606363176 CJGMNTHJCTWUED-HZQMYPQZSA-N 325.342 0.931 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C[C@H]1CO 288643585 UMJTZQWBPGNOQK-ZBFHGGJFSA-N 343.427 0.766 10 20 ECCD CNS(=O)(=O)NC1CCN(Cc2cc3c(cc2O)OCO3)CC1 291476404 FKUZQIZSARDDJK-UHFFFAOYSA-N 343.405 0.139 10 20 ECCD NC(=O)[C@@H]1CC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 816891081 IAARNFJMPWXOPP-OLZOCXBDSA-N 335.379 0.790 10 20 ECCD CN1CCN(C)[C@@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)C1 819169003 XJEAZFVMUOPFEC-CQSZACIVSA-N 332.404 0.402 10 20 ECCD NC(=O)NC(=O)CCNCc1ccc(N2CCC(O)CC2)c(F)c1 819121790 ORAFYYJSRBPCHY-UHFFFAOYSA-N 338.383 0.461 10 20 ECCD CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)NCc1ccc(O)c(O)c1 830555274 SERWKMZJCWQTOR-CQSZACIVSA-N 342.417 0.820 10 20 ECCD CC(C)S(=O)(=O)CC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832272975 KUWGLVCLBAILNZ-CQSZACIVSA-N 327.450 0.692 10 20 ECCD COCC(=O)N1C[C@@H]2C(NC(=O)c3ccc(N=NC(N)=O)cc3)[C@H]2C1 1013292920 HPLIBKDVWSSSQL-RYUDHWBXSA-N 345.359 0.682 10 20 ECCD N[C@H]1C[C@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 852860008 HLFQYHDQLXFFBB-HDJSIYSDSA-N 337.445 0.275 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCOC3)nc12 921213647 DICDLGWJVDFZQQ-SECBINFHSA-N 335.316 0.691 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@H]3CCN3C)cc2)CC1 924007530 NVSKNPHFGVJMSK-QGZVFWFLSA-N 331.464 0.942 10 20 ECCD CN[C@H]1CCN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 923277050 BFMPUYMJMIHUDV-WMZOPIPTSA-N 348.491 0.472 10 20 ECCD COc1ccc(O)c([C@H](C)NS(=O)(=O)N(C)C2CCNCC2)c1 866752436 ORVSHRIEIRVNPY-NSHDSACASA-N 343.449 0.980 10 20 ECCD COc1ccc(CNC(=O)[C@H]2CCCCN2S(C)(=O)=O)c(O)c1 794383072 JMOXLEZAURFSAO-CYBMUJFWSA-N 342.417 0.831 10 20 ECCD NC(=O)C1CCN(C(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)CC1 1325400456 IRBYXIBCKGXBKG-RQOWECAXSA-N 348.355 0.378 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCCNC(=O)C1)c1ccc(N(C)C)cc1 1349323713 MZIKBRFIPMAOMT-LBPRGKRZSA-N 332.404 0.278 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCN3C(=O)NC[C@H]3C2)cc1F 131317716 WYOADIMLYPWYKE-LBPRGKRZSA-N 335.383 0.811 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCC(N)CC3)CC2)cc1 237265780 NENQMGVBGNQPHA-UHFFFAOYSA-N 332.448 0.767 10 20 ECCD CC(C)OCCOC[C@@H](O)CN(C)C(=O)c1cccc(O)c1O 279432135 ZHJWSWYHWRGVDU-LBPRGKRZSA-N 327.377 0.972 10 20 ECCD CNS(=O)(=O)NC1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 291476455 FMDCANLEPSALIP-UHFFFAOYSA-N 344.456 0.910 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@](C)(C(=O)O)C2)cc1 817109795 KKALOEZNFRLKCX-QGZVFWFLSA-N 333.388 0.692 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)CN3CCOCC3)C2)cc1 819585043 BEVBXMLVWWZVAR-HNNXBMFYSA-N 333.432 0.970 10 20 ECCD COCCN(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 830626999 DROVGDCKFQQILA-UHFFFAOYSA-N 349.431 0.369 10 20 ECCD C[C@]1(CO)CCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 760093940 BKLFSBBYBZGDFV-CQSZACIVSA-N 328.390 0.751 10 20 ECCD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@H]1O 779268215 PVRKYKWOHNTTPV-JOYOIKCWSA-N 328.390 0.607 10 20 ECCD Cc1ncc(C)c(N2CC=C(CCNC(=O)[C@@H]3CNC(=O)N3)CC2)n1 1089860760 LJNJVAVOUHOSEY-AWEZNQCLSA-N 344.419 0.418 10 20 ECCD C[C@@H](NC(=O)C(=O)NCC(=O)NCC1CC1)c1ccc(N(C)C)cc1 1323500876 IFNRWJQTLZIITD-GFCCVEGCSA-N 346.431 0.572 10 20 ECCD C[C@H](NC(=O)C(=O)N1CC[C@](F)(CO)C1)c1ccc(N(C)C)cc1 1323271794 WLILLEQNVGUGDL-YVEFUNNKSA-N 337.395 0.863 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cn(C)cn1 1334768133 REEKFWMAKZPLDC-UHFFFAOYSA-N 329.404 0.727 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(C(N)=O)CC1 7351549 YVLUSHUCYZQXTF-UHFFFAOYSA-N 332.448 0.908 10 20 ECCD CN(C)[C@H](CNC=C1C(=O)NC(=S)NC1=O)Cc1ccccc1 29006124 XQXCJCQOJPIQKW-LBPRGKRZSA-N 332.429 0.164 10 20 ECCD CN1CCO[C@@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 81266326 CDQBCRONHSAJJN-MRXNPFEDSA-N 337.395 0.609 10 20 ECCD C[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H](C(N)=O)O1 268430974 ISYTULARIBINST-CZUORRHYSA-N 348.447 0.286 10 20 ECCD Cc1cc(O)c(CN2CCN(C(=O)Cn3cnnn3)CC2)cc1C 289799079 MOQXFJVOKITKID-UHFFFAOYSA-N 330.392 0.340 10 20 ECCD CC[C@H](N)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827390810 VBPFESIBOHQCEW-AWEZNQCLSA-N 325.434 0.275 10 20 ECCD C[C@H](CN)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827389886 OZSFDSQRSPULDD-GFCCVEGCSA-N 325.434 0.132 10 20 ECCD CN(C)CC[C@H](N)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 846672035 BBOVSJMYLRYCTM-HNNXBMFYSA-N 338.427 0.558 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1CCCCN1 842171464 RIUZGSPBJCFJES-MRXNPFEDSA-N 342.443 0.937 10 20 ECCD CNC[C@H](C)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 851686263 XNWGEOAICAJHEF-UONOGXRCSA-N 348.447 0.425 10 20 ECCD O=C(CN1C(=O)c2ccccc2S1(=O)=O)NCc1ccccc1O 769362410 JGTYMADYKJUBGQ-UHFFFAOYSA-N 346.364 0.853 10 20 ECCD O=C1NC[C@@H]2CN(Cc3cc(Cl)cc(F)c3O)CCN2C1=O 775736496 HAHFGGTVSSVMNJ-SNVBAGLBSA-N 327.743 0.327 10 20 ECCD NS(=O)(=O)c1cccc(S(=O)(=O)Nc2ccc(O)cc2F)c1 780837607 KJKKUJRRRFDREU-UHFFFAOYSA-N 346.361 0.980 10 20 ECCD CCN(CC)c1ccc(CN2C[C@@H](C(N)=O)[C@H](C(N)=O)C2)cc1F 895315053 WRZONMXUQWQPFR-CHWSQXEVSA-N 336.411 0.691 10 20 ECCD CC[C@@H](OC)C(=O)N1CC(NC(=O)c2cc(OC)nc(OC)c2)C1 996367501 DAZVLCCJGZISDQ-GFCCVEGCSA-N 337.376 0.464 10 20 ECCD CN(C)c1ccc(CNC(=O)c2cccn(CC(=O)O)c2=O)cc1 1593709151 WZYUQRZBUYHXOF-UHFFFAOYSA-N 329.356 0.929 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)c3nc(=O)[nH][nH]3)cc2F)CC1 106922445 DNFOMPKWWGUUHJ-UHFFFAOYSA-N 348.382 0.309 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)Nc2cncnc2N(C)C)cc1 184429528 UEZOLYXXQGNQNJ-UHFFFAOYSA-N 342.403 0.864 10 20 ECCD NS(=O)(=O)c1ccc(CCNC(=O)c2cccc(O)c2O)cc1 322900696 CPTOMXVUOPMTHV-UHFFFAOYSA-N 336.369 0.718 10 20 ECCD C[C@@H](O)c1cn(CC(=O)N2CCOc3cc(N(C)C)ccc32)nn1 268871688 QEQRRUAMVGQMCI-LLVKDONJSA-N 331.376 0.823 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@@H](C)C(=O)OC)nc12 280665282 FLWSMIGJRRDSOK-VIFPVBQESA-N 336.348 0.605 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCNC(=O)[C@H]2C)cc1 283710385 AAYOYJOAPLOSJN-CYBMUJFWSA-N 346.431 0.496 10 20 ECCD O=C1C[C@@H](N[C@@H]2CCc3cccc(O)c32)CN1CCN1CCOCC1 296986360 SCLGMRGAGXSLOM-HZPDHXFCSA-N 345.443 0.902 10 20 ECCD CN(C)c1ccc(CNC(=O)c2cnn(C[C@H](O)CO)c2)cc1F 824669637 OZTFZIYJZOODNK-ZDUSSCGKSA-N 336.367 0.371 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H]3NCC3(C)C)CC2)cc1 829505364 LSPNCSFFXHDXES-QGZVFWFLSA-N 346.475 0.931 10 20 ECCD Cc1noc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 729524827 SZKZAJHOPIUFHC-UHFFFAOYSA-N 326.334 0.385 10 20 ECCD Nc1ccc(CCNS(=O)(=O)CCCN2CCOCC2)cc1 827558841 RIPSTRJPFFBGQS-UHFFFAOYSA-N 327.450 0.453 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)CN1CCOC1=O 823794798 ZIOQNVGSGRZKFW-UHFFFAOYSA-N 336.344 0.736 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)c1cn(C)c(=O)n(C)c1=O 735013422 GJJPIPNKUWNJDO-UHFFFAOYSA-N 330.388 0.388 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)NC[C@H]2CNCCO2)cc1 846177931 FPUJRDGDQYISQS-MRXNPFEDSA-N 336.436 0.761 10 20 ECCD O=C(Cn1nc2n(c1=O)CCCC2)OCC(=O)c1ccc(O)c(O)c1 845230583 NDTZVVVZKYGYCP-UHFFFAOYSA-N 347.327 0.218 10 20 ECCD CCN1CC[C@H](OC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 849712805 RPAHTPDEPVBQLP-LBPRGKRZSA-N 342.373 0.541 10 20 ECCD O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1(O)CNC1 852869549 GNWHNHQOFGKRKX-NSHDSACASA-N 341.358 0.707 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@](C)(OC)C(=O)O)CC2)cc1F 852951532 QIDCCHMGCIBLLV-INIZCTEOSA-N 340.351 0.973 10 20 ECCD Cc1ncc(S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)n1C 858611654 MQPDNFQVFVDSIW-AWEZNQCLSA-N 337.449 0.773 10 20 ECCD Cc1ccc(O)c(CNC(=O)C2CCN(S(N)(=O)=O)CC2)c1 862759935 NGULNOQILZHDAQ-UHFFFAOYSA-N 327.406 0.232 10 20 ECCD CN(C)c1ccc(CN(C(=O)C(=O)N2C[C@@H]3C[C@H]2CN3)C2CC2)cc1 868358213 DUBAVFAIIFNJMY-YOEHRIQHSA-N 342.443 0.816 10 20 ECCD COC[C@@H](O)CN1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1113703950 UJERJDROIQEKQG-AWEZNQCLSA-N 349.391 0.614 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CCCN3C=O)CC2)c(OC)c1 870165728 LDWRQNTZNZXGNT-INIZCTEOSA-N 347.415 0.973 10 20 ECCD CN(Cc1cnn(C)c1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 774170276 CUZGRWIXIZQZMC-UHFFFAOYSA-N 329.404 0.761 10 20 ECCD COC(=O)[C@@H]1CN(Cc2ccc([N+](=O)[O-])c(OC)c2O)CCO1 774877599 LGGHWLZFODVLKD-NSHDSACASA-N 326.305 0.683 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1nc2ncccn2n1 773764253 ZBIVLTNLCYJECF-JTQLQIEISA-N 327.344 0.825 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCc2ncncc2C1 1120388063 JZIUDZFYLARSGS-UHFFFAOYSA-N 326.356 0.726 10 20 ECCD COCCOCCNCCNC(=O)c1ccc(N=NC(N)=O)cc1 1153047575 FTNHYEZDAUEOMO-UHFFFAOYSA-N 337.380 0.831 10 20 ECCD COC[C@@H](OC)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1331736828 CBPNEBXSTPZLMX-MRXNPFEDSA-N 349.431 0.666 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@]1(C)CCC(=O)N1 1331751285 HNQILAGXFGGMCD-SFHVURJKSA-N 347.415 0.916 10 20 ECCD O=C(O)Cn1cc(S(=O)(=O)NCc2cccc(Cl)c2O)cn1 1602164902 NUBNWVZNCRCSCR-UHFFFAOYSA-N 345.764 0.805 10 20 ECCD COCCN1C(=O)/C(=C\Nc2ccccc2C(=O)O)C(=O)NC1=S 1606893240 IVLXXBYWEILQEQ-NTMALXAHSA-N 349.368 0.570 10 20 ECCD CN1CCN(c2ccc(CN3C[C@@H](O)C[C@H]3C(=O)O)cc2F)CC1 1610136977 FEXDEWLEMPJTCN-BBRMVZONSA-N 337.395 0.597 10 20 ECCD C[C@H](NC(=O)C1(NC(N)=O)CC1)c1ccc(N2CCOCC2)cc1 162822282 QEQQNHNESBUZDD-LBPRGKRZSA-N 332.404 0.901 10 20 ECCD C[C@H](O)C[C@H]1COCCN1C(=O)C(=O)N(C)Cc1ccccc1O 1348401139 WHZGKGBCEWCKJS-JSGCOSHPSA-N 336.388 0.349 10 20 ECCD O=C1CN(C(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)CCN1 268100380 NJCKFPGHIZNORD-HNNXBMFYSA-N 347.415 0.332 10 20 ECCD CCOCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 283430125 BLVDZEUWAZUJFY-UHFFFAOYSA-N 335.404 0.292 10 20 ECCD COC(=O)[C@@H](C)N(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 280696866 ICWGFJMBKUKSFF-CQSZACIVSA-N 349.431 0.837 10 20 ECCD C[C@@H](CCN)NC(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 911293236 CPPYHCKRVHPDHG-XJKSGUPXSA-N 349.479 0.325 10 20 ECCD O=C(NCc1ccc(N2CCCCC2)cc1)[C@H]1CCS(=O)(=O)N1 845310604 BAETYSNSYRYWPT-OAHLLOKOSA-N 337.445 0.985 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCN(C)C[C@@H]1CN)c1ccc(N(C)C)cc1 842201785 CCPISGJJAASNFC-BBRMVZONSA-N 347.463 0.031 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)NC/C=C\CO)CC2)cc1 853543065 ZLKSFACRQFDUNI-IHWYPQMZSA-N 348.447 0.665 10 20 ECCD C[C@H](C(=O)N(C)C)N1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1031464160 IDJUMGMMTPJPDL-SNVBAGLBSA-N 346.391 0.740 10 20 ECCD C[C@H](NC(=O)N1C[C@H](O)C[C@H]1CO)c1ccc(N2CCOCC2)cc1 776120076 REALYOBICJBQOS-RRQGHBQHSA-N 349.431 0.721 10 20 ECCD C[C@@H](C(N)=O)N1CC[C@](C)(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1046862575 MFOPZVYFABSJJR-QFYYESIMSA-N 346.391 0.917 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)[C@H](NC(=O)C2CC2)[C@H](C)O)c1 779538328 VHUIMJWJDXASAF-AMJWSMQMSA-N 336.388 0.854 10 20 ECCD COc1ccc(CNC[C@@H]2CCN(S(C)(=O)=O)C2)c(O)c1OC 893223940 RMNSAPAVBAFOTI-NSHDSACASA-N 344.433 0.781 10 20 ECCD CN(C)c1ccc([C@H](CNc2cc(=O)n(C)c(=O)n2C)N(C)C)cc1 897521468 GTGMHRULBZTGKN-HNNXBMFYSA-N 345.447 0.865 10 20 ECCD CNC(=O)CC(=O)NCCC1=CCN(c2ncnc3c2CCC3)CC1 1089822701 MWAMWKSIFKDDLK-UHFFFAOYSA-N 343.431 0.744 10 20 ECCD Cc1ncc(C)c(N2CC=C(CCNC(=O)Cn3ncnn3)CC2)n1 1089845554 VAULUXJUZPQBEE-UHFFFAOYSA-N 342.407 0.423 10 20 ECCD Cc1nc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)n[nH]1 1333387245 KJAHDBGYDBLDRZ-UHFFFAOYSA-N 330.392 0.454 10 20 ECCD CCOc1ccc(N2CCN(C(=O)COCC(=O)OC)CC2)cc1 1350969087 VUQPEJPHBMUUKW-UHFFFAOYSA-N 336.388 0.924 10 20 ECCD CN1C(=O)C(=CNc2sccc2-c2nn[nH]n2)C(=O)N(C)C1=O 1591161843 SPZCDDURIIXAAB-UHFFFAOYSA-N 333.333 0.274 10 20 ECCD C[C@H](NCCNS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 158236224 PPRDPKVWKUKCEK-ZDUSSCGKSA-N 327.450 0.723 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2ccc(=O)n(C)c2=O)cc1F 69914195 LHZNDIYHMRFBMB-UHFFFAOYSA-N 334.351 0.069 10 20 ECCD Cc1ccc(C(=O)N2CCCN(S(C)(=O)=O)CC2)c(O)c1O 267551712 DBMURGPQBPGWSY-UHFFFAOYSA-N 328.390 0.514 10 20 ECCD O=C(NCCS(=O)(=O)N1CCSCC1)c1cccc(O)c1O 274967712 MPFNVMNKIDFBME-UHFFFAOYSA-N 346.430 0.206 10 20 ECCD C[C@@H](O)CCN(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 285726692 NSHHOMRHPDPPCY-CYBMUJFWSA-N 333.432 0.915 10 20 ECCD COCCn1nnc2c1CCN(Cc1cc3c(cc1O)OCO3)C2 293766545 YDYPPEGCOOQIRA-UHFFFAOYSA-N 332.360 0.917 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCn2ncnc2C1)c1ccc(N(C)C)cc1 807674660 OTAPGLJIBZQEMU-LBPRGKRZSA-N 342.403 0.564 10 20 ECCD C[C@@H]1C(=O)NCCN1C(=O)C(=O)NCCCSc1nccs1 806281954 CJTCQVNJYDKTPD-SECBINFHSA-N 342.446 0.088 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@@H]3CCNC3)C2)cc1 818677214 RCFBLKQLIPNNID-ZIAGYGMSSA-N 346.431 0.116 10 20 ECCD C[C@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)C[C@@H](C)S1(=O)=O 811797668 JZEFGEDSASQSTQ-RBZYPMLTSA-N 327.402 0.825 10 20 ECCD CS(=O)(=O)NCCN1C(=O)/C(=C\c2cccnc2)SC1=S 727178292 UOJHDXHXEWPKET-JXMROGBWSA-N 343.455 0.832 10 20 ECCD NC(=O)NC(=O)CCNCc1ccc(N2CCC(CO)CC2)cc1 843066324 UUKKEKXFJOBXGW-UHFFFAOYSA-N 334.420 0.570 10 20 ECCD COC[C@H](C)NC(=O)NC(=O)CN1CCCc2cc(CN)ccc21 843349937 NBVIJXYXGLDWSP-LBPRGKRZSA-N 334.420 0.759 10 20 ECCD O=S(=O)(NCc1ccc(N2CCC(O)CC2)cc1)c1cnc[nH]1 851844165 QHORDBPPVDIASC-UHFFFAOYSA-N 336.417 0.849 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)NC[C@H]3COCCN3)C2)cc1 861647149 CDNYYSWRIAQEFE-CABCVRRESA-N 348.447 0.809 10 20 ECCD COc1ccc(-n2nnnc2CN2C[C@H]3C[C@H]2[C@@H]3NC(C)=O)cc1 1037270330 UZEHHKXEHYEVHW-DIOULYMOSA-N 328.376 0.380 10 20 ECCD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1119484703 RMEZTOXRLMZRLI-HNNXBMFYSA-N 344.459 0.923 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CCN(C)C3=O)CC2)c(OC)c1 870167518 JXCUNQFGYKEICA-CQSZACIVSA-N 347.415 0.831 10 20 ECCD Cc1cc(N(C)C)ccc1CNS(=O)(=O)[C@H](C)C(=O)N(C)C 774881099 PJNIZTZQYUUANE-GFCCVEGCSA-N 327.450 0.957 10 20 ECCD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC1 795804965 AJOYZGVLPZSMBM-UHFFFAOYSA-N 329.397 0.702 10 20 ECCD COCC(=O)N1C[C@H]2[C@H](NC(=O)c3ccc(N=NC(N)=O)cc3)[C@H]2C1 976709823 HPLIBKDVWSSSQL-IMRBUKKESA-N 345.359 0.682 10 20 ECCD COc1ccc(-n2nnnc2CN2CC[C@H]2CN(C)C(C)=O)cc1 1085447101 USEUJDZFHWBROI-AWEZNQCLSA-N 330.392 0.724 10 20 ECCD COc1cccc(CNC(=O)[C@@H]2CC(c3cnn(C)c3)=NO2)c1O 1335855886 PCGWRMFVENWYPS-AWEZNQCLSA-N 330.344 0.944 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3COCCO3)ccc21 1341846152 SEGHKPPNALGHSG-OAHLLOKOSA-N 347.415 0.217 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2nn[nH]n2)n1C 1609115751 JIJBOUZVCSYMSK-SECBINFHSA-N 342.359 0.977 10 20 ECCD CN1CCN(CCN(CC(=O)O)Cc2cc(F)c(F)cc2O)CC1 1598616818 KPDQGNHRDDQYFZ-UHFFFAOYSA-N 343.374 0.804 10 20 ECCD O=C(NCCS(=O)(=O)NCC1CCC1)NCc1ccccc1O 69427106 QGCTZXUODPMEMK-UHFFFAOYSA-N 341.433 0.911 10 20 ECCD COc1cc(N2CC(n3cc(C(=O)O)nn3)C2)c([N+](=O)[O-])cc1OC 327216739 LDKCDHCCGUOMSU-UHFFFAOYSA-N 349.303 0.963 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN[C@H]3C(=O)NCC[C@@H]3C)nc12 282283917 IIXTWUNJPMJASY-TVQRCGJNSA-N 347.375 0.226 10 20 ECCD COCCS(=O)(=O)CC(=O)NCc1ccc(N2CCCC2)cc1 298488842 BTAGGQNYCLBFHV-UHFFFAOYSA-N 340.445 0.964 10 20 ECCD COC(=O)COCC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 822371197 SQMVXZWLNXAAHV-CYBMUJFWSA-N 336.388 0.827 10 20 ECCD O=C1CNCCN1[C@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1 843063502 BSJIXSBBEHTRSY-ZDUSSCGKSA-N 333.388 0.517 10 20 ECCD CN(CC(=O)NCCCN1CCCC1=O)c1ccc2c(c1)OCO2 756653399 INTHWFLKRGPRCW-UHFFFAOYSA-N 333.388 0.980 10 20 ECCD C[C@@H]1[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CCS1(=O)=O 863530589 ZBQIAPZSHVMUKX-ZYHUDNBSSA-N 338.385 0.732 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CN(CCCO)CCO2)cc1 1035623988 FZOREGCTIMCSSK-CQSZACIVSA-N 349.391 0.662 10 20 ECCD COc1ccc(CN[C@@H]2CS(=O)(=O)C[C@H]2OC)c(O)c1OC 895344006 KLRJJKXKQFHAKR-ZYHUDNBSSA-N 331.390 0.311 10 20 ECCD Cn1nncc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 784735250 FFRMXOJXAWWJOX-UHFFFAOYSA-N 337.405 0.130 10 20 ECCD NC(=O)CN1CCC2(C1)CN(C(=O)c1ccc(N=NC(N)=O)cc1)C2 1073473484 BJSVDLSWRIGGFL-UHFFFAOYSA-N 344.375 0.482 10 20 ECCD COc1ccc(CNC(=O)NCC(C)(C)NS(C)(=O)=O)c(O)c1 792930597 AJDOPOSPOKXQPB-UHFFFAOYSA-N 345.421 0.528 10 20 ECCD CSCCC(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089804632 QFXHCYWXBFAMPG-UHFFFAOYSA-N 347.448 0.915 10 20 ECCD COC[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)OC 1325140640 DDEYROMQLCJBOY-SWLSCSKDSA-N 337.420 0.707 10 20 ECCD CCOC(=O)[C@H]1CNCCN1Cc1ccc(N2CCN(C)CC2)cc1 1328400267 GDWZXSUCXAYMDA-GOSISDBHSA-N 346.475 0.775 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CC[C@@H](CN)C2)c1 1579347779 LZNCASRIKFVZJJ-NXEZZACHSA-N 327.406 0.621 10 20 ECCD CCC(=O)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250703 FOKTVAVHTQIWNV-UHFFFAOYSA-N 333.344 0.289 10 20 ECCD COc1ccc(N2CCN(Cc3cn(CC(=O)O)nn3)CC2)cc1F 1599585507 CGUHVSGYKMOKGE-UHFFFAOYSA-N 349.366 0.833 10 20 ECCD Cc1cc(-c2nn[nH]n2)c(O)nc1C(=O)NCc1ccc(O)cc1O 1591835342 HQUUTTZWJKYNAI-UHFFFAOYSA-N 342.315 0.617 10 20 ECCD O=C(NCc1ccc(-c2nn[nH]n2)cn1)NCc1ccccc1O 1593135270 LGUKZYYBNRIPAJ-UHFFFAOYSA-N 325.332 0.967 10 20 ECCD CN(C)c1ccc(CNC(=O)[C@@H]2CCCN(CC(=O)O)C2=O)cc1 1593708840 GEPFHOJLZVULRA-AWEZNQCLSA-N 333.388 0.692 10 20 ECCD CNS(=O)(=O)[C@H]1CCN(Cc2cc(F)cc(C(C)=O)c2O)C1 156141066 STXJKSUSGSMOOP-LBPRGKRZSA-N 330.381 0.857 10 20 ECCD C[C@@H](O)CN1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 189338442 UROZBWKFHJNTML-MRXNPFEDSA-N 348.491 0.709 10 20 ECCD Nc1ccc(NC(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)cc1 238006981 HSIBQJZLLBECBU-CYBMUJFWSA-N 332.404 0.388 10 20 ECCD CN(C)S(=O)(=O)c1cnn(CC(=O)c2ccc(O)c(O)c2)c1 737405561 ICLUKBCZVCPUJD-UHFFFAOYSA-N 325.346 0.428 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C[C@H](C)N1 842150179 OHAMAELXXMANAJ-KBPBESRZSA-N 344.459 0.894 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CC[C@@H](CN)C3)CC2)cc1 844219577 LDWZFUQSAXDAMS-HNNXBMFYSA-N 332.448 0.624 10 20 ECCD C[C@@H](C(=O)O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 842571129 RPVGRERQHUEOQY-LLVKDONJSA-N 340.401 0.258 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3CCCN3)ccc21 842150660 UKRVXMNBAJLHQC-HNNXBMFYSA-N 330.432 0.553 10 20 ECCD O=C1C[C@H](C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)N1 854906020 MXIVPXSWPNAZTK-GFCCVEGCSA-N 325.315 0.306 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)NC[C@H]2CC[C@H](C(N)=O)O2)c1 759777819 XEGMSNHSNICEEP-DRCTWCGVSA-N 337.376 0.794 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)CCS(C)(=O)=O 854988402 WIEZQHFTXLVFDM-UHFFFAOYSA-N 343.401 0.719 10 20 ECCD NS(=O)(=O)C[C@@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 932944051 BNCZSVRSKRRNGR-OAHLLOKOSA-N 339.461 0.634 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@@H]3COC[C@H]3O)C2)cc1 889265183 UKVJTGPXIIAXEK-KBRIMQKVSA-N 349.431 0.923 10 20 ECCD COc1cccc(O)c1CNc1cnn(CC(=O)NCCN(C)C)c1 893549978 GSPCWNSWRMEKJJ-UHFFFAOYSA-N 347.419 0.887 10 20 ECCD O=C(NCCC1=CCN(c2cc(F)ncn2)CC1)C(=O)NCC1CC1 1089840456 QZTXJWDIKSTSBO-UHFFFAOYSA-N 347.394 0.785 10 20 ECCD COc1ccc(CNC2CCN(C(=O)c3nnn(C)n3)CC2)cc1C 996907968 ORDPLYHCSAHRPK-UHFFFAOYSA-N 344.419 0.922 10 20 ECCD CNC(=O)[C@H]1CCC[C@@H]1NC(=O)C(=O)N(C)Cc1ccccc1O 1325447386 YOEXAPITRBNJFA-STQMWFEESA-N 333.388 0.382 10 20 ECCD C[C@@H](NC(=O)C(=O)N[C@H]1CCN(C)C1=O)c1ccc(N(C)C)cc1 1323490596 QPPDVFWCRLCGIA-RISCZKNCSA-N 332.404 0.277 10 20 ECCD C[C@@H]1CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1331951595 WHCPKXSLCNFQJJ-GFCCVEGCSA-N 335.379 0.899 10 20 ECCD CCn1c(C(N)=O)nnc1N(C)CCN(C)c1ccc(OC)cc1 1339636875 PETJRJDFVQIGTF-UHFFFAOYSA-N 332.408 0.978 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)Nc1ccon1 1333484233 GTNDXYJGCQYQFT-UHFFFAOYSA-N 344.371 0.891 10 20 ECCD COC[C@H]1CN(Cc2cc(O)n3ncc(C(=O)O)c3n2)C[C@H](C)O1 1332645326 NKVAKHAUMYHTLZ-GXSJLCMTSA-N 336.348 0.369 10 20 ECCD COc1ccc(N2CC[C@H](NC(=O)[C@H]3CC(C(=O)O)=NO3)C2)cc1 1604809593 LRKHNNPAMZVBFR-IINYFYTJSA-N 333.344 0.620 10 20 ECCD CCNC(=O)NC(=O)CN(C)Cc1ccc(N2CCOCC2)cc1 16386988 SMLHGAGWSAUFLJ-UHFFFAOYSA-N 334.420 0.801 10 20 ECCD C[C@@H]1c2nncn2CCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 283440754 JWTGGMBEXFJAKL-GFCCVEGCSA-N 342.403 0.564 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CNCCO1 842276928 FYKXOOJMUNVWSR-INIZCTEOSA-N 348.447 0.206 10 20 ECCD CN(C[C@H]1CCCC[C@@H]1O)C(=O)C(=O)NCCc1ccc(N)cc1 842238098 IBNIYJFPPUPEJQ-ZBFHGGJFSA-N 333.432 0.937 10 20 ECCD C[C@H](NC(=O)C(=O)NC[C@H]1CNCCO1)c1ccc(N(C)C)cc1 842202927 MTRQKQQVCQLAMW-SWLSCSKDSA-N 334.420 0.034 10 20 ECCD Nc1ccc(CCNS(=O)(=O)c2cnn([C@H]3CCOC3)c2)cc1 842822642 GWFWCPBYOCSGAV-AWEZNQCLSA-N 336.417 0.948 10 20 ECCD CO[C@@H]1COC[C@@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852381281 YQOMBLGKVIBCMP-DLBZAZTESA-N 349.431 0.861 10 20 ECCD COc1ccc(N(C)CCN(C)S(=O)(=O)N2CCNCC2)cc1 923652346 MRSJYCPORAQQTN-UHFFFAOYSA-N 342.465 0.213 10 20 ECCD CN[C@@H]1CCN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 923277049 BFMPUYMJMIHUDV-SJLPKXTDSA-N 348.491 0.472 10 20 ECCD CC[C@H](C(N)=O)N1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1031464640 VZRLUJQRAPLGAK-GFCCVEGCSA-N 332.364 0.527 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2COC(=O)C2)N(C)C)cc1 1119978268 ZISVBJBRKAZDLY-ZFWWWQNUSA-N 334.420 0.970 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCOCC3)CC2)cc1F 779222779 CPUBMJNGXUDGLQ-UHFFFAOYSA-N 337.395 0.815 10 20 ECCD CNCCNC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 891992931 BQOAJHRWXLERHP-UHFFFAOYSA-N 333.436 0.407 10 20 ECCD Cn1cc([C@@H]2C[S@@](=O)CCN2C(=O)c2cccc(O)c2O)cn1 799001210 NUWJMJGCHJSQRO-MYODQAERSA-N 335.385 0.777 10 20 ECCD Nc1nccnc1C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089823172 YPPFSOSSXUTODT-UHFFFAOYSA-N 343.366 0.945 10 20 ECCD CCS(=O)(=O)CC(=O)NCCNCc1ccc(OC)c(C)c1 1152376431 BKCWZHWYNMOFDF-UHFFFAOYSA-N 328.434 0.644 10 20 ECCD CC(C)NC(=O)CCNC(=O)C(=O)NCc1ccc(N(C)C)cc1 1321365127 PHKMWIKNDQFECH-UHFFFAOYSA-N 334.420 0.400 10 20 ECCD N[C@H](CCC(=O)O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1601175167 YIAZJZKXFHNZIM-MRXNPFEDSA-N 349.431 0.704 10 20 ECCD CN(C)CCN1CCN(C(=O)NCCc2ccc(N)cc2)CC1=O 1578419022 WAIXJDFFWYGMKR-UHFFFAOYSA-N 333.436 0.227 10 20 ECCD O=C(O)Cn1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)nn1 1595143708 RAZNBWXHLLMZFU-UHFFFAOYSA-N 345.359 0.129 10 20 ECCD C[C@H](N[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccccc1O 183609946 DJPZKCOGCTWKPH-GJZGRUSLSA-N 333.432 0.976 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCC1CC1 191755825 XLJSTSTWGKZKQQ-UHFFFAOYSA-N 335.379 0.805 10 20 ECCD Cc1ccc(C(=O)N[C@H]2CCN(CCN3CCOCC3)C2)c(O)c1O 371663711 DXTSSOANPNQEAE-AWEZNQCLSA-N 349.431 0.543 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3C[C@@H](O)C3)cc2)CC1 822321026 VOPSGRQNLDPTAI-WOVMCDHWSA-N 331.416 0.742 10 20 ECCD COc1ccc(O)c(CNC(=O)CCC(=O)NCCNC(C)=O)c1 734018448 RYBLWUHENLKUAE-UHFFFAOYSA-N 337.376 0.050 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC[C@@H](CN)C2)cc1 846363639 OLACEMJYBHSKHE-AWEZNQCLSA-N 348.447 0.397 10 20 ECCD CN(CCCN1CCCC1)C(=O)C(=O)NCCc1ccc(N)cc1 842237623 WSYMJPMLZAYHDX-UHFFFAOYSA-N 332.448 0.872 10 20 ECCD O=C(NCc1ccccc1O)C(=O)Nc1ccc(-n2cnnn2)cc1 748481245 IRNPNHHJPVSQOA-UHFFFAOYSA-N 338.327 0.623 10 20 ECCD O=C1CC[C@@H](C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)N1 868838829 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344.419 0.346 10 20 ECCD Cc1nonc1CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807676005 BSJUWAMDYNKBOC-SNVBAGLBSA-N 331.376 0.938 10 20 ECCD COC[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 297819077 LKIUWGLBLAJLQA-MRXNPFEDSA-N 349.431 0.585 10 20 ECCD O=C(CCn1cc[nH]c(=O)c1=O)NCc1ccc(N2CCCC2)cc1 726865517 INVRBYCPZQLVCS-UHFFFAOYSA-N 342.399 0.843 10 20 ECCD CNC[C@@H](C)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 832172156 DHJYAOZKDPFASK-CQSZACIVSA-N 332.448 0.827 10 20 ECCD COc1ccc(N(C)CC(=O)NCCCN(C)S(C)(=O)=O)cc1 844353060 FGHPXFZDBDBQTF-UHFFFAOYSA-N 343.449 0.529 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@@H]3COCO3)cc2)CC1 923837009 AZHYVCGLTVMEMW-MRXNPFEDSA-N 334.420 0.611 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(CC(N)=O)[C@H](C)C2)cc(OC)n1 947496418 AQDIKZYAKSUKHP-ZYHUDNBSSA-N 336.392 0.167 10 20 ECCD COc1ccc(CN[C@H]2CN(C(=O)Cn3cnnn3)C[C@@H]2C)cc1C 1054373339 FESMICXHFASBNV-ZFWWWQNUSA-N 344.419 0.627 10 20 ECCD C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CN(CC(N)=O)C1 970954852 PUVRZFPNSMMESF-VIFPVBQESA-N 332.364 0.384 10 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COc1ccc(N2CC[C@@H](CNC(=O)CN3CCNC(=O)C3)C2)cc1 911277970 ZHNXTBWWAIGQAA-AWEZNQCLSA-N 346.431 0.070 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CC(=O)N(C)C1 914919070 IGRHHFMABLTWBC-AWEZNQCLSA-N 347.415 0.733 10 20 ECCD O=C1CCC(=O)N1CCN1C(=O)CN(Cc2ccccc2O)C1=O 925302768 FUWDVARSQNDQJS-UHFFFAOYSA-N 331.328 0.305 10 20 ECCD COc1ccc(N2CCN(C(=O)CS(C)(=O)=O)CC2)cc1F 753737596 GUINYJHLIHAVGS-UHFFFAOYSA-N 330.381 0.528 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)[C@@H](NC(=O)C2CC2)[C@@H](C)O)c1 779538332 VHUIMJWJDXASAF-WMFXKJRFSA-N 336.388 0.854 10 20 ECCD C[C@@H]1CCN(CC(N)=O)C[C@@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 968684850 JVTMTWLUDDVNJO-MFKMUULPSA-N 346.391 0.775 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N(C)CCOCCN)cc2)CC1 892940599 YWNVABBDCJPNSI-UHFFFAOYSA-N 349.479 0.555 10 20 ECCD CCN(C(=O)C(=O)NCCCSc1nccs1)[C@H]1CCNC1 1337402876 PHZLUUZPOSEBDG-NSHDSACASA-N 342.490 0.952 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNC/C=C\CO)CC2)cc1 1262566186 IYXSEUSTJRMMJM-BAHPRDJBSA-N 335.448 0.316 10 20 ECCD Nc1ccc(NC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1 1345811349 HBKFHPGQFIAGTH-GWCFXTLKSA-N 337.401 0.243 10 20 ECCD CN1CCN(c2ccc(CN3C[C@@H](O)C[C@]3(C)CO)cc2F)CC1 1350328457 TYMSICUHDRMOFS-MAUKXSAKSA-N 337.439 0.895 10 20 ECCD C[C@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)C[C@@H](C(=O)O)O1 1599928182 WLYHBVNAYVPSKQ-WFASDCNBSA-N 335.404 0.543 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)Cn3cccn3)nc12 265088521 SIQGOLACQJGNSR-LLVKDONJSA-N 344.375 0.986 10 20 ECCD CCN1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1=O 807677615 RCYDRRYTZGUPIP-ZDUSSCGKSA-N 346.431 0.621 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCO[C@@H](C(=O)O)C1 817888114 ATOPFPHTNQBULX-CQSZACIVSA-N 349.387 0.023 10 20 ECCD COc1cccc(CNC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2OC)c1O 821153622 FZASPQRDSQZBNM-ZYHUDNBSSA-N 344.389 0.012 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2CCS(=O)(=O)C2)c1 729041605 UUZQIGZXMUEZJZ-UWVGGRQHSA-N 328.390 0.948 10 20 ECCD CNS(=O)(=O)N1CCC(C(=O)N[C@H](C)c2ccccc2O)CC1 827946214 ANYPXQDTCQCBJC-LLVKDONJSA-N 341.433 0.746 10 20 ECCD CN(C)c1ccc(CNS(=O)(=O)N(C)CCC(=O)O)cc1F 830639903 TUJZNHZIOCRBKQ-UHFFFAOYSA-N 333.385 0.633 10 20 ECCD CN1CCN(c2ccc(CNC[C@H](O)CN(C)C3CC3)cc2)CC1 905425877 CEKRUALDQXVEKX-IBGZPJMESA-N 332.492 0.983 10 20 ECCD Cn1nccc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 748839409 UZNXEACOELQUOY-UHFFFAOYSA-N 348.428 0.585 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CCn2ncn(C)c2=O)cc1 844857048 OQTUPHSYFWJZSF-UHFFFAOYSA-N 347.419 0.575 10 20 ECCD N[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 842213918 PCZBTEGVKIXPNF-MRXNPFEDSA-N 330.432 0.757 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3CCC[C@@]3(N)C2)cc1 857100812 NNYQLNVNPGRAKQ-RDTXWAMCSA-N 330.432 0.709 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCc3nonc3C)C2)cc(OC)n1 1020352375 LTLHSRNYUWHJPZ-HAQNSBGRSA-N 347.375 0.841 10 20 ECCD C[C@H](C(N)=O)N1CC(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1032215680 LSQFVWUVNFEDGW-SECBINFHSA-N 332.364 0.384 10 20 ECCD COC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1117416089 RZJIFAUAALSLCT-CYBMUJFWSA-N 335.404 0.291 10 20 ECCD COc1ccc(N2CCN(Cc3nc(=O)n(C)[nH]3)CC2)c(OC)c1 879463328 WBHKXQBWNQWBJK-UHFFFAOYSA-N 333.392 0.448 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCn1ccnc1 775101989 YMBLZBAWJYRYQV-UHFFFAOYSA-N 329.404 0.690 10 20 ECCD CCC1(CC)NC(=O)N(CC(=O)NCCc2ccc(O)c(O)c2)C1=O 770631740 VEEVZDZPFAFYEO-UHFFFAOYSA-N 349.387 0.867 10 20 ECCD Cc1ccc(C(=O)N2CCC(N(C)S(C)(=O)=O)CC2)c(O)c1O 780911867 SCWLDVJUQNUAOC-UHFFFAOYSA-N 342.417 0.902 10 20 ECCD C[C@@H](NC(=O)C(=O)NCCN1CCNC1=O)c1ccc(N(C)C)cc1 897864738 AFOWRMLJQIBCJO-GFCCVEGCSA-N 347.419 0.071 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC1(O)CCC1 1324497126 BDCVAWACSHTVOW-LBPRGKRZSA-N 337.372 0.993 10 20 ECCD C[C@H]1[C@@H](C)N(C(=O)C(=O)N(C)Cc2ccccc2O)CC[S@@]1=O 1325340153 DEFBCUWNNHWMEW-WCBZVUCDSA-N 338.429 0.719 10 20 ECCD CN(CCNS(C)(=O)=O)C(=O)NCc1ccc(N(C)C)cc1 1322806828 NQALLMWMVFSHQC-UHFFFAOYSA-N 328.438 0.443 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H](N2CC=CC2)C1 1348176302 ZPVFZIQAGMBJSC-HNNXBMFYSA-N 329.400 0.823 10 20 ECCD C[C@@]1(C(=O)O)CCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1603293153 YGVGOCNSSOUNRU-AWEZNQCLSA-N 342.373 0.843 10 20 ECCD O=C(O)c1cn([C@@H]2CCN(Cc3cc4c(cc3O)OC[C@H]4O)C2)nn1 1610858541 IRBOUUHCYDOHHM-QMTHXVAHSA-N 346.343 0.555 10 20 ECCD COc1cc(C)c(CNCC[C@H]2CNCCS2(=O)=O)c(O)c1 1579145380 ZTCHGCDDJGPGFT-ZDUSSCGKSA-N 328.434 0.576 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(NC)CCC1 1578026068 PGNFOEXOPZOFCS-LBPRGKRZSA-N 336.388 0.830 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)NCCNS(C)(=O)=O 66698852 RFWHRRQCPKTJFT-UHFFFAOYSA-N 329.422 0.863 10 20 ECCD O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NCc1ccccc1O 266650509 ZLWMOYIJIJTEIR-UXOAXIEHSA-N 330.340 0.171 10 20 ECCD Cn1c(=O)nc(O)c2nc(CCC(=O)NCc3ccccc3O)[nH]c21 748347156 WQMNRKKFRJFQEH-UHFFFAOYSA-N 343.343 0.317 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNCC[C@H](C)O)CC2)cc1 843063233 UELPLPJEIFLIQA-RDJZCZTQSA-N 337.464 0.539 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCO[C@H](C(N)=O)C1 840490201 XLGMFHUYOGGSCH-BBRMVZONSA-N 348.447 0.888 10 20 ECCD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C[C@@H]1CO 857074056 DUXGHUXUFRQAIH-DZGCQCFKSA-N 333.432 0.846 10 20 ECCD Cc1cccc(O)c1CN(C)CC(=O)N[C@H]1CCS(=O)(=O)C1 876616448 NFDHCFRHJJJMOP-LBPRGKRZSA-N 326.418 0.436 10 20 ECCD CC(=O)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 1118813933 QNTSAIGAOCLUHI-CQSZACIVSA-N 332.404 0.106 10 20 ECCD CO[C@@H]1COC[C@@H]1NC(=O)NCc1ccc(N2CCN(C)CC2)cc1 883742584 JKKZIAYWWCEWHF-DLBZAZTESA-N 348.447 0.651 10 20 ECCD CN(CCc1ccccn1)C(=O)CNC(=O)c1cccc(O)c1O 790632176 XOWLLFDGOUVQKR-UHFFFAOYSA-N 329.356 0.924 10 20 ECCD CO[C@@H](C)C(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089810612 UMZWDUMERQMBTQ-NSHDSACASA-N 331.380 0.197 10 20 ECCD O=C(NCCC1=CCN(c2nccn3nnnc23)CC1)[C@@H]1CCOC1 1089813737 YCTTZUUUIVNQEE-CYBMUJFWSA-N 343.391 0.199 10 20 ECCD C[C@@H](NCCOCCS(C)(=O)=O)c1cc(C(=O)O)ccc1O 1593271655 KEURUCDEWVLNAG-SNVBAGLBSA-N 331.390 0.802 10 20 ECCD CN1CCN(c2ccc(CN3CCC[C@@H](O)[C@H]3C(=O)O)cc2)CC1 1598622800 ZNMNQCUZDVXEAX-SJORKVTESA-N 333.432 0.848 10 20 ECCD 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COCCN(Cc1cc2c(cc1O)OCO2)[C@@H]1CCS(=O)(=O)C1 8148134 LXBBZLIRBREPAR-GFCCVEGCSA-N 343.401 0.756 10 20 ECCD CC(=O)NC[C@@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)CCO1 172186573 NGCVYLNEVMSBQC-QGZVFWFLSA-N 348.447 0.206 10 20 ECCD CS(=O)(=O)NCCNC(=O)NCc1ccc(N2CCCC2)cc1 48558418 OARVBTOACZNFTO-UHFFFAOYSA-N 340.449 0.635 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H](C)S(C)(=O)=O)CC2)cc1F 84814769 DFNRPPFZNPKQBJ-LLVKDONJSA-N 344.408 0.916 10 20 ECCD COCC[C@H](CO)NC(=O)NCc1ccc(N2CCOCC2)cc1 280932087 FANDWZYBBAAXST-OAHLLOKOSA-N 337.420 0.720 10 20 ECCD COC[C@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCO1 807673868 AREWTCPXVLCCCM-CZUORRHYSA-N 349.431 0.804 10 20 ECCD C[C@H](O)CN(C)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 803304397 BEYBNIWUGPAELE-UONOGXRCSA-N 349.431 0.540 10 20 ECCD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCNC(=O)C2)c1 915809228 OYHVAUPHEWGQPR-UHFFFAOYSA-N 347.415 0.359 10 20 ECCD CCC(=O)N[C@H]1CCN(Cc2nnnn2-c2ccc(OC)cc2)C1 1009816216 PQVRWCNFGPUDMB-LBPRGKRZSA-N 330.392 0.771 10 20 ECCD COc1ccc(O)c(CNC(=O)NCCc2nnc(S)n2C)c1 853736890 RZTQYEUCSMYIFM-UHFFFAOYSA-N 337.405 0.860 10 20 ECCD COC(=O)c1cnn(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 860696886 HMDZXJRXXOTORQ-JTQLQIEISA-N 333.344 0.828 10 20 ECCD COc1ccc(N2CCN(C(=O)CCNC(N)=O)CC2)c(OC)c1 870162632 LJUHEJNQFVAYDT-UHFFFAOYSA-N 336.392 0.411 10 20 ECCD COC(=O)[C@@H](NCc1ccc(OC)c(Cn2cccn2)c1)[C@@H](C)O 1119520030 XYCIPEWTDKRPKI-WBMJQRKESA-N 333.388 0.952 10 20 ECCD CN(C)c1cc(F)c(CN2C[C@H](C(N)=O)[C@@H](C(N)=O)C2)cc1F 895312827 TUHLVDDYIKMMHT-UWVGGRQHSA-N 326.347 0.049 10 20 ECCD Cn1nnc(C(=O)NCCC2=CCN(c3cccc(F)n3)CC2)n1 1089853531 DSLMHIQKMWUNPN-UHFFFAOYSA-N 331.355 0.701 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@H](OC)C3CC3)C2)cc(OC)n1 996368340 LRIKZCJBMZKOCC-OAHLLOKOSA-N 349.387 0.464 10 20 ECCD COCC(=O)NCCCN(C)Cc1nnnn1-c1ccc(OC)cc1 1230945496 XXLPPOUVNGPPIJ-UHFFFAOYSA-N 348.407 0.255 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN[C@H]3CO[C@@H](C)C3)CC2)cc1 1335397910 LCJGEFLMMVQGCC-LZLYRXPVSA-N 349.475 0.945 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CC(F)C3)C2)cc1 1332043074 HJUNTVTYTMYUBD-LBPRGKRZSA-N 335.379 0.818 10 20 ECCD O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@@H]1COCCN1 1602057571 LFPIOAFZTJOENE-GFCCVEGCSA-N 342.779 0.837 10 20 ECCD C[C@H]1[C@@H](C)N(C(=O)c2ccccc2S(C)(=O)=O)CCS1(=O)=O 265525685 MTRAENMWRSKOLB-MNOVXSKESA-N 345.442 0.738 10 20 ECCD CCS(=O)(=O)N1CCC[C@@H](C(=O)NCc2ccc(O)c(O)c2)C1 272332658 MYODQCPELHACLO-GFCCVEGCSA-N 342.417 0.776 10 20 ECCD CO[C@H](CN)CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 278240557 LKHVDDQGGIHTLO-KRWDZBQOSA-N 335.448 0.875 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)NS(C)(=O)=O 274984654 XWTKSYSXFVBALY-SECBINFHSA-N 330.406 0.473 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](C)[C@H]1CO 807096715 ICHUYSBRQJQEFE-MLGOLLRUSA-N 333.432 0.907 10 20 ECCD C[C@@H]1C[C@@H](CO)CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 817274324 JZKWWDGJQDBQAF-UKRRQHHQSA-N 333.432 0.846 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CN1CCN(C)C(=O)C1 839919270 GLOHZMBAFGBESN-HNNXBMFYSA-N 346.475 0.882 10 20 ECCD Cn1c(N)c(C(=O)CSc2ncc(Cl)s2)c(=O)n(C)c1=O 849998606 PQVMNUYELOWLPP-UHFFFAOYSA-N 346.821 0.751 10 20 ECCD C[C@@H](CC[S@@](C)=O)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 748366415 GOQHHEZLLZKDEA-JLTPVHFHSA-N 348.446 0.651 10 20 ECCD COC(=O)C(C)(C)N1CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 841112306 XXKODAFGEFAVDP-UHFFFAOYSA-N 348.403 0.303 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCNC[C@@H]3C)CC2)cc1 923279796 DAXNQGKOBGOGHK-WMZOPIPTSA-N 348.491 0.472 10 20 ECCD COc1ccc(CN[C@H]2C[C@H](NC(=O)[C@@H]3COC(=O)N3)C2)cc1C 1020121349 IIZPQDLLBNVBEA-IHRRRGAJSA-N 333.388 0.849 10 20 ECCD CO[C@]1(C(=O)NCc2ccc(N(C)C)cc2)CCS(=O)(=O)C1 887767684 SWZACGPCTKZFNC-OAHLLOKOSA-N 326.418 0.573 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cc(CCO)nn3)CC2)cc1 881024286 XIKFPQFMZIDQLX-UHFFFAOYSA-N 345.403 0.170 10 20 ECCD CN1CCO[C@@H](C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C1=O 891246418 NRACCCVIIJBQQV-HOTGVXAUSA-N 348.447 0.329 10 20 ECCD COc1cc(C(=O)N[C@H]2CC[C@@H](C)N(CC(N)=O)C2)cc(OC)n1 1071645555 KOLFMXDMZHEOCL-PWSUYJOCSA-N 336.392 0.167 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC([C@H]3CCOC3)C2)cc1 1321593934 QUJFAZVMGCXOAG-AWEZNQCLSA-N 331.416 0.864 10 20 ECCD Cn1cnc(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)n1 1327535391 NCEVAXONOPJQBW-UHFFFAOYSA-N 344.419 0.776 10 20 ECCD CCOc1ccc(N2CCN(C(=O)C[C@H]3CC(=O)NC3=O)CC2)cc1 1262336987 ZRUWZFXWBWFMGH-CYBMUJFWSA-N 345.399 0.787 10 20 ECCD CC[C@H](C)[C@@H](NC(=O)COC(=O)c1cccc(O)c1O)C(=O)O 1594906084 UVMSCQQKAXUANY-QPUJVOFHSA-N 325.317 0.870 10 20 ECCD CN(C)c1ccc(CNC(=O)CN[C@H](C(=O)O)c2ccnn2C)cc1 1593708988 ODJNXTKNKLFWER-INIZCTEOSA-N 345.403 0.518 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNCCC(=O)N2CCOCC2)c1O 278831379 IRPDANUSBZWFPX-UHFFFAOYSA-N 339.348 0.648 10 20 ECCD C/C=C/C[C@@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 274591578 JGRJSPOBPRCYFK-UFFNRZRYSA-N 328.390 0.821 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(CCO)CC(F)F)nc12 280217875 KZCJFWYZGAWYCT-UHFFFAOYSA-N 344.318 0.671 10 20 ECCD NC(=O)c1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2)nc1 299577992 CPBVFJXXTAVAIB-UHFFFAOYSA-N 340.383 0.947 10 20 ECCD COC[C@@H](CS(=O)(=O)N1CCOc2cc(N(C)C)ccc21)OC 641364187 VRQJSBIAPIXACU-ZDUSSCGKSA-N 344.433 0.943 10 20 ECCD COC(=O)COCC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 822371198 SQMVXZWLNXAAHV-ZDUSSCGKSA-N 336.388 0.827 10 20 ECCD COc1cccc(CNC(=O)Cn2[nH]cc3c(=O)ncnc2-3)c1O 730589898 WGZLEOAIBFNEGX-UHFFFAOYSA-N 329.316 0.102 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)[C@H]3C[C@H]3C(N)=O)C2)cc1C 1019391918 SPFNKFBBMJUWKR-ZNMIVQPWSA-N 331.416 0.816 10 20 ECCD COCC(=O)N(C)CC(=O)NCc1ccc(N2CCC(O)CC2)cc1 856212970 YPIQATZSFCNYOP-UHFFFAOYSA-N 349.431 0.369 10 20 ECCD C[C@@]1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CN(CCO)CCO1 1108433174 YYACFLKGDBILSX-MRXNPFEDSA-N 349.391 0.662 10 20 ECCD COc1cc(C(=O)NC2CN([C@@H]3CCCN(C)C3=O)C2)cc(OC)n1 1030612532 RWYLEXWECBEHBM-CYBMUJFWSA-N 348.403 0.134 10 20 ECCD COCC(=O)NC1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779500688 NBCZCJJHOSYIBV-HWKANZROSA-N 334.372 0.865 10 20 ECCD COCCOCCNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 789913238 CKOXXUYXSSGCNO-ZDUSSCGKSA-N 337.420 0.709 10 20 ECCD C[C@@H](O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785427185 ACMSAYLQSUSQET-UKRRQHHQSA-N 333.432 0.988 10 20 ECCD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CC[C@@H](C)C2)cc1 797431105 HNLYLTHYZIFRBA-SNVBAGLBSA-N 348.450 0.561 10 20 ECCD Cc1nc(N2CC=C(CCNC(=O)CC(N)=O)CC2)ccc1[N+](=O)[O-] 1089821942 FHWHWZATMJNJJX-UHFFFAOYSA-N 347.375 0.816 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2CO[C@H](C)C2)cc1 1327558252 QHAOQMUNTLIPHD-ZIAGYGMSSA-N 349.431 0.883 10 20 ECCD CNC(=O)CN1CCN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])CC1 1606271091 OUQPRASOHWCWDT-HWKANZROSA-N 348.359 0.561 10 20 ECCD O=C(O)/C=C\c1ccc(N2CCN3C(=O)NC(=O)[C@@H]3C2)c([N+](=O)[O-])c1 1601881079 NBDSSUDZVYTPKZ-QQHVMHFCSA-N 346.299 0.433 10 20 ECCD O=C(COc1ccc(-c2nn[nH]n2)cc1)NCc1c(O)cccc1O 1582127654 WDMHNSZUOUTCDX-UHFFFAOYSA-N 341.327 0.973 10 20 ECCD O=C(C(F)F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249782 ZEPCUCHOHGKEGD-UHFFFAOYSA-N 327.287 0.575 10 20 ECCD CCN(CCO)CCNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 183968557 KPVCDPVGXCBPCY-VMPITWQZSA-N 347.459 0.967 10 20 ECCD CCS(=O)(=O)NCCS(=O)(=O)N(C)Cc1ccccc1O 269863193 ZHUDTOQVXCLEBJ-UHFFFAOYSA-N 336.435 0.093 10 20 ECCD NC(=O)N1CC[C@H](NC(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 265136728 UEUBUFOZBVUDNS-VFQAQYNWSA-N 344.415 0.806 10 20 ECCD COCCNC(=O)CNC(=O)c1csc(Cc2ccc(N)cc2)n1 817908726 IBMCLJKMJCRPOU-UHFFFAOYSA-N 348.428 0.809 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1CCCN1 842170603 KISGPFNPZMQAGF-OAHLLOKOSA-N 328.416 0.547 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NC[C@@H](N)C1CC1 842070028 KNLKWECLUNBODD-CXAGYDPISA-N 346.475 0.962 10 20 ECCD COc1ccc(-n2nnnc2CN2CCC[C@H]2CNC(C)=O)cc1 1027710774 ARMVWFZCXUNKDQ-AWEZNQCLSA-N 330.392 0.771 10 20 ECCD CC1(C)OCC(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CO1 756709242 ISBGZRKRCFJBSS-UHFFFAOYSA-N 344.389 0.645 10 20 ECCD COC[C@@H](O)CNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 899095198 HVSPRCRKLUZICG-HOTGVXAUSA-N 338.452 0.662 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@@H]2CCNC2=O)cc1 1325650197 LYRRCTSSQLQVEG-OAHLLOKOSA-N 346.431 0.496 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN(C)C1=O 1323697767 CMTTXWASNFYTFS-AWEZNQCLSA-N 332.404 0.024 10 20 ECCD COC(=O)C[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 1325393497 USUZHZSLYZGULM-HNNXBMFYSA-N 347.415 0.923 10 20 ECCD CCOc1cccc(CNCC2(O)CCS(=O)(=O)CC2)c1O 1321759564 WDFNWFOBYPSLNS-UHFFFAOYSA-N 329.418 0.820 10 20 ECCD C[C@H]1CN(c2ccc(CNC(=O)Cn3ncnn3)cc2F)C[C@H](C)O1 1337366669 VKWTYDGQJNUXKT-RYUDHWBXSA-N 348.382 0.742 10 20 ECCD Cc1ccc(C(=O)NC[C@]2(C(=O)O)C[C@@H]2S(C)(=O)=O)c(O)c1O 1600340319 SYMZYCSHKCNZPQ-LKFCYVNXSA-N 343.357 0.024 10 20 ECCD CC[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796600999 PKXQTAJSTQAJHC-RNJOBUHISA-N 349.387 0.516 10 20 ECCD CS(=O)(=O)NCCNC(=O)NCc1c(O)ccc2c1CCCC2 266525923 PGSBUHZHBBKPPO-UHFFFAOYSA-N 341.433 0.619 10 20 ECCD CS(=O)(=O)NC[C@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1 261940285 LGNCGGHLAFRWAC-CYBMUJFWSA-N 325.434 0.599 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(CC(=O)N(C)C)nn1 273141760 FFQHPBZDPHQFQN-JTQLQIEISA-N 347.375 0.139 10 20 ECCD CN(C)c1ccc(CN2C(=O)[C@H]3CS(=O)(=O)CCN3C2=O)cc1 280881794 AGOKXKFCWXKXEG-CYBMUJFWSA-N 337.401 0.314 10 20 ECCD CN(CCn1cccn1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 283648545 XPYRHWQKFXSRLY-UHFFFAOYSA-N 329.404 0.724 10 20 ECCD C[C@@]1(C(N)=O)CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 280405907 XYHICNGMYBELGK-GOSISDBHSA-N 346.431 0.930 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@H]3CCNC3)C2)cc1 818677209 RCFBLKQLIPNNID-KGLIPLIRSA-N 346.431 0.116 10 20 ECCD CN(CC(=O)NCCc1ccc(N)cc1)[C@@H]1CCS(=O)(=O)C1 832652775 FVKUPNFJEZMHNJ-CQSZACIVSA-N 325.434 0.046 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCC(=O)O)cc2)C1 842572980 OZQCREMDDORNBJ-ZDUSSCGKSA-N 333.388 0.869 10 20 ECCD C[C@@H]1OC(C)(C)N[C@@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 842036498 UJJWVJPDYFCJFL-SWLSCSKDSA-N 348.447 0.598 10 20 ECCD CC[C@H](OC)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 743869197 KJZJIBCEBUMTQS-HNNXBMFYSA-N 340.445 0.963 10 20 ECCD O=C(CCN1C(=O)CCNC1=S)NCCc1ccc(O)c(O)c1 847590143 SQFRCYOJSRWIMB-UHFFFAOYSA-N 337.401 0.253 10 20 ECCD C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1CN 842035120 CSMJOWZFPHFPAV-CZUORRHYSA-N 332.448 0.955 10 20 ECCD CCn1cc(CNC(=O)CN(CC(=O)O)c2ccc(OC)cc2)nn1 853011037 RHZSUTRRVDRSTF-UHFFFAOYSA-N 347.375 0.514 10 20 ECCD Cc1oc(S(N)(=O)=O)cc1C(=O)NCCc1ccc(O)c(O)c1 798333823 FKZUZKXRADRDRU-UHFFFAOYSA-N 340.357 0.619 10 20 ECCD CNC(=O)NCC(=O)N1C[C@@H](NCc2ccc(OC)c(C)c2)[C@H](C)C1 1214790170 DYGQRIOWEDWAHA-UKRRQHHQSA-N 348.447 0.869 10 20 ECCD Cn1cc(CNCCNC(=O)c2ccc(N=NC(N)=O)cc2)nn1 1153047808 LEYINBCHXGJESV-UHFFFAOYSA-N 330.352 0.497 10 20 ECCD NC(=O)C(=O)NCCC1=CCN(c2cnc3ccccc3n2)CC1 1089862213 PUQYCKVWJKBWKG-UHFFFAOYSA-N 325.372 0.758 10 20 ECCD CCNC(=O)C(C)(C)CNC(=O)C(=O)N(C)Cc1ccccc1O 1323708057 VCLOEAYBSNVQEZ-UHFFFAOYSA-N 335.404 0.629 10 20 ECCD COC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1334094633 CPEMRBRQZLEWAK-CYBMUJFWSA-N 349.431 0.415 10 20 ECCD O=C(O)[C@@]12CCOC[C@@H]1CN(Cc1cc3c(cc1O)OC[C@H]3O)C2 1608817697 RNJHEIOPDFWVAO-FABXCBLPSA-N 335.356 0.741 10 20 ECCD COCCOC[C@H](NCc1ccc(N2CC[C@H](O)C2)cc1)C(=O)O 1777218152 CNYJNVHELXRCHN-HOTGVXAUSA-N 338.404 0.463 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](NC(=O)c3nnn(C)n3)C2)cc1C 1022558509 ACOYQMBIFTZNGT-BETUJISGSA-N 330.392 0.578 10 20 ECCD COC[C@H](CS(=O)(=O)N1CCOc2cc(N(C)C)ccc21)OC 641364186 VRQJSBIAPIXACU-CYBMUJFWSA-N 344.433 0.943 10 20 ECCD CNC(=O)NCC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 837709414 VRFGPKGQZIUIKT-UHFFFAOYSA-N 342.346 0.347 10 20 ECCD C[C@@H](NC(=O)[C@H]1OCCN(C)C1=O)c1ccc(N2CCOCC2)cc1 900386896 KFCYBCYLYXNFPF-CZUORRHYSA-N 347.415 0.558 10 20 ECCD COC(=O)CC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 905398883 AKOWARKBTWXZLI-UHFFFAOYSA-N 349.431 0.887 10 20 ECCD COC(=O)Cn1cc(S(=O)(=O)Nc2ccc(O)cc2C)cn1 743260230 ZQUSPSNBGWBCCB-UHFFFAOYSA-N 325.346 0.871 10 20 ECCD COc1ccc(CNC(=O)N[C@H]2CCc3c(nnn3C)C2)c(O)c1 848669785 IWEGFCBTPHIWLP-NSHDSACASA-N 331.376 0.886 10 20 ECCD CO[C@@H](C)CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 749573741 ZKUXTYBQJRDURM-ZDUSSCGKSA-N 340.445 0.963 10 20 ECCD COCCOCCN1CCN(C(=O)c2ccc(C)c(O)c2O)CC1 846616657 FKKDYDWFNZNJHG-UHFFFAOYSA-N 338.404 0.827 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N3CCOC[C@H]3CO)cc2)CC1 924008226 RLGUTLNKZUCXNH-QGZVFWFLSA-N 348.447 0.341 10 20 ECCD O=C(C[C@@H]1CCCS(=O)(=O)C1)NCCc1ccc(O)c(O)c1 1117755446 OZYDAUVHEDMWHE-LBPRGKRZSA-N 327.402 0.971 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@H](CO)[C@H](O)C1 787998052 VXOHGZZGBKGUAI-DOTOQJQBSA-N 335.448 0.386 10 20 ECCD CCc1nc(C)cc(N2CC=C(CCNC(=O)CC(N)=O)CC2)n1 1089822000 IPNUZNLCPUXKDW-UHFFFAOYSA-N 331.420 0.866 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)Cc3ncc[nH]3)C2)cc(OC)n1 996367816 FYDMSEDRYXNPLI-UHFFFAOYSA-N 345.359 0.005 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)Cc3cnoc3)C2)cc(OC)n1 996367828 GJRSBNPJUAKJRT-UHFFFAOYSA-N 346.343 0.270 10 20 ECCD CO[C@@H](C)CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1328315034 LDTUFXZKQUMNSL-KBPBESRZSA-N 349.431 0.852 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1nnc(C)o1 1326071983 QNTLJHJOEKPEHQ-NSHDSACASA-N 349.343 0.622 10 20 ECCD 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VVIGHHMPNNWICG-ZETCQYMHSA-N 340.361 0.946 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC[C@@](C)(O)C2)cc1 1327352796 ZMWDRZNLSLEMFO-GOSISDBHSA-N 349.431 0.573 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC(N3CCCC3=O)C2)cc1 1335476474 XWYCTNZCVWUWJS-UHFFFAOYSA-N 344.415 0.202 10 20 ECCD CC(C)NC(=O)CN1CCN(C(=O)NCc2ccc(N)cc2)CC1 1338798151 JPQMKWOBXHNWDG-UHFFFAOYSA-N 333.436 0.621 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1(CC(N)=O)CC1 1331814506 BROCMAIHVAFXIO-UHFFFAOYSA-N 346.431 0.483 10 20 ECCD Nc1ccc(CNC(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)cc1 1515330938 CAIXHWTXJLPQQW-OAHLLOKOSA-N 346.431 0.066 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1COCCN1 165416521 NJOHBZIAKZERBI-OAHLLOKOSA-N 337.395 0.391 10 20 ECCD CN1CCCc2cc(CNC(=O)CCNS(C)(=O)=O)ccc21 57550021 CQKQCHVRIXNZID-UHFFFAOYSA-N 325.434 0.625 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CCCCNC1=O 54787339 PDJORYOXUJYZFP-INIZCTEOSA-N 346.431 0.991 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CN(C)CCO3)CC2)cc1F 177288427 PICLAVLKCRWWGR-MRXNPFEDSA-N 337.395 0.814 10 20 ECCD CN(C)c1ccc(CN(C)S(=O)(=O)N(C)CCC(=O)O)cc1 316512138 TXPVECNOFFJRLT-UHFFFAOYSA-N 329.422 0.836 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)CNC(=O)O)CC2)cc1 285813079 WNUAPIWQHYFSHA-UHFFFAOYSA-N 336.392 0.201 10 20 ECCD Cc1cccc(=O)n1C[C@@](C)(O)C(=O)NCCc1ccc(O)c(O)c1 281737720 XQCXRQGORBNPRY-GOSISDBHSA-N 346.383 0.678 10 20 ECCD CCOC(=O)CN(CCNS(C)(=O)=O)Cc1ccccc1O 823582140 ZTFBENYZFHVOMT-UHFFFAOYSA-N 330.406 0.307 10 20 ECCD CN(CC(=O)NCc1ccccc1O)S(=O)(=O)c1cccnc1 748345515 MSSJIFNELLSTMA-UHFFFAOYSA-N 335.385 0.724 10 20 ECCD CN1CCC[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)C1=O 748626485 SKYFEMXTUDWLDY-INIZCTEOSA-N 346.431 0.943 10 20 ECCD Nc1nc(N)nc(NCc2cc(F)c(N3CCOCC3)c(F)c2)n1 858566871 ITJHHBQSCZUFRJ-UHFFFAOYSA-N 337.334 0.763 10 20 ECCD CCN1CCOC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856212916 WOYMEXWNAQYJJM-GOSISDBHSA-N 347.459 0.985 10 20 ECCD COc1ccc(N2CCC(NC(=O)c3cn(CCN)nn3)CC2)cc1 851631262 ZJTPJYLCCRJEKX-UHFFFAOYSA-N 344.419 0.644 10 20 ECCD CCCCS(=O)(=O)NCC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773762735 NYPKIHPLVRCNCG-NSHDSACASA-N 344.433 0.865 10 20 ECCD CCS(=O)(=O)NCCNC(=O)NCc1ccc(OC)cc1O 792832880 QBDAXNHNVYJGJA-UHFFFAOYSA-N 331.394 0.139 10 20 ECCD COc1ccc(CNC(=O)NCCOCCS(C)(=O)=O)c(O)c1 792956647 QAPIRYHROZDOKJ-UHFFFAOYSA-N 346.405 0.261 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)Cn3cnnn3)CC2)n1 1089799892 FUBDVCVEKHPHFE-UHFFFAOYSA-N 328.380 0.115 10 20 ECCD CC(=O)N[C@@H](C)C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089799644 LKTJMQKMRWVKBQ-NSHDSACASA-N 335.383 0.783 10 20 ECCD COC[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)OC 1329120355 QSVIUQCTKVZJEN-OAHLLOKOSA-N 337.420 0.455 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCC1([S@@](C)=O)CCC1 1323903155 XYTYNHOBRFCFLD-HSZRJFAPSA-N 338.429 0.768 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1cnn(C)c1 1344770138 PAVWGYCWOSWOGQ-UHFFFAOYSA-N 343.431 0.803 10 20 ECCD CC[C@H](NCCN1CCNC1=O)c1cccc(-c2nn[nH]n2)c1O 1604055002 KLNLKZRFDKAQTN-LBPRGKRZSA-N 331.380 0.638 10 20 ECCD COc1cccc(CNS(=O)(=O)c2cc(C(=O)O)cn2C)c1O 1607322993 VONJTBQAKZMRSE-UHFFFAOYSA-N 340.357 0.916 10 20 ECCD COc1cc(C)c(CNCC[C@@H]2CNCCS2(=O)=O)c(O)c1 1579145376 ZTCHGCDDJGPGFT-CYBMUJFWSA-N 328.434 0.576 10 20 ECCD CCN1CCC[C@H]1CN/C=C1/C(=O)NC(=S)N(CC(C)C)C1=O 28843131 PKUNKZWARMNKKE-VWLVURMCSA-N 338.477 0.844 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1COCCO1 1340775578 CFNSYQPHKCPDNZ-INIZCTEOSA-N 349.431 0.633 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)CNC(=O)[C@@H]1CCCN1 351556076 MZQWQKZQNZVROH-ZDUSSCGKSA-N 332.404 0.346 10 20 ECCD CCN(CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 263662091 BBXFBBSFWXJHBB-UHFFFAOYSA-N 341.433 0.978 10 20 ECCD C[S@@](=O)CCNC(=O)C(=O)NCCCSc1nccs1 804997764 RAORARBVCCUFPI-HXUWFJFHSA-N 335.476 0.236 10 20 ECCD CCNC(=O)CN(CC)Cc1cc(O)n2ncc(C(=O)OCC)c2n1 298723162 LGGPCBJHQVZCRZ-UHFFFAOYSA-N 349.391 0.570 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N(C)CCCO)C2)cc1 824981511 WEYMVYDFWCHRHU-CQSZACIVSA-N 349.431 0.479 10 20 ECCD COc1cc2c(c(OC)c1)N(CC(=O)N1CCNC(=O)C1)CCC2 839653851 ICEOOOIJPCZOFX-UHFFFAOYSA-N 333.388 0.415 10 20 ECCD COC(=O)[C@@H]1C[C@H](O)CN(CC(=O)NCc2ccc(N(C)C)cc2)C1 830880956 FSVCDFLXVPPIAZ-ZBFHGGJFSA-N 349.431 0.225 10 20 ECCD CCOC(=O)[C@H](N)C(=O)NCc1ccc(N2CCSCC2)cc1 852860471 RMQGAWBFJFGSJY-CQSZACIVSA-N 337.445 0.746 10 20 ECCD CCN(CCN)C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 861743669 WMDOCPDMVVZCME-CQSZACIVSA-N 348.447 0.508 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2cc(COCCO)nn2)cc1 881094817 UAURANLSJGRUNE-UHFFFAOYSA-N 333.392 0.169 10 20 ECCD O=C1[C@H]2COCCN2C(=O)N1Cc1ccc(N2CCOCC2)cc1 777592651 SBOQLDOGEXZFGF-OAHLLOKOSA-N 331.372 0.686 10 20 ECCD CN(C)c1ccc([C@@H](CNCc2cn(CC(N)=O)nn2)N(C)C)cc1 898449276 AIJHJJDIQARNSM-MRXNPFEDSA-N 345.451 0.222 10 20 ECCD CO[C@]1(C(=O)NCc2cc(Cl)ccc2O)CCS(=O)(=O)C1 898277061 IRPZQSSLLHERBO-CYBMUJFWSA-N 333.793 0.866 10 20 ECCD COCCN(CC(=O)N(C)C)Cc1ccc(OC)c(OC)c1O 891690629 FYCVGRSYCKCEHO-UHFFFAOYSA-N 326.393 0.946 10 20 ECCD C[C@@H]1OCC[C@@]12CN(C(=O)C(=O)N(C)Cc1ccccc1O)CCO2 1325637274 SNQOWWDDFPFDOG-SCLBCKFNSA-N 348.399 0.757 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC(C)(C)O 1324954872 SZHFDECLOILCIY-NSHDSACASA-N 325.361 0.849 10 20 ECCD CN(C)c1ccc([C@@H](CNCc2cn(CC(=O)O)nn2)N(C)C)cc1 1336151745 BJVDBZFEKOSRHU-MRXNPFEDSA-N 346.435 0.821 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnnn1CC 1347689170 BJPSZDZOYFDRRT-NSHDSACASA-N 348.359 0.613 10 20 ECCD CCOC(=O)CN(C)C(=O)CN(C)c1ccc(OCC(=O)O)cc1 1596616193 SQOQEQFAEMVEMZ-UHFFFAOYSA-N 338.360 0.608 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)[C@@H](N)CCC(=O)O)C2)cc1 1599586340 NILWBDBIMAMOKS-DOMZBBRYSA-N 335.404 0.830 10 20 ECCD O=C1COc2cc([N+](=O)[O-])c(N3C[C@@H](C(=O)O)C[C@@H](O)C3)cc2N1 401862138 RYROZSADYUWIMO-JGVFFNPUSA-N 337.288 0.198 10 20 ECCD Cc1c(CNC(=O)C(=O)NC[C@@H]2CNCCO2)n(C)c2ccccc12 419707156 LJMVKSBYRUNJNO-ZDUSSCGKSA-N 344.415 0.208 10 20 ECCD CS(=O)(=O)N1CCC[C@@H]1CNC(=O)/C=C/c1ccc(O)c(O)c1 272417358 JPWOADWCRZMSCN-HOSRBBHYSA-N 340.401 0.651 10 20 ECCD CS(=O)(=O)N[C@@H]1CCC[C@H]1CNC(=O)c1cccc(O)c1O 279430454 ZCVGIZCEQAVLHW-GXSJLCMTSA-N 328.390 0.546 10 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CCN(C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CCNC1 887066282 IJWPCPYFHSNPSB-MRXNPFEDSA-N 332.448 0.921 10 20 ECCD C[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)N(C)C 899472090 HEFGRSNLVJMFJM-ZDUSSCGKSA-N 332.448 0.955 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3CC[C@H]2[C@H](O)C3)cc1F 897580919 AIHUZVKKYZKDED-VBNZEHGJSA-N 349.406 0.880 10 20 ECCD CN1CCO[C@@H](C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C1 891254060 VNJDMZZFTBRMNX-DLBZAZTESA-N 334.464 0.802 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)[C@H]3CCCO3)C2)cc(OC)n1 973850320 ZIRIHBQUKUKPNB-FRRDWIJNSA-N 349.387 0.655 10 20 ECCD COc1ccc(CNC[C@H]2C[C@H](NC(=O)Cn3cnnn3)C2)cc1C 983124247 POKZHSDJPKIVQA-SHTZXODSSA-N 344.419 0.675 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3CCC(=O)NC3)CC2)ncn1 1089870633 ZFINVUKIQRQOET-OAHLLOKOSA-N 343.431 0.954 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)NC[C@H]1COCCO1 1322799572 HRNDSEOPOOVXHX-JTQLQIEISA-N 345.446 0.273 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CN3C(=O)NC4(CC4)C3=O)cc2)C1 1321939944 BOSBMGDHHXBJEX-ZDUSSCGKSA-N 342.399 0.973 10 20 ECCD COc1ccc(N2CCN([C@H]3CCN(CCC(=O)O)C3=O)CC2)cc1 1607270174 IVKRPNPWNHHTSP-INIZCTEOSA-N 347.415 0.893 10 20 ECCD O=C(O)CNC(=O)[C@H]1CCCN1Cc1ccc(N2CCOCC2)cc1 1610782444 BQSOUSJQKOFSGP-MRXNPFEDSA-N 347.415 0.688 10 20 ECCD COC(=O)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 55524213 WYQULNDIIOHEHA-UHFFFAOYSA-N 339.367 0.977 10 20 ECCD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCOc2ncccc21 267161372 QOTVFADXFLGQRX-UHFFFAOYSA-N 346.368 0.305 10 20 ECCD C[C@H]1CN(C2CC2)C[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 283562592 RHYKPFLGZMKGQR-SUMWQHHRSA-N 344.459 0.968 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCS(=O)CC3)nc12 729266039 QCWCWLQWYUPFMT-UHFFFAOYSA-N 338.389 0.176 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N3)cc2F)CC1 826718890 AZUNKCLACKEBRD-CQSZACIVSA-N 334.395 0.472 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3CCNC[C@@H]3C2)cc1F 911116184 YRNPAANLUBFVRH-UONOGXRCSA-N 348.422 0.576 10 20 ECCD C[C@]1(CN)CCN(C(=O)C(=O)NCCCSc2nccs2)C1 842093299 QHNYTBWZOKTAFC-CQSZACIVSA-N 342.490 0.939 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCCCSc2nccs2)[C@H](C)CN1 842093821 STIUDSREYFRHGP-WDEREUQCSA-N 342.490 0.950 10 20 ECCD Cc1c(NC=C2C(=O)N(C)C(=O)N(C)C2=O)cccc1-n1cnnn1 920980064 VONAHOTXTVKJMU-UHFFFAOYSA-N 341.331 0.317 10 20 ECCD Cc1ccc(CN[C@@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)c(O)c1 877037400 PSFCQZRCTRXEQB-HUUCEWRRSA-N 340.445 0.288 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@]3(C)CNC(=O)C3)CC2)nn1 1089851200 NQPZMOXSMAXGMK-SFHVURJKSA-N 343.431 0.954 10 20 ECCD CO[C@@H](C)CN1C[C@H](O)[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1084108860 IWTIQNHZXFHQKZ-GDLCADMTSA-N 349.391 0.659 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@H]3CCC(=O)NC3)CC2)nn1 1089870523 UTYISDWYEANFKC-HNNXBMFYSA-N 343.431 0.954 10 20 ECCD COc1ccc(N2CCN(C(=O)COCc3nn[nH]n3)CC2)cc1 1331985279 VSDBPNRIPVCVFL-UHFFFAOYSA-N 332.364 0.074 10 20 ECCD C[C@@H]1CN(c2ccc(CNC(=O)Cn3ncnn3)cc2F)C[C@@H](C)O1 1337366671 VKWTYDGQJNUXKT-VXGBXAGGSA-N 348.382 0.742 10 20 ECCD COC(=O)N1CC(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 1343405316 JSDSDWUMHGXYRW-NSHDSACASA-N 348.403 0.497 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCC[C@H](C(=O)O)C2=O)cc1 1606054031 ITBGBUBZKVYCOJ-AWEZNQCLSA-N 333.388 0.692 10 20 ECCD CSc1ccccc1C(=O)N1CCS(=O)(=O)C[C@H]1C(=O)O 1594196330 MHVLXFBMLGVYMY-JTQLQIEISA-N 329.399 0.732 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3COC(=O)N3)C2)cc1C 1022036216 IIZPQDLLBNVBEA-MJBXVCDLSA-N 333.388 0.849 10 20 ECCD CCOC(=O)C(=O)N1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 272476479 QFKFVFXHCKEYKY-GQCTYLIASA-N 348.355 0.345 10 20 ECCD CCS(=O)(=O)NCCNC(=O)NCc1cc(Cl)ccc1O 844880962 JABJDLZNAHJEAR-UHFFFAOYSA-N 335.813 0.784 10 20 ECCD CC(C)(C)OC(=O)NCC(=O)NCc1cn(-c2ccc(N)cc2)nn1 849134323 DIKZBOMYOXPFAJ-UHFFFAOYSA-N 346.391 0.990 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](CN)C2)cc1 842208882 XUKGMWCEQNUOTC-HNNXBMFYSA-N 332.448 0.956 10 20 ECCD CCN1CCCC[C@@H]1CNC(=O)C(=O)NCCc1ccc(N)cc1 842194060 QBTKZOOTRDFCDL-MRXNPFEDSA-N 332.448 0.918 10 20 ECCD Cc1nnc(CN(C)Cc2cc(O)n3ncc(C(=O)O)c3n2)s1 851709399 NNUZALNYWOAHGN-UHFFFAOYSA-N 334.361 0.925 10 20 ECCD CC[C@H](C(N)=O)N1CC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1039060443 KDAWCJJQNQCARK-CHWSQXEVSA-N 346.391 0.917 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OC[C@@H]2COC(=O)O2)c1 763944297 LBVYZEDVIOJHGO-MRVPVSSYSA-N 331.302 0.456 10 20 ECCD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCc1ccc(O)c(O)c1 768899641 KPGBBPKNTRAJFD-UHFFFAOYSA-N 333.300 0.527 10 20 ECCD CN(C)C(=O)CCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1117053229 SVGWQOGHZGNYQI-UHFFFAOYSA-N 338.383 0.102 10 20 ECCD COCCNCC(=O)N1CCN(c2ccc(OC)cc2OC)CC1 877227225 FYXSUNJJAJZYQD-UHFFFAOYSA-N 337.420 0.588 10 20 ECCD CNS(=O)(=O)CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891251056 CQMSGIXYGHEKIL-AWEZNQCLSA-N 342.465 0.021 10 20 ECCD COC(=O)[C@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1325686494 MKJABNRWJGGRQF-OKILXGFUSA-N 347.415 0.779 10 20 ECCD CCOC[C@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)CCO1 1328939464 UCJSHOLSFYOXED-CQSZACIVSA-N 336.388 0.615 10 20 ECCD O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1COC(=O)N1 1602056901 AZXKHNAQNNCWNS-VIFPVBQESA-N 328.708 0.567 10 20 ECCD COc1ccc(CN[C@@H](C)CNC(=O)CN2CCOCC2)cc1C 1752866140 NRNYEVVOAGOCTF-HNNXBMFYSA-N 335.448 0.930 10 20 ECCD CN(C)CC(=O)N1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 272555710 ZKLRXIJLECZVDX-GQCTYLIASA-N 333.388 0.343 10 20 ECCD CC(C)NS(=O)(=O)NCCNCc1cc([N+](=O)[O-])ccc1O 277018784 MKRNZPFKQIZZHN-UHFFFAOYSA-N 332.382 0.222 10 20 ECCD COCCN(CCOC)S(=O)(=O)NCc1ccc(N(C)C)cc1 298328389 RRAXFCAQOCWXOF-UHFFFAOYSA-N 345.465 0.682 10 20 ECCD CN(C)c1ccc(CNC(=O)NC[C@@H]2CC(C(N)=O)=NO2)cc1F 297225483 MZQCJLPUSSTHLX-JTQLQIEISA-N 337.355 0.321 10 20 ECCD COC(=O)c1cn(CCNC(=O)/C=C/c2ccc(O)c(O)c2)nn1 803644672 OQNJULHPLRAMRI-HWKANZROSA-N 332.316 0.306 10 20 ECCD CC(CO)(CO)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 823524791 XMJQGNWODIDWSY-UHFFFAOYSA-N 337.420 0.190 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)c1cnn(C[C@@H](O)CO)c1 830145654 CYEVVPPPYOQJMN-OAHLLOKOSA-N 333.388 0.994 10 20 ECCD COC(=O)CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 906332411 SVLSJVLGLMTOHM-UHFFFAOYSA-N 340.401 0.101 10 20 ECCD O=C(NCCN1CCN(c2ncccn2)CC1)c1cc(O)cs1 731870715 NHDMJXLGPLXIAQ-UHFFFAOYSA-N 333.417 0.796 10 20 ECCD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cn(CC(N)=O)nn1 742563895 TZBWFBXWGMVZMD-UHFFFAOYSA-N 344.419 0.880 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1CNCCCO1 842273465 HJFUUFLMVRFWSH-OAHLLOKOSA-N 349.431 0.626 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCC(F)F 753779576 LMIFXEHNOSWXPZ-UHFFFAOYSA-N 341.358 0.863 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NC[C@@H]2CCN2C)cc1 931886625 QARZSBQKTSVIRL-HNNXBMFYSA-N 348.447 0.410 10 20 ECCD CNC(=O)[C@H]1CN(C(=O)NCCCSc2nccs2)CCO1 781939026 MRTVSTHJXWIDFG-SNVBAGLBSA-N 344.462 0.782 10 20 ECCD CCNC(=O)CNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891587559 DMVORIUSWLUUSP-HNNXBMFYSA-N 335.452 0.791 10 20 ECCD CN(CCC(N)=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 899105810 ZCWBNBLXULNSNJ-HNNXBMFYSA-N 335.452 0.872 10 20 ECCD O=C(Cn1ncnn1)NCCC1=CCN(c2ncncc2Cl)CC1 1089844381 AWNBSLKAYCRKGG-UHFFFAOYSA-N 348.798 0.460 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3nonc3C)C2)cc(OC)n1 996368383 MBEVBBXUFQQKAG-UHFFFAOYSA-N 347.331 0.045 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@](C)(O)COC 1320519506 GYGHUKXZQRGNBY-ZBEGNZNMSA-N 341.360 0.086 10 20 ECCD Cc1ccc(O)c(CNc2nc(O)n(C)c(=O)c2-c2nn[nH]n2)c1 1605875274 ANJAVEVTMAZIQQ-UHFFFAOYSA-N 329.320 0.292 10 20 ECCD CN1CCNC[C@@H]1C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1606247839 UJUBLIZSRQSFNQ-GFCCVEGCSA-N 341.795 0.362 10 20 ECCD COC(C)(C)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248683 DHAVNBOPTDJWIX-UHFFFAOYSA-N 349.387 0.735 10 20 ECCD Cc1ccc(C(=O)N[C@@H]2CCCCN(CC(=O)O)C2=O)c(O)c1O 1594346044 AGMUWEUEDLNJRZ-LLVKDONJSA-N 336.344 0.602 10 20 ECCD CCN(CCO)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 123077448 ZGMGQRJNDZMGBH-UHFFFAOYSA-N 339.411 0.593 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC(=O)N1 297988166 ZTIPHSUMZJNRQF-GFCCVEGCSA-N 332.404 0.058 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)N3CCNCC3)CC2)cc1 817934476 JCOZAUCMEZVJFP-UHFFFAOYSA-N 346.431 0.166 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1CCN(C)C1=O 819697177 RNVFGKBPHRMKLE-CYBMUJFWSA-N 334.372 0.762 10 20 ECCD CNCCCNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 841750156 MNSWKAKZWRDLBD-UHFFFAOYSA-N 349.479 0.726 10 20 ECCD CONC(=O)CNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 914400557 ODUNZIMBSBACDH-LBPRGKRZSA-N 336.392 0.561 10 20 ECCD COc1cc(O)c(CN[C@@H]2CCN(S(C)(=O)=O)C2)cc1OC 846035550 WBZJHVIVOZXFCG-LLVKDONJSA-N 330.406 0.533 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN(C)C[C@H](C)O)CC2)cc1 754048078 DNDDMGYFWBTZBB-RDJZCZTQSA-N 337.464 0.491 10 20 ECCD COc1ccc(CNCCNS(C)(=O)=O)cc1Cn1cccn1 873025557 AYPYTLHKMGHSKY-UHFFFAOYSA-N 338.433 0.579 10 20 ECCD COC(=O)C[C@H]1C(=O)NCCN1C(=O)/C=C/c1ccc(O)c(O)c1 779499945 NFQGSGHUMUCIRD-TZNOJPMFSA-N 334.328 0.001 10 20 ECCD CC[C@H](F)C(=O)NCCNCc1nnnn1-c1ccc(OC)cc1 1132436011 FBEVSOJMGRIAPP-ZDUSSCGKSA-N 336.371 0.625 10 20 ECCD O=C(Cn1cncn1)NCCC1=CCN(c2nccnc2F)CC1 1089831622 GHORATYRFZQBEL-UHFFFAOYSA-N 331.355 0.550 10 20 ECCD CN1CCOC[C@@H]1C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089819409 KLYUWQPTJFCXDN-CQSZACIVSA-N 349.410 0.589 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCN(CCF)C[C@H]2O)cc1 1090839913 TUMBYNPAHWLVHA-CHWSQXEVSA-N 337.355 0.984 10 20 ECCD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCCc1ccc(O)c(O)c1 1319772041 MBRSSPQSKNQRCK-UHFFFAOYSA-N 333.300 0.527 10 20 ECCD Nc1ccc(CC(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)cc1 1326626651 LKXHWPMVHWYIAM-OAHLLOKOSA-N 337.445 0.143 10 20 ECCD COc1ccc(N2CCC(NC(=O)C(=O)N3CC(F)C3)CC2)cc1 1322249042 UMTBMDZSMXPDRE-UHFFFAOYSA-N 335.379 0.961 10 20 ECCD COC[C@H](C)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1332813906 OQRVUUUUAAFCAB-KBPBESRZSA-N 349.431 0.852 10 20 ECCD CC[C@H](NC[C@H]1COCCN1C)c1cccc(-c2nn[nH]n2)c1O 1604054707 JCDYQJHFNREIBJ-FZMZJTMJSA-N 332.408 0.944 10 20 ECCD Cn1nncc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 281420460 ABANIVOPAIRAGX-UHFFFAOYSA-N 333.367 0.845 10 20 ECCD COC[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 297819073 LKIUWGLBLAJLQA-INIZCTEOSA-N 349.431 0.585 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)c1nccnc1C(N)=O 563184116 NRONDPBSTQCGFE-UHFFFAOYSA-N 327.344 0.681 10 20 ECCD Cn1ncc(CCCN2C(=O)CN(Cc3ccccc3O)C2=O)n1 819169364 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ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CC(=O)N(C)C2)cc1 1321599531 XKVVOXMTTAXARP-CQSZACIVSA-N 346.431 0.496 10 20 ECCD O=C(CN1C(=O)CNC1=O)NCc1cc(Cl)cc(Cl)c1O 1342798660 HXRINCHQCPVTQH-UHFFFAOYSA-N 332.143 0.867 10 20 ECCD CC(C)(C)NC(=O)CNC(=O)CSc1ncc(C(=O)O)s1 1589823704 PEMRKZPFLVYMNH-UHFFFAOYSA-N 331.419 0.964 10 20 ECCD C[C@@H](NCCCS(C)(=O)=O)c1cccc(-c2nn[nH]n2)c1O 1589960692 FMOHPCHNZLDQQN-SECBINFHSA-N 325.394 0.658 10 20 ECCD CN(CC(=O)N1CCOCC1)c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 1598380556 ISURVSAAYJAWNJ-HWKANZROSA-N 349.343 0.988 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](CO)C2)cc1F 283094456 HAHDBJRHNDDHHV-ZDUSSCGKSA-N 337.395 0.739 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H](O)C1CC1 822759268 LZSPYTUHSPWQGV-OAHLLOKOSA-N 338.429 0.309 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3C[C@H]3C(=O)O)cc2)C1 739160855 PFQJOGTWVNHWER-BPLDGKMQSA-N 345.399 0.725 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](C)C(=O)O 848608414 FVBJJNVMVGIUQX-LBPRGKRZSA-N 335.404 0.938 10 20 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JGYVWOLHWUDYQM-UHFFFAOYSA-N 346.431 0.897 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N(CCO)CC(F)F)cc1 283479832 MCMPTOWJKCLZQC-UHFFFAOYSA-N 329.347 0.455 10 20 ECCD C[C@H](C[S@](C)=O)NC(=O)C(=O)NCCCSc1nccs1 806281689 GVPQQKPWSOSERM-BTKVJGODSA-N 349.503 0.625 10 20 ECCD NC(=O)[C@@H]1CC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 816891396 RPYDVNKDPGLBTN-KGLIPLIRSA-N 349.406 0.915 10 20 ECCD O=C1CN(Cc2ccccc2O)C(=O)N1C[C@H]1CCCS1(=O)=O 819167756 GWGJQYDYRNSLQP-GFCCVEGCSA-N 338.385 0.734 10 20 ECCD O=C1NC(=O)[C@H]2CN(Cc3cccc(Br)c3O)C[C@@H]12 824893440 SATZCBJMDJLREY-DTORHVGOSA-N 325.162 0.859 10 20 ECCD Cc1oc(/C=C2/SC(=S)N(CC(N)=O)C2=O)cc1C(=O)O 738969191 JGFPTFMUPNOCOE-FPYGCLRLSA-N 326.355 0.973 10 20 ECCD C[C@H]1CCN(CC(=O)NCc2ccc(N(C)C)cc2)[C@H](C(N)=O)C1 839568070 XGAFCNANAONLCA-BBRMVZONSA-N 332.448 0.955 10 20 ECCD CCN(CC(=O)N(C)C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 919814773 AKWTTWOLCHYCTE-UHFFFAOYSA-N 343.405 0.314 10 20 ECCD NS(=O)(=O)CCCCCC(=O)OCC(=O)c1ccc(O)c(O)c1 845195078 UVCZQTBZASTRFV-UHFFFAOYSA-N 345.373 0.673 10 20 ECCD COc1ccc(O)c([C@@H](C)NS(=O)(=O)CCS(C)(=O)=O)c1 751316871 CWFFBCSMMQHOSR-SECBINFHSA-N 337.419 0.426 10 20 ECCD COc1ccc(O)c(CNC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2OC)c1 853736854 QNSATBUGXDITII-YPMHNXCESA-N 344.389 0.012 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2C[C@@H](O)[C@H](NC(=O)C3CC3)C2)cc1 1022868653 QZJCJDAXPVNGFS-CHWSQXEVSA-N 345.359 0.561 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCCO)CC2)cc1 778231254 FFDJKZHKLXAVAK-FPLPWBNLSA-N 347.415 0.399 10 20 ECCD NS(=O)(=O)C[C@@H]1CCCCN1C(=O)/C=C\c1ccc(O)c(O)c1 779534390 FSLQJRFXRQAFOR-HWPRWLFBSA-N 340.401 0.781 10 20 ECCD COCCCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 774491455 MRAXELQEVGEBAG-AWEZNQCLSA-N 349.431 0.853 10 20 ECCD CN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1cc(F)cc(F)c1O 893961044 CATUFVDMNUZTJW-LLVKDONJSA-N 348.371 0.406 10 20 ECCD COc1ccc(N2CCN(C(=O)COC(=O)CNC(C)=O)CC2)cc1 798010140 RAYBMONSLJROEI-UHFFFAOYSA-N 349.387 0.023 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NC[C@@H](C)OC)cc1 1347368467 YDSRGJIZVBCHIF-CYBMUJFWSA-N 337.420 0.741 10 20 ECCD CC(=O)C(=O)Cn1cc(-c2nn[nH]n2)c(=O)c2cc(Cl)ccc21 1602912186 NMLOLXMGGMVDDV-UHFFFAOYSA-N 331.719 0.993 10 20 ECCD O=C(c1ccon1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249228 MFZKSQZIRBWQLO-UHFFFAOYSA-N 344.327 0.612 10 20 ECCD CN1CCO[C@@H](CNC(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 108790576 PNIUXBDTWXATLT-UKTKYZJWSA-N 345.443 0.983 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C)CC3)CC2)cc1 106381399 YPPFULMDSKZUMC-SFHVURJKSA-N 348.491 0.426 10 20 ECCD CCN(CC)c1ccc(CNC(=O)NCCS(N)(=O)=O)cc1 194511040 CBWDJTKFTWFAGP-UHFFFAOYSA-N 328.438 0.621 10 20 ECCD COC(=O)c1ccc(O)c([C@H](C)NCCCNS(C)(=O)=O)c1 273437090 XHKWSQJHBDQCOU-JTQLQIEISA-N 330.406 0.769 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@](C)(O)C3)nc12 271071635 VRRYIIMKNNJIQW-INIZCTEOSA-N 334.376 0.958 10 20 ECCD CN(C[C@H]1CCCN1C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 817274917 SJPUUWURPKNNSC-MRXNPFEDSA-N 332.448 0.921 10 20 ECCD O=CN1CCC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 822687407 BFNUFWYFVXXCPP-MRXNPFEDSA-N 335.379 0.899 10 20 ECCD CN1CCN(c2ccc(CN3C[C@H]4C(=O)NC(=O)[C@H]4C3)cc2)CC1 824893600 WNHQIZKJTRBSOG-IYBDPMFKSA-N 328.416 0.143 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3COC[C@H]3OC)nc12 830096081 BNIMZEGPQXNNDV-VXGBXAGGSA-N 336.348 0.115 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1[C@H]2CNC[C@H]21 844173636 NEBSLBYIMDUEKI-HALDLXJZSA-N 333.407 0.868 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCO[C@@H](C(N)=O)C1 840490210 XLGMFHUYOGGSCH-CZUORRHYSA-N 348.447 0.888 10 20 ECCD CONC(=O)CNC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 922951575 YKWPHDHYRZLUIB-GFCCVEGCSA-N 336.392 0.498 10 20 ECCD NC(=O)CN1CCC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1028344439 FUKXJDBNEUZISX-LBPRGKRZSA-N 332.364 0.529 10 20 ECCD COc1cc(C(=O)NC2CN([C@@H](C)c3nc(C)no3)C2)cc(OC)n1 1030614293 GMFCSJXAAUIAOO-VIFPVBQESA-N 347.375 0.965 10 20 ECCD CN1CCN(c2ccc(CNC[C@H]3CC(C(N)=O)=NO3)cc2F)CC1 1117109780 VRLDWPNHVYFSSC-CYBMUJFWSA-N 349.410 0.297 10 20 ECCD C[C@H]1C(=O)N(C)CCN1C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1117504433 GUSGHXHANHZBRZ-OLZOCXBDSA-N 346.431 0.619 10 20 ECCD CCOC(=O)NCC(=O)NCc1ccc(N2CCN(C)CC2)cc1 881850069 MLJNBSRPUCNUIH-UHFFFAOYSA-N 334.420 0.801 10 20 ECCD COc1ccc(CNC(=O)c2ccc(S(N)(=O)=O)o2)c(O)c1 794379601 SBQVYFJJJBLEGU-UHFFFAOYSA-N 326.330 0.571 10 20 ECCD Cc1ccnc(N2CC=C(CCNC(=O)CC(N)=O)CC2)c1[N+](=O)[O-] 1089822026 KFNQQLRMRZHSLM-UHFFFAOYSA-N 347.375 0.816 10 20 ECCD C[C@H]1C[C@H]1C(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089802189 IBCQMTKIFLOMMA-WCQYABFASA-N 327.392 0.818 10 20 ECCD C[C@H]1C(=O)N(C)CCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 1325391609 IGRRZYSQISLIOV-LBPRGKRZSA-N 332.404 0.058 10 20 ECCD CN1CCN(c2ccc(CN3C[C@H](O)C[C@@H]3C(=O)O)cc2F)CC1 1610136978 FEXDEWLEMPJTCN-CZUORRHYSA-N 337.395 0.597 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2C[C@@H](C(=O)O)C[C@@H](O)C2)cc1 1598317616 JPDMTBSZUCITOQ-DZGCQCFKSA-N 335.404 0.136 10 20 ECCD C[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)S(C)(=O)=O 54284093 FQDIHAQARYBEHC-GFCCVEGCSA-N 326.418 0.573 10 20 ECCD COCCCS(=O)(=O)N1CCN(Cc2ccccc2O)CC1 179586865 NDCOPKSEQGRMRE-UHFFFAOYSA-N 328.434 0.876 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCNC(=O)[C@@H]1C 807103887 WTQGARPDOQLUON-LBPRGKRZSA-N 332.404 0.024 10 20 ECCD O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NCc1ccccc1O 299457444 AZKYUMYCVTWJPB-GREKMHCPSA-N 326.352 0.816 10 20 ECCD CC1(C)COC(=O)[C@@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 837635143 VLAJHTAEJVARLL-NSHDSACASA-N 342.373 0.445 10 20 ECCD COC[C@H](NC(=O)C(=O)NCCc1ccc(N)cc1)[C@H]1CCCO1 842173826 VGXJWZBWXTYSAF-LSDHHAIUSA-N 335.404 0.238 10 20 ECCD C[C@H](N)CN(C)C(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 911578195 KDHAGTSQFQQQQV-XJKSGUPXSA-N 349.479 0.277 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N[C@H]2CCN(CC3CC3)C2)cc1 842202602 OUIHKUHGGXIXHX-INIZCTEOSA-N 330.432 0.528 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)Cc2nnn(C(C)(C)C)n2)cc1 852790936 CEBIBPUUZRQJTJ-CQSZACIVSA-N 345.451 0.853 10 20 ECCD Oc1cc2c(cc1CN1CC[C@H](CN3CCOCC3)C1)[C@H](O)CO2 768466595 SRJUUVSXQGRXGH-CXAGYDPISA-N 334.416 0.972 10 20 ECCD C[C@H](C(N)=O)N1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1044352284 BMUJDTBRJKUSNK-SECBINFHSA-N 332.364 0.479 10 20 ECCD NC(=O)CNCC1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1206961947 SKDSQMCSOLZIBK-UHFFFAOYSA-N 346.391 0.776 10 20 ECCD CNC(=O)NCC(=O)NCCC1=CCN(c2nccnc2F)CC1 1089867832 RXOQDNDUNYMUHS-UHFFFAOYSA-N 336.371 0.188 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CC(NC(=O)[C@H]3CCCO3)C2)cc1 990164599 JTSSYWWWQSSJIG-CYBMUJFWSA-N 345.359 0.969 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCC1(CO)COC1 1333885829 QIWIDOWHMAMZKP-UHFFFAOYSA-N 349.431 0.456 10 20 ECCD CC[C@@H]1C(=O)NCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 151082816 FHZKZDNAPRYVAK-MRXNPFEDSA-N 332.448 0.921 10 20 ECCD COC(=O)CN(Cc1nnn(C)n1)Cc1cc(Cl)ccc1O 193467716 GKOQNNRBEVKHAV-UHFFFAOYSA-N 325.756 0.744 10 20 ECCD O=C(Cn1cc(NC(=O)c2c(F)ccc(O)c2O)cn1)NC1CC1 276504819 ADKCYTPEXZVAFE-UHFFFAOYSA-N 334.307 0.964 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCn2ccnc2)cc1F 284068944 STMSHXMJNVZKFS-UHFFFAOYSA-N 333.367 0.521 10 20 ECCD C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 282068419 DISGGDAUJWRLLH-QPUJVOFHSA-N 341.389 0.018 10 20 ECCD CC(C)[C@@H](C(=O)NCCc1ccc(N)cc1)N1CCCS1(=O)=O 818545319 XKRKPLHFXKNYOS-HNNXBMFYSA-N 339.461 0.988 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@@H](CN)C1 817974301 KQTRGJYFJHHQCD-HNNXBMFYSA-N 349.431 0.707 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](CO)O1 839219279 GXFIYJURMHXCTE-BBRMVZONSA-N 349.431 0.319 10 20 ECCD CC(=O)N[C@@H](CC(=O)NCc1c(O)ccc2c1CCCC2)C(N)=O 769563103 XAEXRWSWVWQYHI-AWEZNQCLSA-N 333.388 0.267 10 20 ECCD COC(=O)c1cn(C2CN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)nn1 779549617 PKNYORNESLEWLO-HYXAFXHYSA-N 344.327 0.573 10 20 ECCD C[C@@H](NC(=O)C(=O)N1CCN(C)C(=O)[C@H]1C)c1ccc(N(C)C)cc1 1117504432 GUSGHXHANHZBRZ-CHWSQXEVSA-N 346.431 0.619 10 20 ECCD C[C@](CO)(NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 770022389 DVKWCWKMZCYPMO-CQSZACIVSA-N 328.390 0.655 10 20 ECCD CCO[C@@H]1CN(C(=O)C(N)=O)C[C@H]1CNCc1ccc(OC)c(C)c1 1087078761 MJDJBTMULJZMQC-GDBMZVCRSA-N 349.431 0.442 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)c2cnn(CCO)c2)N(C)C)cc1 1348545076 DYVXHFQAEDNJJW-QGZVFWFLSA-N 345.447 0.974 10 20 ECCD COc1ccc(CNCCN(C)C(=O)[C@H]2CC[C@@H](C(N)=O)O2)cc1C 1753232307 QALSDXMEZUEWQZ-JKSUJKDBSA-N 349.431 0.585 10 20 ECCD C[C@@H](NS(C)(=O)=O)C(=O)NCc1ccc2c(c1)CCCN2C 57558820 AKIICTUYMHBWIR-LLVKDONJSA-N 325.434 0.623 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCNC(=O)C1(C)C 172289303 QBGHZZAQESVUIV-UHFFFAOYSA-N 332.448 0.921 10 20 ECCD C[C@H](NC(=O)C(=O)NCc1nccn1C)c1ccc(N(C)C)cc1 804626266 QCAMPAVERDEVDI-LBPRGKRZSA-N 329.404 0.980 10 20 ECCD COC(=O)CC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 909858109 YRRLKYSSPMNCNH-UHFFFAOYSA-N 328.315 0.981 10 20 ECCD Cc1ncccc1CCNC(=O)C(=O)NCCc1ccc(N)cc1 911293072 RMGPCIUHFXPSGS-UHFFFAOYSA-N 326.400 0.990 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)NCCCSc2nccs2)[C@H](C)CN1 842093818 STIUDSREYFRHGP-GHMZBOCLSA-N 342.490 0.950 10 20 ECCD CN1CCN(c2ccc(CNCCCN3CCNCC3)cc2)CC1 841029932 PCMYKTJKWXTATN-UHFFFAOYSA-N 331.508 0.823 10 20 ECCD NC(=O)c1ccc(F)c(NC(=O)C(=O)NCc2ccccc2O)c1 748481147 HUNTYRXTOYYMOX-UHFFFAOYSA-N 331.303 0.885 10 20 ECCD O=C(NCCNS(=O)(=O)Cc1ccon1)c1cc(O)cs1 750250195 OIOVTFGOADVYHS-UHFFFAOYSA-N 331.375 0.291 10 20 ECCD CN(C[C@H]1C[C@@H](O)C1)C(=O)C(=O)NCCCSc1nccs1 875218231 CDRNPUXWAQEYNA-PHIMTYICSA-N 343.474 0.971 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)N2CCCNC(=O)C2)N(C)C)cc1 899097640 DGUPYBZQYIIKSJ-MRXNPFEDSA-N 347.463 0.887 10 20 ECCD COCC(=O)NCCC(=O)NCc1ccc(N2CCOCC2)cc1 1251264227 IVASICXSIBSEQG-UHFFFAOYSA-N 335.404 0.292 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1C[C@@H]2C[C@]2(C(=O)O)C1 1598530660 QBCCOROJXHNDQJ-PEBVRCNWSA-N 332.356 0.720 10 20 ECCD CN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1cccc(Cl)c1O 179769156 GNNKJXCESXBABB-LLVKDONJSA-N 346.836 0.781 10 20 ECCD CN(C)C(C)(C)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 271192398 GKLXKOIPQSXASN-UHFFFAOYSA-N 329.422 0.834 10 20 ECCD C[C@H](CC(N)=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 283533361 TXERDDBQQOCGQI-LLVKDONJSA-N 337.395 0.915 10 20 ECCD CC[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(N)=O 297262948 FHPQVPVLPVJXAR-CYBMUJFWSA-N 338.383 0.725 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)CCNC(=O)[C@@H]2CCCN2)c1 828667998 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329.360 0.883 10 20 ECCD C[C@@H]1OC(=O)N[C@@H]1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891248475 MIMKRRJIYJPLMB-CQDKDKBSSA-N 334.420 0.968 10 20 ECCD COC[C@@H](CO)NC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 792853130 PEHHOBTWZUPJBF-UKRRQHHQSA-N 337.420 0.891 10 20 ECCD COCn1nccc1S(=O)(=O)NCc1ccc(OC)cc1O 795358086 LHZBROKLZNKUSS-UHFFFAOYSA-N 327.362 0.680 10 20 ECCD CCC(=O)NC[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1O 1081143583 CGOIVMWCJZHVQY-DGCLKSJQSA-N 347.375 0.808 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@@H](C)CC(N)=O)CC2)n1 1089849818 FGOXNNFKDNITIK-LBPRGKRZSA-N 331.420 0.939 10 20 ECCD COc1ccc(-n2nnnc2CN2[C@H]3CC[C@@H]2C[C@@H]3NC(C)=O)cc1 1095077987 QDDRCOZMXSXNKT-KBMXLJTQSA-N 342.403 0.912 10 20 ECCD Cc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c(=O)n(C)c1 1341714818 OXWWIJHXHYHTMB-UHFFFAOYSA-N 345.355 0.402 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CCS(=O)(=O)C1 1342327595 VFZGMLXROUMLPF-PWSUYJOCSA-N 327.402 0.970 10 20 ECCD CNC(=O)CN[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1C 1755124386 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C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](CO)O1 839219281 GXFIYJURMHXCTE-CJNGLKHVSA-N 349.431 0.319 10 20 ECCD CC(=O)NCCCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851936980 YZGAVPNKVCMRJQ-UHFFFAOYSA-N 348.447 0.973 10 20 ECCD CN1CCN(C)[C@H](CNCc2ccc(N3CCC(O)CC3)cc2)C1 877031095 MIXOONAVSLXGND-GOSISDBHSA-N 332.492 0.983 10 20 ECCD O=S1(=O)CCC(O)(CNCc2cc3c(cc2O)OCO3)CC1 1322303312 ZIKNAXSLJPYWIE-UHFFFAOYSA-N 329.374 0.150 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](F)C(=O)O 1605456857 MTEAMDLPQPQUKY-ZDUSSCGKSA-N 339.367 0.640 10 20 ECCD CC(=O)C(=O)COC(=O)c1c(C)oc(-n2cccc2)c1-c1nn[nH]n1 1602912206 OCIAHERJQRLDHS-UHFFFAOYSA-N 343.299 0.874 10 20 ECCD C[C@@H]1[C@H](C(=O)O)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1594158704 LIDNVYFUVLZANI-PSASIEDQSA-N 342.373 0.699 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2C[C@@H](O)C[C@@H](C(=O)O)C2)cc1 1598317619 JPDMTBSZUCITOQ-HIFRSBDPSA-N 335.404 0.136 10 20 ECCD CCN1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1=O 273473533 KFENDKDNOBFVJN-UHFFFAOYSA-N 341.389 0.068 10 20 ECCD 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CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4C[C@]4(CO)C3)nc12 782633296 NSYHITGVQKSDAP-MGPLVRAMSA-N 332.360 0.426 10 20 ECCD COC(=O)NCC(=O)NCCC1=CCN(c2ccc(C)nn2)CC1 1089809047 WLLHOOLSVHIIEV-UHFFFAOYSA-N 333.392 0.784 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CC(NC(=O)c3cn[nH]c3)C2)cc1 990323653 ITJCCQZPYYVDRL-UHFFFAOYSA-N 341.331 0.827 10 20 ECCD CC[C@H](NCCCNC(=O)c1ccc(N=NC(N)=O)cc1)C(N)=O 1177238496 ZGLMWWFIBRTMBX-LBPRGKRZSA-N 334.380 0.822 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C[C@]1(C)CO 1330821454 CRNSDMYSZWCFIO-SCLBCKFNSA-N 333.432 0.846 10 20 ECCD C[C@@H]1CN2CCN1C[C@@H]2C(=O)N1CCOc2cc(N(C)C)ccc21 1347952942 YSRXXAPVBWDZEB-CZUORRHYSA-N 330.432 0.866 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCCc2ccc(N)cc2)CC[C@H]1C(=O)O 1599912228 SSCWMQPVQDASHO-SMDDNHRTSA-N 333.388 0.497 10 20 ECCD COc1ccc(CNC[C@H](O)CNC(=O)c2cncnc2)cc1C 1753908373 HRNFKJQEYDSPQJ-HNNXBMFYSA-N 330.388 0.674 10 20 ECCD CN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)CC(C)(CO)CO 158968138 VQZJTBPSLAHWTD-UHFFFAOYSA-N 337.464 0.634 10 20 ECCD 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ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H]4C[C@]4(CO)C3)nc12 782633298 NSYHITGVQKSDAP-QLJPJBMISA-N 332.360 0.426 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@H]3CCCNC3=O)cc2)CC1 899212113 PRNQBJSCYNUMAS-INIZCTEOSA-N 330.432 0.581 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)n1cncn1 1325764568 TYVPEIOYUBGWOV-JQWIXIFHSA-N 348.359 0.541 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCn2cccn2)c1 55221890 LKZLOUCAHTWZCO-UHFFFAOYSA-N 338.389 0.780 10 20 ECCD CN1C(=O)C(=CNNc2ncnc3sccc23)C(=O)N(C)C1=O 111027076 MTFKOUZYXNEEHP-UHFFFAOYSA-N 332.345 0.542 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]3C(=O)OC)nc12 265073413 XJXWEEOOBMPZSF-LBPRGKRZSA-N 348.359 0.749 10 20 ECCD COCC1(O)CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 270327508 BBVWRQMNPBXQIQ-UHFFFAOYSA-N 335.448 0.842 10 20 ECCD CNC(=O)C(C)(C)CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 283604188 UZHVDQKHPQHVJO-UHFFFAOYSA-N 334.420 0.257 10 20 ECCD C[C@H]1C(=O)NCCN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291041 DUEXVLQYVMXJTC-ZDUSSCGKSA-N 342.399 0.026 10 20 ECCD 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O=C(O)CN1CCC[C@H](C(=O)NCCc2ccc(O)c(O)c2)C1=O 1595082765 KUQNEYVUDVOBIB-LLVKDONJSA-N 336.344 0.080 10 20 ECCD O=C(CN1CCC(=O)NC1=O)NCc1c(O)ccc2c1CCCC2 266562343 PWAHDENWAORRBV-UHFFFAOYSA-N 331.372 0.829 10 20 ECCD Cc1ccc(C(=O)N(C)C2CCN(S(C)(=O)=O)CC2)c(O)c1O 272556863 BUPSTYKJNJRBCL-UHFFFAOYSA-N 342.417 0.902 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)CCCC(N)=O)cc2)CC1 280261740 NWOOVARNOIUJTG-UHFFFAOYSA-N 346.431 0.627 10 20 ECCD CN(C)c1ccc(OCC(=O)NCCCN(C)S(C)(=O)=O)cc1 289396565 NIGWIWTZOIJYMG-UHFFFAOYSA-N 343.449 0.529 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)C[S@](C)=O 807099209 NULYYKJDXVHGLD-MYODQAERSA-N 339.461 0.560 10 20 ECCD CN(C)c1ccc(CN(C(=O)C(=O)N2CCNCC2)C2CC2)cc1 817926488 KAWBSPZNCZFFFG-UHFFFAOYSA-N 330.432 0.675 10 20 ECCD C[C@@H](NC(=O)[C@@H]1OCCN(C)C1=O)c1ccc(N2CCOCC2)cc1 900386895 KFCYBCYLYXNFPF-CJNGLKHVSA-N 347.415 0.558 10 20 ECCD CCn1[nH]c(C)nc1=NC(=O)c1cc(NS(C)(=O)=O)ccc1O 839903053 UCVDNTDYYKLMQY-UHFFFAOYSA-N 339.377 0.358 10 20 ECCD 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ECCD CN(C)c1ccc([C@H](CNC(=O)C[C@H]2CC(=O)NC2=O)N(C)C)cc1 891250616 YLBVVSFOXAESQH-ZFWWWQNUSA-N 346.431 0.524 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)Cn3cncn3)CC2)ncn1 1089831520 AKULORHYNDJXFA-UHFFFAOYSA-N 327.392 0.720 10 20 ECCD O=C(NCCC1=CCN(c2cncc(Cl)n2)CC1)[C@H]1CCNC1=O 1089855083 GWANWAWYCGBDNF-GFCCVEGCSA-N 349.822 0.909 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C[C@H]3CNCCO3)cc2)CC1 1332067389 AMGAHXLLDHZKDU-KRWDZBQOSA-N 332.448 0.433 10 20 ECCD C[C@@H](NC(=O)C(=O)N1CCCNC(=O)C1)c1ccc(N(C)C)cc1 1349323712 MZIKBRFIPMAOMT-GFCCVEGCSA-N 332.404 0.278 10 20 ECCD O=C(O)Cn1cc(CNCc2ccc(N3CCC(O)CC3)cc2)nn1 1608797607 PFXGXUZTPBFTSS-UHFFFAOYSA-N 345.403 0.614 10 20 ECCD CCC(=O)N1CC(O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1043559221 FXSUZEJLXGRAHK-UHFFFAOYSA-N 333.348 0.562 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CCCOC2)c1 55319190 GDYTYXPDEDIPKD-SNVBAGLBSA-N 328.390 0.920 10 20 ECCD CCN(CC)c1ccc(CNC(=O)c2cn(CC(N)=O)nn2)cc1 79629353 LGSQHJMLRJPJAH-UHFFFAOYSA-N 330.392 0.540 10 20 ECCD 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COc1ccc(CNC(=O)C(=O)Nc2cc(C)cn(C)c2=O)c(O)c1 797389035 MJTLTSKGAMZZKI-UHFFFAOYSA-N 345.355 0.663 10 20 ECCD COc1ccc(CNC[C@H]2C[C@H](NC(=O)[C@H]3CNC(=O)N3)C2)cc1C 984722750 LUTPDAJOELYAPU-RBSFLKMASA-N 346.431 0.669 10 20 ECCD C[C@H](NC(N)=O)C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089827376 JIHOMJLXGGRWLZ-JTQLQIEISA-N 336.371 0.315 10 20 ECCD COCCCC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1841264529 HVOYOHZXQMOGGY-UHFFFAOYSA-N 349.387 0.736 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1C[C@H]1C(=O)O 1598519222 LVXIJYUSZTYKBS-TZMCWYRMSA-N 333.388 0.548 10 20 ECCD COc1ccc(CN[C@@H]2CN(C(=O)Cn3ncnn3)C[C@H]2C)cc1C 1054651048 VCUXTBRIQOMATH-UKRRQHHQSA-N 344.419 0.627 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCN([C@H]3CCOC3)CC2)cc1 366517889 SQNPKVBJXUIITR-SFHVURJKSA-N 346.475 0.775 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CC[C@H](O)CC2)c1 271232428 DMHRVQIGJMDXMY-HOMQSWHASA-N 328.390 0.797 10 20 ECCD CN(C)c1ccc(CNC(=O)CN[C@H](CO)c2cnn(C)c2)cc1 275194115 PJKVJOYVNNZGHY-MRXNPFEDSA-N 331.420 0.426 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@@H](O)C3)ccc21 283346089 XAHDKBFAJQYASH-OAHLLOKOSA-N 331.416 0.669 10 20 ECCD COCCN1C[C@H](C(=O)OCC(=O)c2ccc(O)c(O)c2)CC1=O 800132492 SRFLAUBXWNQLSX-LLVKDONJSA-N 337.328 0.319 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](C)[C@@H]1CO 807096717 ICHUYSBRQJQEFE-WBMJQRKESA-N 333.432 0.907 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NCCC(=O)O)cc1F 817110339 BXOWFQVSXIAXPJ-UHFFFAOYSA-N 339.367 0.879 10 20 ECCD C[C@H]1[C@H](N(C)C)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 816767613 CLWCAVWPKPYITN-GXFFZTMASA-N 341.433 0.928 10 20 ECCD CC(=O)NCC(=O)NCC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 839918736 NDCSKFKFGHXRMV-CYBMUJFWSA-N 348.447 0.361 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCc3nn[nH]c3C2)c1 748364367 VPKQYWKHFFWJAG-UHFFFAOYSA-N 337.361 0.080 10 20 ECCD CC[C@H](CN1CCOCC1)NC(=O)C(=O)NCCc1ccc(N)cc1 911286944 AYCVFBLVIBTQFT-MRXNPFEDSA-N 348.447 0.155 10 20 ECCD CC(C)(CNC(=O)NCCc1ccc(N)cc1)NS(C)(=O)=O 841801844 ZBOFSUGZCUTBBX-UHFFFAOYSA-N 328.438 0.438 10 20 ECCD CC(C)[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CCN1 842035805 JFWMTOVZTLXLBK-MRXNPFEDSA-N 332.448 0.825 10 20 ECCD C[C@H](C(N)=O)N1CC[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1029013811 IHJDPWNDTBPRQN-MNOVXSKESA-N 346.391 0.775 10 20 ECCD Cc1ccc(O)c(CNC(=O)[C@H]2CCCN(S(C)(=O)=O)C2)c1 862754232 VHOWRPRXBFEGHJ-LBPRGKRZSA-N 326.418 0.988 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN[C@H](CCO)C3CC3)nc12 763069138 SHKGYLRMXUHEDK-CYBMUJFWSA-N 334.376 0.862 10 20 ECCD C[C@@H](N[C@H](C)c1ccccc1O)C(=O)N[C@@H]1CCS(=O)(=O)C1 879649798 UUZGKYUBLRYQPY-IJLUTSLNSA-N 326.418 0.735 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN(CCO)C3CC3)CC2)cc1 779218780 HEPNKODJNIXQMX-SFHVURJKSA-N 349.475 0.635 10 20 ECCD CC(C)CC(=O)N[C@H](CC(N)=O)C(=O)N(C)Cc1ccccc1O 798162610 ZGLFXHDRJXNMNX-CYBMUJFWSA-N 335.404 0.757 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1COC(C)(C)O1 1324899329 NMGDBEBNPDEBRU-OAHLLOKOSA-N 349.431 0.945 10 20 ECCD C[C@H](NC(=O)C(=O)NCC1(CC(N)=O)CC1)c1ccc(N(C)C)cc1 1327687075 WTMCNJVCKNZMHW-LBPRGKRZSA-N 346.431 0.702 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1C=CCC1 1328275740 WVXVNHTYJRZKPT-HNNXBMFYSA-N 329.400 0.974 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CC(=O)N(C2CNC2)C1 1578489901 UJRLFRZGJNLKHV-CQSZACIVSA-N 345.447 0.467 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCN(C)C1=O 172404878 ONFHKEVFNRJJSM-MRXNPFEDSA-N 346.431 0.895 10 20 ECCD CN(CC(=O)N1CCOCC1)C(=O)NCc1ccc(N(C)C)cc1 74019704 YWZLGSNWPVDKGK-UHFFFAOYSA-N 334.420 0.753 10 20 ECCD COC(=O)[C@@]1(F)CCN(CC(=O)NCc2ccc(N(C)C)cc2)C1 267824666 PQNZDAUIHUXHHZ-QGZVFWFLSA-N 337.395 0.956 10 20 ECCD CNS(=O)(=O)CC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 267596507 LYTCRBJYLITIAR-UHFFFAOYSA-N 325.434 0.793 10 20 ECCD CN(C)c1ccc([C@@H](CNS(=O)(=O)C2COC2)N(C)C)cc1 908459786 KXLVINWIRWVPPU-OAHLLOKOSA-N 327.450 0.674 10 20 ECCD COc1ccc(O)c(CNC(=O)NCCC(=O)N2CCOCC2)c1 734064809 LUDXJRXMOJLXOU-UHFFFAOYSA-N 337.376 0.449 10 20 ECCD COc1ccc(O)c([C@H](C)NS(=O)(=O)N(C)CCC(=O)O)c1 833733185 BPZKYNCTPPMGLK-VIFPVBQESA-N 332.378 0.703 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)Cn2cc([C@@H](C)O)nn2)cc1 846442778 XDMIZEXXCBLEDH-CYBMUJFWSA-N 347.419 0.935 10 20 ECCD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCNC1 842226406 PJLHDTRRKTYDPD-OAHLLOKOSA-N 332.448 0.968 10 20 ECCD CN(C)c1cc(F)c(CNCCCN2CCNC(=O)C2)cc1F 858185233 STKFFAFJZVUPHQ-UHFFFAOYSA-N 326.391 0.942 10 20 ECCD CCOc1ccc(CN2CCN(S(=O)(=O)N(C)C)CC2)c(O)c1 768250589 WECAUAOKZJMEBE-UHFFFAOYSA-N 343.449 0.715 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCCNCC(=O)NCC2CC2)cc1 1153047436 DMVXRAZCAYPGIV-UHFFFAOYSA-N 346.391 0.695 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2F)C1 1845094130 IIUKYJCHAYKBJR-WDEREUQCSA-N 335.335 0.668 10 20 ECCD O=C(Cn1cnc(-c2nn[nH]n2)n1)NCc1cc(Cl)ccc1O 1592940938 KSAKESCDGHRDTR-UHFFFAOYSA-N 334.727 0.134 10 20 ECCD CN(Cc1ccccc1O)C(=O)c1ccnc2c(C(N)=O)cnn12 136461360 ORVMHQMPPGMMIU-UHFFFAOYSA-N 325.328 0.806 10 20 ECCD C[C@H](C[S@@](C)=O)NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 285620593 DJQSWDJQKMRKKY-DJNLSKAYSA-N 343.424 0.391 10 20 ECCD CC[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)C(=O)NC 823523839 KPWFJGXEZYQUFR-INIZCTEOSA-N 348.447 0.972 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CCNC(=O)[C@H]1CCCN1 825942872 NHNSNEIQKZNVJG-MRXNPFEDSA-N 332.448 0.969 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3C[C@@H]3C(=O)O)cc2)C1 739160858 PFQJOGTWVNHWER-YUELXQCFSA-N 345.399 0.725 10 20 ECCD COCCNCCNC(=O)NCc1ccc(N2CCOCC2)cc1 841729219 DHMTVJPWBBTGBK-UHFFFAOYSA-N 336.436 0.558 10 20 ECCD N=C1NC(=O)[C@@H](CC(=O)NCc2ccc(N3CCOCC3)cc2)S1 742572889 GYVYDZUOMNKCMM-CYBMUJFWSA-N 348.428 0.696 10 20 ECCD C[C@@H](O)[C@@H]1NC(=O)N(Cc2ccc(N3CCN(C)CC3)cc2)C1=O 925080203 RRTKDTAMHIAXEU-DOMZBBRYSA-N 332.404 0.240 10 20 ECCD CC1=NO[C@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 854798784 WGYXLEQZHCQBLA-JTQLQIEISA-N 327.362 0.658 10 20 ECCD CNS(=O)(=O)c1ccc(C(=O)NCCc2ccc(O)c(O)c2)o1 768900324 UDMGGTGWUSGNRM-UHFFFAOYSA-N 340.357 0.571 10 20 ECCD COc1cc(N2CCN3C(=O)NC(=O)[C@@H]3C2)c([N+](=O)[O-])cc1OC 778587795 FSZNZMAFTQROTQ-JTQLQIEISA-N 336.304 0.352 10 20 ECCD C[C@H](N)CCNC(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1120436737 XFLMUDOGNBKRSB-BBRMVZONSA-N 349.479 0.325 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)Cn3cc(C)nn3)CC2)cc1 899901032 AVPJLRHYQVTJEA-INIZCTEOSA-N 331.420 0.778 10 20 ECCD CN(C)c1cc(F)c(CN2C[C@@H](C(N)=O)[C@H](C(N)=O)C2)cc1F 895312826 TUHLVDDYIKMMHT-NXEZZACHSA-N 326.347 0.049 10 20 ECCD COc1cc(C(=O)N[C@@H](C)CCNC(=O)C(F)F)cc(OC)n1 1075250968 VSLPLHHWFXRKFI-QMMMGPOBSA-N 331.319 0.989 10 20 ECCD O=C(NCCC1=CCN(c2ncncc2Cl)CC1)[C@@H]1CCNC1=O 1089855413 KNCTZOQFXUUXRL-LBPRGKRZSA-N 349.822 0.909 10 20 ECCD CNC(=O)CCCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1325710133 MNORIRCHMQWOAQ-UHFFFAOYSA-N 334.420 0.353 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@H]1O 1325555986 BONFCGJMIDLKNK-XJKSGUPXSA-N 333.432 0.940 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CC(F)C3)C2)cc1 1332043073 HJUNTVTYTMYUBD-GFCCVEGCSA-N 335.379 0.818 10 20 ECCD CN1C(=O)C(=Cc2cccc3[nH]nc(C(=O)O)c23)C(=O)N(C)C1=O 1776115605 FGWCNWQGNDJXBL-UHFFFAOYSA-N 328.284 0.695 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCN(CC(C)(C)O)CC2)cc1 171153249 POBNFZFSMDUKHP-UHFFFAOYSA-N 348.491 0.757 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCC(CC(N)=O)CC2)cc1 77168496 VRBANVTUNJTURY-UHFFFAOYSA-N 332.448 0.956 10 20 ECCD CN(CC(=O)NCc1ccc(N(C)C)cc1)CC1(O)CCOCC1 189776061 ORSWFLZFHBBXFJ-UHFFFAOYSA-N 335.448 0.842 10 20 ECCD CCC[C@@H](C(=O)N1CCOc2cc(N(C)C)ccc21)S(N)(=O)=O 611651302 SJWRNKVOLKCFCR-AWEZNQCLSA-N 341.433 0.935 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCN(C(=O)[C@H](C)O)CC2)c1O 278334824 ZRURSWIAPIRJDH-JTQLQIEISA-N 339.348 0.334 10 20 ECCD COc1ccc(O)c(CN2CCN(C(=O)C(=O)NC3CC3)CC2)c1 271718462 JABCUBKLGIRFRF-UHFFFAOYSA-N 333.388 0.324 10 20 ECCD CC(=O)C(=O)CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCCO3)C1=O 289524810 DMBQGVUQMPMSFJ-KRWDZBQOSA-N 346.339 0.773 10 20 ECCD CCO[C@@H]1C[C@](O)(CNC(=O)C(=O)Nc2ccc(N)cc2)C1(C)C 841115016 XQEDFQBIFKVFNK-DYVFJYSZSA-N 335.404 0.890 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CCC(N)CC3)ccc21 842149805 GDXVGDDHTOETED-UHFFFAOYSA-N 330.432 0.635 10 20 ECCD NC(=O)c1nccnc1C(=O)NCc1ccc(N2CCOCC2)cc1 742246947 IZGCUGGTIZLJFK-UHFFFAOYSA-N 341.371 0.342 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@@H]2CNC[C@@H]2C1 841729711 IEBSFRFEWXGPAC-IYBDPMFKSA-N 330.432 0.884 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N1CC(F)C1 852500627 PQGSPRXTXOIUEJ-UHFFFAOYSA-N 341.408 0.785 10 20 ECCD COc1cccc(CNC(=O)[C@H](CCSC)NC(N)=O)c1O 860242395 ZVSQDUGZZCXAIC-JTQLQIEISA-N 327.406 0.807 10 20 ECCD Cn1nncc1CN1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1031464482 TZMJXYSFCYBVRF-UHFFFAOYSA-N 342.363 0.592 10 20 ECCD CS(=O)(=O)N1CCCC[C@H]1C(=O)NCCc1ccc(O)c(O)c1 762261528 ODXJYNXDTXGMET-LBPRGKRZSA-N 342.417 0.571 10 20 ECCD CN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CCNC1=O 1117452801 PJIRZIJHGNNRCL-HNNXBMFYSA-N 342.399 0.026 10 20 ECCD CNS(=O)(=O)CCNCc1ccc(N2CCC(O)CC2)cc1 877465058 SZAJGCBUNPZLEI-UHFFFAOYSA-N 327.450 0.287 10 20 ECCD CC(=O)NC[C@H]1COCCN1C(=O)c1ccc(N=NC(N)=O)cc1 964041870 VWSRXHCSOVLTGA-ZDUSSCGKSA-N 333.348 0.826 10 20 ECCD CCOCC(=O)NCCCNCc1nnnn1-c1ccc(OC)cc1 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332.364 0.481 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C(=O)N3CC(F)C3)cc2)CC1 1262145413 WIOGNHASVJDWGW-UHFFFAOYSA-N 334.395 0.235 10 20 ECCD COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@H]2CCC(=O)N2)cc1C 1755774790 KLSSVTNCENQNTA-LSDHHAIUSA-N 349.431 0.191 10 20 ECCD C[C@H](Cn1cccn1)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 283514960 PXGSGWUGXDJBRD-CYBMUJFWSA-N 329.404 0.770 10 20 ECCD CC(=O)C(=O)COC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 808485848 XKIJPGLOUJAQNS-UHFFFAOYSA-N 329.286 0.313 10 20 ECCD CC(C)[C@@H]1C(=O)NCCN1CC(=O)NCc1ccc(N(C)C)cc1 299437745 YBJPHESLVAMKOP-QGZVFWFLSA-N 332.448 0.825 10 20 ECCD CCC[C@@H](C(=O)NCc1ccc(N(C)C)c(F)c1)S(N)(=O)=O 824670197 VYNLDXIIUOBXKZ-ZDUSSCGKSA-N 331.413 0.965 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H](O)C3CC3)cc2)C1 822938853 ZMZSFQHDVGXLOW-GOEBONIOSA-N 331.416 0.775 10 20 ECCD NC(=O)[C@@H]1C[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 900901558 NZVKSJYHGQMFEP-OLZOCXBDSA-N 335.379 0.524 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)CCn1cc[nH]c(=O)c1=O 734468479 XZFFBTPIGXYOLB-UHFFFAOYSA-N 330.388 0.618 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CC(=O)N1 831706779 LFFRARFTSZLWPL-JTQLQIEISA-N 326.736 0.436 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H](CN)C[C@@H]1C 842154110 RLQMSLUJUBGOQE-KBPBESRZSA-N 332.448 0.873 10 20 ECCD COC(=O)[C@H]1CNCCCN1Cc1ccc(N2CCOCC2)cc1 843123168 IMDVROLOFKWXQM-QGZVFWFLSA-N 333.432 0.860 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NC[C@H]1CCCN1 842070938 VKNQEQVQJJUSDT-GOEBONIOSA-N 346.475 0.976 10 20 ECCD COC(=O)C[C@@H](C)N1CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 841055691 LOASQBUXUVHUMY-GFCCVEGCSA-N 348.403 0.303 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H](O)c3cnn(C)c3)CC2)cc1F 857464678 JTVUUMKQHYKZMJ-MRXNPFEDSA-N 348.378 0.950 10 20 ECCD COc1ccc(O)c(CNC(=O)N[C@H]2CCCS(=O)(=O)C2)c1 758656705 DASWFEJMUVGVJM-NSHDSACASA-N 328.390 0.777 10 20 ECCD COc1cc(Cl)cc(CN2CCN3C(=O)NC(=O)[C@@H]3C2)c1O 761215642 HKZFYEQZBFCEPH-JTQLQIEISA-N 325.752 0.790 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(C(=O)c3cc[nH]n3)C2)cc(OC)n1 941653759 JCFUHFFKMWVBSC-LLVKDONJSA-N 345.359 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CCOC(=O)CN(CCC(=O)N1CCNCC1)Cc1ccccc1O 1577951484 PCHMRKFXOLHFLA-UHFFFAOYSA-N 349.431 0.579 10 20 ECCD COC(=O)CN(CC(=O)O)Cc1ccc(N2CCOCC2)c(F)c1 1598861914 TVOYHDCOENMDQX-UHFFFAOYSA-N 340.351 0.722 10 20 ECCD CNC(=O)CN1CCC(NCc2ccc(N3CCOCC3)cc2)CC1 78973235 VSLOJKMYFRFGBO-UHFFFAOYSA-N 346.475 0.823 10 20 ECCD COCc1noc(CN2CCN(C(=O)c3cccc(O)c3O)CC2)n1 275436538 BIPAZUAUJUPSRZ-UHFFFAOYSA-N 348.359 0.585 10 20 ECCD CC(C)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)OCCO 292009642 DBSBRVISTBCIPJ-UHFFFAOYSA-N 346.405 0.281 10 20 ECCD C[C@@H](NC(=O)CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)c1ccccc1O 827937451 XECSDBWDKIXPEO-CEMKBHKYSA-N 344.367 0.732 10 20 ECCD CN1CCCc2cc(CNC(=O)CCCS(N)(=O)=O)ccc21 906454546 FXEZINAEGRFHHZ-UHFFFAOYSA-N 325.434 0.754 10 20 ECCD C[C@@H]1CC(=O)NCCN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 839299624 DPPOUDRIXRBKTP-CYBMUJFWSA-N 346.431 0.448 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCc3ccn(C)n3)C2)cc(OC)n1 1020352417 NOUBWAMZRGALDV-HDJSIYSDSA-N 345.403 0.883 10 20 ECCD 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ECCD CN(C)C(=O)Cn1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)nn1 56968433 RQRFVUMQNNKRGC-UHFFFAOYSA-N 344.419 0.705 10 20 ECCD CCN(CC)c1ccc(CNC(=O)Cn2ccc(=O)[nH]c2=O)cc1 194648240 RAORUWZKMBNFCL-UHFFFAOYSA-N 330.388 0.699 10 20 ECCD COC(=O)[C@@]1(NCC(=O)N(C)Cc2ccc(N(C)C)cc2)CCOC1 271257626 TYWODBYDYXLGPB-GOSISDBHSA-N 349.431 0.633 10 20 ECCD COc1ccc(O)c(CN2CCN(C(=O)CN3CCOCC3)CC2)c1 271860337 YJWQKAVDVBEFQF-UHFFFAOYSA-N 349.431 0.377 10 20 ECCD CN(CCN(C)C1CC1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 283501058 NNXCUVUUISBTKO-UHFFFAOYSA-N 332.448 0.921 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCCn2cccn2)cc1F 284161780 UMOBJNXEVZNPPZ-UHFFFAOYSA-N 347.394 0.911 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)Cn3cccnc3=O)C2)cc1 819583951 XORHEKAQOITBSN-AWEZNQCLSA-N 342.399 0.895 10 20 ECCD CON(C)C(=O)CNC(=O)NCc1cccc(Br)c1O 817802361 OMQFZKYDPWYWPH-UHFFFAOYSA-N 346.181 0.974 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)CN3CCOCC3=O)C2)cc1 819587111 FEEUANLWOQIXCH-CQSZACIVSA-N 347.415 0.497 10 20 ECCD CCOC(=O)CN(CCN1C(=O)CNC1=O)Cc1ccccc1O 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349.387 0.819 10 20 ECCD COC(=O)COc1ccc(N(C)Cc2cn(CC(=O)OC)nn2)cc1 295345790 IGYIORRQPWGIPW-UHFFFAOYSA-N 348.359 0.639 10 20 ECCD COCCOCCOCCN(C)C(=O)c1c(F)ccc(O)c1O 296733332 OEEAYVVGMPFPKZ-UHFFFAOYSA-N 331.340 0.989 10 20 ECCD C[C@H](CCO)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 738982844 CDURBDNCTUQREV-HIFRSBDPSA-N 348.447 0.958 10 20 ECCD CC(=O)N[C@H]1CCCN(C(=O)COC(=O)c2cc(O)cs2)C1 732353133 LUMADMDBDBTNJI-JTQLQIEISA-N 326.374 0.738 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)NC[C@@H]1CCCN1 842092737 MDDMAXCSWLOHMU-JTQLQIEISA-N 328.463 0.610 10 20 ECCD C[C@@H]1CNCCN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 842170905 NRAHSGXSHKMYRQ-CQSZACIVSA-N 328.416 0.499 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](N[C@H]3CCCNC3=O)C2)cc(OC)n1 1020352557 VJTHUFNWLDRGFH-AVGNSLFASA-N 348.403 0.228 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCN3C(=O)NC(=O)[C@@H]3C2)cc1F 760107034 QTLIQMIYQSQHJQ-ZDUSSCGKSA-N 349.366 0.337 10 20 ECCD CC(C)OC(=O)[C@H](C)CNC(=O)C(=O)NCCc1ccc(N)cc1 1118042842 DKPJYELXYDFZGG-GFCCVEGCSA-N 335.404 0.631 10 20 ECCD CC(=O)N(C)[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1O 958365896 KYMZQPPDDPKHJW-STQMWFEESA-N 333.348 0.513 10 20 ECCD O=C(Cn1nccn1)NCCC1=CCN(c2nccnc2F)CC1 1089844253 XKKSEYHMSAMHQE-UHFFFAOYSA-N 331.355 0.550 10 20 ECCD Cn1cc(C(=O)NCCC2=CCN(c3nccnc3F)CC2)nn1 1089828594 CTTRSQJZELFOBA-UHFFFAOYSA-N 331.355 0.701 10 20 ECCD C[C@@H](NC(=O)C(=O)N(C)C[C@H]1COCCO1)c1ccc(N(C)C)cc1 1328097387 MZBPUTIJRYSWJP-CJNGLKHVSA-N 349.431 0.804 10 20 ECCD C[C@H](NC(=O)C(=O)N(C)C[C@H]1COCCO1)c1ccc(N(C)C)cc1 1328097386 MZBPUTIJRYSWJP-BBRMVZONSA-N 349.431 0.804 10 20 ECCD CN(C)[C@@H]1CCCC[C@@H]1NC(=O)C(=O)NCCc1ccc(N)cc1 1325704503 OHZNFQLCZOIBTH-JKSUJKDBSA-N 332.448 0.917 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCCNC(=O)C1 1332314268 SIFOZYVELHGESF-UHFFFAOYSA-N 332.404 0.060 10 20 ECCD NC(=O)c1cn(C2CCN(C(=O)c3cccc(O)c3O)CC2)nn1 1331882151 UIGKELWGINDCOG-UHFFFAOYSA-N 331.332 0.266 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCNC(C)(C)C1 1348854131 XLZMOHSLRMZSBC-UHFFFAOYSA-N 332.448 0.921 10 20 ECCD CN(C[C@H]1CN2C[C@@H](CCC2=O)O1)c1ccc(OCC(=O)O)cc1 1777053210 IZCWDVJCVUQMPM-CABCVRRESA-N 334.372 0.976 10 20 ECCD CC(=O)N[C@H]1CCCN(C(=O)CN(C)c2ccc3c(c2)OCO3)C1 270382687 WFKYIAPKYBDYJD-ZDUSSCGKSA-N 333.388 0.979 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(CC(=O)N(C)C)nn1 273141761 FFQHPBZDPHQFQN-SNVBAGLBSA-N 347.375 0.139 10 20 ECCD CN(C)S(=O)(=O)CCN1C(=O)CN(Cc2ccccc2O)C1=O 819169606 NICRXTYWPVNULR-UHFFFAOYSA-N 341.389 0.048 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N(C)C[C@@H](C)O)C2)cc1 824980504 DGUZSEJDPNBHSM-KGLIPLIRSA-N 349.431 0.477 10 20 ECCD C[C@@H]1C[C@@H](CN)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 842171809 XIXZBULMADXWAQ-ZBFHGGJFSA-N 342.443 0.875 10 20 ECCD C[C@@H](C[C@@H](C)N)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 843263833 ZXMXJOJQIKAVFZ-OLZOCXBDSA-N 332.448 0.927 10 20 ECCD COCCn1cc(NC(=O)C(=O)NCc2cc(C)ccc2O)cn1 862024453 YGKCGAMUIPMNLJ-UHFFFAOYSA-N 332.360 0.798 10 20 ECCD Oc1cc2c(cc1CN1CCN(c3ncccn3)CC1)[C@H](O)CO2 768438633 WHHSVWDIHMQJPT-OAHLLOKOSA-N 328.372 0.930 10 20 ECCD COc1ccc(N2CCN(CCC(=O)NC(N)=O)CC2)c(OC)c1 879463167 BCEVADNWNNYAQP-UHFFFAOYSA-N 336.392 0.411 10 20 ECCD CN1CC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1=O 773214758 MMYFTEAJSQULAP-AWEZNQCLSA-N 349.406 0.881 10 20 ECCD COCCCS(=O)(=O)NCc1ccc(N2CCN(C)CC2)cc1 882664102 KDQADUBWQMHHGH-UHFFFAOYSA-N 341.477 0.894 10 20 ECCD O=C(O)CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 780609849 OWOVRXZWHCKALF-UHFFFAOYSA-N 325.340 0.671 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)C[C@H]2C[C@H]2C)cc1 1133357239 VKHYUQCGKOEGMJ-CHWSQXEVSA-N 344.419 0.923 10 20 ECCD CO[C@@H](C)CC(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089817050 GZSOJPSXGVYDDI-LBPRGKRZSA-N 345.407 0.587 10 20 ECCD COc1cc(C(=O)N[C@@H](C)CCCCNCCO)cc(OC)n1 1171676469 FRQJFSOMOSRVQG-LBPRGKRZSA-N 325.409 0.969 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCN(CCO)C(C)(C)C1 1324833525 NEWBSDLYCDDGRP-UHFFFAOYSA-N 349.431 0.266 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1CN2CCC[C@H]2CO1 1323750442 DPCNVEHTSDPERF-GJZGRUSLSA-N 347.415 0.330 10 20 ECCD CNC(=O)CCCN(C)C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1342715603 VFCFQOCBSQNOIO-ZDUSSCGKSA-N 348.447 0.914 10 20 ECCD CN1CCN(c2ccc(CN3CCCNC[C@H]3C(=O)O)cc2)CC1 1598622337 DERVWFQKFHLAPL-KRWDZBQOSA-N 332.448 0.687 10 20 ECCD COc1ccc(CNS(=O)(=O)c2cc(C(=O)O)cn2C)c(O)c1 1599573145 PAGANHZXNGZKIC-UHFFFAOYSA-N 340.357 0.916 10 20 ECCD O=C(NC1CC1)C(=O)N1CCN(Cc2c(O)cccc2Cl)CC1 119474098 KJCHUODZKRRVDO-UHFFFAOYSA-N 337.807 0.968 10 20 ECCD CC[C@@H](CNS(C)(=O)=O)NC(=O)NCc1ccc(N(C)C)cc1 296199713 HVCNFTBVMJTXHP-ZDUSSCGKSA-N 342.465 0.880 10 20 ECCD O=C1O[C@H]2C[C@H]1N(C(=O)NCc1ccc(N3CCC(O)CC3)cc1)C2 823524816 XVHCOSLFNGTGMU-JKSUJKDBSA-N 345.399 0.857 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CCOCC3)C2)cc1 824973480 BLMQFPSHEKGWGK-AWEZNQCLSA-N 347.415 0.497 10 20 ECCD COc1ccc(O)c(CNC(=O)Nc2ncn(CC(=O)N(C)C)n2)c1 747543606 BOQPBYGEBHQPQK-UHFFFAOYSA-N 348.363 0.402 10 20 ECCD NC1(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCC1 842213217 LWQNCBGZUOTLDP-UHFFFAOYSA-N 330.432 0.901 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCN([C@@H]3CCNC3=O)C2)cc1 1016379873 ATZPFFDCPIXGNU-CHWSQXEVSA-N 344.375 0.542 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC(=O)N(C)C1=O 858827061 UVKYCRVCFHUDAL-UHFFFAOYSA-N 332.404 0.995 10 20 ECCD CN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@@H]1CCN(CC(N)=O)C1 1033699342 NFYHFBRCPITRQA-GFCCVEGCSA-N 332.364 0.481 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CNCCO3)CC2)c(OC)c1 877227915 QLIDKYYDSQEABY-INIZCTEOSA-N 335.404 0.341 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NCCCC(=O)NC)cc1 1322197633 OWVIZABSXXMECH-UHFFFAOYSA-N 348.447 0.791 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N3CC[C@@H](CN)C3)cc2)CC1 1331453003 DPJFAZOMPSIYGC-INIZCTEOSA-N 331.464 0.929 10 20 ECCD C[C@H](NC(=O)Cn1cnc(-c2nn[nH]n2)n1)c1ccc(N(C)C)cc1 1609119914 OUNFXJXGLLENQB-JTQLQIEISA-N 341.379 0.402 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C[C@@H](C(=O)O)O1 1599912615 YYDQZWPEGIRHDP-FZMZJTMJSA-N 349.387 0.069 10 20 ECCD Nc1ccc(CC(=O)N2CCN(c3ccc4nncn4n3)CC2)cc1 167933828 DNCYHOZBSDRDKP-UHFFFAOYSA-N 337.387 0.598 10 20 ECCD CN(C)C[C@](C)(O)CNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 153325273 OTJLGZSNTVSLKZ-MBNRZODZSA-N 347.459 0.965 10 20 ECCD Cc1c(CNC(=O)C(=O)N[C@@H]2CCCNC2)n(C)c2ccccc12 419703740 FBTSGAWIDUHBRU-CYBMUJFWSA-N 328.416 0.971 10 20 ECCD C[C@]1(O)CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 1345068823 YLZQBRHKDUMMIY-SFHVURJKSA-N 347.415 0.123 10 20 ECCD COCCN1C[C@H](C(=O)N2CCOc3cc(N(C)C)ccc32)CC1=O 266386384 YLXUUFXLAPLEKG-CYBMUJFWSA-N 347.415 0.973 10 20 ECCD CC(=O)C(=O)COC(=O)CNC(=O)c1ccc(Br)cc1 808486590 UVJNUUDBWWPHJE-UHFFFAOYSA-N 342.145 0.880 10 20 ECCD COCCN1CN(Cc2ccc(N3CCOCC3)c(F)c2)CC1=O 802658855 JTMTYHKEMMUCCL-UHFFFAOYSA-N 337.395 0.910 10 20 ECCD NCCCn1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)nn1 827567172 AOHZVZMLKWZVTG-UHFFFAOYSA-N 344.419 0.394 10 20 ECCD C[C@@H](N)CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827394947 HOTGGIJUVQGFKZ-GFCCVEGCSA-N 325.434 0.275 10 20 ECCD CN1CCO[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)C1=O 900254893 QUUAUABOWQIQPA-OAHLLOKOSA-N 349.456 0.713 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N[C@@H](CN)C1CC1 842071281 YAZDQJSXCWYEIO-GUYCJALGSA-N 346.475 0.962 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)N(C)C[C@H](C)N)CC2)cc1 863750899 YXLWPGIGWSNZTD-AWEZNQCLSA-N 348.447 0.540 10 20 ECCD CN1CCC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 769947591 HPEQJRSVLAMHJE-NSHDSACASA-N 341.389 0.114 10 20 ECCD COC(=O)[C@@H]1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)C[C@@H]1C 1118487410 UHWBIKYXGDUESV-SWLSCSKDSA-N 347.415 0.585 10 20 ECCD C[C@@H]1OC(=O)N[C@@H]1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 786073826 QZGUUOPKLMGSDB-NHYWBVRUSA-N 349.387 0.751 10 20 ECCD COc1ccc(CN[C@@H]2CN(C(=O)[C@H](C)NC(N)=O)C[C@H]2C)cc1C 1214506380 TVIQGELOZZBCEQ-VNHYZAJKSA-N 348.447 0.997 10 20 ECCD COc1ccc(CNC[C@H]2C[C@H](NC(=O)[C@@H]3CNC(=O)N3)C2)cc1C 984722749 LUTPDAJOELYAPU-KKUMJFAQSA-N 346.431 0.669 10 20 ECCD CC(C)(O)CC(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089827907 SURVVUDRVIOGSU-UHFFFAOYSA-N 345.407 0.323 10 20 ECCD COc1ccc(CNCCCNC(=O)[C@H]2CN(C)CCO2)cc1C 1156152207 HTOADPKPPCEPDL-QGZVFWFLSA-N 335.448 0.930 10 20 ECCD CC(=O)N1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@H](O)C1 991567411 WZIVOTNYZZICGL-QWHCGFSZSA-N 333.348 0.561 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cc[nH]n1 1320399154 OMGQKFZSSMZGNH-LBPRGKRZSA-N 333.344 0.654 10 20 ECCD C[C@H](NC(=O)C(=O)NCCO[C@@H]1CCOC1)c1ccc(N(C)C)cc1 1332982143 SYSKBFBNSORQSI-XJKSGUPXSA-N 349.431 0.852 10 20 ECCD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNC(=O)CN)cc1 1349074159 CLYMPUWKPOXARD-MRXNPFEDSA-N 348.447 0.335 10 20 ECCD Cc1cc(N(C)C)ccc1CN1CCS(=O)(=O)C[C@H]1C(=O)O 1594312258 ZBUIXRRBPOXNLL-AWEZNQCLSA-N 326.418 0.745 10 20 ECCD Cc1nnc(SCC(=O)NCc2ccc(N(C)C)cc2)n(N)c1=O 7229023 ZYZDFZNCOWDIEZ-UHFFFAOYSA-N 348.432 0.135 10 20 ECCD CN(C)C(=O)NCCNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 179578016 LRUKMGPJAJHPLT-VMPITWQZSA-N 346.431 0.924 10 20 ECCD CN1CCCc2cc(CNC(=O)NC[C@H]3CC[C@H](C(N)=O)O3)ccc21 126147236 IGYJSOLMCWNDOA-GDBMZVCRSA-N 346.431 0.901 10 20 ECCD COc1cc(N2CCC(S(N)(=O)=O)CC2)c([N+](=O)[O-])cc1OC 367939771 BCHHQRSUNZWIRR-UHFFFAOYSA-N 345.377 0.869 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)CCC(N)=O 297894789 RCKZVZODRSSJCI-UHFFFAOYSA-N 334.420 0.435 10 20 ECCD COC(=O)[C@@H]1C[C@H](O)CN(C(=O)NCc2ccc(N(C)C)cc2)C1 825604052 XOAJYCDEBQSTKC-HIFRSBDPSA-N 335.404 0.818 10 20 ECCD COc1cc(Cl)cc(CN[C@H]2CS(=O)(=O)C[C@@H]2OC)c1O 826985635 JEXXHCNQKODCQB-JQWIXIFHSA-N 335.809 0.956 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@H]3C(=O)O)cc2)C1 739160857 PFQJOGTWVNHWER-VHDGCEQUSA-N 345.399 0.725 10 20 ECCD O=C(N[C@H]1CCNC1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 842227125 YWAXEJHLDRRDDK-GJZGRUSLSA-N 347.415 0.378 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(Cc3cnnn3C)C2)cc(OC)n1 1015100580 CASXZMJZFDQSMB-GFCCVEGCSA-N 346.391 0.232 10 20 ECCD COc1ccc(S(N)(=O)=O)cc1C(=O)NCc1ccccc1O 748349919 LIMZSFKTFHIURC-UHFFFAOYSA-N 336.369 0.978 10 20 ECCD COC(=O)c1cc(/C=C2/C(=O)Nc3ccc(S(N)(=O)=O)cc32)c[nH]1 753133872 RUKXFMWMFXJEOR-NYYWCZLTSA-N 347.352 0.941 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(C(=O)[C@@H]3CCOC3)C2)cc(OC)n1 938307821 FZMTXYKPZUWJKL-YPMHNXCESA-N 349.387 0.466 10 20 ECCD Cc1cccc(O)c1CN1CCn2c(nn(CC(=O)N(C)C)c2=O)C1 877464813 NTJYQGOXMZTEFV-UHFFFAOYSA-N 345.403 0.163 10 20 ECCD C[C@@H]1CN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCN1 1119425239 SMONQYJZJWXYLQ-OAHLLOKOSA-N 331.464 0.942 10 20 ECCD CN(C(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(N)cc1 877077311 CHVDYFLHGIIJFJ-AWEZNQCLSA-N 346.431 0.412 10 20 ECCD COC[C@H](C)NC(=O)NC(=O)CN[C@@H](C)c1cc(OC)ccc1O 775369882 BKDCKGRNWFRNJJ-QWRGUYRKSA-N 339.392 0.912 10 20 ECCD COc1ccc(-n2nnnc2CN2CC[C@@](C)(NC(C)=O)C2)cc1 1046089526 GIEAWIYKHZCYJL-MRXNPFEDSA-N 330.392 0.771 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NCC(=O)N(C)C)cc2)CC1 883072022 WKTYNNFFLKRHQR-UHFFFAOYSA-N 333.436 0.326 10 20 ECCD CNS(=O)(=O)c1cc(NS(=O)(=O)N2CCCC2)ccc1O 790404657 GKSYYTMMMYIOJB-UHFFFAOYSA-N 335.407 0.053 10 20 ECCD CC[C@@H](F)C(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089857253 NYLFXBRDCDJXBC-GFCCVEGCSA-N 333.371 0.910 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(F)CCOC1 1326071717 OIHGCVDFMDKPSB-ZBEGNZNMSA-N 341.335 0.817 10 20 ECCD C[C@@H](NC[C@@]1(OCCO)CCOC1)c1cc(C(=O)O)ccc1O 1604336163 DDQHQTHVTCJWRK-BZNIZROVSA-N 325.361 0.909 10 20 ECCD NC(=O)Cn1cc(C(=O)NCc2cc(Cl)cc(Cl)c2O)nn1 807837430 PTEBGQZUDTYTIG-UHFFFAOYSA-N 344.158 0.706 10 20 ECCD O=C(/C=C\c1ccc(O)c(O)c1)NCCN1CCC2(C1)OCCO2 912896848 NPRHJGZESLLNPT-RQOWECAXSA-N 334.372 0.676 10 20 ECCD NCCN(CCO)C(=O)NCc1ccc(N2CCSCC2)cc1 841707710 YFNQLJAPADNVGG-UHFFFAOYSA-N 338.477 0.702 10 20 ECCD C[C@@H](C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1)N1CCN(C)CC1 843297019 DZESQMQYKJVPLG-WMLDXEAASA-N 333.480 0.505 10 20 ECCD CC(C)CN1CCN(C(=O)C(=O)Nc2ccc(N)cc2)[C@@H](C)C1=O 841109835 PWVNRUXNRCOGKG-LBPRGKRZSA-N 332.404 0.923 10 20 ECCD COCC(=O)N(C)CC(=O)NC1CCN(c2ccc(OC)cc2)CC1 758971597 WHODKIITKWIMJT-UHFFFAOYSA-N 349.431 0.885 10 20 ECCD Cc1cc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)ncn1 757920025 NSDOMRHXDRNGFK-UHFFFAOYSA-N 336.373 0.792 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cnn(CCF)c1 861795105 MTKLJEQJYOZVCS-UHFFFAOYSA-N 336.323 0.561 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCC[C@]1(C)NC(=O)NC1=O 773744112 MUAPTDAZHBUSGV-QGHHPUGFSA-N 349.387 0.913 10 20 ECCD CCOCCNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 786823578 LCJZEKKAXXJHKP-UHFFFAOYSA-N 349.431 0.933 10 20 ECCD C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CN([C@@H](C)C(N)=O)C1 970953105 CFCZRRQGPKAOSD-UWVGGRQHSA-N 346.391 0.773 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)C[C@@H]2CCS(=O)(=O)C2)cc1 1328224807 SVZGXMXQSQDMST-WFASDCNBSA-N 339.461 0.693 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCC(=O)NCC2CC2)cc1 1322918216 DIMAULYYRJFICM-UHFFFAOYSA-N 332.404 0.011 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CNCCN3C)C2)cc1 1340386265 PVZPSGIAEVENQC-PBHICJAKSA-N 332.448 0.541 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCn1cncn1 1346105537 JGWMZLBGMNMEPU-UHFFFAOYSA-N 344.419 0.509 10 20 ECCD C[C@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)NCC(=O)O 1609772991 DNXMJFSYSJJHLN-OLZOCXBDSA-N 335.404 0.763 10 20 ECCD COc1ccc(O)c(CN(CCN2CCN(C)CC2)CC(=O)O)c1 1599599003 ZHYYJIMKVDEUDG-UHFFFAOYSA-N 337.420 0.535 10 20 ECCD COc1ccc(N2CC[C@H](NC(=O)Cn3cc(C(=O)O)cn3)C2)cc1 1599586468 QJKCXUCKRCMRKS-ZDUSSCGKSA-N 344.371 0.985 10 20 ECCD CN(C)c1ccc(CNC(=O)NCC(C)(C)NS(C)(=O)=O)cc1 109353347 YJZWSBFZJFBKGJ-UHFFFAOYSA-N 342.465 0.880 10 20 ECCD CON(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1345171419 SMXOAHZYDNPSOY-UHFFFAOYSA-N 325.340 0.298 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)CCS(C)(=O)=O 266390349 ZYLUBNRBLYBNET-UHFFFAOYSA-N 348.446 0.326 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](C)[C@H]3CO)nc12 276024295 KWUSZQPNRCOVFB-ZWNOBZJWSA-N 334.376 0.814 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCCC(C)(C)O)ccc21 285670050 IJRQSZSMPQBOTF-UHFFFAOYSA-N 333.432 0.962 10 20 ECCD NC(=O)C1=NO[C@@H](CNC(=O)NCc2ccc(N3CCCC3)cc2)C1 837627317 RUIVXAYHJXPLTA-CQSZACIVSA-N 345.403 0.716 10 20 ECCD Nc1ccc(CC(=O)N2CCC[C@@H](C(=O)N3CCNCC3)C2)cc1 832409341 HBMVKPWESUKTCY-OAHLLOKOSA-N 330.432 0.482 10 20 ECCD CC(=O)N[C@H](C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917832569 AZFLXRKBUOMYCA-DOMZBBRYSA-N 346.431 0.529 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H]3CC[C@H]3O)CC2)cc1 843116433 PPNPBMTXFKHSMG-CGTJXYLNSA-N 335.448 0.291 10 20 ECCD CC[C@H](CO)NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758185623 JWSDQYYAAPICSI-NVXWUHKLSA-N 337.464 0.539 10 20 ECCD COc1cc(C(=O)NC2CN(Cc3n[nH]c(C)n3)C2)cc(OC)n1 1030615001 VLKCKZNLWSLTCG-UHFFFAOYSA-N 332.364 0.140 10 20 ECCD CC(=O)NC[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 944430001 HHJLHEVQSGFVDA-ZDUSSCGKSA-N 333.348 0.826 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C1(CO)COC1 1321160702 XZRGEIZMNCHVLA-UHFFFAOYSA-N 336.388 0.263 10 20 ECCD CCN(CC)c1ccc(CN(C)c2nnnn2CC(=O)NOC)cc1 1334488109 OUJNTEDJVNOAJV-UHFFFAOYSA-N 347.423 0.833 10 20 ECCD CC(=O)N[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1331428683 AJDDONJZRXGEKT-NSHDSACASA-N 341.389 0.114 10 20 ECCD COC[C@@H](O)CN1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1266361983 WITLIDNIZGAVLZ-KBPBESRZSA-N 349.391 0.660 10 20 ECCD C[C@H](NC[C@@]1(OCCO)CCOC1)c1cc(C(=O)O)ccc1O 1604336165 DDQHQTHVTCJWRK-ZBEGNZNMSA-N 325.361 0.909 10 20 ECCD COc1ccc(N2CCC(NC(=O)C3=NOC4(CNC4)C3)CC2)cc1 1579224806 ZLHUCKWAQSAMII-UHFFFAOYSA-N 344.415 0.899 10 20 ECCD COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1755786174 XBFBBWLQNPAPSR-LISAXSMJSA-N 348.443 0.805 10 20 ECCD CN(C[C@H]1COCCO1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 826705830 CERVKNDYHZMWFN-HNNXBMFYSA-N 335.404 0.243 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](N)C3)CC2)cc1 923282492 SQCVRTXVQUBGFJ-AEFFLSMTSA-N 348.491 0.601 10 20 ECCD Nc1nc(N)nc(NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 858355538 QFGAZINZMRFTEC-UHFFFAOYSA-N 333.371 0.748 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNc3nc(N)nc(N)n3)cc2)C1 858357741 VLVMGVRZNVTVNY-NSHDSACASA-N 342.407 0.350 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2COCCO2)cc1F 1117098227 IRHMNCGBGACMMZ-LBPRGKRZSA-N 339.367 0.040 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H]1CCOC1 1117025184 PLSPZQIONSOESS-HNNXBMFYSA-N 347.415 0.292 10 20 ECCD CS(=O)(=O)C1(C(=O)NCCc2ccc(O)c(O)c2)CCOCC1 1117755634 QAGRAEKXOAMEGV-UHFFFAOYSA-N 343.401 0.350 10 20 ECCD CN1CCN(C(=O)CNCc2ccc(N3CCC(O)CC3)cc2)CC1 876985377 ZGEUORQDEUZJRG-UHFFFAOYSA-N 346.475 0.511 10 20 ECCD COC[C@H](O)Cc1cn(CC(=O)NCc2ccc(N(C)C)cc2)nn1 881094284 ZIZQNKULDMVVDE-MRXNPFEDSA-N 347.419 0.210 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCc4nn[nH]c4C3)nc12 788467079 DVGNZVPFPMBNFO-UHFFFAOYSA-N 343.347 0.288 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@H]2[C@@H]3CN(CCO)C[C@H]23)cc1 979159600 PAGNTXURVBAKRJ-ZSOGYDGISA-N 331.376 0.749 10 20 ECCD COc1nc(C)cc(N2CC=C(CCNC(=O)c3cnn[nH]3)CC2)n1 1089871213 PMHKXMZWXQKFAV-UHFFFAOYSA-N 343.391 0.868 10 20 ECCD CCn1nncc1CNCCNC(=O)c1ccc(N=NC(N)=O)cc1 1153048220 WDYKEPSSOVLPRQ-UHFFFAOYSA-N 344.379 0.980 10 20 ECCD Cc1ccc(O)c(CNS(=O)(=O)C[C@@H]2CCCS(=O)(=O)C2)c1 1334974886 GKDXTNUSSTXCON-GFCCVEGCSA-N 347.458 0.945 10 20 ECCD C[C@@H](OC(=O)c1cccc(O)c1O)C(=O)N1CCC(C(=O)O)CC1 1604419214 YAFCMGIANVNQMQ-SECBINFHSA-N 337.328 0.966 10 20 ECCD CO[C@@H]1CNC[C@H]1NC(=O)NCc1cccc(Br)c1O 1579120482 FTTPBDUOIGCPPT-GHMZBOCLSA-N 344.209 0.941 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCN1C(=O)CNC1=O 265081374 MZQVBQXOYXDHNQ-UHFFFAOYSA-N 347.419 0.836 10 20 ECCD COc1ccc(O)c([C@@H](C)NCCNS(=O)(=O)NC(C)C)c1 277081276 JSVCJUIREVSCFO-LLVKDONJSA-N 331.438 0.884 10 20 ECCD COCCN(C)C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 804317440 CTDAFYRBRQAGFH-UHFFFAOYSA-N 349.431 0.885 10 20 ECCD NC(=O)CN1C(=O)/C(=C/c2ccc(O)c([N+](=O)[O-])c2)SC1=S 727175441 BIGPPLFJYMHPSQ-WTKPLQERSA-N 339.354 0.987 10 20 ECCD COC(=O)[C@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 728574139 XBYYMVQXDDVSSK-MRXNPFEDSA-N 349.431 0.585 10 20 ECCD CN1CCN(c2ccc(CNC[C@@H](O)CN(C)C3CC3)cc2)CC1 905425878 CEKRUALDQXVEKX-LJQANCHMSA-N 332.492 0.983 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)Cn1cnc(-c2nn[nH]n2)n1 822205888 MJDZXTBXGALLGR-UHFFFAOYSA-N 341.379 0.149 10 20 ECCD CCOC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 842237024 AIJHLZNLFGNLOG-CQSZACIVSA-N 347.415 0.729 10 20 ECCD CO[C@@H]1CS(=O)(=O)C[C@H]1NC(=O)/C=C\c1ccc(O)c(O)c1 855475987 IOOZBISKEYJPPL-KMOZTTGJSA-N 327.358 0.039 10 20 ECCD CNS(=O)(=O)CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 751562667 BIOSNYUZSFZXEG-LBPRGKRZSA-N 341.433 0.250 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)C[C@H]1CCC(=O)N1 854988537 ZOAIPEZMXRTDCW-CYBMUJFWSA-N 334.372 0.953 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cnn(C[C@@H](O)CO)c1 854324698 NDBHKWWLHGQIPP-MRXNPFEDSA-N 332.404 0.575 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC/C=C/CO)cc2)C1 853466313 YNGAKXYVZZIPLB-YLSAJCSVSA-N 346.431 0.736 10 20 ECCD COC(=O)[C@H]1CC[C@@H](C(=O)OC)N(C(=O)c2cccc(O)c2O)C1 862823330 GBSFYKBGWNHCHR-ONGXEEELSA-N 337.328 0.665 10 20 ECCD CN(C)c1ccc(CNC(=O)N(CCO)CCOCCO)cc1F 875181925 ZHSKZVAUUMEORR-UHFFFAOYSA-N 343.399 0.405 10 20 ECCD C[C@H]1C(=O)N(C)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1 777466466 ZAYTYWPVGHPPGR-AWEZNQCLSA-N 346.431 0.895 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)C2(C)CC2)cc1 1127834388 YYHZRLRCTWBKAV-UHFFFAOYSA-N 330.392 0.677 10 20 ECCD C[C@H](NC(N)=O)C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089827915 SZDXFWPWANCBIS-JTQLQIEISA-N 336.371 0.315 10 20 ECCD CNC(=O)[C@H](C)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1177238065 POGIVHROLIKKSQ-JTQLQIEISA-N 334.380 0.693 10 20 ECCD C[C@H](NC(=O)C(=O)N1CC[C@@](F)(CO)C1)c1ccc(N(C)C)cc1 1323271792 WLILLEQNVGUGDL-SJCJKPOMSA-N 337.395 0.863 10 20 ECCD COc1ccc(CNC(=O)CN2CCC[C@H](C(=O)O)C2=O)c(O)c1 1599565368 ONVYTMATGLYSPJ-LBPRGKRZSA-N 336.344 0.340 10 20 ECCD COCC(=O)N(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 270247953 UBDOXWMMCHZCNX-UHFFFAOYSA-N 335.404 0.449 10 20 ECCD COCCOC[C@@H](O)CNCc1ccc(N2CCOCC2)c(F)c1 818967662 YEDAOVRNYXZFLU-HNNXBMFYSA-N 342.411 0.776 10 20 ECCD COc1ccc(N2CCN(C(=O)CNC(=O)[C@@H]3CCCN3)CC2)cc1 825728530 ZRAJTQSALOTEJB-INIZCTEOSA-N 346.431 0.212 10 20 ECCD NCCCCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827391241 ZQYSQZQMJWCKPX-UHFFFAOYSA-N 339.461 0.667 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3COC[C@H]3O)C2)cc1 824681834 QIOXYMHDANHNOQ-APHBMKBZSA-N 335.404 0.580 10 20 ECCD CCOC1CN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 834377153 BPKPEICYLBTZRJ-QGZVFWFLSA-N 349.475 0.899 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CC[C@@H]2CNC[C@@H]21 842214439 SCSAPFYFNQJJMM-WBVHZDCISA-N 342.443 0.723 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCO[C@H](C(N)=O)C1 840490209 XLGMFHUYOGGSCH-CJNGLKHVSA-N 348.447 0.888 10 20 ECCD CN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CCN(C(=O)C(N)=O)C1 939383733 OOSWQHRSLNUHMG-NSHDSACASA-N 346.347 0.007 10 20 ECCD C[C@H](NC(=O)Cn1cnc(N)n1)c1ccc(N2CCOCC2)cc1 865018785 NPHMFKGIEUAZHX-LBPRGKRZSA-N 330.392 0.574 10 20 ECCD COc1ccc(CNCCOCCS(C)(=O)=O)c(O)c1OC 1119949358 XOFAPYMFSVOLKO-UHFFFAOYSA-N 333.406 0.560 10 20 ECCD C[C@@H]1CN(C)C(=O)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 783755922 IQYOJUUHVBXCFQ-SECBINFHSA-N 341.389 0.066 10 20 ECCD O=C(O)CN1CCCC[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1=O 1595090205 MZLMRZBPUBKDIO-PZBABLGHSA-N 348.355 0.693 10 20 ECCD CN(CC(=O)N=[S@@](C)(=O)N(C)C)c1ccc(OCC(=O)O)cc1 1598384887 MGENSDDMAWPBRN-HSZRJFAPSA-N 343.405 0.687 10 20 ECCD COc1ccc(CNC(=O)C(=O)Nc2cc3n(n2)CCCC3)c(O)c1 376918070 NFUPRYLMOWGRCW-UHFFFAOYSA-N 344.371 1.189 10 20 ECCD 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CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCNC(=O)C2)N(C)C)cc1 891254508 YOCQUOCIKLRCOA-GDBMZVCRSA-N 332.448 0.998 10 20 ECCD C[C@H](C(N)=O)N(C)[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 980511071 NQXMZKXARXAMBI-ZWNOBZJWSA-N 346.391 0.869 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CC(=O)N(C)C1 1322849559 PUNCBTXQVUZKPA-AWEZNQCLSA-N 346.431 0.448 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1cccn1 1337826256 HWRULPFMGCBGDF-LBPRGKRZSA-N 333.344 0.585 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H](O)C[C@@H]1C(=O)O 1598519453 RAJGBNPSGZPORV-HUUCEWRRSA-N 335.404 0.231 10 20 ECCD Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)c2c(=O)[nH]n(C)c2n1 157971944 ZXOQLHQTDWPDJB-UHFFFAOYSA-N 342.355 0.954 10 20 ECCD OCCN(CCN1CCOCC1)Cc1ccc(N2CCOCC2)cc1 92186554 LGHDOBKTLLCGBM-UHFFFAOYSA-N 349.475 0.650 10 20 ECCD CN1CCC[C@H]1C(=O)N1CCN(C(=O)c2cccc(O)c2O)CC1 279763631 FDWBRIRKGMTDAS-ZDUSSCGKSA-N 333.388 0.476 10 20 ECCD COC(=O)COCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 289056280 LPKXKDFRPIJJGE-UHFFFAOYSA-N 336.388 0.671 10 20 ECCD CCS(=O)(=O)C[C@@H](C)N1C(=O)CN(Cc2ccccc2O)C1=O 819168772 WCLGGWRJQDWLKN-LLVKDONJSA-N 340.401 0.980 10 20 ECCD Cn1cc(CN2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)cn1 825756182 KWANJSFVVXLFRQ-UHFFFAOYSA-N 334.351 0.928 10 20 ECCD COCCCNC(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 824918028 RZARMWMUZIKCDK-CQSZACIVSA-N 349.431 0.790 10 20 ECCD C[C@H](NC(=O)O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 833739948 YZSKPQQJIDSTSI-JTQLQIEISA-N 325.340 0.935 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H]1CCCCN1 842171462 RIUZGSPBJCFJES-INIZCTEOSA-N 342.443 0.937 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C[C@H](C)N1 842170309 DLTWLLAGKIXJTB-GJZGRUSLSA-N 342.443 0.888 10 20 ECCD N[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 842171217 QGIYSJDZUKIREI-HNNXBMFYSA-N 328.416 0.629 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@H](OC)C3)CC2)cc1 754052191 XMXUWSMLDLIXEN-MJGOQNOKSA-N 349.475 0.899 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)N=S(C)(C)=O 866898569 GWXZIZPKILXETJ-UHFFFAOYSA-N 333.435 0.924 10 20 ECCD 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NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCNC3=O)cc2)C1 822937663 JURIRSMNWLRKFC-UKRRQHHQSA-N 344.415 0.141 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)CCNC(=O)[C@@H]2CCCN2)cc1 832274633 WIOIBJMQACZWGO-HOTGVXAUSA-N 347.463 0.127 10 20 ECCD CN1CCCc2cc(CNC(=O)NCCS(N)(=O)=O)ccc21 746983232 XALFEEZIVTVEGZ-UHFFFAOYSA-N 326.422 0.157 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](N)C2)cc1F 842208654 CUORVLHSSNAYAC-CYBMUJFWSA-N 336.411 0.848 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCN[C@H](C)C3)CC2)cc1 923290690 NPLGXJZAPQYCMX-AEFFLSMTSA-N 348.491 0.472 10 20 ECCD C[C@@H](NC(=O)NC[C@H]1CNCCO1)c1ccc(N2CCOCC2)cc1 841742403 XBSSUOCJWQALEF-RHSMWYFYSA-N 348.447 0.872 10 20 ECCD Cc1ccc(O)c(CNC(=O)CNS(=O)(=O)c2cn(C)cn2)c1 862758093 OMOVELHLWPPCFO-UHFFFAOYSA-N 338.389 0.029 10 20 ECCD CCN(CCN)C(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 861759840 QMCIQLYRVAHSKO-UHFFFAOYSA-N 348.447 0.587 10 20 ECCD COCCN(Cc1ccc(N2CCC(O)CC2)cc1)[C@@H](C)C(N)=O 876695522 ARCMRPOYTSHVJF-AWEZNQCLSA-N 335.448 0.970 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1cc(CCCO)nn1 881083957 OVVLQTAZYQDKTL-UHFFFAOYSA-N 331.420 0.928 10 20 ECCD Cc1ccc(C(=O)N2CCN([C@H](C)C(=O)NC3CC3)CC2)c(O)c1O 780860432 FHGDZOMFOZVAIF-GFCCVEGCSA-N 347.415 0.831 10 20 ECCD NC(=O)[C@H]1CC[C@@H]1C(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089850479 ZFLHXHJOCJIWPX-STQMWFEESA-N 347.394 0.770 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)c3c[nH]c(=O)cn3)CC2)ncn1 1089855659 NDLXVMMYVQUFPY-UHFFFAOYSA-N 340.387 0.825 10 20 ECCD CON(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H](C)CC(=O)O 1599312293 RNIMXFUNWISYQX-QMMMGPOBSA-N 346.361 0.631 10 20 ECCD CN1C[C@@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1=O 55524089 KACFHNBBRSIAKF-ZDUSSCGKSA-N 335.379 0.757 10 20 ECCD Cc1cccc(CN2CCN(C(=O)CN3CCOCC3)CC2)c1O 179658715 XPUBLDKZYNLAAR-UHFFFAOYSA-N 333.432 0.677 10 20 ECCD O=S(=O)(CCNCc1c(O)cccc1Cl)N1CCOCC1 113337029 METYBNXRPWLVHO-UHFFFAOYSA-N 334.825 0.797 10 20 ECCD CCC(CC)(NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(N)=O 271349261 XIYFACMGPODEHA-UHFFFAOYSA-N 343.405 0.538 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCS(=O)(=O)N(C)C 274921302 LLLSZLNPKZCQNU-SNVBAGLBSA-N 330.406 0.427 10 20 ECCD C[C@H]1CCNC(=O)[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 282068422 DISGGDAUJWRLLH-UFBFGSQYSA-N 341.389 0.018 10 20 ECCD CC(C)CN1C(=O)/C(=C\NNc2ncccc2F)C(=O)NC1=S 284894572 AJRXMSMEKWERRW-TWGQIWQCSA-N 337.380 0.920 10 20 ECCD CC[C@@H](CNS(C)(=O)=O)NCc1ccc([N+](=O)[O-])c(OC)c1O 295083720 QQXCKKXSJOKUAV-JTQLQIEISA-N 347.393 0.726 10 20 ECCD COCCn1cc(NC(=O)C(=O)N(C)Cc2ccccc2O)cn1 918444755 WDSZNANIOFYXFL-UHFFFAOYSA-N 332.360 0.832 10 20 ECCD O=C(NC1CNC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 842235733 NIQULIMCAPSXLV-UHFFFAOYSA-N 329.356 0.602 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CC[C@H](CN)C1 842275064 ZBYZJDCEXVOORC-LSDHHAIUSA-N 332.448 0.955 10 20 ECCD O=C(NCCNC1CC1)C(=O)NCc1ccc(N2CC=CC2)cc1 842170463 GPJLLJMLDNLOTJ-UHFFFAOYSA-N 328.416 0.547 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]3C(N)=O)nc12 859664230 CQZRHCRNCIKNFM-NSHDSACASA-N 333.348 0.061 10 20 ECCD COC[C@@H]1NC(=O)N(Cc2ccc(N3CCC(O)CC3)cc2)C1=O 853088669 FVFXZEMZRQKWDA-HNNXBMFYSA-N 333.388 0.715 10 20 ECCD O=C1NC(=O)N2CCN(Cc3ccc(N4CCOCC4)cc3)C[C@@H]12 761214711 DBEIKWKVQXDVKF-HNNXBMFYSA-N 330.388 0.259 10 20 ECCD COc1cc(C(=O)NC2CN(Cc3cnc(C)nc3)C2)cc(OC)n1 1030612395 NCXYQMMZIUVWHM-UHFFFAOYSA-N 343.387 0.811 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CCN2[C@@H]2CCNC2=O)cc1 1039061571 ROVVRCKCZZVJLP-CHWSQXEVSA-N 344.375 0.542 10 20 ECCD Cn1cnc(C(=O)NCc2ccc(N3CCOCC3)cc2)cc1=O 874154984 NHZUNPINHYKACT-UHFFFAOYSA-N 328.372 0.547 10 20 ECCD COc1ccc(CNCCNC(=O)[C@H]2C[C@H]2C(=O)N(C)C)cc1C 1133925001 DMUCFUDTJSVPIF-LSDHHAIUSA-N 333.432 0.934 10 20 ECCD COc1ccc(-n2nnnc2CNCCCNC(=O)[C@@H]2C[C@@H]2C)cc1 1154307397 DFQZDDWDXZYTCN-SWLSCSKDSA-N 344.419 0.923 10 20 ECCD CCCOCC(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089812021 OPWXIJWATLPWED-UHFFFAOYSA-N 345.407 0.589 10 20 ECCD CN1CCN(c2ccc(CNC(=O)CO[C@@H]3CCOC3)cc2)CC1 1332672555 ACQBSQDKKGOURE-QGZVFWFLSA-N 333.432 0.860 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3C[C@@H](C(=O)O)C3)ccc21 1333314851 YAXJSFFWUXMPJS-OKILXGFUSA-N 345.399 0.665 10 20 ECCD CCS(=O)(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1331691847 QBAKNCYCPGXCFG-UHFFFAOYSA-N 325.434 0.828 10 20 ECCD O=C(NC1CCC(C(=O)O)CC1)C(=O)N1Cc2cccc(O)c2C1 1601435380 RTGKNQJMBRBQBW-UHFFFAOYSA-N 332.356 0.994 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@H]2CCOC2)C1 1846689608 DKSATCJIVQIYEI-NSHDSACASA-N 347.371 0.346 10 20 ECCD COCCN1C(=O)/C(=C/Nc2ccc3[nH]ncc3c2)C(=O)NC1=S 105490328 DMADQLCMTXPJCN-DHZHZOJOSA-N 345.384 0.748 10 20 ECCD COCCS(=O)(=O)N(C)Cc1ccc(N2CCOCC2)cc1 101569643 YOJGNRQMWRUBGZ-UHFFFAOYSA-N 328.434 0.931 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)CN1CCN(CC)C(=O)C1=O 264127951 SHIVVBQUUUKDBO-UHFFFAOYSA-N 347.415 0.822 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NC3CCOCC3)ccc21 284320314 ZTXLXUIEFMAPTP-UHFFFAOYSA-N 331.416 0.980 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)c1nccnc1N 819696353 QMQSWDSTBCBUSC-UHFFFAOYSA-N 330.344 0.970 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)N3CCO[C@@H](CN)C3)C2)cc1 818654475 BKGINDQSDSAAAY-YOEHRIQHSA-N 348.447 0.891 10 20 ECCD Cn1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)n1 727354077 ZBMDJYIQXOBMMW-UHFFFAOYSA-N 330.391 0.592 10 20 ECCD CN1CCN(C(=O)CN(C)C(=O)/C=C/c2ccc(O)c(O)c2)CC1 825293993 XVUQMNXLEBFGCW-GQCTYLIASA-N 333.388 0.343 10 20 ECCD CC(C)(O)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 731119732 MPESCGNUWUOXJR-AWEZNQCLSA-N 348.447 0.958 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCN1CCNCC1 842226344 ONXRZZWVGHNZBR-UHFFFAOYSA-N 348.447 0.152 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN(C)[C@@H]3CCOC3)CC2)cc1 754028699 BRRBOOXFTSJDDQ-MSOLQXFVSA-N 349.475 0.899 10 20 ECCD C[C@H](CN)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 851691595 JJQOTUVLCRWURZ-CYBMUJFWSA-N 348.447 0.070 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCOC3)cc2)C1 752255444 LCELFSGUNMSVAA-CABCVRRESA-N 346.431 0.976 10 20 ECCD CN(CC(=O)NC1CC1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 920431006 KJBFRGLJBDLZFX-UHFFFAOYSA-N 341.389 0.114 10 20 ECCD O=C(NCCO)c1cc(NS(=O)(=O)c2cccs2)ccc1O 768921392 RDPYHNCKBJEQSR-UHFFFAOYSA-N 342.398 0.977 10 20 ECCD NC(=O)C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C1CCOCC1 779489913 TVRDXRQRIQQAOC-OHVSUOQFSA-N 334.372 0.898 10 20 ECCD COc1ccc(CNCCNC(=O)c2cccn3nnnc23)cc1C 1128204324 QFNQVKHQQHNWPX-UHFFFAOYSA-N 340.387 0.961 10 20 ECCD NC(=O)CN1C[C@H]2[C@H](CNC(=O)c3ccc(N=NC(N)=O)cc3)[C@H]2C1 979159872 QFUZFLAFSHKPGZ-XYYAHUGASA-N 344.375 0.242 10 20 ECCD O=C(N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)c1cccc(O)c1O 1324921108 YNENPEXTQYYOJN-MEBBXXQBSA-N 341.385 0.564 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(C)=NO1 1330782729 NFLWYTUSSJCOND-FZMZJTMJSA-N 336.344 0.853 10 20 ECCD CN(C)c1ccc(CN2CCS(=O)(=O)C[C@@H]2C(=O)O)cc1F 1610904600 APAVMKDIMDPIOB-CYBMUJFWSA-N 330.381 0.575 10 20 ECCD COc1ccc(N2CCN(C[C@@]3(O)CCCNC3)CC2)c(OC)c1 1579225880 XWKOTRLJHYQGDZ-GOSISDBHSA-N 335.448 0.940 10 20 ECCD COc1ccc(N2CC[C@@H](NC(=O)NC[C@@]3(C)CNCCO3)C2)cc1 1579224484 LIVLAMYMVKCHIW-RDTXWAMCSA-N 348.447 0.952 10 20 ECCD CCN(CCNCc1ccc(OC)c(C)c1)C(=O)Cn1ncnn1 1754044323 AACQZRMNZOMOQV-UHFFFAOYSA-N 332.408 0.628 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2CC(=O)NCC(=O)N1CCCC1 175023691 ATJVVZPUPSKCCI-UHFFFAOYSA-N 346.431 0.690 10 20 ECCD COc1ccc(N2CCN(CCCNC(=O)CNC(C)=O)CC2)cc1 123388370 TUFXRUJMGNJTFQ-UHFFFAOYSA-N 348.447 0.460 10 20 ECCD CN(C)c1ccc(CNC(=O)NCCC(=O)N2CCOCC2)cc1 46072462 VCOVRCCRJICBGJ-UHFFFAOYSA-N 334.420 0.801 10 20 ECCD COc1cc(Br)cc(CN2CCO[C@H](C(N)=O)C2)c1O 92734951 OFAYBIQOZWHOLX-NSHDSACASA-N 345.193 0.849 10 20 ECCD Cc1ccc(C(=O)NCCCn2nc3n(c2=O)CCCC3)c(O)c1O 267637059 YMNYBYPESQXYRY-UHFFFAOYSA-N 346.387 0.921 10 20 ECCD Cc1nncn1CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 271421967 RKLMIHOECZZEIY-UHFFFAOYSA-N 339.377 0.094 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(F)(F)C(=O)N1CCOCC1 290205208 XXFRNYJONDCVNJ-UHFFFAOYSA-N 328.315 0.845 10 20 ECCD CNC(=O)[C@H]1CCCCN1CC(=O)NCc1ccc(N(C)C)cc1 298080525 KBGFTOAWCHBXDN-MRXNPFEDSA-N 332.448 0.969 10 20 ECCD CNCCCNC(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 818677728 UZGKFBXISOASBX-CQSZACIVSA-N 348.447 0.363 10 20 ECCD O=C(O)CN(CC(=O)N1CCNC1=O)Cc1cc(Cl)ccc1O 739783679 JBVQPRVIEXWTJB-UHFFFAOYSA-N 341.751 0.484 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N[C@@H]1CCNC1 842070390 OLXAQNDDRCKZRL-UKRRQHHQSA-N 332.448 0.586 10 20 ECCD CNC[C@H](C)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 851655092 LUCJCVGMBBDYST-DZGCQCFKSA-N 347.463 0.795 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NC[C@H]1CCN1C 930865897 GXMTVXIRJQWPSV-WMLDXEAASA-N 346.475 0.929 10 20 ECCD Cn1c(=O)nc(O)c2cc(C(=O)NCc3ccccc3O)cnc21 769366191 VKILWWDCHNBQHN-UHFFFAOYSA-N 326.312 0.670 10 20 ECCD CNS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C/c1cn(C)cn1)CC2 933497068 MRFFZPZGSIBIRE-GQCTYLIASA-N 346.412 0.931 10 20 ECCD CS(=O)(=O)NC1CN(Cc2ccc(N3CCOCC3)cc2)C1 862486420 ZQALWEFBWKYVDY-UHFFFAOYSA-N 325.434 0.257 10 20 ECCD Cn1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 762427891 XELRGNUHZXCSRC-UHFFFAOYSA-N 343.387 0.512 10 20 ECCD Cc1ccc(O)c(CNC(=O)[C@@H](CC(N)=O)NC(=O)CC(C)C)c1 862756287 VBAOQTZACLOVFO-CYBMUJFWSA-N 335.404 0.723 10 20 ECCD NC(=O)[C@@H]1CC[C@@H](CNC(=O)NCCCSc2nccs2)O1 760193890 KIDMUACQFQGCPJ-UWVGGRQHSA-N 344.462 0.957 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CN(CCCO)C[C@H]2O)cc1 958732510 NYWUVVIJKRFLLN-TZMCWYRMSA-N 349.391 0.254 10 20 ECCD C[C@H](C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1)NCC(N)=O 1146662476 GZRKLGQSMSTBOW-NXEZZACHSA-N 334.380 0.821 10 20 ECCD COc1ccc(CNCCCNC(=O)C2CC(=O)NC(=O)C2)cc1C 1168314240 RMXXGAVRCPPNLY-UHFFFAOYSA-N 347.415 0.652 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCN([C@@H]2CCOC2)CC1 1329631412 LHXXBERDRJXULL-OAHLLOKOSA-N 347.415 0.284 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)[C@H]1CC12CCS(=O)(=O)CC2 1321436683 SSQPHSGZUXLFGU-GFCCVEGCSA-N 339.413 0.971 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)C[C@H]2C=CS(=O)(=O)C2)cc1 1349137500 LHJYDRMSOLGWAE-IUODEOHRSA-N 337.445 0.817 10 20 ECCD COC(=O)C[C@H](O)CNC(=O)c1csc(Cc2ccc(N)cc2)n1 1578800948 DGXONTRKVLYIDK-LBPRGKRZSA-N 349.412 0.970 10 20 ECCD C[C@](CCF)(NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)O 1592498530 XIBOOTBFODROAD-CYBMUJFWSA-N 348.352 0.696 10 20 ECCD NC(=O)[C@@H]1CC[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)O1 276497219 VZRLCLVMPIMTRD-VNQPRFMTSA-N 348.399 0.933 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)C[C@@H](C)C(=O)O 817116324 SORRTIQPYSXTIW-GFCCVEGCSA-N 335.404 0.856 10 20 ECCD Cn1ccc(N2CCC[C@@H](NC(=O)Cc3ccc(N)cc3)C2=O)n1 830597837 UCLJKWDLCDDHEG-CQSZACIVSA-N 327.388 0.857 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc(N)nc(N(C)C)n1 831925208 TUPSGZCNKXMTAF-MRVPVSSYSA-N 332.364 0.292 10 20 ECCD COc1ccc(N2CCN(C(=O)N[C@H]3[C@@H]4CNC[C@@H]43)CC2)cc1F 842000389 YMKSRZLYKFBXNR-VIKVFOODSA-N 334.395 0.884 10 20 ECCD C[C@@H](CC(N)=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 749131203 HEZJIIQAIBVKJQ-LBPRGKRZSA-N 325.434 0.275 10 20 ECCD CC[C@@H](CO)NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758185621 JWSDQYYAAPICSI-DOTOQJQBSA-N 337.464 0.539 10 20 ECCD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@]1(C)CO 856251614 QDELTBDQDDVXIX-BONVTDFDSA-N 342.417 0.854 10 20 ECCD CN(C(=O)CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)c1ccc(N)cc1 877078077 ZYYMADBWLUPXEZ-GBOPCIDUSA-N 329.356 0.394 10 20 ECCD CN1CCN(c2ccc(CN(C)CCNS(C)(=O)=O)cc2)CC1 1116483902 WSIRSNFKVJKFCL-UHFFFAOYSA-N 340.493 0.419 10 20 ECCD C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@H]1O 779268212 PVRKYKWOHNTTPV-BXKDBHETSA-N 328.390 0.607 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N3C[C@H]4C[C@H]3C(=O)O4)cc2)CC1 889663843 VPEUFUFEFPNFAF-CVEARBPZSA-N 344.415 0.648 10 20 ECCD Cc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)nn1C 785294394 MICIWAPAEGDHNU-VIFPVBQESA-N 332.360 0.826 10 20 ECCD CC[C@H](F)C(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089857255 NYLFXBRDCDJXBC-LBPRGKRZSA-N 333.371 0.910 10 20 ECCD CCOC(=O)c1[nH]ncc1/C=C1/SC(N2CCOCC2)=NC1=O 1319433429 KZONDXBVEVADSA-JXMROGBWSA-N 336.373 0.889 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)C[C@H]2CCS(=O)(=O)C2)cc1 1328224805 SVZGXMXQSQDMST-IUODEOHRSA-N 339.461 0.693 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCC3(CC2)CNC(=O)C3)cc1 72696919 XUNKVVJFFJAWGZ-UHFFFAOYSA-N 344.459 0.971 10 20 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CN1CCCc2cc(CNC(=O)C(=O)N(C)[C@@H]3CCNC3=O)ccc21 1327983233 RAHXBUDRGGUDMH-OAHLLOKOSA-N 344.415 0.032 10 20 ECCD Nc1ccc(CCNS(=O)(=O)C[C@H]2CCCS(=O)(=O)C2)cc1 1326983780 GDJSUGMFNJGIAC-ZDUSSCGKSA-N 346.474 0.556 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)c2cnc(C(=O)O)cn2)cc1 1327239047 ADASNXJUIVKIQN-LBPRGKRZSA-N 329.360 0.671 10 20 ECCD CNC(=O)CN1CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 271004038 GPYJYXRCSZROSG-UHFFFAOYSA-N 338.364 0.480 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCCN(C)CC3)CC2)cc1 298687443 XEXCOGCGXILCDH-UHFFFAOYSA-N 346.475 0.981 10 20 ECCD COC[C@H](C)NC(=O)NC(=O)CSc1ncc(C(=O)OC)s1 295399035 WAQDSSJMMILBHU-ZETCQYMHSA-N 347.418 0.883 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@](C)(O)C3CC3)nc12 805579883 OKMICURNLCOKHL-INIZCTEOSA-N 349.343 0.816 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N(C)[C@@H](C)CN)C2)cc1 818675811 HGAFQFYTNQEFMM-UONOGXRCSA-N 348.447 0.443 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@H]3CCOC3)C2)cc1 824934747 GDHZUQZSFOFPJO-KGLIPLIRSA-N 347.415 0.543 10 20 ECCD CN(C)c1ccc(CNC(=O)N2C[C@H]3C(=O)NC(=O)[C@H]3C2)cc1F 838030796 YYKZXBJXJMFRNJ-PHIMTYICSA-N 334.351 0.306 10 20 ECCD NS(=O)(=O)[C@@H]1CCN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])C1 739191951 JOBNSGJFTNCRLE-WUWIAWFRSA-N 341.345 0.560 10 20 ECCD Nc1ccc(CCNC(=O)[C@@H]2CC[C@H](CN3CCOCC3)O2)cc1 911783509 VSVGTIOVVPFCEH-SJORKVTESA-N 333.432 0.807 10 20 ECCD COC[C@H]1COCCN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 910894175 JEBPKQCKPMJFSU-INIZCTEOSA-N 349.431 0.585 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H]3CN)CC2)cc1 923292299 HIQCVEIIAUPEOE-QZTJIDSGSA-N 348.491 0.601 10 20 ECCD CONC(=O)CNC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 927212180 UVFVNMHDOXDZGF-UHFFFAOYSA-N 340.355 0.344 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CN(C(=O)C3CC3)C[C@H]2O)cc1 1024287109 GMPLVXHBNAWHJT-CHWSQXEVSA-N 345.359 0.561 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@@H](O)C3)cc2)C1 874111196 DVRBVLJGFIDUNJ-FMKPAKJESA-N 331.416 0.775 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC(N2CCCC2=O)C1 1262538784 NCRMPOBHUGCIJT-UHFFFAOYSA-N 331.372 0.184 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@]12CNC[C@H]1CCO2 1548549526 SPDCJFWITRRYCN-KDOFPFPSSA-N 349.406 0.657 10 20 ECCD O=C(Cc1ccc(-c2nn[nH]n2)nc1)NCc1ccc(O)cc1O 1592914293 UZEJINNUXHMMBT-UHFFFAOYSA-N 326.316 0.532 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2Cc1cc(=O)n(C)c(=O)n1C 175031185 QLMCELSOOCYKKN-UHFFFAOYSA-N 330.388 0.549 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)CN2C(=O)CCC2=O)N(C)C)cc1 38635179 BNPMMMYMVOBPOW-HNNXBMFYSA-N 346.431 0.621 10 20 ECCD COc1ccc(N2CCN(S(=O)(=O)[C@@H]3CCOC3)CC2)cc1 265577292 XPQKGHVYEHMTRL-OAHLLOKOSA-N 326.418 0.936 10 20 ECCD CS(=O)(=O)N1CCC[C@@H](NC(=O)NCc2ccccc2O)C1 263756074 QSAZYTLCDZDXOD-GFCCVEGCSA-N 327.406 0.615 10 20 ECCD CC1(C)[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@H]1O 275236912 KKSDQPCCDBGATR-NWDGAFQWSA-N 328.390 0.653 10 20 ECCD COc1ccc(N2CC[C@H](CNS(=O)(=O)C3COC3)C2)cc1 819888291 UPXRIDYJWVXXON-GFCCVEGCSA-N 326.418 0.840 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1ncn(C)n1 811355927 IRLFMGOHFXAARF-UHFFFAOYSA-N 331.376 0.697 10 20 ECCD C[C@@H](CC(N)=O)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 837715677 UIEGCGSNFUMXES-JTQLQIEISA-N 341.358 0.929 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1C[C@@H]2CNC[C@@H]2C1 842170539 IDIQSAZVSZUNHK-IYBDPMFKSA-N 340.427 0.357 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@H]3CNC[C@H]3C2)cc1 842036751 WRPBARUXAGZCRI-ARFHVFGLSA-N 344.459 0.873 10 20 ECCD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1(CO)CC1 855481975 VHWLYIVVQFMWFL-VIFPVBQESA-N 328.390 0.655 10 20 ECCD COCCOC[C@H](O)CNCc1ccc(N2CCC(O)CC2)cc1 853122576 QMWVOVCLKCZXNN-GOSISDBHSA-N 338.448 0.761 10 20 ECCD COc1ccc(N2CCN(c3nccn4nnnc34)CC2)c(OC)c1 866139308 SLDWVFPULFXTHO-UHFFFAOYSA-N 341.375 0.863 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2CN(CC(=O)N3CCC3)C2)cc1 1031464430 RMZVLFDIBYGIFW-UHFFFAOYSA-N 344.375 0.495 10 20 ECCD CC1(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)COC1 782579579 LNKBCNAVEDARBS-UHFFFAOYSA-N 338.429 0.574 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3CO[C@@H](C)C3)CC2)cc1 1335397912 LCJGEFLMMVQGCC-XYJFISCASA-N 349.475 0.945 10 20 ECCD CC[C@H](C)NC(=O)CCNC(=O)C(=O)N(C)Cc1ccccc1O 1340852451 APQGAWXZFQHIEZ-LBPRGKRZSA-N 335.404 0.772 10 20 ECCD CN1CCN(c2ccc(CN[C@H](CCC(N)=O)C(=O)O)cc2)CC1 1353952565 OBBXLBDIXVTZFJ-OAHLLOKOSA-N 334.420 0.247 10 20 ECCD O=C(Nc1nc(-c2ccncc2)n[nH]1)C1=S=C(c2nn[nH]n2)C=C1 1609571127 QOFSUJPQPNDZPR-UHFFFAOYSA-N 339.344 0.014 10 20 ECCD COC(=O)/C=C/c1ccc(N2C[C@H](O)C[C@H]2C(=O)O)c([N+](=O)[O-])c1 1610175095 HEJSGRGPQOWIQI-CEBVKENUSA-N 336.300 0.805 10 20 ECCD CCn1c(N)c(C(=O)CN(C)Cc2ccccc2O)c(=O)[nH]c1=O 109772408 IUNQMJJHINWRFZ-UHFFFAOYSA-N 332.360 0.159 10 20 ECCD COCCCS(=O)(=O)NCc1ccc(N2CCOCC2)cc1 111332268 GZCCWLIYEVXETL-UHFFFAOYSA-N 328.434 0.979 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)CN1CCS(=O)(=O)CC1 263996639 FKDHWZWAYNNJOS-UHFFFAOYSA-N 340.445 0.861 10 20 ECCD O=C(c1cccc(O)c1O)N1CCC[C@H](N2CCCS2(=O)=O)C1 279628787 XVQNGPJLEDLYTE-NSHDSACASA-N 340.401 0.738 10 20 ECCD CCn1ncnc1CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 807899286 LDVAHJSBYXVBRD-UHFFFAOYSA-N 344.419 0.639 10 20 ECCD COCCONC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 819272823 ILIDEAIDROFNCT-INIZCTEOSA-N 339.436 0.346 10 20 ECCD CNC(=O)NC(=O)CCN(CC(=O)O)Cc1cc(Cl)ccc1O 737543935 XMAOUIOIOBJDKA-UHFFFAOYSA-N 343.767 0.778 10 20 ECCD CN(CC(=O)O)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 739631103 IUMZBHZDPUDGEN-UHFFFAOYSA-N 339.367 0.295 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N[C@H]2CCN3CCCC[C@H]23)cc1 842227219 SQSQHHMONKKAQB-JKSUJKDBSA-N 330.432 0.671 10 20 ECCD Nc1ccc(NC(=O)C(=O)N[C@H]2CCCC[C@@H]2N2CCOCC2)cc1 841072120 HDTYTIQXXGKAOQ-HOTGVXAUSA-N 346.431 0.967 10 20 ECCD C[C@@H](N)[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 842149618 CJLWOIQCGNFGER-CZUORRHYSA-N 344.459 0.881 10 20 ECCD Cn1ncnc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 853797696 AGPIMNURJIBMGH-CYBMUJFWSA-N 342.403 0.447 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NCc3nncn3C)C2)cc(OC)n1 1022367376 CWGRKLOQYKEBHY-TXEJJXNPSA-N 346.391 0.278 10 20 ECCD COC[C@@H]1CCCN1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 862597610 NCNKUCYGCKBNPH-NSHDSACASA-N 343.405 0.519 10 20 ECCD CNS(=O)(=O)c1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1 768914357 NZIJIRAIVJNJDB-UHFFFAOYSA-N 336.369 0.936 10 20 ECCD COc1ccc(CN2CCC[C@H](NS(C)(=O)=O)C2)c(O)c1OC 891620743 KRMWJZSASCHGCZ-LBPRGKRZSA-N 344.433 0.923 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@@H]3COCCN3)cc2)CC1 892291730 ZWNMQPKHZSEVRA-MRXNPFEDSA-N 347.463 0.226 10 20 ECCD Cn1nncc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 798405059 YHRUVJRURNVYDN-ZDUSSCGKSA-N 342.403 0.447 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3nccs3)C2)cc(OC)n1 996369687 YZMJGXLNYSLCSV-UHFFFAOYSA-N 348.384 0.810 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)C3CCOCC3)C2)cc(OC)n1 996367904 HPWGZXQTXNIRJK-UHFFFAOYSA-N 349.387 0.466 10 20 ECCD COc1ccc(CNCCCNC(=O)C[C@@H]2NC(=O)NC2=O)cc1C 1160171877 FGJSQURNHJZTJA-ZDUSSCGKSA-N 348.403 0.198 10 20 ECCD CNS(=O)(=O)CC(=O)NCCCNCc1ccc(OC)c(C)c1 1176343523 XKRRDJNMJYITEY-UHFFFAOYSA-N 343.449 0.149 10 20 ECCD CNC(=O)c1cccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)n1 1321312520 VJDFXMFKYFTZLC-UHFFFAOYSA-N 330.296 0.892 10 20 ECCD Cn1ncc(C2CC2)c1CNC(=O)C(=O)NCCc1ccc(N)cc1 1333542747 MYQBACCWFDCLHX-UHFFFAOYSA-N 341.415 0.855 10 20 ECCD CCN(CCC(=O)NC)C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1356217796 NFASROQFTXCBIM-UHFFFAOYSA-N 348.447 0.696 10 20 ECCD CC[C@H](NC[C@@]1(O)CCN(C)C1)c1cccc(-c2nn[nH]n2)c1O 1604052969 AEHWOHYGQWJSTN-BBRMVZONSA-N 332.408 0.680 10 20 ECCD Cc1ccc(O)c(CNS(=O)(=O)c2cncc(-c3nn[nH]n3)c2)c1 1581209546 LFYDZRMDWKRWOZ-UHFFFAOYSA-N 346.372 0.754 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1C[C@H]2C[C@H](C(=O)O)C[C@@H]12 1598530419 GCJURHGXZLKPEY-RQJABVFESA-N 346.383 0.966 10 20 ECCD CCOc1ccc(N2CCN([C@H]3CCN(CC(=O)O)C3=O)CC2)cc1 1592691680 URQXQWBRQDRAKG-INIZCTEOSA-N 347.415 0.893 10 20 ECCD CN1CCN(c2ccc(CN3CCO[C@@H](C(=O)O)C3)cc2F)CC1 1593787224 VCJBTRSKQHJFDL-MRXNPFEDSA-N 337.395 0.863 10 20 ECCD CCS(=O)(=O)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 41428788 YNMKIIGXTLUOPP-UHFFFAOYSA-N 341.433 0.283 10 20 ECCD C[C@@H](O)C[C@H]1COCCN1CC(=O)NCc1ccc(N(C)C)cc1 299309140 NILRWWYRMOBLRN-PBHICJAKSA-N 335.448 0.841 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)N1CC[C@H](C(=O)O)C1 817110794 NDSVSCCGHZFNKV-VIFPVBQESA-N 343.430 0.675 10 20 ECCD C[C@H]1CN(c2ccc(CNC(=O)[C@H]3CC(=O)N3)cc2F)C[C@@H](C)O1 822688087 KGGSHCDHTMYNIX-UHIISALHSA-N 335.379 0.944 10 20 ECCD Cn1nccc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 727354014 XOUZQMRMTADEQQ-UHFFFAOYSA-N 330.391 0.592 10 20 ECCD COC[C@@](C)(O)CNC(=O)NCc1ccc(N2CCOCC2)cc1 732700684 IRGDNDOGZBNXFZ-KRWDZBQOSA-N 337.420 0.720 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@](C)(CN)C1 842154986 YWZATZZCMXCZGC-SFHVURJKSA-N 332.448 0.875 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H](N)C[C@@H]3C)CC2)cc1 923411262 BMNXISMOEAULMQ-BQFCYCMXSA-N 348.491 0.600 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C[C@H](O)C[C@H]3C)CC2)cc1 761111764 DCDFXKLBVNEBOR-GDBMZVCRSA-N 333.432 0.799 10 20 ECCD CN(C)S(=O)(=O)c1ccc(C(=O)NCc2ccccc2O)cn1 771416456 HEWXVIIFNKUTBT-UHFFFAOYSA-N 335.385 0.968 10 20 ECCD COC[C@@H](O)CNC(=O)NCc1ccc(N2CCN(C)CC2)cc1 889662469 DXWJNPPZDKXCCT-INIZCTEOSA-N 336.436 0.245 10 20 ECCD 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CN(C)c1ccc2c(c1)OCCN2C(=O)Cn1ccc(=O)[nH]c1=O 173194929 HJXLIIKVCIYUEH-UHFFFAOYSA-N 330.344 0.028 10 20 ECCD C[C@@H](NS(C)(=O)=O)C(=O)NCc1ccc(N2CCCC2)cc1 63093368 CTSJXFDXMBRWOG-GFCCVEGCSA-N 325.434 0.841 10 20 ECCD CNC(=O)NC(=O)[C@@H](C)N1CCN(c2ccc(OC)c(F)c2)CC1 84866205 RJEOIFXENAKWJW-LLVKDONJSA-N 338.383 0.800 10 20 ECCD CC(=O)c1cn(CC(=O)N2CCOc3cc(N(C)C)ccc32)nn1 450045509 GOSKGZCBXZSLLJ-UHFFFAOYSA-N 329.360 0.972 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1=NN(CCO)C(=O)CC1 274952587 RUWKKGWZXHFTIH-SNVBAGLBSA-N 335.360 0.116 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1ccnc1-c1nn[nH]n1 825965890 HGOBKJSWMWCJAC-UHFFFAOYSA-N 340.391 0.788 10 20 ECCD COc1ccc(N2CCN(Cn3cnc(C(=O)O)n3)CC2)cc1F 832383833 OOKVEBGAJUFZCY-UHFFFAOYSA-N 335.339 0.904 10 20 ECCD CCC[C@H](O)[C@@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 839814958 AYSXAQFADCCQRT-YPMHNXCESA-N 346.405 0.015 10 20 ECCD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CN1CCNC(=O)C1 915215354 LUGWZJAXXKKLTA-UHFFFAOYSA-N 332.448 0.921 10 20 ECCD 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O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCCNCC1 842214369 QANXNTWXEZNPFG-UHFFFAOYSA-N 330.432 0.725 10 20 ECCD O=C(NCc1cccc(Br)c1O)[C@H]1CCS(=O)(=O)N1 846014346 INSFXZGFQNMAIK-SECBINFHSA-N 349.206 0.463 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)N[C@H]3CCNC3)CC2)cc1 841751033 VKEUMLZXUNFSPU-HNNXBMFYSA-N 347.463 0.478 10 20 ECCD C[C@H]1CN(CC(C)(C)O)CCN1C(=O)C(=O)Nc1ccc(N)cc1 841112315 JVKQHVQAIRYLPO-LBPRGKRZSA-N 334.420 0.511 10 20 ECCD O=C(COC(=O)c1cccc(O)c1O)NCCCN1CCCC1=O 758573604 WBGSRDWBXJVTJZ-UHFFFAOYSA-N 336.344 0.383 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@H](O)C3)cc2)C1 853464875 XJZJVPODVWPESS-DZKIICNBSA-N 346.431 0.711 10 20 ECCD COc1ccc(-n2nnnc2CN2CCO[C@H](CNC(C)=O)C2)cc1 1035262070 PGPQOAVOOPMRQE-OAHLLOKOSA-N 346.391 0.008 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](COC)OC 1118693298 GYNHTWJETZZBDM-SMDDNHRTSA-N 341.360 0.350 10 20 ECCD C[C@@H](NC(=O)NCCN1CCNC(=O)C1)c1ccc(N(C)C)cc1 773613119 PBCKYFUGBHQGFD-CYBMUJFWSA-N 333.436 0.545 10 20 ECCD 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CS(=O)(=O)[C@H]1C[C@]1(CNCc1cc(F)cc(F)c1O)C(=O)O 1599763661 PIVKWKSZOFPEAC-GXFFZTMASA-N 335.328 0.648 10 20 ECCD COCCN1C(=O)/C(=C\NCc2ccc(C)cc2)C(=O)NC1=S 60863158 ASQWQLXBWNUOSW-RAXLEYEMSA-N 333.413 0.858 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCn2cncc2C1 297788658 JFQSYCFNDMXGDH-UHFFFAOYSA-N 341.415 0.950 10 20 ECCD O=C1CNC(=O)c2ccc(C(=O)NCc3ccc(O)c(O)c3)cc2N1 815836119 QPTQYHHQNVCMHE-UHFFFAOYSA-N 341.323 0.710 10 20 ECCD C[C@H](OC(=O)c1cc(O)cs1)C(=O)N1CCC[C@H](C(N)=O)C1 732352997 JVTBJPLEMRNWEY-IUCAKERBSA-N 326.374 0.723 10 20 ECCD C[C@H]1CNCCN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 842170904 NRAHSGXSHKMYRQ-AWEZNQCLSA-N 328.416 0.499 10 20 ECCD C[C@@H](c1ccc(N2CCOCC2)cc1)N1C(=O)N[C@@H]([C@@H](C)O)C1=O 924532539 DSLXAUGMLJGODH-ZOWXZIJZSA-N 333.388 0.885 10 20 ECCD Cn1nnc(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)n1 852283870 CQONPIUWJKGXDG-UHFFFAOYSA-N 345.407 0.171 10 20 ECCD COc1ccc(-n2nnnc2CNC[C@@H]2CCN(C(C)=O)C2)cc1 1026630955 YHDHWJSQHVGXEL-ZDUSSCGKSA-N 330.392 0.629 10 20 ECCD C[C@]1(CCCC(=O)NCCc2ccc(O)c(O)c2)NC(=O)NC1=O 1116404708 MYONXYDIBGBKKE-MRXNPFEDSA-N 335.360 0.525 10 20 ECCD CO[C@@]1(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CCOC1 1117597254 HSZOYPSRTRKHCR-GOSISDBHSA-N 349.431 0.599 10 20 ECCD COC(=O)[C@H](CC(C)C)NC(=O)COC(=O)c1cccc(O)c1O 776282454 RMVTVHOFEWMEIQ-NSHDSACASA-N 339.344 0.959 10 20 ECCD CC[C@H](OC)C(=O)NCCNCc1nnnn1-c1ccc(OC)cc1 1124550275 DLSRAHVYXCWSIL-AWEZNQCLSA-N 348.407 0.302 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCF)CC2)cc1 798060369 LVDFBRKHDBQTRM-VOTSOKGWSA-N 335.379 0.986 10 20 ECCD CCc1cc(N2CC=C(CCNC(=O)CNC(N)=O)CC2)nc(C)n1 1089804434 IHACAGGZGZHHAW-UHFFFAOYSA-N 346.435 0.659 10 20 ECCD COCc1cc(N2CC=C(CCNC(=O)c3cnon3)CC2)ncn1 1089837751 FFYMCVVFMDGBFB-UHFFFAOYSA-N 344.375 0.963 10 20 ECCD COC(=O)CCCNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1327296185 RYAQWPMWDCZBGU-GFCCVEGCSA-N 335.404 0.999 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C1=NO[C@]2(CCNC2)C1 1580713679 HEPRCMWDWITMOU-GOSISDBHSA-N 344.415 0.648 10 20 ECCD Cc1ccc(O)c(CN[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1 178907121 JEKZGNVJAXQVSO-INIZCTEOSA-N 333.432 0.723 10 20 ECCD Cc1cc(C(=O)NCCS(N)(=O)=O)c(C)n1-c1ccc(C#N)cc1 303155046 GAPPAOWAORTKLH-UHFFFAOYSA-N 346.412 0.984 10 20 ECCD COc1ccc(N2CCN(C(=O)CN[C@H]3COC[C@@H]3OC)CC2)cc1 290138729 MNJHNYSPENSGCL-IRXDYDNUSA-N 349.431 0.347 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N(C)CCO)C2)cc1 824980542 DYNQPCOYZWIGHE-CYBMUJFWSA-N 335.404 0.088 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)N3CCNC(=O)C3)C2)cc1 824693871 NPMIRFIGUOCCCY-CYBMUJFWSA-N 332.404 0.663 10 20 ECCD CC(=O)c1cc(CN(C)CC(=O)O)c(O)c(CN2CCOCC2)c1 738586153 PMQXEXZHUBSYQW-UHFFFAOYSA-N 336.388 0.943 10 20 ECCD CS(=O)(=O)N1CCC(NC(=O)NCc2ccccc2O)CC1 748463431 PXHIUURPYBHICQ-UHFFFAOYSA-N 327.406 0.615 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CC[C@@H]1N 842094005 VRENRYIDTSKFOF-QWRGUYRKSA-N 342.490 0.937 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC[C@H]1C(=O)O 868345236 DJQLPFJNMCOFNB-CMPLNLGQSA-N 332.356 0.804 10 20 ECCD COC(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@H]1C 1116976257 PSOSXGHWRCHJQR-WFASDCNBSA-N 347.415 0.779 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCc1nc(C2CC2)no1 1117150326 LXVTXTYXOMHJQP-UHFFFAOYSA-N 330.344 0.927 10 20 ECCD COCCCNC(=O)CN(C)Cc1ccc([N+](=O)[O-])c(OC)c1O 774822256 ZAPIDFMBZQRGAF-UHFFFAOYSA-N 341.364 0.894 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CCC(=O)N3)CC2)c(OC)c1 870162633 LKMBCFSWNRAZDV-CYBMUJFWSA-N 333.388 0.631 10 20 ECCD CSCC(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089804790 UMRFDWCKIDJSLG-UHFFFAOYSA-N 333.421 0.525 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@@H]3[C@@H](CO)[C@@H]3C2)c1 1324289398 HFTDIPQFQNBBHH-GDNZZTSVSA-N 326.374 0.074 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H]3C[C@@]3(CO)C2)c1 1320562623 SAOZRMAWDOSOCB-OTYXRUKQSA-N 326.374 0.218 10 20 ECCD CNCCCC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1842916452 UWQRVGWOBRSDCN-UHFFFAOYSA-N 348.403 0.309 10 20 ECCD C[C@H]1CN2CCN1C[C@H]2C(=O)NCc1ccc2cccnc2c1O 1348747286 RIRDVOUYGDMUOJ-WFASDCNBSA-N 326.400 0.945 10 20 ECCD Cc1ccc(C(=O)NC[C@H]2CCC[C@]23NC(=O)NC3=O)c(O)c1O 272740545 MBHCJOPLMVYJOZ-ABKXIKBNSA-N 333.344 0.514 10 20 ECCD O=C(C[C@@H]1COCCN1)NCc1ccc(N2CCC(CO)CC2)cc1 285688677 AIMFWUXWIVZABC-QGZVFWFLSA-N 347.459 0.890 10 20 ECCD CC(=O)N(C)CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 299232220 HQFWCOHEKONCPE-UHFFFAOYSA-N 337.395 0.881 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](C(=O)O)C2)cc1 817109869 MRDZRCCRGPZVGW-ZDUSSCGKSA-N 333.388 0.692 10 20 ECCD COC[C@H]1NC(=O)N(C[C@H](c2ccc(N(C)C)cc2)N(C)C)C1=O 900185364 KTWNQRYAHQHWQD-HUUCEWRRSA-N 334.420 0.922 10 20 ECCD COc1cccc([C@@H](C)NCCNS(=O)(=O)NC(C)C)c1O 846163457 AOQPEJXJUVVCAV-LLVKDONJSA-N 331.438 0.884 10 20 ECCD CN(Cc1nnc(O)o1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 857295211 NRTYDWRFUKXSPP-UHFFFAOYSA-N 342.333 0.125 10 20 ECCD NC(=O)COc1cccc(NS(=O)(=O)c2cccc3nonc23)c1 765036163 KSDLIPQZMJWNFY-UHFFFAOYSA-N 348.340 0.888 10 20 ECCD O=C(C[C@@H]1CCNC1=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089845303 SMQYVUKKCPELAV-ZDUSSCGKSA-N 347.394 0.785 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@](C)(O)COC 1320519505 GYGHUKXZQRGNBY-MEDUHNTESA-N 341.360 0.086 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CC(=O)N(C2CC2)C1 1322899834 PYISBPCYYFRKPG-GFCCVEGCSA-N 331.372 0.230 10 20 ECCD C[C@@H](O)Cc1cn(CC(=O)N(C)Cc2ccc(N(C)C)cc2)nn1 1333532953 IOPXZGBHDFQLNC-CYBMUJFWSA-N 331.420 0.926 10 20 ECCD CC(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2 1795067037 ZUDZKYJLYVNDQD-JJLQDPRZSA-N 349.387 0.352 10 20 ECCD O=C(CCn1cncn1)NCc1ccc(N2CCOCC2)c(F)c1 55523766 DYIHNGVNTDXYRU-UHFFFAOYSA-N 333.367 0.960 10 20 ECCD COCC(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 128687456 DYVRQEUYTNGCIO-UHFFFAOYSA-N 333.432 0.814 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](O)CC3)nc12 293074632 JEWQKLNLXLMPRR-LBPRGKRZSA-N 334.376 0.958 10 20 ECCD C[C@H](NC(=O)[C@H](C)NCc1ccc(N2CCN(C)CC2)cc1)C(=O)O 901743476 MFPDFCOOQHJXRR-KBPBESRZSA-N 348.447 0.506 10 20 ECCD CN1CCN(c2ccc(CNC[C@H](O)CN3CCCC3)cc2)CC1 905427408 NWNYPRVSMVUGEU-IBGZPJMESA-N 332.492 0.985 10 20 ECCD CCOC(=O)CC1=NN(C2=NS(=O)(=O)c3ccccc32)C(=O)C1 917348342 OKCCOINYPJBEQO-UHFFFAOYSA-N 335.341 0.677 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1CCCNC1 842170945 OWXMDUJKKAWLJW-HNNXBMFYSA-N 328.416 0.547 10 20 ECCD CN(C)S(=O)(=O)CCNC(=O)NCc1cc(Cl)ccc1O 845207414 ALGJOTSXOVYFPW-UHFFFAOYSA-N 335.813 0.736 10 20 ECCD O=C(NCCN1CCCC1=O)NCc1ccc(N2CCOCC2)cc1 844909754 KCQUMYTVTJJHCC-UHFFFAOYSA-N 346.431 0.945 10 20 ECCD CN(C)C(=O)O[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841135540 JDDQKWHURSDTHL-CYBMUJFWSA-N 334.376 0.897 10 20 ECCD O=C(CCn1cc[nH]c(=O)c1=O)NCc1c(O)ccc2c1CCCC2 743717843 SGOMJDFYKWSVBA-UHFFFAOYSA-N 343.383 0.828 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CCNC(=O)C1 761210838 HWANGFLDXNTMEM-CQSZACIVSA-N 347.415 0.780 10 20 ECCD CC(=O)NCc1cn(CC(=O)NCc2ccc(N(C)C)cc2)nn1 881094900 WQACXFUDWMPJNA-UHFFFAOYSA-N 330.392 0.297 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@H]3CC(=O)N(C)C3)CC2)nn1 1089867895 VLKMPZSAMSSTHD-HNNXBMFYSA-N 343.431 0.906 10 20 ECCD CC(=O)O[C@H]1CCN(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)C1 1776209196 FHGOVEFRPGOUQH-JTQLQIEISA-N 344.345 0.385 10 20 ECCD CCN(CC)CC(=O)N1CCN(C(=O)NCc2ccc(N)cc2)CC1 1346738668 JBGQZSGWYIUZRP-UHFFFAOYSA-N 347.463 0.964 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2C(=O)NC3(CCC3)C2=O)cc1 298153600 BSEJTUPQYOJGGX-UHFFFAOYSA-N 330.388 0.843 10 20 ECCD CN(C[C@H](O)C1CC1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803689428 RHMHQKQAFIUNAG-KRWDZBQOSA-N 345.443 0.915 10 20 ECCD C[C@@H](N)[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 817918523 KLMHVNWHCMKZFD-CZUORRHYSA-N 348.447 0.286 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C)N1 817919444 SOCNOBNABZWRKZ-OKILXGFUSA-N 332.448 0.920 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)C(C)(C)CO)nc12 726667335 JVDHQJNVNQLHEL-UHFFFAOYSA-N 337.332 0.673 10 20 ECCD CCS(=O)(=O)CCNCc1ccc(N2CCN(C)CC2)cc1 905425743 AKKNAHRJWNJNMD-UHFFFAOYSA-N 325.478 0.963 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCN([C@@H]3CCNC3)CC2)c1O 843125097 WBVYPIAETRWSGH-CYBMUJFWSA-N 336.392 0.789 10 20 ECCD COc1cccc(CNS(=O)(=O)N(C)C2CCOCC2)c1O 751309064 GEDOUVWJQQHWNR-UHFFFAOYSA-N 330.406 0.846 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ncn(C)n1 768761628 GREAJTQNGJUOFU-UHFFFAOYSA-N 344.419 0.993 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1CCOC(=O)N1 862040162 ZWEJSLMKNSMHCL-LBPRGKRZSA-N 336.344 0.782 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(S(N)(=O)=O)o1 773740077 LAZZZCFJBNRDNV-QMMMGPOBSA-N 340.357 0.699 10 20 ECCD Cc1nc(CC(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)n[nH]1 1089832105 NYWOQCJLLQOCGS-UHFFFAOYSA-N 345.382 0.928 10 20 ECCD CN(Cc1cn(C)nn1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1328650809 FEZZQDWEOIVQHB-UHFFFAOYSA-N 339.377 0.164 10 20 ECCD Nc1ccc(CNC(=O)N2CCN(C(=O)CN3CCCC3)CC2)cc1 1262603827 WOOMTYUNMRMDSX-UHFFFAOYSA-N 345.447 0.718 10 20 ECCD CN(C)c1ccc(CNC(=O)CN[C@]2(CC(=O)O)CCOC2)cc1 1598318386 YKKYOHJLVWTSSS-KRWDZBQOSA-N 335.404 0.592 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCCN(C(N)=O)CC2)cc1 153618050 RCWULBBSXUUVIM-UHFFFAOYSA-N 333.436 0.455 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H](C)N3CCN(C)CC3)CC2)cc1 193146529 OQMWVDAIDWQUPV-MRXNPFEDSA-N 346.475 0.980 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)CN1CCCS1(=O)=O 266319113 GJXBXUCVYFLFIE-UHFFFAOYSA-N 339.417 0.514 10 20 ECCD COCc1nc2n(n1)C[C@H](NC(=O)NCc1ccccc1O)CC2 268143470 UNPQNXAGIHRWGB-GFCCVEGCSA-N 331.376 0.944 10 20 ECCD CC(C)(CCO)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 269661337 IKRLKULJASNDSD-UHFFFAOYSA-N 330.406 0.902 10 20 ECCD COc1ccc(N2CCN(C(=O)C[C@H](CN)OC)CC2)cc1F 278251627 MPTYSOZAUSQQRO-CYBMUJFWSA-N 325.384 0.847 10 20 ECCD COCC(=O)N(C)CC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 819585418 FEDJCHSGISOHRG-AWEZNQCLSA-N 349.431 0.743 10 20 ECCD CNC[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 842149432 ZKDPVOBNKUAJGD-CYBMUJFWSA-N 336.411 0.576 10 20 ECCD C[C@H]1CN[C@H](C)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 842170920 NZZDKORRHXZQIN-CABCVRRESA-N 342.443 0.888 10 20 ECCD CN(C)CCN(C[C@@H]1CCCO1)C(=O)C(=O)Nc1ccc(N)cc1 841025968 RGUVOPSSMRHAOQ-HNNXBMFYSA-N 334.420 0.777 10 20 ECCD CNC[C@@H](C)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 851686262 XNWGEOAICAJHEF-KGLIPLIRSA-N 348.447 0.425 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)Nc3nnn(C)n3)C2)cc1 932256259 USIKFISFVWJKSI-NSHDSACASA-N 331.380 0.867 10 20 ECCD COc1ccc(-n2nnnc2CN2CC[C@@H](N(C)C(C)=O)C2)cc1 1032853790 VGJDGWXKLMPDDJ-CQSZACIVSA-N 330.392 0.724 10 20 ECCD C[C@@H](NC(=O)CN1CCNCC1)c1ccc(N2CCOCC2)cc1 876740102 GTZIWQASYLBPEJ-OAHLLOKOSA-N 332.448 0.606 10 20 ECCD CN1CCO[C@H](C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C1=O 891246420 NRACCCVIIJBQQV-JKSUJKDBSA-N 348.447 0.329 10 20 ECCD CN(CCNC(=O)C(=O)NCCCSc1nccs1)C1CC1 793935700 GAFVJWGXICMZFE-UHFFFAOYSA-N 342.490 0.952 10 20 ECCD NC(=O)[C@@H]1C[C@@H]1C(=O)NCCC1=CCN(c2ncncc2Cl)CC1 1089866370 INCZTSHBHWFBJH-NEPJUHHUSA-N 349.822 0.894 10 20 ECCD CCC(=O)NCC(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089822800 PIXZYNSMIZOHHR-UHFFFAOYSA-N 335.383 0.785 10 20 ECCD CNC(=O)CCn1nnnc1N(C)CCN(C)c1ccc(OC)cc1 1334540616 IDTGXNUCVCCNRJ-UHFFFAOYSA-N 347.423 0.390 10 20 ECCD C[C@H](NS(C)(=O)=O)C(=O)NCc1c(O)ccc2c1CCCC2 75159815 CFXIDXOFRONRMI-JTQLQIEISA-N 326.418 0.825 10 20 ECCD COc1cccc(CNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)c1O 269562844 FZMZHRGDEQHGJK-CYBMUJFWSA-N 344.433 0.981 10 20 ECCD C[C@@H](O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 283376270 YVFMEFVBFWUBFE-DGCLKSJQSA-N 337.395 0.737 10 20 ECCD CCN(C)C(=O)CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 283911907 GSOSQKOWRCWQQQ-UHFFFAOYSA-N 346.431 0.498 10 20 ECCD CC(C)(CNC(=O)NCc1ccc(N2CCOCC2)cc1)C(N)=O 299103564 LWRUTLWABLEVKE-UHFFFAOYSA-N 334.420 0.834 10 20 ECCD COCCOC[C@H](O)CN1CCN(c2ccc(OC)c(F)c2)CC1 296864958 VOXGWSUPWSCCAY-OAHLLOKOSA-N 342.411 0.980 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@](C)(CN)C3)ccc21 842150415 RQLIMGPFICPJGH-LJQANCHMSA-N 344.459 0.883 10 20 ECCD CC[C@H](C(N)=O)N1CC[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1015103435 OLCPSEMIXFNXHV-VXGBXAGGSA-N 336.392 0.167 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)c1nccn2nnnc12 749142764 FEXNGXWKIMQENS-UHFFFAOYSA-N 325.376 0.992 10 20 ECCD CN(CC(=O)NCc1cc(Cl)ccc1O)[C@@H]1CCS(=O)(=O)C1 846474021 QGLXBORYGYNNEQ-GFCCVEGCSA-N 346.836 0.781 10 20 ECCD CS(=O)(=O)NCCNC(=O)NCCCSc1nccs1 759548548 VPAHHISMSZFEBP-UHFFFAOYSA-N 338.480 0.474 10 20 ECCD O=C1[C@H]2C[C@@H](O)CN2C(=O)N1Cc1ccc(N2CCOCC2)c(F)c1 924488615 RPMIMKZLWDDMCL-IUODEOHRSA-N 349.362 0.560 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NCc3nccn3C)C2)cc(OC)n1 1022367946 MUAUOBROKVEJQA-BETUJISGSA-N 345.403 0.883 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(C(=O)c3cnon3)C2)cc(OC)n1 938307840 HAAFDWCHFGMZQY-JTQLQIEISA-N 347.331 0.126 10 20 ECCD CCO[C@H](C)C(=O)NCCNCc1nnnn1-c1ccc(OC)cc1 1123969132 UIHJBTSRJXREPK-GFCCVEGCSA-N 348.407 0.302 10 20 ECCD Cc1cccc(O)c1CN1CCN(S(=O)(=O)c2cc[nH]n2)CC1 894979297 WKZUWRMSTJTZSX-UHFFFAOYSA-N 336.417 0.930 10 20 ECCD Cn1nncc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 798969887 VCIXYHPFSCGUAZ-UHFFFAOYSA-N 329.404 0.954 10 20 ECCD NC(=O)CN1CCN(Cc2cc(Br)cc(F)c2O)CC1 715817695 WAFMEHNJQJRAKS-UHFFFAOYSA-N 346.200 0.897 10 20 ECCD Cc1ccc(O)c(CNS(=O)(=O)N2CCC(C(=O)O)CC2)c1 1607811495 KXWPDMOOIZLDLQ-UHFFFAOYSA-N 328.390 0.832 10 20 ECCD Cc1ccc(CN2C[C@@H](N3C(=O)CNC3=O)C[C@H]2C(=O)O)c(O)c1 1607780671 BMRIMYBQVICGLQ-RYUDHWBXSA-N 333.344 0.280 10 20 ECCD CN(C)c1ccc(CN2C[C@@H](N3C(=O)CNC3=O)C[C@H]2C(=O)O)cc1 1598318229 SMMJVLVGDZSIJN-KBPBESRZSA-N 346.387 0.332 10 20 ECCD CCC(=O)NCC1(NCc2nnnn2-c2ccc(OC)cc2)CC1 1754503978 DLKMZIXQVYETLB-UHFFFAOYSA-N 330.392 0.819 10 20 ECCD CN(CC(=O)NCc1c(O)ccc2c1CCCC2)S(C)(=O)=O 75159741 TVUCWKOGYDDDJS-UHFFFAOYSA-N 326.418 0.779 10 20 ECCD Cc1ccc(C(=O)N2CCN(S(=O)(=O)C3CC3)CC2)c(O)c1O 529722569 DOADMMRDNJIZJK-UHFFFAOYSA-N 340.401 0.656 10 20 ECCD CC[C@@H](C)[C@H](O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 269388115 WSHBFXDOUWWWIS-NOZJJQNGSA-N 330.406 0.901 10 20 ECCD COCc1nc2n(n1)C[C@H](NC(=O)c1ccc(C)c(O)c1O)CC2 364710633 XIZRJUKFQHRBEM-SNVBAGLBSA-N 332.360 0.889 10 20 ECCD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC(=O)N(C)C 275808387 ZHZNJJDYSNZGCB-UHFFFAOYSA-N 348.447 0.694 10 20 ECCD O=C1C[C@H](N[C@@H]2CCc3cccc(O)c32)CN1CCN1CCOCC1 296986366 SCLGMRGAGXSLOM-JKSUJKDBSA-N 345.443 0.902 10 20 ECCD N[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C1CC1 842171969 YKDDMUXNKXFCLY-INIZCTEOSA-N 328.416 0.533 10 20 ECCD C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ncnn1C 1117617247 WGLCDLGMIUBVMX-GFCCVEGCSA-N 344.419 0.717 10 20 ECCD COc1ccc(CNC[C@@H]2CN(C(=O)c3cnn[nH]3)CCO2)cc1C 1051696859 AJGKGJCJJZUNEX-CQSZACIVSA-N 345.403 0.753 10 20 ECCD COc1ccc(N2CCN(C(=O)NCc3nnn(C)n3)CC2)cc1F 787437505 STFRHGLJZIULEH-UHFFFAOYSA-N 349.370 0.390 10 20 ECCD Cc1n[nH]cc1S(=O)(=O)NCc1ccc(N2CCN(C)CC2)cc1 882663855 CTYFOZSIFWISQG-UHFFFAOYSA-N 349.460 0.948 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)c2ccco2)cc1 1122693249 XHOXPQWUSRPDFN-UHFFFAOYSA-N 342.359 0.784 10 20 ECCD COc1ccc(CNC(=O)Nc2ncn(CC(=O)N(C)C)n2)c(O)c1 797630454 GEYHLOYXPDAVJK-UHFFFAOYSA-N 348.363 0.402 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3cnco3)C2)cc(OC)n1 973463624 NPEYQQPMNAUUTO-XYPYZODXSA-N 346.343 0.778 10 20 ECCD COC[C@@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@@H]1CCCO1 1323639899 UXQICOBCMQODTB-HIFRSBDPSA-N 336.388 0.661 10 20 ECCD COC(=O)[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@H]1C(=O)O 1606415183 CFBUBYBLIFVDPX-UQRCUPDISA-N 335.312 0.443 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)C2CN(C3CCOCC3)C2)cc1 1578424678 RIKZNGMKFFQTFJ-SFHVURJKSA-N 346.475 0.979 10 20 ECCD Cn1cnc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)c1 69114791 DHLOINCRSNFRQR-UHFFFAOYSA-N 336.417 0.735 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N(CCO)C2CCC2)cc1F 285717777 MZJNAOHWVYZOGV-UHFFFAOYSA-N 337.395 0.881 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](O)C3CC3)nc12 730884307 YSDVXRYLUDLDLX-GFCCVEGCSA-N 335.316 0.426 10 20 ECCD CC(C)[C@@H](N)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 842191963 PQGYOBYFEAOOHO-INIZCTEOSA-N 348.447 0.239 10 20 ECCD Cc1ccc(C(=O)N2CCC[C@H](NS(C)(=O)=O)C2)c(O)c1O 751533264 MDDXJLBYEPVLGJ-JTQLQIEISA-N 328.390 0.560 10 20 ECCD Cn1cc([C@H](O)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cn1 856213519 PBNIGJDMWNLEPB-KRWDZBQOSA-N 344.415 0.731 10 20 ECCD COC(=O)c1cnn(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 860696887 HMDZXJRXXOTORQ-SNVBAGLBSA-N 333.344 0.828 10 20 ECCD O=C(NCc1ccc(O)c(O)c1)C1=CN2CCS(=O)(=O)N=C2C=C1 768914612 BRMGNJXZNWDDCT-UHFFFAOYSA-N 349.368 0.212 10 20 ECCD CC[C@@H](CNS(C)(=O)=O)NC(=O)/C=C/c1ccc(O)c(O)c1 1117846279 KNDYYNNSCANIAD-ZRQQLDRUSA-N 328.390 0.555 10 20 ECCD CN1CC[C@@H](NC(=O)C(=O)NCCCSc2nccs2)C1=O 1117377229 SKFJCRJVKUYUCY-SECBINFHSA-N 342.446 0.088 10 20 ECCD CN(C)c1ccc(CNC(=O)N(CCO)CCOCCO)cc1 875015593 KKPQNTBNBMJOEG-UHFFFAOYSA-N 325.409 0.265 10 20 ECCD COC(=O)COc1ccc(N(C)CC(=O)N=S(C)(C)=O)cc1 878406834 DQDNXSMTCLOQHC-UHFFFAOYSA-N 328.390 0.929 10 20 ECCD C[C@@H](NC(=O)N1CC[C@H](S(N)(=O)=O)C1)c1ccc(N(C)C)cc1 774972996 GYPAILIFWAIDNS-RISCZKNCSA-N 340.449 0.886 10 20 ECCD CNC(=O)CC(=O)NCCC1=CCN(c2cncc(Cl)n2)CC1 1089822816 PYNAWCDYERBGMI-UHFFFAOYSA-N 337.811 0.909 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN(C)CCNS(C)(=O)=O)c1O 1321020088 QSMFLUSMAQKJGG-UHFFFAOYSA-N 333.366 0.290 10 20 ECCD CCO[C@@H]1C[C@@H](NC(=O)C(=O)NCCc2ccc(N)cc2)[C@@H]1OC 1325414956 ZFYCEMMBJCMOJT-KFWWJZLASA-N 335.404 0.236 10 20 ECCD Nc1ccc(CNC(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)cc1 1338535403 SYMHAQRWTBSYMG-QGZVFWFLSA-N 347.463 0.475 10 20 ECCD CCOc1ccc(N2CCN(C(=O)C3(n4cnnn4)CC3)CC2)cc1 1334348870 PWMCASIFHSQBJJ-UHFFFAOYSA-N 342.403 0.910 10 20 ECCD CC(=O)OC[C@H](C)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1333809853 VBLVGKMJBPKOCD-ZDUSSCGKSA-N 340.445 0.963 10 20 ECCD COC[C@@H](C)NC(=O)C(=O)N(C)CCN(C)c1ccc(OC)cc1 1332793620 MRGWROIAEXSHCD-CYBMUJFWSA-N 337.420 0.741 10 20 ECCD CCOCC(=O)NCCC1=CCN(c2ccnc(C(=O)O)n2)CC1 1605618763 ONYMAEZBHCGBRV-UHFFFAOYSA-N 334.376 0.854 10 20 ECCD O=C(O)COCCOCCNC(=O)NCc1c(O)cccc1F 1606284628 GSFPDJOATZAACJ-UHFFFAOYSA-N 330.312 0.448 10 20 ECCD COC(C)(C)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1841108149 BRRITLCFYQLEOV-UHFFFAOYSA-N 349.387 0.735 10 20 ECCD C[C@H](O)[C@H](NC(=O)C1CC1)C(=O)NCc1ccc(N(C)C)c(F)c1 180993896 OHHLULOIQDZFES-BONVTDFDSA-N 337.395 0.784 10 20 ECCD CC(=O)N[C@@H]1CCCN(C(=O)CN(C)c2ccc3c(c2)OCO3)C1 270382685 WFKYIAPKYBDYJD-CYBMUJFWSA-N 333.388 0.979 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNCCNC(=O)c2ccn[nH]2)c1O 278497227 MUUYBNSMJIOMEI-UHFFFAOYSA-N 335.320 0.552 10 20 ECCD CCN(CC)S(=O)(=O)Nc1ccc(NS(=O)(=O)NC)cc1 282012535 PPUYQWJRAWHRDI-UHFFFAOYSA-N 336.439 0.561 10 20 ECCD CC(=O)C(=O)Cn1c(=O)oc2cc(S(=O)(=O)N(C)C)ccc21 808021273 GQAOCBJYZJBLHW-UHFFFAOYSA-N 326.330 0.003 10 20 ECCD COC(=O)c1cn(CCNC(=O)/C=C\c2ccc(O)c(O)c2)nn1 803644673 OQNJULHPLRAMRI-HYXAFXHYSA-N 332.316 0.306 10 20 ECCD CCN1CCN(C(=O)C(=O)NCCCSc2nccs2)CC1 806275588 MKRGPNFUGHUVPI-UHFFFAOYSA-N 342.490 0.906 10 20 ECCD O=C(NCC(=O)N1CCNCC1)NCc1c(O)ccc2c1CCCC2 841919880 LNABUULQYKRQKN-UHFFFAOYSA-N 346.431 0.502 10 20 ECCD CCOC(=O)[C@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)CC12COC2 840098877 FIVZCBLNVCMSQP-UKRRQHHQSA-N 349.383 0.830 10 20 ECCD C[C@H](NC(=O)C(=O)N1CC[C@@H]2CNC[C@@H]21)c1ccc(N(C)C)cc1 842202521 IPHICCLMERAIAE-BJJXKVORSA-N 330.432 0.750 10 20 ECCD COC(=O)c1ccc(O)c([C@@H](C)NCCC(=O)N2CCN(C)CC2)c1 756536268 UGPRUCVQPQKYIL-CYBMUJFWSA-N 349.431 0.994 10 20 ECCD C[C@@H](C[S@@](C)=O)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 768451415 UOPOLBBHEYVSNY-JLTPVHFHSA-N 348.446 0.603 10 20 ECCD COc1ccc(N2CCN(C(=O)CCCc3nn[nH]n3)CC2)cc1 873778750 IMPUOBQNVJHRKY-UHFFFAOYSA-N 330.392 0.880 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNCC(C)(C)NS(C)(=O)=O)c1O 775030305 QMUOSHGZBBFKHU-UHFFFAOYSA-N 347.393 0.726 10 20 ECCD NCc1ncc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 876730187 FRVPORAZJNFIIJ-UHFFFAOYSA-N 345.378 0.841 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCN3C(=O)NC(=O)[C@H]3C2)c1O 775058692 XCDTUXISFIIGIM-SNVBAGLBSA-N 336.304 0.045 10 20 ECCD Cc1cc(C(=O)Cn2nnn(C)c2=O)c(C)n1-c1ccc(F)cn1 882233182 YWSBQFPHVZEFDK-UHFFFAOYSA-N 330.323 0.801 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)C[C@H]2C[C@@H]2C)cc1 1133357241 VKHYUQCGKOEGMJ-QWHCGFSZSA-N 344.419 0.923 10 20 ECCD CO[C@@H]1CN(CCCO)C[C@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1082389779 HPDHKYKXLYEBDA-ZIAGYGMSSA-N 349.391 0.660 10 20 ECCD NC(=O)[C@@H]1C[C@@H]1C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089866902 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C[C@@H](NC(=O)N[C@@H]1COC[C@@H]1O)c1ccc(N2CCOCC2)cc1 875158517 POOSLFPWYUPXBX-WQVCFCJDSA-N 335.404 0.643 10 20 ECCD C[C@@H](NC(=O)C(=O)NCCC(=O)N(C)C)c1ccc(N(C)C)cc1 1117077950 JSUHZPSLQDSNJQ-GFCCVEGCSA-N 334.420 0.524 10 20 ECCD CN(C)C(=O)CN1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1044352414 HJGVBIAQMJWNIW-UHFFFAOYSA-N 346.391 0.693 10 20 ECCD COCCN(C)C(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 898328958 HRVGRPFGOAKVAH-UHFFFAOYSA-N 348.447 0.159 10 20 ECCD COc1ccc(CNC(=O)C(=O)Nc2c3c(nn2C)CCC3)c(O)c1 797389969 HSFHMROXKSLORH-UHFFFAOYSA-N 344.371 0.878 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCN(CCCO)C[C@@H]2O)cc1 1090831849 WINOZGHSUOCWPC-KGLIPLIRSA-N 349.391 0.396 10 20 ECCD NC(=O)CSCC(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1610637106 XRQFWHOPISKGJC-UHFFFAOYSA-N 346.792 0.677 10 20 ECCD NC(=O)C[C@@H](NCc1ccc(N2CCOCC2)c(F)c1)C(=O)O 1777567549 JIDZXROPXSIXFI-GFCCVEGCSA-N 325.340 0.081 10 20 ECCD CNC(=O)NC(=O)[C@H](C)N(C)Cc1ccc(N2CCOCC2)cc1 16386996 UINXQCPCTZBYRW-ZDUSSCGKSA-N 334.420 0.799 10 20 ECCD C[C@H](CO[C@H]1CCOC1)NC(=O)C(=O)N(C)Cc1ccccc1O 1346879464 ZOTNXJIDXAIWIX-OCCSQVGLSA-N 336.388 0.661 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN(C)CC(=O)N2CCOCC2)c1O 278229475 MNGMNHQARCORST-UHFFFAOYSA-N 339.348 0.600 10 20 ECCD NC(=O)[C@@H]1C[C@@H](F)CN1C(=O)/C=C/c1ccc(N2CCOCC2)cc1 284827803 AZTJYFMHSWRCPK-JIVAZCRISA-N 347.390 0.961 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCN(C)C3)CC2)cc1 729921680 SBVPMKMLGLZFMY-INIZCTEOSA-N 346.475 0.885 10 20 ECCD C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@H]1C(=O)O 828385185 GPDMEURVAWMXCD-LDYMZIIASA-N 342.373 0.556 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)C2(C(=O)NC3CC3)CC2)cc1 832280668 PWBITSTVTHTKLV-HNNXBMFYSA-N 330.432 0.927 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C[C@H](C)N1 842147515 FXGOEYYIMCAJJY-RYUDHWBXSA-N 336.411 0.717 10 20 ECCD C[C@H](N)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 842170473 GULIBYXKDUFVGB-HOCLYGCPSA-N 342.443 0.875 10 20 ECCD O=S(=O)(NCc1ccccc1O)c1cnc2nc(O)nc(O)c2c1 751151930 YFKXACULGMYMGF-UHFFFAOYSA-N 348.340 0.620 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N(C)C[C@@H](C)N)C2)cc1 861782553 DXFOCPUGDFAYEX-ZIAGYGMSSA-N 348.447 0.443 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)NC[C@H]3COCCN3)C2)cc1 861647150 CDNYYSWRIAQEFE-GJZGRUSLSA-N 348.447 0.809 10 20 ECCD O=C1NN(c2ccccc2)C(=O)/C1=C/c1cn(C[C@H]2CCCO2)nn1 865219421 XLYWTMUZRRPOIC-UWZYDCLUSA-N 339.355 0.919 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(C(=O)c3cnco3)C2)cc(OC)n1 938311860 XLDBKNWUCYUTHB-NSHDSACASA-N 346.343 0.731 10 20 ECCD CNC(=O)C[C@@H](C)NC(=O)NCc1ccc(N2CCN(C)CC2)cc1 883730031 HFVULHJHCIDGMG-CQSZACIVSA-N 347.463 0.762 10 20 ECCD COC(=O)[C@@H]1CN(C)CCN(Cc2ccc(OC)c(OC)c2O)C1 894896159 JFXSQWJTOUMHOF-CYBMUJFWSA-N 338.404 0.946 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)Cn3nccn3)CC2)ncn1 1089843773 NSGWOVQYESPIKX-UHFFFAOYSA-N 327.392 0.720 10 20 ECCD C[C@@H](NC(=O)C(=O)NCC(=O)N1CCCC1)c1ccc(N(C)C)cc1 1323177695 CYFXWIZUDBDZHV-CYBMUJFWSA-N 346.431 0.668 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@H]3CC(=O)N3)cc2)CC1 1334389645 LCIGMCFBSUJGTE-HNNXBMFYSA-N 344.415 0.250 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(C)c1N 1342917138 TVQIJWPCRXCGAY-NSHDSACASA-N 348.359 0.318 10 20 ECCD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cn(C)nn1 1350635921 ITDXARSICQIDID-ZDUSSCGKSA-N 349.460 0.901 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)C2=NOC3(CNC3)C2)N(C)C)cc1 1578424508 JOGUCYDIPHJPJZ-INIZCTEOSA-N 345.447 0.590 10 20 ECCD CN(CCNS(C)(=O)=O)Cc1ccc(N2CCOCC2)cc1 107367573 SETIYNWSUGUFQZ-UHFFFAOYSA-N 327.450 0.504 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNC[C@@H](O)CN2CCCC2)c1O 278627311 GJWPJVBLXZFWBF-GFCCVEGCSA-N 325.365 0.855 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@]1(F)CCNC1 377149978 CWQKQVJGILIBPK-MRXNPFEDSA-N 325.359 0.980 10 20 ECCD C[C@H](NC(=O)C(=O)N1CC(=O)N(C)C[C@@H]1C)c1ccc(N(C)C)cc1 807675405 XEOBTTNTBVBXGB-STQMWFEESA-N 346.431 0.619 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)NCCS(=O)(=O)N(C)C 290973727 OSUIOFNOEWYTGK-UHFFFAOYSA-N 342.465 0.785 10 20 ECCD O=C(O)CN(CCN1C(=O)CNC1=O)Cc1cc(Cl)ccc1O 739785633 QOAYHXXRMBSQGZ-UHFFFAOYSA-N 341.751 0.484 10 20 ECCD CN(C)c1ccc([C@H](N)CNS(=O)(=O)CC2CCNCC2)cc1 905341559 AAZXXYFFZHNZDM-MRXNPFEDSA-N 340.493 0.671 10 20 ECCD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCNC2)cc1 842225292 HYYOXJLPUVEYKL-OAHLLOKOSA-N 332.448 0.969 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1(S(N)(=O)=O)CC1 846260076 FSMDNOAOHKAYSE-LBPRGKRZSA-N 339.461 0.929 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H]2CNC[C@@H]2C1 842152692 HXCAFCUUYAMROS-GASCZTMLSA-N 330.432 0.355 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H](C)NC[C@H]1C 842155022 ZNQAJEMDVWWWSH-ZIAGYGMSSA-N 332.448 0.886 10 20 ECCD NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1 748568700 APMBCCDCNSZUHM-UHFFFAOYSA-N 349.368 0.295 10 20 ECCD C[C@H](N)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 842147077 AAXTXCXPXVHDGW-WCQYABFASA-N 336.411 0.704 10 20 ECCD CO[C@H]1CS(=O)(=O)C[C@H]1NC(=O)NCc1ccc(N(C)C)cc1 853244866 QKFWFJXJDDWYLZ-KGLIPLIRSA-N 341.433 0.364 10 20 ECCD NC(=O)[C@@H]1CC[C@H](C(=O)NCc2cccc(Br)c2O)O1 861332414 ADDZYVFMDNVBHD-VHSXEESVSA-N 343.177 0.804 10 20 ECCD C[C@@H](OC(=O)c1cccc(O)c1O)C(=O)Nc1ncnc2[nH]cnc12 776280445 QMMFUXHFNDQUHH-SSDOTTSWSA-N 343.299 0.948 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(CC(N)=O)[C@H](C)C2)cc(OC)n1 947496417 AQDIKZYAKSUKHP-PWSUYJOCSA-N 336.392 0.167 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H](C)O)CC2)cc1 778238316 NDPOBFZGSNPQHW-HSBSLETESA-N 347.415 0.397 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)C2=CCCC2)cc1 1125637876 KLPJZTKVLSALLW-UHFFFAOYSA-N 342.403 0.987 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)CS(C)(=O)=O)N(C)C)cc1 891254799 JVBYOPKOASXGAX-AWEZNQCLSA-N 327.450 0.516 10 20 ECCD O=C(NCCNS(=O)(=O)c1cccnc1)c1cccc(O)c1O 790900203 VQTKCZIXEYDGPV-UHFFFAOYSA-N 337.357 0.201 10 20 ECCD CCO[C@@H](C)C(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089810610 UKFWFGYIBHZHNI-LBPRGKRZSA-N 345.407 0.587 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(C)=NO1 1330782730 NFLWYTUSSJCOND-SMDDNHRTSA-N 336.344 0.853 10 20 ECCD O=C(O)c1cc(O)ccc1NS(=O)(=O)c1cnn2c1OCCC2 1602287796 CLWUSMMXRVUUIQ-UHFFFAOYSA-N 339.329 0.870 10 20 ECCD CCNC(=O)CC[C@H](NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776878367 OIPJPLZMBIRZJJ-NSHDSACASA-N 325.321 0.760 10 20 ECCD CCNC(=O)[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1 54786206 LEYIOGKKYOWYJA-ZDUSSCGKSA-N 334.420 0.847 10 20 ECCD COC(=O)CN(CCN1CCOCC1)C(=O)c1cccc(O)c1O 279264921 JTGCEQCJYBWNJS-UHFFFAOYSA-N 338.360 0.045 10 20 ECCD Cc1cc(C(=O)NCCCS(N)(=O)=O)c(C)n1-c1ccccn1 298974953 MRKYFFJINVONGK-UHFFFAOYSA-N 336.417 0.898 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCc2cccnn2)cc1F 803664297 JWQUJGGWHKZMGE-UHFFFAOYSA-N 331.351 0.614 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H](C)O[C@H](CO)C1 807096031 RNLUXVQLZBSARB-BBRMVZONSA-N 349.431 0.285 10 20 ECCD CNS(=O)(=O)C[C@H]1CCCN1C(=O)c1c(F)ccc(O)c1O 826700854 NMDXCBFSFIAARV-MRVPVSSYSA-N 332.353 0.391 10 20 ECCD CNS(=O)(=O)c1ccc(C(=O)NCc2cc(OC)ccc2O)o1 734016380 NQPQZQPSYXEEPB-UHFFFAOYSA-N 340.357 0.832 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@](C)(CN)C2)cc1F 842147894 IIHHJLFXJMSWGA-KRWDZBQOSA-N 336.411 0.705 10 20 ECCD Cc1nn(C)cc1S(=O)(=O)NC[C@H](N)c1ccc(N(C)C)cc1 842786399 ZNHNSNNMKFCXNY-AWEZNQCLSA-N 337.449 0.773 10 20 ECCD COCCN(CCOC)S(=O)(=O)NCc1cc(OC)ccc1O 751415750 WODKLINHNXAPMN-UHFFFAOYSA-N 348.421 0.330 10 20 ECCD CC(=O)OC1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 1116975632 ALLGODYBPQIEMH-UHFFFAOYSA-N 347.415 0.923 10 20 ECCD C[C@H](NC(=O)N(CCO)CCOCCO)c1ccc(N(C)C)cc1 875507105 AQBNQOGNUUFBDD-AWEZNQCLSA-N 339.436 0.826 10 20 ECCD CNC(=O)[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2C)CCO1 781940546 NCKSJIYBRUTGJW-OAHLLOKOSA-N 334.420 0.717 10 20 ECCD COC(=O)[C@H]1[C@@H](O)CCCN1Cc1ccc(OC)c(OC)c1O 893868946 XRSUNPRANNQLHG-WCQYABFASA-N 325.361 0.908 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCCCC(=O)NC1CC1 1321724769 ZFPYYVPTIRKQEP-UHFFFAOYSA-N 333.388 0.526 10 20 ECCD CN1CCN(c2ccc(CNC(=O)COC3CCNCC3)cc2)CC1 1353147988 VVAPEGNKBVGZHE-UHFFFAOYSA-N 346.475 0.823 10 20 ECCD CC(C)C(=O)NCCC1=CCN(c2nccnc2-c2nn[nH]n2)CC1 1603196469 HRNJALAJXZVHTQ-UHFFFAOYSA-N 342.407 0.956 10 20 ECCD CC(=O)NCC(=O)NCC(=O)NCc1c(C)c2ccccc2n1C 352124293 XHWYPRHYHZXXHR-UHFFFAOYSA-N 330.388 0.355 10 20 ECCD CN(C)c1ccc(CNC(=O)C(F)(F)C(=O)N2CCOCC2)cc1 296228009 QIAVFLBAHOWLFJ-UHFFFAOYSA-N 341.358 0.863 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1CN(C)CCO1 819695994 HHRHQTCUUCDCAU-HNNXBMFYSA-N 336.388 0.615 10 20 ECCD CCN(CC)c1ccc(CNC(=O)NC[C@H](O)Cn2ccnn2)cc1 837724768 IWSAJBZYAPDJAN-INIZCTEOSA-N 346.435 0.985 10 20 ECCD COCCOCCOCCS(=O)(=O)Nc1ccc(O)cc1F 844661029 WWQZWXASJLJNOG-UHFFFAOYSA-N 337.369 0.953 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNCCCCO)CC2)cc1 843061032 DTVDMLHPTHFHSB-KRWDZBQOSA-N 337.464 0.540 10 20 ECCD CN(C)c1ccc(CNC(=O)NCC(=O)N2CCNCC2)cc1F 841761601 PMRUHIBKHWFDKS-UHFFFAOYSA-N 337.399 0.123 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3C[C@@H]4C[C@H]3CN4)CC2)cc1 923409616 CASOKQYVIQNPTI-RYQLBKOJSA-N 346.475 0.224 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CCO[C@@H]3CN)CC2)cc1F 852871701 AXXNLUBZSBBPSY-XJKSGUPXSA-N 337.395 0.847 10 20 ECCD O=C1CC[C@@H](C(=O)NCCC2=CCN(c3nccnc3F)CC2)N1 1089835054 QSTXRLFRWCZDAQ-LBPRGKRZSA-N 333.367 0.537 10 20 ECCD C[C@H]1CN(c2ccc(CNC(=O)C[C@H](O)CN)cc2F)C[C@@H](C)O1 1341570681 IMBZSEHKDWGTAG-SCRDCRAPSA-N 339.411 0.765 10 20 ECCD C[C@H]1[C@H](C(=O)O)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1594158706 LIDNVYFUVLZANI-WCBMZHEXSA-N 342.373 0.699 10 20 ECCD CCS(=O)(=O)CCN[C@@H](C)c1cccc(-c2nn[nH]n2)c1O 1590846569 MXRXSTOKNFLFHF-VIFPVBQESA-N 325.394 0.658 10 20 ECCD CCC(=O)NCC1(O)CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1041061062 ZCLJYCBTPOYRJF-UHFFFAOYSA-N 333.348 0.562 10 20 ECCD CC(=O)N[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 817274482 LUQLITJROLYGST-CQSZACIVSA-N 332.404 0.106 10 20 ECCD C[C@H](N)[C@H](C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 827468989 ITBZEAAWPDNQLV-KCQAQPDRSA-N 332.448 0.988 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)[C@@]23CCC(=O)N2CCS3)cc1 843298804 QBSKHQUUMBQKOM-YOEHRIQHSA-N 348.472 0.934 10 20 ECCD COC1(C)CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1117453324 XAPOTACBRNEMLX-UHFFFAOYSA-N 329.400 0.926 10 20 ECCD COCc1nc(C(=O)NCc2ccc(N3CCOCC3)cc2)no1 775376984 DYLWHIVYKBQVBT-UHFFFAOYSA-N 332.360 0.983 10 20 ECCD CN(Cc1ccccc1O)C(=O)NCC[C@H]1CNCCS1(=O)=O 1120646012 GGEGQXUFDJWEHE-ZDUSSCGKSA-N 341.433 0.310 10 20 ECCD COc1ccc(CN[C@@H]2CCN(C(=O)[C@H]3C[C@H]3C(N)=O)C2)cc1C 969978281 SPFNKFBBMJUWKR-KFWWJZLASA-N 331.416 0.816 10 20 ECCD Cc1ccc(C(=O)N2CCC(NS(C)(=O)=O)CC2)c(O)c1O 780861303 KDYOHZQKLQWHHR-UHFFFAOYSA-N 328.390 0.560 10 20 ECCD CC(C)OCC(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089810914 ZZLDHVFTIISIJW-UHFFFAOYSA-N 345.407 0.587 10 20 ECCD C[C@H](NC(=O)C(=O)N[C@H](C)c1ncnn1C)c1ccc(N(C)C)cc1 1323196544 JDBZFKSZBWVPFK-NWDGAFQWSA-N 344.419 0.936 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H](C2OCCO2)C1 1334927675 ZERKMERHVUEYBD-ZDUSSCGKSA-N 334.372 0.572 10 20 ECCD COCCNC(=O)C1CCN(C(=O)NCc2ccc(N)cc2)CC1 1353539035 HQSGISANSDCKLH-UHFFFAOYSA-N 334.420 0.953 10 20 ECCD CN1C(=O)/C(=C\c2cn(CC(=O)O)nn2)c2cc([N+](=O)[O-])ccc21 1777085633 LCBPISFVNPAAHU-WCIBSUBMSA-N 329.272 0.788 10 20 ECCD CN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1ccc(N(C)C)cc1 194704957 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VBDMCUUWHNWEHJ-RHSMWYFYSA-N 335.448 0.793 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@H](OC)C3)nc12 878970319 NMCWCPKOBLEBBZ-CYBMUJFWSA-N 336.348 0.416 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H](CO)OC(C)(C)C1 1117999293 RECSWSJLUYVESP-CYBMUJFWSA-N 336.388 0.349 10 20 ECCD C[C@@H](C(=O)N(C)CC(=O)NCc1ccc(O)c(O)c1)n1cccn1 778922981 MWVGPWXNHPQGLK-NSHDSACASA-N 332.360 0.630 10 20 ECCD COc1ccc(CNC(=O)[C@@](C)(O)Cn2c(C)cccc2=O)c(O)c1 794381006 HNOCURYZCZKVQK-SFHVURJKSA-N 346.383 0.938 10 20 ECCD O=C(NCCC1=CCN(c2ccc3nnnn3n2)CC1)[C@@H]1CCCO1 1089800053 UEVHEZRQSQLLES-ZDUSSCGKSA-N 343.391 0.341 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)C[C@@]2(CCOC2)O1 1326912413 UTWBKSPBUBJUEX-SCLBCKFNSA-N 348.399 0.757 10 20 ECCD CNC[C@@H](C)CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1326150065 AASUKKZWIXOQKM-CYBMUJFWSA-N 332.448 0.657 10 20 ECCD O=C(O)c1cnn2c(O)cc(CN3CCOC[C@H]3[C@@H]3CCCO3)nc12 1326511090 XTTDPQVPTDASBV-STQMWFEESA-N 348.359 0.513 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@](F)(CO)C1 1346590459 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0.803 10 20 ECCD COc1cc(C(=O)N[C@@H](C)C[C@@H](C)NCCCO)cc(OC)n1 1134872529 LKZVSZJNPGAXMU-NEPJUHHUSA-N 325.409 0.968 10 20 ECCD COc1cccc(CNC(=O)C(=O)Nc2cncnc2OC)c1O 782809535 WFHDMULFLALXTG-UHFFFAOYSA-N 332.316 0.454 10 20 ECCD COc1ccc(-n2nnnc2CN2C[C@@H](NC(C)=O)[C@H](OC)C2)cc1 1081240046 HYWZAFICGCXXQO-HUUCEWRRSA-N 346.391 0.006 10 20 ECCD CCN(CC)C(=O)CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 1329865804 DHRSVZOHYOQGAL-UHFFFAOYSA-N 334.420 0.353 10 20 ECCD N[C@H]1C[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 1333957975 DUDAVLKVBSZKRL-GASCZTMLSA-N 330.432 0.757 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@](F)(CO)C2)cc1F 1345504666 BJHNHWSSELFHJX-MRXNPFEDSA-N 341.358 0.441 10 20 ECCD Nc1ccc(CN2CC[C@H]3[C@H](C2)NC(=O)N3C2CCNCC2)cc1 1356082740 DUZRFZDBNXLVPP-IRXDYDNUSA-N 329.448 0.989 10 20 ECCD C[C@H](NC[C@]1(OCCO)CCOC1)c1cccc(-c2nn[nH]n2)c1O 1603657388 NNJRIXPVISBOPU-MEDUHNTESA-N 349.391 0.391 10 20 ECCD NC[C@@H]1CC(C(=O)N(CC(=O)O)Cc2cc(Cl)ccc2O)=NO1 1601186773 XELQFGXAJMOBIL-JTQLQIEISA-N 341.751 0.562 10 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O=C1CN(Cc2ccccc2O)C(=O)N1[C@H]1CCCS(=O)(=O)C1 819168834 WKMQJXYBDZOKJB-LBPRGKRZSA-N 338.385 0.734 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)Cn1cccnc1=O 819693940 WJYLENCDTPTNFS-UHFFFAOYSA-N 345.355 0.541 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N[C@@H]3CCOC3)C2)cc1 824934748 GDHZUQZSFOFPJO-UONOGXRCSA-N 347.415 0.543 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1CCNC[C@@H]1C 842070361 NUXLUCAOUVXLTL-GJZGRUSLSA-N 346.475 0.929 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N(C)C[C@H](C)N)cc1 863769336 BSYLVCHXZVJYIE-ZDUSSCGKSA-N 336.436 0.395 10 20 ECCD CNC(=O)[C@H]1CCC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785432402 BKZAWMASYLZUJX-LSDHHAIUSA-N 346.431 0.400 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)C3=COCCC3)C2)cc(OC)n1 996369375 VECKQIDIPOPYSY-UHFFFAOYSA-N 347.371 0.734 10 20 ECCD CCOc1cc(N2CC=C(CCNC(=O)CC(N)=O)CC2)nc(C)n1 1089821880 AKYQWZFWSRRZAT-UHFFFAOYSA-N 347.419 0.702 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(C)(CO)CC2)cc1 1322920812 UIIVFGNZYFDSKD-UHFFFAOYSA-N 333.432 0.990 10 20 ECCD CCN(CCO)CCNCc1ccc(N2CCN(C)CC2)c(F)c1 1342727832 KXVSEDXNEPTWKG-UHFFFAOYSA-N 338.471 0.981 10 20 ECCD COc1ccc(CNCCN(CCO)C(=O)[C@@H]2CCN(C)C2)cc1C 1754897299 LNDVJUNXYGAJJG-QGZVFWFLSA-N 349.475 0.866 10 20 ECCD CNS(=O)(=O)CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 267725581 VSWYZYSZKOPBRZ-UHFFFAOYSA-N 341.433 0.031 10 20 ECCD COCCn1cc(/C=C2/SC(=S)N(CC(=O)O)C2=O)cn1 266277519 IIUBHYZUIDDDRJ-RUDMXATFSA-N 327.387 0.815 10 20 ECCD Cc1ccc(C(=O)NC[C@@H]2CCC[C@]23NC(=O)NC3=O)c(O)c1O 272740546 MBHCJOPLMVYJOZ-FVMDXXJSSA-N 333.344 0.514 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@](C)(C(N)=O)C1 297759254 HKZAMNFREWXUIU-SFHVURJKSA-N 346.431 0.435 10 20 ECCD COC(=O)[C@@H]1CN(CN2CCN(c3ccc(OC)cc3)CC2)C(=O)O1 839949214 LNRYNGLNTMQLJY-HNNXBMFYSA-N 349.387 0.769 10 20 ECCD CNC(=O)NC1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 839665801 JUHJGJLGJWJBKC-UHFFFAOYSA-N 347.463 0.762 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@@H]3CCOC(=O)N3)cc2)CC1 918847368 ZZPRLJQOTVIPCV-HNNXBMFYSA-N 332.404 0.553 10 20 ECCD C[C@@H](N)C[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 843260500 WZNMSNFIKGTEPH-ZIAGYGMSSA-N 348.447 0.381 10 20 ECCD COc1ccc(CNC(=O)CCCCCS(N)(=O)=O)c(O)c1 846060649 GITVMWJXUKTEQW-UHFFFAOYSA-N 330.406 0.866 10 20 ECCD COCCn1nc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1=O 753644983 QRCFVEGZPBXTBU-NSHDSACASA-N 347.371 0.662 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N(C)C[C@@H](C)N)cc1 863769335 BSYLVCHXZVJYIE-CYBMUJFWSA-N 336.436 0.395 10 20 ECCD CCOCC(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 777045449 QAHGALIBHYCJBC-UHFFFAOYSA-N 331.346 0.526 10 20 ECCD CC(=O)N1CC2(C[C@H](NC(=O)c3ccc(N=NC(N)=O)cc3)CO2)C1 965733962 NXWFOJNEPXVDTH-ZDUSSCGKSA-N 345.359 0.969 10 20 ECCD O=C1N[C@@H](C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)CO1 1089829476 PEFCSXFRMRKNEP-LLVKDONJSA-N 335.339 0.367 10 20 ECCD O=C(NCCC1=CCN(c2nccn3nnnc23)CC1)c1cnco1 1089851501 SEZRHRRTCOWBQY-UHFFFAOYSA-N 340.347 0.464 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCCOC[C@H]1CCOC1 1322549493 CRRNTQYWJXKYOO-ZDUSSCGKSA-N 336.388 0.520 10 20 ECCD Cn1cc(/C=C2/SC(NC3CCCCC3)=NC2=O)c(=O)n(C)c1=O 192789769 YJKHBJPMEZAXRW-XYOKQWHBSA-N 348.428 0.977 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)Nc2cccn(C)c2=O)cc1F 86450930 HLAKKEXXXOAMGA-UHFFFAOYSA-N 346.362 0.845 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)NC(N)=O 274919913 SWFUSQKJHAHCEQ-QMMMGPOBSA-N 343.767 0.604 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCC(C)(C)O)cc1F 285667980 IFAMTIRKJWWWQT-UHFFFAOYSA-N 325.384 0.785 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)c1cnn(C[C@@H](O)CO)c1 821842853 OMNMFLZXBQJIQJ-QGZVFWFLSA-N 344.415 0.767 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H](CN)C3CC3)ccc21 842149789 FOHMHNSDIQNVBK-HNNXBMFYSA-N 330.432 0.539 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN([C@@H]3CCN(C)C3=O)C2)cc(OC)n1 1015104139 QMAPTSDROCIOHN-QWHCGFSZSA-N 348.403 0.134 10 20 ECCD Cn1cc(N2CCN(C(=O)NCCc3ccc(N)cc3)CC2=O)cn1 841959540 YHHKIIRHXXWKHP-UHFFFAOYSA-N 342.403 0.603 10 20 ECCD COc1ccc(N2CCN(C(=O)C(C)(C)C(N)=O)CC2)c(OC)c1 870167145 BXCJHJSLYIOSBS-UHFFFAOYSA-N 335.404 0.864 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC(=O)N1CCCC1 1117433415 FXAVVUWKORVVEE-UHFFFAOYSA-N 346.431 0.416 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CC[C@@H]3C(N)=O)CC2)c(OC)c1 870165754 MAZLCJGAZISLBP-KBPBESRZSA-N 347.415 0.864 10 20 ECCD O=C1NC(=O)N2CCN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)C[C@@H]12 779433080 PLDZLLXKFAJUGK-JTQLQIEISA-N 340.723 0.690 10 20 ECCD O=C(NC[C@@H](O)COc1ccc2c(c1)OCO2)c1cccc(O)c1O 790579585 KOQPQNAGOHAGDL-SNVBAGLBSA-N 347.323 0.996 10 20 ECCD CCn1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)nn1 1327989397 OTMUAFPKFUXETO-UHFFFAOYSA-N 348.382 0.436 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCCC(=O)NC2CC2)cc1 1340246880 CYQBPYHANQCTKZ-UHFFFAOYSA-N 346.431 0.544 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@]1(C)CCC(=O)N1 1348750366 XSAPSBVWYFJURL-SFHVURJKSA-N 346.431 0.462 10 20 ECCD COCCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847475441 WHDBBRPLBFVVPQ-STQMWFEESA-N 349.387 0.735 10 20 ECCD COC1CCN(S(=O)(=O)Nc2cc(F)c(O)cc2C(=O)O)CC1 1599124156 NLSBIIAUKHRDJU-UHFFFAOYSA-N 348.352 0.997 10 20 ECCD Cc1nc(O)nc(O)c1S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 1777411957 TZKHPHPGSAAXIP-UHFFFAOYSA-N 341.301 0.401 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CC[C@H](O)C2)c1 276829650 FLIDCSKDHGROQU-KOLCDFICSA-N 328.390 0.655 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN[C@@](C)(C(N)=O)C(C)C)nc12 289413939 TYPYIAKTIWGIMP-MRXNPFEDSA-N 349.391 0.601 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](O)c1cnn(C)c1 819698784 RYAQYDRBUMCIOZ-INIZCTEOSA-N 347.371 0.751 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H]2NCC[C@@H]2C1 817917318 AXNAOCMSQTYWAO-WBVHZDCISA-N 344.459 0.921 10 20 ECCD C[C@H]1C[C@H](CN)CN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 817991259 OFIGJRUCCWDLIM-DZGCQCFKSA-N 332.448 0.907 10 20 ECCD C[C@H]1[C@@H](C)N(Cc2cc(O)n3ncc(C(=O)O)c3n2)CC[S@@]1=O 737746711 YFIPRLTYBGICRA-OIFKANJSSA-N 338.389 0.474 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCCOCC2)cc1 846247450 XCGONVVPHPJAMD-UHFFFAOYSA-N 349.431 0.839 10 20 ECCD Nc1cnc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cn1 852869205 ZDMXRSQVNROULI-UHFFFAOYSA-N 327.388 0.950 10 20 ECCD CC[C@H](NC)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 852790447 QKHNJGMPCVJROS-HNNXBMFYSA-N 339.461 0.536 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCN(c3nc[nH]n3)CC2)cc1 878824367 UKAJCTYNBGJRBN-UHFFFAOYSA-N 343.435 0.309 10 20 ECCD COCCN(Cc1ccc(N2CCC(O)CC2)cc1)[C@H](C)C(N)=O 876695523 ARCMRPOYTSHVJF-CQSZACIVSA-N 335.448 0.970 10 20 ECCD C[C@H]1C[C@@H](N)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 884566072 AJFAXQHNHGNSOF-DZGCQCFKSA-N 328.416 0.627 10 20 ECCD CNC(=O)CN1C[C@@H]2C(NC(=O)c3ccc(N=NC(N)=O)cc3)[C@H]2C1 962972092 ISWDEAJELAQQFW-RYUDHWBXSA-N 344.375 0.255 10 20 ECCD CCc1ncnc(N2CC=C(CCNC(=O)CC(=O)NC)CC2)c1F 1089822719 NUUJBCXXWHFMSQ-UHFFFAOYSA-N 349.410 0.957 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@@H]3COCCN3C)CC2)nn1 1089819999 QQCJOMTWOWZXRE-INIZCTEOSA-N 345.447 0.758 10 20 ECCD CNC(=O)NCC(=O)NCCC1=CCN(c2cc(C)ncn2)CC1 1089868064 YTWGFLUHDYMVID-UHFFFAOYSA-N 332.408 0.357 10 20 ECCD CCC(=O)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1O 991139605 SLOZOLLMEHPBPQ-QWHCGFSZSA-N 347.375 0.951 10 20 ECCD CCOc1ccc(N2CCN(CCCS(N)(=O)=O)CC2)cc1 1319846398 BHAATJMAXMCIML-UHFFFAOYSA-N 327.450 0.886 10 20 ECCD CC(=O)N1CCC(NC(=O)C(=O)N(C)Cc2ccccc2O)CC1 1256892507 SMJVENFOBHDUFX-UHFFFAOYSA-N 333.388 0.478 10 20 ECCD CCNS(=O)(=O)[C@@H]1CCN(C(=O)NCc2ccc(N)cc2)C1 1577878168 BWHMGFPGVHZCQC-CYBMUJFWSA-N 326.422 0.492 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CCCC12CN(C(=O)C1(F)CC1)C2 1843250777 OJVIQIBXCBGKPD-UHFFFAOYSA-N 335.335 0.812 10 20 ECCD Nc1ccc(CNC(=O)NCCS(=O)(=O)N2CCCC2)cc1 1580445782 VVIMQHQTQJTQEK-UHFFFAOYSA-N 326.422 0.494 10 20 ECCD O=C(c1cnco1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248838 ARMAMSPZSDIWHH-UHFFFAOYSA-N 344.327 0.612 10 20 ECCD COc1ccc(CNC[C@H](O)CNC(=O)c2cn(C)nn2)cc1C 1753908865 CIXSWOVCYMTBEY-ZDUSSCGKSA-N 333.392 0.013 10 20 ECCD C[C@H](NC(=O)Cn1cccnc1=O)c1ccc(N2CCOCC2)cc1 148480212 ZKLFFIRBXMWTCI-AWEZNQCLSA-N 342.399 0.957 10 20 ECCD O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NCc1ccc(O)c(O)c1 272267193 COWWXLUTEVLBQM-GREKMHCPSA-N 342.351 0.521 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C(=O)N1CCNC(=O)C1 298077252 SOUJRHLSOCOBGV-UHFFFAOYSA-N 333.388 0.479 10 20 ECCD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)C[C@H](C)OC)cc1 800843414 AFDAUDWBQMQEHW-VIFPVBQESA-N 337.423 0.339 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C2=C[C@@H](O)[C@@H](O)[C@H](O)C2)cc1 822607975 PWYPGVMBWVHUTI-BRWVUGGUSA-N 334.416 0.562 10 20 ECCD O=C1NCC[C@@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 828156990 XNJVFWRTGKLJEX-INIZCTEOSA-N 331.416 0.648 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](CN)C2)cc1 842208887 XUKGMWCEQNUOTC-OAHLLOKOSA-N 332.448 0.956 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@H](O)CNc2ncccn2)cc1 1105879291 IZTACTZQQVLEKG-LBPRGKRZSA-N 343.347 0.842 10 20 ECCD COC(=O)C[C@@H]1C(=O)NCCN1Cc1cc(F)c(N(C)C)cc1F 862213906 YBDGNMMNCNQKMW-CQSZACIVSA-N 341.358 0.894 10 20 ECCD Cc1ccc(C(=O)NC[C@@H](O)C(N)=O)cc1-n1c(C)cc(C=O)c1C 861355125 JHOKBBJQAVPQSW-MRXNPFEDSA-N 343.383 0.791 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@@H](CO)NC(=O)OC(C)(C)C)c1 860240414 ALHNPLIKEQGRAT-GFCCVEGCSA-N 340.376 0.903 10 20 ECCD COc1ccc(CN(C)C(=O)C(=O)NCCc2ccc(N)cc2)cn1 1118552634 WDJGMQXWMOWESH-UHFFFAOYSA-N 342.399 0.990 10 20 ECCD COCCOCC(=O)NCCC1=CCN(c2nccnc2F)CC1 1089815066 PZXYQJOBVINZSR-UHFFFAOYSA-N 338.383 0.922 10 20 ECCD O=C1CC[C@@H](C(=O)NCCC2=CCN(c3nccnc3F)CC2)CN1 1089870644 ZOVUIWKJRHEOQY-CYBMUJFWSA-N 347.394 0.785 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCn3cnnc3C2)c1 1321602442 LNHJCWFBTWVWQQ-UHFFFAOYSA-N 337.361 0.011 10 20 ECCD CO[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1802385590 UVAFGJJARYUVMH-FOUMNBMASA-N 349.387 0.780 10 20 ECCD CN1C[C@H](C(=O)NCc2ccc(N3CCCCC3)cc2)NCC1=O 1578516696 BTYRENIVEZCZEM-MRXNPFEDSA-N 330.432 0.723 10 20 ECCD CN1CC[C@@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1=O 1345513713 IISVAOWRDRETIM-CQSZACIVSA-N 344.415 0.032 10 20 ECCD CN1CCN(CC(=O)N2CCOc3cc(N(C)C)ccc32)CC1=O 332365110 RDEKFYDHMZDLKH-UHFFFAOYSA-N 332.404 0.252 10 20 ECCD CCN(CC)c1ccc(CNC(=O)NCCN2CCNC(=O)C2)cc1 272997790 QWCZEVYMDSYELW-UHFFFAOYSA-N 347.463 0.764 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNCC2(S(C)(=O)=O)CC2)c1O 279619419 GRIQKDWGVUQREZ-UHFFFAOYSA-N 330.362 0.976 10 20 ECCD Cn1cc(N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2=O)cn1 295115196 LTEAPLJSXXKDRI-UHFFFAOYSA-N 334.307 0.459 10 20 ECCD NC(=O)CN1C(=O)/C(=C/c2ccc(-c3nn[nH]n3)o2)SC1=S 822868783 HMIAXQMXHJXCDH-CLTKARDFSA-N 336.358 0.146 10 20 ECCD C[C@H](NC(=O)C(=O)NC[C@@H]1CNCCCO1)c1ccc(N(C)C)cc1 842203132 PEGPFEFSFYMZQH-BBRMVZONSA-N 348.447 0.425 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CC[C@H]3NC(=O)CC[C@H]3C2)cc1 852497120 UAUQIRURUFJMBV-DOTOQJQBSA-N 344.459 0.969 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3ccnc3CN)CC2)cc1 864619045 HBBFJLOXDMXWNO-UHFFFAOYSA-N 329.404 0.699 10 20 ECCD NS(=O)(=O)c1cc(C(=O)NCCc2ccc(O)c(O)c2)co1 764850256 WSFJJCARCASASB-UHFFFAOYSA-N 326.330 0.311 10 20 ECCD COC(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1C 1116976255 PSOSXGHWRCHJQR-IUODEOHRSA-N 347.415 0.779 10 20 ECCD CCS(=O)(=O)NCCNCc1ccc(N2CCC(O)CC2)cc1 876984741 KOZBXDVDMVNXGB-UHFFFAOYSA-N 341.477 0.677 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)C=C2CCC2)cc1 1125552378 YSRMZIYBKIPCLZ-UHFFFAOYSA-N 342.403 0.987 10 20 ECCD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1ccccc1O 770510139 YSNXEMVEWCDLHI-CYBMUJFWSA-N 326.418 0.517 10 20 ECCD CC[C@@H](OC)C(=O)NCCNCc1nnnn1-c1ccc(OC)cc1 1124550276 DLSRAHVYXCWSIL-CQSZACIVSA-N 348.407 0.302 10 20 ECCD O=C1CC[C@H](C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)CN1 1089870156 LGRTZEFWWWUCLG-ZDUSSCGKSA-N 347.394 0.785 10 20 ECCD COc1ccc(CNC(=O)C2(S(C)(=O)=O)CCOCC2)c(O)c1 1326327062 JYEAYBXOTCOJSG-UHFFFAOYSA-N 343.401 0.611 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CNCCN3C)C2)cc1 1340386267 PVZPSGIAEVENQC-RHSMWYFYSA-N 332.448 0.541 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccn(CC(=O)O)n1 1593760546 CEBPYPFCHMVXEP-UHFFFAOYSA-N 332.316 0.270 10 20 ECCD COC[C@@H](C)N[C@@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1755648074 XIUVTJWEHWOHIQ-ZWNOBZJWSA-N 337.380 0.564 10 20 ECCD O=C(CCCS(=O)(=O)N1CCCC1)NCc1ccc(O)c(O)c1 272263733 BZXIJPVTHGKUDA-UHFFFAOYSA-N 342.417 0.920 10 20 ECCD CNC(=O)CCN(C)C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807672717 GQLDFKGVAJBDEZ-GFCCVEGCSA-N 334.420 0.524 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN[C@@H]3CCOC3)CC2)cc1 819187345 IKAGZZGKCKPJFK-WBVHZDCISA-N 335.448 0.557 10 20 ECCD C[C@H](O)CCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 734215134 CTZYGEXOHUZJBL-ZFWWWQNUSA-N 348.447 0.958 10 20 ECCD COCCCS(=O)(=O)NCCOC(=O)c1ccc(C)c(O)c1O 746973435 RAEANIPVLTWAGT-UHFFFAOYSA-N 347.389 0.519 10 20 ECCD CN1CC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 929523257 HKTVWFRSOJHJOI-MRXNPFEDSA-N 330.432 0.723 10 20 ECCD C[C@@H](NCCn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1O 879648691 ZKHCCXLIZKQECX-LLVKDONJSA-N 343.387 0.490 10 20 ECCD COc1ccc(N2CCN(C(=O)CS(C)(=O)=O)CC2)c(OC)c1 870163668 CLYHQVDQLZOFFY-UHFFFAOYSA-N 342.417 0.397 10 20 ECCD C[C@H](O)c1cn(C2CN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)nn1 779566443 UHPPRDYEFNRXFW-GFAPAMAISA-N 330.344 0.839 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCOC1 788313107 QJTXXBOJWIMIJY-AWEZNQCLSA-N 333.388 0.045 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)[C@@H](O)c2cnn(C)c2)N(C)C)cc1 891247054 GYDGTBPMMWIJQS-SJORKVTESA-N 345.447 0.939 10 20 ECCD COc1cccc(O)c1CN1CCS(=O)(=NS(C)(=O)=O)CC1 894822720 GPMAGBGEZRYXOG-UHFFFAOYSA-N 348.446 0.644 10 20 ECCD CNC(=O)C1(C(=O)NCCC2=CCN(c3nccnc3F)CC2)CC1 1089835275 UCIBTONVQJRFPM-UHFFFAOYSA-N 347.394 0.785 10 20 ECCD CCC(=O)NC[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1O 1081143585 CGOIVMWCJZHVQY-YPMHNXCESA-N 347.375 0.808 10 20 ECCD CCS(=O)(=O)NCCS(=O)(=O)NCc1cc(C)ccc1O 1329804837 DWWUILGRESHRQA-UHFFFAOYSA-N 336.435 0.059 10 20 ECCD C[C@@H](NC(=O)C(=O)NCc1cn(C)cn1)c1ccc(N(C)C)cc1 1333429722 QJAIBADITPTWCN-GFCCVEGCSA-N 329.404 0.980 10 20 ECCD COc1ccc(N2CCC(NC(=O)[C@@H](N)CCC(=O)O)CC2)cc1 1599586744 VLDUGXDCJLMGHW-HNNXBMFYSA-N 335.404 0.972 10 20 ECCD NC(=O)Cc1occc1C(=O)N1C[C@@H](C(N)=O)Cc2ccccc21 352653707 ZRMNGSDDDUQMMW-NSHDSACASA-N 327.340 0.612 10 20 ECCD O=S1(=O)C[C@@H](NCc2cc(F)ccc2O)[C@@H](N2CCOCC2)C1 272527503 ZEUROJSIJIYYLR-KGLIPLIRSA-N 344.408 0.119 10 20 ECCD CC(C)NC(=O)CN1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 276581794 OTFQNQNDNKFCSP-UHFFFAOYSA-N 339.367 0.519 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)CSCC(N)=O)C2)cc1 819583576 XOWLXBZHFZQAGA-GFCCVEGCSA-N 337.445 0.856 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H](C(=O)O)C2)c1 818648560 YQPILWMBEYANDA-QMMMGPOBSA-N 328.346 0.310 10 20 ECCD NC(=O)CNC(=S)NCc1ccc(N2CCC(O)CC2)c(F)c1 727078750 RKCDUTMJSRSEBR-UHFFFAOYSA-N 340.424 0.236 10 20 ECCD COC[C@](C)(O)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 745320362 ZLBZLICRERVWKU-KRWDZBQOSA-N 338.404 0.652 10 20 ECCD CN[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 842212694 ITULGOCBUZTOQC-HNNXBMFYSA-N 330.432 0.723 10 20 ECCD C[C@H](CN1CCCCC1)NC(=O)C(=O)NCCc1ccc(N)cc1 842175496 SUVVVRFRCSBHPW-CQSZACIVSA-N 332.448 0.918 10 20 ECCD CN(C)S(=O)(=O)N1CCN(C(=O)Nc2ccc(N)cc2)CC1 850750065 IIAPGRCGCFMXKT-UHFFFAOYSA-N 327.410 0.225 10 20 ECCD COc1ccc(CNC2CC(CNC(=O)Cn3ncnn3)C2)cc1C 1100338161 KMTPUOOPCGDCPQ-UHFFFAOYSA-N 344.419 0.675 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C)C(=O)[C@@H]3C)nc12 778258543 TZGXHIMKRVZASR-JTQLQIEISA-N 347.375 0.274 10 20 ECCD CNS(=O)(=O)CCNC(=O)N[C@@H](C)c1cc(OC)ccc1O 784129385 QMFXNJCARBJUDW-VIFPVBQESA-N 331.394 0.310 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@H]3OCC[C@H]3C)C2)cc(OC)n1 996377677 BEEFLIGUKBKTPV-BMIGLBTASA-N 349.387 0.464 10 20 ECCD C[C@@H](NC1CC(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 1091385346 FVDAFZMHFJXXOS-TTXORMCVSA-N 346.391 0.821 10 20 ECCD C[C@H](NC(=O)C(=O)N[C@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 1329304808 XLNPLWMEEPSVBD-AAEUAGOBSA-N 332.404 0.277 10 20 ECCD CON(C)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1340815874 FGLIALCXJYUUNQ-ZDUSSCGKSA-N 348.403 0.024 10 20 ECCD C[C@@H](CN1CCCC1=O)NC(=O)C(=O)N(C)Cc1ccccc1O 1345447850 BYXQFFKLZBRSIT-LBPRGKRZSA-N 333.388 0.478 10 20 ECCD O=S(=O)(CC1CNC1)NCc1ccc(N2CCOCC2)cc1 1580862780 DTPVLLRVZRTVGS-UHFFFAOYSA-N 325.434 0.162 10 20 ECCD CO[C@H](C(=O)O)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1593909278 VCSBANNFSZSTHJ-ZDUSSCGKSA-N 344.314 0.517 10 20 ECCD CN1CCC(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 55157673 FGFCXUBMAKTHGB-UHFFFAOYSA-N 327.406 0.588 10 20 ECCD Nc1ccc(CC(=O)Nc2cnn(CCN3CCOCC3)c2)cc1 269272874 UMRVFHRTNOTCTQ-UHFFFAOYSA-N 329.404 0.979 10 20 ECCD O=C1NC(=O)[C@H]2CN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)C[C@@H]12 824893075 JTIGNDWXSLUBQJ-DTORHVGOSA-N 325.708 0.658 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)NCC3(CO)COC3)C2)cc1 824687447 SLHLPSZSQOVECU-CQSZACIVSA-N 349.431 0.830 10 20 ECCD CS(=O)(=O)C1CN(Cc2ccc(N3CCOCC3)c(F)c2)C1 841886947 ARAOUARNXLNZCY-UHFFFAOYSA-N 328.409 0.891 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CCNS(C)(=O)=O)cc1 846448192 ZUWUSORXZLTJRU-UHFFFAOYSA-N 343.449 0.529 10 20 ECCD C[C@H](N)CNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 841915116 MBMFSAPNDNGNEE-JTQLQIEISA-N 328.363 0.948 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN(C)[C@H](C)CO)CC2)cc1 754069986 JDNCHUUCSADBJS-WBVHZDCISA-N 337.464 0.491 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)N[C@@H](C)c2ncn(C)n2)cc1 853007220 RLOSJTAMOMOUHQ-NSHDSACASA-N 347.375 0.592 10 20 ECCD CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@@H]1CCNC1 884531247 HDEPDDVOLJGFLA-MRXNPFEDSA-N 332.448 0.888 10 20 ECCD CNC(=O)Cc1noc(CN2CCOc3cc(N(C)C)ccc32)n1 774763302 YQURPTIMQPVZIS-UHFFFAOYSA-N 331.376 0.823 10 20 ECCD C[C@@H](O)CN1C[C@H]2[C@H](NC(=O)c3ccc(N=NC(N)=O)cc3)[C@H]2C1 962970828 GYHHIBLQUDTVQH-QQUHWDOBSA-N 331.376 0.890 10 20 ECCD CNS(=O)(=O)[C@H]1CCN(Cc2ccc(OC)c(OC)c2O)C1 892237880 SPGMSXGKWGAPRG-NSHDSACASA-N 330.406 0.533 10 20 ECCD C[C@H]1C[C@H](NC(=O)c2cccc(O)c2O)C(=O)N1c1cnn(C)c1 790811187 LZPNIVVIFRWXBK-CABZTGNLSA-N 330.344 0.755 10 20 ECCD CC(C)CC(=O)N[C@@H](CC(N)=O)C(=O)N(C)Cc1ccccc1O 798162611 ZGLFXHDRJXNMNX-ZDUSSCGKSA-N 335.404 0.757 10 20 ECCD CNC(=O)CC(=O)NCCC1=CCN(c2cc(C)nc(OC)n2)CC1 1089823767 PGBADTQGRWEZFR-UHFFFAOYSA-N 347.419 0.573 10 20 ECCD Nc1ccc(CC(=O)N2CCN(C(=O)N3CCOCC3)CC2)cc1 1326568505 ZMCVKAPXJORCNW-UHFFFAOYSA-N 332.404 0.408 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN[C@H]3CO[C@H](C)C3)CC2)cc1 1335397909 LCJGEFLMMVQGCC-JFIYKMOQSA-N 349.475 0.945 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@@H](O)C2)C1 1843844137 QRXXMKFKHZFYAR-KLPPZKSPSA-N 347.371 0.081 10 20 ECCD CN1CCCc2cc(CNC(=O)CC[C@H]3NC(=O)NC3=O)ccc21 57549962 MGZSHSXUBWMPBT-CYBMUJFWSA-N 330.388 0.673 10 20 ECCD C[C@H](O)[C@@H](NC(=O)C1CC1)C(=O)NCc1ccc2c(c1)CCCN2C 180723124 GNYRATVAJUMJKJ-YVEFUNNKSA-N 345.443 0.961 10 20 ECCD Cc1cccc(-n2c(C)cc(C(=O)N(CC(N)=O)CC(N)=O)c2C)c1 78692875 YWUGSIDKKGZCLQ-UHFFFAOYSA-N 342.399 0.815 10 20 ECCD C[C@@H](CO[C@H]1CCOC1)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 283648495 XPNYMKVXKPCCJH-BBRMVZONSA-N 349.431 0.679 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCCO[C@@H]2CCOC2)cc1 283317097 BSHAZECTMLFUTE-MRXNPFEDSA-N 349.431 0.681 10 20 ECCD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cnn(C)c1 283475445 LXBUVMGXKCZHHO-LBPRGKRZSA-N 329.404 0.980 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)CNC(C)=O)CC2)cc1 299498629 LLYSUPXQZCCJKS-UHFFFAOYSA-N 334.420 0.070 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCO[C@H](CN)C1 817918434 JLOHUUJFFPLQSW-MRXNPFEDSA-N 348.447 0.287 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](N)C(C)C)cc2)CC1 832173254 PRWJZVRKGABBJE-QGZVFWFLSA-N 332.448 0.955 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1[C@@H]2CNC[C@@H]21 841713269 XBKJJSQVSPCKTH-VIKVFOODSA-N 334.395 0.679 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H](N)C1CC1 842226955 LOGVUUZJRXEDGB-MRXNPFEDSA-N 332.448 0.955 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCN([C@@H]3CCNC3)CC2)cc1 841654089 MTTAFHKIKZEXOT-QGZVFWFLSA-N 331.464 0.942 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@@H]([C@H]2CCCO2)C1 1117953104 VEOLRPWPQDZTAH-HZPDHXFCSA-N 348.399 0.757 10 20 ECCD O=C(CCNCc1ccc(N2CCC(O)CC2)cc1)N1CCOCC1 876954445 LFHWTGMLQXOJIW-UHFFFAOYSA-N 347.459 0.986 10 20 ECCD O=C(NCCNCc1ccc(N2CCC(O)CC2)cc1)c1cc[nH]n1 877184827 NVOBPLVCTDEJDZ-UHFFFAOYSA-N 343.431 0.890 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1CCOC[C@H]1O 875749566 MUZVSQWVHJNHAW-IAGOWNOFSA-N 349.431 0.597 10 20 ECCD NC(=O)CCCC(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089836432 UOJRGXWGMGNGFL-UHFFFAOYSA-N 335.383 0.914 10 20 ECCD CCOc1ccc(N2CCN(CCC(=O)NCC(=O)OC)CC2)cc1 1324298183 JMTZMJAOZAWAAI-UHFFFAOYSA-N 349.431 0.887 10 20 ECCD C[C@@H](C(=O)N(CC(=O)O)Cc1ccccc1O)N1CCN(C)CC1 1262181559 PBXZFHCSDHIMOG-ZDUSSCGKSA-N 335.404 0.441 10 20 ECCD O=C(O)c1cn(CCNCc2ccc(N3CCOCC3)c(F)c2)nn1 1350669215 ZEVOXBCPZYHERN-UHFFFAOYSA-N 349.366 0.742 10 20 ECCD O=C(c1cccc(O)c1O)N1CCN([C@]2(C(=O)O)CCOC2)CC1 1602626873 SHQKCFSGBPVXMB-MRXNPFEDSA-N 336.344 0.099 10 20 ECCD CCN(CC)c1ccc(CNC(=O)c2[nH]c(=O)[nH]c(=O)c2N)cc1F 172799562 FZNZENBEULUVDD-UHFFFAOYSA-N 349.366 0.561 10 20 ECCD COc1ccc(N2CCN(C(=O)CN[C@H](CO)C(C)C)CC2)cc1 180613897 VGXKBHGEZVOGRQ-QGZVFWFLSA-N 335.448 0.950 10 20 ECCD COCCn1nc(C(=O)NCc2ccc(N(C)C)cc2)ccc1=O 198542439 XRXTZKFDQBZZOQ-UHFFFAOYSA-N 330.388 0.886 10 20 ECCD COc1ccc(O)c(CNC(=O)CN2C(=O)NC3(CCCC3)C2=O)c1 361156374 GVVWFBIXURCHLR-UHFFFAOYSA-N 347.371 0.882 10 20 ECCD COC[C@@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCO1 807673867 AREWTCPXVLCCCM-CJNGLKHVSA-N 349.431 0.804 10 20 ECCD CCN(CC)c1ccc(CNC(=O)NC[C@H]2CC(C(N)=O)=NO2)cc1 297389548 NQHIVLBGPIOJEC-CQSZACIVSA-N 347.419 0.962 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C[C@@H]3CC(=O)NC3=O)C2)cc1 823202458 SJGYUVHOAOHBAC-CHWSQXEVSA-N 345.399 0.691 10 20 ECCD CS(=O)(=O)N=S1(=O)CCN(Cc2cc(F)ccc2O)CC1 820840671 AOMYTDVZWAKIMR-UHFFFAOYSA-N 336.410 0.775 10 20 ECCD O=C1C[C@@H](C(=O)NCc2ccc(N3CCCCC3)cc2)NC(=O)N1 824261909 MSIQDCRAZNDMLY-AWEZNQCLSA-N 330.388 0.891 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)c2cnc3c(c2)nnn3C)cc1 832285207 PROLJHQBGCHHFX-CQSZACIVSA-N 339.403 0.859 10 20 ECCD COc1cccc(CNC(=O)NCCOCCS(C)(=O)=O)c1O 745855455 UCLFCQDWWGMZCW-UHFFFAOYSA-N 346.405 0.261 10 20 ECCD COCCN1C(=O)/C(=C\Nc2ccc3c[nH]nc3c2)C(=O)NC1=S 920976577 LEWITYCDEVLALW-FLIBITNWSA-N 345.384 0.748 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)c2cn(CCN)nn2)cc1 851642604 ZWRFPTKHDMWQTA-UHFFFAOYSA-N 332.408 0.454 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NCc3cnnn3C)C2)cc(OC)n1 1022368742 YYPIUSOXAVALPU-TXEJJXNPSA-N 346.391 0.278 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCOC[C@H]3CO)CC2)cc1 769905673 ZNFRGORMXUBDOD-MRXNPFEDSA-N 349.431 0.037 10 20 ECCD C[C@@H](NC(=O)C(=O)NC[C@@H]1COCCN1)c1ccc(N(C)C)cc1 861765907 AQEKTCCTPQQBSG-TZMCWYRMSA-N 334.420 0.034 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)c3noc(C)n3)CC2)cc1 766502183 OZYKYYUTZRKGIA-UHFFFAOYSA-N 345.403 0.939 10 20 ECCD CCN(C(=O)c1ccc(N=NC(N)=O)cc1)C1CN([C@@H](C)C(N)=O)C1 957442623 GCFXDAVPWSAOCH-JTQLQIEISA-N 346.391 0.869 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCCNCC(=O)N2CCCC2)cc1 1153037490 NTPSOMIBSVFOAG-UHFFFAOYSA-N 346.391 0.791 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3CO[C@H](C)C3)CC2)cc1 1335397911 LCJGEFLMMVQGCC-SOLBZPMBSA-N 349.475 0.945 10 20 ECCD COCCN1CC[C@H](N[C@@H](C)c2cccc(-c3nn[nH]n3)c2O)C1 1605105114 SUHFPSMHFHJRKA-RYUDHWBXSA-N 332.408 0.944 10 20 ECCD O=C(O)CN1CCCC[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C1=O 1595090206 MZLMRZBPUBKDIO-SMYYYNMVSA-N 348.355 0.693 10 20 ECCD CNC(=O)CCN(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 170792264 XAXGJGGOJLBPCR-UHFFFAOYSA-N 348.447 0.412 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3OCCN(C)C3=O)C2)cc1 911277833 XLHOVAFIKWJSLH-BBRMVZONSA-N 347.415 0.495 10 20 ECCD CCn1cc(S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)cn1 842785778 WCHXCHNDUYBUQL-HNNXBMFYSA-N 337.449 0.947 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC/C=C/CO)cc2)C1 853466310 YNGAKXYVZZIPLB-BGTMTDRBSA-N 346.431 0.736 10 20 ECCD COc1ccc(O)c([C@H](C)NS(=O)(=O)CCS(C)(=O)=O)c1 751316878 CWFFBCSMMQHOSR-VIFPVBQESA-N 337.419 0.426 10 20 ECCD CN1C(=O)N[C@@]2(CCC[C@H]2CNC(=O)NCc2ccccc2O)C1=O 752025700 ZGIYPYMNZBSWJW-YVEFUNNKSA-N 346.387 0.912 10 20 ECCD CCn1ncc(C)c1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 850400614 ISFSRYDJOVCHDG-UHFFFAOYSA-N 332.360 0.920 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CCCNC3=O)CC2)c(OC)c1 870165835 AYNZFUFIHLSUKV-CQSZACIVSA-N 347.415 0.879 10 20 ECCD CNS(=O)(=O)CCC(=O)NCCNCc1ccc(OC)c(C)c1 1127082282 OHIRYBBEBTYGNW-UHFFFAOYSA-N 343.449 0.149 10 20 ECCD CN1CCN(CC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CC1 891254522 YRYIJHVCQKGFDQ-GOSISDBHSA-N 347.507 0.719 10 20 ECCD CO[C@@H](C)CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1328315036 LDTUFXZKQUMNSL-UONOGXRCSA-N 349.431 0.852 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H](N)CCC(=O)O 325716287 SXFIGOUKBRHWNK-OAHLLOKOSA-N 335.404 0.674 10 20 ECCD CN(C)c1ccc(CN(C(=O)Cn2ncn(C)c2=O)C2CC2)cc1 272194434 FRMAVDZQUDUCPC-UHFFFAOYSA-N 329.404 0.839 10 20 ECCD COC[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 283990346 JKUFMKGRBFBDHN-CQSZACIVSA-N 349.431 0.538 10 20 ECCD CC(=O)C(=O)CN1C(=O)N[C@]2(CCN(Cc3ccccc3)C2)C1=O 808034894 ZGTNQKWLLPFIQA-KRWDZBQOSA-N 329.356 0.341 10 20 ECCD CCS(=O)(=O)N(C)CCCNC(=O)NCc1ccccc1O 299467990 CBDKORSRECYFTL-UHFFFAOYSA-N 329.422 0.863 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)CCC(=O)N2CCOCC2)cc1 832278478 CULWIGZWDKXGMR-MRXNPFEDSA-N 348.447 0.508 10 20 ECCD Cc1cc(C(=O)N2CC(S(N)(=O)=O)C2)c(C)n1-c1ccccn1 910521239 FGMAXSDTNKNCBE-UHFFFAOYSA-N 334.401 0.602 10 20 ECCD CNC[C@@H]1CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 844219200 HWLRWGKQINIHGB-INIZCTEOSA-N 346.475 0.885 10 20 ECCD CN1C(=O)C(=CNNc2ncccc2C(F)(F)F)C(=O)N(C)C1=O 915261544 YJEVKPUAAFZIDB-UHFFFAOYSA-N 343.265 0.951 10 20 ECCD C[C@@H](C(=O)O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 842572144 CDCFVDNSQDXQBC-DGCLKSJQSA-N 333.388 0.725 10 20 ECCD O=C(Cc1nc[nH]n1)NCc1ccc(N2CCC(CO)CC2)cc1 865953004 AEYBQGFFWMQODR-UHFFFAOYSA-N 329.404 0.872 10 20 ECCD Cc1ccc(CN(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c(O)c1 876616708 STZMBIORMJPXPZ-CYBMUJFWSA-N 326.418 0.436 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@@H]3CNC(=O)C3)cc2)CC1 883744076 UEKYMXMXAIXIPH-HNNXBMFYSA-N 345.447 0.374 10 20 ECCD O=C(CO)N1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 793594872 SYHNQZDODFDDJA-UHFFFAOYSA-N 329.740 0.590 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@@]3(C)CCNC3=O)CC2)n1 1089865033 JTPIDMQFXXAUKZ-GOSISDBHSA-N 343.431 0.954 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)C(C)(C)C(N)=O)CC2)nn1 1089849042 TWYNSICNNMLDRN-UHFFFAOYSA-N 331.420 0.939 10 20 ECCD CO[C@H](C)C(=O)N1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 994377776 YQRVNSQXAGRBMB-SECBINFHSA-N 333.348 0.825 10 20 ECCD Cn1ncc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1N 181154949 BUVAQJHOITZOTO-UHFFFAOYSA-N 333.367 0.908 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CC[C@@H](O)C2)c1 276829647 FLIDCSKDHGROQU-GXSJLCMTSA-N 328.390 0.655 10 20 ECCD CC(C)C(=O)N[C@@H](CO)C(=O)NCc1ccc(N2CCOCC2)cc1 291595174 WTLUVZKFQKXPLI-INIZCTEOSA-N 349.431 0.273 10 20 ECCD CN(C)C(=O)COC1CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])C1 830552103 XBVGQABWUKVKNI-XQRVVYSFSA-N 349.343 0.986 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)O[C@H]1CNOC1 914242549 MREULLYIKIPRHM-LBPRGKRZSA-N 325.340 0.792 10 20 ECCD CC[C@@H](C(N)=O)N1CC[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1015103430 OLCPSEMIXFNXHV-NEPJUHHUSA-N 336.392 0.167 10 20 ECCD COc1ccc(N(C)CCN(C)[C@@H]2CCN(CC(=O)O)C2=O)cc1 852731070 ZNPRIOIFUPGOEL-OAHLLOKOSA-N 335.404 0.749 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H]3COC[C@H]3C2)c1 872320485 YTOVRVIGQQVOMH-AOOOYVTPSA-N 326.374 0.482 10 20 ECCD C[C@@H](NC(=O)Cn1ncn2nccc2c1=O)c1ccc(N(C)C)cc1 773018005 KWNUQCZNBTZYOD-GFCCVEGCSA-N 340.387 0.834 10 20 ECCD C[C@H](C(N)=O)N1C[C@@H]2C(NC(=O)c3ccc(N=NC(N)=O)cc3)[C@H]2C1 962978832 XNVHORGODOHOCK-ZHAHWJHGSA-N 344.375 0.383 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@@H]3COCCN3C)CC2)n1 1089819996 QPGLWKZVSIPSLB-INIZCTEOSA-N 345.447 0.758 10 20 ECCD Cc1cnc(N2CC=C(CCNC(=O)CC(N)=O)CC2)c([N+](=O)[O-])c1 1089822182 SORRPVRVAMXBMQ-UHFFFAOYSA-N 347.375 0.816 10 20 ECCD O=C(NCCC1=CCN(c2nccn3nnnc23)CC1)C1CCC1 1089803890 WQYWWIITRARUOY-UHFFFAOYSA-N 327.392 0.962 10 20 ECCD COC(=O)[C@H]1C[C@H](O)CN1Cc1ccc(N2CCC(O)CC2)cc1 1333000257 MYQDOJPIUIZASP-DLBZAZTESA-N 334.416 0.756 10 20 ECCD COC[C@@H](O)CN[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1267026262 KOSBLQFZTGLJAU-KBPBESRZSA-N 349.391 0.660 10 20 ECCD O=C(NCc1ccc(O)cc1O)[C@H](O)c1ccc(-c2nn[nH]n2)cc1 1606832163 COFJHFBWNXWSCL-CQSZACIVSA-N 341.327 0.628 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CC(=O)N(C2CNC2)C1 1578489900 UJRLFRZGJNLKHV-AWEZNQCLSA-N 345.447 0.467 10 20 ECCD CC[C@H](NC)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249739 SBUWMTBVOCSHLV-LBPRGKRZSA-N 348.403 0.308 10 20 ECCD COCCNC(=O)CN1CCN(Cc2cc(C)c(C)cc2O)CC1 111996162 USYIGFSUVCLYFS-UHFFFAOYSA-N 335.448 0.889 10 20 ECCD COc1ccc(N2CCN(CCC(=O)N3CCN(C)CC3)CC2)cc1 244164106 UZRGKDKSCPHXHJ-UHFFFAOYSA-N 346.475 0.981 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C[C@@H]1CNCCO1 269247943 VVZMAVXZJBGEKR-QGZVFWFLSA-N 333.432 0.860 10 20 ECCD CN1CC[C@@H]2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)[C@@H]2C1 283564651 RLYJTKJPECTQMA-NVXWUHKLSA-N 344.459 0.921 10 20 ECCD CCN(C)C(=O)CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807670525 GEHLGZMWUDCXFM-GFCCVEGCSA-N 334.420 0.524 10 20 ECCD CCNC(=O)N1CC[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1 819170677 LROMMLMJAFTBOO-CYBMUJFWSA-N 346.387 0.960 10 20 ECCD CN(CCN)C(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 817915217 JDEVJXXDVVYFTE-CQSZACIVSA-N 335.404 0.317 10 20 ECCD Cn1cc(-c2nn[nH]n2)cc1C(=O)NCCc1ccc(O)c(O)c1 822641053 AFGIRIKPQJMSKI-UHFFFAOYSA-N 328.332 0.589 10 20 ECCD CO[C@H](CN)CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 827469367 VZVKWMVBUBVHAD-HOCLYGCPSA-N 348.447 0.368 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 839681437 PKMRVKQSTGYAJH-HZPDHXFCSA-N 348.403 0.599 10 20 ECCD CNC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 842035885 JSDIHENADPBIOT-HNNXBMFYSA-N 332.448 0.827 10 20 ECCD COc1ccc(N2CCN(C(=O)c3cn(CCN)nn3)CC2)cc1F 852812959 FTAABOZPTZOAKC-UHFFFAOYSA-N 348.382 0.347 10 20 ECCD Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC(=O)NCCO 860085821 XAGMTUJTNDBBEO-UHFFFAOYSA-N 343.383 0.745 10 20 ECCD Cc1ocnc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 763254488 ZTWRGTPAGUNZRP-UHFFFAOYSA-N 325.346 0.990 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCN3C(=O)NC(=O)[C@H]3C2)cc1 778651340 QVWJJNXDBBRYED-CYBMUJFWSA-N 331.376 0.198 10 20 ECCD CN1CCN(c2ccc(CNc3ccc(C(N)=O)nn3)cc2)CC1 882880363 NWOVDOZDAWQUEO-UHFFFAOYSA-N 326.404 0.939 10 20 ECCD COC[C@H](CO)NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 899103408 LOETWRHBPSEXQQ-GOEBONIOSA-N 338.452 0.662 10 20 ECCD COc1cccc(CNc2cnn(CC(=O)NCCN(C)C)c2)c1O 893550943 PUBZNRGXVDCXDD-UHFFFAOYSA-N 347.419 0.887 10 20 ECCD COc1ccc(CNCC2CC(NC(=O)Cn3cnnn3)C2)cc1C 961530443 POKZHSDJPKIVQA-UHFFFAOYSA-N 344.419 0.675 10 20 ECCD COc1ccc(CNCCNC(=O)C2CC(=O)NC(=O)C2)cc1C 1135273208 MJIVXHCSCXAYSS-UHFFFAOYSA-N 333.388 0.262 10 20 ECCD COc1ccc(CN[C@@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]2C)cc1C 1082714058 UEXYCGUMOINZQG-VHDGCEQUSA-N 346.431 0.622 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3CCN(C)C3=O)CC2)ncn1 1089853997 MOFDHJMVHCBFCC-HNNXBMFYSA-N 343.431 0.906 10 20 ECCD NC(=O)c1cn(C2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)nn1 1329655057 PMZAJWDUCXFTDC-UHFFFAOYSA-N 349.322 0.405 10 20 ECCD COC(=O)[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](C(=O)O)C1 1610164206 CFRKBEMUFHLOQL-WEPHUFDCSA-N 349.339 0.976 10 20 ECCD C[C@H]1CN(c2ccc(CNC(=O)[C@H](N)CO)cc2F)C[C@H](C)O1 1341659515 PSTXGYKAAZDCLA-COPLHBTASA-N 325.384 0.375 10 20 ECCD CC(=O)NCCCNC(=O)C(=O)NCc1c(C)c2ccccc2n1C 359809997 RGDUFZUSDRJJOO-UHFFFAOYSA-N 344.415 0.745 10 20 ECCD CN(C[C@@H]1CCCN(C(=O)c2cccc(O)c2O)C1)S(C)(=O)=O 285888026 DWBQZWZHRXDZGO-NSHDSACASA-N 342.417 0.841 10 20 ECCD COC[C@H](C)NC(=O)NC(=O)COC(=O)c1ccc(C)c(O)c1O 727005097 GGGWHVUEZIOQKS-VIFPVBQESA-N 340.332 0.424 10 20 ECCD CN(C(=O)c1ccc(N=NC(N)=O)cc1)C1CCN(CC(N)=O)CC1 1006461756 HXUMNQTXQDBCIN-UHFFFAOYSA-N 346.391 0.871 10 20 ECCD O=C(CN1CCN(C(=O)c2cccc(O)c2O)CC1)N1CCCC1 776598015 BEWQGZWYOWYNIE-UHFFFAOYSA-N 333.388 0.478 10 20 ECCD O=C1NC(=O)N2CCN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)C[C@H]12 779433082 PLDZLLXKFAJUGK-SNVBAGLBSA-N 340.723 0.690 10 20 ECCD CN1C(=O)C(=Cc2cn(Cc3cccnc3)nn2)C(=O)N(C)C1=O 783696374 JYYGBFJEJVCMQB-UHFFFAOYSA-N 326.316 0.155 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C(=O)N3CCCC3)cc2)CC1 898327662 RGCGQLFZPMZOEP-UHFFFAOYSA-N 330.432 0.677 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)CNC(=O)C3CC3)CC2)nn1 1089814969 MQACKWFDCIELRU-UHFFFAOYSA-N 343.431 0.954 10 20 ECCD CNC(=O)[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCO1 182472853 YUNKQLSQKULYTA-NSHDSACASA-N 329.740 0.901 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)Cn3cccn3)cc2)CC1 276127836 LEPYEQRUAXIUPV-UHFFFAOYSA-N 341.415 0.868 10 20 ECCD COC(=O)[C@H]1C[C@H](O)CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 276668023 UKSUWHVCGBPQFL-JKSUJKDBSA-N 349.431 0.319 10 20 ECCD CC(=O)N1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 283615777 VTVVLDBRNZJPNQ-UHFFFAOYSA-N 346.431 0.450 10 20 ECCD COC(=O)CCCONC(=O)c1cc(NS(C)(=O)=O)ccc1O 290550630 HRCCSIYWGZQEBB-UHFFFAOYSA-N 346.361 0.378 10 20 ECCD COC(=O)C[C@H](C)N1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 295423704 WCAQYYCTFWGXIU-JTQLQIEISA-N 340.351 0.946 10 20 ECCD Oc1ccccc1CNC[C@@H]1CNc2c(-c3nn[nH]n3)cnn2C1 738400086 BYBCTZPIDASHMW-SNVBAGLBSA-N 326.364 0.600 10 20 ECCD CS(=O)(=O)N1CCN(CCNCc2c(O)cccc2Cl)CC1 733327035 LKIKWOGUWMZXJJ-UHFFFAOYSA-N 347.868 0.712 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)C[C@@H](O)C1CC1 839218749 ACULUXXAOPQEEW-MRXNPFEDSA-N 333.432 0.940 10 20 ECCD C[C@@]1(CN)CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 842170551 IPOOPSKCYHWLMY-IBGZPJMESA-N 342.443 0.876 10 20 ECCD CCN1CCN(CCC(=O)NC[C@H](N)c2ccc(N(C)C)cc2)CC1 844163320 YTVMGFBZYWZIKE-SFHVURJKSA-N 347.507 0.896 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3CCC[C@]3(N)C2)cc1 857100810 NNYQLNVNPGRAKQ-KSSFIOAISA-N 330.432 0.709 10 20 ECCD COc1ccc(O)c(CNS(=O)(=O)CCCN2CCOCC2)c1 766062641 DOQICKJSTQBIBP-UHFFFAOYSA-N 344.433 0.543 10 20 ECCD CC[C@H](CNS(C)(=O)=O)NC(=O)/C=C/c1ccc(O)c(O)c1 1117846275 KNDYYNNSCANIAD-OKPNEXGHSA-N 328.390 0.555 10 20 ECCD CN1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C(C)(C)C1 770155403 ANMJUCRMFFHXCB-UHFFFAOYSA-N 341.433 0.930 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3ccc(O)nn3)cc2)CC1 881849979 YOPSYRBZGUUANY-UHFFFAOYSA-N 327.388 0.864 10 20 ECCD COc1ccc(CNCCNC(=O)CN2CC(=O)N(C)C2=O)cc1C 1147645474 WMPSCEVBHJFSJX-UHFFFAOYSA-N 348.403 0.103 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@@H]3CC(=O)N(C)C3)CC2)nn1 1089867896 VLKMPZSAMSSTHD-OAHLLOKOSA-N 343.431 0.906 10 20 ECCD C[C@@H](CC(N)=O)C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089850471 YQWATOAAYUKYFC-NSHDSACASA-N 335.383 0.770 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3[nH]cnc3C)C2)cc(OC)n1 996369663 YGNYHGXJDCCTOW-UHFFFAOYSA-N 345.359 0.385 10 20 ECCD COc1ccc(N2CC[C@@H](CNCc3cn(CC(=O)O)nn3)C2)cc1 1332438482 RQXPQYOUTCKJTN-ZDUSSCGKSA-N 345.403 0.987 10 20 ECCD CNC(=O)CCN(C)c1nnc(-c2sccc2O)n1CCOC 1523650672 CNDQICRLPGTHBT-UHFFFAOYSA-N 339.421 0.931 10 20 ECCD CC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249611 DHVWZDLJSTVURT-UHFFFAOYSA-N 347.371 0.679 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H]1CCC[C@@]12NC(=O)NC2=O 272675942 RDNSPTWSMVHQMQ-WVFARQBBSA-N 345.355 0.606 10 20 ECCD COC(=O)[C@@H]1CN(C(=O)c2ccoc2CC(N)=O)c2ccccc2O1 560421374 MFTHRRCSAZVRKD-AWEZNQCLSA-N 344.323 0.888 10 20 ECCD C[C@H](CCN)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 842254107 RXCCFKGVTJRFFI-UKRRQHHQSA-N 349.431 0.753 10 20 ECCD CN(C)CC[C@@H](N)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 846672036 BBOVSJMYLRYCTM-OAHLLOKOSA-N 338.427 0.558 10 20 ECCD NC(=O)Cn1cc(C(=O)NCCCSc2nccs2)nn1 742669883 QZGIDIDWYPKMNE-UHFFFAOYSA-N 326.407 0.132 10 20 ECCD CNC(=O)CN1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1016367079 IDNXCIJUJMJKTJ-GFCCVEGCSA-N 332.364 0.399 10 20 ECCD COc1ccc(O)c(CNC(=O)c2cc(S(N)(=O)=O)c(C)o2)c1 756764721 KKOOIVKWLYYUIG-UHFFFAOYSA-N 340.357 0.880 10 20 ECCD C[C@H](NC(=O)CN1CCNCC1)c1ccc(N2CCOCC2)cc1 876740101 GTZIWQASYLBPEJ-HNNXBMFYSA-N 332.448 0.606 10 20 ECCD COC[C@]1(C(=O)NCc2ccc3c(c2)CCCN3C)CNCCO1 876741386 UEEAIVBSIJUHGL-SFHVURJKSA-N 333.432 0.690 10 20 ECCD O=C(CN1C(=O)CCC1=O)N1CCN(Cc2ccccc2O)CC1 770508708 FQBMDJJBZUZIDF-UHFFFAOYSA-N 331.372 0.185 10 20 ECCD CC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCN(CC(N)=O)CC1 1045650890 RVGSZMVBXNMMBB-UHFFFAOYSA-N 346.391 0.919 10 20 ECCD NS(=O)(=O)[C@@H]1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 785984472 FQJOCSGOQUMJSD-SECBINFHSA-N 335.769 0.817 10 20 ECCD CNS(=O)(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 795805822 KGSXGIKOUDFMFX-GHMZBOCLSA-N 331.413 0.993 10 20 ECCD O=C(CNC(=O)C1CC1)NCCC1=CCN(c2cnc(F)cn2)CC1 1089814999 NMAHKZXZLZLYPH-UHFFFAOYSA-N 347.394 0.785 10 20 ECCD O=C(C[C@H]1CCC(=O)N1)NCCC1=CCN(c2cnc(F)cn2)CC1 1089834167 CJBPSYUOAGHZFO-CYBMUJFWSA-N 347.394 0.927 10 20 ECCD 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O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@@H]1CCCN1 842206377 FDEDUCIEOVRCHF-HNNXBMFYSA-N 330.432 0.771 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NC[C@@H](C)CN 842069776 BTPUDSVXWHYJCQ-JSGCOSHPSA-N 334.464 0.819 10 20 ECCD CC(=O)NCC(=O)N1CCC[C@H]1C(=O)N(C)Cc1ccccc1O 769281260 VEAIPBFEPHCAEI-AWEZNQCLSA-N 333.388 0.478 10 20 ECCD CCOC(=O)CCCNC(=O)COC(=O)c1cccc(O)c1O 776278702 FFKXYPXSRYIYCN-UHFFFAOYSA-N 325.317 0.714 10 20 ECCD CN(CCCNC(=O)/C=C\c1ccc(O)c(O)c1)S(C)(=O)=O 779498316 PPQNHZMEAJZYSK-ALCCZGGFSA-N 328.390 0.509 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2cc(Cn3cccn3)nn2)cc1 881094889 WEXZAOXOJDLMPX-UHFFFAOYSA-N 339.403 0.905 10 20 ECCD CNC(=O)Cn1nc(NC(=O)NCc2ccc(OC)cc2O)cc1C 797639063 FQAJDMYOIVRXCK-UHFFFAOYSA-N 347.375 0.973 10 20 ECCD CS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccccc2O)cn1 795112818 QCXGUPRDVGJTLM-UHFFFAOYSA-N 342.398 0.669 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3ccon3)C2)cc(OC)n1 973062239 WMPZDXJPFLCSJP-XYPYZODXSA-N 346.343 0.778 10 20 ECCD 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C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)N(C)C1CC1 283625139 WHIMKNYJLIDTKF-ZDUSSCGKSA-N 332.448 0.968 10 20 ECCD CNC(=O)[C@H](C)NC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 823732750 ILQKEEAURMCJLA-STQMWFEESA-N 334.420 0.955 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)CCn2cc[nH]c(=O)c2=O)c1 728978813 OWSKYGTWWFAIMY-SNVBAGLBSA-N 333.344 0.518 10 20 ECCD C[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823554542 WTPGPWKDBCIHJU-ZDUSSCGKSA-N 346.431 0.678 10 20 ECCD C[C@H](NC(=O)CNS(=O)(=O)N(C)C)c1ccc(N(C)C)cc1 832431460 PLCVBXVQAXVFIC-NSHDSACASA-N 328.438 0.326 10 20 ECCD CC1=CC(NC(=O)c2ccc(S(C)(=O)=O)o2)=S=C1C(=O)O 738239310 HFGFOVVMLOWPQQ-UHFFFAOYSA-N 329.355 0.493 10 20 ECCD C[C@H](NC(=O)c1cnn(C[C@H](O)CO)c1)c1ccc(N(C)C)cc1 832431516 PVNNGFAFJWHKFZ-LRDDRELGSA-N 332.404 0.793 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN([C@H]3CCN(C)C3=O)C2)cc(OC)n1 1015104137 QMAPTSDROCIOHN-OLZOCXBDSA-N 348.403 0.134 10 20 ECCD COC[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 740128881 XTYYWZZWUNVMHS-SNVBAGLBSA-N 328.390 0.872 10 20 ECCD 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10 20 ECCD CO[C@@]1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCOC1 764455146 QAECHJASUSLMKF-CQSZACIVSA-N 344.389 0.299 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)CNC3CC3)cc2)CC1 1119383506 LYLOUWXFPLRJAH-UHFFFAOYSA-N 330.432 0.757 10 20 ECCD O=C(CNCc1ccc(N2CCC(O)CC2)cc1)N1CCOCC1 877139098 HNTAWCSOCRKSSY-UHFFFAOYSA-N 333.432 0.596 10 20 ECCD CCS(=O)(=O)N1CCN(C(=O)NCc2ccc(N)cc2)CC1 1262603483 JWZMMLMGZULKEG-UHFFFAOYSA-N 326.422 0.446 10 20 ECCD CS(=O)(=O)C[C@@H]1CN(C(=O)NCc2ccc(N)cc2)CCO1 1579336725 GSKJEVCWFBYDFI-ZDUSSCGKSA-N 327.406 0.224 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cn[nH]c2)C1 1843501189 WUUXXIWLVCMBGG-UHFFFAOYSA-N 343.343 0.347 10 20 ECCD C[C@@](CNCc1ccc(N2CC[C@H](O)C2)cc1)(CC(=O)O)C(=O)O 1776425339 PFEHWIVZEDEEIU-YOEHRIQHSA-N 336.388 0.913 10 20 ECCD CCS(=O)(=O)NCCNC(=O)NCc1ccc(N(C)C)cc1 61441990 CSHSUKZAPXGHOW-UHFFFAOYSA-N 328.438 0.491 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)c1nc(O)nc(O)c1N 347723083 MBOMVZBMXFDBPK-UHFFFAOYSA-N 331.332 0.575 10 20 ECCD 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COC(=O)CN(CC(=O)OC)Cc1ccc(OC)c(OC)c1O 891722127 RIVCBCDEWFJPMD-UHFFFAOYSA-N 327.333 0.557 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@H]3CN(C)C(=O)N3)CC2)n1 1089855854 QPOFPJSGRVAELP-CQSZACIVSA-N 344.419 0.451 10 20 ECCD C[C@@]1(C(=O)NCCC2=CCN(c3nccnc3F)CC2)CNC(=O)C1 1089851479 RXZUWVZLYJVKGY-KRWDZBQOSA-N 347.394 0.785 10 20 ECCD C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CO1 1326402920 SGAWTBRXDIHTQF-DOMZBBRYSA-N 331.416 0.979 10 20 ECCD CC(=O)N1C[C@H]2CN(C(=O)C(=O)N(C)Cc3ccccc3O)C[C@H]2C1 1262524695 RDCCPGYYVHFYIK-GASCZTMLSA-N 345.399 0.287 10 20 ECCD CNC(=O)NCC(=O)N(C)[C@H](C)CNCc1ccc(OC)c(C)c1 1753694799 GVWJTPOQCAIKTO-CYBMUJFWSA-N 336.436 0.869 10 20 ECCD CCc1cccc(CNC[C@]2(C(=O)O)C[C@@H]2S(C)(=O)=O)c1O 1597587127 PUJLIXDKAXKYKK-SWLSCSKDSA-N 327.402 0.932 10 20 ECCD COCCN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1=O 181574173 FEUMSGBZNBGOHB-UHFFFAOYSA-N 333.432 0.814 10 20 ECCD Nc1ccc(NC(=O)CCN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1 269139836 UZPXTDQSAZXQIC-GBOPCIDUSA-N 329.356 0.760 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN(C)[C@@H]2CCS(=O)(=O)C2)c1O 278219011 LFZRIQCMOALSJX-SNVBAGLBSA-N 330.362 0.928 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N(C)C[C@@H](C)O 817860899 YSWLTBXWYVONPX-UONOGXRCSA-N 335.448 0.947 10 20 ECCD CN(Cc1ccccc1O)C(=O)[C@@H]1CCCN(S(N)(=O)=O)C1 816889090 MCCCHERNKDOZPX-GFCCVEGCSA-N 327.406 0.266 10 20 ECCD C[C@H](N)[C@H](C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827389527 MOKWECOGHGUBPP-STQMWFEESA-N 339.461 0.521 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@H]1CC(=O)N1 831706683 KBZXZAQVDMTQDE-LLVKDONJSA-N 340.763 0.826 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H]([C@@H](C)N)C1 842153085 KCXGVJYFLJNVPZ-UKRRQHHQSA-N 332.448 0.873 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CCC[C@@H]3CN)ccc21 842149560 AHQNVBXKQUUCKU-OAHLLOKOSA-N 330.432 0.635 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)CCO)CC2)cc1 843083364 PGKFLBRQAJZQSP-DOTOQJQBSA-N 337.464 0.539 10 20 ECCD CO[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)NCc1ccc(N(C)C)cc1 853244868 QKFWFJXJDDWYLZ-UONOGXRCSA-N 341.433 0.364 10 20 ECCD CCOC(=O)[C@@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 763984688 VLJONIXCGAAFST-MRVPVSSYSA-N 330.362 0.445 10 20 ECCD CN1CC[C@H](N2CC(NC(=O)c3ccc(N=NC(N)=O)cc3)C2)C1=O 1031464456 SEPPZAQLSMDPKC-ZDUSSCGKSA-N 344.375 0.494 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@H]2COCCN2CCO)cc1 1051262475 AMMJWPKLPKNGPJ-ZDUSSCGKSA-N 335.364 0.272 10 20 ECCD CCNC(=O)CC(=O)NCCC1=CCN(c2nccnc2F)CC1 1089827873 SKDCVAIPTOXNJX-UHFFFAOYSA-N 335.383 0.785 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@H]3CC[C@H]3C(N)=O)CC2)ncn1 1089849854 HGULCDIWAFOQMZ-CABCVRRESA-N 343.431 0.939 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1C=CCC1 1328275741 WVXVNHTYJRZKPT-OAHLLOKOSA-N 329.400 0.974 10 20 ECCD C[C@H](NC(=O)C(=O)NCCNC(=O)C1CC1)c1ccc(N(C)C)cc1 1346735951 PMCUHAMDKMMONE-LBPRGKRZSA-N 346.431 0.572 10 20 ECCD CCS(=O)(=O)NCC(=O)NCc1c(O)ccc2c1CCCC2 179362099 OKBIVLLCHNVSHX-UHFFFAOYSA-N 326.418 0.827 10 20 ECCD COCCN1C(=O)/C(=C\NCc2ccccc2F)C(=O)NC1=S 60863773 OWCMLUGZGKXAFA-LUAWRHEFSA-N 337.376 0.689 10 20 ECCD CS(=O)(=O)N1CCC[C@H](C(=O)NCCc2ccc(O)c(O)c2)C1 528857351 LBPZJJJAAAGCGN-LBPRGKRZSA-N 342.417 0.428 10 20 ECCD COCCN(C)CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 263794802 ROYMOHQRWAQISZ-UHFFFAOYSA-N 345.421 0.072 10 20 ECCD CCOC(=O)COCCNC(=O)NCc1cccc(OC)c1O 297324585 BKMLSOWESDQUIK-UHFFFAOYSA-N 326.349 0.780 10 20 ECCD O=C(c1cc(O)cs1)N1CCN(C[C@H]2CCCS2(=O)=O)CC1 913124194 CVCMHABBCVBQSY-GFCCVEGCSA-N 344.458 0.789 10 20 ECCD CCN1C[C@@H](C)N(C(=O)C(=O)NCCc2ccc(N)cc2)C[C@H]1C 842242632 UFYVBHXCKLVCBK-ZIAGYGMSSA-N 332.448 0.869 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C3(C(=O)O)CC3)cc2)C1 844250994 UYKZCWDQYWQPCG-CYBMUJFWSA-N 345.399 0.869 10 20 ECCD C[C@@H](C(=O)O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 842572146 CDCFVDNSQDXQBC-YPMHNXCESA-N 333.388 0.725 10 20 ECCD COc1ccc(N2CC[C@@H](NC(=O)c3cn(CCCN)nn3)C2)cc1 851639148 BTSFDZPFFPEVPF-CYBMUJFWSA-N 344.419 0.644 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CC(=O)N(CCN(C)C)C2)c1 768912236 YYVOBTRPMYLXTQ-STQMWFEESA-N 349.431 0.988 10 20 ECCD CN(CCOCCN)C(=O)NCc1ccc(N2CCOCC2)cc1 861565906 XBAHRJXAUCJRSD-UHFFFAOYSA-N 336.436 0.640 10 20 ECCD CN(C)c1ccc(CNC(=O)CNC2(CC(=O)O)CCOCC2)cc1 1118506411 PHQLCSLZJZIUQI-UHFFFAOYSA-N 349.431 0.982 10 20 ECCD O=C1NC(=O)[C@H]2CN(Cc3ccc(N4CCC(O)CC4)cc3)C[C@@H]12 877567546 OFCKSWFKCLFWHY-IYBDPMFKSA-N 329.400 0.352 10 20 ECCD CCNS(=O)(=O)CCNCc1ccc(N2CCC(O)CC2)cc1 877008388 QFNIUGLLNJWHBU-UHFFFAOYSA-N 341.477 0.677 10 20 ECCD CN1CCC[C@@H](OC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 778785779 ZDIRTWAOPMYSBR-GFCCVEGCSA-N 342.373 0.541 10 20 ECCD CN1CC[C@@H](C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 899473761 XBCIOBIKGFKPHO-MRXNPFEDSA-N 344.459 0.956 10 20 ECCD O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1cccc(O)c1O 790873262 KONCOORPWFNZHU-TXFQPVFDSA-N 342.351 0.635 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)c3cn(C)nn3)CC2)n1 1089828545 AGAAZKWQXZEKRC-UHFFFAOYSA-N 327.392 0.870 10 20 ECCD O=C(Cc1nc[nH]n1)NCCC1=CCN(c2cnc(F)cn2)CC1 1089841854 KWEQQTABJFBQBX-UHFFFAOYSA-N 331.355 0.619 10 20 ECCD Cc1nnc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)n1C 1321364937 MGQLYOMHXFHWQI-UHFFFAOYSA-N 330.392 0.122 10 20 ECCD CC(=O)N1CC(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C1 1334066416 NGEQXHGKFQBPMD-QGZVFWFLSA-N 332.448 0.950 10 20 ECCD O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)CCOC1CNC1 1602057517 GZDRBESGKFVMEO-UHFFFAOYSA-N 342.779 0.837 10 20 ECCD O=C(CNc1ccc(-c2nn[nH]n2)cn1)NCc1cccc(O)c1O 1606558039 OASPZVZOTGZCIX-UHFFFAOYSA-N 341.331 0.401 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC3CC2(C(=O)O)C3)c1 1607376578 PQAOOSRJSRSPQC-UHFFFAOYSA-N 340.357 0.453 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H](O)Cc1cnn(C)c1 331787791 OPAMBTKKAFCTQZ-OAHLLOKOSA-N 330.388 0.815 10 20 ECCD CN1C(=O)N[C@]2(CCC[C@@H]2CNC(=O)c2cccc(O)c2O)C1=O 365315373 OMYVGTBEXXISRJ-ABKXIKBNSA-N 333.344 0.548 10 20 ECCD CNCCC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 286166732 QPXWXBNHPJPPTM-UHFFFAOYSA-N 334.464 0.933 10 20 ECCD CNC(=O)C(C)(C)CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 807099084 JQBSNHPNKMFKLN-UHFFFAOYSA-N 348.447 0.566 10 20 ECCD Cc1cc(Cn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1N(C)C 292781680 UTNLOGUZKLQIME-UHFFFAOYSA-N 327.388 0.856 10 20 ECCD CN(C)S(=O)(=O)c1cc(C(=O)NCc2ccc(N)cc2)n(C)c1 297299345 VLDPAEZUZLMUIL-UHFFFAOYSA-N 336.417 0.788 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCC[S@@](C)=O)cc1F 803661931 OTCQUQYPLPSZRX-JOCHJYFZSA-N 329.397 0.003 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)C(=O)O)CC2)cc1 842586848 YBBPPEQKQQNRCR-CYBMUJFWSA-N 335.404 0.654 10 20 ECCD COC(=O)[C@H]1C[C@@H](O)CN(Cc2ccc(N3CCN(C)CC3)cc2)C1 843433639 BQAZSXZXTIFJDP-FUHWJXTLSA-N 347.459 0.794 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(Cc3cn(C)nn3)C2)cc(OC)n1 1015104777 SCAYAJJUHFPPRU-GFCCVEGCSA-N 346.391 0.232 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)NC[C@@H]2COC3(CCCC3)O2)cc1 842145584 SKVUDLMCCXAAOD-OAHLLOKOSA-N 347.415 0.729 10 20 ECCD C[C@H](CN)N(C)C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 911581009 YASZMEOXUGTKRC-CJNGLKHVSA-N 349.479 0.277 10 20 ECCD NS(=O)(=O)CCCCCC(=O)NCCc1ccc(O)c(O)c1 845834713 XJFCSKUDLSAYAQ-UHFFFAOYSA-N 330.406 0.605 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCCC[C@H]2CN)cc1F 842147990 KIOAGWYZXWQWKG-ZDUSSCGKSA-N 336.411 0.848 10 20 ECCD C[C@@H](CCN)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 842254105 RXCCFKGVTJRFFI-DZGCQCFKSA-N 349.431 0.753 10 20 ECCD COc1ccc(N2CCN([C@H]3CCN(CC(=O)O)C3=O)CC2)cc1 852726800 ZBUFUVCMNBOLQG-HNNXBMFYSA-N 333.388 0.503 10 20 ECCD Cn1cc(S(N)(=O)=O)cc1C(=O)NCCc1ccc(O)c(O)c1 762274437 IMCKDPVURGFFFX-UHFFFAOYSA-N 339.373 0.056 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3COCCO3)CC2)c(OC)c1 870164433 XLOGJFUGBUXRIM-INIZCTEOSA-N 336.388 0.768 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCC[C@@]12CCOC2=O 1117985046 WVYVOAGSERQOKP-KRWDZBQOSA-N 332.356 0.659 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CN1CCOCC1 778845210 QPUNDZZMWQFTFH-UHFFFAOYSA-N 349.431 0.586 10 20 ECCD Cn1cc(N2C[C@@H](C(=O)NCCc3ccc(N)cc3)CC2=O)cn1 876528157 QNHMCRLEZMFFRY-ZDUSSCGKSA-N 327.388 0.714 10 20 ECCD C[S@@](=O)CCN1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779519595 LFILVUQVXMIPCQ-UUCGHWEQSA-N 338.429 0.634 10 20 ECCD CCNC(=O)CC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 780914844 MJJIRWPYLPFOMM-UHFFFAOYSA-N 348.447 0.460 10 20 ECCD Cn1nnc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n1 787441795 NVDYDKLVTOTDEC-ZDUSSCGKSA-N 346.391 0.807 10 20 ECCD O=C1C[C@@H](C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)CCN1 1089821308 XOJQUPVDMJRQTH-ZDUSSCGKSA-N 347.394 0.785 10 20 ECCD CN(C(=O)C(=O)NCc1ccc(N2CCCC2)cc1)[C@H]1CCNC1=O 1321659305 SJCIGENAFQKSCG-HNNXBMFYSA-N 344.415 0.250 10 20 ECCD CCON(C)C(=O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 1325179198 QYEBJAAUPZJHEJ-UHFFFAOYSA-N 339.367 0.893 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)[C@H]3CNCCN3C)C2)cc1 1340386270 PVZPSGIAEVENQC-WMLDXEAASA-N 332.448 0.541 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)C[C@H](O)CN)cc2F)CC1 1357430371 FPZOTWNAGSSRED-AWEZNQCLSA-N 338.427 0.294 10 20 ECCD CCS(=O)(=O)NCCNC(=O)NCc1ccc(N(C)C)c(F)c1 57647273 DIZWMSIIFWOSFI-UHFFFAOYSA-N 346.428 0.630 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cn(CC(N)=O)nn1 79774540 IWTRDAQEESBKJR-UHFFFAOYSA-N 330.392 0.492 10 20 ECCD CN(C[C@H](O)C1CC1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291623 GECLXNCUIOYOPU-KRWDZBQOSA-N 343.427 0.908 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1CC(=O)N(C)C1 819693873 WAVCLRZTJKOJQY-CYBMUJFWSA-N 334.372 0.762 10 20 ECCD C[C@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC(=O)N1 823523853 KTYJLZWNKXPDEM-ZDUSSCGKSA-N 346.431 0.678 10 20 ECCD C[C@@H](N)[C@@H](C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827389524 MOKWECOGHGUBPP-CHWSQXEVSA-N 339.461 0.521 10 20 ECCD CCOC[C@H](O)CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 849328053 YJTFLCWISBLCEL-MRXNPFEDSA-N 342.461 0.408 10 20 ECCD CO[C@@H]1COC[C@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852393232 YQOMBLGKVIBCMP-IAGOWNOFSA-N 349.431 0.861 10 20 ECCD Cc1cc(Cn2cc(CN3CCNC(=O)C3)nn2)ccc1N(C)C 883997150 BVOHSHYFILIGGN-UHFFFAOYSA-N 328.420 0.633 10 20 ECCD CCC(=O)NCc1cn(CC(=O)NCc2ccc(N(C)C)cc2)nn1 881094513 LASSRRHLFXCXRQ-UHFFFAOYSA-N 344.419 0.687 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2cc(CSCCN)nn2)cc1 881094363 ISNBZEHYPDGOEQ-UHFFFAOYSA-N 348.476 0.852 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)CSC)C2)cc(OC)n1 996367457 CPVVCYVWQVAIPD-UHFFFAOYSA-N 325.390 0.402 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)C[C@@H]2C=CS(=O)(=O)C2)cc1 1349137502 LHJYDRMSOLGWAE-SWLSCSKDSA-N 337.445 0.817 10 20 ECCD COC(=O)c1ccc(O)c([C@H](C)NCCn2cc(C(=O)O)nn2)c1 1598984969 WUCDUKQJNMUIJX-VIFPVBQESA-N 334.332 0.819 10 20 ECCD CS(=O)(=O)N1CC[C@H](NCc2ccc(N3CCOCC3)cc2)C1 400148856 CKOYYLSZXXYKEK-HNNXBMFYSA-N 339.461 0.647 10 20 ECCD O=C1C[C@H](NCc2ccc3c(c2)CCO3)CN1CCN1CCOCC1 172698038 MWZRUYYVCDYDIB-KRWDZBQOSA-N 345.443 0.644 10 20 ECCD O=C(CSCC(=O)N1CCOCC1)NCc1ccc(O)c(O)c1 269094743 MJUZREMHQDXLNW-UHFFFAOYSA-N 340.401 0.306 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCOCC2CC2)c1 264474376 JSDUQWPTMABDKN-UHFFFAOYSA-N 328.390 0.920 10 20 ECCD CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)c1cccc(O)c1O 274951530 IIOMUFCCBRCHFH-ZDUSSCGKSA-N 335.404 0.770 10 20 ECCD CN1CCN(C)[C@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)C1 819169001 XJEAZFVMUOPFEC-AWEZNQCLSA-N 332.404 0.402 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N2CCC[C@@H](n3ccnn3)C2)cc1 818676040 KSOKWIAIZVZMGH-OAHLLOKOSA-N 342.403 0.383 10 20 ECCD CO[C@H]1CS(=O)(=O)C[C@@H]1NC(=O)NCc1cc(Cl)ccc1O 821141211 IRDJZFVQWXXGPE-JQWIXIFHSA-N 348.808 0.657 10 20 ECCD CN(Cc1cn(C)nn1)C(=O)NCc1ccc(N2CCOCC2)cc1 852004248 FLFKQCUZIKYNIP-UHFFFAOYSA-N 344.419 0.993 10 20 ECCD CO[C@H]1CS(=O)(=O)C[C@H]1NCc1cc(F)c(N(C)C)cc1F 858188644 HRHXBPGACOEVCH-OCCSQVGLSA-N 334.388 0.932 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H](C(N)=O)C2)c1 920432291 INRKNDHDRLJTNY-VIFPVBQESA-N 341.389 0.101 10 20 ECCD CN1CCN(c2ccc(CNC(=O)CN3CCCC3=O)cc2)CC1 881849495 PCNOODIKHPNLOO-UHFFFAOYSA-N 330.432 0.677 10 20 ECCD CC(=O)N1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@@H](O)C1 991567407 WZIVOTNYZZICGL-OLZOCXBDSA-N 333.348 0.561 10 20 ECCD O=C(CN1C(=O)CNC1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1318627105 XTHSWFAVIQRQGD-ZDUSSCGKSA-N 347.371 0.452 10 20 ECCD CO[C@@H](CN)CC(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1606673869 RJDJXFNQBBPDFK-LLVKDONJSA-N 330.768 0.823 10 20 ECCD COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CN(C)CCO2)cc1C 1754262088 KMWKLVFJOJGVPM-YOEHRIQHSA-N 335.448 0.929 10 20 ECCD CCCCN(CC(N)=O)Cc1cc(O)n2ncc(C(=O)OCC)c2n1 52704106 DQYZJKDBCBMZKC-UHFFFAOYSA-N 349.391 0.699 10 20 ECCD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)N1CCOCC1 53697242 XLINVRWLMVGACT-UHFFFAOYSA-N 341.433 0.190 10 20 ECCD O=C1CN(C(=O)CN2CCCc3cc(OC(F)F)ccc32)CCN1 65597175 VVEBVRFUDZTJPP-UHFFFAOYSA-N 339.342 0.999 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3ncn(C)c3=O)CC2)cc1F 182351401 YTOULOYXYPXIBO-UHFFFAOYSA-N 349.366 0.078 10 20 ECCD Cc1n[nH]c(S(=O)(=O)N(C)Cc2ccccc2O)c1C(=O)O 315376898 JYAKIVCCHVDYRK-UHFFFAOYSA-N 325.346 0.943 10 20 ECCD COCCN1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 194605793 DUSKKSQSJUTOJF-UHFFFAOYSA-N 348.491 0.975 10 20 ECCD Nc1ccc(CC(=O)N2CCN(C(=O)CN3CCCC3)CC2)cc1 237889256 KQHZPZKRHASECA-UHFFFAOYSA-N 330.432 0.578 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)c1nc(N)nc(N(C)C)n1 611652241 WYVTUHMQEMQYHX-UHFFFAOYSA-N 343.391 0.625 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)c2cn(CC(=O)N(C)C)nn2)c1 728981476 BASBYXGBICWVHD-SNVBAGLBSA-N 347.375 0.572 10 20 ECCD C[C@@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C 743639202 VVDMTJIEANANSL-MNOVXSKESA-N 341.433 0.976 10 20 ECCD CCn1c(N)c(C(=O)CN(C)c2ccc(OC)cc2)c(O)nc1=O 844353537 QYDVWHMHPHZWGR-UHFFFAOYSA-N 332.360 0.879 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@H](CCN)C2)cc1F 911115240 SYVOOEXZVUEXSH-GFCCVEGCSA-N 336.411 0.705 10 20 ECCD Nc1ccc(NC(=O)NCCS(=O)(=O)N2CCSCC2)cc1 841299415 CIHLNGAANOXPHD-UHFFFAOYSA-N 344.462 0.769 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1CNCCO1 842278105 YKDCYVWFIDGLGZ-CQSZACIVSA-N 335.404 0.235 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3CNC[C@@H]3C2)cc1F 842147994 KKZJMWPWQINOFV-BETUJISGSA-N 334.395 0.186 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCC(N)CC2)cc1 846363806 PQQFKIDAEKKUJC-UHFFFAOYSA-N 348.447 0.540 10 20 ECCD CCn1ncnc1CNC(=O)CN(CC(=O)O)c1ccc(OC)cc1 853007728 CZKACCWWWHJCSA-UHFFFAOYSA-N 347.375 0.514 10 20 ECCD CNS(=O)(=O)CCN1CCN(c2ccc(OC)c(F)c2)CC1 856728608 VZSPLASPGIRBIN-UHFFFAOYSA-N 331.413 0.506 10 20 ECCD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@H]1CCNC1 851685392 AHGUSNABSRMDRY-AWEZNQCLSA-N 348.472 0.334 10 20 ECCD CN1CCC[C@H](N(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 769913422 QICQDWPIIFWBHD-LBPRGKRZSA-N 341.433 0.930 10 20 ECCD COC(=O)C(C)(C)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769763476 IFIOCTGECVEOLP-UHFFFAOYSA-N 344.389 0.787 10 20 ECCD COC1(CO)CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 773943240 DHPDEUIOUQWTOM-UHFFFAOYSA-N 335.448 0.842 10 20 ECCD CCNC(=O)CN1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779493360 QDYMZGSAHBMAPD-GQCTYLIASA-N 333.388 0.391 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCn3ncnc3C2)cc1 785422299 JKIODLZIXDQQCN-UHFFFAOYSA-N 328.376 0.003 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H]2CCC[C@@H](N)[C@H]2C1 1331836947 YDSKZPKQZVXWFH-AEGPPILISA-N 331.416 0.936 10 20 ECCD COc1ccnc(NNC(=S)Nc2ccccc2-c2nn[nH]n2)n1 1605338338 JQYMATRDQPTBJI-UHFFFAOYSA-N 343.376 0.979 10 20 ECCD CN(C)c1ccc(CNC(=O)N2C[C@H]3COC[C@@]3(C(=O)O)C2)cc1 1604090710 DAAJQHLHNVBLDY-GUYCJALGSA-N 333.388 0.995 10 20 ECCD COC[C@@H](C)N[C@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1755648073 XIUVTJWEHWOHIQ-MFKMUULPSA-N 337.380 0.564 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCOC[C@@H]2CC(=O)O)c1O 1599345667 MCADXKPOPKYCSJ-JTQLQIEISA-N 326.305 0.985 10 20 ECCD O=C(NC1CC1)C(=O)N1CCN(Cc2cc(Cl)ccc2O)CC1 91930558 WGBCKQXUFWXHHE-UHFFFAOYSA-N 337.807 0.968 10 20 ECCD COc1cccc(CNC(=O)NCCCN2C(=O)CCC2=O)c1O 266824104 LXPSVVLJZQKSHY-UHFFFAOYSA-N 335.360 0.739 10 20 ECCD COC(=O)c1ccc(O)c([C@@H](C)NCCOCCS(C)(=O)=O)c1 273542957 YSYUFHKMNGEMLU-LLVKDONJSA-N 345.417 0.891 10 20 ECCD COC(=O)c1cn(CCNC(=O)NCc2ccc(N(C)C)cc2)nn1 285376179 XPFGOPNGQYIMSA-UHFFFAOYSA-N 346.391 0.630 10 20 ECCD C[C@H](O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 283223227 OOSFHCRQCRPNPN-HOCLYGCPSA-N 343.427 0.908 10 20 ECCD COCc1noc(CN2CCN(C(=O)Cc3ccc(N)cc3)CC2)n1 831998922 WDZYZLXRJRXVKF-UHFFFAOYSA-N 345.403 0.685 10 20 ECCD CCOCCS(=O)(=O)NCc1nc(Cc2ccc(N)cc2)no1 843162564 ZWYGBESLAKBCDR-UHFFFAOYSA-N 340.405 0.699 10 20 ECCD COc1cc(C(=O)N[C@H]2CCCN([C@@H](C)C(N)=O)C2)cc(OC)n1 1007790050 FYORFEKUZRUWHT-JQWIXIFHSA-N 336.392 0.167 10 20 ECCD COc1ccc(N(C)CCN(C)CCS(=O)(=O)CC(=O)O)cc1 844839184 JUHFONGSBRRJQI-UHFFFAOYSA-N 344.433 0.563 10 20 ECCD C[C@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C 743639203 VVDMTJIEANANSL-QWRGUYRKSA-N 341.433 0.976 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC(F)(F)CN 842152340 HFBBOTUMSNVGAJ-UHFFFAOYSA-N 328.363 0.387 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCc2cn(C)cn2)cc1F 929802257 RZNQANHVNCLYJT-UHFFFAOYSA-N 333.367 0.558 10 20 ECCD O=C(Cn1cccnc1=O)NCc1ccc(N2CCC(O)CC2)cc1 856209900 GPZZELLHXIPNBG-UHFFFAOYSA-N 342.399 0.521 10 20 ECCD COC[C@@](C)(O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1 870164866 DWXNXBWDAWQPJT-QGZVFWFLSA-N 338.404 0.750 10 20 ECCD O=C1CN(C(=O)C(=O)NCCCSc2nccs2)CCCN1 1119189678 WCAYONGENBOMAN-UHFFFAOYSA-N 342.446 0.090 10 20 ECCD CNC(=O)NCCC(=O)NCc1ccc(N2CCN(C)CC2)cc1 881853530 ZBEBTXYVIKMNQJ-UHFFFAOYSA-N 333.436 0.374 10 20 ECCD CN1CCN(c2ccc(CNS(=O)(=O)c3ccn(C)n3)cc2)CC1 882663593 SQFDOOKCHQRFLN-UHFFFAOYSA-N 349.460 0.650 10 20 ECCD C[C@H]1OC(=O)N[C@H]1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 786073823 QZGUUOPKLMGSDB-IAQYHMDHSA-N 349.387 0.751 10 20 ECCD COc1ccc(CN[C@@H]2CCN(C(=O)[C@@H]3CCC(=O)N3)C2)cc1C 970524792 UQZXHKHNCRRKNE-CABCVRRESA-N 331.416 0.973 10 20 ECCD Cc1nn[nH]c1C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089854370 SGTAONMAXYSZBB-UHFFFAOYSA-N 331.355 0.999 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnnn1C 1321642586 PKBNQIZHQPDFKA-JTQLQIEISA-N 334.332 0.131 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC(=O)N[C@H]2CCCC[C@H]21 1324862009 DMZIMPLFYMMIFO-UONOGXRCSA-N 345.399 0.620 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](C)[C@H](C)N)cc2)CC1 1329287529 NNZNNADNLAACCF-KBPBESRZSA-N 332.448 0.955 10 20 ECCD CN1CCN(c2ccc(CNC(=O)CCc3nc[nH]n3)cc2)CC1 1330814049 VHYDIICMMQAPAI-UHFFFAOYSA-N 328.420 0.806 10 20 ECCD O=C(O)[C@H]1C[C@H](O)CN(Cc2ccc(N3CCC(O)CC3)cc2)C1 1601770196 UUOKTPMMPLFZJH-YOEHRIQHSA-N 334.416 0.915 10 20 ECCD CO[C@H]1CCN(CC(=O)NCc2ccc(N(C)C)cc2)[C@@H](C(=O)O)C1 1599124392 DEAOYWJPXLXSKN-JKSUJKDBSA-N 349.431 0.933 10 20 ECCD CN1CCN(C(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)CC1 183173324 QLFZOTZIXKLHCD-UHFFFAOYSA-N 346.475 0.729 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)Cn1nnc2c(cnn2C)c1=O 132195335 NVIAEMYKGYGRTB-UHFFFAOYSA-N 327.392 0.681 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](O)[C@H](CC)C3)nc12 270872864 JJXRNGXXUICVGG-ZWNOBZJWSA-N 334.376 0.814 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CC[C@@H]3OCC(=O)N[C@H]3C2)cc1 836250624 XIAHTROHKIOJLN-GJZGRUSLSA-N 332.404 0.552 10 20 ECCD COc1ccc(O)c(CNS(=O)(=O)c2cc(C(=O)O)n(C)c2)c1 833733862 UBQFTPWGDVUNNV-UHFFFAOYSA-N 340.357 0.916 10 20 ECCD CN(C)c1ccc([C@H](N)CNS(=O)(=O)C[C@@H]2CCCO2)cc1 842784428 JOKXDRQAWXNWQN-LSDHHAIUSA-N 327.450 0.851 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCO[C@H](CN)C1 844227186 VTJSJRBETFKTLO-QGZVFWFLSA-N 334.464 0.761 10 20 ECCD CN(CC1(O)CCC1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 760084854 NPWPEVWMHRXTAE-UHFFFAOYSA-N 328.390 0.751 10 20 ECCD COc1cc(C(=O)N[C@H]2COC3(C2)CN(CCF)C3)cc(OC)n1 1053859069 YZZPUWBUVPDJHX-GFCCVEGCSA-N 339.367 0.641 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)n1cncn1 1325764569 TYVPEIOYUBGWOV-PWSUYJOCSA-N 348.359 0.541 10 20 ECCD COC[C@H](C)NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1332813907 OQRVUUUUAAFCAB-UONOGXRCSA-N 349.431 0.852 10 20 ECCD COc1cc(O)c(CN(CCNC(C)=O)[C@H](C)C(=O)O)cc1OC 1604732261 VNEPOVSILHFTRD-SNVBAGLBSA-N 340.376 0.821 10 20 ECCD CNS(=O)(=O)CCN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 187172550 TVVYSXZWBOGBRK-GFCCVEGCSA-N 345.440 0.862 10 20 ECCD CCN(CC)c1ccc(CNC(=O)N2CCO[C@H](C(N)=O)C2)cc1 139513212 REXPNLUTLLLRQQ-HNNXBMFYSA-N 334.420 0.929 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)CNC(=O)[C@H]1CCCN1 351556075 MZQWQKZQNZVROH-CYBMUJFWSA-N 332.404 0.346 10 20 ECCD CCC[C@H]1C(=O)NCCN1CC(=O)NCc1ccc(N(C)C)cc1 299688290 NPPTVWFCINUNBH-INIZCTEOSA-N 332.448 0.969 10 20 ECCD CCN1CCN(CC(=O)N[C@H](C)c2cc(OC)ccc2O)C(=O)C1=O 728978855 VGESCLPIHLBXDM-LLVKDONJSA-N 349.387 0.269 10 20 ECCD COc1ccc(O)c(CNC(=O)c2ccc(-c3nn[nH]n3)nc2)c1 737106362 RPDOSQULAGJYRZ-UHFFFAOYSA-N 326.316 0.906 10 20 ECCD O=C(NCc1cccc(Br)c1O)NC[C@@H]1CNCCO1 842012125 UVGYZWYPZSGYLP-JTQLQIEISA-N 344.209 0.942 10 20 ECCD NC(=O)[C@H]1CCCCN1C(=O)COC(=O)/C=C/c1ccc(O)c(O)c1 759596882 WJMWVKQRRCNZQY-HOSRBBHYSA-N 348.355 0.521 10 20 ECCD NCCn1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)nn1 852790315 OVPVBXCMWRMZCH-UHFFFAOYSA-N 346.460 0.720 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@@](C)(O)C3)CC2)cc1 754050739 ROBQVFDFZWMCLU-IEBWSBKVSA-N 349.475 0.635 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnccn1 1116592500 XKMMQHSBLFHXMK-NSHDSACASA-N 331.328 0.792 10 20 ECCD CNC(=O)[C@@H](C)N1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1044355030 NDXKTJNSYMQVLK-SNVBAGLBSA-N 346.391 0.740 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CCCNC1=O 1118014370 RAULVTLZRAXQNJ-AWEZNQCLSA-N 346.431 0.320 10 20 ECCD COc1ccc(CN[C@@H]2CCN(C(=O)Cn3cnnc3O)C2)cc1C 968466540 BQYPZBIHLCWPEQ-CQSZACIVSA-N 345.403 0.691 10 20 ECCD O=C(NCCC1=CCN(c2nccn3nnnc23)CC1)[C@@H]1CCCO1 1089799191 BIUFMNRWCOINGS-ZDUSSCGKSA-N 343.391 0.341 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)c3c[nH]c(=O)cn3)CC2)nn1 1089856275 XKQNIFRBQMUQAF-UHFFFAOYSA-N 340.387 0.825 10 20 ECCD C[C@@H](NC(=O)Cn1cnc(-c2nn[nH]n2)n1)c1ccc(N(C)C)cc1 1609119915 OUNFXJXGLLENQB-SNVBAGLBSA-N 341.379 0.402 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)C2CN([C@H]3CCOC3)C2)cc1 1578424844 ZBCHTMBKRCXNHL-DLBZAZTESA-N 332.448 0.589 10 20 ECCD CO[C@@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251116 YABPVFLVEJGNTM-JTQLQIEISA-N 335.360 0.345 10 20 ECCD CN1CCC[C@@H]1C(=O)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 271195110 SEDWCGPDIRQQES-CQSZACIVSA-N 347.415 0.859 10 20 ECCD C[C@H]1CS(=O)(=O)C[C@H]1NC(=O)NCc1ccc(N(C)C)cc1 289764934 NKLWUFMDBMVOIF-SMDDNHRTSA-N 325.434 0.985 10 20 ECCD C[C@H](C[S@@](C)=O)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 288581870 ONJVTULONZEANG-YEBMWUKDSA-N 349.456 0.562 10 20 ECCD C[C@@H](NC(=O)C(=O)NCC[S@@](C)=O)c1ccc(N(C)C)cc1 804999093 CYTGRDAXRTXSSC-RKFFSXRUSA-N 325.434 0.425 10 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10 20 ECCD O=C(NCCCSc1nccs1)C(=O)N1CCC(CO)CC1 774184400 CBMGSUJORIOYPT-UHFFFAOYSA-N 343.474 0.972 10 20 ECCD COc1ccc(N2CCN(C(=O)COC(=O)C3(C)COC3)CC2)cc1 782398418 XMMXDBJTRFSYSC-UHFFFAOYSA-N 348.399 0.924 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3OCCN(C)C3=O)CC2)cc1 899940719 VRMNXAWVJONKAX-OAHLLOKOSA-N 333.388 0.201 10 20 ECCD O=C1[C@@H]2C[C@@H](O)CN2C(=O)N1Cc1ccc(N2CCC(O)CC2)cc1 1340029785 OQHFMSNGDDZCAD-CVEARBPZSA-N 345.399 0.545 10 20 ECCD CN(CCO)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 130463046 GDHLHBKCTGXVAO-UHFFFAOYSA-N 325.384 0.921 10 20 ECCD Nc1ccc(CCNC(=O)CN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1 262572414 FPACEBGDHNQZKC-RRCSTGOVSA-N 343.383 0.090 10 20 ECCD CN(C[C@H]1CCC[C@H]1O)C(=O)C(=O)NCc1ccc(N(C)C)cc1 283668251 YQRRSVHHIUBBHA-GDBMZVCRSA-N 333.432 0.988 10 20 ECCD C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 284015994 QXBDCLGQYCFUHX-LBPRGKRZSA-N 347.394 0.909 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C[C@H]3CC(=O)NC3=O)C2)cc1 823202461 SJGYUVHOAOHBAC-STQMWFEESA-N 345.399 0.691 10 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COc1ccc(N2CCN(CCCNC(=O)C3(N)CC3)CC2)cc1 269260068 METBBJFFEZARDK-UHFFFAOYSA-N 332.448 0.815 10 20 ECCD CC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(OC)OC 278666090 PQBZERLRBQXIDY-LLVKDONJSA-N 346.405 0.891 10 20 ECCD N[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)C1CCOCC1 282410071 CUQCXKCIKDSTFJ-KRWDZBQOSA-N 333.432 0.893 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCC(S(N)(=O)=O)CC2)c1O 373203726 HCXCUSUHZZJDTE-UHFFFAOYSA-N 345.377 0.562 10 20 ECCD C[S@@](=O)CCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 735116283 GEHOQYLYIXZIHJ-HXUWFJFHSA-N 334.419 0.262 10 20 ECCD COCC(COC)N1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 839802133 JSAVGAQJPZZFHL-UHFFFAOYSA-N 342.367 0.656 10 20 ECCD COc1ccc(N2CCCN(C(=O)NC[C@@H]3CNCCO3)CC2)cc1 842010846 KSOIMYMDYQCCDN-KRWDZBQOSA-N 348.447 0.905 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CSCC(N)=O)cc1 846447652 TZQKZPROCNGTSY-UHFFFAOYSA-N 325.434 0.808 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(Cc3ncccn3)C2)cc(OC)n1 1015100609 CLWKBJCZAYLPLG-ZDUSSCGKSA-N 343.387 0.893 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)CC3OCCO3)cc2)CC1 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333.387 0.302 10 20 ECCD COC1CCN(c2ccc(Cn3cc(C[C@H](N)CO)nn3)cc2)CC1 1336898528 VNICBFUNKDOVGE-HNNXBMFYSA-N 345.447 0.804 10 20 ECCD O=C(O)[C@@H]1C[C@H](N2C(=O)CNC2=O)CN1Cc1cccc(F)c1O 1602197426 GYPDQWIVCGNXJN-ONGXEEELSA-N 337.307 0.111 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2CCNC[C@H]2O)N(C)C)cc1 1578424609 OTEBMHICVWVKNT-IXDOHACOSA-N 349.479 0.377 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NCC(=O)N(C)C)cc1 188376844 DHIUJGNCJJMPTI-UHFFFAOYSA-N 334.420 0.353 10 20 ECCD O=C1NC[C@H]2CN(Cc3cc(Cl)cc(Cl)c3O)CCN2C1=O 91866430 QNKJBYRXYYMUOD-JTQLQIEISA-N 344.198 0.842 10 20 ECCD COCCN(CC(=O)OC)Cc1ccc([N+](=O)[O-])c(OC)c1O 278314626 XGWCPFLCOXIUEV-UHFFFAOYSA-N 328.321 0.930 10 20 ECCD CCn1c(SCC(=O)C(C)=O)nc2cc(S(N)(=O)=O)ccc21 289734866 SXZDCAJEYRNUIL-UHFFFAOYSA-N 341.414 0.954 10 20 ECCD CS(=O)(=O)N[C@@H]1CCCC[C@@H]1CNC(=O)c1cccc(O)c1O 287312394 NHEIWQSXVVYQMF-ZYHUDNBSSA-N 342.417 0.936 10 20 ECCD C[C@@H](O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 283223233 OOSFHCRQCRPNPN-ZBFHGGJFSA-N 343.427 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RCGDGAOHODTFOT-JOCQHMNTSA-N 342.403 0.818 10 20 ECCD CN(C)S(=O)(=O)N(C)CC(=O)NCc1cc(Cl)ccc1O 846477493 RKRZGYXTBGIUHD-UHFFFAOYSA-N 335.813 0.400 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)OCCN1CCCS1(=O)=O 759596092 MDODUGZAOKLKGK-HWKANZROSA-N 327.358 0.690 10 20 ECCD COC(=O)c1ccc(O)c([C@@H](C)NCCn2cc(C(=O)OC)nn2)c1 793564044 BJFCCHOAOLXDNW-SNVBAGLBSA-N 348.359 0.908 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cncn3C)C2)cc(OC)n1 996378626 LEKVWZVCGLNCQM-UHFFFAOYSA-N 345.359 0.087 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCc1ccnc(N(C)C)n1 1325375605 YUQHDXSQQAVMGX-UHFFFAOYSA-N 343.387 0.523 10 20 ECCD C[C@H](NC(=O)C(=O)NCc1cn(C)cn1)c1ccc(N(C)C)cc1 1333429723 QJAIBADITPTWCN-LBPRGKRZSA-N 329.404 0.980 10 20 ECCD CN(c1nnc(-c2sccc2O)n1C)[C@@H]1CCS(=O)(=O)C1 1355344601 NFPNBRHDVHBGQS-MRVPVSSYSA-N 328.419 0.873 10 20 ECCD CCCN(CC(=O)O)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1589665622 LYPPCBIZDUBXEU-UHFFFAOYSA-N 330.362 0.701 10 20 ECCD O=C([C@H]1CCCO1)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 16355932 WYYXXMCZRXOFAU-CQSZACIVSA-N 334.372 0.944 10 20 ECCD C[C@@H](O)CCN(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 288526258 KTPJVPIKRYMFQZ-CQSZACIVSA-N 331.416 0.908 10 20 ECCD CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 284123422 NMGQRTRYWBBCSK-HNNXBMFYSA-N 349.431 0.681 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)N[C@H]1CCOC1 827955337 DZLLRQPJZWXREP-AWEZNQCLSA-N 347.415 0.169 10 20 ECCD CO[C@H](C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1)c1cnn(C)c1 832286397 ZJPCBXVTBXHAIH-CVEARBPZSA-N 331.420 0.990 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H]3CCNC3)cc2)CC1 843500693 YZTYEIUSLNJFQW-KRWDZBQOSA-N 344.459 0.971 10 20 ECCD CC(C)OC[C@H]1CN(C(=O)C(=O)NCCc2ccc(N)cc2)CCO1 842238476 QYTRONITLBITEM-MRXNPFEDSA-N 349.431 0.580 10 20 ECCD COc1cccc(CNC(=O)CCCCCS(N)(=O)=O)c1O 845833724 MXXFKBZOUNHQQC-UHFFFAOYSA-N 330.406 0.866 10 20 ECCD CNC[C@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 851690661 IYLUJJAQJQOGHM-DZGCQCFKSA-N 349.431 0.624 10 20 ECCD COc1cccc(CNC(=O)C(=O)Nc2cnn(CCF)c2)c1O 861753298 UGTGSVVQRHRZRY-UHFFFAOYSA-N 336.323 0.822 10 20 ECCD COc1cc(C(=O)NC2CN(C[C@H]3C[C@@]34CCOC4)C2)cc(OC)n1 1030615008 VLWHVFOYRQKLOZ-FZKQIMNGSA-N 347.415 0.939 10 20 ECCD COC(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1C 1116976254 PSOSXGHWRCHJQR-DOMZBBRYSA-N 347.415 0.779 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)c(OC)c1 870165536 YZHCWWNKYAMJLU-CYBMUJFWSA-N 347.415 0.879 10 20 ECCD COc1ccc(CNC(=O)[C@@](C)(O)Cn2ccc(C)cc2=O)c(O)c1 794382075 XEZFCWMEAFOOSD-SFHVURJKSA-N 346.383 0.938 10 20 ECCD COc1ccc(CN[C@@H]2CCN(C(=O)Cn3ncnn3)[C@@H]2C)cc1C 986290948 SISCPPRZZJCXRJ-UKRRQHHQSA-N 344.419 0.769 10 20 ECCD CO[C@H](C)CC(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089817049 GZSOJPSXGVYDDI-GFCCVEGCSA-N 345.407 0.587 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCS(=O)(=O)C1 1323436926 UNROBOKOVVOERK-GFCCVEGCSA-N 340.401 0.044 10 20 ECCD Cn1cc(C(=O)Nc2c(Cl)ccc3nonc23)c(=O)n(C)c1=O 1323419814 QOBKAQPDYOVCTH-UHFFFAOYSA-N 335.707 0.526 10 20 ECCD Cc1c(/C=C2\SC(N3CCOCC3)=NC2=O)c(C(=O)O)nn1C 1600009188 IIFKGQQEFWVAFM-YFHOEESVSA-N 336.373 0.729 10 20 ECCD CS(=O)(=O)C1(C(=O)NCc2cc(Cl)ccc2O)CCNCC1 1579330647 MPYLTKYWNPCLCA-UHFFFAOYSA-N 346.836 0.829 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCCCCS(C)(=O)=O 1349044637 BZOXKYCGENHZKU-UHFFFAOYSA-N 342.417 0.292 10 20 ECCD COc1cccc(CNC(=O)c2cnc3n(c2=O)CCS3)c1O 269218746 ZENVRUMXUXDWJI-UHFFFAOYSA-N 333.369 0.993 10 20 ECCD Cc1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)ncn1 803662557 XPDDLVYEJBEHDM-UHFFFAOYSA-N 345.378 0.923 10 20 ECCD COc1ccc(N2CC[C@H](CN3C(=O)[C@@H]4C[C@@H](O)CN4C3=O)C2)cc1 819176199 HVHFACDUGXBYKD-BJJXKVORSA-N 345.399 0.919 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)[C@H]3CNC(=O)N3)C2)cc1C 1019308699 DPYJOQLCLJRGOP-UONOGXRCSA-N 332.404 0.376 10 20 ECCD CSC[C@H](O)CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 849327192 QCMPDSWEMQTGSK-OAHLLOKOSA-N 344.502 0.735 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCCNCC1 842170078 ALXBCEUMZQBYMY-UHFFFAOYSA-N 328.416 0.501 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CC3(N)CC3)cc2)C1 852860275 AXEHCDFVKZAUKN-AWEZNQCLSA-N 330.432 0.886 10 20 ECCD CN(C[C@@H](O)C1CC1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 760808890 QWSNAAMSTHODEG-CYBMUJFWSA-N 328.390 0.607 10 20 ECCD O=C(Cc1nc[nH]n1)NCCC1=CCN(c2cc(F)ncn2)CC1 1089841192 CHYUVVSWBTVNKZ-UHFFFAOYSA-N 331.355 0.619 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3ccc[nH]3)C2)cc(OC)n1 996369697 ZEBMTRGUKIFXRG-UHFFFAOYSA-N 330.344 0.681 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@H]3CCN(C)C3=O)CC2)ncn1 1089853999 MOFDHJMVHCBFCC-OAHLLOKOSA-N 343.431 0.906 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nnn(C)c1C 1321361986 UIODLEBJIXFCJI-NSHDSACASA-N 348.359 0.439 10 20 ECCD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1ccc(N)cc1 1336117514 OJJSANSSNWVULB-CQSZACIVSA-N 325.434 0.394 10 20 ECCD COc1ccc(CNS(=O)(=O)c2c[nH]c(C(=O)O)c2)c(O)c1 1599572739 BJMVTKFVGMDSQI-UHFFFAOYSA-N 326.330 0.906 10 20 ECCD Cn1c(=O)ccn(CC(=O)NCc2c(O)ccc3c2CCCC3)c1=O 75159949 SJKWDRZJNRGDAB-UHFFFAOYSA-N 343.383 0.448 10 20 ECCD Cc1ccc(C(=O)N2CCCC[C@@H]2CNS(C)(=O)=O)c(O)c1O 272817365 ODWLTZSIVWUMNP-LLVKDONJSA-N 342.417 0.950 10 20 ECCD O=C(/C=C/c1ccc(N2CCOCC2)cc1)N1CCOC[C@@H](O)C1 295744142 APZCCMSFZXXGRN-ZVVFDCPKSA-N 332.400 0.756 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNCCS(=O)(=O)N(C)C)c1O 290798238 FCJRLJXQKVQPEW-UHFFFAOYSA-N 333.366 0.290 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H](O)C1CC1 822759267 LZSPYTUHSPWQGV-HNNXBMFYSA-N 338.429 0.309 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)CCC(N)=O)cc2F)CC1 906603362 YOEDFRLUHUKQEN-UHFFFAOYSA-N 336.411 0.849 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H]3C(=O)O)nc12 737154532 CEYXWWBHVRHKBK-LLVKDONJSA-N 334.332 0.661 10 20 ECCD C[C@@H]1CCCN(CCNC(=O)C(=O)NCCc2ccc(N)cc2)C1 842175902 WXLDTVSZVJUDIR-CQSZACIVSA-N 332.448 0.776 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CSCN3)cc2)CC1 843500683 YOSMEYMASBHZCD-MRXNPFEDSA-N 348.472 0.634 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NOC[C@H]2CCOC2)cc1F 1117135019 UKMVEQMSDGDCQS-LBPRGKRZSA-N 339.367 0.592 10 20 ECCD COCC(=O)N1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 941155500 ZPSUWJUJPWYBGI-GFCCVEGCSA-N 333.348 0.826 10 20 ECCD COCCN(Cc1ccc(N2CCN(C)CC2)cc1)[C@@H](C)C(N)=O 775680517 FWAMRHCSZFGACP-HNNXBMFYSA-N 334.464 0.761 10 20 ECCD COc1ccc(CNC(=O)C(=O)Nc2c(C)ccn(C)c2=O)c(O)c1 797389297 ZEMBSXXTPDYMID-UHFFFAOYSA-N 345.355 0.663 10 20 ECCD CNC(=O)NCC(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089867597 OZMIFVXTQZZFAF-UHFFFAOYSA-N 336.371 0.188 10 20 ECCD Nc1ccc(CC(=O)N2CCC(C(=O)N3CCOCC3)CC2)cc1 1326310588 FPNGUQXKJIOOFF-UHFFFAOYSA-N 331.416 0.909 10 20 ECCD Cn1cc(N2CCN(C(=O)NCc3ccc(N)cc3)CC2=O)cn1 1262603730 SWHRVDSWYAZWQS-UHFFFAOYSA-N 328.376 0.561 10 20 ECCD C[C@H](NCCS(=O)(=O)N(C)C)c1cccc(-c2nn[nH]n2)c1O 1589964084 RGEPGJMTCCWDIF-VIFPVBQESA-N 340.409 0.114 10 20 ECCD CN(C)CCNC(=O)Cn1cc(NC(=O)Cc2ccc(N)cc2)cn1 262671114 OISZAJUOTOSDHV-UHFFFAOYSA-N 344.419 0.324 10 20 ECCD CNC(=O)CCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 299019862 WOXUGYBWANUYTF-UHFFFAOYSA-N 338.383 0.598 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1cnnn1C 807614241 CPVSPOWJHDVUBY-UHFFFAOYSA-N 344.419 0.993 10 20 ECCD O=C(Cn1ccc(O)nc1=O)NCCCSc1nccs1 733880315 GXCJYCWUPJQOPV-UHFFFAOYSA-N 326.403 0.704 10 20 ECCD NC[C@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 842213786 MSWLBYRQESRUOM-INIZCTEOSA-N 330.432 0.757 10 20 ECCD C[C@@H](N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 1019854333 XSFVABUNHKFDFB-SKDRFNHKSA-N 332.364 0.527 10 20 ECCD CN1CCN(CC2CN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)CC1 854644259 LFNXZYZFYPGJAQ-HWKANZROSA-N 331.416 0.817 10 20 ECCD Cn1cc(N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2=O)cn1 768464442 RINQJWUEFFXIAQ-OAHLLOKOSA-N 344.371 0.400 10 20 ECCD C[C@H](C[S@](C)=O)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 768451404 UOPOLBBHEYVSNY-BTKVJGODSA-N 348.446 0.603 10 20 ECCD COc1ccc(O)c([C@H](C)NCC2(O)CCS(=O)(=O)CC2)c1 1116477947 QTFYGBZFVLKDCF-NSHDSACASA-N 329.418 0.991 10 20 ECCD O=C(NCCS(=O)(=O)N1CCCC1)NCc1ccccc1O 892527382 ORNUTZFJWKSWRH-UHFFFAOYSA-N 327.406 0.617 10 20 ECCD Cc1nc(CN2CCN(Cc3cc4c(cc3O)OCO4)CC2)n[nH]1 895266775 NHERVJRCHJOHOA-UHFFFAOYSA-N 331.376 0.865 10 20 ECCD C[C@@H](C(N)=O)N1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@H](C)C1 1081025938 FIBSHRJLDCMALO-GBIKHYSHSA-N 346.391 0.773 10 20 ECCD Cc1nnc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)n1C 1322573460 DELJUGHSFVITLT-UHFFFAOYSA-N 344.419 0.464 10 20 ECCD Nc1ccc(CC(=O)N[C@H]2CCN(c3ccc4nncn4n3)C2)cc1 1580442735 HFIHDCTVKRWAOD-AWEZNQCLSA-N 337.387 0.644 10 20 ECCD COc1cccc(CNC(=O)c2cccn(CC(=O)O)c2=O)c1O 1594129832 RYABVYLVDRPIGB-UHFFFAOYSA-N 332.312 0.577 10 20 ECCD O=S1(=O)C[C@H](NCc2cc(F)ccc2O)[C@@H](N2CCOCC2)C1 272527499 ZEUROJSIJIYYLR-KBPBESRZSA-N 344.408 0.119 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNCc3cc[nH]n3)CC2)cc1 818957471 WFTRNTVCAULVQG-QGZVFWFLSA-N 345.447 0.691 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@H]2NCC[C@H]2C1 817917315 AXNAOCMSQTYWAO-DOTOQJQBSA-N 344.459 0.921 10 20 ECCD CN(C)CCN(C(=O)c1cc(O)cs1)[C@H]1CCS(=O)(=O)C1 829735576 FTBSTIFUBDAQSA-JTQLQIEISA-N 332.447 0.645 10 20 ECCD C[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC(=O)N1 823523852 KTYJLZWNKXPDEM-CYBMUJFWSA-N 346.431 0.678 10 20 ECCD CN(C)c1ccc([C@@H](CN2C(=O)[C@@H]3C[C@@H](O)CN3C2=O)N(C)C)cc1 900184637 CQWZMCMYFCHLSK-OWCLPIDISA-N 346.431 0.753 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(Cc3cnn(C)n3)C2)cc(OC)n1 1015104263 RKTUUCPHTAFHBP-GFCCVEGCSA-N 346.391 0.232 10 20 ECCD CC(=O)N[C@H]1CCCN(C(=O)COC(=O)c2cccc(O)c2O)C1 758572312 KBYCDSMXEKUUHM-NSHDSACASA-N 336.344 0.382 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)Cn3cnc(N)n3)C2)cc1 868955593 LOGRZNCKHIFBEC-GFCCVEGCSA-N 330.392 0.512 10 20 ECCD NC(=O)c1ncn(C2CCN(C(=O)Cc3ccc(N)cc3)CC2)c1N 1118200251 FYHLWZCBRFHVRX-UHFFFAOYSA-N 342.403 0.553 10 20 ECCD Nc1ncncc1CNC(=O)NCc1ccc(N2CCOCC2)cc1 771424770 YEPURUUGQYDWIR-UHFFFAOYSA-N 342.403 0.895 10 20 ECCD Cc1ccc(O)c(CNC(=O)NCCC(=O)N2CCN(C)CC2)c1 875068695 PQSUQQLSXIOJPU-UHFFFAOYSA-N 334.420 0.664 10 20 ECCD CN1CCN(c2ccc(CNC(=O)CCc3cnn[nH]3)cc2)CC1 881853339 RYMONRCZIIXADK-UHFFFAOYSA-N 328.420 0.806 10 20 ECCD CCN(CC)S(=O)(=O)N1CCN(Cc2ccc(N)cc2)CC1 1120263305 MYWJKJWCGRMVFY-UHFFFAOYSA-N 326.466 0.973 10 20 ECCD COc1ccc(CNC(=O)NCCS(=O)(=O)NC(C)C)c(O)c1 792915767 YKHNABJEXHBKAF-UHFFFAOYSA-N 345.421 0.528 10 20 ECCD C[C@@H](NC(=O)C(=O)N(C)[C@@H]1CCNC1=O)c1ccc(N(C)C)cc1 1325142071 PDXGXNPJEQDWAO-BXUZGUMPSA-N 332.404 0.277 10 20 ECCD O=S(=O)(NCc1ccc(O)cc1O)c1cccc(-c2nn[nH]n2)c1 1607067206 DWHGEAZNIQLXEP-UHFFFAOYSA-N 347.356 0.756 10 20 ECCD CC(C)(C)OC(=O)[C@]1(C(=O)N2Cc3cccc(O)c3C2)CNCCO1 1575150061 QCMGHMVOOJTPJA-GOSISDBHSA-N 348.399 0.935 10 20 ECCD COc1ncc(/C=C/C(=O)N(C)c2cc(-c3nn[nH]n3)ccn2)cn1 1591663232 LBFLNQUJYQAQNU-ONEGZZNKSA-N 338.331 0.737 10 20 ECCD Cc1cc(C(=O)NC(C(N)=O)C(N)=O)c(C)n1-c1cccc(Cl)c1 72028160 VKMQWAVXCHFWQV-UHFFFAOYSA-N 348.790 0.817 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H](N)C(C)C)CC2)cc1 269238642 AKWIIKHHBKMILF-QGZVFWFLSA-N 334.464 0.917 10 20 ECCD CN[C@@H]1CCCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 817919602 VEMYCCCVPUEWAR-OAHLLOKOSA-N 332.448 0.921 10 20 ECCD COC(=O)c1cnn(C)c1NC(=O)C(=O)N(C)Cc1ccccc1O 815398666 PYZROSFUSJULJK-UHFFFAOYSA-N 346.343 0.509 10 20 ECCD NC(=O)C1=NO[C@H](CNC(=O)NCc2cc(Cl)ccc2O)C1 845181370 IEFCNCLFOPJVHD-VIFPVBQESA-N 326.740 0.475 10 20 ECCD COC[C@@H](NC(=O)C(=O)NCCc1ccc(N)cc1)[C@H]1CCCO1 842173825 VGXJWZBWXTYSAF-HUUCEWRRSA-N 335.404 0.238 10 20 ECCD C[C@@H]1C[C@H](NC(=O)C(N)=O)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1012946913 DDMNFGRXLJOULS-KCJUWKMLSA-N 346.347 0.054 10 20 ECCD CN(C)C[C@@H]1NC(=O)N(Cc2ccc(N3CCC(O)CC3)cc2)C1=O 924997762 CQAUNEMKRQCGLT-INIZCTEOSA-N 346.431 0.630 10 20 ECCD Cc1ccc(O)c(CNC(=O)NC[C@H]2CCCN2S(C)(=O)=O)c1 858316274 QEXKZOZATJSEBN-CYBMUJFWSA-N 341.433 0.924 10 20 ECCD CCCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1024287134 HMPUUHYPPCFPEH-CHWSQXEVSA-N 347.375 0.951 10 20 ECCD CS(=O)(=O)N1CCC[C@H]1C(=O)NCCc1ccc(O)c(O)c1 768900424 JAVRIIKIXOTCNH-NSHDSACASA-N 328.390 0.181 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)CCCN2C(=O)CNC2=O)c1 768910509 GTLJCMNKFHFUCW-JTQLQIEISA-N 335.360 0.910 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CNCCO3)CC2)c(OC)c1 877227916 QLIDKYYDSQEABY-MRXNPFEDSA-N 335.404 0.341 10 20 ECCD CCN1CCOC[C@@H]1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 881852595 XCFMTNPDHAGWQH-GOSISDBHSA-N 346.475 0.775 10 20 ECCD CN1C[C@@H](NC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CC1=O 893460228 FBQYGPWMAUHOMG-GOEBONIOSA-N 347.463 0.885 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)N3CC[C@H]3CO)cc2)CC1 896518038 KBBFKAFFKOUMRZ-INIZCTEOSA-N 346.431 0.665 10 20 ECCD CS(=O)(=O)C1(C(=O)OCC(=O)c2ccc(O)c(O)c2)CCC1 796185122 HVWLSELCSXVOIL-UHFFFAOYSA-N 328.342 0.791 10 20 ECCD NC(=O)[C@H]1CC[C@H]1C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089854973 BGZKLWPQAYFAAH-QWHCGFSZSA-N 347.394 0.770 10 20 ECCD COc1ccc(CN[C@H](C)CNC(=O)CN2CCOCC2)cc1C 1752866141 NRNYEVVOAGOCTF-OAHLLOKOSA-N 335.448 0.930 10 20 ECCD NC1(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)COC1 1580144115 LCDAERFJVGRJFJ-UHFFFAOYSA-N 337.395 0.521 10 20 ECCD C[C@@H](N[C@@H]1CC(=O)N(C2CC2)C1)c1cccc(-c2nn[nH]n2)c1O 1589952432 TZSKZXHPDQJTRB-NXEZZACHSA-N 328.376 0.986 10 20 ECCD COc1cc(C(=O)N[C@H](C)CN(C)C(=O)[C@@H](C)OC)cc(OC)n1 1756435240 VBCHEUCUFZNIME-GHMZBOCLSA-N 339.392 0.710 10 20 ECCD CN(C[C@H](O)CN1CCOCC1)C(=O)/C=C/c1ccc(O)c(O)c1 272445819 NAMQIWMICFOKLH-KQIUPUNMSA-N 336.388 0.263 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)NC[C@H](C)N)C2)cc1 818676402 NMROYVNRYSJGMB-QWHCGFSZSA-N 334.420 0.101 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1 817109436 VOBYWAUBYPIZBR-CQSZACIVSA-N 345.399 0.836 10 20 ECCD CN(CCC(=O)O)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 817114181 HVDRVWUTOHSBIV-UHFFFAOYSA-N 331.372 0.612 10 20 ECCD CON(C)C(=O)CCNCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 818968614 VUCCSEGZVYWWOG-HNNXBMFYSA-N 348.447 0.888 10 20 ECCD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccn(C)n1 838245251 KCEZKIJGZRFSLU-SECBINFHSA-N 338.389 0.988 10 20 ECCD COC(=O)CNC(=O)[C@@H]1CCCN1C(=O)c1ccc(C)c(O)c1O 841461090 QAWFIRGEPCRKCH-NSHDSACASA-N 336.344 0.300 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC[C@@H]1CCNC1 842153232 MQKDHPOHXRCBAP-AWEZNQCLSA-N 332.448 0.793 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)NCCS(C)(=O)=O)cc1 844528515 LDUQPYCECWVQMV-UHFFFAOYSA-N 343.449 0.817 10 20 ECCD CCOc1ccc(N2CCN(C(=O)[C@@H]3OCCN(C)C3=O)CC2)cc1 1119598565 QKBXKDGLFXZRDC-MRXNPFEDSA-N 347.415 0.591 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN1S(C)(=O)=O 773747553 BDXAWBZSLLVMAI-ZYHUDNBSSA-N 342.417 0.569 10 20 ECCD C[C@H]1C[C@@H]1C(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089802853 ZLJAAUCZWAUJDK-AAEUAGOBSA-N 327.392 0.818 10 20 ECCD COc1ccc(N2CCN(C(=O)C(=O)N(C)OC)CC2)c(OC)c1 1261855571 YUFPIGSJGCPHFY-UHFFFAOYSA-N 337.376 0.372 10 20 ECCD NCc1cc(O)nc(CNCc2ccc(N3CCC(O)CC3)cc2)n1 1580336835 QROGLFGTAJXOCW-UHFFFAOYSA-N 343.431 0.892 10 20 ECCD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)N1CCCC1 264141456 BHQLOZWZZZXOOS-UHFFFAOYSA-N 325.434 0.953 10 20 ECCD Cn1ccc(N2CCC[C@@H](NC(=O)c3cccc(O)c3O)C2=O)n1 279076903 DQPNIZFLRPVHRG-LLVKDONJSA-N 330.344 0.757 10 20 ECCD O=C(Nc1ccnn1[C@H]1CCS(=O)(=O)C1)c1cccc(O)c1O 275082946 FEBFXXVGSWBUQX-VIFPVBQESA-N 337.357 0.906 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)[C@@H](C)CN1 842147268 CZFCMNUVDMTGLP-RYUDHWBXSA-N 336.411 0.717 10 20 ECCD C[C@H](NCC1(O)CCS(=O)(=O)CC1)c1cc([N+](=O)[O-])ccc1O 756610415 VJZIWMVKZWLQFF-JTQLQIEISA-N 344.389 0.891 10 20 ECCD CC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NC 857531491 IFMLIVWBBCHHSB-JTQLQIEISA-N 329.378 0.018 10 20 ECCD COc1ccc(N2CCN(C(=O)C(=O)NCC(F)F)CC2)cc1 767415009 LWAZXVNRLNLURC-UHFFFAOYSA-N 327.331 0.725 10 20 ECCD C[C@@H](NCCN1CCN(S(C)(=O)=O)CC1)c1c(O)cccc1F 886523184 YIABMJVXOJUAEJ-GFCCVEGCSA-N 345.440 0.759 10 20 ECCD COc1ccc(-n2nnnc2CNCCCNC(=O)C(F)F)cc1 1154051978 KGCMRQVWKGGBRC-UHFFFAOYSA-N 340.334 0.532 10 20 ECCD C[C@H](NC(=O)C(=O)N1C[C@H]2C[C@@]2(CO)C1)c1ccc(N(C)C)cc1 1329313075 XHVNUZNTYUHLPS-WRSAYESZSA-N 331.416 0.771 10 20 ECCD CN(C(=O)NCc1ccc(N)cc1)C1CCN(S(C)(=O)=O)CC1 1335726691 VSUJAXLAYLFKHQ-UHFFFAOYSA-N 340.449 0.834 10 20 ECCD CC[C@@H]1C[C@H]1NC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1331782040 FNWWZTMIQVFVRH-NVXWUHKLSA-N 344.459 0.969 10 20 ECCD CCn1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)nn1 1350767828 NYAGVIOLGKQLLE-UHFFFAOYSA-N 344.419 0.605 10 20 ECCD Cc1ccc(O)c(CNC(=O)Nc2nn(C)cc2-c2nn[nH]n2)c1 1605875363 DXGKDHXBBASQRZ-UHFFFAOYSA-N 328.336 0.936 10 20 ECCD C[C@@](O)(CNCc1ccc(N2CCOCC2)c(F)c1)CC(=O)O 1776461503 LFONZOJHCPRSRT-INIZCTEOSA-N 326.368 0.978 10 20 ECCD O=C1CO[C@@H]2CCN(Cc3ccc(N4CCOCC4)cc3)C[C@H]2N1 377225404 QJRSXXZNRWLUOZ-IAGOWNOFSA-N 331.416 0.613 10 20 ECCD CO[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 294589364 OJEQMLVQTHYZJM-CYBMUJFWSA-N 328.390 0.919 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1CN(S(C)(=O)=O)C1 900400270 LQZHUXJRKCFOHJ-UHFFFAOYSA-N 339.461 0.993 10 20 ECCD COc1cccc(CNC(=O)CN(C)c2ncnc3[nH]cnc23)c1O 732284592 YYESJGPUZKMILY-UHFFFAOYSA-N 342.359 0.820 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)CCN2C(=O)CCC2=O)cc1 832293147 QGXDQRXDBDSWIM-CQSZACIVSA-N 332.404 0.408 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)Cn3ncnn3)C2)cc1C 1018850752 DMIPQSFHWJSCKI-AWEZNQCLSA-N 330.392 0.381 10 20 ECCD CC[C@@H](NC)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 852790448 QKHNJGMPCVJROS-OAHLLOKOSA-N 339.461 0.536 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)c1cnc2nc(O)nc(O)c2c1 762263931 MSJUPTQYDAWQMR-UHFFFAOYSA-N 342.311 0.820 10 20 ECCD COc1cc(CN2CCN(C(=O)C(=O)NC(C)C)CC2)c(O)cc1C 768441278 FYHINTHZEAWZOG-UHFFFAOYSA-N 349.431 0.878 10 20 ECCD CN1CCN(c2ccc([C@@H]3NC(=O)[C@@H]4CSCCN43)cc2)CC1 771518722 VPEBVXNCULGMSH-JKSUJKDBSA-N 332.473 0.984 10 20 ECCD CCONC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 778222900 DGYGULWEBYLOKO-CMDGGOBGSA-N 333.388 0.968 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NCC[S@@](C)=O)cc1 788969155 ZUINONMIIAMYMO-HSZRJFAPSA-N 339.461 0.644 10 20 ECCD C[C@H]1C[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1332795149 DBPIXGJDZXXKMJ-HOCLYGCPSA-N 344.459 0.827 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NOC[C@@H]3CCOC3)ccc21 1341103372 JKACXRZRRJHXPM-CQSZACIVSA-N 347.415 0.770 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)c1ccc(-c2nn[nH]n2)c(O)c1 1609550827 HPGSMXKKTJSGSL-UHFFFAOYSA-N 341.327 0.956 10 20 ECCD NC(=O)C1(O)CCN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])CC1 1610635318 QYPIJIBHARWANX-DUXPYHPUSA-N 335.316 0.509 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@]3(C)CCNC3)CC2)cc1 269241293 BKAPWCMKNVUIEI-LJQANCHMSA-N 346.475 0.933 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNCC2(O)CCN(C)CC2)c1O 278487323 KQMNNJUNAKBRNV-UHFFFAOYSA-N 325.365 0.855 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](O)C(C)C)cc2)CC1 293059257 XENGQCNEZANGSJ-KRWDZBQOSA-N 333.432 0.988 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1CC[C@H](CO)C1 817861737 LCZTUFVDJYUFRG-GJZGRUSLSA-N 347.459 0.949 10 20 ECCD C[C@@H](O)CN(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 830620166 QAMGIAKJNXZVMV-CYBMUJFWSA-N 349.431 0.103 10 20 ECCD COC(=O)CNC(=O)COC(=O)c1cc(C)n(-c2ccccn2)c1C 914908185 XWVVAWLXCHXBKM-UHFFFAOYSA-N 345.355 0.935 10 20 ECCD CC(C)NS(=O)(=O)CCNC(=O)NCCc1ccc(N)cc1 841755808 MLFAZSHOUHMAAE-UHFFFAOYSA-N 328.438 0.438 10 20 ECCD CN(C)CCn1cc(NC(=O)C(=O)NCCc2ccc(N)cc2)cn1 846320931 PAXZWKWQSSQCEK-UHFFFAOYSA-N 344.419 0.324 10 20 ECCD O=C(CO[C@H]1CCCNC1)NCc1ccc(N2CCOCC2)cc1 844171408 SLSNHKVIBBSJIM-KRWDZBQOSA-N 333.432 0.908 10 20 ECCD COc1cccc(CNC(=O)NCc2ccc(C(N)=O)nc2)c1O 753952817 CWDLDFORPLJGKX-UHFFFAOYSA-N 330.344 0.894 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@@H]3CCO[C@@H]3CN)cc2)CC1 1119316148 DARMAERGUFFNNC-IAGOWNOFSA-N 332.448 0.418 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(C(=O)[C@@H](C)OC)C2)cc(OC)n1 941654093 RWLFDBWUNPMVAZ-ZYHUDNBSSA-N 337.376 0.464 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1COCCO1 1116646972 TYQRRWXZUFRUGX-FZMZJTMJSA-N 339.344 0.104 10 20 ECCD C[C@@H]1CCCN1CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 773200255 SMUCOVJSWOJLPI-LLVKDONJSA-N 341.433 0.978 10 20 ECCD CC(=O)N[C@H]1COC2(C1)CN(C(=O)c1ccc(N=NC(N)=O)cc1)C2 965573136 BOFUZRMWQBASCX-CYBMUJFWSA-N 345.359 0.969 10 20 ECCD Cc1ncc(C)c(N2CC=C(CCNC(=O)[C@@H]3COC(=O)N3)CC2)n1 1089828636 GGCMNUZGHRWUAC-AWEZNQCLSA-N 345.403 0.845 10 20 ECCD COc1nc(C)cc(N2CC=C(CCNC(=O)CNC(N)=O)CC2)n1 1089804338 FFGNOQAJVPHLJU-UHFFFAOYSA-N 348.407 0.105 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)C[C@@H]3CCOC3)C2)cc(OC)n1 996369202 SNPPLVQNKOJEAO-NSHDSACASA-N 349.387 0.466 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H](C2OCCO2)C1 1334927674 ZERKMERHVUEYBD-CYBMUJFWSA-N 334.372 0.572 10 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20 ECCD CN1C(=O)CS/C1=C/C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 876507210 YBEWVRZRNXDHGQ-MJOIQJIUSA-N 334.445 0.915 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCc3cc[nH]n3)ccc21 774147848 FRILAYUUBFTZAI-UHFFFAOYSA-N 327.388 0.725 10 20 ECCD C[C@H](NC(=O)CN1CCS(=O)(=O)CC1)c1ccc(N(C)C)cc1 773002365 ZSSWZBOIIHEYTL-ZDUSSCGKSA-N 339.461 0.660 10 20 ECCD C[C@H]1CC(=O)NCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785424017 KKOUXYLHXYYGAL-LBPRGKRZSA-N 332.404 0.106 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNCC(C)(C)O)CC2)cc1 1120487946 MEJKRUREQPIAFC-INIZCTEOSA-N 337.464 0.539 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@@H]3CCCO3)C2)cc(OC)n1 996368379 MADQXAUFTBQMQP-LBPRGKRZSA-N 335.360 0.218 10 20 ECCD CCN1CC[C@@H](NCCNC(=O)c2ccc(N=NC(N)=O)cc2)C1=O 1153037196 GSCOCQFGEYLNLW-CYBMUJFWSA-N 346.391 0.789 10 20 ECCD COc1ccc(N2CCN(c3ncncc3-c3nn[nH]n3)CC2)cc1 1605295552 ZVBCGIYZIXMKKH-UHFFFAOYSA-N 338.375 0.992 10 20 ECCD C[C@@H](CC(=O)O)N1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 1609735414 ZUBPYVQPECFBCS-VIFPVBQESA-N 326.324 0.858 10 20 ECCD CC(F)(F)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249696 MQJSLUIIEFNNDH-UHFFFAOYSA-N 341.314 0.965 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)CNC(C)=O)cc2F)CC1 106702323 DXAHHCATERCCQI-UHFFFAOYSA-N 336.411 0.720 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(=O)n(C)n1 68535771 LDFAAYHGRKRNKT-UHFFFAOYSA-N 342.399 0.889 10 20 ECCD C[C@H](C(=O)NCc1ccccc1O)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 269165755 WTCZRKTYNINVAJ-WMESBKTJSA-N 344.367 0.559 10 20 ECCD CNS(=O)(=O)[C@H]1CCN(Cc2cc(OC)c(OC)cc2O)C1 371362186 YAFTXWQQQWGESH-NSHDSACASA-N 330.406 0.533 10 20 ECCD C[C@H]1C[C@H](CO)CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 817274325 JZKWWDGJQDBQAF-ZFWWWQNUSA-N 333.432 0.846 10 20 ECCD CCOC(=O)[C@@H](C)OC(=O)c1cc(NS(C)(=O)=O)ccc1O 725928189 WUFFBQVVXNHTKP-MRVPVSSYSA-N 331.346 0.872 10 20 ECCD O=C(CN1CCCS1(=O)=O)NCCCSc1nccs1 733972969 PWMRCNFGNMRKHA-UHFFFAOYSA-N 335.476 0.777 10 20 ECCD C[C@H](NC(=O)C(=O)N1C[C@@H]2CCNC[C@@H]2C1)c1ccc(N(C)C)cc1 911225113 BYSUZIAJYMAMDC-CWRNSKLLSA-N 344.459 0.998 10 20 ECCD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nc[nH]n1 748378673 IKSPNIZEDVUEOC-SSDOTTSWSA-N 325.350 0.373 10 20 ECCD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C(=O)O 848609495 FGFLJBZYJNEDES-LBPRGKRZSA-N 331.372 0.516 10 20 ECCD CN1CC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1=O 856212036 FSBJUTBSOFDTTR-INIZCTEOSA-N 331.416 0.742 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3CO)CC2)cc1 754021248 YMDULAZWHYWROT-MSOLQXFVSA-N 349.475 0.635 10 20 ECCD COc1ccc(N2CCN(C(=S)NCC(N)=O)CC2)c(OC)c1 865260250 MRZAHFOSLCVWPN-UHFFFAOYSA-N 338.433 0.186 10 20 ECCD COC(=O)C[C@H]1C(=O)NCCN1Cc1ccc(N2CCOCC2)cc1 768159149 BEVLGUHSFZJLNH-INIZCTEOSA-N 347.415 0.387 10 20 ECCD C[C@@H](NC(=O)NCC(=O)N1CCOCC1)c1ccc(N(C)C)cc1 773434449 BPRXIAGHNGXNJD-CYBMUJFWSA-N 334.420 0.972 10 20 ECCD CC(=O)c1cc(Cl)cc(CN2CCN3C(=O)NC(=O)[C@@H]3C2)c1O 778953613 PXFPWWOYYPOYTD-LBPRGKRZSA-N 337.763 0.984 10 20 ECCD COC(=O)CNC(=O)[C@H](C)N[C@H](C)c1ccc(N2CCOCC2)cc1 775253690 BMGHNDIWISKVNU-KGLIPLIRSA-N 349.431 0.852 10 20 ECCD 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COc1ccc(N2CC[C@H](NC(=O)NC[C@H](F)C(=O)O)C2)cc1 1599585691 HTYCRSFXCJBFQH-GWCFXTLKSA-N 325.340 0.996 10 20 ECCD C[C@H]1CN=C(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)S1 819778200 XWXUPWSQTFZELC-ZETCQYMHSA-N 329.403 0.985 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@H]2CCCCN2S(C)(=O)=O)c1 734017643 SXPGWRUTXJKVJP-CYBMUJFWSA-N 342.417 0.831 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3=COCC3)nc12 734188303 CBNWYXYIWGYZGH-UHFFFAOYSA-N 333.300 0.959 10 20 ECCD O=C(NCc1ccc(N2CCSCC2)cc1)N[C@@H]1COC[C@H]1O 837650823 CMVFEJDYWWEJDE-HUUCEWRRSA-N 337.445 0.799 10 20 ECCD COCCN(C)S(=O)(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 842786054 YRVYJUWNPURMFM-CQSZACIVSA-N 330.454 0.165 10 20 ECCD COC1CCN(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)CC1 849217985 LHOBUJXLWDJMJN-UHFFFAOYSA-N 330.362 0.858 10 20 ECCD Cc1ccc(C(=O)NC2CCN([C@H]3CCN(C)C3=O)CC2)c(O)c1O 843884710 FPQBQRVHTLSZBW-AWEZNQCLSA-N 347.415 0.831 10 20 ECCD C[C@@H]1CN(c2ccc(CNC(=O)C3(O)CNC3)cc2F)C[C@@H](C)O1 852859832 BMEIKHWOULOECO-VXGBXAGGSA-N 337.395 0.390 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)Cn3cnccc3=O)CC2)cc1 758222303 KDKJUQVZYANABJ-INIZCTEOSA-N 344.415 0.435 10 20 ECCD CNC(=O)CN1CC[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1029013797 HTTMKLXTPJRDEI-NSHDSACASA-N 346.391 0.647 10 20 ECCD CN1CC[C@@H](N2CCC(NC(=O)Cc3ccc(N)cc3)CC2)C1=O 877146821 VZZJSWKQVOLNQF-MRXNPFEDSA-N 330.432 0.623 10 20 ECCD CN1C(=O)CS/C1=C\C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 876507209 YBEWVRZRNXDHGQ-KHAFMBKQSA-N 334.445 0.915 10 20 ECCD COCCN(Cc1ccc(N2CCN(C)CC2)cc1)[C@H](C)C(N)=O 775680519 FWAMRHCSZFGACP-OAHLLOKOSA-N 334.464 0.761 10 20 ECCD NC(=O)C1=NO[C@@H](CNCc2ccc(N3CCOCC3)c(F)c2)C1 789562142 VTCJYZOZPGDAFV-GFCCVEGCSA-N 336.367 0.382 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CNCCN3C)CC2)c(OC)c1 1122189784 KEAOKBCARUABNW-INIZCTEOSA-N 348.447 0.256 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N[C@@H](CO)CCF)cc2)CC1 889660633 DKJKBXIIMKISTL-OAHLLOKOSA-N 338.427 0.958 10 20 ECCD COc1ccc(CNC(=O)N[C@@H]2CCCS(=O)(=O)C2)c(O)c1 793137313 MJUMPHXNUXPBDF-LLVKDONJSA-N 328.390 0.777 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)[C@@H]3CNC(=O)N3)[C@H]2C)cc1C 1074841922 CDXSRUIQPBAOPL-QEJZJMRPSA-N 346.431 0.764 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@@H]3CN(C)CCO3)CC2)nn1 1089823202 ABUFFYPYCXKDFV-INIZCTEOSA-N 345.447 0.758 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C)cn1 1324120193 ARZLCNKHKJYGRP-NSHDSACASA-N 333.344 0.736 10 20 ECCD Nc1ccc(CN2CCN(S(=O)(=O)Cc3ccon3)CC2)cc1 1337838257 MWRCRINEOBUSGZ-UHFFFAOYSA-N 336.417 0.904 10 20 ECCD Cc1ccc(C(=O)OCC(=O)N[C@H](C(=O)O)C(C)C)c(O)c1O 1610492072 OYVYZCMMRIUHCZ-NSHDSACASA-N 325.317 0.788 10 20 ECCD Cc1cc(C(=O)NC[C@H]2CC(C(N)=O)=NO2)c(C)n1-c1ccccn1 189867224 ONHRWBWSAJXOLQ-GFCCVEGCSA-N 341.371 0.849 10 20 ECCD CCc1cc(NC(=O)C(=O)NCc2cccc(OC)c2O)n(C)n1 265560047 NDIJIXGILNOUPY-UHFFFAOYSA-N 332.360 0.952 10 20 ECCD C[C@H](O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 283223224 OOSFHCRQCRPNPN-GOEBONIOSA-N 343.427 0.908 10 20 ECCD COC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCCO1 283336279 CXSOCASRGRMJLL-JKSUJKDBSA-N 349.431 0.679 10 20 ECCD O=C(O)CCCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 817109253 SNDCEXARXHCECJ-UHFFFAOYSA-N 333.388 0.884 10 20 ECCD NC(=O)CN1C(=O)/C(=C\c2ccc(-c3nn[nH]n3)o2)SC1=S 822868789 HMIAXQMXHJXCDH-XVNBXDOJSA-N 336.358 0.146 10 20 ECCD CC(=O)NCCN(C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823520811 ZEMVMBGNVZHYSS-UHFFFAOYSA-N 348.447 0.925 10 20 ECCD COc1ccc(N2CCN(C(=O)c3cn(C)c(=O)n3C)CC2)cc1F 900997048 DIEGHGNAZQIMIW-UHFFFAOYSA-N 348.378 0.834 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3cc(CO)on3)cc2)CC1 918847186 YZHDMTCRASILGM-UHFFFAOYSA-N 330.388 0.849 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H](O)C(C)(C)O)CC2)c(OC)c1 913482051 DIHSYAPVTFWLPG-HNNXBMFYSA-N 338.404 0.484 10 20 ECCD CNCCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 842230865 BIMYWKKQBJMVLC-CQSZACIVSA-N 335.404 0.235 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1[C@@H]2CNC[C@@H]21 841999771 KLLCPIBESLSACR-FVQHAEBGSA-N 330.432 0.882 10 20 ECCD CN1C(=O)C(=CNNc2cccc(C(F)(F)F)n2)C(=O)N(C)C1=O 740168205 SVZYLHTZAIMQAZ-UHFFFAOYSA-N 343.265 0.951 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3C(N)=O)cc2)CC1 918860913 GWZPQUJGPWFZFZ-INIZCTEOSA-N 345.447 0.598 10 20 ECCD CC[C@H](C)NC(=O)CN1CCN(C(=O)Cc2ccc(N)cc2)CC1 746306013 GLSZKRFWSAGHHR-AWEZNQCLSA-N 332.448 0.870 10 20 ECCD Cc1ccnc2nc(C(=O)NC[C@H](N)c3ccc(N(C)C)cc3)nn12 844163230 WATLKRHYPPCJDJ-AWEZNQCLSA-N 339.403 0.929 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)NCc2cnn(C)c2C)cc1 853007128 PTPBDNFMVJCGJQ-UHFFFAOYSA-N 346.387 0.945 10 20 ECCD CNS(=O)(=O)c1ccc(C(=O)NCc2ccc(O)c(O)c2)o1 768915015 QZLVPZQSECNGNN-UHFFFAOYSA-N 326.330 0.529 10 20 ECCD COc1ccc(O)c(CNC(=O)C(=O)Nc2cnn(CCF)c2)c1 861747377 QRQCPJRJNKIQNL-UHFFFAOYSA-N 336.323 0.822 10 20 ECCD CO[C@]1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCOC1 764454789 QAECHJASUSLMKF-AWEZNQCLSA-N 344.389 0.299 10 20 ECCD C[C@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)CCS(=O)(=O)C1 762161444 MMLBUHUQQRNVHU-IINYFYTJSA-N 327.402 0.685 10 20 ECCD O=C(NCc1ccccc1O)[C@@H](O)[C@@H](O)c1nc2ccccc2[nH]1 779815427 PZLFCGKXVQFIGM-CABCVRRESA-N 327.340 0.979 10 20 ECCD CON(C)C(=O)CNC(=O)NCc1ccc(N2CCN(C)CC2)cc1 883750228 CTVPANRUMPQIRQ-UHFFFAOYSA-N 349.435 0.257 10 20 ECCD CN1CC[C@@H](NC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C1=O 893116417 GLYJBZFRVHCFFR-HZPDHXFCSA-N 347.463 0.885 10 20 ECCD O=C1C[C@H](C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)CCN1 1089820657 IIBYNSZVZIJJTH-CYBMUJFWSA-N 347.394 0.785 10 20 ECCD Cc1nc(CNCCNC(=O)c2ccc(N=NC(N)=O)cc2)n[nH]1 1153048056 SBZXSPQZYZYUNW-UHFFFAOYSA-N 330.352 0.795 10 20 ECCD CC(C)(F)C(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089798293 ZUTNEWIWTQKYEC-UHFFFAOYSA-N 333.371 0.910 10 20 ECCD C[C@]1(CO)CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1324752008 NSOFXFTXTZSRAR-HNNXBMFYSA-N 342.417 0.998 10 20 ECCD COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H]2CCCNC2=O)cc1C 1755631937 NEGZAZDVWFLLBA-HUUCEWRRSA-N 349.431 0.097 10 20 ECCD CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1 1796137648 PDSUUCSSLYTXNO-QHBPRCKVSA-N 335.360 0.106 10 20 ECCD COC(=O)CCNC(=O)CN1CCN(c2ccc(OC)cc2)CC1 66863861 IKFWWAWQEAPMHM-UHFFFAOYSA-N 335.404 0.497 10 20 ECCD CNS(=O)(=O)CCNC(=O)NCc1ccc(N2CCCC2)cc1 187403937 SPTVHBVPRGRMCI-UHFFFAOYSA-N 340.449 0.635 10 20 ECCD COCCO[C@H]1C[C@H](CO)CN(Cc2cc3c(cc2O)OCO3)C1 278736378 QZDMCJUOWOWAHG-JSGCOSHPSA-N 339.388 0.967 10 20 ECCD CS(=O)(=O)N[C@H]1CCCC[C@H]1CNC(=O)c1cccc(O)c1O 287312391 NHEIWQSXVVYQMF-JQWIXIFHSA-N 342.417 0.936 10 20 ECCD Cc1nc2c(n1CCO)CC[C@@H](NC(=O)c1cccc(O)c1O)C2 846122552 WYFKAFMDPIFKTK-LLVKDONJSA-N 331.372 0.882 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](NC(=O)Cn3ncnn3)C2)cc1C 1022086268 OGZRJAMLTMKSHS-OKILXGFUSA-N 330.392 0.427 10 20 ECCD C[C@H](NC(=O)NCCN1CCNC(=O)C1)c1ccc(N(C)C)cc1 773613121 PBCKYFUGBHQGFD-ZDUSSCGKSA-N 333.436 0.545 10 20 ECCD CNC(=O)[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2C)CCO1 781940543 NCKSJIYBRUTGJW-HNNXBMFYSA-N 334.420 0.717 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCc2nn[nH]c2C1 788469886 RIQZDEAGGKRWBQ-UHFFFAOYSA-N 328.420 0.887 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3CCNC3=O)CC2)ncn1 1089854919 AHRDYUOLAFRJDZ-AWEZNQCLSA-N 329.404 0.564 10 20 ECCD C[C@@H](NC1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 999908481 WPLXHTZQHAIXOV-UHEGKEBESA-N 346.391 0.915 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](CC)CO 1350715923 KXKXHLQBKBAVML-NEPJUHHUSA-N 325.361 0.707 10 20 ECCD COC(=O)/C=C\c1ccc(N2C[C@H](O)C[C@H]2C(=O)O)c([N+](=O)[O-])c1 1610175098 HEJSGRGPQOWIQI-ZRIUIHNJSA-N 336.300 0.805 10 20 ECCD C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)CN[C@@H]1CCNC1=O 1753644229 BLERWRFKWYJAQD-ZWNOBZJWSA-N 346.391 0.693 10 20 ECCD COCCN1CC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 272215549 HAUYRJOACZSJKZ-UHFFFAOYSA-N 333.388 0.934 10 20 ECCD C[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)[C@H]1CO 806279104 FJOVGHYSJVFILY-MNOVXSKESA-N 343.474 0.971 10 20 ECCD COc1ccc(CNC(=O)NCCc2nnc(S)n2C)c(O)c1 820279413 UFBCXHOHTDWTDD-UHFFFAOYSA-N 337.405 0.860 10 20 ECCD CN1CCO[C@@H](C(=O)NCc2ccc(N3CCSCC3)cc2)C1=O 900254891 QUUAUABOWQIQPA-HNNXBMFYSA-N 349.456 0.713 10 20 ECCD O=C(O)Cn1cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cn1 833275402 XZIAFWZZWLVHDN-UHFFFAOYSA-N 341.301 0.172 10 20 ECCD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](O)C3CC3)CC2)cc1 730878462 ODHFESKLGAMCHG-QGZVFWFLSA-N 348.399 0.658 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](C(=O)O)C2CC2)c1 833737167 BXTVGNCTIDDTNV-LLVKDONJSA-N 328.346 0.357 10 20 ECCD O=C1CC(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)=NN1 837710003 ZXDWYJAGKRHBJK-UHFFFAOYSA-N 338.314 0.294 10 20 ECCD CN(C)c1ccc(CN2CCS(=O)(=NS(C)(=O)=O)CC2)cc1 846919136 YDGVEBHHHDQQAV-UHFFFAOYSA-N 345.490 0.996 10 20 ECCD C[C@@H](NC(=O)[C@H](N)CCN(C)C)c1ccc(N2CCOCC2)cc1 846672222 DMSJKKQWKVUANS-RHSMWYFYSA-N 334.464 0.979 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(CCn3cncn3)C2)cc(OC)n1 1015101490 GLDLALWKDTVVAR-ZDUSSCGKSA-N 346.391 0.195 10 20 ECCD CN1CC(=O)N(Cc2ccc(N3CCC(C(N)=O)CC3)cc2)C1=O 925133507 LTCYZKRBEOWEAF-UHFFFAOYSA-N 330.388 0.782 10 20 ECCD COCC[C@@H]1NC(=O)N(Cc2ccc(N3CCN(C)CC3)cc2)C1=O 925081104 YCYKHPGSFGSCKH-INIZCTEOSA-N 346.431 0.895 10 20 ECCD COc1ccc(N2CCN(CCCN[C@@H]3CNCCOC3)CC2)cc1 925522404 ZIUJBLCPYKCDKW-QGZVFWFLSA-N 348.491 0.785 10 20 ECCD 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C[C@H](NC(=O)C(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(N(C)C)cc1 817113207 ACASPMMCNCDOKG-WCQYABFASA-N 333.388 0.863 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCO[C@@H](CN)C1 817918432 JLOHUUJFFPLQSW-INIZCTEOSA-N 348.447 0.287 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)CN2CCCS2(=O)=O)c1 728983410 ZLGKDTBKHSITNO-JTQLQIEISA-N 328.390 0.614 10 20 ECCD COC[C@H](O)CNC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 823732905 JCYMPSHXOVRLAG-DZGCQCFKSA-N 337.420 0.828 10 20 ECCD CNC(=O)c1ccc(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)cn1 832273552 OQBPLDZGDBYKHS-OAHLLOKOSA-N 341.415 0.937 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H](C)N3C(=O)CCC3=O)CC2)cc1 914683932 RHZHBBWRYVMEJL-ZDUSSCGKSA-N 345.399 0.881 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H](C(N)=O)C2)c1 920432290 INRKNDHDRLJTNY-SECBINFHSA-N 341.389 0.101 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN[C@H]2CCCS(=O)(=O)C2)c1O 775026204 ZLFYSOFHMGNMQR-JTQLQIEISA-N 330.362 0.976 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1C[C@H]1F 1123826412 RTPFXKBYPWNXHD-ZIAGYGMSSA-N 326.393 0.896 10 20 ECCD Cc1ccc(C(=O)N2CCCC[C@@H]2CS(N)(=O)=O)c(O)c1O 780984628 NSAOZERRJCRLAS-SNVBAGLBSA-N 328.390 0.689 10 20 ECCD Cc1cc2[nH]c(=O)c(C(=O)OCC(=O)c3ccc(O)c(O)c3)cn2n1 783334350 CHPICQSJOWOVCU-UHFFFAOYSA-N 343.295 0.782 10 20 ECCD C[C@@]1(C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)CCNC1=O 1089865493 YPYWVOONUIIVSB-KRWDZBQOSA-N 347.394 0.785 10 20 ECCD O=C(NCCC1=CCN(c2ncnc3[nH]cnc23)CC1)c1cnon1 1089838055 KHWOHPYJMWYXTN-UHFFFAOYSA-N 340.347 0.693 10 20 ECCD NC(=O)CN[C@H]1C[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1086562457 RUDZJPKIZISXON-OTCDBFHCSA-N 332.364 0.432 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCC[C@@H]1C(=O)NC1CC1 1328318888 AYBSWZPFMTUBNW-CQSZACIVSA-N 345.399 0.620 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H]2NC(=O)CC[C@@H]2C1 1327316493 KLCOIYWVTNALGZ-TZMCWYRMSA-N 345.399 0.478 10 20 ECCD CC[C@@H](NC)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249738 SBUWMTBVOCSHLV-GFCCVEGCSA-N 348.403 0.308 10 20 ECCD COc1ccc(N2CCN(c3ccc4nnnn4n3)CC2)cc1F 84929213 PWXCASKCYYPZGC-UHFFFAOYSA-N 329.339 0.994 10 20 ECCD C[C@@H](C(=O)NC1CC1)N1CCN(C(=O)Cc2ccc(N)cc2)CC1 237492366 YALVZEJMNKOFIS-ZDUSSCGKSA-N 330.432 0.623 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cn[nH]c1 918336987 AFCSRTNLOBBVGX-UHFFFAOYSA-N 334.401 0.575 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](C)CN)CC2)cc1 841751065 WBYMBYSTOJQDIT-HNNXBMFYSA-N 349.479 0.711 10 20 ECCD COc1cc(C(=O)NC2CN([C@@H](C)c3n[nH]c(C)n3)C2)cc(OC)n1 1030614350 HPJZFESVHXGKDY-VIFPVBQESA-N 346.391 0.701 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1COCCN1 861802287 IFJQHYATVYXHKQ-OAHLLOKOSA-N 349.431 0.626 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)C[C@@]2(O)CCCNC2)N(C)C)cc1 1341622780 OQTLIDVRRQVFNW-MJGOQNOKSA-N 348.491 0.976 10 20 ECCD CN(C)c1ccc(CN[C@@H]2CC(=O)N(CCN3CCOCC3)C2)cc1 178904267 YVDXWIGCMMEDIL-QGZVFWFLSA-N 346.475 0.775 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC(C)(O)CC3)nc12 268497257 WPPBXPQIEFVVLU-UHFFFAOYSA-N 334.376 0.958 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)CN2CCCS2(=O)=O)c1 728983418 ZLGKDTBKHSITNO-SNVBAGLBSA-N 328.390 0.614 10 20 ECCD NCC[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 911158480 LCQSHOHSYXREQZ-MRXNPFEDSA-N 342.443 0.876 10 20 ECCD CN1CCN(C(=O)NCCCSc2nccs2)[C@@H](CN)C1 841858024 SGZVEVFEGRSLID-NSHDSACASA-N 329.495 0.910 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCc2nnnn2CC1 845931879 UIXLQICPOXDSQS-CMPLNLGQSA-N 331.376 0.784 10 20 ECCD NCC(F)(F)CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 842171153 PCLHPPWANUQGTQ-UHFFFAOYSA-N 338.358 0.389 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N(C)CCCN)cc1 852921214 KECOBKSJUAQXFQ-UHFFFAOYSA-N 336.436 0.397 10 20 ECCD Cc1nc(CC(=O)NCc2ccc(N3CCC(O)CC3)cc2)n[nH]1 856209693 XVKLLBGLCAYHMU-UHFFFAOYSA-N 329.404 0.933 10 20 ECCD C[C@H](NC(=O)[C@@H]1CSCC(=O)N1)c1ccc(N2CCOCC2)cc1 930744898 PHFCYKJYCYRDRT-WFASDCNBSA-N 349.456 0.932 10 20 ECCD CC(C)(C)OC(=O)NCc1nnnn1CC(=O)c1ccc(O)c(O)c1 769857781 UHPPUHVBWPFPJI-UHFFFAOYSA-N 349.347 0.992 10 20 ECCD CN1C(=O)CC[C@@H](NCc2ccc(N3CCC(O)CC3)cc2)C1=O 877598270 BQXZZUOJDCUEIX-MRXNPFEDSA-N 331.416 0.885 10 20 ECCD C[C@@]1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCN(C(=O)C(N)=O)C1 957141493 KZTIMJGOQHVDRZ-OAHLLOKOSA-N 346.347 0.055 10 20 ECCD C[C@H]1C[C@H](N)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 884566075 AJFAXQHNHGNSOF-ZFWWWQNUSA-N 328.416 0.627 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)C[C@@H](C)NC(N)=O)CC2)nn1 1089843321 CZUOJTKEUUIXHG-CYBMUJFWSA-N 346.435 0.875 10 20 ECCD CN1CCN(c2ccc(CN3CCC(O)(CN)CC3)cc2F)CC1 1327431102 MJHVTDHBQHJELH-UHFFFAOYSA-N 336.455 0.863 10 20 ECCD O=C(O)c1cnn2c(O)cc(CN3CCOC[C@@H]3[C@H]3CCCO3)nc12 1326511079 XTTDPQVPTDASBV-CHWSQXEVSA-N 348.359 0.513 10 20 ECCD CN(C)CC[C@H](N)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1330962136 ZNXAWIWLIVWJKX-KRWDZBQOSA-N 333.480 0.334 10 20 ECCD C[C@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@H]1CN(C)CCO1 1343130717 LGJVIKSDEGFFKI-SWLSCSKDSA-N 335.404 0.186 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H](N)CCS(C)(=O)=O 1353064031 QHYSDHYYQWUDSN-LBPRGKRZSA-N 341.433 0.240 10 20 ECCD CNC(=O)CN1CCC(NC(=O)NCc2ccc(N(C)C)cc2)CC1 27356069 XEPYNIXSBDYWML-UHFFFAOYSA-N 347.463 0.762 10 20 ECCD CN(C[C@@H]1CCC[C@@H]1O)C(=O)C(=O)NCc1ccc(N(C)C)cc1 283668261 YQRRSVHHIUBBHA-HOCLYGCPSA-N 333.432 0.988 10 20 ECCD O=C(NCc1ccccc1O)C(=O)Nc1cccc2c1CNC2=O 806879802 JVCJXIAVINHUOO-UHFFFAOYSA-N 325.324 0.891 10 20 ECCD NS(=O)(=O)c1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1 473123236 UMFITWUAMUVHJD-UHFFFAOYSA-N 336.369 0.718 10 20 ECCD NC(=O)CN1C(=O)/C(=C\c2ccc(-c3nn[nH]n3)cc2)SC1=S 737746493 ICESAJCNAWVUBJ-WEVVVXLNSA-N 346.397 0.553 10 20 ECCD COC[C@@](C)(O)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 837706605 GSTSNXGSAWJTMG-MRXNPFEDSA-N 344.358 0.815 10 20 ECCD CN(C)C(=O)O[C@H]1CCCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841135541 JDDQKWHURSDTHL-ZDUSSCGKSA-N 334.376 0.897 10 20 ECCD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C[C@H]1CN 842035130 CBPXFWYVISLMIZ-DZGCQCFKSA-N 332.448 0.812 10 20 ECCD CO[C@@H]1CS(=O)(=O)C[C@H]1NCc1cc(F)c(N(C)C)cc1F 858188646 HRHXBPGACOEVCH-TZMCWYRMSA-N 334.388 0.932 10 20 ECCD C[C@H](NC(=O)C(=O)NC[C@H]1COCCN1)c1ccc(N(C)C)cc1 861765905 AQEKTCCTPQQBSG-JSGCOSHPSA-N 334.420 0.034 10 20 ECCD COC[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)C[C@H](C)O1 1117898519 YQTWHBIBCSFWAI-JSGCOSHPSA-N 336.388 0.613 10 20 ECCD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H](C)CN1C 770160767 CEVJALXEUAXDQE-QWRGUYRKSA-N 341.433 0.928 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N3CCNC(=O)C3)cc2)CC1 889673446 GFUZANBTDMKIMI-UHFFFAOYSA-N 331.420 0.080 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC([C@H]3CCOC3)C2)c1 792613547 NXZTWOGBMHPPCW-JTQLQIEISA-N 340.401 0.872 10 20 ECCD COc1ccc(CNC(=O)[C@H](NS(C)(=O)=O)C(C)C)c(O)c1 794376398 DYXGNUJNVUZWDI-CYBMUJFWSA-N 330.406 0.591 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)c3cnon3)CC2)nc(CO)n1 1089838592 UODRINBKHILYJW-UHFFFAOYSA-N 344.375 0.617 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCC(OCC(N)=O)CC2)cc1 1318808988 HUXXFEVXTOVIRC-UHFFFAOYSA-N 334.420 0.929 10 20 ECCD Cc1noc(CCCNC(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 1321420427 RYDSKNQZBGLCTK-UHFFFAOYSA-N 345.403 0.809 10 20 ECCD NC(=O)[C@@H]1CCCCN1C(=O)CSc1ncc(C(=O)O)s1 1601144150 DWRHHJHVJYHIBH-ZETCQYMHSA-N 329.403 0.800 10 20 ECCD CN1CCN(CCN(CC(=O)O)Cc2cccc(F)c2O)CC1 1598616435 GOPKSQGINWKZJD-UHFFFAOYSA-N 325.384 0.665 10 20 ECCD O=C1NC[C@@H]2CN(Cc3c(O)ccc(Cl)c3F)CCN2C1=O 191437293 LNHCMQUGYWQQMN-MRVPVSSYSA-N 327.743 0.327 10 20 ECCD COc1ccc(CNC(=O)Cn2nc3n(c2=O)CCCCC3)c(O)c1 373691560 ARXLZMCZRQRIJY-UHFFFAOYSA-N 346.387 0.802 10 20 ECCD CC(C)(N)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 842257461 JYIFRCKMAIMYPO-AWEZNQCLSA-N 349.431 0.753 10 20 ECCD CN(C)[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 919819707 YPJVNLIOSHWLNJ-ZDUSSCGKSA-N 341.433 0.834 10 20 ECCD COc1ccc(CNC(=O)C2=C(C)N(C)c3nnnn3[C@@H]2C)c(O)c1 848022553 CRZMIVWURVBWAS-SNVBAGLBSA-N 344.375 0.989 10 20 ECCD COc1cccc(CNC(=O)N[C@H]2CCCS(=O)(=O)C2)c1O 758657490 KROJDXOIVXIOFJ-NSHDSACASA-N 328.390 0.777 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCN3C(=O)CC[C@@H]3C2)cc1 766267745 ADZVERFURHGEFY-MRXNPFEDSA-N 330.432 0.675 10 20 ECCD CN(C)CCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 762421448 BGNXQRHALBMUCM-HNNXBMFYSA-N 347.463 0.749 10 20 ECCD Cc1cccc(O)c1CN[C@@H]1CC(=O)N(CCN2CCOCC2)C1 877152388 MMOYJYSRBHNJHX-OAHLLOKOSA-N 333.432 0.723 10 20 ECCD COc1ccc(CNC[C@H]2CN(C(=O)c3nc[nH]n3)CCO2)cc1C 1051871984 CRGORUQZJHQQNK-AWEZNQCLSA-N 345.403 0.753 10 20 ECCD CCOCCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 786822559 ATAUDJBKHPWGMG-AWEZNQCLSA-N 349.431 0.853 10 20 ECCD Cc1ccc(CN2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c(O)c1 894978003 CDCPSGXGGZDINE-UHFFFAOYSA-N 336.417 0.930 10 20 ECCD CC(C)C(=O)N1C[C@H](O)[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 967588480 WEOMGXLASPRVNC-OLZOCXBDSA-N 347.375 0.807 10 20 ECCD O=C(Cn1nccn1)NCCC1=CCN(c2cnc(F)cn2)CC1 1089843249 AUKRIEWXQMXHJP-UHFFFAOYSA-N 331.355 0.550 10 20 ECCD CN1CC[C@H](C(=O)NCCC2=CCN(c3nccnc3F)CC2)C1=O 1089853690 HPMPOKZNOJYKHK-CYBMUJFWSA-N 347.394 0.737 10 20 ECCD O=C(NCCC1=CCN(c2cccc(F)n2)CC1)[C@@H]1CCNC1=O 1089855397 JDZZXAPFDSWFSQ-ZDUSSCGKSA-N 332.379 1.000 10 20 ECCD C[C@H](C(=O)NC1CC1)N1CCN(C(=O)NCc2ccc(N)cc2)CC1 1336290004 FQFVMCOYWBJZOD-CYBMUJFWSA-N 345.447 0.763 10 20 ECCD 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0.167 10 20 ECCD COc1nc(C)cc(N2CC=C(CCNC(=O)CC(N)=O)CC2)n1 1089822153 RDDHBPZAMWOUNB-UHFFFAOYSA-N 333.392 0.312 10 20 ECCD CC(C)CNC(=O)CNCCNC(=O)c1ccc(N=NC(N)=O)cc1 1153037259 JMRSASJXMAONRF-UHFFFAOYSA-N 348.407 0.941 10 20 ECCD COc1ccc(CNCCCNC(=O)c2cn(C)c(=O)n2C)cc1C 1177108375 VLVUSDYDIZMKSA-UHFFFAOYSA-N 346.431 0.951 10 20 ECCD COc1ccc(N2CCN(C(=O)C(=O)N3CC(F)C3)CC2)cc1F 1325496498 HZAARUIVVHEFKX-UHFFFAOYSA-N 339.342 0.663 10 20 ECCD COc1ccc(CNC(=O)N[C@@H](C)[C@@H]2CN(C)CCN2C)c(O)c1 1347183900 BQFCSXLGTJIALZ-WFASDCNBSA-N 336.436 0.834 10 20 ECCD CC1(C)NC(=O)N(CCCNC(=O)NCc2ccccc2O)C1=O 1342018642 MRSXVIUQFOYIBU-UHFFFAOYSA-N 334.376 0.912 10 20 ECCD COc1ccc(N2CC[C@@H](NC(=O)c3cnnn3C3CNC3)C2)cc1 1579224504 MBXFCKJYAXCVKM-GFCCVEGCSA-N 342.403 0.440 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C12CC(CN1)C2 1578026402 USWVZBIRSRNURF-JKGQDXBKSA-N 334.372 0.440 10 20 ECCD COC[C@]1(C(=O)O)CN(Cc2cc(OC)c(OC)cc2O)CCO1 1593983435 IFUCGQGFCVNTMC-INIZCTEOSA-N 341.360 0.711 10 20 ECCD CC(=O)N[C@@]1(CO)CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1055676291 CMCKWBVZJPVMBO-INIZCTEOSA-N 347.375 0.952 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNCCS(=O)(=O)NC(C)C)c1O 278844837 KNRMQWPOCBLCMR-UHFFFAOYSA-N 347.393 0.726 10 20 ECCD CN(C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CC1 283790079 GLOJRUASKWFSTO-UHFFFAOYSA-N 335.379 0.899 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)CS(C)(=O)=O)C2)cc1 819582324 KKIIEKBIHOOVEG-GFCCVEGCSA-N 326.418 0.682 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CCNC(=O)[C@@H]1CCCN1 825942871 NHNSNEIQKZNVJG-INIZCTEOSA-N 332.448 0.969 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCNC3=O)cc2)C1 822937664 JURIRSMNWLRKFC-ZFWWWQNUSA-N 344.415 0.141 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)CCC(N)=O)CC2)cc1 906434095 LCPPQEVTXSDXNE-UHFFFAOYSA-N 334.420 0.199 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NCC(F)F)cc1 846441609 AQAHRMSZFYNZMY-UHFFFAOYSA-N 329.347 0.971 10 20 ECCD COc1cccc([C@H](C)NCCS(=O)(=O)N2CCOCC2)c1O 846149845 RMXNTTBVOOIYIE-LBPRGKRZSA-N 344.433 0.713 10 20 ECCD COCCNCCNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 842152249 FMMJIFPBUSPLOO-UHFFFAOYSA-N 336.436 0.029 10 20 ECCD CN1CCO[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 856211379 NWTNILZAEXISAY-KRWDZBQOSA-N 333.432 0.595 10 20 ECCD COc1ccc(N2CCCN(C(=O)[C@@H]3CSCC(=O)N3)CC2)cc1 930310040 QYUYQMIOIIZOIJ-HNNXBMFYSA-N 349.456 0.966 10 20 ECCD COc1cccc(CNC(=O)[C@H]2CCCN2C(=O)CNC(C)=O)c1O 769499394 YQIFUUOVXANEPI-CYBMUJFWSA-N 349.387 0.144 10 20 ECCD O=C1[C@@H]2[C@H](O)CCCN2C(=O)N1Cc1ccc(N2CCOCC2)cc1 761070529 VLXDPDMPRZMTOA-CVEARBPZSA-N 345.399 0.811 10 20 ECCD CNC(=O)CCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 769842952 STSGUFOMPDVUFY-UHFFFAOYSA-N 329.378 0.020 10 20 ECCD CCN[C@@H](C)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 876909964 NWGPJPYILMCZDI-AWEZNQCLSA-N 332.448 0.969 10 20 ECCD CS(=O)(=O)N1CCC[C@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 782482265 IAYUZUGKZDDEPH-JTQLQIEISA-N 343.357 0.248 10 20 ECCD C[C@@H]1CCN(CC(N)=O)C[C@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 968684851 JVTMTWLUDDVNJO-ZWNOBZJWSA-N 346.391 0.775 10 20 ECCD CC(=O)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1O 991151790 PWXKIERJKVZPNE-STQMWFEESA-N 333.348 0.561 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C2CC(O)C2)C1 1841302277 QRXXMKFKHZFYAR-UHFFFAOYSA-N 347.371 0.081 10 20 ECCD CCN(CC)c1ccc(CN2CCN3C(=O)C(=O)NC[C@@H]3C2)cc1F 91866267 KAYGHWYNGZYBCL-CQSZACIVSA-N 348.422 0.815 10 20 ECCD O=C1NC(=O)C2(CCC(NCc3cc([N+](=O)[O-])ccc3O)CC2)N1 285536670 QFESSAQXPWBRRB-UHFFFAOYSA-N 334.332 0.911 10 20 ECCD O=C1NC(=S)NC(=O)C1=CNc1cc(C(=O)O)ccc1Cl 473087919 GNRPFXJPTRWGPE-UHFFFAOYSA-N 325.733 0.865 10 20 ECCD COc1cccc(CNC(=O)Cc2noc(C)c2-c2nn[nH]n2)c1O 826216307 SBMFQMQMFCPMCF-UHFFFAOYSA-N 344.331 0.736 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3C[C@H]3C(=O)O)nc12 737154640 GDWAUKRNXVVJTC-BDAKNGLRSA-N 349.299 0.376 10 20 ECCD CC(C)[C@H]1C(=O)NCCN1Cc1cc(O)n2ncc(C(=O)O)c2n1 737618164 ZHDNFFSTRUILEQ-LBPRGKRZSA-N 333.348 0.090 10 20 ECCD CN1CCN(c2ccc(CNC(=O)Cn3cccnc3=O)cc2)CC1 918884653 XJUWOZANYVPQBW-UHFFFAOYSA-N 341.415 0.312 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CC(=O)N1 831706780 LFFRARFTSZLWPL-SNVBAGLBSA-N 326.736 0.436 10 20 ECCD CCNCCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 841725544 MKPZBLMZNHEJKK-OAHLLOKOSA-N 347.463 0.797 10 20 ECCD Cc1nc(CC(=O)NCc2ccc(N3CCN(C)CC3)cc2)n[nH]1 918846028 PDULPHRIYFROFK-UHFFFAOYSA-N 328.420 0.724 10 20 ECCD NC[C@H]1OCC[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 852860792 VCAASGCVFYGFIS-QZTJIDSGSA-N 347.459 0.875 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3CC(=O)C3)nc12 769806880 YXWSXOMLMBAPEK-UHFFFAOYSA-N 333.300 0.634 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cccc(O)n2)c1 777462070 WEAQFRQJAOBNPH-UHFFFAOYSA-N 337.357 0.794 10 20 ECCD CCN(C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCNC1 887066281 IJWPCPYFHSNPSB-INIZCTEOSA-N 332.448 0.921 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@H]3COCCO3)cc2)CC1 883165341 CDUSIAVXSWJCQH-KRWDZBQOSA-N 348.447 0.653 10 20 ECCD COc1ccc(-n2nnnc2CN[C@H]2CN(C(C)=O)C[C@H]2C)cc1 1054304408 ZEJBGVDZIZQSCN-ABAIWWIYSA-N 330.392 0.627 10 20 ECCD CNS(=O)(=O)c1cc(NS(=O)(=O)N2CC[C@@H](C)C2)ccc1O 790407761 PQKVCWPQWWIMJZ-SECBINFHSA-N 349.434 0.299 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C(=O)N3CC(C)(C)C3)cc2)CC1 1333004130 NHXDTGLOPANXHK-UHFFFAOYSA-N 344.459 0.923 10 20 ECCD CO[C@@H]1CN[C@@](C)(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1333260022 XFTCTWPKOTWJKM-PKOBYXMFSA-N 346.475 0.822 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@H]3COC(=O)N3)C2)cc1C 1022036215 IIZPQDLLBNVBEA-HZSPNIEDSA-N 333.388 0.849 10 20 ECCD O=C1C[C@H](NCc2cc(F)ccc2O)CN1CCN1CCOCC1 180924345 KVBRUYKOLGDNLV-HNNXBMFYSA-N 337.395 0.554 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNC[C@H]3CCOC3)CC2)cc1 818976056 RVNDSVZTWXKKRW-SJLPKXTDSA-N 349.475 0.804 10 20 ECCD CC(C)[C@@H](N)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 827468843 DWFUZYGDYVDLNS-GDBMZVCRSA-N 332.448 0.988 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)Cn1cnc(-c2nn[nH]n2)n1 821109560 MDLVBEYRVHXCFS-UHFFFAOYSA-N 342.363 0.603 10 20 ECCD CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2cc(O)cs2)CC1 731911569 MARKNKYGAWSQFB-VIFPVBQESA-N 326.374 0.690 10 20 ECCD CC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCCC2)cc1)C(N)=O 740741714 PTXUCMUTKBRLJD-HNNXBMFYSA-N 332.404 0.283 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCC(OCCO)CC2)cc1 757131681 PVKBQIZPUNLVEM-UHFFFAOYSA-N 335.448 0.842 10 20 ECCD COC/C=C/C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 855396748 VSOGIRXTKQNNSG-NSCUHMNNSA-N 338.429 0.740 10 20 ECCD COC(=O)[C@](C)(CO)NCC(=O)N(C)Cc1ccc(N(C)C)cc1 852158663 YYUSHARRHUZAIA-KRWDZBQOSA-N 337.420 0.225 10 20 ECCD CC(C)N(CC(N)=O)C(=O)c1cc(NS(C)(=O)=O)ccc1O 769614984 NFPSBWKAVJEMBY-UHFFFAOYSA-N 329.378 0.100 10 20 ECCD C[C@@H]1COCCN1CCN1C(=O)CN(Cc2ccccc2O)C1=O 1119623903 GVXOMABMPLDCMS-CYBMUJFWSA-N 333.388 0.877 10 20 ECCD CN(C[C@@H](O)C(F)(F)F)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785432594 DTZOOSVTPXCQPL-GFCCVEGCSA-N 347.337 0.750 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C(=O)NC3CCC3)cc2)CC1 897478594 CDKURKSLFWUSHC-UHFFFAOYSA-N 330.432 0.723 10 20 ECCD CN(C)c1ccc(CNC(=O)NCc2nnc3n2CCOC3)cc1 790608047 SYMSWURWLOFJLJ-UHFFFAOYSA-N 330.392 0.874 10 20 ECCD COc1ccc(CNC(=O)CN(C)C(=O)[C@@H](C)n2cccn2)c(O)c1 794387770 LUZYMNBARSZTRF-GFCCVEGCSA-N 346.387 0.933 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)C(F)F)C2)cc(OC)n1 973766015 NEVNVIQCBRHYSB-DTORHVGOSA-N 329.303 0.741 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CC(=O)N(C)C1 1323296366 SCSONUIUULFEQX-CYBMUJFWSA-N 333.388 0.478 10 20 ECCD C[C@@H]1C[C@H](N)CN1C(=O)C(=O)NCCCSc1nccs1 1262065270 VUZMTMJNFLIIAA-ZJUUUORDSA-N 328.463 0.690 10 20 ECCD O=C(O)c1cn([C@H]2CCN(Cc3cc4c(cc3O)OC[C@H]4O)C2)nn1 1610858539 IRBOUUHCYDOHHM-IINYFYTJSA-N 346.343 0.555 10 20 ECCD O=C(NCc1c(O)cccc1O)[C@@H](O)c1ccc(-c2nn[nH]n2)cc1 1593119214 JPXZOUPFISDAQD-AWEZNQCLSA-N 341.327 0.628 10 20 ECCD CN1CCN(c2ccc(CN3CCC[C@@H](O)[C@@H]3C(=O)O)cc2)CC1 1598622798 ZNMNQCUZDVXEAX-IAGOWNOFSA-N 333.432 0.848 10 20 ECCD COc1ccc(N(C)CCNS(=O)(=O)c2cnn(C)c2)cc1F 121832950 NQBHGSPPWUSBCX-UHFFFAOYSA-N 342.396 0.983 10 20 ECCD CN(C)c1ccc(CNC(=O)NCCOCCS(C)(=O)=O)cc1 266532677 PLCCXOBJKMJWIQ-UHFFFAOYSA-N 343.449 0.613 10 20 ECCD CNC(=O)CN1CCC(NC(=O)/C=C/c2ccc(O)c(O)c2)CC1 272358999 BTQXNSJIRFFRIW-HWKANZROSA-N 333.388 0.438 10 20 ECCD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)[C@@H]1CO 285756975 QQCMZYLLTGJCPY-CXAGYDPISA-N 345.443 0.915 10 20 ECCD O=C(CN1CCN(Cc2cc3c(cc2O)OCO3)CC1)N1CCCC1 298877118 IUPXOQNPYOGSJS-UHFFFAOYSA-N 347.415 0.861 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@@H]2CNC[C@@H]2C1 817917727 DOPRULOJJQIZPB-IYBDPMFKSA-N 344.459 0.779 10 20 ECCD Cn1cc(C(=O)NCc2ccc(N3CCCC3)cc2)c(=O)n(C)c1=O 735037031 YVTGEYJSNGOYAE-UHFFFAOYSA-N 342.399 0.614 10 20 ECCD NC1(CNC(=O)C(=O)NCCCSc2nccs2)CCC1 842093669 SACPBZWMCFQLMU-UHFFFAOYSA-N 328.463 0.739 10 20 ECCD CN1CCC[C@@H]2CN(C(=O)C(=O)NCCc3ccc(N)cc3)CC[C@@H]21 842237662 XJOMJTQSMQZMOF-WBVHZDCISA-N 344.459 0.870 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)[C@@H](C)NS(C)(=O)=O)cc1 846446476 MBQIIMSOUKMPOD-GFCCVEGCSA-N 343.449 0.528 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1COCCN1 861802257 HNZHHQBPLPNCBL-AWEZNQCLSA-N 335.404 0.235 10 20 ECCD CN(CC(=O)NC1CCN(S(C)(=O)=O)CC1)c1ccc(N)cc1 866668418 QBHVGCFLWLPMPK-UHFFFAOYSA-N 340.449 0.245 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)CNC(=O)C2CC2)N(C)C)cc1 891252178 HVEKBGKKXPUZQZ-MRXNPFEDSA-N 332.448 0.998 10 20 ECCD CC[C@@H](OC)C(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089814434 FCQORFHPZIPMJJ-CYBMUJFWSA-N 345.407 0.587 10 20 ECCD CCO[C@H](C)C(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089810657 VEYVZJOPLKQSSF-GFCCVEGCSA-N 345.407 0.587 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)NOC[C@H]1CCOC1 1346325769 DDPYKBUKEHRJLD-JTQLQIEISA-N 345.446 0.826 10 20 ECCD COc1ccc(CNCCN(C)C(=O)CN2CCOCC2)cc1C 1753181842 XJDXZDBVVRAMSL-UHFFFAOYSA-N 335.448 0.884 10 20 ECCD C[C@H](NCCO)[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 1755448125 OEHGJFYNHVRYBQ-SMDDNHRTSA-N 349.391 0.660 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)c3nc[nH]n3)cc2)CC1 276273850 QLWRDHLXEJRRSF-UHFFFAOYSA-N 328.376 0.403 10 20 ECCD CC(C)NC(=O)CN(C)CC(=O)OCC(=O)c1ccc(O)c(O)c1 803694185 NRVFOHYZPZAZTO-UHFFFAOYSA-N 338.360 0.280 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ncn(C)n3)nc12 811358203 NLTKYHZEAJDLOW-UHFFFAOYSA-N 346.303 0.097 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCC[C@H]3CO)CC2)cc1 729543196 HTNLBXJIHOHPDQ-INIZCTEOSA-N 333.432 0.801 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)CNC3CC3)CC2)cc1 829500878 SHJKKZDDAYZDKY-UHFFFAOYSA-N 332.448 0.685 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCNC3=O)cc2)C1 822937661 JURIRSMNWLRKFC-DZGCQCFKSA-N 344.415 0.141 10 20 ECCD CN(C)CCN(CC(=O)N(C)C)Cc1ccc(N2CCOCC2)cc1 827158008 LWZJXQRVCPREFX-UHFFFAOYSA-N 348.491 0.975 10 20 ECCD CN(C)c1ccc(CN(C(=O)C(=O)NCC2(N)CC2)C2CC2)cc1 911502819 JBYNKBQOPDMWAM-UHFFFAOYSA-N 330.432 0.851 10 20 ECCD COC(=O)c1c[nH]nc1S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 912526506 LCRCSQULLCDZLT-UHFFFAOYSA-N 341.301 0.401 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)N3CCOC[C@H]3CO)C2)cc1 922951340 VVPRJEAAEYMDSH-GDBMZVCRSA-N 349.431 0.924 10 20 ECCD CCCNS(=O)(=O)NCc1ccc(N2CCC(O)CC2)cc1 851844425 XNCLHKFJIVPYEV-UHFFFAOYSA-N 327.450 0.982 10 20 ECCD O=C(CNC(=O)c1ccc(O)cc1)NCCc1ccc(O)c(O)c1 762275702 XXOVSAYMVACVLE-UHFFFAOYSA-N 330.340 0.892 10 20 ECCD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCNCC1 1118197778 BYJCSLFQJPWCFZ-INIZCTEOSA-N 333.432 0.805 10 20 ECCD CN1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H](CO)C1 879003604 NHPYASFZARDJPK-QGZVFWFLSA-N 334.464 0.319 10 20 ECCD COc1ccc(N2CCN(C(=O)c3cnn(C)n3)CC2)c(OC)c1 870166258 XRPQXUWVEIGYKN-UHFFFAOYSA-N 331.376 0.795 10 20 ECCD CC(=O)N1C[C@@H]2CN(CC(=O)NCc3ccc(N(C)C)cc3)C[C@@H]2C1 880310404 BBSKWLSGQAESEW-CALCHBBNSA-N 344.459 0.779 10 20 ECCD C[C@H](C(N)=O)N1C[C@H]2C(NC(=O)c3ccc(N=NC(N)=O)cc3)[C@@H]2C1 962978829 XNVHORGODOHOCK-GGZOMVNGSA-N 344.375 0.383 10 20 ECCD CN(C)CCNC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 891087035 JQNKMUPYROWSFD-UHFFFAOYSA-N 347.463 0.749 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3C[C@@]3(CO)C2)cc1F 1325971887 MXFDFHLCWCGJJD-SJCJKPOMSA-N 335.379 0.349 10 20 ECCD C[C@H](NC(=O)C(=O)N[C@H]1C[C@H](C(=O)O)C1)c1ccc(N(C)C)cc1 1337193545 YMSNLZKPMLNFKV-DRZSPHRISA-N 333.388 0.909 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCn1cnnn1 1332517132 ZPKGSEVUIACRBQ-UHFFFAOYSA-N 330.392 0.558 10 20 ECCD CO[C@H]1CN[C@](C)(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1333260020 XFTCTWPKOTWJKM-MJGOQNOKSA-N 346.475 0.822 10 20 ECCD COc1ccc(O)c(CN2CCN([C@@]3(C(=O)O)CCOC3)CC2)c1 1599599000 ZECCFBDCCXMWDM-KRWDZBQOSA-N 336.388 0.762 10 20 ECCD O=C(/C=C/c1ccc(N2CCOCC2)cc1)N[C@H]1CCC(=O)NC1 264540368 HISIPRPZCARRQP-MIOHMZDASA-N 329.400 0.931 10 20 ECCD CC1(C)[C@@H](O)C[C@@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 275238724 KKSDQPCCDBGATR-RYUDHWBXSA-N 328.390 0.653 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN2C(=O)OC[C@@H]2C1 370557700 LPLWXDQDQIOINJ-INIZCTEOSA-N 346.431 0.847 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCC2(C1)OCCO2)c1ccc(N(C)C)cc1 807672690 FZVBZWUIFVHXDI-ZDUSSCGKSA-N 347.415 0.905 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCSC[C@@H]2C(N)=O)cc1 299185832 AKRJHPJMKRQZNR-CQSZACIVSA-N 336.461 0.272 10 20 ECCD O=C(O)CCCNC(=O)C(=O)NCCCSc1nccs1 817110367 CLUQDAPFLMMHOZ-UHFFFAOYSA-N 331.419 0.723 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2(C(=O)O)CCCC2)c1 820894609 ZCHFAICOFCDWDM-UHFFFAOYSA-N 342.373 0.891 10 20 ECCD COCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 826602498 CYDMYZZYDBOTEL-UHFFFAOYSA-N 349.431 0.417 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2(O)CCOCC2)c1 748354540 GVBWVHBMTYKWBU-UHFFFAOYSA-N 344.389 0.035 10 20 ECCD C[C@H](CN)NC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 842254265 HEKQLKVACPURLT-GFCCVEGCSA-N 331.372 0.977 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cc(CON)nn3)CC2)cc1 881023289 JVCZBLHHMAUYIS-UHFFFAOYSA-N 346.391 0.026 10 20 ECCD C[C@@H](CC(N)=O)NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 899098860 UBOLIROKCFZNAU-SWLSCSKDSA-N 335.452 0.918 10 20 ECCD Cc1nc(CC(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)n[nH]1 1089831857 HKQLIOGXEAJADT-UHFFFAOYSA-N 345.382 0.928 10 20 ECCD COc1ccc(N2CCN(c3cc(=O)n(C)c(O)n3)CC2)cc1F 1337067221 VVRBWRCPEYTADB-UHFFFAOYSA-N 334.351 0.960 10 20 ECCD O=C(O)C[C@@H](CNCc1ccc(N2CCOCC2)c(F)c1)C(=O)O 1332032073 ZWNVXOVDRRRQOH-LBPRGKRZSA-N 340.351 0.927 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N(C)C3CC(O)C3)ccc21 1345515466 TYRZEPQNQAABCZ-UHFFFAOYSA-N 331.416 0.667 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CN2C(=O)CCC2=O)cc1 1346850625 XSPGAILQKMCHDT-UHFFFAOYSA-N 333.388 0.739 10 20 ECCD COc1ccc(CN[C@@H](CO)CNC(=O)c2[nH]nnc2C)cc1C 1755633799 DBSXLKSOFAXTCQ-CYBMUJFWSA-N 333.392 0.311 10 20 ECCD CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1 1787292125 XBLXGGXZODLTST-DRZSPHRISA-N 349.387 0.496 10 20 ECCD COC[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 266773881 QHZGTCBQAVSGOR-LLVKDONJSA-N 344.389 0.251 10 20 ECCD O=C(N[C@H]1CCOC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 804698959 XSZUCKKPDVNYOY-LSDHHAIUSA-N 348.399 0.805 10 20 ECCD COc1ccc(N2CCN(C(=O)CN(C)C(C)(C)C(N)=O)CC2)cc1 295568598 YNTGNXOWCQURJA-UHFFFAOYSA-N 348.447 0.540 10 20 ECCD C[C@@H]1CN=C(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)S1 819778199 XWXUPWSQTFZELC-SSDOTTSWSA-N 329.403 0.985 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCNC(N)=O 828519270 KHBDELYTMXQZPP-UHFFFAOYSA-N 343.767 0.606 10 20 ECCD CNC(=O)C1(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 730044137 UTSCQSGRJVQNET-UHFFFAOYSA-N 347.415 0.780 10 20 ECCD CN(C)c1ccc(CNC(=O)NC[C@@H](O)Cn2ccnn2)cc1F 838028459 GFCKSWVHKBRJDR-GFCCVEGCSA-N 336.371 0.344 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)C(=O)O)cc2)CC1 842690980 IOEPRGJZFKEBBS-LBPRGKRZSA-N 333.388 0.692 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCS(=O)(=O)C1 845929774 FNGUWSCETGHEEI-CMPLNLGQSA-N 327.402 0.970 10 20 ECCD CCN(CCN)C(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 863749808 BTCIQBNWNQAOJP-UHFFFAOYSA-N 348.447 0.541 10 20 ECCD C[C@@H]1CN2CCN1C[C@H]2C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 1121810576 YWTVMCQGWWKVIA-COXVUDFISA-N 331.464 0.257 10 20 ECCD NS(=O)(=O)[C@H]1CCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 785986641 VYGOYNYOUQAXGV-ZDUSSCGKSA-N 343.424 0.525 10 20 ECCD CN(Cc1ccccc1O)C(=O)NCCS(=O)(=O)N1CCCC1 897965839 XCUWUOBEBFBEIL-UHFFFAOYSA-N 341.433 0.959 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@H]3CC[C@@H]3C(N)=O)CC2)nn1 1089855674 NXNGMOALRYXCPK-GJZGRUSLSA-N 343.431 0.939 10 20 ECCD CNC[C@H](C)CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1326150070 AASUKKZWIXOQKM-ZDUSSCGKSA-N 332.448 0.657 10 20 ECCD C[C@H](NC(=O)C(=O)N1C[C@H]2C[C@]2(CO)C1)c1ccc(N(C)C)cc1 1329313073 XHVNUZNTYUHLPS-WPKBUWHJSA-N 331.416 0.771 10 20 ECCD CNC[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1325369593 JKDQHJYLVVBIHM-CQSZACIVSA-N 332.448 0.875 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](C(=O)O)[C@H]3C)nc12 1596744824 WPHYHLQOXBBEGT-KOLCDFICSA-N 348.359 0.907 10 20 ECCD CS(=O)(=O)NCCN(Cc1ccccc1O)C[C@@H]1CCCO1 109761745 PZNNFOPKHVHISL-AWEZNQCLSA-N 328.434 0.922 10 20 ECCD CS(=O)(=O)CCOCCNC(=O)/C=C/c1ccc(O)c(O)c1 272655593 NQPVOXSILMCFFZ-HWKANZROSA-N 329.374 0.288 10 20 ECCD Cn1nnc2c1C[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)CC2 811345938 VLKPJBRELFGUBW-JTQLQIEISA-N 331.328 0.757 10 20 ECCD C[C@H](OC(=O)c1cc(O)cs1)C(=O)N1CCC[C@@H](C(N)=O)C1 732352996 JVTBJPLEMRNWEY-DTWKUNHWSA-N 326.374 0.723 10 20 ECCD NC[C@H](NC(=O)C(=O)NCCCSc1nccs1)C1CC1 842093738 SJSVKTSEABILAE-JTQLQIEISA-N 328.463 0.595 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)[C@H](C)NS(C)(=O)=O)cc1 846446477 MBQIIMSOUKMPOD-LBPRGKRZSA-N 343.449 0.528 10 20 ECCD O=C1NC[C@@H]2CN(Cc3ccc(N4CCC(O)CC4)cc3)CCN12 876799753 KRZMOHIDHIYBCZ-MRXNPFEDSA-N 330.432 0.857 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCO)CC2)cc1 778221299 RRKPGASHFWMBOF-SREVYHEPSA-N 333.388 0.009 10 20 ECCD COC[C@H](C)S(=O)(=O)NCc1ccc(N2CCN(C)CC2)cc1 882664599 YGPAEIFLKIBMJL-AWEZNQCLSA-N 341.477 0.893 10 20 ECCD COc1ccc(CNC[C@@H]2CN(C(=O)CC(N)=O)CCO2)cc1C 1051506222 ZUCQQRNLPBAYJI-CQSZACIVSA-N 335.404 0.196 10 20 ECCD CC(=O)N[C@@H](C)C(=O)NCCC1=CCN(c2cc(C)ncn2)CC1 1089799616 LDQDYBKREWEYMY-ZDUSSCGKSA-N 331.420 0.952 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2CN(C(=O)c3cn[nH]c3)C2)cc1 994372275 GCPJHCWPZBUECH-UHFFFAOYSA-N 341.331 0.827 10 20 ECCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CC1)C2)c1cc(O)nc(O)c1 1796140023 AKZLQKYSRHONOR-JJLQDPRZSA-N 347.371 0.106 10 20 ECCD COc1cc(N2C[C@H](O)C[C@@H](C(=O)O)C2)c([N+](=O)[O-])cc1OC 401860253 QNODBCCICJHDAC-RKDXNWHRSA-N 326.305 0.884 10 20 ECCD NC(=O)[C@H]1CC[C@@H](CNC(=O)NCc2ccc(N3CC=CC3)cc2)O1 121818480 YGMVNHVCQGTEMB-JKSUJKDBSA-N 344.415 0.895 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC(=O)N1 297988170 ZTIPHSUMZJNRQF-LBPRGKRZSA-N 332.404 0.058 10 20 ECCD COc1cccc(CNC(=O)NCCc2nnc(S)n2C)c1O 820259787 JSOIRZARDLFYRB-UHFFFAOYSA-N 337.405 0.860 10 20 ECCD COc1ccc(N2CCC(NC(=O)[C@@H]3OCCN(C)C3=O)CC2)cc1 900508275 LTCIABWRFNEHJU-INIZCTEOSA-N 347.415 0.637 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H]3CCN3C)CC2)cc1 905547414 WPCLXBDJMXDIEU-ZWKOTPCHSA-N 348.491 0.472 10 20 ECCD COC(=O)CN(CCN1CCOCC1)C(=O)Cc1ccc(N)cc1 831916021 FWAQLGSMQGZBFL-UHFFFAOYSA-N 335.404 0.145 10 20 ECCD CCN(CC)c1ccc(CNC(=O)[C@H]2CCS(=O)(=O)N2)cc1F 845467831 JHNVFMPEVKJOTD-CYBMUJFWSA-N 343.424 0.980 10 20 ECCD C[C@H](N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 1019854332 XSFVABUNHKFDFB-CABZTGNLSA-N 332.364 0.527 10 20 ECCD COc1cc(Cl)cc(CN2CCN3C(=O)NC(=O)[C@H]3C2)c1O 761215646 HKZFYEQZBFCEPH-SNVBAGLBSA-N 325.752 0.790 10 20 ECCD CC[C@H](NC(C)=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 881854935 LZOPZSWQGFNXKH-KRWDZBQOSA-N 332.448 0.969 10 20 ECCD C[C@H](O)CN1C[C@H]2[C@H](NC(=O)c3ccc(N=NC(N)=O)cc3)[C@H]2C1 962970827 GYHHIBLQUDTVQH-OLRMPSLUSA-N 331.376 0.890 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N3CC[C@@H]4CNC[C@@H]43)cc2)CC1 892939088 GOQJURGUVOACJB-AEFFLSMTSA-N 343.475 0.942 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)C[C@@H]2C[C@H]2C)cc1 1133357240 VKHYUQCGKOEGMJ-OLZOCXBDSA-N 344.419 0.923 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)C[C@H](C)NC(N)=O)CC2)n1 1089844315 YXAGQOZBEFRDCP-LBPRGKRZSA-N 346.435 0.875 10 20 ECCD CN(C)C(=O)CC(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089867119 BIMUZMBOPZETCX-UHFFFAOYSA-N 335.383 0.737 10 20 ECCD O=[N+]([O-])c1ccc(O)c(CNCC2(O)CCS(=O)(=O)CC2)c1 1325683542 GIFGSPJNJJYEGT-UHFFFAOYSA-N 330.362 0.330 10 20 ECCD CCN(CC)c1ccc(CN(C)C(=O)C(=O)NCCCON)cc1 1335830299 UVOBQTZDZPAVFK-UHFFFAOYSA-N 336.436 0.888 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)c1cnn(CCO)c1 1348571343 YRRVKURGHNSZRS-UHFFFAOYSA-N 330.388 0.642 10 20 ECCD O=C(O)CNC(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(O)c(O)c1 1602064271 NJYVMLDHEHDZJD-VLWUPBBWSA-N 334.328 0.303 10 20 ECCD CN1C[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)CC1=O 267555336 DZHYGBAXHDECLP-AWEZNQCLSA-N 332.404 0.553 10 20 ECCD N[C@H]1CCN(C(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 817914934 CNCUOOZGQRVJTH-LSDHHAIUSA-N 347.415 0.459 10 20 ECCD O=C(NCc1ccccc1O)C1=CN2CCS(=O)(=O)N=C2C=C1 748353884 QNRGKTCSPUGUDK-UHFFFAOYSA-N 333.369 0.506 10 20 ECCD CNC[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 842149026 SSCJBIQHROEGGA-ZDUSSCGKSA-N 336.411 0.718 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)NC[C@H](C)N)CC2)cc1 841751475 ZHWUPQMKFGUBIF-AWEZNQCLSA-N 335.452 0.464 10 20 ECCD CC(C)NC(=O)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851924699 NDLITFMHEBPNLD-UHFFFAOYSA-N 348.447 0.972 10 20 ECCD C[C@@H](CO)NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 764212292 KQICPOYEHTWADO-LBPRGKRZSA-N 341.433 0.101 10 20 ECCD CN1CCO[C@H](C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C1 891254080 VNJDMZZFTBRMNX-IRXDYDNUSA-N 334.464 0.802 10 20 ECCD COCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1078253828 UBHGGSOJCVZOMU-CHWSQXEVSA-N 335.364 0.270 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)C[C@@H](C)NC(N)=O)CC2)n1 1089844314 YXAGQOZBEFRDCP-GFCCVEGCSA-N 346.435 0.875 10 20 ECCD C[S@](=O)c1ccc(NC(=O)C2=S=C(c3nn[nH]n3)C=C2)cc1 1591684490 XMGCQCZOFSXYSK-QFIPXVFZSA-N 333.398 0.572 10 20 ECCD CC(=O)N[C@]1(CO)CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1055676294 CMCKWBVZJPVMBO-MRXNPFEDSA-N 347.375 0.952 10 20 ECCD C[C@H](NS(C)(=O)=O)C(=O)NCc1ccc(N2CCCC2)cc1 67841568 CTSJXFDXMBRWOG-LBPRGKRZSA-N 325.434 0.841 10 20 ECCD Cc1c(CNC(=O)C(=O)N2CCNC[C@H]2C)n(C)c2ccccc12 419704870 HPBGNLXBADLHAK-GFCCVEGCSA-N 328.416 0.923 10 20 ECCD COc1cccc(CNS(=O)(=O)CCCN2CCOCC2)c1O 274258339 ZROMTIVIXMVCLA-UHFFFAOYSA-N 344.433 0.543 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@]1(F)CCNC1 377149977 CWQKQVJGILIBPK-INIZCTEOSA-N 325.359 0.980 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H]2CNC[C@@H]21 817995943 JTTTTZUPBVAXHN-ZBFHGGJFSA-N 330.432 0.531 10 20 ECCD O=C(CN1CCC(=O)NC1=O)NCc1ccc(N2CCOCC2)cc1 731869683 BCEHSLVGTRIXGO-UHFFFAOYSA-N 346.387 0.081 10 20 ECCD O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)CN1CCOCC1 911360390 RCZKDANWDJEIPU-UHFFFAOYSA-N 342.779 0.791 10 20 ECCD C[C@H]1C[C@@H](NC(=O)C(=O)NCCc2ccc(N)cc2)CN1C1CC1 842165809 HUMHUTQFYWQXOF-SWLSCSKDSA-N 330.432 0.669 10 20 ECCD COCC(=O)N1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C[C@H]1C 1012164040 HNDXLKMKIAHTEH-ZYHUDNBSSA-N 337.376 0.464 10 20 ECCD C[C@H](C(=O)NC[C@H](N)c1ccc(N(C)C)cc1)N1CCN(C)CC1 843297013 DZESQMQYKJVPLG-PBHICJAKSA-N 333.480 0.505 10 20 ECCD COc1ncnc(OC)c1C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 843299883 YUENAEVNFODSQL-ZDUSSCGKSA-N 345.403 0.990 10 20 ECCD CN(CCCN)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 851655706 UUWLILHUFNFNJQ-HNNXBMFYSA-N 347.463 0.879 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3C[C@H](O)C[C@H]3C)CC2)cc1 754083254 YFWZRNQLTUERRU-NXHRZFHOSA-N 349.475 0.633 10 20 ECCD O=S(=O)(NCc1ccc(N2CCC(O)CC2)cc1)c1ncc[nH]1 867532056 PFYZDEALCKCTHL-UHFFFAOYSA-N 336.417 0.849 10 20 ECCD COc1ncc(NC(=O)C(=O)NCc2ccccc2O)cc1C(N)=O 762441473 BOVWPXYWYNPHLB-UHFFFAOYSA-N 344.327 0.150 10 20 ECCD Cn1nncc1C(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089829816 YNTNQKMXLMTLPC-UHFFFAOYSA-N 331.355 0.701 10 20 ECCD O=C(CCn1cnnn1)NCc1ccc(N2CCOCC2)c(F)c1 1337779920 MLDFVJVWENAASE-UHFFFAOYSA-N 334.355 0.355 10 20 ECCD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Cn1nnc(N)n1 1346428808 FSACLSQZWLJBRW-UHFFFAOYSA-N 329.408 0.904 10 20 ECCD C[C@@H](NCCC1CS(=O)(=O)C1)c1cccc(-c2nn[nH]n2)c1O 1589962351 SILUKYGPPBYGSI-SECBINFHSA-N 337.405 0.658 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ncon2)C1 1844592588 WUFLFLLPGZCIHI-UHFFFAOYSA-N 345.315 0.007 10 20 ECCD COc1cccc(CNC(=O)[C@](C)(O)Cn2c(C)cccc2=O)c1O 281571636 MKNDEGGCJOPZAC-GOSISDBHSA-N 346.383 0.938 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2CCOCC2)c1 299533814 OUZPRRYPUCADBS-UHFFFAOYSA-N 328.390 0.920 10 20 ECCD Oc1c(Br)cccc1CNC[C@H](O)Cn1ccnn1 839179339 LTHWHWQRPZARAG-JTQLQIEISA-N 327.182 0.897 10 20 ECCD O=C(Cn1cccn1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918340881 XFEZZFCQNJVCIA-UHFFFAOYSA-N 348.428 0.434 10 20 ECCD C[C@@H](NC(=O)C(=O)NCCN1CCCC1=O)c1ccc(N(C)C)cc1 846734664 NKMNBCLMTWLSLN-CYBMUJFWSA-N 346.431 0.668 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCC2CCNCC2)cc1F 842147243 CYVGPTAOBWHQIE-UHFFFAOYSA-N 336.411 0.624 10 20 ECCD C[C@H](CN)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 841721092 DCFXAFZRKKETAF-UKRRQHHQSA-N 347.463 0.782 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N(C)CCCN 851686272 XQECBRIBPVERHK-AWEZNQCLSA-N 334.464 0.915 10 20 ECCD CN1CCN(CC(=O)NCc2ccc3c(c2)CCCN3C)CC1=O 763248643 DUPXNOWUQUQMPQ-UHFFFAOYSA-N 330.432 0.459 10 20 ECCD CCOC(=O)c1cc(NS(=O)(=O)c2cnnn2C)ccc1O 863410791 LEEIDASGKNNSBF-UHFFFAOYSA-N 326.334 0.498 10 20 ECCD COC(=O)c1cn(C2CN(Cc3cc(OC)c(OC)cc3O)C2)nn1 779613175 HQSWTOFHWNYDIN-UHFFFAOYSA-N 348.359 0.844 10 20 ECCD COc1ccc(CNCCNC(=O)[C@@H](C)N2C(=O)CCC2=O)cc1C 1128719531 FEJJPQBFRGFYCX-CYBMUJFWSA-N 347.415 0.747 10 20 ECCD C[C@H](C(N)=O)N1CC[C@](C)(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1046862530 MFOPZVYFABSJJR-HWPZZCPQSA-N 346.391 0.917 10 20 ECCD COc1ccc(-n2nnnc2CN2C[C@H]3[C@H](NC(C)=O)[C@H]3C2)cc1 957993492 XRHADOFAKKCXMO-FOLVSLTJSA-N 328.376 0.237 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCOC[C@H]2CCOC2)cc1 785424536 JVAOBPOFSIZTQI-HNNXBMFYSA-N 349.431 0.538 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccn(C)n3)nc12 785680415 UBEUKRMRXOFGLX-UHFFFAOYSA-N 345.315 0.702 10 20 ECCD CN1CCOC[C@H]1C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089819408 KLYUWQPTJFCXDN-AWEZNQCLSA-N 349.410 0.589 10 20 ECCD CN1CCCC[C@@H]1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1339263756 KHRJGOYDVAPRQX-GFCCVEGCSA-N 341.433 0.978 10 20 ECCD COc1ccc(CNC(=O)N[C@@H](C)[C@H]2CN(C)CCN2C)c(O)c1 1347183897 BQFCSXLGTJIALZ-SWLSCSKDSA-N 336.436 0.834 10 20 ECCD N[C@H](CO)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1340105951 PXUUNERHGXMAEM-GXFFZTMASA-N 329.347 0.693 10 20 ECCD CC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1842653637 JGIHENJHBQBKPR-UHFFFAOYSA-N 347.371 0.679 10 20 ECCD CN1CCCc2cc(CNC(=O)CSc3n[nH]c(=O)[nH]3)ccc21 187044130 JPRYNDPKEXEROH-UHFFFAOYSA-N 333.417 0.889 10 20 ECCD Cc1ccc(C(=O)NC[C@H]2CCC[C@@]23NC(=O)N(C)C3=O)c(O)c1O 368003088 VPRWLQZRZSJBLR-BMLIUANNSA-N 347.371 0.857 10 20 ECCD C[C@@H](O)C[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 283360249 XXNVHKPLYFYIIU-CZUORRHYSA-N 349.431 0.367 10 20 ECCD Nc1cnc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 827357743 YHIYNRWMYVTRDW-UHFFFAOYSA-N 331.351 0.965 10 20 ECCD O=C(NCCCSc1nccs1)NCCN1CCNCC1 841855553 BCZYFUXIDXLAMR-UHFFFAOYSA-N 329.495 0.830 10 20 ECCD O[C@@H]1CCN(C2CN(Cc3ccc(N4CCOCC4)c(F)c3)C2)C1 846067538 HSLFBONKFHXNHH-MRXNPFEDSA-N 335.423 0.913 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NCc1cn(CC(N)=O)nn1 840975662 JOTWKDADTCIHCG-CYBMUJFWSA-N 330.436 0.859 10 20 ECCD CC(=O)N[C@@H](C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917832572 AZFLXRKBUOMYCA-WFASDCNBSA-N 346.431 0.529 10 20 ECCD CCn1c(N)c(C(=O)CN(C)c2ccc3c(c2)OCO3)c(O)nc1=O 756653421 JCGPVRRIZLGMAN-UHFFFAOYSA-N 346.343 0.599 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCc3nc(C)no3)C2)cc(OC)n1 1020352240 DTTVXUCGAPRGIX-HAQNSBGRSA-N 347.375 0.841 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H]2CC[C@H](C1)N2 884531240 HBWVMSRTFIDUST-GASCZTMLSA-N 330.432 0.640 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)Cn3ncccc3=O)CC2)cc1 781830596 ZBCJUQZKHVBYGM-MRXNPFEDSA-N 344.415 0.435 10 20 ECCD COc1ccc(CNCC2CC(NC(=O)[C@@H]3CNC(=O)N3)C2)cc1C 962245921 LUTPDAJOELYAPU-NRXISQOPSA-N 346.431 0.669 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)NCc2ncn(C)n2)N(C)C)cc1 893954763 HYEGCSBPLRDJKD-HNNXBMFYSA-N 345.451 0.983 10 20 ECCD C[C@H](C(N)=O)N1CC[C@@H]1CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1085994737 SRAMXROVFFGSEX-ZWNOBZJWSA-N 346.391 0.869 10 20 ECCD CCc1cc(N2CC=C(CCNC(=O)CC(N)=O)CC2)nc(C)n1 1089822080 NLDYQNCNJROMIL-UHFFFAOYSA-N 331.420 0.866 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3ccns3)C2)cc(OC)n1 996380224 ZPCFCEIVTSRYBQ-UHFFFAOYSA-N 348.384 0.810 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CN1C(=O)CNC1=O 1326021203 BTYRWCRLORYNHA-LBPRGKRZSA-N 332.404 0.660 10 20 ECCD CN1CCN(c2ccc(CNC(=O)CO[C@H]3CCOC3)cc2)CC1 1332672554 ACQBSQDKKGOURE-KRWDZBQOSA-N 333.432 0.860 10 20 ECCD Cc1cc2nc(NC(=O)C3=S=C(C(=O)O)C=C3)cc(N(C)C)n2n1 1607713089 KBFPKICYSNYLOS-UHFFFAOYSA-N 345.384 0.775 10 20 ECCD CN1CCN(c2ccc(CN3C[C@@H](O)C[C@@H]3C(=O)O)cc2F)CC1 1610136979 FEXDEWLEMPJTCN-XJKSGUPXSA-N 337.395 0.597 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)NCC1[C@H]2CNC[C@H]12 1580713663 GLINNJCFFAWQNU-HOTGVXAUSA-N 330.432 0.788 10 20 ECCD O=C1CC(C(=O)N2CCCC23CN(C(=O)c2cc(O)nc(O)c2)C3)C1 1846992906 KIERMENFBWXDMS-UHFFFAOYSA-N 345.355 0.289 10 20 ECCD CC(C)NC(=O)CNC(=O)NCc1ccc(N2CCOCC2)cc1 54786417 ZIFJHUDHKBBFID-UHFFFAOYSA-N 334.420 0.847 10 20 ECCD C[C@H](CS(C)(=O)=O)C(=O)NCc1ccc(N2CCOCC2)cc1 266945937 SUTDROYBOSLQIP-CYBMUJFWSA-N 340.445 0.820 10 20 ECCD CS(=O)(=O)Nc1ccc(NS(=O)(=O)C[C@H]2CCCO2)cc1 265377825 INFUCSGEMILOCV-GFCCVEGCSA-N 334.419 0.979 10 20 ECCD COC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 283459814 KXQKALGWTZCVJW-UHFFFAOYSA-N 347.415 0.780 10 20 ECCD CNC(=O)NCC(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 294872422 DIGFFFNEFFQAOA-UHFFFAOYSA-N 343.767 0.476 10 20 ECCD CCCN(CC(N)=O)C(=O)c1cc(NS(C)(=O)=O)ccc1O 817056274 VTGYUYPBWOEDIF-UHFFFAOYSA-N 329.378 0.101 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCOC3=O)CC2)cc1F 820720071 CTAAOZDDJLTGGL-UHFFFAOYSA-N 337.351 0.935 10 20 ECCD CN1CC[C@@H](N(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 738549108 OFOKJHNJAVWNJF-LLVKDONJSA-N 341.389 0.066 10 20 ECCD C[C@H](CO)C1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)CC1 846343933 PMLVYRSHJHXCJX-CYBMUJFWSA-N 333.432 0.795 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N(C)CCCO)cc1 846253985 ADEARDSYINSSBK-UHFFFAOYSA-N 337.420 0.431 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3CCC[C@]3(N)C2)cc1 857100809 NNYQLNVNPGRAKQ-KDOFPFPSSA-N 330.432 0.709 10 20 ECCD CO[C@@H]1CS(=O)(=O)C[C@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 855475988 IOOZBISKEYJPPL-NEQXKTFVSA-N 327.358 0.039 10 20 ECCD O=C1N[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCO1 862225766 GCPKUJLFMBZKHI-OAHLLOKOSA-N 333.388 0.762 10 20 ECCD O=C(Cn1nnc2ccccc2c1=O)NCCc1ccc(O)c(O)c1 762268349 CVKYIYFJFXXERK-UHFFFAOYSA-N 340.339 0.562 10 20 ECCD COc1cc(N2CCN3C(=O)NC(=O)[C@H]3C2)c([N+](=O)[O-])cc1OC 778587798 FSZNZMAFTQROTQ-SNVBAGLBSA-N 336.304 0.352 10 20 ECCD COc1ccc(-n2nnnc2CN2C[C@H]3CN(C(C)=O)C[C@H]3C2)cc1 1048633185 INGPJKKRUKXQIO-OKILXGFUSA-N 342.403 0.581 10 20 ECCD COc1cc(O)c(CNCCS(=O)(=O)N2CCCC2)cc1OC 897830656 HOWNTHVWROIMKL-UHFFFAOYSA-N 344.433 0.925 10 20 ECCD CC(=O)NCC(=O)NCCC1=CCN(c2cncc(Cl)n2)CC1 1089807168 GZFIGIAEKKWROO-UHFFFAOYSA-N 337.811 0.909 10 20 ECCD O=C(NCCC1=CCN(c2nccn3nnnc23)CC1)c1cc[nH]c1 1089867900 VOSGEJTWNVPCAX-UHFFFAOYSA-N 338.375 0.804 10 20 ECCD COc1ccc(CNCCNC(=O)CC[C@@H]2NC(=O)NC2=O)cc1C 1150401598 YGUJNRKHOXECBX-ZDUSSCGKSA-N 348.403 0.198 10 20 ECCD CC(=O)N1CCC(CNC(=O)C(=O)N(C)Cc2ccccc2O)CC1 1322765535 VVTLRGIJSZGAQC-UHFFFAOYSA-N 347.415 0.725 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CC[C@@](F)(CO)C1 1345137423 FSKNDGBKRTZQQQ-SFHVURJKSA-N 349.406 0.836 10 20 ECCD COC(=O)COCC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1355178862 NEEQLVMZDXGFNO-HNNXBMFYSA-N 337.420 0.661 10 20 ECCD O=C(COC(=O)c1cccc(O)c1O)Nc1cccc(C(=O)O)n1 1601335287 MDPVJUXVYQRKFB-UHFFFAOYSA-N 332.268 0.987 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(CC(N)=O)CC(C)C)nc12 52536105 BGRGGWJZYRZKDE-UHFFFAOYSA-N 349.391 0.555 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H]3C(=O)O)CC2)cc1 269281810 GFAHLQFAOKJYHD-MRXNPFEDSA-N 347.415 0.893 10 20 ECCD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)C[C@@H]2CCCO2)cc1 281976100 MCZCCAFEGJKDCI-LBPRGKRZSA-N 349.434 0.483 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CC(C(N)=O)=NO1 297889197 HGYHPWDEEBIUAX-AWEZNQCLSA-N 347.419 0.914 10 20 ECCD CCOC(=O)[C@H]1NCC[C@H]1NCc1ccc(N2CCOCC2)cc1 817894511 LPHOQHVTIYTJLC-SJORKVTESA-N 333.432 0.906 10 20 ECCD COC(=O)[C@H]1C[C@@H](O)CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 826816557 HERCMMCJNNDHML-VHSXEESVSA-N 340.332 0.972 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H]3CCN3C)CC2)cc1 905547413 WPCLXBDJMXDIEU-ROUUACIJSA-N 348.491 0.472 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCCNC3)ccc21 842149602 BTQHKCBLPKHBRC-HNNXBMFYSA-N 330.432 0.553 10 20 ECCD C[C@H]1NC(=S)N(Cc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1=O 917642342 RREVHAQVBGKXOQ-DGCLKSJQSA-N 346.456 0.994 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@@H](N)C3)cc2)C1 844174925 DQFDQPQCTXTGSP-SOUVJXGZSA-N 330.432 0.742 10 20 ECCD Cc1cc(C(=O)N(CCO)CCOCCO)c(C)n1-c1ccccn1 862247189 SHCBAHRDXKMQIZ-UHFFFAOYSA-N 347.415 0.933 10 20 ECCD COc1cc(C(=O)NC2CC(CN[C@H]3CCNC3=O)C2)cc(OC)n1 962037605 YOGLHFVTSRWKQS-GDKBPFBDSA-N 348.403 0.085 10 20 ECCD CC(=O)N[C@@H](C)C(=O)NCCC1=CCN(c2ccc(C)nn2)CC1 1089799703 NFOUQCPYSFPARQ-ZDUSSCGKSA-N 331.420 0.952 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2CN(C(=O)c3cnn[nH]3)C2)cc1 994379778 LOTQBNWLLCXRLX-UHFFFAOYSA-N 342.319 0.222 10 20 ECCD Cc1noc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)n1 1322344063 ACJODKMLILSGCA-UHFFFAOYSA-N 331.376 0.719 10 20 ECCD Cn1nnc(CNCCCNC(=O)c2ccc(N=NC(N)=O)cc2)n1 1177237599 FGTKTIOAVNNAPX-UHFFFAOYSA-N 345.367 0.282 10 20 ECCD COc1ccc(N2CCC(NC(=O)N3CCNC(=O)C3)CC2)cc1 102577323 PCAMHJRRZQUPLC-UHFFFAOYSA-N 332.404 0.805 10 20 ECCD CC(=O)NCCNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 73044411 AYVPNTFZOXTMSJ-UHFFFAOYSA-N 334.420 0.801 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCC1(C)OCCO1 806371264 BZCNXOURIKJESG-UHFFFAOYSA-N 349.431 0.947 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(CC)CC(=O)OC)nc12 299340315 OHUOPGDWLSPDOD-UHFFFAOYSA-N 336.348 0.607 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CC(N3CC[C@@H](O)C3)C2)cc1F 826019282 CIZKQBHJMWVSCC-CQSZACIVSA-N 336.411 0.852 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H](CO)O1 839219286 GXFIYJURMHXCTE-XJKSGUPXSA-N 349.431 0.319 10 20 ECCD COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)Cc1ccc(N)cc1 831992586 HKLDUGCFNOMHPG-AWEZNQCLSA-N 335.404 0.631 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)CN1C(=O)C(=O)N(C)C1=O 734405023 PVVCWBPEUZZITG-UHFFFAOYSA-N 332.360 0.098 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@]3(C)CCNC3=O)cc2)CC1 918838880 MFOONGDRMPWWHP-GOSISDBHSA-N 330.432 0.581 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](N)C2)cc1F 842208656 CUORVLHSSNAYAC-ZDUSSCGKSA-N 336.411 0.848 10 20 ECCD C[C@H](NC(=O)C(=O)NC[C@H]1CNCCCO1)c1ccc(N(C)C)cc1 842203135 PEGPFEFSFYMZQH-XJKSGUPXSA-N 348.447 0.425 10 20 ECCD COC(=O)[C@@H]1CNCCCN1Cc1ccc(N2CCN(C)CC2)cc1 843122764 DUYFYQFEIRTEGY-SFHVURJKSA-N 346.475 0.775 10 20 ECCD COCCNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 920252210 YEJXUDSMDJGESJ-FPLPWBNLSA-N 347.415 0.663 10 20 ECCD CN(Cc1ccccc1O)C(=O)NC[C@H]1CCCN1S(C)(=O)=O 753692751 LOTAKBWAQPEXHP-CYBMUJFWSA-N 341.433 0.958 10 20 ECCD C[C@@H](NC(=O)C(=O)N[C@@H]1CCNC1)c1ccc(N2CCOCC2)cc1 861743340 SQPOOHRXZWBROS-UKRRQHHQSA-N 346.431 0.179 10 20 ECCD Cn1nccc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 765100718 RVLMIXWVLFLCMI-UHFFFAOYSA-N 336.417 0.735 10 20 ECCD C[C@H](NC(=O)NCCNS(C)(=O)=O)c1ccc(N(C)C)cc1 773166470 OVNUVNZSNGMTOZ-NSHDSACASA-N 328.438 0.662 10 20 ECCD C[C@H]1[C@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C 771408349 ULHMCTVMYJVJOX-QWRGUYRKSA-N 341.433 0.928 10 20 ECCD O=C(c1c(F)ccc(O)c1O)N1CC(CNC(=O)C(F)(F)F)C1 881447866 DGKCLPKFXMDJFH-UHFFFAOYSA-N 336.241 0.987 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@@]3(O)CCOC3)cc2)CC1 889663278 NYEIOOSDMMJBBJ-SFHVURJKSA-N 348.447 0.389 10 20 ECCD O=C(CCCN1C(=O)CCC1=O)OCC(=O)c1ccc(O)c(O)c1 782921713 XKZQVOITOGCZIX-UHFFFAOYSA-N 335.312 0.753 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(C)C(C)(C)C2)cc1 897361528 KPIZWXCCJITWDK-UHFFFAOYSA-N 332.448 0.921 10 20 ECCD COc1cc(C(=O)NC2CC3(CC(NCCO)C3)C2)cc(OC)n1 964213635 XIFGQYANNROSCF-UHFFFAOYSA-N 335.404 0.722 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@H]3CCNC(=O)C3)CC2)nn1 1089821076 QZIIDAKJFJIAJZ-HNNXBMFYSA-N 343.431 0.954 10 20 ECCD CCCNC(=O)CNCCNC(=O)c1ccc(N=NC(N)=O)cc1 1153048259 XVMJSESABFIJGR-UHFFFAOYSA-N 334.380 0.695 10 20 ECCD CC(C)(C)OC(=O)NCC(=O)NCC(=O)NCc1ccccc1O 271026597 ZRNBDDUUBSHLFZ-UHFFFAOYSA-N 337.376 0.649 10 20 ECCD C[C@H](O)CN(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 131094339 ARXRKPLQIKUJOS-ZDUSSCGKSA-N 339.411 0.591 10 20 ECCD COCCN1C(=O)/C(=C\NNc2ncccc2C)C(=O)NC1=S 276685854 LWXJWJBKJZIDKM-NTMALXAHSA-N 335.389 0.080 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1CCOC1 282968394 CLMUEHKPQOSQFK-OAHLLOKOSA-N 329.400 0.832 10 20 ECCD CN1C(=O)CO[C@@H](C(=O)NCc2ccccc2O)[C@@H]1c1cnn(C)c1 281752307 YKZRRPWTRTXEFD-JKSUJKDBSA-N 344.371 0.340 10 20 ECCD CCN1C(=O)C(=CNNc2ncncc2F)C(=O)N(CC)C1=S 291917312 AKFMWVNUXXWNCG-UHFFFAOYSA-N 338.368 0.412 10 20 ECCD C[C@@H](CN(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C)C(=O)O 817106210 FJNCZZNHEPMVBR-LBPRGKRZSA-N 347.415 0.864 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)NC[C@@H](C)CN)C2)cc1 818676501 NYLPLOZEXZOVKJ-KBPBESRZSA-N 348.447 0.349 10 20 ECCD COc1cc(N(C)CC(=O)NCCC(=O)O)cc(OC)c1OC 737890762 BXQCFMFPCSTNKQ-UHFFFAOYSA-N 326.349 0.740 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CC[C@@H](O)[C@H]3C)CC2)cc1 832209448 IJVNTKIDQJTEEJ-RHSMWYFYSA-N 333.432 0.799 10 20 ECCD C[C@H](CC(N)=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 749131200 HEZJIIQAIBVKJQ-GFCCVEGCSA-N 325.434 0.275 10 20 ECCD CNC(=O)[C@@H](C)N1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1016367059 HWQVCMIPYXMTAZ-ZWNOBZJWSA-N 346.391 0.788 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3C[C@H](N)C[C@@H]3C)CC2)cc1 923411263 BMNXISMOEAULMQ-JZXOWHBKSA-N 348.491 0.600 10 20 ECCD Cc1nc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)nn1C 1117750728 LURBQUAKIWMFKD-QMMMGPOBSA-N 333.348 0.221 10 20 ECCD COc1ccc(O)c(CNC(=O)NCC2(S(C)(=O)=O)CC2)c1 793017729 STLOXSSVFUEYKW-UHFFFAOYSA-N 328.390 0.777 10 20 ECCD CO[C@@H]1CN(CCO)C[C@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1082390059 XJUCRPPXVYYQHV-CHWSQXEVSA-N 335.364 0.270 10 20 ECCD CC(C)(C(N)=O)C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089848933 QBIMBHJULVEDJA-UHFFFAOYSA-N 335.383 0.770 10 20 ECCD CN1CCN(c2ccc(CNC(=O)Cc3nnc(N)s3)cc2)CC1 1521899307 YQGKHQCVNVRLRW-UHFFFAOYSA-N 346.460 0.731 10 20 ECCD CN(CC(=O)N1CCNC1=O)Cc1ccc(N2CCOCC2)cc1 153188721 KAKWACXQZFGYOB-UHFFFAOYSA-N 332.404 0.507 10 20 ECCD C[C@H](NC(=O)N1CCNC(=O)C1)c1ccc(N2CCOCC2)cc1 125063435 VBXIJOWAYSAXCH-ZDUSSCGKSA-N 332.404 0.726 10 20 ECCD COc1ccc(N2CCN(CC(=O)N3CCNC3=O)CC2)cc1F 84866772 FMDLJRXIYWFDSR-UHFFFAOYSA-N 336.367 0.508 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)NCCS(=O)(=O)NC 276045939 RFAXJJIPVQGRFT-UHFFFAOYSA-N 329.422 0.863 10 20 ECCD COc1ccc(-n2c(C)cc(C(=O)N[C@@H](CO)C(N)=O)c2C)cc1 804357126 ZERWMNLCSPSYCC-HNNXBMFYSA-N 331.372 0.679 10 20 ECCD CC(C)NS(=O)(=O)CCNC(=O)N(C)Cc1ccccc1O 299405665 DTMYUTZBSRBPHY-UHFFFAOYSA-N 329.422 0.861 10 20 ECCD C[C@@]1(C[C@@H]2CCCN2C(=O)c2cccc(O)c2O)NC(=O)NC1=O 804558189 XNSRZKCIUBYUAM-FVMDXXJSSA-N 333.344 0.691 10 20 ECCD CN(C)CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 727371294 HUDGHAZLTALMHM-UHFFFAOYSA-N 325.434 0.099 10 20 ECCD COC(=O)[C@H]1C[C@H](O)CN(C(=O)NCc2ccc(N(C)C)cc2)C1 825604057 XOAJYCDEBQSTKC-ZFWWWQNUSA-N 335.404 0.818 10 20 ECCD N[C@@H](CNC(=O)C(=O)NCCCSc1nccs1)C1CC1 842094125 WGMCVACQDFUZBJ-JTQLQIEISA-N 328.463 0.595 10 20 ECCD COc1ccc(N2CCN(CCCNC(=O)N(C)CCN)CC2)cc1 841665562 OQYBCSKRFYOESO-UHFFFAOYSA-N 349.479 0.807 10 20 ECCD CCN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@@H]1CCN(CC(N)=O)C1 1034053067 OUIXFJZBUXZXGS-CYBMUJFWSA-N 346.391 0.871 10 20 ECCD COc1cc(C(=O)NC2CN(Cc3nc(C)no3)C2)cc(OC)n1 1030611858 WOFJBBORHMQRSE-UHFFFAOYSA-N 333.348 0.404 10 20 ECCD COCCN1CN(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1=O 888003745 ZTWWWEMZUODUIK-UHFFFAOYSA-N 338.383 0.849 10 20 ECCD COc1ccc(-n2nnnc2CNC[C@@H]2CN(C(C)=O)CCO2)cc1 1051384432 SDPDZEMVAXNBOT-OAHLLOKOSA-N 346.391 0.008 10 20 ECCD C[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)NCc1ccc(N(C)C)cc1 887634335 NKLWUFMDBMVOIF-RISCZKNCSA-N 325.434 0.985 10 20 ECCD CN1CCN(c2ccc(CNS(=O)(=O)[C@@H]3CCOC3)cc2)CC1 882664086 JJDWXHDQTGSZLU-MRXNPFEDSA-N 339.461 0.647 10 20 ECCD C[C@H](CN1CCOCC1)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785428835 SWYYPVWQUWELFX-CQSZACIVSA-N 348.447 0.206 10 20 ECCD CN(Cc1cc2c(cc1O)OC[C@@H]2O)[C@H]1CCN(S(C)(=O)=O)C1 793588214 LFFJWSAYFZIGNM-FZMZJTMJSA-N 342.417 0.284 10 20 ECCD O=C(C[C@@H]1CCC(=O)N1)NCCC1=CCN(c2cc(F)ncn2)CC1 1089834107 ABURUAOQENRSOZ-ZDUSSCGKSA-N 347.394 0.927 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)NC[C@H]2COCCN2)N(C)C)cc1 1336921501 KCMJQYIXSMAFOP-RDJZCZTQSA-N 349.479 0.643 10 20 ECCD 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332.360 0.826 10 20 ECCD COCc1cc(N2CC=C(CCNC(=O)c3cnn[nH]3)CC2)ncn1 1089871420 SPYRRLCTZULYLU-UHFFFAOYSA-N 343.391 0.698 10 20 ECCD COc1ccc(N(C)CC(=O)N2CCC(C(N)=O)CC2)c(OC)c1 1319414642 GFEATOSMYMPBNS-UHFFFAOYSA-N 335.404 0.864 10 20 ECCD C[C@@H](NCCS(=O)(=O)CCC(N)=O)c1ccc(N(C)C)cc1 1325181415 MDSKACHSNUZWDH-GFCCVEGCSA-N 327.450 0.693 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)c2cnc(C(=O)O)cn2)cc1 1327239044 ADASNXJUIVKIQN-GFCCVEGCSA-N 329.360 0.671 10 20 ECCD CO[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C[C@H]1OC 1326816050 GPCNMUDWMIPCPF-IYBDPMFKSA-N 349.431 0.549 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)CN2C(=O)CNC2=O)N(C)C)cc1 1336954661 JDKPRNKIMCQMPI-AWEZNQCLSA-N 347.419 0.023 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccn(C)c1=O 1338723048 DWCGXRISZHIPOJ-SNVBAGLBSA-N 345.355 0.482 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)NOC[C@@H]1CCOC1 1346325770 DDPYKBUKEHRJLD-SNVBAGLBSA-N 345.446 0.826 10 20 ECCD COc1cc(CN2CCS(=O)(=O)C[C@H]2CC(=O)O)c(O)cc1C 1607157254 BPMZRISGAVXVCJ-GFCCVEGCSA-N 343.401 0.783 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0.742 10 20 ECCD COc1ccc(N2CCCN(C(=O)CN3CCN(C)CC3)CC2)cc1 109955025 JZVTVEYDSDCFGJ-UHFFFAOYSA-N 346.475 0.981 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(CCN(C)C)C1 273160417 KETBVBMRMJKPFQ-TZMCWYRMSA-N 349.431 0.555 10 20 ECCD Cc1ccc(C(=O)N2CCC[C@H]2C[C@@]2(C)NC(=O)NC2=O)c(O)c1O 286075494 CMYIIPXJDUFYAD-DYZYQPBXSA-N 347.371 0.999 10 20 ECCD CC(C)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1=O 283574998 SDXVOCSOUJVUCI-HNNXBMFYSA-N 346.431 0.494 10 20 ECCD CN(C)c1ccc(CN2CCN(S(=O)(=O)c3cc[nH]n3)CC2)cc1 289640933 WQNPROXLMDYTDF-UHFFFAOYSA-N 349.460 0.982 10 20 ECCD Cn1cnn(CCC(=O)NCc2c(O)ccc3c2CCCC3)c1=O 293650717 IGWNNXZRIQZMOA-UHFFFAOYSA-N 330.388 0.873 10 20 ECCD Cn1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nn1 808288050 XHTWRMZUUNFWLY-ZDUSSCGKSA-N 342.403 0.447 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NOC1CCOCC1 807292359 WTAURYVDAREROU-UHFFFAOYSA-N 345.399 0.906 10 20 ECCD CNCCCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827390755 UJGBWNOUHIOMNO-UHFFFAOYSA-N 339.461 0.537 10 20 ECCD 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COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(C(N)=O)c2)c1 734073850 XQIOQPDOTMXBNF-UHFFFAOYSA-N 343.339 0.755 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN[C@@](C)(CC)C(=O)O)nc12 737155476 XAGROVRTKGEUFY-HNNXBMFYSA-N 336.348 0.955 10 20 ECCD CCOC(=O)c1c[nH]nc1S(=O)(=O)NCc1ccc(O)cc1O 912557135 SWNXKHDVRNVYBI-UHFFFAOYSA-N 341.345 0.476 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)[C@@H]2CCCN(C(N)=O)C2)cc1 843296701 DVUWZOBVWLNEFB-HIFRSBDPSA-N 333.436 0.659 10 20 ECCD COc1ccc(CNC(=O)C2=C(C)N(C)c3nnnn3[C@H]2C)c(O)c1 848022552 CRZMIVWURVBWAS-JTQLQIEISA-N 344.375 0.989 10 20 ECCD NC(=O)[C@@H]1CC[C@H](CNC(=O)NCc2cc(Cl)ccc2O)O1 845049600 BWZHBPPRXABWTP-PWSUYJOCSA-N 327.768 0.878 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@](C)(CN)C1 842154984 YWZATZZCMXCZGC-GOSISDBHSA-N 332.448 0.875 10 20 ECCD COc1cc(C)cc(CN2CCN(C(=O)C(=O)NC3CC3)CC2)c1O 754727045 HIIYBBIVKRHCBO-UHFFFAOYSA-N 347.415 0.632 10 20 ECCD CCOC(=O)C[C@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 761604223 YQYPSVXNVLFIQC-VIFPVBQESA-N 344.389 0.835 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(O)C3)CC2)cc1 778326914 ZMLNMINKUMGOFU-SREVYHEPSA-N 345.399 0.103 10 20 ECCD CN(CCS(N)(=O)=O)Cc1ccc(N2CCOCC2)c(F)c1 877827447 VJGKGRFGUHLONA-UHFFFAOYSA-N 331.413 0.383 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N[C@H]3CC(=O)N(C)C3)cc2)CC1 883496682 AWHQZHOLNGRZHL-HNNXBMFYSA-N 345.447 0.468 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@@H]3CNC(=O)N3)CC2)n1 1089860539 DPLKCZYNDPYXNC-ZDUSSCGKSA-N 330.392 0.109 10 20 ECCD CCc1nc(C)cc(N2CC=C(CCNC(=O)CNC(N)=O)CC2)n1 1089804573 MQZUUCLQXJAYHK-UHFFFAOYSA-N 346.435 0.659 10 20 ECCD COC(=O)CCCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1321396413 WMLOCPKQLZRJIE-UHFFFAOYSA-N 345.399 0.748 10 20 ECCD CC(C)N1C[C@@H](NC(=O)C(=O)N(C)Cc2ccccc2O)CC1=O 1328267252 NVWUDRRYWZVQJK-ZDUSSCGKSA-N 333.388 0.476 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N[C@H]3[C@@H]4CNC[C@@H]43)cc2)CC1 1353490589 YLYZZEWVRFQGGJ-FVQHAEBGSA-N 329.448 0.455 10 20 ECCD C[C@@H]1CN2CCN1C[C@H]2C(=O)NCc1ccc(N2CCOCC2)cc1 1519019564 HXNLPWPBGLYEJX-QAPCUYQASA-N 344.459 0.528 10 20 ECCD 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325.409 0.969 10 20 ECCD CC(C)N1C[C@H](NC(=O)C(=O)N(C)Cc2ccccc2O)CC1=O 1328267251 NVWUDRRYWZVQJK-CYBMUJFWSA-N 333.388 0.476 10 20 ECCD CC(C)[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)O 1588829777 UEMVZDLCQTWDJF-NSHDSACASA-N 344.389 0.850 10 20 ECCD CC(C)[C@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847629745 HNUCXABERZAIPX-HUBLWGQQSA-N 349.387 0.325 10 20 ECCD CCN(C)c1ccc(CN2CCS(=O)(=O)C[C@@H]2C(=O)O)cc1 1596194889 WAFDTZYXVPPSNO-CQSZACIVSA-N 326.418 0.826 10 20 ECCD COc1cccc(CNC(=O)[C@H](C)n2cnc(-c3nn[nH]n3)n2)c1O 1591638721 FQUSWWHJHLOSES-QMMMGPOBSA-N 344.335 0.050 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2C2OCCO2)cc1 1354381724 GKXDRLULLWLCDJ-HNNXBMFYSA-N 347.415 0.733 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCN(C(C)(C)C(N)=O)CC2)cc1 267503988 JOXRJEUQCVQPDH-UHFFFAOYSA-N 347.463 0.844 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)c3cncn3C)CC2)cc1 289592513 URWRZYKMIQAARY-UHFFFAOYSA-N 343.431 0.981 10 20 ECCD CCOC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc(O)c(O)c2)C1 901131825 PPOMAYMSBQRTNL-CYBMUJFWSA-N 336.388 0.989 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CCCNCC3)ccc21 842149960 IAPSFLZZDHIRBS-UHFFFAOYSA-N 330.432 0.507 10 20 ECCD Cc1cnc2nc(C(=O)NC[C@H](N)c3ccc(N(C)C)cc3)nn2c1 852792458 WTJLZPBNDXDLJU-AWEZNQCLSA-N 339.403 0.929 10 20 ECCD Cn1ccc(/C=C2\SC(=S)N(CCNS(C)(=O)=O)C2=O)c1 763281177 DIFFBWODWUYXBV-YFHOEESVSA-N 345.471 0.776 10 20 ECCD C[C@H](CO)N(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 768051005 YSKLPUQZYYVKII-HIFRSBDPSA-N 348.447 0.911 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNC[C@H]3C[C@H](O)C3)CC2)cc1 872245100 BBXRTKSXTZIDQC-KBAYOESNSA-N 349.475 0.539 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)NCC3CNC3)cc2)CC1 1119477048 OQJVUUKEDSZPOD-UHFFFAOYSA-N 345.447 0.407 10 20 ECCD CN(C[C@H]1CCN1C(=O)C(N)=O)C(=O)c1ccc(N=NC(N)=O)cc1 977890541 LZUQUTVSJOVHNY-LLVKDONJSA-N 346.347 0.007 10 20 ECCD COc1ccc(CNC[C@H]2CN(C(=O)C(N)=O)CCCO2)cc1C 1078458873 UQZZWLNITFIJDB-AWEZNQCLSA-N 335.404 0.196 10 20 ECCD CN(C)C(=O)CC(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089867194 GCGRYCUHTJKELT-UHFFFAOYSA-N 335.383 0.737 10 20 ECCD C[C@@H](CC(N)=O)C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089850233 QNXXJKSWGIPRDM-NSHDSACASA-N 335.383 0.770 10 20 ECCD O=C(O)CN1CCCC[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1=O 1595090203 MZLMRZBPUBKDIO-HOSRBBHYSA-N 348.355 0.693 10 20 ECCD CC[C@H]1C(=O)NCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 151082871 FHZKZDNAPRYVAK-INIZCTEOSA-N 332.448 0.921 10 20 ECCD CCOc1cccc(CN2CCCN(C(=O)CNC(C)=O)CC2)c1O 529665748 QRPUNJPZXRFIDM-UHFFFAOYSA-N 349.431 0.961 10 20 ECCD C[C@H]1C[C@H](C(=O)O)CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 817887934 HIJDSXVCYXTZAD-JSGCOSHPSA-N 347.415 0.938 10 20 ECCD Oc1ccc(CCNC(=S)NCCCN2CCOCC2)cc1O 916114548 SKBNFNFIQCJGLI-UHFFFAOYSA-N 339.461 0.827 10 20 ECCD COC(=O)CCN(C)S(=O)(=O)NCc1cccc(OC)c1O 751309561 NSUUDQMBKCZVTA-UHFFFAOYSA-N 332.378 0.230 10 20 ECCD Cn1c(COC(=O)/C=C/c2ccc(O)c(O)c2)cc(=O)n(C)c1=O 759593341 BTPHGTQTRNOVHG-GQCTYLIASA-N 332.312 0.252 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NOCC(C)(C)O)cc2)CC1 889663377 PQFZXNUCSXQENP-UHFFFAOYSA-N 336.436 0.940 10 20 ECCD N=c1cc[nH]c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 787921209 CRBAGARDNXDZPP-UHFFFAOYSA-N 331.351 0.795 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@H]3CO[C@@H](C)C3)C2)cc(OC)n1 996379409 RKGDYDSFXZWKQW-CMPLNLGQSA-N 349.387 0.464 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@@H]3CO[C@H](C)C3)C2)cc(OC)n1 996379412 RKGDYDSFXZWKQW-PWSUYJOCSA-N 349.387 0.464 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CN1C(=O)CCC1=O 1317721158 FBXFVMRHMRSQDC-UHFFFAOYSA-N 345.399 0.631 10 20 ECCD CCn1cccc(CNC(=O)C(=O)N(C)Cc2ccccc2O)c1=O 1324136555 NGEMLHIAPBRFAX-UHFFFAOYSA-N 343.383 0.849 10 20 ECCD COc1ccc(N2CCCN(C(=O)Cn3ncn(C)c3=O)CC2)cc1 179442772 HEZNMYYRKCANEW-UHFFFAOYSA-N 345.403 0.329 10 20 ECCD CNS(=O)(=O)CCNC(=O)NCc1ccc(N2CC=CC2)cc1 187564969 WUQOXJDWTMHESX-UHFFFAOYSA-N 338.433 0.411 10 20 ECCD CN(C)c1ccc(CNC(=O)CCCN2C(=O)CNC2=O)cc1F 123468097 ORRVLAPVYRPBES-UHFFFAOYSA-N 336.367 0.840 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCC(NC(N)=O)CC2)cc1 81541182 VXGNFUJPBZEZBR-UHFFFAOYSA-N 333.436 0.502 10 20 ECCD CCOC(=O)CN(C)C(=O)CN1CCOc2cc(N(C)C)ccc21 266882643 YAYUAVUTCCQXFK-UHFFFAOYSA-N 335.404 0.973 10 20 ECCD COCCN(Cc1ccc([N+](=O)[O-])c(OC)c1O)[C@@H](C)C(N)=O 278283987 TYLKEOJTPZTIMN-VIFPVBQESA-N 327.337 0.631 10 20 ECCD CCN1CCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 283678467 ZLSQHBRSUMYKLI-MRXNPFEDSA-N 332.448 0.969 10 20 ECCD CC(=O)C(=O)CN1C(=O)C(=O)N(C23CC4CC(CC(C4)C2)C3)C1=O 289515700 CQCGPEPHXSHCQQ-UHFFFAOYSA-N 332.356 0.904 10 20 ECCD CC[C@H](CNS(C)(=O)=O)NC(=O)NCc1cccc(OC)c1O 298041982 HWXDKJOJYXIIKJ-LLVKDONJSA-N 345.421 0.528 10 20 ECCD NC(=O)CCNC(=O)c1ccc(NC(=O)c2cccc(O)c2O)cc1 817115696 XNQQLSATMIORRY-UHFFFAOYSA-N 343.339 0.955 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)N3CC[C@@H](N)C3)CC2)cc1 817934464 IWQAGAHYGYTUFL-CQSZACIVSA-N 346.431 0.294 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)NC[C@H]1CCCN1 842092739 MDDMAXCSWLOHMU-SNVBAGLBSA-N 328.463 0.610 10 20 ECCD Cc1onc(N)c1S(=O)(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 842785379 LVRUBWIFYGTFCV-GFCCVEGCSA-N 339.421 0.610 10 20 ECCD C[C@@H](O)[C@@H]1NC(=O)N(Cc2ccc(N3CCOCC3)c(F)c2)C1=O 924487313 JJGDCZLIBVTTSP-YGRLFVJLSA-N 337.351 0.464 10 20 ECCD COc1ccc(N2CCN(C(=S)NCC(N)=O)CC2)cc1F 753961102 HTCUWLVVQRNWGV-UHFFFAOYSA-N 326.397 0.316 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCC(=O)N3CCC3)C2)cc(OC)n1 1020352504 SJLPDSJLPCUFKV-JOCQHMNTSA-N 348.403 0.182 10 20 ECCD CS(=O)(=O)NC1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779493720 NZJAGCQOMMHANA-HWKANZROSA-N 340.401 0.651 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCC(=O)NC2)N(C)C)cc1 891255944 SZUZKOZBQIUVOV-GDBMZVCRSA-N 332.448 0.998 10 20 ECCD NC(=O)c1ccc(N2CCN(C(=O)c3cccc(O)c3O)CC2)nc1 790542221 NKRWCSRPAPZGEB-UHFFFAOYSA-N 342.355 0.554 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)c3cnnn3C)CC2)nn1 1089828588 CCACZCKTFDIOHR-UHFFFAOYSA-N 327.392 0.870 10 20 ECCD Cn1c(-c2sccc2O)nnc1N1CCN(S(C)(=O)=O)CC1 1341279974 KHHBEYGRJPWHIC-UHFFFAOYSA-N 343.434 0.331 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2nc3cnccn3c2=O)cc1 185548997 VCNIBSNPXIFYIU-UHFFFAOYSA-N 326.360 0.273 10 20 ECCD CC[C@](C)(NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)OC 271300932 QTZGFPOKGMFPSP-AWEZNQCLSA-N 344.389 0.835 10 20 ECCD COC(=O)c1cn(CCNC(=O)NCc2cccc(OC)c2O)nn1 287767872 JNDLVGXPFPMTJI-UHFFFAOYSA-N 349.347 0.278 10 20 ECCD CS(=O)(=O)NC1CC(NC(=O)/C=C/c2ccc(O)c(O)c2)C1 801463774 VMZNESCNYZVUEO-HWKANZROSA-N 326.374 0.307 10 20 ECCD CN(CC(N)=O)C(=O)c1cccc(NC(=O)c2cccc(O)c2O)c1 803710119 XHBOTLFPCDJRQU-UHFFFAOYSA-N 343.339 0.907 10 20 ECCD CCN(CCN)C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 911578107 ICDQKULFWSFEHI-INIZCTEOSA-N 349.479 0.279 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@@H](CO)[C@@H](O)C1 840483873 LTYCRZQJMOTNNJ-QRTARXTBSA-N 335.448 0.987 10 20 ECCD CNC[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 842154311 SMKIMQILNLJDKO-CQSZACIVSA-N 332.448 0.745 10 20 ECCD O=C(N[C@@H]1CCNC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 842224493 CHIXDDOZVXXAJE-CQSZACIVSA-N 343.383 0.992 10 20 ECCD COC[C@](C)(O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 754989653 NTIZDPSHQUNDNV-INIZCTEOSA-N 326.368 0.676 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2ncnc2S(C)(=O)=O)cc1 871686301 WELTVPNBPLVVLT-UHFFFAOYSA-N 337.405 0.064 10 20 ECCD CNC(=O)CN1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1044355379 RLWUYVZFSDTBST-UHFFFAOYSA-N 332.364 0.351 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1C[C@@H](O)[C@@H](CO)C1 1118633887 HLUCRPBMVNSQDF-RHSMWYFYSA-N 349.431 0.142 10 20 ECCD O=C(N[C@@H]1CCCN(CCN2CCOCC2)C1)c1cc(O)cs1 882631738 JTFUADPLXGEGIO-CYBMUJFWSA-N 339.461 0.980 10 20 ECCD CN(C)c1ccc(CNC(=O)CN(CC(N)=O)C2CCOCC2)cc1 880394740 QJJKRWJXTMDAAA-UHFFFAOYSA-N 348.447 0.335 10 20 ECCD C[C@H](O)CN(C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 891087743 WBMCSDIZNCQNIW-ZDUSSCGKSA-N 348.447 0.911 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3CNC(=O)N3)CC2)nc(C)n1 1089860624 IASIFSGOMQVGIJ-AWEZNQCLSA-N 344.419 0.418 10 20 ECCD CN1C[C@H](C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)NC1=O 1089855049 DFLYGGXRGHVZQA-GFCCVEGCSA-N 348.382 0.282 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCCCNCC(=O)NC2CC2)cc1 1177237559 DUHYCIWOGCAKAC-UHFFFAOYSA-N 346.391 0.837 10 20 ECCD CN(Cc1ncon1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1331165379 MHRHKWRQKYXKCG-UHFFFAOYSA-N 326.334 0.419 10 20 ECCD COc1ccc(N2CCC(NC(=O)CN3C(=O)CCC3=O)CC2)cc1 1345718661 UDOVUODPTNNGSG-UHFFFAOYSA-N 345.399 0.929 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)C2CN(C3CCOCC3)C2)cc1 1578424677 RIKZNGMKFFQTFJ-GOSISDBHSA-N 346.475 0.979 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2F)C1 1845903261 IIUKYJCHAYKBJR-QWRGUYRKSA-N 335.335 0.668 10 20 ECCD CN(C)CCC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249791 ZUXHTVOWKQCFIS-UHFFFAOYSA-N 348.403 0.262 10 20 ECCD O=C(CN1CCOCC1)NCc1ccc(N2CCOCC2)c(F)c1 51151930 JOYLARQCFVLELA-UHFFFAOYSA-N 337.395 0.611 10 20 ECCD O=C(N[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(O)c1O 365996956 LIMQJZXDYOVQMA-ZDUSSCGKSA-N 335.404 0.234 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@H](CO)c1cnn(C)c1 274076205 QGKRWFHOFJKIGP-QGZVFWFLSA-N 345.447 0.768 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCOCC23CC3)c1 802293800 VPEFYOGMJYVEDI-UHFFFAOYSA-N 326.374 0.769 10 20 ECCD CC(=O)C(=O)COC(=O)c1cccc(S(=O)(=O)NC(C)C)c1 808485183 PJZCHRHVPXVILN-UHFFFAOYSA-N 327.358 0.688 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(Cc3cn(C)nn3)C2)cc(OC)n1 1015104780 SCAYAJJUHFPPRU-LBPRGKRZSA-N 346.391 0.232 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NC[C@@H]1CCN1C 930865898 GXMTVXIRJQWPSV-YOEHRIQHSA-N 346.475 0.929 10 20 ECCD CN(C(=O)C(N)=O)[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 938731476 WLUKDIIAAZKKRA-NSHDSACASA-N 346.347 0.007 10 20 ECCD COc1ccc(CNC[C@H]2CCCN2C(=O)Cn2cnnn2)cc1C 1034855157 UISSKTKCTHFQFX-OAHLLOKOSA-N 344.419 0.771 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)N(C)CCn2cccn2)cc1 872932487 NIQVRYPXXOQVCZ-UHFFFAOYSA-N 346.387 0.941 10 20 ECCD CNS(=O)(=O)C[C@H]1CCCN1C(=O)/C=C\c1ccc(O)c(O)c1 779531300 VROYXNGPVWZHRZ-SMYYYNMVSA-N 340.401 0.651 10 20 ECCD CC(=O)c1cc(F)cc(Cn2cc(CN3CCNCC3)nn2)c1O 880995927 ITMXMXAYVAOZJY-UHFFFAOYSA-N 333.367 0.779 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)NC[C@H]2CNC(=O)C2)N(C)C)cc1 895337493 NEGBIECTIYRGLD-CZUORRHYSA-N 347.463 0.791 10 20 ECCD COc1ccc(-n2nnnc2CN(C)[C@H]2CCN(C(C)=O)C2)cc1 970916335 QWTZPQHQZDLGOL-AWEZNQCLSA-N 330.392 0.724 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)CN3CCOCC3)CC2)n1 1089819233 GZEZUZBFSDELCM-UHFFFAOYSA-N 345.447 0.760 10 20 ECCD NC(=O)NCCC(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089836483 WVIWJIQRLDFCMV-UHFFFAOYSA-N 336.371 0.317 10 20 ECCD C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CO1 1332192689 BTRROEQICXFJEF-DZGCQCFKSA-N 347.415 0.433 10 20 ECCD C[C@@H]1Cn2nc(C(=O)NC[C@@H](N)c3ccc(N(C)C)cc3)cc2CN1 1262553592 FQPTWBRMGQMVIO-MLGOLLRUSA-N 342.447 0.871 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCC(=O)NC(C)(C)C)cc1 1344853119 YMMQODCBMNIJOB-UHFFFAOYSA-N 348.447 0.790 10 20 ECCD CS(=O)(=O)CCC(=O)NCc1ccc(N2CCOCC2)cc1 97152678 ORLPOWCAIFAPEB-UHFFFAOYSA-N 326.418 0.574 10 20 ECCD Nc1ccc(CC(=O)NC[C@@H](N2CCNCC2)C(F)(F)F)cc1 262026239 PBHGKPPINSTQTG-CYBMUJFWSA-N 330.354 0.764 10 20 ECCD CCN1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 285681689 JRRVZEKWGBRXIZ-UHFFFAOYSA-N 336.411 0.672 10 20 ECCD O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)NCCc1ccc(O)c(O)c1 815833879 ITTOIBLJFMITJW-BETUJISGSA-N 344.367 0.708 10 20 ECCD COc1ccc(N2CC[C@H](CNCc3cn(CC(N)=O)nn3)C2)cc1 818220303 HDEIUXVPBSUIHZ-CYBMUJFWSA-N 344.419 0.388 10 20 ECCD CCOCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 826845091 FATFNAKLCIVGLR-UHFFFAOYSA-N 349.431 0.417 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CN2CCC(=O)NC2=O)cc1 844853827 LCFSSEQGVXXXSK-UHFFFAOYSA-N 348.403 0.532 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3cn[nH]c3)nc12 748039698 TVOWKMDIJRBRDY-UHFFFAOYSA-N 330.348 0.967 10 20 ECCD C[C@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C 743639204 VVDMTJIEANANSL-WDEREUQCSA-N 341.433 0.976 10 20 ECCD COc1cccc(O)c1CN1CCN(C(=O)CN2CCOCC2)CC1 768234915 RVMUDVHFQWRWCQ-UHFFFAOYSA-N 349.431 0.377 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@@H]2CC(=O)N(c3cnn(C)c3)C2)c1 860243016 ZXQQRUMYCRZQOL-GFCCVEGCSA-N 344.371 0.804 10 20 ECCD COc1cc(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(CCO)C3)cc(OC)n1 1047104213 PCZQPVYNBLSCAO-YUTCNCBUSA-N 335.404 0.674 10 20 ECCD 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COc1c([N+](=O)[O-])ccc(CN2CCOC[C@H]2CC(=O)O)c1O 1599345668 MCADXKPOPKYCSJ-SNVBAGLBSA-N 326.305 0.985 10 20 ECCD CCC(=O)NCCN(CCO)C(=O)c1ccc(N=NC(N)=O)cc1 1057917895 URPGJUXTQKPFAY-UHFFFAOYSA-N 335.364 0.810 10 20 ECCD O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NCc1ccccc1O 266534820 KPVQSFWTQRLFFM-VDERGJSUSA-N 344.367 0.561 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCNC(=O)C(C)(C)C)cc1 283438265 JTQIJKIOUWTPGC-UHFFFAOYSA-N 348.447 0.647 10 20 ECCD COC[C@@H]1CN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CCO1 807673866 AREWTCPXVLCCCM-BBRMVZONSA-N 349.431 0.804 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H](O)CC2)c1 819318078 IZBHTEOXOOUAMZ-NSHDSACASA-N 328.390 0.751 10 20 ECCD CCS(=O)(=O)NC(=O)c1ccc(NC(=O)C2=S=CC=C2)cc1 732607101 MCHSMGGYJWDZHC-UHFFFAOYSA-N 338.410 0.982 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)c2nnc(O)nc2O)cc1 846442400 PSTZWOHQYYSYDC-UHFFFAOYSA-N 333.348 0.500 10 20 ECCD C[C@H](N)C[C@@H](C)NC(=O)C(=O)NCCCSc1nccs1 843258773 CKGBXRHQVMYHQZ-VHSXEESVSA-N 330.479 0.984 10 20 ECCD 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COc1ccc(-n2nnnc2CNC[C@H]2C[C@H](NC(C)=O)C2)cc1 982952800 FIFYAICAHBDTBP-JOCQHMNTSA-N 330.392 0.675 10 20 ECCD COc1ccc(CNCCNC(=O)[C@@H]2CCCN2C(N)=O)cc1C 1153586211 LUGWRUVWBRHQHU-AWEZNQCLSA-N 334.420 0.753 10 20 ECCD COc1ccc(N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OC 1318027101 HAIGLSLKAWIPBI-NSHDSACASA-N 342.417 0.443 10 20 ECCD CC(=O)C(=O)COC(=O)[C@H](Oc1ccccc1-c1nn[nH]n1)C(C)C 1609061639 OIQJEKNEKUUAQC-CQSZACIVSA-N 346.343 0.971 10 20 ECCD COc1ccc(-n2nnnc2CN[C@H]2C[C@@H](NC(=O)C3CC3)C2)cc1 1021761225 RCGDGAOHODTFOT-BETUJISGSA-N 342.403 0.818 10 20 ECCD CCS(=O)(=O)CC(=O)NCc1ccc(N2CCOCC2)cc1 54285414 GIDOKEKGWIZFHL-UHFFFAOYSA-N 326.418 0.574 10 20 ECCD COC(=O)[C@@H](N/C=C1/C(=O)NC(=S)N(CC(C)C)C1=O)C(C)C 60864251 ZUMBRNCYGCPFCT-YAEJEKNGSA-N 341.433 0.557 10 20 ECCD COc1ccc(O)c(CN2CCCN(C(=O)CNC(C)=O)CC2)c1 529665860 SRGSPRXZIJZMCQ-UHFFFAOYSA-N 335.404 0.571 10 20 ECCD CS(=O)(=O)c1nnc(NC(=O)c2ccc(C3=S=CC=C3)o2)[nH]1 341915690 DIIMGOLINDYFFM-UHFFFAOYSA-N 338.370 0.679 10 20 ECCD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@H]1CO 288658214 VIRUCQCNXUYMBW-PBHICJAKSA-N 343.427 0.908 10 20 ECCD Cc1nn(C)c(C(=O)Nc2nc(C3=S=CC=C3)n[nH]2)c1[N+](=O)[O-] 732070663 BOGHJOHFXPNCKF-UHFFFAOYSA-N 333.333 0.633 10 20 ECCD COc1ccc(O)c(CNC(=O)NCCOCCS(C)(=O)=O)c1 745821391 YLZFWEWMIPWFSL-UHFFFAOYSA-N 346.405 0.261 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCCNCC1 842152789 JDMJOFNMSKFROW-OAHLLOKOSA-N 332.448 0.936 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCN[C@@H](C)C1 842153940 QUVJPYTVUIUHMI-DZGCQCFKSA-N 332.448 0.934 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(Cc3n[nH]c(C)n3)C2)cc(OC)n1 1015105651 XTOKEOHGCYZFBV-LBPRGKRZSA-N 346.391 0.530 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CC[C@@H]3C(N)=O)CC2)cc1F 847557024 NWFGTIFLLHKRPT-STQMWFEESA-N 335.379 0.994 10 20 ECCD COC(=O)[C@@]1(C)CCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 842237683 WDFWKTODWXFMKB-KRWDZBQOSA-N 333.388 0.339 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC[C@@H]1COCCO1 851992819 IZAVDSXNYUKUFB-QGZVFWFLSA-N 349.431 0.862 10 20 ECCD 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CN1CCN(c2ccc(CN3C[C@@H](CO)[C@@H](CO)C3)cc2F)CC1 1352878970 SXSFWJOLKBZIBN-IYBDPMFKSA-N 337.439 0.610 10 20 ECCD CN(C)c1ccc(CNC(=O)NCCN2C(=O)CCC2=O)cc1F 73062196 LYJYFTCPZSKWNL-UHFFFAOYSA-N 336.367 0.840 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](N)CCS(C)(=O)=O 313988592 ANVOYTICRPYGAN-AWEZNQCLSA-N 327.450 0.473 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CC[C@H](C(N)=O)O1 126276588 YYWKKUKBRZVSHH-LSDHHAIUSA-N 334.420 0.927 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3nc(C)sc3=O)CC2)cc1 192455472 MWNAHWXSXPWBNW-UHFFFAOYSA-N 348.428 0.971 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCNC3)CC2)cc1 269299539 PXEWYDPSIDHHJZ-OAHLLOKOSA-N 332.448 0.543 10 20 ECCD COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)C(N)=O)CCCC1 614070568 IVLOZJNGWBGUJD-INIZCTEOSA-N 345.399 0.491 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](N(C)C)C2)cc1 283656212 XZRZBJPMYYFTAV-INIZCTEOSA-N 332.448 0.921 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCC2(N(C)C)CCC2)cc1 807029975 UZEHDCFXJZPTLE-UHFFFAOYSA-N 332.448 0.969 10 20 ECCD O=C(Cc1ncc[nH]1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 822759554 SVBRNDSQTVBAET-UHFFFAOYSA-N 348.428 0.503 10 20 ECCD COC[C@](C)(O)CNC(=O)NCc1ccc(N2CCOCC2)cc1 732700685 IRGDNDOGZBNXFZ-QGZVFWFLSA-N 337.420 0.720 10 20 ECCD CCS(=O)(=O)N[C@H](C)C(=O)N[C@@H](C)c1cc(OC)ccc1O 830540919 PTWKFETXCVJPBV-VHSXEESVSA-N 330.406 0.906 10 20 ECCD CN(CCCN)C(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 911581007 XZVDNVGUNVFFPZ-MRXNPFEDSA-N 349.479 0.279 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N[C@H](C)CCN 842069869 FVJQUBWIFXNRKF-ZIAGYGMSSA-N 334.464 0.962 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN([C@@H]3CCCNC3=O)C2)cc(OC)n1 1015100750 DICMIMPIQDNRGO-QWHCGFSZSA-N 348.403 0.182 10 20 ECCD C[C@H](N[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 1021116436 GCNKKKFFVKACKK-UWJYBYFXSA-N 332.364 0.573 10 20 ECCD CN1C[C@H](C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CC1=O 891255972 UMHKNLHMBLMZPE-GDBMZVCRSA-N 332.448 0.950 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@@](C)(O)Cn2ccc(C)cc2=O)c1 790712826 MOWAUNNIISKDNR-SFHVURJKSA-N 346.383 0.938 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)Cn3nccn3)CC2)n1 1089843283 CCIDLBWYXWZHSH-UHFFFAOYSA-N 327.392 0.720 10 20 ECCD CNC(=O)CN1CC[C@@H]1CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1085994214 GAUYCZCDEUTDIN-CYBMUJFWSA-N 346.391 0.741 10 20 ECCD CC(=O)N1CCN(C(=O)C(=O)N(C)Cc2ccccc2O)[C@@H](C)C1 1324942181 NOUUGVLTPUFEGQ-LBPRGKRZSA-N 333.388 0.430 10 20 ECCD C[C@@H]([C@@H](C)NC(=O)C(=O)N(C)Cc1ccccc1O)N1CCOCC1 1322584230 XQTWPOMTTFYFAC-KGLIPLIRSA-N 349.431 0.576 10 20 ECCD C[C@H](NC(=O)C(=O)N[C@@H](C)c1ncn(C)n1)c1ccc(N(C)C)cc1 1342711057 AFILUGXVNIMNOV-RYUDHWBXSA-N 344.419 0.936 10 20 ECCD Nc1ccc(NC(=O)[C@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)cc1 1345811350 HBKFHPGQFIAGTH-GXFFZTMASA-N 337.401 0.243 10 20 ECCD CN1CCN(c2ccc(CN[C@](C)(CO)C(=O)O)cc2F)CC1 1598624619 PKWJFLIZRNSFIQ-MRXNPFEDSA-N 325.384 0.503 10 20 ECCD C[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C(N)=O)O1 268430972 ISYTULARIBINST-CJNGLKHVSA-N 348.447 0.286 10 20 ECCD O=C1NC(=O)C2(CCC(NCc3cc4c(cc3O)OCO4)CC2)N1 285391943 DIPANNOPVUVNBY-UHFFFAOYSA-N 333.344 0.731 10 20 ECCD CCN(CC(=O)c1c(N)n(C)c(=O)n(C)c1=O)c1ccc(OC)cc1 299405353 XIRZYGOWLHSSTE-UHFFFAOYSA-N 346.387 0.384 10 20 ECCD C[C@H](NC(=O)NC[C@H]1CC(C(N)=O)=NO1)c1ccc(N(C)C)cc1 838560142 SKXVONNAIZWKME-GXFFZTMASA-N 333.392 0.743 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H](C)N[C@H](C)C1 842151878 DFKRDVLIXIDCRS-ZIAGYGMSSA-N 332.448 0.886 10 20 ECCD CO[C@](C)(C(=O)O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 849364175 FBLUPNININEXGM-INIZCTEOSA-N 340.351 0.768 10 20 ECCD O=C(NCc1ccccc1O)Nc1cnc(N2CCNCC2)nc1 841324792 GCFAIBVEPYDCAG-UHFFFAOYSA-N 328.376 0.914 10 20 ECCD COc1cncc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n1 845947582 QHMYGDQWNBZBFJ-SECBINFHSA-N 346.343 0.582 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)C(=O)N[C@@H]2CCOC2)N(C)C)cc1 929988956 PBVQVCFWOVOIRP-GDBMZVCRSA-N 348.447 0.377 10 20 ECCD CNC(=O)[C@H](O)CNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 763701747 VVLOBJYTFYCKKQ-MRXNPFEDSA-N 347.415 0.741 10 20 ECCD NC(=O)[C@@H]1CC[C@H](CNC(=O)NCCCSc2nccs2)O1 760193894 KIDMUACQFQGCPJ-ZJUUUORDSA-N 344.462 0.957 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3CCOC[C@H]3O)C2)cc1 875680474 VJNLTRVVEMKWBF-IAOVAPTHSA-N 349.431 0.971 10 20 ECCD CCn1[nH]nnc1=NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 888343799 XQGBRARLZRMBJN-UHFFFAOYSA-N 349.370 0.412 10 20 ECCD COC[C@@H](C)C(=O)NCCNCc1nnnn1-c1ccc(OC)cc1 1124753678 LCLBSRBLMBKWAM-GFCCVEGCSA-N 348.407 0.159 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CCOC3(CN(CCO)C3)C2)cc1 1053546913 YUYZOFZWPXITCH-UHFFFAOYSA-N 347.375 0.368 10 20 ECCD CO[C@@H](C(=O)O)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1604431729 FLGCTWNHSQTSAC-CQSZACIVSA-N 349.387 0.104 10 20 ECCD CN(CC(=O)N1CCN(C(=O)C2CC2)CC1)Cc1ccccc1O 111235182 LWGMALBDSFTDQZ-UHFFFAOYSA-N 331.416 0.905 10 20 ECCD COc1ccc(O)c(CNC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)c1 364807330 VBGOHROAKTVCFL-QGZVFWFLSA-N 347.371 0.738 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N(C)[C@H](C)CN)C2)cc1 818675812 HGAFQFYTNQEFMM-ZIAGYGMSSA-N 348.447 0.443 10 20 ECCD O=C(NCc1ccccc1O)[C@H](O)c1ccc(-c2nn[nH]n2)cc1 826443490 RGNVZDBLZUIBRQ-CQSZACIVSA-N 325.328 0.922 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](C)N)CC2)cc1 841751477 ZHWUPQMKFGUBIF-CQSZACIVSA-N 335.452 0.464 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)[C@H](C)CN1 842150468 SMFDMDWJFTYIQP-ZIAGYGMSSA-N 344.459 0.894 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CN)CC2)cc1 841750393 PRAKSTTXIATYMI-CQSZACIVSA-N 335.452 0.464 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@H](O)C3)CC2)cc1 754027086 BHHWNWJCFOLJJG-DLBZAZTESA-N 335.448 0.245 10 20 ECCD CN1C(=O)CN(CC(=O)NCCCSc2nccs2)C1=O 859351974 PKPDABDWWQNQQL-UHFFFAOYSA-N 328.419 0.636 10 20 ECCD Cc1ncc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)o1 857534905 CGUWWXUBACPORG-UHFFFAOYSA-N 325.346 0.990 10 20 ECCD COc1ccc(N(C)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)nc1 766840062 HIHJBUFHBWHRHX-UHFFFAOYSA-N 348.384 0.551 10 20 ECCD CC1(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)COC1 875127359 CTUFEOJBBUFBCD-CQSZACIVSA-N 346.431 0.976 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H](CO)C1 774207645 NKZZWLMWNGDCDA-CQSZACIVSA-N 333.432 0.908 10 20 ECCD NC(=O)C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C1CCOCC1 779489911 TVRDXRQRIQQAOC-CXLRFSCWSA-N 334.372 0.898 10 20 ECCD CC(C)(C)NS(=O)(=O)CCNC(=O)/C=C\c1ccc(O)c(O)c1 779499390 LZNQMOINELDJLQ-ALCCZGGFSA-N 342.417 0.945 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCCCO)cc2)C1 787013645 LJFKYGYCVFRYQL-HNNXBMFYSA-N 348.447 0.960 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CC(NC(=O)c3nc[nH]n3)C2)cc1 997815279 ANXYBIDAIRIQEX-UHFFFAOYSA-N 342.319 0.222 10 20 ECCD C[C@H]1COC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1333342075 OHDRTAJPEWTNQG-BBRMVZONSA-N 329.400 0.830 10 20 ECCD Cc1ccc(C(=O)NC2(C(=O)O)CCS(=O)(=O)CC2)c(O)c1O 1600335802 DCGMCWMOZVGAGM-UHFFFAOYSA-N 343.357 0.168 10 20 ECCD C[C@@H]1[C@@H](C(=O)O)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1594158705 LIDNVYFUVLZANI-SCZZXKLOSA-N 342.373 0.699 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)S(C)(=O)=O 42720422 ZCANVASCOHJLLR-UHFFFAOYSA-N 327.450 0.993 10 20 ECCD COCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 283648900 STKRSTHKOLQMEU-UHFFFAOYSA-N 335.404 0.292 10 20 ECCD CCOc1cccc(CN2CCC(NS(=O)(=O)NC)CC2)c1O 291645944 UFTSHEVDHZRHNF-UHFFFAOYSA-N 343.449 0.809 10 20 ECCD Cn1ncnc1COC(=O)c1cc(NS(C)(=O)=O)ccc1O 801242116 REFPNBSZBWJAKX-UHFFFAOYSA-N 326.334 0.249 10 20 ECCD Cc1nc2ccc(NC(=O)C(=O)NCc3ccccc3O)cn2n1 810358772 LMGPWSJFORDHQD-UHFFFAOYSA-N 325.328 0.998 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1NC(=O)O[C@@H]1C 819699003 VSLNWRMOICTSSR-QMTHXVAHSA-N 336.344 0.781 10 20 ECCD COc1ccc(N2CCN(C(=O)CNC(=O)[C@H]3CCCN3)CC2)cc1 825728531 ZRAJTQSALOTEJB-MRXNPFEDSA-N 346.431 0.212 10 20 ECCD NS(=O)(=O)[C@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 779519974 NKIJMBAPKSJLOW-QZPNVGJNSA-N 326.374 0.391 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2nccc(N)n2)c1 771041438 STDBHVLEMKOTOH-UHFFFAOYSA-N 337.361 0.066 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCN(CC3CC3)C2)cc1 785424921 WVAYXDPFMHXAKR-INIZCTEOSA-N 344.459 0.969 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2[C@@H]3CN(CCCO)C[C@@H]23)cc1 962968141 ACBJVEWDOUKIGP-CHWSQXEVSA-N 331.376 0.891 10 20 ECCD CCc1nn(C)cc1NC(=O)C(=O)NCc1ccc(OC)cc1O 797390368 UVTQGVQNVHRUBD-UHFFFAOYSA-N 332.360 0.952 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)Cn3cnnc3O)CC2)n1 1089827514 NMFZJDNDSQAFHT-UHFFFAOYSA-N 343.391 0.425 10 20 ECCD C[C@H](CC(N)=O)C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089850232 QNXXJKSWGIPRDM-LLVKDONJSA-N 335.383 0.770 10 20 ECCD C[C@@H]1C[C@H]1C(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089802188 IBCQMTKIFLOMMA-DGCLKSJQSA-N 327.392 0.818 10 20 ECCD O=C(O)CN(Cc1ccccc1O)C(=O)[C@@H]1OC[C@@H]2COCC[C@@H]21 1346336879 MYESTFIIQWCKPA-HEHGZKQESA-N 335.356 0.857 10 20 ECCD CN(C(=O)NCc1ccc(N)cc1)[C@@H]1CCN(S(C)(=O)=O)C1 1262603211 AVYMFXFJMACNCV-CYBMUJFWSA-N 326.422 0.444 10 20 ECCD C[C@H]1SC[C@H](C(=O)NCCC(=O)O)N1C(=O)c1cc(O)cs1 1604838033 GTIJDOVUVTZAPX-VXNVDRBHSA-N 344.414 0.948 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@]34CNC[C@H]3CCO4)CC2)cc1F 1548554323 FZPKPXRSWQSFMO-ACJLOTCBSA-N 349.406 0.861 10 20 ECCD CC(C)OCC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248696 FNIQMDJHYRPBJU-UHFFFAOYSA-N 349.387 0.735 10 20 ECCD 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COc1ccc(N2CC[C@H](CNC(=O)CN3CCNCC3)C2)cc1 876931874 XPGAWJNPIQBIFL-OAHLLOKOSA-N 332.448 0.543 10 20 ECCD CN1CCN(c2ccc(CN=c3nc4[nH][nH]cc-4c(O)n3)cc2)CC1 882880329 MPDGNBPNTXQVJA-UHFFFAOYSA-N 339.403 0.796 10 20 ECCD CNC(=O)C[C@H](C)NC(=O)NCc1ccc(N2CCN(C)CC2)cc1 883730030 HFVULHJHCIDGMG-AWEZNQCLSA-N 347.463 0.762 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H](N)CCC(=O)O)CC2)cc1F 1599584986 ARGDXORCCMEZDJ-CYBMUJFWSA-N 339.367 0.675 10 20 ECCD CN(C)c1ccc(CNC(=O)CCN2CCCS2(=O)=O)cc1F 194893207 HWFGFQSZJNZVLV-UHFFFAOYSA-N 343.424 0.934 10 20 ECCD CN(CC(C)(C)O)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 283868638 DKJKKQMDKLVGBQ-UHFFFAOYSA-N 349.431 0.369 10 20 ECCD CCN(C)C(=O)CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 807096487 JUIQMCXWNQVCFN-UHFFFAOYSA-N 334.420 0.272 10 20 ECCD CCCN(CCO)C(=O)C(=O)NCCCSc1nccs1 806278263 PMEOFLORRDJEPN-UHFFFAOYSA-N 331.463 0.972 10 20 ECCD CCN1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1=O 807677614 RCYDRRYTZGUPIP-CYBMUJFWSA-N 346.431 0.621 10 20 ECCD COCCN(CC(=O)NCC(=O)O)c1ccc(OC)c(OC)c1 294733889 JCLGWAMCZRVQGC-UHFFFAOYSA-N 326.349 0.357 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H]3COCCO3)CC2)cc1 299511393 SRJWYTMBFHBIPF-QGZVFWFLSA-N 349.431 0.349 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H](NC(C)=O)C1 817764103 NZOLRXUSXHUXBA-OAHLLOKOSA-N 347.415 0.868 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCN(C(C)(C)CO)CC2)cc1 735871072 VHQJHVINJUOULV-UHFFFAOYSA-N 348.491 0.757 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)c2cc([C@H]3CCNC3)[nH]n2)cc1 841847125 ZXEMXYHQAVEWRD-ZFWWWQNUSA-N 342.447 0.982 10 20 ECCD COCCNCCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 842270381 IUAVQKLKFHFHTQ-UHFFFAOYSA-N 336.436 0.063 10 20 ECCD NC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 842170943 OWADVUJNHJMFJE-INIZCTEOSA-N 342.443 0.876 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCCO[C@@H](CN)C1 842154971 YUPRDWXYWBAULG-INIZCTEOSA-N 348.447 0.253 10 20 ECCD C[C@H](NCCS(=O)(=O)N1CCOCC1)c1cc(F)ccc1O 756684533 BQBHMFYTMINABQ-NSHDSACASA-N 332.397 0.844 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](N[C@@H]3CCCNC3=O)C2)cc(OC)n1 1022368365 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HRPIWQKFLVAJDZ-NSHDSACASA-N 346.343 0.946 10 20 ECCD COC[C@@H](C)NC(=O)NC(=O)COC(=O)c1ccc(C)c(O)c1O 727005096 GGGWHVUEZIOQKS-SECBINFHSA-N 340.332 0.424 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)NC3CC3)cc2)C1 734428715 OXZKYQPRCUEJDY-ZDUSSCGKSA-N 344.415 0.283 10 20 ECCD COc1cncc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n1 845947583 QHMYGDQWNBZBFJ-VIFPVBQESA-N 346.343 0.582 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNCC3(CO)CC3)CC2)cc1 843076915 ZQKXLPYQTRRGKJ-KRWDZBQOSA-N 349.475 0.540 10 20 ECCD O=C(CCn1ccnn1)NCc1ccc(N2CCC(O)CC2)cc1 856209954 JEVJZPVEYPBSEN-UHFFFAOYSA-N 329.404 0.946 10 20 ECCD CN(CCOCCN)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 861749749 ITSIHEDVLDLMJA-UHFFFAOYSA-N 348.447 0.119 10 20 ECCD CN[C@H]1CCN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1119425380 UUPBSDQGHKFJQT-INIZCTEOSA-N 331.464 0.942 10 20 ECCD COc1cc(C(=O)N[C@H]2COC3(C2)CN(C(C)=O)C3)cc(OC)n1 965755510 MUBUUUGSWWNJRJ-GFCCVEGCSA-N 335.360 0.218 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)C[C@]2(CCOC2)O1 1326912414 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MQGTUEFERSQRAS-UHFFFAOYSA-N 335.452 0.465 10 20 ECCD CN1CC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 929523255 HKTVWFRSOJHJOI-INIZCTEOSA-N 330.432 0.723 10 20 ECCD COc1ccc(O)c(CNC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c1 769540821 JRPGYYRWKQPVHJ-UHFFFAOYSA-N 341.323 0.861 10 20 ECCD CN1CCC[C@@H](N(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 769913420 QICQDWPIIFWBHD-GFCCVEGCSA-N 341.433 0.930 10 20 ECCD NS(=O)(=O)C[C@@H]1CCCCN1C(=O)/C=C/c1ccc(O)c(O)c1 779534394 FSLQJRFXRQAFOR-PZBABLGHSA-N 340.401 0.781 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNCCCN(C)S(C)(=O)=O)c1O 774960797 IKVJGQAXKNUZRR-UHFFFAOYSA-N 347.393 0.680 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3c[nH]c(C(N)=O)c3)cc2)CC1 881849245 CZZCSSKCXHYGLY-UHFFFAOYSA-N 341.415 0.795 10 20 ECCD COc1ccc(CNCC2CC(NC(=O)Cn3ncnn3)C2)cc1C 961841044 ACYMRJGLATYPET-UHFFFAOYSA-N 344.419 0.675 10 20 ECCD COCCn1nnnc1N(C)Cc1ccc(N2CCOCC2)cc1 1262390795 OMTYAJIWDXQTHX-UHFFFAOYSA-N 332.408 0.793 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1C[C@@H]2C[C@@]2(CO)C1 1346592436 YUTOZODZOAMFJA-KXBFYZLASA-N 341.411 0.520 10 20 ECCD O=C(O)COCCOCCNC(=O)/C=C/c1ccc(O)c(O)c1 1606279130 SKFDSJZBTUSWMT-DUXPYHPUSA-N 325.317 0.345 10 20 ECCD O=C(O)c1cn([C@H]2CCCN(C(=O)c3cccc(O)c3O)C2)nn1 1610856825 VIMHSZGUYJTKET-VIFPVBQESA-N 332.316 0.865 10 20 ECCD CN(C)CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796599558 YMZDBDHSARIDSJ-CLLJXQQHSA-N 348.403 0.306 10 20 ECCD CC(=O)c1cc(Cl)cc(CN2CCN(C(=O)CO)CC2)c1O 152643457 QYGKILIPDLDLJL-UHFFFAOYSA-N 326.780 0.885 10 20 ECCD CCOC(=O)CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 51385363 JPUPUIRSGYYZGT-UHFFFAOYSA-N 330.362 0.447 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CC[C@@H](C(=O)O)O3)CC2)cc1 325753965 CXIZUZYAMLUBTD-CABCVRRESA-N 334.372 0.976 10 20 ECCD C[C@H]1CCNC(=O)[C@@H]1NCC(=O)N(C)Cc1ccc(N(C)C)cc1 193568457 SHGDVTBRDKGCAE-SUMWQHHRSA-N 332.448 0.825 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCC(=O)N(C)C 283505638 DYGYUJCEBNAQNH-UHFFFAOYSA-N 335.404 0.725 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)Cn3cccn3)CC2)cc1 299493774 IKLHJKQOVFMGBS-UHFFFAOYSA-N 343.431 0.830 10 20 ECCD C[C@@H]1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)CC(=O)N1 297143889 UZSDFYRLVFVCGQ-BTKRWWFXSA-N 329.400 0.883 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)N1CCCOCC1 806277035 ODXZRWHNJDZEJB-UHFFFAOYSA-N 329.447 0.990 10 20 ECCD CN1CC[C@@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 729526178 ZBFQDABQZKEXIO-JKSUJKDBSA-N 344.459 0.956 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCN(C3CC3)C2)c1 746882981 OQGMZGCVMKQNFZ-LLVKDONJSA-N 339.417 0.730 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN(C)CC(=O)O)CC2)cc1 846263284 SWQBHVZSGNJUFT-HNNXBMFYSA-N 337.420 0.195 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@@H]3CNC[C@@H]3C2)cc1 842036754 WRPBARUXAGZCRI-OWCLPIDISA-N 344.459 0.873 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN(C)[C@H]3CCNC3)CC2)cc1 923288310 VIRYEGDKZPDYPG-ROUUACIJSA-N 348.491 0.472 10 20 ECCD O=C(/C=C\c1ccc(O)c(O)c1)OCCN1CCCS1(=O)=O 759596093 MDODUGZAOKLKGK-HYXAFXHYSA-N 327.358 0.690 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CCCO3)nc12 763802581 LVMMTNALYLZZIC-NSHDSACASA-N 335.316 0.834 10 20 ECCD Cn1ncnc1CN1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1031464610 VCSHMHGDACMWMY-UHFFFAOYSA-N 342.363 0.592 10 20 ECCD COc1ccc(CNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c(O)c1 1116871291 MTEUHMZPIUWAOW-UHFFFAOYSA-N 333.300 0.787 10 20 ECCD CC[C@H](CNS(C)(=O)=O)NC(=O)/C=C\c1ccc(O)c(O)c1 1117846274 KNDYYNNSCANIAD-JPVGGKMYSA-N 328.390 0.555 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)N[C@H]3CCNC3)cc2)CC1 892007238 PJFQSTZQESSSCU-HNNXBMFYSA-N 345.447 0.549 10 20 ECCD COc1ccc(N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)cc1F 1319594789 PQXKAGIELSOOLN-JTQLQIEISA-N 330.381 0.574 10 20 ECCD CCn1c(C(N)=O)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1342971305 CWUVLWKUOBJJSR-UHFFFAOYSA-N 344.419 0.870 10 20 ECCD COc1cc(NS(=O)(=O)c2cnn(CC(=O)O)c2)ccc1O 1607183657 WUTWMOZWFSUZTK-UHFFFAOYSA-N 327.318 0.483 10 20 ECCD C[C@@H]1[C@H](C(=O)O)CCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 1594142310 RWFGQYMYKPJUDM-BXUZGUMPSA-N 333.388 0.690 10 20 ECCD O=C(O)CS(=O)(=O)CCNCc1ccc(N2CCOCC2)cc1 1595125084 LCTNNYGKGKBAFK-UHFFFAOYSA-N 342.417 0.112 10 20 ECCD CS(=O)(=O)NCCCNCc1ccc(N2CCOCC2)c(F)c1 66970964 PGVAFRMVEPAFCR-UHFFFAOYSA-N 345.440 0.691 10 20 ECCD CCS(=O)(=O)NCCNCc1ccc([N+](=O)[O-])c(OC)c1O 278561885 BKSXDVHRJPJFRF-UHFFFAOYSA-N 333.366 0.338 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1CNCCO1 842278083 XBGKOISTQMJWJD-OAHLLOKOSA-N 349.431 0.626 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCS1(=O)=O 847381346 KDZYBIHGSGTDDB-OAHLLOKOSA-N 338.429 0.717 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)Cn2cccnc2=O)cc1 846445658 CLOVOWBRXFIGMQ-UHFFFAOYSA-N 330.388 0.847 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H](C)CN)cc1F 842210399 ZZFGFCFBBULSMK-LBPRGKRZSA-N 338.427 0.999 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)NCCc2ccnn2C)cc1 853007083 OQOXOLUMZQYWFB-UHFFFAOYSA-N 346.387 0.679 10 20 ECCD CCN(CCN)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 861565781 ZWKQQNZXTANJTQ-HNNXBMFYSA-N 347.463 0.879 10 20 ECCD O=C(CN1CCNCC1)NCc1ccc(N2CCSCC2)cc1 876731542 RTOFQOAFHBSRTJ-UHFFFAOYSA-N 334.489 0.761 10 20 ECCD COC(=O)c1cn(C2CN(C(=O)c3ccc(C)c(O)c3O)C2)nn1 781021452 PVIXDHGTIJQTCU-UHFFFAOYSA-N 332.316 0.481 10 20 ECCD COc1ccc(CNCCNC(=O)Cn2nc(C)ccc2=O)cc1C 1148559870 NASAFOOZKGPEPH-UHFFFAOYSA-N 344.415 0.775 10 20 ECCD COc1ccc(CNS(=O)(=O)c2ccc(C(N)=O)cc2)c(O)c1 795357789 IXWWECBKFXUNNP-UHFFFAOYSA-N 336.369 0.978 10 20 ECCD COCC(=O)NCCC1=CCN(c2ncnc3c2ncn3C)CC1 1089798163 SYCIVTIKDXCTQX-UHFFFAOYSA-N 330.392 0.653 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@H]3COC(=O)N3)CC2)nn1 1089829773 WREUFPRUEGLUKA-CYBMUJFWSA-N 331.376 0.536 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3[nH]ccc3C)C2)cc(OC)n1 996369489 XXPHGFMPUHGJST-UHFFFAOYSA-N 344.371 0.990 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ncn(C)n1 1323009549 BQJJRLIAXJTXRW-UHFFFAOYSA-N 345.403 0.966 10 20 ECCD CN(C(=O)C(=O)NCCCSc1nccs1)[C@@H]1CCNC1=O 1342164422 FDLZKYSMHFZVND-SECBINFHSA-N 342.446 0.088 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)C2CN([C@H]3CCOC3)C2)cc1 1578424846 ZBCHTMBKRCXNHL-IRXDYDNUSA-N 332.448 0.589 10 20 ECCD 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C[C@@H](C(N)=O)N1CC[C@@H](N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1033698999 HSANZHYEDZJPSL-GXFFZTMASA-N 346.391 0.869 10 20 ECCD COc1ccc(N2CCN(S(=O)(=O)c3nncn3C)CC2)cc1 866389384 RRZRJHDKDMGVCL-UHFFFAOYSA-N 337.405 0.335 10 20 ECCD C[C@@H](C(=O)N(C)c1ccc(N)cc1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 877077380 GENNWFLTSLMGJS-XNHWVXRISA-N 343.383 0.783 10 20 ECCD COc1ccc(-n2nnnc2CN2CC(N(C)C(=O)C(C)C)C2)cc1 1042489399 KFGCDAUDFASDME-UHFFFAOYSA-N 344.419 0.970 10 20 ECCD COC(=O)N1CC(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1117654866 QFKLSDZDGGJGKO-UHFFFAOYSA-N 348.403 0.278 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCn4ncnc4C3)nc12 770686867 XWSQLVMZTGKEIW-UHFFFAOYSA-N 343.347 0.219 10 20 ECCD C[C@@]1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCOC1=O 794086884 VVXMXUDHMMVKSW-CYBMUJFWSA-N 328.346 0.199 10 20 ECCD C[C@H](N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@H]1C)C(N)=O 1075140746 XOZBCIHYJPFRCE-KWBADKCTSA-N 346.391 0.915 10 20 ECCD CCC(=O)N1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@H](O)C1 991568524 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CQGGJUIGZZYJTN-ZDUSSCGKSA-N 328.372 0.747 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN(C)C(C)=O 1320143127 SQFUMSHQQNCTSG-LBPRGKRZSA-N 338.360 0.167 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)NC[C@@H](C)OC)C2)cc1 1347644108 PNEDISPZTWMBAH-KGLIPLIRSA-N 349.431 0.789 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2cnc(C(=O)O)cc2=O)cc1 1606055141 CYYOQVZHRKLKDA-UHFFFAOYSA-N 330.344 0.324 10 20 ECCD O=C(O)[C@H](Cc1cnc[nH]1)NCc1ccc(N2CC[C@H](O)C2)cc1 1777589296 VWLNQKNCBZESOJ-HOTGVXAUSA-N 330.388 0.766 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCC(O)CC3)CC2)cc1 23993355 WNPKUYWKRQKXJC-UHFFFAOYSA-N 333.432 0.801 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)CN1CCC(=O)NC1=O 266349829 OTKCYPLXWHLVPI-UHFFFAOYSA-N 332.360 0.420 10 20 ECCD CCN(CC(C)(C)O)C(=O)c1cc(NS(C)(=O)=O)ccc1O 270942363 VUMFAHZBXHUAIY-UHFFFAOYSA-N 330.406 0.997 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)CCNC(=O)[C@@H]2CCCN2)c1 828667996 XQHXHFJYPYQFDQ-FZMZJTMJSA-N 335.404 0.836 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H](OC)C(=O)O)CC2)cc1F 901919507 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1594158707 LIDNVYFUVLZANI-WPRPVWTQSA-N 342.373 0.699 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3CNC(=O)N3)C2)cc1C 1022629721 HCDPWHYWWUFQJV-MJBXVCDLSA-N 332.404 0.422 10 20 ECCD Cn1nc2c(cc1=O)CN(C(=O)/C=C/c1ccc(O)c(O)c1)CC2 368066746 ZUQGGEQNLCGQQC-HWKANZROSA-N 327.340 0.790 10 20 ECCD COCC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 283950302 HSYIURQKSCPZGA-CQSZACIVSA-N 349.431 0.681 10 20 ECCD C[C@@H](NC(=O)C(=O)N1CCn2cnnc2C1)c1ccc(N(C)C)cc1 807670725 HLZPHBGUWHQQIN-GFCCVEGCSA-N 342.403 0.564 10 20 ECCD CC(C)[C@@H](CO)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 805315491 LMNLMILSSBIDTJ-SNVBAGLBSA-N 330.406 0.758 10 20 ECCD C[C@H]1[C@@H](N(C)C)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 816767612 CLWCAVWPKPYITN-GWCFXTLKSA-N 341.433 0.928 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN[C@H]3CCOC3)CC2)cc1 819187342 IKAGZZGKCKPJFK-DOTOQJQBSA-N 335.448 0.557 10 20 ECCD COCC1(S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)CC1 842784995 JTNSMVRWUYFMIO-AWEZNQCLSA-N 327.450 0.851 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H]2COCCN2)cc1 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SRAMXROVFFGSEX-GXFFZTMASA-N 346.391 0.869 10 20 ECCD C[C@H](C(=O)O)N(C(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 1588589281 GYSNZUHJNWAZOX-MRVPVSSYSA-N 342.373 0.841 10 20 ECCD COc1ccc(N2CCN(S(=O)(=O)C[C@@H](C)C(=O)O)CC2)cc1 20184805 ICIJKOGTUQFIEC-GFCCVEGCSA-N 342.417 0.868 10 20 ECCD CC(=O)N1CC(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 191860311 KBJQZDUNQLBRJG-UHFFFAOYSA-N 345.443 0.990 10 20 ECCD Nc1ccc(CCNS(=O)(=O)N2CCC3(CC2)OCCO3)cc1 262785139 QCIYRKXLKDXFJS-UHFFFAOYSA-N 341.433 0.485 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3ccn[nH]3)cc2)CC1 276290412 TYQMJKLLQGYXOM-UHFFFAOYSA-N 341.415 0.937 10 20 ECCD C[C@@H]1OCC[C@@]1(O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 279489905 NEAZCNASAJXQEZ-LKFCYVNXSA-N 344.389 0.033 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCOCC34CC4)nc12 801982033 FNMBMTSJVAKMPQ-UHFFFAOYSA-N 332.360 0.976 10 20 ECCD NCCCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827387936 BDZFDFBURATIKL-UHFFFAOYSA-N 325.434 0.277 10 20 ECCD CNC(=O)NC(=O)CN(CC(=O)O)Cc1cc(Cl)ccc1O 737542721 HMDIRAIOQPZWEX-UHFFFAOYSA-N 329.740 0.388 10 20 ECCD COC(=O)CN(CCN1CCOCC1)C(=O)c1cc(O)cs1 735522836 NHZLAERWGDBJCL-UHFFFAOYSA-N 328.390 0.401 10 20 ECCD CCS(=O)(=O)NCCCN(C)c1ccc(OCC(=O)O)cc1 846280475 XPFHTFNIHIAYCV-UHFFFAOYSA-N 330.406 0.916 10 20 ECCD CCO[C@@H](C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 920096934 JFTFCBZMDHBAPC-ZDUSSCGKSA-N 340.445 0.963 10 20 ECCD CN(C[C@@H]1COCCO1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 855681179 HBGPEMLRLVTGOC-LLVKDONJSA-N 344.389 0.251 10 20 ECCD CNS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C\c1cn(C)cn1)CC2 933497069 MRFFZPZGSIBIRE-XQRVVYSFSA-N 346.412 0.931 10 20 ECCD C[C@@H](NC(=O)c1cn(CC(=O)N(C)C)nn1)c1ccc(N(C)C)cc1 773013131 ITTHCOHJYCZZCL-GFCCVEGCSA-N 344.419 0.923 10 20 ECCD COc1ccc(CNC[C@@H]2CN(C(=O)C(N)=O)CCCO2)cc1C 1078458874 UQZZWLNITFIJDB-CQSZACIVSA-N 335.404 0.196 10 20 ECCD CN1C[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1=O 1321936029 YKIDOJLXQYVCBF-CQSZACIVSA-N 344.415 0.032 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cccn(C)c1=O 1338723044 DWCGXRISZHIPOJ-JTQLQIEISA-N 345.355 0.482 10 20 ECCD CO[C@@H]1CCOC[C@H]1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1332978537 BZOJCJMOPDONBL-APHBMKBZSA-N 349.431 0.850 10 20 ECCD COC[C@H](C)NC(=O)NC(=O)CSc1ncc(C(=O)O)s1 1606796877 CJUBBNLIUOSTAO-LURJTMIESA-N 333.391 0.794 10 20 ECCD Cn1nnnc1-c1cccc(S(=O)(=O)NCc2ccc(N)cc2)c1 1580025901 BOWRTYGYXZWIAI-UHFFFAOYSA-N 344.400 0.938 10 20 ECCD CC(=O)c1cc(F)cc(CN(CCO)CCN2CCOCC2)c1O 86168613 SRYMSUFZEMZVFG-UHFFFAOYSA-N 340.395 0.860 10 20 ECCD COc1cccc(CNC(=O)NCCC(=O)N2CCOCC2)c1O 266705591 XQYIEIAADDUMNJ-UHFFFAOYSA-N 337.376 0.449 10 20 ECCD CN1C[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)CC1=O 267555339 DZHYGBAXHDECLP-CQSZACIVSA-N 332.404 0.553 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)NS(C)(=O)=O 274984656 XWTKSYSXFVBALY-VIFPVBQESA-N 330.406 0.473 10 20 ECCD C[C@@H]1C[C@H](NC(=O)C(=O)NCCCSc2nccs2)CCN1 842093685 SDPPWZHUBNLFDH-GHMZBOCLSA-N 342.490 0.998 10 20 ECCD NC(=O)CN1CCCC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1034548118 KORAENSBWFYGCT-ZDUSSCGKSA-N 346.391 0.919 10 20 ECCD CNS(=O)(=O)c1cc(C(=O)NCc2ccc(O)c(O)c2)co1 778918362 PDZTVMJEENIBTF-UHFFFAOYSA-N 326.330 0.529 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](O)[C@@H](C)C3)nc12 778258368 GYGWHIXOPNVEQM-GXFFZTMASA-N 334.376 0.814 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C[C@H]3CCC(=O)NC3)cc2)CC1 881853389 UQORQZQQLICSLI-MRXNPFEDSA-N 344.459 0.971 10 20 ECCD CN(C)[C@@H]1CCC[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 788602456 NQAXXIBONBABHU-CHWSQXEVSA-N 341.433 0.976 10 20 ECCD Cn1cc([C@H]2C[S@@](=O)CCN2C(=O)c2cccc(O)c2O)cn1 799001212 NUWJMJGCHJSQRO-SPSFWMDKSA-N 335.385 0.777 10 20 ECCD COc1ccc(CNC(=O)N[C@H]2CCCS(=O)(=O)C2)c(O)c1 793137314 MJUMPHXNUXPBDF-NSHDSACASA-N 328.390 0.777 10 20 ECCD CO[C@H](C)CN1C[C@H](O)[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1084108861 IWTIQNHZXFHQKZ-HONMWMINSA-N 349.391 0.659 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCN(CCCO)C[C@H]2O)cc1 1090831851 WINOZGHSUOCWPC-ZIAGYGMSSA-N 349.391 0.396 10 20 ECCD COCc1nccc(NC(=O)C(=O)NCc2cc(C)ccc2O)n1 1329133606 WLVSBJCFUSFICK-UHFFFAOYSA-N 330.344 0.892 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@@H]2CO)c1 1341764645 SSHBSYYSMFIYLP-LLVKDONJSA-N 328.390 0.751 10 20 ECCD CS(=O)(=O)C[C@H]1CN(C(=O)NCc2ccc(N)cc2)CCO1 1579336724 GSKJEVCWFBYDFI-CYBMUJFWSA-N 327.406 0.224 10 20 ECCD O=C([C@@H]1CCCN1C(=O)Cc1ccc(O)c(O)c1)N1CCNCC1 1580803135 ANLJLZYOZVDURD-ZDUSSCGKSA-N 333.388 0.063 10 20 ECCD CN(Cc1ccccc1O)C(=O)[C@@H]1CC[C@H](C(=O)N2CCOCC2)O1 287252717 RTLBABREYUZPCT-JKSUJKDBSA-N 348.399 0.757 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C[C@H]1CO 285741400 PEEGKOBBYGJXBQ-CJNGLKHVSA-N 345.443 0.772 10 20 ECCD C[C@H](O)C[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 283360251 XXNVHKPLYFYIIU-XJKSGUPXSA-N 349.431 0.367 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cc(C(C)=O)nn3)CC2)cc1 822197338 WPHPMLRBJNGTMN-UHFFFAOYSA-N 343.387 0.838 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CN1CCOC1=O 873861926 KTCUQBCBSMDWPJ-UHFFFAOYSA-N 333.388 0.934 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CCCO[C@@H](CNCCO)C2)cc1 1202190296 AUCQBTYOIXGLHH-AWEZNQCLSA-N 349.391 0.662 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1COCCO1 1323391896 QMPKNUDYJYIKTC-HNNXBMFYSA-N 335.404 0.209 10 20 ECCD CCOc1ccc(N2CCN(C(=O)CS(=O)(=O)NC)CC2)cc1 1253443534 XGWQXCPPZLFAPC-UHFFFAOYSA-N 341.433 0.283 10 20 ECCD O=C(O)[C@@H]1CC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)O1 1602176584 DVPABLGSIOIDTQ-CVEARBPZSA-N 348.399 0.896 10 20 ECCD C[C@H](O)CN1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 189386628 YXDKENVDJSZHLM-HNNXBMFYSA-N 334.464 0.367 10 20 ECCD COCCN(C)C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 326718346 CAZWTWGBHGGLNX-QGZVFWFLSA-N 337.464 0.756 10 20 ECCD C[C@H](CCN(C)C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 267209712 MROWCNHHPNGFPL-SNVBAGLBSA-N 329.422 0.834 10 20 ECCD O=C(CNC(=O)[C@@H]1CCCN1)NCc1c(O)ccc2c1CCCC2 830597502 LSBDFEGTWLARHT-HNNXBMFYSA-N 331.416 0.755 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NCC2(N)CC2)cc1 911507079 VNTVDYDGWHKRNJ-UHFFFAOYSA-N 334.420 0.197 10 20 ECCD CCS(=O)(=O)N1CCN(C(=O)c2ccc(C)c(O)c2O)CC1 751538149 LEXWKUCDRZZQAV-UHFFFAOYSA-N 328.390 0.514 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)NCc2cnnn2C)cc1 853008808 ZPWBUAAOLGZFFU-UHFFFAOYSA-N 333.348 0.031 10 20 ECCD CN(CCOCCN)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 861753730 BUDYRGTUVCBGAF-UHFFFAOYSA-N 346.431 0.113 10 20 ECCD O=C1NN(c2ccccc2)C(=O)/C1=C/c1cn(C[C@@H]2CCCO2)nn1 865219419 XLYWTMUZRRPOIC-AHSSXEFNSA-N 339.355 0.919 10 20 ECCD COCCN1CN(Cc2ccc(N3CCC(O)CC3)cc2)CC1=O 877504409 FFRPWYVHWHUYBJ-UHFFFAOYSA-N 333.432 0.896 10 20 ECCD COCCCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 774491456 MRAXELQEVGEBAG-CQSZACIVSA-N 349.431 0.853 10 20 ECCD COCC(=O)N[C@@H](C)C(=O)NCCNCc1ccc(OC)c(C)c1 1127999007 IBWNNXBZGUKJQV-ZDUSSCGKSA-N 337.420 0.361 10 20 ECCD CN1CCO[C@H](C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C1 891254086 VNJDMZZFTBRMNX-SJORKVTESA-N 334.464 0.802 10 20 ECCD NC(=O)[C@@H]1C[C@@H]1C(=O)NCCC1=CCN(c2cccc(F)n2)CC1 1089866654 MXSZINSDMDAEGV-OLZOCXBDSA-N 332.379 0.985 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)c3ncn(C)n3)CC2)ncn1 1089828627 FWCDGXUDIKRGPJ-UHFFFAOYSA-N 327.392 0.870 10 20 ECCD C[C@H](NC(N)=O)C(=O)NCCC1=CCN(c2cccc(F)n2)CC1 1089827998 VWBJGWPDIQARIU-NSHDSACASA-N 335.383 0.920 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2CN(C(=O)c3ncc[nH]3)C2)cc1 994373040 KHPLQFUVQXMZCB-UHFFFAOYSA-N 341.331 0.827 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC(C(C)(C)O)C1 1346555072 OEYBDYAYNTWARS-UHFFFAOYSA-N 333.432 0.907 10 20 ECCD COCCN1C(=O)/C(=C/Nc2ccccc2C(=O)O)C(=O)NC1=S 1606893239 IVLXXBYWEILQEQ-CSKARUKUSA-N 349.368 0.570 10 20 ECCD CNS(=O)(=O)[C@@H]1CCN(Cc2cc(F)cc(C(C)=O)c2O)C1 156141178 STXJKSUSGSMOOP-GFCCVEGCSA-N 330.381 0.857 10 20 ECCD COc1ccc(-n2nnnc2CNC[C@@H]2CN(C(C)=O)C[C@H]2C)cc1 1048088718 DDHRZAAIIDWUKB-TZMCWYRMSA-N 344.419 0.875 10 20 ECCD CCCCOC(=O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 264457579 UKVBNBILHNNQNH-UHFFFAOYSA-N 344.389 0.837 10 20 ECCD COCCOCCS(=O)(=O)NCc1ccc(N(C)C)c(F)c1 269769977 KOWZXMGJPIADFI-UHFFFAOYSA-N 334.413 0.974 10 20 ECCD NC(=O)[C@H]1CCCN1CCCNC(=O)/C=C/c1ccc(O)c(O)c1 272365133 CNAMWSKYJXRBOR-VUDGCMKMSA-N 333.388 0.567 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(F)CCNC3)cc2)CC1 832173680 UUWYUOUAMSWCJG-GOSISDBHSA-N 348.422 0.673 10 20 ECCD CN1CCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 839219315 HENHJSNKXSBJTB-UHFFFAOYSA-N 332.404 0.012 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3n[nH]c(O)n3)cc2)C1 918370720 BDRBZVLYEQXJNY-LLVKDONJSA-N 344.375 0.142 10 20 ECCD O=C(NCc1cc(Cl)ccc1O)c1cnn(C[C@@H](O)CO)c1 855022664 FJWMBXDQVFJLFG-GFCCVEGCSA-N 325.752 0.525 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@H]2C[C@H](N[C@@H]3CCNC3=O)C2)cc1 1021116651 LIVIVCXJYYCQNH-JHJVBQTASA-N 344.375 0.588 10 20 ECCD COc1cc(C(=O)NC2CN(Cc3ccnn3C)C2)cc(OC)n1 1030612352 LTCCBMUGAAFNQY-UHFFFAOYSA-N 331.376 0.447 10 20 ECCD NC(=O)CC(=O)N1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 938149615 YAQPNDGBPWRLOU-NSHDSACASA-N 346.347 0.055 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(-c2nc(Cn3cncn3)no2)c1 1116618284 PSRBFAHFHKCQGD-UHFFFAOYSA-N 336.333 0.454 10 20 ECCD COc1ccc(-n2nnnc2CN2CC([C@@H](C)NC(C)=O)C2)cc1 969177809 USQPUNKDMVFFQZ-LLVKDONJSA-N 330.392 0.627 10 20 ECCD O=C(NCCC1=CCN(c2ccc3nnnn3n2)CC1)c1cn[nH]c1 1089815090 RDJBQOJXEADILD-UHFFFAOYSA-N 339.363 0.199 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@H]3C[C@H]3C(N)=O)CC2)nc(C)n1 1089866059 BGTZOOPPFVGJME-CABCVRRESA-N 343.431 0.858 10 20 ECCD NC(=O)CN1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)c1ccc(N=NC(N)=O)cc1 1096641489 SJNYZQNSVJEILS-AGIUHOORSA-N 344.375 0.669 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(C(C)(C)C)C1=O 1326142814 ZFECYGYDXLYXDZ-ZDUSSCGKSA-N 347.415 0.866 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)CN1C(=O)C(=O)N(C)C1=O 269194420 XJRDJEBOGYTCFJ-UHFFFAOYSA-N 333.344 0.551 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN(C3CC3)C2)cc1 283630441 WOKADCHTVUUVJH-OAHLLOKOSA-N 344.459 0.969 10 20 ECCD C[C@@]1(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCNC1=O 820424501 HKVGAVXHXHRXNO-GOSISDBHSA-N 349.406 0.929 10 20 ECCD COC(=O)c1cc(S(=O)(=O)NCc2cccc(OC)c2O)c[nH]1 751306951 XXTOKLKJPMKQPO-UHFFFAOYSA-N 340.357 0.994 10 20 ECCD CC(=O)NCC(=O)N1CCCN(Cc2ccc(N(C)C)cc2)CC1 859782537 RREUCIVVUQSWMU-UHFFFAOYSA-N 332.448 0.923 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CCOC(=O)N3)CC2)cc1F 859966169 QCOWXPNAKXWBGZ-CYBMUJFWSA-N 337.351 0.981 10 20 ECCD CNC[C@H](C)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 851656181 ICMDNEBJXPBSOD-HNNXBMFYSA-N 349.479 0.724 10 20 ECCD CN(CC(N)=O)[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1027698445 JXWPAEQNRSCDFN-CYBMUJFWSA-N 346.391 0.871 10 20 ECCD CCN(CCN)C(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 861782771 JZWFJTGVCUZJMO-CQSZACIVSA-N 348.447 0.445 10 20 ECCD COc1ccc(N2CCN(c3ccc4nnnn4n3)CC2)c(OC)c1 1118991928 SXLPDWFZFPMWRJ-UHFFFAOYSA-N 341.375 0.863 10 20 ECCD O=C(CN1CCNCC1)N(Cc1ccccc1O)C[C@H]1CCCO1 876873055 VADXTQYSHCPPTI-MRXNPFEDSA-N 333.432 0.805 10 20 ECCD CCOC(=O)CN(C)C(=O)COC(=O)/C=C/c1ccc(O)c(O)c1 784286484 MBSKEXUEGNKOSY-FNORWQNLSA-N 337.328 0.676 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@H]3CC34CC4)C2)cc(OC)n1 996380156 YLMVPPNSYWSWBQ-GFCCVEGCSA-N 331.372 0.840 10 20 ECCD CC(=O)NC[C@@H]1CCCCN1C(=O)C(=O)N(C)Cc1ccccc1O 1329343048 BEZSBCWWOZVCLV-HNNXBMFYSA-N 347.415 0.868 10 20 ECCD 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C[C@H](NCCN1CCCOCC1)c1cccc(-c2nn[nH]n2)c1O 1603662762 PSKJZLBLJKASKV-LBPRGKRZSA-N 332.408 0.945 10 20 ECCD COc1ccc(N2CCCN(C(=O)C3(NC(N)=O)CC3)CC2)cc1 179345623 GCSCDTRMUCHWLY-UHFFFAOYSA-N 332.404 0.935 10 20 ECCD COc1ccc(N2CCN(CCCNS(N)(=O)=O)CC2)cc1 119857388 DRBBXIOSDKHEHJ-UHFFFAOYSA-N 328.438 0.000 10 20 ECCD C[C@@H](O)[C@@H](NC(=O)C1CC1)C(=O)N(C)Cc1ccc(N(C)C)cc1 180894953 JYYKLFOITBUXRD-MLGOLLRUSA-N 333.432 0.987 10 20 ECCD CS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCOCC2)cc1 268748816 BPDODSMWTNVGTH-UHFFFAOYSA-N 335.407 0.047 10 20 ECCD CCN1C(=O)[C@H]2CN(Cc3cc4c(cc3O)OCO4)CCN2C1=O 362016058 YFZGZGLZTGILQV-LLVKDONJSA-N 333.344 0.589 10 20 ECCD CCOCc1cc(CNCCNS(=O)(=O)N(C)C)ccc1OC 298211060 ZAOQANUTZNYMKF-UHFFFAOYSA-N 345.465 0.717 10 20 ECCD C[C@@H]1COCCN1C(=O)C(=O)NCCCSc1nccs1 806276260 AQEBJRZBRPLUCV-SNVBAGLBSA-N 329.447 0.989 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)NC[C@@H]3CNCCO3)C2)cc1 818656499 XWSZCWITMOUZQB-PBHICJAKSA-N 348.447 0.809 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNCc3cocn3)CC2)cc1 819039753 SVEQIINRPDAXRB-QGZVFWFLSA-N 346.431 0.956 10 20 ECCD COC(=O)[C@@H]1C[C@H](O)CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 826816558 HERCMMCJNNDHML-ZJUUUORDSA-N 340.332 0.972 10 20 ECCD O=C(CNC1CC1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827397336 ZUOSPGHOVMIGMP-UHFFFAOYSA-N 337.445 0.290 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3NCC3(C)C)cc2)CC1 832172864 MDVYFEAILXQHCX-KRWDZBQOSA-N 344.459 0.969 10 20 ECCD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccn(C)n1 838245252 KCEZKIJGZRFSLU-VIFPVBQESA-N 338.389 0.988 10 20 ECCD O=C1CN(CC(=O)NCc2cccc(Br)c2O)CCN1 907756902 AKYLPBKNJQJRFD-UHFFFAOYSA-N 342.193 0.203 10 20 ECCD CN(C)C(=O)[C@H]1CCN(CC(=O)NCc2ccc(N(C)C)cc2)C1 839636001 MVPRRZCMAFYCST-HNNXBMFYSA-N 332.448 0.779 10 20 ECCD COCCS(=O)(=O)CC(=O)NCc1ccc(N(C)C)cc1C 734402940 SYVASRRIKDUIPA-UHFFFAOYSA-N 328.434 0.738 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)C[C@H](O)C3CC3)nc12 747659096 XYARNPFIGPEYTN-ZDUSSCGKSA-N 334.376 0.814 10 20 ECCD CONC(=O)CNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 927205661 LIQNSWUWDNBTRK-UHFFFAOYSA-N 336.392 0.342 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)[C@H]3COC(=O)N3)C2)cc1C 1018787487 JWZXWRHAHBITGY-UONOGXRCSA-N 333.388 0.803 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(Cc3nccn3C)C2)cc(OC)n1 1015109913 XFSFDZYONVZXPO-ZDUSSCGKSA-N 345.403 0.837 10 20 ECCD Cn1cccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1=O 769825565 HIOOZIRDIWJZQE-UHFFFAOYSA-N 337.357 0.715 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CCN2[C@@H]2CCNC2=O)cc1 1039061574 ROVVRCKCZZVJLP-QWHCGFSZSA-N 344.375 0.542 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNC[C@@H]2CCCS2(=O)=O)c1O 775036334 FDQLOURURVHPQR-JTQLQIEISA-N 330.362 0.976 10 20 ECCD O=C1NC(=O)N2CCN(Cc3cccc(Br)c3O)C[C@@H]12 779433069 PAVWQKFSJYLLTN-JTQLQIEISA-N 340.177 0.891 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3cnon3)C2)cc(OC)n1 974323682 NMWMICVNJPPANE-AOOOYVTPSA-N 347.331 0.173 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@H]3CCC(=O)N3)CC2)n1 1089819358 JECYAEYFJGVPHD-CQSZACIVSA-N 329.404 0.706 10 20 ECCD O=C(C[C@@H]1CCNC1=O)NCCC1=CCN(c2nccnc2F)CC1 1089844745 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335.404 0.724 10 20 ECCD CNC(=O)CNC(=O)c1cccc(NC(=O)c2cccc(O)c2O)c1 800687369 KSVVPLXVDCHDFH-UHFFFAOYSA-N 343.339 0.826 10 20 ECCD COc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)ccn1 806958595 HWZOMIDQUJEOCB-UHFFFAOYSA-N 331.328 0.799 10 20 ECCD CNS(=O)(=O)CC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 819584105 DEZKFTZDASLHBA-GFCCVEGCSA-N 341.433 0.187 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H](C)CN1 817991170 NSGBKXKZOPBAQP-ZIAGYGMSSA-N 332.448 0.920 10 20 ECCD COc1ccc(N(C)CCN(C)CC(=O)N2CCNC(=O)C2)cc1 844400014 SJHFFGIPNJISLU-UHFFFAOYSA-N 334.420 0.022 10 20 ECCD COc1ccc(CN[C@H]2C[C@H](NC(=O)[C@H]3CN(C)C(=O)N3)C2)cc1C 1020471003 SQFUTYDNUFNQDD-RBSFLKMASA-N 346.431 0.764 10 20 ECCD CCOc1ccc(N2CCN(CCS(=O)(=O)NC)CC2)cc1 1118746758 QATYYDLJMZOIFU-UHFFFAOYSA-N 327.450 0.757 10 20 ECCD Cc1ccc(S(N)(=O)=O)c(C(=O)NCc2ccc(O)c(O)c2)c1 778920129 WYBIYCXCCPRGND-UHFFFAOYSA-N 336.369 0.984 10 20 ECCD CCN1CCO[C@H](C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 881851034 NLCCUVIQWRBGSI-SFHVURJKSA-N 346.475 0.775 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@H]3CNC(=O)C3)cc2)CC1 883744077 UEKYMXMXAIXIPH-OAHLLOKOSA-N 345.447 0.374 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)Nc1cccc(C(N)=O)n1 780049395 ZGIYSTYTZZVFBG-UHFFFAOYSA-N 328.328 0.483 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)[C@@]2(C)CCNC2=O)N(C)C)cc1 891247719 UNYDGQZCRVDYTA-QAPCUYQASA-N 332.448 0.998 10 20 ECCD CN(CCO)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 891087018 JIPDUCXUAVQEAZ-UHFFFAOYSA-N 334.420 0.522 10 20 ECCD COC(=O)CCCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1321563704 LCBZDXYMJFIGNZ-UHFFFAOYSA-N 347.415 0.972 10 20 ECCD C[C@H](NC(=O)C(=O)N1C[C@@H]2C[C@]2(CO)C1)c1ccc(N(C)C)cc1 1329313077 XHVNUZNTYUHLPS-XAYKYTGQSA-N 331.416 0.771 10 20 ECCD CN1CCN(CCN(CC(=O)O)C(=O)c2cc(O)cs2)CC1 1606241694 LORWYUQSLIHSQD-UHFFFAOYSA-N 327.406 0.228 10 20 ECCD O=C(COC(=O)c1ccc(-c2nn[nH]n2)o1)c1ccc(O)c(O)c1 1592881801 MKYDAPKMJGMYGR-UHFFFAOYSA-N 330.256 0.911 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)Cn1cc(C(=O)O)nn1 1598519120 JUCODOHODQJXGP-UHFFFAOYSA-N 331.376 0.902 10 20 ECCD O=C(c1cnoc1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250001 ZOUBLEQMCJAQMP-UHFFFAOYSA-N 344.327 0.612 10 20 ECCD CNC(=O)CN[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1C 1755124387 AJUUCEMCJCLRCG-MFKMUULPSA-N 346.391 0.645 10 20 ECCD CC[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796601000 PKXQTAJSTQAJHC-YVECIDJPSA-N 349.387 0.516 10 20 ECCD O=C1CN(C(=O)CN(Cc2ccco2)Cc2ccccc2O)CCN1 72952737 KJGAGIGBFMJLBY-UHFFFAOYSA-N 343.383 0.946 10 20 ECCD CCNc1nc(NCC)n2c(SCC(=O)NC3CC3)nnc2n1 49513669 YRPXXLOVQMCRED-UHFFFAOYSA-N 336.425 0.754 10 20 ECCD COc1ccc(N2CCN(C(=O)C(=O)c3cnn(C)c3)CC2)cc1 195096663 XYULRNBSOPRMQY-UHFFFAOYSA-N 328.372 0.960 10 20 ECCD CN1CC=C(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 271864953 BBECWUDVDWYVSA-UHFFFAOYSA-N 339.417 0.755 10 20 ECCD COc1ccc(N2CCN(CCNCc3cnn(C)n3)CC2)cc1 293652662 SNGYLNSNQRYWSM-UHFFFAOYSA-N 330.436 0.736 10 20 ECCD COc1nccc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n1 297723885 BQAFBOIUZGINJH-UHFFFAOYSA-N 347.350 0.945 10 20 ECCD O=C1CN(Cc2ccccc2O)C(=O)N1Cc1nnnn1C1CC1 819168225 NJAJGRBICLZZAR-UHFFFAOYSA-N 328.332 0.678 10 20 ECCD CC(=O)NCCN(C(=O)/C=C\c1ccc(O)c(O)c1)[C@H](C)C(=O)O 819744302 FQLGRKGHUGRHFH-AYYIZTPMSA-N 336.344 0.549 10 20 ECCD CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@@H]2CO)c1 902629514 FZOAJIXWAKESGP-QGZVFWFLSA-N 334.416 0.994 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CC[C@H](N3CCNCC3)C2)c1O 843121177 GEBKQULYQJUWMU-ZDUSSCGKSA-N 336.392 0.789 10 20 ECCD O=C(O)COCC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 844252013 FJEGALNIUGCAAR-UHFFFAOYSA-N 340.351 0.504 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)N(C)CCCN)CC2)cc1 852916388 HJNZFSJLNUDMFN-UHFFFAOYSA-N 348.447 0.541 10 20 ECCD COC(=O)CCN(C)S(=O)(=O)NCc1cc(OC)ccc1O 751414697 BXFKGQYTXVQJOY-UHFFFAOYSA-N 332.378 0.230 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@H]2CC(=O)N(CCN(C)C)C2)c1 769529738 ONYINGUVPHAGMN-ZDUSSCGKSA-N 335.404 0.427 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)NCC[C@H](O)C2CC2)cc1 899856443 QOIMUOLENFKAHC-HNNXBMFYSA-N 336.388 0.863 10 20 ECCD CCC(=O)N1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@@H](O)C1 991568527 YVAUQVALKJMIRZ-STQMWFEESA-N 347.375 0.951 10 20 ECCD CCOCCC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1846680639 LSMHKKQQTHRKQX-UHFFFAOYSA-N 349.387 0.736 10 20 ECCD COc1ccc(CNC/C=C\CNC(=O)Cn2cnnn2)cc1C 1754093822 DZYNPFLLDCATJC-ARJAWSKDSA-N 330.392 0.452 10 20 ECCD CCC(=O)N1CC[C@@](O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1040156451 MCOVDSGTXFMNEG-MRXNPFEDSA-N 347.375 0.952 10 20 ECCD CCOc1ccc(O)c(CN2CCCN(C(=O)CNC(C)=O)CC2)c1 529664938 NMCNFLHJZFSSMS-UHFFFAOYSA-N 349.431 0.961 10 20 ECCD C[C@@H](CNC(=O)c1c(F)ccc(O)c1O)CN1CCN(C)CC1 276583036 LWPWMOJJFFHYLV-NSHDSACASA-N 325.384 0.850 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)C3CC(=O)C3)cc2)CC1 276319758 YRVONYJTJBVKNF-UHFFFAOYSA-N 329.400 0.950 10 20 ECCD CN1CC[C@H]2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)[C@@H]2C1 283564648 RLYJTKJPECTQMA-DOTOQJQBSA-N 344.459 0.921 10 20 ECCD CN(Cc1ccccc1O)C(=O)c1nc(N)nc(N2CCOCC2)n1 816888948 FXTCIYNYZZBXSS-UHFFFAOYSA-N 344.375 0.268 10 20 ECCD COc1cc(O)c(CN[C@H]2CS(=O)(=O)C[C@@H]2OC)cc1OC 826986065 PTFUNDCOBCCZDP-HZMBPMFUSA-N 331.390 0.311 10 20 ECCD CS(=O)(=O)N1CC[C@@H](NC(=O)NCCc2ccc(N)cc2)C1 846170560 BAEYZGYDAPFIQS-CYBMUJFWSA-N 326.422 0.144 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CC[C@@H](CN)C1 842152270 FRUGOZUGRGMGMA-UKRRQHHQSA-N 332.448 0.921 10 20 ECCD C[C@H]1OC(C)(C)N[C@@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 842036497 UJJWVJPDYFCJFL-IUODEOHRSA-N 348.447 0.598 10 20 ECCD CNC[C@@H](C)NC(=O)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 851690129 ZNYIEHMEMOPTIE-KGLIPLIRSA-N 348.447 0.362 10 20 ECCD COc1ccc(-n2nnnc2CN(C)C[C@@H]2CCN(C(C)=O)C2)cc1 1029616422 LMOQLVDMPOPMDT-AWEZNQCLSA-N 344.419 0.971 10 20 ECCD CN1CCN(CCCS(=O)(=O)N(C)Cc2ccccc2O)CC1 866834907 QWUAGHRWPJYFEU-UHFFFAOYSA-N 341.477 0.791 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ncn(C)n1 1117389303 FVRFTYHTTOJLNO-UHFFFAOYSA-N 331.376 0.576 10 20 ECCD CN1CCN(c2ccc([C@H]3NC(=O)[C@@H]4CSCCN34)cc2)CC1 771518718 VPEBVXNCULGMSH-HOTGVXAUSA-N 332.473 0.984 10 20 ECCD C[C@H](NC(=O)CCn1cc[nH]c(=O)c1=O)c1ccc(N(C)C)cc1 773011192 DHDIOAGSFZBKAF-LBPRGKRZSA-N 330.388 0.870 10 20 ECCD CCC(=O)N[C@@H](C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 881849498 DTPGINYRDWQYIO-AWEZNQCLSA-N 332.448 0.969 10 20 ECCD Cc1c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cnn1C 785298000 SYXFKFFCBRCPBX-SECBINFHSA-N 332.360 0.826 10 20 ECCD COc1ccc(CN2CCN(CC(=O)N(C)C)CC2)c(O)c1OC 891505413 LETBLYQGHWZZMV-UHFFFAOYSA-N 337.420 0.615 10 20 ECCD O=C(NCCC1=CCN(c2nccn3nnnc23)CC1)c1cn[nH]c1 1089815012 NVYFCCALFKOYEC-UHFFFAOYSA-N 339.363 0.199 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@@H]3CCC(=O)NC3)CC2)n1 1089870378 SFYALZCQKLGTBV-OAHLLOKOSA-N 343.431 0.954 10 20 ECCD COc1ccc(-n2nnnc2CNC2CC(N(C)C(C)=O)C2)cc1 998323394 KDLRFAYCGYPTQN-UHFFFAOYSA-N 330.392 0.770 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1C[C@@H]2C[C@@]2(CO)C1 1327620770 MNSMKRCPRQVHEW-KXBFYZLASA-N 343.427 0.744 10 20 ECCD CNC(=O)CCCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1340722151 YCTIJDPHMZVXKX-UHFFFAOYSA-N 344.415 0.321 10 20 ECCD Nc1ccc(CN2CC[C@H]3[C@@H](C2)NC(=O)N3C2CCNCC2)cc1 1356082815 DUZRFZDBNXLVPP-SJORKVTESA-N 329.448 0.989 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)COCC(=O)O 1590648497 QPCNYZNNUCWFRR-UHFFFAOYSA-N 325.317 0.385 10 20 ECCD COc1ccc(CNC[C@H](O)CNC(=O)c2nccc(C)n2)cc1C 1753910497 XUDFDFGDFQHPPU-HNNXBMFYSA-N 344.415 0.983 10 20 ECCD C[C@H](O)[C@H](NC(=O)C1CC1)C(=O)N(C)Cc1ccc(N(C)C)cc1 180894905 JYYKLFOITBUXRD-LRDDRELGSA-N 333.432 0.987 10 20 ECCD CN(C)C(=O)CN1CCC(NC(=O)/C=C/c2ccc(O)c(O)c2)CC1 272490198 RLMBROOMFQLKKQ-GQCTYLIASA-N 347.415 0.780 10 20 ECCD CN1C(=O)CN(CC(=O)N2CCOc3cc(N(C)C)ccc32)C1=O 625916429 UVZBQXDYBJZANO-UHFFFAOYSA-N 332.360 0.372 10 20 ECCD COc1cccc(CNC(=O)c2cc(S(N)(=O)=O)cn2C)c1O 729859249 LEHMXAJCHWMPDP-UHFFFAOYSA-N 339.373 0.317 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCS(=O)(=O)C1 845929777 FNGUWSCETGHEEI-ZYHUDNBSSA-N 327.402 0.970 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)cc1 846768964 TZGDWLPGCZHJJW-HNNXBMFYSA-N 338.429 0.921 10 20 ECCD COc1cc(C(=O)NC2CN(Cc3cc(C)ncn3)C2)cc(OC)n1 1030614204 DWLZBZIVIHDIHN-UHFFFAOYSA-N 343.387 0.811 10 20 ECCD C[C@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)N(C)C 874111785 WQJZMZSWZSXZKM-HIFRSBDPSA-N 332.448 0.955 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]3CCO)nc12 778270776 UHAGLTBPMZBXJP-LBPRGKRZSA-N 334.376 0.958 10 20 ECCD CC(=O)N1CCOC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 964232159 XTGHMFDUNZOSPP-CYBMUJFWSA-N 333.348 0.826 10 20 ECCD CC[C@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847493286 XSZSEXVRTPSCQS-SRVKXCTJSA-N 335.360 0.079 10 20 ECCD CC(C)OCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847336379 ONNQRMSJFRLZKH-STQMWFEESA-N 349.387 0.733 10 20 ECCD COCCOC[C@H](NCc1ccc(N2CCOCC2)cc1)C(=O)O 1777218235 WNHPSFDOFLECDB-INIZCTEOSA-N 338.404 0.729 10 20 ECCD O=C1NC(=S)NC(=O)C1=CNc1ccc(NC(=O)C2CC2)cc1 10352685 KNYJLIGVFYIUQD-UHFFFAOYSA-N 330.369 0.862 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@]3(C)CCNC3=O)CC2)c(OC)c1 825208975 UCDPKEYWMRQYQS-SFHVURJKSA-N 347.415 0.879 10 20 ECCD CN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1cnn(C)c1 917311177 NVHKVRMIZXJBAR-UHFFFAOYSA-N 338.389 0.063 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CCN)CC2)cc1 841751408 YDSKKUZZTVWYPD-OAHLLOKOSA-N 349.479 0.854 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C[C@@H](C)O)C3CC3)nc12 847092336 DKFRHOJALJLMME-SNVBAGLBSA-N 334.376 0.957 10 20 ECCD C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)C(=O)NCCc1ccc(N)cc1 842167738 ULGWCLYLYKMIOE-LRDDRELGSA-N 330.432 0.526 10 20 ECCD CS(=O)(=O)Cc1noc(COC(=O)c2cccc(O)c2O)n1 758547574 MFPGEKGQUIBXJB-UHFFFAOYSA-N 328.302 0.382 10 20 ECCD CN(CCCN)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 851655707 UUWLILHUFNFNJQ-OAHLLOKOSA-N 347.463 0.879 10 20 ECCD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)NCC(=O)N1CCCC1 759589792 SWGGAMHUFHLFQA-GQCTYLIASA-N 348.355 0.393 10 20 ECCD CCN(CCN)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 861567802 OYJZTCRNVMQSNZ-UHFFFAOYSA-N 349.479 0.807 10 20 ECCD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1119484704 RMEZTOXRLMZRLI-OAHLLOKOSA-N 344.459 0.923 10 20 ECCD CCN(C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@H]1CCNC1 884519814 DNJSNTDSVUJXNY-ZDUSSCGKSA-N 336.411 0.718 10 20 ECCD Cn1nnc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)n1 786974724 VVYLNFOMGJORQZ-UHFFFAOYSA-N 347.448 0.763 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(c3ncccn3)C2)cc(OC)n1 1058602429 KOYHMYHTFBSQQB-GFCCVEGCSA-N 329.360 0.898 10 20 ECCD CNS(=O)(=O)c1cc(NS(=O)(=O)c2c[nH]nc2C)ccc1O 790406392 OXYJRVCFAIBVNK-UHFFFAOYSA-N 346.390 0.133 10 20 ECCD NS(=O)(=O)Cc1cccc(CNC(=O)c2cccc(O)c2O)c1 790629434 MDAHFYNWAJXZLK-UHFFFAOYSA-N 336.369 0.816 10 20 ECCD CCOCC(=O)NCCC1=CCN(c2ccnc(C(=O)OC)n2)CC1 1089800528 NFFNXLIPDBQNKR-UHFFFAOYSA-N 348.403 0.943 10 20 ECCD C[C@H]1[C@@H](C)N(C(=O)C(=O)N(C)Cc2ccccc2O)CC[S@]1=O 1325340152 DEFBCUWNNHWMEW-YCDSQXFLSA-N 338.429 0.719 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCOC[C@@H]1CCO 1333309404 BCMONLMCJJDQSO-INIZCTEOSA-N 349.431 0.287 10 20 ECCD C[C@@H]1CN(c2ccc(CNC(=O)C[C@H](O)CN)cc2F)C[C@@H](C)O1 1341570679 IMBZSEHKDWGTAG-BZPMIXESSA-N 339.411 0.765 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C[C@]1(O)CCNC1 1578489782 LDQOCJLPCWCPMA-GOSISDBHSA-N 333.432 0.596 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CSCC(=O)N3)CC2)cc1 74716474 JQNXJCIKOGQZNW-AWEZNQCLSA-N 335.429 0.575 10 20 ECCD CC(=O)C(=O)CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCO3)C1=O 289007184 WZCOWDPOVJGOJK-INIZCTEOSA-N 332.312 0.383 10 20 ECCD CN(C)CCN(C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 284273561 SNVBBDXNWGLDML-UHFFFAOYSA-N 332.448 0.923 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1CCCO1 283386399 WUBBPYDQTBDITP-MRXNPFEDSA-N 329.400 0.974 10 20 ECCD COC[C@](C)(NCC(=O)NCc1ccc(N(C)C)cc1)C(=O)OC 299733077 YFCYQOSHOLAAJA-KRWDZBQOSA-N 337.420 0.537 10 20 ECCD CCn1ncnc1CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803665043 VSRMWXYIDCQDAA-UHFFFAOYSA-N 348.382 0.436 10 20 ECCD CN(C(=O)C(=O)NCCCSc1nccs1)[C@H]1CCOC1 806278146 OAHOKYNMYSOMMD-JTQLQIEISA-N 329.447 0.989 10 20 ECCD CN(C)c1ccc([C@H](CNS(=O)(=O)N2CCC2)N(C)C)cc1 908460628 WQCHAOCRSXRVIU-HNNXBMFYSA-N 326.466 0.895 10 20 ECCD COc1ccc(N2CCN(CCNS(=O)(=O)N(C)C)CC2)cc1 732923299 UQHOPKZMYPIXCH-UHFFFAOYSA-N 342.465 0.213 10 20 ECCD COc1ccc(CNC(=O)C(F)(F)C(=O)N2CCOCC2)c(O)c1 836210212 UOIKIKIZILNCFA-UHFFFAOYSA-N 344.314 0.511 10 20 ECCD COc1ccc(O)c(CNS(=O)(=O)c2ccc(C(=O)O)nc2)c1 833734005 YSFKXPGAKQZATJ-UHFFFAOYSA-N 338.341 0.973 10 20 ECCD CS(=O)(=O)NC1CC(NC(=O)NCc2cc(Cl)ccc2O)C1 845174965 DFWYOEAESUEPJW-UHFFFAOYSA-N 347.824 0.925 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC[C@H]1CCNC1 842153233 MQKDHPOHXRCBAP-CQSZACIVSA-N 332.448 0.793 10 20 ECCD NCC(F)(F)CNC(=O)NCc1ccc(N2CCOCC2)cc1 841730477 RUAZHLGUTZHMJW-UHFFFAOYSA-N 328.363 0.916 10 20 ECCD CCNCCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 841725543 MKPZBLMZNHEJKK-HNNXBMFYSA-N 347.463 0.797 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN2C)cc1 929526823 XVSUJZRUMJVFJF-MRXNPFEDSA-N 332.448 0.969 10 20 ECCD C[C@@H](NCC1(O)CCS(=O)(=O)CC1)c1cc([N+](=O)[O-])ccc1O 756610429 VJZIWMVKZWLQFF-SNVBAGLBSA-N 344.389 0.891 10 20 ECCD COc1ccc(CN[C@H]2C[C@H](NC(=O)Cn3cnnc3O)C2)cc1C 1020091549 ZPWUGQMHVXDRFS-HDJSIYSDSA-N 345.403 0.738 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2CN(CCn3cncn3)C2)cc1 1031464746 ZJPUGBXKUYASKP-UHFFFAOYSA-N 342.363 0.555 10 20 ECCD CN1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1(C)C 774249091 ILPMKXOEDDCUBK-UHFFFAOYSA-N 341.433 0.930 10 20 ECCD Cc1nc(N2CC=C(CCNC(=O)C(N)=O)CC2)ccc1[N+](=O)[O-] 1089862196 POXIGKURAYCOQD-UHFFFAOYSA-N 333.348 0.426 10 20 ECCD O=C(C[C@@H]1CCC(=O)N1)NCCC1=CCN(c2cnc(F)cn2)CC1 1089834168 CJBPSYUOAGHZFO-ZDUSSCGKSA-N 347.394 0.927 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)N[C@H]2[C@@H]3CNC[C@@H]32)N(C)C)cc1 1336238111 BFGNLQHTSZLCKB-TWMKSMIVSA-N 331.464 0.872 10 20 ECCD O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@H]1CNCCO1 1610780291 DQGXLXDTSNWVSE-LBPRGKRZSA-N 342.779 0.837 10 20 ECCD O=C(O)Cn1cc(C(=O)NCc2ccc3cccnc3c2O)nn1 1595143399 BUDIBPRLPNEKBI-UHFFFAOYSA-N 327.300 0.547 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)NCCn2cc(C(=O)O)nn2)c1 1599598695 QDATULIQMVPWPE-SECBINFHSA-N 349.347 0.751 10 20 ECCD NC(=O)[C@@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 155696532 AGCUVJYWYMXEQX-HNNXBMFYSA-N 330.388 0.459 10 20 ECCD COCc1nc2n(n1)C[C@@H](NC(=O)NCc1ccccc1O)CC2 268143472 UNPQNXAGIHRWGB-LBPRGKRZSA-N 331.376 0.944 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCn1cncn1 263832082 NOOYGCMOMYSWNT-UHFFFAOYSA-N 344.419 0.956 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CC[C@H](S(C)(=O)=O)C2)cc1 281942367 ADJMAPRCXJOKOU-HNNXBMFYSA-N 339.461 0.488 10 20 ECCD CN(Cc1nccn1C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 285620562 DJBZMAOPVMBYHD-UHFFFAOYSA-N 347.394 0.900 10 20 ECCD CN1CCC[C@@H]1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 299292413 QAAQZHZMTICHRP-LLVKDONJSA-N 327.406 0.588 10 20 ECCD CN1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)[C@H](CN)C1 841757774 AGUBWSQSNHGGJA-MRXNPFEDSA-N 331.464 0.853 10 20 ECCD C[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)C(=O)N(C)C 851984569 NEUIZUJDZJDMQH-ZDUSSCGKSA-N 348.447 0.924 10 20 ECCD CN1CCC(N(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 769569905 KWZPURBQIQBOOZ-UHFFFAOYSA-N 341.433 0.930 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCN(C)C1=O 1119075131 YSXCNQQONRBLGQ-HNNXBMFYSA-N 346.431 0.448 10 20 ECCD Cc1cc(C(=O)N[C@H]2CC(=O)N(C)C2=O)c(C)n1-c1ccccn1 773660531 ZAJOFHKZLODGNG-ZDUSSCGKSA-N 326.356 0.976 10 20 ECCD C[C@@H](C(N)=O)N1CC[C@@](C)(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1046862531 MFOPZVYFABSJJR-MGPLVRAMSA-N 346.391 0.917 10 20 ECCD COC[C@@H](CO)NC(=O)NCc1ccc(N2CCN(C)CC2)cc1 889665085 FLNBTZRPEZVQSP-OAHLLOKOSA-N 336.436 0.245 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)[C@@H](C)C2CC2)cc1 1125334279 KACPWTKOVPMIBY-LBPRGKRZSA-N 344.419 0.923 10 20 ECCD CCN(C(=O)c1ccc(N=NC(N)=O)cc1)C1CN([C@H](C)C(N)=O)C1 957442624 GCFXDAVPWSAOCH-SNVBAGLBSA-N 346.391 0.869 10 20 ECCD O=C(CCn1cnnn1)NCCC1=CCN(c2cc(F)ncn2)CC1 1089842044 MNCBXSXIWSCZGJ-UHFFFAOYSA-N 346.370 0.335 10 20 ECCD O=C1N[C@H](C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)CO1 1089829470 PASPJPBMIGOSEA-NSHDSACASA-N 335.339 0.367 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)C[C@@]2(CCOC2)O1 1326912412 UTWBKSPBUBJUEX-FZKQIMNGSA-N 348.399 0.757 10 20 ECCD CCn1c(-c2sccc2O)nnc1N1CCO[C@H](C(=O)NC)C1 1520738652 NFKKKBFZURKRFY-JTQLQIEISA-N 337.405 0.683 10 20 ECCD COc1cccc(CNC(=O)[C@H]2CCCN(CC(=O)O)C2=O)c1O 1574232258 UYWVEJWTJVDFFJ-LLVKDONJSA-N 336.344 0.340 10 20 ECCD COc1ccc(CN[C@@H](CO)CNC(=O)c2ccnnc2)cc1C 1755639200 LRMPTPUKJZPUCA-OAHLLOKOSA-N 330.388 0.674 10 20 ECCD CC[C@@H](C)[C@H](NC(=O)COC(=O)c1cccc(O)c1O)C(=O)O 1594906081 UVMSCQQKAXUANY-PELKAZGASA-N 325.317 0.870 10 20 ECCD Cc1c(CNC(=O)C(=O)NC[C@H]2CNCCO2)n(C)c2ccccc12 419707155 LJMVKSBYRUNJNO-CYBMUJFWSA-N 344.415 0.208 10 20 ECCD CCOC(=O)CN(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 263713186 VNFSHYOEZOPKPE-UHFFFAOYSA-N 330.362 0.399 10 20 ECCD CN(CCOCCO)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 283870754 FBXXEBWMTJAEMU-UHFFFAOYSA-N 349.431 0.370 10 20 ECCD C[C@H]1C(=O)NCCN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 285583902 ADHHXGAVXANSMV-LBPRGKRZSA-N 344.415 0.032 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)N(C)CCCO)CC2)cc1 839259570 TZACELUSAHNNAS-UHFFFAOYSA-N 349.431 0.575 10 20 ECCD O=C(Cn1cncn1)NCc1ccc(N2CCC(CO)CC2)cc1 919968552 HWRCQAGNQGKLIW-UHFFFAOYSA-N 329.404 0.803 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NC[C@H](N)C1CC1 842070029 KNLKWECLUNBODD-DYVFJYSZSA-N 346.475 0.962 10 20 ECCD CNCCN(C)C(=O)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 842070084 LUTFSOZNGOYPHR-AWEZNQCLSA-N 334.464 0.786 10 20 ECCD COc1ccc(N2CCC(NC(=O)C[C@H]3CC(=O)NC3=O)CC2)cc1 931578522 XXPRREHDWTVPSS-LBPRGKRZSA-N 345.399 0.833 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)NC/C=C/CO)CC2)cc1 853543066 ZLKSFACRQFDUNI-NSCUHMNNSA-N 348.447 0.665 10 20 ECCD COc1ccc(N(C)CCN(C)C[C@@H](O)C[C@@]2(O)CCOC2)cc1 930850920 ZQWKQYBHAUIFHB-WMZOPIPTSA-N 338.448 0.966 10 20 ECCD CNC(=O)[C@@H](C)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 957849642 NSEMUTGKJJGJRA-LLVKDONJSA-N 346.391 0.741 10 20 ECCD CN1C(=O)CN(CC(=O)NCc2ccc3c(c2)CCCN3C)C1=O 1328739935 FRXJCBXXKKALRR-UHFFFAOYSA-N 330.388 0.579 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCN([C@H]2CCOC2)CC1 1329631409 LHXXBERDRJXULL-HNNXBMFYSA-N 347.415 0.284 10 20 ECCD Cn1nncc1CNCc1ccc(N2CCC(C(N)=O)CC2)cc1 1331961616 XVLWQASALRIWAB-UHFFFAOYSA-N 328.420 0.807 10 20 ECCD Cc1oc(CNC(=O)C(=O)NCCc2ccc(N)cc2)cc1C(=O)O 1608046997 BMMBAWXKHWDVII-UHFFFAOYSA-N 345.355 0.844 10 20 ECCD CN(C)c1ccc(CNC(=O)c2ccnc3c(C(N)=O)cnn23)cc1 153440435 LQQOHIOGXFRAMT-UHFFFAOYSA-N 338.371 0.824 10 20 ECCD COC(=O)COc1ccc(N(C)CC(=O)NC[C@H]2CCCO2)cc1 273074854 KBBNQJLILAVOLJ-OAHLLOKOSA-N 336.388 0.970 10 20 ECCD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 281519845 BUBLOAVYCJESBB-CZUORRHYSA-N 346.431 0.847 10 20 ECCD CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1cc([C@@H](C)O)nn1 819761503 SGJXNLWXXJXVJZ-SNVBAGLBSA-N 325.365 0.839 10 20 ECCD CC(C)(CN)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827394876 FZJTZZICHHRBSU-UHFFFAOYSA-N 339.461 0.523 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)C(=O)N2CC[C@@H](N)C2)N(C)C)cc1 911577345 CAVGHGUZEGLNAG-GDBMZVCRSA-N 347.463 0.031 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)N(C)[C@@H](C)CN)CC2)cc1 841750526 RQTXAPGXRGSQCV-HNNXBMFYSA-N 349.479 0.806 10 20 ECCD C[C@@H](O)[C@H]1CCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 855868917 JIZCHUJNLJORQN-BXKDBHETSA-N 328.390 0.749 10 20 ECCD COC[C@H](O)CN1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1113703951 UJERJDROIQEKQG-CQSZACIVSA-N 349.391 0.614 10 20 ECCD NC(=O)CCCC(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089836632 ZZXJZYRZWJLYHK-UHFFFAOYSA-N 335.383 0.914 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3CCCNC3=O)CC2)ncn1 1089849069 UVLDOIKPWFAXMC-OAHLLOKOSA-N 343.431 0.954 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2CN(C(=O)[C@@H]3CCOC3)C2)cc1 994370980 BJUDGFIYJNJSHB-LLVKDONJSA-N 345.359 0.826 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@H](C)CC(N)=O)CC2)ncn1 1089850039 LICGTOVMAJJCBT-GFCCVEGCSA-N 331.420 0.939 10 20 ECCD COc1ccc(-n2nnnc2CNCCCNC(=O)[C@@H]2C[C@H]2C)cc1 1154307396 DFQZDDWDXZYTCN-IUODEOHRSA-N 344.419 0.923 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccncn1 1320775072 LYPAKWNDSMQKCX-LBPRGKRZSA-N 331.328 0.792 10 20 ECCD O=C(Cn1ncccc1=O)NCc1ccc(N2CCOCC2)c(F)c1 1326594243 WOQKKIVNMSWRDE-UHFFFAOYSA-N 346.362 0.535 10 20 ECCD C[C@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C(=O)O)O1 1607475608 XYAUIKWDYLCHPU-BBRMVZONSA-N 349.431 0.885 10 20 ECCD CCC(=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796602885 XIADOGMKZWRUAU-ZSBIGDGJSA-N 347.371 0.724 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cnn(C[C@H](O)CO)c1 611651216 SATSBSMJFCWNLZ-AWEZNQCLSA-N 346.387 0.342 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCS(=O)(=O)C[C@@H]2C)c1O 278284182 UCWWYZPDVBMDKF-VIFPVBQESA-N 330.362 0.928 10 20 ECCD O=C1N[C@]2(CCOC2)C(=O)N1Cc1ccc(N2CCOCC2)cc1 277357943 NTFVZXYFANABAD-KRWDZBQOSA-N 331.372 0.734 10 20 ECCD C[C@H](Cn1ccnc1)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 283770723 CWHUBUMZTIDIIW-CYBMUJFWSA-N 329.404 0.770 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CCNCC3)C2)cc1 818677993 VUGJYCFGPMGYAA-CQSZACIVSA-N 346.431 0.070 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCC(C)(C)C(=O)O)cc1 818658680 YENMTLVEWTVNDO-UHFFFAOYSA-N 335.404 0.986 10 20 ECCD C[C@@H]1C[C@@H](CN)CN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 817991260 OFIGJRUCCWDLIM-HIFRSBDPSA-N 332.448 0.907 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(C[C@@H](O)CO)c1 831925029 RIANWVFNCZJUAG-ZWNOBZJWSA-N 335.360 0.009 10 20 ECCD NCC[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 911054069 CTOPTABHRWZIQY-NSHDSACASA-N 342.490 0.939 10 20 ECCD CCN1CCN(CCC(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)CC1 844163319 YTVMGFBZYWZIKE-GOSISDBHSA-N 347.507 0.896 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H]3CNC[C@@H]32)cc1 842208487 VKBNOIQBUZMHMV-WBVHZDCISA-N 344.459 0.969 10 20 ECCD COc1ccc(O)c(CNC(=O)N[C@H]2CS(=O)(=O)C[C@@H]2OC)c1 853736851 QNSATBUGXDITII-AAEUAGOBSA-N 344.389 0.012 10 20 ECCD C[C@H](NC(=O)C[C@@H]1CC(=O)NC1=O)c1ccc(N2CCOCC2)cc1 930745292 UXUJEZNRMOQDQW-GXTWGEPZSA-N 345.399 0.753 10 20 ECCD COc1cc(C(=O)NC2CN(CC(=O)N(C)C3CC3)C2)cc(OC)n1 1030612534 RXSYTZUXLRNRNP-UHFFFAOYSA-N 348.403 0.134 10 20 ECCD COCCS(=O)(=O)CC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773008814 NUDXBOHJQDMODO-GFCCVEGCSA-N 328.434 0.991 10 20 ECCD O=C(NCCC1=CCN(c2nccnc2F)CC1)C(=O)NCC1CC1 1089840229 JIFUVYYPYKHTQN-UHFFFAOYSA-N 347.394 0.785 10 20 ECCD COc1ccc(N2CCN(C(=O)C(=O)N3CCC3)CC2)c(OC)c1 1331987210 ZUXCBHUIFKQLNP-UHFFFAOYSA-N 333.388 0.585 10 20 ECCD 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COCCN(C(=O)c1cccc(O)c1O)[C@H]1CCS(=O)(=O)C1 274903143 QJOKAMGRLOVXAV-JTQLQIEISA-N 329.374 0.374 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCc3n[nH]c(=O)cc3C2)cc1 274818419 AWFUVPBGTASMKW-UHFFFAOYSA-N 341.415 0.510 10 20 ECCD Cc1cc(O)ccc1NS(=O)(=O)CCCS(=O)(=O)N(C)C 811684378 GUEXJDDTEOODAD-UHFFFAOYSA-N 336.435 0.724 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)COCCN 843490454 ZDHNDSVDEGEJQO-UHFFFAOYSA-N 330.768 0.523 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3C[C@H]4C[C@H]4N3)cc2)C1 844175397 HJKMLJFVNJOXSK-SRABZTEZSA-N 342.443 0.755 10 20 ECCD C[C@@H](N)CN(C)C(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 863749501 SPZUZMYYARYRPB-HIFRSBDPSA-N 349.431 0.705 10 20 ECCD C[C@H](NC(=O)Nc1nnn(C)n1)c1ccc(N2CCOCC2)cc1 932274377 FEHMSZKCQVIQBI-NSHDSACASA-N 331.380 0.929 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)CN3CCNCC3)C2)cc1 876931873 XPGAWJNPIQBIFL-HNNXBMFYSA-N 332.448 0.543 10 20 ECCD CC[C@H](N[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 970837114 FOYFNPSRVHOCMW-OLZOCXBDSA-N 346.391 0.917 10 20 ECCD 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Cc1ccc(C(=O)N2CCN(C(=O)[C@H]3CCCN3C)CC2)c(O)c1O 272757067 PNHLZWIXMWFJCL-CQSZACIVSA-N 347.415 0.785 10 20 ECCD CCN(CC)c1ccc(CN(C)C(=O)CN2CCNCC2=O)cc1 826019375 DRSZTZIRCZGCFH-UHFFFAOYSA-N 332.448 0.923 10 20 ECCD C[C@H]1CN(c2ccc(CNC(=O)C3=NNC(=O)C3)cc2F)C[C@H](C)O1 731870693 MUWCRSMQBKUQPE-QWRGUYRKSA-N 348.378 0.931 10 20 ECCD CN1CCCc2cc(CNC(=O)N3CCC(O)(C(N)=O)CC3)ccc21 915389725 CSGXDCHSSHGBRY-UHFFFAOYSA-N 346.431 0.591 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCc3n[nH]cc3C2)c1 744356616 VQHRMRSIJXJPFZ-UHFFFAOYSA-N 336.373 0.685 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCO[C@H]([C@H](C)N)C1)c1ccc(N(C)C)cc1 842203532 UDONRYUCCWSTSD-XEZPLFJOSA-N 348.447 0.504 10 20 ECCD CNCCCNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 842223867 GZOXZXKRIOYKEY-UHFFFAOYSA-N 332.448 0.969 10 20 ECCD CNC[C@@H]1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 842202482 HVFUVDPKWFVHCN-KGLIPLIRSA-N 332.448 0.998 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCCS(N)(=O)=O 923210319 BLEYEDSBGQFVJH-UHFFFAOYSA-N 342.465 0.963 10 20 ECCD 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COc1cc(C(=O)NC2CN(C(=O)[C@@H]3CCCOC3)C2)cc(OC)n1 996369384 VVINHFZCXPBUBS-LLVKDONJSA-N 349.387 0.466 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)C(=O)N2CC(F)C2)N(C)C)cc1 1334678919 HJXLNFTUZDISHW-HNNXBMFYSA-N 336.411 0.652 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CCCC12CN(C(=O)[C@H]1C[C@@H](O)C1)C2 1843249508 RGYQYBKWYIGSKM-KLPPZKSPSA-N 347.371 0.081 10 20 ECCD COCCN(C)S(=O)(=O)NCc1ccc2c(c1)CCCN2C 111335077 WKTIJXGNMWCGKF-UHFFFAOYSA-N 327.450 0.982 10 20 ECCD CCOc1ccc(N2CCN(C(=O)[C@@H]3CSCC(=O)N3)CC2)cc1 1355097383 PDBZQMZRFOUOJR-HNNXBMFYSA-N 349.456 0.966 10 20 ECCD O=C(Cn1cnnn1)NCc1ccc(N2CCC(O)CC2)c(F)c1 266713708 KARGQNRLWZUULR-UHFFFAOYSA-N 334.355 0.090 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CC[C@H](CO)C1 284289188 UGCBYAKJBYTAKH-HNNXBMFYSA-N 331.416 0.744 10 20 ECCD C[C@@H](O)CCN(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 283947161 HPQKWWNNXNNLFC-CQSZACIVSA-N 349.431 0.369 10 20 ECCD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H](C)N1C 294026171 RCBIVEHWFUHHJN-PHIMTYICSA-N 341.433 0.928 10 20 ECCD 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1755212371 PBUCVKXYYFENCQ-UHFFFAOYSA-N 348.447 0.917 10 20 ECCD CN(C1CCN(Cc2cc3c(cc2O)OCO3)CC1)S(C)(=O)=O 52085047 BAZMDTBUCNIWHR-UHFFFAOYSA-N 342.417 0.977 10 20 ECCD COC(=O)CN(CCC(=O)NC(N)=O)Cc1cc(Cl)ccc1O 264638791 XBTUWIKYXHJPAN-UHFFFAOYSA-N 343.767 0.606 10 20 ECCD CC(C)NC(=O)CN1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 272486380 RDBFVIGCERTMFI-GQCTYLIASA-N 347.415 0.780 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)C(F)(F)C(=O)N1CCOCC1 296224372 PBECPOAKLVIZKQ-UHFFFAOYSA-N 344.314 0.251 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN[C@H]2CS(=O)(=O)C[C@@H]2OC)c1O 826985115 BSJIPFUKUMVNTC-ONGXEEELSA-N 346.361 0.211 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCNCC3)cc2)C1 841722680 PNYZRIPVKDYYAL-OAHLLOKOSA-N 345.447 0.503 10 20 ECCD COC(=O)C[C@H](N)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 852869081 UDDWCVHFDBBFHR-HNNXBMFYSA-N 335.404 0.154 10 20 ECCD CNC(=O)[C@H](C)N1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1039061104 PJPLMQZKAWPZKD-GWCFXTLKSA-N 346.391 0.788 10 20 ECCD C[C@H]1C(=O)N(C)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 779275474 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325855831 WKUQDYCKTVLANV-CJHWANRJSA-N 332.316 0.906 10 20 ECCD CS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCCOCC2)cc1 844646334 MMUBEZVALYGFJC-UHFFFAOYSA-N 349.434 0.437 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C[C@@H]4CNC[C@@H]4C3)CC2)cc1 844222436 FBNHPHZZWFSXTH-IYBDPMFKSA-N 344.459 0.495 10 20 ECCD CCOC(=O)[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)CC12COC2 840098880 FIVZCBLNVCMSQP-ZFWWWQNUSA-N 349.383 0.830 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H]([C@@H](C)N)C1 842153084 KCXGVJYFLJNVPZ-HIFRSBDPSA-N 332.448 0.873 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cc[nH]n1 918337782 NYPAFMVXXQSVKY-UHFFFAOYSA-N 334.401 0.575 10 20 ECCD C[C@H](NCCN1CCN(S(C)(=O)=O)CC1)c1cc(F)ccc1O 756534298 LUTUOUZDHHVMPX-LBPRGKRZSA-N 345.440 0.759 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCO[C@@H](C)C3)CC2)cc1 779216078 MZVKISYTUHMALO-WMZOPIPTSA-N 349.475 0.899 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCN(C)C1=O 1119075132 YSXCNQQONRBLGQ-OAHLLOKOSA-N 346.431 0.448 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCCN(C)C1=O 1119134684 AJUKNDDSOCKLOT-HNNXBMFYSA-N 346.431 0.414 10 20 ECCD CCS(=O)(=O)N1CCC(C(=O)NCc2ccc(N)cc2)CC1 1122540980 YEIVRAIBLVJPIX-UHFFFAOYSA-N 325.434 0.947 10 20 ECCD COc1cc(C(=O)N[C@H]2CCC[C@H](NCC(N)=O)C2)cc(OC)n1 981198511 JAYSMIAWLUMOIX-RYUDHWBXSA-N 336.392 0.215 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CC(=O)N(C(C)(C)C)C1 1329581731 UOHPCWXULQVGGL-CYBMUJFWSA-N 347.415 0.866 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CC(C(C)(C)O)C3)ccc21 1345514332 LGIKDQYDTPBJOQ-UHFFFAOYSA-N 345.443 0.915 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)C2(S(C)(=O)=O)CC2)cc1 1521145179 OQEHYLZQCFACFR-CYBMUJFWSA-N 325.434 0.446 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H](F)C(=O)O)cc1 1596288980 ALZMKEUSPZCWSX-ZDUSSCGKSA-N 339.367 0.688 10 20 ECCD CNC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc(N(C)C)cc2)C1 111264443 COOOMEZGOCBQKN-OAHLLOKOSA-N 332.448 0.827 10 20 ECCD CCN(CC)CCCN/C=C1/C(=O)NC(=S)N(CCOC)C1=O 60862354 NDWIELFSJUHPIG-QXMHVHEDSA-N 342.465 0.082 10 20 ECCD CCN(CC)c1ccc(CNC(=O)Cn2ncn(C)c2=O)cc1F 179488809 KRITTZJYZLWTAP-UHFFFAOYSA-N 335.383 0.884 10 20 ECCD COc1ccc(N2CCC(NC(=O)C(=O)N(C)C[C@@H](C)O)CC2)cc1 804317259 XVXNKQZAJQHCIJ-CYBMUJFWSA-N 349.431 0.619 10 20 ECCD Cc1nc(NC(=O)C(=O)NCCCSc2nccs2)nn1C 815537434 AHMVKMXTRPTHHX-UHFFFAOYSA-N 340.434 0.817 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)C2CN(S(C)(=O)=O)C2)c1 901126547 CBPNUFGWLUKXGS-VIFPVBQESA-N 328.390 0.469 10 20 ECCD O=C1CN(CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCN1 901177780 UQGGUWXKKCVEGI-HNNXBMFYSA-N 347.415 0.332 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N(C)C[C@H](C)O)cc1 846248435 FLPTXVPLWLHBKX-ZDUSSCGKSA-N 337.420 0.429 10 20 ECCD CCN[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 842170942 OVYGJKFLPCKLOO-CQSZACIVSA-N 330.432 0.793 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)NCc2cnnn2C)N(C)C)cc1 894873411 RUUUUJCSLDFJES-INIZCTEOSA-N 345.451 0.983 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3cc[nH]n3)nc12 787779925 KHKBIQXKEYRHNO-UHFFFAOYSA-N 345.315 0.621 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)CSCC(N)=O)N(C)C)cc1 891253065 PYHWMEDERNVBPX-CQSZACIVSA-N 338.477 0.690 10 20 ECCD CN1CCO[C@H](C(=O)NCCC2=CCN(c3nccnc3F)CC2)C1 1089816834 CMNLJEQRVYJRHK-AWEZNQCLSA-N 349.410 0.589 10 20 ECCD COC[C@H](OC)C(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089860844 NCUYRFOIBOSTFO-ZDUSSCGKSA-N 338.383 0.920 10 20 ECCD Cn1cnnc1CNCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1177238480 YJBXAIBGPOTPEE-UHFFFAOYSA-N 344.379 0.887 10 20 ECCD COC(=O)[C@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1328330075 MKJABNRWJGGRQF-HDJSIYSDSA-N 347.415 0.779 10 20 ECCD CCOC(=O)C[C@H](C)CNC(=O)C(=O)NCCc1ccc(N)cc1 1325407994 QIEHINAFXGLSGT-LBPRGKRZSA-N 335.404 0.633 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NOC[C@H]3CCOC3)ccc21 1341103371 JKACXRZRRJHXPM-AWEZNQCLSA-N 347.415 0.770 10 20 ECCD O=C(C1=COCC1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251262 OCIUTGAMEQFLQR-UHFFFAOYSA-N 345.355 0.614 10 20 ECCD COC(=O)C[C@H](CC(=O)O)NCc1ccc(N2CC[C@H](O)C2)cc1 1777108121 IVYNEWUIDAWOAH-ZFWWWQNUSA-N 336.388 0.754 10 20 ECCD COC[C@H](O)CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 265409306 SBKMASOAVYRTNS-CYBMUJFWSA-N 341.383 0.469 10 20 ECCD C[C@H]1CN(Cc2cc3c(cc2O)OCO3)CCN1S(C)(=O)=O 271809318 BGJABXJIZJQZOU-JTQLQIEISA-N 328.390 0.587 10 20 ECCD COCCCN(CCO)C(=O)C(=O)NCc1ccc(N(C)C)cc1 283331327 CPLMBNZTPKVZCC-UHFFFAOYSA-N 337.420 0.226 10 20 ECCD COCCN1C[C@@H](C(=O)OCC(=O)c2ccc(O)c(O)c2)CC1=O 800132493 SRFLAUBXWNQLSX-NSHDSACASA-N 337.328 0.319 10 20 ECCD O=C1NCC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 829263598 LTQDRVBENUXMMM-CYBMUJFWSA-N 335.379 0.539 10 20 ECCD O[C@@H](CNCc1ccc(N2CCOCC2)cc1)C[C@]1(O)CCOC1 905062745 NZQYVCONLPSTLO-QZTJIDSGSA-N 336.432 0.515 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NCCCON 911051004 ZHKYTTLQPGJAPX-CYBMUJFWSA-N 336.436 0.505 10 20 ECCD COC(=O)CNC(=O)[C@H]1CCCN1C(=O)/C=C/c1ccc(O)c(O)c1 841461104 QOTUOQWAWHMBCE-HOSRBBHYSA-N 348.355 0.391 10 20 ECCD CNC[C@H]1CCCN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 842149959 IAHUWVBESCKWQE-MRXNPFEDSA-N 344.459 0.896 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)C(=O)N2CCOCC2)N(C)C)cc1 934310552 BNDGPUMZMVDXEX-MRXNPFEDSA-N 348.447 0.330 10 20 ECCD NS(=O)(=O)[C@@H]1CCN(Cc2ccc(N3CCC(O)CC3)cc2)C1 877466171 ZUNOMZMWPISWPS-MRXNPFEDSA-N 339.461 0.511 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)COC(C)C)cc1 1124432239 SDKSBGCWJAZQIY-UHFFFAOYSA-N 348.407 0.302 10 20 ECCD CN1CCN(c2ccc(CN3CCN4C(=O)NC[C@@H]4C3)cc2)CC1 775736772 JOILOJUUAPCXMS-QGZVFWFLSA-N 329.448 0.648 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@@H]3CCN(C)C3=O)cc2)CC1 881853859 MIPKHZFTSHEDQD-INIZCTEOSA-N 330.432 0.533 10 20 ECCD COc1c(NC(=O)C(=O)NCc2ccccc2O)cccc1C(N)=O 782795699 MBHLKHZLUHBRLT-UHFFFAOYSA-N 343.339 0.755 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)N[C@H]3CCOC3)cc2)CC1 884236075 MDGGNBFIQRPSJE-HNNXBMFYSA-N 346.431 0.976 10 20 ECCD CCS(=O)(=O)CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891256264 WPKCXTMVZYVASF-HNNXBMFYSA-N 341.477 0.906 10 20 ECCD COc1ccc(CNCCNC(=O)c2ccn3nnnc3c2)cc1C 1132271942 ICAZAINOCXNCEB-UHFFFAOYSA-N 340.387 0.961 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)C(=O)NCC3CC3)CC2)n1 1089840290 LZVKIIXEPWMKGQ-UHFFFAOYSA-N 343.431 0.954 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NOC[C@H]1CCOC1 1329165390 RGVTXDWFCGFOMX-HNNXBMFYSA-N 345.399 0.763 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H]2NC(=O)CC[C@@H]2C1 1327316492 KLCOIYWVTNALGZ-OCCSQVGLSA-N 345.399 0.478 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CC(=O)N(C)C1 1258266804 KBSUNWCGKJJDPM-ZDUSSCGKSA-N 332.404 0.024 10 20 ECCD C[C@H](C(=O)NCc1cc(Cl)ccc1O)n1cnc(-c2nn[nH]n2)n1 1573729146 HPERNAKETSZIBV-SSDOTTSWSA-N 348.754 0.695 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCNCC3)CC2)cc1 325164266 JIVWTVXGGAKTQW-QGZVFWFLSA-N 334.464 0.083 10 20 ECCD O=C(CN1CCNCC1)NCc1ccc(N2CCOCC2)c(F)c1 325465005 BOYFAQQKUWMEPO-UHFFFAOYSA-N 336.411 0.184 10 20 ECCD COC(=O)c1cn(CC(=O)N2CCOc3cc(N(C)C)ccc32)nn1 267088328 KBDGXTXUNUDLQV-UHFFFAOYSA-N 345.359 0.556 10 20 ECCD Cc1cc(N2CC[C@H](NC(=O)c3c(F)ccc(O)c3O)C2=O)n(C)n1 295014135 QCUMHTZQCBSLCH-JTQLQIEISA-N 348.334 0.814 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)N3CCOCC3)CC2)cc1 299515203 VNGDONADAVGSJL-UHFFFAOYSA-N 348.447 0.859 10 20 ECCD CC(=O)N[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 817829555 YCCYVRSAOODPHR-OAHLLOKOSA-N 346.431 0.414 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNS(=O)(=O)N(C)C 824234293 HNGGBHLYSIJRAI-UHFFFAOYSA-N 342.465 0.497 10 20 ECCD O[C@@H](CNCc1ccc(N2CCOCC2)cc1)C[C@@]1(O)CCOC1 905062744 NZQYVCONLPSTLO-MSOLQXFVSA-N 336.432 0.515 10 20 ECCD CCO[C@H]1C[C@](CO)(NC(=O)C(=O)Nc2ccc(N)cc2)C1(C)C 841117981 APZCVBWINUACQJ-SUMWQHHRSA-N 335.404 0.890 10 20 ECCD COC(=O)[C@@H]1CNCCCN1Cc1ccc(N2CCOCC2)cc1 843123167 IMDVROLOFKWXQM-KRWDZBQOSA-N 333.432 0.860 10 20 ECCD CC[C@@H](CO)NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758185625 JWSDQYYAAPICSI-RDJZCZTQSA-N 337.464 0.539 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H](N)C3)CC2)cc1 923281833 RAUIGHHFPLOOJT-RDJZCZTQSA-N 334.464 0.211 10 20 ECCD CO[C@@H]1CN(C(C)=O)C[C@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 942298911 ZMHFZQITENOUJW-CHWSQXEVSA-N 333.348 0.825 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1C[C@@H](O)[C@H](CO)C1 1118633888 HLUCRPBMVNSQDF-WMLDXEAASA-N 349.431 0.142 10 20 ECCD O=C1[C@H]2C[C@@H](O)CN2C(=O)N1Cc1ccc(N2CCC(O)CC2)cc1 1119631135 OQHFMSNGDDZCAD-HZPDHXFCSA-N 345.399 0.545 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)NCCNC(=O)c1cnccn1 1123817233 IAOYRVRDZYZUJH-DUXPYHPUSA-N 328.328 0.447 10 20 ECCD CN1CCN(C(=O)N2CCN(C(=O)c3cc(O)cs3)CC2)CC1 896236526 QGJBWRJMEXMKGW-UHFFFAOYSA-N 338.433 0.579 10 20 ECCD CN1C[C@H](NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC1=O 893460238 FBQYGPWMAUHOMG-ZBFHGGJFSA-N 347.463 0.885 10 20 ECCD COC[C@H](OC)C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089859855 SGTIHJVNMKSAOU-ZDUSSCGKSA-N 338.383 0.920 10 20 ECCD COc1ccc(N2CCN(c3nnc(CCO)n3C)CC2)cc1F 1350403241 YHGBRURQFUDZQA-UHFFFAOYSA-N 335.383 0.824 10 20 ECCD O=C(O)/C=C\c1ccc(N2CCn3nnc(CO)c3C2)c([N+](=O)[O-])c1 1601883458 SNPGDXOALMOVBR-RQOWECAXSA-N 345.315 0.797 10 20 ECCD O=C([C@@H]1C[C@@H]1F)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248835 AMIONVTVHXCRKN-MNOVXSKESA-N 335.335 0.668 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H]2[C@@H](C1)[C@@H]2C(=O)O 1598519501 UJERYUOGNQCXPO-QLPKVWCKSA-N 331.416 0.973 10 20 ECCD COc1ccc(N2CCN(CN3CC(=O)N(C)C3=O)CC2)cc1F 182289003 DBRISOXKZCGCMI-UHFFFAOYSA-N 336.367 0.808 10 20 ECCD CN(C[C@@H](O)CN1CCOCC1)C(=O)c1c(F)ccc(O)c1O 276644044 VKDPJMACBSFVOA-SNVBAGLBSA-N 328.340 0.002 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CC[C@H](C(N)=O)O3)CC2)cc1 279726588 VKTLHWVLYIOSRS-CABCVRRESA-N 333.388 0.377 10 20 ECCD COC(=O)C(C)(C)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 299068973 VQABPAUXUFSNJJ-UHFFFAOYSA-N 349.431 0.885 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C(=O)O)C(C)C)nc12 818229502 UOMQXKBUOCHVFF-LBPRGKRZSA-N 336.348 0.810 10 20 ECCD CCS(=O)(=O)CCCN1C(=O)CN(Cc2ccccc2O)C1=O 819171576 IYEVZZZTOUJBEQ-UHFFFAOYSA-N 340.401 0.981 10 20 ECCD CC(C)[C@@H](N)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 827468844 DWFUZYGDYVDLNS-GOEBONIOSA-N 332.448 0.988 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2(CC(=O)O)CCC2)c1 833738228 UPCMJGDNCLPRRZ-UHFFFAOYSA-N 342.373 0.891 10 20 ECCD COc1ccc(-n2nnnc2CN2CC=C(CNC(C)=O)CC2)cc1 1000346782 CMHVQTDSJJGKPF-UHFFFAOYSA-N 342.403 0.939 10 20 ECCD CN(CC(=O)N1CCNCC1)Cc1ccc(N2CCOCC2)cc1 843047422 UVOVQSYGCQBNIS-UHFFFAOYSA-N 332.448 0.387 10 20 ECCD NC(=O)C1CCN(c2ccc(CN[C@@H]3CNCCOC3)cc2)CC1 925776726 IDUADAOTYPGSIH-MRXNPFEDSA-N 332.448 0.466 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NCc3ncnn3C)C2)cc(OC)n1 1022367643 HXFDDOAYBOYKTO-TXEJJXNPSA-N 346.391 0.278 10 20 ECCD CC(=O)NCC(=O)N1CCCN(C(=O)c2cc(O)cs2)CC1 862961064 OORWGSKHPPRBPW-UHFFFAOYSA-N 325.390 0.264 10 20 ECCD COCCn1ccc(NC(=O)C(=O)NCc2cc(C)ccc2O)n1 862026134 WSKSAKNYCXLVBC-UHFFFAOYSA-N 332.360 0.798 10 20 ECCD COCCC(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 761946776 FPGXMXVGWMYQMA-UHFFFAOYSA-N 331.346 0.526 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCN3C(=O)NC(=O)[C@@H]3C2)c1O 775058690 XCDTUXISFIIGIM-JTQLQIEISA-N 336.304 0.045 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCC[C@]1(C)NC(=O)NC1=O 773744109 MUAPTDAZHBUSGV-BTDLBPIBSA-N 349.387 0.913 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CCN([C@H]3CCNC3=O)CC2)cc1 957849607 LYTXEKPFNISDQX-ZDUSSCGKSA-N 344.375 0.495 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NC1CCC1 788459764 CEWDBPUDVXBOEU-UHFFFAOYSA-N 335.379 0.947 10 20 ECCD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2c[nH]nc2C)cc1 797431751 XNRUXFIGTXUXOM-UHFFFAOYSA-N 345.406 0.395 10 20 ECCD CC(=O)N1CC(C(=O)NCCC2=CCN(c3ccnc(C)n3)CC2)C1 1089823994 SCLKBAWUZSUZLL-UHFFFAOYSA-N 343.431 0.906 10 20 ECCD CN(C)C(=O)O[C@H]1CCN(C(=O)C(=O)N(C)Cc2ccccc2O)C1 1325151151 NXWAZJIQQBNOKW-ZDUSSCGKSA-N 349.387 0.650 10 20 ECCD CCNC(=O)N1CC[C@H](NC(=O)C(=O)N(C)Cc2ccccc2O)C1 1347050783 WAUOVABDWKUVJH-ZDUSSCGKSA-N 348.403 0.271 10 20 ECCD CC(=O)N1CC[C@@](O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1040156014 HPVYRSUOKAOWNP-OAHLLOKOSA-N 333.348 0.562 10 20 ECCD CCN(CCCNC=C1C(=O)NC(=S)NC1=O)c1ccccc1 52536945 MLBLIFGAJGEKTD-UHFFFAOYSA-N 332.429 0.907 10 20 ECCD O=C(O)/C=C/c1ccc(N2CCS(=O)(=O)CC2)c([N+](=O)[O-])c1 387101336 XFOMGGBHESFHRI-DUXPYHPUSA-N 326.330 0.927 10 20 ECCD C[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)C[C@@H](C)S1(=O)=O 811797670 JZEFGEDSASQSTQ-RULNRJAQSA-N 327.402 0.825 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@]2(CCNC2)C1 842152343 HFUSWHJFGKPEPG-IBGZPJMESA-N 344.459 0.889 10 20 ECCD C[C@@H]1C[C@@H](CN)CN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 842149771 FAZVNZDHTGDHET-HIFRSBDPSA-N 344.459 0.881 10 20 ECCD CCC(=O)N1C[C@@H]2C[C@H]1CN2Cc1nnnn1-c1ccc(OC)cc1 1032238119 HCRQWCDWOFYAQP-KBPBESRZSA-N 342.403 0.866 10 20 ECCD Cc1ccc(O)c(CNC(=O)[C@H](CC(N)=O)NC(=O)CC(C)C)c1 862756295 VBAOQTZACLOVFO-ZDUSSCGKSA-N 335.404 0.723 10 20 ECCD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCc2ncccc21 770316793 HTUVZLMELAVJJS-UHFFFAOYSA-N 330.369 0.468 10 20 ECCD CC[C@@H](N[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 970837112 FOYFNPSRVHOCMW-CHWSQXEVSA-N 346.391 0.917 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)CCn3cnnn3)CC2)nn1 1089841434 FTEKRODXXFYVFO-UHFFFAOYSA-N 342.407 0.505 10 20 ECCD Nc1ccc(CN2CC[C@@H]3[C@H](C2)NC(=O)N3C2CCNCC2)cc1 1356082737 DUZRFZDBNXLVPP-DLBZAZTESA-N 329.448 0.989 10 20 ECCD COc1ccc(N2CCN(CC(=O)N3CCOCC3)CC2)cc1F 84866350 KXARZMKARAMUCF-UHFFFAOYSA-N 337.395 0.815 10 20 ECCD C[C@H](NS(C)(=O)=O)C(=O)N1CCOc2cc(N(C)C)ccc21 266952211 XSCJQMHKXBBMFI-JTQLQIEISA-N 327.406 0.416 10 20 ECCD CCS(=O)(=O)N[C@H](C)C(=O)N1CCOc2cc(N(C)C)ccc21 611652513 YBWJVWKKZZKUDF-LLVKDONJSA-N 341.433 0.806 10 20 ECCD Cc1cccc(=O)n1C[C@](C)(O)C(=O)NCCc1ccc(O)c(O)c1 281737726 XQCXRQGORBNPRY-SFHVURJKSA-N 346.383 0.678 10 20 ECCD CO[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 294589368 OJEQMLVQTHYZJM-ZDUSSCGKSA-N 328.390 0.919 10 20 ECCD C[C@H](NC(=O)C(=O)N1CC[C@@](C)(C(N)=O)C1)c1ccc(N(C)C)cc1 807674040 FGFHETITJHTTPX-KPZWWZAWSA-N 346.431 0.654 10 20 ECCD COCCn1nc(C(=O)NCc2cc(OC)ccc2O)ccc1=O 734016587 UIRYMMKZANGKJR-UHFFFAOYSA-N 333.344 0.534 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Cn3cccn3)cc2)C1 917832993 KTRBKJWVNWGGPG-HNNXBMFYSA-N 341.415 0.901 10 20 ECCD C[C@H](N)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 842230032 PHLFOFJNPCGLPB-GXTWGEPZSA-N 335.404 0.363 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CC[C@H](CN)C1 842275062 ZBYZJDCEXVOORC-GJZGRUSLSA-N 332.448 0.955 10 20 ECCD 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C[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)CN(C)C 816720859 NOJNMDHNGPPWMO-JTQLQIEISA-N 329.422 0.691 10 20 ECCD CC(=O)N[C@H](C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 837704107 GTVXYFUZPCKSBY-SNVBAGLBSA-N 341.358 0.942 10 20 ECCD CN(C)CCn1ccc(NC(=O)C(=O)NCc2ccccc2O)n1 746384268 IXNZHHLIJWHMCC-UHFFFAOYSA-N 331.376 0.405 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCC[C@@H]3CCNC3)ccc21 842150383 QNMQPBROTCKGBM-AWEZNQCLSA-N 344.459 0.801 10 20 ECCD CN(C)C1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 841455439 RXCVWCFFPPSMKM-UHFFFAOYSA-N 327.406 0.588 10 20 ECCD C[C@H](C(N)=O)N1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1016367962 MSMMQJLXGYSALN-BXKDBHETSA-N 332.364 0.527 10 20 ECCD C[C@@H](N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)(C)O 857525342 QSGINKLEXHMGTQ-SECBINFHSA-N 330.406 0.995 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CC[C@H]3C(N)=O)CC2)c(OC)c1 870165755 MAZLCJGAZISLBP-KGLIPLIRSA-N 347.415 0.864 10 20 ECCD CNS(=O)(=O)c1ccc(C(=O)N(C)Cc2ccccc2O)cn1 771406238 HYZZKPDJFBGXOT-UHFFFAOYSA-N 335.385 0.968 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C[C@@H]4C[C@]4(CO)C3)CC2)cc1 782616245 KCRLPTAGEACPDN-HNAYVOBHSA-N 345.443 0.658 10 20 ECCD C[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCN(C)CC3)cc2)C(=O)O1 896370158 LINMZSUQPJGRQQ-CJNGLKHVSA-N 346.431 0.942 10 20 ECCD C[C@@H](N[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1C)C(N)=O 1082952571 FFQMMBUPFLDESY-GIPNMCIBSA-N 346.391 0.773 10 20 ECCD COCCn1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)n1 1337189469 BYJPPADPZJCMJV-UHFFFAOYSA-N 348.359 0.238 10 20 ECCD O=C(O)[C@H](Cn1cncn1)NCc1ccc(N2CCOCC2)c(F)c1 1334852493 GKESHCQLFKWDGB-AWEZNQCLSA-N 349.366 0.497 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cncn1C 1343730692 DRLLZXOPJXFKEU-NSHDSACASA-N 333.344 0.736 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@]3(C(=O)O)CCCO3)CC2)cc1 1594101263 NHNBCOVLOYUPSA-QGZVFWFLSA-N 334.372 0.978 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1C[C@@H]2C[C@H]1CN2 1353491501 UWCPDBUEOIQACJ-HOCLYGCPSA-N 330.432 0.903 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)CNCC3CC3)CC2)cc1 269287915 JCTABGYZYNPJRL-UHFFFAOYSA-N 346.475 0.933 10 20 ECCD CCS(=O)(=O)N1CCC[C@@H](C(=O)NCc2ccc(N)cc2)C1 296870102 DWWVUNBMRARASV-CYBMUJFWSA-N 325.434 0.947 10 20 ECCD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC(=O)N1 297301256 HUOBWBSENSZTQN-CYBMUJFWSA-N 332.404 0.553 10 20 ECCD C[C@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)C[C@@H](C)S1(=O)=O 811797666 JZEFGEDSASQSTQ-ISTVAULSSA-N 327.402 0.825 10 20 ECCD CN1CCN(c2ccc(CN[C@@H]3CCC(=O)N(C)C3=O)cc2)CC1 818233703 MQBFLLVBYSHPJM-MRXNPFEDSA-N 330.432 0.675 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CCOCC3)C2)cc1 824973483 BLMQFPSHEKGWGK-CQSZACIVSA-N 347.415 0.497 10 20 ECCD O=C(NCCCSc1nccs1)c1cnn(C[C@@H](O)CO)c1 827474566 DNFZCRGPWVGBDM-LLVKDONJSA-N 342.446 0.605 10 20 ECCD O=C(CC[C@@H]1NC(=O)NC1=O)NCCCSc1nccs1 733975199 ZUYFYVLGCURQMV-QMMMGPOBSA-N 328.419 0.730 10 20 ECCD NC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 842170944 OWADVUJNHJMFJE-MRXNPFEDSA-N 342.443 0.876 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](CCN)C1 911127281 XCLVAGMBNPTCKR-CQSZACIVSA-N 332.448 0.875 10 20 ECCD CCS(=O)(=O)NCC(=O)N(C)CCN(C)c1ccc(OC)cc1 846441838 DHPXCLSLYYNZDG-UHFFFAOYSA-N 343.449 0.529 10 20 ECCD CCCNC(=O)CN(C)C(=O)CN1CCCc2cc(CN)ccc21 843350469 RJTJZRBGOSHRSV-UHFFFAOYSA-N 332.448 0.883 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)Cn3cnnn3)C2)cc1C 1018483214 YGFPSMRZICNZNQ-AWEZNQCLSA-N 330.392 0.381 10 20 ECCD COC[C@@H](C)NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758183958 CAMWDVAHLJXYMT-NVXWUHKLSA-N 337.464 0.803 10 20 ECCD CN1CC[C@@](O)(CNC(=O)NCCCSc2nccs2)C1 763144506 XTDFLSGYXZHBRK-CYBMUJFWSA-N 330.479 0.991 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(C(=O)[C@@H]3CCCO3)C2)cc(OC)n1 938308483 QUHAMNCWQAVRCD-STQMWFEESA-N 349.387 0.609 10 20 ECCD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785432401 BKZAWMASYLZUJX-HUUCEWRRSA-N 346.431 0.400 10 20 ECCD COC(=O)CNC(=O)[C@H]1CCCN1Cc1cc(C)cc(OC)c1O 895025091 MNGXDILGUXGRKG-CYBMUJFWSA-N 336.388 0.963 10 20 ECCD CNS(=O)(=O)NC1CCN(Cc2cc(C)cc(OC)c2O)CC1 894608096 DSOMFBCVVOSIJT-UHFFFAOYSA-N 343.449 0.727 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)C(C)(C)C(N)=O)CC2)n1 1089848510 GXMUVNPOMCRKIA-UHFFFAOYSA-N 331.420 0.939 10 20 ECCD O=C(Cn1nccn1)NCCC1=CCN(c2cc(F)ncn2)CC1 1089844064 SYPROSLFPXOBAX-UHFFFAOYSA-N 331.355 0.550 10 20 ECCD CN1CCN(c2ccc(CN[C@H](Cc3cnc[nH]3)C(=O)O)cc2)CC1 1334070805 XUYVWLRZOUJNLI-QGZVFWFLSA-N 343.431 0.947 10 20 ECCD COc1ccc(N2CCC(NC(=O)CCn3cnnn3)CC2)cc1 1332054469 NYORMUBLLOEBSV-UHFFFAOYSA-N 330.392 0.857 10 20 ECCD C[C@@H](NC(=O)C(=O)N1CC(F)C1)c1ccc(N2CCOCC2)cc1 1341058221 GCMHQPDKSJMLGT-GFCCVEGCSA-N 335.379 0.881 10 20 ECCD O=C(CN1CCC(CO)CC1)NCc1ccc(N2CCOCC2)cc1 1346749132 DQZPDSJBBFFNPP-UHFFFAOYSA-N 347.459 0.844 10 20 ECCD CC(=O)c1cc(F)cc(CN(C)C[C@H](O)CN2CCOCC2)c1O 83245496 CQMXXBOIERXBHL-HNNXBMFYSA-N 340.395 0.859 10 20 ECCD CN1CC(=O)N(CC(=O)NCc2c(O)ccc3c2CCCC3)C1=O 269079596 DFCPUHJCYVWQSW-UHFFFAOYSA-N 331.372 0.781 10 20 ECCD COC(=O)CNC(=O)CN(Cc1ccccc1O)C[C@H]1CCCO1 268085502 IQNPGCHVOIARAF-CQSZACIVSA-N 336.388 0.662 10 20 ECCD CCNC(=O)CN1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 272441897 MONXIUIVUBFSMB-FNORWQNLSA-N 347.415 0.781 10 20 ECCD O=C(O)/C=C/c1ccc(N2C[C@H]3C(=O)NC(=O)[C@H]3C2)c([N+](=O)[O-])c1 386956216 JQLGXYJWFVYPIN-XXIYDDFUSA-N 331.284 0.401 10 20 ECCD C[C@H](NC(=O)NC[C@@H](O)Cn1ccnn1)c1ccc(N(C)C)cc1 838560838 ZQXJTADMDCAOOC-SWLSCSKDSA-N 332.408 0.765 10 20 ECCD COc1ccc(O)c(CNC(=O)NCCCN(C)S(C)(=O)=O)c1 734065890 FHBOVVCMZICNRA-UHFFFAOYSA-N 345.421 0.482 10 20 ECCD COc1ccc(O)c(CNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)c1 734018317 MWSNMBSFTITMOF-UHFFFAOYSA-N 333.300 0.787 10 20 ECCD O=C(CN1CCCC1)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 738159804 DIWYVFZYOTXQID-UHFFFAOYSA-N 347.415 0.861 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1C[C@@H]2CNC[C@@H]2C1 842212011 BXFJNBVUXOVJDF-IYBDPMFKSA-N 342.443 0.581 10 20 ECCD CN[C@@H](C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 848416069 XUOBRJHWQNVGJK-HNNXBMFYSA-N 334.464 0.931 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CC(=O)NC(=O)N2)cc1 855020348 NJYRUSKGEMBNIO-ZDUSSCGKSA-N 334.376 0.188 10 20 ECCD 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CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](O)CC3)nc12 293074628 JEWQKLNLXLMPRR-GFCCVEGCSA-N 334.376 0.958 10 20 ECCD C[C@]1(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCNC1=O 820424509 HKVGAVXHXHRXNO-SFHVURJKSA-N 349.406 0.929 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2)CC1 839732708 FIXLZUQVSPOJQN-HZPDHXFCSA-N 346.387 0.637 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCNCC1 842266110 PIEIJTOTVQEEHW-OAHLLOKOSA-N 332.448 0.969 10 20 ECCD O=C1[C@H]2COCCN2C(=O)N1Cc1ccc(N2CCC(O)CC2)cc1 853090056 WGSBGEBTIGKSKI-MRXNPFEDSA-N 345.399 0.811 10 20 ECCD COc1ccc(CN[C@@H]2CC[C@H]3CN(C(=O)C(N)=O)C[C@H]32)cc1C 1026345983 IOPUJBJJZUXVTO-RRFJBIMHSA-N 331.416 0.816 10 20 ECCD NC(=O)[C@H]1CC[C@@H](CNC(=O)NCCCSc2nccs2)O1 760193892 KIDMUACQFQGCPJ-VHSXEESVSA-N 344.462 0.957 10 20 ECCD Cn1cc(N2C[C@@H](C(=O)NCc3ccc(O)c(O)c3)CC2=O)cn1 860243474 NVTHDWMYOQMFPA-NSHDSACASA-N 330.344 0.501 10 20 ECCD C[C@H](NCC(=O)N1CCNC(=O)C1)c1ccc(N2CCOCC2)cc1 775260789 QATOZKJOYYOYQT-AWEZNQCLSA-N 346.431 0.132 10 20 ECCD O=C1NC(=O)N2CCN(Cc3cccc(Br)c3O)C[C@H]12 779433070 PAVWQKFSJYLLTN-SNVBAGLBSA-N 340.177 0.891 10 20 ECCD COC(=O)CN(CCN1CCN(C)CC1)Cc1ccc(C)cc1O 877497271 LTJBMPFFIJXTSH-UHFFFAOYSA-N 335.448 0.923 10 20 ECCD Cn1cc([C@H](O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 774380356 PFODWWYDZKFXJF-INIZCTEOSA-N 348.378 0.746 10 20 ECCD CO[C@]1(C(=O)NCc2ccc(N(C)C)cc2C)CCS(=O)(=O)C1 889011082 JRTAYWZEEHUOSA-MRXNPFEDSA-N 340.445 0.881 10 20 ECCD CN1CCO[C@@H](C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)C1 1089823220 ANDAQXVFRHBOJI-CQSZACIVSA-N 349.410 0.589 10 20 ECCD COc1ccc(-n2nnnc2CN2[C@H]3CC[C@@H]2C[C@H]3NC(C)=O)cc1 1096698853 QDDRCOZMXSXNKT-BMFZPTHFSA-N 342.403 0.912 10 20 ECCD COCCn1nnc2c1CCN(C(=O)NCc1ccc(N)cc1)C2 1336290557 OQGKSUXOQMMVRY-UHFFFAOYSA-N 330.392 0.775 10 20 ECCD O=C1N[C@@H](CO)C(=O)N1Cc1cc(F)c(N2CCOCC2)c(F)c1 1340147656 WGKYILOHZILDHI-LBPRGKRZSA-N 341.314 0.214 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1C[C@@H]2C[C@H]1CN2 1353272888 PLGPUEVIPFIVHC-QRTARXTBSA-N 344.459 0.681 10 20 ECCD Cc1ccc(O)c(CN2C[C@@H](N3C(=O)CNC3=O)C[C@H]2C(=O)O)c1 1607811248 OFQBUNVSTZATLF-RYUDHWBXSA-N 333.344 0.280 10 20 ECCD O=C(O)COCCOCCNC(=O)/C=C\c1ccc(O)c(O)c1 1606279131 SKFDSJZBTUSWMT-RQOWECAXSA-N 325.317 0.345 10 20 ECCD CCN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)CC(=O)NC 1753094847 KDPILQRRGQQOPG-UHFFFAOYSA-N 334.380 0.647 10 20 ECCD COCCOCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 55522900 RFDUNONQINOFNN-UHFFFAOYSA-N 326.368 0.942 10 20 ECCD CN(C)c1ccc(CN2CCN(C(=O)CN3CCOCC3)CC2)cc1 123936248 DXQLMPLBBFYESE-UHFFFAOYSA-N 346.475 0.729 10 20 ECCD CN(CC(=O)N1CCOCC1)Cc1ccc(N2CCOCC2)cc1 70758215 UWHDIZGCCNFCNI-UHFFFAOYSA-N 333.432 0.814 10 20 ECCD CCN(CC)c1ccc(CN2CCN3C(=O)C(=O)NC[C@H]3C2)cc1F 91866269 KAYGHWYNGZYBCL-AWEZNQCLSA-N 348.422 0.815 10 20 ECCD COC[C@@H](O)CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 265409308 SBKMASOAVYRTNS-ZDUSSCGKSA-N 341.383 0.469 10 20 ECCD CN(CC(=O)NCCCN(C)S(C)(=O)=O)Cc1ccccc1O 264709390 LTVWWRUPTUUCQQ-UHFFFAOYSA-N 343.449 0.222 10 20 ECCD CN(C)S(=O)(=O)c1cc(C(=O)NCc2ccccc2O)n(C)c1 272335144 NJHWVZSPGQAGHN-UHFFFAOYSA-N 337.401 0.911 10 20 ECCD CN(C(=O)C(=O)NCCCSc1nccs1)[C@@H]1CCOC1 806278147 OAHOKYNMYSOMMD-SNVBAGLBSA-N 329.447 0.989 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](C)S(C)(=O)=O 819693276 MWMOVZPMYQEOIF-NSHDSACASA-N 343.401 0.717 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H](CCCO)C2)cc1 817274170 FICHQGSXCYJBPF-HNNXBMFYSA-N 333.432 0.990 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)NC[C@H]3CNC(=O)C3)C2)cc1 823693706 QABSWPKOCPVOLB-ZIAGYGMSSA-N 346.431 0.957 10 20 ECCD O=C(CN1CCC(=O)NC1=O)NCCCSc1nccs1 735272649 KAKWKIFWPXMLIR-UHFFFAOYSA-N 328.419 0.683 10 20 ECCD CS(=O)(=O)CCN1CCC(NC(=O)c2cc(O)cs2)CC1 732291043 NOXHFEWYOHUNCJ-UHFFFAOYSA-N 332.447 0.693 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)NC[C@H]1CC(C(N)=O)=NO1 838479997 VOMNVZQRFPPUPU-CYBMUJFWSA-N 333.392 0.490 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCC[C@H](N)C2)cc1 846364589 SWMFXOXOMBTHPV-AWEZNQCLSA-N 348.447 0.540 10 20 ECCD CNC[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 842207157 LPCYZSIMUVSNGM-INIZCTEOSA-N 344.459 0.971 10 20 ECCD CCN1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@H]1C 754505532 BOJJKWKXNMZNML-LLVKDONJSA-N 341.433 0.930 10 20 ECCD COc1cccc(CNC(=O)c2cn(CC3(C)COC3)nn2)c1O 759957384 DKBQZRGIBDHXGW-UHFFFAOYSA-N 332.360 0.959 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCC(C(=O)NCCO)CC2)cc1 920277823 KSZNTVALJZMRLE-UHFFFAOYSA-N 348.447 0.783 10 20 ECCD COc1ccc(N(C)CCN(C)C[C@H](O)C[C@@]2(O)CCOC2)cc1 930850897 ZQWKQYBHAUIFHB-AEFFLSMTSA-N 338.448 0.966 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C)[C@@H](C)C3)nc12 761068164 GXIFUUYNTKVDLU-NSHDSACASA-N 333.392 0.748 10 20 ECCD CCNS(=O)(=O)[C@H]1CCN(Cc2ccc(OC)c(OC)c2O)C1 893436180 HLMQVFHQALFSAN-LBPRGKRZSA-N 344.433 0.923 10 20 ECCD CC(=O)N(C)CC(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089812073 ACQNTUZRDXXQAM-UHFFFAOYSA-N 335.383 0.737 10 20 ECCD O=C(NCCC1=CCN(c2cnc(F)cn2)CC1)c1c[nH]c(=O)cn1 1089855877 RKGUYEIRSJNRLR-UHFFFAOYSA-N 344.350 0.656 10 20 ECCD CCN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H](C)C(=O)O 1603715495 NOLQOKBSUIYJOV-MRVPVSSYSA-N 330.362 0.699 10 20 ECCD O=C(CSc1ncc(C(=O)O)s1)NCC(=O)N1CCCC1 1601351010 VUULVWCSVNMNBP-UHFFFAOYSA-N 329.403 0.672 10 20 ECCD Cc1c(CNC(=O)C(=O)NC[C@H]2CCNC2)n(C)c2ccccc12 419705686 JIEQVIHFHSSSMC-ZDUSSCGKSA-N 328.416 0.829 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1CCNC(=O)C1 817859376 BQODXSHMVQNTAN-ZDUSSCGKSA-N 346.431 0.067 10 20 ECCD C[C@H]1C[C@H](C(=O)O)CN(C(=O)C(=O)N(C)Cc2ccccc2O)C1 817896602 LTZMDMNZKYQDPR-AAEUAGOBSA-N 334.372 0.920 10 20 ECCD CN1CCN(c2ccc(CNC(=S)NCC(=O)N(C)C)cc2)CC1 905529149 KQNWACJGUIQJQF-UHFFFAOYSA-N 349.504 0.491 10 20 ECCD CN(C[C@@H]1CCCC[C@@H]1O)C(=O)C(=O)NCCc1ccc(N)cc1 842238095 IBNIYJFPPUPEJQ-HOCLYGCPSA-N 333.432 0.937 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H](C)CN1 842170921 NZZDKORRHXZQIN-GJZGRUSLSA-N 342.443 0.888 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[C@@H]1CCNC1 842232363 IPWNCLRINMVLPY-AWEZNQCLSA-N 332.448 0.827 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCC[C@@H](N)C2)cc1 846364590 SWMFXOXOMBTHPV-CQSZACIVSA-N 348.447 0.540 10 20 ECCD C[C@@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@@H]1CCC(=O)N1 918845311 KQKCINONZUJXRS-PBHICJAKSA-N 344.459 0.969 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(C[C@@H]3CCOC3)C2)cc(OC)n1 1015103367 NZVWPACTMFVYFJ-GXTWGEPZSA-N 335.404 0.939 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(CCn3cccn3)C2)cc(OC)n1 1015104241 RIGRGTMBLXAVCA-AWEZNQCLSA-N 345.403 0.800 10 20 ECCD O=C(CCN1CCOCC1)NCc1ccc(N2CCC(O)CC2)cc1 856210444 BVUKSGLYRCWICD-UHFFFAOYSA-N 347.459 0.986 10 20 ECCD CCc1nc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n[nH]1 1116503660 IBMNBLSZCZUSLW-UHFFFAOYSA-N 325.350 0.697 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N[C@@H](CN)C3CC3)cc2)CC1 892025915 BAASWWJDPNXTJR-KRWDZBQOSA-N 331.464 0.975 10 20 ECCD C[C@@H]1C[C@H](NC(=O)c2cccc(O)c2O)C(=O)N1c1cnn(C)c1 790811189 LZPNIVVIFRWXBK-SKDRFNHKSA-N 330.344 0.755 10 20 ECCD NC(=O)C(=O)NCCC1=CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 1089861608 BNBNCACUHLLJDP-UHFFFAOYSA-N 336.323 0.862 10 20 ECCD CCNC(=O)CC(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089822298 ZINNSOKHTXMULN-UHFFFAOYSA-N 335.383 0.785 10 20 ECCD C[C@H](NCCNC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)NC1CC1 1153037245 IHEVUWYOTQRWJL-JTQLQIEISA-N 346.391 0.836 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1C[C@H](N)C1 1333448708 QNIPWWZOGDCXHE-SHTZXODSSA-N 332.448 0.955 10 20 ECCD COc1cc(C)cc(CN(CCN2CCOCC2)CC(=O)O)c1O 1610293269 LTEFQLUJIHMBFK-UHFFFAOYSA-N 338.404 0.928 10 20 ECCD COCCCC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248735 IYOFEHYNMMFPJU-UHFFFAOYSA-N 349.387 0.736 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2cocn2)C1 1842544886 AJAWIIJQHLDPHD-UHFFFAOYSA-N 344.327 0.612 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@@H]([C@H](C)N)C1 817949093 HKXMNNCANJEBPW-XJKSGUPXSA-N 349.431 0.705 10 20 ECCD Cc1ccc(C(=O)OCC(=O)NCC(=O)NC(C)(C)C)c(O)c1O 727004176 HQMBBWQYYPOSNW-UHFFFAOYSA-N 338.360 0.594 10 20 ECCD COc1cc(O)c(CN2CC(n3cc(C(=O)O)nn3)C2)cc1OC 833729240 GTSKWHMBIPTRFR-UHFFFAOYSA-N 334.332 0.756 10 20 ECCD O=C(NCC(=O)N1CCNCC1)NCc1ccc(N2CCCC2)cc1 841709696 LKQBHFWUSOHOAF-UHFFFAOYSA-N 345.447 0.518 10 20 ECCD O=C(Cn1cc(CO)nn1)NCc1ccc(N2CCOCC2)c(F)c1 761987395 PZUDFQGUMWMPQE-UHFFFAOYSA-N 349.366 0.063 10 20 ECCD O=C(CC[C@@H]1NC(=O)NC1=O)NCc1c(O)ccc2c1CCCC2 769562643 JPHOTEBYTPGCOB-ZDUSSCGKSA-N 331.372 0.875 10 20 ECCD C[C@@H]1C[C@@H](NC(=O)c2cccc(O)c2O)C(=O)N1c1cnn(C)c1 790811186 LZPNIVVIFRWXBK-BXKDBHETSA-N 330.344 0.755 10 20 ECCD CS(=O)(=O)CC(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089810150 ILWVJFQTSQAWLL-UHFFFAOYSA-N 342.396 0.303 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC[C@@H](OC)C2)cc1 1349591356 HKBPQHGSQZBPPL-MRXNPFEDSA-N 349.431 0.837 10 20 ECCD Cc1noc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n1 1346553699 RQWWPIVJHVADGU-UHFFFAOYSA-N 349.366 0.858 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)c2coc(-c3nn[nH]n3)c2)cc1 1591031153 AQZMKEQAJYDNCP-CYBMUJFWSA-N 341.375 0.956 10 20 ECCD Nc1nccnc1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 57368093 LAVJWFYWONYZRG-UHFFFAOYSA-N 331.351 0.965 10 20 ECCD C[C@H](O)CN1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 189299499 UROZBWKFHJNTML-INIZCTEOSA-N 348.491 0.709 10 20 ECCD O=C1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN1 80048583 NJNMYOPBDXJQQU-UHFFFAOYSA-N 336.367 0.304 10 20 ECCD COCCS(=O)(=O)CC(=O)NCc1c(O)ccc2c1CCCC2 266459747 GDXYWRQRMKBKAU-UHFFFAOYSA-N 341.429 0.948 10 20 ECCD Cn1cc([C@@H](O)C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 282903207 CWUJAEGYFQMSEW-MRXNPFEDSA-N 330.388 0.607 10 20 ECCD CC[C@H](CNS(C)(=O)=O)NC(=O)N(C)Cc1ccccc1O 298028273 GKHZQGHUOUYEOO-GFCCVEGCSA-N 329.422 0.861 10 20 ECCD CC(C)(CO)CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 295371959 HOKFGNMZQZIYBB-UHFFFAOYSA-N 330.406 0.902 10 20 ECCD Cc1c(C(=O)NCCc2ccc(O)c(O)c2)nnn1-c1ccn(C)n1 293849124 YTBAIBVIBUCSPT-UHFFFAOYSA-N 342.359 0.693 10 20 ECCD COC(=O)C[C@]1(NCC(=O)NCc2ccc(N(C)C)cc2)CCOC1 839561319 UFJHBKOCFQHVDI-GOSISDBHSA-N 349.431 0.681 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(Cc3nncs3)C2)cc(OC)n1 1015101300 FFOCGYLTKCGBGS-LLVKDONJSA-N 349.416 0.955 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@H](CCN)C1 926287504 DUAMMLKXBCJPAS-HNNXBMFYSA-N 332.448 0.908 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H](O)c3cnn(C)c3)CC2)cc1F 857464677 JTVUUMKQHYKZMJ-INIZCTEOSA-N 348.378 0.950 10 20 ECCD CO[C@@H]1CCOC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 1119810191 LCQOGDCUSLUYCM-HZPDHXFCSA-N 349.431 0.597 10 20 ECCD CN(C[C@H]1C[C@@H](O)C1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 875140396 CWDQUWDNDOAGKU-BETUJISGSA-N 337.395 0.737 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CCO)n1C 1121354795 QPRVENYHICEUPQ-UHFFFAOYSA-N 331.420 0.823 10 20 ECCD O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1cccc(O)c1O 790873259 KONCOORPWFNZHU-DUBDDPSESA-N 342.351 0.635 10 20 ECCD CNS(=O)(=O)c1cc(NS(=O)(=O)N(C)CC2CC2)ccc1O 790407798 REDCXRPVVIWGEP-UHFFFAOYSA-N 349.434 0.299 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCC(=O)N(C)C 1321631751 WWGSWZNXXIZMTR-UHFFFAOYSA-N 334.420 0.272 10 20 ECCD C[C@H](NC(=O)C(=O)N[C@H]1CCN(C)C1=O)c1ccc(N(C)C)cc1 1323490595 QPPDVFWCRLCGIA-FZMZJTMJSA-N 332.404 0.277 10 20 ECCD NC(=O)Cc1occc1C(=O)N1C[C@H](C(N)=O)Cc2ccccc21 352653706 ZRMNGSDDDUQMMW-LLVKDONJSA-N 327.340 0.612 10 20 ECCD COc1ncnc(N(C)C)c1NC(=O)C(=O)NCc1ccccc1O 271614827 BUBMJQIMPKAEEA-UHFFFAOYSA-N 345.359 0.512 10 20 ECCD NC(=O)[C@H]1CC[C@@H](C(=O)NCc2ccc(N3CCOCC3)cc2)O1 276485150 SSWGVCJPOPXECF-CABCVRRESA-N 333.388 0.172 10 20 ECCD Cc1ccc(C(=O)N2CCN(CC(=O)N3CCCC3)CC2)c(O)c1O 271292391 QOHAOOICSZPXKL-UHFFFAOYSA-N 347.415 0.786 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)NCC1(OCCO)CCOCC1 282286053 YOSWIEVATWSPPC-DUXPYHPUSA-N 337.372 0.785 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@H](C)C(=O)OC)nc12 280665270 FLWSMIGJRRDSOK-SECBINFHSA-N 336.348 0.605 10 20 ECCD C[C@@H](O)CCN(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 285603663 BWVUTUQZGRPBLT-LLVKDONJSA-N 325.384 0.737 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNCc3ccon3)CC2)cc1 819129498 KGRYNUQIKMVWMO-KRWDZBQOSA-N 346.431 0.956 10 20 ECCD O=C1CN(CC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCN1 901177783 UQGGUWXKKCVEGI-OAHLLOKOSA-N 347.415 0.332 10 20 ECCD NS(=O)(=O)CCCCNC(=O)NCc1cc(Cl)ccc1O 845222076 XICPYHUKEYLAAX-UHFFFAOYSA-N 335.813 0.914 10 20 ECCD COC(=O)[C@@H]1CN(C)CCN(Cc2cc(OC)c(OC)cc2O)C1 840959087 SVNJSFAVGVWMPY-CYBMUJFWSA-N 338.404 0.946 10 20 ECCD C[C@@H](CN)NC(=O)C(=O)N(Cc1ccco1)Cc1ccccc1O 842254266 HEKQLKVACPURLT-LBPRGKRZSA-N 331.372 0.977 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@](C)(O)C3)CC2)cc1 754050740 ROBQVFDFZWMCLU-MJGOQNOKSA-N 349.475 0.635 10 20 ECCD CNC[C@@H](C)NC(=O)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 851684794 HYHRFHWSODHCNC-UONOGXRCSA-N 334.464 0.832 10 20 ECCD NS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccc(O)cc1 776744956 RDPBGBWJVQBNCJ-UHFFFAOYSA-N 328.371 0.840 10 20 ECCD C[C@H](NCCS(=O)(=O)N1CCOCC1)c1c(O)cccc1F 886545369 LOKIZSCMEMCCDD-NSHDSACASA-N 332.397 0.844 10 20 ECCD C[C@H](O)[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 774188486 NDVVIBRYSGGTJN-QWRGUYRKSA-N 343.474 0.971 10 20 ECCD C[C@H](OC(=O)c1cc(O)cs1)C(=O)N[C@H]1CCS(=O)(=O)C1 783608499 RNFJBGYNBAIVTB-YUMQZZPRSA-N 333.387 0.302 10 20 ECCD COCCOCCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 789914426 NSBUMXFKVIIIKJ-UHFFFAOYSA-N 337.420 0.490 10 20 ECCD CN1CCNC[C@H]1C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1122026446 SGTAZANPOLHRPL-HOTGVXAUSA-N 333.432 0.803 10 20 ECCD NS(=O)(=O)c1cccc(CNC(=O)c2c(F)ccc(O)c2O)c1 789952686 GQYGHPUNKBOZLI-UHFFFAOYSA-N 340.332 0.814 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)N3CC[C@H]3CO)CC2)cc1 892429962 WMXFXWKVUUFSKO-INIZCTEOSA-N 348.447 0.593 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCCn3cccn3)ccc21 793746032 MBDVSSNPWSJKFW-UHFFFAOYSA-N 341.415 0.698 10 20 ECCD C[C@H]1CCN1C(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1331851650 XHWLMSFDCPVGRL-AWEZNQCLSA-N 330.432 0.675 10 20 ECCD Cc1cc(-c2nn[nH]n2)cnc1C(=O)NCc1c(O)cccc1O 1591875622 IEQCYMQWUUQWNU-UHFFFAOYSA-N 326.316 0.911 10 20 ECCD CN(CC(=O)NCc1ccc(N(C)C)cc1)CC(=O)N1CCOCC1 7242077 UITQLAQBOACJMA-UHFFFAOYSA-N 348.447 0.159 10 20 ECCD CCN(CC)c1ccc(CNC(=O)NCCS(=O)(=O)NC)cc1 187404323 HZBQQXBNVQLPSJ-UHFFFAOYSA-N 342.465 0.881 10 20 ECCD CCCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCNC1 842034997 BBJMRDBANSWFJN-MRXNPFEDSA-N 332.448 0.969 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CC3(N)CC3)cc2)C1 852860276 AXEHCDFVKZAUKN-CQSZACIVSA-N 330.432 0.886 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C[C@@H](N)C[C@@H]3C)CC2)cc1 866682923 OIXSPCQWBMAYHB-GJZGRUSLSA-N 332.448 0.765 10 20 ECCD COc1ccc(-n2nnnc2CN2CC(N(C)C(=O)C3CC3)C2)cc1 1042395380 BKGOLFAGERGOAD-UHFFFAOYSA-N 342.403 0.724 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)N[C@H]2COC[C@H]2OC)cc1 872986879 UQFRUPFLMNMCPU-UONOGXRCSA-N 338.360 0.116 10 20 ECCD C[C@@H](NC(=O)c1cn(C)c(=O)n(C)c1=O)c1ccc(N(C)C)cc1 772997267 FINBZLVNIVGWAH-LLVKDONJSA-N 330.388 0.641 10 20 ECCD CN1CCN(c2ccc(CNC(=O)CN(C)C(=O)C3CC3)cc2)CC1 881851346 RWMFHLIJKCCRGJ-UHFFFAOYSA-N 344.459 0.923 10 20 ECCD COc1cccc(CNC(=O)N[C@H](C)[C@H]2CN(C)CCN2C)c1O 1123793367 BLMJXSRITOHQII-TZMCWYRMSA-N 336.436 0.834 10 20 ECCD CNC(=O)[C@@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)CCO1 781926598 OVTDDTIGTDOKLA-INIZCTEOSA-N 337.395 0.609 10 20 ECCD CC(=O)NCCNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891503731 UULSGFPNEUKFHA-INIZCTEOSA-N 335.452 0.791 10 20 ECCD C[C@@H](NCCNC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)NC1CC1 1153037246 IHEVUWYOTQRWJL-SNVBAGLBSA-N 346.391 0.836 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cnc(C)[nH]3)C2)cc(OC)n1 996368852 OSKOTJVXKADBDN-UHFFFAOYSA-N 345.359 0.385 10 20 ECCD O=C1C[C@@H](C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)CCN1 1089820658 IIBYNSZVZIJJTH-ZDUSSCGKSA-N 347.394 0.785 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)CCNC(N)=O)CC2)nn1 1089836622 ZFWIKZFYUFHEFS-UHFFFAOYSA-N 332.408 0.486 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1COC(C)(C)O1 1324899328 NMGDBEBNPDEBRU-HNNXBMFYSA-N 349.431 0.945 10 20 ECCD CC(C)N1C[C@H](NC(=O)C(=O)NCCc2ccc(N)cc2)CC1=O 1325362124 LWQMHVAICIYPGV-CQSZACIVSA-N 332.404 0.053 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)[C@@H](c2cncn2C)N(C)C)cc1 1352990183 YKUWRTPFBRGKFW-DOTOQJQBSA-N 344.463 0.905 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CCO[C@H](CNCCCO)C2)cc1 1755018629 VYBYJATYJFLYDU-CQSZACIVSA-N 349.391 0.662 10 20 ECCD O=C(O)[C@@H]1CS(=O)(=O)CCN1Cc1cc(Cl)c(F)cc1O 1594962267 QQBSHWZUXDMMEF-JTQLQIEISA-N 337.756 0.868 10 20 ECCD CN1CCN(c2ccc(CNC[C@@H](CC(=O)O)C(=O)O)cc2)CC1 1777091517 XXXHYHPJSNGVPI-CQSZACIVSA-N 335.404 0.704 10 20 ECCD CN1C(=O)C(=Cc2cccn3c(C(=O)O)cnc23)C(=O)N(C)C1=O 1776115974 OMSDDDMTISUPQJ-UHFFFAOYSA-N 328.284 0.466 10 20 ECCD CN(C)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1795577125 QPFSJNYYDLACFB-CLLJXQQHSA-N 348.403 0.306 10 20 ECCD CC(C)C[C@@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 271397821 JVJPOAJMKAHHRC-NSHDSACASA-N 330.406 0.901 10 20 ECCD COc1cc(O)c(CN2CCCN(S(C)(=O)=O)CC2)cc1OC 271078369 HSQJCRZVZLPROF-UHFFFAOYSA-N 344.433 0.877 10 20 ECCD Cc1ncoc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 816707996 LJLJWGZTJQPMED-UHFFFAOYSA-N 325.346 0.990 10 20 ECCD CCOC(=O)CN(CCN1C(=O)CCC1=O)Cc1ccccc1O 823576277 KZEAIUCTHSYIFW-UHFFFAOYSA-N 334.372 0.906 10 20 ECCD C[C@H](CN)CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 842250068 SIVTTXZSTOCKEL-CYBMUJFWSA-N 332.448 0.955 10 20 ECCD C[C@@H](CN)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 842250588 WBLJVTPOGUMOHG-ZFWWWQNUSA-N 349.431 0.611 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCN[C@H](C)C3)CC2)cc1 844219204 IIRJGCNZZKWSKW-OAHLLOKOSA-N 332.448 0.638 10 20 ECCD NC[C@@H]1OCC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 852860617 SYCPZKDKEQMMHZ-BBRMVZONSA-N 337.395 0.642 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)c2nc3ncccn3n2)cc1 852791517 INLCFVOMPPSADG-ZDUSSCGKSA-N 325.376 0.620 10 20 ECCD COc1cc(C(=O)NC2CN(Cc3cc(C)n(C)n3)C2)cc(OC)n1 1030612017 FPPZUHUWRQFJDR-UHFFFAOYSA-N 345.403 0.755 10 20 ECCD COc1ccc(-n2nnnc2CN2CC[C@@H]2CNC(=O)C2CC2)cc1 1037994252 OKIYMWOYLXGYGS-CQSZACIVSA-N 342.403 0.771 10 20 ECCD O=C1NC(=O)N2CCN(Cc3ccc(N4CCC(O)CC4)cc3)C[C@H]12 877167588 CSQXFUJYRUHYDU-MRXNPFEDSA-N 344.415 0.384 10 20 ECCD C[C@@H](NC(=O)CN1CCS(=O)(=O)CC1)c1ccc(N(C)C)cc1 773002364 ZSSWZBOIIHEYTL-CYBMUJFWSA-N 339.461 0.660 10 20 ECCD COCCn1cc(C(=O)NCCNCc2ccc(OC)c(C)c2)nn1 1127056802 KCORMMZYXPYVKA-UHFFFAOYSA-N 347.419 0.761 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)[C@@H]2CCCO2)cc1 1123117086 BVWCLZIMYIWNQW-AWEZNQCLSA-N 346.391 0.056 10 20 ECCD CC(=O)N(C)CC(=O)NCCC1=CCN(c2ccc(C)nn2)CC1 1089807828 WFNRHZUUNNNSRC-UHFFFAOYSA-N 331.420 0.906 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)c3cn(C)nn3)CC2)ncn1 1089829620 TYUXHHZKCGGOKY-UHFFFAOYSA-N 327.392 0.870 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)CC(F)(F)F)C2)cc(OC)n1 996369360 UNOQDXQXZNSMGE-UHFFFAOYSA-N 347.293 0.992 10 20 ECCD Cc1cc(C(=O)NCc2ccc(O)c(O)c2)c2c(=O)[nH]n(C)c2n1 182527646 NYLAILGVFALSGO-UHFFFAOYSA-N 328.328 0.911 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@H]3CCN(C)C3=O)nc12 265641933 KBXUPSZCJIFOAW-LBPRGKRZSA-N 347.375 0.274 10 20 ECCD CN(Cc1ccccc1O)C(=O)CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 266631749 WWTAIKNCLAHISD-RRCSTGOVSA-N 344.367 0.513 10 20 ECCD CN(Cc1ccccc1O)C(=O)NC[C@H]1CCN(S(C)(=O)=O)C1 269971050 KYDIZDQZQYFDOS-GFCCVEGCSA-N 341.433 0.815 10 20 ECCD COc1cc(O)c(CN2CCN(S(C)(=O)=O)[C@@H](C)C2)cc1OC 271918004 TWQYHEQUUVGNDQ-NSHDSACASA-N 344.433 0.875 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCc2nncn2C1 368387386 IDJORQUHTCHLAT-HNNXBMFYSA-N 341.415 0.994 10 20 ECCD COC[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)OC 272740145 CQBRKPADWWVOAC-SNVBAGLBSA-N 332.378 0.155 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)c3cnn(C)c3)CC2)cc1 299493806 IMXLSZUAWJCGMD-UHFFFAOYSA-N 343.431 0.981 10 20 ECCD COc1cccc(CNC(=O)CCC(=O)NCCNC(C)=O)c1O 732283870 DKHATGQGCDXCKQ-UHFFFAOYSA-N 337.376 0.050 10 20 ECCD O=C(NCCCO)NCc1cc(F)c(N2CCOCC2)c(F)c1 838745747 XULGGFCCQJGJKT-UHFFFAOYSA-N 329.347 0.983 10 20 ECCD CC(C)(CO)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 847362277 PMKJFBIPMPMVAE-UHFFFAOYSA-N 340.445 0.556 10 20 ECCD Cn1cc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)cn1 920637116 ZWLGUCGETXRTHM-UHFFFAOYSA-N 325.346 0.854 10 20 ECCD Cc1ccc(C(=O)Nc2nnc(NS(C)(=O)=O)s2)c(O)c1O 770485409 CLYXTONAWOXDBD-UHFFFAOYSA-N 344.374 0.882 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C(=O)N(C)CC3CC3)cc2)CC1 898330023 VUAXFIUVVHUPEG-UHFFFAOYSA-N 344.459 0.923 10 20 ECCD COc1ccc(CNCCNC(=O)[C@H]2CCCS2(=O)=O)cc1C 1151683760 HTRAUPSEICUCLO-OAHLLOKOSA-N 340.445 0.787 10 20 ECCD COc1cccc(CN2CCN(C(=O)N3CCOCC3)CC2)c1O 1341523672 ZDRQRYAWGUIQOL-UHFFFAOYSA-N 335.404 0.971 10 20 ECCD CC(=O)C(=O)COC(=O)[C@@H]1CCCN1c1ccc(-c2nn[nH]n2)cc1 1588781412 AVENGEBFGYVLLS-ZDUSSCGKSA-N 343.343 0.537 10 20 ECCD CN(C)c1ccc(CN2CCC[C@H](CNS(N)(=O)=O)C2)cc1 158902360 YGWHYBBELSPNRB-CQSZACIVSA-N 326.466 0.758 10 20 ECCD CC(=O)NCCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 79850951 WWZSGVVEAWLFRQ-UHFFFAOYSA-N 338.383 0.598 10 20 ECCD O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NCc1ccc(O)c(O)c1 272267197 COWWXLUTEVLBQM-KUDNYVPYSA-N 342.351 0.521 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@](C)(C(N)=O)C2)cc1 283475311 LUDLHXNMEOEFCW-QGZVFWFLSA-N 332.404 0.093 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)COC(F)F)nc12 803729364 NVNMAICBIMDZKP-UHFFFAOYSA-N 345.258 0.894 10 20 ECCD CS(=O)(=O)NC1CC(NC(=O)/C=C\c2ccc(O)c(O)c2)C1 801463775 VMZNESCNYZVUEO-HYXAFXHYSA-N 326.374 0.307 10 20 ECCD C[C@H]([C@H]1CN(C)CCO1)N1C(=O)CN(Cc2ccccc2O)C1=O 819170324 IIYMIMFFFZTHBV-IUODEOHRSA-N 333.388 0.876 10 20 ECCD NC(=O)CN1C(=O)/C(=C/c2ccc([N+](=O)[O-])c(O)c2)SC1=S 727176730 ZAKHJWGNHBPYBA-WTKPLQERSA-N 339.354 0.987 10 20 ECCD Cc1ccc(C(=O)OCC(=O)NCCCn2cccn2)c(O)c1O 727003812 HDDKRNOZKUGBOK-UHFFFAOYSA-N 333.344 0.966 10 20 ECCD C[C@@H](NC(=O)N1CCOC[C@H]1CO)c1ccc(N2CCOCC2)cc1 914401015 ZORWKTGKHJFBLL-RHSMWYFYSA-N 349.431 0.987 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCCO[C@@H](CN)C1)c1ccc(N(C)C)cc1 842203659 VRAQGDDURNLBFZ-BBRMVZONSA-N 348.447 0.506 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@@H](C)C(=O)O)cc1 848607413 AGQOFOIYXFJOKE-GFCCVEGCSA-N 335.404 0.986 10 20 ECCD CC1=C(C(=O)NCCc2ccc(O)c(O)c2)[C@@H](C)n2nnnc2N1C 847589643 KOXCAFOKBBROPQ-SNVBAGLBSA-N 344.375 0.728 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CCCS(N)(=O)=O)cc1 911892698 MUKYCPAEDMODBH-UHFFFAOYSA-N 343.449 0.659 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCC(=O)O)cc2)C1 842572979 OZQCREMDDORNBJ-CYBMUJFWSA-N 333.388 0.869 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN(C)[C@H]3CCNC3)CC2)cc1 923288311 VIRYEGDKZPDYPG-ZWKOTPCHSA-N 348.491 0.472 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)[C@H]3CCC(=O)N3)C2)cc1C 1018625819 UQZXHKHNCRRKNE-LSDHHAIUSA-N 331.416 0.973 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCc3cnon3)C2)cc(OC)n1 1020352283 HCJAGKMHSFWNJY-XYPYZODXSA-N 333.348 0.532 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCC[C@]12CCOC2=O 1117985049 WVYVOAGSERQOKP-QGZVFWFLSA-N 332.356 0.659 10 20 ECCD COc1ccc(N2CCN(CCCNC(=O)c3nc[nH]n3)CC2)cc1 772779464 QYQLGXCOXLYQFM-UHFFFAOYSA-N 344.419 0.755 10 20 ECCD O=C(COCC(=O)NCc1ccc(O)c(O)c1)NCc1cccnc1 778925593 LZURQJPDYNVRJX-UHFFFAOYSA-N 345.355 0.442 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)NC(C)(CO)CO)N(C)C)cc1 899101586 IZBNWAAGGCTKJO-HNNXBMFYSA-N 338.452 0.398 10 20 ECCD CN1C[C@H](C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)CC1=O 1089867375 IVWQSYONQQVGFZ-CYBMUJFWSA-N 347.394 0.737 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NC2CCOCC2)cc1 1326669105 UTXHADHXICSOEF-UHFFFAOYSA-N 349.431 0.885 10 20 ECCD CN1CCCC[C@H]1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1339263757 KHRJGOYDVAPRQX-LBPRGKRZSA-N 341.433 0.978 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H]1CNCCS1(=O)=O 1340187029 XCTMQZRIKFXUDU-OAHLLOKOSA-N 339.461 0.488 10 20 ECCD 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10 20 ECCD Cc1[nH]nc(S(=O)(=O)NCc2ccc(N(C)C)cc2)c1C(=O)O 1600673562 JWTONWKGTZKIQD-UHFFFAOYSA-N 338.389 0.961 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H]1CCC[C@]12NC(=O)NC2=O 272675938 RDNSPTWSMVHQMQ-PELIBPFYSA-N 345.355 0.606 10 20 ECCD CC1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)OCCO1 270763481 PHQYOYOJJSNGEY-UHFFFAOYSA-N 330.362 0.257 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCO[C@@H](C(=O)O)C2)cc1F 737377622 MRCXDQOMTDWHEB-CYBMUJFWSA-N 325.340 0.887 10 20 ECCD C[C@H](CN)CNC(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 911292625 QVIQOWKMGXLWFC-CZUORRHYSA-N 349.479 0.183 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)N(C)[C@H](C)CN)CC2)cc1 841750527 RQTXAPGXRGSQCV-OAHLLOKOSA-N 349.479 0.806 10 20 ECCD Cc1ccc(O)c(CNC(=O)C2CCN(S(C)(=O)=O)CC2)c1 862759669 IXWYXPLWAHQLKF-UHFFFAOYSA-N 326.418 0.988 10 20 ECCD NS(=O)(=O)c1ccc(C(=O)NCCc2ccc(O)c(O)c2)s1 767775927 STMDBDDVRYZJMK-UHFFFAOYSA-N 342.398 0.779 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@](O)(C3CC3)C2)cc1F 1117165305 TYUVQJATTKXYSY-SFHVURJKSA-N 349.406 0.881 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@H](CO)C3)CC2)cc1 779221937 DJQHVXIMTPTKAX-FUHWJXTLSA-N 349.475 0.492 10 20 ECCD COc1ccc(-n2nnnc2CNC[C@H]2CN(C(C)=O)CCO2)cc1 1051384427 SDPDZEMVAXNBOT-HNNXBMFYSA-N 346.391 0.008 10 20 ECCD CN(C)c1ccc(CNC(=O)C[C@H]2CNCCS2(=O)=O)cc1 1121982862 VSCJOCLWCYGRCF-AWEZNQCLSA-N 325.434 0.146 10 20 ECCD C[C@@H]1[C@@H](NCC(N)=O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 987594102 HPHPEMXVXZBLPK-SKDRFNHKSA-N 332.364 0.527 10 20 ECCD C[C@H](NC(=O)C(=O)NCCCC(=O)N(C)C)c1ccc(N(C)C)cc1 1323257641 UQQMNHHMCLTHRR-ZDUSSCGKSA-N 348.447 0.914 10 20 ECCD O=C(NCCO)C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 1329546562 WOYJCGPXBOOPOA-DUXPYHPUSA-N 334.372 0.458 10 20 ECCD Nc1ccc(CNC(=O)N2CCC[C@@H](C(=O)N3CCNCC3)C2)cc1 1337069968 DTDMDJAVBSPQKX-OAHLLOKOSA-N 345.447 0.622 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@](F)(CO)C2)cc1F 1345504664 BJHNHWSSELFHJX-INIZCTEOSA-N 341.358 0.441 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCC[C@@H]1C1OCCO1 1345861031 PHWIHQADXMZMJD-CYBMUJFWSA-N 334.372 0.715 10 20 ECCD Cc1ccc(O)c(CNC(=O)C(=O)Nc2cnn(CC(=O)O)c2C)c1 1600465249 VDNDACIKJHRQKR-UHFFFAOYSA-N 346.343 0.545 10 20 ECCD CN1CCN(c2ccc(CN3C[C@@H](O)C[C@H](C(=O)O)C3)cc2)CC1 1606245284 APLCFZDSVKYILT-RDJZCZTQSA-N 333.432 0.706 10 20 ECCD O=C(NCc1ccccc1O)C(=O)Nc1ccc(-c2nn[nH]n2)cc1 1606839075 AQHQFUCUMWQSKI-UHFFFAOYSA-N 338.327 0.827 10 20 ECCD Cn1[nH]c(C2CCNCC2)nc1=NC(=O)/C=C/c1ccc(O)c(O)c1 1579994114 QOTHIXJKMVRHGL-HWKANZROSA-N 343.387 0.767 10 20 ECCD O=C(O)CN1CCC[C@H](C(=O)NCc2cc(Cl)ccc2O)C1=O 1595084986 ZXLUQJCKZXSXLA-LLVKDONJSA-N 340.763 0.985 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)CNC(=O)CNC(C)=O 282442996 IFYQEXHPOQTAQV-UHFFFAOYSA-N 335.404 0.773 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H](O)C3CC3)cc2)C1 822938852 ZMZSFQHDVGXLOW-GDBMZVCRSA-N 331.416 0.775 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)Cn1[nH]cc2c(=O)ncnc1-2 734406531 UHWRASVFEPWCPU-UHFFFAOYSA-N 340.387 0.762 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cn(CC(N)=O)nn1 839919142 PUHISYMTRLADTL-LBPRGKRZSA-N 344.419 0.499 10 20 ECCD COc1ccc(O)c(CNC(=O)C2=C(C)N(C)c3nnnn3[C@@H]2C)c1 847590673 DEEQRWNHFBXFJO-SNVBAGLBSA-N 344.375 0.989 10 20 ECCD CN(C[C@H]1CCOC1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 749541471 CDGVRZNWHZOGGN-SNVBAGLBSA-N 328.390 0.872 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCC[C@H](N)C2)cc1F 842149411 YLZJVJAGOMNBMW-STQMWFEESA-N 336.411 0.894 10 20 ECCD O=C(NCc1cccc(Br)c1O)NC[C@H]1CNCCO1 842012126 UVGYZWYPZSGYLP-SNVBAGLBSA-N 344.209 0.942 10 20 ECCD CCN(C)C(=O)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852260872 FLWHZJKMNVHTFE-UHFFFAOYSA-N 348.447 0.925 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 767778878 NWNVLTAPFYWQCX-UHFFFAOYSA-N 341.323 0.600 10 20 ECCD CS(=O)(=O)NC1CN(Cc2cccc(Br)c2O)C1 862486011 TVMDMCDGMMEEAF-UHFFFAOYSA-N 335.223 0.888 10 20 ECCD COc1cc(C(=O)N[C@@H]2COC3(C2)CN(CCF)C3)cc(OC)n1 1053859070 YZZPUWBUVPDJHX-LBPRGKRZSA-N 339.367 0.641 10 20 ECCD COC[C@@H](NCc1ccc(N2CCOCC2)c(F)c1)C(=O)OC 789576860 RSBROZWWJFMJFJ-CQSZACIVSA-N 326.368 0.940 10 20 ECCD 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COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@@H]3C(N)=O)CC2)cc1 900407133 PDHRXZXIQOGFTN-JKSUJKDBSA-N 346.431 0.055 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccon1 747155041 QSTIUSBZLFYKMG-UHFFFAOYSA-N 335.385 0.839 10 20 ECCD CCc1cccc(CN2CCN(S(=O)(=O)N(C)C)CC2)c1O 848880617 HQGPFEUHXSEOOC-UHFFFAOYSA-N 327.450 0.879 10 20 ECCD CN(C)[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 919819706 YPJVNLIOSHWLNJ-CYBMUJFWSA-N 341.433 0.834 10 20 ECCD CN(C[C@H]1COCCO1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 855681182 HBGPEMLRLVTGOC-NSHDSACASA-N 344.389 0.251 10 20 ECCD COc1ccc(CN[C@@H]2CC[C@@H]3CN(C(=O)C(N)=O)C[C@@H]32)cc1C 1026345981 IOPUJBJJZUXVTO-QLFBSQMISA-N 331.416 0.816 10 20 ECCD NC(=O)[C@H]1CCCCN1C(=O)COC(=O)/C=C\c1ccc(O)c(O)c1 759596888 WJMWVKQRRCNZQY-SMYYYNMVSA-N 348.355 0.521 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@@H]2CC(=O)N(CCN(C)C)C2)c1 769529734 ONYINGUVPHAGMN-CYBMUJFWSA-N 335.404 0.427 10 20 ECCD CCNS(=O)(=O)CCNCc1ccc([N+](=O)[O-])c(OC)c1O 775027202 IXCRTDMADZZEJW-UHFFFAOYSA-N 333.366 0.338 10 20 ECCD 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CN(Cc1ccc(N(C)C)cc1)C(=O)NCCCS(N)(=O)=O 923212360 WLFBYWBZPBIHKK-UHFFFAOYSA-N 328.438 0.573 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@]3(C)CO)nc12 759903171 TUVZLLBZPUYVAS-MRXNPFEDSA-N 334.376 0.958 10 20 ECCD COc1cccc(CNC(=O)NCc2nnnn2CC2CC2)c1O 771373817 FGRRQPYOBCEOSW-UHFFFAOYSA-N 332.364 0.797 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCOCC1)c1ccc(N2CCOCC2)cc1 774179780 HPMBXKWFMPCNKK-AWEZNQCLSA-N 347.415 0.559 10 20 ECCD C[C@@H]1OC(=O)N[C@@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 788630148 GOFZQJPUTDCBHM-WFASDCNBSA-N 333.388 0.979 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCNC(=O)C2)N(C)C)cc1 891254510 YOCQUOCIKLRCOA-HOCLYGCPSA-N 332.448 0.998 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CSCC3=O)CC2)cc1 8138758 JXUKGYYRQHPMDZ-UHFFFAOYSA-N 335.429 0.877 10 20 ECCD CNC(=O)CCCNC(=O)NCc1ccc(N2CCOCC2)cc1 54785874 XARIQWMOFHALAO-UHFFFAOYSA-N 334.420 0.849 10 20 ECCD CN1CCCc2cc(CNC(=O)CN3CCCS3(=O)=O)ccc21 58769803 KTNVSSCTBQWMAV-UHFFFAOYSA-N 337.445 0.721 10 20 ECCD CC(C)[C@H](N)C(=O)NCC(=O)N1CCOc2cc(N(C)C)ccc21 271114765 DULLUUVTNQHBLO-INIZCTEOSA-N 334.420 0.578 10 20 ECCD Cn1cncc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 809616201 SJVQOKURBQBVFG-UHFFFAOYSA-N 348.428 0.585 10 20 ECCD COC(=O)COCC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 806614653 ZRVCPJNTMBPYKT-ZDUSSCGKSA-N 336.388 0.890 10 20 ECCD CN1C(=O)CC[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1=O 819179673 GKYLACXKEFUQGG-LLVKDONJSA-N 331.328 0.304 10 20 ECCD COC(=O)[C@H]1C[C@@H](O)CN(CC(=O)NCc2ccc(N(C)C)cc2)C1 830880953 FSVCDFLXVPPIAZ-GOEBONIOSA-N 349.431 0.225 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@]2(CCNC2)C1 842152346 HFUSWHJFGKPEPG-LJQANCHMSA-N 344.459 0.889 10 20 ECCD COCCOCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917833491 PBBKSYSSYMKXFO-OAHLLOKOSA-N 349.431 0.668 10 20 ECCD Cc1ccc(N(C)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)nn1 742224806 YZALLQOEHSRGKF-UHFFFAOYSA-N 333.373 0.245 10 20 ECCD O=C1CC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CN1 919970526 ISCUXUPGPIGJDL-ZDUSSCGKSA-N 349.406 0.929 10 20 ECCD CN(Cc1ccccc1O)S(=O)(=O)C[C@@H]1CCCS(=O)(=O)C1 849376790 VATYOCCFIWYGKU-GFCCVEGCSA-N 347.458 0.979 10 20 ECCD COC(=O)CNC(=O)[C@H](C)N(C)Cc1ccc(N2CCOCC2)cc1 857758981 VTLNOMBBGAYHLE-AWEZNQCLSA-N 349.431 0.633 10 20 ECCD CN(CCCN)C(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 852918187 YMVQPKZNFGCTIS-UHFFFAOYSA-N 348.447 0.289 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@H]2CCCN2C(=O)CNC(C)=O)c1 769529709 MTUHSGPHTJNNPH-CQSZACIVSA-N 349.387 0.144 10 20 ECCD NC(=O)C1=CC(C(=O)Nc2nnc(-c3ccncc3)s2)=S=C1 1116300322 WSUGJGCFSKPRQW-UHFFFAOYSA-N 331.382 0.672 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H](O)C[C@@]1(C)CO 878982548 AUTSUPYTRQGHOE-AEFFLSMTSA-N 335.448 0.529 10 20 ECCD Nc1ccc(CC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1 71700741 ZMDTWSFHPZLTLZ-UHFFFAOYSA-N 333.413 0.818 10 20 ECCD CS(=O)(=O)N[C@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)C1 789957835 XUDDKNFIKNTJLO-QMMMGPOBSA-N 332.353 0.391 10 20 ECCD COc1cc(C(=O)N[C@@H]2CC[C@H]3CN(CCO)C[C@@H]3C2)cc(OC)n1 980141153 MKSNORWZXZJJRQ-AEGPPILISA-N 349.431 0.921 10 20 ECCD C[C@]1(C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)CNC(=O)C1 1089850778 HLEBAJPOISTCPO-QGZVFWFLSA-N 347.394 0.785 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@H]3CCO[C@@H]3C)C2)cc(OC)n1 996369511 YCHXQVRHPQAQRX-MFKMUULPSA-N 349.387 0.464 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3COCCO3)CC2)ncn1 1089807676 PBTBUNRFBTYYGL-HNNXBMFYSA-N 332.404 0.843 10 20 ECCD O=C1CN(c2nnc(-c3sccc3O)n2C[C@H]2CCOC2)CCN1 1345432724 KNXUHOFPGJWJFM-SNVBAGLBSA-N 349.416 0.685 10 20 ECCD CCOC(=O)CN(CCCS(N)(=O)=O)Cc1ccccc1O 1261442931 GCOIPPHHMVBJAM-UHFFFAOYSA-N 330.406 0.436 10 20 ECCD C[C@H](CC(=O)O)N1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 1609735413 ZUBPYVQPECFBCS-SECBINFHSA-N 326.324 0.858 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@H](CC(=O)O)C2)cc1 1610105520 UAWSQXSPQAYTRU-CQSZACIVSA-N 349.387 0.071 10 20 ECCD O=C(c1ccno1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249146 BQDGZFZQUDVMTA-UHFFFAOYSA-N 344.327 0.612 10 20 ECCD Cc1ccc(C(=O)NCc2ccc(-c3nn[nH]n3)cn2)c(O)c1O 1592127901 KWKLDEUNCAIJRJ-UHFFFAOYSA-N 326.316 0.911 10 20 ECCD COc1ccc(N2CCCN(C(=O)[C@@H](N)CCC(=O)O)CC2)cc1 1599585591 FRGJRPABFTYLCK-HNNXBMFYSA-N 335.404 0.926 10 20 ECCD COc1ccc(CN2CCS(=O)(=O)C[C@@H]2C(=O)O)c(O)c1OC 1594094093 HQFONUBWIVHVCQ-SNVBAGLBSA-N 345.373 0.093 10 20 ECCD COCCS(=O)(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 5098926 INQLQHKMAKLRJP-HNNXBMFYSA-N 329.466 0.921 10 20 ECCD COc1ccc(N2CCN(CCNCCS(C)(=O)=O)CC2)cc1 320171812 QTFLFBREZANMEU-UHFFFAOYSA-N 341.477 0.451 10 20 ECCD O=S(=O)(C1CC1)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 529640337 LCFVGNLYGMGNIM-UHFFFAOYSA-N 340.401 0.731 10 20 ECCD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)OCC(=O)C(C)=O)cc1 808485953 AQRDLTSTUMQTAV-VIFPVBQESA-N 343.357 0.063 10 20 ECCD O=C(NCc1c(O)ccc2c1CCCC2)c1cnn(C[C@H](O)CO)c1 830559716 UBFUSEUUVDZRPB-AWEZNQCLSA-N 345.399 0.751 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)C3(C(N)=O)CC3)cc2F)CC1 731637460 WLRDJIWRLAAOES-UHFFFAOYSA-N 348.422 0.849 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3)cc2)CC1 832172881 MUWVJSYWRCZSBZ-KRWDZBQOSA-N 330.432 0.723 10 20 ECCD C[C@@H](CO)C1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)CC1 846343935 PMLVYRSHJHXCJX-ZDUSSCGKSA-N 333.432 0.795 10 20 ECCD CC(C)(C)OC(=O)CNC(=O)COC(=O)c1cccc(O)c1O 758557490 BGIMEBREZUWKKE-UHFFFAOYSA-N 325.317 0.713 10 20 ECCD COc1ccc(N2CCC(NC(=O)C(=O)N(C)C[C@@H](C)N)CC2)cc1 861759586 MVTVOAWMAHEJMV-CYBMUJFWSA-N 348.447 0.586 10 20 ECCD COCC(=O)NCCC(=O)N1CCCN(c2ccc(OC)cc2)CC1 1115893885 PHWKZEPXNLGRPA-UHFFFAOYSA-N 349.431 0.887 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCNCC3)CC2)cc1F 876781094 JRCSQOGHNOQGOH-UHFFFAOYSA-N 336.411 0.388 10 20 ECCD CC(=O)NC[C@H]1CCCCN1C(=O)C(=O)NCCc1ccc(N)cc1 1118924000 DMZSVGVCSSORHH-MRXNPFEDSA-N 346.431 0.445 10 20 ECCD COc1ccc(O)c(CNC(=O)CCC[C@]2(C)NC(=O)NC2=O)c1 772705288 DXNFQVLHBNGZCQ-INIZCTEOSA-N 335.360 0.785 10 20 ECCD C[C@@H]1OC(=O)N[C@H]1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891248660 MIMKRRJIYJPLMB-TUKIKUTGSA-N 334.420 0.968 10 20 ECCD Cc1nc(C)c(F)c(N2CC=C(CCNC(=O)CC(N)=O)CC2)n1 1089821912 CGIDDYXZEAHQIQ-UHFFFAOYSA-N 335.383 0.751 10 20 ECCD CCC(=O)NCC(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089822534 IUKOEOFINIROKW-UHFFFAOYSA-N 335.383 0.785 10 20 ECCD COCCCN(C)CCNC(=O)C(=O)N(C)Cc1ccccc1O 1325002697 WIIQJICELKAYKB-UHFFFAOYSA-N 337.420 0.435 10 20 ECCD CN(CC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc2c(c1)OCO2 1341158961 YBRAEPKOCMHEPO-JTQLQIEISA-N 326.374 0.155 10 20 ECCD CNC[C@H](O)[C@@H](C)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 1341569099 HMWDRJGHWNIERI-PBHICJAKSA-N 335.448 0.950 10 20 ECCD COc1ccc(N2CC[C@@H](NCCS(=O)(=O)CC(=O)O)C2)cc1 1594101012 ACMBWOQECNVYMU-GFCCVEGCSA-N 342.417 0.363 10 20 ECCD CN(C)C(=O)Cn1cnc(NC(=O)NCc2ccc(N(C)C)cc2)n1 177468852 UECOFPITHFYNRB-UHFFFAOYSA-N 345.407 0.754 10 20 ECCD CS(=O)(=O)N1CC[C@@H](CNC(=O)NCc2ccccc2O)C1 269933127 JARFJYVKENUWRT-NSHDSACASA-N 327.406 0.473 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCNC(=O)[C@@H]2C)cc1 283710387 AAYOYJOAPLOSJN-ZDUSSCGKSA-N 346.431 0.496 10 20 ECCD CC[C@H]1C(=O)N(CC)CCN1C(=O)C(=O)NCCc1ccc(N)cc1 842235255 GCYKRWYVAWITNW-HNNXBMFYSA-N 346.431 0.397 10 20 ECCD Cc1nn(CC(=O)NCc2ccc3c(c2)CCCN3C)c(=O)n1C 846842742 JJPGTBWIAVJOHY-UHFFFAOYSA-N 329.404 0.589 10 20 ECCD O=C(NCc1cccc(Br)c1O)[C@@H]1CCS(=O)(=O)N1 846014347 INSFXZGFQNMAIK-VIFPVBQESA-N 349.206 0.463 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3NC(=O)O[C@H]3C)CC2)cc1F 841402679 WSLQVTULUXXFRK-HZMBPMFUSA-N 337.351 0.980 10 20 ECCD O=C(CN1CC[C@@H]1CO)NCc1ccc(N2CCOCC2)c(F)c1 934028786 ZVTZMPWOJCCPMG-CQSZACIVSA-N 337.395 0.345 10 20 ECCD C[C@@H](NC(=O)Cn1cnc(N)n1)c1ccc(N2CCOCC2)cc1 865018784 NPHMFKGIEUAZHX-GFCCVEGCSA-N 330.392 0.574 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC(CO)CC1 774211744 ZJSRDSBVZDMGSB-UHFFFAOYSA-N 333.432 0.908 10 20 ECCD O=C(NC[C@H](O)COc1ccc2c(c1)OCO2)c1cccc(O)c1O 790579583 KOQPQNAGOHAGDL-JTQLQIEISA-N 347.323 0.996 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCCNCCN2CCCC2=O)cc1 1153037505 OIPDHCKJHUKMOJ-UHFFFAOYSA-N 346.391 0.791 10 20 ECCD C[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CO1 1332192695 BTRROEQICXFJEF-ZFWWWQNUSA-N 347.415 0.433 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC(OCC(F)F)C2)cc1 1352287852 UMIKQRAAEFOFCI-UHFFFAOYSA-N 341.358 0.861 10 20 ECCD 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CN(C(=O)C(=O)NCc1ccc(N2CCCC2)cc1)[C@@H]1CCNC1=O 1321659306 SJCIGENAFQKSCG-OAHLLOKOSA-N 344.415 0.250 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@@H]3CC[C@H](C(=O)O)O3)cc2)CC1 1331263432 VUHSGKJCHLNKDO-JKSUJKDBSA-N 347.415 0.687 10 20 ECCD CCN(CC)C(=O)CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 1332579793 FFSWJCPVMLWXQH-UHFFFAOYSA-N 348.447 0.662 10 20 ECCD COc1ccc(CNC[C@@H](C)NC(=O)CN2CCOCC2=O)cc1C 1754229183 XBTCCLBHXMVDHB-CQSZACIVSA-N 349.431 0.457 10 20 ECCD C[C@@H](C(=O)NCc1ccccc1O)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 269165756 WTCZRKTYNINVAJ-XNHWVXRISA-N 344.367 0.559 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCCN(C)CC3)nc12 297716478 BPQLQBSNFRBKTI-UHFFFAOYSA-N 333.392 0.749 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCn2ncnc2C1 807103023 KUGYCTJQGCUOIY-UHFFFAOYSA-N 342.403 0.311 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(CCO)CC(F)F 297656058 FKSPXYYNHLKWHA-UHFFFAOYSA-N 343.374 0.797 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1CCNC(=O)C1 817859375 BQODXSHMVQNTAN-CYBMUJFWSA-N 346.431 0.067 10 20 ECCD CC(C)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)O 826596305 NYDKEANERUTTKK-UHFFFAOYSA-N 330.362 0.604 10 20 ECCD CS(=O)(=O)CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919968191 DLDCQAQIMIENIO-UHFFFAOYSA-N 340.445 0.556 10 20 ECCD CN(C)c1ccc(CNS(=O)(=O)N2CCCOCC2)cc1F 845836417 JNGKBDNJGBVNOE-UHFFFAOYSA-N 331.413 0.948 10 20 ECCD C[C@H](N)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 842230033 PHLFOFJNPCGLPB-JSGCOSHPSA-N 335.404 0.363 10 20 ECCD NC(=O)CN1CC[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1029013761 GQNJSIPNMPEMOD-SNVBAGLBSA-N 332.364 0.386 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CC(=O)N(CCN(C)C)C2)c1 768912233 YYVOBTRPMYLXTQ-OLZOCXBDSA-N 349.431 0.988 10 20 ECCD CNC(=O)CN1CC[C@H](N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1033698848 CYUWBEUFUYZLML-ZDUSSCGKSA-N 346.391 0.741 10 20 ECCD CN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1ccccc1N 774374476 BWCOZCTVYBONNH-UHFFFAOYSA-N 349.412 0.911 10 20 ECCD CN1C(=O)C(=Cc2cc(Br)nn2C)C(=O)N(C)C1=O 779220823 IPRKDZKWTQFQRS-UHFFFAOYSA-N 327.138 0.616 10 20 ECCD 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C[C@@H](NC(=O)C(=O)NCCO[C@@H]1CCOC1)c1ccc(N(C)C)cc1 1332982142 SYSKBFBNSORQSI-CZUORRHYSA-N 349.431 0.852 10 20 ECCD O=C1CN(c2nnc(-c3sccc3O)n2C[C@@H]2CCOC2)CCN1 1345432723 KNXUHOFPGJWJFM-JTQLQIEISA-N 349.416 0.685 10 20 ECCD CCCNC(=O)[C@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1262647921 SPVMNGNOEYNGDL-VIFPVBQESA-N 343.405 0.408 10 20 ECCD O=C(CN1C(=O)CCC1=O)NCc1ccc(N2CCC(O)CC2)cc1 1350016260 RCXQHDMZHDCROS-UHFFFAOYSA-N 345.399 0.413 10 20 ECCD CCn1c(-c2sccc2O)nnc1N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1 1356276894 JOIFNJHDPDGBCO-DTORHVGOSA-N 347.400 0.783 10 20 ECCD COC[C@@H](NCc1ccc(N2CCN(C)CC2)c(F)c1)C(=O)O 1606816445 WVZOUGNRRRMRLK-CQSZACIVSA-N 325.384 0.767 10 20 ECCD COc1cccc(CNC(=O)Cn2nc3ccccn3c2=O)c1O 155493021 ITZHZGJHIBEWPU-UHFFFAOYSA-N 328.328 0.527 10 20 ECCD CC(C)CN1C(=O)/C(=C\NCCCn2ccnc2)C(=O)NC1=S 28969449 LMTQNHBXFCDQLQ-WQLSENKSSA-N 335.433 0.646 10 20 ECCD COc1cc(N(C)CC(=O)N2CCNC(=O)C2)cc(OC)c1OC 266021508 WQYNXWXCXVHSAB-UHFFFAOYSA-N 337.376 0.107 10 20 ECCD 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CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCC(=O)O 1591005898 NOZXNUMWDKJFJJ-JTQLQIEISA-N 325.317 0.553 10 20 ECCD COc1ccc(N2CCN(CCCNC(=O)NCCO)CC2)cc1 42876549 CNELEOWHQAGRPS-UHFFFAOYSA-N 336.436 0.499 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cnccc3=O)CC2)cc1 267428168 UIYGVYLDIRSCCJ-UHFFFAOYSA-N 328.372 0.601 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCNC(=O)C[C@H]3C)nc12 367103814 SEYGNEJOQXJYPW-SNVBAGLBSA-N 347.375 0.322 10 20 ECCD C[C@@H](CS(C)(=O)=O)N1C(=O)CN(Cc2ccccc2O)C1=O 819168682 UTZNOLALMHQCKB-JTQLQIEISA-N 326.374 0.590 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)C(=O)N2CC[C@@H](N)C2)N(C)C)cc1 911577351 CAVGHGUZEGLNAG-ZBFHGGJFSA-N 347.463 0.031 10 20 ECCD COC(=O)c1ccc(O)c([C@@H](C)NCCNC(=O)c2cc[nH]n2)c1 757637969 JGFWLEMNPBHERH-SNVBAGLBSA-N 332.360 0.983 10 20 ECCD CC[C@@H](CCO)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 762830267 FAVHOPRZGFLXFZ-JTQLQIEISA-N 330.406 0.902 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)N(C)Cc2cnn(C)c2)cc1 872886222 BLKITTCHRXEOFH-UHFFFAOYSA-N 346.387 0.978 10 20 ECCD CC(=O)N1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@@H](O)C1 991567418 WZIVOTNYZZICGL-STQMWFEESA-N 333.348 0.561 10 20 ECCD CC[C@@H](NC[C@H]1COCCN1C)c1cccc(-c2nn[nH]n2)c1O 1604054709 JCDYQJHFNREIBJ-SMDDNHRTSA-N 332.408 0.944 10 20 ECCD NC(=O)C[C@H]1CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])CCO1 1608231594 GZGOZRQWOKJTNH-MORRKMRCSA-N 335.316 0.773 10 20 ECCD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1n[nH]cc1C(=O)O 1603107920 SNQUAUKXYCENOV-UHFFFAOYSA-N 325.302 0.817 10 20 ECCD COc1ccc(N2CC[C@@H](NC(=O)Cn3cc(C(=O)O)cn3)C2)cc1 1599586467 QJKCXUCKRCMRKS-CYBMUJFWSA-N 344.371 0.985 10 20 ECCD CN1CCN(c2ccc(CN[C@@H](Cn3cccn3)C(=O)O)cc2)CC1 1777091186 PJUNGGNXCOTMSZ-KRWDZBQOSA-N 343.431 0.878 10 20 ECCD CN1CCCc2cc(CNC(=O)N3CCO[C@@H](C(N)=O)C3)ccc21 51714478 YNQNJWWTTVNGTF-OAHLLOKOSA-N 332.404 0.465 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@H]1CO 288617681 RHRYSDJFKUACAN-INIZCTEOSA-N 329.400 0.662 10 20 ECCD COc1cccc(CNC(=O)NCCS(=O)(=O)N(C)C)c1O 291003227 BXVDXOKZVIOBQE-UHFFFAOYSA-N 331.394 0.091 10 20 ECCD C[C@@H](CN(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C(=O)O 817116726 ZAIKJMDPIGKCJR-ZDUSSCGKSA-N 345.399 0.858 10 20 ECCD CCOCCNC(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 824923968 YBCQNDUACGIUSF-CQSZACIVSA-N 349.431 0.790 10 20 ECCD O=C1CSC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)N1 826532317 YTTZBFBUGVVICE-HNNXBMFYSA-N 349.456 0.496 10 20 ECCD COc1cc(C(=O)NC2CCN([C@@H](C)C(N)=O)CC2)cc(OC)n1 1003244773 HCWYLBWJXPINFA-JTQLQIEISA-N 336.392 0.167 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1OCCN(C)C1=O 910557472 BPDUKDHSGLLGTO-XJKSGUPXSA-N 333.432 0.965 10 20 ECCD CNC(=O)CN1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1016367080 IDNXCIJUJMJKTJ-LBPRGKRZSA-N 332.364 0.399 10 20 ECCD COc1ccc(CNC[C@@H]2CCN(C(=O)Cn3cnnn3)C2)cc1C 1026672518 OYJWRVOKHJVPBO-HNNXBMFYSA-N 344.419 0.628 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(C(=O)C(F)F)C2)cc(OC)n1 941653824 KNLPXCGSDZAKDR-SECBINFHSA-N 329.303 0.695 10 20 ECCD CN(CC(=O)NCc1ccc(O)c(O)c1)c1ncnc2[nH]cnc12 778919486 FKWCBFZRKIRWEF-UHFFFAOYSA-N 328.332 0.517 10 20 ECCD CC(=O)NCC(=O)NCCC1=CCN(c2ncccc2[N+](=O)[O-])CC1 1089807811 VPDQGCLHZLGWTI-UHFFFAOYSA-N 347.375 0.769 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3C[C@@]3(CO)C2)cc1F 1325971886 MXFDFHLCWCGJJD-PXAZEXFGSA-N 335.379 0.349 10 20 ECCD Cn1cnc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)c1 1332902313 LGBCJDYAQUAEOM-UHFFFAOYSA-N 339.399 0.729 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1ccc(C)n1 1347839698 JLZDRBQCKIGZPQ-ZDUSSCGKSA-N 347.371 0.893 10 20 ECCD COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cn(C)nn2)cc1C 1755777532 KOPNIAFARVHLEX-CQSZACIVSA-N 347.419 0.355 10 20 ECCD C[C@H](NC(=O)C(=O)N(C)Cc1ccccc1O)c1nnnn1C1CC1 1351771221 ZIYBSRIMMHJBOO-JTQLQIEISA-N 344.375 0.549 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2ccnc2S(C)(=O)=O)cc1 81274242 BUQXQYDOIDSYFL-UHFFFAOYSA-N 336.417 0.669 10 20 ECCD CN1CC[C@@H](N(C)C(=O)NCc2ccc(N3CCOCC3)cc2)C1=O 265790763 WYSRFJWZONEWKC-MRXNPFEDSA-N 346.431 0.895 10 20 ECCD COc1cccc(CNC(=O)Nc2ncn(CC(=O)N(C)C)n2)c1O 267047940 FXMSZMOQMLAXMI-UHFFFAOYSA-N 348.363 0.402 10 20 ECCD Cn1ccc(N2CCC[C@H](NC(=O)c3cccc(O)c3O)C2=O)n1 279076906 DQPNIZFLRPVHRG-NSHDSACASA-N 330.344 0.757 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@H](C(=O)O)C2)c1 818648559 YQPILWMBEYANDA-MRVPVSSYSA-N 328.346 0.310 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)c1ccn2nnnc2c1 823295766 PJIXHYQSSVETRW-UHFFFAOYSA-N 338.371 0.891 10 20 ECCD O=C(O)[C@@H]1CC[C@H](C(=O)NCc2ccc(N3CCOCC3)cc2)O1 901943224 JQEULBQJPHHBNW-CABCVRRESA-N 334.372 0.772 10 20 ECCD C[C@H](CS(C)(=O)=O)N(C)CC(=O)NCc1ccc(N(C)C)cc1 839489344 LQQNNTJHMBONEV-CYBMUJFWSA-N 341.477 0.734 10 20 ECCD CCN(CC)c1ccc(CNC(=O)NCC(=O)N2CCNCC2)cc1 841718841 CLYGGOKWLVYYNL-UHFFFAOYSA-N 347.463 0.764 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3C(N)=O)CC2)c(OC)c1 913483046 YTKPELFRNGGUKY-QWHCGFSZSA-N 333.388 0.474 10 20 ECCD CC(C)[C@H](N)CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 842171951 XZVPLUGPRMLVAL-MRXNPFEDSA-N 330.432 0.779 10 20 ECCD COc1cc(C(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(N)=O)cc(OC)n1 1021311714 NNCNVWKMRFVMCR-YHWZYXNKSA-N 348.403 0.309 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)C(=O)NCCCCN)N(C)C)cc1 1120428783 KNEVWJDUODEEFU-MRXNPFEDSA-N 349.479 0.327 10 20 ECCD O=C1NCCC[C@H]1C(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089849124 WUGDYMWSMZVOLG-CYBMUJFWSA-N 347.394 0.785 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)CN3CCOCC3)CC2)nn1 1089819331 IOKLZXKYXIZMRZ-UHFFFAOYSA-N 345.447 0.760 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)CN3CCOCC3)CC2)ncn1 1089818747 BFZUOGWWPBRKQT-UHFFFAOYSA-N 345.447 0.760 10 20 ECCD CCOc1ccc(N2CCN(C(=O)CN(C)C(=O)COC)CC2)cc1 1319731888 CWJYRYHPBKJIHY-UHFFFAOYSA-N 349.431 0.839 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC(=O)N[C@H]2CCCC[C@@H]21 1324862007 DMZIMPLFYMMIFO-KBPBESRZSA-N 345.399 0.620 10 20 ECCD Cc1ccc(C(=O)OCC(=O)N2CCC(C(=O)O)CC2)c(O)c1O 1607747383 CYGIHSUFKOWEPU-UHFFFAOYSA-N 337.328 0.886 10 20 ECCD CCc1cccc(CN2C[C@@H](N3C(=O)CNC3=O)C[C@H]2C(=O)O)c1O 1597586487 DTFPJSUNBNEFMN-STQMWFEESA-N 347.371 0.534 10 20 ECCD Nc1ccc(Cc2nc(C(=O)N3CCNC[C@H]3CO)cs2)cc1 1358029171 QSYSWCMWOZLKBX-ZDUSSCGKSA-N 332.429 0.722 10 20 ECCD C[C@]1(O)CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 271165302 WQJDRXPDLMUMAS-AWEZNQCLSA-N 328.390 0.751 10 20 ECCD CN(Cc1nc(CS(C)(=O)=O)no1)c1ccc2c(c1)OCO2 270370618 UFJAWPXDFGKMET-UHFFFAOYSA-N 325.346 0.979 10 20 ECCD CC(C)NS(=O)(=O)NCCNC(=O)NCc1ccccc1O 276947806 BNNHVUHZLWSRET-UHFFFAOYSA-N 330.410 0.024 10 20 ECCD CN(Cc1cnn(C)c1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 283078174 FZPJLKWSJXDAFJ-UHFFFAOYSA-N 347.394 0.900 10 20 ECCD CN1CCN(c2ccc(CN[C@H]3CCC(=O)N(C)C3=O)cc2)CC1 818233702 MQBFLLVBYSHPJM-INIZCTEOSA-N 330.432 0.675 10 20 ECCD COCCOCC1=NN(C2=NS(=O)(=O)c3ccccc32)C(=O)C1 905018427 PQDJMHRKOFXDDJ-UHFFFAOYSA-N 337.357 0.387 10 20 ECCD NC(=O)[C@@]1(NC(=O)c2csc(Cc3ccc(N)cc3)n2)CCOC1 848436457 RTHDMDBDRAFQRI-MRXNPFEDSA-N 346.412 0.690 10 20 ECCD CC[C@@H](N)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 841722437 NWBKOXMCGHLBMY-HUUCEWRRSA-N 347.463 0.925 10 20 ECCD Cc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n[nH]1 918338187 XHBDWVMKZJIOLH-UHFFFAOYSA-N 348.428 0.883 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1OCCN(C)C1=O 910557469 BPDUKDHSGLLGTO-BBRMVZONSA-N 333.432 0.965 10 20 ECCD COC(=O)CNC(=O)[C@@H](C)N(C)Cc1ccc(N2CCOCC2)cc1 857758982 VTLNOMBBGAYHLE-CQSZACIVSA-N 349.431 0.633 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)[C@@H]2CCOC2)c1 762875350 WWPITDYGUCSKQZ-SECBINFHSA-N 343.357 0.526 10 20 ECCD CCOc1ccc(CN2CCN(C(=O)C(=O)NC3CC3)CC2)c(O)c1 768865676 LSAZMFMOFUULPC-UHFFFAOYSA-N 347.415 0.714 10 20 ECCD C[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nnnn1C 787670798 GMWOMVRWBNVEOU-SSDOTTSWSA-N 341.349 0.205 10 20 ECCD C[C@H]1CCN(CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1319832113 LFTSRBDDUDKEQD-NSHDSACASA-N 341.433 0.835 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCC[C@@H](n2ccnn2)C1 1326673232 CVIZMUSYEOIPFH-CQSZACIVSA-N 343.387 0.806 10 20 ECCD CCCN1CCCN(C(=O)C(=O)N(C)Cc2ccccc2O)CC1=O 1328532674 MMVUPBUVRSRBDO-UHFFFAOYSA-N 347.415 0.822 10 20 ECCD COC(=O)[C@H]1C[C@@H](O)CN1Cc1ccc(N2CCC(O)CC2)cc1 1333000258 MYQDOJPIUIZASP-IAGOWNOFSA-N 334.416 0.756 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cn(C)nn1 1349670281 JUSZSQOGBJIQTD-UHFFFAOYSA-N 330.392 0.122 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)CNCCN)cc2F)CC1 1340118259 IEFPUPWRGKTJIE-UHFFFAOYSA-N 337.443 0.132 10 20 ECCD COc1ccc(N2CCN(CCc3cn(CC(=O)O)nn3)CC2)cc1 1599586809 XJXWJRZAVKCLFB-UHFFFAOYSA-N 345.403 0.736 10 20 ECCD Cc1ccc(O)c(CN[C@@H]2CS(=O)(=O)C[C@@H]2N2CCOCC2)c1 265240669 LIDKSCLLNHIVQW-CABCVRRESA-N 340.445 0.288 10 20 ECCD CNC(=O)NC(=O)CN(CCOC)c1ccc(OC)c(OC)c1 266867673 NTVXKYPNFQEEQC-UHFFFAOYSA-N 325.365 0.612 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)CSc1n[nH]c(=O)[nH]1 275076265 CLDKIMOSPUFOQA-UHFFFAOYSA-N 335.389 0.682 10 20 ECCD CC1(C)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H]1O 279268277 JELPMMVICGWDTO-LBPRGKRZSA-N 328.390 0.607 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CC[C@@H](C(N)=O)O3)CC2)cc1 279726598 VKTLHWVLYIOSRS-LSDHHAIUSA-N 333.388 0.377 10 20 ECCD Cc1ccn(C[C@](C)(O)C(=O)NCc2ccc(O)c(O)c2)c(=O)c1 279853285 SAERZVWSFCLYBP-KRWDZBQOSA-N 332.356 0.635 10 20 ECCD COC(=O)c1cn([C@@H]2CCN(C(=O)c3ccc(C)c(O)c3O)C2)nn1 376923804 COJQRDHYDDHEQH-SNVBAGLBSA-N 346.343 0.872 10 20 ECCD CNS(=O)(=O)[C@@H]1CCN(Cc2cc(OC)c(OC)cc2O)C1 371362181 YAFTXWQQQWGESH-LLVKDONJSA-N 330.406 0.533 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C(=O)N(C)CCC(N)=O 298128770 XCQIUEWHNXRAOO-UHFFFAOYSA-N 335.404 0.855 10 20 ECCD COC(=O)c1ccc(O)c([C@@H](C)NCCS(=O)(=O)N(C)C)c1 810262964 HEEZTMXPOJDWJF-SNVBAGLBSA-N 330.406 0.721 10 20 ECCD Cn1cnc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 810183452 WPUKPGUCWXRKBV-ZDUSSCGKSA-N 342.403 0.447 10 20 ECCD COc1ccc(O)c(CNC(=O)Cc2noc(C)c2-c2nn[nH]n2)c1 826210366 OKEOPGABRMGDBM-UHFFFAOYSA-N 344.331 0.736 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)N1C[C@H]2C(=O)NC(=O)[C@H]2C1 838479588 RPEDTHNAJSOHRZ-OKILXGFUSA-N 330.388 0.475 10 20 ECCD CC(C)[C@H](N)C(=O)NCC(=O)NCCCSc1nccs1 843439995 VGUYORWHDPALMF-NSHDSACASA-N 330.479 0.841 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)c2ccc(=O)n(C)n2)cc1 844851623 CMNCFRYXFZKGFC-UHFFFAOYSA-N 330.388 0.997 10 20 ECCD COC(=O)c1ccc(O)c([C@H](C)NCc2nc(O)cc(CN)n2)c1 854232097 LLRRBXVXGWELTJ-VIFPVBQESA-N 332.360 0.984 10 20 ECCD COc1cc(CN2CC(NC(=O)c3cc(OC)nc(OC)c3)C2)on1 1030613338 AJZIFIUCUSGOGF-UHFFFAOYSA-N 348.359 0.710 10 20 ECCD CN(C)S(=O)(=O)CCC(=O)OCC(=O)c1ccc(O)c(O)c1 784660594 NJORETJKCIOXBX-UHFFFAOYSA-N 331.346 0.105 10 20 ECCD COc1ccc(CNC2CC(NS(C)(=O)=O)C2)c(O)c1OC 894265888 XNIZNPJWKDXTOK-UHFFFAOYSA-N 330.406 0.579 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](CNC(=O)[C@H]3CNC(=O)N3)C2)cc1C 1086184746 WWBFFRCNHBUIGS-QLFBSQMISA-N 346.431 0.669 10 20 ECCD C[C@@H]1C[C@H](O)CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1325860535 DBKNCGZUXQOLCV-PBHICJAKSA-N 343.427 0.908 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N2CCO[C@@H](C(F)F)C2)cc1 1333614876 PZPNYEDJHFJSLK-GFCCVEGCSA-N 327.331 0.420 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)CCn2cnnn2)N(C)C)cc1 1342708039 NTSXJHDMPJOFFI-HNNXBMFYSA-N 331.424 0.548 10 20 ECCD COC(=O)[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@@H]1C(=O)O 1606415181 CFBUBYBLIFVDPX-FWCMMDKOSA-N 335.312 0.443 10 20 ECCD Cc1cc(-c2nn[nH]n2)c(O)nc1C(=O)NCc1cc(O)ccc1O 1591835802 UQJDLPGEJKTGDV-UHFFFAOYSA-N 342.315 0.617 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCNC(=O)[C@H]2CC(=O)O)c1O 1599344084 BELIKRDARJRVJG-SNVBAGLBSA-N 339.304 0.084 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCN(C)CC3)CC2)cc1 106381403 YPPFULMDSKZUMC-GOSISDBHSA-N 348.491 0.426 10 20 ECCD CNC(=O)[C@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 181576732 NPPUNDYVUPJJHD-MRXNPFEDSA-N 346.431 0.943 10 20 ECCD CN1CCN(C(=O)CCNC(=O)NCc2ccc(N(C)C)cc2)CC1 43862394 GVFBJVUYTPXSJW-UHFFFAOYSA-N 347.463 0.716 10 20 ECCD CN(Cc1ccccc1O)C(=O)CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 266631750 WWTAIKNCLAHISD-VDERGJSUSA-N 344.367 0.513 10 20 ECCD O=C(CN1C(=O)NC2(CCCC2)C1=O)NCc1ccc(O)c(O)c1 272332703 NAIQSEQMUGLIJG-UHFFFAOYSA-N 333.344 0.579 10 20 ECCD C[C@@H](O)CN1CCN(CC(=O)NCc2ccc(N(C)C)cc2)[C@H](C)C1 299484425 ZRNVLDBTTMGMBW-HZPDHXFCSA-N 348.491 0.756 10 20 ECCD CN(CCC(N)=O)C(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 297867751 NHGKEFYIJKYYIK-UHFFFAOYSA-N 346.431 0.577 10 20 ECCD C[C@H](O)CN1CCN(CC(=O)NCc2ccc(N(C)C)cc2)[C@@H](C)C1 299484414 ZRNVLDBTTMGMBW-HOTGVXAUSA-N 348.491 0.756 10 20 ECCD C[C@H](NC(=O)[C@H]1OCCN(C)C1=O)c1ccc(N2CCOCC2)cc1 900386897 KFCYBCYLYXNFPF-XJKSGUPXSA-N 347.415 0.558 10 20 ECCD CNC(=O)c1ccc(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)cn1 832273548 OQBPLDZGDBYKHS-HNNXBMFYSA-N 341.415 0.937 10 20 ECCD CN1CCC(CNC(=O)c2cccc(O)c2O)(N2CCOCC2)CC1 839807884 GFTADNSULWWATP-UHFFFAOYSA-N 349.431 0.624 10 20 ECCD C[C@H]1CN(C2CC2)C[C@H]1NC(=O)C(=O)NCCc1ccc(N)cc1 842167736 ULGWCLYLYKMIOE-BLLLJJGKSA-N 330.432 0.526 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)NCC(=O)N1CCNCC1 841828363 SYEFRSVTIMDGKF-UHFFFAOYSA-N 333.436 0.292 10 20 ECCD COC(=O)[C@@H]1CNCCCN1Cc1ccc([N+](=O)[O-])c(OC)c1O 843124391 ZXTPWDDNQGTHAN-LBPRGKRZSA-N 339.348 0.646 10 20 ECCD CCNC(=O)c1cccc(NC=C2C(=O)N(C)C(=O)N(C)C2=O)c1 920979394 KUSRNVLKHFTGPC-UHFFFAOYSA-N 330.344 0.783 10 20 ECCD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1cc(C)ccc1O 768160014 KTBVPGRKGJPBAS-AWEZNQCLSA-N 340.445 0.826 10 20 ECCD COC[C@H](C)NC(=O)NC(=O)CN[C@H](C)c1cc(OC)ccc1O 775369883 BKDCKGRNWFRNJJ-WDEREUQCSA-N 339.392 0.912 10 20 ECCD COC(=O)Cn1cc(CCOC(=O)c2ccc(C)c(O)c2O)nn1 773155112 YWIQWFHSPXVHDN-UHFFFAOYSA-N 335.316 0.570 10 20 ECCD COC(=O)c1ccc(O)c([C@H](C)NCCn2cc(C(=O)OC)nn2)c1 793564043 BJFCCHOAOLXDNW-JTQLQIEISA-N 348.359 0.908 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@@H]3C[C@H](C)CO3)C2)cc(OC)n1 996368302 KUWOMWJVJDIEEY-GWCFXTLKSA-N 349.387 0.464 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3CC[C@@H]3C(N)=O)CC2)ncn1 1089849952 HGULCDIWAFOQMZ-LSDHHAIUSA-N 343.431 0.939 10 20 ECCD CNC(=O)CC(=O)NCCC1=CCN(c2ncnc3[nH]cnc23)CC1 1089824051 UUNNRUYTLGTVBB-UHFFFAOYSA-N 343.391 0.132 10 20 ECCD C[C@H](NC(=O)C(=O)N[C@@H]1CC[C@H](C(N)=O)C1)c1ccc(N(C)C)cc1 1345370577 XICOJVRRHWBJSR-FPMFFAJLSA-N 346.431 0.700 10 20 ECCD CN1CCN(C(=O)NCc2ccc(N(C)C)cc2)C[C@H](C(=O)O)C1 1606234151 GBRWORCDRVCSJG-CQSZACIVSA-N 334.420 0.910 10 20 ECCD C[C@]1(C(N)=O)CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 280405923 XYHICNGMYBELGK-SFHVURJKSA-N 346.431 0.930 10 20 ECCD COc1ccc(N(C)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cn1 299348257 BRWAFNVMMQJXJN-UHFFFAOYSA-N 348.384 0.551 10 20 ECCD COc1ccc(N2CCC(NC(=O)C(=O)N(C)CCO)CC2)cc1 804319865 UFBBLZYUFDLFCM-UHFFFAOYSA-N 335.404 0.231 10 20 ECCD COC(=O)[C@H]1C[C@@H](O)CN(C(=O)NCc2ccc(N(C)C)cc2)C1 825604050 XOAJYCDEBQSTKC-DZGCQCFKSA-N 335.404 0.818 10 20 ECCD C[C@H](CO)NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 820986112 KQICPOYEHTWADO-GFCCVEGCSA-N 341.433 0.101 10 20 ECCD C[C@H](N)[C@@H](C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 827468988 ITBZEAAWPDNQLV-IPYPFGDCSA-N 332.448 0.988 10 20 ECCD C[C@@H](NC(=O)NC[C@H]1CC(C(N)=O)=NO1)c1ccc(N(C)C)cc1 838560144 SKXVONNAIZWKME-ZWNOBZJWSA-N 333.392 0.743 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CCCNC1 842226697 LABUHBXIGZXIKD-OAHLLOKOSA-N 332.448 0.827 10 20 ECCD COc1ccc(N2CCN(C(=O)N[C@H]3[C@@H]4CNC[C@@H]43)CC2)c(OC)c1 1119476636 CLLBFRSGLTZHRN-HALDLXJZSA-N 346.431 0.753 10 20 ECCD C[C@H](NC(=S)NCCNS(C)(=O)=O)c1ccc(N(C)C)cc1 774249859 LVPGQJKVHLOBMI-NSHDSACASA-N 344.506 0.827 10 20 ECCD CCCCS(=O)(=O)NCC(=O)NCc1ccc(OC)cc1O 794390073 GUTPEOZTTAXSQV-UHFFFAOYSA-N 330.406 0.737 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)NCCn1cccn1 793746154 MJUUUYUHGVAFAU-UHFFFAOYSA-N 339.446 0.754 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCN(CCCO)C[C@H]2O)cc1 1090831850 WINOZGHSUOCWPC-UONOGXRCSA-N 349.391 0.396 10 20 ECCD C[C@H]1C(=O)N(C)CCN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1324902870 WQRLIFWKVHYFSD-ZDUSSCGKSA-N 346.431 0.400 10 20 ECCD O=C(O)COCCN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 1595112148 LRNUDIUPIXHDPQ-UHFFFAOYSA-N 342.735 0.911 10 20 ECCD CNC(=O)NCCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 294884722 DPQFXXFDHLGGKC-UHFFFAOYSA-N 348.447 0.831 10 20 ECCD CN(CCOCCO)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807290370 WCLRIYDDNSCMPB-UHFFFAOYSA-N 347.415 0.146 10 20 ECCD CCOC[C@@H](O)CNCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 818968795 XLKLXMPUAPCBDY-RDJZCZTQSA-N 335.448 0.875 10 20 ECCD CN1CCCc2cc(CNC(=O)c3cn(CCCN)nn3)ccc21 827913944 TYPMOIBBGYSNPY-UHFFFAOYSA-N 328.420 0.939 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@@H]3CSCC(=O)N3)cc2)CC1 829296239 GWUCUVQJLKPHKV-HNNXBMFYSA-N 348.472 0.286 10 20 ECCD CN1CCC(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 725900410 SNEDFCKTJWBQPL-UHFFFAOYSA-N 341.433 0.835 10 20 ECCD CN(C)CC(C)(C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 837238874 BBVJFIACDNYYIL-UHFFFAOYSA-N 329.422 0.834 10 20 ECCD CN(C)c1ccc(CNS(=O)(=O)N2CCC[C@H]2C(=O)O)cc1F 737955275 PVDOQERIVCOJHH-ZDUSSCGKSA-N 345.396 0.775 10 20 ECCD CNC[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 842150994 ZLQWFGDJYIYEAW-HNNXBMFYSA-N 344.459 0.753 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C1=NN2CCCN=C2N1 748024268 KFBPJFMCOPSGHR-UHFFFAOYSA-N 326.404 0.881 10 20 ECCD CNC[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 842170502 HKOGCZSKIXAPJU-KRWDZBQOSA-N 342.443 0.889 10 20 ECCD Cc1ccc(O)c(CNC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)c1 858316205 NLVWQOPVDLVMSH-LBPRGKRZSA-N 341.433 0.781 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCc3cnn(C)n3)C2)cc(OC)n1 1020352618 YFNTVWVLEDKQPK-HAQNSBGRSA-N 346.391 0.278 10 20 ECCD COc1cccc(CNC(=O)C(=O)Nc2cc(C)cn(C)c2=O)c1O 766464983 FKMDDSLUBNSQHH-UHFFFAOYSA-N 345.355 0.663 10 20 ECCD COc1cc(O)c(CN2CCC[C@H](NS(C)(=O)=O)C2)cc1OC 762176345 URFUFPQAMWLNRZ-LBPRGKRZSA-N 344.433 0.923 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CO)CC(F)F)c1 760685481 OYBIYCMIUQXJLE-MRVPVSSYSA-N 338.332 0.510 10 20 ECCD C[C@@H](NC(=O)C(=O)Nc1cnn(CCN(C)C)c1)c1ccccc1O 874191166 PZNKSKQSBKRXBL-GFCCVEGCSA-N 345.403 0.966 10 20 ECCD CC[C@@H](CN1CCOCC1)NC(=O)C(=O)N(C)Cc1ccccc1O 1119913127 NCCLVHYDGKAPNG-HNNXBMFYSA-N 349.431 0.578 10 20 ECCD CCn1[nH]nnc1=NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 888345355 WDCMTZOAGCDUHN-UHFFFAOYSA-N 345.407 0.615 10 20 ECCD CN(C)CCOCCNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785428012 IVKPEXKRQUENGV-UHFFFAOYSA-N 336.436 0.063 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)CCS(C)(=O)=O)N(C)C)cc1 891254692 IKHXVKUSBVXOGA-HNNXBMFYSA-N 341.477 0.906 10 20 ECCD NC(=O)c1ccccc1NCC(=O)NCCc1ccc(O)c(O)c1 788309614 VCAKZFPMSXTFEQ-UHFFFAOYSA-N 329.356 0.968 10 20 ECCD Cc1ncc(C)c(N2CC=C(CCNC(=O)[C@H]3COC(=O)N3)CC2)n1 1089828637 GGCMNUZGHRWUAC-CQSZACIVSA-N 345.403 0.845 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)CC(C)(C)O)C2)cc(OC)n1 996369681 YVNWFUANEOQUEC-UHFFFAOYSA-N 337.376 0.200 10 20 ECCD C[C@@H](NC(=O)C(=O)N(C)Cc1cn(C)nn1)c1ccc(N(C)C)cc1 1328981409 MONNCSIPZXPQHB-GFCCVEGCSA-N 344.419 0.717 10 20 ECCD C[C@H](CO[C@@H]1CCOC1)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 283648500 XPNYMKVXKPCCJH-CZUORRHYSA-N 349.431 0.679 10 20 ECCD Cc1cc(CCNC(=O)[C@H](CO)NC(N)=O)c(C)n1-c1ccccc1 822273834 LJIUTAZFDTXOBI-INIZCTEOSA-N 344.415 0.782 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H]2C(=O)O)c1 820894126 BLDNSPXMOBMYPR-SNVBAGLBSA-N 328.346 0.453 10 20 ECCD CNC(=O)[C@H](C)NC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 823732748 ILQKEEAURMCJLA-QWHCGFSZSA-N 334.420 0.955 10 20 ECCD COc1ccc(N2CCN(C(=O)Cc3noc(CCN)n3)CC2)cc1 843217882 VJYFDTCUWIALIR-UHFFFAOYSA-N 345.403 0.471 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@@H](O)[C@@H](CO)C1 840483874 LTYCRZQJMOTNNJ-YSVLISHTSA-N 335.448 0.987 10 20 ECCD CNC[C@@H](C)NC(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 851690133 ZNYIEHMEMOPTIE-ZIAGYGMSSA-N 348.447 0.362 10 20 ECCD CC(C)C(=O)N[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1O 1023085910 SPCJBKJZVFSIGE-CHWSQXEVSA-N 347.375 0.807 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C[C@H](N)C[C@@H]3C)CC2)cc1 866682926 OIXSPCQWBMAYHB-LSDHHAIUSA-N 332.448 0.765 10 20 ECCD COC(=O)COCC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1119440854 YBYSHOONWJHENU-UHFFFAOYSA-N 335.404 0.244 10 20 ECCD C[C@H](NC(N)=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 773788197 AIXPXYIACGYGIL-WCQYABFASA-N 347.419 0.061 10 20 ECCD Cc1nn(C)c(=O)c(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1C 782661540 ZJKRVLSVGNBMFN-UHFFFAOYSA-N 332.312 0.848 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)[C@]2(C)CCNC2=O)N(C)C)cc1 891247717 UNYDGQZCRVDYTA-CRAIPNDOSA-N 332.448 0.998 10 20 ECCD C[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CO1 1328298593 ANGGMAMPGSOWTP-UKRRQHHQSA-N 329.400 0.973 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCNC(C)(C)C1 1327520491 NFVMMMYZEJYWML-UHFFFAOYSA-N 332.448 0.888 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)c1cc(=O)n(C)c(O)n1 1515328507 RSHKKUSMAFUXJW-UHFFFAOYSA-N 330.388 0.959 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3CCNC3=O)C2)cc1C 1022543730 UEXMJSSDVXPHQO-QLFBSQMISA-N 331.416 0.877 10 20 ECCD CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cccc(O)c2O)C1 854877971 DWRPYYNCZTUXEG-ZYHUDNBSSA-N 338.360 0.808 10 20 ECCD CN(CCCN1C(=O)CNC1=O)Cc1ccc(N2CCOCC2)cc1 104944808 FAQMHVHNNVUHPO-UHFFFAOYSA-N 346.431 0.897 10 20 ECCD CN1C[C@@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1=O 125755097 YQBVCQRHSYIQCH-INIZCTEOSA-N 345.443 0.990 10 20 ECCD C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)c1ccccc1S(C)(=O)=O 265525687 MTRAENMWRSKOLB-QWRGUYRKSA-N 345.442 0.738 10 20 ECCD CSCC[C@@H](NC(N)=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 273138635 DJGMWLUUTCBXGT-GXSJLCMTSA-N 341.433 0.935 10 20 ECCD CCOC(=O)[C@H](N)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 392327487 SEYILAFSMRRSLW-CQSZACIVSA-N 339.367 0.169 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)c1ccc(-c2nn[nH]n2)nc1 826439110 FLMGNXNRRQRTGE-UHFFFAOYSA-N 326.316 0.645 10 20 ECCD COc1ccc(N2CCN(Cn3nc(C(=O)O)ccc3=O)CC2)cc1 738022948 PTGQVYVPAGBCOF-UHFFFAOYSA-N 344.371 0.730 10 20 ECCD CCN(C)C(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 746582917 ITHSVNKOQCUMPD-UHFFFAOYSA-N 330.362 0.399 10 20 ECCD CN(C)c1ccc([C@@H](N)CNS(=O)(=O)C[C@H]2CCOC2)cc1 842786086 YXDMVYBWCHEUPX-WFASDCNBSA-N 327.450 0.708 10 20 ECCD CC(=O)N(C)CC(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 914921972 GGIVDBULQQWSMV-UHFFFAOYSA-N 335.404 0.733 10 20 ECCD CS(=O)(=O)N1CCC[C@@H](NC(=O)NCCc2ccc(N)cc2)C1 841737133 BGJAPHSFPLRKGY-CQSZACIVSA-N 340.449 0.535 10 20 ECCD COC(=O)CCN1CC[C@@H](OC(=O)/C=C\c2ccc(O)c(O)c2)C1=O 849744999 ISRBVDAUYLVAKN-PKXJPQMGSA-N 349.339 0.818 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H]1CCOC1 1117025185 PLSPZQIONSOESS-OAHLLOKOSA-N 347.415 0.292 10 20 ECCD C[C@@H](NCc1nc(N)nc(N)n1)c1ccc(N2CCOCC2)cc1 775258248 VFQUJFUOQBOBGF-LLVKDONJSA-N 329.408 0.723 10 20 ECCD NS(=O)(=O)c1ccc(F)c(C(=O)NCc2ccc(O)c(O)c2)c1 798334497 YQEKHJDKJIVFHT-UHFFFAOYSA-N 340.332 0.814 10 20 ECCD COc1ccc(CN[C@@H]2CCN(C(=O)CCn3cnnn3)C2)cc1C 970325364 HBUYGHWHYSLIFK-OAHLLOKOSA-N 344.419 0.771 10 20 ECCD COc1ccc(CNC(=O)Cn2[nH]cc3c(=O)ncnc2-3)c(O)c1 794379325 PFKHKSOEQFYTGZ-UHFFFAOYSA-N 329.316 0.102 10 20 ECCD CN1CC2(CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)C1 1328308830 NDGCLJFDDZKQJU-UHFFFAOYSA-N 339.417 0.541 10 20 ECCD COC[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1334502328 FWKMDVRMPJXOJK-CQSZACIVSA-N 348.447 0.206 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC[C@H](F)C(=O)O 1601539322 XQUFHZJGCVHFNG-AWEZNQCLSA-N 339.367 0.870 10 20 ECCD COC(=O)[C@@H]1C[C@H](C(=O)O)CCN1Cc1cc2c(cc1O)OCO2 1610164396 OEHCPKSVEKFJOF-KOLCDFICSA-N 337.328 0.959 10 20 ECCD CN(C)c1ccc(CNC(=O)CN[C@@H](C(=O)O)C2CCOCC2)cc1 1598317457 FHWFDOVGEWRZCO-QGZVFWFLSA-N 349.431 0.838 10 20 ECCD COc1ccc(Br)c(CN[C@H](CC(N)=O)C(=O)O)c1O 1777348825 PTOFWPLIDCRMSW-MRVPVSSYSA-N 347.165 0.582 10 20 ECCD CN1CCO[C@H](CNC(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 108790573 PNIUXBDTWXATLT-WEBJUUICSA-N 345.443 0.983 10 20 ECCD Cn1nncc1CNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 288419114 JNQRXGGONOHKSI-QPJJXVBHSA-N 327.388 0.981 10 20 ECCD O=C(Cn1cnnn1)N1CCN(Cc2cc(Cl)ccc2O)CC1 809734135 WWYDUYSZUSYSQL-UHFFFAOYSA-N 336.783 0.377 10 20 ECCD CCOC(=O)Cn1cnc(NC(=O)NCc2cccc(OC)c2O)n1 824455649 OCEWZSUOQOTLCM-UHFFFAOYSA-N 349.347 0.877 10 20 ECCD COC(=O)CC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 906434115 LRADFIZSYSEVFH-UHFFFAOYSA-N 335.404 0.497 10 20 ECCD O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H]1COCCO1 837705124 QPBIOSYPLJHUKQ-AWEZNQCLSA-N 342.342 0.833 10 20 ECCD NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1 731054337 BWGHVPSVYVJUQU-UHFFFAOYSA-N 328.371 0.840 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)NCC1(CO)COC1 747387842 IGTQTJXOBQVZSX-UHFFFAOYSA-N 335.404 0.331 10 20 ECCD COc1ccc(N2CCN(C(=O)CN(C)[C@H]3CCNC3)CC2)cc1 844220642 ZYTAZSSYPBJUOS-INIZCTEOSA-N 332.448 0.638 10 20 ECCD NC[C@@H]1CCCN(C(=O)C(=O)NCCCSc2nccs2)C1 842094238 WXACPMRWEUTAGK-NSHDSACASA-N 342.490 0.939 10 20 ECCD O=C(NCC(=O)N1CCOCC1)NCc1cc(Cl)ccc1O 845094238 NIYIETCFBGCIDP-UHFFFAOYSA-N 327.768 0.704 10 20 ECCD CCN(CC)c1ccc(CNC(=O)[C@H]2CCS(=O)(=O)N2)cc1 845234066 VATQHYSDCYEKRM-CQSZACIVSA-N 325.434 0.841 10 20 ECCD CC[C@@H](C)[C@H](NC(=O)COC(=O)c1cccc(O)c1O)C(=O)OC 758562469 UMCILYBNKKUVPG-RNCFNFMXSA-N 339.344 0.959 10 20 ECCD CNC(=O)C[C@@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 857527574 RGWRUNNKLCYGIW-MRVPVSSYSA-N 329.378 0.018 10 20 ECCD O=C(CN1CCOCC1=O)NCc1ccc(N2CCC(O)CC2)cc1 856213720 UVHUSDLLGCSEFQ-UHFFFAOYSA-N 347.415 0.123 10 20 ECCD CN1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C(=O)N(C)C1=O 765970413 OJJLKDXPMLOWNU-UHFFFAOYSA-N 334.244 0.937 10 20 ECCD CNC1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCC1 863923545 XGQUBEJIOUQMHU-UHFFFAOYSA-N 327.406 0.636 10 20 ECCD CCCNC(=O)CNC(=O)NCc1ccc(N2CCN(C)CC2)cc1 883074521 ASSYRPRYKKOGFR-UHFFFAOYSA-N 347.463 0.764 10 20 ECCD COc1ccc(-n2nnnc2CN[C@H]2CN(C(C)=O)C[C@@H]2C)cc1 1054304410 ZEJBGVDZIZQSCN-NHYWBVRUSA-N 330.392 0.627 10 20 ECCD COCCN1C[C@@H](O)[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 958732450 NRZUKSQWUXYRMC-GXTWGEPZSA-N 349.391 0.518 10 20 ECCD COCCN1CCOC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1051264266 SMNCIYAEWYUPNE-AWEZNQCLSA-N 349.391 0.926 10 20 ECCD C[C@H]1[C@@H](N[C@H](C)C(N)=O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1075140747 XOZBCIHYJPFRCE-NRUUGDAUSA-N 346.391 0.915 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)Cn3ncnn3)CC2)n1 1089845708 YSUUYOPWGMSVNR-UHFFFAOYSA-N 328.380 0.115 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCCOC[C@@H]1CCOC1 1322549492 CRRNTQYWJXKYOO-CYBMUJFWSA-N 336.388 0.520 10 20 ECCD CO[C@]1(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCOC1 1324443767 TWPDELFZCRTVJJ-KRWDZBQOSA-N 335.404 0.291 10 20 ECCD O=C(O)CN1CCCC[C@H](NC(=O)c2c(F)ccc(O)c2O)C1=O 1574723404 HANRFWVUSFHRTQ-VIFPVBQESA-N 340.307 0.432 10 20 ECCD Nc1ccc(CNC(=O)c2cc(N3CCNC(=O)C3)ccn2)cc1 1580445416 CCYNXQPJUYRUKS-UHFFFAOYSA-N 325.372 0.530 10 20 ECCD CC[C@@H](NCCN1CC[C@H](O)C1)c1cccc(-c2nn[nH]n2)c1O 1590469490 JFFJVTMFJBHYBP-SMDDNHRTSA-N 332.408 0.680 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@@]3(C(=O)O)CCCO3)cc2)CC1 1593787186 SJYQARCXXZNJFX-GOSISDBHSA-N 347.415 0.688 10 20 ECCD CNC(=O)NCCC(=O)N(C)CCNCc1ccc(OC)c(C)c1 1753185485 LYZYOCJLTMDVOL-UHFFFAOYSA-N 336.436 0.871 10 20 ECCD O=C(O)C[C@@H]1C(=O)NCCN1Cc1cc(Br)ccc1O 300437202 BRWIIXVZVZNEDH-SNVBAGLBSA-N 343.177 0.930 10 20 ECCD CN(C)[C@H](CNC=C1C(=O)NC(=S)NC1=O)c1cccc(F)c1 29006156 JSTONWMFOPAXIC-GFCCVEGCSA-N 336.392 0.433 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1ccn(C)n1 809176413 XGUWSCVGJXVZFO-UHFFFAOYSA-N 343.431 0.803 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1CCOCC1 817862235 NZCVGKVDVNFOGF-CQSZACIVSA-N 333.432 0.967 10 20 ECCD O=C(NCc1cc(Cl)ccc1O)C1=NN(CCO)C(=O)CC1 846473207 KHYUMEUOJOLIBK-UHFFFAOYSA-N 325.752 0.633 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCNC[C@H]2C)cc1 842206478 GVDLPHWQJYTUKX-CQSZACIVSA-N 332.448 0.969 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCO[C@H](CN)C2)cc1 842207753 PGFYDJMTBKQBOO-MRXNPFEDSA-N 348.447 0.335 10 20 ECCD COc1ccc(N2CCCN([C@@H]3CCN(CC(=O)O)C3=O)CC2)cc1 852726472 PKKLZTHUFXJQKQ-MRXNPFEDSA-N 347.415 0.893 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](N[C@@H]3CCN(C)C3=O)C2)cc(OC)n1 1020352181 BJJOHUZNUILRNP-JHJVBQTASA-N 348.403 0.180 10 20 ECCD COc1ccc(CNCCNC(=O)c2cc(C(N)=O)c[nH]2)cc1C 1135813109 RMZOZYMHPKUJTL-UHFFFAOYSA-N 330.388 0.950 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)CNC(N)=O)CC2)nc(C)n1 1089804386 GGCOJCQPSGWEOP-UHFFFAOYSA-N 332.408 0.405 10 20 ECCD CN(CC(=O)N1CCCC1)C(=O)C(=O)N(C)Cc1ccccc1O 1327652542 KTCHJVPFGMPVLJ-UHFFFAOYSA-N 333.388 0.431 10 20 ECCD COc1ccc(O)c(CNC(=O)c2ccnc(-c3nn[nH]n3)c2)c1 1605303844 YDMLGUBHYULMNX-UHFFFAOYSA-N 326.316 0.906 10 20 ECCD CC(C)CN1C(=O)/C(=C\NCCCN2CCCC2)C(=O)NC1=S 52536863 MKMYDOIQUOBZEC-RAXLEYEMSA-N 338.477 0.845 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN(C)[C@H]2CCS(=O)(=O)C2)c1O 278219009 LFZRIQCMOALSJX-JTQLQIEISA-N 330.362 0.928 10 20 ECCD CCNS(=O)(=O)[C@@H]1CCN(Cc2cc(OC)c(OC)cc2O)C1 271245636 GDULZOXPKJAJTI-GFCCVEGCSA-N 344.433 0.923 10 20 ECCD CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1ccc(=O)n(C)c1=O 819761449 QVQSXHIEOMLTBD-UHFFFAOYSA-N 338.360 0.055 10 20 ECCD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CCNCC1 842217664 XDIZLCJGZAHRNL-UHFFFAOYSA-N 348.472 0.288 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCc3cn(C)cn3)ccc21 929806399 ZPDRIYJGIRCEPE-UHFFFAOYSA-N 341.415 0.735 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(Cc3csnn3)C2)cc(OC)n1 1015103406 OBZADFHICPEXSB-NSHDSACASA-N 349.416 0.955 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)[C@H]3CCNC3=O)C2)cc1C 1019239141 GNHVOJJABYHKCD-GJZGRUSLSA-N 331.416 0.830 10 20 ECCD CN(C)S(=O)(=O)NCCNCc1ccc(N2CCCC2)cc1 1117866229 OEEGFMJOEBOOKM-UHFFFAOYSA-N 326.466 0.772 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CN(CCF)C[C@H]2O)cc1 958731929 KPTUOUCUXZBVBD-WCQYABFASA-N 337.355 0.841 10 20 ECCD NC(=O)[C@@H]1C[C@@H]1C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089866740 QZSAELSZAGTHQP-NEPJUHHUSA-N 333.367 0.380 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3CC(=O)N(C)C3)CC2)ncn1 1089867820 QYZIATFNHNZTRU-OAHLLOKOSA-N 343.431 0.906 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NCC[C@H](C)N 1331318605 JTTKXQBTBDMZKI-KBPBESRZSA-N 334.464 0.962 10 20 ECCD COCC(=O)NCCC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1347877301 KVAWGDQTWSPMQF-UHFFFAOYSA-N 349.431 0.417 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2cccc(C(=O)O)c2=O)cc1 1606055989 RWJYFODLIHZNFS-UHFFFAOYSA-N 329.356 0.929 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(CCO)CC1 58028964 NDCAGPITCIJTTB-UHFFFAOYSA-N 334.464 0.321 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCC(=O)N1CCOCC1 273139794 DSQCDKKGDVLHRG-GFCCVEGCSA-N 336.388 0.784 10 20 ECCD CS(=O)(=O)c1nnc(COC(=O)c2cccc(O)c2O)s1 803439405 BCIJKBOEWHOLKF-UHFFFAOYSA-N 330.343 0.710 10 20 ECCD C[C@@H](O)[C@@H]1NC(=O)N(C[C@@H](c2ccc(N(C)C)cc2)N(C)C)C1=O 900185525 OFTZEWOJVODPNN-UGFHNGPFSA-N 334.420 0.657 10 20 ECCD COCCN(C)C(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 839259475 QCXZEYKLDFZFES-UHFFFAOYSA-N 349.431 0.839 10 20 ECCD CNCCN(C)C(=O)C(=O)N(C)CCN(C)c1ccc(OC)cc1 846363274 MULIAWYLNQGCIU-UHFFFAOYSA-N 336.436 0.268 10 20 ECCD CN1CC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1=O 788614816 OXKBPNNCGOALQX-VIFPVBQESA-N 341.389 0.114 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3COC(=O)N3)CC2)ncn1 1089828569 BEAIUYKXZBYPNM-ZDUSSCGKSA-N 331.376 0.536 10 20 ECCD COc1ccc(CNCCNC(=O)c2ccc(=O)n(C)n2)cc1C 1150130336 NWQXCSIFJNFMJR-UHFFFAOYSA-N 330.388 0.617 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@H]1O 1325555985 BONFCGJMIDLKNK-CZUORRHYSA-N 333.432 0.940 10 20 ECCD O=C(N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)c1cccc(O)c1O 1324921101 YNENPEXTQYYOJN-BMIGLBTASA-N 341.385 0.564 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1COCCO1 1340775579 CFNSYQPHKCPDNZ-MRXNPFEDSA-N 349.431 0.633 10 20 ECCD NC(=O)[C@H]1CCCCN1C(=O)CSc1ncc(C(=O)O)s1 1601144149 DWRHHJHVJYHIBH-SSDOTTSWSA-N 329.403 0.800 10 20 ECCD O=C(O)c1cn([C@H]2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)C2)nn1 1610858536 IRBOUUHCYDOHHM-HZMBPMFUSA-N 346.343 0.555 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H](C)NS(C)(=O)=O)CC2)cc1 53757381 NLJUOVXUULCYCQ-LBPRGKRZSA-N 341.433 0.282 10 20 ECCD CCS(=O)(=O)N(C)CC(=O)N1CCOc2cc(N(C)C)ccc21 332709373 KZPFCOWXCFYAER-UHFFFAOYSA-N 341.433 0.760 10 20 ECCD 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ECCD COC(=O)[C@H]1[C@H](C(=O)O)[C@H]2CC[C@H]1N2C(=O)c1cccc(O)c1O 1606366935 YMPIYOFQAILOLK-CNVPUSNMSA-N 335.312 0.575 10 20 ECCD O=S1(=O)CC[C@H](N2CCN(Cc3cc(F)ccc3O)CC2)C1 179889162 AQEPWXRNSKCXFK-AWEZNQCLSA-N 328.409 0.836 10 20 ECCD C[C@@H](O)CN(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 131094572 ARXRKPLQIKUJOS-CYBMUJFWSA-N 339.411 0.591 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3[nH]nnc3C)nc12 805546684 LMQDNKSHCFYUGT-UHFFFAOYSA-N 346.303 0.395 10 20 ECCD O=C(NCCCSc1nccs1)c1cnn(C[C@H](O)CO)c1 827474567 DNFZCRGPWVGBDM-NSHDSACASA-N 342.446 0.605 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN(C)[C@@H]3CCNC3)CC2)cc1 923288309 VIRYEGDKZPDYPG-QZTJIDSGSA-N 348.491 0.472 10 20 ECCD Nc1ccc(NC(=O)CCN2CCN(C(=O)[C@H]3CCCO3)CC2)cc1 843292190 JGRBUPVEILIIQU-MRXNPFEDSA-N 346.431 0.921 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCC(F)F 753800544 CEGZIHIEMPCHCO-UHFFFAOYSA-N 327.331 0.521 10 20 ECCD CN(C)c1ccc(CNC(=O)NCc2nc(O)cc(CN)n2)cc1F 851657247 VQZPRIBSROSFMV-UHFFFAOYSA-N 348.382 0.845 10 20 ECCD CCn1nncc1CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 850356546 UQFLZPQZMLTFOC-UHFFFAOYSA-N 349.460 0.823 10 20 ECCD CO[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1117452239 AUOKTIPMLDGHDH-INIZCTEOSA-N 329.400 0.926 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CCOC[C@H]3O)C2)cc1 875680475 VJNLTRVVEMKWBF-KBRIMQKVSA-N 349.431 0.971 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N[C@H](CO)CCF)cc2)CC1 889660632 DKJKBXIIMKISTL-HNNXBMFYSA-N 338.427 0.958 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)c3n[nH]c(O)n3)cc2)CC1 788003261 IMIFSPKXSITKGX-UHFFFAOYSA-N 344.375 0.109 10 20 ECCD NC(=O)[C@H]1CCCN1C1CCN(C(=O)c2cccc(O)c2O)CC1 790608790 GJYSDXKIFJODGW-CYBMUJFWSA-N 333.388 0.652 10 20 ECCD CC[C@@H](F)C(=O)NCCNCc1nnnn1-c1ccc(OC)cc1 1132436010 FBEVSOJMGRIAPP-CYBMUJFWSA-N 336.371 0.625 10 20 ECCD COc1ccc(CNS(=O)(=O)CCCN2CCOCC2)c(O)c1 795358462 QZXXFNUXKJSBNO-UHFFFAOYSA-N 344.433 0.543 10 20 ECCD CNC(=O)CN1CC[C@H]1CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1085994215 GAUYCZCDEUTDIN-ZDUSSCGKSA-N 346.391 0.741 10 20 ECCD 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O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCC[C@@H](O)C1 283183280 LTNQDZYHEVOJTD-MRXNPFEDSA-N 329.400 0.662 10 20 ECCD O=C1NC[C@@H]2CN(Cc3ccc4ccccc4c3O)CCN2C1=O 816520601 SVGLSMQGXMBOHS-CQSZACIVSA-N 325.368 0.688 10 20 ECCD Cn1cc(C(=O)NCCCSc2nccs2)c(O)nc1=O 733972480 RXMSOLUZGAUMFN-UHFFFAOYSA-N 326.403 0.855 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCN1 842149615 CHISEMPOIFJSHC-ZDUSSCGKSA-N 330.432 0.506 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4CNC[C@@H]4C3)nc12 917199235 WQVSFRVSFQXZCI-PHIMTYICSA-N 331.376 0.263 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCC(O)(C(N)=O)CC2)cc1F 915373335 ZIMQTHZXYVSEDA-UHFFFAOYSA-N 338.383 0.414 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC(n3ccnc3)C2)c1 750235715 KHNHXFMRHASUSW-UHFFFAOYSA-N 336.373 0.657 10 20 ECCD C[C@H](C(N)=O)N1CC[C@@H](N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1033699001 HSANZHYEDZJPSL-ZWNOBZJWSA-N 346.391 0.869 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(C(=O)CSC)C2)cc(OC)n1 941654082 RLHYPRWAJPHLEW-LLVKDONJSA-N 339.417 0.793 10 20 ECCD C[C@H]1COCCN1CCN1C(=O)CN(Cc2ccccc2O)C1=O 1119623907 GVXOMABMPLDCMS-ZDUSSCGKSA-N 333.388 0.877 10 20 ECCD CC(C)C1(O)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 788614938 ILJJXWXRBJMNHX-UHFFFAOYSA-N 328.390 0.607 10 20 ECCD CN(C)C(=O)CNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891577041 QHJSSSMBOXPENL-HNNXBMFYSA-N 335.452 0.743 10 20 ECCD Cn1nncc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 798405057 YHRUVJRURNVYDN-CYBMUJFWSA-N 342.403 0.447 10 20 ECCD COc1cccc(CNS(=O)(=O)c2c[nH]c(C(=O)O)c2)c1O 1607322828 KQUQHAZWSYTFIL-UHFFFAOYSA-N 326.330 0.906 10 20 ECCD COc1cc(O)c(CNCCNS(=O)(=O)NC(C)C)cc1OC 277775177 WJUGEODCQXOSLB-UHFFFAOYSA-N 347.437 0.331 10 20 ECCD CCN(C1CCN(C(=O)c2cccc(O)c2O)CC1)S(C)(=O)=O 275162058 UTZZGUBDBUJMDD-UHFFFAOYSA-N 342.417 0.984 10 20 ECCD CC(C)(O)CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 284212968 WWMFNIHDXNHSHU-UHFFFAOYSA-N 349.431 0.417 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CC[C@@H](CO)C1 284289192 UGCBYAKJBYTAKH-OAHLLOKOSA-N 331.416 0.744 10 20 ECCD Cc1nc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)nn1C 815447573 UUMQWNGEWYWCSI-UHFFFAOYSA-N 342.403 0.761 10 20 ECCD Cc1ccc(C(=O)OCC(=O)NCC(=O)N2CCCC2)c(O)c1O 727005521 RXHAFSSCSKYLEB-UHFFFAOYSA-N 336.344 0.302 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)NCC(=O)N(C)C)C2)cc1 822583573 PQFLXPJOHANAFC-CYBMUJFWSA-N 334.420 0.909 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CN1CCN(C)C(=O)C1 839919273 GLOHZMBAFGBESN-OAHLLOKOSA-N 346.475 0.882 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@]3(CCCN3)C2)cc1F 842148358 MOWXTMYKRMFBGY-GOSISDBHSA-N 348.422 0.862 10 20 ECCD O=C(NC1CC1)N[C@H]1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 760549435 KOLPHQKBBPSEGL-WFASDCNBSA-N 333.388 0.854 10 20 ECCD C[C@@H](NCC(=O)N1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 765417768 UTGKYTFTVSXCBK-MRXNPFEDSA-N 346.475 0.948 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CCC(=O)NC3)CC2)c(OC)c1 870163940 KCZUHVRNGMBMSR-ZDUSSCGKSA-N 347.415 0.879 10 20 ECCD O=C1COc2ncc(C(=O)OCC(=O)c3ccc(O)c(O)c3)cc2N1 784494112 NCDCPHHBUFCVNE-UHFFFAOYSA-N 344.279 0.863 10 20 ECCD 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COCCn1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cn1 80147264 IVIVHBWNLALKLB-UHFFFAOYSA-N 345.403 0.850 10 20 ECCD CN(C(=O)/C=C/c1ccc(N2CCOCC2)cc1)[C@@H]1COC[C@H]1O 287340490 OUTBNBBETPVMTE-MWRSBEEJSA-N 332.400 0.755 10 20 ECCD C[C@H]1C(=O)NCCN1C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 284293115 UMEKODDPDNNCDS-ZDUSSCGKSA-N 344.415 0.250 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N[C@@H]3CCNC3)C2)cc1 818677211 RCFBLKQLIPNNID-UONOGXRCSA-N 346.431 0.116 10 20 ECCD Cn1ncc(CNCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 815117188 NHIXNVBYJSIICP-AWEZNQCLSA-N 328.420 0.807 10 20 ECCD O=C(NCc1ccc(N2CCCCC2)cc1)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1 824262260 UVMAHLBEFXBSCH-KZNAEPCWSA-N 346.427 0.706 10 20 ECCD NC(=O)C1(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 732274886 VCWPQYYRXZFTEI-UHFFFAOYSA-N 335.379 0.669 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@@H]3C(=O)O)CC2)cc1 738021928 KGLIJHOTIOTULU-CVEARBPZSA-N 347.415 0.654 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CC[C@@H](N3CCNCC3)C2)cc1 844225809 VNPVSWRABYHDIJ-GOSISDBHSA-N 345.491 0.348 10 20 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COC(=O)CCN(CC(=O)O)Cc1cc(OC)c(OC)cc1O 1593841302 UPOUAIZUZJOBLL-UHFFFAOYSA-N 327.333 0.859 10 20 ECCD C[C@](CNCc1ccc(N2CC[C@@H](O)C2)cc1)(CC(=O)O)C(=O)O 1776425337 PFEHWIVZEDEEIU-RHSMWYFYSA-N 336.388 0.913 10 20 ECCD CN1CCCc2cc(CNC(=O)NCCS(C)(=O)=O)ccc21 58574468 CQRRIKBJULPUNA-UHFFFAOYSA-N 325.434 0.913 10 20 ECCD CS(=O)(=O)N1CC(CNCc2ccc(N3CCOCC3)cc2)C1 189698156 XKOXOCIMLGCVFA-UHFFFAOYSA-N 339.461 0.504 10 20 ECCD C[C@H]1C[C@@H](C(=O)O)CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 817887933 HIJDSXVCYXTZAD-GXTWGEPZSA-N 347.415 0.938 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)CCn1ccnn1 819693144 KMMXFQIIYAXCPO-UHFFFAOYSA-N 332.360 0.966 10 20 ECCD NC(=O)C1(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1 732273026 IPWXHJWJEUCLII-UHFFFAOYSA-N 331.416 0.777 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)CCNC(C)=O)nc12 830148146 IUKABPTZXQUTGM-UHFFFAOYSA-N 335.364 0.180 10 20 ECCD O=C1NC(=S)NC(=O)C1=CNNc1ncccc1C(F)(F)F 915261323 OPAGPOXFUKBTPF-UHFFFAOYSA-N 331.279 0.432 10 20 ECCD CN1CCN(c2ccc(CN3C(=O)[C@H]4C[C@@H](O)CN4C3=O)cc2)CC1 925081384 ZFALNEZSIGXRPP-HZPDHXFCSA-N 344.415 0.336 10 20 ECCD CO[C@](C)(C(=O)O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 852957605 YJPIQEWBXNHWSU-KRWDZBQOSA-N 336.388 0.754 10 20 ECCD CNC(=O)Cc1ccccc1NC(=O)C(=O)NCc1ccccc1O 1115925337 IZJPBWKCEQZQQJ-UHFFFAOYSA-N 341.367 0.936 10 20 ECCD CC(C)C[C@H](O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 771047735 CUVPJWRFKTVFAK-NSHDSACASA-N 330.406 0.901 10 20 ECCD O=C(C[C@H]1CCS(=O)(=O)C1)OCC(=O)c1ccc(O)c(O)c1 782547506 BZYJCAIWVMIFDJ-SECBINFHSA-N 328.342 0.649 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cnnn1C 798793744 KHIKOYNEKRVZKU-UHFFFAOYSA-N 331.376 0.697 10 20 ECCD C[C@@H]1CN([C@H](C)C(N)=O)C[C@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1081025939 FIBSHRJLDCMALO-GIPNMCIBSA-N 346.391 0.773 10 20 ECCD COC(=O)C[C@@H](O)CNC(=O)c1csc(Cc2ccc(N)cc2)n1 1578800946 DGXONTRKVLYIDK-GFCCVEGCSA-N 349.412 0.970 10 20 ECCD COc1ncc(/C=C\C(=O)N(C)c2cc(-c3nn[nH]n3)ccn2)cn1 1591663231 LBFLNQUJYQAQNU-ARJAWSKDSA-N 338.331 0.737 10 20 ECCD 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ECCD COc1ccc(N(C)CCN(C)CN2C[C@H](C(=O)O)CC2=O)cc1 1599583860 GMQIVQZFMJEHBP-CYBMUJFWSA-N 335.404 0.954 10 20 ECCD CCN1CCc2cc(CN[C@@H](CS(C)(=O)=O)C(=O)O)ccc21 1776877647 QNXPHMONBJUOHZ-ZDUSSCGKSA-N 326.418 0.656 10 20 ECCD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCC[C@H]1O 288176854 ASVCICIUQFSSTA-DGCLKSJQSA-N 328.390 0.749 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CC[C@H](S(C)(=O)=O)C2)c1O 282896485 ZVJHOQKTUBTNGZ-JTQLQIEISA-N 330.362 0.928 10 20 ECCD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCCn2nccc21 299582512 CFSHXVRXUNZWQV-UHFFFAOYSA-N 333.373 0.117 10 20 ECCD O=C(Nc1ccc(-c2nnco2)cc1)C1=S=C(c2nn[nH]n2)C=C1 823303467 JHKSQOWMZHAEQP-UHFFFAOYSA-N 339.340 0.884 10 20 ECCD C[C@@](O)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 743716466 WMGKKWLOOSZPCV-CQSZACIVSA-N 328.390 0.655 10 20 ECCD C[C@](O)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 743716465 WMGKKWLOOSZPCV-AWEZNQCLSA-N 328.390 0.655 10 20 ECCD CCCNC(=O)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851920659 CYVSCVDLOKJJJG-UHFFFAOYSA-N 348.447 0.973 10 20 ECCD 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20 ECCD CNC(=O)[C@H](C)NC(=O)NCc1ccc(N2CCN(C)CC2)cc1 889663280 NZWVTXOXKVJYET-ZDUSSCGKSA-N 333.436 0.372 10 20 ECCD C[C@H]1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CN1CC(N)=O 1072101680 ITGJJCDUSSIBFD-GXFFZTMASA-N 346.391 0.917 10 20 ECCD Cc1ccc([N+](=O)[O-])c(N2CC=C(CCNC(=O)CC(N)=O)CC2)n1 1089822044 LFHXQVFEHRNTGK-UHFFFAOYSA-N 347.375 0.816 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@@H]3COCCO3)CC2)n1 1089807140 FUVJHXZMNMIVPY-HNNXBMFYSA-N 332.404 0.843 10 20 ECCD CCOc1cc(N2CC=C(CCNC(=O)CC(N)=O)CC2)ncn1 1089821881 AMGOXFUGCHVVLS-UHFFFAOYSA-N 333.392 0.394 10 20 ECCD CN1C[C@@H]2CCCN(C(=O)C(=O)N(C)Cc3ccccc3O)[C@@H]2C1 1325926070 GTBFXRXHSLKKBP-DZGCQCFKSA-N 331.416 0.903 10 20 ECCD CN(C)C(=O)CCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1321857218 PFEOLHMDRTWGFI-UHFFFAOYSA-N 334.420 0.306 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NC[C@H]1C[C@H](N)C1 1331590715 RHTSANBXLCIFEQ-DZKIICNBSA-N 346.475 0.962 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCn3ncnc3C2)c1 1338233443 LJTIMUXVXGEPSB-UHFFFAOYSA-N 337.361 0.011 10 20 ECCD NC(=O)C[C@@H]1CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])CCO1 1608231588 GZGOZRQWOKJTNH-CJHWANRJSA-N 335.316 0.773 10 20 ECCD COCC(=O)NCCC1=CCN(c2ncccc2-c2nn[nH]n2)CC1 1605039331 DZFUEBZMJUKYBE-UHFFFAOYSA-N 343.391 0.551 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C3=NOC4(CNC4)C3)cc2)CC1 1578536123 BEDUVNSYELPCBF-UHFFFAOYSA-N 343.431 0.173 10 20 ECCD O=C(C[C@@]1(O)CCNC1)NCc1cccc(Br)c1O 1580501176 RHIOTVHOJPKLCG-ZDUSSCGKSA-N 329.194 0.885 10 20 ECCD C[C@H](N[C@@H]1CCc2c(nnn2C)C1)c1cccc(-c2nn[nH]n2)c1O 1589952445 ANSUZPBNKAZUEK-VHSXEESVSA-N 340.391 0.909 10 20 ECCD Cn1cc(/C=C/C(=O)N2CCCc3nc(-c4nn[nH]n4)ccc32)cn1 1592567047 OMOYIVDIMDJNPQ-QPJJXVBHSA-N 336.359 0.988 10 20 ECCD C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)[C@@H]1CCNC1=O 1755327480 DSYFYLNEUMBKAV-ZWNOBZJWSA-N 346.391 0.788 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1cccc(C(=O)O)c1=O 1592883385 RLXBTZWVTDCKCM-JTQLQIEISA-N 346.339 0.705 10 20 ECCD Cc1ccc(O)c(CN(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 91953965 PKSCRYWIYCYFIY-CYBMUJFWSA-N 326.418 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0.917 10 20 ECCD COc1ccc(O)c(CNC(=O)c2coc(S(N)(=O)=O)c2)c1 764264218 DMQOQUQXOLDAET-UHFFFAOYSA-N 326.330 0.571 10 20 ECCD CCn1nncc1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 875253610 WNQNFFORMWNKAM-UHFFFAOYSA-N 344.419 0.605 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCCC(C)(C)N)ccc21 884520999 KSCAHHHLSUAIHA-UHFFFAOYSA-N 332.448 0.929 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCOC[C@H]1CCO 1120507337 JXOIFOVSYWMDFS-MRXNPFEDSA-N 349.431 0.321 10 20 ECCD CC(C)(O)CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 792067733 XPWXNTUFTCEUCE-UHFFFAOYSA-N 340.445 0.699 10 20 ECCD C[C@H]1[C@H](NCC(N)=O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 987594100 HPHPEMXVXZBLPK-JOYOIKCWSA-N 332.364 0.527 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@@]3(C)CNC(=O)C3)CC2)n1 1089850560 DAIIGBYMGIKTOC-GOSISDBHSA-N 343.431 0.954 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cscn3)C2)cc(OC)n1 996369167 SDZJXUMXPGSXEO-UHFFFAOYSA-N 348.384 0.810 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCC2(CCNC2=O)CC1 1329686468 AUPZYEHDYFDMHA-UHFFFAOYSA-N 345.399 0.479 10 20 ECCD 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COc1ccc(-n2nnnc2CNCCNC(=O)C2CC(C)C2)cc1 1125508934 AYFPAPIACMKIEY-UHFFFAOYSA-N 344.419 0.923 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCNC(=O)C2)N(C)C)cc1 891254509 YOCQUOCIKLRCOA-GOEBONIOSA-N 332.448 0.998 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@H]3CCC(=O)NC3)CC2)ncn1 1089870631 ZFINVUKIQRQOET-HNNXBMFYSA-N 343.431 0.954 10 20 ECCD O=C1CCC[C@H](C(=O)NCCC2=CCN(c3nccnc3F)CC2)N1 1089844753 KYAMZYAPLOXGNS-CYBMUJFWSA-N 347.394 0.927 10 20 ECCD COc1ccc(N2CC[C@@H](NC(=O)N3CCO[C@H](C(=O)O)C3)C2)cc1 1341340848 AFVZSCAYXYCGGD-DOMZBBRYSA-N 349.387 0.769 10 20 ECCD O=C(Cc1ccc(O)c(O)c1)NC[C@H](N1CCNCC1)C(F)(F)F 1580570253 UJPFMGGRESOCLI-ZDUSSCGKSA-N 347.337 0.593 10 20 ECCD Cc1cc(N(C)C)ccc1CNCCn1cnc(-c2nn[nH]n2)n1 1591994674 IORHHGXRZFDHCC-UHFFFAOYSA-N 327.396 0.622 10 20 ECCD COc1ccc(CNC[C@@H](O)CNC(=O)c2cnn(C)c2C)cc1C 1753905508 IPMMPKKZOASYHL-OAHLLOKOSA-N 346.431 0.926 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(CC(N)=O)C(C)C)nc12 51966190 DFNPJERSFAGGPA-UHFFFAOYSA-N 335.364 0.307 10 20 ECCD CC(C)OCCS(=O)(=O)NCC(=O)NCCc1ccc(N)cc1 262584635 TTXMMJNXWNWPKO-UHFFFAOYSA-N 343.449 0.272 10 20 ECCD Cc1ccc(O)c(CN[C@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)c1 265240684 LIDKSCLLNHIVQW-LSDHHAIUSA-N 340.445 0.288 10 20 ECCD COc1cccc(CNC(=O)NCC2(S(C)(=O)=O)CC2)c1O 279756554 ZGBAUWHCBICNFA-UHFFFAOYSA-N 328.390 0.777 10 20 ECCD COc1ccc(N2CCC(NC(=O)CSCC(N)=O)CC2)cc1 726630866 UBEUHKJBMPPAKC-UHFFFAOYSA-N 337.445 0.999 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)NC[C@@]3(O)CCOC3)C2)cc1 824685476 FHNKLLZAAOBBRS-KDOFPFPSSA-N 349.431 0.972 10 20 ECCD Cc1ccc(C(=O)NC2CCN([C@@H]3CCN(C)C3=O)CC2)c(O)c1O 843884714 FPQBQRVHTLSZBW-CQSZACIVSA-N 347.415 0.831 10 20 ECCD CC(C)CN1CCO[C@@H](CNC(=O)C(=O)Nc2ccc(N)cc2)C1 841002548 ZTGWFPBIWVZHCQ-HNNXBMFYSA-N 334.420 0.680 10 20 ECCD CN1CCN(CC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 856211411 OWFPCKYALJSSFK-UHFFFAOYSA-N 346.475 0.511 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3nc(=N)cc[nH]3)cc2)CC1 883146628 SWXGXXHLZQTYSY-UHFFFAOYSA-N 326.404 0.571 10 20 ECCD CCS(=O)(=O)NCC(=O)NCCNCc1ccc(OC)c(C)c1 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1089865197 OJBMVIZCIURTPV-QGZVFWFLSA-N 347.394 0.785 10 20 ECCD CC[C@H](F)C(=O)N1CC(NC(=O)c2cc(OC)nc(OC)c2)C1 996369425 WZILFVJQBSJRNI-NSHDSACASA-N 325.340 0.788 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC[C@](C)(O)C2)cc1 1327352797 ZMWDRZNLSLEMFO-SFHVURJKSA-N 349.431 0.573 10 20 ECCD C[C@@H](C(=O)NC1CC1)N1CCN(C(=O)NCc2ccc(N)cc2)CC1 1336290005 FQFVMCOYWBJZOD-ZDUSSCGKSA-N 345.447 0.763 10 20 ECCD CCOc1ccc(O)c(CNCCn2cnc(-c3nn[nH]n3)n2)c1 1609245261 CCUDTRAXMZCVRI-UHFFFAOYSA-N 330.352 0.352 10 20 ECCD CCNC(=O)CC(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1596456291 JPFRUBRYDKKOTD-UHFFFAOYSA-N 328.752 0.985 10 20 ECCD CC(C)NC(=O)C(=O)N1CCN(C(=O)Cc2ccc(N)cc2)CC1 236623220 DYJQGHAWTCJFEA-UHFFFAOYSA-N 332.404 0.007 10 20 ECCD COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)C(N)=O)CCCC1 614070569 IVLOZJNGWBGUJD-MRXNPFEDSA-N 345.399 0.491 10 20 ECCD CN1C(=O)NC2(CCN(Cc3cc4c(cc3O)OCO4)CC2)C1=O 289408100 HLDQDYTZDFBPPD-UHFFFAOYSA-N 333.344 0.637 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C(=O)N1CC(=O)N[C@H](C)C1 297946011 FQFARNCYLLSHNY-CYBMUJFWSA-N 347.415 0.868 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCNC(=O)C[C@H]1C 807102599 GEJNIIGZJLZYAY-CYBMUJFWSA-N 346.431 0.414 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N(C)CCN)C2)cc1 818678225 WYWKRCQCYWFRBA-CYBMUJFWSA-N 334.420 0.055 10 20 ECCD CN(C)C(=O)CN1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 823709629 ZGMDVQASLSBGIT-UHFFFAOYSA-N 325.340 0.083 10 20 ECCD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N1CCC(C(=O)O)CC1 833095069 PEEUVJAWUXLVIC-RQOWECAXSA-N 349.339 0.977 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N(C)[C@@H](C)CN)cc1 846366197 ZWVARZAJVZKZKO-ZDUSSCGKSA-N 336.436 0.395 10 20 ECCD COc1cc(N2CCN(C(=O)NCCN)CC2)cc(OC)c1OC 841920641 IVUVDPXLFQYBRZ-UHFFFAOYSA-N 338.408 0.503 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)NCC(=O)N1CCNCC1 841920586 PLLDIRMQSHLCNF-UHFFFAOYSA-N 333.436 0.326 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2cccn(C)c2=O)c1 754938896 XNDXSOZQINFGLY-JTQLQIEISA-N 345.355 0.915 10 20 ECCD CN(C)C(=O)CN1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1039060562 LHUKFTBJMAHBSP-ZDUSSCGKSA-N 346.391 0.741 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@H](O)C1 774187009 IXSZRTCAAWKOLK-JTQLQIEISA-N 329.447 0.725 10 20 ECCD CS(=O)(=O)N1CC(CNC(=O)/C=C/c2ccc(O)c(O)c2)C1 779336356 ZOIDNIYEELNXLK-HWKANZROSA-N 326.374 0.119 10 20 ECCD COCCN1C[C@@H](O)[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 958732454 NRZUKSQWUXYRMC-TZMCWYRMSA-N 349.391 0.518 10 20 ECCD C[C@H]1OC(=O)N[C@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 788630146 GOFZQJPUTDCBHM-IUODEOHRSA-N 333.388 0.979 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CC[C@H](C(N)=O)O2)N(C)C)cc1 891246454 NYRODPJIUQAKBB-OAGGEKHMSA-N 348.447 0.504 10 20 ECCD COc1ccc(CNCCNC(=O)c2cn(C)c(=O)cn2)cc1C 1131540412 ZDXMXIJEGBEWTD-UHFFFAOYSA-N 330.388 0.617 10 20 ECCD CC(C)OCC(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089810232 LGQGWIOAIHTPPE-UHFFFAOYSA-N 345.407 0.587 10 20 ECCD COc1cc(O)c(CN2CCN(Cc3nc[nH]n3)CC2)cc1OC 1334383052 DPQPOFPUWSSSQC-UHFFFAOYSA-N 333.392 0.845 10 20 ECCD Cc1nn[nH]c1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1351044613 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NWPBBQSNYRMQMI-UHFFFAOYSA-N 332.448 0.872 10 20 ECCD CCN1CCN(CC(=O)NCc2cc(Cl)ccc2O)C(=O)C1=O 846472852 NCXLKTFKWKWMKF-UHFFFAOYSA-N 339.779 0.353 10 20 ECCD NC(=O)CNC1CCC(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1026612642 IIMMLWWVSOWVOQ-UHFFFAOYSA-N 346.391 0.965 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N(C)C[C@H](C)N 861741713 WWOXTFAHFVBJSZ-KBPBESRZSA-N 334.464 0.914 10 20 ECCD COc1ccc(N2CCN(C(=O)CN[C@H]3COC[C@@H]3C)CC2)cc1 932502019 RAMUUMUWAFABGN-YOEHRIQHSA-N 333.432 0.968 10 20 ECCD CN(C)C[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 769861509 OMKJUBCRZPBDFH-LLVKDONJSA-N 341.433 0.787 10 20 ECCD O=C(NCc1ccccc1O)[C@@H](O)[C@H](O)c1nc2ccccc2[nH]1 779815428 PZLFCGKXVQFIGM-GJZGRUSLSA-N 327.340 0.979 10 20 ECCD C[C@@H](C(N)=O)N1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1044352285 BMUJDTBRJKUSNK-VIFPVBQESA-N 332.364 0.479 10 20 ECCD Cc1ccc(O)c(CN2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c1 894978675 OIYSAIVIZPRAHA-UHFFFAOYSA-N 336.417 0.930 10 20 ECCD COc1ccc(CNC(=O)C(=O)Nc2cncnc2OC)c(O)c1 797390309 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O=C(CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1)NC1CC1 853246215 IIEYAPSLRKGHAC-UHFFFAOYSA-N 346.431 0.726 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CN2CCCN1CC2 763997130 JSVYYUPRKJOOGW-GOSISDBHSA-N 344.459 0.529 10 20 ECCD COCC(=O)N1CCN(Cc2ccc(N3CCC(O)CC3)cc2)CC1 876568493 YNKXMYNMCCPHAL-UHFFFAOYSA-N 347.459 0.938 10 20 ECCD CCC(=O)N(C)C1CN(Cc2nnnn2-c2ccc(OC)cc2)C1 1042385820 VFVFHSFRQSDQPU-UHFFFAOYSA-N 330.392 0.724 10 20 ECCD CCn1[nH]nnc1=NC(=O)NCc1ccc(N2CCSCC2)cc1 888343810 YCVVNSKFTIAEGB-UHFFFAOYSA-N 347.448 0.990 10 20 ECCD C[C@H]1[C@@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C 771408351 ULHMCTVMYJVJOX-WDEREUQCSA-N 341.433 0.928 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1nc(=N)cc[nH]1 787924903 JTIVKNNWUZJYEA-UHFFFAOYSA-N 327.388 0.998 10 20 ECCD COc1ccc(CNCCNC(=O)[C@H]2CN(C)C[C@@H](C)O2)cc1C 1130182525 LUXPEGKTIQHUQM-RHSMWYFYSA-N 335.448 0.929 10 20 ECCD CN1CC[C@H](NCCNC(=O)c2ccc(N=NC(N)=O)cc2)C1=O 1153037822 VFTKLVDTGDZQDA-LBPRGKRZSA-N 332.364 0.399 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@H]3CC[C@@H]3C(N)=O)CC2)n1 1089850395 XDMDWZJXFFGEFQ-GJZGRUSLSA-N 343.431 0.939 10 20 ECCD CNC[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1326163907 ANJUYMBTNXTLGG-AWEZNQCLSA-N 330.432 0.651 10 20 ECCD C[C@@H](NC(=O)C(=O)N1CCOC[C@H]1CCO)c1ccc(N(C)C)cc1 1333430929 YQFAUFYJNXTGFC-CZUORRHYSA-N 349.431 0.540 10 20 ECCD CNC(=O)CCCN(C)C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1342715602 VFCFQOCBSQNOIO-CYBMUJFWSA-N 348.447 0.914 10 20 ECCD CC(=O)C(=O)COC(=O)[C@@H](Oc1ccccc1-c1nn[nH]n1)C(C)C 1609061638 OIQJEKNEKUUAQC-AWEZNQCLSA-N 346.343 0.971 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)NC2(CCO)CNC2)N(C)C)cc1 1578424815 XHYOPLLNCCBPMZ-INIZCTEOSA-N 349.479 0.379 10 20 ECCD CC(C)(C)OC(=O)NCCNCC(=O)NCc1cccc(O)c1O 1575226365 RORHUXZFMXTNAP-UHFFFAOYSA-N 339.392 0.828 10 20 ECCD Cc1cccc(CN2CCN(C(=O)C(=O)N3CCCC3)CC2)c1O 179765090 XLBQPLXUXFIPSF-UHFFFAOYSA-N 331.416 0.967 10 20 ECCD COC(=O)[C@H]1COCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 269624968 JJZOTLGVXPITFY-MRXNPFEDSA-N 349.431 0.585 10 20 ECCD COc1ccc(N2CCN(C(=O)CCn3ncn(C)c3=O)CC2)cc1 292756606 RZTGAQARZQEEKB-UHFFFAOYSA-N 345.403 0.329 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCO[C@H](C(=O)O)C1)c1ccc(N(C)C)cc1 817115190 KXBDVRHJMAQDNO-FZMZJTMJSA-N 349.387 0.242 10 20 ECCD CC[C@H](C)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)O 820449117 CLFZDUVDGPUKIH-UFBFGSQYSA-N 344.389 0.993 10 20 ECCD COC1CCN(c2ccc(CN3CCN(C(=O)CO)CC3)cc2)CC1 828505602 VAPJGZQLULDZPO-UHFFFAOYSA-N 347.459 0.938 10 20 ECCD CCS(=O)(=O)N[C@H](C)C(=O)NCc1ccc(N(C)C)c(F)c1 824668958 AHLGEHUGUUOJLP-SNVBAGLBSA-N 331.413 0.836 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CS(=O)(=O)C[C@@H]2OC)c1O 826985113 BSJIPFUKUMVNTC-KOLCDFICSA-N 346.361 0.211 10 20 ECCD C[C@@]1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCOC1 733364501 VNMDACUWXJDJMH-AWEZNQCLSA-N 328.390 0.920 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)C(C)(C)S(C)(=O)=O)cc1 843297763 KYPGVHFPVLEDRF-ZDUSSCGKSA-N 327.450 0.692 10 20 ECCD CCN1CCN(CCc2noc(Cc3ccc(N)cc3)n2)C(=O)C1=O 843212527 XKUYBZPKUUXXTD-UHFFFAOYSA-N 343.387 0.476 10 20 ECCD C[C@@H]1COC[C@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 929803965 HGQCEKYOFYLUQM-IUODEOHRSA-N 331.416 0.836 10 20 ECCD C[C@@H]1COC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 929470180 ZPUYQBOIWRZLOK-CZUORRHYSA-N 347.415 0.291 10 20 ECCD COc1ccc(N2CCN(CCN3CCNCC3)CC2)c(OC)c1 866697583 SMVWKHHKHWIFPR-UHFFFAOYSA-N 334.464 0.731 10 20 ECCD COc1ccc(-n2c(C)cc(C(=O)NC(C(N)=O)C(N)=O)c2C)cc1 875737097 AFJYZPJNEMPXMR-UHFFFAOYSA-N 344.371 0.172 10 20 ECCD C[C@@H]1NC(=S)N(Cc2ccc(N3CCC(C(N)=O)CC3)cc2)C1=O 887271044 YXZVLDSJYGXWPT-NSHDSACASA-N 346.456 0.994 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC(O)(C(C)C)C3)nc12 773890380 FXPCBOXOMVHCNC-UHFFFAOYSA-N 334.376 0.814 10 20 ECCD COCn1nccc1S(=O)(=O)NCc1cccc(OC)c1O 790026662 NVMBFAOLZKBAKM-UHFFFAOYSA-N 327.362 0.680 10 20 ECCD C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CN([C@H](C)C(N)=O)C1 970953103 CFCZRRQGPKAOSD-NXEZZACHSA-N 346.391 0.773 10 20 ECCD CCOCC(=O)NCC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1075486200 ONFWIWLIPVEYMN-NSHDSACASA-N 339.392 0.760 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NCC1(CC(N)=O)CC1 1325700993 IOBKZKOTUORISY-UHFFFAOYSA-N 347.415 0.903 10 20 ECCD COc1ccc(N2CCN(c3nnc(CCO)n3C)CC2)c(OC)c1 1338044367 JSYDQAHNRBXZIR-UHFFFAOYSA-N 347.419 0.694 10 20 ECCD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)C(=O)N(C)C 1261115312 ZYAFMHVDIHKCDA-JTQLQIEISA-N 338.383 0.101 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCCOc1cccnc1 1345578105 OQWBALPAVAETDK-UHFFFAOYSA-N 329.356 0.941 10 20 ECCD CO[C@H](CN)CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 1345792013 JODUPAIEKNBKDE-KRWDZBQOSA-N 348.447 0.335 10 20 ECCD C/C=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2 1800458232 CEMGHPHDEAJKBJ-NXUIKZECSA-N 347.371 0.272 10 20 ECCD CC(C)[C@@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1847629749 HNUCXABERZAIPX-SLEUVZQESA-N 349.387 0.325 10 20 ECCD CNC(=O)[C@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 184039345 AVKWHAORKOCFHX-MRXNPFEDSA-N 348.447 0.158 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCN1CCCS1(=O)=O 274968295 VGQUDZGCYSUEQQ-LLVKDONJSA-N 342.417 0.571 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC[C@@]1(O)CCOC1 823530179 BVRDSKHQVRQRLX-SFHVURJKSA-N 349.431 0.598 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)C2(S(C)(=O)=O)CCC2)cc1 832283735 ASXXLLWGCDPKNC-AWEZNQCLSA-N 339.461 0.836 10 20 ECCD NC(=O)C1(O)CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 919908592 IFQBHQPRHSCQEK-UHFFFAOYSA-N 344.415 0.585 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)CN)CC2)cc1 842247721 HBEFXRDEVIQZDR-AWEZNQCLSA-N 348.447 0.445 10 20 ECCD C[C@@H](NC(=O)C(=O)NC[C@H]1COCCN1)c1ccc(N(C)C)cc1 861765906 AQEKTCCTPQQBSG-OCCSQVGLSA-N 334.420 0.034 10 20 ECCD C[C@H](OC(=O)c1cccc(O)c1O)C(=O)Nc1ncnc2[nH]cnc12 776280453 QMMFUXHFNDQUHH-ZETCQYMHSA-N 343.299 0.948 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)N[C@@H]3CCOC3)cc2)CC1 884236076 MDGGNBFIQRPSJE-OAHLLOKOSA-N 346.431 0.976 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)c2ccc(=O)n(C)n2)N(C)C)cc1 891258219 QIUHEOSMWGUMRO-MRXNPFEDSA-N 343.431 0.879 10 20 ECCD C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CO1 1328298591 ANGGMAMPGSOWTP-HIFRSBDPSA-N 329.400 0.973 10 20 ECCD Nc1ccc(NC(=O)C(=O)NC2CCN([C@@H]3CCOC3)CC2)cc1 1330509645 GTIBNOCILAVQAB-OAHLLOKOSA-N 332.404 0.577 10 20 ECCD CO[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1330349867 SDEBBROSFZCMIX-ZDUSSCGKSA-N 335.404 0.291 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1C[C@@H](N)C1 1334006000 QNIPWWZOGDCXHE-GASCZTMLSA-N 332.448 0.955 10 20 ECCD O=C(C[C@@H]1CC(=O)NC1=O)NCc1ccc(N2CCSCC2)cc1 1351355017 YVZCOJGNKUCGRA-CYBMUJFWSA-N 347.440 0.909 10 20 ECCD O=C(Cc1ccc(O)c(O)c1)NOc1cccc(-c2nn[nH]n2)c1 1606599818 JWRHTDCSRKQLQD-UHFFFAOYSA-N 327.300 0.931 10 20 ECCD CN(Cc1ccccc1O)C(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1 67644574 YHJOLFCRSBUFCH-CYBMUJFWSA-N 341.433 0.958 10 20 ECCD C[C@@H](C(=O)N[C@H]1CCS(=O)(=O)C1)N(C)Cc1ccccc1O 269606164 CMBVQUADBAQQEX-AAEUAGOBSA-N 326.418 0.516 10 20 ECCD CC(=O)C(=O)Cn1nnc([C@@H]2CN(Cc3ccccc3)CCO2)n1 367936186 VJNNVTXAOXFRMB-HNNXBMFYSA-N 329.360 0.405 10 20 ECCD COC[C@]1(C)NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 277199248 DPXAGWUQPGPIRR-KRWDZBQOSA-N 333.388 0.980 10 20 ECCD CCN(C)C(=O)CNC(=O)C(=O)NCCCSc1nccs1 806275699 RJPMTMCONBVOQU-UHFFFAOYSA-N 344.462 0.336 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N(C)CCO)C2)cc1 824980543 DYNQPCOYZWIGHE-ZDUSSCGKSA-N 335.404 0.088 10 20 ECCD CC(=O)NCCN(C)C(=O)NCc1ccc(N2CCOCC2)cc1 825752752 AIADRIHXCBMRJK-UHFFFAOYSA-N 334.420 0.801 10 20 ECCD O=C(NCCCSc1nccs1)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1 827474584 FPJDFMLNOBQRNR-GMTAPVOTSA-N 330.431 0.154 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)CC3(O)CCC3)nc12 838211278 WWUVLFIGBHJYDV-UHFFFAOYSA-N 349.343 0.960 10 20 ECCD C[C@H](CCN)NC(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 911293234 CPPYHCKRVHPDHG-CJNGLKHVSA-N 349.479 0.325 10 20 ECCD CN1CCN(C(=O)CCNC(=O)NCCc2ccc(N)cc2)CC1 841693914 SPLOFQAGXCRBPA-UHFFFAOYSA-N 333.436 0.275 10 20 ECCD COC[C@@H]1COCCN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 910894176 JEBPKQCKPMJFSU-MRXNPFEDSA-N 349.431 0.585 10 20 ECCD CNCCNC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 842232897 VQXPTKQQRULZIM-UHFFFAOYSA-N 334.420 0.070 10 20 ECCD CN(CC(=O)NCc1ccc(N(C)C)cc1)CC(=O)N1CCCC1 749899760 WJZLHEZCZYYSGL-UHFFFAOYSA-N 332.448 0.923 10 20 ECCD COc1ccc(CN[C@@H]2CC[C@H]3CN(C(=O)C(N)=O)C[C@@H]32)cc1C 1026345984 IOPUJBJJZUXVTO-SOUVJXGZSA-N 331.416 0.816 10 20 ECCD CC[C@@H](N[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 1023149956 OBTOZLQPYCKQEJ-FRRDWIJNSA-N 346.391 0.963 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1 854375898 YXPYTRFDPJOKSP-BRWVUGGUSA-N 335.400 0.934 10 20 ECCD Cc1ccc(O)c(CNC(=O)CN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)c1 862759863 JHGDPGQUJOJDBO-RRCSTGOVSA-N 344.367 0.479 10 20 ECCD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)c1ncnn1C 1117164346 LKFVQXCWVXUZBQ-SNVBAGLBSA-N 348.382 0.514 10 20 ECCD CN1CCN(c2ccc(CN3CCN(C)C[C@H]3CO)cc2F)CC1 1119246970 NBRGBRWGJKKUKY-INIZCTEOSA-N 336.455 0.686 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN1S(C)(=O)=O 773747551 BDXAWBZSLLVMAI-PWSUYJOCSA-N 342.417 0.569 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N3C[C@@H]4C[C@@]4(CO)C3)cc2)CC1 889665421 NVPYLNHOIZYLSG-LPHOPBHVSA-N 344.459 0.962 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@H]3CCCN3)cc2)CC1 891998295 BFLZZXYRACWICH-MRXNPFEDSA-N 331.464 0.990 10 20 ECCD CC[C@H](F)C(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089858170 ZOTNLLMMTDDGRK-LBPRGKRZSA-N 333.371 0.910 10 20 ECCD CC[C@H]1C(=O)N(CC)CCN1C(=O)C(=O)N(C)Cc1ccccc1O 1331194499 HYJDTCYOGPJBEA-AWEZNQCLSA-N 347.415 0.820 10 20 ECCD COc1cccc(O)c1CN1CCN([C@]2(C(=O)O)CCOC2)CC1 1607326394 GCOOHPFCNHTDNR-QGZVFWFLSA-N 336.388 0.762 10 20 ECCD O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1nn[nH]n1 1602057481 FLEPLMJSCHKADW-UHFFFAOYSA-N 339.739 0.605 10 20 ECCD Nc1ccc(CNC(=O)NCCNS(=O)(=O)c2cccnc2)cc1 1580445737 SHIWUJVAOXPONR-UHFFFAOYSA-N 349.416 0.442 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCC[C@@H]3CO)CC2)cc1 63512758 HTNLBXJIHOHPDQ-MRXNPFEDSA-N 333.432 0.801 10 20 ECCD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCOC1 270811310 OGQGWIDYMHLDGL-NXEZZACHSA-N 328.390 0.919 10 20 ECCD CCOC(=O)c1cc(NS(=O)(=O)CCOCCOC)ccc1O 295182747 JCNWIEXZVLFHDA-UHFFFAOYSA-N 347.389 0.974 10 20 ECCD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nncn1C 805424688 NERJGBDVZSRWND-QMMMGPOBSA-N 340.361 0.810 10 20 ECCD Nc1nsc(N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)n1 295062535 HHWCAPAWVQNDCR-UHFFFAOYSA-N 339.352 0.633 10 20 ECCD CN1CCC[C@H](CN(C)C(=O)C(=O)NCCc2ccc(N)cc2)C1 842235156 DQGRFMFBLWMFSW-HNNXBMFYSA-N 332.448 0.728 10 20 ECCD C[C@](O)(CNC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)O 844932242 DXDUBVSCVKHHSE-HNNXBMFYSA-N 335.385 0.882 10 20 ECCD C[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)[C@@H]1CCO 851688308 WLZMTMDCEWXMOA-CZUORRHYSA-N 333.432 0.937 10 20 ECCD COc1ccc(O)c(CNC(=O)N[C@@H]2CCCS(=O)(=O)C2)c1 758656704 DASWFEJMUVGVJM-LLVKDONJSA-N 328.390 0.777 10 20 ECCD COC[C@H](OC)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 850196818 FJBLDZOBGFVXDC-HNNXBMFYSA-N 338.404 0.916 10 20 ECCD C[C@H](N)CN(C)C(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 861742497 IGZKYACUJRHJAG-KBPBESRZSA-N 348.447 0.506 10 20 ECCD NS(=O)(=O)C[C@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 779515318 RJPOXCNQVQFDNB-RNZFLTOJSA-N 340.401 0.638 10 20 ECCD COc1ccc(CNCCNC(=O)Cn2ccc(O)nc2=O)cc1C 1130938681 QNMGBIKVUVZROM-UHFFFAOYSA-N 346.387 0.172 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H]4C[C@@]4(CO)C3)nc12 782633295 NSYHITGVQKSDAP-HWPZZCPQSA-N 332.360 0.426 10 20 ECCD CC[C@H](OC)C(=O)N1CC(NC(=O)c2cc(OC)nc(OC)c2)C1 996367504 DAZVLCCJGZISDQ-LBPRGKRZSA-N 337.376 0.464 10 20 ECCD O=C(NCCC1=CCN(c2nccn3nnnc23)CC1)c1cocn1 1089820419 WGVOMAWHMNQMSP-UHFFFAOYSA-N 340.347 0.464 10 20 ECCD Cn1cc(C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)nn1 1089829815 YLGKERVFLCGNAB-UHFFFAOYSA-N 331.355 0.701 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)C[C@@H]3CCCO3)C2)cc(OC)n1 996369406 WMPAPGMOIINGQJ-ZDUSSCGKSA-N 349.387 0.609 10 20 ECCD Nc1ccc(CC(=O)N2CCC(c3nnc4n3CCNC4)CC2)cc1 1329497944 ALRXKDULYCBCEN-UHFFFAOYSA-N 340.431 0.912 10 20 ECCD CCS(=O)(=O)N1CCN(C(=O)NCCc2ccc(N)cc2)CC1 1335893310 UQUOIYGYDKOZQB-UHFFFAOYSA-N 340.449 0.488 10 20 ECCD O=S(=O)(c1cccnc1-c1nn[nH]n1)N1Cc2cccc(O)c2C1 1582802075 XJNZRCNMLRCSPR-UHFFFAOYSA-N 344.356 0.672 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCC(=O)NC3=O)CC2)cc1 212886502 SKTDJOWTYFOFJA-UHFFFAOYSA-N 346.387 0.286 10 20 ECCD COc1ccc(N2CCN(CCS(=O)(=O)N(C)C)CC2)cc1F 286331878 IEBGAVNCXGVGQA-UHFFFAOYSA-N 345.440 0.848 10 20 ECCD Cc1nc(Cn2nnc(NC(=O)c3cccc(O)c3O)c2C)no1 803561476 BZBDZTQAKPWWOP-UHFFFAOYSA-N 330.304 0.990 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NOC3CCOCC3)ccc21 803687259 YZCDIMAYGARXTB-UHFFFAOYSA-N 347.415 0.912 10 20 ECCD C[C@H]1C[C@@H](CN)CN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 817991262 OFIGJRUCCWDLIM-ZFWWWQNUSA-N 332.448 0.907 10 20 ECCD Cc1ccc(C(=O)NCc2ccccc2S(N)(=O)=O)c(O)c1O 813758374 DHRIXPNLZAPYSD-UHFFFAOYSA-N 336.369 0.984 10 20 ECCD O=C(CNc1ccc(-c2nn[nH]n2)cn1)NCc1ccc(O)c(O)c1 826413745 PSFJPKZLLUIXJE-UHFFFAOYSA-N 341.331 0.401 10 20 ECCD C[C@@H](C(N)=O)N1CCC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1009675974 VAYHJFYCWSDHAF-GWCFXTLKSA-N 346.391 0.917 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CC[C@H](CN)C1 842152271 FRUGOZUGRGMGMA-ZFWWWQNUSA-N 332.448 0.921 10 20 ECCD CCN(CCCNC(=O)NCCc1ccc(N)cc1)S(C)(=O)=O 841725990 PUMASABQYXXJIA-UHFFFAOYSA-N 342.465 0.782 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)NCc2cccnn2)cc1 853006793 KHOYXHKCSACHHL-UHFFFAOYSA-N 330.344 0.693 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCc3ccnn3C)C2)cc(OC)n1 1020352422 NXGOAVWJJOSKDU-JOCQHMNTSA-N 345.403 0.883 10 20 ECCD COc1cccc(CNC(=O)c2cc(S(N)(=O)=O)c(C)o2)c1O 769508107 QOFIJJBUWRYFSL-UHFFFAOYSA-N 340.357 0.880 10 20 ECCD COc1cccc(CNC(=O)NC[C@@H]2CCCS2(=O)=O)c1O 767172905 LBFVATMWGREZOG-NSHDSACASA-N 328.390 0.777 10 20 ECCD CN(CC1(C)COC1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 862762601 LXHZUEDQHOCOFU-UHFFFAOYSA-N 328.390 0.872 10 20 ECCD O=C(CN1CC[C@H]1CO)NCc1ccc(N2CCOCC2)c(F)c1 934028784 ZVTZMPWOJCCPMG-AWEZNQCLSA-N 337.395 0.345 10 20 ECCD C/C=C(/C)C(=O)NCCNCc1nnnn1-c1ccc(OC)cc1 1125444153 SFRVKHFBMSOQMJ-QCDXTXTGSA-N 330.392 0.843 10 20 ECCD O=C(CO)N1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 793594918 USVIFCMFUPDFFQ-UHFFFAOYSA-N 337.395 0.299 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1cc(C)cn1 1324136403 NWKQRNZTSUJHFJ-ZDUSSCGKSA-N 347.371 0.893 10 20 ECCD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC(C(N)=O)C(N)=O)c1 1322721504 SELJEPIPOPTHMR-UHFFFAOYSA-N 348.790 0.817 10 20 ECCD O=C(O)c1c[nH]nc1S(=O)(=O)NCc1cccc(Cl)c1O 1602506749 OZIFFAGWAUZCGL-UHFFFAOYSA-N 331.737 0.945 10 20 ECCD CN1CCN(Cc2ccc(N3CCOCC3)cc2)C[C@@H](C(=O)O)C1 1598619781 SBVOLXJWYZFDAA-INIZCTEOSA-N 333.432 0.971 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1nnc(CCC(=O)O)n1 1598519492 TXVVMLDCDSGFJV-UHFFFAOYSA-N 346.391 0.415 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCC[C@@H](S(N)(=O)=O)C2)c1O 365817176 GZJNKSVFVMMTQO-SNVBAGLBSA-N 345.377 0.562 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCc3n[nH]c(=O)cc3C2)c1O 278516164 QZOXHHGTHMEREK-UHFFFAOYSA-N 332.316 0.951 10 20 ECCD O=C(N[C@H]1CCN(CCN2CCOCC2)C1)c1cc(O)cs1 734557298 CZGAPVUUNPMIJW-LBPRGKRZSA-N 325.434 0.590 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4CCN(C)[C@@H]4C3)nc12 831728274 DVBZQDMOYOPKQQ-SMDDNHRTSA-N 345.403 0.748 10 20 ECCD CCS(=O)(=O)N[C@H](C)C(=O)N[C@H](C)c1cc(OC)ccc1O 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UCCBBLJYBNCXRV-LBPRGKRZSA-N 344.433 0.923 10 20 ECCD CCOC(=O)[C@@H]1CNCCN1Cc1ccc([N+](=O)[O-])c(OC)c1O 1326991112 NVJLDLCTGLDFGA-LBPRGKRZSA-N 339.348 0.646 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCn1cnnn1 1332364875 QEHINPZYRYGJCA-UHFFFAOYSA-N 346.391 0.331 10 20 ECCD O=C([C@H]1CCCO1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249767 XISQZCCMQLYNQN-GFCCVEGCSA-N 347.371 0.489 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCC[C@H](S(N)(=O)=O)C2)c1O 365815712 GZJNKSVFVMMTQO-JTQLQIEISA-N 345.377 0.562 10 20 ECCD CCNC(=O)CN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 273605361 MHRUUCBSZSNKTP-UHFFFAOYSA-N 337.420 0.971 10 20 ECCD C[C@@H](OC(=O)c1cc(O)cs1)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1 732354284 IXOBODUNCJGHGR-RKDXNWHRSA-N 347.414 0.645 10 20 ECCD COCCNCC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 832172803 KBAUPFJMMHDDDA-UHFFFAOYSA-N 348.447 0.207 10 20 ECCD C[C@H](N[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 1001031919 PUJKOBJDRCKZCK-GWCFXTLKSA-N 346.391 0.917 10 20 ECCD CNCCCNC(=O)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 842070068 LKBCXJAOPLHEBI-CQSZACIVSA-N 334.464 0.834 10 20 ECCD CN(C)C(=O)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851925682 YYVKYRVWXBJZIY-UHFFFAOYSA-N 334.420 0.535 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)CCCC(=O)NC)nc12 753206377 JLZAKBSIPNOLMY-UHFFFAOYSA-N 349.391 0.570 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NC[C@H]1CCN1C 930865896 GXMTVXIRJQWPSV-RHSMWYFYSA-N 346.475 0.929 10 20 ECCD CNC(=O)NCCC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891248824 NMFSIDUPPSJIGK-OAHLLOKOSA-N 335.452 0.791 10 20 ECCD COc1ccc(CN2CCN(c3cnn(C)c3)C(=O)C2)c(O)c1OC 892075100 KVTORJWYHJZJCJ-UHFFFAOYSA-N 346.387 0.992 10 20 ECCD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccnn2C)cc1 797432714 OWGNLFOYIAHFGD-UHFFFAOYSA-N 345.406 0.097 10 20 ECCD CNC(=O)NCCC(=O)NCCC1=CCN(c2cc(C)ncn2)CC1 1089828539 AASLLPDSXFGHQH-UHFFFAOYSA-N 346.435 0.747 10 20 ECCD CC(=O)N[C@H](C)C(=O)NCCC1=CCN(c2ccnc(C)n2)CC1 1089800143 XNSKLEZFABOPHK-GFCCVEGCSA-N 331.420 0.952 10 20 ECCD COCc1nccc(NC(=O)C(=O)NCc2ccc(OC)cc2O)n1 1329570208 FSNLQLJTLXAHRM-UHFFFAOYSA-N 346.343 0.592 10 20 ECCD Cn1[nH]c(C2CCNCC2)nc1=NC(=O)Cc1ccc(O)c(O)c1 1579993858 KBEGXEGVBQKNFD-UHFFFAOYSA-N 331.376 0.296 10 20 ECCD O=C1NC(=S)NC(=O)C1=CNCc1ccccc1CN1CCCC1 52536904 KZVFVCUDXNSHRX-UHFFFAOYSA-N 344.440 0.787 10 20 ECCD C[S@@](=O)CCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 735094932 QEDIOQZYRNFSRQ-HSZRJFAPSA-N 343.424 0.840 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CC[C@H](CN)C3)ccc21 842149784 FKXWMTWKCGJQPT-BBRMVZONSA-N 344.459 0.929 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCN(C)CC2)cc1 846289897 MDNBFTLINAACMB-UHFFFAOYSA-N 348.447 0.364 10 20 ECCD C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CC[C@H]1NCC(N)=O 1036304605 CNANXTHMJDJOFH-ZWNOBZJWSA-N 346.391 0.775 10 20 ECCD COc1ccc(N2CCCN(C(=O)CN3CCNCC3)CC2)cc1 876732961 KNHAUSACSSVBKL-UHFFFAOYSA-N 332.448 0.639 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CCO[C@H](C)C3)CC2)cc1 779216074 MZVKISYTUHMALO-SJLPKXTDSA-N 349.475 0.899 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CC[C@H]2C(N)=O)N(C)C)cc1 891248384 MBDRUOOVMUQMHR-OAGGEKHMSA-N 332.448 0.983 10 20 ECCD CCOCCOC[C@@H](O)CNC(=O)/C=C\c1ccc(O)c(O)c1 792043073 AXTMFVZUULXSOO-AGLBCWCQSA-N 325.361 0.641 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@@]34COC[C@@H]3C4)C2)cc(OC)n1 996379294 PNTLMNPKLHPZNZ-GTNSWQLSSA-N 347.371 0.076 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCc3ncn(C)n3)ccc21 1322547388 JROYBVQQJCSATD-UHFFFAOYSA-N 342.403 0.130 10 20 ECCD C[C@@]1(O)CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1323018821 JHNLDRLLZBPVDR-GOSISDBHSA-N 329.400 0.662 10 20 ECCD C[C@H](O)Cc1cn(CC(=O)N(C)Cc2ccc(N(C)C)cc2)nn1 1333532954 IOPXZGBHDFQLNC-ZDUSSCGKSA-N 331.420 0.926 10 20 ECCD C[C@H](NC[C@]1(OCCO)CCOC1)c1cc(C(=O)O)ccc1O 1604336164 DDQHQTHVTCJWRK-MEDUHNTESA-N 325.361 0.909 10 20 ECCD C[C@@H](N[C@@H]1CCC(=O)N(C)C1=O)c1cccc(-c2nn[nH]n2)c1O 1589955931 NRAMLRIPLYOOAI-LDYMZIIASA-N 330.348 0.370 10 20 ECCD CCS(=O)(=O)NCCCNCc1ccc([N+](=O)[O-])c(OC)c1O 278868502 MSDIBHDRBZNMJP-UHFFFAOYSA-N 347.393 0.728 10 20 ECCD C[C@H](O)CCN(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 285603667 BWVUTUQZGRPBLT-NSHDSACASA-N 325.384 0.737 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CC(=O)N[C@H](C)C3)CC2)cc1 296376046 XSXUJUIFGTYHPN-CQSZACIVSA-N 346.431 0.164 10 20 ECCD N[C@@H]1CCN(C(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 817914933 CNCUOOZGQRVJTH-HUUCEWRRSA-N 347.415 0.459 10 20 ECCD CNS(=O)(=O)CC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 819584106 DEZKFTZDASLHBA-LBPRGKRZSA-N 341.433 0.187 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCOC3=O)CC2)c(OC)c1 825208951 SSPTVSGMUBKYAL-UHFFFAOYSA-N 349.387 0.805 10 20 ECCD CN(C)[C@H](CNC(=O)C(=O)NCCc1ccc(N)cc1)c1ccco1 842024012 LBIDQJPIBKBFFW-OAHLLOKOSA-N 344.415 0.940 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@]3(CCCN3)C2)cc1F 842148360 MOWXTMYKRMFBGY-SFHVURJKSA-N 348.422 0.862 10 20 ECCD COc1ccc(O)c(CNC(=O)N[C@@H]2CCN(S(C)(=O)=O)C2)c1 844975805 UBABARHMZZARBO-LLVKDONJSA-N 343.405 0.234 10 20 ECCD O=C(OCC(=O)N1CCN(C(=O)C2CC2)CC1)c1cccc(O)c1O 758547921 NZJXPAORZREWCL-UHFFFAOYSA-N 348.355 0.335 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N(C)CCOCCN 863754003 LRMYLXDHZXCLGM-UHFFFAOYSA-N 337.420 0.565 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CN(CCO)CCO2)cc1 1035623732 DPDCSSSTIWUTJT-ZDUSSCGKSA-N 335.364 0.272 10 20 ECCD CC(C)OCCS(=O)(=O)NCC(=O)NCc1ccc(O)c(O)c1 778923509 ONJLOXBEZKASEQ-UHFFFAOYSA-N 346.405 0.058 10 20 ECCD CN1CCN(c2ccc(CN3C(=O)N[C@@]4(CCOC4)C3=O)cc2)CC1 877880266 IEOVPAWBWCVFAF-GOSISDBHSA-N 344.415 0.649 10 20 ECCD CNC(=O)CN1CC([C@H](C)NC(=O)c2ccc(N=NC(N)=O)cc2)C1 970953581 GTQATRRYNAMAKB-JTQLQIEISA-N 346.391 0.645 10 20 ECCD COC[C@H]1C[C@@H](O)CN1C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1328941437 DLTHFAMJCYGQTB-APHBMKBZSA-N 349.431 0.538 10 20 ECCD O=C1CCN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)CCN1 108788985 SQUOXDNCWMXJDI-ZZXKWVIFSA-N 329.400 0.885 10 20 ECCD O=S(=O)(NCc1ccccc1O)N1CCC2(CC1)OCCO2 271136497 UCESUQPAMNBWHU-UHFFFAOYSA-N 328.390 0.566 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(=O)N(CCN(C)C)C1 273160414 KETBVBMRMJKPFQ-GXTWGEPZSA-N 349.431 0.555 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)CNS(=O)(=O)N(C)C 816914638 ZGYRJJNLQIAKFI-UHFFFAOYSA-N 329.422 0.527 10 20 ECCD CCOC(=O)CN(CCN1C(=O)N[C@@H](C)C1=O)Cc1ccccc1O 823576757 XTCXQNBWTKVYAO-LBPRGKRZSA-N 349.387 0.698 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCN(C)C(=O)C1 839220533 KQIOWYLOAXAZJR-UHFFFAOYSA-N 346.431 0.402 10 20 ECCD CC(CO)(CO)NC(=O)NCc1ccc(N2CCSCC2)cc1 844888417 DDMZCHPRBQAWIF-UHFFFAOYSA-N 339.461 0.782 10 20 ECCD COc1cccc(CNC(=O)N[C@@H]2CCN(S(C)(=O)=O)C2)c1O 845421024 ZEDZASDYCOHJLR-LLVKDONJSA-N 343.405 0.234 10 20 ECCD NCCC(=O)NC[C@H]1CCCCN1Cc1cc2c(cc1O)OCO2 843122826 VNQHJYBXHGSQQA-CYBMUJFWSA-N 335.404 0.940 10 20 ECCD CN1CCN(c2ccc(CN3C(=O)[C@H]4COCCN4C3=O)cc2)CC1 925082205 IFBSBNMMDIFDLW-MRXNPFEDSA-N 344.415 0.601 10 20 ECCD C[C@@H](OC(=O)c1cccc(O)c1O)C(=O)N1CCC[C@@H](C(N)=O)C1 758562299 QIFBLDDLRLPYSL-NXEZZACHSA-N 336.344 0.367 10 20 ECCD Nc1nccnc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856211291 LCEQHTSLIOXHCU-UHFFFAOYSA-N 327.388 0.950 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CC(OC)C3)CC2)cc1 759048399 FVKHOBHFIGKXQF-INIZCTEOSA-N 335.448 0.509 10 20 ECCD 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COc1cc(C(=O)NC2CN(C(=O)c3cnccn3)C2)cc(OC)n1 996368814 NLAJJNOZTGHGII-UHFFFAOYSA-N 343.343 0.143 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3ccoc3)C2)cc(OC)n1 996368387 MEJSAPNYQLPHQT-UHFFFAOYSA-N 331.328 0.946 10 20 ECCD CCN1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1=O 1332617181 QKAXRPYUQOCMHI-HNNXBMFYSA-N 346.431 0.414 10 20 ECCD C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)[C@@H]1CCNC1=O 1755327476 DSYFYLNEUMBKAV-GXFFZTMASA-N 346.391 0.788 10 20 ECCD CN(C)c1ccc(CN2CCO[C@@H](Cn3cc(C(=O)O)nn3)C2)cc1 1777039673 BDJKFURLVAHYEM-OAHLLOKOSA-N 345.403 0.943 10 20 ECCD CCOCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796599513 TXOCJTFCZGCYEL-CLLJXQQHSA-N 349.387 0.781 10 20 ECCD CS(=O)(=O)NCCC(=O)NCc1c(O)ccc2c1CCCC2 75160045 JGJXALHBSOFUFO-UHFFFAOYSA-N 326.418 0.827 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cc([C@@H](C)O)nn3)CC2)cc1 268819984 JPQVSPWUSAMETO-CYBMUJFWSA-N 345.403 0.689 10 20 ECCD COc1cc(O)c(CN2CCC3(CC2)NC(=O)N(C)C3=O)cc1OC 289543926 XBKHJMYVJOJQAG-UHFFFAOYSA-N 349.387 0.926 10 20 ECCD C[C@H](C[S@](C)=O)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 283466551 LHHLFQQEXWWXKC-XFNZEKPQSA-N 325.434 0.252 10 20 ECCD COc1ccc(N2CCN(CCCNC(=O)[C@@H](C)CN)CC2)cc1 286110586 OBZVFDRKUMIVAS-HNNXBMFYSA-N 334.464 0.918 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(CC)CC(=O)N(C)C)nc12 735870266 QVUCTPDUMBWGDQ-UHFFFAOYSA-N 349.391 0.522 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)CCCS(C)(=O)=O)cc1 832272577 HEMJQTFQQVDBDS-CQSZACIVSA-N 327.450 0.693 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)N1CCCNCC1 842093112 OSCICAUSBCGDQO-UHFFFAOYSA-N 328.463 0.563 10 20 ECCD O=C(CCCN1C(=O)CNC1=O)NCc1cc(Cl)ccc1O 846478693 DNELLPLBDLUZOA-UHFFFAOYSA-N 325.752 0.994 10 20 ECCD CC1(C)OC[C@@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)O1 769213140 AHRAICWQXLDKKD-SNVBAGLBSA-N 344.389 0.645 10 20 ECCD Cc1cccc(O)c1CN1CCN(C(=O)C(=O)N2CCOCC2)CC1 876552502 AXRHUPWVXILZRJ-UHFFFAOYSA-N 347.415 0.204 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H](O)C3)CC2)cc1 779217887 JJRCOJJWKVGBTM-MSOLQXFVSA-N 349.475 0.635 10 20 ECCD CN1CCN(c2ccc(CNS(=O)(=O)C3COC3)cc2)CC1 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COC(=O)C[C@@H]1C(=O)NCCN1Cc1cc(OC)c(OC)cc1O 271827736 QEUQKOYWIMWWLC-LLVKDONJSA-N 338.360 0.273 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CCc3nnnn3CC2)c1O 817418666 BBGDOXQPBNYBNG-SNVBAGLBSA-N 334.336 0.790 10 20 ECCD C[C@H](N)C[C@H](C)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 843259878 SKKUZISKPRKWIG-KBPBESRZSA-N 330.432 0.921 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(S(N)(=O)=O)CC1 845310273 NTZCAXRIKPHGBB-UHFFFAOYSA-N 325.434 0.922 10 20 ECCD COc1ccc(CNC(=O)CCN2C(=O)CCNC2=S)c(O)c1 848024306 YZXRTQCRLVEWTF-UHFFFAOYSA-N 337.401 0.514 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2COC[C@H]2C)cc1 932087764 AFCXTQMFKISVSA-CJNGLKHVSA-N 349.431 0.741 10 20 ECCD COC[C@H]1CCCN1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 862597609 NCNKUCYGCKBNPH-LLVKDONJSA-N 343.405 0.519 10 20 ECCD CCS(=O)(=O)N1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779481957 UGHZFZGWSVWANK-XQRVVYSFSA-N 340.401 0.605 10 20 ECCD CNC(=O)CC(=O)NCCC1=CCN(c2cc(C)nc(C)n2)CC1 1089823026 UYCDCQYBSBVGRG-UHFFFAOYSA-N 331.420 0.872 10 20 ECCD NC(=O)C(=O)NCCC1=CCN(c2cccc(F)c2[N+](=O)[O-])CC1 1089862572 WONMSXARHKHCPA-UHFFFAOYSA-N 336.323 0.862 10 20 ECCD C[C@@H](NC(=O)C(=O)NCCCC(=O)N(C)C)c1ccc(N(C)C)cc1 1323257640 UQQMNHHMCLTHRR-CYBMUJFWSA-N 348.447 0.914 10 20 ECCD C[C@H](NC(=O)C(=O)N[C@@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 1329304812 XLNPLWMEEPSVBD-WCQYABFASA-N 332.404 0.277 10 20 ECCD CCOc1ccc(N2CCN(S(=O)(=O)C3COC3)CC2)cc1 1255778444 CVMARJDWDZKRHO-UHFFFAOYSA-N 326.418 0.936 10 20 ECCD C[C@H](CNCc1ncnn1C)NC(=O)c1ccc(N=NC(N)=O)cc1 1754256076 MNNWHSSIUKIMQJ-SNVBAGLBSA-N 344.379 0.886 10 20 ECCD CN(CCN1C(=O)CNC1=O)Cc1ccc(N2CCOCC2)cc1 104944802 YNOVLQIANJFPNJ-UHFFFAOYSA-N 332.404 0.507 10 20 ECCD CN(C)c1ccc(CNC(=O)C(C)(C)NS(C)(=O)=O)cc1F 173326025 AQUINLJOGBCZTF-UHFFFAOYSA-N 331.413 0.836 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H](C)S(C)(=O)=O)CC2)cc1F 84814767 DFNRPPFZNPKQBJ-NSHDSACASA-N 344.408 0.916 10 20 ECCD CS(=O)(=O)N1CCC[C@H](C(=O)NCc2ccc(O)c(O)c2)C1 528864856 TWOLAJWXFCQXJR-NSHDSACASA-N 328.390 0.386 10 20 ECCD COC[C@@H](CCO)NC(=O)NCc1ccc(N2CCOCC2)cc1 265823153 NCEOENPDDLHXEC-OAHLLOKOSA-N 337.420 0.720 10 20 ECCD COCCO[C@@H]1C[C@H](CO)CN(Cc2cc3c(cc2O)OCO3)C1 278736373 QZDMCJUOWOWAHG-GXTWGEPZSA-N 339.388 0.967 10 20 ECCD COc1cccc(CNC(=O)[C@H]2CCCN2S(C)(=O)=O)c1O 729858802 DKJZJRIBGNOBOU-LLVKDONJSA-N 328.390 0.441 10 20 ECCD O=C1NCC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 829263600 LTQDRVBENUXMMM-ZDUSSCGKSA-N 335.379 0.539 10 20 ECCD CC[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)OC 849322955 VLOXGKUTZZCVDS-HNNXBMFYSA-N 340.445 0.963 10 20 ECCD Cc1nn(CC(=O)NCc2ccc(N3CCOCC3)cc2)c(=O)n1C 847381199 GEXCSHHZJHAWTK-UHFFFAOYSA-N 345.403 0.043 10 20 ECCD O=C1CNCCN1[C@@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1 843063501 BSJIXSBBEHTRSY-CYBMUJFWSA-N 333.388 0.517 10 20 ECCD O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)c1cc(O)cs1 755863463 ABVHMDYYTFKLBH-VDUILEQBSA-N 332.381 0.991 10 20 ECCD COC[C@H](C)NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 758183956 CAMWDVAHLJXYMT-DOTOQJQBSA-N 337.464 0.803 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCc3ncnn3C)C2)cc(OC)n1 1020352304 HXFDDOAYBOYKTO-HAQNSBGRSA-N 346.391 0.278 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNC3CCOCC3)CC2)cc1 758210268 OSKQZBFJDAKNMW-GOSISDBHSA-N 349.475 0.947 10 20 ECCD Cc1ccc(CN[C@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)c(O)c1 877037401 PSFCQZRCTRXEQB-LSDHHAIUSA-N 340.445 0.288 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cccnc3)C2)cc(OC)n1 996367837 GOZBJTPWMBDLNA-UHFFFAOYSA-N 342.355 0.748 10 20 ECCD COc1cccc(CNC(=O)c2cc(-c3nn[nH]n3)ccn2)c1O 1605316610 CBVMOZBPIQKKRI-UHFFFAOYSA-N 326.316 0.906 10 20 ECCD C[C@@H](CN)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1795956309 SXMZOFQTNYBQFO-SYEHKZFSSA-N 348.403 0.339 10 20 ECCD COCCN(CC(=O)N1CCNC1=O)c1ccc(OC)c(OC)c1 267645014 WNLVRZWSXBFZOS-UHFFFAOYSA-N 337.376 0.708 10 20 ECCD COc1ccc(O)c(CNC(=O)c2cn(CC3(C)COC3)nn2)c1 371899668 QFBIHIAZLPCSGH-UHFFFAOYSA-N 332.360 0.959 10 20 ECCD NC(=O)[C@@H]1CC[C@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)O1 819170757 OBJRXEQABBPQJG-YPMHNXCESA-N 333.344 0.189 10 20 ECCD C[C@H](NC(=O)C(=O)NC[C@@H]1CNCCO1)c1ccc(N(C)C)cc1 842202928 MTRQKQQVCQLAMW-WFASDCNBSA-N 334.420 0.034 10 20 ECCD CCN1CC[C@H](NC(=O)CN(CC(=O)O)c2ccc(OC)cc2)C1=O 853008299 NSKWWVDMFPEBDB-AWEZNQCLSA-N 349.387 0.323 10 20 ECCD COc1ccc(N2CCN(CCN[C@@H]3C(=O)NCC3(C)C)CC2)cc1 924833419 WFRBNZKQCFYTFN-QGZVFWFLSA-N 346.475 0.931 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)C[C@H]3C[C@@H](O)C3)nc12 859969258 CSNOKBDJDVDEMS-KLPPZKSPSA-N 334.376 0.814 10 20 ECCD O=C(CCN1CCOCC1)NCc1ccc(N2CCOCC2)cc1 750866413 DTLAOYYZELDILW-UHFFFAOYSA-N 333.432 0.862 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)Cn3cnc(N)n3)C2)cc1 868955594 LOGRZNCKHIFBEC-LBPRGKRZSA-N 330.392 0.512 10 20 ECCD CC(C)[C@H](NS(C)(=O)=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773739690 ISFGJGCJVIZGGG-YGRLFVJLSA-N 344.433 0.719 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H](O)C3)CC2)cc1 779217897 JJRCOJJWKVGBTM-ZWKOTPCHSA-N 349.475 0.635 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H](C)O)CC2)cc1 778238318 NDPOBFZGSNPQHW-WBTMPAOCSA-N 347.415 0.397 10 20 ECCD C[C@@H](NCCS(=O)(=O)N1CCOCC1)c1c(O)cccc1F 886545368 LOKIZSCMEMCCDD-LLVKDONJSA-N 332.397 0.844 10 20 ECCD NOCCCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1120570316 CYYKQADQNVWLQS-UHFFFAOYSA-N 340.399 0.866 10 20 ECCD CS(=O)(=O)CCn1ccc(NC(=O)c2cccc(O)c2O)n1 790766971 DJMKGNDHSOKGBN-UHFFFAOYSA-N 325.346 0.591 10 20 ECCD CCN(C)c1ccc(Cn2cc(CCNS(C)(=O)=O)nn2)cc1 1330796080 VDHBFNYJZAEXIV-UHFFFAOYSA-N 337.449 0.874 10 20 ECCD CO[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1332956030 IAFSIPGVYVMUIM-AWEZNQCLSA-N 348.447 0.206 10 20 ECCD Nc1ccc(NC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1 1345811351 HBKFHPGQFIAGTH-MFKMUULPSA-N 337.401 0.243 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC(C(C)(C)O)C1 1344960288 WIYKVEYJUXXRSC-UHFFFAOYSA-N 333.432 0.940 10 20 ECCD CC(=O)C(=O)COC(=O)C(C)(C)c1cc(F)cc(-c2nn[nH]n2)c1 1602911296 BEGVFRJKLONPMN-UHFFFAOYSA-N 334.307 0.985 10 20 ECCD O=C(CSc1ncc(C(=O)O)s1)N[C@H]1CCS(=O)(=O)C1 1601350977 STIPYOBBEXVERR-LURJTMIESA-N 336.416 0.237 10 20 ECCD C[C@]1(C(=O)O)CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 1593765280 PSFPHWVGNPGIHS-KRWDZBQOSA-N 333.388 0.641 10 20 ECCD COc1ccc(CNC(=O)c2cccn(CC(=O)O)c2=O)c(O)c1 1594094554 LLNKSLQWRSYXAY-UHFFFAOYSA-N 332.312 0.577 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCNC(=O)C2CC2)c1 55093430 SPTBHRMHSMGTAL-UHFFFAOYSA-N 341.389 0.020 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCc4[nH]ncc4C3)nc12 118854612 PKLSFBANNLRNSA-UHFFFAOYSA-N 342.359 0.893 10 20 ECCD CC(=O)N1CCC(NC(=O)CN(C)c2ccc3c(c2)OCO3)CC1 270346479 OWIIRDXZPJQOIR-UHFFFAOYSA-N 333.388 0.979 10 20 ECCD CNC(=O)NCCC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 819590217 JHAGFPACNAKOLV-CYBMUJFWSA-N 334.420 0.957 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCOC[C@@H]1C(=O)O 823659634 JWAQLQIWEMNYQD-OAHLLOKOSA-N 335.404 0.496 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2CCC(=O)N(C)C2=O)c1 823905664 KHLAWJAGIDJKIY-CABZTGNLSA-N 335.360 0.908 10 20 ECCD CNC(=O)CCN(C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823554197 RIMDMCSRZKNMCS-UHFFFAOYSA-N 348.447 0.925 10 20 ECCD C[S@](=O)CCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 735116282 GEHOQYLYIXZIHJ-FQEVSTJZSA-N 334.419 0.262 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4CNC[C@H]4C3)nc12 917199236 WQVSFRVSFQXZCI-QWRGUYRKSA-N 331.376 0.263 10 20 ECCD C[C@H]1CCN(S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)C1 842784845 MMJDLHBPGNSZOH-SWLSCSKDSA-N 326.466 0.929 10 20 ECCD O=C(N[C@@H]1CCNC1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 842227126 YWAXEJHLDRRDDK-HUUCEWRRSA-N 347.415 0.378 10 20 ECCD COc1ccc(O)c(CNS(=O)(=O)N2CCC(OC)CC2)c1 849376931 AGFRWXUKBOBHCV-UHFFFAOYSA-N 330.406 0.846 10 20 ECCD CS(=O)(=O)[C@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 763385576 WBJSLRXPIFWYCU-SMDDNHRTSA-N 327.402 0.827 10 20 ECCD CNC(=O)CN1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1039062427 WXIWCQRPTQEUFI-LBPRGKRZSA-N 332.364 0.399 10 20 ECCD CCN(C(C)=O)C1CN(Cc2nnnn2-c2ccc(OC)cc2)C1 949544418 LSNRMGKRXFNEOV-UHFFFAOYSA-N 330.392 0.724 10 20 ECCD CCn1[nH]nnc1=NC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 888332855 LSNLTJKHFVEUDN-UHFFFAOYSA-N 349.370 0.617 10 20 ECCD O=C1CN(CCCNCc2ccc(N3CCC(O)CC3)cc2)CCN1 883153035 PCFLDGQXAFGDTI-UHFFFAOYSA-N 346.475 0.559 10 20 ECCD CN1CC[C@H](C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 899473760 XBCIOBIKGFKPHO-INIZCTEOSA-N 344.459 0.956 10 20 ECCD COc1ccc(CNC(=O)[C@@H]2CCCN2S(C)(=O)=O)c(O)c1 794382368 ARCOJHBVBKICOL-LBPRGKRZSA-N 328.390 0.441 10 20 ECCD CN(C)CCNC(=O)Cn1cc(NC(=O)c2cccc(O)c2O)cn1 790775657 BYTJRMAMIRBPSB-UHFFFAOYSA-N 347.375 0.224 10 20 ECCD COCCNCC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1337105959 SFQFJXLDIXQUKP-UHFFFAOYSA-N 348.447 0.241 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)NCC[C@H](C)N)C2)cc1 1333624443 FQFALWDQGDCPQG-KBPBESRZSA-N 348.447 0.491 10 20 ECCD COc1ccc(CNC(=O)N[C@H](C)[C@@H]2CN(C)CCN2C)c(O)c1 1347183893 BQFCSXLGTJIALZ-DOMZBBRYSA-N 336.436 0.834 10 20 ECCD CN(c1nnc(-c2sccc2O)n1C)[C@H]1CCS(=O)(=O)C1 1355344602 NFPNBRHDVHBGQS-QMMMGPOBSA-N 328.419 0.873 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@]12CNC[C@@H]1CCO2 1578489842 PUWZQMJARQCVDQ-QFBILLFUSA-N 345.443 0.860 10 20 ECCD COC[C@H](C)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1841662067 OUUFDWNXFRFINR-NSHDSACASA-N 349.387 0.592 10 20 ECCD COc1ccc(CN[C@@H](CO)CNC(=O)c2[nH]cnc2C)cc1C 1755648707 IHGUYDNYSMHGRL-CQSZACIVSA-N 332.404 0.916 10 20 ECCD O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)N1CCNC1=O 70976664 CDZUJAKOFNVKSS-CQSZACIVSA-N 333.388 0.925 10 20 ECCD CS(=O)(=O)NCc1ccc(C(=O)NCCc2ccc(N)cc2)o1 237386017 QVBCBUGVNZFCMK-UHFFFAOYSA-N 337.401 0.884 10 20 ECCD O=C1CC[C@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)N1 265603326 MSNNVHTTYCHAOT-MRXNPFEDSA-N 331.416 0.790 10 20 ECCD CCn1cnnc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 299112973 YPWQXINOJZNFCD-UHFFFAOYSA-N 339.377 0.305 10 20 ECCD NC(=O)[C@@H]1CC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 816891398 RPYDVNKDPGLBTN-ZIAGYGMSSA-N 349.406 0.915 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@H](O)Cn1ccnn1 838477157 FALWLOPCLDNULE-OAHLLOKOSA-N 332.408 0.513 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CN1CCOCC1=O 839922263 SQXLKJLVLRMKPN-CQSZACIVSA-N 333.432 0.967 10 20 ECCD C[C@@H](C[C@@H](C)N)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 843260498 WZNMSNFIKGTEPH-KGLIPLIRSA-N 348.447 0.381 10 20 ECCD CS(=O)(=O)N1CC(CNC(=O)NCc2cc(Cl)ccc2O)C1 845131680 NBFQFGMWHAGORS-UHFFFAOYSA-N 347.824 0.736 10 20 ECCD O=C1NCCC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 869295533 YTAAUYGJGTUMJD-INIZCTEOSA-N 331.416 0.790 10 20 ECCD COc1ccc(-n2nnnc2CN2CC(NC(=O)C3CC3)C2)cc1 1030040143 NZBHUORRCQQRHS-UHFFFAOYSA-N 328.376 0.381 10 20 ECCD COCCNC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 887342349 VJDDSRZBNOELMA-UHFFFAOYSA-N 334.420 0.834 10 20 ECCD COCCn1nc(C(=O)NCc2ccc(OC)cc2O)ccc1=O 794376882 KOPICHHDXKMVAD-UHFFFAOYSA-N 333.344 0.534 10 20 ECCD C[C@H]1COC[C@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1333342078 OHDRTAJPEWTNQG-XJKSGUPXSA-N 329.400 0.830 10 20 ECCD C[C@H](N)CCNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1331319667 PMJRHGKAEDISER-AWEZNQCLSA-N 348.447 0.335 10 20 ECCD CCOc1ccc(N2CCN(C(=O)CN3CCNC(=O)C3)CC2)cc1 1331924260 TZFFSGNKPUCNRA-UHFFFAOYSA-N 346.431 0.166 10 20 ECCD COc1ccc(N2CC[C@@H](N=c3cc[nH]c(-c4nn[nH]n4)n3)C2)cc1 1605291521 WJUXBOLVVARQTJ-LLVKDONJSA-N 338.375 0.778 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)C2(F)CC2)C1 1845892981 WVHHTDZABDDEKB-UHFFFAOYSA-N 335.335 0.812 10 20 ECCD CC(=O)NCC(=O)N1CCCN(C(=O)c2ccc(C)c(O)c2O)CC1 529916138 DJYGFKBFJRYHKT-UHFFFAOYSA-N 349.387 0.217 10 20 ECCD COCCN(C)S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 264759009 OIWPTBNESJWAIG-UHFFFAOYSA-N 343.449 0.436 10 20 ECCD NC(=O)[C@H]1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)CCO1 264576418 UGONVQAASLSBMT-WUTVXBCWSA-N 345.399 0.249 10 20 ECCD Cc1ccc(C(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)c(O)c1O 272710680 DTBGMYJVDAUUBW-SNVBAGLBSA-N 328.390 0.418 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCO[C@H](CNC(C)=O)C2)c1O 278168523 FMVGMIJQWSKVJR-GFCCVEGCSA-N 339.348 0.646 10 20 ECCD COc1cccc(CNC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1O 815834300 CNTRYPHIMCYDGC-BETUJISGSA-N 344.367 0.968 10 20 ECCD NCCNC(=O)[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 843047926 BXBYGWKQGOQVKW-QGZVFWFLSA-N 346.475 0.810 10 20 ECCD CNCCCNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 841721911 KWSNFVYZGCECHJ-HNNXBMFYSA-N 347.463 0.797 10 20 ECCD CC[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)OC 762806014 XMELPTTTYKDNFX-NSHDSACASA-N 331.346 0.872 10 20 ECCD CN1C(=O)[C@@H]2CN(Cc3ccc(N4CCOCC4)c(F)c3)C[C@@H]2C1=O 877720356 OINOPYOLJGBSCX-OKILXGFUSA-N 347.390 0.709 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CC[C@H](S(N)(=O)=O)C2)c1O 775109615 ZJVIAFHPPHDJLT-VIFPVBQESA-N 331.350 0.172 10 20 ECCD CN1CCN(c2ccc(CNS(=O)(=O)c3ccnn3C)cc2)CC1 882663291 UNCBTQJFRIZMFD-UHFFFAOYSA-N 349.460 0.650 10 20 ECCD CCN1CCO[C@@H](C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 881851032 NLCCUVIQWRBGSI-GOSISDBHSA-N 346.475 0.775 10 20 ECCD O=C1NCCC[C@H]1C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089848670 KSXZRJVLFDYRMF-CYBMUJFWSA-N 347.394 0.785 10 20 ECCD CNC(=O)Cc1noc(COC(=O)/C=C\c2ccc(O)c(O)c2)n1 1320277724 GRBRXLXLUOKPAC-HYXAFXHYSA-N 333.300 0.526 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H]2NC(=O)CC[C@H]2C1 1327316490 KLCOIYWVTNALGZ-GXTWGEPZSA-N 345.399 0.478 10 20 ECCD COCCNC(=O)C1(N[C@@H](C)c2cccc(-c3nn[nH]n3)c2O)CC1 1605105892 GGRHRTRXIZMAHR-JTQLQIEISA-N 346.391 0.518 10 20 ECCD CN1CCN(c2ccc(CN3CCO[C@H](C(=O)O)C3)cc2F)CC1 1593787223 VCJBTRSKQHJFDL-INIZCTEOSA-N 337.395 0.863 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCCOC2)c1 55319189 GDYTYXPDEDIPKD-JTQLQIEISA-N 328.390 0.920 10 20 ECCD CN1CCN(c2ccc(CN3C[C@@H](O)C[C@@]3(C)CO)cc2F)CC1 1350328459 TYMSICUHDRMOFS-YJBOKZPZSA-N 337.439 0.895 10 20 ECCD COCCN(C(=O)c1ccc(C)c(O)c1O)[C@H]1CCS(=O)(=O)C1 271255930 IQAGVGNMTLOHTE-NSHDSACASA-N 343.401 0.682 10 20 ECCD O=C(NCCS(=O)(=O)NCC1CCC1)c1c(F)ccc(O)c1O 276569005 KEVLWBCKXPYCDF-UHFFFAOYSA-N 346.380 0.686 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](CC)[C@@H](O)C3)nc12 270872850 JJXRNGXXUICVGG-GWCFXTLKSA-N 334.376 0.814 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC(=O)NCC1(C)C 282842323 SVERNYSNIRQXHA-UHFFFAOYSA-N 332.448 0.921 10 20 ECCD C[C@@H](C[S@@](C)=O)NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 289550084 CZHSNZALTFIQBV-DAOPMYJZSA-N 339.461 0.594 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CCCC1 283204123 NDJLHTJUYMIDQC-UHFFFAOYSA-N 335.379 0.901 10 20 ECCD CCOCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 283139061 BIUYIYPLHBWVMP-UHFFFAOYSA-N 349.431 0.682 10 20 ECCD COC(=O)C[C@H](N)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 827459048 RHCOFQWTBYUCOU-HNNXBMFYSA-N 335.404 0.624 10 20 ECCD Cc1nn(C)c(=O)c(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)c1C 843299485 WKOSURLPNABVLX-HNNXBMFYSA-N 343.431 0.893 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NCCn3cccn3)C2)cc(OC)n1 1022368261 RDPZUCYKLJVPFX-OKILXGFUSA-N 345.403 0.846 10 20 ECCD COc1ccc(N2CCC(NC(=O)C(=O)N(C)C[C@H](C)N)CC2)cc1 861759588 MVTVOAWMAHEJMV-ZDUSSCGKSA-N 348.447 0.586 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cnc(N)n3)CC2)c(OC)c1 870166673 SKORDEZMDCFIDB-UHFFFAOYSA-N 346.391 0.226 10 20 ECCD C[C@@H]1C[C@H](N)CN1C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 884638285 SBKWGOWRNGIVOE-HIFRSBDPSA-N 330.432 0.851 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)C[C@@H]2COCCN2)N(C)C)cc1 1122328523 OBOXIKZJAUEZIN-NVXWUHKLSA-N 334.464 0.850 10 20 ECCD CC(C)N(C)C(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 898324307 LCICATYINNUIJJ-UHFFFAOYSA-N 332.448 0.921 10 20 ECCD Cc1nccnc1N(C)C(=O)C1=CC=CN2CCS(=O)(=O)N=C12 893291797 LYXVFWWOGRVGMK-UHFFFAOYSA-N 333.373 0.245 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)c3nnn(C)n3)CC2)nn1 1089853756 ISINCRKSMSTUJL-UHFFFAOYSA-N 328.380 0.265 10 20 ECCD O=C1NC(=O)C2(CCC(C(=O)NCCc3ccc(O)c(O)c3)CC2)N1 1319577280 NVHDGWKXAHAWHI-UHFFFAOYSA-N 347.371 0.525 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccn(C)n1 1329528767 DUJSCQARAGAZCH-ZDUSSCGKSA-N 347.371 0.664 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NCC[C@H](C)N)cc1 1330859502 GJSFCPVPHQQUNV-ZDUSSCGKSA-N 336.436 0.443 10 20 ECCD C[C@@H]1C[C@@H](NC(=O)c2c(F)ccc(O)c2O)C(=O)N1c1cnn(C)c1 1344112456 UCTUNMPNVYZZAN-LDYMZIIASA-N 348.334 0.894 10 20 ECCD O=C(O)c1cnn2c(O)cc(CN3CCC[C@H](n4ccnn4)C3)nc12 1349592227 OXGQJQPSVLQVIA-NSHDSACASA-N 343.347 0.562 10 20 ECCD C[C@H](NC1CN(S(=O)(=O)N(C)C)C1)c1cc(C(=O)O)ccc1O 1593231098 IOBJYSQRTNNTHE-VIFPVBQESA-N 343.405 0.232 10 20 ECCD CC(C)(O)CCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289212 LYIHJVQBYDUEQE-UHFFFAOYSA-N 331.416 0.956 10 20 ECCD NC(=O)[C@@H]1CC[C@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 816891080 IAARNFJMPWXOPP-CHWSQXEVSA-N 335.379 0.790 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N2CC[C@H](N3CCCC3)C2)cc1 842235466 GNFAOPRINYDCFZ-INIZCTEOSA-N 330.432 0.624 10 20 ECCD CN1CCN(c2ccc(CN3CCN([C@@H]4CCNC4)CC3)cc2)CC1 843124453 AZKIHGKMAQXKJO-HXUWFJFHSA-N 343.519 0.918 10 20 ECCD CCN1C[C@H](C)N(C(=O)C(=O)NCCc2ccc(N)cc2)C[C@H]1C 842242628 UFYVBHXCKLVCBK-KGLIPLIRSA-N 332.448 0.869 10 20 ECCD COC(=O)Cn1cc(CCOC(=O)/C=C/c2ccc(O)c(O)c2)nn1 759597353 RFLPBOSNCLTACQ-HWKANZROSA-N 347.327 0.661 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN3CC[C@H]2C3)c1 854730206 ZWHINXDRJYDWPL-NSHDSACASA-N 325.390 0.294 10 20 ECCD COc1ccc(CN[C@H]2C[C@H](NC(=O)Cn3ncnn3)C2)cc1C 1020158194 OGZRJAMLTMKSHS-HDJSIYSDSA-N 330.392 0.427 10 20 ECCD COC(=O)N1CCN(C(=O)C(=O)N(C)Cc2ccccc2O)CC1 1117843881 SVEDDYLCUQPOIT-UHFFFAOYSA-N 335.360 0.261 10 20 ECCD COc1ccc(CN(C)C[C@H](O)CN2CCOCC2)c(O)c1OC 892096503 UKRBGESRHNJYEM-AWEZNQCLSA-N 340.420 0.534 10 20 ECCD COc1ccc(CNCCNC(=O)CC2CS(=O)(=O)C2)cc1C 1130581662 VNOXGPURUOZVEI-UHFFFAOYSA-N 340.445 0.644 10 20 ECCD CN1C[C@H](C(=O)NCCC2=CCN(c3cccc(F)n3)CC2)NC1=O 1089855768 OZWREBUMANFQKC-CYBMUJFWSA-N 347.394 0.887 10 20 ECCD C[C@H](CC(N)=O)C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089850470 YQWATOAAYUKYFC-LLVKDONJSA-N 335.383 0.770 10 20 ECCD C[C@]1(C(=O)NCCC2=CCN(c3nccnc3F)CC2)CCNC1=O 1089864932 HPXMHNQFYHTHPC-QGZVFWFLSA-N 347.394 0.785 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CC(NC(=O)c3cc[nH]n3)C2)cc1 990293806 HDODILXLNKLQNW-UHFFFAOYSA-N 341.331 0.827 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CC[C@H](C(N)=O)C1 1326391768 VUJOSLIIFIPEBM-UONOGXRCSA-N 346.431 0.481 10 20 ECCD O=C(Cc1ccc(O)c(O)c1)NCc1cncc(-c2nn[nH]n2)c1 1582142283 NJKNCXNBISOLAD-UHFFFAOYSA-N 326.316 0.532 10 20 ECCD COCCCN(C(=O)Cc1ccc(N)cc1)[C@@H]1CCS(=O)(=O)C1 150747625 NKUFIGBIOSFGHZ-OAHLLOKOSA-N 340.445 0.864 10 20 ECCD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCCc2n[nH]cc21 280127668 OYYHHIHPHGNBMJ-UHFFFAOYSA-N 333.373 0.187 10 20 ECCD CCS(=O)(=O)N1CCN(C(=O)c2ccc(C)c(O)c2O)[C@H](C)C1 805365519 SWTZNFPLDGUCKO-LLVKDONJSA-N 342.417 0.902 10 20 ECCD NC(=O)[C@H]1CC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 816891397 RPYDVNKDPGLBTN-UONOGXRCSA-N 349.406 0.915 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H]3CCOC3)CC2)cc1 818976057 RVNDSVZTWXKKRW-WMZOPIPTSA-N 349.475 0.804 10 20 ECCD COc1ccc(N2CCC(NC(=O)C3(n4cnnn4)CC3)CC2)cc1 825426014 SYXRURNSOZAMSS-UHFFFAOYSA-N 342.403 0.956 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCn2cnnc2C1 732453238 UIONDEDPJKOBJP-UHFFFAOYSA-N 342.403 0.840 10 20 ECCD Cc1ccc(C(=O)OCc2nc(CS(C)(=O)=O)no2)c(O)c1O 744910528 QZEZUVGEOXRLBI-UHFFFAOYSA-N 342.329 0.691 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCC[C@H]2CCNC2)cc1F 842149441 ZVGNDJJNTJYJSL-GFCCVEGCSA-N 336.411 0.624 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@H](C)CN1 842170923 NZZDKORRHXZQIN-LSDHHAIUSA-N 342.443 0.888 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCO[C@H]([C@@H](C)N)C1)c1ccc(N(C)C)cc1 842203531 UDONRYUCCWSTSD-WWGRRREGSA-N 348.447 0.504 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC[C@H]1CNCCO1 851666534 IIRBTZAEZCKSID-QGZVFWFLSA-N 348.447 0.435 10 20 ECCD CC(C)(C)N1C[C@H](CNC(=O)C(=O)Nc2ccc(N)cc2)CC1=O 850852474 IDPJIKGWIQPDKE-NSHDSACASA-N 332.404 0.971 10 20 ECCD CC[C@@H]1C(=O)NCCCN1CC(=O)NCc1ccc(N(C)C)cc1 933220089 SABSSAZYZYCUNC-MRXNPFEDSA-N 332.448 0.969 10 20 ECCD COc1ccc(O)c(CNC(=O)CN(C)C(=O)[C@@H](C)n2cccn2)c1 769539720 UTDQKXZXSUWKGX-GFCCVEGCSA-N 346.387 0.933 10 20 ECCD COc1cc(C(=O)NC2CN([C@H](C)C(=O)NC3CC3)C2)cc(OC)n1 1030615085 XWWHGEZSZRLXAO-SNVBAGLBSA-N 348.403 0.180 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)N(CCO)CCN1CCOCC1 779537464 PNIOKJICBOXYQK-DUXPYHPUSA-N 336.388 0.264 10 20 ECCD C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@H](CO)O1 786724136 LLLYKZCECJCUNO-RHSMWYFYSA-N 349.431 0.814 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)NCc2cnnn2C)N(C)C)cc1 894873423 RUUUUJCSLDFJES-MRXNPFEDSA-N 345.451 0.983 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C(=O)NCC3CC3)cc2)CC1 897398018 QJCACPXZLHFYTD-UHFFFAOYSA-N 330.432 0.581 10 20 ECCD COc1ccc(CNCCNC(=O)C(=O)NCC(F)F)cc1C 1130643014 MGRRDPJRXIPFOF-UHFFFAOYSA-N 329.347 0.591 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3ncc[nH]3)C2)cc(OC)n1 973242924 VASFASAGQDMEPS-XYPYZODXSA-N 345.359 0.513 10 20 ECCD CCNC(=O)CC(=O)NCCC1=CCN(c2ccc(C)nn2)CC1 1089822079 NIJZVDOWWRMYOI-UHFFFAOYSA-N 331.420 0.954 10 20 ECCD COC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1332968299 CPEMRBRQZLEWAK-ZDUSSCGKSA-N 349.431 0.415 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnco1 1847926094 FBIRIBLOJCEXBY-QWRGUYRKSA-N 344.327 0.610 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCN3C(=O)NC[C@@H]3C2)cc1 175892668 QTOLWLJYKCHQRY-OAHLLOKOSA-N 331.420 0.078 10 20 ECCD O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NCc1ccccc1O 266650498 ZLWMOYIJIJTEIR-GBOPCIDUSA-N 330.340 0.171 10 20 ECCD CCN(C)C(=O)[C@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 276592722 LAFWLSJNWUPDCF-VIFPVBQESA-N 343.405 0.360 10 20 ECCD C[C@@H](C[S@@](C)=O)NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 285620595 DJQSWDJQKMRKKY-SDWAUSNYSA-N 343.424 0.391 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC[C@@H]1CO 284003472 KBJPESSBWKSHLR-MRXNPFEDSA-N 331.416 0.886 10 20 ECCD C[C@H]1c2nncn2CCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 283440760 JWTGGMBEXFJAKL-LBPRGKRZSA-N 342.403 0.564 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1COC(C)(C)OC1 806655338 NCTJTRXQWDRNBW-UHFFFAOYSA-N 349.431 0.979 10 20 ECCD N[C@H]1CCN(C(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 817914932 CNCUOOZGQRVJTH-GJZGRUSLSA-N 347.415 0.459 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=S)NCCNS(C)(=O)=O)c1 728792675 MLHDNEXGVPNXSY-SECBINFHSA-N 347.462 0.475 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](O)C3CC3)nc12 730884308 YSDVXRYLUDLDLX-LBPRGKRZSA-N 335.316 0.426 10 20 ECCD CCNC(=O)CCC(=O)NCc1ccc(N2CCN(C)CC2)cc1 918865442 LTCDUYOWJUVPRL-UHFFFAOYSA-N 332.448 0.971 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1C[C@@H](N)[C@H](C)C1 911050413 VYGZULRGRHYPDS-CKEIUWERSA-N 346.475 0.914 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@@H]3CCN3C)cc2)CC1 924007527 NVSKNPHFGVJMSK-KRWDZBQOSA-N 331.464 0.942 10 20 ECCD COc1ccc(N2CC[C@@H](CN3C(=O)N[C@@H]([C@@H](C)O)C3=O)C2)cc1 924950374 OICYIHSVJBZOLP-JMSVASOKSA-N 333.388 0.823 10 20 ECCD CN(C)c1ccc(CNC(=O)[C@@H]2CCCN(S(N)(=O)=O)C2)cc1 854270736 RHDVNBQPWFFATA-CYBMUJFWSA-N 340.449 0.284 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NCc3ccnn3C)C2)cc(OC)n1 1022367975 NXGOAVWJJOSKDU-BETUJISGSA-N 345.403 0.883 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN2C(=O)NC(=O)[C@H]2C1 760118780 SJLJAKKKXVNDCM-CQSZACIVSA-N 345.403 0.507 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CN2CC(=O)N(C)C2=O)cc1 862130010 ZVPCBPIYZRMNON-UHFFFAOYSA-N 348.403 0.484 10 20 ECCD CN(CCS(N)(=O)=O)C(=O)NCc1ccc(N(C)C)c(F)c1 875179571 BPBSSGJOQBKKON-UHFFFAOYSA-N 332.401 0.322 10 20 ECCD CCC(=O)N[C@H](C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 881849500 DTPGINYRDWQYIO-CQSZACIVSA-N 332.448 0.969 10 20 ECCD COc1cc(O)c(CN2CCC(S(N)(=O)=O)CC2)cc1OC 785985106 LJJHGRQRZQPUIY-UHFFFAOYSA-N 330.406 0.662 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@@H]3CCNC3=O)CC2)nn1 1089856312 ZBNTUHBMODZSKM-AWEZNQCLSA-N 329.404 0.564 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NOC[C@@H]1CCOC1 1323723713 KIULWNMSUBDSCR-CYBMUJFWSA-N 335.404 0.762 10 20 ECCD CN1CCN(c2ccc(CNC[C@@H](O)Cn3ccnn3)cc2F)CC1 1326796482 HNNCKUPZDGVZQU-OAHLLOKOSA-N 348.426 0.320 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H]2CCC[C@H](N)[C@H]2C1 1331836951 YDSKZPKQZVXWFH-QEJZJMRPSA-N 331.416 0.936 10 20 ECCD COC(=O)NC1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1342711168 ASQBJPZHIULLJK-LLVKDONJSA-N 348.403 0.497 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)[C@]12CNC[C@H]1CCO2 1548571994 KKWAKGMUCXKIIL-BEFAXECRSA-N 345.443 0.642 10 20 ECCD CCOCCS(=O)(=O)NCC(=O)NCc1ccc(N(C)C)cc1 268118849 KRZUZSCEQOHBNC-UHFFFAOYSA-N 343.449 0.325 10 20 ECCD NC(=O)CSCC(=O)NCc1cccc(Br)c1O 277590705 SKSOALAAILSAIP-UHFFFAOYSA-N 333.207 0.989 10 20 ECCD COc1ccc2c(c1)c1c(n2CC(=O)NC(CO)CO)CCCC1 651624749 GOAKHAIIJKJFTE-UHFFFAOYSA-N 332.400 0.998 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1CCN[C@@H](C)C1 842069879 FYKIHRYVCMOBON-GJZGRUSLSA-N 346.475 0.929 10 20 ECCD C[C@@H](O)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 765464935 JSRATPGNFROBQR-TZMCWYRMSA-N 334.420 0.568 10 20 ECCD C[C@H](CNC(=O)C(=O)N(C)Cc1ccccc1O)Cn1cccn1 1117086111 RCIIZQQPDHDYGA-CYBMUJFWSA-N 330.388 1.000 10 20 ECCD CN(Cc1ccccc1O)C(=O)Nc1nc(CS(C)(=O)=O)no1 775517775 OMHDEZOMIXGRCM-UHFFFAOYSA-N 340.361 0.984 10 20 ECCD Cn1cnc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cc1=O 888520797 IPQYVVFPUTXWBN-UHFFFAOYSA-N 343.387 0.939 10 20 ECCD COc1cc(N(C)Cc2cn(C)c(=O)n(C)c2=O)cc(OC)c1OC 780774920 OTOUJXPJWVRGDY-UHFFFAOYSA-N 349.387 0.746 10 20 ECCD NC(=O)[C@@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@H]1C(N)=O 895315057 WTBGKDPNPPSJSK-HZPDHXFCSA-N 330.432 0.696 10 20 ECCD Cc1c[nH]nc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 799564108 UNUIDAKXPISFSA-UHFFFAOYSA-N 348.428 0.883 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@@H]3CCN(C)C3=O)CC2)nn1 1089853981 MBPQJMAWUFAPGU-HNNXBMFYSA-N 343.431 0.906 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@@H]3CC[C@H]3C(N)=O)CC2)n1 1089850396 XDMDWZJXFFGEFQ-HUUCEWRRSA-N 343.431 0.939 10 20 ECCD COc1ccc(N2CCN(C(=O)C(=O)N3CC[C@@H]3C)CC2)c(OC)c1 1335656132 MUHQLMUSHZTBML-ZDUSSCGKSA-N 347.415 0.973 10 20 ECCD O=C(O)c1cn([C@@H]2CCN(Cc3cc4c(cc3O)OCO4)C2)nn1 1608962417 RVSKUUCUSWFCBP-SNVBAGLBSA-N 332.316 0.858 10 20 ECCD COc1cc(O)c(CN2CCC[C@H]2C(=O)NCC(=O)O)cc1OC 1607183164 KQBFMZGLRPXLBP-NSHDSACASA-N 338.360 0.575 10 20 ECCD CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2 1795146582 BWLSBWCHSDKGHE-DRXBFXEBSA-N 349.387 0.496 10 20 ECCD CNS(=O)(=O)CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 269871229 YTAGSGQNWGLCHX-ZDUSSCGKSA-N 342.417 0.449 10 20 ECCD O=C(Nc1cnn(CC(=O)N2CCOCC2)c1)c1cccc(O)c1O 279251536 IDQLGAIRRDOKOB-UHFFFAOYSA-N 346.343 0.405 10 20 ECCD COC(=O)COc1ccc(N(C)Cc2nc(N)nc(N(C)C)n2)cc1 273099628 OHVBIXWUYSOWAZ-UHFFFAOYSA-N 346.391 0.708 10 20 ECCD C[C@H]1C[C@@H](CN)CN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 842149773 FAZVNZDHTGDHET-ZFWWWQNUSA-N 344.459 0.881 10 20 ECCD 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10 20 ECCD CCC[C@@H]1C(=O)NCCN1CC(=O)NCc1ccc(N(C)C)cc1 299688293 NPPTVWFCINUNBH-MRXNPFEDSA-N 332.448 0.969 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCC[C@@H](CO)C1 297690832 BEVMHOZLLCGWRO-OAHLLOKOSA-N 333.432 0.942 10 20 ECCD Cn1cnn(CCC(=O)NCCCSc2nccs2)c1=O 815591198 ZRIQRVUPCPXWDS-UHFFFAOYSA-N 327.435 0.727 10 20 ECCD COC(=O)[C@@H](NC(=O)COC(=O)c1cccc(O)c1O)C(C)C 811189383 UVQBHMHOFFZECM-LBPRGKRZSA-N 325.317 0.568 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](O)c1cnn(C)c1 819698786 RYAQYDRBUMCIOZ-MRXNPFEDSA-N 347.371 0.751 10 20 ECCD O=C(NCCN1CCNCC1)NCc1c(O)ccc2c1CCCC2 841920185 FZLFRSGZXNGIOH-UHFFFAOYSA-N 332.448 0.975 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)NC(C)=O)CC2)cc1 742917178 SFAGNEXTOJNZOK-CQSZACIVSA-N 348.447 0.458 10 20 ECCD CCS(=O)(=O)C1CN(Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 841885436 ADAZOLUJXYKVHI-UHFFFAOYSA-N 330.362 0.928 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CCOC1 921203380 GWVSIECEWSUYPK-CQSZACIVSA-N 338.429 0.574 10 20 ECCD 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CN(CC1(O)CCS(=O)(=O)CC1)c1ccc(OCC(=O)O)cc1 846279966 RHQWSPIEAJKSRK-UHFFFAOYSA-N 343.401 0.526 10 20 ECCD CC[C@@H](NC(=O)NCCc1ccc(N)cc1)C(=O)N1CCOCC1 841853788 GIKNAHLEAVDIAO-OAHLLOKOSA-N 334.420 0.748 10 20 ECCD C[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H]1CO 857364847 MDAHGRPNAGMHTD-WDEREUQCSA-N 342.417 0.854 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CN(CCF)C[C@H]2O)cc1 958731928 KPTUOUCUXZBVBD-DGCLKSJQSA-N 337.355 0.841 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)C(C)(C)F)cc1 1122517028 LNGATLYIDGPVCM-UHFFFAOYSA-N 336.371 0.625 10 20 ECCD COC(=O)[C@@]1(C)CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785424160 MDAFYVRPSOERNH-SFHVURJKSA-N 347.415 0.780 10 20 ECCD COC(=O)[C@H]1C[C@@H](O)CN(Cc2ccc(OC)c(OC)c2O)C1 895126037 UPVAKIPPWAQSIJ-NWDGAFQWSA-N 325.361 0.765 10 20 ECCD NC(=O)CC(=O)NCCC1=CCN(c2ncccc2[N+](=O)[O-])CC1 1089821958 GBUHMBNENGVTGI-UHFFFAOYSA-N 333.348 0.508 10 20 ECCD COC[C@@H](O)CN[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1188251513 KOSBLQFZTGLJAU-KGLIPLIRSA-N 349.391 0.660 10 20 ECCD O=C(Nc1ccnc2ccnn12)C1=S=C(NC(=O)C2CC2)C=C1 1356418628 FUDVGVUYZYMIJU-UHFFFAOYSA-N 327.369 0.799 10 20 ECCD CCOCCC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251164 BJDUDEBJBQCGTI-UHFFFAOYSA-N 349.387 0.736 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)OC3CNC3)cc2)CC1 1580088959 FBSTVHWGPRFOLZ-UHFFFAOYSA-N 332.404 0.586 10 20 ECCD O=C(CNc1ccc(-c2nn[nH]n2)cn1)NCc1ccc(O)cc1O 1592879317 NFOHTEKZLKHFGV-UHFFFAOYSA-N 341.331 0.401 10 20 ECCD CON(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H](C)CC(=O)O 1599312291 RNIMXFUNWISYQX-MRVPVSSYSA-N 346.361 0.631 10 20 ECCD COC[C@@H](C)OC[C@@H](O)CN(C)c1ccc(OCC(=O)O)cc1 1777181540 XHQXQDQADUDSPV-OCCSQVGLSA-N 327.377 0.999 10 20 ECCD NC(=O)[C@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 155696644 AGCUVJYWYMXEQX-OAHLLOKOSA-N 330.388 0.459 10 20 ECCD CN(Cc1ccccc1O)C(=O)CN(C)[C@@H]1CCS(=O)(=O)C1 53916052 VPQGSFFBEOHPEI-CYBMUJFWSA-N 326.418 0.470 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3nnc[nH]3)nc12 266860752 JUSQSLIONXXOKT-UHFFFAOYSA-N 331.336 0.362 10 20 ECCD Cc1nnc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1C 273203866 QVNAAACZKUFYBX-UHFFFAOYSA-N 325.350 0.453 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)N1CC(=O)N(C2CC2)C1 280174010 TWAXRXQYKVPDLR-UHFFFAOYSA-N 344.415 0.997 10 20 ECCD C[C@H](OC(=O)c1cc(O)cs1)C(=O)N(C)[C@H]1CCS(=O)(=O)C1 732354282 IXOBODUNCJGHGR-IUCAKERBSA-N 347.414 0.645 10 20 ECCD CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2cc(O)cs2)CC1 731911568 MARKNKYGAWSQFB-SECBINFHSA-N 326.374 0.690 10 20 ECCD C[C@@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCN1 842265021 ATWILZSTERUVSF-UKRRQHHQSA-N 332.448 0.968 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)c2cc([C@@H]3CCNC3)[nH]n2)cc1 841847124 ZXEMXYHQAVEWRD-UKRRQHHQSA-N 342.447 0.982 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)NCC(F)F 856211882 BWBUOYJCDLKOCP-UHFFFAOYSA-N 341.358 0.645 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)NCC2(CC(N)=O)CC2)cc1 853010824 NGYGCVCLAMODOB-UHFFFAOYSA-N 349.387 0.358 10 20 ECCD CN(C)c1ccc(CNC(=O)NCc2nc(O)cc(CN)n2)cc1 851655575 WZORRALSGQROEN-UHFFFAOYSA-N 330.392 0.706 10 20 ECCD CCOCCS(=O)(=O)NCC(=O)NCc1cc(C)ccc1O 862758061 NIIUXERLTNRCLG-UHFFFAOYSA-N 330.406 0.273 10 20 ECCD COc1cc(C(=O)NC2CN([C@H](C)c3n[nH]c(C)n3)C2)cc(OC)n1 1030614347 HPJZFESVHXGKDY-SECBINFHSA-N 346.391 0.701 10 20 ECCD O=C(NCc1ccc(N2CCSCC2)cc1)c1nnc(O)nc1O 765471984 LVZITQAOXPCODA-UHFFFAOYSA-N 347.400 0.766 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(CC(N)=O)[C@@H](C)C2)cc(OC)n1 947496416 AQDIKZYAKSUKHP-JQWIXIFHSA-N 336.392 0.167 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(CCn2cncn2)CC1 779520063 OATFLSABEIPMRY-DUXPYHPUSA-N 343.387 0.547 10 20 ECCD COc1cccc(CNC(=O)C(=O)Nc2cc(C)c(=O)n(C)c2)c1O 781967932 SQLPYNUAOMNXOD-UHFFFAOYSA-N 345.355 0.663 10 20 ECCD CNC(=O)CCCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1325693214 AHKKTJQHCSLIBG-UHFFFAOYSA-N 346.431 0.545 10 20 ECCD CCNC(=O)CC[C@H](NCc1ccc(N2CCOCC2)cc1)C(=O)O 1776878197 UIGJKNLDBPGDFC-INIZCTEOSA-N 349.431 0.982 10 20 ECCD COC(=O)CNC(=O)[C@H](C)N1CCN(c2ccc(OC)cc2)CC1 42290143 ZZUIOJVALITVHE-ZDUSSCGKSA-N 335.404 0.495 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC[C@H]1CO 284003467 KBJPESSBWKSHLR-INIZCTEOSA-N 331.416 0.886 10 20 ECCD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1COCCO1 299176499 XQGPFQGHPGXQLL-QGZVFWFLSA-N 334.416 0.927 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(=O)n(C)n1 819693499 PWESFBOWLIPKQT-UHFFFAOYSA-N 345.355 0.691 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)c2cc(=O)n(C)cn2)cc1 824207834 HHHWUJICAZNNPP-UHFFFAOYSA-N 330.388 0.997 10 20 ECCD CC1=NO[C@@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 854798788 WGYXLEQZHCQBLA-SNVBAGLBSA-N 327.362 0.658 10 20 ECCD CNS(=O)(=O)CCN(Cc1ccccc1O)C[C@H]1CCCO1 856731496 QGXFSLCXWMIZRZ-CQSZACIVSA-N 328.434 0.922 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1[C@H]2CC[C@H]1CNC2 853361592 OLPQZVOULWFCDJ-HOTGVXAUSA-N 330.432 0.640 10 20 ECCD CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@H]1CCNC1 884531246 HDEPDDVOLJGFLA-INIZCTEOSA-N 332.448 0.888 10 20 ECCD O=C(CO)N1CCN(Cc2cccc(Br)c2O)CC1 793593689 PFQGJTYIJFCULS-UHFFFAOYSA-N 329.194 0.791 10 20 ECCD C[C@@H]1C[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1332795150 DBPIXGJDZXXKMJ-ZBFHGGJFSA-N 344.459 0.827 10 20 ECCD COC(=O)CN(CCN1CCN(C)CC1)C(=O)Cc1ccc(N)cc1 1578812123 KBXDGTFGTCSJOI-UHFFFAOYSA-N 348.447 0.060 10 20 ECCD C[C@@H](NCCO)[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 1755448124 OEHGJFYNHVRYBQ-RISCZKNCSA-N 349.391 0.660 10 20 ECCD COCCCN(C(=O)Cc1ccc(N)cc1)[C@H]1CCS(=O)(=O)C1 150747633 NKUFIGBIOSFGHZ-HNNXBMFYSA-N 340.445 0.864 10 20 ECCD COCCN(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 54361713 HSZXVEIMFWSGBX-UHFFFAOYSA-N 339.411 0.857 10 20 ECCD COc1ccc(O)c(CNC(=O)Cc2c(C)[nH]c3ccnn3c2=O)c1 114543868 PXSAMKYYSPGJPX-UHFFFAOYSA-N 342.355 0.904 10 20 ECCD CSC[C@@](C)(O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 266455298 DZRGYWYMFWYRHQ-ZDUSSCGKSA-N 348.446 0.608 10 20 ECCD COCC(=O)N(C)CC(=O)NCc1cccc(Br)c1O 277617696 VWJQUYUTBBPABF-UHFFFAOYSA-N 345.193 0.876 10 20 ECCD Cc1cccc(CN2CCn3c(nn(CC(=O)N(C)C)c3=O)C2)c1O 276183123 VLAVNPUTCIEOGI-UHFFFAOYSA-N 345.403 0.163 10 20 ECCD CCN(C)C(=O)CNC(=O)C(=O)N(CC)Cc1ccc(N(C)C)cc1 808946270 SLAPIKJQAACYDD-UHFFFAOYSA-N 348.447 0.696 10 20 ECCD CN(C)c1ccc(CN(C)S(=O)(=O)c2n[nH]cc2C(=O)O)cc1 390923879 COJBPHCQMWZMPG-UHFFFAOYSA-N 338.389 0.995 10 20 ECCD Cc1cc(CN2CCN(S(=O)(=O)N(C)C)CC2)ccc1N(C)C 815017178 WLQUOQPDLYLNCV-UHFFFAOYSA-N 340.493 0.985 10 20 ECCD O=C(O)[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 738549442 WVVKDKYNSRBHDS-HNNXBMFYSA-N 349.387 0.518 10 20 ECCD Cc1nnc(N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)n1C 911908814 FHCQDZFSNULERB-GQCTYLIASA-N 343.387 0.897 10 20 ECCD C[C@@H](O)[C@@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 747616966 MQCVIABOUPEMDK-GHMZBOCLSA-N 342.417 0.997 10 20 ECCD C[C@@H](O)[C@@H](NC(=O)C1CC1)C(=O)NCc1cc(Cl)ccc1O 846473189 KDHHTCUDZGBTAQ-AMIZOPFISA-N 326.780 0.937 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCCNCC3)CC2)cc1 923278166 ZDQSSXQTCRKUKH-GOSISDBHSA-N 348.491 0.473 10 20 ECCD CCNC(=O)[C@H](C)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851946848 PZLNLXINMPJGPD-ZDUSSCGKSA-N 348.447 0.972 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CCCOCC3)CC2)cc1 754031330 HAJDIPLEXGCYBX-SFHVURJKSA-N 349.475 0.900 10 20 ECCD CN(C)CC1(O)CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 931484616 OBQWUPONWCMVCH-UHFFFAOYSA-N 348.491 0.757 10 20 ECCD COc1cc(C(=O)NC2CN(C[C@H]3CCCOC3)C2)cc(OC)n1 1030612545 SGZGAYDPOAFUSW-GFCCVEGCSA-N 335.404 0.939 10 20 ECCD CC(C)OC(=O)[C@@H](C)CNC(=O)C(=O)NCCc1ccc(N)cc1 1118042843 DKPJYELXYDFZGG-LBPRGKRZSA-N 335.404 0.631 10 20 ECCD O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@H]1CCOC1 789856439 URUVLYLZMBJKLJ-AWEZNQCLSA-N 349.456 0.761 10 20 ECCD CNC(=O)[C@H]1CCC[C@H]1NCC(=O)NCc1ccc(N(C)C)cc1 794576191 HVLMZYIXPUTKND-JKSUJKDBSA-N 332.448 0.873 10 20 ECCD CCC(=O)N[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1O 991139597 SLOZOLLMEHPBPQ-CHWSQXEVSA-N 347.375 0.951 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCOCCF)cc1F 1328889166 VMCLHKKSCIVLNA-UHFFFAOYSA-N 329.347 0.610 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(CC2CC2)C1 1326456170 DAAKTEPONRPGQC-OAHLLOKOSA-N 331.416 0.951 10 20 ECCD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C[C@H](O)CN)cc1 1340184905 QUSPQGPDVGGWIL-DLBZAZTESA-N 335.448 0.970 10 20 ECCD C[C@@H](C(=O)N[C@H](C)c1ccccc1O)n1cnc(-c2nn[nH]n2)n1 1573741573 DCWHHPLOCZNKHV-BDAKNGLRSA-N 328.336 0.602 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CC(n3cc(C(=O)O)nn3)C2)c1O 1599345089 QEDWBNHYKXORIH-UHFFFAOYSA-N 349.303 0.656 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCCS2(=O)=O)cc1F 58733705 OVGDSGXXHXYEPD-UHFFFAOYSA-N 329.397 0.543 10 20 ECCD CN(C)[C@@H](CNC=C1C(=O)NC(=S)NC1=O)Cc1ccccc1 29006120 XQXCJCQOJPIQKW-GFCCVEGCSA-N 332.429 0.164 10 20 ECCD O=C(NCc1ccccc1O)[C@@H]1CC[C@H](C(=O)N2CCOCC2)O1 287288443 IMVWNWUIOUZSLC-LSDHHAIUSA-N 334.372 0.415 10 20 ECCD CC(=O)NCCCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 285674931 IYKYJSXNEJSKTC-UHFFFAOYSA-N 346.431 0.328 10 20 ECCD CC(C)(N)CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827388432 HCNNDRIUEPXWNQ-UHFFFAOYSA-N 339.461 0.665 10 20 ECCD COc1ccc(N2CCN(C(=O)CN[C@@H]3COC[C@H]3OC)CC2)cc1 830081327 MNJHNYSPENSGCL-IAGOWNOFSA-N 349.431 0.347 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCCN([C@@H](C)C(N)=O)C2)cc(OC)n1 1007790049 FYORFEKUZRUWHT-CMPLNLGQSA-N 336.392 0.167 10 20 ECCD 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CS(=O)(=O)N1CC[C@@H](NCc2ccc(N3CCOCC3)cc2)C1 400148861 CKOYYLSZXXYKEK-OAHLLOKOSA-N 339.461 0.647 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](N)CCS(C)(=O)=O 319316488 YRMCHPMRJLDHHC-HNNXBMFYSA-N 341.477 0.863 10 20 ECCD C[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H]1CO 275950715 DYKPMDIUMREPFV-JOYOIKCWSA-N 328.390 0.607 10 20 ECCD COC(=O)C[C@H](N)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 827725860 PBMRZZPFMOAXRQ-DOMZBBRYSA-N 335.404 0.591 10 20 ECCD CC(=O)NCCN(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 834678608 YOHHCWAPKJUHIE-UHFFFAOYSA-N 346.431 0.280 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC[C@H](CN)C2)cc1 846363642 OLACEMJYBHSKHE-CQSZACIVSA-N 348.447 0.397 10 20 ECCD CN(C)c1ccc(CNC(=O)N[C@@H]2CCN(S(C)(=O)=O)C2)cc1 844776246 DQAZGCPPLBMWBC-CYBMUJFWSA-N 340.449 0.586 10 20 ECCD CNS(=O)(=O)CCN1CCCN(c2ccc(OC)cc2)CC1 856722104 RYXPWWMKBFNWNK-UHFFFAOYSA-N 327.450 0.757 10 20 ECCD CN1C(=O)CC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856212615 OQNRZILMLWSENV-INIZCTEOSA-N 331.416 0.885 10 20 ECCD 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COc1ccc(CN[C@H]2CCCN(C(=O)c3nnn(C)n3)C2)cc1C 999919977 HVBBKAYUOJXTBM-AWEZNQCLSA-N 344.419 0.922 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccn(C)n1 1324136401 NVWINTPCAPDYPO-LBPRGKRZSA-N 333.344 0.736 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCc1cnc(N(C)C)n1C 1322868951 OVDRRYLYTNVWKT-UHFFFAOYSA-N 345.403 0.467 10 20 ECCD COC1CCN(c2ccc(Cn3cc(C[C@@H](N)CO)nn3)cc2)CC1 1336898530 VNICBFUNKDOVGE-OAHLLOKOSA-N 345.447 0.804 10 20 ECCD Cn1cc(-c2nn[nH]n2)cc1C(=O)OCC(=O)c1ccc(O)c(O)c1 1609478023 NGFDENXFWLAWMB-UHFFFAOYSA-N 343.299 0.656 10 20 ECCD O=C(CNc1ccc(-c2nn[nH]n2)cn1)NCc1cc(O)ccc1O 1592879244 KAKSSUSWVVQPTK-UHFFFAOYSA-N 341.331 0.401 10 20 ECCD C/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1 1796140875 CRLCEJYIYMCADT-NXUIKZECSA-N 347.371 0.272 10 20 ECCD CCC(=O)N(CCO)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1056735634 CHFPEIOFJCMLMJ-UHFFFAOYSA-N 335.364 0.810 10 20 ECCD COCCNCCNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 237314644 NBCGMTSHDKMPNZ-QPJJXVBHSA-N 333.432 0.889 10 20 ECCD Cn1cnc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)n1 837715924 XANQTXBAOZQHFI-UHFFFAOYSA-N 337.330 0.860 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)[C@@]23CCC(=O)N2CCS3)cc1 843298801 QBSKHQUUMBQKOM-PBHICJAKSA-N 348.472 0.934 10 20 ECCD CCO[C@@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccccc2O)[C@H]1OC 1117643215 IFJTUWHGBOHQPJ-NWANDNLSSA-N 336.388 0.659 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCn1cncn1 1116592580 XZISJTKBOSKIOS-LBPRGKRZSA-N 348.359 0.370 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)C[C@H]2COCCN2)N(C)C)cc1 1122328524 OBOXIKZJAUEZIN-RDJZCZTQSA-N 334.464 0.850 10 20 ECCD COC(=O)c1cnc(SCc2nnc3c(=O)n(C)ccn23)s1 882174645 UTYCWHQWVAETDK-UHFFFAOYSA-N 337.386 0.963 10 20 ECCD CNC(=O)[C@H](C)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 957849643 NSEMUTGKJJGJRA-NSHDSACASA-N 346.391 0.741 10 20 ECCD CCOCCN1C[C@H](O)[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1221133651 NJCNQIQVIAINOE-KGLIPLIRSA-N 349.391 0.660 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)[C@H]2CNCCN2C)N(C)C)cc1 1523576119 FGWBDZVAUBQPRN-DLBZAZTESA-N 333.480 0.375 10 20 ECCD 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CC[C@@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)C(N)=O 899097852 HVOHKFKGIIIOGC-HUUCEWRRSA-N 335.452 0.918 10 20 ECCD COc1ccc(CNCCNC(=O)CC[C@H]2NC(=O)NC2=O)cc1C 1150401596 YGUJNRKHOXECBX-CYBMUJFWSA-N 348.403 0.198 10 20 ECCD Cc1noc2ncnc(N3CC=C(CCNC(=O)CC(N)=O)CC3)c12 1089821954 FXKKSFBQQFQUBG-UHFFFAOYSA-N 344.375 0.444 10 20 ECCD COc1ccc(CNC(=O)C(=O)Nc2ccc(=O)n(C)c2)c(O)c1 1256427461 HSXWXGNWCYGFQD-UHFFFAOYSA-N 331.328 0.354 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNCC3(O)CCC3)CC2)cc1 1338463275 VOMFBIBMTCMMGX-KRWDZBQOSA-N 349.475 0.683 10 20 ECCD COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CNC[C@@H]3O)ccc21 1342175235 FTFIPPRFXCAOHF-WBVHZDCISA-N 331.416 0.967 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H](O)C[C@H]1C(=O)O 1598519452 RAJGBNPSGZPORV-GJZGRUSLSA-N 335.404 0.231 10 20 ECCD C[C@H]1CN(CCC(=O)O)CCN1C(=O)C(=O)Nc1ccc(N)cc1 1594513307 IVROPEKTUVJFGA-NSHDSACASA-N 334.376 0.215 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1C[C@@H]1C(=O)O 1595890707 AESRNXOWNCAKJQ-STQMWFEESA-N 334.372 0.968 10 20 ECCD COc1ccc(N2CCN(CCCC(=O)NC(N)=O)CC2)cc1F 177712123 XBEWPDXLARNKCO-UHFFFAOYSA-N 338.383 0.931 10 20 ECCD CN1CC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)C1=O 265690454 MSSVLHNBLCHCKM-OAHLLOKOSA-N 332.404 0.553 10 20 ECCD O=C1COc2c(cccc2NC(=O)C(=O)NCc2ccccc2O)N1 377935336 AHPNDTCBQYDZDU-UHFFFAOYSA-N 341.323 0.978 10 20 ECCD CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 285370532 XERAYVUZBBEZGI-UHFFFAOYSA-N 345.321 0.904 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCN(CC3CC3)CC2)cc1 283329285 CMIPTBFVVLCJNN-UHFFFAOYSA-N 344.459 0.923 10 20 ECCD COCCCN(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 284182147 VCOOYXZNZWJVPI-UHFFFAOYSA-N 349.431 0.634 10 20 ECCD NC(=O)c1[nH]nnc1NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 297778611 NJJHTLXENMMUFI-ZZXKWVIFSA-N 342.359 0.392 10 20 ECCD CC(C)[C@H]1C(=O)NCCN1CC(=O)NCc1ccc(N(C)C)cc1 299437741 YBJPHESLVAMKOP-KRWDZBQOSA-N 332.448 0.825 10 20 ECCD CC(C)C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)O 819972616 RQSPZMWIUBZHAO-LLVKDONJSA-N 344.389 0.993 10 20 ECCD 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ECCD COCCN1C(=O)/C(=C\NCc2ccc(F)cc2)C(=O)NC1=S 60862487 WPXNGMFDGPHBQC-XFXZXTDPSA-N 337.376 0.689 10 20 ECCD COC(=O)[C@H](C)N(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 280696863 ICWGFJMBKUKSFF-AWEZNQCLSA-N 349.431 0.837 10 20 ECCD C[C@@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)C[C@@H](C)S1(=O)=O 811797661 JZEFGEDSASQSTQ-GPCCPHFNSA-N 327.402 0.825 10 20 ECCD Cn1cncc1CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 733330673 HUADLDBNZWUBIR-UHFFFAOYSA-N 334.445 0.945 10 20 ECCD CN1CCCc2cc(CNC(=O)NCCN3C(=O)CNC3=O)ccc21 733352049 RLVJUYQDXIWYNA-UHFFFAOYSA-N 345.403 0.420 10 20 ECCD C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1CN 842035123 CSMJOWZFPHFPAV-XJKSGUPXSA-N 332.448 0.955 10 20 ECCD COc1ccc(CNC(=O)CCn2cnc3c(N)ncnc32)c(O)c1 846950829 RTJBVLVXPIMWNF-UHFFFAOYSA-N 342.359 0.829 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CCC(NC(=O)C(N)=O)CC2)cc1 947160998 HOCFTSJHHSTBKR-UHFFFAOYSA-N 346.347 0.055 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3cocn3)C2)cc(OC)n1 973946401 NKQDJKZNRMYYTB-PHIMTYICSA-N 346.343 0.778 10 20 ECCD 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348.359 0.908 10 20 ECCD COc1ccc(CNC(=O)c2cn(C[C@@H]3CCCN3)nn2)c(O)c1 832178099 NLXGXCDTMZEHHW-LBPRGKRZSA-N 331.376 0.674 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CNC(=O)[C@H]2CCCN2)cc1 846696019 CGEHLJZXRADKGJ-MRXNPFEDSA-N 348.447 0.458 10 20 ECCD C[C@@H](CN)CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 842250069 SIVTTXZSTOCKEL-ZDUSSCGKSA-N 332.448 0.955 10 20 ECCD CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)NCCc2ccc(N)cc2)O1 841868408 VPMOATDKTOQYSD-HUUCEWRRSA-N 334.420 0.746 10 20 ECCD NC[C@H]1OCC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 852917339 YWXJXWTWUCFOMY-IAGOWNOFSA-N 333.432 0.628 10 20 ECCD O=C(C[C@H]1CNCCO1)NCc1ccc(N2CCC(O)CC2)cc1 852868472 GHFHFYKRZSJUFJ-KRWDZBQOSA-N 333.432 0.642 10 20 ECCD C[C@@H](C(N)=O)N1CC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1039061810 UJXODGTYIDBXKM-JOYOIKCWSA-N 332.364 0.527 10 20 ECCD Cn1ncnc1CNCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 877145449 HTVSPLGYHAXAOZ-AWEZNQCLSA-N 328.420 0.807 10 20 ECCD CS(=O)(=O)CCN1CCC(NC(=O)Cc2ccc(N)cc2)CC1 1118217192 ZEQAPJUOVQKOIK-UHFFFAOYSA-N 339.461 0.437 10 20 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COc1cc(C)cc(CNCCS(=O)(=O)N2CCOCC2)c1O 894243279 JFFLUBJJSNGZDY-UHFFFAOYSA-N 344.433 0.461 10 20 ECCD C[C@]1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCOC1=O 794086886 VVXMXUDHMMVKSW-ZDUSSCGKSA-N 328.346 0.199 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]3C(=O)NC)nc12 55017298 NQSSWPZYIDTISU-LBPRGKRZSA-N 347.375 0.322 10 20 ECCD CCOCCS(=O)(=O)NCC(=O)N(C)Cc1ccccc1O 268171076 QGORIEAEOIXLOU-UHFFFAOYSA-N 330.406 0.307 10 20 ECCD C[C@@H]1C(=O)NCCN1C(=O)/C=C/c1ccc(N2CCOCC2)cc1 264574623 TWTFGEOUQZILSS-BTKRWWFXSA-N 329.400 0.883 10 20 ECCD CN1CCN(C(=O)C2CCN(C(=O)c3cccc(O)c3O)CC2)CC1 274899348 PCPPFPBCJNBRSA-UHFFFAOYSA-N 347.415 0.724 10 20 ECCD Cn1cnc(NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)n1 815351910 UANFXNDFBRZVSW-UHFFFAOYSA-N 328.376 0.670 10 20 ECCD CCS(=O)(=O)N1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 825652611 HDZFROVWIOGMKG-UHFFFAOYSA-N 332.353 0.344 10 20 ECCD COc1cc(O)c(CN[C@H]2CS(=O)(=O)C[C@H]2OC)cc1OC 826986066 PTFUNDCOBCCZDP-IINYFYTJSA-N 331.390 0.311 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@H](CN)C1 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CN(C)c1ccc(CNC(=O)CCS(=O)(=O)N(C)C)cc1F 136728695 YTMBWVLRVGETSQ-UHFFFAOYSA-N 331.413 0.789 10 20 ECCD CN1CCO[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 81266325 CDQBCRONHSAJJN-INIZCTEOSA-N 337.395 0.609 10 20 ECCD O=C(CNC[C@H]1CCCO1)NCc1ccc(N2CCOCC2)cc1 237933698 LJHIPIMZGZJWNG-QGZVFWFLSA-N 333.432 0.908 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@H](CN)C1 817949691 MKEKKYVWECYZRE-CQSZACIVSA-N 335.404 0.317 10 20 ECCD CN(C)S(=O)(=O)NCC(=O)NCc1ccc(N2CCCC2)cc1 816867083 FSXLIGHBSALKSG-UHFFFAOYSA-N 340.449 0.299 10 20 ECCD COc1ccc(N2CCN(S(=O)(=O)c3ccn(C)n3)CC2)cc1 826888031 MIEMTEKQNOAKAL-UHFFFAOYSA-N 336.417 0.940 10 20 ECCD CC[C@H](CNS(C)(=O)=O)NCc1ccc(N2CCOCC2)cc1 824677858 KDWHPGZYAIKHHM-OAHLLOKOSA-N 341.477 0.941 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N(C)C[C@@H](C)O)cc1 846248434 FLPTXVPLWLHBKX-CYBMUJFWSA-N 337.420 0.429 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CNC3(C(N)=O)CCCC3)nc12 746475397 KGKUHZDJGOJZAE-UHFFFAOYSA-N 347.375 0.499 10 20 ECCD 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CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H]([C@@H](C)O)C3)nc12 272608384 RXRNMMTZSRHXLT-MNOVXSKESA-N 334.376 0.814 10 20 ECCD CCN1C(=O)[C@H]2CN(Cc3cc(OC)c(OC)cc3O)CCN2C1=O 378443208 RAOZZOLNOAMQKF-GFCCVEGCSA-N 349.387 0.878 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@H]4C[C@H]3C(=O)O4)nc12 295201462 KWTLEHLNIJJADJ-KOLCDFICSA-N 332.316 0.111 10 20 ECCD O=C(OCC(=O)N1CCN(C(=O)C2CC2)CC1)c1cc(O)cs1 732353990 MSEGUXLLCFKDHD-UHFFFAOYSA-N 338.385 0.691 10 20 ECCD CCS(=O)(=O)N[C@H](C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 831924052 BUQOXDUJHNLGJM-VHSXEESVSA-N 330.406 0.473 10 20 ECCD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](C)N)CC2)cc1 841665880 RRFBGLMIFMFFRH-OAHLLOKOSA-N 349.479 0.854 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCc3cnnn3C)C2)cc(OC)n1 1020352631 YYPIUSOXAVALPU-HAQNSBGRSA-N 346.391 0.278 10 20 ECCD CO[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1117452240 AUOKTIPMLDGHDH-MRXNPFEDSA-N 329.400 0.926 10 20 ECCD Cc1cccc(O)c1CN(C)CC(=O)N[C@@H]1CCS(=O)(=O)C1 876616447 NFDHCFRHJJJMOP-GFCCVEGCSA-N 326.418 0.436 10 20 ECCD CS(=O)(=O)N1CCCC[C@@H]1C(=O)NCc1ccc(O)c(O)c1 778930037 PNAXWJBUGQJXAC-LLVKDONJSA-N 328.390 0.528 10 20 ECCD CN(C)c1ccc(CNc2nc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1F 892131301 FWADKNLVHGKRAT-UHFFFAOYSA-N 346.366 0.778 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)[C@@H]3CCCO3)C2)cc(OC)n1 973850321 ZIRIHBQUKUKPNB-XQQFMLRXSA-N 349.387 0.655 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)c3cc[nH]n3)CC2)nc(CO)n1 1089807008 DFYCODCKUVOEAG-UHFFFAOYSA-N 342.403 0.957 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](CNCc3cnon3)C2)cc(OC)n1 984209025 QJPQKKAITCSCFD-UMSPYCQHSA-N 347.375 0.780 10 20 ECCD NC(=O)[C@H]1CC[C@@H]1C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089855471 LYKZVXITTIIOAW-STQMWFEESA-N 347.394 0.770 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCCCN[C@@H]2CCNC2=O)cc1 1177238161 SZWGXSXEKNNCCA-GFCCVEGCSA-N 332.364 0.447 10 20 ECCD C[C@H](O)[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1342030395 WTAAFWXETSYNNE-UWVGGRQHSA-N 328.390 0.607 10 20 ECCD Nc1ccc(Cc2nc(C(=O)N3CCNC[C@@H]3CO)cs2)cc1 1358029167 QSYSWCMWOZLKBX-CYBMUJFWSA-N 332.429 0.722 10 20 ECCD C[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1801950254 FJEYPRUJEVVREA-KXGXSXBTSA-N 335.360 0.125 10 20 ECCD COc1ccc(N2CCC(NC(=O)N[C@@H]3CCNC[C@H]3O)CC2)cc1 1579224556 PEFVDGMXJCHYDW-IAGOWNOFSA-N 348.447 0.686 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN2C(=O)NC[C@H]2C1 151442089 RIUAUXREWSRYEH-HNNXBMFYSA-N 331.420 0.980 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](CN(C)C)C3)nc12 114199553 NUYCNLWTZTZXCT-LBPRGKRZSA-N 347.419 0.995 10 20 ECCD CN1CCCc2cc(CNC(=O)NCCNS(C)(=O)=O)ccc21 58558452 UQRVJXGRJLAVIJ-UHFFFAOYSA-N 340.449 0.417 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCN(CC)CC3)nc12 76413443 TZAYFBAEOKHYHQ-UHFFFAOYSA-N 333.392 0.749 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)CCNC(=O)[C@@H]1CCCN1 354751680 QLBRXSZLOONIFP-AWEZNQCLSA-N 346.431 0.736 10 20 ECCD Cc1ccc(C(=O)NC[C@H]2CCC[C@@]23NC(=O)NC3=O)c(O)c1O 272740547 MBHCJOPLMVYJOZ-JDNHERCYSA-N 333.344 0.514 10 20 ECCD O=C1[C@H]2COCCN2C(=O)N1Cc1ccc(N2CCOCC2)c(F)c1 272364548 ZDLRFXXRIUYRIF-OAHLLOKOSA-N 349.362 0.825 10 20 ECCD C[C@H](O)CCN(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 288526256 KTPJVPIKRYMFQZ-AWEZNQCLSA-N 331.416 0.908 10 20 ECCD C[C@H]1CS(=O)(=O)CCN1CC(=O)NCc1ccc(N(C)C)cc1 299448774 YXCUTSYDNYKLBC-ZDUSSCGKSA-N 339.461 0.488 10 20 ECCD CC[C@H](CNS(C)(=O)=O)NCc1cc(OC)c(OC)cc1O 295090343 ROWOADRVLKEXRP-LLVKDONJSA-N 332.422 0.827 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)NC[C@H]3CNCCO3)C2)cc1 818656504 XWSZCWITMOUZQB-WMLDXEAASA-N 348.447 0.809 10 20 ECCD CNC[C@@H]1CCCN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 817989479 PMTXLLSOCCEGIP-INIZCTEOSA-N 332.448 0.921 10 20 ECCD CO[C@H](CN)CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 827469368 VZVKWMVBUBVHAD-ZBFHGGJFSA-N 348.447 0.368 10 20 ECCD NS(=O)(=O)c1ccc2c(c1)/C(=C\c1c[nH]c(C(=O)O)c1)C(=O)N2 833089236 NUIJBAPBLOTFBQ-XCVCLJGOSA-N 333.325 0.853 10 20 ECCD Cc1cc(C(=O)NCC(=O)N2CCNCC2)c(C)n1-c1ccccn1 832410538 WUTBMUZORIAFPI-UHFFFAOYSA-N 341.415 0.651 10 20 ECCD C[C@@H](CCO)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 738982841 CDURBDNCTUQREV-DZGCQCFKSA-N 348.447 0.958 10 20 ECCD COc1ccc(CN[C@H]2CCCN(C(=O)[C@@H]3CNC(=O)N3)C2)cc1C 1000049002 MFMJHUMSCYHYIS-GJZGRUSLSA-N 346.431 0.766 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNC[C@@H](O)C3CC3)CC2)cc1 843072310 WCJYHYMFXIDUMG-IEBWSBKVSA-N 349.475 0.539 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCNCC1 842223983 UDZLLYXQAJGYCL-UHFFFAOYSA-N 332.448 0.969 10 20 ECCD COCCS(=O)(=O)NCc1ccc(N2CCC(O)CC2)cc1 851843435 DPMKBGLARKYKMP-UHFFFAOYSA-N 328.434 0.714 10 20 ECCD C[C@H](O)[C@H]1CCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 855868918 JIZCHUJNLJORQN-JOYOIKCWSA-N 328.390 0.749 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCO[C@@H](OC)C3)CC2)cc1 878968264 MUYUJRJKRFJJPA-GOSISDBHSA-N 349.431 0.649 10 20 ECCD CC[S@](=O)CCNC(=O)CN(CC(=O)O)c1ccc(OC)cc1 872929953 QHFNYQPOLZMONG-QHCPKHFHSA-N 342.417 0.471 10 20 ECCD CC(=O)N(C)CC(=O)NCCC1=CCN(c2ccnc(C)n2)CC1 1089812499 WBLOXKYRMBCCCX-UHFFFAOYSA-N 331.420 0.906 10 20 ECCD COc1ccc(-n2nnnc2CN[C@H]2CCCN(C(C)=O)C2)cc1 998325872 GFZAZWXYYMJXIU-ZDUSSCGKSA-N 330.392 0.771 10 20 ECCD CN1CCO[C@H](C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)C1 1089823785 PQFRFIGGGXEYNM-AWEZNQCLSA-N 349.410 0.589 10 20 ECCD COCC(=O)NCCC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1261438709 NTSTYFAWOFXUJI-AWEZNQCLSA-N 349.431 0.790 10 20 ECCD c1cc(N2CCOCC2)ccc1Cn1nnnc1N1CCCOCC1 1355494615 QJRMJEMSUQTYQU-UHFFFAOYSA-N 344.419 0.785 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)NCc1cnn(Cc2cnn[nH]2)c1 1577762172 IAZVIBMDRLPXMH-DUXPYHPUSA-N 340.343 0.790 10 20 ECCD C[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)CCN1S(C)(=O)=O 276549552 HIVHVXBYOMGMDR-QMMMGPOBSA-N 332.353 0.343 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](CC(N)=O)C2)cc1 283632538 WRWQNAHHXFXAAR-CQSZACIVSA-N 346.431 0.483 10 20 ECCD CS(=O)(=O)NC1CC(NCc2ccc(N3CCOCC3)cc2)C1 800890479 JLRDQTLYIPAFDG-UHFFFAOYSA-N 339.461 0.693 10 20 ECCD COC(=O)C1(CNC(=O)c2c(F)ccc(O)c2O)CCOCC1 828167120 RHUHKZIDCZHJOI-UHFFFAOYSA-N 327.308 0.937 10 20 ECCD C[C@H](CO)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918117336 CJKJXHJBNXSHDS-TZMCWYRMSA-N 334.420 0.568 10 20 ECCD CCN1CC[C@@H](OC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 849712804 RPAHTPDEPVBQLP-GFCCVEGCSA-N 342.373 0.541 10 20 ECCD COCCOc1ccc(CNC(=O)c2c(F)ccc(O)c2O)nn1 857263020 SWWHERLZSBDZAS-UHFFFAOYSA-N 337.307 0.982 10 20 ECCD C[C@H](N)CN(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 861786111 FIEJDFOGEGLSKT-ZDUSSCGKSA-N 348.447 0.070 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCCCNCCn2cncn2)cc1 1177237460 AOVGAWKDAHTNMA-UHFFFAOYSA-N 344.379 0.850 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)N(CCN)CCO)N(C)C)cc1 1346712330 PKVMRTPIAFCNPK-INIZCTEOSA-N 337.468 0.318 10 20 ECCD COc1ccc(N2CCN(C(=O)c3cnn(CCO)c3)CC2)cc1 1346654160 CMBZLSRFXFAQFL-UHFFFAOYSA-N 330.388 0.846 10 20 ECCD C[C@H](NC(=O)C(=O)N1CC(F)C1)c1ccc(N2CCOCC2)cc1 1341058222 GCMHQPDKSJMLGT-LBPRGKRZSA-N 335.379 0.881 10 20 ECCD O=C(CCn1cnnn1)NCc1ccc(N2CCC(CO)CC2)cc1 1353995501 WSPYWCWFXJOTFY-UHFFFAOYSA-N 344.419 0.588 10 20 ECCD NC(=O)Cc1occc1C(=O)N1CCc2c(-c3nn[nH]n3)cccc21 1606420088 YFKRJEAHZUEPAQ-UHFFFAOYSA-N 338.327 0.690 10 20 ECCD COCCC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249605 CNPSYVZVUFVXLN-UHFFFAOYSA-N 335.360 0.346 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1cccc(C(=O)O)c1=O 1592883387 RLXBTZWVTDCKCM-SNVBAGLBSA-N 346.339 0.705 10 20 ECCD C[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)S(C)(=O)=O 54284092 FQDIHAQARYBEHC-LBPRGKRZSA-N 326.418 0.573 10 20 ECCD COCCNC(=O)CN1CCN(Cc2cc(Cl)ccc2O)CC1 121257682 QTYOBHIMADFLAK-UHFFFAOYSA-N 341.839 0.926 10 20 ECCD O=C1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)CCN1 80017742 MKSBPXIACIOKQJ-UHFFFAOYSA-N 334.445 0.881 10 20 ECCD CN(C)c1ccc(CN2C(=O)[C@@H]3CS(=O)(=O)CCN3C2=O)cc1 280881803 AGOKXKFCWXKXEG-ZDUSSCGKSA-N 337.401 0.314 10 20 ECCD CN(CCO)C(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 297799912 IYQJBSUVEMSKJL-CQSZACIVSA-N 336.388 0.351 10 20 ECCD CCOCCONC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662998 QJOVXQNFQBISAW-UHFFFAOYSA-N 327.356 0.592 10 20 ECCD CCS(=O)(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 726974162 CYHWAEGVAUZXST-UHFFFAOYSA-N 332.447 0.361 10 20 ECCD Nc1ccc(CC(=O)Nc2ccn(CCN3CCOCC3)n2)cc1 831920803 CRQWXJOMTSVMSA-UHFFFAOYSA-N 329.404 0.979 10 20 ECCD O=C(Cn1cc(C(=O)O)nn1)NCc1c(O)ccc2c1CCCC2 833120958 VRMVMCBWCIFWRT-UHFFFAOYSA-N 330.344 0.877 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@@H]3CCN(C)C(=O)C3)cc2)CC1 881850559 YDRUTHXKLSIJHQ-MRXNPFEDSA-N 344.459 0.923 10 20 ECCD CCNS(=O)(=O)[C@H]1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 770680060 WNEXAXSFQARBSQ-FZMZJTMJSA-N 342.417 0.332 10 20 ECCD C[C@@H]1CN2CCN1C[C@@H]2C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 1121810578 YWTVMCQGWWKVIA-KBRIMQKVSA-N 331.464 0.257 10 20 ECCD CNC(=O)[C@@]1(C)CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785427954 HUEHYZMLQXZTTJ-SFHVURJKSA-N 346.431 0.353 10 20 ECCD Nc1ccc(CC(=O)N2CCN(S(=O)(=O)c3cc[nH]n3)CC2)cc1 1326039303 XLQPGFJRVKNEMN-UHFFFAOYSA-N 349.416 0.068 10 20 ECCD CN1CCN(c2ccc(CN(CCO)CCCO)cc2F)CC1 1254010407 CWBYCRSWIHWQJM-UHFFFAOYSA-N 325.428 0.754 10 20 ECCD CC1(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)COC1 1843248739 JIHCJLMQHVPYBP-UHFFFAOYSA-N 347.371 0.346 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCN1CCNC(=O)C1 272849095 HDGFBIZKGNTXGW-UHFFFAOYSA-N 347.463 0.716 10 20 ECCD COC(=O)c1cn([C@@H]2CCN(Cc3cc4c(cc3O)OCO4)C2)nn1 376926124 HRPIWQKFLVAJDZ-LLVKDONJSA-N 346.343 0.946 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C(=O)O)[C@@H](C)C3)nc12 829889427 AQZAZGZYPOUNMV-JOYOIKCWSA-N 348.359 0.764 10 20 ECCD O=C1CN(CC(=O)NCc2ccc(N3CCCCC3)cc2)CCN1 900405372 VXXUYWZRPHFMNI-UHFFFAOYSA-N 330.432 0.725 10 20 ECCD CN1CC[C@H]2[C@H](CCCN2C(=O)C(=O)NCCc2ccc(N)cc2)C1 842238470 QUCZMHQYBNLERE-WBVHZDCISA-N 344.459 0.870 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H](N)[C@@H](C)C1 842151923 DKNSMEHVBOWNRA-BBRMVZONSA-N 332.448 0.873 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCc3ncccn3)C2)cc(OC)n1 1020352510 SXCZCVPJCBIPBE-JOCQHMNTSA-N 343.387 0.939 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N[C@@H]3CCOC[C@H]3O)cc2)CC1 889659113 QUWKCBJZNITRMZ-IAGOWNOFSA-N 348.447 0.387 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)N(C)[C@@H]3COC[C@H]3O)C2)cc1 889265182 UKVJTGPXIIAXEK-IAOVAPTHSA-N 349.431 0.923 10 20 ECCD 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ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N[C@@H]1CCCNC1 842070778 SIHXWHIGJWMALZ-GDBMZVCRSA-N 346.475 0.976 10 20 ECCD N[C@H](CNC(=O)C(=O)NCCCSc1nccs1)C1CC1 842094129 WGMCVACQDFUZBJ-SNVBAGLBSA-N 328.463 0.595 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC[C@H]1COCO1 923338394 ZEJQNXXQOLQYIE-INIZCTEOSA-N 335.404 0.820 10 20 ECCD CC(C)(C)N1CC[C@@H](NC(=O)C(=O)NCCc2ccc(N)cc2)C1 851688164 RUJHBOIMVURBHQ-OAHLLOKOSA-N 332.448 0.917 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC[C@@H]2CCOC2=O)c1 754084160 CMUDTXQDYWGMFU-VIFPVBQESA-N 343.357 0.874 10 20 ECCD C[C@@H](NC(=O)COC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)N(C)C 759592896 BGPKMUASLKTTPS-ONRRBMGISA-N 336.344 0.247 10 20 ECCD CCN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CCN(CC(N)=O)C1 1034053068 OUIXFJZBUXZXGS-ZDUSSCGKSA-N 346.391 0.871 10 20 ECCD CNC(=O)N1CCN(Cc2ccc(N3CCN(C)CC3)cc2)CC1 775724976 PGPVQWJZLFXNNA-UHFFFAOYSA-N 331.464 0.895 10 20 ECCD COc1cccc(CNC(=O)N[C@@H](C)[C@H]2CN(C)CCN2C)c1O 1123793361 BLMJXSRITOHQII-GXTWGEPZSA-N 336.436 0.834 10 20 ECCD 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Cc1cccc(CN[C@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)c1O 271869051 MCTDPOWMQFAOPK-LSDHHAIUSA-N 340.445 0.288 10 20 ECCD CC(C)NS(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 272141064 BNUIIGKDPZTPSN-UHFFFAOYSA-N 331.413 0.995 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCNC3)CC2)cc1 842226135 MHSFTRKOIGFGJP-CQSZACIVSA-N 346.431 0.212 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCC1(N)CC1 911501274 BHAMFMZADYKJJJ-UHFFFAOYSA-N 346.431 0.089 10 20 ECCD NC(=O)c1ncn(C2CCN(C(=O)c3cccc(O)c3O)CC2)c1N 848039704 RVJIKKKBBYCUIA-UHFFFAOYSA-N 345.359 0.453 10 20 ECCD CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1cccc(O)c1O 862845392 XOEYUYHFXYSBSH-GHMZBOCLSA-N 328.390 0.688 10 20 ECCD CCNS(=O)(=O)N1CCN(c2ccc(OC)cc2OC)CC1 867732004 VRKFMLDQHOXVJB-UHFFFAOYSA-N 329.422 0.680 10 20 ECCD CC(=O)NC[C@H]1CN(Cc2ccc(N3CCN(C)CC3)cc2)CCO1 775700136 GGMSMINMUIHAAO-IBGZPJMESA-N 346.475 0.775 10 20 ECCD C[C@@]1(C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)CNC(=O)C1 1089850776 HLEBAJPOISTCPO-KRWDZBQOSA-N 347.394 0.785 10 20 ECCD 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C[C@H](CNC(=O)C(=O)N(C)Cc1ccccc1O)CN1CCOCC1 1117145532 BLHUPNWXACHRJC-CQSZACIVSA-N 349.431 0.435 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CCOC[C@H]1O 875140996 JXCYVAJYZMWHKS-HZPDHXFCSA-N 335.404 0.472 10 20 ECCD C[C@@H](O)CN(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 774180267 QGKDJFOYCWHEOG-HIFRSBDPSA-N 348.447 0.911 10 20 ECCD O=C(CNC(=O)Cc1ccc(O)cc1)NCCc1ccc(O)c(O)c1 781097114 LSRFDELXYYSBFB-UHFFFAOYSA-N 344.367 0.821 10 20 ECCD C[C@H](NC(=O)C(=O)NCCN1CCNC1=O)c1ccc(N(C)C)cc1 897864739 AFOWRMLJQIBCJO-LBPRGKRZSA-N 347.419 0.071 10 20 ECCD C[C@H](CC(N)=O)C(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089849840 GVGRNXAZUINADD-LLVKDONJSA-N 335.383 0.770 10 20 ECCD COc1ccc(CNC(=O)C2(S(C)(=O)=O)CCNCC2)c(O)c1 1326316435 HMPWQSMECMONDX-UHFFFAOYSA-N 342.417 0.184 10 20 ECCD O=C(Cn1cccc(C(=O)O)c1=O)NCCc1ccc(O)c(O)c1 1608379563 UMLYWIYZRGSOKW-UHFFFAOYSA-N 332.312 0.317 10 20 ECCD C[C@@H](NCc1nnc2n1CCC2)c1cccc(-c2nn[nH]n2)c1O 1589976128 HXQAEGRAPXTXCN-SECBINFHSA-N 326.364 0.961 10 20 ECCD 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346.431 0.895 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N[C@@]3(C)CCNC3)cc2)CC1 892938582 BCVQEQLCMHBZED-SFHVURJKSA-N 331.464 0.990 10 20 ECCD CN(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1cc(F)cc(F)c1O 893961045 CATUFVDMNUZTJW-NSHDSACASA-N 348.371 0.406 10 20 ECCD COC[C@H](C)C(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089818727 AQGYYCWVOSJOLO-LBPRGKRZSA-N 345.407 0.445 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@H]3C[C@H]3C(N)=O)CC2)ncn1 1089866671 OBOXGCMYMKJCCZ-KGLIPLIRSA-N 329.404 0.549 10 20 ECCD Cn1ncc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 1327094652 GBIIQZGZDXDKJE-UHFFFAOYSA-N 335.433 0.340 10 20 ECCD CN(C)C(=O)CCCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1325892418 RUPILTQOHRUUAT-UHFFFAOYSA-N 348.447 0.696 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3CSCN3)cc2)CC1 1331449574 LWYDQPYDJKABRL-HNNXBMFYSA-N 348.472 0.667 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCC(=O)NC(C)C 1260176203 FKQFZQTWPFZVLD-UHFFFAOYSA-N 348.447 0.708 10 20 ECCD C[C@@H](O)[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1342030397 WTAAFWXETSYNNE-ZJUUUORDSA-N 328.390 0.607 10 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Cc1ccc(O)c(CNC(=O)c2nc(N)nc(N3CCOCC3)n2)c1 862755369 FUBOEBPHDPOPLU-UHFFFAOYSA-N 344.375 0.234 10 20 ECCD O=C1NN(c2ccccc2)C(=O)/C1=C\c1cn(C[C@@H]2CCCO2)nn1 865219420 XLYWTMUZRRPOIC-BUYRESAOSA-N 339.355 0.919 10 20 ECCD COc1cc(C(=O)NC2CN(CCc3ccnn3C)C2)cc(OC)n1 1030612404 NPNULQVIEQKSPV-UHFFFAOYSA-N 345.403 0.489 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@@H](O)C3)CC2)cc1 874242941 JWSOUQFMOJICRP-FZNQNYSPSA-N 333.432 0.704 10 20 ECCD CN1CCN(c2ccc(CNCCCNS(C)(=O)=O)cc2)CC1 771822539 GJMDXSDKZNWLLH-UHFFFAOYSA-N 340.493 0.467 10 20 ECCD CS(=O)(=O)N[C@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 779479365 NCNIFJILKILLMX-PZBABLGHSA-N 340.401 0.651 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@H]1CNCCS1(=O)=O 1340187028 XCTMQZRIKFXUDU-HNNXBMFYSA-N 339.461 0.488 10 20 ECCD O=C(O)CN1CCC[C@@H](C(=O)NCc2cccc(Cl)c2O)C1=O 1606252393 YIRFUMRDXZBIOI-JTQLQIEISA-N 340.763 0.985 10 20 ECCD Cc1nn(CC(=O)c2ccc(O)c(O)c2)c(=O)c(-c2nn[nH]n2)c1C 1592438963 ZSNOHGVJEMHJOX-UHFFFAOYSA-N 342.315 0.334 10 20 ECCD 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CCOC(=O)[C@@H]1NCC[C@@H]1NCc1ccc(N2CCN(C)CC2)cc1 925764465 ZCHOXRDEUSNXRE-ZWKOTPCHSA-N 346.475 0.822 10 20 ECCD COC(=O)c1cc(/C=C2/SC(=S)N(CC(N)=O)C2=O)c[nH]1 753140113 YONJREMTDJLEBR-FPYGCLRLSA-N 325.371 0.488 10 20 ECCD C[C@H](N)CN(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 861564287 JWCOKEDSZQOKHO-ZFWWWQNUSA-N 347.463 0.877 10 20 ECCD CNC(=O)C1(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)CC1 870164123 OJUIIVDHFVUPHM-UHFFFAOYSA-N 347.415 0.879 10 20 ECCD CNC(=O)[C@@H]1CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCO1 773627012 VOLQXDHMVQNROL-DOMZBBRYSA-N 334.420 0.970 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1C[C@@H]2CC[C@H](C1)N2 884637944 GTLAYZZLZJTDSR-IYBDPMFKSA-N 342.443 0.866 10 20 ECCD COc1ccc(-n2nnnc2CN[C@@H]2CCN(C(=O)C3CC3)C2)cc1 965991181 KYTGDNPDNJXYOW-CYBMUJFWSA-N 342.403 0.771 10 20 ECCD CNC(=O)CCN(C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788930792 AFLJIUMRGYTFSH-UHFFFAOYSA-N 346.431 0.498 10 20 ECCD CNS(=O)(=O)c1cccc(CNC(=O)c2cccc(O)c2O)c1 790535343 HSAIQXYXYFJFDW-UHFFFAOYSA-N 336.369 0.936 10 20 ECCD CNS(=O)(=O)c1cc(C(=O)NCc2ccc(OC)cc2O)co1 794388410 SEHBBTPLWVGBCL-UHFFFAOYSA-N 340.357 0.832 10 20 ECCD COc1ccc(CNC(=O)C(=O)Nc2cncnc2N(C)C)c(O)c1 797389552 NBKJLEPSFDSBSC-UHFFFAOYSA-N 345.359 0.512 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H]2C[C@@]2(CO)C1 1346556292 WTNMNEBGJVQWIL-KDOFPFPSSA-N 331.416 0.518 10 20 ECCD O=C(O)[C@@]1(C(=O)NCc2ccc(N3CCOCC3)cc2)CCCO1 1605930870 MGDCGSCGOGMUHO-KRWDZBQOSA-N 334.372 0.773 10 20 ECCD CNC(=O)NCC(=O)N(C)CCCNCc1ccc(OC)c(C)c1 1754373540 HXJTXTSLBGJPKL-UHFFFAOYSA-N 336.436 0.871 10 20 ECCD COCCOC[C@H](NCc1ccc(N2CC[C@@H](O)C2)cc1)C(=O)O 1777218151 CNYJNVHELXRCHN-CVEARBPZSA-N 338.404 0.463 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CCCN3C(N)=O)CC2)cc1 80296161 WLOUXJJZKDIFSM-HNNXBMFYSA-N 332.404 0.887 10 20 ECCD Nc1ccc(CC(=O)NCCS(=O)(=O)N2CCSCC2)cc1 262650096 WIBWDIIDKAFBEH-UHFFFAOYSA-N 343.474 0.306 10 20 ECCD CCS(=O)(=O)NCCN(C)c1ccc(OCC(=O)OC)cc1 273151248 XSKSDLFTWFJILP-UHFFFAOYSA-N 330.406 0.614 10 20 ECCD CCN1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 283370033 FVTOQAVBGQPXPV-UHFFFAOYSA-N 332.448 0.923 10 20 ECCD COCCOC[C@H](O)CN(C)c1ccc(OCC(=O)OC)cc1 295068571 WCSCOFHURVTQJL-CQSZACIVSA-N 327.377 0.699 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C3(C(N)=O)CC3)cc2)C1 731612220 HVSAUYXBAGEUHS-CYBMUJFWSA-N 344.415 0.270 10 20 ECCD C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCN1 842149028 SSLJYMNFJYVSTJ-DGCLKSJQSA-N 336.411 0.765 10 20 ECCD Cn1cc(C[C@@H](CO)CNC(=O)/C=C/c2ccc(O)c(O)c2)cn1 848036200 CURNDFSFJJPIMM-LYKUJDHUSA-N 331.372 0.812 10 20 ECCD NC(=O)COc1cccc(NC(=O)C(=O)NCc2ccccc2O)c1 748481861 PRAVKUZZXHELFZ-UHFFFAOYSA-N 343.339 0.511 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)Cn2ccc(O)nc2=O)cc1 846445598 BGBKENHZIKNYQS-UHFFFAOYSA-N 346.387 0.552 10 20 ECCD CC(C)[C@@H](CO)ONC(=O)c1cc(NS(C)(=O)=O)ccc1O 857286673 GABURYZYJRCLJG-GFCCVEGCSA-N 332.378 0.442 10 20 ECCD CC[C@@]1(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCNC1=O 881854537 FXDXACDBOKLURV-LJQANCHMSA-N 344.459 0.971 10 20 ECCD COc1ccc(CNCCNC(=O)CN2CCCNC2=O)cc1C 1130784565 YNJMUWAOCVLKAB-UHFFFAOYSA-N 334.420 0.625 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cnns3)C2)cc(OC)n1 996369447 XHVKKFKCHUKFRJ-UHFFFAOYSA-N 349.372 0.205 10 20 ECCD CN(C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)C1CC(O)C1 1323193929 KBFJRNHWSVMLCD-UHFFFAOYSA-N 347.415 0.121 10 20 ECCD COC(=O)N1CC(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1343405314 JSDSDWUMHGXYRW-LLVKDONJSA-N 348.403 0.497 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CCCC(=O)N1 800242030 LPYSJBPVJWNREN-OAHLLOKOSA-N 347.415 0.923 10 20 ECCD COC(=O)c1ccc(C(=O)Nc2nc(C3=S=CC=C3)n[nH]2)n1C 815338838 PTEIEIBDTRRPJO-UHFFFAOYSA-N 331.357 0.808 10 20 ECCD COCCN(C)C(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 824973523 CPCFYHDHZHEFJO-CQSZACIVSA-N 349.431 0.743 10 20 ECCD CCn1nc(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)ccc1=O 832272546 GRGNUUXNXRMGSY-AWEZNQCLSA-N 329.404 0.759 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cnn[nH]3)cc2)C1 918371622 HSRPDMBKHABZFK-LBPRGKRZSA-N 328.376 0.436 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2CCCNC2)cc1 846343245 JXSRAMLGZMMRCV-AWEZNQCLSA-N 348.447 0.458 10 20 ECCD COc1cccc(CNC(=O)CS[C@H]2CCS(=O)(=O)C2)c1O 769508075 OGNHPRYGRKRSQT-NSHDSACASA-N 345.442 0.937 10 20 ECCD COc1ccc(N2CCN(C(=O)c3cc(=O)n(C)cn3)CC2)cc1 873779619 XTEZNYCGUGGSMS-UHFFFAOYSA-N 328.372 0.751 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CN(C)CCO3)CC2)c(OC)c1 870165365 WIKJIYSPJASBOS-KRWDZBQOSA-N 349.431 0.683 10 20 ECCD COc1ccncc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774363823 XHYBFBGSNIEQIY-UHFFFAOYSA-N 331.328 0.799 10 20 ECCD NS(=O)(=O)c1ccc(F)c(CNC(=O)c2cccc(O)c2O)c1 790721107 UDVBTSLMYJHTCM-UHFFFAOYSA-N 340.332 0.814 10 20 ECCD COc1ccc(CNCCNC(=O)COCc2nncn2C)cc1C 1146209117 UVTPEOTXKNLIEX-UHFFFAOYSA-N 347.419 0.555 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3COC[C@H]3C2)cc1F 1332776108 KSQRNDWRRIZKQB-BETUJISGSA-N 335.379 0.613 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cc([C@H](C)O)nn3)CC2)cc1 268819986 JPQVSPWUSAMETO-ZDUSSCGKSA-N 345.403 0.689 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1[C@@H](CO)CC[C@@H]1CO 287538691 VVBORNVBVCDIMX-IAGOWNOFSA-N 335.448 0.529 10 20 ECCD CN1CCCc2cc(CNC(=O)CCn3ncn(C)c3=O)ccc21 292926648 GOYAIFCWGYBGOR-UHFFFAOYSA-N 329.404 0.671 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@@H]2C(N)=O)c1 299070780 GBYVGXUSEQJEHV-LLVKDONJSA-N 341.389 0.244 10 20 ECCD CN1CCN(c2ccc(CNCCCn3cc(CO)nn3)cc2)CC1 810162656 ORDZANASQWACDN-UHFFFAOYSA-N 344.463 0.702 10 20 ECCD C[C@H](NC(=O)NC[C@@H]1CNCCO1)c1ccc(N2CCOCC2)cc1 841742405 XBSSUOCJWQALEF-YOEHRIQHSA-N 348.447 0.872 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCN([C@H]3CCNC3)CC2)c1O 843125098 WBVYPIAETRWSGH-ZDUSSCGKSA-N 336.392 0.789 10 20 ECCD CNC(=O)CN1CCC(NC(=O)N[C@H](C)c2ccccc2O)CC1 868044732 QYOYYPFSFSJHLH-GFCCVEGCSA-N 334.420 0.963 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCC(NCCO)CC2)cc1 866683400 YJLYEANEERWLNK-UHFFFAOYSA-N 334.464 0.415 10 20 ECCD COc1ccc(-n2nnnc2CN2CC(NC(=O)C(F)F)C2)cc1 1030037145 NTJOZEHMEOXWEX-UHFFFAOYSA-N 338.318 0.236 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2Cc1nnc2c(=O)n(C)ccn12 878319114 JUKQBGZKFHAIMA-UHFFFAOYSA-N 340.387 0.893 10 20 ECCD COc1cc(C(=O)NC2CN(Cc3cncn3C)C2)cc(OC)n1 1030612378 MWPGJASRQBBYLU-UHFFFAOYSA-N 331.376 0.447 10 20 ECCD COC(=O)CNC(=O)[C@@H]1CCCN1Cc1cc(C)cc(OC)c1O 895025092 MNGXDILGUXGRKG-ZDUSSCGKSA-N 336.388 0.963 10 20 ECCD CCN1C(=O)[C@H]2CN(Cc3ccc(OC)c(OC)c3O)CCN2C1=O 892218869 WNCQTYSCIYZPFS-GFCCVEGCSA-N 349.387 0.878 10 20 ECCD O=C1NCC2(CCOCC2)[C@H]1NCc1ccc(N2CCOCC2)cc1 895772790 LMCWZQMSIGPOKJ-KRWDZBQOSA-N 345.443 0.908 10 20 ECCD C[C@@]1(O)CCN(C(=O)C(=O)NCCCSc2nccs2)C1 1342165295 HHQRZQCWXCAQSE-CYBMUJFWSA-N 329.447 0.725 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)c2cccnc2OCCO)cc1 1578424540 KTEPMQISJVGEGB-INIZCTEOSA-N 344.415 0.949 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C[C@@H](O)CN1CCOCC1 154190797 IEKFSTUVKBYFEI-LJQANCHMSA-N 349.475 0.648 10 20 ECCD O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCNC1=O 70976663 CDZUJAKOFNVKSS-AWEZNQCLSA-N 333.388 0.925 10 20 ECCD COc1cccc(CNC(=O)[C@H]2CC(=O)N(c3cn[nH]c3)C2)c1O 364395378 XAYHUIPKONCHGI-NSHDSACASA-N 330.344 0.793 10 20 ECCD O=C(CN1CCCN(C(=O)c2cccc(O)c2O)CC1)N1CCCC1 274869497 DLHMXFALGQRNGS-UHFFFAOYSA-N 347.415 0.868 10 20 ECCD COCCN(C(=O)c1ccc(C)c(O)c1O)[C@@H]1CCS(=O)(=O)C1 271255927 IQAGVGNMTLOHTE-LLVKDONJSA-N 343.401 0.682 10 20 ECCD CN(C)c1ccc(CNc2[nH]nc3c2c(=O)n(C)c(=O)n3C)cc1F 902665639 YDQNQINHKSQNLU-UHFFFAOYSA-N 346.366 0.778 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNC[C@H]3CCN3C)CC2)cc1 905547412 WPCLXBDJMXDIEU-QZTJIDSGSA-N 348.491 0.472 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CCNC1=O 831706575 GWPUUUAVPFZTFT-NSHDSACASA-N 340.763 0.683 10 20 ECCD CCO[C@@H]1C[C@](CO)(NC(=O)C(=O)Nc2ccc(N)cc2)C1(C)C 841117977 APZCVBWINUACQJ-CXAGYDPISA-N 335.404 0.890 10 20 ECCD CN(C)CC[C@@H](N)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 846672356 FZAZMUPJXXYHBI-GOSISDBHSA-N 348.491 0.791 10 20 ECCD C[C@H](NC(=O)[C@H](N)CCN(C)C)c1ccc(N2CCOCC2)cc1 846672223 DMSJKKQWKVUANS-WMLDXEAASA-N 334.464 0.979 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@H](N)C3)CC2)cc1 923281832 RAUIGHHFPLOOJT-DOTOQJQBSA-N 334.464 0.211 10 20 ECCD C[C@H](NC(=O)COC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)N(C)C 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Nc1ccc(CCNC(=O)N2CCN(CC(=O)NC3CC3)CC2)cc1 841963107 WPVQLEHHTLVIDH-UHFFFAOYSA-N 345.447 0.417 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCN2CCCC2=O)cc1 846724082 QDILQJCOQYLJOY-UHFFFAOYSA-N 332.404 0.107 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3CN)CC2)cc1 923292298 HIQCVEIIAUPEOE-MSOLQXFVSA-N 348.491 0.601 10 20 ECCD CC(C)(C)N1CC[C@H](NC(=O)C(=O)NCCc2ccc(N)cc2)C1 851688163 RUJHBOIMVURBHQ-HNNXBMFYSA-N 332.448 0.917 10 20 ECCD CCOc1cccc(CNCCNS(=O)(=O)NC(C)C)c1O 758560689 JBJXPGBJEGAPDV-UHFFFAOYSA-N 331.438 0.713 10 20 ECCD COc1ccc(CNC[C@H]2CCN(C(=O)Cn3ncnn3)C2)cc1C 1026847881 RAIKLPDJTUBKEQ-OAHLLOKOSA-N 344.419 0.628 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCC2[C@H]3CN(CCO)C[C@H]23)cc1 979159582 PAGNTXURVBAKRJ-ZIAGYGMSSA-N 331.376 0.749 10 20 ECCD Cn1cc(C(=O)NCCc2ccc(O)c(O)c2)c(=O)c2cnn(C)c21 791219586 DVSOLSDGRRXQKP-UHFFFAOYSA-N 342.355 0.656 10 20 ECCD CCn1ncnc1CNCCNC(=O)c1ccc(N=NC(N)=O)cc1 1153047309 ASJTYZLTNNJNIO-UHFFFAOYSA-N 344.379 0.980 10 20 ECCD CSCC(=O)NCCC1=CCN(c2ncnc3c2nnn3C)CC1 1089804849 WDYQOMMZWMVLQY-UHFFFAOYSA-N 347.448 0.764 10 20 ECCD CNC(=O)NCC(=O)NCCC1=CCN(c2nc(C)ncc2C)CC1 1089867170 FBKSXDCDHGYYQF-UHFFFAOYSA-N 346.435 0.665 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](C)[C@@H](C)N)cc2)CC1 1329287532 NNZNNADNLAACCF-ZIAGYGMSSA-N 332.448 0.955 10 20 ECCD NC(=O)C1CCN(C(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)CC1 1325400455 IRBYXIBCKGXBKG-DUXPYHPUSA-N 348.355 0.378 10 20 ECCD CN1CCN(c2ccc(CNC[C@]3(O)CCN(C)C3)cc2F)CC1 1320222090 WXNUQNIGCMBWMH-GOSISDBHSA-N 336.455 0.734 10 20 ECCD CNC(=O)CN(C)[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1194368029 OEBYVZASMYOXIA-ZDUSSCGKSA-N 346.391 0.741 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@@H]2CC(=O)N(c3cn[nH]c3)C2)c1 364362854 WPGOFONDAZYHNR-LLVKDONJSA-N 330.344 0.793 10 20 ECCD CN1CCN(CCCN(C)C(=O)c2c(F)ccc(O)c2O)CC1 276639392 UVHMJFIUCVYKPB-UHFFFAOYSA-N 325.384 0.946 10 20 ECCD CN1CCC(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 285122164 YDWMWCOGDUUBRP-UHFFFAOYSA-N 332.448 0.921 10 20 ECCD CC1CCN(c2ccc(CNC(=O)[C@@H](CO)NC(N)=O)cc2)CC1 294720882 VCWCFEVAPWYVLB-OAHLLOKOSA-N 334.420 0.568 10 20 ECCD O=C1NC(=O)N2CCN(Cc3ccc(Br)cc3O)C[C@H]12 825447505 VLOCUNVCQVHNIP-SNVBAGLBSA-N 340.177 0.891 10 20 ECCD O=C(O)CN(CC(=O)N1CCOCC1)Cc1cc(Cl)ccc1O 739783804 LIZGVOBXWYWUQL-UHFFFAOYSA-N 342.779 0.791 10 20 ECCD CN(C)c1ccc(CN(C(=O)C(=O)NCCCON)C2CC2)cc1 911507271 UFSJSRIJFDKCNN-UHFFFAOYSA-N 334.420 0.640 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CCCNCC3)ccc21 842149985 JQHQYOASVXHZCG-MRXNPFEDSA-N 344.459 0.944 10 20 ECCD C[C@@H]1C[C@H](CN)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 842171799 XIXZBULMADXWAQ-GDBMZVCRSA-N 342.443 0.875 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CNCCO1 843489217 JDLLUHONFPTULM-ZDUSSCGKSA-N 342.779 0.536 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CN2C(=O)CN(C)C2=O)cc1 846446456 LKZRMLGUAYGQCA-UHFFFAOYSA-N 348.403 0.484 10 20 ECCD COc1ccc(CNC[C@@H]2CCN(C(=O)c3nnn(C)n3)C2)cc1C 1027001584 LOZAGXDRCQWGME-AWEZNQCLSA-N 344.419 0.779 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)NCC(F)F 753801766 UEWVRSCVGFYKLX-UHFFFAOYSA-N 345.321 0.660 10 20 ECCD CN1CCN(c2ccc(CN3CCN4C(=O)NC(=O)[C@H]4C3)cc2)CC1 779433156 QTLXOPIZVMFTRX-MRXNPFEDSA-N 343.431 0.174 10 20 ECCD CN(C)c1ccc(CNC(=O)N[C@@]2(C(=O)O)CCOC2)cc1F 797715784 UIJUWVILYFNFPS-HNNXBMFYSA-N 325.340 0.935 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@]3(C)CCNC3=O)CC2)ncn1 1089864996 IZTOBFZKAOUSQL-GOSISDBHSA-N 343.431 0.954 10 20 ECCD CCOc1cc(N2CC=C(CCNC(=O)CNC(N)=O)CC2)ncn1 1089804564 LWFCGFUDSAFBMH-UHFFFAOYSA-N 348.407 0.186 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)c3nnn(C)n3)CC2)ncn1 1089854450 VVNDXPCZAVLGDV-UHFFFAOYSA-N 328.380 0.265 10 20 ECCD COc1ccc(CNC[C@H](C)NC(=O)C[C@@H]2CC(=O)NC2=O)cc1C 1754296980 HLSTXWMIYYVMDT-GXTWGEPZSA-N 347.415 0.651 10 20 ECCD O=C1CNC(=O)N1CCN(Cc1ccccc1O)C[C@@H]1CCCO1 264674566 AIKKPBFVGZMJDE-AWEZNQCLSA-N 333.388 0.925 10 20 ECCD CC1(Cn2cc(C(=O)NCCc3ccc(O)c(O)c3)nn2)COC1 273723736 PURUMENNTMKVIY-UHFFFAOYSA-N 332.360 0.698 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cnnn1C 810351887 YEFAUHARKWNLHJ-UHFFFAOYSA-N 330.392 0.868 10 20 ECCD Cn1ncc(CNCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 815117189 NHIXNVBYJSIICP-CQSZACIVSA-N 328.420 0.807 10 20 ECCD CCNC(=O)CNC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 822580131 QSKFNUDLROADAQ-ZDUSSCGKSA-N 334.420 0.957 10 20 ECCD CN(CCN1CCNCC1)CC(=O)NCc1ccc(N(C)C)cc1 844219597 LVBWSMNUUIURMO-UHFFFAOYSA-N 333.480 0.206 10 20 ECCD CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NCCN)cc1 842222867 UKSRUFHHDJIIGH-UHFFFAOYSA-N 344.415 0.949 10 20 ECCD COc1ccc(O)c(CN2CCN([C@]3(C(=O)O)CCOC3)CC2)c1 1599599001 ZECCFBDCCXMWDM-QGZVFWFLSA-N 336.388 0.762 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CC=C(C(=O)O)C2)c1 1599761211 QJMNXKNAKCRSHF-VIFPVBQESA-N 340.357 0.667 10 20 ECCD CO[C@@]1(C(=O)O)CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 1599070472 UUZBBQCAWAXILU-KRWDZBQOSA-N 349.387 0.071 10 20 ECCD O=S1(=O)CC[C@@H](N2CCN(Cc3cc(F)ccc3O)CC2)C1 179889147 AQEPWXRNSKCXFK-CQSZACIVSA-N 328.409 0.836 10 20 ECCD COc1ccc(N2CCCN(CC(=O)N3CCN(C)CC3)CC2)cc1 178983774 MUDKBBHJZAOSGN-UHFFFAOYSA-N 346.475 0.981 10 20 ECCD Cc1cc(C(=O)N2CCN(C(=O)CO)CC2)c(C)n1-c1ccccn1 89547995 NMJVREKBHYVOGL-UHFFFAOYSA-N 342.399 0.766 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(CCO)CCOC)nc12 265673310 YGCRQRPAYXRZMC-UHFFFAOYSA-N 338.364 0.052 10 20 ECCD COCCN1C[C@@H](C(=O)N2CCOc3cc(N(C)C)ccc32)CC1=O 266386386 YLXUUFXLAPLEKG-ZDUSSCGKSA-N 347.415 0.973 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@]2(O)CCSC2)c1 267137307 SWSDQJWIYWOJPI-CYBMUJFWSA-N 346.430 0.362 10 20 ECCD CCOC(=O)[C@@H]1NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 277549510 ZQISVFDDFZOKJP-CQSZACIVSA-N 347.371 0.507 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CSCC(N)=O 298499855 YQPKOIIKDZXJOD-UHFFFAOYSA-N 337.445 0.700 10 20 ECCD N[C@@H]1CCN(C(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 817914931 CNCUOOZGQRVJTH-CABCVRRESA-N 347.415 0.459 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C1CN(S(C)(=O)=O)C1 900730703 AGBPASYMMWBYEY-UHFFFAOYSA-N 325.434 0.569 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCOC[C@@H]1CC(N)=O 832751390 RDEMPXQHQGTHHG-INIZCTEOSA-N 348.447 0.287 10 20 ECCD CCn1cc(S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)cn1 842785782 WCHXCHNDUYBUQL-OAHLLOKOSA-N 337.449 0.947 10 20 ECCD N[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 842192364 RKWLQWDOFVJLQG-OAHLLOKOSA-N 346.431 0.089 10 20 ECCD C[C@H](N[C@@H]1CCN(S(C)(=O)=O)C1)c1cc([N+](=O)[O-])ccc1O 846190657 UWJPIEQFPABNQW-VHSXEESVSA-N 329.378 0.985 10 20 ECCD CNC(=O)NC(=O)COC(=O)c1csc(Cc2ccc(N)cc2)n1 751937688 UBXBWZMYILOMSQ-UHFFFAOYSA-N 348.384 0.929 10 20 ECCD COc1cccc(CNC(=O)C(=O)Nc2cncnc2N(C)C)c1O 761066306 ROYFKUKDSXYEDS-UHFFFAOYSA-N 345.359 0.512 10 20 ECCD CN1CC[C@H](NC(=O)C(=O)NCCCSc2nccs2)C1=O 1117377230 SKFJCRJVKUYUCY-VIFPVBQESA-N 342.446 0.088 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)Cn2cccnc2=O)N(C)C)cc1 891251646 CVHCQLOQYJLBCR-MRXNPFEDSA-N 343.431 0.728 10 20 ECCD C[C@H](C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)S(C)(=O)=O 891256260 WPBLPFIBYZSEIE-DOMZBBRYSA-N 341.477 0.905 10 20 ECCD COc1ccc(CNC(=O)N[C@H](C)CN2CCN(C)CC2)c(O)c1 792990164 PPGQVEZJTIAKFU-CYBMUJFWSA-N 336.436 0.836 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3n[nH]cc3F)C2)cc(OC)n1 996380155 YLDLRQVGWKRKAL-UHFFFAOYSA-N 349.322 0.215 10 20 ECCD C[C@@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)NCC(=O)O 1609772984 DNXMJFSYSJJHLN-CHWSQXEVSA-N 335.404 0.763 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)OC1CNC1 1580713853 MGNHORUCGXFNBZ-UHFFFAOYSA-N 339.417 0.119 10 20 ECCD COc1ccc(CN[C@H](CO)CNC(=O)[C@H]2CCCNC2=O)cc1C 1755631936 NEGZAZDVWFLLBA-GJZGRUSLSA-N 349.431 0.097 10 20 ECCD CN(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1cc(F)ccc1O 179942511 REDXJKNYMGXZLS-LBPRGKRZSA-N 330.381 0.266 10 20 ECCD CN(C)c1ccc(CNC(=O)NC[C@H]2CC[C@@H](C(N)=O)O2)cc1F 126146753 XGCBMZANXREWTD-RISCZKNCSA-N 338.383 0.724 10 20 ECCD CCCN(CC(=O)NC)C(=O)c1cc(NS(C)(=O)=O)ccc1O 271321064 YGJIFQNZGWXGMH-UHFFFAOYSA-N 343.405 0.362 10 20 ECCD COC(=O)[C@@H]1C[C@@H](O)CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 826816555 HERCMMCJNNDHML-NXEZZACHSA-N 340.332 0.972 10 20 ECCD COc1cccc(CNC(=O)c2ccc(-c3nn[nH]n3)nc2)c1O 737131916 IIHQCNVKEKLIMY-UHFFFAOYSA-N 326.316 0.906 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NC[C@@H](C)CN)cc1 846341550 DCTSLZSVRJBEOL-ZDUSSCGKSA-N 336.436 0.301 10 20 ECCD COc1ccc(CNS(=O)(=O)N2CCC(OC)CC2)c(O)c1 849391821 UXBKTFJPCFAHDB-UHFFFAOYSA-N 330.406 0.846 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CC[C@@H]3NC(=O)CC[C@@H]3C2)cc1 852497126 UAUQIRURUFJMBV-WBVHZDCISA-N 344.459 0.969 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(C[C@H]3CCOC3)C2)cc(OC)n1 1015103383 NZVWPACTMFVYFJ-TZMCWYRMSA-N 335.404 0.939 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CCO[C@H]1CN 852857134 JTNGFXDKTAQCEM-SJORKVTESA-N 333.432 0.845 10 20 ECCD C[C@@H](CCN)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 851689598 RCUFTFZMKLQZRI-ZDUSSCGKSA-N 348.447 0.117 10 20 ECCD CS(=O)(=O)[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 763385569 WBJSLRXPIFWYCU-BXUZGUMPSA-N 327.402 0.827 10 20 ECCD O=C(NCCO)C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 768316109 CPJVEFDPJXCUEU-UHFFFAOYSA-N 347.459 0.844 10 20 ECCD CN1CCN(c2ccc(CN3CCN(C)C[C@@H]3CO)cc2F)CC1 1119246971 NBRGBRWGJKKUKY-MRXNPFEDSA-N 336.455 0.686 10 20 ECCD COc1ccc(-n2nnnc2CN2CC[C@](C)(NC(C)=O)C2)cc1 1046089525 GIEAWIYKHZCYJL-INIZCTEOSA-N 330.392 0.771 10 20 ECCD CCOC(=O)c1cn(CC(=O)NCc2ccc(N(C)C)cc2)nn1 881093598 CILGBFQZMMDJEU-UHFFFAOYSA-N 331.376 0.837 10 20 ECCD Cn1cc([C@H]2C[S@](=O)CCN2C(=O)c2cccc(O)c2O)cn1 799001211 NUWJMJGCHJSQRO-SFDCACGMSA-N 335.385 0.777 10 20 ECCD CN[C@@H](C)CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1325713445 RPKCRVSALFXSPP-ZDUSSCGKSA-N 332.448 0.799 10 20 ECCD CNC(=O)CCCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1322156124 MDJJOUASLWCDNU-UHFFFAOYSA-N 346.431 0.328 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3C[C@H](N)C3)ccc21 1331605049 WNKLHEHOAREZMG-CTYIDZIISA-N 330.432 0.539 10 20 ECCD COc1ccc(CNC(=O)NC[C@@H](C)N2CCN(C)CC2)c(O)c1 1347102891 UBWOMGVCBLRSBO-CYBMUJFWSA-N 336.436 0.836 10 20 ECCD CCn1ncnc1CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 1353003236 LEGWFILEQSVLDI-UHFFFAOYSA-N 349.460 0.823 10 20 ECCD O=C(O)/C=C/c1ccc(N2CCN3C(=O)NC(=O)[C@H]3C2)c([N+](=O)[O-])c1 1601881077 NBDSSUDZVYTPKZ-FXMSTWTQSA-N 346.299 0.433 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1cc(CC(=O)O)nn1 1606160561 PGIKMUHMIXTUMC-UHFFFAOYSA-N 331.376 0.630 10 20 ECCD Nc1ccc(CNC(=O)NCCS(=O)(=O)C2CCOCC2)cc1 1580445701 QEMDJUIMVASXLL-UHFFFAOYSA-N 341.433 0.662 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@]3(C(=O)O)CCCO3)CC2)cc1 1594101261 NHNBCOVLOYUPSA-KRWDZBQOSA-N 334.372 0.978 10 20 ECCD Cc1nc(C(=O)NCc2cccc(O)c2O)ccc1-c1nn[nH]n1 1592349433 PPQMXFKYUFIZLM-UHFFFAOYSA-N 326.316 0.911 10 20 ECCD COc1ccc(O)c(CN2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c1 179607315 NPVSIBOFTIGOQU-CQSZACIVSA-N 340.445 0.706 10 20 ECCD CN(C)C(=O)CN1CCC(NC(=O)NCc2ccccc2O)CC1 69427140 IRQYHBACUXNVTR-UHFFFAOYSA-N 334.420 0.744 10 20 ECCD CNS(=O)(=O)CCNC(=O)N(C)Cc1ccc(N(C)C)cc1 187851603 YOWKNZFGWCYQBT-UHFFFAOYSA-N 328.438 0.443 10 20 ECCD CN1CC[C@@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 265546098 SCDYUHYARMXXAM-JTQLQIEISA-N 327.406 0.445 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](CC(N)=O)C3)nc12 377599499 FJPDUVSESYSTNE-SNVBAGLBSA-N 347.375 0.309 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H]1CCCO1 283408341 YOORCBSEWYLQDG-INIZCTEOSA-N 347.415 0.435 10 20 ECCD CN(C(=O)/C=C/c1ccc(O)c(O)c1)[C@H]1CCN(S(C)(=O)=O)C1 293742019 LMPIZRYWRLNYLW-FUEXJSSKSA-N 340.401 0.603 10 20 ECCD CNC(=O)NCCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 292641450 FWYVUXXTENNNNP-UHFFFAOYSA-N 334.420 0.801 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@@H](CN)C1 817949690 MKEKKYVWECYZRE-AWEZNQCLSA-N 335.404 0.317 10 20 ECCD CC(C)OCCS(=O)(=O)NCC(=O)N(C)Cc1ccccc1O 748525673 HOJMYSGRODDJNF-UHFFFAOYSA-N 344.433 0.695 10 20 ECCD CCOC(=O)[C@H](N)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 852862930 NIQKQIAFDFCMTC-SWLSCSKDSA-N 335.404 0.591 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H]3CO)CC2)cc1 934015829 GVQMONLZAHJOJN-SJORKVTESA-N 335.448 0.245 10 20 ECCD Cc1ccc(CN2CCN(C(=O)C(=O)N3CCOCC3)CC2)c(O)c1 876553249 LWKXCJWOQVRFSU-UHFFFAOYSA-N 347.415 0.204 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1[nH]cc2c(=O)ncnc1-2 773745596 MQYZEQGCRORIKU-SECBINFHSA-N 343.343 0.230 10 20 ECCD 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COc1ccc(CN[C@H]2CCN(C(=O)Cn3ncnn3)[C@@H]2C)cc1C 986290945 SISCPPRZZJCXRJ-HIFRSBDPSA-N 344.419 0.769 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@H]3CC[C@@H]3C(N)=O)CC2)ncn1 1089849950 HGULCDIWAFOQMZ-GJZGRUSLSA-N 343.431 0.939 10 20 ECCD CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777848033 ZJVINBBAHCXSAJ-CXAGYDPISA-N 349.387 0.640 10 20 ECCD CCCNC(=O)CN1CCC(NC(=O)Cc2ccc(N)cc2)CC1 262217368 ZDDMEGDVXUHJGG-UHFFFAOYSA-N 332.448 0.918 10 20 ECCD COCCOCC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 276172661 SSOXIGZGPGUCQU-UHFFFAOYSA-N 349.431 0.634 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCCCCS(N)(=O)=O 845929334 ATKGLHFNGYXOFE-NSHDSACASA-N 344.433 0.994 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@H](CN)C3)CC2)cc1 923280892 JROJAHXJJPBXNM-SJLPKXTDSA-N 348.491 0.459 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(C(=O)c3cocn3)C2)cc(OC)n1 938307848 HIGLDFVAJNTFAJ-NSHDSACASA-N 346.343 0.731 10 20 ECCD C[C@@H]1CN(CC(N)=O)CC[C@@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 945220224 GOLBHVMOHIZSQD-MFKMUULPSA-N 346.391 0.775 10 20 ECCD 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C[C@@H]1CC(=O)NCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785424016 KKOUXYLHXYYGAL-GFCCVEGCSA-N 332.404 0.106 10 20 ECCD CNC(=O)[C@]1(C)CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785427951 HUEHYZMLQXZTTJ-GOSISDBHSA-N 346.431 0.353 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)NC(C)=O 1320141939 FRNVEEMZXARBQN-SKDRFNHKSA-N 338.360 0.213 10 20 ECCD CN1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1=O 1321828967 IEIYJYXAAFHXGW-AWEZNQCLSA-N 344.415 0.250 10 20 ECCD CCN1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1=O 1334536435 SCRXVGYXHWFVIE-OAHLLOKOSA-N 346.431 0.496 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C[C@H]3COCCN3)cc2)CC1 1349886789 VOVXRTKSBMUSCP-INIZCTEOSA-N 332.448 0.433 10 20 ECCD Nc1ccc(CC(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 262660066 YTGDMTZGBXAERB-WRFANHODSA-N 339.395 0.735 10 20 ECCD COCCCN(C(=O)c1cccc(O)c1O)[C@H]1CCS(=O)(=O)C1 279485657 HGBIXAGZNKEQKN-NSHDSACASA-N 343.401 0.764 10 20 ECCD CO[C@H]1COC[C@H]1S(=O)(=O)N1CCOc2cc(N(C)C)ccc21 632051158 DGEOKXHSNGRNOA-LSDHHAIUSA-N 342.417 0.695 10 20 ECCD CC[C@@H](CNS(C)(=O)=O)NCc1cc(OC)c(OC)cc1O 295090344 ROWOADRVLKEXRP-NSHDSACASA-N 332.422 0.827 10 20 ECCD C[C@H]1[C@@H](CO)CCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 817275094 VUCHWIDESYGBAB-DZGCQCFKSA-N 333.432 0.988 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)N[C@H]2CCC(=O)N(C)C2=O)c1 823905666 KHLAWJAGIDJKIY-SKDRFNHKSA-N 335.360 0.908 10 20 ECCD Cc1cc(C(=O)N2CC[C@H](S(N)(=O)=O)C2)c(C)n1-c1ccccn1 732662445 RFVUHIYRMHJGGZ-ZDUSSCGKSA-N 348.428 0.992 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC1CCNCC1 842151297 AIGWGHIKLDEJTJ-UHFFFAOYSA-N 332.448 0.793 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNCC3(N)CCC3)CC2)cc1 923330345 CPOJQGRGPUQKOU-KRWDZBQOSA-N 348.491 0.649 10 20 ECCD CN1CCN(CCCS(=O)(=O)NCc2ccccc2O)CC1 866830794 WNAIQHIPSBHLHU-UHFFFAOYSA-N 327.450 0.449 10 20 ECCD CC(=O)NCCc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 1116613243 QWDMLWYRIIUVCH-UHFFFAOYSA-N 340.361 0.492 10 20 ECCD COc1ccc(N2CCN(C(=O)c3cnnn3C)CC2)c(OC)c1 870165573 FJJUFWVAOFXERK-UHFFFAOYSA-N 331.376 0.795 10 20 ECCD O=C(C[C@@H]1CC(=O)NC1=O)NCc1ccc(N2CCOCC2)c(F)c1 1119844693 YEBCVMVTLRECQG-GFCCVEGCSA-N 349.362 0.331 10 20 ECCD COc1ncccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774361848 JFRHRJSETVDWHV-UHFFFAOYSA-N 331.328 0.799 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)[C@]1(CO)CCOC1 782175139 DBFWSFJACHOZJU-SFHVURJKSA-N 335.448 0.794 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2COC[C@@H]2O)N(C)C)cc1 899097866 IELITWKGCVEPHQ-PMPSAXMXSA-N 336.436 0.414 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@](C)(O)Cn2ccc(C)cc2=O)c1 790712823 MOWAUNNIISKDNR-GOSISDBHSA-N 346.383 0.938 10 20 ECCD CC(=O)N1CC(C(=O)NCCC2=CCN(c3cc(C)ncn3)CC2)C1 1089824101 VVGUVHPWVRYIAE-UHFFFAOYSA-N 343.431 0.906 10 20 ECCD COC1(C)CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 1323680819 ZEKBOAIFIRLEOK-UHFFFAOYSA-N 331.416 0.933 10 20 ECCD Cn1cc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)nn1 1327202767 ZSQKLLMPFPWZIG-UHFFFAOYSA-N 335.433 0.340 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)C[C@H]2CCS(=O)(=O)C2)cc1 1328224804 SVZGXMXQSQDMST-DOMZBBRYSA-N 339.461 0.693 10 20 ECCD C[C@H](CN1CCCC1=O)NC(=O)C(=O)N(C)Cc1ccccc1O 1345447848 BYXQFFKLZBRSIT-GFCCVEGCSA-N 333.388 0.478 10 20 ECCD CS(=O)(=O)NCC1CCN(C(=O)NCc2ccc(N)cc2)CC1 1579346686 SHUQYAKDRZMWCD-UHFFFAOYSA-N 340.449 0.740 10 20 ECCD CCOC(=O)[C@@H](N)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 392327486 SEYILAFSMRRSLW-AWEZNQCLSA-N 339.367 0.169 10 20 ECCD COc1cccc(CNC(=O)C2CCN(S(C)(=O)=O)CC2)c1O 727762992 VBBOGJLRXGBBNJ-UHFFFAOYSA-N 342.417 0.689 10 20 ECCD CN(C)c1ccc(CN(C(=O)[C@@H]2CCS(=O)(=O)N2)C2CC2)cc1 845165997 APNQOJRNZWPARU-HNNXBMFYSA-N 337.445 0.935 10 20 ECCD CCCS(=O)(=O)CC(=O)NC[C@H](N)c1ccc(N(C)C)cc1 843296354 BHYAMPQJGGMQEJ-AWEZNQCLSA-N 327.450 0.693 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)COCc2nncn2C)cc1 844857073 PJZKSMXMGSNFOC-UHFFFAOYSA-N 347.419 0.935 10 20 ECCD COCCCn1ccc(NC(=O)C(=O)NCc2ccccc2O)n1 754937126 NYIBXDUIYWATPL-UHFFFAOYSA-N 332.360 0.880 10 20 ECCD O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1(O)CNC1 852869548 GNWHNHQOFGKRKX-LLVKDONJSA-N 341.358 0.707 10 20 ECCD COCCN1C(=O)/C(=C/Nc2ccc3c[nH]nc3c2)C(=O)NC1=S 920976574 LEWITYCDEVLALW-DHZHZOJOSA-N 345.384 0.748 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)Cc3nc[nH]n3)cc2)CC1 867680380 KFIKWXIZKCOXLR-UHFFFAOYSA-N 342.403 0.332 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCC2CN([C@H]3CCNC3=O)C2)cc1 1032219400 YNTOXHUVNSFREQ-ZDUSSCGKSA-N 344.375 0.399 10 20 ECCD CCONC(=O)CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1118356665 YLRUSMWJZDYTMF-LLVKDONJSA-N 336.392 0.114 10 20 ECCD Nc1ccc(CCNC(=O)N[C@@H]2CCN(C3CCOCC3)C2=O)cc1 892038925 KPRUZAIEXCVLQB-MRXNPFEDSA-N 346.431 0.890 10 20 ECCD COc1ccc(CN[C@@H]2CCN(C(=O)[C@@H]3COC(=O)N3)C2)cc1C 968552949 JWZXWRHAHBITGY-KGLIPLIRSA-N 333.388 0.803 10 20 ECCD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccoc2)ccc1O 795354152 PXEXTMHFMNCYOL-UHFFFAOYSA-N 332.359 0.694 10 20 ECCD COc1ccc(CN[C@H]2C[C@H](C)N(C(=O)Cn3cnnn3)C2)cc1C 988000242 GGWUNJBSTJTXIL-ZFWWWQNUSA-N 344.419 0.769 10 20 ECCD O=C1CC[C@H](C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)N1 1089820325 UZHNYBKIHUXEMO-GFCCVEGCSA-N 333.367 0.537 10 20 ECCD COc1ccc(O)c([C@H](C)NCC(=O)N2CCC(C(N)=O)CC2)c1 1337210329 FACYPLDDNBNJIX-NSHDSACASA-N 335.404 0.775 10 20 ECCD CCN(CC)C(=O)CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1261998829 UOZCJSPZWNOPJT-CYBMUJFWSA-N 348.447 0.914 10 20 ECCD Oc1cc(Br)ccc1CNC[C@H](O)Cn1ccnn1 1261677379 OVZQGSVMYBSZOM-NSHDSACASA-N 327.182 0.897 10 20 ECCD O=C(O)c1ccc(N2CCN(C(=O)c3cccc(O)c3O)CC2)nn1 1608898517 DLPRZBPBGMQTAM-UHFFFAOYSA-N 344.327 0.548 10 20 ECCD O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)Cn1ncnn1 1602057269 QXOKRLOLOORGTM-UHFFFAOYSA-N 325.712 0.146 10 20 ECCD CC(=O)C(=O)CN1C(=O)N[C@](C)(c2ccc3c(c2)OCCCO3)C1=O 289524815 DMBQGVUQMPMSFJ-QGZVFWFLSA-N 346.339 0.773 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)C3(CO)CCC3)nc12 292206857 SURNAOYZDIWDTK-UHFFFAOYSA-N 334.376 0.958 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CCS(=O)(=O)N1 651415568 HXDODXAMTVAMJE-LLVKDONJSA-N 325.390 0.170 10 20 ECCD CCN1CCN(CC(=O)N[C@@H](C)c2cc(OC)ccc2O)C(=O)C1=O 728978856 VGESCLPIHLBXDM-NSHDSACASA-N 349.387 0.269 10 20 ECCD CC[C@H](CNS(C)(=O)=O)NC(=O)NCc1ccc(OC)cc1O 838658273 VPJGJTHNOCWFOR-LLVKDONJSA-N 345.421 0.528 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NCCC(=O)O)cc1 846325867 HFDIJLNCYBTLRU-UHFFFAOYSA-N 337.376 0.181 10 20 ECCD COc1ccc(O)c(CN2CCN(C(=O)N3CCOCC3)CC2)c1 1116483165 CXRHBEWTGRJBEJ-UHFFFAOYSA-N 335.404 0.971 10 20 ECCD C[C@@H](NCC(=O)N1CCNC(=O)C1)c1ccc(N2CCOCC2)cc1 775260792 QATOZKJOYYOYQT-CQSZACIVSA-N 346.431 0.132 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC3CCNCC3)cc2)CC1 891962391 RNADPLYJCAKMOC-UHFFFAOYSA-N 331.464 0.990 10 20 ECCD O=C(NCCC1=CCN(c2nccnc2F)CC1)c1c[nH]c(=O)cn1 1089855398 JFQJPQAPFFNXOB-UHFFFAOYSA-N 344.350 0.656 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCCOCCF)ccc21 1330412933 VFTSYKJFEDHVRE-UHFFFAOYSA-N 337.395 0.788 10 20 ECCD CN1CCNC[C@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1343393972 WRQKQMVDJDZGME-INIZCTEOSA-N 334.489 0.760 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@H]2C[C@@H](N[C@H]3CCNC3=O)C2)cc1 1023149856 LIVIVCXJYYCQNH-XQQFMLRXSA-N 344.375 0.588 10 20 ECCD C[C@H](CO)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 131993284 VQYORKNQCQGFKQ-CYBMUJFWSA-N 339.411 0.591 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@](C)(C(N)=O)C3)nc12 280753979 NNFBVZYOYOCZBL-MRXNPFEDSA-N 347.375 0.309 10 20 ECCD CN(C)C(=O)[C@@H]1CCCN1CC(=O)NCc1ccc(N(C)C)cc1 280835192 LLHQZPHPDWVTRN-INIZCTEOSA-N 332.448 0.921 10 20 ECCD CNS(=O)(=O)NC1CCN(Cc2cccc(OC)c2O)CC1 291438760 BSVGAEUIYKZDKP-UHFFFAOYSA-N 329.422 0.419 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)CS(C)(=O)=O)C2)cc1 819582325 KKIIEKBIHOOVEG-LBPRGKRZSA-N 326.418 0.682 10 20 ECCD Cc1cnn(C)c1S(=O)(=O)NC[C@H](N)c1ccc(N(C)C)cc1 842784162 CBOJKPHCDLTCKH-AWEZNQCLSA-N 337.449 0.773 10 20 ECCD O=C([C@@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1)N1CCNCC1 843047537 VIRDCBUCWQRLAU-CYBMUJFWSA-N 347.415 0.765 10 20 ECCD CCN[C@H](C)CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 842150429 SBOISGVDJNKMII-CYBMUJFWSA-N 332.448 0.799 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 843299035 QMRLNYDBNJHHBV-AWEZNQCLSA-N 332.364 0.674 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)c1 770656644 LALHKGMJAWNBSA-ZDUSSCGKSA-N 344.433 0.981 10 20 ECCD CN1CC(=O)N(Cc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1=O 777611234 SXNPVTJCIPVSAH-CYBMUJFWSA-N 330.388 0.782 10 20 ECCD Cc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n(C)n1 785297640 QTKAUIYRYWTXCN-SECBINFHSA-N 332.360 0.826 10 20 ECCD C[C@@]1(CO)CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1324752011 NSOFXFTXTZSRAR-OAHLLOKOSA-N 342.417 0.998 10 20 ECCD O=C(CCC(=O)N1CCC(O)CC1)NCCc1ccc(O)c(O)c1 1324688024 RCBSZEJTFFWZBZ-UHFFFAOYSA-N 336.388 0.520 10 20 ECCD Cn1cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cc1C(N)=O 320175136 NHZOQQADFNVXKI-UHFFFAOYSA-N 339.329 0.329 10 20 ECCD O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCOc2ccncc21 267532576 QTCJLWGKIOFDMM-UHFFFAOYSA-N 346.368 0.305 10 20 ECCD CCOC(=O)[C@@H](C)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 267736315 ARAQNXGZRYTACX-VIFPVBQESA-N 344.389 0.693 10 20 ECCD Cn1nncc1CNC(=O)NCc1ccc(N2CCOCC2)cc1 287067127 HCYLLISBMLREND-UHFFFAOYSA-N 330.392 0.651 10 20 ECCD Cn1cc(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)cn1 283714814 AOVBGYHCMUWQCX-UHFFFAOYSA-N 341.415 0.953 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cccnn1 806465615 YDDFAOGKVSGDHB-UHFFFAOYSA-N 327.388 0.784 10 20 ECCD C[C@H]1[C@H](CO)CCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 817275097 VUCHWIDESYGBAB-ZFWWWQNUSA-N 333.432 0.988 10 20 ECCD O=C(O)/C=C/c1ccc(N2CC[C@@]3(C2)NC(=O)NC3=O)c([N+](=O)[O-])c1 739625276 OENIXGJZDSOMEU-OMDKTOEGSA-N 346.299 0.481 10 20 ECCD Cn1cc(/C=C/C(=O)N(CC(=O)O)c2ccccc2)c(=O)n(C)c1=O 492208745 ORAOZCLGABNUSP-CMDGGOBGSA-N 343.339 0.215 10 20 ECCD CCNCCNC(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 911282234 OXZJNKYKASKXIR-MRXNPFEDSA-N 349.479 0.197 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)NC[C@@H]2CNC(=O)C2)cc1 845259596 ZBMBOOWMBDGULF-ZDUSSCGKSA-N 334.420 0.909 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N2CC(=O)N[C@H]3CCCC[C@@H]32)cc1 842235883 KPPOZTRQTXUERW-GJZGRUSLSA-N 344.415 0.197 10 20 ECCD CO[C@@H]1CS(=O)(=O)C[C@H]1NC(=O)NCc1ccc(N(C)C)cc1 853244870 QKFWFJXJDDWYLZ-ZIAGYGMSSA-N 341.433 0.364 10 20 ECCD C[C@@H](NC(=O)NCCC(=O)N1CCN(C)CC1)c1ccccc1O 875068444 NDHYGGBQBNDXNO-CYBMUJFWSA-N 334.420 0.917 10 20 ECCD CN(C(=O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(N)cc1 877077312 CHVDYFLHGIIJFJ-CQSZACIVSA-N 346.431 0.412 10 20 ECCD COc1ccc(CNCC(C)(C)NS(C)(=O)=O)c(O)c1OC 892880992 NJTLDPGFCCXPNM-UHFFFAOYSA-N 332.422 0.827 10 20 ECCD C[C@@H]1OCC[C@]12CN(C(=O)C(=O)N(C)Cc1ccccc1O)CCO2 1325637275 SNQOWWDDFPFDOG-UGSOOPFHSA-N 348.399 0.757 10 20 ECCD C[C@H]1CN(c2ccc(CNC(=O)CNCCN)cc2F)C[C@H](C)O1 1263096320 NJMKONUEPSWKRO-STQMWFEESA-N 338.427 0.604 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)c1ccnc(-c2nn[nH]n2)c1 1593106064 OEUMSOMNOSRUFK-UHFFFAOYSA-N 326.316 0.645 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)NCC(=O)N1CCOCC1 179769236 CTHMTNGIWRLPPU-UHFFFAOYSA-N 334.420 0.753 10 20 ECCD CNC(=O)C1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 186128339 HDXFQXMVGPBTDK-QPJJXVBHSA-N 329.400 0.741 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCNC3)CC2)cc1 269299537 PXEWYDPSIDHHJZ-HNNXBMFYSA-N 332.448 0.543 10 20 ECCD CNS(=O)(=O)[C@@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 371559629 ACSUKHWEQJLOJC-HOSRBBHYSA-N 340.401 0.651 10 20 ECCD COc1cc(Cl)cc(CN[C@H]2CS(=O)(=O)C[C@H]2OC)c1O 826985634 JEXXHCNQKODCQB-CMPLNLGQSA-N 335.809 0.956 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NC[C@@H]2CCCO2)cc1 846720599 UTTIFSZBJHKMPK-INIZCTEOSA-N 349.431 0.885 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCN2CCCC2)c1 919808065 PPNRFSZIOOQDGU-UHFFFAOYSA-N 341.433 0.979 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNC[C@H](O)C3CC3)CC2)cc1 843072309 WCJYHYMFXIDUMG-HKUYNNGSSA-N 349.475 0.539 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@]3(CCNC3)C2)cc1F 842149397 YACDHDXQCAADIB-SFHVURJKSA-N 348.422 0.720 10 20 ECCD C[C@@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCN1 842265020 ATWILZSTERUVSF-HIFRSBDPSA-N 332.448 0.968 10 20 ECCD CNC(=O)CN1CCC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1028344529 IVGXQTVXPAVMFR-ZDUSSCGKSA-N 346.391 0.789 10 20 ECCD O=c1[nH]c2ccc(S(=O)(=O)NCc3ccccc3O)cc2[nH]c1=O 751149047 KQVVUYBCTLBCFO-UHFFFAOYSA-N 347.352 0.401 10 20 ECCD NS(=O)(=O)C[C@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 779515315 RJPOXCNQVQFDNB-FUEXJSSKSA-N 340.401 0.638 10 20 ECCD C[C@@H](C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)S(C)(=O)=O 891256263 WPBLPFIBYZSEIE-WFASDCNBSA-N 341.477 0.905 10 20 ECCD CCCN(CC(N)=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 795508817 UEIHIBJTZDEYPD-UHFFFAOYSA-N 348.447 0.541 10 20 ECCD COc1cc(C(=O)N[C@@H]2CC[C@H]3CN(CCO)C[C@H]3C2)cc(OC)n1 980141155 MKSNORWZXZJJRQ-NWANDNLSSA-N 349.431 0.921 10 20 ECCD C[C@@]1(C(=O)NCCC2=CCN(c3nccnc3F)CC2)CCNC1=O 1089864931 HPXMHNQFYHTHPC-KRWDZBQOSA-N 347.394 0.785 10 20 ECCD COc1ccc(N2CCC(NC(=O)CN3C(=O)CNC3=O)CC2)cc1 1318167995 YVIWQJAVXSMDON-UHFFFAOYSA-N 346.387 0.332 10 20 ECCD CCOC(=O)[C@H]1CNCCN1Cc1ccc([N+](=O)[O-])c(OC)c1O 1326991111 NVJLDLCTGLDFGA-GFCCVEGCSA-N 339.348 0.646 10 20 ECCD C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)C(=O)N(C)Cc1ccccc1O 1324261498 NJZHKBHOEBWAPY-WFASDCNBSA-N 331.416 0.950 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)NC[C@@H]2COCCN2)N(C)C)cc1 1336921504 KCMJQYIXSMAFOP-WBVHZDCISA-N 349.479 0.643 10 20 ECCD CN(Cc1ccccc1O)C(=O)C1(S(C)(=O)=O)CCNCC1 1261493130 LBTPTRIYKHDOQH-UHFFFAOYSA-N 326.418 0.517 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3C[C@@H](N)C3)ccc21 1262067253 WNKLHEHOAREZMG-OTVXOJSOSA-N 330.432 0.539 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2C[C@H](C)O[C@H](C(=O)O)C2)c1O 1599345257 GMLOTYPWBDXDOQ-KWQFWETISA-N 326.305 0.983 10 20 ECCD NC(=O)C[C@H](NCc1ccc(N2CCOCC2)c(F)c1)C(=O)O 1777567550 JIDZXROPXSIXFI-LBPRGKRZSA-N 325.340 0.081 10 20 ECCD CC(=O)NCCNC(=O)CCC(=O)NCc1ccc(N(C)C)cc1C 115725884 HILMUAPVPUQEHG-UHFFFAOYSA-N 348.447 0.710 10 20 ECCD C[C@H](C(=O)N(C)C)S(=O)(=O)NCc1ccc2c(c1)CCCN2C 193877343 AKAXUTNFBFZTTD-GFCCVEGCSA-N 339.461 0.965 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCn2cnnc2C1 264277053 DJVHZOOFOQSKPB-UHFFFAOYSA-N 328.420 0.818 10 20 ECCD O=C(/C=C/c1ccc(N2CCOCC2)cc1)N1C[C@@H](O)C[C@H]1CO 274788455 GMPHILLRYYKSJM-LUACWQNHSA-N 332.400 0.491 10 20 ECCD CCNS(=O)(=O)[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C1 276542729 GJRBREWQZQFULQ-QMMMGPOBSA-N 332.353 0.391 10 20 ECCD CC(=O)NCCCNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 807094760 AAFGMKJDZGUJRD-UHFFFAOYSA-N 334.420 0.320 10 20 ECCD CC(=O)C(=O)COC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1 808543426 UBCDVWDVMHAODV-UHFFFAOYSA-N 348.267 0.563 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2C[C@@H](CO)OC(C)(C)C2)cc1 817279254 KYYYGBRUPYDFLR-INIZCTEOSA-N 335.448 0.841 10 20 ECCD C[C@H]1C[C@@H](CO)CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 817274322 JZKWWDGJQDBQAF-DZGCQCFKSA-N 333.432 0.846 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 729041606 UUZQIGZXMUEZJZ-VHSXEESVSA-N 328.390 0.948 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2nc3n(c2=O)CCCC3)cc1F 844357824 REUUFQTYLUMSJH-UHFFFAOYSA-N 347.394 0.903 10 20 ECCD Cn1cc(C(=O)NCc2c(O)ccc3c2CCCC3)c(=O)n(C)c1=O 743719168 RNTKULFGSZWXCY-UHFFFAOYSA-N 343.383 0.598 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCO[C@@H](CN)C1 844227185 VTJSJRBETFKTLO-KRWDZBQOSA-N 334.464 0.761 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N2CC[C@@H](N3CCCC3)C2)cc1 842235468 GNFAOPRINYDCFZ-MRXNPFEDSA-N 330.432 0.624 10 20 ECCD COC(=O)[C@H]1C[C@@H](O)CN(Cc2cc(OC)c(OC)cc2O)C1 843435931 ZRUCHWDAXWSMKI-NWDGAFQWSA-N 325.361 0.765 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CCOC(=O)N3)CC2)cc1F 859966171 QCOWXPNAKXWBGZ-ZDUSSCGKSA-N 337.351 0.981 10 20 ECCD CN(C)c1ccc(CNS(=O)(=O)N(C)C2CCNCC2)cc1 866745037 SMQLLVGPRBCQTJ-UHFFFAOYSA-N 326.466 0.771 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CCN(C)C1=O 772518480 LPHUWUVBZOLBCL-OAHLLOKOSA-N 347.415 0.733 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C3(n4cnnn4)CC3)cc2)CC1 881854343 CKHSGLGTCIEDHL-UHFFFAOYSA-N 341.419 0.230 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@H]3COCCN3)cc2)CC1 892291728 ZWNMQPKHZSEVRA-INIZCTEOSA-N 347.463 0.226 10 20 ECCD COc1ccc(CNCCNC(=O)CCS(C)(=O)=O)cc1C 1130333747 LIQFKRJJZBSCOX-UHFFFAOYSA-N 328.434 0.644 10 20 ECCD Cc1cc(-c2nn[nH]n2)cnc1C(=O)NCc1ccc(O)cc1O 1605551934 JAOBPWFXNLTZKM-UHFFFAOYSA-N 326.316 0.911 10 20 ECCD CC1(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)COC1 1847340038 WKNIYQIANNUEQW-RYUDHWBXSA-N 347.371 0.345 10 20 ECCD C[C@@H](C(=O)N[C@@H]1CCS(=O)(=O)C1)N(C)Cc1ccccc1O 269606169 CMBVQUADBAQQEX-WCQYABFASA-N 326.418 0.516 10 20 ECCD COC(=O)CCNC(=O)CN1CCCN(c2ccc(OC)cc2)CC1 360809623 HWQDRRKOIMBPBE-UHFFFAOYSA-N 349.431 0.887 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NCc1ccon1 806398710 QMUFCTKUXVCRPE-UHFFFAOYSA-N 326.356 0.983 10 20 ECCD Cn1cnc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 808389973 MZZQAFGSTPYXAX-UHFFFAOYSA-N 334.445 0.945 10 20 ECCD CS(=O)(=O)CCNCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 818967897 DPZOCWKOQDJUIC-CQSZACIVSA-N 339.461 0.523 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CNC(C)(C)CC(=O)O)nc12 829890401 QSQAKCBYLDWBBZ-UHFFFAOYSA-N 336.348 0.955 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)NCCCN1C(=O)CNC1=O 731045342 CVDKPRZHXXXMCG-UHFFFAOYSA-N 347.419 0.836 10 20 ECCD CN(C)c1ccc(CN(C(=O)CN2CCNC(=O)C2)C2CC2)cc1 915215440 QLQHARQZAUAFEZ-UHFFFAOYSA-N 330.432 0.675 10 20 ECCD O=C(N[C@H]1CCNC1)C(=O)N(Cc1ccco1)Cc1ccccc1O 842224492 CHIXDDOZVXXAJE-AWEZNQCLSA-N 343.383 0.992 10 20 ECCD C[C@@H](CN)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 841721088 DCFXAFZRKKETAF-DZGCQCFKSA-N 347.463 0.782 10 20 ECCD CN(C)c1ccc([C@@H](N)CNS(=O)(=O)N(C)CC2CC2)cc1 842784776 LTXAETWTDAFFLE-HNNXBMFYSA-N 326.466 0.929 10 20 ECCD Cc1nn(C)cc1S(=O)(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 842786400 ZNHNSNNMKFCXNY-CQSZACIVSA-N 337.449 0.773 10 20 ECCD COc1ccc(O)c(CNC(=O)N[C@H]2CS(=O)(=O)C[C@H]2OC)c1 853736853 QNSATBUGXDITII-WCQYABFASA-N 344.389 0.012 10 20 ECCD CCOC(=O)[C@H](N)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 852862929 NIQKQIAFDFCMTC-IUODEOHRSA-N 335.404 0.591 10 20 ECCD Cc1ccc(O)c(CNC(=O)NCCNS(=O)(=O)NC(C)C)c1 858403325 BKYXGYZLYXPTRP-UHFFFAOYSA-N 344.437 0.332 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCc3n[nH]cc3C2)cc1 785427284 CLQZCHZZFICSFJ-AWEZNQCLSA-N 341.415 0.766 10 20 ECCD CCO[C@@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 785433944 QAWXLQVDHXZEGA-HZPDHXFCSA-N 349.431 0.679 10 20 ECCD COc1ccc(CNC[C@@H]2CN(C(=O)c3nc[nH]n3)CCO2)cc1C 1051871985 CRGORUQZJHQQNK-CQSZACIVSA-N 345.403 0.753 10 20 ECCD COc1ccc(-n2nnnc2CN2C[C@H]3CC[C@H]2CN3C(C)=O)cc1 971011693 JFRMHWBBPMGCQZ-LSDHHAIUSA-N 342.403 0.866 10 20 ECCD CN(C)C[C@H](NCc1ccc(N2CCOCC2)c(F)c1)C(=O)O 1332486191 UCIUXMQUSUTAEF-AWEZNQCLSA-N 325.384 0.767 10 20 ECCD COc1ccc(N2CCN(c3cncc(-c4nn[nH]n4)n3)CC2)cc1 1591607203 DKLCBFCCJBSQHP-UHFFFAOYSA-N 338.375 0.992 10 20 ECCD C[C@H]1OCC[C@]1(O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 279489908 NEAZCNASAJXQEZ-OTYXRUKQSA-N 344.389 0.033 10 20 ECCD COC(=O)[C@@H]1[C@@H](O)CCCN1CC(=O)NCc1ccc(N(C)C)cc1 298528384 MAPAKPZPTCEUOS-RDJZCZTQSA-N 349.431 0.367 10 20 ECCD COC(=O)[C@H]1[C@@H](O)CCCN1CC(=O)NCc1ccc(N(C)C)cc1 298528381 MAPAKPZPTCEUOS-DOTOQJQBSA-N 349.431 0.367 10 20 ECCD Cn1nncc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 810369378 RYWKTSSFOXWWSE-UHFFFAOYSA-N 329.360 0.654 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)CN3CCNCC3=O)C2)cc1 831748730 LNJNZFPQBAESFS-CQSZACIVSA-N 346.431 0.070 10 20 ECCD O=C(C[C@@H]1CCC(=O)N1)NCc1ccc(N2CCC(O)CC2)cc1 856210660 LRIWXYIKQDCVFG-AWEZNQCLSA-N 331.416 0.933 10 20 ECCD COC(=O)c1cc(S(=O)(=O)NCc2cc(OC)ccc2O)c[nH]1 751415469 POSVMLSPWHFKIB-UHFFFAOYSA-N 340.357 0.994 10 20 ECCD Oc1cc2c(cc1CN1CC[C@@H](CN3CCOCC3)C1)[C@H](O)CO2 768466599 SRJUUVSXQGRXGH-SUMWQHHRSA-N 334.416 0.972 10 20 ECCD Cc1ccc(CN[C@H]2CS(=O)(=O)C[C@@H]2N2CCOCC2)c(O)c1 877037399 PSFCQZRCTRXEQB-GJZGRUSLSA-N 340.445 0.288 10 20 ECCD COc1cccc(O)c1CN[C@@H]1CC(=O)N(CCN2CCOCC2)C1 771965328 XQTQEQXIRQGBNW-CQSZACIVSA-N 349.431 0.424 10 20 ECCD OCc1cn(CCCNCc2ccc(N3CCC(O)CC3)cc2)nn1 877540458 ZOUMRXXUTBDXTI-UHFFFAOYSA-N 345.447 0.911 10 20 ECCD COc1ccc(-n2nnnc2CNC[C@H]2CN(C(C)=O)C[C@@H]2C)cc1 1048088716 DDHRZAAIIDWUKB-JSGCOSHPSA-N 344.419 0.875 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3cocn3)C2)cc(OC)n1 973096337 NKQDJKZNRMYYTB-XYPYZODXSA-N 346.343 0.778 10 20 ECCD COc1ccc(CN[C@@H]2CN(C(=O)CCNC(N)=O)C[C@H]2C)cc1C 1216722999 MALJDTCLHSMCOI-UKRRQHHQSA-N 348.447 0.999 10 20 ECCD COc1ccc(CNCCCNC(=O)CS(C)(=O)=O)cc1C 1155312314 VMEMXHDZCPCKAD-UHFFFAOYSA-N 328.434 0.644 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@@H]3CCO[C@@H]3C)C2)cc(OC)n1 996369513 YCHXQVRHPQAQRX-ZWNOBZJWSA-N 349.387 0.464 10 20 ECCD O=C(Cn1cc(C(=O)O)nn1)NCc1ccc2cccnc2c1O 1601382952 WGHJFKWTCNGNMJ-UHFFFAOYSA-N 327.300 0.547 10 20 ECCD CC(=O)N1CC[C@](O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1040156010 HPVYRSUOKAOWNP-HNNXBMFYSA-N 333.348 0.562 10 20 ECCD Cc1ccc(C(=O)N2CCC[C@@H](CNS(C)(=O)=O)C2)c(O)c1O 272756477 KSQYMIUMVPYFNQ-NSHDSACASA-N 342.417 0.808 10 20 ECCD C[C@@H]1CC(=O)NCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 372383886 JODYRWKJFHFBNW-CQSZACIVSA-N 332.448 0.921 10 20 ECCD CN(C)c1ccc(CN(C(=O)C(=O)NCCC(=O)O)C2CC2)cc1 817114393 HLSHUPPCRKXHSV-UHFFFAOYSA-N 333.388 0.835 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)CS(=O)(=O)CC 819695869 CFPCHULPVVRTTE-UHFFFAOYSA-N 343.401 0.719 10 20 ECCD COc1cccc(CNC(=O)[C@H]2CCCCN2S(C)(=O)=O)c1O 729859603 UDXXGFOBHCPNNF-GFCCVEGCSA-N 342.417 0.831 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)C3CC3)cc2)C1 742280766 VSWVUDRBPRQBRF-ZDUSSCGKSA-N 337.445 0.970 10 20 ECCD COC[C@H]1CN(C(=O)C(=O)NCCc2ccc(N)cc2)C[C@H](C)O1 842234732 AYOFPMMIFGAHNN-SWLSCSKDSA-N 335.404 0.190 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC3(CCNCC3)C2)cc1 842035442 GZUOTTTYKDKLIB-UHFFFAOYSA-N 344.459 0.971 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCN([C@@H]3CCNC3)CC2)cc1 844224919 VHCRZLWPQQDHCR-GOSISDBHSA-N 345.491 0.348 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@H](CN)C2)cc1F 842148316 MCSMHXKZMCZPPZ-WCQYABFASA-N 336.411 0.752 10 20 ECCD CN1C[C@@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1=O 852189053 UNNLFKALPIOMEW-AWEZNQCLSA-N 346.431 0.678 10 20 ECCD C[C@H](O)[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 774188487 NDVVIBRYSGGTJN-WDEREUQCSA-N 343.474 0.971 10 20 ECCD COc1ccc(-n2nnnc2CNCCCNC(=O)C2CC2)cc1 1154066236 DSBFLLNSTKMAEE-UHFFFAOYSA-N 330.392 0.677 10 20 ECCD COc1ccc(CN[C@@H]2CCN(C(=O)CCNC(N)=O)C2)cc1C 1187703988 LHSNXEVZCJKNBH-CQSZACIVSA-N 334.420 0.753 10 20 ECCD CC(C)N1C[C@@H](NC(=O)C(=O)NCCc2ccc(N)cc2)CC1=O 1325362123 LWQMHVAICIYPGV-AWEZNQCLSA-N 332.404 0.053 10 20 ECCD CNC(=O)CN[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1188251323 ILKZPBWBVCFZTB-GFCCVEGCSA-N 332.364 0.399 10 20 ECCD C[C@@H]1COC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1333342076 OHDRTAJPEWTNQG-CJNGLKHVSA-N 329.400 0.830 10 20 ECCD COc1ccc(NC(C)=O)cc1NC=C1C(=O)N(C)C(=O)N(C)C1=O 60863938 MAUPHWPKCKZOJT-UHFFFAOYSA-N 346.343 1.000 10 20 ECCD CCN1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 271270722 MKLPKVSRLUBQIB-UHFFFAOYSA-N 341.433 0.932 10 20 ECCD CCCN(CC(=O)OC)C(=O)c1cc(NS(C)(=O)=O)ccc1O 271297127 SYJFUNIELWYWCK-UHFFFAOYSA-N 344.389 0.789 10 20 ECCD COC(=O)c1cn(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)nn1 274970259 VSMNQVGOTFAIFV-SECBINFHSA-N 334.332 0.223 10 20 ECCD COc1ccc(N2CCC(NC[C@H]3CC(C(N)=O)=NO3)CC2)cc1 370478505 ZQQITSIWBZPXSS-OAHLLOKOSA-N 332.404 0.884 10 20 ECCD CCOC(=O)c1cc(NS(=O)(=O)N2CCOCC2)ccc1O 295191339 LACXBESVTHKVEQ-UHFFFAOYSA-N 330.362 0.558 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N[C@@H](C)CCN)C2)cc1 818676681 PHHXRWWSLIXBCZ-KBPBESRZSA-N 348.447 0.491 10 20 ECCD C[C@@H](CN)CNC(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 911292623 QVIQOWKMGXLWFC-BBRMVZONSA-N 349.479 0.183 10 20 ECCD CNC[C@H]1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 842202483 HVFUVDPKWFVHCN-UONOGXRCSA-N 332.448 0.998 10 20 ECCD C[C@H](N)[C@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 844220549 HOWGKQPRQKKKBZ-WMLDXEAASA-N 334.464 0.759 10 20 ECCD CCN(CCO)C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 754027430 KNFBWVSUKCWKLC-KRWDZBQOSA-N 337.464 0.492 10 20 ECCD O=C1C[C@@H](CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C(=O)N1 935033117 AVYCJBIYABYAQZ-KBPBESRZSA-N 346.383 0.953 10 20 ECCD CNC(=O)CN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N=NC(N)=O)cc1 1032810201 WEZDFPYNEUAJRL-STQMWFEESA-N 344.375 0.494 10 20 ECCD Cc1ccc(CN2CCN(C(=O)C(=O)N3CCCC3)CC2)c(O)c1 876614567 PKNHGTRTZFXWBB-UHFFFAOYSA-N 331.416 0.967 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C3=NN(C)C(=O)CC3)cc2)CC1 881848948 GOQHZEJLRAIGDO-UHFFFAOYSA-N 343.431 0.663 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3CC[C@H](C2)N3)cc1F 884520111 MVUGAYZUHAGBIB-BETUJISGSA-N 334.395 0.471 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C[C@@H]1CCN(CC(=O)NCc2ccc(N(C)C)cc2)[C@@H](C(N)=O)C1 839568077 XGAFCNANAONLCA-CZUORRHYSA-N 332.448 0.955 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@@]3(C)CCNC3=O)cc2)CC1 918838882 MFOONGDRMPWWHP-SFHVURJKSA-N 330.432 0.581 10 20 ECCD C[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C(=O)O 848608076 PRLHMDOWBKYJRY-LBPRGKRZSA-N 333.388 0.740 10 20 ECCD C[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H]1CO 857364844 MDAHGRPNAGMHTD-GHMZBOCLSA-N 342.417 0.854 10 20 ECCD O=C1C[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCN1 856212287 KBEHBCKDBNJRPH-CQSZACIVSA-N 331.416 0.790 10 20 ECCD NC[C@H]1OCC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 852917338 YWXJXWTWUCFOMY-DLBZAZTESA-N 333.432 0.628 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H](C)OC)CC2)cc1 1118502829 DXUPZSCSKFXBBN-CQSZACIVSA-N 349.431 0.885 10 20 ECCD C[C@H]1C[C@@H](NCC(N)=O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1044876004 CAPZJLAPRSZXLD-GWCFXTLKSA-N 346.391 0.917 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](C)N(C(=O)Cn3cnnn3)C2)cc1C 988000238 GGWUNJBSTJTXIL-HIFRSBDPSA-N 344.419 0.769 10 20 ECCD Cn1ncc(C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)n1 1089835072 RJIYKVBAABDNLQ-UHFFFAOYSA-N 331.355 0.701 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@H]3CCNC3=O)CC2)ncn1 1089854922 AHRDYUOLAFRJDZ-CQSZACIVSA-N 329.404 0.564 10 20 ECCD COc1ccc(CNCCCNC(=O)CN2C(=O)CCC2=O)cc1C 1175648719 ZRGXMDXJLACXJL-UHFFFAOYSA-N 347.415 0.749 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ncn(C)n1 1326072404 WMLMGENVTUYKQZ-JTQLQIEISA-N 334.332 0.131 10 20 ECCD C[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1ncnn1C 1323196543 JDBZFKSZBWVPFK-NEPJUHHUSA-N 344.419 0.936 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)NC[C@H]2COCCN2)N(C)C)cc1 1336921495 KCMJQYIXSMAFOP-DOTOQJQBSA-N 349.479 0.643 10 20 ECCD Nc1ccc(CN2CCN(C(=O)CN3C(=O)CCC3=O)CC2)cc1 1334753914 IHORVWGKLQRLOJ-UHFFFAOYSA-N 330.388 0.062 10 20 ECCD COc1cccc(CNC(=O)Cc2ccc(-c3nn[nH]n3)nc2)c1O 1605317061 PZPIRIJTICISEL-UHFFFAOYSA-N 340.343 0.835 10 20 ECCD CCN1C(=O)CO[C@H](C(=O)Nc2ccc(N)cc2)[C@H]1c1nccn1C 1577756531 YZSSMXZMJDBGJV-GJZGRUSLSA-N 343.387 0.929 10 20 ECCD CC(C)CNC(=O)c1ccccc1NC=C1C(=O)NC(=S)NC1=O 60864313 SHXJTVMGCVBOSL-UHFFFAOYSA-N 346.412 0.899 10 20 ECCD COc1cccc(CN2CCN([C@H]3CCS(=O)(=O)C3)CC2)c1O 120423368 PMZQZHAJXYLFGE-AWEZNQCLSA-N 340.445 0.706 10 20 ECCD CN(C(=O)C1=CC=CN2CCS(=O)(=O)N=C12)c1ncccc1F 130979095 CMKCMMBPZUOFID-UHFFFAOYSA-N 336.348 0.681 10 20 ECCD Nc1nnc(CNC(=O)/C=C/c2ccc(N3CCOCC3)cc2)o1 275203378 ICFYOEOFRXBZTI-ZZXKWVIFSA-N 329.360 0.818 10 20 ECCD C[S@@](=O)C1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 282101392 FYSQIYBQKVNZTP-OAQYLSRUSA-N 346.430 0.405 10 20 ECCD COc1ccc(N2CCN(CCC(=O)N3CCNCC3)CC2)cc1 392064718 KRUHKAVGLSNJQX-UHFFFAOYSA-N 332.448 0.639 10 20 ECCD CCCNS(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 293020070 OODLQLNJCKJVEZ-UHFFFAOYSA-N 331.413 0.996 10 20 ECCD CCS(=O)(=O)N1CCN(Cc2cc3c(cc2O)OCO3)[C@H](C)C1 809725623 XMWQNOWWPYTZBG-LLVKDONJSA-N 342.417 0.977 10 20 ECCD NC(=O)c1ccc(N2CCN(C(=O)c3cc(O)cs3)CC2)nc1 732269154 GLGGKSCKTUDVSJ-UHFFFAOYSA-N 332.385 0.910 10 20 ECCD Cn1cc(CN2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)cn1 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COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](O)C(N)=O)c2C)cc1 791254977 OIAFAPGYPDVFQC-OAHLLOKOSA-N 331.372 0.679 10 20 ECCD CC[C@@H]1[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CCN1CC(N)=O 1087843972 AALZLDPSEHTVJG-QWHCGFSZSA-N 346.391 0.917 10 20 ECCD C[C@@]1(C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)CCNC1=O 1089865196 OJBMVIZCIURTPV-KRWDZBQOSA-N 347.394 0.785 10 20 ECCD COc1ccc(CNCCNC(=O)c2cn(C)c(=O)n2C)cc1C 1152713401 XMIXLQOOVLSOGY-UHFFFAOYSA-N 332.404 0.560 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNC2CC(NS(C)(=O)=O)C2)c1O 802655253 XENMCNPFHJVCDP-UHFFFAOYSA-N 345.377 0.479 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNCc3ccon3)CC2)cc1 819129499 KGRYNUQIKMVWMO-QGZVFWFLSA-N 346.431 0.956 10 20 ECCD COc1cc(O)c(CN(CCN(C)C)CC(=O)N(C)C)cc1OC 827158028 MDLJYBQPWYPKSO-UHFFFAOYSA-N 339.436 0.861 10 20 ECCD C[C@@H](CCO)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 738982847 CDURBDNCTUQREV-ZFWWWQNUSA-N 348.447 0.958 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C[C@H](NC(C)=O)C(N)=O 740742518 OBFYZHUPBLCKCD-HNNXBMFYSA-N 334.420 0.481 10 20 ECCD 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ECCD CCn1c(-c2sccc2O)nnc1N1CCN2C(=O)NC[C@H]2C1 1121764559 RLIBQEDZEKAFQH-VIFPVBQESA-N 334.405 0.946 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)c2cn(C)c(=O)n2C)N(C)C)cc1 891246089 LYUSZMBSEJADIC-OAHLLOKOSA-N 345.447 0.823 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](C)N(C(=O)Cn3ncnn3)C2)cc1C 988852891 WMRVCWVBDAUCBT-HIFRSBDPSA-N 344.419 0.769 10 20 ECCD O=C(NCCC1=CCN(c2cccc(F)n2)CC1)[C@H]1CCNC1=O 1089855396 JDZZXAPFDSWFSQ-CYBMUJFWSA-N 332.379 1.000 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3ccncc3)C2)cc(OC)n1 996368865 PNHJPZOBXOOCTK-UHFFFAOYSA-N 342.355 0.748 10 20 ECCD COc1cccc(CNC(=O)[C@H]2CC(c3cnn(C)c3)=NO2)c1O 1335855888 PCGWRMFVENWYPS-CQSZACIVSA-N 330.344 0.944 10 20 ECCD O=C(NCc1cccc(O)c1O)[C@H]1COCCN1CC(F)(F)F 1263894299 AFZGNISLEUMYSS-SNVBAGLBSA-N 334.294 0.977 10 20 ECCD N[C@@H](CCC(=O)O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1601175166 YIAZJZKXFHNZIM-INIZCTEOSA-N 349.431 0.704 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H](F)C(=O)O 1598519229 MDFVZRBSEGGIOC-LBPRGKRZSA-N 325.340 0.250 10 20 ECCD O=S(=O)(Nc1ccccc1-n1cnnn1)c1cccc2nonc12 161945946 VARYDLPWPQKMOZ-UHFFFAOYSA-N 343.328 0.999 10 20 ECCD CC(=O)N1CCN(C(=O)CCNC(=O)c2ccc(C)c(O)c2O)CC1 267561008 GKKAMNSVIPPOFB-UHFFFAOYSA-N 349.387 0.217 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C[C@@H]1COCCN1 285851983 XTIUUKLNUZUNNR-MRXNPFEDSA-N 333.432 0.860 10 20 ECCD O=C(O)/C=C\c1ccc(N2CCS(=O)(=O)CC2)c([N+](=O)[O-])c1 387101343 XFOMGGBHESFHRI-RQOWECAXSA-N 326.330 0.927 10 20 ECCD COCCNCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 827468980 IKUUVNWMKLOFSY-HNNXBMFYSA-N 348.447 0.241 10 20 ECCD COCCN1C[C@H](C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)CC1=O 832278231 BZTDJWPQWMTAOQ-GDBMZVCRSA-N 348.447 0.364 10 20 ECCD Cc1cc(C(=O)N[C@@]2(C(N)=O)CCOC2)c(C)n1-c1ccccn1 848319816 NMNNETWSEVHPCI-KRWDZBQOSA-N 328.372 0.863 10 20 ECCD CCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1024287079 FBIOUNYPMLXNGE-VXGBXAGGSA-N 333.348 0.561 10 20 ECCD COc1ccc(N2CCN(C(=O)C[C@@H]3CC(=O)NC3=O)CC2)cc1F 934402835 CUSYECSMDCUJSH-NSHDSACASA-N 349.362 0.536 10 20 ECCD 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OSAYYVFUJKSSGB-UGSOOPFHSA-N 349.431 0.852 10 20 ECCD CNS(=O)(=O)CCN(CC(=O)O)Cc1cc(Cl)ccc1O 1606302151 AEIPFDINXLITBL-UHFFFAOYSA-N 336.797 0.481 10 20 ECCD COc1cc(O)c(CNCCC(=O)NCCC(=O)O)cc1OC 1607182575 ARVAHCXZYDVUDZ-UHFFFAOYSA-N 326.349 0.480 10 20 ECCD CNC(=O)Cc1noc(CN(C)c2ccc(OCC(=O)O)cc2)n1 1598648334 HDXTUODGUFDGIT-UHFFFAOYSA-N 334.332 0.458 10 20 ECCD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1C[C@@H](C(=O)O)C1 1598078833 JHVKWWNPNJYPPW-WAAGHKOSSA-N 342.373 0.699 10 20 ECCD CN(C)CC[C@H](NCc1ccc(N2CCN(C)CC2)cc1)C(=O)O 1777030321 KPECATPUPFTIKF-KRWDZBQOSA-N 334.464 0.933 10 20 ECCD COc1ccc(N2CCN(CCCNC(=O)CN(C)C)CC2)cc1 193557530 YARGGRFLJOIEEY-UHFFFAOYSA-N 334.464 0.885 10 20 ECCD C[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](CO)O1 248933865 BRWBAHWNVPAHKG-PBHICJAKSA-N 335.448 0.793 10 20 ECCD O=S(=O)(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCOC1 265370721 AKCRWHZZLALMMH-HNNXBMFYSA-N 326.418 0.732 10 20 ECCD COC(=O)CNC(=O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 268085501 IQNPGCHVOIARAF-AWEZNQCLSA-N 336.388 0.662 10 20 ECCD COCCNC(=O)Cn1cc(NC(=O)c2cccc(O)c2O)cn1 279090964 GBZZUZACXUVMDC-UHFFFAOYSA-N 334.332 0.309 10 20 ECCD C[C@@H]1OCC[C@]1(O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 279489911 NEAZCNASAJXQEZ-XPTSAGLGSA-N 344.389 0.033 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC[C@H](O)C1 283072322 FQOMSIRPENYWQH-INIZCTEOSA-N 331.416 0.886 10 20 ECCD CNC(=O)C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 284862073 IHMXHRQXCVDACB-UHFFFAOYSA-N 337.376 0.107 10 20 ECCD CC(=O)C(=O)COC(=O)CCNS(=O)(=O)c1cccc(Cl)c1 808485775 WPPTYXGTWOHYFT-UHFFFAOYSA-N 347.776 0.710 10 20 ECCD CC(=O)C(=O)COC(=O)CCNS(=O)(=O)c1ccc(C)c(C)c1 808485107 XUILHOVUSZIPNC-UHFFFAOYSA-N 341.385 0.673 10 20 ECCD COC(=O)[C@H]1[C@H](O)CCCN1CC(=O)NCc1ccc(N(C)C)cc1 298528383 MAPAKPZPTCEUOS-NVXWUHKLSA-N 349.431 0.367 10 20 ECCD CCOC(=O)CN(Cc1nc(N)nc(N)n1)Cc1ccccc1O 823581988 VPJSCNYKHGKVSZ-UHFFFAOYSA-N 332.364 0.307 10 20 ECCD CN1CC[C@@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 729526177 ZBFQDABQZKEXIO-HZPDHXFCSA-N 344.459 0.956 10 20 ECCD C[C@@H](NC(=O)CN1CCN(S(C)(=O)=O)CC1)c1ccccc1O 827937306 RJOUAPYKQJPPSF-GFCCVEGCSA-N 341.433 0.147 10 20 ECCD NC(=O)[C@@H]1CN(C(=O)c2csc(Cc3ccc(N)cc3)n2)CCO1 827980329 MCMCGTOQILVFGU-ZDUSSCGKSA-N 346.412 0.642 10 20 ECCD COCC(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1009823445 VCWGIBCWPCUVSQ-UHFFFAOYSA-N 333.348 0.780 10 20 ECCD C[C@@H]1CN(C)C(=O)CN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 839329798 DGOKASBPIPVQNX-CYBMUJFWSA-N 346.431 0.400 10 20 ECCD C[C@@H](N)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 842036671 QMQYVDDPBIFATR-UKRRQHHQSA-N 332.448 0.955 10 20 ECCD CN(Cc1ccccc1O)C(=O)N[C@@H]1CCN(S(C)(=O)=O)C1 845416977 ADEQKGWXSCYZSM-GFCCVEGCSA-N 327.406 0.568 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H](CN)C[C@@H]1C 842154115 RLQMSLUJUBGOQE-UONOGXRCSA-N 332.448 0.873 10 20 ECCD COCCOC[C@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 743678855 RHVGWIWEJYAGRM-JTQLQIEISA-N 346.405 0.545 10 20 ECCD CC(C)N1CC[C@@H](N(C)C(=O)C(=O)NCCc2ccc(N)cc2)C1 842238750 XOTYFNHSSXLYIR-MRXNPFEDSA-N 332.448 0.869 10 20 ECCD CNC[C@H](C)NC(=O)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 851684792 HYHRFHWSODHCNC-KBPBESRZSA-N 334.464 0.832 10 20 ECCD C[C@@H](O)[C@@H](NC(=O)C1CC1)C(=O)OCC(=O)c1ccc(O)c(O)c1 783948523 HWHYDMAYSZKGEH-XLKFXECMSA-N 337.328 0.099 10 20 ECCD C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCN1C 785428976 UISRYRUVHBMVLQ-ZFWWWQNUSA-N 332.448 0.968 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@H](CO)[C@H](O)C1 787998055 VXOHGZZGBKGUAI-NVXWUHKLSA-N 335.448 0.386 10 20 ECCD NS(=O)(=O)c1ccc(CNC(=O)c2c(F)ccc(O)c2O)s1 790069954 HGEMDUYLPRBBSV-UHFFFAOYSA-N 346.361 0.876 10 20 ECCD C[C@H]1OCC[C@]12CN(C(=O)C(=O)N(C)Cc1ccccc1O)CCO2 1325637272 SNQOWWDDFPFDOG-ACJLOTCBSA-N 348.399 0.757 10 20 ECCD COC(=O)[C@@H]1CC[C@H](NC(=O)C(=O)N(C)Cc2ccccc2O)C1 1333664594 HBOCKXNYXCOARG-YPMHNXCESA-N 334.372 0.809 10 20 ECCD CNC[C@H](O)[C@H](C)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1343721265 FOWHQHQGLWBYQA-ZQIUZPCESA-N 335.448 0.854 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)N2CCO[C@@H](CN)C2)N(C)C)cc1 1353529858 YRPWGYJCVDGJMQ-IRXDYDNUSA-N 349.479 0.724 10 20 ECCD COCCO[C@@H]1C[C@@H](CO)CN(C(=O)NCc2ccc(N)cc2)C1 1357792403 WWIOSTIOTHCJBP-GDBMZVCRSA-N 337.420 0.824 10 20 ECCD COc1ccc(O)c(CNS(=O)(=O)c2cncc(C(=O)O)c2)c1 1610343904 BKZATRIUBACPQI-UHFFFAOYSA-N 338.341 0.973 10 20 ECCD CCn1cc(C(=O)NC[C@@H](CO)NCc2ccc(OC)c(C)c2)nn1 1755642987 DRFCUBPRMXXTAI-AWEZNQCLSA-N 347.419 0.496 10 20 ECCD C[C@H](NCCN1C(=O)CNC1=O)c1ccc(N2CCOCC2)cc1 181256136 GCTPLRQOVYBBPY-ZDUSSCGKSA-N 332.404 0.726 10 20 ECCD Cc1ccc(O)c(CN[C@H]2CS(=O)(=O)C[C@@H]2N2CCOCC2)c1 265240674 LIDKSCLLNHIVQW-GJZGRUSLSA-N 340.445 0.288 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N(CCO)C2CCC2)c1 275954978 JUBJLCAJZUJHFE-UHFFFAOYSA-N 328.390 0.751 10 20 ECCD COCCn1nnc2c1CCN(C(=O)c1ccc(C)c(O)c1O)C2 294311330 KWMGIDDCPGUUNK-UHFFFAOYSA-N 332.360 0.843 10 20 ECCD Cc1cc(C(=O)NCCO)c(C)n1-c1ccc(-c2nn[nH]n2)cc1 822177366 XVZHLFXRHAOUAL-UHFFFAOYSA-N 326.360 0.996 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3CSCC(=O)N3)C2)cc1 823201341 BTNHRCZZZTXVHP-WFASDCNBSA-N 349.456 0.869 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H](C(=O)O)C2)c1 738164267 QRCVRHKAIZDAFS-VIFPVBQESA-N 342.373 0.701 10 20 ECCD CCn1cc(NC(=O)C(=O)NCc2cccc(OC)c2O)ccc1=O 737283581 CKAYASWSWLBVND-UHFFFAOYSA-N 345.355 0.837 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2[nH]cc3c(=O)ncnc2-3)cc1F 730539067 HTLSOOIPKUYUIG-UHFFFAOYSA-N 344.350 0.593 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NCC(=O)N(C)C 839634910 UOIYOTJWLHVXHZ-CYBMUJFWSA-N 348.447 0.313 10 20 ECCD CN(C)c1ccc(CNC(=O)N[C@H]2CCN(S(C)(=O)=O)C2)cc1 844776247 DQAZGCPPLBMWBC-ZDUSSCGKSA-N 340.449 0.586 10 20 ECCD CONC(=O)CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 925253212 DOBYHKNRQFPJEG-UHFFFAOYSA-N 327.724 0.487 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H]3CO)cc2)C1 892201527 MBFWDYMNDMZSGF-GOEBONIOSA-N 346.431 0.665 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(F)CCOC1 1326071716 OIHGCVDFMDKPSB-MEDUHNTESA-N 341.335 0.817 10 20 ECCD O=C(NCc1ccccc1O)C(=O)Nc1ccnn1C[C@@H]1CCOC1 1324222611 ZFFIPFYHBKALRW-LBPRGKRZSA-N 344.371 0.880 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCC(N)=O 1256132073 RNRSMEOBEVZITQ-NSHDSACASA-N 338.360 0.344 10 20 ECCD O=C(O)[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H]1C1CC1 1340097937 GFSCOFZZPXPVPJ-GXTWGEPZSA-N 344.367 0.804 10 20 ECCD CC[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)O 1573803952 JJNLXKZFTKEBKM-MRVPVSSYSA-N 330.362 0.604 10 20 ECCD CC[C@@H](NCC(=O)NCC(F)F)c1cccc(-c2nn[nH]n2)c1O 1590464903 REANZTLUJUTEOW-SNVBAGLBSA-N 340.334 0.994 10 20 ECCD C[C@@H](Cn1ccnc1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 57170366 PPJBTBHNBHOORQ-JTQLQIEISA-N 338.389 0.779 10 20 ECCD Cc1nc(S(=O)(=O)NCCC(=O)Nc2ccc(N)cc2)cn1C 237674012 QNMIOPZRVKCNNK-UHFFFAOYSA-N 337.405 0.618 10 20 ECCD CSCC[C@H](NC(N)=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 273138642 DJGMWLUUTCBXGT-ONGXEEELSA-N 341.433 0.935 10 20 ECCD CCS(=O)(=O)C[C@H](C)N1C(=O)CN(Cc2ccccc2O)C1=O 819168774 WCLGGWRJQDWLKN-NSHDSACASA-N 340.401 0.980 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(CC(=O)O)C(C)C)nc12 820374173 LZXILWWMOLAGLH-UHFFFAOYSA-N 336.348 0.907 10 20 ECCD C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H]1C(=O)O 828385181 GPDMEURVAWMXCD-KCJUWKMLSA-N 342.373 0.556 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCCO[C@H](CN)C1)c1ccc(N(C)C)cc1 842203662 VRAQGDDURNLBFZ-XJKSGUPXSA-N 348.447 0.506 10 20 ECCD CCc1cccc(CN[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1O 848899108 CDPSUTCSNFTHDI-KRWDZBQOSA-N 347.459 0.977 10 20 ECCD CCOc1ccc(CNCC2(O)CCS(=O)(=O)CC2)c(O)c1 741262005 TWKBVIGANHWVLT-UHFFFAOYSA-N 329.418 0.820 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCc3n[nH]c(C)n3)C2)cc(OC)n1 1020352248 FFBOFWLROAKJAV-HAQNSBGRSA-N 346.391 0.576 10 20 ECCD Cc1cccc(-n2c(C)cc(C(=O)NS(=O)(=O)CC(N)=O)c2C)c1 766930130 WUPJKTCBLNZYKJ-UHFFFAOYSA-N 349.412 0.947 10 20 ECCD C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CC[C@H]1NCC(N)=O 1036304601 CNANXTHMJDJOFH-GXFFZTMASA-N 346.391 0.775 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)NC3(C)COC3)CC2)cc1 875171978 LUCCIMZITKSROV-UHFFFAOYSA-N 348.447 0.905 10 20 ECCD O=C1[C@@H]2COCCN2C(=O)N1Cc1ccc(N2CCOCC2)cc1 777592649 SBOQLDOGEXZFGF-HNNXBMFYSA-N 331.372 0.686 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CCO[C@H]3CN)CC2)c(OC)c1 877227272 HEYGMKYDNXURLO-YOEHRIQHSA-N 349.431 0.716 10 20 ECCD COc1ccc(O)c(CNC(=O)CN2CCCCS2(=O)=O)c1 878852472 OKAWEZMRSNZHAO-UHFFFAOYSA-N 328.390 0.443 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2cc(CSCCO)nn2)cc1 881094387 JCGJZOGVLXKVGV-UHFFFAOYSA-N 349.460 0.886 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)CC2CC2)cc1 1122538890 KIYHNAFDEYYPAI-UHFFFAOYSA-N 330.392 0.677 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3ccn(C)c3)C2)cc(OC)n1 996368240 JSNUWGINRKPCDS-UHFFFAOYSA-N 344.371 0.692 10 20 ECCD O=C(NCCC1=CCN(c2ccc3nnnn3n2)CC1)[C@H]1CC1(F)F 1089830420 AJRUPSNAZZUPBY-LLVKDONJSA-N 349.345 0.817 10 20 ECCD C[C@H](NC1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 999908479 WPLXHTZQHAIXOV-ALXWSUNGSA-N 346.391 0.915 10 20 ECCD C[C@H](N[C@H]1C[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 1086281778 FVDAFZMHFJXXOS-OUJBWJOFSA-N 346.391 0.821 10 20 ECCD C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CO1 1332192691 BTRROEQICXFJEF-HIFRSBDPSA-N 347.415 0.433 10 20 ECCD 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C[C@@H](NC(=O)CS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 920881937 HZIGCQQKFGQGQJ-GFCCVEGCSA-N 326.418 0.745 10 20 ECCD CNC[C@H]1CCCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 842149025 SSCJBIQHROEGGA-CYBMUJFWSA-N 336.411 0.718 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN(C)[C@@H](C)CN)CC2)cc1 923289430 ILYYKYMRSNXHKO-DOTOQJQBSA-N 336.480 0.457 10 20 ECCD CN1C(=O)CN(CC(=O)NCc2ccc(N3CCCC3)cc2)C1=O 858452937 QHCFMZKFWMAVSR-UHFFFAOYSA-N 330.388 0.797 10 20 ECCD C[C@H](NC(N)=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 775872061 MRYWBLIMRBYKAA-JTQLQIEISA-N 338.383 0.460 10 20 ECCD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)C(=O)N(C)C 1117454359 CMDLSUNWPBKHMB-LBPRGKRZSA-N 334.420 0.304 10 20 ECCD CN1CCN(c2ccc(CNc3cc(=O)n(C)c(O)n3)cc2)CC1 1120958099 GYGBRYMMARDJHL-UHFFFAOYSA-N 329.404 0.850 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)c2cn(C)c(=O)n2C)N(C)C)cc1 891246088 LYUSZMBSEJADIC-HNNXBMFYSA-N 345.447 0.823 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC([C@@H]3CCOC3)C2)c1 792613548 NXZTWOGBMHPPCW-SNVBAGLBSA-N 340.401 0.872 10 20 ECCD 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YAFKTZYPIRXHHJ-GXFFZTMASA-N 346.391 0.917 10 20 ECCD CN1CCC[C@H]1C(=O)N1CCN(C(=O)NCc2ccc(N)cc2)CC1 1336290911 WQFWPDVHKRIVTB-INIZCTEOSA-N 345.447 0.717 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1C[C@@H](C(=O)O)C1 1337258715 KYBKIQOGDGFBLM-BETUJISGSA-N 333.388 0.690 10 20 ECCD COCCCS(=O)(=O)NCCSc1ncc(C(=O)O)s1 1610258026 HAKJDMWKJPULRM-UHFFFAOYSA-N 340.448 0.889 10 20 ECCD C[C@H](CN[C@@H]1CCNC1=O)NC(=O)c1ccc(N=NC(N)=O)cc1 1754256395 ZVBHHIVQHFIYDC-BXKDBHETSA-N 332.364 0.445 10 20 ECCD CNS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C/c1cnn(C)c1)CC2 153015475 BEVJVNBOBPNMKT-ZZXKWVIFSA-N 346.412 0.931 10 20 ECCD CCNS(=O)(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 178605249 URAQEKPXFRKBRP-UHFFFAOYSA-N 331.413 0.731 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cn1cnc(N)n1 324532929 HSMZHZDAKXQWEG-UHFFFAOYSA-N 330.392 0.356 10 20 ECCD COCCCS(=O)(=O)NCC(=O)N(C)Cc1ccccc1O 269416189 CHFMZKALSHJSRJ-UHFFFAOYSA-N 330.406 0.307 10 20 ECCD CN1C(=O)C(=O)N(CC(=O)NCc2ccc3c(c2)CCCN3C)C1=O 265083139 VTBRSOZSYRHESH-UHFFFAOYSA-N 344.371 0.106 10 20 ECCD C[C@@H](NS(C)(=O)=O)C(=O)N1CCOc2cc(N(C)C)ccc21 266952214 XSCJQMHKXBBMFI-SNVBAGLBSA-N 327.406 0.416 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C[C@H](NC(C)=O)C(N)=O 801549724 XQDBQICISASADL-AWEZNQCLSA-N 335.404 0.901 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCC4(C3)OCCO4)nc12 729265353 DNSORHNTIZUHLW-UHFFFAOYSA-N 348.359 0.560 10 20 ECCD C[C@H]1CN(C)C(=O)CN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 839329799 DGOKASBPIPVQNX-ZDUSSCGKSA-N 346.431 0.400 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCO[C@@H](CN)C1)c1ccc(N(C)C)cc1 842203364 RXAFQSDLCUVSFB-WFASDCNBSA-N 334.420 0.116 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)[C@]23CCC(=O)N2CCS3)cc1 843298803 QBSKHQUUMBQKOM-WMLDXEAASA-N 348.472 0.934 10 20 ECCD NC(=O)c1ncn(CC(=O)NCc2ccc(N3CCCC3)cc2)n1 845190884 BNYVVYBPXORDBB-UHFFFAOYSA-N 328.376 0.294 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)c1nc(N)nc(N(C)C)n1 846634866 IHPYSJGFLSCZPB-UHFFFAOYSA-N 329.408 0.824 10 20 ECCD O=C1C[C@@H](CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)CN1 927516969 JBJQLNNTVQQQQV-SECBINFHSA-N 337.763 0.946 10 20 ECCD Cc1cc(NC(=O)C(=O)N(C)Cc2ccccc2O)c(=O)n(C)c1 766365447 OOJLRYAWFZMFTM-UHFFFAOYSA-N 329.356 0.996 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cn(C)nn1 1118276591 KBJFJMXVLPOWNW-UHFFFAOYSA-N 345.403 0.966 10 20 ECCD C[C@H](NC(=O)N1CCN2C(=O)NC(=O)[C@@H]2C1)c1ccc(N(C)C)cc1 776245597 HXXZMLVFSJYTKG-FZMZJTMJSA-N 345.403 0.759 10 20 ECCD C[C@@H](NCCCS(N)(=O)=O)c1ccc(N2CCOCC2)cc1 775255942 SDIOYRUYFRPLLM-CYBMUJFWSA-N 327.450 0.852 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNCCN(C)C)CC2)cc1 1120468853 OEYVYPDAAGKIEC-KRWDZBQOSA-N 336.480 0.329 10 20 ECCD O=C(NCCC1=CCN(c2cc(Cl)c(O)nn2)CC1)c1nc[nH]n1 1089837657 CUDKXDIIPYBBNM-UHFFFAOYSA-N 349.782 0.910 10 20 ECCD CC(C)c1cc(N2CC=C(CCNC(=O)CNC(N)=O)CC2)ncn1 1089804480 JUDZYOPKHBPGQB-UHFFFAOYSA-N 346.435 0.911 10 20 ECCD Cn1ncc(CNCCCNC(=O)c2ccc(N=NC(N)=O)cc2)n1 1177237611 GBFWKXVWSDGFGB-UHFFFAOYSA-N 344.379 0.887 10 20 ECCD Cn1cnnc1COCC(=O)NCc1ccc(N2CCOCC2)cc1 1330334965 QUIRPPYCFKPVAR-UHFFFAOYSA-N 345.403 0.485 10 20 ECCD COc1ccc(CNCC(=O)NCC(=O)O)cc1Cn1cccn1 1607260317 ZOZLGPCMUHEZFE-UHFFFAOYSA-N 332.360 0.230 10 20 ECCD COCc1nc2n(n1)C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)CC2 272714487 YMRACTOOHTXFPR-QDBLGGKGSA-N 344.371 0.980 10 20 ECCD CC[C@H]1C(=O)NCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 271252915 JKKKSTXSOUBBLW-NSHDSACASA-N 341.389 0.114 10 20 ECCD CCN1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H](C)C1 288215947 COYKGTBYBCBCIE-LLVKDONJSA-N 341.433 0.930 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)c3cc[nH]n3)CC2)cc1 299498621 LKQOYJIMTXHSDU-UHFFFAOYSA-N 329.404 0.970 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCN(C)C3)CC2)cc1 729921681 SBVPMKMLGLZFMY-MRXNPFEDSA-N 346.475 0.885 10 20 ECCD CCN(CC)c1ccc(CN(C)C(=O)CN2CCNC(=O)C2)cc1 900025793 HPBISGRNRGVRIO-UHFFFAOYSA-N 332.448 0.923 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@H]3C(=O)O)CC2)cc1 738021939 KGLIJHOTIOTULU-JKSUJKDBSA-N 347.415 0.654 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H](N)[C@H](C)C2)cc1 842207602 ODQFKHXNDPUOEF-CZUORRHYSA-N 332.448 0.955 10 20 ECCD C[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N(C)C 750609933 WQNDIKMZDWLRKB-ZDUSSCGKSA-N 339.461 0.488 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CC(=O)N(CCN(C)C)C2)c1 768912232 YYVOBTRPMYLXTQ-CHWSQXEVSA-N 349.431 0.988 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@@H](O)C[C@H]1CO 776123737 QNGWWRXREJIUKM-HOTGVXAUSA-N 335.404 0.160 10 20 ECCD O=C(C(=O)N1CCN(C(=O)c2cccc(O)c2O)CC1)N1CCCC1 776337023 YDHBFSUKPZFCGH-UHFFFAOYSA-N 347.371 0.005 10 20 ECCD CN(C)c1ccc(CNc2nc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 891577953 HSARFFGYJJBSIG-UHFFFAOYSA-N 328.376 0.638 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1[nH]nnc1C 1321131074 ZUAAOWZFQRJPIQ-JTQLQIEISA-N 334.332 0.429 10 20 ECCD CNS(=O)(=O)CCNCc1ccc(N2CCN(C)CC2)c(F)c1 1326071878 TUCZRLKUEAMHOW-UHFFFAOYSA-N 344.456 0.216 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ncccn1 1352107163 PVQBIIOODUZKNI-UHFFFAOYSA-N 327.388 0.817 10 20 ECCD CN1CCCc2cc(CNCCS(=O)(=O)CC(=O)O)ccc21 1593781171 IDEVQLLIUVJZPT-UHFFFAOYSA-N 326.418 0.658 10 20 ECCD Cc1cc(C(=O)NCCN2C(=O)CNC2=O)c(C)n1-c1ccccn1 113192400 UKPPJIYYLSOZEN-UHFFFAOYSA-N 341.371 0.771 10 20 ECCD CS(=O)(=O)CCS(=O)(=O)NCc1ccc(N2CCCC2)cc1 172727712 SMEREDBDCSHWCG-UHFFFAOYSA-N 346.474 0.751 10 20 ECCD CC(=O)N1CCN(c2ccc(CNS(=O)(=O)N(C)C)cc2)CC1 188130691 RKRLJVQCDMBUFI-UHFFFAOYSA-N 340.449 0.251 10 20 ECCD CN(C)c1ccc(CN2CCN(C(=O)Cn3cnnn3)CC2)cc1 289795167 MGNOWWMUEUBMKV-UHFFFAOYSA-N 329.408 0.084 10 20 ECCD C[C@H](C[S@@](C)=O)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 283466547 LHHLFQQEXWWXKC-RKFFSXRUSA-N 325.434 0.252 10 20 ECCD CNCCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827388428 HBKCSLFTCWWWQH-UHFFFAOYSA-N 325.434 0.147 10 20 ECCD COc1ccc(N2CCN(C(=O)CCCS(N)(=O)=O)CC2)cc1 905104166 JZSVUIQTYCWHAL-UHFFFAOYSA-N 341.433 0.413 10 20 ECCD CC(=O)NCCN(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 834770939 MIXIVCXZVLSIFP-UHFFFAOYSA-N 334.420 0.272 10 20 ECCD C[C@@H](NC(=O)C(=O)N1CCO[C@H](CN)C1)c1ccc(N(C)C)cc1 842203362 RXAFQSDLCUVSFB-IUODEOHRSA-N 334.420 0.116 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1[C@H]2CNC[C@H]21 844174362 XYUSEDUEXLTRRW-ZSHCYNCHSA-N 349.456 0.003 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CC(=O)NC(=O)N1 854948094 LAMFRMWCZIQSCO-RISCZKNCSA-N 332.404 0.706 10 20 ECCD CCOC(=O)[C@@H](N)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 852894933 ZUGYSYQTJPYFQF-WFASDCNBSA-N 335.404 0.528 10 20 ECCD Cc1ccc(C(=O)NC[C@H](O)C(N)=O)cc1-n1c(C)cc(C=O)c1C 861355124 JHOKBBJQAVPQSW-INIZCTEOSA-N 343.383 0.791 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)NC[C@@H]2COCCN2)cc1 861686783 DOOQCIIFGYFBHC-CQSZACIVSA-N 336.436 0.761 10 20 ECCD COC(OC)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 874111837 XZGCFDUSGWJZKJ-CYBMUJFWSA-N 335.404 0.623 10 20 ECCD CN1CCNC[C@H]1C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1122026444 SGTAZANPOLHRPL-CVEARBPZSA-N 333.432 0.803 10 20 ECCD COc1cc(C(=O)NC2CC3(CC(NCC(N)=O)C3)C2)cc(OC)n1 964212629 OJRWGUXTDJMHHF-UHFFFAOYSA-N 348.403 0.215 10 20 ECCD COCC(=O)NCCC1=CCN(c2cc(-n3ccnc3)ncn2)CC1 1089797850 LPOMIOJYAGXPDD-UHFFFAOYSA-N 342.403 0.952 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1nccc1C 1261814761 MWAVAPAJAJGVDF-ZDUSSCGKSA-N 347.371 0.893 10 20 ECCD CN1CCN(c2ccc(CN3C[C@H](O)C[C@]3(C)CO)cc2F)CC1 1350328456 TYMSICUHDRMOFS-CRAIPNDOSA-N 337.439 0.895 10 20 ECCD C[C@@H](NCCN1CCCOCC1)c1cccc(-c2nn[nH]n2)c1O 1603662761 PSKJZLBLJKASKV-GFCCVEGCSA-N 332.408 0.945 10 20 ECCD C[C@@H](NC[C@@H](O)c1ccnn1C)c1cccc(-c2nn[nH]n2)c1O 1589980172 YWPCFJBUVKAQCO-NOZJJQNGSA-N 329.364 0.690 10 20 ECCD CNC(=O)CN[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1C 1755124385 AJUUCEMCJCLRCG-GWCFXTLKSA-N 346.391 0.645 10 20 ECCD COC[C@H](C)N[C@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1755648071 XIUVTJWEHWOHIQ-GWCFXTLKSA-N 337.380 0.564 10 20 ECCD COc1cccc(CNS(=O)(=O)c2cc(C(=O)O)[nH]n2)c1O 1599674200 LOIWSUHLSCGTOQ-UHFFFAOYSA-N 327.318 0.301 10 20 ECCD COCCN(C)C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 326718345 CAZWTWGBHGGLNX-KRWDZBQOSA-N 337.464 0.756 10 20 ECCD CCc1nn(C)cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 271861905 OEOXNHDSPLMRMG-UHFFFAOYSA-N 332.360 0.691 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CC[C@H](C(N)=O)O1 276547359 FRNJSKPSWDFYDX-CVEARBPZSA-N 347.415 0.515 10 20 ECCD CC(C)OCCOC[C@H](O)CN(C)C(=O)c1cccc(O)c1O 279432131 ZHJWSWYHWRGVDU-GFCCVEGCSA-N 327.377 0.972 10 20 ECCD COCC(=O)N(C)CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 270340929 ZLDBTPGYPMORTH-UHFFFAOYSA-N 349.431 0.586 10 20 ECCD CC(C)[C@](C)(NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(N)=O 286044429 ALPUUOOKIZTBPF-AWEZNQCLSA-N 343.405 0.394 10 20 ECCD C[C@@H](O)C[C@@H]1COCCN1CC(=O)NCc1ccc(N(C)C)cc1 299309158 NILRWWYRMOBLRN-RHSMWYFYSA-N 335.448 0.841 10 20 ECCD CS(=O)(=O)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 299089499 ZPJSFQLRVZJVRP-UHFFFAOYSA-N 330.381 0.323 10 20 ECCD COc1ccc(N2CC[C@@H](CN3C(=O)[C@@H]4C[C@@H](O)CN4C3=O)C2)cc1 819176200 HVHFACDUGXBYKD-XPKDYRNWSA-N 345.399 0.919 10 20 ECCD COC(=O)c1cc(O)c(F)cc1NS(=O)(=O)N1CCOCC1 830160563 DMVUDPCSWRDMEB-UHFFFAOYSA-N 334.325 0.307 10 20 ECCD COc1ccc(N2CCCN(C(=O)[C@H]3OCCN(C)C3=O)CC2)cc1 900293276 ARTYGDFEEHSICB-INIZCTEOSA-N 347.415 0.591 10 20 ECCD 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10 20 ECCD COC(=O)[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)C[C@@H]1C(=O)O 1606415182 CFBUBYBLIFVDPX-HUPZIKASSA-N 335.312 0.443 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC4CC3(C(=O)O)C4)nc12 1596742852 DEJKXGJWBAPHLF-UHFFFAOYSA-N 346.343 0.661 10 20 ECCD O=C(O)[C@@H](Cc1cnc[nH]1)NCc1ccc(N2CC[C@H](O)C2)cc1 1777589298 VWLNQKNCBZESOJ-JKSUJKDBSA-N 330.388 0.766 10 20 ECCD C/C=C/C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1783060263 SSTYGRPHEBSWDM-YATRRXNKSA-N 347.371 0.512 10 20 ECCD CC(C)(C)[C@@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 278405298 LHSCDCBOZNXIBP-GFCCVEGCSA-N 330.406 0.901 10 20 ECCD COC(=O)c1cnc(SCC(=O)NCC(=O)N2CCCC2)s1 295412214 XKHNZTPRFPGTNK-UHFFFAOYSA-N 343.430 0.760 10 20 ECCD CN(C)c1ccc(CNC(=O)CCNC(=O)[C@H]2CCCN2)cc1F 827906077 FMQOLSSNRRCYDL-CQSZACIVSA-N 336.411 0.766 10 20 ECCD CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)NCCc1ccc(N)cc1 832659090 LDXJZNIWITUSKV-CYBMUJFWSA-N 327.450 0.891 10 20 ECCD C[C@H](N[C@H]1CCN(S(C)(=O)=O)C1)c1cc([N+](=O)[O-])ccc1O 846190655 UWJPIEQFPABNQW-UWVGGRQHSA-N 329.378 0.985 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cc(C(N)=O)cn3)CC2)cc1 754798194 KBFUHMKKIYDGRK-UHFFFAOYSA-N 343.387 0.339 10 20 ECCD CN1CC[C@@](O)(CNC(=O)NCc2ccc(N3CCOCC3)cc2)C1 763012543 MSGDHDXBQOKUIC-GOSISDBHSA-N 348.447 0.389 10 20 ECCD NC(=O)c1ccc(OCC(=O)NCCc2ccc(O)c(O)c2)cc1 762262143 QMYFZBSYZOPVEQ-UHFFFAOYSA-N 330.340 0.934 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NCc3cncn3C)C2)cc(OC)n1 1022367902 LJJUZLWWYVURSC-BETUJISGSA-N 345.403 0.883 10 20 ECCD Oc1cc2c(cc1CN1CC[C@H](CN3CCOCC3)C1)[C@@H](O)CO2 768466596 SRJUUVSXQGRXGH-DYVFJYSZSA-N 334.416 0.972 10 20 ECCD CN1CCN(c2ccc(CN[C@H](Cn3cncn3)C(=O)O)cc2)CC1 1119551240 VZGQDPQFRNVUNA-MRXNPFEDSA-N 344.419 0.273 10 20 ECCD CS(=O)(=O)Nc1nnc(NC(=O)c2cccc(O)c2O)s1 776633076 UYZSSGMVRLLJSM-UHFFFAOYSA-N 330.347 0.573 10 20 ECCD COc1cccc(CNS(=O)(=O)N2CCOC(C)(C)C2)c1O 776860976 ANEQOAYSSVHAPN-UHFFFAOYSA-N 330.406 0.846 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCCCO)cc2)C1 787014087 LJFKYGYCVFRYQL-OAHLLOKOSA-N 348.447 0.960 10 20 ECCD COc1ccc(O)c(CNC(=O)c2ccc(S(N)(=O)=O)cc2)c1 798334387 WYTWRLYEIQHUTC-UHFFFAOYSA-N 336.369 0.978 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@H]3COCCN3C)CC2)nn1 1089820002 QQCJOMTWOWZXRE-MRXNPFEDSA-N 345.447 0.758 10 20 ECCD COC(C)(C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1324782705 BACNGSHKVQGKDF-UHFFFAOYSA-N 349.431 0.681 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2nc(C)n(C)n2)c1 1324287566 XUNCAQBDAYTKGD-QMMMGPOBSA-N 333.348 0.654 10 20 ECCD CN1CCN(c2ccc(CNC(=O)CN3C(=O)CCC3=O)cc2)CC1 1352376216 VYKHJZLKYKADDR-UHFFFAOYSA-N 344.415 0.204 10 20 ECCD CC(=O)N1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 38419429 VKRIFEWAIHKZTA-UHFFFAOYSA-N 332.448 0.875 10 20 ECCD COCCn1nnc2c1CCN(C(=O)/C=C/c1ccc(O)c(O)c1)C2 294399044 QKVCXGXKQBDRFF-HWKANZROSA-N 344.371 0.934 10 20 ECCD C[C@H](CN(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)C(=O)O 817106783 LOZOBUPETPUZNN-SNVBAGLBSA-N 339.367 0.687 10 20 ECCD CN(C)c1ccc(CNC(=O)Nc2nn(C)cc2-c2nn[nH]n2)cc1 821589542 SBMJTBRPCLSWOC-UHFFFAOYSA-N 341.379 0.988 10 20 ECCD O=C(CNC(=O)N1CCCC1)NCc1ccc(N2CCOCC2)cc1 900337672 JZWMYUUPMCQBQS-UHFFFAOYSA-N 346.431 0.945 10 20 ECCD N[C@H]1CCCN(C(=O)C(=O)NCCCSc2nccs2)C1 842093935 UYEXQIJGLQVHRT-JTQLQIEISA-N 328.463 0.691 10 20 ECCD C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)C(=O)O 848607828 JXHCLIQKSCANAK-VIFPVBQESA-N 325.340 0.345 10 20 ECCD Nc1ccc(CCNC(=O)N2CCC[C@H](N3CCNCC3=O)C2)cc1 841955497 FEONMCHCBVYSIW-INIZCTEOSA-N 345.447 0.417 10 20 ECCD C[C@H](CO)[C@@H]1CCCCN1C(=O)C(=O)NCCc1ccc(N)cc1 851688292 WCDBYABUPBWNNJ-CJNGLKHVSA-N 333.432 0.937 10 20 ECCD C[C@H](CCN)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 851689597 RCUFTFZMKLQZRI-CYBMUJFWSA-N 348.447 0.117 10 20 ECCD CC[C@@H](N[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 1021116716 OBTOZLQPYCKQEJ-JHJVBQTASA-N 346.391 0.963 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3COC[C@H]3C)CC2)cc1 932491026 ZPGFVGKFBYBPBX-SZVBFZGTSA-N 349.475 0.803 10 20 ECCD CNC(=O)Cn1nc(NC(=O)NCc2cc(OC)ccc2O)cc1C 767972945 MBPBLZCAAKNEPY-UHFFFAOYSA-N 347.375 0.973 10 20 ECCD 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1120730536 NTGLWLXZFJDCLB-HNNXBMFYSA-N 330.344 0.944 10 20 ECCD O=C(c1c(F)ccc(O)c1O)N1CCN(C(=O)[C@@H]2CCCO2)CC1 790065409 NEYUXLXYQXVYKD-LBPRGKRZSA-N 338.335 0.700 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CCO[C@@H]3CN(CCO)C[C@@H]32)cc1 1083288691 UHPVCRXOVXMHHE-UONOGXRCSA-N 347.375 0.367 10 20 ECCD O=C1CN(Cc2ccccc2O)C(=O)N1C[C@@H]1CCS(=O)(=O)C1 1332417490 LNDKDENOMVQRPO-NSHDSACASA-N 338.385 0.591 10 20 ECCD CON(C)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1340815873 FGLIALCXJYUUNQ-CYBMUJFWSA-N 348.403 0.024 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3C[C@H]3C(=O)O)cc2)CC1 1601143753 LYSYJGGSSHDMDI-LSDHHAIUSA-N 345.399 0.725 10 20 ECCD O=C(Cc1ccc(-c2nn[nH]n2)nc1)NCc1c(O)cccc1F 1606596605 QPEHKNZMYKDJLH-UHFFFAOYSA-N 328.307 0.965 10 20 ECCD CC(C)NS(=O)(=O)NCCNCc1cc2c(cc1O)OCO2 277124325 ZEFSDZGMDUSOIY-UHFFFAOYSA-N 331.394 0.043 10 20 ECCD CN(C[C@H](O)C1CC1)C(=O)C(=O)NCCCSc1nccs1 806281676 GNIXAELOLJYVHM-NSHDSACASA-N 343.474 0.971 10 20 ECCD C[C@@H](NC(=O)C(=O)N1CCNC(=O)[C@H]1C)c1ccc(N(C)C)cc1 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346.387 0.323 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](N[C@@H]3CCNC3=O)C2)cc1 970838321 XQJADHMLRAOQPU-CHWSQXEVSA-N 344.375 0.542 10 20 ECCD COc1ccc(CNCCNC(=O)[C@H](C)N2CCOCC2)cc1C 1153844981 JHGNXJAAYDFRFH-HNNXBMFYSA-N 335.448 0.930 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@@H]3CCO[C@H]3C)C2)cc(OC)n1 996369508 YCHXQVRHPQAQRX-GXFFZTMASA-N 349.387 0.464 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H]1COCCO1 1257292900 XUXJHIBPWSWUAU-MRXNPFEDSA-N 345.399 0.211 10 20 ECCD CCNC(=O)N1CC[C@@H](NC(=O)C(=O)N(C)Cc2ccccc2O)C1 1347050782 WAUOVABDWKUVJH-CYBMUJFWSA-N 348.403 0.271 10 20 ECCD CN1CCN(c2ccc(CNCCCN3CCNCC3)cc2F)CC1 1345098657 AYSCZPCONQCVOO-UHFFFAOYSA-N 349.498 0.962 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)CCC(=O)O)cc2)CC1 1574496218 IHQUAWFEFDWBGD-UHFFFAOYSA-N 333.388 0.869 10 20 ECCD CN(Cc1nnc2c(=O)[nH]ccn12)c1ccc(OCC(=O)O)cc1 1598539354 FSEORTCQEBPLIO-UHFFFAOYSA-N 329.316 0.517 10 20 ECCD CN(CC(=O)NCCc1ccc(O)c(O)c1)c1ncnc2nc[nH]c12 270540521 JYEOPROTRXGECH-UHFFFAOYSA-N 342.359 0.559 10 20 ECCD O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)c1cccc(O)c1O 373566060 BOOYWGDITPDQOR-UHFFFAOYSA-N 340.401 0.784 10 20 ECCD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cnn(C)c1 283475444 LXBUVMGXKCZHHO-GFCCVEGCSA-N 329.404 0.980 10 20 ECCD O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCCc1ccc(O)c(O)c1 298769385 PURZVBXQASJITB-STQMWFEESA-N 346.383 0.932 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)N3CCO[C@@H](CN)C3)C2)cc1 818654472 BKGINDQSDSAAAY-PBHICJAKSA-N 348.447 0.891 10 20 ECCD NC(=O)CN1CCC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1009681067 JZPJWTPMDKFWIZ-LBPRGKRZSA-N 332.364 0.529 10 20 ECCD C[C@]1(C2CCN(C(=O)Cc3ccc(N)cc3)CC2)NC(=O)NC1=O 830811462 IYLPZAYIUHKUKB-QGZVFWFLSA-N 330.388 0.648 10 20 ECCD CCc1cccc(CNCCN2CCN(S(C)(=O)=O)CC2)c1O 848896187 UTYSABBYAYCSGH-UHFFFAOYSA-N 341.477 0.621 10 20 ECCD COc1ccc(N2CCC(NC(=O)NC[C@H]3COCCN3)CC2)cc1 861572564 SETDENSWCPNXSP-HNNXBMFYSA-N 348.447 0.952 10 20 ECCD C[C@@H](NC(=O)CN1C(=O)C(=O)N(C)C1=O)c1ccc(N(C)C)cc1 773023352 WJVJHFNTAMGNCG-SNVBAGLBSA-N 332.360 0.350 10 20 ECCD C[C@H](NC(=O)N1CC[C@H](S(N)(=O)=O)C1)c1ccc(N(C)C)cc1 774972995 GYPAILIFWAIDNS-FZMZJTMJSA-N 340.449 0.886 10 20 ECCD O=C(CN1C(=O)CCC1=O)NCc1ccc(N2CCOCC2)cc1 1350994707 PARXZEYSEOPTJP-UHFFFAOYSA-N 331.372 0.288 10 20 ECCD O=C(O)[C@@H]1C[C@@H](O)CN(Cc2ccc(N3CCOCC3)c(F)c2)C1 1608600257 BYHDXILHORBGDA-ZIAGYGMSSA-N 338.379 0.930 10 20 ECCD CN(C)CCN1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)CC1=O 269226185 SAUMUIJMJXSCQR-CYBMUJFWSA-N 335.404 0.167 10 20 ECCD CC1(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)COC1 286822877 AZPGIADZBVXUQU-UHFFFAOYSA-N 329.400 0.832 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1COC[C@H]1O 297306753 IBTGDDFDLWGVPS-UKRRQHHQSA-N 339.367 0.221 10 20 ECCD CCNCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 818677268 SABAMYKJDKQDMR-AWEZNQCLSA-N 348.447 0.363 10 20 ECCD CN(C)CCOc1ccc(N(C)Cc2cn(CC(N)=O)nn2)cc1 839012050 VVAPYSTYQNTYMC-UHFFFAOYSA-N 332.408 0.340 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3CCCCN3)ccc21 842150003 KYEAQLDLDMPUKY-MRXNPFEDSA-N 344.459 0.944 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](CN)C2)cc1F 842148384 NDSMJMYLXIQIBV-ZDUSSCGKSA-N 336.411 0.705 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C[C@@H](C)N1 842147516 FXGOEYYIMCAJJY-TXEJJXNPSA-N 336.411 0.717 10 20 ECCD C=CC(=O)N(C)CC(=O)N(CC(=O)OCC)Cc1ccccc1O 862039960 VLMGAIGFUYFTLW-UHFFFAOYSA-N 334.372 0.928 10 20 ECCD C[C@H](C(N)=O)N1CC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1039061806 UJXODGTYIDBXKM-BXKDBHETSA-N 332.364 0.527 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)C[C@H]1C[C@@H](O)C1 875251354 KFGHEYAAFDRIJE-AKAXFMLLSA-N 333.432 0.907 10 20 ECCD COc1ccc(CN[C@H]2CN(C(=O)Cn3ncnn3)C[C@@H]2C)cc1C 1054651050 VCUXTBRIQOMATH-ZFWWWQNUSA-N 344.419 0.627 10 20 ECCD COc1ccc(CNC(=O)N[C@@H](C)CN2CCN(C)CC2)c(O)c1 792990165 PPGQVEZJTIAKFU-ZDUSSCGKSA-N 336.436 0.836 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)C[C@@H]3CCNC3=O)CC2)ncn1 1089844509 CYDUXBVBZYZRNJ-HNNXBMFYSA-N 343.431 0.954 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)C3(CF)CC3)C2)cc(OC)n1 996380133 XXTXSDBWLAGLDH-UHFFFAOYSA-N 337.351 0.789 10 20 ECCD CC(C)c1nccc(N2CC=C(CCNC(=O)CNC(N)=O)CC2)n1 1089804296 CGLPHDBRQZURTK-UHFFFAOYSA-N 346.435 0.911 10 20 ECCD COC[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)OC 1325140638 DDEYROMQLCJBOY-IUODEOHRSA-N 337.420 0.707 10 20 ECCD CCN(C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CCNC1=O 1328579608 JLFPUIDUUSTRTG-OAHLLOKOSA-N 346.431 0.448 10 20 ECCD CN1CCCc2cc(CNC(=O)c3cn(CC(=O)O)nn3)ccc21 1604216383 MNVHREMTWGSYPT-UHFFFAOYSA-N 329.360 0.675 10 20 ECCD COc1ccc(CNC(=O)[C@@H](C)n2cnc(-c3nn[nH]n3)n2)c(O)c1 1591592621 VODXVTWOEBFZLP-MRVPVSSYSA-N 344.335 0.050 10 20 ECCD CCN(CC)c1ccc(CNC(=O)c2cn(CC(N)=O)nn2)cc1F 173263660 XGCKOAOLKTXKRK-UHFFFAOYSA-N 348.382 0.679 10 20 ECCD Cc1c(CNC(=O)C(=O)NC[C@H]2CCCN2)n(C)c2ccccc12 419702879 CJTMLWJLEYKCLZ-CYBMUJFWSA-N 328.416 0.971 10 20 ECCD Cc1c(CNC(=O)C(=O)Nc2ncn(C)n2)n(C)c2ccccc12 340402791 JAZJSZSKYSDHFC-UHFFFAOYSA-N 326.360 0.870 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)NCc3nnn(C)n3)C2)cc1 823520240 DTIPCKFYOUVRNL-GFCCVEGCSA-N 345.407 0.544 10 20 ECCD Cc1cc(C(=O)NC[C@@H](O)Cn2ccnn2)c(C)n1-c1ccccn1 838086059 FVXQTLMTDXFLTO-CQSZACIVSA-N 340.387 0.872 10 20 ECCD C[C@@H](N)C[C@@H](C)NC(=O)C(=O)NCCCSc1nccs1 843258771 CKGBXRHQVMYHQZ-NXEZZACHSA-N 330.479 0.984 10 20 ECCD O=C(NCCNC1CC1)C(=O)NCc1ccc(N2CCCC2)cc1 842206681 ILWVCMAIGCHIJP-UHFFFAOYSA-N 330.432 0.771 10 20 ECCD COCCN1C(=O)/C(=C/N[C@@H]2CCCC[C@H]2C)C(=O)NC1=S 920978084 UGEVCDNREFCRCJ-LNOKQREWSA-N 325.434 0.928 10 20 ECCD COc1ccc(-n2nnnc2CN2CCC[C@@H]2CNC(C)=O)cc1 1027710775 ARMVWFZCXUNKDQ-CQSZACIVSA-N 330.392 0.771 10 20 ECCD CCn1cc(S(=O)(=O)NCc2ccccc2O)c([N+](=O)[O-])n1 754806807 VYFRJIHBPOWVTE-UHFFFAOYSA-N 326.334 0.995 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CCOC(=O)N3)CC2)c(OC)c1 870165713 KKGLVNJTTOPYEN-ZDUSSCGKSA-N 349.387 0.851 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N3CC[C@@H](CO)C3)cc2)CC1 889660635 DKUGXVRORWXIKJ-MRXNPFEDSA-N 332.448 0.962 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccn(C)n2)cc1 785432606 FIAKHYGDJVKWSO-UHFFFAOYSA-N 329.404 0.461 10 20 ECCD COc1ccc(CNCCNC(=O)CCn2ncn(C)c2=O)cc1C 1131769568 XZTDMRJYGDXVPX-UHFFFAOYSA-N 347.419 0.195 10 20 ECCD CO[C@@H]1CN[C@](C)(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1333260015 XFTCTWPKOTWJKM-HKUYNNGSSA-N 346.475 0.822 10 20 ECCD Cc1sc(NC=C2C(=O)NC(=S)NC2=O)c(C(=O)O)c1C 1600888429 FSUHOWMVIABFMT-UHFFFAOYSA-N 325.371 0.890 10 20 ECCD CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)N[C@H](C)c1ccccc1O 827930925 VDZHQJZFMSEUBV-BXUZGUMPSA-N 333.388 0.697 10 20 ECCD COC[C@H](CO)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 823524369 RPTXAFSBOFELEK-AWEZNQCLSA-N 337.420 0.454 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H]3NCC3(C)C)CC2)cc1 829505360 LSPNCSFFXHDXES-KRWDZBQOSA-N 346.475 0.931 10 20 ECCD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C(=O)O 848609486 FGFLJBZYJNEDES-GFCCVEGCSA-N 331.372 0.516 10 20 ECCD COc1ccc(N2CCC(NC(=O)C(=O)NCC3(N)CC3)CC2)cc1 911189240 ZJIZXSGVLLJCDY-UHFFFAOYSA-N 346.431 0.388 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCNC2)cc1F 842149037 TXTMIBPDPSRKLC-ZDUSSCGKSA-N 336.411 0.624 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3C[C@H](C)[C@@H](O)C3)CC2)cc1 754097210 MHLFRDJVDLTCCV-IEZWGBDMSA-N 349.475 0.491 10 20 ECCD COc1cccc(CNC(=O)c2ccc(S(N)(=O)=O)nc2)c1O 764103495 YDIWDKWUOBNXIJ-UHFFFAOYSA-N 337.357 0.373 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3COC[C@@H]3O)C2)cc1 875679720 QIOXYMHDANHNOQ-WQVCFCJDSA-N 335.404 0.580 10 20 ECCD CN(CC(N)=O)[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 980520574 IHOPNHLRHSSHON-GFCCVEGCSA-N 332.364 0.481 10 20 ECCD COCCN1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@@H](O)C1 1090830376 MCXSZSFGUXNSHB-KBPBESRZSA-N 349.391 0.660 10 20 ECCD CCOC(=O)N1CC[C@H](NC(=O)C(=O)N(C)Cc2ccccc2O)C1 1327435389 HWFNRZNMFFKHID-ZDUSSCGKSA-N 349.387 0.698 10 20 ECCD Cn1ncc(CNCc2ccc(N3CCC(C(N)=O)CC3)cc2)n1 1334034321 WTLAPJWAEPMGMG-UHFFFAOYSA-N 328.420 0.807 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCc3ncccn3)ccc21 1330960835 KWSREJAFPWCTAR-UHFFFAOYSA-N 339.399 0.792 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCC(OCC(N)=O)CC2)cc1 1334390910 MEPCWMFTTIYCDN-UHFFFAOYSA-N 348.447 0.335 10 20 ECCD 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COc1ccc(N2CCN(C(=O)COC(=O)C3(O)CCC3)CC2)cc1 918759731 AOOQDRVZUFZCIM-UHFFFAOYSA-N 348.399 0.802 10 20 ECCD NCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 844192453 SHQKVRKQUKZDER-UHFFFAOYSA-N 344.394 0.517 10 20 ECCD C[C@@H](CN)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 841721093 DCFXAFZRKKETAF-ZFWWWQNUSA-N 347.463 0.782 10 20 ECCD C[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)S(C)(=O)=O 856210114 NRKVRXLMWHHLDN-LBPRGKRZSA-N 340.445 0.697 10 20 ECCD Cn1cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cc1C(=O)O 757659665 ZEUVHRVINVZVNO-UHFFFAOYSA-N 340.313 0.928 10 20 ECCD NS(=O)(=O)c1cc(C(=O)NCc2ccc(O)c(O)c2)cs1 768917264 HEDFAQFOPIBMRO-UHFFFAOYSA-N 328.371 0.737 10 20 ECCD CS(=O)(=O)Cc1noc(NC(=O)NCc2ccccc2O)n1 765245566 IQTZVGUFNQZINI-UHFFFAOYSA-N 326.334 0.642 10 20 ECCD COc1ccc(N2CCN(C(=O)N=c3nc[nH]n3C)CC2)c(OC)c1 879004168 ZHDLQZXOGPXIEP-UHFFFAOYSA-N 346.391 0.608 10 20 ECCD C[C@@H](NC(=O)NCCNS(C)(=O)=O)c1ccc(N(C)C)cc1 773166469 OVNUVNZSNGMTOZ-LLVKDONJSA-N 328.438 0.662 10 20 ECCD 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CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(O)CCCC1 1116669520 RSYZQQVTOONKSL-LBPRGKRZSA-N 337.372 0.993 10 20 ECCD COCCN(CC(=O)N(C)C)Cc1ccc(N2CCN(C)CC2)cc1 775656342 FATSRMLHBUIENQ-UHFFFAOYSA-N 348.491 0.975 10 20 ECCD O=C(NCCC1=CCN(c2cc(F)ncn2)CC1)[C@@H]1COCCO1 1089807896 ZIKBAVNGRSTUME-ZDUSSCGKSA-N 336.367 0.674 10 20 ECCD NC(=O)CNC1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 997391983 PWLCUEBXKIQMRB-UHFFFAOYSA-N 332.364 0.529 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCCN[C@H]2CCCNC2=O)cc1 1153047820 MAOFTQAUMYGGSV-LBPRGKRZSA-N 332.364 0.447 10 20 ECCD CNC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 1321365417 VXHQDWUXGASWSZ-AWEZNQCLSA-N 346.431 0.353 10 20 ECCD CC(=O)N1CCC[C@H](CNC(=O)C(=O)N(C)Cc2ccccc2O)C1 1328776003 XHRGORZORGYKEB-CQSZACIVSA-N 347.415 0.725 10 20 ECCD CO[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 1258445798 RTPCSBFNISAFLA-JTQLQIEISA-N 329.447 0.989 10 20 ECCD COc1ccc(N2CCN(c3nnc(C(N)=O)n3C)CC2)c(OC)c1 1355671048 QGWXCZYTQXKVJR-UHFFFAOYSA-N 346.391 0.258 10 20 ECCD O=C(O)CN1CCCC[C@H](NCc2cc([N+](=O)[O-])ccc2O)C1=O 1606258662 GILXKRQODDTMTN-LBPRGKRZSA-N 337.332 0.856 10 20 ECCD CN1CC[C@H](N(C)C(=O)NCc2ccc(N3CCOCC3)cc2)C1=O 265790761 WYSRFJWZONEWKC-INIZCTEOSA-N 346.431 0.895 10 20 ECCD COC(=O)[C@@H]1COCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 269624966 JJZOTLGVXPITFY-INIZCTEOSA-N 349.431 0.585 10 20 ECCD COC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C[C@H](C)O1 283653471 XWUZAOJLGXHMMK-BBRMVZONSA-N 349.431 0.631 10 20 ECCD Cc1nonc1CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 807676004 BSJUWAMDYNKBOC-JTQLQIEISA-N 331.376 0.938 10 20 ECCD COC[C@@H](O)CNC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 823732906 JCYMPSHXOVRLAG-HIFRSBDPSA-N 337.420 0.828 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)C3(N)CCC3)cc2)CC1 832173218 OCRROOOROLYFRO-UHFFFAOYSA-N 330.432 0.853 10 20 ECCD C[C@@H](N)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 842230035 PHLFOFJNPCGLPB-TZMCWYRMSA-N 335.404 0.363 10 20 ECCD CNC[C@@H](C)NC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 851685910 HWPJONIPOURNRJ-CYBMUJFWSA-N 348.447 0.504 10 20 ECCD CCN(CCO)C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 754027431 KNFBWVSUKCWKLC-QGZVFWFLSA-N 337.464 0.492 10 20 ECCD COc1ccc(N(C)CCN(C)S(=O)(=O)c2nncn2C)cc1 867459831 CEHSZBQFPGZSLX-UHFFFAOYSA-N 339.421 0.581 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1coc(S(N)(=O)=O)c1 773768016 AGLAEZKTEZVJAN-QMMMGPOBSA-N 340.357 0.699 10 20 ECCD CN1CCN(c2ccc(CNc3cc(=O)n(C)c(=O)n3C)cc2)CC1 882879814 NYMXBXWAADKKPK-UHFFFAOYSA-N 343.431 0.448 10 20 ECCD COC(=O)CNC(=O)[C@@H](C)N[C@@H](C)c1ccc(N2CCOCC2)cc1 775253691 BMGHNDIWISKVNU-UONOGXRCSA-N 349.431 0.852 10 20 ECCD COCC(=O)NCC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1075347584 IECBGTLLBHUNLG-JTQLQIEISA-N 325.365 0.370 10 20 ECCD COC[C@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)OC 1325140642 DDEYROMQLCJBOY-WFASDCNBSA-N 337.420 0.707 10 20 ECCD CCN1CCC[C@H](NC(=O)C(=O)N(C)Cc2ccccc2O)C1=O 1335102869 ZFANGOXAVROLPG-ZDUSSCGKSA-N 333.388 0.478 10 20 ECCD COCCn1nnnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1262211449 FGBOYUIFDMXPGQ-UHFFFAOYSA-N 336.371 0.794 10 20 ECCD N[C@@H](Cc1cn(Cc2ccc(N3CCOCC3)cc2)nn1)C(=O)O 1601175723 JECUQFUJWKLFDJ-HNNXBMFYSA-N 331.376 0.117 10 20 ECCD CC(C)(C)OC(=O)NC[C@@H](O)CNC(=O)c1cccc(O)c1O 854714689 GWXYSNJLKVJPOB-VIFPVBQESA-N 326.349 0.713 10 20 ECCD CN(C)c1ccc(CNC(=O)CN(CCO)C2CCOCC2)cc1 298407074 FJNTVUSGXYGSCN-UHFFFAOYSA-N 335.448 0.842 10 20 ECCD COCCn1nc(C(=O)NCc2cccc(OC)c2O)ccc1=O 729861697 VTMMRPBSDPAWBZ-UHFFFAOYSA-N 333.344 0.534 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)NCCN1C(=O)CNC1=O 734532353 VNOHJYIBTLCBKR-UHFFFAOYSA-N 333.392 0.412 10 20 ECCD Cc1ccnc2nc(C(=O)OCC(=O)c3ccc(O)c(O)c3)nn12 916590182 GJAZGDRKTOJHPH-UHFFFAOYSA-N 328.284 0.884 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)c3cn(C)c(=O)n3C)C2)cc1 911276848 OQWFGDZOOAYWFH-ZDUSSCGKSA-N 344.415 0.989 10 20 ECCD CNCCN(C)C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 911577378 CMXYVIQOEHBFAW-INIZCTEOSA-N 349.479 0.149 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N[C@@H](C)CCN 842069868 FVJQUBWIFXNRKF-UONOGXRCSA-N 334.464 0.962 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCC(N)CC3)CC2)cc1 923277113 JYDVIECWUUXAET-GOSISDBHSA-N 348.491 0.601 10 20 ECCD CCOC(=O)N1CCN(S(=O)(=O)Nc2ccc(O)cc2F)CC1 758169363 QLFULFOTOIOJSV-UHFFFAOYSA-N 347.368 0.962 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCNC(=O)C2)N(C)C)cc1 891254511 YOCQUOCIKLRCOA-ZBFHGGJFSA-N 332.448 0.998 10 20 ECCD CN(CC(N)=O)C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 985816299 WGDYGKOGTOCHON-UHFFFAOYSA-N 346.391 0.871 10 20 ECCD O=C(CNC(=O)C1CC1)NCCC1=CCN(c2cc(F)ncn2)CC1 1089815469 YHESXYQEHJJQGK-UHFFFAOYSA-N 347.394 0.785 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3c[nH]nc3C)C2)cc(OC)n1 996367284 AISMMFQXOCOXHF-UHFFFAOYSA-N 345.359 0.385 10 20 ECCD COCCOC1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1328498220 YNSJVYDWHZNBKP-UHFFFAOYSA-N 349.431 0.585 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCC2(CC1)CNC(=O)O2 1345837207 LOJCOQUDAPZSHN-UHFFFAOYSA-N 347.371 0.452 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3cnn(CCO)c3)cc2)CC1 1520554583 RRHIBCKFAWRYCM-UHFFFAOYSA-N 343.431 0.557 10 20 ECCD NC(=O)C[C@H]1COCCN1c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 1608231166 BHGXUONHOAQSIS-FWEMWIAWSA-N 335.316 0.773 10 20 ECCD C[C@H](N[C@H](C)CN1CCOCC1)c1cccc(-c2nn[nH]n2)c1O 1589848283 QCOAGURKIWIDHL-NEPJUHHUSA-N 332.408 0.944 10 20 ECCD COc1ccc(CN[C@H](CO)CNC(=O)c2nn(C)cc2C)cc1C 1755628921 YFCNZFDZCGMBKE-HNNXBMFYSA-N 346.431 0.926 10 20 ECCD CN1CCO[C@@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 174472186 ZNWSDPQRFVSXKK-QGZVFWFLSA-N 333.432 0.812 10 20 ECCD Cc1cc(N(C)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)ccn1 272841755 IQTYJZPVYXRRJQ-UHFFFAOYSA-N 332.385 0.850 10 20 ECCD COc1c([N+](=O)[O-])ccc([C@@H]2NC(=O)[C@H]3CSCCN32)c1O 278231535 VEPCEFVRSFYBRL-BXKDBHETSA-N 325.346 0.855 10 20 ECCD O=C(NCc1ccccc1O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1 299457433 AZHJFAVJKKVXQM-OAHLLOKOSA-N 347.415 0.189 10 20 ECCD CN(C)c1ccc(CNC(=O)NC[C@H]2CC(C(N)=O)=NO2)cc1F 297225486 MZQCJLPUSSTHLX-SNVBAGLBSA-N 337.355 0.321 10 20 ECCD CNS(=O)(=O)CC(=O)NCc1cc(Cl)cc(Cl)c1O 813685641 NIGBUISMZVQDRZ-UHFFFAOYSA-N 327.189 0.864 10 20 ECCD CCNC(=O)N1CC[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1 819170678 LROMMLMJAFTBOO-ZDUSSCGKSA-N 346.387 0.960 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCN(C)CC1 839220207 DOEAOXDBRYYGAB-UHFFFAOYSA-N 332.448 0.875 10 20 ECCD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCN1C 748351919 XKAGQAGCKQHZGD-JTQLQIEISA-N 327.406 0.540 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCO[C@H]([C@H](C)N)C1 842151245 AFGSWADFDMUMGT-BBRMVZONSA-N 348.447 0.252 10 20 ECCD Cn1cc(N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2=O)cn1 768464440 RINQJWUEFFXIAQ-HNNXBMFYSA-N 344.371 0.400 10 20 ECCD O=C(CNC(=O)COc1ccccc1)NCc1ccc(O)c(O)c1 778925646 MRNGXDHTEOOJER-UHFFFAOYSA-N 330.340 0.909 10 20 ECCD C[C@@H](NC(=O)N1CCN2C(=O)NC(=O)[C@@H]2C1)c1ccc(N(C)C)cc1 776245602 HXXZMLVFSJYTKG-RISCZKNCSA-N 345.403 0.759 10 20 ECCD Cn1ncc(C(=O)NCCC2=CCN(c3nccnc3F)CC2)n1 1089834481 HCZRKIFCCYKSBK-UHFFFAOYSA-N 331.355 0.701 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CC(NC(=O)[C@@H]3CCOC3)C2)cc1 990415730 KBTHNAPMCUGQAI-LLVKDONJSA-N 345.359 0.826 10 20 ECCD CN(C)[C@H]1CCCC[C@@H]1NC(=O)C(=O)NCCc1ccc(N)cc1 1325704501 OHZNFQLCZOIBTH-HOTGVXAUSA-N 332.448 0.917 10 20 ECCD CC(C)N1CC[C@@H](NC(=O)C(=O)N(C)Cc2ccccc2O)C1=O 1326623815 NVKSUPMFQWRTSH-CYBMUJFWSA-N 333.388 0.476 10 20 ECCD COCCOC[C@@H](C)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 1327318731 LCFGBWLEBDZDOQ-CYBMUJFWSA-N 337.420 0.537 10 20 ECCD COC(=O)[C@@H]1C[C@H](O)CN1Cc1ccc(N2CCN(C)CC2)cc1 1343491222 OZJYYKSUKSLDRY-IRXDYDNUSA-N 333.432 0.547 10 20 ECCD C[C@@H](C(=O)NCc1cc(Cl)ccc1O)n1cnc(-c2nn[nH]n2)n1 1573729147 HPERNAKETSZIBV-ZETCQYMHSA-N 348.754 0.695 10 20 ECCD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1CNCCO1 188103796 WDVADKKMFQQUBI-QGZVFWFLSA-N 333.432 0.500 10 20 ECCD C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@H]1CO 276888197 XIHFRTHICJOPNJ-ZJUUUORDSA-N 328.390 0.464 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CC[C@H](O)C2)c1 276829655 FLIDCSKDHGROQU-ONGXEEELSA-N 328.390 0.655 10 20 ECCD COc1ccc(CNC(=O)[C@@H]2CC(=O)N(c3cn[nH]c3)C2)c(O)c1 373657144 ANJYSRNMFRSHEN-LLVKDONJSA-N 330.344 0.793 10 20 ECCD COc1ccc(N2CCC(NCC(=O)N3CCNCC3)CC2)cc1 817945814 MPRXIHGBVUKGGC-UHFFFAOYSA-N 332.448 0.685 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@@H]([C@@H](C)N)C1 817949092 HKXMNNCANJEBPW-CZUORRHYSA-N 349.431 0.705 10 20 ECCD C[C@H](N)[C@@H](C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 827468990 ITBZEAAWPDNQLV-VNHYZAJKSA-N 332.448 0.988 10 20 ECCD COc1ccc(O)c(CNS(=O)(=O)N2CCC(C(=O)O)CC2)c1 833733199 CCUDONJJJVXKMU-UHFFFAOYSA-N 344.389 0.532 10 20 ECCD CN1CCCc2cc(CNC(=O)N3C[C@H]4C(=O)NC(=O)[C@H]4C3)ccc21 838032203 XZUSLOAXNPBFQO-OKILXGFUSA-N 342.399 0.483 10 20 ECCD C[C@@H](CN)CNC(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 911292626 QVIQOWKMGXLWFC-XJKSGUPXSA-N 349.479 0.183 10 20 ECCD Cc1nonc1CC(=O)NCc1ccc(N2CCN(C)CC2)cc1 918845637 NKRIYBRGMMAAJM-UHFFFAOYSA-N 329.404 0.989 10 20 ECCD CN1C(=O)CN(CC(=O)NCc2ccc(N3CCOCC3)cc2)C1=O 858724192 LALGJUPUEKLZLK-UHFFFAOYSA-N 346.387 0.033 10 20 ECCD COC(=O)CNC(=O)CNCc1cccc(Br)c1O 877706969 WDDXCXXCPUTCTR-UHFFFAOYSA-N 331.166 0.534 10 20 ECCD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1cccc(C)c1O 775642638 MSCJWSCHZNJFCX-CQSZACIVSA-N 340.445 0.826 10 20 ECCD CNC(=O)CCNC(=O)NCc1ccc(N2CCN(C)CC2)cc1 883159325 GYYCYSVEUUKUAG-UHFFFAOYSA-N 333.436 0.374 10 20 ECCD COCCC(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089802807 YATOOXZIAYFCFO-UHFFFAOYSA-N 331.380 0.199 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)C(N)=O 1320809880 XWJOOYRYOOXLNR-JTQLQIEISA-N 338.360 0.200 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCCC(=O)N1CCCCC1 1326696698 XNUWVXMEUMOOGP-UHFFFAOYSA-N 347.415 0.869 10 20 ECCD CC1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CNC1 1331015390 GMEMARQMGRZNNC-UHFFFAOYSA-N 330.432 0.614 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCC(O)(CO)CC1)c1ccc(N(C)C)cc1 1261705285 PITYJWLPFAKPJP-ZDUSSCGKSA-N 349.431 0.276 10 20 ECCD COC(=O)[C@H]1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)[C@H]1C 1345196669 DGARSIQERXBTMI-FZMZJTMJSA-N 333.388 0.338 10 20 ECCD O=C(CN1CCN(c2ccccn2)CC1)NCc1cccc(O)c1O 1352658385 UDVZHSNHNRUPNG-UHFFFAOYSA-N 342.399 0.931 10 20 ECCD COc1ccc(N2CCN(c3cnc(-c4nn[nH]n4)cn3)CC2)cc1 1609357629 PJCZEIWTLLXYMP-UHFFFAOYSA-N 338.375 0.992 10 20 ECCD COc1ccc(N2CC[C@H](NC(=O)NC[C@]3(C)CNCCO3)C2)cc1 1579224483 LIVLAMYMVKCHIW-KSSFIOAISA-N 348.447 0.952 10 20 ECCD NC(=O)c1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 124057129 JMLSTVDHZRFSQZ-UHFFFAOYSA-N 340.383 0.947 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)[C@@H]3CCN(C)C3=O)nc12 265641932 KBXUPSZCJIFOAW-GFCCVEGCSA-N 347.375 0.274 10 20 ECCD COc1cc(N2CCN(Cc3nnn(C)n3)CC2)cc(OC)c1OC 281763166 YWZUQVLMKZNQDC-UHFFFAOYSA-N 348.407 0.558 10 20 ECCD COc1cc(Cl)cc(CN2CCNC(=O)[C@@H]2CC(=O)O)c1O 388595428 UJUFKPVAEVTPJY-JTQLQIEISA-N 328.752 0.829 10 20 ECCD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1COCCO1 299176496 XQGPFQGHPGXQLL-KRWDZBQOSA-N 334.416 0.927 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H](NC(C)=O)C1 817764102 NZOLRXUSXHUXBA-HNNXBMFYSA-N 347.415 0.868 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H](CO)OC(C)(C)C2)cc1 817274339 KQQKYAXQSYJIAA-HNNXBMFYSA-N 349.431 0.367 10 20 ECCD CC(C)NC(=O)[C@@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 839901877 XYLQXOGZRMXOJO-SECBINFHSA-N 343.405 0.407 10 20 ECCD COC(=O)CNC(=O)[C@H]1CCCN1Cc1cc2c(cc1O)OCO2 841892636 PCGXIMICCXHKGJ-LLVKDONJSA-N 336.344 0.375 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)NCC[C@@H]1CCNC1 842094178 WREZGVANKUCGKL-NSHDSACASA-N 342.490 0.857 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)C[C@@H]1COCCO1 850602262 SPVOGCZSLUYFCV-MRXNPFEDSA-N 349.431 0.585 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1[C@H]2CC[C@H]1CNC2 853367793 TYTFBEQWEDDOST-IRXDYDNUSA-N 342.443 0.866 10 20 ECCD CCNC(=O)NC(=O)[C@H](C)N(C)c1ccc(OCC(=O)OC)cc1 784559507 TUWPBJKIFYSBKD-NSHDSACASA-N 337.376 0.909 10 20 ECCD COc1ccc(-n2nnnc2CN(C)[C@@H]2CCN(C(C)=O)C2)cc1 970916336 QWTZPQHQZDLGOL-CQSZACIVSA-N 330.392 0.724 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccnn1C 1255148756 PJHQXQLLZUQJBO-NSHDSACASA-N 333.344 0.736 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3CNCCN3C)C2)cc1 1340386273 PVZPSGIAEVENQC-YOEHRIQHSA-N 332.448 0.541 10 20 ECCD COCCn1c(-c2sccc2O)nnc1N1CCCNC(=O)C1 1523650500 BACUBEAGKRMCBA-UHFFFAOYSA-N 337.405 0.685 10 20 ECCD COc1ccc(N2CC[C@H](NCCS(=O)(=O)CC(=O)O)C2)cc1 1594101013 ACMBWOQECNVYMU-LBPRGKRZSA-N 342.417 0.363 10 20 ECCD CCS(=O)(=O)NCCNC(=O)NCc1ccc(N(C)C)cc1C 115677687 RCMWUCNUHHIYTR-UHFFFAOYSA-N 342.465 0.800 10 20 ECCD CC(C)(C)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(N)=O 271363427 YMOFFBHUQUDACS-LLVKDONJSA-N 343.405 0.394 10 20 ECCD C[C@H]1CN(c2ccc(CNC(=O)Cn3cnnn3)cc2F)C[C@H](C)O1 298869553 SZLYGMZQQRAIGQ-RYUDHWBXSA-N 348.382 0.742 10 20 ECCD Cc1c(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)cnn1C 291931338 OOCNBNMPNNVNHQ-UHFFFAOYSA-N 344.418 0.901 10 20 ECCD COC[C@H](OC)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 822937682 KLTGVOMTZVASDP-HOCLYGCPSA-N 349.431 0.666 10 20 ECCD COC[C@@H]1NC(=O)N(C[C@H](c2ccc(N(C)C)cc2)N(C)C)C1=O 900185365 KTWNQRYAHQHWQD-LSDHHAIUSA-N 334.420 0.922 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN(C)C(=O)C2)cc1 846722679 BASUDRFWYHEZOB-UHFFFAOYSA-N 346.431 0.450 10 20 ECCD COc1ccc(N2CCC(NC(=O)NC[C@@H]3CNCCO3)CC2)cc1 841779005 KEYNLOHFTFVIQK-KRWDZBQOSA-N 348.447 0.952 10 20 ECCD CO[C@@](C)(C(=O)O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 849364176 FBLUPNININEXGM-MRXNPFEDSA-N 340.351 0.768 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)NC(C)(C)CN)CC2)cc1 841749950 KQJITUJJSHPVSM-UHFFFAOYSA-N 349.479 0.854 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(O)CCOC3)cc2)CC1 857494592 RNXYBQXDNJYUPQ-GOSISDBHSA-N 347.415 0.123 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCNC3)cc2)C1 851654762 IJHNONKSCJWXMS-GJZGRUSLSA-N 345.447 0.549 10 20 ECCD CNS(=O)(=O)C[C@H]1CCCN1Cc1cc2c(cc1O)OC[C@H]2O 768463309 GRIYQGIBUSRYHE-BXUZGUMPSA-N 342.417 0.332 10 20 ECCD C[C@H](NC(=O)Cn1ncn2nccc2c1=O)c1ccc(N(C)C)cc1 773018006 KWNUQCZNBTZYOD-LBPRGKRZSA-N 340.387 0.834 10 20 ECCD CNS(=O)(=O)C[C@@H]1CCCN1C(=O)/C=C/c1ccc(O)c(O)c1 779531299 VROYXNGPVWZHRZ-PZBABLGHSA-N 340.401 0.651 10 20 ECCD COc1ccc(O)c(CN2CCN(S(=O)(=O)N(C)C)CC2)c1 775650380 ZHMFOHDQSPGUFP-UHFFFAOYSA-N 329.422 0.325 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cncs3)C2)cc(OC)n1 996369374 VBZIHMJREAMCNV-UHFFFAOYSA-N 348.384 0.810 10 20 ECCD CC(=O)N1CC(C(=O)NCCC2=CCN(c3ccc(C)nn3)CC2)C1 1089824217 ZQRJWSFBFUSSGH-UHFFFAOYSA-N 343.431 0.906 10 20 ECCD CCNC(=O)CC(=O)NCCC1=CCN(c2cc(C)ncn2)CC1 1089822193 TTZRHMIONJHHLJ-UHFFFAOYSA-N 331.420 0.954 10 20 ECCD COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@H]2CCC(=O)N2)cc1C 1755774789 KLSSVTNCENQNTA-HUUCEWRRSA-N 349.431 0.191 10 20 ECCD COc1ccc(CN[C@H](CO)CNC(=O)c2ccnn2C)cc1C 1755622231 DOVHSXDBCNHSIW-AWEZNQCLSA-N 332.404 0.618 10 20 ECCD COc1ccc(CN[C@H](C)CNC(=O)[C@H]2CC[C@@H](C(N)=O)O2)cc1C 1752900908 MMAPMRYVTHBNGG-UHOFOFEASA-N 349.431 0.631 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCS1(=O)=O 119758098 WMWMBHJFVFADEA-UHFFFAOYSA-N 325.434 0.747 10 20 ECCD Cc1cc(C)cc(-n2c(C)cc(C(=O)NC(C(N)=O)C(N)=O)c2C)c1 267176691 FVIWNRDNWOFNJF-UHFFFAOYSA-N 342.399 0.780 10 20 ECCD CC(=O)NCCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 299269866 UDSKBGMKJMVVMJ-UHFFFAOYSA-N 329.378 0.020 10 20 ECCD CN1CCN(c2ccc(CNC[C@@H](O)C[C@@]3(O)CCOC3)cc2)CC1 905427848 OGPBVIDVEOECCH-OALUTQOASA-N 349.475 0.430 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)C(C)(C)NS(C)(=O)=O)cc1 832284911 NWUFKNCJTWKDDC-ZDUSSCGKSA-N 342.465 0.196 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(O)(C(=O)O)CC1 833694751 BZQJLAUFYDRKGQ-UHFFFAOYSA-N 349.431 0.623 10 20 ECCD COc1ccc(O)c(CNC(=O)c2cc(S(N)(=O)=O)cn2C)c1 734015673 VSYFCYQPGXXJRG-UHFFFAOYSA-N 339.373 0.317 10 20 ECCD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2CS(=O)(=O)C[C@H]2O)cc1 913369611 OPJFQOPLUNDIEW-HZPDHXFCSA-N 348.424 0.982 10 20 ECCD CC(C)(N)CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 851688981 IVVAIIDVAFGDLX-UHFFFAOYSA-N 348.447 0.117 10 20 ECCD CN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CCN(CC(N)=O)C1 1033699343 NFYHFBRCPITRQA-LBPRGKRZSA-N 332.364 0.481 10 20 ECCD CCOc1ccc(CN2CCN(C(=O)C(=O)NC(C)C)CC2)c(O)c1 768213972 CYBWCVNZTYUALW-UHFFFAOYSA-N 349.431 0.960 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCO)CC2)cc1 778221300 RRKPGASHFWMBOF-VOTSOKGWSA-N 333.388 0.009 10 20 ECCD C[C@H](NC(=O)N1C[C@@H](O)C[C@H]1CO)c1ccc(N2CCOCC2)cc1 776120075 REALYOBICJBQOS-JQFCIGGWSA-N 349.431 0.721 10 20 ECCD O=C(N[C@@H]1CCN(C2CCOCC2)C1=O)c1c(F)ccc(O)c1O 881061891 AXZGSLDPPCJIJC-LLVKDONJSA-N 338.335 0.747 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)C(=O)C(C)(C)C)C2)cc(OC)n1 996368899 QEWWARGFFGWOBA-UHFFFAOYSA-N 349.387 0.655 10 20 ECCD COc1ccc(O)c([C@H](C)NCc2nnc3c(=O)n(C)ccn23)c1 1331257759 PTAQQHJSMZEWAN-JTQLQIEISA-N 329.360 0.993 10 20 ECCD COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CC(C(=O)O)=NO3)C2)cc1 1604809600 LRKHNNPAMZVBFR-YGRLFVJLSA-N 333.344 0.620 10 20 ECCD O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@@H]1CNCCO1 1610780290 DQGXLXDTSNWVSE-GFCCVEGCSA-N 342.779 0.837 10 20 ECCD COc1ccc(O)c(CN[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1 367611618 CPPWLVIAJKRSOY-HNNXBMFYSA-N 349.431 0.424 10 20 ECCD C[C@@H](C(=O)NC1CC1)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 836428442 LHJFGXLBBBPDEZ-LBPRGKRZSA-N 347.415 0.906 10 20 ECCD C[C@H](NC(=O)N1CCOC[C@H]1CO)c1ccc(N2CCOCC2)cc1 914401016 ZORWKTGKHJFBLL-WMLDXEAASA-N 349.431 0.987 10 20 ECCD CNS(=O)(=O)CC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840556961 OBLGCRJHEBDJAM-LBPRGKRZSA-N 327.450 0.657 10 20 ECCD Nc1ccc(NC(=O)C(=O)N2CCC[C@H](C(=O)NCC3CC3)C2)cc1 841009797 VOBZURCYGBKRQY-ZDUSSCGKSA-N 344.415 0.972 10 20 ECCD CS(=O)(=O)N1CC[C@H](NC(=O)NCc2cc(Cl)ccc2O)C1 845427434 ZGYNHFXZBYEIQO-NSHDSACASA-N 347.824 0.879 10 20 ECCD O=S(=O)(NCc1ccccc1O)c1ccc(-n2cnnn2)cc1 751151994 ZJOKNWXLSRCCPA-UHFFFAOYSA-N 331.357 0.846 10 20 ECCD O=C1CCC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)N1 856213052 BAAXWKXRIKSBNG-MRXNPFEDSA-N 331.416 0.933 10 20 ECCD CNC(=O)[C@@H](C)N1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1039061107 PJPLMQZKAWPZKD-MFKMUULPSA-N 346.391 0.788 10 20 ECCD CN1CC(=O)N(Cc2ccc(N3CCS(=O)(=O)CC3)cc2)C1=O 777605553 SNVOKKGBBHBVPR-UHFFFAOYSA-N 337.401 0.315 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)c2cc[nH]c2)cc1 1127907246 DZZZUARZELWRTD-UHFFFAOYSA-N 341.375 0.519 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC3(C2)OCCO3)cc1 785438948 IMQXWENZUQAGMG-UHFFFAOYSA-N 333.388 0.344 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)Cn3nnnc3C)CC2)cc1 788422884 YKFIBFLSWVHDRF-HNNXBMFYSA-N 332.408 0.173 10 20 ECCD COCCN1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@H](OC)C1 1082390050 WNPBTYZNZQWSFO-ZIAGYGMSSA-N 349.391 0.924 10 20 ECCD C[C@@]1(C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)CCC(=O)N1 1089860642 IUAWMIIDRGIHAS-KRWDZBQOSA-N 347.394 0.927 10 20 ECCD CN1C[C@@H](C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)CC1=O 1089867376 IVWQSYONQQVGFZ-ZDUSSCGKSA-N 347.394 0.737 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)NC[C@@H]2CNCCO2)N(C)C)cc1 1336910659 WLVNRNIKSWPVIF-IRXDYDNUSA-N 349.479 0.643 10 20 ECCD CN(C)[S@](C)(=O)=NS(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 1777036970 NPZFWVQOXAQQTM-HXUWFJFHSA-N 337.379 0.322 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)CC(=O)NC3CC3)nc12 51856811 YCLDNHNNHODQSQ-UHFFFAOYSA-N 347.375 0.322 10 20 ECCD COCCS(=O)(=O)CC(=O)N(C)Cc1ccc(N(C)C)cc1 298493003 IBQYQQADMRRKNJ-UHFFFAOYSA-N 328.434 0.772 10 20 ECCD NC(=O)c1ccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cc1 390414213 MIHMNICZCSFWPT-UHFFFAOYSA-N 336.325 0.990 10 20 ECCD CCS(=O)(=O)N[C@@H](C)C(=O)NCc1ccc(N(C)C)c(F)c1 824668957 AHLGEHUGUUOJLP-JTQLQIEISA-N 331.413 0.836 10 20 ECCD CNC[C@H]1CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 844219201 HWLRWGKQINIHGB-MRXNPFEDSA-N 346.475 0.885 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H](CO)C2)c1 920445578 SBXOYNIDNNQFNT-JTQLQIEISA-N 328.390 0.608 10 20 ECCD COc1ccc(CNC[C@@H]2CCN(C(=O)Cn3ncnn3)C2)cc1C 1026847880 RAIKLPDJTUBKEQ-HNNXBMFYSA-N 344.419 0.628 10 20 ECCD CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccco2)ccc1O 790408411 YGDSNQFCWLBYTJ-UHFFFAOYSA-N 332.359 0.694 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCS(=O)(=O)C1 1323436927 UNROBOKOVVOERK-LBPRGKRZSA-N 340.401 0.044 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)NCCCCN)C2)cc1 1326583506 IRWLWCKKGOXLKE-AWEZNQCLSA-N 348.447 0.493 10 20 ECCD CN1CCC[C@@H]1C(=O)N1CCN(C(=O)NCc2ccc(N)cc2)CC1 1336290912 WQFWPDVHKRIVTB-MRXNPFEDSA-N 345.447 0.717 10 20 ECCD O=C(COC(=O)c1cc(-c2nn[nH]n2)c[nH]1)c1ccc(O)c(O)c1 1606562317 VIHVOMVYXFPESR-UHFFFAOYSA-N 329.272 0.646 10 20 ECCD COc1ccc(CNC[C@H](C)CNC(=O)[C@@H]2CN(C)C(=O)N2)cc1C 1753626767 SSXVNIFCBHCBPT-WFASDCNBSA-N 348.447 0.869 10 20 ECCD COc1ccc(N2CCN(S(=O)(=O)[C@H]3CCOC3)CC2)cc1 265577290 XPQKGHVYEHMTRL-HNNXBMFYSA-N 326.418 0.936 10 20 ECCD COC(=O)[C@]1(F)CCN(CC(=O)NCc2ccc(N(C)C)cc2)C1 267824664 PQNZDAUIHUXHHZ-KRWDZBQOSA-N 337.395 0.956 10 20 ECCD COCCn1c([C@@H]2CNC(=O)C2)nnc1N(C)Cc1ccccc1O 818280857 HICSVRQQSQPTML-ZDUSSCGKSA-N 345.403 0.870 10 20 ECCD O=C(NCCNc1ncccc1-c1nn[nH]n1)c1cc(O)cs1 738081705 GKPNVBLNFOBLAS-UHFFFAOYSA-N 331.361 0.871 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CCCNC1 842226696 LABUHBXIGZXIKD-HNNXBMFYSA-N 332.448 0.827 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)[C@@H]3CCC(=O)N3)C2)cc1C 1019678706 UQZXHKHNCRRKNE-GJZGRUSLSA-N 331.416 0.973 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CC=CCN3)CC2)cc1 923429210 RKNHLMRKVIFYKT-QGZVFWFLSA-N 332.448 0.555 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H](CCO)C2)c1 763236463 DZRUCWNAZRJLBB-NSHDSACASA-N 342.417 0.998 10 20 ECCD Cc1ccc(CN[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c(O)c1 877152639 OWARVVAHULZACB-MRXNPFEDSA-N 333.432 0.723 10 20 ECCD CS(=O)(=O)N[C@@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 779479369 NCNIFJILKILLMX-SMYYYNMVSA-N 340.401 0.651 10 20 ECCD COc1ccc(N2CCN(Cn3nc(C)oc3=O)CC2)c(OC)c1 872707011 SJAKRQVQCDLGGQ-UHFFFAOYSA-N 334.376 0.942 10 20 ECCD O=C(CC(=O)OCC(=O)c1ccc(O)c(O)c1)NCC(F)(F)F 784599714 FMIQDNBGLUTKMR-UHFFFAOYSA-N 335.234 0.892 10 20 ECCD COc1cccc(CNC(=O)c2ccc(S(N)(=O)=O)cc2)c1O 798334353 WAWCDXIUSYWJJY-UHFFFAOYSA-N 336.369 0.978 10 20 ECCD O=C1C[C@H](C(=O)NCCC2=CCN(c3nccnc3F)CC2)CCN1 1089821060 QLEHCBAKOOWWDK-CYBMUJFWSA-N 347.394 0.785 10 20 ECCD CSCC(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089804333 DXROGCNUNULFIZ-UHFFFAOYSA-N 333.421 0.525 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cncnc3)C2)cc(OC)n1 996369486 XWBHJRDLEJQVAV-UHFFFAOYSA-N 343.343 0.143 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@H]3C[C@H]3C(N)=O)CC2)nn1 1089866405 JKGXSFIARYBZRP-KGLIPLIRSA-N 329.404 0.549 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(C(C)(C)C)C1=O 1326142812 ZFECYGYDXLYXDZ-CYBMUJFWSA-N 347.415 0.866 10 20 ECCD COC(=O)[C@H]1C[C@@H](NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1331802129 USTMIQISVWEGFF-BNOWGMLFSA-N 347.415 0.998 10 20 ECCD O=S(=O)(c1ccc(-c2nn[nH]n2)cn1)N1Cc2cccc(O)c2C1 1593451978 LQTKQPZTWZDWIP-UHFFFAOYSA-N 344.356 0.672 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@H]3CNC(=O)N3)C2)cc1C 1022629720 HCDPWHYWWUFQJV-HZSPNIEDSA-N 332.404 0.422 10 20 ECCD COC(=O)c1cn([C@H]2CCN(C(=O)c3cccc(O)c3O)C2)nn1 365751164 AEZUPGZSRNSTKX-VIFPVBQESA-N 332.316 0.563 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NOC1CCOCC1 807101543 AAEPWSXZTXPSDM-UHFFFAOYSA-N 335.404 0.904 10 20 ECCD Cc1noc([C@@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 725893621 KXOHGADLYDNPPA-SSDOTTSWSA-N 340.361 0.946 10 20 ECCD COCC1(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)CCNCC1 832272653 IDERRABSQBMURJ-MRXNPFEDSA-N 334.464 0.885 10 20 ECCD CO[C@H](C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918338136 UUIIVXWYSHQCBU-GFCCVEGCSA-N 326.418 0.573 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NC[C@@H](N)C2CC2)cc1 846345761 YKOUPUOAEMHSQI-MRXNPFEDSA-N 348.447 0.443 10 20 ECCD CN(C)C(=O)CN1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1016368315 OPZQYUSNTPSXBZ-ZDUSSCGKSA-N 346.391 0.741 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CC[C@@H]1N 842094003 VRENRYIDTSKFOF-MNOVXSKESA-N 342.490 0.937 10 20 ECCD COc1ccc(N(C)Cc2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)cc1 844353347 SJIIBTKCZMNAEI-UHFFFAOYSA-N 329.360 0.605 10 20 ECCD COC[C@](C)(O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 754987622 ICHFABQFPNNOPN-KSSFIOAISA-N 349.431 0.402 10 20 ECCD CCOC[C@@H]1CN(C(=O)C(=O)NCCc2ccc(N)cc2)CCO1 861776848 MXVBTOHDGUGVAL-HNNXBMFYSA-N 335.404 0.191 10 20 ECCD C[C@H](NC(=O)C(=O)N[C@@H]1CCNC1)c1ccc(N2CCOCC2)cc1 861743335 SQPOOHRXZWBROS-DZGCQCFKSA-N 346.431 0.179 10 20 ECCD COc1cc(C(=O)NC2CN(CC[C@@H]3CCOC3)C2)cc(OC)n1 1030614540 KVGQXRJEJHBUSL-GFCCVEGCSA-N 335.404 0.939 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N2CC[C@@H]3NC(=O)CC[C@@H]3C2)cc1 1118485556 BPKBGBCEDPTRTN-HIFRSBDPSA-N 344.415 0.055 10 20 ECCD COc1ccc(N2CCN(CCN3C(=O)CNC3=O)CC2)c(OC)c1 879463687 MEMQGBADMVXOFA-UHFFFAOYSA-N 348.403 0.378 10 20 ECCD COc1ccc(CN[C@H]2C[C@H]3CC[C@H]2N(C(=O)C(N)=O)C3)cc1C 1079030489 GEHARLVTKOQIBL-QLFBSQMISA-N 331.416 0.958 10 20 ECCD CN(C(=O)CNCCNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1153037248 IPYRWOPDRUMCMR-UHFFFAOYSA-N 346.391 0.789 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC(=O)N[C@@H]2CCCC[C@@H]21 1324862008 DMZIMPLFYMMIFO-KGLIPLIRSA-N 345.399 0.620 10 20 ECCD O=C(O)/C=C\c1ccc(N2CCN3C(=O)NC(=O)[C@H]3C2)c([N+](=O)[O-])c1 1601881076 NBDSSUDZVYTPKZ-DTRQGZQOSA-N 346.299 0.433 10 20 ECCD COC(=O)CC[C@@H](N)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1578810065 YYNUASMKCQZBDA-MRXNPFEDSA-N 349.431 0.544 10 20 ECCD CN(CC(=O)NC(=O)NC1CC1)Cc1ccc(N2CCOCC2)cc1 16387044 FXTQNUVLDBIEBF-UHFFFAOYSA-N 346.431 0.943 10 20 ECCD CC(C)(C)OC(=O)NC[C@H](O)CNC(=O)c1cccc(O)c1O 854714688 GWXYSNJLKVJPOB-SECBINFHSA-N 326.349 0.713 10 20 ECCD COc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)ncn1 273976037 TWLAHYOVXMSVNG-UHFFFAOYSA-N 347.350 0.945 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)CCC(N)=O)cc2)CC1 907639014 CZUIGFPVZIYRFW-UHFFFAOYSA-N 332.404 0.237 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)N(C)C[C@H](C)O)CC2)cc1 839259262 LIPOPGSNFZDWHH-AWEZNQCLSA-N 349.431 0.573 10 20 ECCD C[C@@H](N)[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 841729978 LKPQNFPRRYHIOL-PBHICJAKSA-N 348.447 0.781 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CCO[C@@H](CN)C3)CC2)cc1 844222245 BIRMJLGVZMZBEQ-KRWDZBQOSA-N 348.447 0.003 10 20 ECCD CCOC(=O)c1cc(/C=C2\SC(N3CCOCC3)=NC2=O)[nH]n1 843269435 QYQHMVBGXWVMLA-FLIBITNWSA-N 336.373 0.889 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)CCS(=O)(=O)N(C)C)cc1 843297322 GZFGQHJJULRYSL-CQSZACIVSA-N 342.465 0.150 10 20 ECCD CCOC(=O)CC(C)(C)CC(=O)C(=O)CN1CCS(=O)(=O)CC1 935947087 SKXIXVROZVJUMU-UHFFFAOYSA-N 347.433 0.225 10 20 ECCD CCOC(=O)[C@H](N)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 852872292 LBRQMPZQLLQWQB-CQSZACIVSA-N 339.367 0.373 10 20 ECCD CS(=O)(=O)N1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768441808 NSDBHXSKXMYSDP-AWEZNQCLSA-N 342.417 0.285 10 20 ECCD CN1C(=O)CN(CC(=O)NCc2c(O)ccc3c2CCCC3)C1=O 860243303 JRQRLSFNGXBFBW-UHFFFAOYSA-N 331.372 0.781 10 20 ECCD CCc1ncc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cn1 774363833 XNICMHDXTJBETF-UHFFFAOYSA-N 330.344 0.748 10 20 ECCD COc1ccc(CNC(=O)[C@H]2CCCN2S(C)(=O)=O)c(O)c1 794382367 ARCOJHBVBKICOL-GFCCVEGCSA-N 328.390 0.441 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](CNC(=O)c3nnn(C)n3)C2)cc1C 1086170558 VPTXYKUQNUDSJL-OKILXGFUSA-N 344.419 0.825 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2CN(C(=O)c3cc[nH]n3)C2)cc1 994377487 XDAKCJNDZKKHKD-UHFFFAOYSA-N 341.331 0.827 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)C[C@@H](O)CN)cc2F)CC1 1357430372 FPZOTWNAGSSRED-CQSZACIVSA-N 338.427 0.294 10 20 ECCD C[C@@H](N[C@@H]1CCc2c(nnn2C)C1)c1cccc(-c2nn[nH]n2)c1O 1589952438 ANSUZPBNKAZUEK-NXEZZACHSA-N 340.391 0.909 10 20 ECCD O=C(O)C1(C(=O)NCc2ccccc2O)CCS(=O)(=O)CC1 1594863469 KDIPNPIBJNBDDE-UHFFFAOYSA-N 327.358 0.288 10 20 ECCD C[C@@](O)(CNS(=O)(=O)c1cc(Cl)cc(Cl)c1O)C(=O)O 1776462292 MLVNVSHNKJGDEZ-SNVBAGLBSA-N 344.172 0.813 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)c1cnc2n(c1=O)CCS2 269191223 JYSPFCMHPJKHDI-UHFFFAOYSA-N 333.369 0.733 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCSC1 283943705 HNDKKQTVINXGSM-AWEZNQCLSA-N 349.456 0.761 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1CO 297892952 QYLKGGGWQXIQTO-HIFRSBDPSA-N 333.432 0.798 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)C2(C(=O)NC3CC3)CC2)cc1 832280669 PWBITSTVTHTKLV-OAHLLOKOSA-N 330.432 0.927 10 20 ECCD NC(=O)C1=NO[C@@H](CNC(=O)NCCCSc2nccs2)C1 838515121 JQUZSNCTLKLYDH-MRVPVSSYSA-N 343.434 0.555 10 20 ECCD COc1cc(C(=O)NC2CCN([C@H](C)C(N)=O)CC2)cc(OC)n1 1003244775 HCWYLBWJXPINFA-SNVBAGLBSA-N 336.392 0.167 10 20 ECCD O=C(OCC(=O)N1CCC2(CC1)OCCO2)c1cccc(O)c1O 758571486 DTWXZIUWINTUNX-UHFFFAOYSA-N 337.328 0.620 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)NCc2nc(O)cc(CN)n2)c1 851680502 ITEIHDFTWZGJNG-VIFPVBQESA-N 347.375 0.916 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CCCNC3=O)CC2)c(OC)c1 870165833 AYNZFUFIHLSUKV-AWEZNQCLSA-N 347.415 0.879 10 20 ECCD C[C@H](NC(=O)NCc1nnn(C)n1)c1ccc(N2CCOCC2)cc1 787065365 PBJSHEBXIVIFJT-LBPRGKRZSA-N 345.407 0.607 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(C)C(=O)[C@H]1C 1324900300 YLMQVBGWEKOTOZ-CYBMUJFWSA-N 346.431 0.366 10 20 ECCD COc1cccc([C@H](C)NCC2(O)CCS(=O)(=O)CC2)c1O 1346206077 CLERBYFFOYOHMD-NSHDSACASA-N 329.418 0.991 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NO[C@H]2CCCCO2)c1 263651824 DVAXSUZBUTXXDF-LBPRGKRZSA-N 330.362 0.952 10 20 ECCD CCS(=O)(=O)N(C)CCCNC(=O)/C=C/c1ccc(O)c(O)c1 272383667 GAOFRCVJPBUMLE-SOFGYWHQSA-N 342.417 0.899 10 20 ECCD COC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCCO1 283336276 CXSOCASRGRMJLL-HOTGVXAUSA-N 349.431 0.679 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@@H](C(=O)O)C3)ccc21 817107442 PRFWNHBQUCGFIK-CQSZACIVSA-N 345.399 0.618 10 20 ECCD NS(=O)(=O)c1cccc(NC(=O)C(=O)NCc2ccccc2O)c1 737168594 YMPJJWIHEZHDKZ-UHFFFAOYSA-N 349.368 0.295 10 20 ECCD COc1cc(C(=O)N[C@H]2CCCN([C@H](C)C(N)=O)C2)cc(OC)n1 1007790051 FYORFEKUZRUWHT-PWSUYJOCSA-N 336.392 0.167 10 20 ECCD NC[C@@H](NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 842213787 MSWLBYRQESRUOM-MRXNPFEDSA-N 330.432 0.757 10 20 ECCD N=C(N)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 849008631 YMFNMBALVQYEAN-UHFFFAOYSA-N 329.383 0.925 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCCNC3CC3)ccc21 842150976 YUOFSXXDEBUVEZ-UHFFFAOYSA-N 330.432 0.553 10 20 ECCD CS(=O)(=O)NC[C@@H]1COCCN1C(=O)Nc1ccc(N)cc1 859698538 YONXYMUQBQMIGJ-GFCCVEGCSA-N 328.394 0.051 10 20 ECCD CCn1nccc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 856478854 WWVBDYDXNKJREK-UHFFFAOYSA-N 338.389 0.910 10 20 ECCD CSC[C@H](CCO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 763237996 WXRJDOTYDKPIOQ-JTQLQIEISA-N 348.446 0.608 10 20 ECCD CN1CCN(C)[C@@H](CNCc2ccc(N3CCC(O)CC3)cc2)C1 877031096 MIXOONAVSLXGND-SFHVURJKSA-N 332.492 0.983 10 20 ECCD CC[C@@H](CO)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 780323296 SOOUKLNBDNHZMY-CABCVRRESA-N 348.447 0.958 10 20 ECCD COCCS(=O)(=O)NCc1ccc(N2CCN(C)CC2)cc1 882664578 XPEHEXQQMYJARH-UHFFFAOYSA-N 327.450 0.504 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN(C)C3(CO)CC3)CC2)cc1 796505484 ZDNLCVRDYDNMFU-KRWDZBQOSA-N 349.475 0.635 10 20 ECCD NC(=O)NCC(=O)NCCC1=CCN(c2ccc([N+](=O)[O-])cc2)CC1 1089804272 BEWRFLVVYJBDAJ-UHFFFAOYSA-N 347.375 0.906 10 20 ECCD Cc1nc(C)c(C)c(N2CC=C(CCNC(=O)CNC(N)=O)CC2)n1 1089804832 VKFAHONPRKOTLX-UHFFFAOYSA-N 346.435 0.713 10 20 ECCD CCC(=O)N1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@@H](O)C1 991568522 YVAUQVALKJMIRZ-OLZOCXBDSA-N 347.375 0.951 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1CN2CCC[C@H]2CO1 1323750446 DPCNVEHTSDPERF-LSDHHAIUSA-N 347.415 0.330 10 20 ECCD CCN(CC)c1ccc(CNC(=O)CN2C(=O)C(=O)N(C)C2=O)cc1 265069561 SRJDGUILKMYXEL-UHFFFAOYSA-N 346.387 0.570 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CC[C@@H](n3cncn3)C2)cc1 372380678 OZGVGBZDNRPLSC-MRXNPFEDSA-N 328.420 0.907 10 20 ECCD CC(=O)NCC(=O)NCC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 839918737 NDCSKFKFGHXRMV-ZDUSSCGKSA-N 348.447 0.361 10 20 ECCD COc1ccc(O)c(CNC(=O)CCN2CCCS2(=O)=O)c1 734015667 VBAGIKOEEPAAFB-UHFFFAOYSA-N 328.390 0.443 10 20 ECCD CN(C)C(=O)Cn1cc(C(=O)NCc2cc(Cl)ccc2O)nn1 846472887 NQCYDQHVJIPIBR-UHFFFAOYSA-N 337.767 0.655 10 20 ECCD C[C@@H](C(N)=O)N1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1016367964 MSMMQJLXGYSALN-JOYOIKCWSA-N 332.364 0.527 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@@H](CN)C3)ccc21 842150188 OKFSWWJENLNHCR-AWEZNQCLSA-N 330.432 0.492 10 20 ECCD C[C@H](NCCN1CCN(S(C)(=O)=O)CC1)c1ccc(F)cc1O 756536971 YANIYXFDEPIVMV-LBPRGKRZSA-N 345.440 0.759 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN(C)C3CC(N)C3)CC2)cc1 923363317 RRYYMXAZEAATCU-VMWRSERWSA-N 348.491 0.600 10 20 ECCD CNC[C@@H](C)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 851656182 ICMDNEBJXPBSOD-OAHLLOKOSA-N 349.479 0.724 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CC(=O)NC(=O)N2)N(C)C)cc1 891248921 OPRBDCXOEDNXCT-UONOGXRCSA-N 347.419 0.070 10 20 ECCD NC(=O)NCCC(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089834561 DDCBPKZCOYNSFM-UHFFFAOYSA-N 336.371 0.317 10 20 ECCD CNC[C@H](O)[C@H](C)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1343721264 FOWHQHQGLWBYQA-VBQJREDUSA-N 335.448 0.854 10 20 ECCD Cc1cc(Br)c(O)c(CNCC(=O)NCC(=O)O)c1 1600070818 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ICCVOCZPGIUHOV-QMMMGPOBSA-N 331.419 0.578 10 20 ECCD CN(CCCN)C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 911581006 XZVDNVGUNVFFPZ-INIZCTEOSA-N 349.479 0.279 10 20 ECCD CN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)[C@H](CN)C1 841730061 NDTYSAJEYHUKOZ-QGZVFWFLSA-N 347.463 0.308 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](N)CCN(C)C)C2)cc1 846682823 MLPYMNWVYUIHJZ-YOEHRIQHSA-N 334.464 0.917 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CN2CCN(C)CC2)cc1 846445686 DTGNMZIHBGNKFY-UHFFFAOYSA-N 334.464 0.837 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)NC[C@H]1CCCNC1 842092308 KWQRWQXJMCCYKO-NSHDSACASA-N 342.490 0.857 10 20 ECCD NCc1cc(O)nc(CNCc2ccc(N3CCOCC3)cc2)n1 863648808 JYGBJWXVCXLWDL-UHFFFAOYSA-N 329.404 0.767 10 20 ECCD C[C@H](N)CCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1119295636 XCGLNFKGYFBDEQ-KBPBESRZSA-N 348.447 0.554 10 20 ECCD Cc1cc(N(C)C)ccc1CNS(=O)(=O)[C@@H](C)C(=O)N(C)C 774881106 PJNIZTZQYUUANE-LBPRGKRZSA-N 327.450 0.957 10 20 ECCD CNC(=O)[C@H]1CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCO1 773627015 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RQNAHBPWNOFGKL-UHFFFAOYSA-N 337.445 0.520 10 20 ECCD CC[C@H](C)NC(=O)CN1CCN(C(=O)c2cccc(O)c2O)CC1 274904149 QQZOROAPUIOISR-LBPRGKRZSA-N 335.404 0.770 10 20 ECCD CC(=O)N(C)CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 299250783 VKNWBCFJUADZOA-UHFFFAOYSA-N 333.432 0.990 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)N[C@H]2CCS(=O)(=O)C2)c1 729041607 UUZQIGZXMUEZJZ-ZJUUUORDSA-N 328.390 0.948 10 20 ECCD CC[C@@H](CNS(C)(=O)=O)NCc1ccc(N2CCOCC2)cc1 824677856 KDWHPGZYAIKHHM-HNNXBMFYSA-N 341.477 0.941 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(C)CCNC3)cc2)CC1 832172871 MKQGFSHGWXOKFW-IBGZPJMESA-N 344.459 0.971 10 20 ECCD CC(C)[C@](C)(O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 743713332 GXIDUNPQIQZCRK-CQSZACIVSA-N 330.406 0.901 10 20 ECCD CC[C@H](CO)NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 931766589 GYGBDYMMOUXRKH-CQSZACIVSA-N 339.411 0.639 10 20 ECCD CN(C)c1cc(F)c(CN2CCN3C(=O)C(=O)NC[C@H]3C2)cc1F 862251896 QABGFEJMYWYYIG-NSHDSACASA-N 338.358 0.173 10 20 ECCD CN(C)c1ccc(CNC(=O)c2ccc(S(N)(=O)=O)nc2)cc1 762738367 SVQGUTMISDLWJN-UHFFFAOYSA-N 334.401 0.725 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)CCCN2C(=O)CNC2=O)c1 768910510 GTLJCMNKFHFUCW-SNVBAGLBSA-N 335.360 0.910 10 20 ECCD CN(C)C(=O)Cn1cc(NC(=O)NCCc2ccc(O)c(O)c2)cn1 761650903 KMUFVLLJWWCXER-UHFFFAOYSA-N 347.375 0.747 10 20 ECCD C[C@@H](NC(=O)Cn1ncn(C)c1=O)c1ccc(N2CCOCC2)cc1 778650729 QHWLFVXCOBRENG-CYBMUJFWSA-N 345.403 0.296 10 20 ECCD COc1cccc(CNC(=O)C(=O)Nc2cn(C)c(=O)cc2C)c1O 781967888 RDUMRLMEDMQJTE-UHFFFAOYSA-N 345.355 0.663 10 20 ECCD COc1ccc(O)c(CNc2cnn(CC(=O)NCCN(C)C)c2)c1 893550538 MPAWUQGDEHGRTQ-UHFFFAOYSA-N 347.419 0.887 10 20 ECCD COCCCC(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089814979 MUUHDWNWLQCOOA-UHFFFAOYSA-N 345.407 0.589 10 20 ECCD CN1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 1328703251 PIMBRRRLUJINRS-CYBMUJFWSA-N 332.404 0.058 10 20 ECCD CCON(CC)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1330063630 AKQYGYFKYJJKNS-UHFFFAOYSA-N 335.404 0.939 10 20 ECCD Oc1cc(F)c(Cl)cc1CNCCn1cnc(-c2nn[nH]n2)n1 1607110340 AMOVBAPEGYNIMJ-UHFFFAOYSA-N 338.734 0.746 10 20 ECCD COCCOC[C@@H](O)CN1CCN(c2ccc(OC)c(F)c2)CC1 296864952 VOXGWSUPWSCCAY-HNNXBMFYSA-N 342.411 0.980 10 20 ECCD CC(=O)N[C@@H](CC(=O)NCCCSc1nccs1)C(N)=O 746020358 QIGPPPNFKXIOPT-VIFPVBQESA-N 330.435 0.122 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CN2CCCN1CC2 763997131 JSVYYUPRKJOOGW-SFHVURJKSA-N 344.459 0.529 10 20 ECCD Cc1ccc(C(=O)NCCCn2c(=O)ccn(C)c2=O)c(O)c1O 861366490 KKKXGYSIYVYSEB-UHFFFAOYSA-N 333.344 0.087 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2CCN(C(=O)C(N)=O)CC2)cc1 948084107 MDNUYQXQWCVUNP-UHFFFAOYSA-N 346.347 0.055 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](CO)OC(C)(C)C1 1117999294 RECSWSJLUYVESP-ZDUSSCGKSA-N 336.388 0.349 10 20 ECCD CS(=O)(=O)CCN(Cc1cc2c(cc1O)OC[C@H]2O)C1CC1 768462525 MKVFIRABEYLOBK-CQSZACIVSA-N 327.402 0.827 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NCCN3CCC3)cc2)CC1 889667053 YBVWGFSKWUJMHT-UHFFFAOYSA-N 331.464 0.943 10 20 ECCD Cn1ncc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 785919901 LIFCIJWIVDPTSX-ZDUSSCGKSA-N 342.403 0.447 10 20 ECCD 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CN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@@H](C(F)F)C1 1261892902 BXHGVAJNSZZHHB-GFCCVEGCSA-N 328.315 0.843 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NCCCCN 1348580170 IRGVLARFPSHKGT-AWEZNQCLSA-N 334.464 0.963 10 20 ECCD CN1CC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1351300596 GHEZBIFVEYYSNZ-INIZCTEOSA-N 328.416 0.499 10 20 ECCD CN(Cc1ccccc1O)C(=O)N[C@H]1CCCN(S(C)(=O)=O)C1 67644576 YHJOLFCRSBUFCH-ZDUSSCGKSA-N 341.433 0.958 10 20 ECCD O=C(CN1CC[C@@H](O)C1)NCc1ccc(N2CCOCC2)c(F)c1 114485957 ZDXMDIMBADXLAU-CQSZACIVSA-N 337.395 0.345 10 20 ECCD CN1C[C@@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1=O 73543077 BMYDEFCVXCGICF-HNNXBMFYSA-N 331.416 0.960 10 20 ECCD C[C@H](NC(=O)C(=O)N1CC(=O)N(C)C[C@H]1C)c1ccc(N(C)C)cc1 807675402 XEOBTTNTBVBXGB-OLZOCXBDSA-N 346.431 0.619 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)c2ccco2)c1 919812442 DZTBTLQRELRRPF-GFCCVEGCSA-N 340.357 0.820 10 20 ECCD CN1CC[C@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1=O 852134504 DQALHZXAEAPBSZ-INIZCTEOSA-N 346.431 0.678 10 20 ECCD COc1ccc(CNC[C@@H]2CN(C(=O)CNC(N)=O)C[C@H]2C)cc1C 1105809515 AANVCJTYBNOHGB-UKRRQHHQSA-N 348.447 0.856 10 20 ECCD C[C@H](NC(=O)N[C@@H]1COC[C@@H]1O)c1ccc(N2CCOCC2)cc1 875158516 POOSLFPWYUPXBX-MAZHCROVSA-N 335.404 0.643 10 20 ECCD O=C(OCC(=O)N1CCN(c2cnccn2)CC1)c1cc(O)cs1 783607726 JYMRWBLWENAIDC-UHFFFAOYSA-N 348.384 0.749 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)CCS(C)(=O)=O)N(C)C)cc1 891254694 IKHXVKUSBVXOGA-OAHLLOKOSA-N 341.477 0.906 10 20 ECCD C[C@@H](NC(=O)C(=O)NCCn1cccn1)c1ccc(N(C)C)cc1 793742727 BBQYMLOSPIOMHW-CYBMUJFWSA-N 329.404 0.943 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3c[nH]cc3C)C2)cc(OC)n1 996379823 XBXNWXYQUVQECN-UHFFFAOYSA-N 344.371 0.990 10 20 ECCD O=C(NCCC1=CCN(c2nccn3nnnc23)CC1)c1ccc[nH]1 1089813632 WWISQLALNLEZCS-UHFFFAOYSA-N 338.375 0.804 10 20 ECCD C[C@@H]1C(=O)N(C)CCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 1325391606 IGRRZYSQISLIOV-GFCCVEGCSA-N 332.404 0.058 10 20 ECCD CN1CCN(c2ccc(CN3CCN4C(=O)NC[C@@H]4C3)cc2F)CC1 1254040577 RYZXHOAFSBJFIC-OAHLLOKOSA-N 347.438 0.787 10 20 ECCD 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CN(C)c1ccc(CNC(=O)Cn2nnc(-c3ccncn3)n2)cc1 295366883 SAXLDBQFJAGJNK-UHFFFAOYSA-N 338.375 0.513 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OC[C@@H]2CNC(=O)O2)c1 801241652 MOUIPBRCCITJAN-QMMMGPOBSA-N 330.318 0.029 10 20 ECCD CC(C)N(C)CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 726195382 XRGIKYKLRHMZQL-UHFFFAOYSA-N 329.422 0.834 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3CCCCN3)ccc21 842150002 KYEAQLDLDMPUKY-INIZCTEOSA-N 344.459 0.944 10 20 ECCD COC[C@@H]1CN(C(=O)C(=O)NCCc2ccc(N)cc2)C[C@H](C)O1 842234733 AYOFPMMIFGAHNN-WFASDCNBSA-N 335.404 0.190 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC[C@@H]1CNCCO1 851666532 IIRBTZAEZCKSID-KRWDZBQOSA-N 348.447 0.435 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCCN(C)C1=O 1119134685 AJUKNDDSOCKLOT-OAHLLOKOSA-N 346.431 0.414 10 20 ECCD CNCc1cn(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1 881023219 IWZRCGCFFRYZGT-UHFFFAOYSA-N 344.419 0.355 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCOC(=O)N2)N(C)C)cc1 891248484 NFZXBQJXRCFDAU-LSDHHAIUSA-N 334.420 0.970 10 20 ECCD COc1ccc(CN[C@@H]2CCN(C(=O)c3nnn(C)n3)C2)cc1C 969624525 BIDXYEIDZKOLIP-CYBMUJFWSA-N 330.392 0.531 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cnsn3)C2)cc(OC)n1 996369173 SEMOMEIVSKTSJM-UHFFFAOYSA-N 349.372 0.205 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCNC(=O)C1CC1 1322155543 JGSBLKZAXMAWSA-UHFFFAOYSA-N 346.431 0.320 10 20 ECCD CCO[C@@H]1C[C@H](NC(=O)C(=O)NCCc2ccc(N)cc2)[C@H]1OC 1325414962 ZFYCEMMBJCMOJT-RRFJBIMHSA-N 335.404 0.236 10 20 ECCD CN(C)C(=O)Cn1cc(C(=O)NCc2ccc(N(C)C)cc2)nn1 56967979 LRVAYNYMGVNQFG-UHFFFAOYSA-N 330.392 0.362 10 20 ECCD CN(C)c1ccc(CN2CCS(=O)(=O)C[C@H]2CC(=O)O)cc1 316578298 LZWHKMFOSQFUGT-CQSZACIVSA-N 326.418 0.826 10 20 ECCD COC(=O)C[C@@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 267284348 IOVMZFULDVAFJM-MRVPVSSYSA-N 330.362 0.445 10 20 ECCD COCCN(Cc1ccc([N+](=O)[O-])c(OC)c1O)[C@H](C)C(N)=O 278283981 TYLKEOJTPZTIMN-SECBINFHSA-N 327.337 0.631 10 20 ECCD CN1CCCc2cc(CNC(=O)CCNC(=O)[C@H]3CCCN3)ccc21 827913932 SUJPWFQTRCARQD-MRXNPFEDSA-N 344.459 0.944 10 20 ECCD CN1CCCc2cc(CNC(=O)[C@@H](N)CCS(C)(=O)=O)ccc21 827914131 YETVYIXXOMWAIX-AWEZNQCLSA-N 339.461 0.447 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cn(C)c(=O)n(C)c1=O 735030880 OLDXREZFQHVQIA-UHFFFAOYSA-N 330.388 0.422 10 20 ECCD C[C@H]1CC(=O)NCCN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 839299625 DPPOUDRIXRBKTP-ZDUSSCGKSA-N 346.431 0.448 10 20 ECCD CC(C)(CNC(=O)C(=O)NCCc1ccc(N)cc1)N1CCOCC1 842024776 SCCRDOVIFBJFJQ-UHFFFAOYSA-N 348.447 0.155 10 20 ECCD CN(C[C@@H]1CCOC1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 749541468 CDGVRZNWHZOGGN-JTQLQIEISA-N 328.390 0.872 10 20 ECCD Cc1cc(N(C)C)ccc1CN1CCN(C(=O)Cn2cnnn2)CC1 840946069 HSYAHXZLDHUXAA-UHFFFAOYSA-N 343.435 0.392 10 20 ECCD CC(C)[C@@](C)(O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 743713330 GXIDUNPQIQZCRK-AWEZNQCLSA-N 330.406 0.901 10 20 ECCD CC(C)CN1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)CC1=O 842236190 MTWAWPKCAJINMY-UHFFFAOYSA-N 346.431 0.254 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)Nc2nnn(C)n2)N(C)C)cc1 932251051 JBCDMHYQEXEBPI-CYBMUJFWSA-N 332.412 0.701 10 20 ECCD CN(C)C(=O)CN1CC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1039060561 LHUKFTBJMAHBSP-CYBMUJFWSA-N 346.391 0.741 10 20 ECCD COc1ccc(N2CCN(c3ccc(C(N)=O)nn3)CC2)c(OC)c1 866137553 PAIRBSTUANYQFE-UHFFFAOYSA-N 343.387 0.919 10 20 ECCD CC[C@@]1(O)CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 779336470 RCLIQYGKUXWCJP-CQSZACIVSA-N 328.390 0.751 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)NC[C@H](C)OC)C2)cc1 1118718762 PNEDISPZTWMBAH-UONOGXRCSA-N 349.431 0.789 10 20 ECCD C[C@H](NC(N)=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 773788189 AIXPXYIACGYGIL-AAEUAGOBSA-N 347.419 0.061 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](C)CO)CC2)cc1 778233773 HUUHFDOXAUNWOM-WBTMPAOCSA-N 347.415 0.397 10 20 ECCD C[C@@H](CS(C)(=O)=O)NCc1ccc(N2CCN(C)CC2)cc1 883289554 SFXXONNOTGUDPZ-AWEZNQCLSA-N 325.478 0.961 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NCC(=O)NC3CC3)cc2)CC1 883079022 IASYDMJHLKLERT-UHFFFAOYSA-N 345.447 0.516 10 20 ECCD C[C@@H](O)CCc1cn(CC(=O)NCc2ccc(N(C)C)cc2)nn1 881094901 WRBYOHWEEJWFPF-CYBMUJFWSA-N 331.420 0.974 10 20 ECCD COc1ccc(CN(CCN(C)C)CC(=O)N(C)C)c(O)c1OC 895368496 JGZVNRFPTWFGIA-UHFFFAOYSA-N 339.436 0.861 10 20 ECCD COc1ccc(CN[C@@H]2CCCN(C(=O)CNC(N)=O)C2)cc1C 1207266079 FXQPLYLUMGSIBY-CQSZACIVSA-N 334.420 0.753 10 20 ECCD NC(=O)[C@H]1CC[C@@H]1C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089854976 BGZKLWPQAYFAAH-STQMWFEESA-N 347.394 0.770 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1C[C@@H]2CCCCN2C1=O 1325637737 IPYXSPUVFVFXJD-KBPBESRZSA-N 345.399 0.620 10 20 ECCD CC(C)(O)C1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1324296798 GKSXUYAJNJJULJ-UHFFFAOYSA-N 328.390 0.607 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1CCCC1 1332456006 OLJJTNSQHNNJTH-ZDUSSCGKSA-N 336.388 0.784 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N(C)Cc1cn(C)nn1 1261610774 ZOVFGWCTGBOFQQ-UHFFFAOYSA-N 345.403 0.918 10 20 ECCD CCOCCOCCN(C)C(=O)C(=O)N(C)Cc1ccccc1O 1261313544 YBKBZAMIXUDTFN-UHFFFAOYSA-N 338.404 0.862 10 20 ECCD CNC(=O)CN(C)CCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1755047924 UPVGOUGEIVZSDH-UHFFFAOYSA-N 348.407 0.989 10 20 ECCD CCCNC(=O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 55129943 QIPDFPFCNPMSCB-UHFFFAOYSA-N 329.378 0.020 10 20 ECCD CCN(CC(N)=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 191707337 IQVWUCIDBIVDRD-UHFFFAOYSA-N 334.420 0.151 10 20 ECCD CCS(=O)(=O)NCCN1CCN(c2ccc(OC)c(F)c2)CC1 84866946 HVEBNPUPEZMZMT-UHFFFAOYSA-N 345.440 0.896 10 20 ECCD Cc1ccc(C(=O)N2CCCC[C@H]2CNS(C)(=O)=O)c(O)c1O 272817367 ODWLTZSIVWUMNP-NSHDSACASA-N 342.417 0.950 10 20 ECCD COc1cc(O)c(CN(C)C[C@@H](O)CN2CCOCC2)cc1OC 271797141 KDLJOIYBHCFLJP-CQSZACIVSA-N 340.420 0.534 10 20 ECCD O=C1CN(Cc2ccccc2O)C(=O)N1CCn1cc([N+](=O)[O-])cn1 819171449 XAYYVWCSDSHNGD-UHFFFAOYSA-N 345.315 0.961 10 20 ECCD CONC(=O)CNC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 922951577 YKWPHDHYRZLUIB-LBPRGKRZSA-N 336.392 0.498 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)C(C)(C)C(N)=O)cc2)CC1 768262200 ZAXQWCCLZFVVKY-UHFFFAOYSA-N 346.431 0.483 10 20 ECCD CN(C)S(=O)(=O)c1cc(C(=O)NCc2ccc(O)c(O)c2)co1 778925319 JTPWITAAYNDBCJ-UHFFFAOYSA-N 340.357 0.871 10 20 ECCD CC(=O)N[C@H](C)C(=O)NCCC1=CCN(c2ccc(C)nn2)CC1 1089799700 NFOUQCPYSFPARQ-CYBMUJFWSA-N 331.420 0.952 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)Cn3ncnn3)CC2)ncn1 1089845249 QNAMBENTTNFAEZ-UHFFFAOYSA-N 328.380 0.115 10 20 ECCD COCCN1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@@H](O)C1 1090830377 MCXSZSFGUXNSHB-KGLIPLIRSA-N 349.391 0.660 10 20 ECCD O=C(NCCO)C1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 1329546563 WOYJCGPXBOOPOA-RQOWECAXSA-N 334.372 0.458 10 20 ECCD CC(=O)N1CCN(c2ccc(CNCCS(C)(=O)=O)cc2)CC1 1338536104 QNWBWXMTXVUPLI-UHFFFAOYSA-N 339.461 0.489 10 20 ECCD COC[C@H](O)CN1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1567819815 OKAVQRRKLUMWIQ-CYBMUJFWSA-N 335.364 0.270 10 20 ECCD CCn1ncnc1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 807097303 MJYMFIODTSUARE-UHFFFAOYSA-N 344.419 0.605 10 20 ECCD Nc1nc(N)nc(CN(CC(=O)O)Cc2cc(Cl)ccc2O)n1 833090841 FRVJKJJAMYARJT-UHFFFAOYSA-N 338.755 0.482 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC[C@@H]1N 842150219 OTDXOJHPWMFXJD-CJNGLKHVSA-N 344.459 0.881 10 20 ECCD N=C1NC(=O)[C@H](CC(=O)NCc2ccc(N3CCOCC3)cc2)S1 742572897 GYVYDZUOMNKCMM-ZDUSSCGKSA-N 348.428 0.696 10 20 ECCD COCC(=O)N1CCC[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 949700113 VKRMOMCTLKTQAP-LBPRGKRZSA-N 337.376 0.466 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CN(CCCO)C[C@@H]2O)cc1 958732509 NYWUVVIJKRFLLN-OCCSQVGLSA-N 349.391 0.254 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CC(NC(=O)c3cnon3)C2)cc1 998237167 UJEDDTJCRXRPOP-UHFFFAOYSA-N 343.303 0.486 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@H]3CNC(=O)N3)CC2)n1 1089860409 DPLKCZYNDPYXNC-CYBMUJFWSA-N 330.392 0.109 10 20 ECCD O=C(C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)C1CC1 1843248740 JJIHODGNPDEUGD-UHFFFAOYSA-N 345.355 0.289 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CSCN1 165415971 WNCXXHBUZGYEJQ-ZDUSSCGKSA-N 325.409 0.941 10 20 ECCD COCc1nn(CC(=O)N(C)Cc2ccc(N(C)C)cc2)c(=O)o1 179915306 CGRABUHZPFVJDH-UHFFFAOYSA-N 334.376 0.707 10 20 ECCD NC(=O)[C@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 51687584 SUHLFEMPPSPHNZ-OAHLLOKOSA-N 332.404 0.683 10 20 ECCD CC(=O)C(=O)COC(=O)c1cccc(S(=O)(=O)NC2CC2)c1 808491244 VIVIGKCYQYTPNM-UHFFFAOYSA-N 325.342 0.442 10 20 ECCD C[C@@H]1C[C@H](C(=O)O)CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 817887935 HIJDSXVCYXTZAD-OCCSQVGLSA-N 347.415 0.938 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)C3(C)CNC3)CC2)cc1 829500960 VGBQLHCESQLZHH-UHFFFAOYSA-N 332.448 0.543 10 20 ECCD CC(C)(O)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 731119733 MPESCGNUWUOXJR-CQSZACIVSA-N 348.447 0.958 10 20 ECCD CCN(CCN)C(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 911578108 ICDQKULFWSFEHI-MRXNPFEDSA-N 349.479 0.279 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCC[C@@H](C(=O)NCCN)C2)cc1 841656047 VBRXQCWZVGVHJU-OAHLLOKOSA-N 347.463 0.749 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CC[C@@H]3C(N)=O)CC2)cc1F 847557023 NWFGTIFLLHKRPT-QWHCGFSZSA-N 335.379 0.994 10 20 ECCD Nc1ccc(CC(=O)N2CCN(C(=O)c3ccc(O)nc3)CC2)cc1 1118200137 AGZUNAPRSJOULC-UHFFFAOYSA-N 340.383 0.897 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(C(=O)c3cnco3)C2)cc(OC)n1 941654349 XLDBKNWUCYUTHB-LLVKDONJSA-N 346.343 0.731 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)CO)CC2)cc1 778233772 HUUHFDOXAUNWOM-NPQIQWPPSA-N 347.415 0.397 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N2CC[C@@H]3NC(=O)CC[C@H]3C2)cc1 1118485558 BPKBGBCEDPTRTN-ZFWWWQNUSA-N 344.415 0.055 10 20 ECCD C[C@H](NC(=O)NCc1ccc(N2CCN(C)CC2)cc1)C(=O)N(C)C 883138242 XEAUGTJGGYHJDH-AWEZNQCLSA-N 347.463 0.714 10 20 ECCD CCN(C)C(=O)CNCCNC(=O)c1ccc(N=NC(N)=O)cc1 1153047653 JMBCHQNVJMMEFI-UHFFFAOYSA-N 334.380 0.647 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@@](C)(O)C3)ccc21 1321936022 YHAKIGKWVNDQKU-GOSISDBHSA-N 331.416 0.669 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)C34CC(CN3)C4)cc2)CC1 1341081275 RMFAKXLXFHMCNH-UHFFFAOYSA-N 342.443 0.723 10 20 ECCD C[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)C1CNC1 1575070318 XTPIWWBWXHTTFM-CYBMUJFWSA-N 344.459 0.860 10 20 ECCD C[C@H](Nc1c(-c2nn[nH]n2)c(=O)n(C)c(=O)n1C)c1ccccc1O 1580441584 PVOKJMHSENXQPW-QMMMGPOBSA-N 343.347 0.143 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC3(CCOC3)C2)c1 294572655 VZGKILCVZMRBPS-UHFFFAOYSA-N 326.374 0.626 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CCCCN1 842226639 JXRWQWGZSZWJNF-OAHLLOKOSA-N 332.448 0.969 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NC[C@@H]1CCCN1 842070939 VKNQEQVQJJUSDT-HOCLYGCPSA-N 346.475 0.976 10 20 ECCD CCOC(=O)[C@@H]1NCC[C@H]1NCc1ccc(N2CCN(C)CC2)cc1 925764463 ZCHOXRDEUSNXRE-QZTJIDSGSA-N 346.475 0.822 10 20 ECCD COc1ccc(N2CCN(c3cc(=O)n(C)c(=O)n3C)CC2)cc1F 853436074 QWJKQGMKVYMVID-UHFFFAOYSA-N 348.378 0.558 10 20 ECCD COCC(=O)N1CCC(NC(=O)c2cc(OC)nc(OC)c2)CC1 943542337 PDBJVIJCMIMBLJ-UHFFFAOYSA-N 337.376 0.466 10 20 ECCD C[C@H](C(=O)N1CCCC1)N1CCN(C(=O)c2cccc(O)c2O)CC1 776668379 BAZOTQHVBNFJTL-CYBMUJFWSA-N 347.415 0.867 10 20 ECCD Cn1ncc(C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)n1 1089835059 QXTYDJMXABCUCQ-UHFFFAOYSA-N 331.355 0.701 10 20 ECCD O=C(O)c1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)[nH]n1 1574574401 QLRHOVJXGNIBCK-UHFFFAOYSA-N 344.371 0.999 10 20 ECCD CN(C)c1ccc(CNC(=O)NC[C@H]2CC[C@H](C(N)=O)O2)cc1F 126146311 XGCBMZANXREWTD-BXUZGUMPSA-N 338.383 0.724 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3nccn3C)nc12 124664205 MWCWKUADFVQYGD-UHFFFAOYSA-N 344.375 0.977 10 20 ECCD CN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1c(O)cccc1Cl 271116779 FSSHAECGPOPLIF-SNVBAGLBSA-N 346.836 0.781 10 20 ECCD O=C(CN1CCN(C(=O)c2cccc(O)c2O)CC1)N1CCCCC1 274914198 VNMMPOUXAXQOND-UHFFFAOYSA-N 347.415 0.868 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3CCCO3)ccc21 283229572 KNNZZRZOTMYPKY-HNNXBMFYSA-N 331.416 0.980 10 20 ECCD CCNS(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)C(C)=O)c1 808487343 HAFWFSCSVCKQSX-UHFFFAOYSA-N 327.358 0.608 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CC(=O)N(C)C1 819693875 WAVCLRZTJKOJQY-ZDUSSCGKSA-N 334.372 0.762 10 20 ECCD COc1ccc(O)c(CNC(=O)Nc2nn(C)cc2-c2nn[nH]n2)c1 821838819 PTKGEIWLFHSIGJ-UHFFFAOYSA-N 344.335 0.636 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H](O)C3CC3)CC2)cc1 824285672 SQCCHDQCXPTBHS-QGZVFWFLSA-N 333.432 0.704 10 20 ECCD CCCN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 826707762 XNTRZXJEQPHHCQ-OAHLLOKOSA-N 332.448 0.969 10 20 ECCD CC(C)NC(=O)C(=O)N1CCN(C(=O)c2cc(O)cs2)CC1 732258733 GQAPUIBNVIOYHV-UHFFFAOYSA-N 325.390 0.263 10 20 ECCD C[C@@H](C[C@@H](C)N)NC(=O)C(=O)NCCCSc1nccs1 843258774 CKGBXRHQVMYHQZ-ZJUUUORDSA-N 330.479 0.984 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Cc3cc[nH]n3)cc2)C1 743316238 PDSRGYYDDUJSEZ-CQSZACIVSA-N 341.415 0.970 10 20 ECCD C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)C(=O)Nc1ccc(N)cc1 841112312 JVKQHVQAIRYLPO-GFCCVEGCSA-N 334.420 0.511 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CC[C@H](CN)C1 842152268 FRUGOZUGRGMGMA-DZGCQCFKSA-N 332.448 0.921 10 20 ECCD C[C@H](O)[C@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 747616970 MQCVIABOUPEMDK-QWRGUYRKSA-N 342.417 0.997 10 20 ECCD CC(=O)N[C@@H](C)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 748123084 VYNNMDJUSWGKOS-LBPRGKRZSA-N 335.404 0.779 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H](O)C3CC3)cc2)CC1 924253722 JSBKCZOPHGFZHV-INIZCTEOSA-N 331.416 0.775 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)c3ncnn3C)cc2)CC1 853803743 HIGRDIQQLHYKQO-UHFFFAOYSA-N 342.403 0.414 10 20 ECCD CCc1nn(C)cc1NC(=O)C(=O)NCc1cc(OC)ccc1O 774248472 SGLZGXFIVBABSJ-UHFFFAOYSA-N 332.360 0.952 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CO)CC2CC2)c1 771000526 RGIJNGCNCILYMT-NSHDSACASA-N 328.390 0.655 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CN(CCCO)C[C@@H]2O)cc1 958732508 NYWUVVIJKRFLLN-JSGCOSHPSA-N 349.391 0.254 10 20 ECCD CN(C)C(=O)CN1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 957849757 SZIAUIYBZKEPNZ-UHFFFAOYSA-N 346.391 0.695 10 20 ECCD COCCN1CC[C@@H](NC(=O)C(=O)N(C)Cc2ccccc2O)C1 1326490130 DPMIOHBDISMNSB-CQSZACIVSA-N 335.404 0.188 10 20 ECCD CN(C)C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 1322811100 KBLJVHPOXLHQKZ-HNNXBMFYSA-N 332.448 0.779 10 20 ECCD COC(=O)[C@@H]1C[C@H](O)CN1Cc1ccc(N2CCC(O)CC2)cc1 1333000259 MYQDOJPIUIZASP-IRXDYDNUSA-N 334.416 0.756 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1([S@@](C)=O)CCNCC1 1576053058 SBSICECAIOYGHM-BSNNYGBQSA-N 340.445 0.646 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)C(=O)NC3CC3)cc2F)CC1 115374016 CUSXYTIRPRKKME-UHFFFAOYSA-N 348.422 0.862 10 20 ECCD Cn1cc(/C=C2\SC(NC3CCCCC3)=NC2=O)c(=O)n(C)c1=O 25251667 YJKHBJPMEZAXRW-WQLSENKSSA-N 348.428 0.977 10 20 ECCD COc1ccc(N2CCC(NC(=O)CN3CCNCC3=O)CC2)cc1 237257519 VDCWYFYZINWJLY-UHFFFAOYSA-N 346.431 0.212 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3nncn3C)nc12 286725147 GPMQVDONVAGXGQ-UHFFFAOYSA-N 345.363 0.372 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H](CO)NC(=O)C(C)C)CC2)cc1 291493675 TZMBTWCJSBWMBX-INIZCTEOSA-N 349.431 0.477 10 20 ECCD O=C(NCc1ccccc1O)NC1CCC2(CC1)NC(=O)NC2=O 806643791 NRNMHUAWWQAMGS-UHFFFAOYSA-N 332.360 0.712 10 20 ECCD CNS(=O)(=O)NC1CCN(Cc2c(O)cccc2OC)CC1 811499872 QFSYDTGOYRANQZ-UHFFFAOYSA-N 329.422 0.419 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCOCCN1 827967731 HFEHGMLIAKFHRC-UHFFFAOYSA-N 338.383 0.709 10 20 ECCD COc1ccc(O)c(CNC(=O)c2cn(CC(=O)N(C)C)nn2)c1 734016370 MWASPPWIOFLPOP-UHFFFAOYSA-N 333.348 0.011 10 20 ECCD C[C@@H](NC(=O)C(=O)N1C[C@@H]2CNC[C@@H]2C1)c1ccc(N(C)C)cc1 842202193 FIMIJGHMEWWNHK-YUELXQCFSA-N 330.432 0.608 10 20 ECCD NC1(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 911249294 HVYKIWUMZVWCRX-UHFFFAOYSA-N 348.472 0.464 10 20 ECCD CC(C)N1CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)CC1 842241583 FMSKQGVNPZNEND-UHFFFAOYSA-N 332.448 0.870 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N2CCSC[C@@H]2CCO)cc1 842238786 YNNITUBSYPBRCV-AWEZNQCLSA-N 337.445 0.254 10 20 ECCD COc1cccc(CNC(=O)C2=C(C)N(C)c3nnnn3[C@@H]2C)c1O 847590533 ZXDVKYQJJAXJSQ-SNVBAGLBSA-N 344.375 0.989 10 20 ECCD C[C@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)N(C)C 874111786 WQJZMZSWZSXZKM-UKRRQHHQSA-N 332.448 0.955 10 20 ECCD Cc1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)ncn1 785422567 NAMXWIIZRKDLQW-UHFFFAOYSA-N 327.388 0.784 10 20 ECCD Cn1nnc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)n1 794789384 BJPJIKXLLTWENE-UHFFFAOYSA-N 336.739 0.534 10 20 ECCD O=C1NC[C@@H](C(=O)NCCC2=CCN(c3cccc(F)n3)CC2)N1 1089860828 MOKQTIOZXGRNEW-LBPRGKRZSA-N 333.367 0.545 10 20 ECCD Cc1ncc(C)c(N2CC=C(CCNC(=O)[C@H]3CNC(=O)N3)CC2)n1 1089860763 LJNJVAVOUHOSEY-CQSZACIVSA-N 344.419 0.418 10 20 ECCD CNC[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1326163908 ANJUYMBTNXTLGG-CQSZACIVSA-N 330.432 0.651 10 20 ECCD COc1ccc(CNS(=O)(=O)c2n[nH]c(C)c2C(=O)O)c(O)c1 1599573059 JTGJTYNXFVZOCF-UHFFFAOYSA-N 341.345 0.609 10 20 ECCD CC(C)(C)OC(=O)N1CC(O)(CNC(=O)c2cccc(O)c2O)C1 839752493 KTVQTHSYOJAJQU-UHFFFAOYSA-N 338.360 0.809 10 20 ECCD CCS(=O)(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 188128588 MJNUEANECVQDCI-UHFFFAOYSA-N 325.434 0.794 10 20 ECCD Cn1cc(/C=C2\SC(N3CCCCC3)=NC2=O)c(=O)n(C)c1=O 255885647 ILDXTGGGJKBHDL-FLIBITNWSA-N 334.401 0.540 10 20 ECCD CNC(=O)N1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 267079261 QKHSJCMFISEXJF-UHFFFAOYSA-N 333.436 0.326 10 20 ECCD CCNC(=O)NC(=O)CN(CC(=O)OCC)Cc1ccccc1O 823581954 UYBKNJOUYDRJKB-UHFFFAOYSA-N 337.376 0.603 10 20 ECCD CNC[C@@H](C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 827468596 ARVZNVNTRADACD-HIFRSBDPSA-N 332.448 0.860 10 20 ECCD C[C@@H](NC(=O)NC[C@@H]1CC(C(N)=O)=NO1)c1ccc(N(C)C)cc1 838560143 SKXVONNAIZWKME-MFKMUULPSA-N 333.392 0.743 10 20 ECCD O=C(NCc1ccccc1O)N[C@@H]1CCN(CCN2CCOCC2)C1 734663472 NMQSBSUBNYEXIV-MRXNPFEDSA-N 348.447 0.598 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CNCCCO1 842154507 ULSNDBTUHTZFQR-MRXNPFEDSA-N 348.447 0.172 10 20 ECCD CN(C)c1ccc([C@@H](N)CNS(=O)(=O)N2CCCOCC2)cc1 846231837 QNXZRSSNHDGUGF-HNNXBMFYSA-N 342.465 0.309 10 20 ECCD CN(C)c1ccc([C@@H](N)CNS(=O)(=O)C[C@@H]2CCCO2)cc1 842784425 JOKXDRQAWXNWQN-GJZGRUSLSA-N 327.450 0.851 10 20 ECCD CNC(=O)[C@H](C)N1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1016367055 HWQVCMIPYXMTAZ-GWCFXTLKSA-N 346.391 0.788 10 20 ECCD COC(=O)NCC(=O)N1CCN(c2ccc(OC)cc2OC)CC1 870163909 JFBZLJLRKLDYSE-UHFFFAOYSA-N 337.376 0.708 10 20 ECCD COc1ccc(O)c([C@@H](C)NCC(=O)N[C@H]2CCS(=O)(=O)C2)c1 1116471085 XTTPIFGQDVHYKA-MNOVXSKESA-N 342.417 0.355 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(CCO)C3)cc(OC)n1 1047104212 PCZQPVYNBLSCAO-UBHSHLNASA-N 335.404 0.674 10 20 ECCD CC[S@@](=O)CCNC(=O)CN(CC(=O)O)c1ccc(OC)cc1 872929952 QHFNYQPOLZMONG-HSZRJFAPSA-N 342.417 0.471 10 20 ECCD COc1ccc(CNCCNC(=O)c2cc(C(N)=O)cn2C)cc1C 1130893778 LQNNOYARFVOJCT-UHFFFAOYSA-N 344.415 0.961 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@@H]3CCNC(=O)C3)CC2)nn1 1089821077 QZIIDAKJFJIAJZ-OAHLLOKOSA-N 343.431 0.954 10 20 ECCD O=C1NCCC[C@@H]1C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089848217 AZMHDJLWLYKUCQ-ZDUSSCGKSA-N 347.394 0.785 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3ocnc3C)C2)cc(OC)n1 996369177 SESCYHOIZRXXER-UHFFFAOYSA-N 346.343 0.650 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3CN(C)CCO3)CC2)ncn1 1089817846 WNDFHMDDTVMNBT-INIZCTEOSA-N 345.447 0.758 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCN(CCO)C[C@@H]2O)cc1 1090829675 DJXJRIGVPRSANP-OLZOCXBDSA-N 335.364 0.006 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@@](F)(CO)C1 1346590460 HARXOTXFJLFEGX-SFHVURJKSA-N 347.390 0.612 10 20 ECCD CCOCC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1842692680 FCSMUZHIJHCCNN-UHFFFAOYSA-N 335.360 0.346 10 20 ECCD CCS(=O)(=O)NCCNC(=O)N(C)Cc1ccc(N(C)C)cc1 119597794 ZCIJQNYPGUKWFA-UHFFFAOYSA-N 342.465 0.833 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)NCC1(O)CCOCC1 264110818 SSMWMXZVUYXDLB-UHFFFAOYSA-N 349.431 0.864 10 20 ECCD CN(C)[C@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 264457684 PBESNOXDCYCEFH-LBPRGKRZSA-N 341.433 0.930 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCc2nccn2C)cc1F 803663302 MOEREPOAUQGTET-UHFFFAOYSA-N 333.367 0.558 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)C[C@@H](O)C1CC1 807099649 BQQPXEFVLVQLGX-MRXNPFEDSA-N 333.432 0.907 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCC(=O)N3)cc2)C1 729842342 VCQGBKIOQJPKJM-UKRRQHHQSA-N 344.415 0.283 10 20 ECCD CC(C)(C)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)O 833422236 BOUNVGRQTDOZER-LLVKDONJSA-N 344.389 0.993 10 20 ECCD CCN(C(=O)COC(=O)c1cc(O)cs1)[C@H]1CCS(=O)(=O)C1 731910206 OMJJFKYPNQNVDE-VIFPVBQESA-N 347.414 0.646 10 20 ECCD C[C@@H](OC(=O)c1cc(O)cs1)C(=O)N(C)[C@H]1CCS(=O)(=O)C1 732354279 IXOBODUNCJGHGR-BDAKNGLRSA-N 347.414 0.645 10 20 ECCD COc1cc(C(=O)N[C@H]2CCCN([C@H]3CCNC3=O)C2)cc(OC)n1 1007790661 HINGURCWCLQMJP-STQMWFEESA-N 348.403 0.182 10 20 ECCD COC(=O)CCN(C)S(=O)(=O)NCc1ccc(N(C)C)cc1C 749290549 GNODFEOGXNCDIY-UHFFFAOYSA-N 343.449 0.890 10 20 ECCD C[C@@H](N)CNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 841915118 MBMFSAPNDNGNEE-SNVBAGLBSA-N 328.363 0.948 10 20 ECCD CCC1(CC)NC(=O)N(CC(=O)NCc2ccc(O)c(O)c2)C1=O 778916301 CCGKBQYBGRJNDI-UHFFFAOYSA-N 335.360 0.825 10 20 ECCD COC(=O)CNC(=O)CNCc1c(O)cccc1Br 877706925 UQBMTIFVGFALSY-UHFFFAOYSA-N 331.166 0.534 10 20 ECCD C[C@@H](O)[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 774188482 NDVVIBRYSGGTJN-GHMZBOCLSA-N 343.474 0.971 10 20 ECCD Nc1ccc(CNC(=O)N[C@@H]2CCN(C3CCOCC3)C2=O)cc1 1120521423 KWYSKSQNOGQFDV-OAHLLOKOSA-N 332.404 0.848 10 20 ECCD COc1ccc(O)c(CNC(=O)c2cn(Cc3noc(C)n3)nn2)c1 787451675 YAAXQGCZYSVAHG-UHFFFAOYSA-N 344.331 0.662 10 20 ECCD CN(C)c1ccc([C@H](CNCc2cn(CC(N)=O)nn2)N(C)C)cc1 898449275 AIJHJJDIQARNSM-INIZCTEOSA-N 345.451 0.222 10 20 ECCD CNS(=O)(=O)CCNC(=O)NCCCSc1nccs1 784558671 YIENWKHRBORTIG-UHFFFAOYSA-N 338.480 0.474 10 20 ECCD COc1ccc(CN[C@H]2CN(C(=O)Cn3cnnn3)C[C@H]2C)cc1C 1054373337 FESMICXHFASBNV-HIFRSBDPSA-N 344.419 0.627 10 20 ECCD COCCOCCNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 789913429 FFQDQMVKXMCNKC-UHFFFAOYSA-N 337.420 0.456 10 20 ECCD COc1ccc(CN[C@H](C)[C@H]2CN(C(=O)C(N)=O)CCO2)cc1C 979352291 BKPBTZDNQGMPRG-IUODEOHRSA-N 335.404 0.194 10 20 ECCD COc1ccc(-n2c(C)cc(C(=O)NC[C@H](O)C(N)=O)c2C)cc1 791254976 OIAFAPGYPDVFQC-HNNXBMFYSA-N 331.372 0.679 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCC(C)(C)N1CCOCC1 1321391055 GJKCMWAPYQXGMM-UHFFFAOYSA-N 349.431 0.578 10 20 ECCD C[C@H](NC(=O)C(=O)NC[C@]1(C)CCC(=O)N1)c1ccc(N(C)C)cc1 1331652861 ZTEIBAJQFJHYRD-SGTLLEGYSA-N 346.431 0.715 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ncccn1 1332099434 MIRPHAHHWBXFMX-NSHDSACASA-N 331.328 0.792 10 20 ECCD CC1(C)NC(=O)N(CCCNC(=O)/C=C\c2ccc(O)c(O)c2)C1=O 1349658178 NGFQESNFJXGICH-ALCCZGGFSA-N 347.371 0.948 10 20 ECCD CCN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H](C)C(=O)O 1603715497 NOLQOKBSUIYJOV-QMMMGPOBSA-N 330.362 0.699 10 20 ECCD COc1ccc(CNCCC(=O)NCCC(=O)O)c(O)c1OC 1599572023 ZREZCYRKTFXRIS-UHFFFAOYSA-N 326.349 0.480 10 20 ECCD Cn1cc(N2CC[C@H](NC(=O)c3c(F)ccc(O)c3O)C2=O)cn1 276582931 LTYSZEAOICNOJD-JTQLQIEISA-N 334.307 0.506 10 20 ECCD CN(C)c1ccc(CNC(=O)CN(C)C2(CO)CCOCC2)cc1 298627281 VLTBAQXUCKYSKV-UHFFFAOYSA-N 335.448 0.842 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@](C)(CN)C1 817918045 GQQRAENUNVLFFY-GOSISDBHSA-N 332.448 0.908 10 20 ECCD C[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H](C)N 827389526 MOKWECOGHGUBPP-QWHCGFSZSA-N 339.461 0.521 10 20 ECCD CN(C)S(=O)(=O)NCCNCc1c(O)ccc(Cl)c1F 839090024 GYGWNOBBZJKKIJ-UHFFFAOYSA-N 325.793 0.670 10 20 ECCD CN[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 842094674 ZZEWKVQHYMUXOV-SNVBAGLBSA-N 328.463 0.562 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@]3(CCNC3)C2)cc1F 842149396 YACDHDXQCAADIB-GOSISDBHSA-N 348.422 0.720 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CC(C)(OC)C3)CC2)cc1 759046876 CZTXHJISQMZXFP-KRWDZBQOSA-N 349.475 0.899 10 20 ECCD COc1ccc(-n2nnnc2CN(C)C[C@H]2CCN(C(C)=O)C2)cc1 1029616424 LMOQLVDMPOPMDT-CQSZACIVSA-N 344.419 0.971 10 20 ECCD CCCCS(=O)(=O)NCC(=O)NCCc1ccc(O)c(O)c1 767786818 PRAKVWVWVYGSAY-UHFFFAOYSA-N 330.406 0.476 10 20 ECCD COc1cc(C(=O)NC2CN(Cc3nccc(C)n3)C2)cc(OC)n1 1030611947 AYZQYOBWFWKFKY-UHFFFAOYSA-N 343.387 0.811 10 20 ECCD COC(=O)Cc1cn(CC(=O)N(C)Cc2ccc(N(C)C)cc2)nn1 881083818 JFPDOFAPOHRWHT-UHFFFAOYSA-N 345.403 0.718 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3cnn(C)c3N)cc2)CC1 881852070 HAOXXILLTVNHMS-UHFFFAOYSA-N 328.420 0.684 10 20 ECCD CCn1[nH]nnc1=NC(=O)NCc1ccc(N2CCOCC2)cc1 888341696 ODBZIVKENKMRKN-UHFFFAOYSA-N 331.380 0.273 10 20 ECCD COc1ccc(CN2CCCN(S(C)(=O)=O)CC2)c(O)c1OC 891554845 BQNFJCCPICNGBO-UHFFFAOYSA-N 344.433 0.877 10 20 ECCD NS(=O)(=O)[C@@H]1CCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 785986639 VYGOYNYOUQAXGV-CYBMUJFWSA-N 343.424 0.525 10 20 ECCD CC(=O)N[C@@H](C)C(=O)NCCC1=CCN(c2ccnc(C)n2)CC1 1089800144 XNSKLEZFABOPHK-LBPRGKRZSA-N 331.420 0.952 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3NC[C@@H]4C[C@@H]43)cc2)CC1 1332237637 KWBHAEBNCYWCPN-RYQLBKOJSA-N 342.443 0.579 10 20 ECCD C[C@H](NC(=O)C(=O)NC[C@@]1(C)CCC(=O)N1)c1ccc(N(C)C)cc1 1331652858 ZTEIBAJQFJHYRD-KPZWWZAWSA-N 346.431 0.715 10 20 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10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)Cn2ncn3nccc3c2=O)c1 1318448733 SXLPNXRAGOATDU-SNVBAGLBSA-N 343.343 0.483 10 20 ECCD Cc1nc2n(n1)C[C@H](NC(=O)C(=O)N(C)Cc1ccccc1O)CC2 1322670702 OFPYEMQZHOFZQV-CYBMUJFWSA-N 343.387 0.382 10 20 ECCD COC(=O)[C@@H](NCc1ccc(N2CCN(C)CC2)c(F)c1)[C@@H](C)O 1334401057 BUFMTCFMYIVWMJ-WBMJQRKESA-N 339.411 0.590 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@](C)(O)C1CC1 1346083721 QCECYIMYVKULHV-YVEFUNNKSA-N 337.372 0.849 10 20 ECCD CN1CCN(c2ccc(CN3CCNC(=O)[C@@H]3CC(=O)O)cc2)CC1 1610137689 ULXHQFVWKHLAQK-INIZCTEOSA-N 346.431 0.214 10 20 ECCD COC[C@H](C)OC[C@H](O)CN(C)c1ccc(OCC(=O)O)cc1 1777181538 XHQXQDQADUDSPV-GXTWGEPZSA-N 327.377 0.999 10 20 ECCD CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1786394570 WICLVWZVOMBKKD-DRZSPHRISA-N 349.387 0.496 10 20 ECCD Cc1cc(C(=O)N2CCO[C@@H](C(N)=O)C2)c(C)n1-c1ccccn1 363268700 FDLCTIZITYFNAT-CQSZACIVSA-N 328.372 0.815 10 20 ECCD O=C(NCC(=O)N1CCOCC1)NCc1c(O)ccc2c1CCCC2 271835509 ACEOTZVXQJUKPP-UHFFFAOYSA-N 347.415 0.929 10 20 ECCD CC(=O)NCCN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 279939315 QWUCNAVQJDGMTG-UHFFFAOYSA-N 325.752 0.946 10 20 ECCD CN(CC(C)(C)O)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 285781721 SZOLLGOUJHOWFW-UHFFFAOYSA-N 333.432 0.915 10 20 ECCD Oc1ccc(Br)cc1CNC[C@H](O)Cn1ccnn1 839178950 JHJVGGKIIVIUPM-NSHDSACASA-N 327.182 0.897 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)N3CCOCC3)CC2)cc1 839259784 XTDJJEKMFSFBPZ-UHFFFAOYSA-N 347.415 0.593 10 20 ECCD CCOC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 842241348 AIJHLZNLFGNLOG-AWEZNQCLSA-N 347.415 0.729 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)c2n[nH]c3c2CNCC3)cc1 841846682 RZKNISVGZNRVAN-CQSZACIVSA-N 328.420 0.551 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)CCO)CC2)cc1 843083365 PGKFLBRQAJZQSP-NVXWUHKLSA-N 337.464 0.539 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@H](CN)C3)ccc21 842150190 OKFSWWJENLNHCR-CQSZACIVSA-N 330.432 0.492 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)C1=NN(CCO)C(=O)CC1 843811141 KXQGDHLRXNNMMK-UHFFFAOYSA-N 346.387 0.449 10 20 ECCD 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O=C1N=C(N2CCOCC2)S/C1=C\c1cn(C[C@H]2CCCO2)nn1 865217380 LBOYANGVIGQLMB-YFBAIUBQSA-N 349.416 0.760 10 20 ECCD O=S1(=O)CC[C@@H](N(Cc2cc3c(cc2O)OC[C@H]3O)C2CC2)C1 768441474 JDFDSXODRUASDM-IUODEOHRSA-N 339.413 0.970 10 20 ECCD CCS(=O)(=O)N1CCC(C(=O)NCc2ccc(O)c(O)c2)CC1 768915108 YSDWKOIBBDLGTP-UHFFFAOYSA-N 342.417 0.776 10 20 ECCD COc1ccc(N2CCN(c3cc(=O)n(C)c(O)n3)CC2)c(OC)c1 1120867642 GQEHUJZODRCEOF-UHFFFAOYSA-N 346.387 0.830 10 20 ECCD C[C@H](O)CN1CCOC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1051263780 KSCSVIBWGNZIBF-SMDDNHRTSA-N 349.391 0.660 10 20 ECCD C[C@H]1C(=O)NCCN1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 899100985 GARHWEJUZSDZHF-BBRMVZONSA-N 347.463 0.885 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)Cn2cnc(N)n2)N(C)C)cc1 891248370 LVJCSXLJMSULTO-CQSZACIVSA-N 331.424 0.345 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NC(=O)[C@H]3CCCO3)C2)cc(OC)n1 972941432 ZIRIHBQUKUKPNB-JHJVBQTASA-N 349.387 0.655 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cnnn3C)nc12 798798157 YIXVZONGTCTYRJ-UHFFFAOYSA-N 346.303 0.097 10 20 ECCD CCN(CC)C(=O)CCCNC(=O)C(=O)NCCc1ccc(N)cc1 1328745482 ICJPWMJGGSJXSN-UHFFFAOYSA-N 348.447 0.692 10 20 ECCD C[C@@H](C(=O)Nc1ccc(N)cc1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 269108480 CQOXPBGLLUVMOO-YPCYXAEESA-N 329.356 0.758 10 20 ECCD O=C(C(=O)N1CCN(C(=O)c2cc(O)cs2)CC1)N1CCCC1 731871770 NFSLKCHIUAADHS-UHFFFAOYSA-N 337.401 0.361 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC(F)(F)CN 842271194 GYAJENNOTVADFU-UHFFFAOYSA-N 328.363 0.421 10 20 ECCD C[C@H](N)[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 844220550 HOWGKQPRQKKKBZ-YOEHRIQHSA-N 334.464 0.759 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(CC(=O)N3CCC3)C2)cc(OC)n1 1015109974 YANOCJFULGXXAU-ZDUSSCGKSA-N 348.403 0.135 10 20 ECCD NC(=O)[C@@H]1CCCN1CCCNC(=O)/C=C\c1ccc(O)c(O)c1 862647175 CNAMWSKYJXRBOR-VGVVRCBHSA-N 333.388 0.567 10 20 ECCD COc1cc(C(=O)NC2CN(CC(=O)N3CCCC3)C2)cc(OC)n1 1030612250 IWHLSAGQPKHRJJ-UHFFFAOYSA-N 348.403 0.135 10 20 ECCD CN[C@@H]1CCN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1119425381 UUPBSDQGHKFJQT-MRXNPFEDSA-N 331.464 0.942 10 20 ECCD COc1ccc(CN[C@@H]2CN(C(=O)c3nnn(C)n3)C[C@H]2C)cc1C 1054980799 ISUPZKPUKQLOKK-TZMCWYRMSA-N 344.419 0.777 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)NCc2cn(C)nn2)N(C)C)cc1 894121048 WBFZANDMZZCLBE-INIZCTEOSA-N 345.451 0.983 10 20 ECCD C[C@H](C(N)=O)N1CC[C@H]1CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1085994736 SRAMXROVFFGSEX-MFKMUULPSA-N 346.391 0.869 10 20 ECCD O=C(NCCn1cncn1)C(=O)NCc1ccc(N2CC=CC2)cc1 1261086399 VLCBYPCBFUDSQE-UHFFFAOYSA-N 340.387 0.087 10 20 ECCD CC(C)NC(=O)CCNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1342689720 BATMUPIATIMXMS-ZDUSSCGKSA-N 348.447 0.961 10 20 ECCD CN1CCN(c2ccc(CN3C[C@H](O)C[C@H]3C(=O)O)cc2F)CC1 1606245391 FEXDEWLEMPJTCN-CJNGLKHVSA-N 337.395 0.597 10 20 ECCD O=C(O)c1cn(C2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)nn1 1608960112 VVILFDKNUIAEJF-UHFFFAOYSA-N 346.343 0.794 10 20 ECCD CC[C@@H](NC[C@@]1(O)CCN(C)C1)c1cccc(-c2nn[nH]n2)c1O 1604052970 AEHWOHYGQWJSTN-CJNGLKHVSA-N 332.408 0.680 10 20 ECCD COc1ccc(CNC[C@@H](O)CNC(=O)c2cn(C)nn2)cc1C 1753908864 CIXSWOVCYMTBEY-CYBMUJFWSA-N 333.392 0.013 10 20 ECCD CN(C)c1ccc(CNC(=O)NCCNC(=O)c2ccn[nH]2)cc1F 181707410 QKFYMFPSJDJSHF-UHFFFAOYSA-N 348.382 0.844 10 20 ECCD CN(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1c(O)cccc1Cl 271116777 FSSHAECGPOPLIF-JTQLQIEISA-N 346.836 0.781 10 20 ECCD CN(CCOCCO)C(=O)NCc1ccc(N2CCOCC2)cc1 282301347 UNOCDPVWVPPIMU-UHFFFAOYSA-N 337.420 0.674 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCc2nnnn2CC1 845931883 UIXLQICPOXDSQS-PWSUYJOCSA-N 331.376 0.784 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCc3nncn3C)C2)cc(OC)n1 1020352208 CWGRKLOQYKEBHY-HAQNSBGRSA-N 346.391 0.278 10 20 ECCD O=C1NC(=O)C2(CCN(Cc3ccc(N4CCOCC4)cc3)CC2)N1 761217541 VCULGAMCGYBMFP-UHFFFAOYSA-N 344.415 0.697 10 20 ECCD COc1ccc(N2CCN(S(=O)(=O)NC3CC3)CC2)c(OC)c1 867731924 SHLFZFFIDYXPAA-UHFFFAOYSA-N 341.433 0.823 10 20 ECCD CN(C)c1nc(N)nc(COC(=O)/C=C\c2ccc(O)c(O)c2)n1 772775077 LHGQBBKVNBQDIF-XQRVVYSFSA-N 331.332 0.688 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)Cn3ncccc3=O)CC2)cc1 781830593 ZBCJUQZKHVBYGM-INIZCTEOSA-N 344.415 0.435 10 20 ECCD CNS(=O)(=O)CCNCc1ccc(N2CCN(C)CC2)cc1 783998617 FHRWOLVPAWEYRK-UHFFFAOYSA-N 326.466 0.077 10 20 ECCD O=C(NCCC1=CCN(c2ccc3nnnn3n2)CC1)[C@@H]1CC1(F)F 1089830421 AJRUPSNAZZUPBY-NSHDSACASA-N 349.345 0.817 10 20 ECCD COCCC(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089802742 VLLHESCDGTYLHD-UHFFFAOYSA-N 331.380 0.199 10 20 ECCD Cn1c(=O)ccn(CC(=O)Nc2c(Cl)ccc3nonc23)c1=O 1321387835 AKMITLZXDQNLOZ-UHFFFAOYSA-N 335.707 0.375 10 20 ECCD CN1CCN(c2ccc(CNCc3nnc4n3CCOC4)cc2)CC1 1320706922 NNDVDRIKMZOWFM-UHFFFAOYSA-N 342.447 0.850 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCN[C@H]3C)cc2)CC1 1328206152 UXQQJMZCTVXMCJ-KBXCAEBGSA-N 344.459 0.969 10 20 ECCD O=C(O)Cn1cc(CCOC(=O)/C=C/c2ccc(O)c(O)c2)nn1 1602160694 NZYUESUTXIIVIW-DUXPYHPUSA-N 333.300 0.573 10 20 ECCD O=C(Cc1ccc(-c2nn[nH]n2)nc1)NCc1cc(O)ccc1O 1592913633 FFDLCTWKHHWZMD-UHFFFAOYSA-N 326.316 0.532 10 20 ECCD O=C(CN1CCOCC1)N1CCN(Cc2cc(F)ccc2O)CC1 179902669 ARVXXRKNJQPRAJ-UHFFFAOYSA-N 337.395 0.508 10 20 ECCD C[C@@H](CO)NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 79967316 WVJMMRCDZXWDPG-NSHDSACASA-N 325.384 0.967 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCS(=O)(=O)CC2)cc1F 278700575 HIYIQRNVCIVZFA-UHFFFAOYSA-N 329.397 0.832 10 20 ECCD CCS(=O)(=O)N1CCC(NC(=O)c2cccc(O)c2O)CC1 279152401 BWIIDXIONDBNGU-UHFFFAOYSA-N 328.390 0.642 10 20 ECCD COCCS(=O)(=O)CC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 274913690 JPGUDWIAECCSDV-JTQLQIEISA-N 331.390 0.206 10 20 ECCD CCNc1nc(NCC)n2c(SCC(=O)N(C)OC)nnc2n1 298798108 PMJUZYYAHKYING-UHFFFAOYSA-N 340.413 0.495 10 20 ECCD CNC[C@H](C)NC(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 911338614 PLVFTWCCPILYDZ-BBRMVZONSA-N 349.479 0.196 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)Cn3nccn3)C2)cc1C 1018914624 SPHVEBAWTCJARE-HNNXBMFYSA-N 329.404 0.986 10 20 ECCD CN(C)c1cc(F)c(CNC[C@]2(O)CCS(=O)(=O)C2)cc1F 858171239 OCSCBWICAXBXOD-CQSZACIVSA-N 334.388 0.670 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2C[C@H](N)C[C@H]2C)cc1 868403214 ZYIWQVPVCBTWKW-ZIAGYGMSSA-N 348.447 0.538 10 20 ECCD Cc1ccc(C(=O)N2CCN(C(=O)N3CCOCC3)CC2)c(O)c1O 1116512187 KDTKXKBRTIAIKD-UHFFFAOYSA-N 349.387 0.616 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)NCc1cc[nH]n1 774151233 ZKWCRBXVDRQCHM-UHFFFAOYSA-N 325.419 0.781 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(CC3CC3)C2)cc1 785424923 WVAYXDPFMHXAKR-MRXNPFEDSA-N 344.459 0.969 10 20 ECCD COc1ccc(CNC(=O)CCC(=O)N2CCC(O)CC2)c(O)c1 794381769 SXNIFAQTHYWOTB-UHFFFAOYSA-N 336.388 0.781 10 20 ECCD O=C1N[C@H](C(=O)NCCC2=CCN(c3nccnc3F)CC2)CO1 1089829500 PWIJUWXVOIACMX-NSHDSACASA-N 335.339 0.367 10 20 ECCD CN(CC(C)(C)O)c1nnnn1Cc1ccc(N2CCOCC2)cc1 1334067707 WEFFJZDFHBXABX-UHFFFAOYSA-N 346.435 0.765 10 20 ECCD CN1CC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1351300597 GHEZBIFVEYYSNZ-MRXNPFEDSA-N 328.416 0.499 10 20 ECCD CCN1CCN(CC(=O)NCc2ccc(N(C)C)cc2C)C(=O)C1=O 115490854 SYSJOGLUUNRYGI-UHFFFAOYSA-N 346.431 0.368 10 20 ECCD CCOC(=O)[C@@H]1NCC[C@H]1NCc1ccc(N2CCOCC2)cc1 817894509 LPHOQHVTIYTJLC-IAGOWNOFSA-N 333.432 0.906 10 20 ECCD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@H]1C(=O)O 828385179 GPDMEURVAWMXCD-GZMMTYOYSA-N 342.373 0.556 10 20 ECCD CO[C@@H](CN)CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 827469366 VZVKWMVBUBVHAD-GOEBONIOSA-N 348.447 0.368 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3C(=O)CCC3=O)CC2)cc1 732408562 OMNJNIWQCNFHCJ-HNNXBMFYSA-N 347.415 0.327 10 20 ECCD CN(C)c1ccc(CNS(=O)(=O)c2cnn(CC(=O)O)c2)cc1 830639361 GISGIBBEYZTPEE-UHFFFAOYSA-N 338.389 0.512 10 20 ECCD C[C@@H]1C[C@@H](NC(=O)C(N)=O)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1012946917 DDMNFGRXLJOULS-LDYMZIIASA-N 346.347 0.054 10 20 ECCD C[C@H](OC(=O)c1cccc(O)c1O)C(=O)N1CCC(C(N)=O)CC1 758561814 NGKWHZVTLAKFHI-VIFPVBQESA-N 336.344 0.367 10 20 ECCD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1c(C)cccc1O 876534174 PEMNCJPCCYDUGU-CYBMUJFWSA-N 340.445 0.826 10 20 ECCD CCOCCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 786822560 ATAUDJBKHPWGMG-CQSZACIVSA-N 349.431 0.853 10 20 ECCD CS(=O)(=O)CC1(C(=O)NCc2cc(Cl)ccc2O)COC1 1347717868 TZPFFDLJKXNOAO-UHFFFAOYSA-N 333.793 0.723 10 20 ECCD C[C@@H](NCc1nnnn1C1CC1)c1cccc(-c2nn[nH]n2)c1O 1589975660 FKCZSGXYSHJITF-MRVPVSSYSA-N 327.352 0.745 10 20 ECCD COC[C@H](CCO)NC(=O)NCc1ccc(N2CCOCC2)cc1 265823147 NCEOENPDDLHXEC-HNNXBMFYSA-N 337.420 0.720 10 20 ECCD C[C@@H]1COCCN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 288707663 YOZQODNFFGZGST-CQSZACIVSA-N 329.400 0.926 10 20 ECCD CC(C)NC(=O)[C@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 839901878 XYLQXOGZRMXOJO-VIFPVBQESA-N 343.405 0.407 10 20 ECCD CC(C)(CC(=O)O)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 833456474 XVRFACJFJBEJMN-UHFFFAOYSA-N 330.362 0.747 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)c2cn(CCCN)nn2)cc1 832278498 DBTVLTZUCFUYQR-CQSZACIVSA-N 331.424 0.123 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](CCN)C2)cc1 842034987 AYRCMSPDHYSNKX-OAHLLOKOSA-N 332.448 0.956 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)Cn2ncn(C)c2=O)N(C)C)cc1 891247985 JFJRDAWGYOCRNY-OAHLLOKOSA-N 346.435 0.067 10 20 ECCD Cn1oc(C(=O)NCCC2=CCN(c3nccnc3F)CC2)cc1=O 1089828543 ACWPBCWBFNMRPB-UHFFFAOYSA-N 347.350 0.864 10 20 ECCD COCCN1CC[C@H](N[C@H](C)c2cccc(-c3nn[nH]n3)c2O)C1 1605105112 SUHFPSMHFHJRKA-NEPJUHHUSA-N 332.408 0.944 10 20 ECCD CC[C@H](NCCN1CC[C@H](O)C1)c1cccc(-c2nn[nH]n2)c1O 1590469489 JFFJVTMFJBHYBP-FZMZJTMJSA-N 332.408 0.680 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C[C@@H]4[C@@H](CO)[C@@H]4C3)CC2)cc1 366446563 TXIGVPROANBZGO-PIIMJCKOSA-N 345.443 0.514 10 20 ECCD CC(C)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1=O 283575000 SDXVOCSOUJVUCI-OAHLLOKOSA-N 346.431 0.494 10 20 ECCD CC(=O)N[C@@H]1CCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 817761531 MFSOEHZYFVYVQZ-OAHLLOKOSA-N 346.431 0.448 10 20 ECCD O=C1CN(CC(=O)NCc2cc(Cl)cc(Cl)c2O)CCN1 908210761 CXEZLLNOJJYIEH-UHFFFAOYSA-N 332.187 0.747 10 20 ECCD Cn1ccnc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1=O 742400077 MAKVUMHVGIMDAB-UHFFFAOYSA-N 348.428 0.627 10 20 ECCD CCONC(=O)CNC(=O)NCc1ccc(N2CCOCC2)cc1 845551428 YXQWJTDYFFOCAB-UHFFFAOYSA-N 336.392 0.390 10 20 ECCD CCc1nc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)n[nH]1 754794920 XYMNRNWHNMEAEO-UHFFFAOYSA-N 340.361 0.801 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)C(=O)NCC(F)F)N(C)C)cc1 891248377 LEMJJMYASGZWGW-ZDUSSCGKSA-N 342.390 0.853 10 20 ECCD COc1cc(C(=O)N[C@@H](C)CCNC(=O)c2nc[nH]n2)cc(OC)n1 1077830819 ZCOSFOZHBKSWAS-VIFPVBQESA-N 348.363 0.155 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@H]3CCC(=O)N3)CC2)ncn1 1089819521 LGVCEQBYPHTYSF-CQSZACIVSA-N 329.404 0.706 10 20 ECCD NC(=O)NCC(=O)NCCC1=CCN(c2ncccc2[N+](=O)[O-])CC1 1089804588 NPFOBKYYEPPFKO-UHFFFAOYSA-N 348.363 0.301 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CCO[C@@H](CNCCCO)C2)cc1 1755018628 VYBYJATYJFLYDU-AWEZNQCLSA-N 349.391 0.662 10 20 ECCD O=C1COc2cc([N+](=O)[O-])c(N3C[C@@H](O)C[C@@H](C(=O)O)C3)cc2N1 401862139 RYROZSADYUWIMO-SFYZADRCSA-N 337.288 0.198 10 20 ECCD CNC(=O)c1cc(S(=O)(=O)NCCc2ccc(N)cc2)cn1C 261825470 XDXKXPRVZXTETK-UHFFFAOYSA-N 336.417 0.488 10 20 ECCD O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NCc1ccccc1O 266650503 ZLWMOYIJIJTEIR-QHSBEEBCSA-N 330.340 0.171 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N(C)CCC(=O)NC)cc1 284062266 MUGRZUPFZWCYHS-UHFFFAOYSA-N 348.447 0.744 10 20 ECCD COC(=O)[C@]1(C)CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 842238192 KAHJDXDKEJFVBJ-GOSISDBHSA-N 347.415 0.729 10 20 ECCD C[C@H](O)[C@@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 747616971 MQCVIABOUPEMDK-WDEREUQCSA-N 342.417 0.997 10 20 ECCD CCOC(=O)CC(C)(C)CC(=O)C(=O)CN1CCCCS1(=O)=O 935944280 QIGMMGDLBSVRGU-UHFFFAOYSA-N 347.433 0.920 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cncnc3)nc12 760805188 RLNJHLFVTUOVGG-UHFFFAOYSA-N 343.299 0.759 10 20 ECCD COCCOCCOC(=O)c1cc(NS(C)(=O)=O)ccc1O 768947768 ACRKRQFDUWJOIV-UHFFFAOYSA-N 333.362 0.584 10 20 ECCD Cn1cc(N2C[C@@H](C(=O)NCCc3ccc(O)c(O)c3)CC2=O)cn1 860234379 FMQHMXGEGMKKGQ-LBPRGKRZSA-N 344.371 0.543 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN[C@H]3C[C@@H](CO)C3)CC2)cc1 872217651 BYRHMEDYYJGVMR-SOLBZPMBSA-N 349.475 0.539 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)NCCN1CCNC(=O)C1 781403699 ATWMCCUUVMRRNT-UHFFFAOYSA-N 333.436 0.292 10 20 ECCD O=C(NCCC1=CCN(c2ncncc2Cl)CC1)[C@H]1CCNC1=O 1089855412 KNCTZOQFXUUXRL-GFCCVEGCSA-N 349.822 0.909 10 20 ECCD CC[C@@H](OC)C(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089814527 GDALNLDSDXQTMU-CYBMUJFWSA-N 345.407 0.587 10 20 ECCD CNC(=O)NCC(=O)N1CC[C@@H](NCc2ccc(OC)c(C)c2)C1 1183059836 LFUUJOCHQDMYLU-CQSZACIVSA-N 334.420 0.623 10 20 ECCD COC(=O)[C@@H]1C[C@@H](O)CN1Cc1ccc(N2CCC(O)CC2)cc1 1262007659 MYQDOJPIUIZASP-SJORKVTESA-N 334.416 0.756 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC[C@H](OC)C2)cc1 1261518005 HKBPQHGSQZBPPL-INIZCTEOSA-N 349.431 0.837 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1c[nH]c(-c2nn[nH]n2)c1 1609115560 BFLWYNODSKRZBH-QMMMGPOBSA-N 328.332 0.967 10 20 ECCD CCn1cc(-c2nn[nH]n2)c(=O)n(Cc2ccc(N(C)C)cc2)c1=O 1590949429 HCKOIMHMQFEGCZ-UHFFFAOYSA-N 341.375 0.324 10 20 ECCD CC[C@@H](NCCCc1nnnn1C)c1cccc(-c2nn[nH]n2)c1O 1590471219 ZIZWJZMELCJYJL-GFCCVEGCSA-N 343.395 0.769 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)C3CC3)C2)C1 1784904337 KPFGNEHBAVMKQG-KRWDZBQOSA-N 347.371 0.346 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 283340643 WRYHKFQIRXBCRB-AWEZNQCLSA-N 347.415 0.387 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)C[C@H](O)C1CC1 807099648 BQQPXEFVLVQLGX-INIZCTEOSA-N 333.432 0.907 10 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CCN(C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCNC1=O 1328579607 JLFPUIDUUSTRTG-HNNXBMFYSA-N 346.431 0.448 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H](N2CC=CC2)C1 1348176304 ZPVFZIQAGMBJSC-OAHLLOKOSA-N 329.400 0.823 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2nn[nH]n2)[nH]1 1589897087 OHIZVUZPXHXFRF-QMMMGPOBSA-N 328.332 0.967 10 20 ECCD COc1ccc(N2CCN(c3cc(-c4nn[nH]n4)cnn3)CC2)cc1 1591607173 CJAAEYFVZRZOEB-UHFFFAOYSA-N 338.375 0.992 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2Cc1cn(C)c(=O)n(C)c1=O 154911352 DEJLQCIZNZCUIC-UHFFFAOYSA-N 330.388 0.549 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@H]3CCNC3=O)C2)cc1C 1022543733 UEXMJSSDVXPHQO-ZNMIVQPWSA-N 331.416 0.877 10 20 ECCD CC(=O)NC[C@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)CCO1 172186577 NGCVYLNEVMSBQC-KRWDZBQOSA-N 348.447 0.206 10 20 ECCD CN(C[C@H]1CCC[C@H]1O)C(=O)c1cc(NS(C)(=O)=O)ccc1O 270056806 BPLIHYJKEZUSQL-ZWNOBZJWSA-N 342.417 0.997 10 20 ECCD C[C@H](CO)CCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 270532102 FUIWBUGBIOMSDY-JTQLQIEISA-N 330.406 0.902 10 20 ECCD 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O=S(=O)(NCc1ccc(O)cc1O)c1ccc(-c2nn[nH]n2)cn1 1582797569 MOIHLLKDWRWRGV-UHFFFAOYSA-N 348.344 0.151 10 20 ECCD Cc1ccc(O)c(CNS(=O)(=O)c2ccc(-c3nn[nH]n3)o2)c1 1592186405 SEZHWPCFSZHKNB-UHFFFAOYSA-N 335.345 0.952 10 20 ECCD CN1CC[C@@H](NC(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1=O 172542168 DFKWAVIUKWPUJK-IEXSPKMKSA-N 329.400 0.883 10 20 ECCD CCN(CC)c1ccc(CNC(=O)NCCN2C(=O)CNC2=O)cc1 265082222 QRSMCAACJOBDJQ-UHFFFAOYSA-N 347.419 0.884 10 20 ECCD O=C(CSc1nnnn1C1CC1)NCCc1ccc(O)c(O)c1 269261596 ZHSYRDJLKMEHNV-UHFFFAOYSA-N 335.389 0.870 10 20 ECCD CC(C)(C(N)=O)N1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 272565073 CJAZUQBECFKKAG-GQCTYLIASA-N 333.388 0.519 10 20 ECCD CC(=O)N[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 817829554 YCCYVRSAOODPHR-HNNXBMFYSA-N 346.431 0.414 10 20 ECCD CN1CCN(c2ccc(CN3CC(OCC(=O)N(C)C)C3)cc2)CC1 839138851 UXCJXHWXEARSFO-UHFFFAOYSA-N 346.475 0.727 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3[C@H]4CNC[C@H]43)cc2)C1 844175602 JSGPSDDEPJMQRE-QMCVQRASSA-N 342.443 0.470 10 20 ECCD 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CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN(C(C)=O)C1 1328555735 OIZMKIKLHFSRFN-OAHLLOKOSA-N 347.415 0.868 10 20 ECCD CN(C)c1ccc(OCCN2CCCS2(=O)=O)cc1C(=O)O 1606058363 AMBZZZDSNNEZFI-UHFFFAOYSA-N 328.390 0.865 10 20 ECCD CNC(=O)[C@@H](C)N(C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1753074828 HNKNUZYUVXLIQU-SNVBAGLBSA-N 334.380 0.645 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C1=NNC(=O)CC1 7230028 VYHODIUMCHLALA-UHFFFAOYSA-N 346.387 0.520 10 20 ECCD O=C1CC[C@@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)N1 265603322 MSNNVHTTYCHAOT-INIZCTEOSA-N 331.416 0.790 10 20 ECCD COC(=O)CN(CC(=O)OC)Cc1cc(F)cc(C(C)=O)c1O 267461608 SJRKRPTXNHIEJX-UHFFFAOYSA-N 327.308 0.882 10 20 ECCD CN(CCCCCO)C(=O)c1cc(NS(C)(=O)=O)ccc1O 279513679 KVQJXGWOTRFGIJ-UHFFFAOYSA-N 330.406 0.998 10 20 ECCD Cc1ccc(C(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c(O)c1O 272896593 ZYZQVLDCBLETBO-SNVBAGLBSA-N 343.405 0.052 10 20 ECCD O=C(Cn1cnnn1)N1CCN(Cc2cccc(Cl)c2O)CC1 289830867 ORZUSHSSVWFRBL-UHFFFAOYSA-N 336.783 0.377 10 20 ECCD CC(=O)NCCCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 285754460 QIFXCZMVYOZKID-UHFFFAOYSA-N 338.383 0.150 10 20 ECCD CNS(=O)(=O)c1cc(NC(=O)c2cccc(O)c2O)ccc1O 807384440 KGTMXOLGXRJFQY-UHFFFAOYSA-N 338.341 0.964 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@]2(C)CO)cc1F 803663656 VYLIAQCVOKMSBY-KRWDZBQOSA-N 337.395 0.881 10 20 ECCD CCOC(=O)CC(C)(C)CC(=O)C(=O)C(C)(C)NS(C)(=O)=O 819761094 MRWQFQPDRNSFDA-UHFFFAOYSA-N 335.422 0.822 10 20 ECCD CC(=O)N1CCN(C(=O)COC(=O)c2ccc(C)c(O)c2O)CC1 727005940 XXIPFYZAHDECNS-UHFFFAOYSA-N 336.344 0.254 10 20 ECCD CC(=O)N(C)Cc1cn(CC(=O)NCc2ccc(N(C)C)cc2)nn1 900512184 KEUROFFPSRGJHE-UHFFFAOYSA-N 344.419 0.639 10 20 ECCD CC(C)(N)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 841721878 JOTOCWALCMPOBR-CQSZACIVSA-N 347.463 0.925 10 20 ECCD CCNCCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 842232969 XPZJPNCJJQYLDE-OAHLLOKOSA-N 349.431 0.626 10 20 ECCD CN[C@@H]1CCN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1 923277047 BFMPUYMJMIHUDV-AEFFLSMTSA-N 348.491 0.472 10 20 ECCD C[C@@H](CO)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 764210760 CJKJXHJBNXSHDS-GXTWGEPZSA-N 334.420 0.568 10 20 ECCD CC[C@H](CO)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 779752009 JXLIMZRHMJDFCO-OAHLLOKOSA-N 335.448 0.952 10 20 ECCD CC[C@H](NC(=O)NCc1ccc(N2CCN(C)CC2)cc1)C(=O)NC 889662226 ABQVVHVHUWWJRS-INIZCTEOSA-N 347.463 0.762 10 20 ECCD CCOC(=O)CNC(=O)[C@H]1COCCN1Cc1ccc(N(C)C)cc1 785799516 ZQBNSHPONTVKBS-MRXNPFEDSA-N 349.431 0.633 10 20 ECCD CN1C[C@@H](C(=O)NCCC2=CCN(c3cccc(F)n3)CC2)NC1=O 1089855772 OZWREBUMANFQKC-ZDUSSCGKSA-N 347.394 0.887 10 20 ECCD O=C1CN(Cc2ccccc2O)C(=O)N1C[C@H]1CCS(=O)(=O)C1 1332417482 LNDKDENOMVQRPO-LLVKDONJSA-N 338.385 0.591 10 20 ECCD C[C@@H](NC(=O)C(=O)N1CC[C@H](NC(N)=O)C1)c1ccc(N(C)C)cc1 1346753470 MDTCGFZGZWZLEA-YPMHNXCESA-N 347.419 0.199 10 20 ECCD COc1ccc(N2CCCN([C@@H](C)C(=O)NCC(=O)O)CC2)cc1 1610338710 BVNRHJYHMUQZDD-ZDUSSCGKSA-N 335.404 0.797 10 20 ECCD NS(=O)(=O)c1cccc(NCc2ccccc2O)c1-c1nn[nH]n1 1592747721 AQYGKTCWAQBEHB-UHFFFAOYSA-N 346.372 0.832 10 20 ECCD Cc1cc(C(=O)NCCC(=O)NC(N)=O)c(C)n1-c1ccccn1 137091893 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COc1ccc(N2CCN(CCCNC(=O)N[C@@H](C)CN)CC2)cc1 841666530 XQQZVILWYNFKIP-HNNXBMFYSA-N 349.479 0.854 10 20 ECCD O=CN1CCC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856208484 RPAYFAXXDMWWON-KRWDZBQOSA-N 331.416 0.885 10 20 ECCD CS(=O)(=O)N1CCC[C@@H]1C(=O)NCCc1ccc(O)c(O)c1 768900418 JAVRIIKIXOTCNH-LLVKDONJSA-N 328.390 0.181 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CCOC[C@H]3C)CC2)cc1 769914240 XQFZTLZXPKHEHC-SJLPKXTDSA-N 349.475 0.899 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N2CC[C@H]3NC(=O)CC[C@H]3C2)cc1 1118485555 BPKBGBCEDPTRTN-DZGCQCFKSA-N 344.415 0.055 10 20 ECCD Cn1cnn(CC(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1=O 770524206 GHLTWCMRFYFHDQ-UHFFFAOYSA-N 349.354 0.930 10 20 ECCD O=C(C[C@H]1CC(=O)NC1=O)NCc1ccc(N2CCOCC2)c(F)c1 1119844694 YEBCVMVTLRECQG-LBPRGKRZSA-N 349.362 0.331 10 20 ECCD C[C@H]1NC(=O)N(Cc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1=O 777609837 FWEUVGLSZLOTQT-YPMHNXCESA-N 330.388 0.829 10 20 ECCD C[C@@H]1CN2CCN1C[C@H]2C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 1121810583 YWTVMCQGWWKVIA-XYPHTWIQSA-N 331.464 0.257 10 20 ECCD CS(=O)(=O)CCNCc1ccc(N2CCC(C(N)=O)CC2)cc1 1120277632 LLJJGENHLJKLMB-UHFFFAOYSA-N 339.461 0.523 10 20 ECCD CS(=O)(=O)CCN1CCC(NC(=O)c2cccc(O)c2O)CC1 790678612 KYBLAMJTUKPNLN-UHFFFAOYSA-N 342.417 0.337 10 20 ECCD O=C(Cn1cncn1)NCCC1=CCN(c2cnc(F)cn2)CC1 1089831836 HENPIJYRJXYJTK-UHFFFAOYSA-N 331.355 0.550 10 20 ECCD COc1ccc(CNCCNC(=O)c2nccnc2C(N)=O)cc1C 1150444484 OSYLOEVTYNYQCX-UHFFFAOYSA-N 343.387 0.412 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1327325239 ZGNVSIYWMLNIIN-UHFFFAOYSA-N 347.331 0.272 10 20 ECCD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNCCN)cc1 1341688354 HHGMLBWPIRMDJP-KRWDZBQOSA-N 334.464 0.809 10 20 ECCD COc1ccc(O)c([C@@H](C)NS(=O)(=O)N2CCC[C@H]2C(=O)O)c1 1604821003 COHWETTVRKJTSG-SKDRFNHKSA-N 344.389 0.845 10 20 ECCD O=C(O)Cn1cc(CNCc2ccc(N3CCOCC3)c(F)c2)nn1 1602162188 QKPWEFXBRRBKKR-UHFFFAOYSA-N 349.366 0.628 10 20 ECCD CC(=O)NCC(=O)N1CCCN(Cc2cc3c(cc2O)OCO3)CC1 529666271 VCYKTDISYCNKQY-UHFFFAOYSA-N 349.387 0.291 10 20 ECCD CC1(C)NC(=O)N(CCCC(=O)NCCc2ccc(O)c(O)c2)C1=O 267521045 URAQANWYTJQPSG-UHFFFAOYSA-N 349.387 0.867 10 20 ECCD C[C@H](C[S@](C)=O)NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 289550095 CZHSNZALTFIQBV-SPSFWMDKSA-N 339.461 0.594 10 20 ECCD COC(=O)c1cn(C2CCN(C(=O)c3cccc(O)c3O)CC2)nn1 280530973 RPPDTQJMDPPTGG-UHFFFAOYSA-N 346.343 0.953 10 20 ECCD CC(C)C(=O)N[C@@H](CO)C(=O)NCc1ccc(N(C)C)c(F)c1 291487437 LDMIIUMEDFZROG-ZDUSSCGKSA-N 325.384 0.641 10 20 ECCD Nc1ncn(CC(=O)NCc2ccc(N3CCSCC3)cc2)n1 864919396 UEMHAOPPTJAOLN-UHFFFAOYSA-N 332.433 0.730 10 20 ECCD O=C(CO)N1CCN(Cc2c(O)cccc2Br)CC1 862358374 FANQQSJUGGJLNR-UHFFFAOYSA-N 329.194 0.791 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCOC[C@H]3C)CC2)cc1 769914237 XQFZTLZXPKHEHC-AEFFLSMTSA-N 349.475 0.899 10 20 ECCD CN(C(=O)CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)c1ccc(N)cc1 877077655 QJZPDDDRPHQLRS-RRCSTGOVSA-N 343.383 0.784 10 20 ECCD COCCN1C[C@H](C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CC1=O 773763343 TZRJBOOMSQOUDK-WCQYABFASA-N 336.388 0.640 10 20 ECCD CO[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1118728809 PLZWVTLSXOHNLB-ZDUSSCGKSA-N 349.431 0.415 10 20 ECCD Cc1noc(CNC(=O)C(=O)NCCCSc2nccs2)n1 1117112453 MBZYPJVWYWUWNM-UHFFFAOYSA-N 341.418 0.749 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2cc(Cn3ccnc3)nn2)cc1 881093731 GUJYYUQDEGNRGD-UHFFFAOYSA-N 339.403 0.905 10 20 ECCD COC(=O)COc1ccc(N(C)CC(=O)N2CCO[C@H](C)C2)cc1 784559031 ZHQZUWONFJVBNU-CYBMUJFWSA-N 336.388 0.922 10 20 ECCD Cc1ncc(C)c(N2CC=C(CCNC(=O)CCNC(N)=O)CC2)n1 1089836469 WLMAYTNKJWDLNX-UHFFFAOYSA-N 346.435 0.795 10 20 ECCD COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)CN)CCCC1 1341382918 LSWIQHMTLXUXCW-LBPRGKRZSA-N 331.416 0.965 10 20 ECCD C[C@H](NC[C@@H](O)c1ccnn1C)c1cccc(-c2nn[nH]n2)c1O 1589980174 YWPCFJBUVKAQCO-TVQRCGJNSA-N 329.364 0.690 10 20 ECCD CN1C[C@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1=O 73543076 BMYDEFCVXCGICF-OAHLLOKOSA-N 331.416 0.960 10 20 ECCD CN(Cc1nc2c([nH]1)c(=O)n(C)c(=O)n2C)c1ccc2c(c1)OCO2 93210862 GMNHNDPFMYAVAL-UHFFFAOYSA-N 343.343 0.325 10 20 ECCD CN(Cc1ccccc1O)C(=O)C1CCN(S(N)(=O)=O)CC1 269152673 PAUINFIDTALDFW-UHFFFAOYSA-N 327.406 0.266 10 20 ECCD COc1ccc(N2CCN(C(=O)C[C@@H]3CNCCO3)CC2)cc1F 269259993 LTROPCVZPVJPJU-CQSZACIVSA-N 337.395 0.861 10 20 ECCD Cn1nncc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 810348916 ZSRWFLIAYKGAEH-UHFFFAOYSA-N 328.376 0.670 10 20 ECCD O=C(CCNC(=O)[C@H]1CCCN1)NCCCSc1nccs1 829527864 HMTZVRLBQGTFOP-LLVKDONJSA-N 342.490 1.000 10 20 ECCD COc1ccc(N2CCN(CCCNC(=O)[C@H]3CCN3)CC2)cc1 844191357 MWOONWLLFRZCFF-QGZVFWFLSA-N 332.448 0.685 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NC[C@@H]1CCCN1 842070940 VKNQEQVQJJUSDT-ZBFHGGJFSA-N 346.475 0.976 10 20 ECCD O=C(CN1CCCNC1=O)NCc1ccc(N2CCOCC2)cc1 919765434 ABKIPMFRZPHKHT-UHFFFAOYSA-N 332.404 0.555 10 20 ECCD C[C@H](C(N)=O)N1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1016367965 MSMMQJLXGYSALN-SKDRFNHKSA-N 332.364 0.527 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3NC(=O)O[C@@H]3C)CC2)c(OC)c1 870167293 DWXCVGWNHQLUJL-ABAIWWIYSA-N 349.387 0.849 10 20 ECCD C[C@H](NC(=O)C(=O)NCCC(=O)N(C)C)c1ccc(N(C)C)cc1 1117077951 JSUHZPSLQDSNJQ-LBPRGKRZSA-N 334.420 0.524 10 20 ECCD C[C@@H]1OC(=O)N[C@@H]1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891248654 MIMKRRJIYJPLMB-GLQYFDAESA-N 334.420 0.968 10 20 ECCD CCN1CCO[C@H](C(=O)NCCNCc2ccc(OC)c(C)c2)C1 1151738199 GUBMUGYGGGBLIG-KRWDZBQOSA-N 335.448 0.930 10 20 ECCD CC[C@@H](NCCCNC(=O)c1ccc(N=NC(N)=O)cc1)C(N)=O 1177238495 ZGLMWWFIBRTMBX-GFCCVEGCSA-N 334.380 0.822 10 20 ECCD COCCN(CC(=O)N1CCNCC1)c1ccc(OC)c(OC)c1 1261492396 BTUXHBWXCBEGHF-UHFFFAOYSA-N 337.420 0.588 10 20 ECCD COCCOC1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1261113346 UMUQPZXDRFEPHS-CYBMUJFWSA-N 349.431 0.804 10 20 ECCD CN1C[C@H](C(=O)O)N(C(=O)c2ccc(N=NC(N)=O)cc2)CC1=O 1606199520 GZYRWMKGYXDTGG-SNVBAGLBSA-N 333.304 0.216 10 20 ECCD O=C(O)[C@@H]1C[C@H](O)CN(Cc2ccc(N3CCOCC3)c(F)c2)C1 1608600255 BYHDXILHORBGDA-KGLIPLIRSA-N 338.379 0.930 10 20 ECCD C[C@@H](O)C(=O)N1CCN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])CC1 1593428284 YXGUBVBWJUNIEN-USEMIUTHSA-N 349.343 0.722 10 20 ECCD Cc1c(CNC(=O)C(=O)Nc2nc(C)n(C)n2)n(C)c2ccccc12 340404225 YJEKAJBODRRVHS-UHFFFAOYSA-N 340.387 1.179 10 20 ECCD CC(C)[C@@H](N)C(=O)NCC(=O)N1CCOc2cc(N(C)C)ccc21 352101781 DULLUUVTNQHBLO-MRXNPFEDSA-N 334.420 0.578 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)NCCN1C(=O)CNC1=O 265018681 DPIVFPAWWZNPDC-UHFFFAOYSA-N 333.392 0.446 10 20 ECCD Cc1ccc(C(=O)NC2CCC3(CC2)NC(=O)NC3=O)c(O)c1O 286170422 HZDGVCFPDUTMHT-UHFFFAOYSA-N 333.344 0.657 10 20 ECCD C[S@](=O)C1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 282101388 FYSQIYBQKVNZTP-NRFANRHFSA-N 346.430 0.405 10 20 ECCD Cc1cc(CN2CCN(C(=O)C(=O)NC3CC3)CC2)ccc1N(C)C 293632319 WWUOTAGGQWBPOI-UHFFFAOYSA-N 344.459 0.984 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[S@@](C)=O 804993453 NVLVDJWHJPYLIY-JOCHJYFZSA-N 325.434 0.206 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@H](C(=O)O)C1 817890834 ZZXVBVOHYFSFRO-ZDUSSCGKSA-N 333.388 0.644 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](C(=O)O)C3)nc12 818229378 NGTJTFNWTIFBEV-SECBINFHSA-N 334.332 0.518 10 20 ECCD COc1cccc(CNC(=O)c2cn(CC(=O)N(C)C)nn2)c1O 729859696 LSBLAZHYTBIALT-UHFFFAOYSA-N 333.348 0.011 10 20 ECCD CN(C)c1ccc(CNC(=O)N2C[C@H](O)C[C@@H]2C(=O)O)cc1F 908613551 QQVFYLPHAKPJKD-ZWNOBZJWSA-N 325.340 0.621 10 20 ECCD C[C@H]1CN(c2ccc(CNC(=O)C3=NNC(=O)C3)cc2F)C[C@@H](C)O1 731870691 MUWCRSMQBKUQPE-PHIMTYICSA-N 348.378 0.931 10 20 ECCD CCNS(=O)(=O)CCNC(=O)NCc1ccc(N(C)C)cc1C 734528749 CNRVIAVLOREYLQ-UHFFFAOYSA-N 342.465 0.800 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCO[C@@H]([C@H](C)N)C1)c1ccc(N(C)C)cc1 842203530 UDONRYUCCWSTSD-HEHGZKQESA-N 348.447 0.504 10 20 ECCD CCNCCNC(=O)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 842070005 JTPCEMMLNBBSRM-CQSZACIVSA-N 334.464 0.834 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NCC(C)(C)N 842071307 ZBBSJWRFNDFZHX-ZDUSSCGKSA-N 334.464 0.962 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CCCCN1 842153855 QMOGPUVCFBTVES-OAHLLOKOSA-N 332.448 0.936 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)c2ccn3nnnc3c2)cc1 852791252 FHBRUBVGUKJBPV-CQSZACIVSA-N 325.376 0.620 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)C(=O)N[C@H]2CCOC2)N(C)C)cc1 929988958 PBVQVCFWOVOIRP-GOEBONIOSA-N 348.447 0.377 10 20 ECCD NC(=O)[C@@H]1CC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856216516 XEYNHBBHPNSKSK-CVEARBPZSA-N 331.416 0.775 10 20 ECCD Cc1cccc(O)c1CN1CCN(C(=O)CN2CCOCC2)CC1 876559069 SOYHKKBNHBHQCW-UHFFFAOYSA-N 333.432 0.677 10 20 ECCD COc1cccc(CNC(=O)CN2CCCCS2(=O)=O)c1O 878667568 UUAUUYPNLNTTNX-UHFFFAOYSA-N 328.390 0.443 10 20 ECCD COCn1nccc1S(=O)(=O)NCc1cc(OC)ccc1O 790026381 LLONFCGRTMOZHA-UHFFFAOYSA-N 327.362 0.680 10 20 ECCD COc1ccc(CNC(=O)[C@H]2CC(=O)N(CCN(C)C)C2)c(O)c1 794381665 QSBFMHVBTNXKNZ-ZDUSSCGKSA-N 335.404 0.427 10 20 ECCD CNC[C@@H](C)CNC(=O)C(=O)NCCCSc1nccs1 1328748914 WGYBNWZCKLEGDM-SNVBAGLBSA-N 330.479 0.713 10 20 ECCD CN(C)C(=O)c1cc(NC(=O)C(=O)NCc2ccccc2O)ccn1 1340169449 FKQKXTUZDKNXFY-UHFFFAOYSA-N 342.355 0.744 10 20 ECCD C[C@H](NS(=O)(=O)CC1CNC1)c1ccc(N2CCOCC2)cc1 1576250347 FZICXWQDUWHTSP-ZDUSSCGKSA-N 339.461 0.723 10 20 ECCD COCCCS(=O)(=O)NCCN(C)c1ccc2c(c1)OCO2 270127589 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333.344 0.323 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccnn2C)cc1 785425475 ZXJJFNNSPPDIGZ-UHFFFAOYSA-N 329.404 0.461 10 20 ECCD Cc1ncc(C)c(N2CC=C(CCNC(=O)[C@H](C)NC(N)=O)CC2)n1 1089827310 HTTFIKYVLWTWCS-LBPRGKRZSA-N 346.435 0.793 10 20 ECCD CSCCC(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089804656 RMXYCHJHBYRQKF-UHFFFAOYSA-N 347.448 0.915 10 20 ECCD CC(=O)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1O 991151789 PWXKIERJKVZPNE-QWHCGFSZSA-N 333.348 0.561 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)C3CC(OC)C3)C2)cc(OC)n1 996379353 QJLBVNQYEXXOJN-UHFFFAOYSA-N 349.387 0.464 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCc2nnnn2C2CC2)cc1 1321365472 XVDBDNDOFRZXDY-UHFFFAOYSA-N 343.391 0.007 10 20 ECCD CCOc1ccc(N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 1333038991 UDLKHYFPMJPAMM-LBPRGKRZSA-N 326.418 0.825 10 20 ECCD CCN(CCC(=O)NC)C(=O)C(=O)NCc1ccc(N(C)C)cc1 1332583247 XIUKVNVXFRMAFK-UHFFFAOYSA-N 334.420 0.353 10 20 ECCD CNS(=O)(=O)C1CCN(Cc2cc3c(cc2O)OCO3)CC1 271198287 RZUJBELHCAPULF-UHFFFAOYSA-N 328.390 0.635 10 20 ECCD 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0.914 10 20 ECCD CC(C)[C@H](CO)ONC(=O)c1cc(NS(C)(=O)=O)ccc1O 857286674 GABURYZYJRCLJG-LBPRGKRZSA-N 332.378 0.442 10 20 ECCD COC(=O)COCC(=O)NCc1ccc(N2CCC(O)CC2)cc1 856213411 KWVNFXHAMZQZEU-UHFFFAOYSA-N 336.388 0.454 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@H](O)C3)cc2)C1 853464876 XJZJVPODVWPESS-IIAWOOMASA-N 346.431 0.711 10 20 ECCD O=C1N[C@@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 858625880 FPYUGOUWUOTPPM-CYBMUJFWSA-N 337.351 0.777 10 20 ECCD NC(=O)CN1CCC[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1023770324 WQKSRJSAPNBPDP-LLVKDONJSA-N 346.391 0.776 10 20 ECCD COc1ccc(N2CCN(C(=O)CN(C)C(C)=O)CC2)c(OC)c1 870163993 LEJLDAPUPAWFRO-UHFFFAOYSA-N 335.404 0.831 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CCO1 774191820 XYKKCZRZOXQKDJ-JTQLQIEISA-N 329.447 0.989 10 20 ECCD CN1C[C@@H](C(=O)NCCC2=CCN(c3nccnc3F)CC2)NC1=O 1089855654 MZLGUQIRIYGXCJ-LBPRGKRZSA-N 348.382 0.282 10 20 ECCD N[C@H]1C[C@H](CNC(=O)C(=O)NCCCSc2nccs2)C1 1333942516 ZZWMZVAIBVKKBG-MGCOHNPYSA-N 328.463 0.595 10 20 ECCD Nc1nnc(CC(=O)NCc2ccc(N3CCOCC3)cc2)s1 1346217653 FESLGMMJWPOXOJ-UHFFFAOYSA-N 333.417 0.816 10 20 ECCD O=C(O)C1=NO[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 1594889956 OMGBIEPEBMTNNY-OAHLLOKOSA-N 347.371 0.493 10 20 ECCD CCN(CCS(C)(=O)=O)CC(=O)NCc1ccc(N(C)C)cc1 154122203 UUGIPMBHWIHVEI-UHFFFAOYSA-N 341.477 0.735 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)C(=O)c1cnn(C)c1 819696670 ZJXYBGVKNFQGNM-UHFFFAOYSA-N 345.355 0.900 10 20 ECCD NCCC(=O)NC[C@@H]1CCCCN1Cc1cc2c(cc1O)OCO2 843122829 VNQHJYBXHGSQQA-ZDUSSCGKSA-N 335.404 0.940 10 20 ECCD Cc1cc(CN2CCS(=O)(=O)C[C@@H]2C(=O)O)ccc1N(C)C 923248983 ISTPOBMYQAUTMF-CQSZACIVSA-N 326.418 0.745 10 20 ECCD CNC[C@H](C)NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 851655095 LUCJCVGMBBDYST-ZFWWWQNUSA-N 347.463 0.795 10 20 ECCD CCN(CCN)C(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 863750102 BBYWPTLIVLMJEC-UHFFFAOYSA-N 348.447 0.289 10 20 ECCD Cc1ccc(C(=O)NC2CCN(S(C)(=O)=O)CC2)c(O)c1O 780859032 FEWWFDRADUZRAC-UHFFFAOYSA-N 328.390 0.560 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)C3(C(N)=O)CC3)CC2)nn1 1089862548 VQFJNRFETNPGQO-UHFFFAOYSA-N 329.404 0.693 10 20 ECCD O=C(NCCC1=CCN(c2cnc(F)cn2)CC1)C(=O)NCC1CC1 1089840219 IWVWVOSCNQRLBO-UHFFFAOYSA-N 347.394 0.785 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)C[C@H]3CCNC3=O)CC2)nn1 1089844944 LRTUSIAZLYITBU-OAHLLOKOSA-N 343.431 0.954 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H](n3cncn3)C2)cc1 1325392379 OEXPXKRYLZEOJO-HNNXBMFYSA-N 342.403 0.434 10 20 ECCD COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)CN)CCCC1 1341382917 LSWIQHMTLXUXCW-GFCCVEGCSA-N 331.416 0.965 10 20 ECCD CC(=O)C(=O)COC(=O)c1cnc(C(F)(F)F)c(-c2nn[nH]n2)c1 1588782414 ULRNMYULDZUULY-UHFFFAOYSA-N 343.221 0.595 10 20 ECCD O=C1NC(=S)NC(=O)C1=CNc1ccc(-c2nn[nH]n2)c(Cl)c1 1593402513 IRKVAHXIKBFHEO-UHFFFAOYSA-N 349.763 0.347 10 20 ECCD O=C(O)[C@H]1CS(=O)(=O)CCN1Cc1cc(Cl)c(F)cc1O 1594962269 QQBSHWZUXDMMEF-SNVBAGLBSA-N 337.756 0.868 10 20 ECCD C[C@H]1C(=O)NCCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 189269439 ZEMUKDPCUCCFNN-AWEZNQCLSA-N 332.448 0.921 10 20 ECCD Cc1ccn(C[C@](C)(O)C(=O)NCCc2ccc(O)c(O)c2)c(=O)c1 279773624 GSEOAQOROHYFAZ-SFHVURJKSA-N 346.383 0.678 10 20 ECCD C[C@@H](C[S@@](C)=O)NC(=O)C(=O)NCCCSc1nccs1 806281691 GVPQQKPWSOSERM-JLTPVHFHSA-N 349.503 0.625 10 20 ECCD COc1ccc(O)c(CNC(=O)NC2CC(NS(C)(=O)=O)C2)c1 802160770 KPVIZXFNPNLSAE-UHFFFAOYSA-N 343.405 0.280 10 20 ECCD CN1C(=O)C(=Cc2ccc(-c3nn[nH]n3)cc2F)C(=O)N(C)C1=O 821618997 DWOBMRJIJWDKHC-UHFFFAOYSA-N 330.279 0.440 10 20 ECCD COc1ccc(N2CCN(C(=O)N[C@@H]3COC(=O)C3)CC2)c(OC)c1 923754359 HDBKVHBWQCQTIF-LBPRGKRZSA-N 349.387 0.851 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)C(=O)N[C@H]2CCOC2)N(C)C)cc1 929988960 PBVQVCFWOVOIRP-HOCLYGCPSA-N 348.447 0.377 10 20 ECCD Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC(=O)NCCO)c1 860085634 PJDWLHBRDBCBEH-UHFFFAOYSA-N 343.383 0.745 10 20 ECCD Cc1ccc(O)c(CNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c1 862760955 ZPAQEQYJTRWELE-UHFFFAOYSA-N 347.396 0.814 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccon3)C2)cc(OC)n1 941653959 OECNJMGRMQOSJE-LLVKDONJSA-N 346.343 0.731 10 20 ECCD Cc1ccc(CNCCN2CCN(S(C)(=O)=O)CC2)c(O)c1 877019058 FLSXZWDECGNZRB-UHFFFAOYSA-N 327.450 0.367 10 20 ECCD C[C@H]1CN(C)[C@H](C)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 770160764 CEVJALXEUAXDQE-MNOVXSKESA-N 341.433 0.928 10 20 ECCD C[C@@H](O)[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 774188484 NDVVIBRYSGGTJN-MNOVXSKESA-N 343.474 0.971 10 20 ECCD O=C(N[C@H]1C[C@H]2C[C@@H](C(=O)O)C[C@@H]12)C(=O)N1Cc2cccc(O)c2C1 1608492659 OCCWETKLSJLOOK-BYNQJWBRSA-N 344.367 0.850 10 20 ECCD Cc1ccc(C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)c(O)c1O 1607730860 OYENHZORKYLJNP-NSHDSACASA-N 338.360 0.752 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CCN)C(F)F)c1 1579347383 AGODWJMXJUEEPE-VIFPVBQESA-N 337.348 0.476 10 20 ECCD COc1ccc(N2CC[C@@H](NC(=O)Cn3cc(C(=O)O)nn3)C2)cc1 1599585211 BPWBWLPOUCKFCT-LLVKDONJSA-N 345.359 0.380 10 20 ECCD C[C@@H](/C=C\C(=O)O)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1592207260 ZJPFPESTFYRPPH-LBLVLHIFSA-N 328.346 0.523 10 20 ECCD C[C@H](NC(=O)[C@H](C)NC(=O)NCc1ccc(N(C)C)cc1)C(=O)O 1599896941 BVGKYVYZIFHPQY-QWRGUYRKSA-N 336.392 0.530 10 20 ECCD CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)(C)C(=O)O 1598078787 HOFRANSEGFSGRA-UHFFFAOYSA-N 330.362 0.699 10 20 ECCD CN(C)c1ccc(CNC(=O)c2cc(S(N)(=O)=O)cn2C)cc1 21400053 XDWYWUIIECROBU-UHFFFAOYSA-N 336.417 0.669 10 20 ECCD CC(=O)c1cc(F)cc(CN2CCN(S(C)(=O)=O)CC2)c1O 171142099 HDXSZKFCXBTQOG-UHFFFAOYSA-N 330.381 0.811 10 20 ECCD Cn1cc(N2CC[C@H](NC(=O)/C=C/c3ccc(O)c(O)c3)C2=O)cn1 367897977 AAYBNAKVXBJEHC-LQPUYASZSA-N 342.355 0.766 10 20 ECCD Cc1nn(CC(=O)N2CCOc3cc(N(C)C)ccc32)c(=O)n1C 653672168 FPJCTUIYIXOURI-UHFFFAOYSA-N 331.376 0.382 10 20 ECCD CN1CCO[C@@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1=O 900026694 NGEYQWYVSAYFSE-MRXNPFEDSA-N 347.415 0.339 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCCNC1 842223706 OCWNRNMSGXJDGO-OAHLLOKOSA-N 332.448 0.969 10 20 ECCD COc1cccc(CNS(=O)(=O)c2cnn3c2OCCC3)c1O 849377476 YSUVVOCSIRSCOO-UHFFFAOYSA-N 339.373 0.858 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)N1C[C@@H]2CNC[C@@H]2C1 842092146 JUBQWBSOKRRUSB-PHIMTYICSA-N 340.474 0.419 10 20 ECCD CCNC(=O)[C@@H](C)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851946847 PZLNLXINMPJGPD-CYBMUJFWSA-N 348.447 0.972 10 20 ECCD CC1(C)OC[C@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)O1 769213138 AHRAICWQXLDKKD-JTQLQIEISA-N 344.389 0.645 10 20 ECCD COc1ccc(-n2nnnc2CN2CCO[C@@H](CNC(C)=O)C2)cc1 1035262069 PGPQOAVOOPMRQE-HNNXBMFYSA-N 346.391 0.008 10 20 ECCD COc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cn1 774355922 FLYBOSJGHYHQDO-UHFFFAOYSA-N 331.328 0.799 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)[C@@H]2CCc3nnn(C)c3C2)cc1 876506113 FFEHORGCDNNVMD-HIFRSBDPSA-N 342.447 0.802 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)NC(C)(CO)CO)N(C)C)cc1 899101589 IZBNWAAGGCTKJO-OAHLLOKOSA-N 338.452 0.398 10 20 ECCD CCOCCOC[C@@H](O)CNC(=O)/C=C/c1ccc(O)c(O)c1 792043074 AXTMFVZUULXSOO-BPJJOFIESA-N 325.361 0.641 10 20 ECCD Nc1ccc(CNC(=O)N2CCN(CC(=O)N3CCCC3)CC2)cc1 1337079248 ZUCGHWFAFFHXFM-UHFFFAOYSA-N 345.447 0.718 10 20 ECCD CCON(C)C(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1334667829 MJSAEDZQONGQDZ-UHFFFAOYSA-N 334.420 0.465 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)Cn2cc(C(=O)O)nn2)cc1 1607268525 ZKXUVRDNHUURSF-UHFFFAOYSA-N 347.375 0.580 10 20 ECCD COc1ccc(CNC(=O)c2ccc(-c3nn[nH]n3)nc2)c(O)c1 1605280053 GTCISDZFVROSEF-UHFFFAOYSA-N 326.316 0.906 10 20 ECCD O=C(O)c1c[nH]nc1S(=O)(=O)NCc1cc(Cl)ccc1O 1602506550 CTAOYUVCCRQIDP-UHFFFAOYSA-N 331.737 0.945 10 20 ECCD CN1CCN(c2ccc(CN[C@@](C)(CO)C(=O)O)cc2F)CC1 1598624617 PKWJFLIZRNSFIQ-INIZCTEOSA-N 325.384 0.503 10 20 ECCD COc1ccc(O)c(CN2CCN([C@H]3CCS(=O)(=O)C3)CC2)c1 179607326 NPVSIBOFTIGOQU-AWEZNQCLSA-N 340.445 0.706 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC(=O)N(C4CC4)C3)nc12 279177734 RJVLCFQEOFRDEL-UHFFFAOYSA-N 345.359 0.376 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@@H]3CO)nc12 298774203 UYVXWUSXSMEKJS-GFCCVEGCSA-N 334.376 0.958 10 20 ECCD C[C@H]1CCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1CO 297975219 QFVVIRMIVOXXMF-XJKSGUPXSA-N 333.432 0.940 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H]3COCCO3)CC2)cc1 299511390 SRJWYTMBFHBIPF-KRWDZBQOSA-N 349.431 0.349 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1CC[C@@H](CO)C1 817861738 LCZTUFVDJYUFRG-HUUCEWRRSA-N 347.459 0.949 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCSCC(=O)O)c1 738164268 QTJWYLWSZMAULR-UHFFFAOYSA-N 348.402 0.311 10 20 ECCD CN(Cc1ccccc1O)C(=O)N[C@H]1CCN(S(C)(=O)=O)C1 845416978 ADEQKGWXSCYZSM-LBPRGKRZSA-N 327.406 0.568 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(C(=O)[C@@H](C)OC)C2)cc(OC)n1 938308505 RWLFDBWUNPMVAZ-PWSUYJOCSA-N 337.376 0.464 10 20 ECCD COC(=O)C[C@H]1C(=O)NCCN1Cc1cc(F)c(N(C)C)cc1F 862213903 YBDGNMMNCNQKMW-AWEZNQCLSA-N 341.358 0.894 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@](O)(CC)C3)nc12 778391597 KWGNYJKLTVUBLX-INIZCTEOSA-N 334.376 0.958 10 20 ECCD COCCO[C@H]1COCC[C@@H]1NC(=O)c1ccc(C)c(O)c1O 777394732 NUVWQPULKHGIPA-STQMWFEESA-N 325.361 0.957 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3cc(O)n(C)n3)cc2)CC1 881853508 YTRKGXKHKOFJHF-UHFFFAOYSA-N 329.404 0.808 10 20 ECCD COc1ccc(CNCCNC(=O)[C@@H](C)CS(C)(=O)=O)cc1C 1152619169 XYJXYGSBSYEKSV-ZDUSSCGKSA-N 342.461 0.890 10 20 ECCD CN1C[C@H](C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)CC1=O 1089868087 ZKQPYZVLNJRZNB-CYBMUJFWSA-N 347.394 0.737 10 20 ECCD COC[C@@H](C)NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1329031409 OQRVUUUUAAFCAB-KGLIPLIRSA-N 349.431 0.852 10 20 ECCD NC(=O)NC1(C(=O)N(CC(=O)O)Cc2cc(Cl)ccc2O)CC1 1601158202 MDZIQPMLKAOZJB-UHFFFAOYSA-N 341.751 0.660 10 20 ECCD C[C@@H](NC[C@H](O)c1ccnn1C)c1cccc(-c2nn[nH]n2)c1O 1589980173 YWPCFJBUVKAQCO-RNCFNFMXSA-N 329.364 0.690 10 20 ECCD COc1ccc(CCNC=C2C(=O)NC(=S)NC2=O)cc1OC 60862431 RZGXXHHAPNMVMI-UHFFFAOYSA-N 335.385 0.251 10 20 ECCD CC[C@H](CNS(C)(=O)=O)NC(=O)NCc1ccc(N(C)C)cc1 296199709 HVCNFTBVMJTXHP-CYBMUJFWSA-N 342.465 0.880 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCN(CC)C(=O)C1 298689914 NBIMHFODTKDJHC-UHFFFAOYSA-N 347.415 0.822 10 20 ECCD CN(Cc1ccccc1O)C(=O)CNS(=O)(=O)c1cccnc1 810156743 RZIZUUMSLUWXNH-UHFFFAOYSA-N 335.385 0.724 10 20 ECCD NC(=O)NCCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918673792 QYVJBUNTERTUSO-ZDUSSCGKSA-N 347.419 0.063 10 20 ECCD COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2CCN(S(C)(=O)=O)C2)c1 846185753 DDBLUAWOJOAOQZ-PWSUYJOCSA-N 342.417 0.863 10 20 ECCD COCC1(S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)CC1 842784996 JTNSMVRWUYFMIO-CQSZACIVSA-N 327.450 0.851 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)NC[C@H]2COC3(CCCC3)O2)cc1 842145583 SKVUDLMCCXAAOD-HNNXBMFYSA-N 347.415 0.729 10 20 ECCD O=C(C[C@H]1CCC(=O)N1)NCc1ccc(N2CCC(O)CC2)cc1 856210661 LRIWXYIKQDCVFG-CQSZACIVSA-N 331.416 0.933 10 20 ECCD O=C(NCc1ccccc1O)[C@H](O)[C@@H](O)c1nc2ccccc2[nH]1 779815429 PZLFCGKXVQFIGM-HUUCEWRRSA-N 327.340 0.979 10 20 ECCD CCS(=O)(=O)C[C@H](C)NC(=O)C(=O)N(C)Cc1ccccc1O 1117380710 XKOQANRTXRTCPI-NSHDSACASA-N 342.417 0.290 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3COC[C@@H]3O)C2)cc1 875679719 QIOXYMHDANHNOQ-MAZHCROVSA-N 335.404 0.580 10 20 ECCD COCCN1C[C@@H](C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CC1=O 773763341 TZRJBOOMSQOUDK-AAEUAGOBSA-N 336.388 0.640 10 20 ECCD COc1ccc(-n2nnnc2CN2C[C@@H]3C(NC(C)=O)[C@H]3C2)cc1 957993495 XRHADOFAKKCXMO-KBPBESRZSA-N 328.376 0.237 10 20 ECCD C[C@@H](O)CN(C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 774180270 QGKDJFOYCWHEOG-UKRRQHHQSA-N 348.447 0.911 10 20 ECCD CC(C)C(=O)N[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1O 961622042 SPCJBKJZVFSIGE-OLZOCXBDSA-N 347.375 0.807 10 20 ECCD COc1ccc(CN2CCC(NS(C)(=O)=O)CC2)c(O)c1OC 891541147 AQJUBUJKQIDTDE-UHFFFAOYSA-N 344.433 0.923 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@H]3CCCN3C)C2)cc(OC)n1 996369449 XKKYTYAJXHSWJH-CYBMUJFWSA-N 348.403 0.134 10 20 ECCD COc1ccc(N2CCN(C(=O)NCCCON)CC2)cc1F 1337029576 IKJGEYSJDXNQRY-UHFFFAOYSA-N 326.372 0.946 10 20 ECCD C[C@H]1Cn2nc(C(=O)NC[C@@H](N)c3ccc(N(C)C)cc3)cc2CN1 1262553590 FQPTWBRMGQMVIO-BLLLJJGKSA-N 342.447 0.871 10 20 ECCD Nc1c(O)nc(O)nc1C(=O)NCc1c(O)ccc2c1CCCC2 269080392 FTUKUFVZMXPAQW-UHFFFAOYSA-N 330.344 0.984 10 20 ECCD CC(C)[C@H](N)C(=O)NCC(=O)NCc1ccc(N2CCOCC2)cc1 271143600 WZWLCMYTBHIGRO-KRWDZBQOSA-N 348.447 0.239 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)NC1CCC2(CC1)NC(=O)NC2=O 286780501 RVWAVMRRDSOBFQ-DUXPYHPUSA-N 345.355 0.748 10 20 ECCD COC(=O)c1cn(CCNC(=O)N(C)Cc2ccccc2O)nn1 287866656 OVYRWVIPGALYSL-UHFFFAOYSA-N 333.348 0.612 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCCNCC2)cc1F 842149426 ZANZGGVTRIKJRT-ZDUSSCGKSA-N 336.411 0.766 10 20 ECCD CNS(=O)(=O)c1cc(C(=O)NCc2cc(OC)ccc2O)co1 756003221 WXBLUPHFEAQPJD-UHFFFAOYSA-N 340.357 0.832 10 20 ECCD NC(=O)c1cnn2c(C(=O)NCCc3ccc(O)c(O)c3)ccnc12 764848004 BGULHCZBGXKISE-UHFFFAOYSA-N 341.327 0.212 10 20 ECCD NC(=O)CC(=O)N1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 941155397 YAQPNDGBPWRLOU-LLVKDONJSA-N 346.347 0.055 10 20 ECCD NC(=O)C1=NO[C@H](CNCc2c(O)cccc2Br)C1 1118804704 OVQMFKBZAROGOT-ZETCQYMHSA-N 328.166 0.875 10 20 ECCD Cn1nnc2cc(C(=O)OCC(=O)c3ccc(O)c(O)c3)cnc21 784688016 QJTRQAZPJCGZMD-UHFFFAOYSA-N 328.284 0.814 10 20 ECCD O=S1(=O)CCC[C@@H](CS(=O)(=O)NCc2ccccc2O)C1 1327398829 KVFUTEBJRQQUQV-LLVKDONJSA-N 333.431 0.636 10 20 ECCD O=C(Cn1ncnn1)NCc1ccc(N2CCC(CO)CC2)cc1 1346540811 NHQQVTDHDGAAOF-UHFFFAOYSA-N 330.392 0.198 10 20 ECCD COc1cc(O)c(CN(CCNC(C)=O)[C@@H](C)C(=O)O)cc1OC 1604732260 VNEPOVSILHFTRD-JTQLQIEISA-N 340.376 0.821 10 20 ECCD O=C(O)CNC(=O)CCNCc1ccc(N2CCOCC2)c(F)c1 1777644560 ZRFSBAOWTOVDBP-UHFFFAOYSA-N 339.367 0.343 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)CN1C(=O)C(=O)N(C)C1=O 282510798 OMJGVZWYVLHGHY-UHFFFAOYSA-N 347.371 0.942 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C3(C(N)=O)CCC3)cc2)CC1 918865140 HQQVYBNYEHSEHD-UHFFFAOYSA-N 330.432 0.710 10 20 ECCD CC[C@H](CN1CCCC1)NC(=O)C(=O)NCCc1ccc(N)cc1 842097583 LWEJJBMNDGKSBK-MRXNPFEDSA-N 332.448 0.918 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N[C@@H]2CCN3CCCC[C@@H]23)cc1 842227216 SQSQHHMONKKAQB-CVEARBPZSA-N 330.432 0.671 10 20 ECCD Cc1ccc([C@@H](C)NCCN2CCN(S(C)(=O)=O)CC2)c(O)c1 756532005 CVHIASXGJSIZEM-CQSZACIVSA-N 341.477 0.928 10 20 ECCD C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nncn1C 765433015 SUEAQBKFZDGKKA-QMMMGPOBSA-N 339.377 0.383 10 20 ECCD CNC(=O)[C@@H]1CN(Cc2ccc(N3CCC(O)CC3)cc2)CCO1 877193277 ZHCMRVCVVJGWEQ-KRWDZBQOSA-N 333.432 0.595 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCN(C=O)CC2)c1 1117721510 RUHVWMURCOUVSY-UHFFFAOYSA-N 341.389 0.068 10 20 ECCD CO[C@]1(C(=O)NCc2ccc(N(C)C)c(F)c2)CCS(=O)(=O)C1 888577083 RZSAYRCKKNLVFW-OAHLLOKOSA-N 344.408 0.712 10 20 ECCD O=C(CCn1cncn1)NCCC1=CCN(c2cc(F)ncn2)CC1 1089805828 GUSTZPYEAQRUGD-UHFFFAOYSA-N 345.382 0.940 10 20 ECCD NCCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1327833968 FVCNRVXGTSRKRH-UHFFFAOYSA-N 348.447 0.119 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCn1cccn1 1321047926 AOSBKTRCXPQLHR-ZDUSSCGKSA-N 347.371 0.975 10 20 ECCD CN1CCN(c2ccc(CNC(=O)N3CCO[C@H](CN)C3)cc2)CC1 1331454976 YXIOVBIQRRZBBY-QGZVFWFLSA-N 347.463 0.308 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@@H]2CCCO2)C1 1846146726 AWIDCWUVWCYTOK-LBPRGKRZSA-N 347.371 0.489 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H]1CCC[C@]12NC(=O)NC2=O 272675933 RDNSPTWSMVHQMQ-DPVXVKIDSA-N 345.355 0.606 10 20 ECCD C[C@@H](C[S@@](C)=O)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 283466545 LHHLFQQEXWWXKC-KPWVOAKYSA-N 325.434 0.252 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCO[C@@H](C(=O)O)C1)c1ccc(N(C)C)cc1 817115192 KXBDVRHJMAQDNO-SMDDNHRTSA-N 349.387 0.242 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@H](C(=O)O)C3)ccc21 817107438 PRFWNHBQUCGFIK-AWEZNQCLSA-N 345.399 0.618 10 20 ECCD O=C(CNC(=O)[C@H]1CCCN1)NCc1ccc(N2CCCC2)cc1 827004719 MLBHCRMQYAZFNE-MRXNPFEDSA-N 330.432 0.771 10 20 ECCD O=C1NCC[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 828156992 XNJVFWRTGKLJEX-MRXNPFEDSA-N 331.416 0.648 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CCCNCC3)ccc21 842149984 JQHQYOASVXHZCG-INIZCTEOSA-N 344.459 0.944 10 20 ECCD COC(=O)[C@H]1C[C@H](O)CN(Cc2ccc(N3CCOCC3)cc2)C1 843435566 VWUSSKFGDPOLDE-RDJZCZTQSA-N 334.416 0.879 10 20 ECCD CNC[C@H](C)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 851690643 ITAZXZYUTBBLLS-AWEZNQCLSA-N 348.447 0.206 10 20 ECCD Cc1ccc(O)c(CNC(=O)C(=O)Nc2cc(N(C)C)ncn2)c1 862024755 GBTPQMRXEKDKKJ-UHFFFAOYSA-N 329.360 0.812 10 20 ECCD CN(C)CC[C@H](N)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1118507246 UFUANDGGXYRHMY-KRWDZBQOSA-N 334.464 0.543 10 20 ECCD C[C@@H](NC(=O)C(=O)NCCS(C)(=O)=O)c1ccc(N(C)C)cc1 788390904 LSTOQFXUJACDOI-LLVKDONJSA-N 341.433 0.091 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2COC(C)(C)O2)cc1 1321920526 FPUVLQWCESJFTF-AWEZNQCLSA-N 335.404 0.637 10 20 ECCD CCOC(=O)[C@@H]1CNCCN1Cc1ccc(N2CCOCC2)cc1 1328401060 QWZAWZLHHXGNIZ-KRWDZBQOSA-N 333.432 0.860 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCCC(=O)N(C)C 1322466898 QTPMZJIZRBGKOH-UHFFFAOYSA-N 348.447 0.662 10 20 ECCD COC(=O)[C@@H]1[C@H](C(=O)O)[C@H]2CC[C@H]1N2C(=O)c1cc(O)cs1 1606363177 CJGMNTHJCTWUED-OYBPUVFXSA-N 325.342 0.931 10 20 ECCD CCN(C(=O)CN(C)Cc1ccccc1O)[C@@H]1CCS(=O)(=O)C1 109770123 PHUZLTATPYGLCQ-CQSZACIVSA-N 340.445 0.860 10 20 ECCD CC(=O)N1CC(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 191882723 MTWUTHKHHHXHOE-UHFFFAOYSA-N 349.406 0.881 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cn(C)c(O)nc1=O 266349952 OWECJWKWDXCPNM-UHFFFAOYSA-N 330.344 0.591 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@@H]2CCCCN2S(C)(=O)=O)c1 734017644 SXPGWRUTXJKVJP-ZDUSSCGKSA-N 342.417 0.831 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C3(C(=O)O)CC3)cc2)C1 844250995 UYKZCWDQYWQPCG-ZDUSSCGKSA-N 345.399 0.869 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)CN(C)S(=O)(=O)N(C)C)c1 845832503 CQVZXCZGYJGVQO-JTQLQIEISA-N 345.421 0.316 10 20 ECCD Cn1ncc2c1CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)C2 857876383 GADYZKQSJAZZNT-UHFFFAOYSA-N 336.373 0.653 10 20 ECCD Cc1ccc(O)c(CNC(=O)c2cc(N3CCNC(=O)C3)ccn2)c1 862756953 BJNMEFPFHJTECQ-UHFFFAOYSA-N 340.383 0.962 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](O)[C@@H](C)C3)nc12 778258365 GYGWHIXOPNVEQM-GWCFXTLKSA-N 334.376 0.814 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@H]3CCO[C@H]3CN)cc2)CC1 1119316149 DARMAERGUFFNNC-IRXDYDNUSA-N 332.448 0.418 10 20 ECCD NS(=O)(=O)[C@@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 779520002 NKIJMBAPKSJLOW-VLWUPBBWSA-N 326.374 0.391 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(C(=O)c3cn[nH]c3)C2)cc(OC)n1 941653942 NRJSJGHPVXGOSO-GFCCVEGCSA-N 345.359 0.466 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)CC(C)(C)O)cc1 1126456610 YHNKMOWEFVWUPN-UHFFFAOYSA-N 348.407 0.038 10 20 ECCD CCS(=O)(=O)NCCCNC(=O)NCc1ccc(OC)cc1O 792904521 MIXPIVYNFOXTCA-UHFFFAOYSA-N 345.421 0.529 10 20 ECCD CCC(=O)NC[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1O 1081143584 CGOIVMWCJZHVQY-WCQYABFASA-N 347.375 0.808 10 20 ECCD O=C(CNC(=O)C1CC1)NCCC1=CCN(c2nccnc2F)CC1 1089814542 GLMCQKLIBPVNBI-UHFFFAOYSA-N 347.394 0.785 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3ncoc3C)C2)cc(OC)n1 996368828 OABLLMPHMLDUSV-UHFFFAOYSA-N 346.343 0.650 10 20 ECCD COC(=O)N1CCC(NC(=O)C(=O)N(C)Cc2ccccc2O)CC1 1326933589 RYLWXQXUBZEWNO-UHFFFAOYSA-N 349.387 0.698 10 20 ECCD CC[C@H](NC)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1843003139 KWJOIWRPFJLTMP-LBPRGKRZSA-N 348.403 0.308 10 20 ECCD O=C(/C=C/c1ccc(N2CCOCC2)cc1)N[C@]1(CO)CCOC1 185267022 JUJQZWDPTKWBGO-PXPSOEEZSA-N 332.400 0.804 10 20 ECCD Cc1ccc(O)c(CN2CCN(C(=O)CN3CCOCC3)CC2)c1 124332031 XZOOOVBUZZXOGP-UHFFFAOYSA-N 333.432 0.677 10 20 ECCD Cc1c(CNC(=O)C(=O)N2CC[C@@H]3CNC[C@@H]32)n(C)c2ccccc12 419712150 SXTPOMYLMJCLQE-DYVFJYSZSA-N 340.427 0.923 10 20 ECCD CC(=O)c1cc(F)cc(CN2CCN(S(N)(=O)=O)CC2)c1O 267085298 SATDQZCBCZBVGR-UHFFFAOYSA-N 331.369 0.055 10 20 ECCD COC(=O)C(C)(C)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 268102976 BNTSCYAWJFSSFD-UHFFFAOYSA-N 344.389 0.693 10 20 ECCD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H](CO)NC(N)=O 270745962 HCOGZOVCKDRPMJ-HNNXBMFYSA-N 334.420 0.665 10 20 ECCD CCOCCONC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289541 YSGPBNNHLNYLLN-UHFFFAOYSA-N 333.388 0.763 10 20 ECCD COc1ccc(N2CCCN(C(=O)[C@@H]3CC(=O)NC(=O)N3)CC2)cc1 822919540 KVGXKUZMGMHMTO-AWEZNQCLSA-N 346.387 0.332 10 20 ECCD CN1CCCc2cc(CNS(=O)(=O)N(C)CCC(=O)O)ccc21 830946376 KSAUHVXHOJAVLY-UHFFFAOYSA-N 341.433 0.810 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1CNCCO1 842278104 YKDCYVWFIDGLGZ-AWEZNQCLSA-N 335.404 0.235 10 20 ECCD COc1ccc(N2CCN(C(=O)C3(NC(N)=O)CC3)CC2)c(OC)c1 870165221 QFQHPPHLRKZVNA-UHFFFAOYSA-N 348.403 0.553 10 20 ECCD COc1ccc(CNC(=O)NCCNC(=O)c2cc[nH]n2)c(O)c1 793042989 PRDLXSALYXYAFG-UHFFFAOYSA-N 333.348 0.353 10 20 ECCD CCOc1ccc(N2CCN(CCN3C(=O)CNC3=O)CC2)cc1 1253832212 VWLXGOVLXKACDQ-UHFFFAOYSA-N 332.404 0.759 10 20 ECCD COC[C@H]1COCCN1C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1332948609 NYKXOTNPZJMMBZ-CJNGLKHVSA-N 349.431 0.804 10 20 ECCD CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)Cc1ncnn1C 1753074545 AIOPHDHBFBZVOD-UHFFFAOYSA-N 344.379 0.839 10 20 ECCD O=C(NCCCn1nc2n(c1=O)CCCC2)c1cccc(O)c1O 274873698 FPXNGWGPTOOUOA-UHFFFAOYSA-N 332.360 0.612 10 20 ECCD COc1cc(N2CCN(S(N)(=O)=O)CC2)cc(OC)c1OC 273612038 OTCJCBSXUGMCBF-UHFFFAOYSA-N 331.394 0.038 10 20 ECCD COc1ccc(CNC(=O)c2cn(C[C@H]3CCCN3)nn2)c(O)c1 832178098 NLXGXCDTMZEHHW-GFCCVEGCSA-N 331.376 0.674 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H]3CC[C@@H](C2)N3)cc1F 842148385 NEGNNVGXGWREJS-KGLIPLIRSA-N 348.422 0.861 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)CCCN2C(=O)CNC2=O)cc1 843296417 CNNMNSSOIKZDLX-CQSZACIVSA-N 347.419 0.201 10 20 ECCD CN(C)CC[C@H](N)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 846673428 TXMFIOQVTVSQBQ-KRWDZBQOSA-N 334.464 0.761 10 20 ECCD C[C@@H]1C[C@@H](CN)CN1C(=O)C(=O)NCCCSc1nccs1 842092880 NGVFOGKSIHGQDH-MNOVXSKESA-N 342.490 0.937 10 20 ECCD CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)NCCc2ccc(N)cc2)O1 841868407 VPMOATDKTOQYSD-GJZGRUSLSA-N 334.420 0.746 10 20 ECCD CN(CC(C)(C)N)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 851686811 UJDXFKNZBIGAGI-UHFFFAOYSA-N 348.447 0.335 10 20 ECCD CC(=O)N1CC2(C1)CN(C(=O)c1ccc(N=NC(N)=O)cc1)CCO2 965405817 HQHHVDQTFYVLMJ-UHFFFAOYSA-N 345.359 0.922 10 20 ECCD CCn1[nH]cnc1=NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1337220666 HNCNGQDKGYMISP-UHFFFAOYSA-N 335.433 0.567 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCc2c[nH]nc2C1 1346338553 LBCOCOJJXHLCPC-ZDUSSCGKSA-N 328.372 0.747 10 20 ECCD CO[C@H](C(=O)O)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1604431714 FLGCTWNHSQTSAC-AWEZNQCLSA-N 349.387 0.104 10 20 ECCD Nc1ccnn1CC(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1601218910 RFDZAPFYKXZTBR-UHFFFAOYSA-N 338.751 0.938 10 20 ECCD COc1ccc(N(C)CCN(C)CCC(=O)N(C)CC(=O)O)cc1 1599583848 FHWAPJNBDKEBAO-UHFFFAOYSA-N 337.420 0.996 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1COCCN1 165416390 NJOHBZIAKZERBI-HNNXBMFYSA-N 337.395 0.391 10 20 ECCD C[C@@H](Cn1cccn1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 55228146 XDFPSMBCCGAURS-JTQLQIEISA-N 338.389 0.779 10 20 ECCD CN(C)c1ccc(CNC(=O)c2ccnc(S(N)(=O)=O)c2)cc1 186791985 CDYHOQYCKWICMY-UHFFFAOYSA-N 334.401 0.725 10 20 ECCD C[C@H](C(=O)N(C)C)S(=O)(=O)N(C)Cc1ccc(N(C)C)cc1 192006153 AVMDTKPKZYUOQW-GFCCVEGCSA-N 327.450 0.991 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)CCS(=O)(=O)N(C)C 521628888 ONMXXMSOQPVHFE-UHFFFAOYSA-N 341.433 0.760 10 20 ECCD COCCN1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 283383380 GQSZONYWIRNKPC-UHFFFAOYSA-N 348.447 0.159 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CCC(=O)N3C)CC2)c(OC)c1 827948512 DAGUPWWJJKZMDN-OAHLLOKOSA-N 347.415 0.973 10 20 ECCD CN(C)C[C@@H]1NC(=O)N(C[C@H](c2ccc(N(C)C)cc2)N(C)C)C1=O 900186317 XHXRAIYOMIPQEC-JKSUJKDBSA-N 347.463 0.837 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCCN(Cc3cnon3)C2)cc(OC)n1 1007795361 ZHXDHMWQBXDJKR-GFCCVEGCSA-N 347.375 0.876 10 20 ECCD CN1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)[C@@H](CN)C1 841757771 AGUBWSQSNHGGJA-INIZCTEOSA-N 331.464 0.853 10 20 ECCD 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1590366320 JKQSKKDFGXAQCB-UHFFFAOYSA-N 328.380 0.710 10 20 ECCD CN1CCN(c2ccc(CN3CC[C@](O)(C(=O)O)C3)cc2F)CC1 1598622499 NMKPXJLCABYQBU-QGZVFWFLSA-N 337.395 0.599 10 20 ECCD CC1(C)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@H]1O 275812567 IZFNJEPARXNRNK-CYBMUJFWSA-N 342.417 0.997 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCN1C(=O)CN(C)C1=O 273229022 WOJJHFWDIDNAMN-LLVKDONJSA-N 349.387 0.819 10 20 ECCD Cc1ccc(O)c(CN2CCn3c(nn(CC(=O)N(C)C)c3=O)C2)c1 276167546 RXCDAOLVIGKEGC-UHFFFAOYSA-N 345.403 0.163 10 20 ECCD C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)[C@@H]1CO 285675084 IZLZWWPCMLBUOR-IAQYHMDHSA-N 337.395 0.737 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CS(=O)(=O)C[C@@H]2C)c1O 290208892 QGZGLUXQVZISKG-WCBMZHEXSA-N 330.362 0.832 10 20 ECCD COCCOC[C@H](O)CN(C)Cc1ccc(N2CCOCC2)cc1 296472164 KBMNAZNQMHDXDP-GOSISDBHSA-N 338.448 0.979 10 20 ECCD C[S@@](=O)CCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 805004634 YWDUGTMARQAJQT-HSZRJFAPSA-N 335.429 0.174 10 20 ECCD CCN(CCCO)C(=O)C(=O)NCCCSc1nccs1 806278616 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328.342 0.791 10 20 ECCD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc[nH]2)cc1 797432837 VCGRRGLYBRGMKM-UHFFFAOYSA-N 331.379 0.087 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)Cc1cn(C)nn1 1330500800 VISPTACVUAGLQH-UHFFFAOYSA-N 344.419 0.464 10 20 ECCD O=C(N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)c1cc(O)cs1 1330736914 JYKMZRQILHRNHE-ZANVPECISA-N 331.415 0.920 10 20 ECCD CCOCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1199270735 NJCNQIQVIAINOE-ZIAGYGMSSA-N 349.391 0.660 10 20 ECCD COCCO[C@@H]1C[C@H](CO)CN(C(=O)NCc2ccc(N)cc2)C1 1357792404 WWIOSTIOTHCJBP-GOEBONIOSA-N 337.420 0.824 10 20 ECCD O=C(NCc1cc(O)ccc1O)c1ccc(-c2nn[nH]n2)c(O)c1 1593122575 LUKGRVBPPLFZFX-UHFFFAOYSA-N 327.300 0.914 10 20 ECCD C[C@H](CC(N)=O)C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1592453030 DOIASQQMKCXHKC-MRVPVSSYSA-N 328.752 0.970 10 20 ECCD CCN(CC)c1ccc(CN2CCN3C(=O)C(=O)NC[C@@H]3C2)cc1 91866945 IHWALNYFXICBDY-MRXNPFEDSA-N 330.432 0.675 10 20 ECCD COCC(=O)N1CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 271081695 YMWRCRRASHDHPI-UHFFFAOYSA-N 339.348 0.907 10 20 ECCD CCN(CCCO)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 287986468 AHOUCSDQFLQELX-UHFFFAOYSA-N 331.416 0.910 10 20 ECCD CN1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1=O 823520090 SDKULXYEEUGGKH-UHFFFAOYSA-N 346.431 0.631 10 20 ECCD COC(=O)CNC(=O)[C@@H]1CCCN1Cc1cc2c(cc1O)OCO2 841892637 PCGXIMICCXHKGJ-NSHDSACASA-N 336.344 0.375 10 20 ECCD C[C@H](C(N)=O)N1CCC(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1004242353 LARUJUACRWJGBB-SNVBAGLBSA-N 346.391 0.917 10 20 ECCD CNCCCNC(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 911270215 JFONUPMATZPYNP-MRXNPFEDSA-N 349.479 0.197 10 20 ECCD N[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C1CC1 842171970 YKDDMUXNKXFCLY-MRXNPFEDSA-N 328.416 0.533 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CN[C@H]3CNCCOC3)cc2)C1 925487950 ZPCOZAXQDCNLBQ-CVEARBPZSA-N 332.448 0.466 10 20 ECCD COC(=O)CNC(=O)CNCc1ccc(N2CCOCC2)c(F)c1 877707209 ZZIBZEHITFBZQB-UHFFFAOYSA-N 339.367 0.041 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)C[C@H]2COCCN2)N(C)C)cc1 1122328522 OBOXIKZJAUEZIN-DOTOQJQBSA-N 334.464 0.850 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)C(F)F)cc1 1122405303 UBTOBAPHYONXTJ-UHFFFAOYSA-N 326.307 0.142 10 20 ECCD Cc1ccc(C(=O)N2CCCC[C@H]2CS(N)(=O)=O)c(O)c1O 780984627 NSAOZERRJCRLAS-JTQLQIEISA-N 328.390 0.689 10 20 ECCD COCC1(C)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 790430789 DSSYAYNSXWHTFC-UHFFFAOYSA-N 328.390 0.872 10 20 ECCD C[C@H](NC(N)=O)C(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089827622 PPENBADRAKLRKD-JTQLQIEISA-N 336.371 0.315 10 20 ECCD O=C1CCC[C@H](C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)N1 1089844387 BBECIIOJFJNOQE-CYBMUJFWSA-N 347.394 0.927 10 20 ECCD CN1CCOC[C@@H]1C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089819595 NDPQNXGDGDHZJB-CQSZACIVSA-N 349.410 0.589 10 20 ECCD CCN1C[C@H](CNC(=O)C(=O)N(C)Cc2ccccc2O)CC1=O 1332828766 ABHKYWSOSTVWJN-LBPRGKRZSA-N 333.388 0.335 10 20 ECCD CC(C)(O)[C@H](N)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1263096597 WQQGNPYYLNDSEF-CQSZACIVSA-N 325.384 0.377 10 20 ECCD COc1ccc(N2CCN(C(=O)C[C@]3(O)CCCNC3)CC2)cc1 1341631698 NSDZWRIGXNRKJB-GOSISDBHSA-N 333.432 0.848 10 20 ECCD Cn1c(O)nc(NCc2cccc(Cl)c2O)c(-c2nn[nH]n2)c1=O 1592544929 DPXILDVCBIZNKV-UHFFFAOYSA-N 349.738 0.637 10 20 ECCD CC(C)C(=O)NCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 55183602 SHNUOSPIPNNYDW-UHFFFAOYSA-N 343.405 0.266 10 20 ECCD C[C@@H](NC(=O)NCC(=O)N(C)C)c1ccc(N2CCOCC2)cc1 65698214 HWIBIHOTUQSYBV-CYBMUJFWSA-N 334.420 0.972 10 20 ECCD COC(=O)C1CCN(S(=O)(=O)NCc2ccccc2O)CC1 269707642 MPUZPQQLKLCNDK-UHFFFAOYSA-N 328.390 0.612 10 20 ECCD COC(=O)CCNC(=O)CN(C)c1cc(OC)c(OC)c(OC)c1 266005650 PVSOYPHKXCBKKZ-UHFFFAOYSA-N 340.376 0.828 10 20 ECCD CN1C[C@@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1=O 267519146 UABJNAGBXIXEST-HNNXBMFYSA-N 346.431 0.895 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCCS(=O)(=O)CC2)c1O 375718829 LTYOZBIZULQNBO-UHFFFAOYSA-N 330.362 0.930 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2nncn2C2CC2)c1 285820991 NTQACMCYLBUSEY-UHFFFAOYSA-N 337.361 0.942 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1nc(C)n(C)n1 815500244 UMKTYZYHFWNFFS-UHFFFAOYSA-N 330.392 0.753 10 20 ECCD CN(C)c1ccc(CN(C(=O)[C@@H]2CC(=O)NC(=O)N2)C2CC2)cc1 821032509 DICJRQAQWAIPCS-AWEZNQCLSA-N 330.388 0.842 10 20 ECCD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832279537 JNBDVBRHKVPIRE-CQSZACIVSA-N 346.391 0.982 10 20 ECCD C[C@@H](N)[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 844220547 HOWGKQPRQKKKBZ-PBHICJAKSA-N 334.464 0.759 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N2CC(=O)N[C@@H]3CCCC[C@@H]32)cc1 842235882 KPPOZTRQTXUERW-CABCVRRESA-N 344.415 0.197 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3[C@H]4CC[C@H]3CNC4)CC2)cc1 852762077 XTIKONHUIFWKJJ-IRXDYDNUSA-N 344.459 0.780 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NCc3n[nH]c(C)n3)C2)cc(OC)n1 1022367407 FFBOFWLROAKJAV-TXEJJXNPSA-N 346.391 0.576 10 20 ECCD C[C@@H](N)CN(C)C(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 863749502 SPZUZMYYARYRPB-UKRRQHHQSA-N 349.431 0.705 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCCCN(CC(N)=O)C2)cc(OC)n1 1034289572 ZHYLTJOWWHGNBY-GFCCVEGCSA-N 336.392 0.168 10 20 ECCD C[C@@H](NC(=O)C1=NN(CCO)C(=O)CC1)c1ccc(N(C)C)cc1 775405673 UGYVGSKLFCDALB-GFCCVEGCSA-N 332.404 0.901 10 20 ECCD COc1ccc(O)c(CNC(=O)CCC[C@@]2(C)NC(=O)NC2=O)c1 772705290 DXNFQVLHBNGZCQ-MRXNPFEDSA-N 335.360 0.785 10 20 ECCD CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)c2c(F)ccc(O)c2O)O1 789997961 QSUIKBKIQUNSOQ-LDYMZIIASA-N 326.324 0.603 10 20 ECCD Cc1nn[nH]c1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 789906060 XOTCYPKCGAOCJV-CYBMUJFWSA-N 342.403 0.745 10 20 ECCD COc1ccc(CN[C@H](C)[C@H]2CN(C(=O)CC(N)=O)CCO2)cc1C 979258226 NYZKICUUOHJRHI-CZUORRHYSA-N 349.431 0.585 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)CCNC(N)=O)CC2)n1 1089836616 ZAAQSEXDVRPRNW-UHFFFAOYSA-N 332.408 0.486 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@]3(C)CNC(=O)C3)CC2)ncn1 1089851426 QIMVJWXVOHIPOW-GOSISDBHSA-N 343.431 0.954 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)NC[C@@H]1CCOC1 1321300660 BBCHWEIBWAGLOA-JTQLQIEISA-N 329.447 0.894 10 20 ECCD COCCO[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 1322920002 PSMATQFXUKUFIW-INIZCTEOSA-N 349.431 0.633 10 20 ECCD Cc1nc2c(n1CCO)CC[C@H](NC(=O)Cc1ccc(N)cc1)C2 1354168522 KEUIYTMZDPRQNC-HNNXBMFYSA-N 328.416 0.982 10 20 ECCD O=C(O)C1=NO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)C1 1608588339 DLCFKAQQTNBEJD-WPTTZPOMSA-N 332.312 0.943 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)[C@H](N)CCC(=O)O)N(C)C)cc1 1598313695 VAWFGXFNLMNVOA-CABCVRRESA-N 336.436 0.664 10 20 ECCD O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NCc1ccccc1O 266534804 KPVQSFWTQRLFFM-RRCSTGOVSA-N 344.367 0.561 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CCC(=O)N1 272218015 KBOLZALVNZUXNI-LLVKDONJSA-N 340.763 0.826 10 20 ECCD COc1ccc(N2CCN(C(=O)CN[C@]3(C)CCOC3=O)CC2)cc1 289618411 RHRNNBCTYLGUNH-GOSISDBHSA-N 347.415 0.639 10 20 ECCD Cc1cnn(C)c1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 285065692 JRJGWRZIGQBIIE-UHFFFAOYSA-N 344.418 0.901 10 20 ECCD CN(C)c1ccc([C@@H](N)CNS(=O)(=O)CC2CCNCC2)cc1 905341558 AAZXXYFFZHNZDM-INIZCTEOSA-N 340.493 0.671 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN(C)C3CC(O)C3)CC2)cc1 759874871 PJSSCWISGGNSNN-DAWZGUTISA-N 349.475 0.633 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@H]2CC(=O)N(c3cnn(C)c3)C2)c1 860243018 ZXQQRUMYCRZQOL-LBPRGKRZSA-N 344.371 0.804 10 20 ECCD CC1(CO)CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 762682756 IEUNXUJMLGCHOC-UHFFFAOYSA-N 342.417 0.998 10 20 ECCD Cc1cc(C(=O)N2CC(=O)N(C)C(=O)C2)c(C)n1-c1ccccn1 773678282 STMNSCDVSGEXJH-UHFFFAOYSA-N 326.356 0.930 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)c2ccon2)cc1 1124201038 QKSDHZVHHUECPX-UHFFFAOYSA-N 343.347 0.179 10 20 ECCD CN1CCN(c2ccc(CN=c3cc[nH]c(C(N)=O)c3)cc2)CC1 882880543 XTAVWVKRQXNORA-UHFFFAOYSA-N 325.416 0.966 10 20 ECCD COc1ccc(N2CCN(S(=O)(=O)N3CCC3)CC2)cc1F 795883391 YUMQEWZDOYFTQG-UHFFFAOYSA-N 329.397 0.907 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@H]3CNC(=O)N3)CC2)ncn1 1089860318 ANALGARJOLVDNV-CYBMUJFWSA-N 330.392 0.109 10 20 ECCD O=C(Cn1cncn1)NCCC1=CCN(c2cc(F)ncn2)CC1 1089832555 YMNFKYGLIYFELZ-UHFFFAOYSA-N 331.355 0.550 10 20 ECCD COC(=O)C[C@H]1CCCN1C(=O)C(=O)N(C)Cc1ccccc1O 1325019212 RMYDKWWPDKSWHV-CYBMUJFWSA-N 334.372 0.905 10 20 ECCD Cc1cc(NC(=O)C2=S=C(S(C)(=O)=O)C=C2)n2ncnc2n1 1459946540 VPGCBCQBJNWSBP-UHFFFAOYSA-N 337.386 0.021 10 20 ECCD CN(C)c1ccc(CNC(=O)NCCC(=O)NCCC(=O)O)cc1 1598318272 UMNXDEOOLJYFOU-UHFFFAOYSA-N 336.392 0.533 10 20 ECCD CCN(CC)c1ccc(CNC(=O)NCCNS(C)(=O)=O)cc1 79968410 WUCMGRLFWZJDGI-UHFFFAOYSA-N 342.465 0.881 10 20 ECCD CN(CCn1cccn1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 285733084 OLFDVHXSMGGYHD-UHFFFAOYSA-N 347.394 0.863 10 20 ECCD CCC(=O)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 283494413 NCKKVOOYGAGXIW-AWEZNQCLSA-N 346.431 0.496 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)CCCN2C(=O)CCC2=O)cc1 832300254 QBGCRYSIPINAHH-HNNXBMFYSA-N 346.431 0.798 10 20 ECCD Cc1nonc1COC(=O)c1cc(NS(C)(=O)=O)ccc1O 837465820 OMLSIRPMHHKCDL-UHFFFAOYSA-N 327.318 0.812 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](NC)C2)cc1 842207198 MZKNAJWJVIWTKC-HNNXBMFYSA-N 332.448 0.969 10 20 ECCD NCC(F)(F)CNC(=O)C(=O)NCCCSc1nccs1 842092016 IUXRFKVZRBIQPC-UHFFFAOYSA-N 338.405 0.452 10 20 ECCD CCn1cc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)nn1 855613073 NTYFVJNDNZPMAZ-UHFFFAOYSA-N 339.377 0.305 10 20 ECCD COC[C@](C)(O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 755008271 YLRMVSBLEAQFSH-SFHVURJKSA-N 336.432 0.909 10 20 ECCD COC(=O)Cn1cc(CCOC(=O)/C=C\c2ccc(O)c(O)c2)nn1 759597359 RFLPBOSNCLTACQ-HYXAFXHYSA-N 347.327 0.661 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(C(=O)[C@H]3CCOC3)C2)cc(OC)n1 938307820 FZMTXYKPZUWJKL-AAEUAGOBSA-N 349.387 0.466 10 20 ECCD O=C(NC1CC1)N[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 760549430 KOLPHQKBBPSEGL-IUODEOHRSA-N 333.388 0.854 10 20 ECCD C[C@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CCS1(=O)=O 762106446 KKKVQFWWGOGZHS-IINYFYTJSA-N 327.402 0.827 10 20 ECCD COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(C)c(=O)n(C)c2)c1 781967828 OXOFSQNNNBOFKH-UHFFFAOYSA-N 345.355 0.663 10 20 ECCD Cc1nnc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)s1 780815080 WHVFZVPVZNZXQS-UHFFFAOYSA-N 342.402 0.854 10 20 ECCD C[C@]1(C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)CNC(=O)C1 1089850603 DRZPCUQBPSGOSD-QGZVFWFLSA-N 347.394 0.785 10 20 ECCD C[C@@H](C(N)=O)N1CC[C@H]1CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1085994734 SRAMXROVFFGSEX-GWCFXTLKSA-N 346.391 0.869 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1=NOC2(CNC2)C1 1578489717 HOPGIDBXYGYWSH-UHFFFAOYSA-N 344.415 0.600 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)NCCN1C(=O)CNC1=O 264983913 FZPOCGJMVUBPOR-UHFFFAOYSA-N 334.376 0.866 10 20 ECCD CN(C)C(=O)Cn1ccc(NC(=O)NCCc2ccc(O)c(O)c2)n1 268631846 WBNBWULTJKSGFD-UHFFFAOYSA-N 347.375 0.747 10 20 ECCD CCOC(=O)CC(C)(C)CC(=O)C(=O)CN1C(=O)CN(C)C1=O 808094777 ZJLIPSZNKZVDAT-UHFFFAOYSA-N 326.349 0.388 10 20 ECCD CC(=O)C(=O)CN1C(=O)c2cc(Br)ccc2S1(=O)=O 808024948 WPEAQHICSNXFHD-UHFFFAOYSA-N 346.158 0.752 10 20 ECCD COc1cccc(CNC(=O)NC2CC(NS(C)(=O)=O)C2)c1O 802422295 RBDMTYSKDJVQJU-UHFFFAOYSA-N 343.405 0.280 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CC[C@@H](N)C3)C2)cc1 818675334 ATCVIZWYYFHQSN-UONOGXRCSA-N 346.431 0.197 10 20 ECCD CCCOCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 920886133 CYOXBDYSLMFJAM-UHFFFAOYSA-N 340.445 0.964 10 20 ECCD CCOC(=O)[C@H](N)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 852894931 ZUGYSYQTJPYFQF-SWLSCSKDSA-N 335.404 0.528 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3C[C@H](C)[C@H](O)C3)CC2)cc1 754097213 MHLFRDJVDLTCCV-VDZJLULYSA-N 349.475 0.491 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)C(=O)NCCCCN)N(C)C)cc1 1120428782 KNEVWJDUODEEFU-INIZCTEOSA-N 349.479 0.327 10 20 ECCD CCOCCONC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788929494 KFDOMAKYGLVWMH-UHFFFAOYSA-N 335.404 0.987 10 20 ECCD C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ncn(C)n1 781397957 QWFWRBJHUQCQLA-MRVPVSSYSA-N 339.377 0.383 10 20 ECCD O=C(CNC(=O)c1ccccn1)OCC(=O)c1ccc(O)c(O)c1 783763974 WYEFCQPURIBJLG-UHFFFAOYSA-N 330.296 0.649 10 20 ECCD COc1ccc(N2CCN(CC(=O)N3CCNCC3)CC2)c(OC)c1 1329374381 BEGRQUHEKRERCI-UHFFFAOYSA-N 348.447 0.258 10 20 ECCD O=C(O)c1cnn2c(O)cc(CN3CCOC[C@H]3[C@H]3CCCO3)nc12 1326511086 XTTDPQVPTDASBV-QWHCGFSZSA-N 348.359 0.513 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)CN3C(=O)CNC3=O)C2)cc1 1348967574 QWJYKBXEPZIFLZ-LBPRGKRZSA-N 346.387 0.190 10 20 ECCD C[C@@H](CNCc1cnnn1C)NC(=O)c1ccc(N=NC(N)=O)cc1 1754297037 BVPWOHFKKDCRIX-JTQLQIEISA-N 344.379 0.886 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2C[C@H]3COC[C@@]3(C(=O)O)C2)c1O 1594048170 MHUIUMPPVIYRQY-BONVTDFDSA-N 338.316 0.842 10 20 ECCD O=C(CCN1C(=O)CCC1=O)NCc1ccc(N2CCOCC2)cc1 54284788 AVBKSUULKYRFJG-UHFFFAOYSA-N 345.399 0.679 10 20 ECCD CNCCN(C)C(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 817915070 HNIJDMWCTLFJAE-OAHLLOKOSA-N 349.431 0.578 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)NC[C@@H]3CNCCO3)C2)cc1 818656506 XWSZCWITMOUZQB-YOEHRIQHSA-N 348.447 0.809 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CCNC(=O)O 737475877 AKECNCVFSKHRGL-UHFFFAOYSA-N 337.376 0.912 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)c2cn(C)c(=O)n2C)cc1 911893362 RBNMVEQLGVPIFO-UHFFFAOYSA-N 332.404 0.941 10 20 ECCD COc1cccc(CNC(=O)C(=O)Nc2ccc(=O)n(C)c2)c1O 1116528903 ZMAVHNBGWSJULF-UHFFFAOYSA-N 331.328 0.354 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCCN(C(=O)C(N)=O)C2)cc1 951860859 QHIJWEBAIXLIAJ-NSHDSACASA-N 346.347 0.055 10 20 ECCD CN1CCC[C@H](OC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 778785780 ZDIRTWAOPMYSBR-LBPRGKRZSA-N 342.373 0.541 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3nc(C)c[nH]3)C2)cc(OC)n1 996378398 IZSVGSMOVBSZQR-UHFFFAOYSA-N 345.359 0.385 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)C(=O)N2CC(F)C2)N(C)C)cc1 1334678920 HJXLNFTUZDISHW-OAHLLOKOSA-N 336.411 0.652 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H](O)C[C@@H]1C(=O)O 1598519454 RAJGBNPSGZPORV-LSDHHAIUSA-N 335.404 0.231 10 20 ECCD CC(=O)N1CCC[C@@](CO)(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1055987494 XFGWAPHKSHRCNH-MRXNPFEDSA-N 347.375 0.952 10 20 ECCD CN1C(=O)C(=CNCCCOC[C@H]2CCCO2)C(=O)N(C)C1=O 52536808 SSHQMDYSRQBJKV-LLVKDONJSA-N 325.365 0.096 10 20 ECCD CC(=O)C(=O)COC(=O)CNS(=O)(=O)c1ccc(C)c(C)c1 808484330 OKVWNYJWFBQOAM-UHFFFAOYSA-N 327.358 0.283 10 20 ECCD Cc1cc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n[nH]1 803661662 JATDFGXSZMYRNM-UHFFFAOYSA-N 333.367 0.856 10 20 ECCD COc1c([N+](=O)[O-])ccc(CNCCCn2cc(CO)nn2)c1O 291705729 ZJABTCONUMQWHK-UHFFFAOYSA-N 337.336 0.573 10 20 ECCD O=C1C[C@@H](N[C@H]2CCc3cccc(O)c32)CN1CCN1CCOCC1 296986347 SCLGMRGAGXSLOM-CVEARBPZSA-N 345.443 0.902 10 20 ECCD CS(C)(=O)=NS(=O)(=O)NCc1ccc(N2CCOCC2)cc1 820787092 HMBFHPRZTUDGNU-UHFFFAOYSA-N 347.462 0.585 10 20 ECCD Cn1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)n(C)c1=O 900337724 LPAHUHUCQFIISY-UHFFFAOYSA-N 330.388 0.490 10 20 ECCD COc1cc(CN2CCN(C(=O)C(=O)NC3CC3)CC2)c(O)cc1C 768438647 DDQMJLPCOSDRQX-UHFFFAOYSA-N 347.415 0.632 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCNC1 861561995 JITAZHUDYVLDOO-CYBMUJFWSA-N 336.411 0.948 10 20 ECCD COC(=O)[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 769933532 CSBDRJGLAAQJJJ-LBPRGKRZSA-N 342.373 0.445 10 20 ECCD C[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N(C)C 874098917 WQNDIKMZDWLRKB-CYBMUJFWSA-N 339.461 0.488 10 20 ECCD CO[C@H]1CN[C@@](C)(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 876726983 SLRROQZWEFDFLD-SJLPKXTDSA-N 333.432 0.906 10 20 ECCD CN1CCN(c2ccc(CNC(=O)CCCCNC(N)=O)cc2)CC1 881849977 YOAZPDMCGQJEMQ-UHFFFAOYSA-N 347.463 0.893 10 20 ECCD Cn1nnc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n1 787441794 NVDYDKLVTOTDEC-CYBMUJFWSA-N 346.391 0.807 10 20 ECCD CCN(CC)c1ccc(CNC(=O)CN2CCN(C)C(=O)C2)cc1 780393958 NXBVSWUJZSCGDB-UHFFFAOYSA-N 332.448 0.923 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCCF)CC2)cc1 798060366 LVDFBRKHDBQTRM-SREVYHEPSA-N 335.379 0.986 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCn1cccn1 793749164 SUBSVEPWBWEWOP-UHFFFAOYSA-N 329.404 0.690 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1C[C@H]2CCCCN2C1=O 1325637738 IPYXSPUVFVFXJD-KGLIPLIRSA-N 345.399 0.620 10 20 ECCD COC(=O)[C@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@H]1C(=O)O 1606431585 VDUISSKSKJJDBO-CVEARBPZSA-N 348.399 0.829 10 20 ECCD CCn1c(-c2sccc2O)nnc1N1CCO[C@@H](C(=O)NC)C1 1520738654 NFKKKBFZURKRFY-SNVBAGLBSA-N 337.405 0.683 10 20 ECCD CCOC(=O)CN(CCC(=O)NCC(=O)O)Cc1ccccc1O 1605539451 OAFXUEFGFMEBQM-UHFFFAOYSA-N 338.360 0.348 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CCC(=O)N3)cc2F)CC1 106829855 PYWRQLPXOOEAEN-HNNXBMFYSA-N 348.422 0.862 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CCNCC3)CC2)cc1 325164265 JIVWTVXGGAKTQW-KRWDZBQOSA-N 334.464 0.083 10 20 ECCD C[C@@H]1CCNC(=O)[C@@H]1NCC(=O)N(C)Cc1ccc(N(C)C)cc1 193568447 SHGDVTBRDKGCAE-CXAGYDPISA-N 332.448 0.825 10 20 ECCD CNC(=O)NC(=O)CN(CC(=O)OC)Cc1cc(Cl)ccc1O 264580207 CGMUSCBHRKLQBL-UHFFFAOYSA-N 343.767 0.476 10 20 ECCD O=C1CNC(=O)N1CCN(Cc1ccccc1O)C[C@H]1CCCO1 264674569 AIKKPBFVGZMJDE-CQSZACIVSA-N 333.388 0.925 10 20 ECCD COC(=O)CC[C@@H](NC(=O)c1ccc(C)c(O)c1O)C(=O)OC 276852364 LCSDYLYUFBXIEB-SNVBAGLBSA-N 325.317 0.631 10 20 ECCD CCCNC(=O)CN1CCC(NC(=O)c2cccc(O)c2O)CC1 274911968 UPRPZEFENPODDI-UHFFFAOYSA-N 335.404 0.818 10 20 ECCD CCN(C)C(=O)CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 288650274 UWZJDNXLTAIDRJ-UHFFFAOYSA-N 344.415 0.274 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCn3cnnc3C2)cc1 283656253 YAERODLWLWBJQS-UHFFFAOYSA-N 328.376 0.003 10 20 ECCD CCNc1nc(NCC)n2c(SCC(=O)N(C)CC)nnc2n1 298767657 CIPFGPDGTIMZGZ-UHFFFAOYSA-N 338.441 0.953 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)NCCC(=O)O)C2)cc1 818657830 LSRHMOAOULAMST-LBPRGKRZSA-N 349.387 0.229 10 20 ECCD C[C@H](NC(=O)C(=O)N1CC[C@H](C(=O)O)C1)c1ccc(N(C)C)cc1 817113202 ACASPMMCNCDOKG-AAEUAGOBSA-N 333.388 0.863 10 20 ECCD Cc1ccc(C(=O)N2CCC(c3nc(=N)n(C)[nH]3)CC2)c(O)c1O 834860730 HYIHPRMEIPQPTD-UHFFFAOYSA-N 331.376 0.967 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN[C@H](C)C1 842153943 QUVJPYTVUIUHMI-HIFRSBDPSA-N 332.448 0.934 10 20 ECCD COCCCS(=O)(=O)NCc1nc(Cc2ccc(N)cc2)no1 843160430 HUAPMSOIVOATPR-UHFFFAOYSA-N 340.405 0.699 10 20 ECCD C[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)[C@H]1CCO 851688307 WLZMTMDCEWXMOA-CJNGLKHVSA-N 333.432 0.937 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCN(C)[C@H](C)C3)nc12 761068163 GXIFUUYNTKVDLU-LLVKDONJSA-N 333.392 0.748 10 20 ECCD COc1ccc(N2CCN(C(=O)C(=O)N(C)C3CC3)CC2)c(OC)c1 867339926 CUQOFDZUEYVXKI-UHFFFAOYSA-N 347.415 0.973 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)N3CCOCC3)cc2)CC1 1119374284 VRJJHHASUMNIQN-UHFFFAOYSA-N 346.431 0.930 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C/COC)nc12 786589167 BJYHHLUUXDEHJQ-SNAWJCMRSA-N 335.316 0.857 10 20 ECCD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCCC2)cc1 797431476 PZOOCQRGGJMROT-UHFFFAOYSA-N 334.423 0.315 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)CCn3cnnn3)C2)cc1 1334218232 SZJXRXSHZIPSGZ-ZDUSSCGKSA-N 330.392 0.715 10 20 ECCD Nc1ccc(CNC(=O)NC[C@H](N2CCNCC2)C(F)(F)F)cc1 1335594826 AECFZLRTWVFYFI-ZDUSSCGKSA-N 345.369 0.904 10 20 ECCD COc1ccc(CNC(=O)c2ccc(-c3nn[nH]n3)n2C)c(O)c1 1605280705 YPHNKLBDXDUURZ-UHFFFAOYSA-N 328.332 0.849 10 20 ECCD COc1ccc(CNC(=O)c2cnccc2-c2nn[nH]n2)c(O)c1 1591595686 WHFGDLNIZSUKDH-UHFFFAOYSA-N 326.316 0.906 10 20 ECCD CN(C)c1ccc(CN2CCO[C@H](Cn3cc(C(=O)O)nn3)C2)cc1 1777039671 BDJKFURLVAHYEM-HNNXBMFYSA-N 345.403 0.943 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)Cc1nc(N)nc(N)n1 153229447 XCLFDRXOJSOLLM-UHFFFAOYSA-N 329.408 0.505 10 20 ECCD C[C@H](C[S@@](C)=O)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 273117869 DJDONJJIIHBWKU-ZPWHCFADSA-N 334.419 0.261 10 20 ECCD Cc1ccc(C(=O)NCC2CCN(S(C)(=O)=O)CC2)c(O)c1O 271229615 ASUQHPYHOHHDPP-UHFFFAOYSA-N 342.417 0.808 10 20 ECCD CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)NCCc1ccc(O)c(O)c1 270564393 WDDNHSITJJDNJV-CYBMUJFWSA-N 344.433 0.720 10 20 ECCD C[C@H](O)CCN(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 283947157 HPQKWWNNXNNLFC-AWEZNQCLSA-N 349.431 0.369 10 20 ECCD CC(C)CN1C(=O)/C(=C\NNc2ncncc2F)C(=O)NC1=S 292036985 QYQDOTVUNHAEIA-BAQGIRSFSA-N 338.368 0.315 10 20 ECCD CC(=O)C(=O)CSc1ccc(S(=O)(=O)N2CCOCC2)cn1 808017083 JSWLNFFOSXAISQ-UHFFFAOYSA-N 344.414 0.353 10 20 ECCD C[C@@H](NC(=O)CN1CCNC(=O)C1)c1ccc(N2CCOCC2)cc1 900386628 ALRJRIJNBNLTFE-CQSZACIVSA-N 346.431 0.132 10 20 ECCD CCOC(=O)[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)CC12COC2 833100775 KHQAVFLBQLMZNY-VIFPVBQESA-N 339.319 0.889 10 20 ECCD CC(C)N1CC[C@H](N(C)C(=O)C(=O)NCCc2ccc(N)cc2)C1 842238749 XOTYFNHSSXLYIR-INIZCTEOSA-N 332.448 0.869 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C3(n4cnnn4)CC3)C2)cc1 854981340 OSGFPHKTFLGPEA-ZDUSSCGKSA-N 342.403 0.814 10 20 ECCD CCCCS(=O)(=O)NCC(=O)NCc1cccc(OC)c1O 761967483 NGAZHQQIKRMJOP-UHFFFAOYSA-N 330.406 0.737 10 20 ECCD Cc1cc(S(N)(=O)=O)ccc1CNC(=O)c1cccc(O)c1O 773351147 MRACOWHIKIDDLO-UHFFFAOYSA-N 336.369 0.984 10 20 ECCD COc1ccc(CNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)c(O)c1 794378482 VWKNKQGMFQFGRK-ZDUSSCGKSA-N 344.433 0.981 10 20 ECCD COc1ccc(CNCCNC(=O)[C@H]2COCCN2C(C)=O)cc1C 1151585235 AEHSUFSKQCNVHX-MRXNPFEDSA-N 349.431 0.457 10 20 ECCD CC(C)(C)N1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)CC1 1327543683 AHCSQGSJSXKCLJ-UHFFFAOYSA-N 332.448 0.870 10 20 ECCD CC(C)C(=O)NCCNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1325127822 VQKQNPJDLXAPBM-ZDUSSCGKSA-N 348.447 0.818 10 20 ECCD N[C@H]1C[C@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1333405847 OIEQVJCGPFHMQF-SHTZXODSSA-N 328.416 0.533 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1C[C@H](C(=O)O)C1 1349938396 UXNLVIURZWLYLX-HDJSIYSDSA-N 343.383 0.658 10 20 ECCD Nc1ccc(CC(=O)N[C@H]2CCCN(CCN3CCOCC3)C2)cc1 1262046555 SMXPJDCWSCSXQP-SFHVURJKSA-N 346.475 0.724 10 20 ECCD COC(=O)C1CC2(C1)CN(C(=O)c1cccc(O)c1O)C[C@H]2C(=O)O 1604291291 GTEQKXOFCONRTP-LGNJSRAPSA-N 349.339 0.824 10 20 ECCD C[C@@H](C(=O)NCc1c(O)cccc1F)n1cnc(-c2nn[nH]n2)n1 1588997276 AGZYKSNCGSNVGL-ZETCQYMHSA-N 332.299 0.180 10 20 ECCD CN1CCCc2cc(CNC(=O)NCC(=O)N3CCOCC3)ccc21 179768557 VSIGMBDZHJJQGH-UHFFFAOYSA-N 346.431 0.727 10 20 ECCD COc1cccc(CNC(=O)N[C@H](C)CN2CCN(C)CC2)c1O 74134225 WDQNHJYPHDHWKL-CYBMUJFWSA-N 336.436 0.836 10 20 ECCD CCS(=O)(=O)N1CCC(C(=O)NCCc2ccc(N)cc2)CC1 237027531 XLRRUFLDXGOGCR-UHFFFAOYSA-N 339.461 0.989 10 20 ECCD COC(=O)C1=S=C(NC(=O)c2ccc(-c3ncn(C)n3)cc2)C=C1 355317745 ROZCKCZIENIHCC-UHFFFAOYSA-N 342.380 0.990 10 20 ECCD CCOC(=O)[C@H](C)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 267736313 ARAQNXGZRYTACX-SECBINFHSA-N 344.389 0.693 10 20 ECCD CN(CCS(=O)(=O)N(C)C)Cc1ccc(N2CCOCC2)cc1 286049529 QZSWGNRKZMYMFT-UHFFFAOYSA-N 341.477 0.846 10 20 ECCD O=C(NCc1ccccc1O)[C@H]1CC(=O)N(CCN2CCOCC2)C1 299457430 AZHJFAVJKKVXQM-HNNXBMFYSA-N 347.415 0.189 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC(=O)N[C@@H](C)C1 297691605 CBESBLPHMYBOOR-ZDUSSCGKSA-N 346.431 0.448 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@@H](C)CCN)C2)cc1 818676685 PHHXRWWSLIXBCZ-UONOGXRCSA-N 348.447 0.491 10 20 ECCD CN(C)S(=O)(=O)CCCS(=O)(=O)Nc1ccc(O)cc1F 811695824 MREWXIMWYUZYHC-UHFFFAOYSA-N 340.398 0.555 10 20 ECCD CS(=O)(=O)NCCN(CC(=O)O)Cc1cc(Cl)ccc1O 738165104 LTHBQGXOSQJDCN-UHFFFAOYSA-N 336.797 0.481 10 20 ECCD CC(=O)N[C@@H](C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917832571 AZFLXRKBUOMYCA-SWLSCSKDSA-N 346.431 0.529 10 20 ECCD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CCOC3)CC2)cc1 910051237 NRHANJNIRJHQQQ-AWEZNQCLSA-N 348.399 0.924 10 20 ECCD C[C@H](CN)N(C)C(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 911581010 YASZMEOXUGTKRC-CZUORRHYSA-N 349.479 0.277 10 20 ECCD CN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C1CC(O)C1 1117407258 MNDNAGBENFASLH-UHFFFAOYSA-N 329.400 0.661 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCN(C)C1 1116669714 WPCQBFFDOALXAP-OLZOCXBDSA-N 336.388 0.640 10 20 ECCD CS(=O)(=O)N[C@@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)C1 789957833 XUDDKNFIKNTJLO-MRVPVSSYSA-N 332.353 0.391 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCCNC2=O)N(C)C)cc1 891245221 AGVHVTCNWPOUGE-HZPDHXFCSA-N 332.448 0.998 10 20 ECCD O=C(CCn1cnnn1)NCCC1=CCN(c2cnc(F)cn2)CC1 1089842072 NCXQPRHAJNMJQG-UHFFFAOYSA-N 346.370 0.335 10 20 ECCD COCC(=O)NCCC1=CCN(c2ncnc3c2cnn3C)CC1 1089798238 XFIZUEYFYLILDT-UHFFFAOYSA-N 330.392 0.653 10 20 ECCD CN1CC[C@@H](C(=O)NCCC2=CCN(c3nccnc3F)CC2)C1=O 1089853691 HPMPOKZNOJYKHK-ZDUSSCGKSA-N 347.394 0.737 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCN(CC2CC2)C1 1326456169 DAAKTEPONRPGQC-HNNXBMFYSA-N 331.416 0.951 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1COCCO1 1257292899 XUXJHIBPWSWUAU-INIZCTEOSA-N 345.399 0.211 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cnn(CCO)c1 1348879581 KVPUFIAREJGAQM-UHFFFAOYSA-N 344.415 0.767 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CC(C(=O)O)=NO2)N(C)C)cc1 1604083585 QRHXSGSMRFFYRH-HUUCEWRRSA-N 348.403 0.701 10 20 ECCD O=C(O)C[C@H]1C(=O)NCCN1Cc1ccc(N2CCOCC2)cc1 1608690746 YEJBWFXMQBDBJA-HNNXBMFYSA-N 333.388 0.298 10 20 ECCD C[C@@H](C(=O)N(C)C)S(=O)(=O)NCc1ccc2c(c1)CCCN2C 193877332 AKAXUTNFBFZTTD-LBPRGKRZSA-N 339.461 0.965 10 20 ECCD Nc1ccc(NC(=O)CCN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1 269139839 UZPXTDQSAZXQIC-QHSBEEBCSA-N 329.356 0.760 10 20 ECCD C[C@@H](C[S@@](C)=O)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 273117861 DJDONJJIIHBWKU-FFVOIRBGSA-N 334.419 0.261 10 20 ECCD COc1cccc(CNC(=O)C(F)(F)C(=O)N2CCOCC2)c1O 289516923 AYZWXLWAJYGNLQ-UHFFFAOYSA-N 344.314 0.511 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H](C)C[S@@](C)=O 807099208 NULYYKJDXVHGLD-DAOPMYJZSA-N 339.461 0.560 10 20 ECCD Cn1cc([C@@H]2CN(C(=O)NCCc3ccc(N)cc3)C[C@H]2N)cn1 818655357 IUNMKTVRZZNQIF-JKSUJKDBSA-N 328.420 0.681 10 20 ECCD NC(=O)NC(=O)CCNCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 818968035 ITHQQEILBIBPOS-ZDUSSCGKSA-N 347.419 0.063 10 20 ECCD COc1cccc(CNC(=O)N[C@H]2CS(=O)(=O)C[C@@H]2OC)c1O 821153619 FZASPQRDSQZBNM-JQWIXIFHSA-N 344.389 0.012 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1cnnc1[S@](C)=O 747808585 HRVNLFFNVCNFNS-QHCPKHFHSA-N 335.433 0.740 10 20 ECCD C[C@@]1(CN)CCN(C(=O)C(=O)NCCCSc2nccs2)C1 842093297 QHNYTBWZOKTAFC-AWEZNQCLSA-N 342.490 0.939 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1C[C@@H](O)C1 874097922 OIVGADRJDVVNFL-OTVXOJSOSA-N 338.429 0.309 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CC(NC(=O)c3ncc[nH]3)C2)cc1 991247611 YJTGGZOWSQQHGO-UHFFFAOYSA-N 341.331 0.827 10 20 ECCD O=C(O)C[C@H](CNCc1ccc(N2CCOCC2)c(F)c1)C(=O)O 1332032070 ZWNVXOVDRRRQOH-GFCCVEGCSA-N 340.351 0.927 10 20 ECCD COc1cccc(CNS(=O)(=O)N2CCC(C(=O)O)CC2)c1O 1594129581 OIUDMPSEZDXNFU-UHFFFAOYSA-N 344.389 0.532 10 20 ECCD CN(C)c1ccc(OCC(=O)NCC(=O)N2CCCC2)cc1C(=O)O 1598328725 ZTXMCYLLVFTFEQ-UHFFFAOYSA-N 349.387 0.568 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN2C(=O)NC[C@H]2C1 151865404 PJHLQFDMDFXYIC-INIZCTEOSA-N 341.415 0.982 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)CN(C)S(C)(=O)=O 266383289 XTIZAAJPDJGBIH-UHFFFAOYSA-N 327.406 0.369 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cc2n(n1)CCCC2 288119232 POMFHKTWBLQQQD-UHFFFAOYSA-N 344.371 0.928 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)C2CN(S(C)(=O)=O)C2)c1 901126546 CBPNUFGWLUKXGS-SECBINFHSA-N 328.390 0.469 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)CCCN2C(=O)CCC2=O)cc1 832300255 QBGCRYSIPINAHH-OAHLLOKOSA-N 346.431 0.798 10 20 ECCD C[C@@H]1CNCCN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 842150977 YUXWUALKOFFQOR-CYBMUJFWSA-N 330.432 0.506 10 20 ECCD C[C@@H](N[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1)C(N)=O 1001032204 PUJKOBJDRCKZCK-MFKMUULPSA-N 346.391 0.917 10 20 ECCD COc1ccc(O)c(CNC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2OC)c1 853736852 QNSATBUGXDITII-DGCLKSJQSA-N 344.389 0.012 10 20 ECCD CCN1CCO[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 856211115 GIDVXCXMKCMOIG-SFHVURJKSA-N 347.459 0.985 10 20 ECCD C[C@H](NCCN1CCN(S(C)(=O)=O)CC1)c1c(O)cccc1F 886523185 YIABMJVXOJUAEJ-LBPRGKRZSA-N 345.440 0.759 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3CNC(=O)N3)CC2)ncn1 1089860319 ANALGARJOLVDNV-ZDUSSCGKSA-N 330.392 0.109 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)Cn3cnnc3O)CC2)nn1 1089828011 VYRYBMQYBQBIAG-UHFFFAOYSA-N 343.391 0.425 10 20 ECCD COc1ccc(-n2nnnc2CNC2CC(CNC(C)=O)C2)cc1 1090888950 AKNIWHWYZNVAIU-UHFFFAOYSA-N 330.392 0.675 10 20 ECCD CC(=O)OC[C@@H](C)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1333809851 VBLVGKMJBPKOCD-CYBMUJFWSA-N 340.445 0.963 10 20 ECCD NC1=c2cccnc2=S=C1C(=O)Nc1nc(-c2ccncc2)n[nH]1 1544755821 TWRXANKVVHAERR-UHFFFAOYSA-N 337.368 0.137 10 20 ECCD COc1cccc(CNC2(CC(=O)O)CCS(=O)(=O)CC2)c1O 1599674331 OKSXZQOWLGTGJS-UHFFFAOYSA-N 343.401 0.913 10 20 ECCD C[C@@](CNCc1ccc(N2CC[C@@H](O)C2)cc1)(CC(=O)O)C(=O)O 1776425336 PFEHWIVZEDEEIU-PBHICJAKSA-N 336.388 0.913 10 20 ECCD CN(Cc1ccccc1O)C(=O)NCCOCCS(C)(=O)=O 266792762 MYPZZBFNGGUVMX-UHFFFAOYSA-N 330.406 0.595 10 20 ECCD CN(Cc1ccccc1O)C(=O)CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 266631751 WWTAIKNCLAHISD-XOUADPBQSA-N 344.367 0.513 10 20 ECCD NC(=O)NC(=O)CCNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 267869244 VCGKKSKUJDNXEM-ZZXKWVIFSA-N 346.387 0.238 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2Cc1nc(N)nc(N(C)C)n1 299603853 IQAFTJTZCJLYKZ-UHFFFAOYSA-N 329.408 0.985 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N3)cc2F)CC1 826718889 AZUNKCLACKEBRD-AWEZNQCLSA-N 334.395 0.472 10 20 ECCD CS(=O)(=O)CCS(=O)(=O)NCCCSc1nccs1 742297111 OTTMTBFTTQNSTD-UHFFFAOYSA-N 344.505 0.589 10 20 ECCD C[C@H](N)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 842147075 AAXTXCXPXVHDGW-AAEUAGOBSA-N 336.411 0.704 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C[C@@H](C)N1 842150181 OHAMAELXXMANAJ-OKILXGFUSA-N 344.459 0.894 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N[C@@H]1CCCNC1 842070780 SIHXWHIGJWMALZ-GOEBONIOSA-N 346.475 0.976 10 20 ECCD CN(C)C(=O)CN1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1016368314 OPZQYUSNTPSXBZ-CYBMUJFWSA-N 346.391 0.741 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN(C)[C@H](C)CN)CC2)cc1 923289433 ILYYKYMRSNXHKO-WBVHZDCISA-N 336.480 0.457 10 20 ECCD CN1CCN(CCCS(=O)(=O)NCc2ccc(O)cc2O)CC1 867416401 CZXGELGCHXVCBM-UHFFFAOYSA-N 343.449 0.155 10 20 ECCD COCCN(CCOC)S(=O)(=O)N[C@H](C)c1ccccc1O 867834053 KFOXNITZEWLBSC-GFCCVEGCSA-N 332.422 0.882 10 20 ECCD NS(=O)(=O)C[C@H]1CCCCN1C(=O)/C=C\c1ccc(O)c(O)c1 779534396 FSLQJRFXRQAFOR-SMYYYNMVSA-N 340.401 0.781 10 20 ECCD CCOc1ccc(N2CCN(C(=O)C[C@@H]3CC(=O)NC3=O)CC2)cc1 1262336988 ZRUWZFXWBWFMGH-ZDUSSCGKSA-N 345.399 0.787 10 20 ECCD C[C@@H](O)C(=O)N1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 93706507 RGBTZEHDVYYSEF-SECBINFHSA-N 343.767 0.979 10 20 ECCD CCN1C(=O)C(=CNNc2ccc(OC)cn2)C(=O)N(CC)C1=S 275529720 QGLHCRGUGGETPH-UHFFFAOYSA-N 349.416 0.886 10 20 ECCD CCNC(=O)NOCC(=O)N1CCN(c2ccc(OC)cc2)CC1 823129132 SAMZLHHOWVHQJR-UHFFFAOYSA-N 336.392 0.595 10 20 ECCD COCCNCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 827468981 IKUUVNWMKLOFSY-OAHLLOKOSA-N 348.447 0.241 10 20 ECCD COc1ccc(N2CCN(C(=O)CN(C)CCNC(C)=O)CC2)cc1 830115514 JGQHMEBFYQCABD-UHFFFAOYSA-N 348.447 0.412 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCO[C@H](CN)C1)c1ccc(N(C)C)cc1 842203363 RXAFQSDLCUVSFB-SWLSCSKDSA-N 334.420 0.116 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCCNC1 842214374 QGXBTJJNQOQUEO-OAHLLOKOSA-N 330.432 0.771 10 20 ECCD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCS(=O)(=O)N2)cc1 845234064 VATQHYSDCYEKRM-AWEZNQCLSA-N 325.434 0.841 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNC[C@H](C)OC)CC2)cc1 849326367 HTPIYUDKQHKHMW-DOTOQJQBSA-N 337.464 0.803 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cccnc3=O)CC2)cc1F 753739501 XJRIJOHDUWGSOO-UHFFFAOYSA-N 346.362 0.740 10 20 ECCD COc1ccc(CNC[C@H]2CCN(C(=O)[C@H]3CNC(=O)N3)C2)cc1C 1027030968 ZORJWWCLHYEXAZ-HUUCEWRRSA-N 346.431 0.623 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)C2CCS(=O)(=O)CC2)cc1 1118203509 RPBOETGRAIZQTH-OAHLLOKOSA-N 339.461 0.693 10 20 ECCD COc1ccc(N2CCN(CCCS(N)(=O)=O)CC2)c(OC)c1 879461088 CFVBVTZPSWPIEX-UHFFFAOYSA-N 343.449 0.504 10 20 ECCD COc1ccc(N2CCN(C(=O)C3(C(N)=O)CC3)CC2)c(OC)c1 870164000 LIUPLICCCYWZPA-UHFFFAOYSA-N 333.388 0.618 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cnnn3)CC2)c(OC)c1 870163475 ZKOBTXUHULGUHC-UHFFFAOYSA-N 332.364 0.039 10 20 ECCD CN(C)C(=O)CN1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779488429 FWTKPTMEWIZAMA-GQCTYLIASA-N 333.388 0.343 10 20 ECCD NC(=O)CC(=O)NCCC1=CCN(c2cc(Cl)c(O)nn2)CC1 1089821966 GNKKKJIGAFOJNM-UHFFFAOYSA-N 339.783 0.354 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)CCNC(N)=O)CC2)nc(C)n1 1089834608 FGRMPZKIDXVDMX-UHFFFAOYSA-N 346.435 0.795 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCC(=O)N2CCCC2)cc1 1256886076 NLZADTRHCLBHIN-UHFFFAOYSA-N 332.404 0.107 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3CCCN3)cc2)CC1 1262049535 XUIQTENJFAWNQH-MRXNPFEDSA-N 330.432 0.757 10 20 ECCD CN1CCN(c2ccc(CN[C@@H](CCC(=O)O)C(=O)O)cc2)CC1 1777091193 RBHXOWNSIDDHDF-HNNXBMFYSA-N 335.404 0.846 10 20 ECCD Nc1ccc(CC(=O)N2CCN(CC(=O)N3CCCC3)CC2)cc1 237890748 ZBPCHMNOZAVHJD-UHFFFAOYSA-N 330.432 0.578 10 20 ECCD COc1ccc(N2CCCN(C(=O)[C@@H]3CC[C@H](C(N)=O)O3)CC2)cc1 366347644 ULCBULLFWFXGAX-CVEARBPZSA-N 347.415 0.767 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@](C)(CN)C1 817918047 GQQRAENUNVLFFY-SFHVURJKSA-N 332.448 0.908 10 20 ECCD C[C@@H]1[C@@H](CO)CCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 817275096 VUCHWIDESYGBAB-UKRRQHHQSA-N 333.432 0.988 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNC[C@H](O)C3CC3)CC2)cc1 843072312 WCJYHYMFXIDUMG-MJGOQNOKSA-N 349.475 0.539 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)C3(C(=O)O)CC3)cc2)CC1 844241877 MASDSVJOAPUDRG-UHFFFAOYSA-N 345.399 0.836 10 20 ECCD Nc1ccc(NC(=O)C(=O)N2CCN(C[C@H]3CCCO3)CC2)cc1 841023262 UMCMLSQVQOLCFI-OAHLLOKOSA-N 332.404 0.531 10 20 ECCD CC[C@@H](CN1CCCC1)NC(=O)C(=O)NCCc1ccc(N)cc1 842097579 LWEJJBMNDGKSBK-INIZCTEOSA-N 332.448 0.918 10 20 ECCD CC(C)NS(=O)(=O)NCc1ccc(N2CCC(O)CC2)cc1 851843412 CURMHEOGNHXFSK-UHFFFAOYSA-N 327.450 0.980 10 20 ECCD NC(=O)CN[C@H]1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1034800900 IIMMLWWVSOWVOQ-HAQNSBGRSA-N 346.391 0.965 10 20 ECCD COC[C@H](CO)NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 899103409 LOETWRHBPSEXQQ-HOCLYGCPSA-N 338.452 0.662 10 20 ECCD COc1ccc(CN(C)[C@H]2CCN(S(C)(=O)=O)C2)c(O)c1OC 894583967 DJHKXOQISBNXJP-LBPRGKRZSA-N 344.433 0.875 10 20 ECCD Cn1nncc1CNCCNC(=O)c1ccc(N=NC(N)=O)cc1 1153047879 ORBPIVUQDAYQEJ-UHFFFAOYSA-N 330.352 0.497 10 20 ECCD 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COc1ccc(O)c(CNC(=O)CCN2C(=O)CCNC2=S)c1 847591419 WEVLTJGUCMLPMO-UHFFFAOYSA-N 337.401 0.514 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)Cn3cncn3)CC2)cc1 742920374 OLJMCONOSAEQOR-UHFFFAOYSA-N 344.419 0.225 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NC[C@H]1CCCN1 842070937 VKNQEQVQJJUSDT-GDBMZVCRSA-N 346.475 0.976 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@@H]3CNC[C@H]3C2)cc1 842036752 WRPBARUXAGZCRI-BZUAXINKSA-N 344.459 0.873 10 20 ECCD C[C@@H](C(N)=O)N1CC[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1029013812 IHJDPWNDTBPRQN-QWRGUYRKSA-N 346.391 0.775 10 20 ECCD CN(Cc1ncc[nH]1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 875140634 FBOUAJNMTRVOMH-UHFFFAOYSA-N 333.367 0.890 10 20 ECCD COc1ccc(CN[C@@H]2CCN(S(C)(=O)=O)C2)c(O)c1OC 895148136 QVXXAKBYMVXLPU-LLVKDONJSA-N 330.406 0.533 10 20 ECCD CCOc1cc(N2CC=C(CCNC(=O)c3nc[nH]n3)CC2)ncn1 1089838030 JXXRFABQEFMXAX-UHFFFAOYSA-N 343.391 0.950 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@](O)(C3CC3)C2)cc1 1344852894 WUYSHLKRADWTNP-GOSISDBHSA-N 331.416 0.742 10 20 ECCD C[C@H](N[C@@H]1CC(=O)N(C2CC2)C1)c1cccc(-c2nn[nH]n2)c1O 1589952440 TZSKZXHPDQJTRB-VHSXEESVSA-N 328.376 0.986 10 20 ECCD Cc1ccccc1-n1c(C)cc(C(=O)N(CC(N)=O)CC(N)=O)c1C 113167162 AQQRPMXWBOJYJN-UHFFFAOYSA-N 342.399 0.815 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCCC3(C2)OCCO3)cc1 283498661 NJMGFUPOQPAANU-UHFFFAOYSA-N 347.415 0.734 10 20 ECCD NC(=O)C1=NO[C@H](CNC(=O)NCc2ccc(N3CC=CC3)cc2)C1 297291079 PYPQNOMVUUGRRS-AWEZNQCLSA-N 343.387 0.492 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](C)C[S@](C)=O 807099211 NULYYKJDXVHGLD-SPSFWMDKSA-N 339.461 0.560 10 20 ECCD CN1CCN(CC(=O)NCc2ccc(N(C)C)cc2)C(C)(C)C1=O 298378342 GKIYSLZAISLMKA-UHFFFAOYSA-N 332.448 0.921 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C)[C@@H](C(=O)O)C3)nc12 829889429 AQZAZGZYPOUNMV-SKDRFNHKSA-N 348.359 0.764 10 20 ECCD CS(=O)(=O)Nc1nnc(NC(=O)Cc2ccc(N)cc2)s1 746411204 QXUKKJFEZDUNJM-UHFFFAOYSA-N 327.391 0.673 10 20 ECCD Cc1cc(CN2CCS(=O)(=O)C[C@H]2C(=O)O)ccc1N(C)C 923248975 ISTPOBMYQAUTMF-AWEZNQCLSA-N 326.418 0.745 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNC(=O)[C@H]1CCCN1 843488426 ZERPNGSQWCORPZ-MRXNPFEDSA-N 332.448 0.969 10 20 ECCD COc1ccc(O)c(CNS(=O)(=O)c2ccc(C(N)=O)cc2)c1 751415561 SHGXIRFYRXWHFV-UHFFFAOYSA-N 336.369 0.978 10 20 ECCD COc1ccc(N2CCCN(C(=O)C[C@@H]3CC(=O)NC3=O)CC2)cc1 930309965 PJUVWLVHZAINIV-ZDUSSCGKSA-N 345.399 0.787 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C[C@@H](C)[C@@H](O)C3)CC2)cc1 768772591 ZZRYAEPKEHKXGB-PBHICJAKSA-N 333.432 0.656 10 20 ECCD CC[C@@H](CNS(C)(=O)=O)NC(=O)/C=C\c1ccc(O)c(O)c1 1117846277 KNDYYNNSCANIAD-XOIDGJRKSA-N 328.390 0.555 10 20 ECCD COc1ccc(CN2CCC3(CC2)NC(=O)N(C)C3=O)c(O)c1OC 894472605 UGZUZUVEHMPNIE-UHFFFAOYSA-N 349.387 0.926 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)c2cc(=O)n(C)cn2)N(C)C)cc1 891246999 RHMHZALNEPEYQL-MRXNPFEDSA-N 343.431 0.879 10 20 ECCD CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)c2c(F)ccc(O)c2O)O1 789997856 QSUIKBKIQUNSOQ-GZMMTYOYSA-N 326.324 0.603 10 20 ECCD CN1CCN(c2ccc(CN3CCN(CC(N)=O)CC3)cc2F)CC1 1320509392 PHPJGEXBAGVYHV-UHFFFAOYSA-N 349.454 0.180 10 20 ECCD CN(C)C(=O)CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1325955249 BGMOPKQFIRINDW-UHFFFAOYSA-N 346.431 0.280 10 20 ECCD CON(C)C(=O)CCNCc1ccc(N2CCN(C(C)=O)CC2)cc1 1338537208 WLFUOXUNESQGKR-UHFFFAOYSA-N 348.447 0.855 10 20 ECCD CCCC(=O)NCC1(O)CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1041193591 MGVQYGAVNNFLQI-UHFFFAOYSA-N 347.375 0.952 10 20 ECCD O=C(/C=C/c1ccc(N2CCOCC2)cc1)NCCN1CCOCC1 264629653 LFQHFWHYFKTXHR-ZZXKWVIFSA-N 345.443 0.985 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCCS(=O)(=O)CC2)cc1 368398298 RTYZEWXXGYYFBI-UHFFFAOYSA-N 339.461 0.489 10 20 ECCD CS(=O)(=O)N[C@H]1CCC[C@@H]1CNC(=O)c1cccc(O)c1O 279430455 ZCVGIZCEQAVLHW-KOLCDFICSA-N 328.390 0.546 10 20 ECCD CNS(=O)(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 286626198 ZEHAEQZKEHZRSV-UHFFFAOYSA-N 345.421 0.299 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)N3C[C@@H](O)C[C@H]3CO)C2)cc1 824685263 CDQSZSNURASYOO-BPUTZDHNSA-N 349.431 0.659 10 20 ECCD CCNC(=O)C(C)(C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 837265709 SRCUSRPTFDFSPA-UHFFFAOYSA-N 343.405 0.408 10 20 ECCD COc1ccc(-n2nnnc2CN2CCC[C@H](NC(C)=O)C2)cc1 1006499693 PTANRQPIXBXGMW-ZDUSSCGKSA-N 330.392 0.771 10 20 ECCD C[C@H](CNC(=O)C(=O)NCCCSc1nccs1)C(=O)O 848607755 ICCVOCZPGIUHOV-MRVPVSSYSA-N 331.419 0.578 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](CCN)C2)cc1 842034986 AYRCMSPDHYSNKX-HNNXBMFYSA-N 332.448 0.956 10 20 ECCD COc1ccc(CNC[C@H]2CCCN2C(=O)[C@@H]2CNC(=O)N2)cc1C 1035030085 BVKGLNGMCNKMRW-CABCVRRESA-N 346.431 0.766 10 20 ECCD COC(=O)CN1CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 874063574 AWCIDSZYYXAPLZ-UHFFFAOYSA-N 339.348 0.907 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H](C)NC(N)=O)CC2)c(OC)c1 870162470 IMOBURIHAWPETE-NSHDSACASA-N 336.392 0.409 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1cnccn1 793486053 QQWJXMXOYDELLJ-UHFFFAOYSA-N 341.415 0.860 10 20 ECCD O=C(CCn1cnnn1)NCc1cccc(Br)c1O 1334933265 GLRQRWKRGFRFJQ-UHFFFAOYSA-N 326.154 0.848 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N3C[C@H]4COC[C@H]4C3)ccc21 1336298226 LCKOCKWVCMMDNP-IYBDPMFKSA-N 343.427 0.790 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCO[C@@H]2CN)N(C)C)cc1 1342290721 BTKUZFUHALZOAZ-IXDOHACOSA-N 334.464 0.835 10 20 ECCD CN(C)c1ccc(CN2CCS(=O)(=O)C[C@H]2C(=O)O)cc1F 1610904601 APAVMKDIMDPIOB-ZDUSSCGKSA-N 330.381 0.575 10 20 ECCD CO[C@]1(C(=O)O)CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 1599070475 UUZBBQCAWAXILU-QGZVFWFLSA-N 349.387 0.071 10 20 ECCD CCNc1nc(NCC)n2c(SCC(=O)NOCC)nnc2n1 54148691 AFIHUDVSWWQRRE-UHFFFAOYSA-N 340.413 0.543 10 20 ECCD CS(=O)(=O)N[C@H]1CCC[C@H]1CNC(=O)Cc1ccc(N)cc1 237396512 ZHBNEEXTKFPCRW-JSGCOSHPSA-N 325.434 0.645 10 20 ECCD COc1ccc(N2CCCN(C(=O)CSCC(N)=O)CC2)cc1 372542255 GVNVILCBBKDPED-UHFFFAOYSA-N 337.445 0.952 10 20 ECCD COc1cc(O)c(CN(C)[C@H]2CCN(S(C)(=O)=O)C2)cc1OC 292100992 PCMUIISTLBVYRE-LBPRGKRZSA-N 344.433 0.875 10 20 ECCD O=C1CN(Cc2ccccc2O)C(=O)N1C[C@@H]1CCCS1(=O)=O 819167757 GWGJQYDYRNSLQP-LBPRGKRZSA-N 338.385 0.734 10 20 ECCD CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NCCc1ccc(N)cc1 818545053 CZHLTNWRCZBLJF-OAHLLOKOSA-N 332.404 0.055 10 20 ECCD CC(=O)N[C@@H](CC(=O)NCc1cc(Cl)cc(Cl)c1O)C(N)=O 813685482 IGSNPFAQRZHXHI-JTQLQIEISA-N 348.186 0.695 10 20 ECCD CN1CCN(c2ccc(CNCCN3CCC(O)CC3)cc2)CC1 825110421 FQCYIJTWKVIWDJ-UHFFFAOYSA-N 332.492 0.985 10 20 ECCD CCn1cc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cn1 736680813 WFFFVIYSKOZNHZ-UHFFFAOYSA-N 338.389 0.910 10 20 ECCD O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)c1cc(O)cs1 735326926 RBGQAEOBXHJPSE-UHFFFAOYSA-N 336.373 0.761 10 20 ECCD Cc1cc(C(=O)N2C[C@H]3C(=O)NC(=O)[C@H]3C2)c(C)n1-c1ccccn1 834318476 DTWMAERHYZSQGK-OKILXGFUSA-N 338.367 0.834 10 20 ECCD COc1cc(N2CCN(C[C@@H]3CNC(=O)C3)CC2)cc(OC)c1OC 851936344 LVLXKORPJCKDQK-ZDUSSCGKSA-N 349.431 0.971 10 20 ECCD COc1ccc(CNCCCNC(=O)c2nnc(O)nc2O)cc1C 1161862932 FPXTZKBXGUFELP-UHFFFAOYSA-N 347.375 0.510 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C[C@@H]3CNCCO3)cc2)CC1 1332067392 AMGAHXLLDHZKDU-QGZVFWFLSA-N 332.448 0.433 10 20 ECCD C[C@@H](CO[C@H]1CCOC1)NC(=O)C(=O)N(C)Cc1ccccc1O 1346879463 ZOTNXJIDXAIWIX-JSGCOSHPSA-N 336.388 0.661 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CC[C@@H](C(N)=O)O1 126277270 YYWKKUKBRZVSHH-CABCVRRESA-N 334.420 0.927 10 20 ECCD C[C@H]1CCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1CO 297975207 QFVVIRMIVOXXMF-BBRMVZONSA-N 333.432 0.940 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CC[C@H](N)C3)C2)cc1 818675333 ATCVIZWYYFHQSN-KGLIPLIRSA-N 346.431 0.197 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNC[C@H]3CCN3C)CC2)cc1 905547411 WPCLXBDJMXDIEU-MSOLQXFVSA-N 348.491 0.472 10 20 ECCD COc1ccc(N2CCN(C(=O)CONC(=O)C3CC3)CC2)cc1 842107617 NEFWNDCRNGCKOP-UHFFFAOYSA-N 333.388 0.802 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NCC1(N)CC1 911051029 ZRKBEHORRHOZIR-ZDUSSCGKSA-N 332.448 0.716 10 20 ECCD C[C@H](NC(=O)NCC(=O)N1CCNCC1)c1ccc(N(C)C)cc1 841883231 SUUXXBYTTCTNIG-ZDUSSCGKSA-N 333.436 0.545 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3CCNC[C@@H]3C2)cc1 910990378 CEZBKIXBSPYYMX-LSDHHAIUSA-N 330.432 0.437 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCC2=CCNCC2)cc1F 842148796 PNADPZSKMSKTEK-UHFFFAOYSA-N 348.422 0.934 10 20 ECCD COc1ccc(O)c(CN2CCC(n3cc(C(N)=O)nn3)CC2)c1 862482762 BJZSBOCGQAODOZ-UHFFFAOYSA-N 331.376 0.928 10 20 ECCD CN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CN(CCF)C[C@@H]1O 1047644789 PVGWZYRCSKJKTP-STQMWFEESA-N 337.355 0.936 10 20 ECCD C=CC(=O)N(C)CC(=O)N1CCN(c2ccc(OC)cc2OC)CC1 870166446 OFTLLQZRQYXCJE-UHFFFAOYSA-N 347.415 0.997 10 20 ECCD CC[C@@H](NC(=O)NCc1ccc(N2CCN(C)CC2)cc1)C(N)=O 889662241 AJVVMXJGHBYCAT-OAHLLOKOSA-N 333.436 0.502 10 20 ECCD CCn1[nH]nnc1=NC(=O)N(C)CCN(C)c1ccc(OC)cc1 888322870 OGTXQSRQUGEINQ-UHFFFAOYSA-N 333.396 0.724 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3ccon3)C2)cc(OC)n1 973916915 WMPZDXJPFLCSJP-PHIMTYICSA-N 346.343 0.778 10 20 ECCD Nc1ccc(NC(=O)[C@@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)cc1 1345811352 HBKFHPGQFIAGTH-ZWNOBZJWSA-N 337.401 0.243 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccno2)C1 1842437734 ZIFKKFJVRJGXOW-UHFFFAOYSA-N 344.327 0.612 10 20 ECCD C[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)N(C)C1CC1 69533711 IZJFYYQNBBREML-JTQLQIEISA-N 341.433 0.976 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)NC[C@H]1CC[C@H](C(N)=O)O1 125867361 UKGQPMOLDJFEFL-HUUCEWRRSA-N 334.420 0.893 10 20 ECCD CCN(CC)c1ccc(CNC(=O)N2CCO[C@@H](C(N)=O)C2)cc1 139513335 REXPNLUTLLLRQQ-OAHLLOKOSA-N 334.420 0.929 10 20 ECCD CN1C(=O)C(=O)N(CC(=O)NCc2c(O)ccc3c2CCCC3)C1=O 269093751 XOXCXKZEAVTJSA-UHFFFAOYSA-N 345.355 0.308 10 20 ECCD COc1cccc(CNC(=O)NCCNC(=O)c2ccn[nH]2)c1O 272564225 GZPGRIPINJBMNA-UHFFFAOYSA-N 333.348 0.353 10 20 ECCD COc1ccc(N2CCN(C(=O)COC(=O)C(C)(C)O)CC2)cc1 725933137 OATQIIQIKHTRMZ-UHFFFAOYSA-N 336.388 0.658 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)C3(O)CCC3)nc12 740229001 YPLPSCQOPJKEMR-UHFFFAOYSA-N 335.316 0.570 10 20 ECCD CO[C@@H]1CS(=O)(=O)C[C@@H]1NCc1cc(F)c(N(C)C)cc1F 858188640 HRHXBPGACOEVCH-GXTWGEPZSA-N 334.388 0.932 10 20 ECCD Cc1cc(CNC(=O)[C@H](CO)NC(N)=O)c(C)n1-c1ccccc1 863165447 AENNFRADXCXCHS-HNNXBMFYSA-N 330.388 0.740 10 20 ECCD O=C1N=C(N2CCOCC2)S/C1=C/c1cn(C[C@H]2CCCO2)nn1 865217184 LBOYANGVIGQLMB-FMNNIJNLSA-N 349.416 0.760 10 20 ECCD COc1ccc(CN[C@H]2C[C@H](NC(=O)[C@@H]3CCNC3=O)C2)cc1C 1020468173 UEXMJSSDVXPHQO-RBSFLKMASA-N 331.416 0.877 10 20 ECCD CCN(CC)S(=O)(=O)CC(=O)NCCc1ccc(O)c(O)c1 767779592 QQYBKXNZPYMSEK-UHFFFAOYSA-N 330.406 0.428 10 20 ECCD C[C@@H]1NC(=O)N(Cc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1=O 777609832 FWEUVGLSZLOTQT-AAEUAGOBSA-N 330.388 0.829 10 20 ECCD CN1CCN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CC1 889674669 RFKDOFJPPLXNDU-UHFFFAOYSA-N 331.464 0.895 10 20 ECCD C[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCN1C 785428974 UISRYRUVHBMVLQ-HIFRSBDPSA-N 332.448 0.968 10 20 ECCD CCn1ncnc1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785435379 YFKFKGFQNBCZBM-UHFFFAOYSA-N 330.392 0.297 10 20 ECCD CN(Cc1nncn1C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1327061573 JUDJAFGLYBAARJ-UHFFFAOYSA-N 339.377 0.164 10 20 ECCD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)C(=O)N(C)C 54787268 OMEXAKBOYOKNGL-ZDUSSCGKSA-N 334.420 0.799 10 20 ECCD CC(=O)N1CC(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 188208375 VPYYWDHVYDZRJS-UHFFFAOYSA-N 331.416 0.960 10 20 ECCD O=C1CN(CCNC(=O)NCc2ccc(N3CCCC3)cc2)CCN1 272990155 QAIMAKBBYSOVSX-UHFFFAOYSA-N 345.447 0.518 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)NCc1cccnn1 806280641 HKKMMKPTSCVCQN-UHFFFAOYSA-N 337.430 0.848 10 20 ECCD CC(=O)NCCCNC(=O)C(=O)NCCCSc1nccs1 806276402 OJWJPYSFGMMJHP-UHFFFAOYSA-N 344.462 0.384 10 20 ECCD CN(Cc1ccccc1O)C(=O)Nc1nn(C)cc1-c1nn[nH]n1 821616029 ZSMHEIHLYYZRRO-UHFFFAOYSA-N 328.336 0.970 10 20 ECCD CCOC(=O)CN(CCCN1C(=O)CNC1=O)Cc1ccccc1O 823580924 BCGGTHIBUJSVST-UHFFFAOYSA-N 349.387 0.699 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)Cc3cnc[nH]3)CC2)cc1 900407267 PSVUBKOYDTXLNZ-UHFFFAOYSA-N 343.431 0.899 10 20 ECCD C[C@@H](NC(=O)c1cnn(C[C@@H](O)CO)c1)c1ccc(N(C)C)cc1 832431517 PVNNGFAFJWHKFZ-MLGOLLRUSA-N 332.404 0.793 10 20 ECCD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(C(N)=O)n(C)c1 758773075 HEQDDZZEAVZQSW-UHFFFAOYSA-N 337.357 0.833 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CC[C@@H](N3CCOC3=O)C2)cc1 852435197 JSLXVEPPGPXELQ-MRXNPFEDSA-N 346.431 0.895 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)C(=O)NCC2CC2)N(C)C)cc1 929296310 XOEVMWCDZMUBQD-MRXNPFEDSA-N 332.448 0.998 10 20 ECCD COCCn1cc(S(=O)(=O)NCc2cc(OC)ccc2O)cn1 751414744 DKEDPLNJFYHGFQ-UHFFFAOYSA-N 341.389 0.722 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@H](CO)C1 774191383 WNNJSXKPXGJUET-NSHDSACASA-N 343.474 0.972 10 20 ECCD C[C@@H]1C[C@@H](N)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 884566074 AJFAXQHNHGNSOF-UKRRQHHQSA-N 328.416 0.627 10 20 ECCD CCN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCNC1=O 799770708 HVAGUMRMBFLNGD-NSHDSACASA-N 341.389 0.114 10 20 ECCD CC(=O)N[C@@H](C)C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089799461 JMMGIEQZEWUQDD-NSHDSACASA-N 335.383 0.783 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)N[C@H]2[C@@H]3CNC[C@@H]32)N(C)C)cc1 1336238114 BFGNLQHTSZLCKB-VVLHAWIVSA-N 331.464 0.872 10 20 ECCD COc1cccc(CNS(=O)(=O)c2cc(C(=O)O)no2)c1O 1599672979 CVVYKRWSSUEYSR-UHFFFAOYSA-N 328.302 0.566 10 20 ECCD CNC(=O)CN(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 53148234 ZGWJTADXFXMRJK-UHFFFAOYSA-N 334.420 0.022 10 20 ECCD CN(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1cccc(Cl)c1O 179769170 GNNKJXCESXBABB-NSHDSACASA-N 346.836 0.781 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2CC(=O)N1CCC(C(N)=O)CC1 181133145 GGSMRQSIIWSBKI-UHFFFAOYSA-N 346.431 0.675 10 20 ECCD CCN(CC)c1ccc(CNC(=O)Cn2ccc(=O)n(C)c2=O)cc1 79391011 SBLJCSRSYBCQBO-UHFFFAOYSA-N 344.415 0.710 10 20 ECCD COc1cccc(CN2CCN(C(=O)CN3CCOCC3)CC2)c1O 271029876 GJFMVDZQUHRYFG-UHFFFAOYSA-N 349.431 0.377 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCOC3)CC2)cc1 804698830 SGMXITNJPGSNSA-AWEZNQCLSA-N 347.415 0.639 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)[C@@H]3CCNC3=O)cc2F)CC1 826719865 XNGVEWZWXZBRDK-CQSZACIVSA-N 348.422 0.720 10 20 ECCD CCn1ccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 839811260 IIIORSMPSVPXDH-UHFFFAOYSA-N 338.389 0.910 10 20 ECCD CCN(CC)c1ccc(CNC(=O)CN2CCNC(=O)C2)cc1F 900637167 OLIYWANYUKSEBB-UHFFFAOYSA-N 336.411 0.720 10 20 ECCD C[C@H](O)[C@@H](NC(=O)C1CC1)C(=O)NCc1cc(Cl)ccc1O 846473191 KDHHTCUDZGBTAQ-ISVAXAHUSA-N 326.780 0.937 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CC[C@H]1N 842094002 VRENRYIDTSKFOF-GHMZBOCLSA-N 342.490 0.937 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CNCCO1 842276931 FYKXOOJMUNVWSR-MRXNPFEDSA-N 348.447 0.206 10 20 ECCD C[C@H](NS(=O)(=O)C1COC1)c1ccc(N2CCOCC2)cc1 755073042 VKDHQBLEDNAGSH-LBPRGKRZSA-N 326.418 0.902 10 20 ECCD Cn1cnc(CNC(=O)C(=O)NCCCSc2nccs2)c1 930197097 DNJRETYRVLANPK-UHFFFAOYSA-N 339.446 0.791 10 20 ECCD O=C(NCCCSc1nccs1)C1=NN(CCO)C(=O)CC1 765490836 AUXNEQKWOKKGNF-UHFFFAOYSA-N 342.446 0.712 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCCn2cncn2)cc1F 1119129636 WRRHLWSYBDPHBH-UHFFFAOYSA-N 348.382 0.306 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)N2CCNC(=O)C2)N(C)C)cc1 899103152 WUNFPNIWXSECMZ-HNNXBMFYSA-N 333.436 0.497 10 20 ECCD C[C@H]1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CN1CC(N)=O 1072101679 ITGJJCDUSSIBFD-GWCFXTLKSA-N 346.391 0.917 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)c3cn[nH]c3)CC2)nc(CO)n1 1089815091 RDUMLDOZSOQSKW-UHFFFAOYSA-N 342.403 0.957 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cc[nH]c3C)C2)cc(OC)n1 996367527 DNQKSLXYIVAPLA-UHFFFAOYSA-N 344.371 0.990 10 20 ECCD O=C(NCCC1=CCN(c2ccc3nnnn3n2)CC1)C1CCC1 1089803616 QAFCDVPGDQVMFS-UHFFFAOYSA-N 327.392 0.962 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCN(CC2CC2)CC1 1325630276 DVFYYMDBNOJDQO-UHFFFAOYSA-N 331.416 0.905 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)N3CCC3)cc2)C1 1325777009 WXGVUUJPKNHAAQ-CQSZACIVSA-N 344.415 0.237 10 20 ECCD COC[C@H]1C[C@@H](O)CN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1261521546 YRSUXFPIZJSDPK-HZPDHXFCSA-N 349.431 0.319 10 20 ECCD COc1ccc(N2CCN(C(=O)c3cnn(CCO)c3)CC2)cc1F 1263765441 PPGZBEOLJVCPME-UHFFFAOYSA-N 348.378 0.986 10 20 ECCD O=C(C(=O)N1C[C@@H]2CCC[C@]2(C(=O)O)C1)N1Cc2cccc(O)c2C1 1601223156 FGGGMKRSWZKJJF-SGTLLEGYSA-N 344.367 0.948 10 20 ECCD NC(=O)NCCC(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1601157203 GUUUKXGZOMFTKG-UHFFFAOYSA-N 329.740 0.517 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H](C(=O)O)C[C@@H](O)C1 1598519042 FLBRQQWMDKNSTM-GOEBONIOSA-N 349.431 0.478 10 20 ECCD COCCN1C(=O)/C(=C\NCc2ccccc2OC)C(=O)NC1=S 60862456 FDSASTKAWCQWKJ-BENRWUELSA-N 349.412 0.558 10 20 ECCD CNC(=O)[C@H]1CN(C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 182620261 PSMKDVWNCZUDFP-MRXNPFEDSA-N 346.431 0.725 10 20 ECCD CCOC(=O)[C@@H]1CCCN1S(=O)(=O)NCc1ccccc1O 269661888 BKFTZEOIUBAQKM-LBPRGKRZSA-N 328.390 0.754 10 20 ECCD CS(=O)(=O)N1CCC[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1 272374958 DWTYFKLKHNNZDM-PZBABLGHSA-N 340.401 0.651 10 20 ECCD COc1cc(O)c(CN(C)[C@@H]2CCN(S(C)(=O)=O)C2)cc1OC 292100989 PCMUIISTLBVYRE-GFCCVEGCSA-N 344.433 0.875 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCC(=O)O)cc2)C1 819110941 FGSDSDSLAXAUML-ZDUSSCGKSA-N 348.403 0.662 10 20 ECCD C=CC(=O)NCCC(=O)NCc1ccc(N2CCN(C)CC2)cc1 918856837 DEWXXLOIPMVDTN-UHFFFAOYSA-N 330.432 0.747 10 20 ECCD COCCOCCS(=O)(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 842785454 NOZOFGYLJSAZAH-OAHLLOKOSA-N 345.465 0.335 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ncccn3)nc12 741037399 XHZODVUCYSBQHU-UHFFFAOYSA-N 343.299 0.759 10 20 ECCD CCOC(=O)[C@@H](N)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 852872291 LBRQMPZQLLQWQB-AWEZNQCLSA-N 339.367 0.373 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)NCc2ncn(C)n2)cc1 853006421 FPJWBFQGWAKSIN-UHFFFAOYSA-N 333.348 0.031 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)N1CC(S(C)(=O)=O)C1 853749629 YDMIBNSPPFPDNU-UHFFFAOYSA-N 325.434 0.999 10 20 ECCD CCN(C)C(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1 867434778 BXIHRWJKCBRXAW-UHFFFAOYSA-N 335.404 0.831 10 20 ECCD CN1C(=O)NC2(CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)C1=O 779523438 BORIEHYFODWHMR-HYXAFXHYSA-N 345.355 0.654 10 20 ECCD C[C@H](NC(=O)N(C)CCS(N)(=O)=O)c1ccc(N(C)C)cc1 872977455 YNUOUGUKIZYHOM-NSHDSACASA-N 328.438 0.744 10 20 ECCD CCc1nncn1CCNC(=O)C(=O)NCc1ccc(N(C)C)cc1 1323025817 CQNNIDMGKYOGMC-UHFFFAOYSA-N 344.419 0.339 10 20 ECCD Cn1cc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)cc1C(=O)O 1600968558 PMELUKLBFSEIES-UHFFFAOYSA-N 340.313 0.928 10 20 ECCD COc1ccc(O)c(CNC(=O)[C@H]2CCCN(S(C)(=O)=O)C2)c1 528863779 QAUFRPFSYIEYBA-NSHDSACASA-N 342.417 0.689 10 20 ECCD O=C1[C@@H]2COCCN2C(=O)N1Cc1ccc(N2CCOCC2)c(F)c1 272364544 ZDLRFXXRIUYRIF-HNNXBMFYSA-N 349.362 0.825 10 20 ECCD NC(=O)[C@H]1CC[C@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 816891082 IAARNFJMPWXOPP-QWHCGFSZSA-N 335.379 0.790 10 20 ECCD C[C@]1(C(=O)O)CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 828012646 IMNACARGLVSRBA-AWEZNQCLSA-N 342.373 0.701 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)C[C@H](C)C(=O)O)nc12 737155492 XCUUAEUZGCEJLA-VIFPVBQESA-N 336.348 0.764 10 20 ECCD Nc1ccc(CCNC(=O)C(=O)N[C@@H]2CCN(CC3CC3)C2)cc1 842202604 OUIHKUHGGXIXHX-MRXNPFEDSA-N 330.432 0.528 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CCN(S(C)(=O)=O)C2)c1O 846033714 MMQNWDGSLVUEPV-SNVBAGLBSA-N 345.377 0.433 10 20 ECCD Cn1ncc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1N 856212591 NNEXAKCKGNJLAT-UHFFFAOYSA-N 329.404 0.893 10 20 ECCD Cc1ccc(C(=O)N2CCC[C@@H](NS(C)(=O)=O)C2)c(O)c1O 751533269 MDDXJLBYEPVLGJ-SNVBAGLBSA-N 328.390 0.560 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2C[C@@H]3COC[C@]3(C(=O)O)C2)c1O 854242448 MHUIUMPPVIYRQY-MEBBXXQBSA-N 338.316 0.842 10 20 ECCD COc1cc(C(=O)NC2CN(CCc3cnn(C)c3)C2)cc(OC)n1 1030612186 HLSSAOAVMMLLOQ-UHFFFAOYSA-N 345.403 0.489 10 20 ECCD Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](CO)C(N)=O)cc1 861663642 KYHOTGLYSXMDDO-INIZCTEOSA-N 343.383 0.412 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCSCC1 774178055 OPQNROVKIGBEPR-UHFFFAOYSA-N 349.456 0.715 10 20 ECCD NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 874080887 WPBSYTWMZPVQPU-UHFFFAOYSA-N 331.294 0.644 10 20 ECCD C[C@H](C(N)=O)N1CC[C@@](C)(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1046862576 MFOPZVYFABSJJR-QLJPJBMISA-N 346.391 0.917 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@H](N)C3CC3)cc2)CC1 892051421 RWTFXKVFWSJHKR-KRWDZBQOSA-N 331.464 0.975 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3[C@@H](O)CC[C@H]3C2)cc1 897361237 CDZWNCRRJLEGSH-IMJJTQAJSA-N 331.416 0.598 10 20 ECCD COc1ccc(CNC(=O)c2ccc(S(N)(=O)=O)nc2)c(O)c1 794379547 POTDAZXMTSBVMH-UHFFFAOYSA-N 337.357 0.373 10 20 ECCD COc1ccc(CN[C@@H](C)[C@H]2CN(C(=O)CC(N)=O)CCO2)cc1C 979258230 NYZKICUUOHJRHI-XJKSGUPXSA-N 349.431 0.585 10 20 ECCD CC(=O)N[C@H](C)C(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089799438 IWUQQKYPTRDSIY-LLVKDONJSA-N 335.383 0.783 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H]2COC(=O)N[C@H]2C1 1326528617 BHVFUIHSNNEAAK-OLZOCXBDSA-N 347.371 0.308 10 20 ECCD CO[C@@]1(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCOC1 1261186175 ADPRKYHLOAPMGE-GOSISDBHSA-N 349.431 0.633 10 20 ECCD CN(C(=O)/C=C\c1ccc(O)c(O)c1)N1CCS(=O)(=O)CC1 1349233387 CJJXKTFBXNXJGD-HYXAFXHYSA-N 326.374 0.215 10 20 ECCD O=C(C[C@@]1(O)CCCNC1)NCc1ccc(N2CCC(O)CC2)cc1 1522061411 VYHBSVOTFIDNGN-IBGZPJMESA-N 347.459 0.769 10 20 ECCD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1cc(C(=O)O)[nH]n1 1607667814 UPTNXUMZBUHNCP-UHFFFAOYSA-N 338.389 0.961 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)c3ccn(C)n3)nc12 274804637 BSEPQMPFIBZSHU-UHFFFAOYSA-N 330.348 0.982 10 20 ECCD CN(C[C@@H]1CCC[C@@H]1O)C(=O)c1cc(NS(C)(=O)=O)ccc1O 270056799 BPLIHYJKEZUSQL-GWCFXTLKSA-N 342.417 0.997 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](O)C(C)(C)C3)nc12 279785549 NWRMFQXUBJRTJN-GFCCVEGCSA-N 334.376 0.814 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCCN(C)C3CC3)ccc21 285135873 SKINZBAMZIOQMW-UHFFFAOYSA-N 344.459 0.896 10 20 ECCD 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10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2OCCCO2)c1 788613064 UPMGDLJGSIHEFC-UHFFFAOYSA-N 330.362 0.257 10 20 ECCD O=C(Cn1cnnn1)NCCC1=CCN(c2cncc(Cl)n2)CC1 1089801029 WRVBZEPDDUCLGG-UHFFFAOYSA-N 348.798 0.460 10 20 ECCD COc1ccc(CNCCNC(=O)c2cn(C)c(=O)nc2O)cc1C 1150984703 WQMNZXAHXBCZEU-UHFFFAOYSA-N 346.387 0.323 10 20 ECCD CNC(=O)CCCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1321728240 PIXJUERERUINCG-UHFFFAOYSA-N 338.383 0.150 10 20 ECCD O=C(NCc1ccccc1O)C(=O)Nc1cccnc1-n1cncn1 1323054842 HPXQIWPZJQCFPS-UHFFFAOYSA-N 338.327 0.623 10 20 ECCD COc1ccc(CNC(=O)N[C@H](C)[C@H]2CN(C)CCN2C)c(O)c1 1347183895 BQFCSXLGTJIALZ-IUODEOHRSA-N 336.436 0.834 10 20 ECCD CN1CCN(c2ccc(CN(C)CCS(N)(=O)=O)cc2F)CC1 1352875544 GKPRVXZGYMUWPF-UHFFFAOYSA-N 344.456 0.298 10 20 ECCD Cc1cc(NC(=O)C2=S=C(NC(=O)C3CC3)C=C2)n2ncnc2n1 1532180815 PXZLFRBQASCQMQ-UHFFFAOYSA-N 342.384 0.503 10 20 ECCD CN(C)c1cc(F)c(CN2CCS(=O)(=O)C[C@H]2C(=O)O)cc1F 1573991882 VAFDYTOXLFUZKZ-ZDUSSCGKSA-N 348.371 0.714 10 20 ECCD CN(C)CC[C@H](N)C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1598215123 VHYOSCHWTANFJJ-LBPRGKRZSA-N 343.811 0.738 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C[C@H](O)CN1CCOCC1 154190653 IEKFSTUVKBYFEI-IBGZPJMESA-N 349.475 0.648 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H](C)NS(C)(=O)=O)CC2)cc1 53757384 NLJUOVXUULCYCQ-GFCCVEGCSA-N 341.433 0.282 10 20 ECCD COCCNC(=O)CN1CCN(Cc2ccc(N(C)C)cc2)CC1 112119160 RLIQPSAGNNGNFM-UHFFFAOYSA-N 334.464 0.633 10 20 ECCD CN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CCOC1 288722494 ZKJCNPIAPMDWGQ-INIZCTEOSA-N 329.400 0.926 10 20 ECCD C[C@H](C[S@](C)=O)NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 285620600 DJQSWDJQKMRKKY-WYVULQQZSA-N 343.424 0.391 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)C1(S(N)(=O)=O)CC1 568022371 RLOUWFVYXZTZKI-UHFFFAOYSA-N 325.390 0.299 10 20 ECCD CNC[C@H](C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827396908 WOIWOMVPNOTKCH-ZDUSSCGKSA-N 339.461 0.393 10 20 ECCD COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1nnnn1C 732203118 PQEMLVUWPNHCGL-UHFFFAOYSA-N 325.756 0.744 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CC[C@@H]4CNC[C@@H]43)CC2)cc1 844225362 OPQWVGNMNWYICM-QAPCUYQASA-N 344.459 0.638 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@H]3CNC[C@@H]3C2)cc1 842036753 WRPBARUXAGZCRI-HRCADAONSA-N 344.459 0.873 10 20 ECCD COc1ccc(-n2nnnc2CN2CC(NC(=O)[C@H]3C[C@H]3C)C2)cc1 1030077323 ZKFDRAFIOPETSF-ABAIWWIYSA-N 342.403 0.627 10 20 ECCD CN(C(=O)CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)c1ccc(N)cc1 877078079 ZYYMADBWLUPXEZ-QHSBEEBCSA-N 329.356 0.394 10 20 ECCD CS(=O)(=O)N[C@@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 779479358 NCNIFJILKILLMX-HOSRBBHYSA-N 340.401 0.651 10 20 ECCD O=C1NC(=O)N2CCN(Cc3ccc(N4CCOCC4)c(F)c3)C[C@@H]12 779432585 HASMNPXDQKNZOV-HNNXBMFYSA-N 348.378 0.398 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2COCCN2CCO)cc1 1051262473 AMMJWPKLPKNGPJ-CYBMUJFWSA-N 335.364 0.272 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@H]3COCCO3)CC2)nn1 1089807722 RMDYXLYUIUAUNE-OAHLLOKOSA-N 332.404 0.843 10 20 ECCD O=C(O)/C=C\c1ccc(N2CC[C@@H]3OCC(=O)N[C@H]3C2)c([N+](=O)[O-])c1 1610750451 KMUOLGRCSJQVDQ-WHTYLAALSA-N 347.327 0.786 10 20 ECCD O=S(=O)(CCNCc1ccccc1O)NC[C@H]1CCCCO1 111405025 BOPCRHHNFPXZAY-CQSZACIVSA-N 328.434 0.970 10 20 ECCD COCCCS(=O)(=O)NCC(=O)NCc1ccc(N(C)C)cc1 269268802 HXFWUVRKCLRTJT-UHFFFAOYSA-N 343.449 0.325 10 20 ECCD COC(=O)C1(NCc2ccc(N(C)C)cc2)CCS(=O)(=O)CC1 278490676 JJYWUISFRNJETA-UHFFFAOYSA-N 340.445 0.963 10 20 ECCD C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 283562589 RHYKPFLGZMKGQR-DYVFJYSZSA-N 344.459 0.968 10 20 ECCD CN(C[C@H]1CCCN(C(=O)c2cccc(O)c2O)C1)S(C)(=O)=O 285888023 DWBQZWZHRXDZGO-LLVKDONJSA-N 342.417 0.841 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNCc3cc[nH]n3)CC2)cc1 818957469 WFTRNTVCAULVQG-KRWDZBQOSA-N 345.447 0.691 10 20 ECCD CCS(=O)(=O)CC(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 833664852 CXZVJHHBOARBGB-UHFFFAOYSA-N 349.792 0.894 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H](C)CN)CC2)cc1 842247722 HBEFXRDEVIQZDR-CQSZACIVSA-N 348.447 0.445 10 20 ECCD NCCN(CCO)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 851681390 OFKBHISJEVPSRJ-UHFFFAOYSA-N 336.436 0.110 10 20 ECCD C[C@H](NC(=O)C(=O)N(C)CCOCCN)c1ccc(N(C)C)cc1 861768084 WLTQZNIJHODSND-ZDUSSCGKSA-N 336.436 0.364 10 20 ECCD C[C@@H]1COC[C@@H]1NC(=O)C(=O)NCCCSc1nccs1 930198389 OOWPBBITIUCIMW-ZJUUUORDSA-N 329.447 0.893 10 20 ECCD CCO[C@@H](C)C(=O)NCCNCc1nnnn1-c1ccc(OC)cc1 1123969133 UIHJBTSRJXREPK-LBPRGKRZSA-N 348.407 0.302 10 20 ECCD COC[C@H](O)CNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 899101415 HVSPRCRKLUZICG-CVEARBPZSA-N 338.452 0.662 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3CC[C@H]2[C@@H](O)C3)cc1 897361546 LFIFFCKHCNCHTQ-BPUTZDHNSA-N 331.416 0.741 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)NCC[C@@H](O)C2CC2)cc1 899856444 QOIMUOLENFKAHC-OAHLLOKOSA-N 336.388 0.863 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CC3(CCN(CCO)C3)C2)cc1 1073473632 GYDQMWFNSWHXHX-UHFFFAOYSA-N 331.376 0.989 10 20 ECCD CS(=O)(=O)CC(=O)NCCC1=CCN(c2nccnc2F)CC1 1089810456 OOCRTEVKSXWXNH-UHFFFAOYSA-N 342.396 0.303 10 20 ECCD Cn1nncc1CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 1327793618 UCCIFPWMRBFHMH-UHFFFAOYSA-N 335.433 0.340 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(C(N)=O)o1 1261147891 KXGZKKBPCUIBRT-UHFFFAOYSA-N 331.328 0.359 10 20 ECCD O=C(CNCc1c(O)cccc1Br)N1CCNCC1 1580556346 JNJVLDBUCIRNMN-UHFFFAOYSA-N 328.210 0.676 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)[C@@H]2CCOC2)C1 1846689607 DKSATCJIVQIYEI-LLVKDONJSA-N 347.371 0.346 10 20 ECCD O=C(O)COCCNC(=O)NCc1ccc(N2CCOCC2)cc1 1595113719 KTQUQZYUVYRAGN-UHFFFAOYSA-N 337.376 0.424 10 20 ECCD COc1ccc(N2CCN(C(=O)CN(C)CC(=O)N(C)C)CC2)cc1 7360748 WZTXAQNWDJFMJS-UHFFFAOYSA-N 348.447 0.364 10 20 ECCD CN(CCn1cnc2c1c(=O)n(C)c(=O)n2C)Cc1ccccc1O 111235103 AMBWVOGHOHAORE-UHFFFAOYSA-N 343.387 0.271 10 20 ECCD COC(=O)[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)C 271200631 IUMBCDUKMQJTPE-LBPRGKRZSA-N 344.389 0.691 10 20 ECCD COCC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 283950297 HSYIURQKSCPZGA-AWEZNQCLSA-N 349.431 0.681 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CS(C)(=O)=O 299077368 VJNCKSXEHUNEIM-UHFFFAOYSA-N 326.418 0.526 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCC1(C)OCCO1 806376285 MYCAOIFMTGUNRQ-UHFFFAOYSA-N 349.431 0.980 10 20 ECCD CN1CCCc2cc(CNC(=O)CNS(=O)(=O)N(C)C)ccc21 816910371 DTUYFXJHLKHBES-UHFFFAOYSA-N 340.449 0.081 10 20 ECCD COCc1cn(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1 900505950 JFAPRAMPCOABDY-UHFFFAOYSA-N 345.403 0.782 10 20 ECCD CC(C)CN(CCN(C)C)C(=O)C(=O)NCCc1ccc(N)cc1 842241355 AKHWJCZOANLGJI-UHFFFAOYSA-N 334.464 0.974 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)NC[C@H]2CNC(=O)C2)cc1 845259594 ZBMBOOWMBDGULF-CYBMUJFWSA-N 334.420 0.909 10 20 ECCD C[C@@H]1[C@@H](C)S(=O)(=O)CCN1Cc1cc2c(cc1O)OC[C@H]2O 768447741 PKYUCFBKYTXYHC-GPCCPHFNSA-N 327.402 0.825 10 20 ECCD CS(=O)(=O)NC1CN(Cc2ccc(Br)cc2O)C1 862484797 BDJAXKQVZDPESI-UHFFFAOYSA-N 335.223 0.888 10 20 ECCD CC[C@@H](C(N)=O)N1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1039060470 KDAWCJJQNQCARK-STQMWFEESA-N 346.391 0.917 10 20 ECCD C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ncnn1C 1117617248 WGLCDLGMIUBVMX-LBPRGKRZSA-N 344.419 0.717 10 20 ECCD CO[C@]1(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CCOC1 1117597255 HSZOYPSRTRKHCR-SFHVURJKSA-N 349.431 0.599 10 20 ECCD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1cccc(C)c1O 775642616 MSCJWSCHZNJFCX-AWEZNQCLSA-N 340.445 0.826 10 20 ECCD O=C(NCCC1=CCN(c2cncc(Cl)n2)CC1)[C@@H]1CCNC1=O 1089855084 GWANWAWYCGBDNF-LBPRGKRZSA-N 349.822 0.909 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@@]3(C)CCNC3=O)CC2)nn1 1089865035 JVMGUMYDHDIIJY-GOSISDBHSA-N 343.431 0.954 10 20 ECCD CN1CC[C@H](C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)C1=O 1089853685 HLNNGTNLADRNAJ-CYBMUJFWSA-N 347.394 0.737 10 20 ECCD C[C@H](NC[C@H](CO)[C@H]1CCOC1)c1cccc(-c2nn[nH]n2)c1O 1589958823 LWCNQNZGKGGHFQ-SDDRHHMPSA-N 333.392 0.868 10 20 ECCD CN(CC(=O)N1CCOCC1)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 1598380558 ISURVSAAYJAWNJ-HYXAFXHYSA-N 349.343 0.988 10 20 ECCD Cn1c(=O)c2c(ncn2CCC(=O)Nc2ccc(N)cc2)n(C)c1=O 269114677 GUEMMUZQWXAHNJ-UHFFFAOYSA-N 342.359 0.045 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H]2CNC[C@@H]2C1 817949010 GABQUWXZQKCZLB-GASCZTMLSA-N 331.416 0.809 10 20 ECCD CNC(=O)CCNC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 824211240 RJMOMLVMPPDLGV-CYBMUJFWSA-N 334.420 0.957 10 20 ECCD CC(=O)N1CCC(NC(=O)COC(=O)c2cc(O)cs2)CC1 732354660 PTWYVHMBEIMOJF-UHFFFAOYSA-N 326.374 0.738 10 20 ECCD CN1CCCc2cc(CNC(=O)c3cn(C)c(=O)n(C)c3=O)ccc21 735008060 PSLGURAENMCENU-UHFFFAOYSA-N 342.399 0.396 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CC[C@H](CS(N)(=O)=O)C2)cc1 913926538 FXCYWARGXSCPIK-ZDUSSCGKSA-N 340.449 0.573 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1CC[C@@H](N)C1 842069896 GGOYLZMXLDGZOJ-UKRRQHHQSA-N 332.448 0.668 10 20 ECCD CC(=O)NCCNC(=O)CCC(=O)NCc1cc(Cl)ccc1O 846474779 BIULBEFOIADBEJ-UHFFFAOYSA-N 341.795 0.694 10 20 ECCD CN(CCCNC(=O)NCCc1ccc(N)cc1)S(C)(=O)=O 841706515 GQJRYPFITXQUTE-UHFFFAOYSA-N 328.438 0.392 10 20 ECCD C[C@H](CNC(=O)C(=O)NCCc1ccc(N)cc1)CN1CCCC1 842224715 HKQPQYBIRQTBNS-CQSZACIVSA-N 332.448 0.776 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCC[C@@]1(C)NC(=O)NC1=O 773744108 MUAPTDAZHBUSGV-BMLIUANNSA-N 349.387 0.913 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)/C=C\C2CC2)cc1 1125243534 VKSAMVCYRSPNGJ-WTKPLQERSA-N 342.403 0.843 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1C[C@H](C(=O)O)C1 1333812002 CSUAGGCINGJNKL-HDJSIYSDSA-N 345.399 0.882 10 20 ECCD Nc1ccc(CC(=O)N[C@@H]2CCCN(CCN3CCOCC3)C2)cc1 1262046554 SMXPJDCWSCSXQP-GOSISDBHSA-N 346.475 0.724 10 20 ECCD Nc1ccc(CNC(=O)N2CCC[C@H](N3CCNCC3=O)C2)cc1 1353540857 YOZGQVHBEXWDOM-HNNXBMFYSA-N 331.420 0.375 10 20 ECCD COC(=O)C1CC2(C1)CN(C(=O)c1cccc(O)c1O)C[C@@H]2C(=O)O 1604291295 GTEQKXOFCONRTP-NPMWDDLUSA-N 349.339 0.824 10 20 ECCD NC(=O)C[C@@H]1COCCN1c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 1608231163 BHGXUONHOAQSIS-CJHWANRJSA-N 335.316 0.773 10 20 ECCD COc1cccc(CNS(=O)(=O)c2cc(C(=O)O)ccn2)c1O 1599674587 TVLLZSYNSBHCED-UHFFFAOYSA-N 338.341 0.973 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)Cn1ccc(=O)n(C)c1=O 173186090 VCRSBOYXGGDQAZ-UHFFFAOYSA-N 344.371 0.039 10 20 ECCD COc1ccc(N2CCN(CN3C(=O)C(=O)N(C)C3=O)CC2)cc1 38383614 NLLBTOZLENPLNX-UHFFFAOYSA-N 332.360 0.195 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)N3CCOCC3)cc2)CC1 188131213 WAXDNIFWLYLQDZ-UHFFFAOYSA-N 346.431 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COc1ccc(CNC(=O)NCc2nnnn2CC2CC2)c(O)c1 793056779 XUKHRPWAOATUBQ-UHFFFAOYSA-N 332.364 0.797 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3ccncn3)C2)cc(OC)n1 996368827 NZHKNRNVSDWMIN-UHFFFAOYSA-N 343.343 0.143 10 20 ECCD Cc1nn[nH]c1C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089850511 AZMBBDVTDBZJCA-UHFFFAOYSA-N 331.355 0.999 10 20 ECCD COCC(=O)NCCC1=CCN(c2ccnc(O)c2[N+](=O)[O-])CC1 1089800292 ILAVENLFRPPCRW-UHFFFAOYSA-N 336.348 0.985 10 20 ECCD Cc1nnc(Cn2nnc(C(=O)NCc3ccccc3O)c2C)o1 1329900050 JMPHRLMIWDSSRN-UHFFFAOYSA-N 328.332 0.962 10 20 ECCD C[C@H]1CCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1331951596 WHCPKXSLCNFQJJ-LBPRGKRZSA-N 335.379 0.899 10 20 ECCD COc1ccc(CNC(=O)c2ccc(-c3nn[nH]n3)cn2)c(O)c1 1296969079 WHGSYEOGYUMSIU-UHFFFAOYSA-N 326.316 0.906 10 20 ECCD COc1cc(CN2CCS(=O)(=O)C[C@@H]2CC(=O)O)c(O)cc1C 1607157255 BPMZRISGAVXVCJ-LBPRGKRZSA-N 343.401 0.783 10 20 ECCD O=C(O)CCNC(=O)CCNCc1ccc(N2CCOCC2)cc1 1608728809 WLHYLXAJUNNORD-UHFFFAOYSA-N 335.404 0.594 10 20 ECCD CC(C)[C@H](O)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1841420793 BBIQEQZBEXGNBO-AWEZNQCLSA-N 349.387 0.327 10 20 ECCD CNC(=O)CN[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1752775846 XXMYUMVNJCVRFR-TXEJJXNPSA-N 332.364 0.445 10 20 ECCD COc1ccc(N2CCN(CN3C[C@@H](C(=O)O)CC3=O)CC2)cc1 1599586358 QBLHXWXJMIKBKQ-ZDUSSCGKSA-N 333.388 0.708 10 20 ECCD CC(C)C(=O)NCC1(O)CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1041540459 JCMIZXIYMQEORX-UHFFFAOYSA-N 347.375 0.808 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(C)CC(=O)NC(C)C)nc12 51855784 JZQZSWWCAZSJMD-UHFFFAOYSA-N 349.391 0.568 10 20 ECCD CN1C(=O)C(=O)N(CC(=O)NCc2ccc(N3CCCC3)cc2)C1=O 264997828 KYBIRICEFLOCBZ-UHFFFAOYSA-N 344.371 0.324 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3CC[C@@H](C(=O)O)C3)CC2)cc1 269299556 PYOXFFYCMJMZTF-CQSZACIVSA-N 347.415 0.750 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@H](CC(N)=O)C1 377608281 RFSHRPMEDZLHHR-OAHLLOKOSA-N 332.448 0.908 10 20 ECCD O=CN1CCC[C@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 822687405 BFNUFWYFVXXCPP-INIZCTEOSA-N 335.379 0.899 10 20 ECCD O=C(O)CN1C(=O)/C(=C/c2ccc(-c3nn[nH]n3)o2)SC1=S 823387443 KBUVQUAQSDVMDA-CLTKARDFSA-N 337.342 0.746 10 20 ECCD CC[C@@H](N)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827396550 VBPFESIBOHQCEW-CQSZACIVSA-N 325.434 0.275 10 20 ECCD COC[C@@H](CO)NC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 823732119 CFGDUZZQHHHRPR-ZIAGYGMSSA-N 337.420 0.828 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)[C@@H]2CC(=O)N(C3CC3)C2)cc1 832292520 IBQVXPCYFCIUCX-CJNGLKHVSA-N 330.432 0.880 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)c2cn(CCCCN)nn2)cc1 832280208 NUSQLTOZHVCQSA-OAHLLOKOSA-N 345.451 0.513 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CSCN3)cc2)C1 844174938 FBHXWGNCQRRIRU-DZGCQCFKSA-N 348.472 0.667 10 20 ECCD Cn1ncnc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 853797938 IVNBNSGJYHWDGK-UHFFFAOYSA-N 329.404 0.954 10 20 ECCD COc1cccc(O)c1CN1CCN(C(=O)C(=O)NC(C)C)CC1 768215067 WPQWURNPPHYWLZ-UHFFFAOYSA-N 335.404 0.570 10 20 ECCD CCN(CCN)C(=O)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 861741506 PEEQYDNAFNBFKN-CQSZACIVSA-N 334.464 0.915 10 20 ECCD 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COC(=O)c1ccc(O)c([C@H](C)NCC(=O)N2CCN(C)CC2)c1 756489749 IZZLXZPRTDTVBI-LBPRGKRZSA-N 335.404 0.603 10 20 ECCD COc1ccc(-n2nnnc2CN2C[C@@H]3C[C@H]2CN3C(C)=O)cc1 1032240629 ZOOVEAQFLDBDJW-KBPBESRZSA-N 328.376 0.476 10 20 ECCD CONC(=O)C1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 879923697 JRSYYJOIYFPDIX-UHFFFAOYSA-N 348.447 0.758 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)N2CCNC(=O)C2)N(C)C)cc1 899103154 WUNFPNIWXSECMZ-OAHLLOKOSA-N 333.436 0.497 10 20 ECCD COc1ccc(CNCCNC(=O)CCc2cnn(C)n2)cc1C 1133917901 KVUAADHYNVIVGW-UHFFFAOYSA-N 331.420 0.971 10 20 ECCD CN(C)CC1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1328722537 PNBTWJZNOFQRHP-UHFFFAOYSA-N 327.406 0.397 10 20 ECCD COc1cc(N2CCN(C[C@H](O)[C@@H](C)O)CC2)cc(OC)c1OC 1335782613 CSSPZRGGHBXBIB-OCCSQVGLSA-N 340.420 0.576 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCC([C@@H](O)C(=O)O)CC2)c1O 1599344137 DFEKDCDUTIFADR-CYBMUJFWSA-N 340.332 0.967 10 20 ECCD O=C1NC(=S)NC(=O)C1=CNCCCn1cnc2ccccc21 52529241 KQNBVXMIXNUAAP-UHFFFAOYSA-N 329.385 0.431 10 20 ECCD COc1ccc(N2CCCN(CCCS(N)(=O)=O)CC2)cc1 170913518 GONYGGOTRAXLAG-UHFFFAOYSA-N 327.450 0.886 10 20 ECCD CN(Cc1ccccc1O)C(=O)CSCC(=O)N1CCOCC1 265920385 MDFNWKUNQZARAT-UHFFFAOYSA-N 338.429 0.943 10 20 ECCD CNC[C@@H](C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 269239788 ARTDEFZRJCPYEA-OAHLLOKOSA-N 334.464 0.789 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=S)NCCNS(C)(=O)=O)c1 728792678 MLHDNEXGVPNXSY-VIFPVBQESA-N 347.462 0.475 10 20 ECCD C[C@H](OC(=O)c1cc(O)cs1)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1 732354280 IXOBODUNCJGHGR-DTWKUNHWSA-N 347.414 0.645 10 20 ECCD C[C@@H](CN)NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 842254433 IWXJFZFFSIJPLH-GXTWGEPZSA-N 335.404 0.363 10 20 ECCD Cc1ccc(O)c(CNC(=O)C(=O)Nc2cnn(CCN(C)C)c2)c1 862025338 JZFDRGVVJJCAOT-UHFFFAOYSA-N 345.403 0.714 10 20 ECCD CNS(=O)(=O)C[C@@H]1CCCN1Cc1cc2c(cc1O)OC[C@H]2O 768463318 GRIYQGIBUSRYHE-SMDDNHRTSA-N 342.417 0.332 10 20 ECCD CN1C(=O)CS/C1=C/C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 876507212 YBEWVRZRNXDHGQ-WJHGTXIHSA-N 334.445 0.915 10 20 ECCD 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C[C@H]1CN2CCN1C[C@@H]2C(=O)N1CCOc2cc(N(C)C)ccc21 1347952945 YSRXXAPVBWDZEB-XJKSGUPXSA-N 330.432 0.866 10 20 ECCD CN(C)c1ccc(CNS(=O)(=O)CCS(C)(=O)=O)cc1F 173078815 MRVFRIDUYYAWBK-UHFFFAOYSA-N 338.426 0.356 10 20 ECCD CCS(=O)(=O)CCN(C)CC(=O)NCc1ccc(N(C)C)cc1 128731035 WWDOBPBDFVJDJA-UHFFFAOYSA-N 341.477 0.735 10 20 ECCD COc1ccc(N2CCN(C(=O)c3ccc(=O)n(C)n3)CC2)cc1F 84815364 JHJDZNCLZUNUBW-UHFFFAOYSA-N 346.362 0.890 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@@H](O)C1 283169579 LCSQKHMWURDRBW-MRXNPFEDSA-N 347.415 0.123 10 20 ECCD C[C@@H]1C(=O)NCCN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 298583333 GGJNICHMVVONTI-GFCCVEGCSA-N 332.404 0.058 10 20 ECCD COC(=O)[C@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)CCO1 728575316 VNGBBRRHANVRBJ-OAHLLOKOSA-N 335.404 0.243 10 20 ECCD CNCCNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 842230863 BIMYWKKQBJMVLC-AWEZNQCLSA-N 335.404 0.235 10 20 ECCD C[C@@H](OC(=O)c1cccc(O)c1O)C(=O)N1CCC[C@H](C(N)=O)C1 758562311 QIFBLDDLRLPYSL-ZJUUUORDSA-N 336.344 0.367 10 20 ECCD Cn1ccc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 850356037 NZAYEVAWMGNXTJ-UHFFFAOYSA-N 334.445 0.945 10 20 ECCD C[C@H](O)CN1C[C@@H]2C(NC(=O)c3ccc(N=NC(N)=O)cc3)[C@H]2C1 962970829 GYHHIBLQUDTVQH-XDTLVQLUSA-N 331.376 0.890 10 20 ECCD O=C(CN1CCCC1)N1CCN(C(=O)c2cccc(O)c2O)CC1 790642516 DLEZBOVSLCTOBL-UHFFFAOYSA-N 333.388 0.478 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cc(C)[nH]n3)C2)cc(OC)n1 996367826 GICFJBNJGXECSX-UHFFFAOYSA-N 345.359 0.385 10 20 ECCD Cc1nc([C@@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)no1 1319659642 VVIGHHMPNNWICG-SSDOTTSWSA-N 340.361 0.946 10 20 ECCD Nc1ccc(CN2CCC[C@H](S(=O)(=O)N3CCOCC3)C2)cc1 1352789995 MQZVQCWZVDYZFH-INIZCTEOSA-N 339.461 0.895 10 20 ECCD CNS(=O)(=O)[C@H]1CCN(Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 365827103 RVRJGNOXTBBKKN-JTQLQIEISA-N 345.377 0.433 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1 817109435 VOBYWAUBYPIZBR-AWEZNQCLSA-N 345.399 0.836 10 20 ECCD CN(C)c1nc(N)nc(C(=O)NCc2ccc3c(c2)CCCN3C)n1 816911794 YUWPMQYUGJITRO-UHFFFAOYSA-N 341.419 0.832 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)[C@@H]2OCCN(C)C2=O)cc1 911893392 RYVBTXQBFQWISW-HNNXBMFYSA-N 335.404 0.447 10 20 ECCD COCC(COC)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 840170821 AGUWNBNEHMSOEV-UHFFFAOYSA-N 338.404 0.900 10 20 ECCD CC[C@@H]1C(=O)N(CC)CCN1C(=O)C(=O)NCCc1ccc(N)cc1 842235454 GCYKRWYVAWITNW-OAHLLOKOSA-N 346.431 0.397 10 20 ECCD CONC(=O)CNC(=O)NCc1cccc(Br)c1O 927213346 BNPZAZSSRPPHSU-UHFFFAOYSA-N 332.154 0.632 10 20 ECCD Nc1ccc(NC(=O)C(=O)N2CC[C@H](CN3CCCC3=O)C2)cc1 850854084 JTMMVOZSJVEJOB-GFCCVEGCSA-N 330.388 0.678 10 20 ECCD CCn1[nH]nnc1=NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 931679831 ZHTOZDXOMCLWJH-CQSZACIVSA-N 346.439 0.605 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNC[C@H]3C[C@@H](O)C3)CC2)cc1 863582061 BBXRTKSXTZIDQC-BPQIPLTHSA-N 349.475 0.539 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(CO)(CO)CC1 879969104 VUPXSLOBWRJCMC-UHFFFAOYSA-N 349.475 0.778 10 20 ECCD C[C@@H](NC(=O)NCc1nnn(C)n1)c1ccc(N2CCOCC2)cc1 787065364 PBJSHEBXIVIFJT-GFCCVEGCSA-N 345.407 0.607 10 20 ECCD Cn1cnc(C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)n1 1089829300 MJFPHNJLYNYOPD-UHFFFAOYSA-N 331.355 0.701 10 20 ECCD COCCN1CCN(C(=O)C(=O)N(C)Cc2ccccc2O)CC1 1328286860 FXNMENOGHRETNR-UHFFFAOYSA-N 335.404 0.141 10 20 ECCD CN1CCN(c2ccc(CNC(=O)CNC[C@@H]3CCCO3)cc2)CC1 1337069572 XLGBMZVSFOVUML-SFHVURJKSA-N 346.475 0.823 10 20 ECCD O=C(N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)c1cc(O)cs1 1330736911 JYKMZRQILHRNHE-NOZJJQNGSA-N 331.415 0.920 10 20 ECCD CC[C@H](NCCCc1nnnn1C)c1cccc(-c2nn[nH]n2)c1O 1590471220 ZIZWJZMELCJYJL-LBPRGKRZSA-N 343.395 0.769 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H](CN)C2CC2)cc1 846341656 DODZLBBZKHBDFG-INIZCTEOSA-N 348.447 0.443 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)[C@@H](N)CCN(C)C)C2)cc1 846682820 MLPYMNWVYUIHJZ-PBHICJAKSA-N 334.464 0.917 10 20 ECCD C[C@@H](NCCN1CCN(S(C)(=O)=O)CC1)c1cc(F)ccc1O 756534295 LUTUOUZDHHVMPX-GFCCVEGCSA-N 345.440 0.759 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NC[C@@H]1CCN1C 930865895 GXMTVXIRJQWPSV-PBHICJAKSA-N 346.475 0.929 10 20 ECCD C[C@H](NC(=O)NC[C@@H]1COCCN1)c1ccc(N2CCOCC2)cc1 861566877 UTMOGXCNFVYGRC-GOEBONIOSA-N 348.447 0.872 10 20 ECCD Cc1nc(CN2CC(NC(=O)c3ccc(N=NC(N)=O)cc3)C2)n[nH]1 1031463974 DJTIWSICSNGOSR-UHFFFAOYSA-N 342.363 0.890 10 20 ECCD COC(=O)Cn1cc(S(=O)(=O)Nc2ccc(O)c(C)c2)cn1 776747424 DGTBOWRDBMFYAY-UHFFFAOYSA-N 325.346 0.871 10 20 ECCD CS(=O)(=O)NCc1ccc(C(=O)NCc2ccc(O)c(O)c2)o1 778927732 UDKCMXDICMDNNE-UHFFFAOYSA-N 340.357 0.670 10 20 ECCD CN(C)CCC(=O)NCCC1=CCN(c2ncnc3[nH]cnc23)CC1 1089857652 QZUYFOSECTYPCG-UHFFFAOYSA-N 343.435 0.947 10 20 ECCD COCCN1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@H](O)C1 1090830379 MCXSZSFGUXNSHB-ZIAGYGMSSA-N 349.391 0.660 10 20 ECCD O=C(O)CN(CCN1CCOCC1)Cc1cc(F)cc(F)c1O 1602055516 NYSMTBVZSJHJEG-UHFFFAOYSA-N 330.331 0.889 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1([S@@](C)=O)CCNCC1 1576053059 SBSICECAIOYGHM-QVQLBTGDSA-N 340.445 0.646 10 20 ECCD C[C@H](N[C@H]1CCC(=O)N(C)C1=O)c1cccc(-c2nn[nH]n2)c1O 1589955930 NRAMLRIPLYOOAI-KWQFWETISA-N 330.348 0.370 10 20 ECCD COCCN1C(=O)/C(=C\Nc2ccc(C)cc2O)C(=O)NC1=S 60863576 CGUVIACFFLTYPX-NTMALXAHSA-N 335.385 0.886 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CCOCC3)CC2)cc1 72751441 BKFPUQRLIXIQGG-KRWDZBQOSA-N 335.448 0.510 10 20 ECCD CNS(=O)(=O)CCNC1CCN(c2ccc(OC)cc2)CC1 368465512 LLPOHGRMAJTDBX-UHFFFAOYSA-N 327.450 0.803 10 20 ECCD CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)NCc1ccc(O)c(O)c1 272362365 SJRPIPBIULNIRX-GFCCVEGCSA-N 330.406 0.678 10 20 ECCD CC(=O)NCCCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 288695081 XPPSQPCTJDJWIP-UHFFFAOYSA-N 344.415 0.321 10 20 ECCD COc1ccc(N2CCN([C@@H](C)C(=O)NCC(=O)O)CC2)cc1F 832383400 GSSAMBIYUMKJNQ-NSHDSACASA-N 339.367 0.546 10 20 ECCD CCO[C@H]1C[C@](O)(CNC(=O)C(=O)Nc2ccc(N)cc2)C1(C)C 841115020 XQEDFQBIFKVFNK-GUYCJALGSA-N 335.404 0.890 10 20 ECCD CN(C)c1ccc(CN(C(=O)Cn2cnc(C(N)=O)n2)C2CC2)cc1 844318465 OBQMNNZNENKGLR-UHFFFAOYSA-N 342.403 0.634 10 20 ECCD O=C(O)CN(Cc1ccccc1O)C(=O)[C@@H]1CC(=O)N(C2CC2)C1 911484326 MJWYRZHGOFXSRD-GFCCVEGCSA-N 332.356 0.816 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)[C@]23CCC(=O)N2CCS3)cc1 843298802 QBSKHQUUMBQKOM-RHSMWYFYSA-N 348.472 0.934 10 20 ECCD CNS(=O)(=O)[C@H]1CCCN(C(=O)NCCc2ccc(N)cc2)C1 841955112 UYVMDNSEGDZMOW-AWEZNQCLSA-N 340.449 0.535 10 20 ECCD CN1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)[C@H](CN)C1 841832007 KTAMDMVJNSDRRS-QGZVFWFLSA-N 329.448 0.847 10 20 ECCD C[C@H]1C[C@H](CN)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 842171802 XIXZBULMADXWAQ-GOEBONIOSA-N 342.443 0.875 10 20 ECCD COCc1nccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 850338135 AJEOCMAEMBZOAM-UHFFFAOYSA-N 343.387 0.944 10 20 ECCD C[C@H](O)CN1CCO[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1035626621 XFWJPIKQZHKJBA-FZMZJTMJSA-N 349.391 0.660 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCN3C(=O)NC(=O)[C@@H]3C2)cc1 778651343 QVWJJNXDBBRYED-ZDUSSCGKSA-N 331.376 0.198 10 20 ECCD COc1ccc(-n2nnnc2CN[C@H]2C[C@H](C)N(C(C)=O)C2)cc1 987649936 ZICZPOHZIOUOGY-AAEUAGOBSA-N 330.392 0.770 10 20 ECCD Cc1nc(CC(=O)NCCC2=CCN(c3nccnc3F)CC2)n[nH]1 1089832182 OQWOZNNWHSBVAJ-UHFFFAOYSA-N 345.382 0.928 10 20 ECCD CC(=O)N1CCC(CO)(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1080894101 CDPTUWZUSDMJOB-UHFFFAOYSA-N 347.375 0.952 10 20 ECCD O=C(Cn1cnnc1O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089827416 KYPWVXMCIPPALP-UHFFFAOYSA-N 347.354 0.256 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC1CCOCC1 1325595847 YXICTQCSQQFFSU-UHFFFAOYSA-N 347.415 0.435 10 20 ECCD CN1CCN(c2ccc(CNCCn3cc(C(=O)O)nn3)cc2)CC1 1334852888 JGYGRDOLXQDOIJ-UHFFFAOYSA-N 344.419 0.518 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)C2CN([C@@H]3CCOC3)C2)cc1 1578424845 ZBCHTMBKRCXNHL-IAGOWNOFSA-N 332.448 0.589 10 20 ECCD C[C@H](O)[C@H](NC(=O)C1CC1)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 274893192 DIENFNPNAKCUQX-FTGAXOIBSA-N 336.388 0.421 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@@H]1CO 806277855 KZPYOUISOCPDMR-SNVBAGLBSA-N 329.447 0.725 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@@]1(C(=O)O)CCOC1 833695572 SCXOMMXXPIXJST-KRWDZBQOSA-N 335.404 0.544 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3cn(C)c(=O)n3C)cc2)CC1 918911762 BDWNWTMHTGNGTK-UHFFFAOYSA-N 343.431 0.406 10 20 ECCD NC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCOCC3)cc2)C1 919859573 AIMNMELIZHPHFU-HNNXBMFYSA-N 346.431 0.930 10 20 ECCD C[C@H](N)C[C@H](C)NC(=O)C(=O)NCCCSc1nccs1 843258772 CKGBXRHQVMYHQZ-UWVGGRQHSA-N 330.479 0.984 10 20 ECCD COc1ccc(O)c([C@H](C)NC(=O)Cn2nc3n(c2=O)CCCC3)c1 845834188 RCYNWCZRJIKUCK-NSHDSACASA-N 346.387 0.973 10 20 ECCD C[C@@H](NC(=O)C(=O)N1[C@H]2CC[C@H]1CNC2)c1ccc(N(C)C)cc1 853365241 REZKQPMSBGDILD-KCXAZCMYSA-N 330.432 0.893 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@@H]3CN(C)CCO3)CC2)n1 1089823694 MJVWORHJWYTLQX-INIZCTEOSA-N 345.447 0.758 10 20 ECCD O=C(NCCn1cncn1)C(=O)NCc1ccc(N2CCCC2)cc1 1322557943 GSQONJZXRKYJQW-UHFFFAOYSA-N 342.403 0.311 10 20 ECCD CO[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1802385591 UVAFGJJARYUVMH-SYEHKZFSSA-N 349.387 0.780 10 20 ECCD Cc1cc(C(=O)NC[C@H](O)CN)c(C)n1-c1ccc2c(c1)OCCO2 1548572659 WEJUOLCHCRTFOD-CQSZACIVSA-N 345.399 0.915 10 20 ECCD CN(CCNCc1cnn[nH]1)C(=O)c1ccc(N=NC(N)=O)cc1 1576834584 SIIQHZQITQULFE-UHFFFAOYSA-N 330.352 0.829 10 20 ECCD C[C@H](C(=O)NCc1c(O)cccc1F)n1cnc(-c2nn[nH]n2)n1 1588997275 AGZYKSNCGSNVGL-SSDOTTSWSA-N 332.299 0.180 10 20 ECCD CN(C)c1ccc(CNC(=O)NC[C@@H]2CC[C@@H](C(N)=O)O2)cc1F 126146522 XGCBMZANXREWTD-FZMZJTMJSA-N 338.383 0.724 10 20 ECCD C[C@@H](O)[C@H](NC(=O)C1CC1)C(=O)N1CCOc2cc(N(C)C)ccc21 542784496 MKNPRCWYLVRNBM-BZNIZROVSA-N 347.415 0.754 10 20 ECCD Nc1ccc(CC(=O)N[C@H]2CCN(CCN3CCOCC3)C2)cc1 829764475 MIJHFKDKCCPJJS-KRWDZBQOSA-N 332.448 0.334 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(C)(N)CC2)cc1F 842147514 FWSUTAUWMPIAST-UHFFFAOYSA-N 336.411 0.848 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)c3cn(C)c(=O)n3C)C2)cc1 911276847 OQWFGDZOOAYWFH-CYBMUJFWSA-N 344.415 0.989 10 20 ECCD NC(=O)CS(=O)(=O)c1ccc(C(=O)NCc2ccccc2O)cc1 754425921 ZZYHGGWMWNIVDU-UHFFFAOYSA-N 348.380 0.581 10 20 ECCD COC(=O)CC(C)(C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769906277 AZQWRMHQOBMRLT-UHFFFAOYSA-N 344.389 0.835 10 20 ECCD CN(CC(F)F)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1117052643 NXQGLYDIBNXGRL-UHFFFAOYSA-N 341.358 0.863 10 20 ECCD CCOC(=O)C[C@@H]1CCCN1C(=O)C(=O)NCCc1ccc(N)cc1 1118045278 QEWOKUMMWYGOPF-HNNXBMFYSA-N 347.415 0.872 10 20 ECCD C[C@H]1CN(C)C(=O)CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 782593120 SKBJDYOQVDYRER-AWEZNQCLSA-N 332.448 0.874 10 20 ECCD COc1ccc(CNCCN2CCN(C(C)=O)CC2)c(O)c1OC 892569729 GEPMMKJUSKZNIG-UHFFFAOYSA-N 337.420 0.663 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@H]3CCNC3=O)CC2)nn1 1089856314 ZBNTUHBMODZSKM-CQSZACIVSA-N 329.404 0.564 10 20 ECCD O=C1NCCC[C@@H]1C(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089848671 KSXZRJVLFDYRMF-ZDUSSCGKSA-N 347.394 0.785 10 20 ECCD COc1ccc(CNC2CC(CNC(=O)c3nnn(C)n3)C2)cc1C 1091188273 VPTXYKUQNUDSJL-UHFFFAOYSA-N 344.419 0.825 10 20 ECCD CN1CCN(c2ccc(CN3CCO[C@H](C(N)=O)C3)cc2F)CC1 1319702689 ROIYHQQCVDSZKM-INIZCTEOSA-N 336.411 0.264 10 20 ECCD CCn1ccnc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1329019676 WNPDNIOCMOIBDR-UHFFFAOYSA-N 338.389 0.910 10 20 ECCD O=C(NCc1c(O)cccc1O)c1cn([C@@H]2CCCNCC2)nn1 1580708372 NRKYQCCJYACAHA-LLVKDONJSA-N 331.376 0.934 10 20 ECCD O=C(O)C[C@H]1C(=O)NCCN1Cc1cc(Br)ccc1O 236432336 BRWIIXVZVZNEDH-JTQLQIEISA-N 343.177 0.930 10 20 ECCD Cn1cc(N2CCN(Cc3cc4c(cc3O)OCO4)CC2=O)cn1 267373688 JFDXVBSWSAVSIM-UHFFFAOYSA-N 330.344 0.703 10 20 ECCD CCS(=O)(=O)N1CCC[C@H](C(=O)NCCc2ccc(N)cc2)C1 269146877 FWNXYRXCJPHRAH-AWEZNQCLSA-N 339.461 0.989 10 20 ECCD C[C@H](C[S@@](C)=O)NC(=O)C(=O)NCCCSc1nccs1 806281688 GVPQQKPWSOSERM-AOUSDQRYSA-N 349.503 0.625 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H]3CCC(=O)N3)CC2)cc1 299514030 UXVAFEQSVZHCQN-MRXNPFEDSA-N 346.431 0.212 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)NC[C@H](O)Cn1ccnn1 838477134 FALWLOPCLDNULE-HNNXBMFYSA-N 332.408 0.513 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCC[C@H]2CO)cc1 846246327 FROXLZQXLVEJSX-HNNXBMFYSA-N 349.431 0.573 10 20 ECCD CC1CCN(c2ccc(CNC(=O)C(=O)NCCCON)cc2)CC1 911250584 UHFLQLLSCOEWKN-UHFFFAOYSA-N 348.447 0.936 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N[C@@H](CN)C1CC1 842071280 YAZDQJSXCWYEIO-DYVFJYSZSA-N 346.475 0.962 10 20 ECCD CC[C@H](CCO)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 762830269 FAVHOPRZGFLXFZ-SNVBAGLBSA-N 330.406 0.902 10 20 ECCD COC(=O)[C@H]1[C@H](O)CCCN1Cc1ccc(N2CCN(C)CC2)cc1 783705074 UXQQQVMSHDXQPW-QZTJIDSGSA-N 347.459 0.937 10 20 ECCD CCN(CC)c1ccc(CN(C)CC(=O)N2CCNC(=O)C2)cc1 781626880 WVRVMYKHBULXGC-UHFFFAOYSA-N 332.448 0.923 10 20 ECCD COc1ccc(CN(C)C[C@@H](O)CN2CCOCC2)c(O)c1OC 892096504 UKRBGESRHNJYEM-CQSZACIVSA-N 340.420 0.534 10 20 ECCD COc1ccc(N2CCC(NC(=O)[C@@H]3CNCCN3C)CC2)cc1 1341685363 UIEFGRFIKGOONM-KRWDZBQOSA-N 332.448 0.684 10 20 ECCD COc1ccc(N2CCC(NC(=O)N[C@H]3CCNC[C@H]3O)CC2)cc1 1579224555 PEFVDGMXJCHYDW-DLBZAZTESA-N 348.447 0.686 10 20 ECCD COCCN(CCOC)S(=O)(=O)N(C)Cc1ccccc1O 269842316 WBHLAUHVSQURBC-UHFFFAOYSA-N 332.422 0.664 10 20 ECCD COC(=O)C[C@@H]1C(=O)NCCN1Cc1cc(Cl)cc(OC)c1O 273726033 JGJYMAMHCIPMSZ-LLVKDONJSA-N 342.779 0.918 10 20 ECCD COc1ccc(N2CCN(CCCN=c3nc[nH]n3C)CC2)cc1 820609143 DFWAKGPILGEUAG-UHFFFAOYSA-N 330.436 0.870 10 20 ECCD CN[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 842094673 ZZEWKVQHYMUXOV-JTQLQIEISA-N 328.463 0.562 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(Cc3ncnn3C)C2)cc(OC)n1 1015103439 OMTHCWPAQIDZNO-LBPRGKRZSA-N 346.391 0.232 10 20 ECCD C[C@H](CCN)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 842254106 RXCCFKGVTJRFFI-HIFRSBDPSA-N 349.431 0.753 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN(C)CCCN)CC2)cc1 923290759 KTTPHXPGBYMUJJ-QGZVFWFLSA-N 336.480 0.459 10 20 ECCD C[C@H]1CO[C@@H](CO)CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 766099404 VBDMCUUWHNWEHJ-WMLDXEAASA-N 335.448 0.793 10 20 ECCD C[C@H](N)CCNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1119295843 YNDCYXRCXQJEFX-DZGCQCFKSA-N 349.431 0.753 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3nnnc3[C@H](C)O)CC2)cc1 798219617 LOUBIPJFLDUQJZ-LBPRGKRZSA-N 346.391 0.084 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@H]3CCOC3)C2)cc(OC)n1 996368228 JOLACCBKCMYFHV-JTQLQIEISA-N 335.360 0.076 10 20 ECCD Nc1ccc(CNC(=O)NCC2(N3CCOCC3)CCOCC2)cc1 1336109416 LVFLCPGWENJGMP-UHFFFAOYSA-N 348.447 0.949 10 20 ECCD CS(=O)(=O)NC1CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])C1 1607375369 UDXBAKFPVZAHKR-HYXAFXHYSA-N 341.345 0.430 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@](O)(C(=O)O)C1 1598518988 BOJJVAZVUAMAEG-KRWDZBQOSA-N 335.404 0.232 10 20 ECCD CN1C(=O)C(=CNCCCOC[C@@H]2CCCO2)C(=O)N(C)C1=O 52536807 SSHQMDYSRQBJKV-NSHDSACASA-N 325.365 0.096 10 20 ECCD CN(Cc1nc2c(=O)n(C)c(=O)n(C)c2[nH]1)Cc1ccccc1O 111235677 DNRYJFSZRQQXFG-UHFFFAOYSA-N 329.360 0.298 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCS(C)(=O)=O 76176253 OKRRMOOZZNAKAE-UHFFFAOYSA-N 340.445 0.916 10 20 ECCD Nc1ccc(CC(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)cc1 237928125 WSOGAYGSJCKRQP-UHFFFAOYSA-N 343.387 0.505 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@H](CO)C1 288503659 JGZVUKDSHDWAFF-HNNXBMFYSA-N 329.400 0.520 10 20 ECCD C[C@@H](C[S@](C)=O)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 283466550 LHHLFQQEXWWXKC-SAHAZLINSA-N 325.434 0.252 10 20 ECCD Cn1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)n1 827032722 LIVGEDKTLOXLAQ-UHFFFAOYSA-N 336.417 0.735 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CS(=O)(=O)C[C@H]2OC)c1O 826985114 BSJIPFUKUMVNTC-MWLCHTKSSA-N 346.361 0.211 10 20 ECCD C[C@@H](CO)NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 838738635 GKLBSNQROCJXOA-JTQLQIEISA-N 329.347 0.981 10 20 ECCD CC(=O)NCCN(C)C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 843241792 GNJDHPJIUHIFRU-UHFFFAOYSA-N 334.420 0.306 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCO[C@@H](C)C2)cc1 846240805 HTXFOPQOYSWYKR-AWEZNQCLSA-N 349.431 0.837 10 20 ECCD CC(C)(C)NC(=O)N1CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 841089020 GAEIPOFEYNAWDS-UHFFFAOYSA-N 347.419 0.860 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)NC[C@H]2CCN2C)cc1 931886627 QARZSBQKTSVIRL-OAHLLOKOSA-N 348.447 0.410 10 20 ECCD C/C=C(\C)C(=O)NCCNCc1nnnn1-c1ccc(OC)cc1 1125444154 SFRVKHFBMSOQMJ-UUILKARUSA-N 330.392 0.843 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@H]3COCCO3)CC2)n1 1089807141 FUVJHXZMNMIVPY-OAHLLOKOSA-N 332.404 0.843 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cc(C)no3)C2)cc(OC)n1 996368743 MRVHPPYBFKRQBS-UHFFFAOYSA-N 346.343 0.650 10 20 ECCD CN(C)C(=O)CN(CC(=O)N(C)C)c1ccc(OCC(=O)O)cc1 1605997030 MUMIUWQHLWKNNR-UHFFFAOYSA-N 337.376 0.133 10 20 ECCD COC(=O)[C@H](NC(=O)/C=C/c1ccc(N2CCOCC2)cc1)[C@@H](C)O 274519176 RXLNYBOXBIUJRL-KULBWLNLSA-N 348.399 0.575 10 20 ECCD COc1ccc(N2CCN(C(=O)NCc3ncn(C)n3)CC2)cc1F 91790763 VFHHULGSWSXHLC-UHFFFAOYSA-N 348.382 0.995 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3CN(C)CCO3)C2)cc1 819584072 CWRGKTUZLDKULT-YOEHRIQHSA-N 333.432 0.968 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)CCNC(=O)NC 819698712 QFRYXSVJWVOONN-UHFFFAOYSA-N 337.376 0.603 10 20 ECCD COCCS(=O)(=O)CC(=O)N[C@H](C)c1cc(OC)ccc1O 728978744 UTTYCROWIIHYRV-SNVBAGLBSA-N 331.390 0.639 10 20 ECCD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)OC)CC2)cc1 917986395 OSJPPJHOLNXARL-ZDUSSCGKSA-N 336.388 0.922 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N[C@H](CN)C1CC1 842071279 YAZDQJSXCWYEIO-CXAGYDPISA-N 346.475 0.962 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@]3(O)CCSC3)cc2)CC1 918857456 OZYUVXQKSFRXTE-KRWDZBQOSA-N 335.473 0.923 10 20 ECCD CC(C)[C@H](NC(=O)C(=O)Nc1ccc(N)cc1)C(=O)N1CCCC1 843051206 FZVFTNYHHXVCBZ-AWEZNQCLSA-N 332.404 0.971 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NCC(F)(F)CN 842271179 FXCUEELSOOSZPM-UHFFFAOYSA-N 329.347 0.841 10 20 ECCD CO[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)/C=C\c1ccc(O)c(O)c1 855475989 IOOZBISKEYJPPL-ZECPTDFPSA-N 327.358 0.039 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H]([C@H](C)O)C1 774206065 IOFVOWUKWWPAJT-ZFWWWQNUSA-N 333.432 0.907 10 20 ECCD C[C@@H]1CN2CCN1C[C@@H]2C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 1121810580 YWTVMCQGWWKVIA-XOKHGSTOSA-N 331.464 0.257 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@H](CO)[C@@H](O)C1 787998059 VXOHGZZGBKGUAI-RDJZCZTQSA-N 335.448 0.386 10 20 ECCD COc1ccc(CNC(=O)C(=O)Nc2cc(OC)ncn2)c(O)c1 797389187 UKUORTGXXIJSPK-UHFFFAOYSA-N 332.316 0.454 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCCNCCN2CCNC2=O)cc1 1153048019 QIUUJZFWVWQPJX-UHFFFAOYSA-N 347.379 0.194 10 20 ECCD COC[C@H](C)NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1332316699 FOYZDXITVMTBOG-AWEZNQCLSA-N 349.431 0.633 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1nc2ccccn2c1=O 183456874 RUXKYEIRFGIGLA-NSHDSACASA-N 342.355 0.655 10 20 ECCD CC(=O)N1CC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)C1 134943439 URCJZWPLUFSEKF-MRXNPFEDSA-N 346.431 0.943 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN(CCO)C3CCC3)nc12 275884225 QTWAPQMHRIWCGM-UHFFFAOYSA-N 334.376 0.958 10 20 ECCD CN(CCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)C1CC1 284407861 BJNPDPUYDVMKSS-UHFFFAOYSA-N 342.443 0.889 10 20 ECCD CNS(=O)(=O)N1CCC(C(=O)NCc2ccccc2O)CC1 802776913 BZDBBVMTAZGUAF-UHFFFAOYSA-N 327.406 0.185 10 20 ECCD O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)NCc1ccc(O)c(O)c1 815836318 YUJCSDCVSQYWEY-TXEJJXNPSA-N 330.340 0.665 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)NC[C@H](C)CN)C2)cc1 818676503 NYLPLOZEXZOVKJ-KGLIPLIRSA-N 348.447 0.349 10 20 ECCD COC[C@@H](OC)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 822937681 KLTGVOMTZVASDP-GOEBONIOSA-N 349.431 0.666 10 20 ECCD C[C@@H](CS(C)(=O)=O)N(C)CC(=O)NCc1ccc(N(C)C)cc1 839489346 LQQNNTJHMBONEV-ZDUSSCGKSA-N 341.477 0.734 10 20 ECCD COC(=O)CCN1CC[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1=O 849744997 ISRBVDAUYLVAKN-LYKUJDHUSA-N 349.339 0.818 10 20 ECCD CN(CCN)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 842217266 VDMBYPFIURRBCH-UHFFFAOYSA-N 336.461 0.273 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)CCn3cnnn3)C2)cc1C 1019557324 HBUYGHWHYSLIFK-HNNXBMFYSA-N 344.419 0.771 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)N3CC[C@H](N)C3)CC2)cc1 841750600 SNOSFFXHLOSLRC-HNNXBMFYSA-N 347.463 0.560 10 20 ECCD C[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)[C@H]1CCO 851688306 WLZMTMDCEWXMOA-BBRMVZONSA-N 333.432 0.937 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CC(OC)C3)CC2)cc1 759048401 FVKHOBHFIGKXQF-MRXNPFEDSA-N 335.448 0.509 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cc(OC)n[nH]2)c1 861739176 PXZFIGAAOWVZTR-MRVPVSSYSA-N 334.332 0.948 10 20 ECCD CS(=O)(=O)[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 763385573 WBJSLRXPIFWYCU-RISCZKNCSA-N 327.402 0.827 10 20 ECCD O=C(CC[C@H]1NC(=O)NC1=O)NCc1c(O)ccc2c1CCCC2 769562640 JPHOTEBYTPGCOB-CYBMUJFWSA-N 331.372 0.875 10 20 ECCD CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2)cn1 794578754 MCPYSXURYXPLHJ-UHFFFAOYSA-N 328.371 0.992 10 20 ECCD COc1ccc(CNC(=O)C2CCC3(CC2)NC(=O)NC3=O)c(O)c1 794377469 OHUOYWXKHKDOBB-UHFFFAOYSA-N 347.371 0.785 10 20 ECCD COc1ccc(CNC(=O)c2ccnc(S(N)(=O)=O)c2)c(O)c1 794386770 ACVYHIYDYHSDRY-UHFFFAOYSA-N 337.357 0.373 10 20 ECCD COc1ccc(CN[C@H]2C[C@H](C)N(C(=O)c3nnn(C)n3)C2)cc1C 989310435 BLKADQGOCSBXRO-JSGCOSHPSA-N 344.419 0.920 10 20 ECCD CN1C[C@@H](C(=O)NCCC2=CCN(c3cc(F)ncn3)CC2)NC1=O 1089855434 LFRBSSNSYFXSKI-LBPRGKRZSA-N 348.382 0.282 10 20 ECCD CCON(C)C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1337955558 NKBCSFSMOBHWBW-HNNXBMFYSA-N 336.436 0.881 10 20 ECCD C[C@H](/C=C/C(=O)O)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1592207258 ZJPFPESTFYRPPH-GWSCVKMXSA-N 328.346 0.523 10 20 ECCD Cn1nnc(Br)c1C(=O)NCCc1ccc(O)c(O)c1 810629020 ZPBZRRUFKCITDN-UHFFFAOYSA-N 341.165 0.961 10 20 ECCD CNC(=O)[C@H]1CCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 170928666 OBXAPSGYVKDIGZ-MRXNPFEDSA-N 332.448 0.921 10 20 ECCD Nc1ccc(CCNC(=O)Cn2nc3n(c2=O)CCCCC3)cc1 237939353 MRXGROKFWZAHGM-UHFFFAOYSA-N 329.404 0.712 10 20 ECCD CC[C@H](C)[C@@H](O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 269388124 WSHBFXDOUWWWIS-ZANVPECISA-N 330.406 0.901 10 20 ECCD O=C(/C=C/c1ccc(N2CCOCC2)cc1)N[C@H]1CCC(=O)NC1=O 269627346 VLFKVJNBHHABIK-MIOHMZDASA-N 343.383 0.458 10 20 ECCD C[C@H]1CC(=O)NCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 369776115 WIPHWHVZALJQSU-VIFPVBQESA-N 341.389 0.114 10 20 ECCD CN(C)C(=O)CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 275420314 HHYBEXBRHNDBME-UHFFFAOYSA-N 346.431 0.448 10 20 ECCD CC(=O)C(=O)CN1C(=O)N[C@@](C)(Cc2ccc3c(c2)OCO3)C1=O 289590618 JLULWHAGMNILHZ-INIZCTEOSA-N 332.312 0.426 10 20 ECCD Cc1cc(C(=O)NCCNS(C)(=O)=O)c(C)n1-c1ccccn1 298317626 KYIQRBMPFCHYQX-UHFFFAOYSA-N 336.417 0.768 10 20 ECCD C[C@@H]1[C@@H](N(C)C)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 816767614 CLWCAVWPKPYITN-MFKMUULPSA-N 341.433 0.928 10 20 ECCD COc1ccc(O)c(CNC(=O)CN(C)[C@H]2CCS(=O)(=O)C2)c1 734015245 BYUQMPBUMLARLZ-LBPRGKRZSA-N 342.417 0.136 10 20 ECCD CN1CCCc2cc(CNC(=O)Cn3cc(C(=O)O)nn3)ccc21 830946350 KLFLMYLVOIMAPQ-UHFFFAOYSA-N 329.360 0.675 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](N)[C@@H](C)C1 842151933 DKNSMEHVBOWNRA-XJKSGUPXSA-N 332.448 0.873 10 20 ECCD NCCNC(=O)[C@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 843047925 BXBYGWKQGOQVKW-KRWDZBQOSA-N 346.475 0.810 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CO)CC2CC2)c1 771000517 RGIJNGCNCILYMT-LLVKDONJSA-N 328.390 0.655 10 20 ECCD CN(C)C(=O)CN1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779488431 FWTKPTMEWIZAMA-XQRVVYSFSA-N 333.388 0.343 10 20 ECCD COC[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CCO1 785428368 KIXRDGCMDJGHCK-OAHLLOKOSA-N 335.404 0.243 10 20 ECCD CCN1C[C@@H](C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CC1=O 881849766 IHXYGYGVRWZYTA-INIZCTEOSA-N 344.459 0.923 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)[C@@]2(C)CCNC2=O)N(C)C)cc1 891247720 UNYDGQZCRVDYTA-YJBOKZPZSA-N 332.448 0.998 10 20 ECCD Cc1oc(S(N)(=O)=O)cc1C(=O)NCc1ccc(O)c(O)c1 798334414 XPUBQWYPSSZIRQ-UHFFFAOYSA-N 326.330 0.577 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)Cn3cnnn3)[C@H]2C)cc1C 985954642 IKHWCTMYRYCBSB-ZFWWWQNUSA-N 344.419 0.769 10 20 ECCD CC(C)(O)CC(=O)N1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 994377704 YDVYYBCUQSUJPF-UHFFFAOYSA-N 347.375 0.951 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)CN3C(=O)CNC3=O)C2)cc1 1348967573 QWJYKBXEPZIFLZ-GFCCVEGCSA-N 346.387 0.190 10 20 ECCD CN(C)c1cc(F)c(CN[C@@H](CS(C)(=O)=O)C(=O)O)cc1F 1350663606 WYCFOQLNWMOSRB-NSHDSACASA-N 336.360 0.618 10 20 ECCD CN(C)CCn1ccc(C(=O)N(CC(=O)O)Cc2ccccc2O)n1 1350801077 JEZWDBQDKVGRFM-UHFFFAOYSA-N 346.387 0.877 10 20 ECCD O=C(O)C[C@@H]1C(=O)NCCN1Cc1ccc(Br)cc1O 700994641 YKSVXMIZZNJWSI-SNVBAGLBSA-N 343.177 0.930 10 20 ECCD CN(CC(C)(CO)CO)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 127462244 PYULVFHZFQJVBG-VMPITWQZSA-N 348.443 0.986 10 20 ECCD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 282068416 DISGGDAUJWRLLH-PRHODGIISA-N 341.389 0.018 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCCCC(=O)O)cc1F 817106623 JYGPEYBYCHZRJV-UHFFFAOYSA-N 339.367 0.879 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)CCNC(=O)[C@H]1CCCN1 829764544 OITIJSLXRGAETR-MRXNPFEDSA-N 332.448 0.936 10 20 ECCD CN[C@@H]1CCN(C(=O)C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C1 842070412 OYEURPALQNNXIU-GDBMZVCRSA-N 346.475 0.929 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1cnnc1[S@@](C)=O 747808583 HRVNLFFNVCNFNS-HSZRJFAPSA-N 335.433 0.740 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNCC[C@H](C)O)CC2)cc1 843063229 UELPLPJEIFLIQA-DOTOQJQBSA-N 337.464 0.539 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCOC[C@H]1CO 923337434 LTMAYINNBNONMR-MRXNPFEDSA-N 349.431 0.550 10 20 ECCD O=C1NCC[C@H]1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 854906841 YOUUASBMMJABFT-LLVKDONJSA-N 339.342 0.554 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1COCCN1 861802258 HNZHHQBPLPNCBL-CQSZACIVSA-N 335.404 0.235 10 20 ECCD O=C1NC(=O)N2CCN(Cc3ccc(N4CCOCC4)cc3)C[C@H]12 761214720 DBEIKWKVQXDVKF-OAHLLOKOSA-N 330.388 0.259 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@@H]3CC34CC4)C2)cc(OC)n1 996380158 YLMVPPNSYWSWBQ-LBPRGKRZSA-N 331.372 0.840 10 20 ECCD COc1ccc(CNC2CCN(C(=O)[C@@H]3CNC(=O)N3)CC2)cc1C 996947257 SHPXAOCVSQKQDV-HNNXBMFYSA-N 346.431 0.766 10 20 ECCD C[C@@H](O)C[C@@H]1COCCN1C(=O)C(=O)N(C)Cc1ccccc1O 1348401141 WHZGKGBCEWCKJS-TZMCWYRMSA-N 336.388 0.349 10 20 ECCD C[C@@H](NC[C@@]1(OCCO)CCOC1)c1cccc(-c2nn[nH]n2)c1O 1603657385 NNJRIXPVISBOPU-BZNIZROVSA-N 349.391 0.391 10 20 ECCD COC(=O)[C@@H]1C[C@@H](O)CN1c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 1610190627 OKXBTLOYGYLQAZ-CEBVKENUSA-N 336.300 0.805 10 20 ECCD CN(CCCN)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1578466096 FCRZPQYOEBCQOJ-UHFFFAOYSA-N 338.427 0.559 10 20 ECCD CN(C)C(=O)CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 120530431 NKYKYZVRWXAYQU-UHFFFAOYSA-N 338.383 0.550 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN[C@H](C(=O)OC)C3CC3)nc12 276262195 BIDGTPYVHYEMQP-ZDUSSCGKSA-N 348.359 0.653 10 20 ECCD COCC[C@H]1NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 285867334 IKCSHMWVLSBTSO-OAHLLOKOSA-N 333.388 0.980 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OC[C@H]2CNC(=O)O2)c1 801241651 MOUIPBRCCITJAN-MRVPVSSYSA-N 330.318 0.029 10 20 ECCD CCOCCONC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686526 CDBARYAOHYGBFT-UHFFFAOYSA-N 335.404 0.770 10 20 ECCD O=C1CN(Cc2ccccc2O)C(=O)N1[C@@H]1CCc2nnnn2CC1 819171128 FEYBFCUALZVJEY-GFCCVEGCSA-N 342.359 0.548 10 20 ECCD COC[C@H](O)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 823531084 SLMSSUCCRGXBAS-MRXNPFEDSA-N 337.420 0.454 10 20 ECCD COCCOC1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 748403303 FKVKDXPGEJTCBP-UHFFFAOYSA-N 344.389 0.251 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCN(c3ncc[nH]3)CC2)cc1 846878904 UPXDZWZKLDBNKU-UHFFFAOYSA-N 342.447 0.914 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCN1 842172009 YXAJQBXTUPYFKS-AWEZNQCLSA-N 328.416 0.499 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NC[C@]2(C)CCCNC2)cc1 842036236 LYLQXTRZNUNEKO-GOSISDBHSA-N 332.448 0.875 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C(=O)C[C@H](C)C3=O)CC2)cc1 749987000 OGVQVENRVASIEP-ZDUSSCGKSA-N 345.399 0.739 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CCCO1 755586746 MUAINJKUMVVAQJ-OAHLLOKOSA-N 338.429 0.717 10 20 ECCD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1ncc[nH]1 866543658 TUFRTBANSFMRQN-UHFFFAOYSA-N 340.380 0.864 10 20 ECCD COc1cc(C)cc(CN2CCN(C(=O)Cn3cnnn3)CC2)c1O 894765675 KOYWBMLLXLPGJZ-UHFFFAOYSA-N 346.391 0.040 10 20 ECCD CO[C@@]1(C(=O)NCc2cc(Cl)ccc2O)CCS(=O)(=O)C1 898277062 IRPZQSSLLHERBO-ZDUSSCGKSA-N 333.793 0.866 10 20 ECCD Cn1oc(C(=O)NCCC2=CCN(c3cnc(F)cn3)CC2)cc1=O 1089824076 VHOBQHUERHGANH-UHFFFAOYSA-N 347.350 0.864 10 20 ECCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1C[C@H]2C[C@]2(CO)C1 1327620766 MNSMKRCPRQVHEW-DNVCBOLYSA-N 343.427 0.744 10 20 ECCD CN(C)c1ccc(CNC(=O)[C@H]2CCCN(CC(=O)O)C2=O)cc1 1593708841 GEPFHOJLZVULRA-CQSZACIVSA-N 333.388 0.692 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CC(=O)N(C)C3)CC2)cc1F 177272231 SCUMOJSCAANROU-GFCCVEGCSA-N 335.379 0.961 10 20 ECCD CCOCCS(=O)(=O)NCc1ccc(N2CCOCC2)cc1 263670017 GLYDBBAMNHDZSG-UHFFFAOYSA-N 328.434 0.979 10 20 ECCD CN1C[C@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1=O 267519148 UABJNAGBXIXEST-OAHLLOKOSA-N 346.431 0.895 10 20 ECCD Cc1c(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)cnn1C 285638348 FRQSWYUMNKHSRI-UHFFFAOYSA-N 347.394 0.866 10 20 ECCD Cn1ncc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 284339947 MEOBEGXIXXDOMZ-UHFFFAOYSA-N 329.404 0.954 10 20 ECCD CCN1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 285809445 WNXBYVTUGAQRBG-UHFFFAOYSA-N 344.459 0.849 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCc3ccon3)ccc21 803686079 VCHAONRNKITLJO-UHFFFAOYSA-N 328.372 0.990 10 20 ECCD C[C@H](NC(=O)C(=O)N(C)CCOCCO)c1ccc(N(C)C)cc1 807673385 SCNIYXPLGYJKKH-ZDUSSCGKSA-N 337.420 0.397 10 20 ECCD COc1cc(Cl)cc(CN[C@@H]2CS(=O)(=O)C[C@@H]2OC)c1O 826985636 JEXXHCNQKODCQB-PWSUYJOCSA-N 335.809 0.956 10 20 ECCD Cc1ccc(O)c(CNC(=O)c2cn(Cc3noc(C)n3)nn2)c1 862755147 DVCJGKKSCKFPAG-UHFFFAOYSA-N 328.332 0.962 10 20 ECCD C=CC(=O)N(C)CC(=O)NCc1ccc(N2CCC(O)CC2)cc1 862225734 FDKURHZFNZXIHH-UHFFFAOYSA-N 331.416 0.908 10 20 ECCD Cc1noc([C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 1116975679 CANBBSOXDZJUBD-SNVBAGLBSA-N 331.376 0.938 10 20 ECCD CCOC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CCO1 875006656 MSVLAIDYWPTSAM-INIZCTEOSA-N 349.431 0.633 10 20 ECCD COC(=O)N[C@@H](C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 881852357 NKQFAIVZDQFXMR-ZDUSSCGKSA-N 334.420 0.799 10 20 ECCD CN1CCN(c2ccc(CN3CC[C@@H](S(N)(=O)=O)C3)cc2)CC1 785985142 LTPWKTZESJUZGM-MRXNPFEDSA-N 338.477 0.301 10 20 ECCD COC(=O)CNC(=O)CNCc1cc(Br)cc(F)c1O 895451134 GOSFMERSUYFUSE-UHFFFAOYSA-N 349.156 0.673 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)c3cnn(C)n3)CC2)nn1 1089834839 MKDOTQYNRWMVRL-UHFFFAOYSA-N 327.392 0.870 10 20 ECCD CC1(C)CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1NCC(N)=O 996685234 ACIRVIXBLHCKCY-LBPRGKRZSA-N 346.391 0.775 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)Cc3ccon3)C2)cc(OC)n1 996368237 JQLXFYMQRBHHCE-UHFFFAOYSA-N 346.343 0.270 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)C[C@H]3CCCO3)C2)cc(OC)n1 996369405 WMPAPGMOIINGQJ-CYBMUJFWSA-N 349.387 0.609 10 20 ECCD COc1ccc(N2CCN(C(=O)CCn3cnnn3)CC2)cc1F 1333254105 QLFJCFLOZGQBGH-UHFFFAOYSA-N 334.355 0.560 10 20 ECCD O=C(C[C@]1(O)CCCNC1)NCc1ccc(N2CCC(O)CC2)cc1 1522061413 VYHBSVOTFIDNGN-LJQANCHMSA-N 347.459 0.769 10 20 ECCD NC(=O)C[C@@H]1CN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])CCO1 1608231592 GZGOZRQWOKJTNH-JRBALWBOSA-N 335.316 0.773 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@]3(C)CCNC3)CC2)cc1 269241291 BKAPWCMKNVUIEI-IBGZPJMESA-N 346.475 0.933 10 20 ECCD CN(C)CCN1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)CC1=O 269226186 SAUMUIJMJXSCQR-ZDUSSCGKSA-N 335.404 0.167 10 20 ECCD C[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)N1CCN(C)CC1 299563112 BCSZIXDPKXMZNX-MRXNPFEDSA-N 346.475 0.775 10 20 ECCD CNC[C@H]1CCCN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 817989480 PMTXLLSOCCEGIP-MRXNPFEDSA-N 332.448 0.921 10 20 ECCD O=C(CNC(=O)[C@@H]1CCCN1)NCCCSc1nccs1 829528734 WABCMGNBYSQHSZ-JTQLQIEISA-N 328.463 0.610 10 20 ECCD CC(C)C(=O)N[C@@H](CO)C(=O)N1CCOc2cc(N(C)C)ccc21 582182209 AASGEELIUWXXOV-ZDUSSCGKSA-N 335.404 0.611 10 20 ECCD CC(=O)NCCN(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 834678652 ZLFVARLOJGHMHU-UHFFFAOYSA-N 338.383 0.102 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN[C@@H](C)C2)cc1 842207668 OVXCSVVRQRFXGG-AWEZNQCLSA-N 332.448 0.969 10 20 ECCD COC(=O)N1CCC[C@@H](NC(=O)C(=O)NCCc2ccc(N)cc2)C1 842161257 MVBMDIDXIMRQFP-CQSZACIVSA-N 348.403 0.275 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCOC3)cc2)C1 752255959 LCELFSGUNMSVAA-HUUCEWRRSA-N 346.431 0.976 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CNC3CCOCC3)CC2)cc1 758210271 OSKQZBFJDAKNMW-SFHVURJKSA-N 349.475 0.947 10 20 ECCD Cc1oc(C(=O)NCCc2ccc(O)c(O)c2)cc1S(N)(=O)=O 768900640 LIAWIOUUPQRYDT-UHFFFAOYSA-N 340.357 0.619 10 20 ECCD CNS(=O)(=O)[C@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 779518909 ACSUKHWEQJLOJC-HWPRWLFBSA-N 340.401 0.651 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2COC[C@H]2O)N(C)C)cc1 899097865 IELITWKGCVEPHQ-OWCLPIDISA-N 336.436 0.414 10 20 ECCD CNS(=O)(=O)c1cc(NS(=O)(=O)N2CCCCC2)ccc1O 790408188 UOSRKXWEBFYAAU-UHFFFAOYSA-N 349.434 0.443 10 20 ECCD CCc1ncnc(N2CC=C(CCNC(=O)CNC(C)=O)CC2)c1F 1089807365 LFIZTGNXPYTWFW-UHFFFAOYSA-N 349.410 0.957 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)C(N)=O)CC2)nc(C2CC2)n1 1089861861 IBCQQGWUCBSXRV-UHFFFAOYSA-N 329.404 0.791 10 20 ECCD CO[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 1321788201 UUTYZIHQBRCOAY-MRXNPFEDSA-N 347.415 0.387 10 20 ECCD COC(=O)C1CCN(S(=O)(=O)NCc2cc(C)ccc2O)CC1 1351395342 PLQPQXNLRGFPPG-UHFFFAOYSA-N 342.417 0.920 10 20 ECCD O=C(c1cc(O)nc(O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc[nH]n1 1847895973 FARNFBLQIIFSFH-RYUDHWBXSA-N 343.343 0.345 10 20 ECCD Cc1c(CNC(=O)Cn2ccc(=O)n(C)c2=O)n(C)c2ccccc12 348637078 UBTRIVKZHOGNNQ-UHFFFAOYSA-N 340.383 0.664 10 20 ECCD O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(C(=O)[C@H]2CCCO2)CC1 272498992 SNOGNLHBVZUNFM-MQDFFIGUSA-N 346.383 0.961 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCOC[C@H]1CC(N)=O 832751391 RDEMPXQHQGTHHG-MRXNPFEDSA-N 348.447 0.287 10 20 ECCD C[C@H](O)CCNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 734215131 CTZYGEXOHUZJBL-DZGCQCFKSA-N 348.447 0.958 10 20 ECCD NS(=O)(=O)[C@H]1CCN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])C1 739191949 JOBNSGJFTNCRLE-GQPNGRKGSA-N 341.345 0.560 10 20 ECCD COCCn1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1 841005335 NEXHXSFHWIFRKU-UHFFFAOYSA-N 345.403 0.896 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCS1(=O)=O 847381345 KDZYBIHGSGTDDB-HNNXBMFYSA-N 338.429 0.717 10 20 ECCD COc1ccc(O)c(CNC(=O)N[C@H]2CCN(S(C)(=O)=O)C2)c1 844975806 UBABARHMZZARBO-NSHDSACASA-N 343.405 0.234 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1CC[C@H](N)C1 842069895 GGOYLZMXLDGZOJ-HIFRSBDPSA-N 332.448 0.668 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCS(=O)(=O)C1 845929776 FNGUWSCETGHEEI-PWSUYJOCSA-N 327.402 0.970 10 20 ECCD C[C@@H]1C[C@H](CN)CN1C(=O)C(=O)NCCCSc1nccs1 842092877 NGVFOGKSIHGQDH-GHMZBOCLSA-N 342.490 0.937 10 20 ECCD COCCNC(=N)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 849017166 HNGGDPHIMKHXKI-CQSZACIVSA-N 333.436 0.649 10 20 ECCD C[C@H]1[C@H](NC(=O)C(N)=O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1011838581 WLAYTCQWEUZRGY-GZMMTYOYSA-N 346.347 0.054 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCCn3cccn3)C2)cc(OC)n1 1020352488 RDPZUCYKLJVPFX-HDJSIYSDSA-N 345.403 0.846 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H]3C[C@H]2CN3)cc1F 884641685 QLTSHFBVCDUICN-KBPBESRZSA-N 348.422 0.861 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)Cc3nc[nH]n3)CC2)n1 1089842883 WWEBRFUSMHUKDC-UHFFFAOYSA-N 327.392 0.789 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCS(=O)(=O)CC1 1324121779 VSKJWYYRUQKJBP-SNVBAGLBSA-N 327.402 0.970 10 20 ECCD N[C@H]1C[C@H](CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 1350025580 DUDAVLKVBSZKRL-SHTZXODSSA-N 330.432 0.757 10 20 ECCD CN(CC(=O)NCC(=O)N1CCCC1)c1ccc(OCC(=O)O)cc1 1598392602 SXFDARJMSFMLCC-UHFFFAOYSA-N 349.387 0.325 10 20 ECCD O=C(O)CN1CCCC[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C1=O 1595090204 MZLMRZBPUBKDIO-HWPRWLFBSA-N 348.355 0.693 10 20 ECCD NC(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)cc1 320853645 UCLHWCUKBHFVJG-UHFFFAOYSA-N 336.325 0.990 10 20 ECCD CCN(C)S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 81182835 TXWLTJTXRMYBDT-UHFFFAOYSA-N 331.413 0.948 10 20 ECCD Cn1ccnc1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 283898625 GGXMLZWHOBUDQA-UHFFFAOYSA-N 341.415 0.953 10 20 ECCD COC[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C[C@@H](C)O1 283653474 XWUZAOJLGXHMMK-CJNGLKHVSA-N 349.431 0.631 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCC[S@](C)=O)ccc21 803687777 PPEKEXKDVJPMCH-QHCPKHFHSA-N 337.445 0.180 10 20 ECCD COC(=O)c1cnc(SCc2cc(=O)n(C)c(=O)n2C)s1 295306060 MRHLSKOKBNKUKP-UHFFFAOYSA-N 327.387 0.619 10 20 ECCD CCN1CCN(c2ccc(CNC(=O)C[C@H]3CC(=O)N3)cc2F)CC1 826719117 GKWMBUILPCQYFO-AWEZNQCLSA-N 348.422 0.862 10 20 ECCD COc1ccc(N2CCN(C(=O)c3nc(O)nc(O)c3N)CC2)cc1 746093507 IOTRPTHDBQAUCI-UHFFFAOYSA-N 345.359 0.441 10 20 ECCD Nc1ccc(NC(=O)C(=O)N2CCN(C(=O)N3CCCC3)CC2)cc1 841013596 GUGZVCDDPOSNDE-UHFFFAOYSA-N 345.403 0.567 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)NCCc2ccc(N)cc2)C[C@H](C2CC2)O1 842236394 OAXPRSPPBQTUAF-MLGOLLRUSA-N 331.416 0.953 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)CC(=O)NCC(F)(F)F)cc1 843298297 NOABZPINHNXKRJ-GFCCVEGCSA-N 346.353 0.937 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@](C)(O)C3)CC2)cc1 754050741 ROBQVFDFZWMCLU-PKOBYXMFSA-N 349.475 0.635 10 20 ECCD CC[C@H](NC)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 852825478 KZGOOWYHYOZOCE-KRWDZBQOSA-N 332.448 0.969 10 20 ECCD COC(=O)CNC(=O)CNCc1ccc(Br)cc1O 877706507 NCFWJIAVDIWPJK-UHFFFAOYSA-N 331.166 0.534 10 20 ECCD COc1ccc(-n2nnnc2CN[C@H]2CCN(C(C)=O)[C@H]2C)cc1 985860710 QBPOZYDNADVHTL-NHYWBVRUSA-N 330.392 0.770 10 20 ECCD CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1ncn2nccc2c1=O 1324065245 OCPUEQOEFXPEAA-UHFFFAOYSA-N 348.359 0.399 10 20 ECCD CC(C)N1CC[C@H](NC(=O)C(=O)N(C)Cc2ccccc2O)C1=O 1326623816 NVKSUPMFQWRTSH-ZDUSSCGKSA-N 333.388 0.476 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)N(CCN)CCO)N(C)C)cc1 1346712346 PKVMRTPIAFCNPK-MRXNPFEDSA-N 337.468 0.318 10 20 ECCD C[C@H](N[C@H]1CC(=O)N(C2CC2)C1)c1cccc(-c2nn[nH]n2)c1O 1589952437 TZSKZXHPDQJTRB-UWVGGRQHSA-N 328.376 0.986 10 20 ECCD CN(CCN[C@H]1CCN(C)C1=O)C(=O)c1ccc(N=NC(N)=O)cc1 1753267469 TWQULNSAXQTJCV-ZDUSSCGKSA-N 346.391 0.741 10 20 ECCD CNC(=O)NC(=O)[C@@H](C)N(C)Cc1ccc(N2CCOCC2)cc1 16386994 UINXQCPCTZBYRW-CYBMUJFWSA-N 334.420 0.799 10 20 ECCD O=C(CN1CCC(=O)NC1=O)NCc1ccc(N2CCCC2)cc1 205635938 SMYLMXHEXIRACP-UHFFFAOYSA-N 330.388 0.845 10 20 ECCD CN1CCCc2cc(CNC(=O)CC[C@@H]3NC(=O)NC3=O)ccc21 57549965 MGZSHSXUBWMPBT-ZDUSSCGKSA-N 330.388 0.673 10 20 ECCD CN(CC(=O)N1CCN(CC(=O)N(C)C)CC1)Cc1ccccc1O 109773523 MBLJOGWSKDLKBO-UHFFFAOYSA-N 348.447 0.056 10 20 ECCD CC(=O)NCCNC(=O)CCC(=O)N(C)Cc1ccc(N(C)C)cc1 109933716 VBXWWBBKPXRAAB-UHFFFAOYSA-N 348.447 0.744 10 20 ECCD CN[C@@H]1CCN(C(=O)C(=O)NCc2c(C)c3ccccc3n2C)C1 419711217 RTNYBYNEWLRHKF-CYBMUJFWSA-N 328.416 0.923 10 20 ECCD O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NCc1ccccc1O 266534838 KPVQSFWTQRLFFM-XOUADPBQSA-N 344.367 0.561 10 20 ECCD O=C(Nc1cnn(CCN2CCOCC2)c1)c1cccc(O)c1O 280396350 FYZYIBBHVLDXHP-UHFFFAOYSA-N 332.360 0.879 10 20 ECCD CNS(=O)(=O)[C@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 371559632 ACSUKHWEQJLOJC-PZBABLGHSA-N 340.401 0.651 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCNC(=O)C[C@H]1C)c1ccc(N(C)C)cc1 807674394 KIXNICIQKSARJZ-OLZOCXBDSA-N 346.431 0.667 10 20 ECCD CC(=O)N[C@@H]1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 817282347 FIMATTGOSBIRSN-MRXNPFEDSA-N 332.448 0.921 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnc[nH]1 725887109 GVWOBPWJMBHPTF-UHFFFAOYSA-N 334.401 0.575 10 20 ECCD COC[C@@H](OC)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 822937680 KLTGVOMTZVASDP-GDBMZVCRSA-N 349.431 0.666 10 20 ECCD C[C@@H](N)C[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 843259885 SKKUZISKPRKWIG-ZIAGYGMSSA-N 330.432 0.921 10 20 ECCD CN[C@@H](C)Cc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 842632370 KCMMWSYHWWERIM-QMMMGPOBSA-N 326.378 0.964 10 20 ECCD Cn1cc(C[C@H](CO)CNC(=O)/C=C\c2ccc(O)c(O)c2)cn1 848036202 CURNDFSFJJPIMM-MFBWXBCUSA-N 331.372 0.812 10 20 ECCD CCS(=O)(=O)CC(=O)NCc1ccc(N2CCC(O)CC2)cc1 856210633 KSWBAPKSLSEFQV-UHFFFAOYSA-N 340.445 0.699 10 20 ECCD C[C@H]1OC(=O)N[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856213206 YHIPDESLDGOPEV-ABAIWWIYSA-N 333.388 0.761 10 20 ECCD C[C@H]1COC[C@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 929803966 HGQCEKYOFYLUQM-SWLSCSKDSA-N 331.416 0.836 10 20 ECCD C[C@H](NCC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 1116651996 RDDPXIMZONODBN-GXTWGEPZSA-N 339.461 0.707 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)CC(C)C)cc1 1122794824 BYHQBUGOGIWETR-UHFFFAOYSA-N 332.408 0.923 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H](CC(N)=O)C2)c1 1329412489 JLLVKEDDBJQXFM-SECBINFHSA-N 341.389 0.101 10 20 ECCD C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnnn1C 1332393533 OQDXFPYUQZJQKM-ZDUSSCGKSA-N 349.460 0.901 10 20 ECCD C[C@@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@@H]1CN(C)CCO1 1343130715 LGJVIKSDEGFFKI-DOMZBBRYSA-N 335.404 0.186 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](OCCO)C2)cc1 1344852793 VFYAVYCVDUBTGU-MRXNPFEDSA-N 349.431 0.369 10 20 ECCD COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CC(C(=O)O)=NO3)C2)cc1 1604809591 LRKHNNPAMZVBFR-HZMBPMFUSA-N 333.344 0.620 10 20 ECCD COc1ccc(N2CCN(CCCNC(=O)[C@H]3C[C@H]3CN)CC2)cc1 1579225018 AEPJKMMYZWKPCO-YJBOKZPZSA-N 346.475 0.918 10 20 ECCD CS(=O)(=O)C1=S=C(C(=O)Nc2nc(-c3ccncc3)n[nH]2)C=C1 1584090529 PYISNNZJYFRHKR-UHFFFAOYSA-N 349.397 0.455 10 20 ECCD CN(C)CCN1C[C@H](C(=O)NCc2ccc(N(C)C)cc2)CC1=O 114161911 YTCHNEYTDWYQJB-OAHLLOKOSA-N 332.448 0.779 10 20 ECCD CCNC(=O)CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 79884662 WXRVGCCHPDRIBC-UHFFFAOYSA-N 348.447 0.831 10 20 ECCD CN(C)c1ccc(CNC(=O)CN(C)[C@@H]2CCS(=O)(=O)C2)cc1 78500611 OFNQYLGHOITHHH-OAHLLOKOSA-N 339.461 0.488 10 20 ECCD C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)c1ccccc1S(C)(=O)=O 265525683 MTRAENMWRSKOLB-GHMZBOCLSA-N 345.442 0.738 10 20 ECCD C[C@H](O)C[C@@H](C)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 267081950 CIENLZSIBCFPAF-ZJUUUORDSA-N 330.406 0.901 10 20 ECCD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)CCC(N)=O 298245741 KPOCWCFLLDIXHV-UHFFFAOYSA-N 348.447 0.823 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)c3cn[nH]c3)CC2)cc1 299493856 ISUWXQOHEWUNGQ-UHFFFAOYSA-N 329.404 0.970 10 20 ECCD COCCOC[C@H](O)CNCc1ccc(N2CCN(C)CC2)cc1 905426115 DGNSZKWDYBVPOF-GOSISDBHSA-N 337.464 0.552 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CNC(=O)[C@@H]2CCCN2)cc1 846696015 CGEHLJZXRADKGJ-INIZCTEOSA-N 348.447 0.458 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C1=NN2CCCN=C2N1 748033120 AKDNEYDHWWISBS-UHFFFAOYSA-N 342.403 0.118 10 20 ECCD Nc1c(O)nc(O)nc1C(=O)NCc1ccc(N2CCOCC2)cc1 742247015 LNIMNXVUGWCDTO-UHFFFAOYSA-N 345.359 0.237 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@]2(C)CCCNC2)cc1 842036239 LYLQXTRZNUNEKO-SFHVURJKSA-N 332.448 0.875 10 20 ECCD COc1ccc(N2CCCN(C(=O)Cn3cnc(N)n3)CC2)cc1 864949692 NGBPXWCPMZGPGM-UHFFFAOYSA-N 330.392 0.608 10 20 ECCD CN(CC(=O)NCCCN(C)S(C)(=O)=O)c1ccc(N)cc1 863556633 AJYSIIQGNKFVFF-UHFFFAOYSA-N 328.438 0.103 10 20 ECCD C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CC[C@@H]1NCC(N)=O 1036304599 CNANXTHMJDJOFH-GWCFXTLKSA-N 346.391 0.775 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@@H]2CC[C@H](C1)N2 868357037 LXHRWLCGGKSNAT-GASCZTMLSA-N 330.432 0.674 10 20 ECCD CC(=O)NCCCNC(=O)NCc1ccc(N2CCN(C)CC2)cc1 883130350 BAJLYRAVOHEHHN-UHFFFAOYSA-N 347.463 0.764 10 20 ECCD C[C@@H](CC(N)=O)NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 899098861 UBOLIROKCFZNAU-WFASDCNBSA-N 335.452 0.918 10 20 ECCD COc1ccc(CNCCNC(=O)[C@@H]2CCCS2(=O)=O)cc1C 1151683759 HTRAUPSEICUCLO-HNNXBMFYSA-N 340.445 0.787 10 20 ECCD NC(=O)C(=O)NCCC1=CCN(c2ncnc3ccccc23)CC1 1089862725 ZSPJAWZYJAOVGL-UHFFFAOYSA-N 325.372 0.758 10 20 ECCD O=S1(=O)CCC[C@H](CS(=O)(=O)NCc2ccccc2O)C1 1327398830 KVFUTEBJRQQUQV-NSHDSACASA-N 333.431 0.636 10 20 ECCD CC(=O)C(=O)COC(=O)CSCc1ccc(-c2nn[nH]n2)cc1 1602912000 LZGAQHRRJOWSNA-UHFFFAOYSA-N 334.357 0.801 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)CC(=O)O 1610017375 AGFMJIFNBULYPW-ONGXEEELSA-N 339.344 0.799 10 20 ECCD COc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3CN(C)C(=O)N3)C2)cc1C 1022546594 SQFUTYDNUFNQDD-ZNMIVQPWSA-N 346.431 0.764 10 20 ECCD CNC(=O)N1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 84696859 ZRXIOMJZVFNTDA-UHFFFAOYSA-N 347.463 0.668 10 20 ECCD COc1ccc(O)c(CN[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1 367611627 CPPWLVIAJKRSOY-OAHLLOKOSA-N 349.431 0.424 10 20 ECCD Cc1nc(S(=O)(=O)NCC(=O)NCc2ccccc2O)cn1C 725895861 SSZPAAIHXVZKHW-UHFFFAOYSA-N 338.389 0.029 10 20 ECCD CN[C@H](C(=O)NC[C@H](N)c1ccc(N(C)C)cc1)c1cnn(C)c1 832272965 KQBQNICIFILCQF-HOTGVXAUSA-N 330.436 0.563 10 20 ECCD 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CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC(=O)OCC2CC2)c1 263766821 RVQBWNOPQFJIQT-UHFFFAOYSA-N 342.373 0.447 10 20 ECCD COC[C@@]1(C)NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 277199251 DPXAGWUQPGPIRR-QGZVFWFLSA-N 333.388 0.980 10 20 ECCD COCCOCCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 284297019 RJGDSMNJBFUFCR-UHFFFAOYSA-N 341.383 0.287 10 20 ECCD CCN1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1=O 283673759 ZAPJSACNCUCLFE-UHFFFAOYSA-N 346.431 0.450 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(C)nn3)cc2)CC1 290128185 MPDJYLSQOAWQSU-UHFFFAOYSA-N 342.403 0.414 10 20 ECCD COc1ccc(O)c(CNC(=O)CCc2nc(-c3nc[nH]n3)no2)c1 734017357 FRADHEKANXYLQK-UHFFFAOYSA-N 344.331 0.818 10 20 ECCD COc1ccc(N2CCN(C(=O)CONC(=N)CN(C)C)CC2)cc1 902612671 LRROSWQIFVJMMI-UHFFFAOYSA-N 349.435 0.404 10 20 ECCD CNCCCN(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 842150196 OLIJCVOOXWEUJK-UHFFFAOYSA-N 332.448 0.753 10 20 ECCD CN(CCNC(=O)C(=O)NCCc1ccc(N)cc1)C1CCCC1 842208007 XTTKSZORWBLHOH-UHFFFAOYSA-N 332.448 0.918 10 20 ECCD COC(=O)C[C@H](C)N1CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 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CLFCDTQGPXYFCN-UHFFFAOYSA-N 338.371 0.891 10 20 ECCD CC(C)[C@@H](N)C(=O)NCCC(=O)N1CCOc2cc(N(C)C)ccc21 1340112155 NOAMQXXZGSTIPE-QGZVFWFLSA-N 348.447 0.968 10 20 ECCD C[C@]1(C(=O)O)CCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1603293157 YGVGOCNSSOUNRU-CQSZACIVSA-N 342.373 0.843 10 20 ECCD COc1cc(N2C[C@@H](O)[C@H](CC(=O)O)C2)c([N+](=O)[O-])cc1OC 1777321240 STIRMJWIDWBNHB-LDYMZIIASA-N 326.305 0.884 10 20 ECCD O=C(Cn1nc2n(c1=O)CCCCC2)NCCc1ccc(O)c(O)c1 154002552 SHMLIQLDPIABES-UHFFFAOYSA-N 346.387 0.541 10 20 ECCD CS(=O)(=O)NC[C@H]1CCCCN1C(=O)Cc1ccc(N)cc1 262037527 ZUUCXJWRJCGAOZ-CQSZACIVSA-N 325.434 0.742 10 20 ECCD CNS(=O)(=O)[C@@H]1CCCN(Cc2cc(OC)c(OC)cc2O)C1 362621367 JDZSDISENBSTAL-GFCCVEGCSA-N 344.433 0.923 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C3(NC(N)=O)CC3)C2)cc1 819585105 BNEKFSTYVGAFGZ-LBPRGKRZSA-N 332.404 0.839 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@](F)(C(=O)O)C2)c1 832699514 JDHIZTNRZGHFIJ-ZDUSSCGKSA-N 346.336 0.403 10 20 ECCD CC1CCN(CCNC(=O)C(=O)NCCc2ccc(N)cc2)CC1 842175060 MPEILAIYOPWBRU-UHFFFAOYSA-N 332.448 0.776 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(Cc3cnon3)C2)cc(OC)n1 1015105652 XVGPILRLGZORHR-LLVKDONJSA-N 333.348 0.486 10 20 ECCD C[C@H]1CO[C@H](CO)CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 766099406 VBDMCUUWHNWEHJ-YOEHRIQHSA-N 335.448 0.793 10 20 ECCD Cc1ccccc1-n1c(C)cc(C(=O)NS(=O)(=O)CC(N)=O)c1C 766916762 PFROGKZGIHZWOX-UHFFFAOYSA-N 349.412 0.947 10 20 ECCD C[C@H](NCC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 1116651997 RDDPXIMZONODBN-JSGCOSHPSA-N 339.461 0.707 10 20 ECCD COC(CN(CCCO)C(=O)/C=C/c1ccc(O)c(O)c1)OC 787286993 RQZZPPRNMSCNGS-FNORWQNLSA-N 325.361 0.941 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3C[C@@H](O)C3)cc2)CC1 899473813 ZKIBBJIQHFJDLL-FZNQNYSPSA-N 331.416 0.775 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N2CC(NC(=O)[C@H]3CCOC3)C2)cc1 990415732 KBTHNAPMCUGQAI-NSHDSACASA-N 345.359 0.826 10 20 ECCD CC(=O)N1CC(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1336919089 XJRGEPOGWZDQME-UHFFFAOYSA-N 330.432 0.533 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H](C)c1ncn(C)n1 1261185650 QBQISKJVNUFHTG-GFCCVEGCSA-N 344.419 0.683 10 20 ECCD CC[C@@H](NCCN1CCNC1=O)c1cccc(-c2nn[nH]n2)c1O 1604055001 KLNLKZRFDKAQTN-GFCCVEGCSA-N 331.380 0.638 10 20 ECCD COc1ccc(CNC(=O)CN2CCC[C@@H](C(=O)O)C2=O)c(O)c1 1599565365 ONVYTMATGLYSPJ-GFCCVEGCSA-N 336.344 0.340 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N(CCO)CCNC(=O)C2CC2)cc1 1057917471 CVEDKRYCYWSHRF-UHFFFAOYSA-N 347.375 0.810 10 20 ECCD CS(=O)(=O)CCNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 108700197 CYCBNUSYQRJTSV-QPJJXVBHSA-N 338.429 0.697 10 20 ECCD CN1C(=O)C(=CNC[C@H](c2cccc(F)c2)N(C)C)C(=O)N(C)C1=O 29006166 KDYODBMRZUYEGQ-CQSZACIVSA-N 348.378 0.952 10 20 ECCD CCS(=O)(=O)NCCN(C)Cc1ccc(N2CCOCC2)cc1 69219761 HYLAQWBVGOWVSU-UHFFFAOYSA-N 341.477 0.894 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)c3cnn(C)n3)cc2)CC1 284610768 IHIBVPXULNEVKN-UHFFFAOYSA-N 342.403 0.414 10 20 ECCD C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)N(C)C1CC1 283625135 WHIMKNYJLIDTKF-CYBMUJFWSA-N 332.448 0.968 10 20 ECCD CN(C)c1ccc(CNC(=O)N[C@@H]2CCc3nnnn3CC2)cc1 817391139 YVFGYRXODSYTTB-CYBMUJFWSA-N 329.408 0.943 10 20 ECCD CN(C)c1ccc(CNC(=O)CCn2cc[nH]c(=O)c2=O)cc1F 727852744 ASPHRIPLCBPDJV-UHFFFAOYSA-N 334.351 0.448 10 20 ECCD CC(C)[C@@H](N)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827387979 BSWGDJUJDFXGJZ-OAHLLOKOSA-N 339.461 0.521 10 20 ECCD CC(=O)N[C@H](C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917832570 AZFLXRKBUOMYCA-IUODEOHRSA-N 346.431 0.529 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@@H]2CNC[C@@H]21 842171249 RCBGSWOFYDNNSA-WBVHZDCISA-N 340.427 0.499 10 20 ECCD CN1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3C=O)cc2)CC1 918845294 KOQGTVILOXVWTD-KRWDZBQOSA-N 330.432 0.675 10 20 ECCD CC[C@@H](CNS(C)(=O)=O)NC(=O)NCCc1ccc(N)cc1 841908485 PCECUDFKGXTMPZ-ZDUSSCGKSA-N 328.438 0.438 10 20 ECCD CN(CCO)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 768048314 SNPARDJCWRHJED-AWEZNQCLSA-N 334.420 0.522 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3cc(O)ncn3)cc2)CC1 881854913 LCHMEYFAPPTNFG-UHFFFAOYSA-N 327.388 0.864 10 20 ECCD CN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1COC[C@H]1O 889372634 FCAYDNLOJWQHJP-IAGOWNOFSA-N 349.431 0.549 10 20 ECCD COC(=O)COc1ccc(N(C)CCCS(=O)(=O)N(C)C)cc1 784553199 COEOZSSLZPUTEM-UHFFFAOYSA-N 344.433 0.956 10 20 ECCD CN1CC[C@@H](C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C1=O 891247944 IWNWLQUKOLXBKU-JKSUJKDBSA-N 332.448 0.950 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)N[C@@H]3CCNC3)cc2)CC1 892007240 PJFQSTZQESSSCU-OAHLLOKOSA-N 345.447 0.549 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCCNCCNC(=O)C2CC2)cc1 1153037262 JQGISENIJKZHQI-UHFFFAOYSA-N 346.391 0.695 10 20 ECCD COC[C@@H](C)C(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089818726 AQGYYCWVOSJOLO-GFCCVEGCSA-N 345.407 0.445 10 20 ECCD CNC(=O)Cc1noc(COC(=O)/C=C/c2ccc(O)c(O)c2)n1 1320277723 GRBRXLXLUOKPAC-HWKANZROSA-N 333.300 0.526 10 20 ECCD CNC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 1321365418 VXHQDWUXGASWSZ-CQSZACIVSA-N 346.431 0.353 10 20 ECCD C[C@H](NC(=O)C(=O)N[C@@H]1CCN(C)C1=O)c1ccc(N(C)C)cc1 1323490598 QPPDVFWCRLCGIA-SMDDNHRTSA-N 332.404 0.277 10 20 ECCD O=C(CN1C(=O)CCC1=O)NCc1cccc(Br)c1O 1521428224 DJYGKQYSUOXGLM-UHFFFAOYSA-N 341.161 0.920 10 20 ECCD 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ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H]1CCCO1 283408346 YOORCBSEWYLQDG-MRXNPFEDSA-N 347.415 0.435 10 20 ECCD CC1(CNC(=O)C(=O)NCCCSc2nccs2)COC1 806013334 OMLYNGAMELTUER-UHFFFAOYSA-N 329.447 0.894 10 20 ECCD CNC[C@@H](C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827396905 WOIWOMVPNOTKCH-CYBMUJFWSA-N 339.461 0.393 10 20 ECCD NC(=O)[C@@H]1CC[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)C1 836250424 WFBYJWFEUKHAGG-CABCVRRESA-N 346.431 0.976 10 20 ECCD C[C@H](NC(=O)c1cnn(C[C@@H](O)CO)c1)c1ccc(N(C)C)cc1 832431515 PVNNGFAFJWHKFZ-BLLLJJGKSA-N 332.404 0.793 10 20 ECCD COc1ccc(N2CCN(C(=O)CN3C[C@@H](O)[C@H](OC)C3)CC2)cc1 832001424 NCHWXNYWOBWOAQ-IAGOWNOFSA-N 349.431 0.035 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCCNC2CC2)cc1F 842149374 XNWVZJADNDNWRG-UHFFFAOYSA-N 336.411 0.766 10 20 ECCD C[C@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@@H]1CCC(=O)N1 918845317 KQKCINONZUJXRS-YOEHRIQHSA-N 344.459 0.969 10 20 ECCD COC(=O)c1cc(O)c(F)cc1NS(=O)(=O)N1CCCOCC1 844661998 CUOOCRYMPKBPBX-UHFFFAOYSA-N 348.352 0.697 10 20 ECCD O=S1(=O)CCN(c2ccc(CNc3nccc(CO)n3)cc2)CC1 853792095 UWFMRICAZMPYSJ-UHFFFAOYSA-N 348.428 0.816 10 20 ECCD COc1cc(C(=O)NC2CN(Cc3snnc3C)C2)cc(OC)n1 1030615075 XFKYAONKCZDZPJ-UHFFFAOYSA-N 349.416 0.873 10 20 ECCD CO[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 1117053036 UUTYZIHQBRCOAY-INIZCTEOSA-N 347.415 0.387 10 20 ECCD COCCCN(CCOC)C(=O)C(=O)N(C)Cc1ccccc1O 1117904064 WFMMDNLNSBTMHQ-UHFFFAOYSA-N 338.404 0.862 10 20 ECCD CN1CCN(c2ccc(CN3CC(N4CC[C@@H](O)C4)C3)cc2F)CC1 1118311228 URBDLZKRNWZXFG-QGZVFWFLSA-N 348.466 0.828 10 20 ECCD NC(=O)c1ccc(NC(=O)C(=O)NCc2ccccc2O)c(F)c1 774197368 PQFLWUVKISJIIM-UHFFFAOYSA-N 331.303 0.885 10 20 ECCD CNC(=O)CCCNC(=O)NCc1ccc(N2CCN(C)CC2)cc1 883176068 VAKCFHOZWCGPHQ-UHFFFAOYSA-N 347.463 0.764 10 20 ECCD O=C(NCCC1=CCN(c2cc(F)ncn2)CC1)[C@@H]1CCNC1=O 1089856171 VMHVPOYLTIZQDO-LBPRGKRZSA-N 333.367 0.395 10 20 ECCD CCO/C=C/C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1846500860 LALUENBEVACGBJ-QPJJXVBHSA-N 347.371 0.860 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CNC1(CO)CCOCC1 69246819 YDVDRRGVLXZDJD-UHFFFAOYSA-N 335.448 0.842 10 20 ECCD COC[C@@H](O)CCNC(=O)NCc1ccc(N2CCOCC2)cc1 270870247 LRHPKSCHKRPLJZ-INIZCTEOSA-N 337.420 0.720 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccnn2C)cc1F 803664242 ICIYTSXJJKMQRP-UHFFFAOYSA-N 347.394 0.600 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)c3nnc(O)nc3O)C2)cc1 819586842 UVINCFQCOTTZET-JTQLQIEISA-N 345.359 0.548 10 20 ECCD O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1C[C@H](O)C[C@H]1CO 823537593 PWAQMRTYAZHTNV-DOTOQJQBSA-N 349.431 0.285 10 20 ECCD CN1C(=O)CC[C@H](NC(=O)NCc2ccc(N(C)C)c(F)c2)C1=O 823898276 KAFOBYASOXXSLG-LBPRGKRZSA-N 336.367 0.838 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)c1cn(C)c(=O)n(C)c1=O 735115009 ANDBMFCSTQDZPD-UHFFFAOYSA-N 331.372 0.842 10 20 ECCD O=C(CNC(=O)COc1ccccc1)NCCc1ccc(O)c(O)c1 917355571 JABPZGMJJNLINB-UHFFFAOYSA-N 344.367 0.952 10 20 ECCD C[C@@H]1CO[C@H](CO)CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 766099396 VBDMCUUWHNWEHJ-PBHICJAKSA-N 335.448 0.793 10 20 ECCD COc1cc(C(=O)NC2CN(CC3CCOCC3)C2)cc(OC)n1 1030614415 JAXOQASTPXATCJ-UHFFFAOYSA-N 335.404 0.939 10 20 ECCD O=C(O)CNC(=O)CCNCc1c(O)cccc1Br 1118978442 BUBDMRXZZKQJDN-UHFFFAOYSA-N 331.166 0.835 10 20 ECCD O=C(N[C@@H]1CCCN(CCN2CCOCC2)C1)c1cccc(O)c1O 882634557 DHKKYJRHQOSIOD-CQSZACIVSA-N 349.431 0.624 10 20 ECCD CN1CC[C@H](NC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C1=O 893116418 GLYJBZFRVHCFFR-JKSUJKDBSA-N 347.463 0.885 10 20 ECCD COc1ccc(CNC(=O)NCCCN2C(=O)CNC2=O)c(O)c1 792920592 ZDYZDWVZNUVDKG-UHFFFAOYSA-N 336.348 0.142 10 20 ECCD COc1ccc(CN[C@@H]2C[C@H](C)N(C(=O)Cn3ncnn3)C2)cc1C 988852890 WMRVCWVBDAUCBT-DZGCQCFKSA-N 344.419 0.769 10 20 ECCD O=C(NCCC1=CCN(c2nccn3nnnc23)CC1)[C@H]1CCOC1 1089813738 YCTTZUUUIVNQEE-ZDUSSCGKSA-N 343.391 0.199 10 20 ECCD COC[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)OC 1329813063 KMBZVFSONOXQNJ-HNNXBMFYSA-N 337.420 0.489 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@]23CCOC3=O)cc1 1327320972 YCXLHHMCHHUFAS-GOSISDBHSA-N 345.399 0.677 10 20 ECCD C[C@H]1CN2CCN1C[C@@H]2C(=O)NCc1ccc2cccnc2c1O 1348747284 RIRDVOUYGDMUOJ-SWLSCSKDSA-N 326.400 0.945 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)[C@H](c2cncn2C)N(C)C)cc1 1352990191 YKUWRTPFBRGKFW-WBVHZDCISA-N 344.463 0.905 10 20 ECCD O=C(O)[C@]1(C(=O)NCc2ccc(N3CCOCC3)cc2)CCCO1 1605930871 MGDCGSCGOGMUHO-QGZVFWFLSA-N 334.372 0.773 10 20 ECCD C[C@@H](NC(=O)N1CCNC(=O)C1)c1ccc(N2CCOCC2)cc1 65698332 VBXIJOWAYSAXCH-CYBMUJFWSA-N 332.404 0.726 10 20 ECCD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2nc(=O)[nH][nH]2)cc1 123199374 CHZOUXSIUNJFQJ-AWEZNQCLSA-N 345.403 0.985 10 20 ECCD C[C@@H]1OCC[C@]1(O)CNC(=O)NCc1ccc(N2CCOCC2)cc1 279417728 IGCXTIFZJSEZSS-KSSFIOAISA-N 349.431 0.862 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@H]3CO)nc12 298774209 UYVXWUSXSMEKJS-LBPRGKRZSA-N 334.376 0.958 10 20 ECCD O=C1C[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CN1C1CC1 819168609 RWDFPSQZGAUQKF-ZDUSSCGKSA-N 329.356 0.920 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N(C)CCC(=O)NC 839274987 IVOSEISLTFNONW-UHFFFAOYSA-N 335.404 0.725 10 20 ECCD CN[C@H]1CCN(C(=O)C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C1 842070614 OYEURPALQNNXIU-ZBFHGGJFSA-N 346.475 0.929 10 20 ECCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN3)cc2)C1 844176326 QMCXYDIFBGKYLX-GDBMZVCRSA-N 330.432 0.757 10 20 ECCD C[C@H]1CNCCN1C(=O)C(=O)NCCCSc1nccs1 842093927 UTELZWMZCXZYPN-JTQLQIEISA-N 328.463 0.562 10 20 ECCD O=C(c1cc(O)cs1)N1CCC(O)(CN2CCOCC2)CC1 761145702 GJEJOPAIXRBUQE-UHFFFAOYSA-N 326.418 0.753 10 20 ECCD COC(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@H]1C 1116976256 PSOSXGHWRCHJQR-SWLSCSKDSA-N 347.415 0.779 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CC(S(C)(=O)=O)C2)cc1F 1118591600 CYONCISEVMWDES-UHFFFAOYSA-N 329.397 0.830 10 20 ECCD CCNC(=O)CN1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779493361 QDYMZGSAHBMAPD-XQRVVYSFSA-N 333.388 0.391 10 20 ECCD C[C@H]1OC(=O)N[C@@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 788630145 GOFZQJPUTDCBHM-DOMZBBRYSA-N 333.388 0.979 10 20 ECCD C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CN(C)CCO1 785432686 HJYVSYJUSVQILT-CZUORRHYSA-N 348.447 0.204 10 20 ECCD COc1ccc(CN2CCN(S(C)(=O)=O)[C@@H](C)C2)c(O)c1OC 893311641 QNDDJCUUHNWHNR-NSHDSACASA-N 344.433 0.875 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)Cn3cnnn3)[C@@H]2C)cc1C 985954633 IKHWCTMYRYCBSB-HIFRSBDPSA-N 344.419 0.769 10 20 ECCD CCC(=O)N1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@H](O)C1 991568519 YVAUQVALKJMIRZ-CHWSQXEVSA-N 347.375 0.951 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@@H]3CCC(=O)N3)CC2)ncn1 1089834806 LGVCEQBYPHTYSF-AWEZNQCLSA-N 329.404 0.706 10 20 ECCD COc1ccc(CN[C@H]2CCCN(C(=O)Cn3cnnn3)C2)cc1C 998496509 PAGJLKAHCPHBDL-HNNXBMFYSA-N 344.419 0.771 10 20 ECCD CN1C[C@@H](COC(=O)c2cc(NS(C)(=O)=O)ccc2O)OC1=O 1261237969 MNQLGVIRKUILLI-VIFPVBQESA-N 344.345 0.371 10 20 ECCD C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cn(C)nn1 1350635918 ITDXARSICQIDID-CYBMUJFWSA-N 349.460 0.901 10 20 ECCD O=C(NCc1c(O)cccc1O)c1cn([C@H]2CCCNCC2)nn1 1580708373 NRKYQCCJYACAHA-NSHDSACASA-N 331.376 0.934 10 20 ECCD CN(C[C@@H]1CCC[C@H]1O)C(=O)c1cc(NS(C)(=O)=O)ccc1O 270056801 BPLIHYJKEZUSQL-GXFFZTMASA-N 342.417 0.997 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC[C@@H]1CO 284042530 MEGABPFPBYOBHZ-MRXNPFEDSA-N 347.415 0.123 10 20 ECCD OCCOC1(CNCc2cc3c(cc2O)OCO3)CCOCC1 282703049 PAUTZRQNSJRQKD-UHFFFAOYSA-N 325.361 0.769 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)c1cnn(C[C@H](O)CO)c1 830145653 CYEVVPPPYOQJMN-HNNXBMFYSA-N 333.388 0.994 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCCNC1CC1 842155023 ZPSANNZRFKRJLC-UHFFFAOYSA-N 332.448 0.936 10 20 ECCD COCCN(C)S(=O)(=O)NC[C@H](N)c1ccc(N(C)C)cc1 842786051 YRVYJUWNPURMFM-AWEZNQCLSA-N 330.454 0.165 10 20 ECCD COCCCS(=O)(=O)NCCOC(=O)c1cccc(O)c1O 758556005 BRALFYSQIJKUAK-UHFFFAOYSA-N 333.362 0.211 10 20 ECCD CCOc1cccc(CN2CCN(S(=O)(=O)N(C)C)CC2)c1O 768249380 DUWVUPZQWGPCLO-UHFFFAOYSA-N 343.449 0.715 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H](O)C[C@]1(C)CO 878982549 AUTSUPYTRQGHOE-FUHWJXTLSA-N 335.448 0.529 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)c1ccc2c(c1)C(=O)NC2=O 770629549 IGXXGMVGKYQKKI-UHFFFAOYSA-N 326.308 0.954 10 20 ECCD C[C@H]1[C@@H](NCC(N)=O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 987594097 HPHPEMXVXZBLPK-CABZTGNLSA-N 332.364 0.527 10 20 ECCD CNC(=O)CC(=O)NCCC1=CCN(c2cc(C)nc(CO)n2)CC1 1089822714 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CYLMZVLWIALNMN-JKSUJKDBSA-N 332.448 0.917 10 20 ECCD NC(=O)[C@H]1CC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856216519 XEYNHBBHPNSKSK-JKSUJKDBSA-N 331.416 0.775 10 20 ECCD NC[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCO1 851681931 RTWIBEBWZZUGIR-QGZVFWFLSA-N 348.447 0.517 10 20 ECCD CCOC[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CCO1 875006657 MSVLAIDYWPTSAM-MRXNPFEDSA-N 349.431 0.633 10 20 ECCD COC[C@]1(C(=O)N2CCN(c3ccc(OC)cc3)CC2)CNCCO1 876708248 JEPXFLBPTDSALL-SFHVURJKSA-N 349.431 0.349 10 20 ECCD CN1CCNC[C@@H]1C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1122026449 SGTAZANPOLHRPL-JKSUJKDBSA-N 333.432 0.803 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)Cc3nc[nH]n3)CC2)ncn1 1089841819 KGMMYWSKUXWNIP-UHFFFAOYSA-N 327.392 0.789 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCN(CCF)C[C@H]2O)cc1 1090839915 TUMBYNPAHWLVHA-QWHCGFSZSA-N 337.355 0.984 10 20 ECCD CS(=O)(=O)NCCNCc1cc(Br)cc(F)c1O 715764692 AVNYYVIAVYKULD-UHFFFAOYSA-N 341.202 0.933 10 20 ECCD C[C@H]1C[C@H](N)CN1C(=O)C(=O)NCCCSc1nccs1 1262065268 VUZMTMJNFLIIAA-UWVGGRQHSA-N 328.463 0.690 10 20 ECCD CC(C)[C@H](N)C(=O)NCCC(=O)N1CCOc2cc(N(C)C)ccc21 1340112153 NOAMQXXZGSTIPE-KRWDZBQOSA-N 348.447 0.968 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)CN3C(=O)CCC3=O)C2)cc1 1346795715 HQXQQXSBTFMODT-ZDUSSCGKSA-N 345.399 0.787 10 20 ECCD CN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc2c(c1)OCO2 1341158962 YBRAEPKOCMHEPO-SNVBAGLBSA-N 326.374 0.155 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CN3CCC2CC3)c1 1514564811 HASVVZZOUKSIKO-ZDUSSCGKSA-N 339.417 0.588 10 20 ECCD C[C@@H](N[C@H]1C[C@H](S(C)(=O)=O)C1)c1cccc(-c2nn[nH]n2)c1O 1589978035 FSKFIZPGOYTNFV-OPRDCNLKSA-N 337.405 0.799 10 20 ECCD COc1ccc(CN[C@H](CO)CNC(=O)[C@]2(C)CCC(=O)N2)cc1C 1755637512 BHQXQWMXYPWBCI-KSSFIOAISA-N 349.431 0.239 10 20 ECCD CN1CCN(C(=O)CCNC(=O)/C=C/c2ccc(O)c(O)c2)CC1 272362175 CDCRDZXGVIBEFJ-HWKANZROSA-N 333.388 0.391 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NCCCC(=O)O)ccc21 817107057 NIMVALYJYACBAP-UHFFFAOYSA-N 333.388 0.666 10 20 ECCD COC(=O)COc1ccc(N(C)C[C@H]2CCCN(C(=O)CN)C2)cc1 841021410 WBHWIRRTCIVHLW-CQSZACIVSA-N 349.431 0.872 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3CC[C@H]3O)CC2)cc1 843116436 PPNPBMTXFKHSMG-KBAYOESNSA-N 335.448 0.291 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)[C@H](N)CCN(C)C)C2)cc1 846682822 MLPYMNWVYUIHJZ-WMLDXEAASA-N 334.464 0.917 10 20 ECCD O=C(NCCN1C(=O)CNC1=O)NCc1c(O)ccc2c1CCCC2 743609885 JLINMXYHMKQXKB-UHFFFAOYSA-N 346.387 0.622 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H]2CNCCO2)cc1 842208122 RNXXHQUBPJLSHC-MRXNPFEDSA-N 348.447 0.254 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H](N)C3)CC2)cc1 923282493 SQCVRTXVQUBGFJ-FUHWJXTLSA-N 348.491 0.601 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)NCC(F)F 852162746 RTYDOEGAVQNEJE-UHFFFAOYSA-N 347.387 0.986 10 20 ECCD C[C@@H](O)c1cn(C2CN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)nn1 779566445 UHPPRDYEFNRXFW-RXNUUUNCSA-N 330.344 0.839 10 20 ECCD COc1ccc(-n2nnnc2CN2CCOC[C@H]2CNC(C)=O)cc1 1050776917 RUGVXZGRUKSUNU-CQSZACIVSA-N 346.391 0.008 10 20 ECCD COc1ccc(CNC(=O)NCCC(=O)N2CCOCC2)c(O)c1 792813517 OJNUZDUJIBUYOD-UHFFFAOYSA-N 337.376 0.449 10 20 ECCD CCOc1ccc(N2CCN(C(=O)CN3C(=O)CCC3=O)CC2)cc1 1347053482 POYAHCXDZOMWCY-UHFFFAOYSA-N 345.399 0.883 10 20 ECCD O=C(O)c1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)[nH]n1 1594768756 PGYSVVVSQIYDKB-UHFFFAOYSA-N 330.344 0.875 10 20 ECCD O=C(O)C[C@H]1C(=O)NCCN1Cc1ccc(Br)cc1O 700994640 YKSVXMIZZNJWSI-JTQLQIEISA-N 343.177 0.930 10 20 ECCD CCOc1ccc(CN2CCCN(C(=O)CNC(C)=O)CC2)c(O)c1 529665130 OWNGUBGQMFSHJV-UHFFFAOYSA-N 349.431 0.961 10 20 ECCD Nc1ccc(CCNC(=O)CN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1 262572417 FPACEBGDHNQZKC-XOUADPBQSA-N 343.383 0.090 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](C)[C@@H]3CO)nc12 276024283 KWUSZQPNRCOVFB-GWCFXTLKSA-N 334.376 0.814 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)NCCOCCOC 284203120 LJUUZSDEKPEAKL-UHFFFAOYSA-N 338.404 0.910 10 20 ECCD CCN(CCCNC(=O)NCc1ccccc1O)S(C)(=O)=O 299526987 RKSBHMKPRVXIMT-UHFFFAOYSA-N 329.422 0.863 10 20 ECCD CCC[C@H](C(=O)NCc1ccc(N(C)C)c(F)c1)S(N)(=O)=O 824670096 VYNLDXIIUOBXKZ-CYBMUJFWSA-N 331.413 0.965 10 20 ECCD O=C1NC(=O)[C@H]2CN(C(=O)NCc3ccc(N4CCCC4)cc3)C[C@@H]12 837626937 NJVXMJRXAZQFJM-GASCZTMLSA-N 342.399 0.701 10 20 ECCD N[C@H]1C[C@@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 844173982 HLFQYHDQLXFFBB-OKILXGFUSA-N 337.445 0.275 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1CC[C@H](N)C1 842069897 GGOYLZMXLDGZOJ-ZFWWWQNUSA-N 332.448 0.668 10 20 ECCD C[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C(=O)O 848608075 PRLHMDOWBKYJRY-GFCCVEGCSA-N 333.388 0.740 10 20 ECCD COc1ccc(N2CCN([C@H]3CC(=O)N(C)C3=O)CC2)c(OC)c1 864350606 GZOIODVIQPODAM-AWEZNQCLSA-N 333.388 0.583 10 20 ECCD C[C@@H](NC(=O)N(CCO)CCOCCO)c1ccc(N(C)C)cc1 875507108 AQBNQOGNUUFBDD-CQSZACIVSA-N 339.436 0.826 10 20 ECCD CN(C)c1ccc(Cn2cc(CN3CCS(=O)CC3)nn2)cc1 881271091 GTKOLWJVTLTDOH-UHFFFAOYSA-N 333.461 0.957 10 20 ECCD NC(=O)CCCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 787112300 RLXDWEULRDJZPZ-CQSZACIVSA-N 346.431 0.660 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@@H]3CC[C@H]3C(N)=O)CC2)nn1 1089855676 NXNGMOALRYXCPK-HUUCEWRRSA-N 343.431 0.939 10 20 ECCD COc1ccc(CNCCCNC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1C 1167388494 RMBQYTQUKFYLFP-ZDUSSCGKSA-N 348.403 0.198 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCC[C@H]1C(=O)NC1CC1 1328318887 AYBSWZPFMTUBNW-AWEZNQCLSA-N 345.399 0.620 10 20 ECCD Cc1ccc(CNC(=O)C(=O)N(C)Cc2ccccc2O)c(=O)n1C 1347306257 FPSGGQLOYJVXJE-UHFFFAOYSA-N 343.383 0.674 10 20 ECCD COc1ccc(N2CCCN(C(=O)CN3CCNCC3=O)CC2)cc1 165752745 QRIBGJQGRYVKPK-UHFFFAOYSA-N 346.431 0.166 10 20 ECCD Nc1nc(N)nc(CN(Cc2ccccc2O)C[C@H]2CCCO2)n1 123509395 QBIOSGAYDHKASE-GFCCVEGCSA-N 330.392 0.923 10 20 ECCD O=C(CCn1ccnn1)NCc1ccc(N2CCOCC2)c(F)c1 77666255 NLLXHINRBCGMFD-UHFFFAOYSA-N 333.367 0.960 10 20 ECCD Cn1cc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)cc1C(N)=O 320765922 GQPKMCAXDGQHPB-UHFFFAOYSA-N 339.329 0.329 10 20 ECCD COc1ccc(N2CCN(C(=O)c3nccnc3C(N)=O)CC2)cc1 266822803 ZQBWVQDSSOGSKX-UHFFFAOYSA-N 341.371 0.547 10 20 ECCD COc1cccc(CNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)c1O 269562846 FZMZHRGDEQHGJK-ZDUSSCGKSA-N 344.433 0.981 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@](O)(C4CC4)C3)nc12 373279738 UMJNBXQXSUADHR-QGZVFWFLSA-N 346.387 0.958 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)Cn3cccnc3=O)C2)cc1 819583952 XORHEKAQOITBSN-CQSZACIVSA-N 342.399 0.895 10 20 ECCD C[C@H]1COC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 929470182 ZPUYQBOIWRZLOK-XJKSGUPXSA-N 347.415 0.291 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(Cc3cnn(C)n3)C2)cc(OC)n1 1015104267 RKTUUCPHTAFHBP-LBPRGKRZSA-N 346.391 0.232 10 20 ECCD C[C@H](Cn1cncn1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 850435393 NBVGSPIEVKUSRQ-CQSZACIVSA-N 349.460 0.691 10 20 ECCD CN(C)C(=O)OCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 855651984 ZRMRTLFXIDDAGI-UHFFFAOYSA-N 345.377 0.192 10 20 ECCD C=CC(=O)NCCC(=O)NCc1ccc(N2CCC(O)CC2)cc1 856212243 JCFSDICRTOSTIO-UHFFFAOYSA-N 331.416 0.956 10 20 ECCD CNS(=O)(=O)[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 768444429 BFESQXARZRMTPJ-RISCZKNCSA-N 342.417 0.332 10 20 ECCD CNS(=O)(=O)C[C@H]1CCCN1Cc1cc2c(cc1O)OC[C@@H]2O 768463314 GRIYQGIBUSRYHE-RISCZKNCSA-N 342.417 0.332 10 20 ECCD COc1ccc(N(CC(=O)O)CC(=O)N2CCS(=O)CC2)cc1 872926831 LNECYYUOIUMFLD-UHFFFAOYSA-N 340.401 0.177 10 20 ECCD Cn1cc(N2CC[C@@H](NC(=O)/C=C\c3ccc(O)c(O)c3)C2=O)cn1 779483001 AAYBNAKVXBJEHC-HSBHDXMMSA-N 342.355 0.766 10 20 ECCD O=S(=O)(NCc1ccc(N2CCC(CO)CC2)cc1)N1CCC1 795849365 WDINADYAWREFPS-UHFFFAOYSA-N 339.461 0.935 10 20 ECCD COc1ccc(CNc2nc3c(c(O)nc(=O)n3C)n2C)c(O)c1 795284320 KNRYSZSBNAJEEJ-UHFFFAOYSA-N 331.332 0.699 10 20 ECCD O=C(CCCF)NCCC1=CCN(c2nccn3nnnc23)CC1 1089849793 CSBWZTGSJRFRKQ-UHFFFAOYSA-N 333.371 0.912 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)Cn3cnnn3)CC2)ncn1 1089800549 NYVAYMFAKJJDLF-UHFFFAOYSA-N 328.380 0.115 10 20 ECCD COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1ccccc1SC 1353857741 AJDQVUFPJDDSGA-LLVKDONJSA-N 343.426 0.821 10 20 ECCD C[C@H](NCCCc1cnn(C)n1)c1cccc(-c2nn[nH]n2)c1O 1589960744 GIYHJUDAFZLJDZ-JTQLQIEISA-N 328.380 0.984 10 20 ECCD CC(C)(C(=O)O)N1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 1589627726 IVTGPDOTHJOWRC-UHFFFAOYSA-N 326.324 0.858 10 20 ECCD CC(=O)N1CCN(C(=O)CN2CCOc3cc(N(C)C)ccc32)CC1 130414901 HBBNWJVXHOOWTE-UHFFFAOYSA-N 346.431 0.642 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)N[C@H]1CCS(=O)(=O)C1 271689128 IDKUPANICSRGPX-NSHDSACASA-N 339.417 0.848 10 20 ECCD C[C@@H](CN(C)C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)C(=O)O 817890715 XYVAMLAZPIQDFF-LBPRGKRZSA-N 335.404 0.890 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N(C)CCCO)C2)cc1 824981510 WEYMVYDFWCHRHU-AWEZNQCLSA-N 349.431 0.479 10 20 ECCD Cc1cc(N2CC[C@@H](NC(=O)Cc3ccc(N)cc3)C2=O)n(C)n1 830659801 YZFIJFFDZKYDDY-CQSZACIVSA-N 327.388 0.775 10 20 ECCD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CCOC3)CC2)cc1 910046737 NRHANJNIRJHQQQ-CQSZACIVSA-N 348.399 0.924 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CCN(OC)CC3)nc12 846980691 XPOZOFVLMJXEOG-UHFFFAOYSA-N 335.364 0.291 10 20 ECCD CCCNCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 842193339 ZRCDZTQOOWRDLX-UHFFFAOYSA-N 348.447 0.255 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCN[C@@H](C)C1 842153950 QUVJPYTVUIUHMI-ZFWWWQNUSA-N 332.448 0.934 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc2nnnn2c1 757637376 XRQMJWCZIHBJSN-UHFFFAOYSA-N 338.371 0.891 10 20 ECCD C[C@@H](CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O)N(C)C 855414872 CTZMBKAKDJIJJM-JTQLQIEISA-N 329.422 0.834 10 20 ECCD CNS(=O)(=O)CCCNC(=O)NCc1ccc(N(C)C)c(F)c1 868940431 QPMLVLVPNXKSDW-UHFFFAOYSA-N 346.428 0.630 10 20 ECCD COc1ccc(N2CCN(C(=O)c3nc(=N)cc[nH]3)CC2)c(OC)c1 866128252 YLBWQKYCLJLPOO-UHFFFAOYSA-N 343.387 0.869 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C(=O)N3CCCCO3)cc2)CC1 1119575396 IXBGGGPXNLPTDH-UHFFFAOYSA-N 346.431 0.609 10 20 ECCD C[C@@H](NC(=O)Cn1ccc(=O)n(C)c1=O)c1ccc(N(C)C)cc1 773028110 XWXKHZXBPLCSLQ-GFCCVEGCSA-N 330.388 0.490 10 20 ECCD O=C1NC[C@H]2CN(Cc3cc(Cl)cc(F)c3O)CCN2C1=O 775736495 HAHFGGTVSSVMNJ-JTQLQIEISA-N 327.743 0.327 10 20 ECCD COc1ccc(N2CCN(CC(=O)NCC(=O)O)CC2)cc1F 781164893 RWDXFVVLXVXDKA-UHFFFAOYSA-N 325.340 0.157 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C\COC)nc12 786589104 BJYHHLUUXDEHJQ-PLNGDYQASA-N 335.316 0.857 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)[C@@H]3CCOC3)C2)cc(OC)n1 996368231 JOLACCBKCMYFHV-SNVBAGLBSA-N 335.360 0.076 10 20 ECCD COc1ccc(N2CCN(CC(=O)N3CCNCC3)CC2)cc1F 1349487165 QANKOUZUBWZHPL-UHFFFAOYSA-N 336.411 0.388 10 20 ECCD O=C(NCc1ccc(O)c(O)c1)c1ccc(-c2nn[nH]n2)c(O)c1 1593139029 BNGKUMJIZUTKBZ-UHFFFAOYSA-N 327.300 0.914 10 20 ECCD CN(C)c1ccc(CNC(=O)CSc2nc(N)nc(N)n2)cc1 7020745 WBPNLNJPNOMSSU-UHFFFAOYSA-N 333.421 0.511 10 20 ECCD Nc1ccc(CC(=O)NC[C@H](N2CCNCC2)C(F)(F)F)cc1 262026242 PBHGKPPINSTQTG-ZDUSSCGKSA-N 330.354 0.764 10 20 ECCD CCOc1ccc(O)c(CN2CCN(C(=O)C(=O)NC3CC3)CC2)c1 271109075 YSYXVPQFLGQDML-UHFFFAOYSA-N 347.415 0.714 10 20 ECCD CC(=O)NCCCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 284360465 ZHKCUMOJXUURSW-UHFFFAOYSA-N 346.431 0.545 10 20 ECCD C[C@@H](CN(C)C(=O)C(=O)NCCCSc1nccs1)C(=O)O 817110677 KKCLGISXTQLBNV-VIFPVBQESA-N 345.446 0.921 10 20 ECCD COC(=O)c1cnc(SCC(=O)N2CCCC[C@H]2C(N)=O)s1 829687388 HPLYLEMEGZFCCM-QMMMGPOBSA-N 343.430 0.888 10 20 ECCD C[C@H](C(=O)NCCc1ccc(O)c(O)c1)n1cnc2c(N)ncnc21 830531922 OSPSNQPQPBBACC-SECBINFHSA-N 342.359 0.740 10 20 ECCD C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCN1 842149645 DHZOQCUSYMASQN-CZUORRHYSA-N 344.459 0.942 10 20 ECCD O=C(NCCN1CCNCC1)NCc1ccc(N2CC=CC2)cc1 841831175 CPJYXDFOHIGKTL-UHFFFAOYSA-N 329.448 0.767 10 20 ECCD NC(=O)c1cc(NC(=O)C(=O)NCc2ccccc2O)ccc1F 748481365 KHUGAPZCGJFGDR-UHFFFAOYSA-N 331.303 0.885 10 20 ECCD Cn1cc(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cn1 853862275 DNVSXGWAGXPKNB-UHFFFAOYSA-N 342.399 0.880 10 20 ECCD Cn1c(NCc2ccc(N3CCC(O)CC3)cc2)cc(=O)n(C)c1=O 853957184 JTAJQMMUIWAKAQ-UHFFFAOYSA-N 344.415 0.657 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)N1CCN2C(=O)NC(=O)[C@@H]2C1 760118779 SJLJAKKKXVNDCM-AWEZNQCLSA-N 345.403 0.507 10 20 ECCD COC(=O)c1cn(C2CN(Cc3cc4c(cc3O)OCO4)C2)nn1 779613238 KGNJLYBLZVIHBG-UHFFFAOYSA-N 332.316 0.556 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CCCNC2=O)c1 774179552 VABOWSQYYVMVHK-SECBINFHSA-N 341.389 0.020 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCOC1 788313109 QJTXXBOJWIMIJY-CQSZACIVSA-N 333.388 0.045 10 20 ECCD CCC(=O)N1C[C@H](O)[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 967584653 FBIOUNYPMLXNGE-NEPJUHHUSA-N 333.348 0.561 10 20 ECCD CO[C@@H](C)C(=O)NCCC1=CCN(c2cc(C)nc(CO)n2)CC1 1089810789 XVYRYFJNPFSADU-ZDUSSCGKSA-N 334.420 0.955 10 20 ECCD COc1cc(C(=O)N[C@@H](C)CCCCNCC(N)=O)cc(OC)n1 1171676441 DYYGFKLLORCAME-NSHDSACASA-N 338.408 0.462 10 20 ECCD COC[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)OC 1329120352 QSVIUQCTKVZJEN-HNNXBMFYSA-N 337.420 0.455 10 20 ECCD CO[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C[C@H]1OC 1256887143 YLJNNZCWSLQSRC-GASCZTMLSA-N 335.404 0.241 10 20 ECCD C[C@@H](NC(=O)C(=O)N1CC[C@@H](NC(N)=O)C1)c1ccc(N(C)C)cc1 1346753468 MDTCGFZGZWZLEA-DGCLKSJQSA-N 347.419 0.199 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CCF)C(=O)O)c1 1607376443 IFBPGIHXFUKUNP-VIFPVBQESA-N 334.325 0.306 10 20 ECCD CC[C@@H](NC[C@]1(O)CCN(C)C1)c1cccc(-c2nn[nH]n2)c1O 1604052972 AEHWOHYGQWJSTN-CZUORRHYSA-N 332.408 0.680 10 20 ECCD O=C(NCCn1cc(C(=O)O)nn1)NCc1cccc(Cl)c1O 1608456234 OIXNYEZYJNEUJA-UHFFFAOYSA-N 339.739 0.835 10 20 ECCD O=C(O)c1cn(C2CN(Cc3cc4c(cc3O)OC[C@H]4O)C2)nn1 1602501826 CQJQLONMRROJPG-CYBMUJFWSA-N 332.316 0.165 10 20 ECCD CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)CCn1cncn1 1753075014 LDSDBIGOCXMSAY-UHFFFAOYSA-N 344.379 0.802 10 20 ECCD C[C@@H](C(=O)NCc1ccc(O)c(O)c1)N1C(=O)NC2(CCCC2)C1=O 364993311 HCHDFITVNJXWEO-JTQLQIEISA-N 347.371 0.967 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCN(C=O)CC1 272957075 PBUKKJYVRUQYFZ-UHFFFAOYSA-N 332.448 0.875 10 20 ECCD COC(=O)C1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 271423481 NLGLCHLFPCMJQZ-UHFFFAOYSA-N 328.346 0.199 10 20 ECCD COC(=O)NCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 299142069 IKKGXVTZUBVROC-UHFFFAOYSA-N 335.404 0.868 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC(=O)N[C@@H](C)C1 298786444 RSHATUIVHYAUPS-LBPRGKRZSA-N 333.388 0.478 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)Cn2ccc(=O)n(C)c2=O)c1 728977608 BCFADGIJFYIJQF-SNVBAGLBSA-N 333.344 0.139 10 20 ECCD O=C(CNC(=O)[C@H]1CCCN1)NCc1ccc(N2CCOCC2)cc1 827567490 MCPRUFNPIWBUPV-MRXNPFEDSA-N 346.431 0.008 10 20 ECCD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)c1cc(O)cs1 732258349 KSLOAAKBSINGEF-SECBINFHSA-N 346.430 0.219 10 20 ECCD COc1cccc(CNC(=O)C2=C(C)N(C)c3nnnn3[C@H]2C)c1O 847590532 ZXDVKYQJJAXJSQ-JTQLQIEISA-N 344.375 0.989 10 20 ECCD CS(=O)(=O)N1CC[C@@H](NC(=O)NCc2cc(Cl)ccc2O)C1 845427433 ZGYNHFXZBYEIQO-LLVKDONJSA-N 347.824 0.879 10 20 ECCD CN(CCN1CCNCC1)Cc1ccc(N2CCOCC2)c(F)c1 843053314 VJULKICTLXMTLU-UHFFFAOYSA-N 336.455 0.999 10 20 ECCD CO[C@H]1CS(=O)(=O)C[C@H]1NCc1ccc(N2CCOCC2)cc1 850359526 KCQJOLCDBVMCJW-CVEARBPZSA-N 340.445 0.425 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN[C@H]3C[C@H](OC)C3)CC2)cc1 863587362 WNCKRHBXPKVUSO-SZVBFZGTSA-N 349.475 0.945 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CCO[C@H]3CN)CC2)c(OC)c1 877227266 HEYGMKYDNXURLO-PBHICJAKSA-N 349.431 0.716 10 20 ECCD COC(=O)CCNC(=O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 775256059 UFZPETDXOVQICA-AWEZNQCLSA-N 349.431 0.853 10 20 ECCD O=C1CN(Cc2ccccc2O)C(=O)N1Cc1nnc2n1CCC2 1119630287 XOWSSSHPMADGFW-UHFFFAOYSA-N 327.344 0.894 10 20 ECCD C[C@H]1NC(=S)N(Cc2ccc(N3CCC(C(N)=O)CC3)cc2)C1=O 887271043 YXZVLDSJYGXWPT-LLVKDONJSA-N 346.456 0.994 10 20 ECCD C[C@H]1C[C@@H](N)CN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 884521151 PBQAPBPDZJIJIW-SWLSCSKDSA-N 330.432 0.633 10 20 ECCD CN1C[C@H](NC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CC1=O 893460212 FBQYGPWMAUHOMG-GDBMZVCRSA-N 347.463 0.885 10 20 ECCD COc1ccc(CNC(=O)CN(C)C(=O)[C@H](C)n2cccn2)c(O)c1 794387772 LUZYMNBARSZTRF-LBPRGKRZSA-N 346.387 0.933 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@H]3COCCN3C)CC2)n1 1089819998 QPGLWKZVSIPSLB-MRXNPFEDSA-N 345.447 0.758 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCCCN[C@@H]2CCCNC2=O)cc1 1177237675 IXPOYAFURRQAAR-CYBMUJFWSA-N 346.391 0.837 10 20 ECCD Cc1ccc(O)c(CNS(=O)(=O)C[C@H]2CCCS(=O)(=O)C2)c1 1334974887 GKDXTNUSSTXCON-LBPRGKRZSA-N 347.458 0.945 10 20 ECCD c1cc(N2CCOCC2)ccc1Cn1nnnc1N1CCOCC1 1350704930 YGJQCHUWMJYKKS-UHFFFAOYSA-N 330.392 0.395 10 20 ECCD O=C(NCc1nc(-c2nn[nH]n2)cs1)c1c(F)ccc(O)c1O 1593151788 CNFPXSSTBJJITJ-UHFFFAOYSA-N 336.308 0.804 10 20 ECCD CN1CCCc2cc(CNS(=O)(=O)CCS(C)(=O)=O)ccc21 173079232 WQEAGMSKSWXWPX-UHFFFAOYSA-N 346.474 0.533 10 20 ECCD CNS(=O)(=O)CCNC(=O)NCc1ccc2c(c1)CCCN2C 187880999 BNODYKJRYGCOEW-UHFFFAOYSA-N 340.449 0.417 10 20 ECCD NC(=O)CCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 79970685 GLCYXSOXMJLJMN-UHFFFAOYSA-N 338.383 0.461 10 20 ECCD Cc1c(CNC(=O)C(=O)Nc2cn(C)nn2)n(C)c2ccccc12 340403159 LFOBZXLSEXIBGM-UHFFFAOYSA-N 326.360 0.870 10 20 ECCD COc1ccc(N2CCN(S(=O)(=O)C3COC3)CC2)cc1F 277034452 JCQZXPIDRULXNY-UHFFFAOYSA-N 330.381 0.685 10 20 ECCD COC(=O)[C@H]1CN(C(=O)c2ccoc2CC(N)=O)c2ccccc2O1 560421381 MFTHRRCSAZVRKD-CQSZACIVSA-N 344.323 0.888 10 20 ECCD Cc1noc([C@H](C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 725893630 KXOHGADLYDNPPA-ZETCQYMHSA-N 340.361 0.946 10 20 ECCD CN(CCC(=O)N(C)CC(=O)O)Cc1ccc(N2CCOCC2)cc1 737411912 DQGYSRSOJWGXDE-UHFFFAOYSA-N 349.431 0.888 10 20 ECCD NCCC(=O)NC[C@H]1CCCCN1C(=O)NCCc1ccc(N)cc1 841955875 QEYXRRBTIQJUOQ-MRXNPFEDSA-N 347.463 0.840 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@H]3CCOC(=O)N3)CC2)c(OC)c1 870165712 KKGLVNJTTOPYEN-CYBMUJFWSA-N 349.387 0.851 10 20 ECCD COCCO[C@@H]1C[C@H](CO)CN(C(=O)c2cccc(O)c2O)C1 773645039 ZQDBYJYKZBRLPK-NWDGAFQWSA-N 325.361 0.584 10 20 ECCD COc1cc(O)c(CN2CCC3(CC2)NC(=O)NC3=O)cc1OC 780891954 FCECVCJZYJWHDO-UHFFFAOYSA-N 335.360 0.583 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCNC(=O)C1CC1 1327961194 JQTWNKXBRDUSSU-UHFFFAOYSA-N 346.431 0.353 10 20 ECCD CN1CCN(c2ccc(CN3CCN(C)C[C@@H]3CN)cc2F)CC1 1329433039 KMEXJJSQNAQGMM-INIZCTEOSA-N 335.471 0.652 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)NCc2nnn(C)n2)N(C)C)cc1 1352054651 NTMHNFXDGGLAJU-CQSZACIVSA-N 346.439 0.378 10 20 ECCD O=C(O)CNC(=O)CNCc1c(O)ccc(F)c1Br 1777644182 BWRJAJIEMUWSGC-UHFFFAOYSA-N 335.129 0.584 10 20 ECCD COc1ccc(N2CCN(CCCNC(=O)[C@H]3CCNC3)CC2)cc1 178872308 SHBOQVSFJMTPHX-INIZCTEOSA-N 346.475 0.933 10 20 ECCD COC(=O)CNC(=O)CN(C)c1cc(OC)c(OC)c(OC)c1 266023190 PVSDFAQPLUCDLE-UHFFFAOYSA-N 326.349 0.438 10 20 ECCD CN(C)c1ccc(CNC(=O)Cn2ccnc2-c2nn[nH]n2)cc1 825879105 HFQFWHADVCYARQ-UHFFFAOYSA-N 326.364 0.446 10 20 ECCD Cc1ccc(C(=O)N2CCN(CC[S@@](C)=O)CC2)c(O)c1O 780949285 IZCMPXLHKFRWDY-JOCHJYFZSA-N 326.418 0.543 10 20 ECCD COC[C@@](C)(O)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 787329130 URVJGRUWPWRSMU-GOSISDBHSA-N 349.431 0.369 10 20 ECCD NC(=O)C1CCN(c2ccc(CNC(=O)C3CC(=O)C3)cc2)CC1 899473230 QDFQCQNSIKEIKE-UHFFFAOYSA-N 329.400 0.984 10 20 ECCD COc1cc(C(=O)N[C@@H]2COC3(C2)CN(C(C)=O)C3)cc(OC)n1 965755512 MUBUUUGSWWNJRJ-LBPRGKRZSA-N 335.360 0.218 10 20 ECCD COc1cc(C)cc(CN2CCCN(C(=O)CNC(C)=O)CC2)c1O 895402056 IUGGJRZZVLITDX-UHFFFAOYSA-N 349.431 0.880 10 20 ECCD CNS(=O)(=O)c1cc(NS(=O)(=O)c2cnc(C)[nH]2)ccc1O 790408279 VECKJMXNIYBRFQ-UHFFFAOYSA-N 346.390 0.133 10 20 ECCD NC(=O)CN[C@@H]1CCC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 981539965 ATRMBSVEFJRAIY-OLZOCXBDSA-N 346.391 0.965 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cncnc1 1321366114 GLDASKCQULJPNY-LBPRGKRZSA-N 331.328 0.792 10 20 ECCD Cn1cnc(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)n1 1324860142 MEFXUMNJTYEURG-UHFFFAOYSA-N 340.387 0.124 10 20 ECCD Cn1cnc(NC(=O)C(=O)NCCCSc2nccs2)n1 1324950928 DSVXLEYKMQSARZ-UHFFFAOYSA-N 326.407 0.509 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NC[C@H]1C[C@@H](N)C1 1331150999 RHTSANBXLCIFEQ-OFQRWUPVSA-N 346.475 0.962 10 20 ECCD CN1CCN(c2ccc(CNC(=O)CCn3cnnn3)cc2)CC1 1332300703 RWPIDWGTLRYOQE-UHFFFAOYSA-N 329.408 0.131 10 20 ECCD O=C(NCc1ccc(O)cc1O)[C@@H](O)c1ccc(-c2nn[nH]n2)cc1 1606832162 COFJHFBWNXWSCL-AWEZNQCLSA-N 341.327 0.628 10 20 ECCD COc1ccc(N2CCN(C(=O)CN(C)C[C@H](C)C(=O)O)CC2)cc1 1610339263 NNJUDMNFYBQPGU-AWEZNQCLSA-N 349.431 0.996 10 20 ECCD CN1CCO[C@@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 175003637 OPMQJNBNJSKDPP-GOSISDBHSA-N 347.459 0.842 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cn(C)cn3)nc12 811228487 KCBFAFRAGRHBTH-UHFFFAOYSA-N 345.315 0.702 10 20 ECCD C[C@@H](CS(=O)(=O)NCc1ccc(N2CCOCC2)cc1)C(=O)O 827564367 WGZZWUDZCPDRKL-LBPRGKRZSA-N 342.417 0.663 10 20 ECCD COc1cc(C(=O)NC2CCN([C@@H]3CCNC3=O)CC2)cc(OC)n1 1003244315 AQBNNEVEKBIQAA-CYBMUJFWSA-N 348.403 0.182 10 20 ECCD CN1[C@H]2CC[C@H]1CN(C(=O)C(=O)NCCc1ccc(N)cc1)CC2 842242152 PADRFGGVPDIWRK-HOTGVXAUSA-N 330.432 0.623 10 20 ECCD C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@@H]1O 779268213 PVRKYKWOHNTTPV-CABZTGNLSA-N 328.390 0.607 10 20 ECCD CCN[C@H](C)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 876909965 NWGPJPYILMCZDI-CQSZACIVSA-N 332.448 0.969 10 20 ECCD COC(=O)[C@]1(C)CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 785424157 MDAFYVRPSOERNH-GOSISDBHSA-N 347.415 0.780 10 20 ECCD COc1cc(C(=O)N[C@@H](C)C[C@H](C)NCCCO)cc(OC)n1 1134872531 LKZVSZJNPGAXMU-RYUDHWBXSA-N 325.409 0.968 10 20 ECCD COC(=O)NCC(=O)NCCC1=CCN(c2cc(C)ncn2)CC1 1089808918 SQWBJKBHPIUNES-UHFFFAOYSA-N 333.392 0.784 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCC[C@H](n2ccnn2)C1 1326673231 CVIZMUSYEOIPFH-AWEZNQCLSA-N 343.387 0.806 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCN(C(=O)C(=O)O)CC2)cc1 1339834635 BIIIBRLDOBOVGQ-UHFFFAOYSA-N 334.376 0.191 10 20 ECCD COC(=O)NC1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 1261083812 QWJWVWDXTOESCL-UHFFFAOYSA-N 348.403 0.244 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2CCNC[C@@H]2O)N(C)C)cc1 1578424608 OTEBMHICVWVKNT-IKGGRYGDSA-N 349.479 0.377 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@@H](C)[C@H](C)N)CC2)cc1 276948879 DLVZCIOSSBIPMA-GJZGRUSLSA-N 334.464 0.917 10 20 ECCD COc1ccc(O)c(CN2CCN(C(=O)C(=O)NC(C)C)CC2)c1 271853088 WSXQLJLELPYQCY-UHFFFAOYSA-N 335.404 0.570 10 20 ECCD C[C@@H](CO)CCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 270532105 FUIWBUGBIOMSDY-SNVBAGLBSA-N 330.406 0.902 10 20 ECCD CCCCN(Cc1ccccc1O)C(=O)C(=O)N1CC(=O)N[C@@H](C)C1 297946018 FQFARNCYLLSHNY-ZDUSSCGKSA-N 347.415 0.868 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H](CO)CC2)c1 294600632 PYSBAGFOQQAMTK-LLVKDONJSA-N 342.417 0.998 10 20 ECCD Cc1ccc(C(=O)N2CCC[C@H](n3cc(CO)nn3)C2)c(O)c1O 293844837 CSQPADZMXRGUIX-LBPRGKRZSA-N 332.360 0.967 10 20 ECCD Cc1cc(CN2CCN(CCS(N)(=O)=O)CC2)ccc1N(C)C 815071065 MPZCTKNOADXUAI-UHFFFAOYSA-N 340.493 0.467 10 20 ECCD C[C@H](NC(=O)N1C[C@H]2C(=O)NC(=O)[C@H]2C1)c1ccc(N(C)C)cc1 838560414 WQLQJXRKONKQLQ-LEWSCRJBSA-N 330.388 0.728 10 20 ECCD Cn1nncc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 837713233 BNLBKYKYHKTWOH-UHFFFAOYSA-N 337.330 0.860 10 20 ECCD Nc1ccc(CCNC(=O)N2CCC[C@@H](N3CCNCC3=O)C2)cc1 841955498 FEONMCHCBVYSIW-MRXNPFEDSA-N 345.447 0.417 10 20 ECCD C[C@@H](CO)[C@H]1CCCCN1C(=O)C(=O)NCCc1ccc(N)cc1 851688294 WCDBYABUPBWNNJ-XJKSGUPXSA-N 333.432 0.937 10 20 ECCD O=C(CN1CCCNC1=O)NCc1ccc(N2CCC(O)CC2)cc1 856210037 MPZWITXOHBJKFT-UHFFFAOYSA-N 346.431 0.679 10 20 ECCD C[C@@H]1OC(=O)N[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856213209 YHIPDESLDGOPEV-XHDPSFHLSA-N 333.388 0.761 10 20 ECCD CN(C)c1cc(F)c(CNCCNS(=O)(=O)N(C)C)cc1F 862364518 BOFXMOIEJPANGK-UHFFFAOYSA-N 336.408 0.516 10 20 ECCD COc1ccc(CNC(=O)CN(C)c2ncnc3[nH]cnc23)c(O)c1 794376239 DANOEWGORAMJGK-UHFFFAOYSA-N 342.359 0.820 10 20 ECCD COC[C@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@@H]1CCCO1 1323639904 UXQICOBCMQODTB-ZFWWWQNUSA-N 336.388 0.661 10 20 ECCD CN1CCN(c2ccc(CNC(=O)C(=O)NC3CC=CC3)cc2)CC1 1331736278 WFFYQWXERWODHQ-UHFFFAOYSA-N 342.443 0.889 10 20 ECCD COc1ccc(O)c([C@@H](C)NCC(=O)N2CCC(C(N)=O)CC2)c1 1337210328 FACYPLDDNBNJIX-LLVKDONJSA-N 335.404 0.775 10 20 ECCD CC(C)CONC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1353817456 KCVAGPUZZIYGKI-UHFFFAOYSA-N 348.447 0.758 10 20 ECCD CN(Cc1cc(=O)n2nc(N)[nH]c2n1)c1ccc(OCC(=O)O)cc1 1606145878 NOBJPIXIQYXNGT-UHFFFAOYSA-N 344.331 0.100 10 20 ECCD CCS(=O)(=O)NCC(=O)NCc1ccc(N2CCOCC2)cc1 269274786 ICFKKMPIZJZDBX-UHFFFAOYSA-N 341.433 0.079 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CCN(C[C@@H](C)O)CC2)c1O 278426909 SKSZGGJYFJYIHB-LLVKDONJSA-N 325.365 0.807 10 20 ECCD NS(=O)(=O)c1cccc(S(=O)(=O)Nc2ccc(O)cc2)c1 817920017 YOQFYDNEGCSGCM-UHFFFAOYSA-N 328.371 0.840 10 20 ECCD COc1ccc(N2CC[C@@H](CNS(=O)(=O)C3COC3)C2)cc1 819888292 UPXRIDYJWVXXON-LBPRGKRZSA-N 326.418 0.840 10 20 ECCD COC(=O)[C@@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)CCO1 728575315 VNGBBRRHANVRBJ-HNNXBMFYSA-N 335.404 0.243 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H](O)C3CC3)cc2)C1 822938854 ZMZSFQHDVGXLOW-HOCLYGCPSA-N 331.416 0.775 10 20 ECCD 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337.288 0.095 10 20 ECCD CC(C)C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)O 819972617 RQSPZMWIUBZHAO-NSHDSACASA-N 344.389 0.993 10 20 ECCD CCOC(=O)CN(CC(=O)N1CCNC1=O)Cc1ccccc1O 823582073 WZUOVNIHZCVXKK-UHFFFAOYSA-N 335.360 0.309 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@H]1CC(C(N)=O)=NO1 838480002 VOMNVZQRFPPUPU-ZDUSSCGKSA-N 333.392 0.490 10 20 ECCD CNC(=O)CCCC(=O)NCc1ccc(N2CCN(C)CC2)cc1 918857756 SPFMWHAOPLIBSD-UHFFFAOYSA-N 332.448 0.971 10 20 ECCD CN(C)C(=O)Cn1cc(-c2nc(Cc3ccc(N)cc3)no2)nn1 843160439 YGWSZRKOHRFOBF-UHFFFAOYSA-N 327.348 0.589 10 20 ECCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC/C=C\CO)cc2)C1 853466312 YNGAKXYVZZIPLB-OYADATRGSA-N 346.431 0.736 10 20 ECCD CNC[C@H](C)NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 851690667 IYLUJJAQJQOGHM-ZFWWWQNUSA-N 349.431 0.624 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](CCO)C3CC3)nc12 763069140 SHKGYLRMXUHEDK-ZDUSSCGKSA-N 334.376 0.862 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2CN([C@H]3CCCNC3=O)C2)cc1 1031463928 BIBWVYXTOBJKHU-ZDUSSCGKSA-N 344.375 0.542 10 20 ECCD 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C[C@@H](CNC(=O)C(=O)N(C)Cc1ccccc1O)Cn1cccn1 1117086112 RCIIZQQPDHDYGA-ZDUSSCGKSA-N 330.388 1.000 10 20 ECCD COc1cccc(O)c1CN(C)CC(=O)N[C@@H]1CCS(=O)(=O)C1 768871777 MBQZBOHUYUBBGO-LLVKDONJSA-N 342.417 0.136 10 20 ECCD COc1cc(C(=O)NC2CN(Cc3nccn3C)C2)cc(OC)n1 1030611868 XBGSWTVPRDYHOI-UHFFFAOYSA-N 331.376 0.447 10 20 ECCD COc1c([N+](=O)[O-])ccc(CN2CC[C@@H](S(N)(=O)=O)C2)c1O 775109614 ZJVIAFHPPHDJLT-SECBINFHSA-N 331.350 0.172 10 20 ECCD CN(Cc1cc2c(cc1O)OC[C@@H]2O)[C@@H]1CCN(S(C)(=O)=O)C1 793588217 LFFJWSAYFZIGNM-RISCZKNCSA-N 342.417 0.284 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)[C@H]3CCN(C)C3=O)CC2)nn1 1089853983 MBPQJMAWUFAPGU-OAHLLOKOSA-N 343.431 0.906 10 20 ECCD COC[C@H](C)N1C[C@H](O)[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1084108805 GGSQVBBZTNDBDD-GDLCADMTSA-N 349.391 0.659 10 20 ECCD O=C(CS[C@@H]1CCS(=O)(=O)C1)NCc1ccc(O)c(O)c1 1319254765 YVJKZFDBYFBIHS-SNVBAGLBSA-N 331.415 0.634 10 20 ECCD C[C@H](N)C[C@@H](C)NC(=O)C(=O)C(=O)C(=O)NC[C@@H]1C[C@H]2C=C[C@H]1CC2 1329470045 PIKRXOJLMDUXPV-NDKCEZKHSA-N 349.431 0.085 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1CC(=O)N(C2CC2)C1 1323373462 KIAUELLATKFAJU-LBPRGKRZSA-N 345.399 0.478 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CCCC2(C1)OCCO2 1325150854 JZXJHPGAKIFTTA-UHFFFAOYSA-N 334.372 0.716 10 20 ECCD O=S(=O)(NCc1ccccc1O)c1cncc(-c2nn[nH]n2)c1 1607067196 CZZQZXDVSKMWKM-UHFFFAOYSA-N 332.345 0.446 10 20 ECCD C[C@H](O)CN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H](C)CO 190813438 BVWBRLXSRRKCLU-GJZGRUSLSA-N 337.464 0.775 10 20 ECCD CCOC(=O)CN(C)C(=O)CN1CCN(c2ccc(OC)cc2)CC1 264722412 PHPQHGOPHZKKGJ-UHFFFAOYSA-N 349.431 0.839 10 20 ECCD O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCc1ccc(O)c(O)c1 269138547 YZZZSJULVNSKBW-RYUDHWBXSA-N 332.356 0.889 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCNC(=O)[C@@H]1C)c1ccc(N(C)C)cc1 807674876 RSDLPDGPHUFVKA-RYUDHWBXSA-N 332.404 0.277 10 20 ECCD COc1ccc(N2CCCN(C(=O)C(=O)NCCC(=O)O)CC2)cc1 817115397 PZCZZMSTYNVHBR-UHFFFAOYSA-N 349.387 0.325 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N[C@H]3CCOC3)C2)cc1 824934746 GDHZUQZSFOFPJO-KBPBESRZSA-N 347.415 0.543 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)C1CN(S(C)(=O)=O)C1 900895110 MDNDXUPXKSFHRG-UHFFFAOYSA-N 339.417 0.369 10 20 ECCD COc1ccc(N(C)CCN(C)Cc2cc(=O)n(C)c(=O)n2C)cc1 844399668 MJSMAHSAZXZRTK-UHFFFAOYSA-N 346.431 0.661 10 20 ECCD C[C@@H](CN)CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 842250582 WBLJVTPOGUMOHG-DZGCQCFKSA-N 349.431 0.611 10 20 ECCD CCN(CCN)C(=O)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 861782770 JZWFJTGVCUZJMO-AWEZNQCLSA-N 348.447 0.445 10 20 ECCD Cn1cnnc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 866582206 IEIIVGFKZGLBEE-UHFFFAOYSA-N 337.405 0.130 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1nc2ncccn2n1 773764254 ZBIVLTNLCYJECF-SNVBAGLBSA-N 327.344 0.825 10 20 ECCD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCCCO)CC2)cc1 778231181 FFDJKZHKLXAVAK-BQYQJAHWSA-N 347.415 0.399 10 20 ECCD COC[C@H](NCc1ccc(N2CCOCC2)c(F)c1)C(=O)OC 789576858 RSBROZWWJFMJFJ-AWEZNQCLSA-N 326.368 0.940 10 20 ECCD CC(C)NS(=O)(=O)NCc1ccc(N2CCN(C)CC2)cc1 882663468 YQLYQAWQLXPEFJ-UHFFFAOYSA-N 326.466 0.771 10 20 ECCD CC(=O)NCC(=O)NCCC1=CCN(c2ncnc3[nH]cnc23)CC1 1089807758 UBEOPKOSUDCHMB-UHFFFAOYSA-N 343.391 0.132 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1CC(=O)N[C@@H]2CCCC[C@H]21 1324862011 DMZIMPLFYMMIFO-ZIAGYGMSSA-N 345.399 0.620 10 20 ECCD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CC12CCS(=O)(=O)CC2 1321436684 SSQPHSGZUXLFGU-LBPRGKRZSA-N 339.413 0.971 10 20 ECCD COc1ccc(CNCCCN(C)S(C)(=O)=O)c(O)c1OC 1336798199 PYPBPLFZZPPZID-UHFFFAOYSA-N 332.422 0.781 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)NCCN2CCNC2=O)cc1 1337077612 HLGGHCLJCRNVAI-UHFFFAOYSA-N 349.435 0.798 10 20 ECCD O=C(COc1ccc(N2CCCC2)cc1)N[C@H]1CCS(=O)(=O)C1 1331095389 NSEFHSBKZLIXBG-ZDUSSCGKSA-N 338.429 0.969 10 20 ECCD Cc1cc(O)c(CN(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1C 60065846 KPFNBMOHMJQTFJ-CQSZACIVSA-N 340.445 0.744 10 20 ECCD CCNC(=O)CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 79884774 RSOCJDRDEJLQCI-UHFFFAOYSA-N 338.383 0.598 10 20 ECCD C[C@]1(C2CC2)NC(=O)N(CC(=O)NCCc2ccc(O)c(O)c2)C1=O 269178059 HILJCXKWMDAVHM-QGZVFWFLSA-N 347.371 0.477 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC(=O)N(C)C[C@H]1C 807098502 XBEGOWKMIQFXCE-CYBMUJFWSA-N 346.431 0.366 10 20 ECCD COC[C@]1(C(=O)OC)CCN(C(=O)c2c(F)ccc(O)c2O)C1 295752278 UURSRVNEOJKMGB-HNNXBMFYSA-N 327.308 0.889 10 20 ECCD Cn1nnc2c1C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)CC2 811345940 VLKPJBRELFGUBW-SNVBAGLBSA-N 331.328 0.757 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)C(=O)NCC(C)(C)N)N(C)C)cc1 911294309 FCGJUSRQSCKJCB-OAHLLOKOSA-N 349.479 0.325 10 20 ECCD C[C@H]1C[C@@H](CN)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 842171806 XIXZBULMADXWAQ-HOCLYGCPSA-N 342.443 0.875 10 20 ECCD CN(C)C(=O)CCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852183154 GHSMWGNFYAMAEH-UHFFFAOYSA-N 348.447 0.925 10 20 ECCD CN1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCC1=O 852581805 XFWXSLSDTZZJQL-UHFFFAOYSA-N 332.448 0.875 10 20 ECCD CN1CC[C@H]1CNC(=O)C(=O)NCCCSc1nccs1 930196943 BVYKHVRGCLQZDS-JTQLQIEISA-N 328.463 0.562 10 20 ECCD CCNC(=O)CC(=O)N1CCN(c2ccc(OC)cc2OC)CC1 870168057 WSOXYDJZFAJYIP-UHFFFAOYSA-N 335.404 0.879 10 20 ECCD CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2cccc(O)c2O)CC1 776280935 ZHSGVYYWMYWCGF-SNVBAGLBSA-N 336.344 0.334 10 20 ECCD CS(=O)(=O)N1CCC(NC(=O)/C=C/c2ccc(O)c(O)c2)CC1 779492291 IQQOZOIZCDTTRL-HWKANZROSA-N 340.401 0.651 10 20 ECCD COCCN(C)C[C@H](O)Cn1cc(COc2ccc(N)cc2)nn1 881418039 DOZYUBIBRGDRMO-HNNXBMFYSA-N 335.408 0.378 10 20 ECCD NC(=O)[C@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@@H]1C(N)=O 895315056 WTBGKDPNPPSJSK-HOTGVXAUSA-N 330.432 0.696 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@@H]3CCC(=O)N3)CC2)n1 1089834588 JECYAEYFJGVPHD-AWEZNQCLSA-N 329.404 0.706 10 20 ECCD COc1ccc(CNC[C@H]2C[C@H](NC(=O)Cn3ncnn3)C2)cc1C 983687752 ACYMRJGLATYPET-SHTZXODSSA-N 344.419 0.675 10 20 ECCD CC(=O)N[C@@H](C)C(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089799439 IWUQQKYPTRDSIY-NSHDSACASA-N 335.383 0.783 10 20 ECCD C[C@H]1[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CCCN1CC(N)=O 994500369 YAFKTZYPIRXHHJ-GWCFXTLKSA-N 346.391 0.917 10 20 ECCD NC(=O)CNCC1(CCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1168419862 YPDWCJCOHLMAJE-UHFFFAOYSA-N 346.391 0.824 10 20 ECCD CN(C(=O)C(=O)NCCCSc1nccs1)[C@H]1CCNC1=O 1342164423 FDLZKYSMHFZVND-VIFPVBQESA-N 342.446 0.088 10 20 ECCD CCOC(=O)[C@H](N)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1343165939 MNIMTBXHNYGEPU-LSDHHAIUSA-N 336.436 0.362 10 20 ECCD CCOC(=O)c1ccc(-c2nn[nH]n2)c(SCC(=O)C(C)=O)n1 1604388502 FUCLKGCZEPTAIC-UHFFFAOYSA-N 335.345 0.689 10 20 ECCD O=C(O)[C@@H]1C[C@H](O)CN(Cc2ccc(N3CCC(O)CC3)cc2)C1 1601770190 UUOKTPMMPLFZJH-PBHICJAKSA-N 334.416 0.915 10 20 ECCD COc1ccc(CNC[C@@H](O)CNC(=O)Cc2cnoc2)cc1C 1753924414 ARGQXZDCQUYZMA-OAHLLOKOSA-N 333.388 0.801 10 20 ECCD CC(C)NC(=O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 55133723 NBHRUOXSLZGNOP-UHFFFAOYSA-N 329.378 0.018 10 20 ECCD CCN(CC)c1ccc(CNC(=O)NCCS(N)(=O)=O)cc1F 264620672 PUDNBHYFLVNPTR-UHFFFAOYSA-N 346.428 0.760 10 20 ECCD C[C@H]1CN(c2ccc(CNC(=O)[C@@H]3CC(=O)N3)cc2F)C[C@@H](C)O1 822688088 KGGSHCDHTMYNIX-WDMOLILDSA-N 335.379 0.944 10 20 ECCD CS(=O)(=O)N1CC(C(=O)NCc2c(O)ccc3c2CCCC3)C1 901132160 RLECFVISALEUEN-UHFFFAOYSA-N 338.429 0.779 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1CC[C@@H](CN)C1 842070054 LCHDNFKUXLXBSD-GJZGRUSLSA-N 346.475 0.915 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)c2ccco2)c1 919812443 DZTBTLQRELRRPF-LBPRGKRZSA-N 340.357 0.820 10 20 ECCD C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@H]1CN 842035116 CSMJOWZFPHFPAV-BBRMVZONSA-N 332.448 0.955 10 20 ECCD Cn1c(S)nnc1CCN1C(=O)CN(Cc2ccccc2O)C1=O 925302059 VKVHKFFIKRBFCV-UHFFFAOYSA-N 347.400 0.816 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3CCN3C)ccc21 929806325 YKOSIPWCFSDVNT-OAHLLOKOSA-N 330.432 0.506 10 20 ECCD C[C@@H]1NC(=O)[C@@H](C)N(CC(=O)NCc2ccc(N(C)C)cc2)[C@H]1C 930838521 ZGTVYWXFJHLHQZ-MELADBBJSA-N 332.448 0.966 10 20 ECCD COc1ccc(N2CCN(C(=O)CNC(=O)C3CC3)CC2)c(OC)c1 870163956 KGFOBWCQVVPCTI-UHFFFAOYSA-N 347.415 0.879 10 20 ECCD CCCNS(=O)(=O)NCc1ccc(N2CCN(C)CC2)cc1 882662325 FCXINUWRLBFLNB-UHFFFAOYSA-N 326.466 0.772 10 20 ECCD COc1ccc(CNC(=O)[C@](C)(O)Cn2ccc(C)cc2=O)c(O)c1 794382074 XEZFCWMEAFOOSD-GOSISDBHSA-N 346.383 0.938 10 20 ECCD CNC(=O)C1(C(=O)NCCC2=CCN(c3ccnc(C)n3)CC2)CC1 1089838300 OCHAGNKYWCYTJP-UHFFFAOYSA-N 343.431 0.954 10 20 ECCD COCCCOCCN(C)C(=O)C(=O)N(C)Cc1ccccc1O 1328336005 DDSPAEKVUMHYSA-UHFFFAOYSA-N 338.404 0.862 10 20 ECCD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C[C@@H](O)CN)cc1 1340184906 QUSPQGPDVGGWIL-IAGOWNOFSA-N 335.448 0.970 10 20 ECCD CC(C)[C@@H](N)C(=O)NCCC(=O)NCc1ccc(N(C)C)c(F)c1 1340190315 JUVSWMUYYNFWTE-MRXNPFEDSA-N 338.427 0.998 10 20 ECCD CN(Cc1ccccc1O)c1nnnn1CCCN1CCOCC1 1351020967 PRIMFGLTIOOENI-UHFFFAOYSA-N 332.408 0.737 10 20 ECCD O=C([C@@H]1CCOC1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251275 OZGDLMLEUVZEND-LLVKDONJSA-N 347.371 0.346 10 20 ECCD COC[C@]1(C(=O)O)CN(Cc2ccc(OC)c(OC)c2O)CCO1 1593984366 PSOQMVUBFCWKOR-INIZCTEOSA-N 341.360 0.711 10 20 ECCD COc1ccc(N(C)CCN(C)CCc2cn(CC(=O)O)nn2)cc1 1599584529 XAVPYNINHARADH-UHFFFAOYSA-N 347.419 0.982 10 20 ECCD O=C(/C=C/c1ccc(N2CCOCC2)cc1)N[C@@]1(CO)CCOC1 185267041 JUJQZWDPTKWBGO-HNSSHINMSA-N 332.400 0.804 10 20 ECCD O=C(O)C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 325721306 UIZQXGWIUYIXAJ-MRVPVSSYSA-N 337.288 0.606 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C)[C@H](CO)C3)nc12 276746538 HAKAAOXCQLGJPV-MNOVXSKESA-N 334.376 0.672 10 20 ECCD CCCN(Cc1ccccc1O)C(=O)NCCN1CCNC(=O)C1 272756199 FJEGYKWYKNPEEQ-UHFFFAOYSA-N 334.420 0.746 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCNC(=O)C2)cc1 283888327 FVMKFGZSQPZRHY-UHFFFAOYSA-N 332.404 0.107 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)NOCCOC)cc1F 804851737 MTVMMPRHRBXMLS-UHFFFAOYSA-N 341.383 0.982 10 20 ECCD CN(C)C(=O)CN1CCC(NC(=O)c2c(F)ccc(O)c2O)CC1 295274148 ORSTYOYLGFCQQD-UHFFFAOYSA-N 339.367 0.519 10 20 ECCD Cn1cc(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 299491487 IMMAPJUNRDONNK-UHFFFAOYSA-N 328.372 0.756 10 20 ECCD NC(=O)c1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1F 726854329 KUHBAZZSWYAKRP-UHFFFAOYSA-N 331.303 0.885 10 20 ECCD O=C1CC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)N1 732274167 LXCNVCCGJSEOIQ-AWEZNQCLSA-N 335.379 0.682 10 20 ECCD C[C@H](NC(=O)[C@@H]1OCCN(C)C1=O)c1ccc(N2CCOCC2)cc1 900386894 KFCYBCYLYXNFPF-BBRMVZONSA-N 347.415 0.558 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H]2CCOC2)cc1 846730887 ROMJBSZKAMJFOU-CYBMUJFWSA-N 335.404 0.495 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H](CN)C2CC2)cc1 846341658 DODZLBBZKHBDFG-MRXNPFEDSA-N 348.447 0.443 10 20 ECCD COc1ccc(N2CCN(C(=O)N[C@@H]3COC(=O)C3)CC2)cc1F 923740946 PNBVKQYUCPIAQW-NSHDSACASA-N 337.351 0.981 10 20 ECCD COc1ccc(N2CCCN(C(=O)c3cn(CCN)nn3)CC2)cc1 851629971 DNCFXRQOGJVDIV-UHFFFAOYSA-N 344.419 0.598 10 20 ECCD O=C(c1cc(O)cs1)N1CCC(N2CCS(=O)(=O)CC2)CC1 760431904 KSDQGCGHCJYSKD-UHFFFAOYSA-N 344.458 0.789 10 20 ECCD CNS(=O)(=O)[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 768444426 BFESQXARZRMTPJ-BXUZGUMPSA-N 342.417 0.332 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)N1CC[C@@H](S(N)(=O)=O)C1 770628868 GFAQEMFHKZAOKD-CQSZACIVSA-N 340.449 0.633 10 20 ECCD CCN1CCN(CC(=O)N[C@H](C)c2ccc(N(C)C)cc2)C(=O)C1=O 773022583 GYUIDOVBROAZPH-CYBMUJFWSA-N 346.431 0.621 10 20 ECCD 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ECCD Cc1cc(C(=O)CN2C[C@H](O)[C@@H](O)C2)c(C)n1-c1ccc(F)cn1 859455189 YCKNDJCWZJBSJA-HOTGVXAUSA-N 333.363 0.848 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NCc3cncn3C)C2)cc(OC)n1 1020352370 LJJUZLWWYVURSC-JOCQHMNTSA-N 345.403 0.883 10 20 ECCD O=C(NCc1ccc(O)c(O)c1)C1=CC=CN2CCS(=O)(=O)N=C12 768914758 ZJZYDNKWDGVNJN-UHFFFAOYSA-N 349.368 0.212 10 20 ECCD C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1C(=O)O 861712687 RQYHDLNEOBLDOQ-WFASDCNBSA-N 347.415 0.938 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(C(=O)[C@@H]3CCCO3)C2)cc(OC)n1 941654045 QUHAMNCWQAVRCD-OLZOCXBDSA-N 349.387 0.609 10 20 ECCD COc1ccc(O)c([C@H](C)NCC(=O)N2CCN(C(C)=O)CC2)c1 775370933 JSBHWMBEXGWKMF-LBPRGKRZSA-N 335.404 0.742 10 20 ECCD CNS(=O)(=O)N1CCC(C(=O)N(C)Cc2ccccc2O)CC1 797191663 VSPPVXBBWRHVGR-UHFFFAOYSA-N 341.433 0.527 10 20 ECCD COC(=O)c1cn(CCNC(=O)NCc2ccc(OC)cc2O)nn1 790907227 VXYBQGBOGFYWFF-UHFFFAOYSA-N 349.347 0.278 10 20 ECCD CCOCC(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089800352 KZULIXZDAZWWII-UHFFFAOYSA-N 331.380 0.199 10 20 ECCD CN(CCNC(=O)C(=O)N(C)Cc1ccccc1O)CC(F)(F)F 1323788416 ZKXLDZUZJZRDHH-UHFFFAOYSA-N 347.337 0.961 10 20 ECCD O=C1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCCN1 1331146187 LVUTZEUXHJMNEJ-UHFFFAOYSA-N 344.415 0.252 10 20 ECCD C[C@@H](NC(=O)C(=O)NC[C@@]1(C)CCC(=O)N1)c1ccc(N(C)C)cc1 1331652860 ZTEIBAJQFJHYRD-KZULUSFZSA-N 346.431 0.715 10 20 ECCD C[C@H](NC(=O)C(=O)N1CCOC[C@H]1CCO)c1ccc(N(C)C)cc1 1333430931 YQFAUFYJNXTGFC-XJKSGUPXSA-N 349.431 0.540 10 20 ECCD C[C@H](O[C@@H](C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1)C(=O)O 1262078293 DLEOLRZZPXSDQH-KBPBESRZSA-N 349.431 0.933 10 20 ECCD Cn1cnc(/C=C/C(=O)N2CCCc3nc(-c4nn[nH]n4)ccc32)c1 1606261021 YXDWFCLZRPOAKW-QPJJXVBHSA-N 336.359 0.988 10 20 ECCD COc1cccc(CNC(=O)[C@@H](C)n2cnc(-c3nn[nH]n3)n2)c1O 1591638720 FQUSWWHJHLOSES-MRVPVSSYSA-N 344.335 0.050 10 20 ECCD C[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)S(C)(=O)=O 55524238 KZZAFXRKCCKFHX-LLVKDONJSA-N 344.408 0.712 10 20 ECCD C[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)N(C)C1CC1 69533714 IZJFYYQNBBREML-SNVBAGLBSA-N 341.433 0.976 10 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IBTGDDFDLWGVPS-DZGCQCFKSA-N 339.367 0.221 10 20 ECCD COc1ccc(CNC[C@@H]2CCCN2C(=O)Cn2cnnn2)cc1C 1044915786 UISSKTKCTHFQFX-HNNXBMFYSA-N 344.419 0.771 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCC3(CC2)CNC(=O)O3)cc1 782002203 XKLGUQRDFOFRER-UHFFFAOYSA-N 346.431 0.943 10 20 ECCD CN1C(=O)CC[C@H]1C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089853687 HMGBPLPFVFTTOT-ZDUSSCGKSA-N 347.394 0.879 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(C)C2=O)cc1 1322198269 VHISCOABSGOCJG-OAHLLOKOSA-N 346.431 0.496 10 20 ECCD CO[C@@H]1CCN(c2nnnn2Cc2ccc(N3CCOCC3)cc2)C1 1355494537 PJUUCNAZBLWVRK-MRXNPFEDSA-N 344.419 0.783 10 20 ECCD O=C(Cn1ncnn1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1519694584 XJAADBZVGVAUTG-UHFFFAOYSA-N 334.355 0.090 10 20 ECCD CC(C)C(=O)N1CC(O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1043559797 NGPGSCUXNVOFNP-UHFFFAOYSA-N 347.375 0.808 10 20 ECCD CNC(=O)[C@@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 181641321 DEPNQZPIXDXTED-INIZCTEOSA-N 344.415 0.719 10 20 ECCD O=C(CN1CCNCC1=O)NCc1ccc(N2CCSCC2)cc1 238110514 FMPLKDDYYLSEOU-UHFFFAOYSA-N 348.472 0.288 10 20 ECCD Cc1ccc(O)c(CN[C@@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)c1 265240679 LIDKSCLLNHIVQW-HUUCEWRRSA-N 340.445 0.288 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@](C)(O)C3CC3)nc12 805579886 OKMICURNLCOKHL-MRXNPFEDSA-N 349.343 0.816 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)Nc3cnnn3C)ccc21 810359208 YLTNZNZWCVWCQJ-UHFFFAOYSA-N 328.376 0.452 10 20 ECCD CC(C)n1[nH]cnc1=NC(=O)C(=O)NCc1cc(Cl)ccc1O 846120913 GGGIKIJKNZXKLX-UHFFFAOYSA-N 337.767 0.895 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3nc(C)oc3=O)CC2)cc1 849983011 QLBJDYSNIJZKLV-UHFFFAOYSA-N 332.360 0.502 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H](CN)C3)CC2)cc1 923280894 JROJAHXJJPBXNM-WMZOPIPTSA-N 348.491 0.459 10 20 ECCD COc1cc(C(=O)N[C@H]2CCN(C(=O)c3ncc[nH]3)C2)cc(OC)n1 938308643 UJCULIXKASJQHA-NSHDSACASA-N 345.359 0.466 10 20 ECCD COc1cc(C(=O)NC2CN(Cc3cnns3)C2)cc(OC)n1 1030614776 QZWMWQAQFNPEJP-UHFFFAOYSA-N 335.389 0.565 10 20 ECCD C[S@](=O)CCN1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779519574 LFILVUQVXMIPCQ-CCZWLNLGSA-N 338.429 0.634 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCc1nnn(C(C)(C)C)n1 1118325979 NEZDWXZOEUFOIM-UHFFFAOYSA-N 346.391 0.409 10 20 ECCD C[C@H](O)CN(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 774180274 QGKDJFOYCWHEOG-ZFWWWQNUSA-N 348.447 0.911 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CNCC(C)(C)O)CC2)cc1 1120487947 MEJKRUREQPIAFC-MRXNPFEDSA-N 337.464 0.539 10 20 ECCD Cc1ccc(C(=O)NCCCN2CCC[C@@H](C(N)=O)C2)c(O)c1O 780919922 YEABGNMTQJFDSK-GFCCVEGCSA-N 335.404 0.723 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)[C@@H](O)c2cnn(C)c2)N(C)C)cc1 891247053 GYDGTBPMMWIJQS-IRXDYDNUSA-N 345.447 0.939 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCOCC(F)F)cc1 1340247408 PZDUFXPWTILFLT-UHFFFAOYSA-N 329.347 0.767 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCC(O)(CO)CC2)cc1F 1347237370 JCPCZWRHLNSZNY-UHFFFAOYSA-N 325.384 0.921 10 20 ECCD O=C(C[C@@]1(O)CCCNC1)NCc1ccc(N2CCOCC2)cc1 1521439715 VLSRZZKGNBQBLP-SFHVURJKSA-N 333.432 0.644 10 20 ECCD O=C1Cc2c(C(=O)N3CCc4c(-c5nn[nH]n5)cccc43)ccnc2N1 1593401191 HMNAEPCXYYAWGW-UHFFFAOYSA-N 347.338 0.959 10 20 ECCD CCN1CCC[C@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 283678465 ZLSQHBRSUMYKLI-INIZCTEOSA-N 332.448 0.969 10 20 ECCD CC[C@@H]1CN(C)CCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 818971848 RAMYYJPAUXXEOA-GFCCVEGCSA-N 341.433 0.930 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C1(n2cnnn2)CC1 823291184 DSNWNRHCKNXGDC-UHFFFAOYSA-N 328.376 0.315 10 20 ECCD O=C(c1cc(O)cs1)N1CCN(C[C@@H]2CCCS2(=O)=O)CC1 913124196 CVCMHABBCVBQSY-LBPRGKRZSA-N 344.458 0.789 10 20 ECCD CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@H]2CCNC2)cc1 842225290 HYYOXJLPUVEYKL-HNNXBMFYSA-N 332.448 0.969 10 20 ECCD CCN(CC)c1ccc(CN(C)C(=O)c2cn(CC(N)=O)nn2)cc1 742499239 YFEKEGQWHLBHOP-UHFFFAOYSA-N 344.419 0.882 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3cc(C)cnc3=O)CC2)cc1 842057400 UGZZKVYKTCJWMP-UHFFFAOYSA-N 342.399 0.909 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN(C)[C@@H](C)CN)CC2)cc1 923289432 ILYYKYMRSNXHKO-RDJZCZTQSA-N 336.480 0.457 10 20 ECCD COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H](CN)C3)CC2)cc1 923280887 JROJAHXJJPBXNM-AEFFLSMTSA-N 348.491 0.459 10 20 ECCD C[C@H](C(=O)N(C)c1ccc(N)cc1)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 877077378 GENNWFLTSLMGJS-NSAPBPOKSA-N 343.383 0.783 10 20 ECCD C[C@H]1C(=O)NCCN1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 899100988 GARHWEJUZSDZHF-XJKSGUPXSA-N 347.463 0.885 10 20 ECCD NS(=O)(=O)c1ccc(C(=O)NCCc2ccc(O)c(O)c2)nc1 798333747 BMTUUQCURXPZBI-UHFFFAOYSA-N 337.357 0.113 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H]2COC[C@H]2C1 1330648030 WWRZDSBBQPRJNX-GASCZTMLSA-N 331.416 0.782 10 20 ECCD CC(=O)N1CC(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C1 1334066415 NGEQXHGKFQBPMD-KRWDZBQOSA-N 332.448 0.950 10 20 ECCD C[C@H]1CN2CCN1C[C@@H]2C(=O)NCc1ccc(N2CCOCC2)cc1 1519019561 HXNLPWPBGLYEJX-MAUKXSAKSA-N 344.459 0.528 10 20 ECCD Cc1cc(Br)cc(CNCC(=O)NCC(=O)O)c1O 1607563447 HJNRQNZVXUJTPM-UHFFFAOYSA-N 331.166 0.754 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)N[C@H]2CCNC[C@H]2O)N(C)C)cc1 1578424611 OTEBMHICVWVKNT-YESZJQIVSA-N 349.479 0.377 10 20 ECCD COc1ccc(N2CCN(C(=O)CN(C)Cc3nnc[nH]3)CC2)cc1 174807283 DKRMNDTWDAULFA-UHFFFAOYSA-N 344.419 0.594 10 20 ECCD Cn1cnc(CNC(=O)/C=C/c2ccc(N3CCOCC3)cc2)n1 120669670 GVIIJICGERYURB-QPJJXVBHSA-N 327.388 0.981 10 20 ECCD NC(=O)N1CC[C@@H](NC(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 265136731 UEUBUFOZBVUDNS-YFCVBGDOSA-N 344.415 0.806 10 20 ECCD CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NCc1ccccc1O 276497904 VVPHUBVMKAJVGM-UHFFFAOYSA-N 346.343 0.557 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)C1=NN2CCCN=C2N1 649347673 OZENKOHGFMCSLP-UHFFFAOYSA-N 328.376 0.456 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)C1CN(C(C)=O)C1 819698394 MCAQKJAOXSRTEZ-UHFFFAOYSA-N 334.372 0.762 10 20 ECCD NC1(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CCC1 827394795 DDPWFGWBZGCTQZ-UHFFFAOYSA-N 337.445 0.419 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCCO[C@H](CN)C1 842154973 YUPRDWXYWBAULG-MRXNPFEDSA-N 348.447 0.253 10 20 ECCD COC[C@@](C)(O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 754987624 ICHFABQFPNNOPN-RDTXWAMCSA-N 349.431 0.402 10 20 ECCD C[C@@H](NC(=O)C[C@H]1CC(=O)NC1=O)c1ccc(N2CCOCC2)cc1 930745294 UXUJEZNRMOQDQW-OCCSQVGLSA-N 345.399 0.753 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OC[C@H]2COC(=O)O2)c1 763944299 LBVYZEDVIOJHGO-QMMMGPOBSA-N 331.302 0.456 10 20 ECCD Cn1cnn(CC(=O)NCc2ccc(N3CCCCC3)cc2)c1=O 778664490 BGAZRJZUFRYOPS-UHFFFAOYSA-N 329.404 0.889 10 20 ECCD CN1CC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1=O 773214760 MMYFTEAJSQULAP-CQSZACIVSA-N 349.406 0.881 10 20 ECCD CN1CCN(c2ccc(CNC(=O)c3cnnc(O)c3)cc2)CC1 881853323 RCIKAPBQTPWMFQ-UHFFFAOYSA-N 327.388 0.864 10 20 ECCD CCC(=O)NC1[C@H]2CN(Cc3nnnn3-c3ccc(OC)cc3)C[C@H]12 957983119 KAZDZJBEMWPEEP-KBPBESRZSA-N 342.403 0.627 10 20 ECCD COc1ccc(CN[C@@H]2CCN(C(=O)[C@@H]3CCNC3=O)C2)cc1C 969577733 GNHVOJJABYHKCD-HUUCEWRRSA-N 331.416 0.830 10 20 ECCD O=C1CN(c2ccc(NC(=O)c3c(F)ccc(O)c3O)cn2)CCN1 789957893 ZABFMIIGXOZVFE-UHFFFAOYSA-N 346.318 0.820 10 20 ECCD COC(=O)c1cc(S(=O)(=O)NCc2ccc(OC)cc2O)c[nH]1 795362667 OXCWOVPAJCWFCJ-UHFFFAOYSA-N 340.357 0.994 10 20 ECCD COC[C@@H](CO)NC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 792853128 PEHHOBTWZUPJBF-DZGCQCFKSA-N 337.420 0.891 10 20 ECCD CCOc1cc(N2CC=C(CCNC(=O)CC(=O)NC)CC2)ncn1 1089822709 NGLXLSFTUSFKFC-UHFFFAOYSA-N 347.419 0.654 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)CNC(=O)C3CC3)CC2)ncn1 1089815500 ZPKAKHHVWUSLGV-UHFFFAOYSA-N 343.431 0.954 10 20 ECCD CC(=O)NCC(=O)NCCC1=CCN(c2cc(C)nc(C)n2)CC1 1089807012 DHZRJTRKBQCUQC-UHFFFAOYSA-N 331.420 0.872 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NC2CN(C(=O)[C@@H]3CCCO3)C2)cc1 994375019 QLJKBCFOVXFLEU-ZDUSSCGKSA-N 345.359 0.969 10 20 ECCD CCOC[C@H](O)CNCc1ccc(N2CCN(C(C)=O)CC2)cc1 1336820492 UZCRMYGBJIOSET-GOSISDBHSA-N 335.448 0.842 10 20 ECCD CC(C)(O)[C@H](N)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1521446189 KRGJZJYEDRKAAT-MRXNPFEDSA-N 335.448 0.610 10 20 ECCD CO/C=C(\C)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1844180062 KQTQMLRBQRYVKO-DHZHZOJOSA-N 347.371 0.860 10 20 ECCD COC(=O)C1=S=C(NC(=O)c2ccc3c(C)nn(C)c3n2)C=C1 342609165 VFVXUHNXVFALAN-UHFFFAOYSA-N 330.369 0.785 10 20 ECCD Cc1ccc(C(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)c(O)c1O 272710679 DTBGMYJVDAUUBW-JTQLQIEISA-N 328.390 0.418 10 20 ECCD CS(=O)(=O)NC[C@@H]1CCCN(C(=O)c2cccc(O)c2O)C1 280191974 PDEQKJYQXVNBLA-JTQLQIEISA-N 328.390 0.499 10 20 ECCD CN(CC(C)(C)O)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803664045 FMKQFJZTECICGD-UHFFFAOYSA-N 325.384 0.737 10 20 ECCD COC(=O)[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 728574138 XBYYMVQXDDVSSK-INIZCTEOSA-N 349.431 0.585 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)N3C[C@@H](O)[C@@H](CO)C3)C2)cc1 824682154 WCJGVKBTWPOYQJ-CKEIUWERSA-N 349.431 0.516 10 20 ECCD CN(CCN1CCCC1=O)CC(=O)NCc1ccc(N(C)C)cc1 733195405 MSARQBNWRPRYTP-UHFFFAOYSA-N 332.448 0.923 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)c2cnn(C[C@H](O)CO)c2)c1 830541523 ZGUZKVBMMHETQJ-PWSUYJOCSA-N 335.360 0.442 10 20 ECCD CCN(CCO)C(=O)C(=O)N(C)CCN(C)c1ccc(OC)cc1 846237282 CLCQHOVWVDGAPZ-UHFFFAOYSA-N 337.420 0.431 10 20 ECCD CN[C@@H](C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 848411349 OJCFOKSKTAWYHY-LBPRGKRZSA-N 325.434 0.146 10 20 ECCD Cc1cc(N(C)C)ccc1CN1CCN(S(=O)(=O)N(C)C)CC1 840911043 UTDQUCUSYDNNCJ-UHFFFAOYSA-N 340.493 0.985 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)C(=O)NCC2CC2)N(C)C)cc1 929296309 XOEVMWCDZMUBQD-INIZCTEOSA-N 332.448 0.998 10 20 ECCD COC[C@](C)(O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1 870164865 DWXNXBWDAWQPJT-KRWDZBQOSA-N 338.404 0.750 10 20 ECCD C[C@H](NC(=O)N1CC(NS(C)(=O)=O)C1)c1ccc(N(C)C)cc1 875508093 SXALQZVFXPQRAI-NSHDSACASA-N 340.449 0.757 10 20 ECCD CN(CCO)Cc1cn(CC(=O)NCc2ccc(N(C)C)cc2)nn1 881094979 ZNJGNLYXDZPRQH-UHFFFAOYSA-N 346.435 0.085 10 20 ECCD COc1ccc(-n2nnnc2CNCCNC(=O)c2ccc[nH]2)cc1 1123445155 MLOUZLKXMANNHX-UHFFFAOYSA-N 341.375 0.519 10 20 ECCD CCCCNC(=O)CN1CCN(C(=O)c2cccc(O)c2O)CC1 790474510 HBHFXXTZMQDNOC-UHFFFAOYSA-N 335.404 0.772 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)C[C@H]3CCNC3=O)CC2)ncn1 1089844511 CYDUXBVBZYZRNJ-OAHLLOKOSA-N 343.431 0.954 10 20 ECCD O=C(CS[C@H]1CCS(=O)(=O)C1)NCc1ccc(O)c(O)c1 1319254764 YVJKZFDBYFBIHS-JTQLQIEISA-N 331.415 0.634 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1nnc(C)n1C 1260264386 OUADKDQJFSVXCM-UHFFFAOYSA-N 344.419 0.431 10 20 ECCD C[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1 1796602870 WDQQSZHTVYSGAQ-KXGXSXBTSA-N 335.360 0.125 10 20 ECCD CS(=O)(=O)NCCN(Cc1ccccc1O)C[C@H]1CCCO1 109761748 PZNNFOPKHVHISL-CQSZACIVSA-N 328.434 0.922 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)Cn1ccc(=O)n(C)c1=O 48121795 MCXKZISVQUZVFE-UHFFFAOYSA-N 344.415 0.662 10 20 ECCD O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H]1CCCO1 283386398 WUBBPYDQTBDITP-INIZCTEOSA-N 329.400 0.974 10 20 ECCD COCCOCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 299216096 SUCORYORDJEXAI-UHFFFAOYSA-N 332.378 0.157 10 20 ECCD COCCN1C(=O)/C(=C\Nc2ccc(N(C)C)cc2)C(=O)NC1=S 299264472 NIKXDCBBRQBFKH-RAXLEYEMSA-N 348.428 0.938 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(C(=O)O)CC2)cc1 817109843 LSPOXAOJQTZKIM-UHFFFAOYSA-N 333.388 0.692 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@](C)(C(=O)O)C3)nc12 829890322 NOTMRRMKRNDRAP-INIZCTEOSA-N 348.359 0.908 10 20 ECCD O=C(N[C@@H]1CCN(CCN2CCOCC2)C1)c1cc(O)cs1 734557289 CZGAPVUUNPMIJW-GFCCVEGCSA-N 325.434 0.590 10 20 ECCD O=C(NCc1ccc(O)cc1O)[C@@H]1COCCN1CC(F)(F)F 910945490 ASTVWBWATGVKDI-NSHDSACASA-N 334.294 0.977 10 20 ECCD COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)CCO)CC2)cc1 843083367 PGKFLBRQAJZQSP-WBVHZDCISA-N 337.464 0.539 10 20 ECCD CCS(=O)(=O)N(C)CCCNC(=O)NCCc1ccc(N)cc1 841706970 KVBPEKYWOXXGKS-UHFFFAOYSA-N 342.465 0.782 10 20 ECCD Cc1ccc(O)c(CNC(=O)Nc2nc(CS(C)(=O)=O)no2)c1 860876194 CYWXFXOIEJURMH-UHFFFAOYSA-N 340.361 0.950 10 20 ECCD COC(=O)CCCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1116985844 CVEOUCYXRQPACR-UHFFFAOYSA-N 347.415 0.755 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H](CO)[C@@H](CO)C1 879692289 JJCMEUYXVIIEMT-IYBDPMFKSA-N 335.448 0.244 10 20 ECCD CCN(CC)S(=O)(=O)CC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773740564 QNDMNVVDBPRVKT-NSHDSACASA-N 344.433 0.817 10 20 ECCD COCC(=O)NCCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1318069366 VHBORANSXPVYCP-UHFFFAOYSA-N 349.431 0.634 10 20 ECCD CN1CCN(c2ccc(CN3CCC(OCC(N)=O)CC3)cc2)CC1 1337239085 LNLHHILJVCMIOG-UHFFFAOYSA-N 346.475 0.905 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCC2(O)CN(C(=O)C3CC3)C2)cc1 1043560374 WBKWEPYFBLBCSB-UHFFFAOYSA-N 345.359 0.562 10 20 ECCD CCN1C(=O)C(=CNC[C@H]2CCCN2CC)C(=O)N(CC)C1=S 28843123 MOVVXQXQWKOBFO-GFCCVEGCSA-N 338.477 0.940 10 20 ECCD C[C@H](C(=O)N1CCCC1)N1CCN(C(=O)Cc2ccc(N)cc2)CC1 237422169 GRIMTYZESUFMQQ-OAHLLOKOSA-N 344.459 0.966 10 20 ECCD C[C@H](C(=O)N[C@@H]1CCS(=O)(=O)C1)N(C)Cc1ccccc1O 269606167 CMBVQUADBAQQEX-DGCLKSJQSA-N 326.418 0.516 10 20 ECCD O=C(/C=C/c1ccc(N2CCOCC2)cc1)N[C@@H]1CCC(=O)NC1=O 269627348 VLFKVJNBHHABIK-NKPGBKMFSA-N 343.383 0.458 10 20 ECCD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCC(=O)N1CCOCC1 273139798 DSQCDKKGDVLHRG-LBPRGKRZSA-N 336.388 0.784 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC(=O)NCC3(C)C)nc12 282486889 HMISZVXSBOZJOY-UHFFFAOYSA-N 347.375 0.322 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCN(C)C1CC1 285080703 PDMJNPQSKFDODJ-UHFFFAOYSA-N 332.448 0.921 10 20 ECCD C[C@@H](CO[C@@H]1CCOC1)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 283648503 XPNYMKVXKPCCJH-XJKSGUPXSA-N 349.431 0.679 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)C(=O)NCC(C)(C)N)C2)cc1 818677999 VVUOJEBGZPGCLV-ZDUSSCGKSA-N 348.447 0.491 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)NCCNS(C)(=O)=O)c1 728944173 OCPNGATYONLKHS-SECBINFHSA-N 331.394 0.310 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1=COCC1 734123659 SUQOBWGQXUAVNU-UHFFFAOYSA-N 336.413 0.842 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)N1CCC(O)(C(N)=O)CC1 919073708 ZVIGDBUSVMDKNJ-UHFFFAOYSA-N 334.420 0.583 10 20 ECCD CN(CCN1CCNCC1)CC(=O)N(C)Cc1ccc(N(C)C)cc1 844218421 ABVJNXBMKHXFKE-UHFFFAOYSA-N 347.507 0.548 10 20 ECCD CC(C)(CN)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 841727176 YIPOTRRXXCLHRF-CQSZACIVSA-N 347.463 0.925 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)NC[C@H](N)C3CC3)ccc21 842149969 IUWOXJLNEHDHNI-HNNXBMFYSA-N 330.432 0.539 10 20 ECCD COc1ccc(N(C)CCN(C)Cc2cn(CC(N)=O)nn2)cc1 846051680 KUEHTKYUIYQSJE-UHFFFAOYSA-N 332.408 0.340 10 20 ECCD CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)NCCc2ccc(N)cc2)O1 841868406 VPMOATDKTOQYSD-CABCVRRESA-N 334.420 0.746 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2CCNCC2)cc1F 842209622 LXQQVRXFCAYFES-UHFFFAOYSA-N 336.411 0.720 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCC2CC(O)C2)c1 762726706 NFGQVBIKJDIWKA-UHFFFAOYSA-N 328.390 0.655 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3[C@H]4CNC[C@H]43)CC2)c(OC)c1 877228304 XZLQFVXDTUYFKT-HALDLXJZSA-N 331.416 0.818 10 20 ECCD NC(=O)C1=NO[C@H](CNCc2ccc(N3CCOCC3)c(F)c2)C1 789562145 VTCJYZOZPGDAFV-LBPRGKRZSA-N 336.367 0.382 10 20 ECCD CN(C)c1ccc([C@H](CNC(=O)CNC(=O)C2CC2)N(C)C)cc1 891252176 HVEKBGKKXPUZQZ-INIZCTEOSA-N 332.448 0.998 10 20 ECCD CN1CCN(c2ccc(CNC(=O)NC[C@@H]3CCCN3)cc2)CC1 891998293 BFLZZXYRACWICH-INIZCTEOSA-N 331.464 0.990 10 20 ECCD COCCCC(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089814392 CEQJRHZOEXGJNE-UHFFFAOYSA-N 345.407 0.589 10 20 ECCD C[C@@H](NC(=O)C(=O)N1CC[C@@](F)(CO)C1)c1ccc(N(C)C)cc1 1323271791 WLILLEQNVGUGDL-PXAZEXFGSA-N 337.395 0.863 10 20 ECCD CCO[C@@H]1COCC[C@H]1NC(=O)C(=O)N(C)Cc1ccccc1O 1329117627 HLNUINHJUMIJDD-UKRRQHHQSA-N 336.388 0.661 10 20 ECCD C[C@@H](NC(=O)C(=O)N[C@@H]1CC[C@H](C(N)=O)C1)c1ccc(N(C)C)cc1 1345370580 XICOJVRRHWBJSR-KWCYVHTRSA-N 346.431 0.700 10 20 ECCD C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)CN[C@H]1CCNC1=O 1753644226 BLERWRFKWYJAQD-GWCFXTLKSA-N 346.391 0.693 10 20 ECCD C[C@H](NCCOCCS(C)(=O)=O)c1cc(C(=O)O)ccc1O 1593271654 KEURUCDEWVLNAG-JTQLQIEISA-N 331.390 0.802 10 20 ECCD CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1 1796137738 SVZCYSXDJYYQPK-DRXBFXEBSA-N 349.387 0.496 10 20 ECCD COCCNC(=O)Cn1cc(NC(=O)Cc2ccc(N)cc2)cn1 160713203 POJAETALECHTLA-UHFFFAOYSA-N 331.376 0.409 10 20 ECCD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1CNCCO1 238171441 WDVADKKMFQQUBI-KRWDZBQOSA-N 333.432 0.500 10 20 ECCD Nc1ccc(CC(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)cc1 829764476 MIJHFKDKCCPJJS-QGZVFWFLSA-N 332.448 0.334 10 20 ECCD COC[C@@H](CO)NC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 823732118 CFGDUZZQHHHRPR-UONOGXRCSA-N 337.420 0.828 10 20 ECCD O=[N+]([O-])c1cc(Cl)cc(CNC[C@H](O)Cn2ccnn2)c1O 839179774 PPBBGIKVAWRKLF-JTQLQIEISA-N 327.728 0.696 10 20 ECCD CN1CC[C@](O)(CNC(=O)NCc2ccc(N3CCOCC3)cc2)C1 763012546 MSGDHDXBQOKUIC-SFHVURJKSA-N 348.447 0.389 10 20 ECCD COCCC(=O)NCC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1075222671 FTWVQBKBSKGMJT-NSHDSACASA-N 339.392 0.760 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NC[C@H]1C[C@H](N)C1 1331590717 RHTSANBXLCIFEQ-IIAWOOMASA-N 346.475 0.962 10 20 ECCD O=C(COc1ccccc1-c1nn[nH]n1)NCc1cc(O)ccc1O 1606577814 XBQWUDCOTPNIAF-UHFFFAOYSA-N 341.327 0.973 10 20 ECCD CN(C)c1ccc2c(c1)OCCN2C(=O)C1=NO[C@]2(CCNC2)C1 1578427032 LZNWAGMTEQOAOQ-QGZVFWFLSA-N 330.388 0.986 10 20 ECCD C[C@H](CN[C@H]1CCNC1=O)NC(=O)c1ccc(N=NC(N)=O)cc1 1754256396 ZVBHHIVQHFIYDC-SKDRFNHKSA-N 332.364 0.445 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(=O)n(C)c2)cc1 182943457 CDEHMFALCSYIAV-UHFFFAOYSA-N 328.372 0.706 10 20 ECCD Cc1ccc(Cn2nccc2NC=C2C(=O)NC(=S)NC2=O)o1 192693762 YEAJDFYOIQCJKG-UHFFFAOYSA-N 331.357 0.660 10 20 ECCD COCCN(C(=O)c1cccc(O)c1O)[C@@H]1CCS(=O)(=O)C1 274903144 QJOKAMGRLOVXAV-SNVBAGLBSA-N 329.374 0.374 10 20 ECCD CCN(CC)C(=O)CN1CCN(C(=O)c2cccc(O)c2O)CC1 274918656 WTOVMILSPQEBAN-UHFFFAOYSA-N 335.404 0.724 10 20 ECCD CNS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCCCC2)cc1 281954790 KDNOYAPUEVFXHY-UHFFFAOYSA-N 348.450 0.705 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1nccn1C 287116620 ZZTDGTZBNJKBNC-UHFFFAOYSA-N 329.404 0.761 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)N(CCO)C1CC1 806280002 HDOSDHYGWDDOEJ-UHFFFAOYSA-N 329.447 0.725 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CCCN1 827394905 GGDXPZKKDJUXTF-OAHLLOKOSA-N 337.445 0.290 10 20 ECCD CCOC(=O)CN(CC(=O)N1CCN(C)CC1)Cc1ccccc1O 823582002 WAKHRLOBCPKQCM-UHFFFAOYSA-N 349.431 0.531 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C)[C@H](C(=O)O)C3)nc12 829889421 AQZAZGZYPOUNMV-BXKDBHETSA-N 348.359 0.764 10 20 ECCD O=C1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCN1 823559099 CCAVLOKWUVFCSO-UHFFFAOYSA-N 332.404 0.289 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NCCNC1CC1 842070339 NIUVXDRBFVSFEN-AWEZNQCLSA-N 346.475 0.976 10 20 ECCD CONC(=O)CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 914400556 ODUNZIMBSBACDH-GFCCVEGCSA-N 336.392 0.561 10 20 ECCD CCc1cccc(CNCCS(=O)(=O)N2CCOCC2)c1O 848896133 SLPWNJGCODWKTC-UHFFFAOYSA-N 328.434 0.706 10 20 ECCD O=C(C[C@H]1CC(=O)NC1=O)NCc1ccc(N2CCOCC2)cc1 930520913 VMYVPXMQQDQUNE-ZDUSSCGKSA-N 331.372 0.192 10 20 ECCD O=C(CN1CCOC1=O)NCc1ccc(N2CCOCC2)c(F)c1 874093154 MOOSJWXOYQFPHV-UHFFFAOYSA-N 337.351 0.731 10 20 ECCD COCCN(CCN(C)C)C(=O)C(=O)N(C)Cc1ccccc1O 1117920365 HOCPUQYLFGJRTJ-UHFFFAOYSA-N 337.420 0.387 10 20 ECCD NC(=O)C(=O)NCCC1=CCN(c2ncnc3ccsc23)CC1 1089862587 XGUZOCOLWKYJCU-UHFFFAOYSA-N 331.401 0.819 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)c3cnn(C)n3)CC2)ncn1 1089834905 OOZJSKHBTNETKB-UHFFFAOYSA-N 327.392 0.870 10 20 ECCD COC(=O)COCC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1355178865 NEEQLVMZDXGFNO-OAHLLOKOSA-N 337.420 0.661 10 20 ECCD CS(=O)(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(N)cc2)C1 1579346638 QOQONWBCZATHNA-ZDUSSCGKSA-N 340.449 0.740 10 20 ECCD Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)ncc1-c1nn[nH]n1 1580867874 KAVMZSVMNOTPDT-UHFFFAOYSA-N 340.343 0.954 10 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334.420 0.922 10 20 ECCD CN(C)C(=O)CN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 732576712 NADIYWCOALEOPI-UHFFFAOYSA-N 346.475 0.729 10 20 ECCD CC(C)(N)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 841721877 JOTOCWALCMPOBR-AWEZNQCLSA-N 347.463 0.925 10 20 ECCD CCNS(=O)(=O)CCNC(=O)NCc1cccc(OC)c1O 745812470 RQUQKVVGLHVRMC-UHFFFAOYSA-N 331.394 0.139 10 20 ECCD CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CC[C@@H](CN)C3)ccc21 842149786 FKXWMTWKCGJQPT-CZUORRHYSA-N 344.459 0.929 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCCNC2)cc1F 842149036 TXTMIBPDPSRKLC-CYBMUJFWSA-N 336.411 0.624 10 20 ECCD COC[C@@H](C)NC(=O)NC(=O)COC(=O)c1cccc(O)c1O 758562431 RIBHVMKJANVNKQ-MRVPVSSYSA-N 326.305 0.115 10 20 ECCD NC(=O)COc1ccccc1C(=O)NCCc1ccc(O)c(O)c1 768900295 DWQMHDWOOCQMGT-UHFFFAOYSA-N 330.340 0.934 10 20 ECCD COC(=O)CNC(=O)CNCc1cc(C)cc(Br)c1O 877706563 NVIIUSSOSFQJAZ-UHFFFAOYSA-N 345.193 0.842 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCCn2ccnc2)c1 771931963 DOOHZCODWIJRRZ-UHFFFAOYSA-N 325.346 0.817 10 20 ECCD Cn1nnc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 787001663 UAKQYWZIEWIXIQ-UHFFFAOYSA-N 349.370 0.185 10 20 ECCD C[C@@H](C(N)=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 957849704 QMEBGFRSUSCQQI-JTQLQIEISA-N 332.364 0.481 10 20 ECCD C[C@H](NCCNC(=O)c1ccc(N=NC(N)=O)cc1)c1nnnn1C 1153047801 KWVOAOTWICSNGV-VIFPVBQESA-N 345.367 0.453 10 20 ECCD O=C1CC[C@H](C(=O)NCCC2=CCN(c3nccnc3F)CC2)N1 1089820006 QSTXRLFRWCZDAQ-GFCCVEGCSA-N 333.367 0.537 10 20 ECCD NC(=O)N=Nc1ccc(C(=O)NCCNCc2nc(O)n[nH]2)cc1 1153047992 PJCKOXNQOARHPL-UHFFFAOYSA-N 332.324 0.192 10 20 ECCD COCCOC1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 1323042724 OPHKBSQTDNFZQP-UHFFFAOYSA-N 349.431 0.551 10 20 ECCD C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1ncnn1C 1322919925 NYBPGQLGQXASHC-NSHDSACASA-N 330.392 0.375 10 20 ECCD CN(C)CC[C@@H](N)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1330962138 ZNXAWIWLIVWJKX-QGZVFWFLSA-N 333.480 0.334 10 20 ECCD COc1ccc(N(C)CCN(C)C(=O)CN2C(=O)CNC2=O)cc1 1261525434 CXYSHEGMSFPUCA-UHFFFAOYSA-N 334.376 0.142 10 20 ECCD CC1(C)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@@H]1O 275812569 IZFNJEPARXNRNK-ZDUSSCGKSA-N 342.417 0.997 10 20 ECCD O=C(CCN1C(=O)NC2(CCCC2)C1=O)NCc1ccc(O)c(O)c1 272333929 NDRAWIBBKUZHNH-UHFFFAOYSA-N 347.371 0.969 10 20 ECCD CCN1C(=O)C(=CNNc2cccc(OC)n2)C(=O)N(CC)C1=S 272384159 JTNAXFFWJJTCPC-UHFFFAOYSA-N 349.416 0.886 10 20 ECCD C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 283340645 WRYHKFQIRXBCRB-CQSZACIVSA-N 347.415 0.387 10 20 ECCD CN1CCCc2cc(CNC(=O)CNC(=O)[C@@H]3CCCN3)ccc21 827913735 JWSFZVCUBOTQQT-HNNXBMFYSA-N 330.432 0.553 10 20 ECCD COc1ccc(O)c(CNC(=O)NCCCN2C(=O)CCC2=O)c1 734071763 XQAFPRLBDAEIQU-UHFFFAOYSA-N 335.360 0.739 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C[C@H](NC(C)=O)C(N)=O)cc1 746133683 IJFAEPDALPSVMO-HNNXBMFYSA-N 334.420 0.529 10 20 ECCD CC(=O)NCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917834947 VCPALQUOZXRAPD-CQSZACIVSA-N 332.404 0.141 10 20 ECCD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCNC1 842226404 PJLHDTRRKTYDPD-HNNXBMFYSA-N 332.448 0.968 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1OCCN(C)C1=O 910557470 BPDUKDHSGLLGTO-CJNGLKHVSA-N 333.432 0.965 10 20 ECCD CS(=O)(=O)CCS(=O)(=O)NCc1cc(Cl)ccc1O 845996333 OLHGIXKCNPUSSL-UHFFFAOYSA-N 327.811 0.510 10 20 ECCD O=C(COC(=O)/C=C\c1ccc(O)c(O)c1)NCC(=O)N1CCCC1 759589793 SWGGAMHUFHLFQA-XQRVVYSFSA-N 348.355 0.393 10 20 ECCD NC(=O)[C@@H]1CCCN1CCCNCc1ccc(N2CCOCC2)cc1 858223065 IHJCTPWZICIFEY-SFHVURJKSA-N 346.475 0.953 10 20 ECCD COc1cc(C(=O)N[C@@H]2CCN(Cc3ccnn3C)C2)cc(OC)n1 1015101517 GSCVDKCTELTMFZ-CYBMUJFWSA-N 345.403 0.837 10 20 ECCD O=C(CCCc1nn[nH]n1)NCc1ccc(N2CCOCC2)cc1 874154916 LXMMINOGKPEQTL-UHFFFAOYSA-N 330.392 0.675 10 20 ECCD CN1CC(=O)N(Cc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1=O 777611235 SXNPVTJCIPVSAH-ZDUSSCGKSA-N 330.388 0.782 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN(C3CC3)C2)cc1 785432449 CRDSRELFVYXHIA-CQSZACIVSA-N 330.432 0.722 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)C[C@@H](C)N1CCO 1325151953 VMUHWNSQQRFXOG-OKILXGFUSA-N 349.431 0.264 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H]2[C@H](N)CCC[C@H]2C1 1331836949 YDSKZPKQZVXWFH-NWANDNLSSA-N 331.416 0.936 10 20 ECCD CN(C(=O)/C=C/c1ccc(O)c(O)c1)N1CCS(=O)(=O)CC1 1349233386 CJJXKTFBXNXJGD-HWKANZROSA-N 326.374 0.215 10 20 ECCD COc1cc(O)c(CN2CCC[C@@H]2C(=O)NCC(=O)O)cc1OC 1607183163 KQBFMZGLRPXLBP-LLVKDONJSA-N 338.360 0.575 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCC(O)(C(=O)O)CC2)cc1 1606054231 OEOMZVHVFQNCBX-UHFFFAOYSA-N 335.404 0.280 10 20 ECCD CN(C)c1ccc(CNC(=O)CN[C@@]2(CC(=O)O)CCCOC2)cc1 1606053885 FPEBOMUUMFQUNB-GOSISDBHSA-N 349.431 0.982 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(-c2nn[nH]n2)cn1C 1603577683 JDHLNSIEVFZUNS-SECBINFHSA-N 342.359 0.977 10 20 ECCD O=C(c1ccc[nH]1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250090 JZUNINFXRQQTGL-UHFFFAOYSA-N 342.355 0.952 10 20 ECCD CCNS(=O)(=O)[C@H]1CCN(Cc2cc3c(cc2O)OCO3)C1 271246686 GOESPLAZLRHFPQ-NSHDSACASA-N 328.390 0.635 10 20 ECCD CN(C)c1ccc(CNC(=O)NCCN2CCNC(=O)C2)cc1F 272900608 IQAIPBSGYYYLRR-UHFFFAOYSA-N 337.399 0.123 10 20 ECCD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CN1CCOCC1=O 839922262 SQXLKJLVLRMKPN-AWEZNQCLSA-N 333.432 0.967 10 20 ECCD CC1CCN(c2ccc(CNC(=O)C(=O)N3CCNCC3)cc2)CC1 842215485 SKPYHOOKRSPZBI-UHFFFAOYSA-N 344.459 0.971 10 20 ECCD CN(C)c1ccc([C@@H](N)CNC(=O)c2nccnc2C(N)=O)cc1 844162973 QEWHQSIJAGAORF-LBPRGKRZSA-N 328.376 0.071 10 20 ECCD COC(=O)c1c[nH]nc1S(=O)(=O)Nc1ccc(O)c(OC)c1 912530216 BOHCOJGGVYWYKX-UHFFFAOYSA-N 327.318 0.711 10 20 ECCD CN(C)c1ccc([C@H](N)CNC(=O)Cn2cnc([N+](=O)[O-])n2)cc1 843299884 YUQPUJYDLHXVBU-GFCCVEGCSA-N 333.352 0.069 10 20 ECCD Cc1n[nH]cc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 920740085 VQDCIOKCZPPUOW-UHFFFAOYSA-N 348.428 0.883 10 20 ECCD COc1cc(N2CCN(C(=O)CO)CC2)c([N+](=O)[O-])cc1OC 767290779 MFQWMKLUHZVTEN-UHFFFAOYSA-N 325.321 0.253 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCC(=O)NC 1117062381 KXEOOGGUDWOUOM-UHFFFAOYSA-N 348.447 0.744 10 20 ECCD CCN(CC)S(=O)(=O)CC(=O)NCc1ccc(OC)cc1O 794377438 OBVTXZVAPOKHQZ-UHFFFAOYSA-N 330.406 0.689 10 20 ECCD CC(C)(F)C(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089797941 NFBMTELNTWPZPM-UHFFFAOYSA-N 333.371 0.910 10 20 ECCD CCOc1ccc(N2CCN([C@@H](C)C(=O)NCC(=O)OC)CC2)cc1 1319847574 PBGIHYMIBROELC-AWEZNQCLSA-N 349.431 0.885 10 20 ECCD COC(=O)[C@H]1CCN(C(=O)C(=O)N(C)Cc2ccccc2O)[C@H]1C 1331280611 AZMBJZLUXOQRLM-AAEUAGOBSA-N 334.372 0.761 10 20 ECCD Nc1ccc(CNC(=O)N[C@H]2CCN(CCN3CCOCC3)C2)cc1 1338535400 SYMHAQRWTBSYMG-KRWDZBQOSA-N 347.463 0.475 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)C(=O)O 1610330856 JBSSYYQCTMNWHX-SCZZXKLOSA-N 325.317 0.409 10 20 ECCD CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCNC1CC1 1578026406 UXSUGZOZOBWHTE-ZDUSSCGKSA-N 336.388 0.830 10 20 ECCD CC(C)C(=O)NCCC1=CCN(c2ccnc(-c3nn[nH]n3)n2)CC1 1589404252 UYXSSWNCMVLXGA-UHFFFAOYSA-N 342.407 0.956 10 20 ECCD COc1ccc(-n2c(C)cc(C(=O)NCC(=O)NCCO)c2C)cc1 268580947 DUKRLPOTAOFVOO-UHFFFAOYSA-N 345.399 0.941 10 20 ECCD CNC(=O)CCN(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 807099087 JRQLGYLEWQOVIS-UHFFFAOYSA-N 334.420 0.272 10 20 ECCD O=C1CNCCN1CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 829003300 MGTXUAHRXXLZCR-HNNXBMFYSA-N 347.415 0.332 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)C(=O)N(C)C[C@@H](C)O)C2)cc1 824980506 DGUZSEJDPNBHSM-ZIAGYGMSSA-N 349.431 0.477 10 20 ECCD CN1CCN(c2ccc(CNC[C@@H](O)CN3CCCC3)cc2)CC1 905427411 NWNYPRVSMVUGEU-LJQANCHMSA-N 332.492 0.985 10 20 ECCD CN1CCO[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1=O 912709158 BNVOKSSHKKEVFB-INIZCTEOSA-N 347.415 0.121 10 20 ECCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccon1 755207122 TVPOAVQYBBLYLK-UHFFFAOYSA-N 330.344 0.766 10 20 ECCD CC(=O)N1CCO[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 944643499 WSYYFZKVWSUBNT-ZDUSSCGKSA-N 333.348 0.826 10 20 ECCD COc1ccc(N2CCN(C(=O)Cc3nc[nH]n3)CC2)c(OC)c1 870166792 VANPSQHEZSJSFX-UHFFFAOYSA-N 331.376 0.713 10 20 ECCD C[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@]1(C)C(=O)O 1607468664 YNJIOFWGVKILAM-BTDLBPIBSA-N 332.356 0.804 10 20 ECCD CC(=O)c1cc(F)cc(CN2CCS(=O)(=O)C[C@@H]2C(=O)O)c1O 1588528093 QPMNFNPBOJWVIZ-GFCCVEGCSA-N 345.348 0.418 10 20 ECCD C[C@H](NCC1(O)CCN(C)CC1)c1cccc(-c2nn[nH]n2)c1O 1589978958 SWAWKMHAAFXFAU-NSHDSACASA-N 332.408 0.680 10 20 ECCD CN(Cc1cnn(C)c1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 55184192 UVTDMUDZCKOVQG-UHFFFAOYSA-N 338.389 0.769 10 20 ECCD CN1CCCc2cc(CNC(=O)CN3CCC(=O)NC3=O)ccc21 264745591 ZZQVGUOASLBITN-UHFFFAOYSA-N 330.388 0.627 10 20 ECCD CCN(CCOCCO)C(=O)C(=O)NCc1ccc(N(C)C)cc1 283665986 YMSJVUPEZNZCKS-UHFFFAOYSA-N 337.420 0.226 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CCC(CO)CC2)cc1F 283053910 DMLJEEAOJBSFNV-UHFFFAOYSA-N 337.395 0.739 10 20 ECCD CN(C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)[C@H]1CCOC1 284179800 UYKFDBOPORZADX-INIZCTEOSA-N 347.415 0.387 10 20 ECCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H](CO)C1 297798830 KCKHXAZVDMFUAF-OAHLLOKOSA-N 333.432 0.942 10 20 ECCD CC(C)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(N)=O 725926965 MAVAMDSKKLKWPT-NSHDSACASA-N 330.362 0.430 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCNC3=O)cc2)CC1 832794093 IVSFMXLZKKGQBX-MRXNPFEDSA-N 344.415 0.107 10 20 ECCD C[C@H](CN)NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 841915456 PXIDYYDUYOPMMT-SNVBAGLBSA-N 328.363 0.948 10 20 ECCD COc1ccc(N2CCN(C(=O)[C@@H]3CCO[C@@H]3CN)CC2)c(OC)c1 877227268 HEYGMKYDNXURLO-RHSMWYFYSA-N 349.431 0.716 10 20 ECCD CN(C)c1ccc(CN(C(=O)CN2C(=O)CNC2=O)C2CC2)cc1 1115885064 NBAOMJPBPONREV-UHFFFAOYSA-N 330.388 0.795 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCc1nnnn1CC1CC1 1117645542 HAWFQANHECTBDT-UHFFFAOYSA-N 344.375 0.064 10 20 ECCD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1ccncc1 773739262 DDYJRLSLLHDSAX-LLVKDONJSA-N 329.356 0.970 10 20 ECCD Cn1nnc(CNC(=O)NCc2cccc(Br)c2O)n1 787437514 SWFZASFEACALRR-UHFFFAOYSA-N 341.169 0.678 10 20 ECCD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1nnnn1C 790240884 LYTQZSNFBBGWNE-GFCCVEGCSA-N 345.407 0.607 10 20 ECCD C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1nnnn1C 790240885 LYTQZSNFBBGWNE-LBPRGKRZSA-N 345.407 0.607 10 20 ECCD CN(Cc1ccccc1O)C(=O)C(=O)NCCCc1cnn(C)c1 1326377104 FPYUQHKXKFOGAY-UHFFFAOYSA-N 330.388 0.833 10 20 ECCD COC[C@]1(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCNC1 1331420941 YSSKDPDNAJLIOP-IBGZPJMESA-N 346.475 0.681 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](C(=O)O)[C@H]1C 1610466820 UOVMDROPXBQGNN-IUODEOHRSA-N 347.415 0.999 10 20 ECCD COC(=O)NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 55524612 RTPISAFENDKROH-UHFFFAOYSA-N 325.340 0.635 10 20 ECCD C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H]1CO 288658219 VIRUCQCNXUYMBW-WMLDXEAASA-N 343.427 0.908 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@H](CCCO)C2)cc1 817274171 FICHQGSXCYJBPF-OAHLLOKOSA-N 333.432 0.990 10 20 ECCD CCOC(=O)COCCN1C(=O)CN(Cc2ccccc2O)C1=O 819170051 SNCWMUZLKGVMJT-UHFFFAOYSA-N 336.344 0.736 10 20 ECCD CN1C(=O)C(=Cc2ccc(F)c(-c3nn[nH]n3)c2)C(=O)N(C)C1=O 826010637 MMAOKNLMUYFJLX-UHFFFAOYSA-N 330.279 0.440 10 20 ECCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ncccn1 743312289 FRPOGMLJFFVHKG-UHFFFAOYSA-N 346.412 0.641 10 20 ECCD O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1CCNC1 841915802 UKQIFDVQWYVCOY-LBPRGKRZSA-N 340.374 0.963 10 20 ECCD CN(C)c1ccc(CNC(=O)N2CCC[C@H](C(=O)NCCN)C2)cc1 841656046 VBRXQCWZVGVHJU-HNNXBMFYSA-N 347.463 0.749 10 20 ECCD CN(C)C(=O)CCNC(=O)C(=O)NCCCSc1nccs1 1117053916 KPCMGQJNFMFQMM-UHFFFAOYSA-N 344.462 0.336 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@@H]2C[C@]2(CO)C1 1117976724 UXEXAFANPGWQSZ-KBXCAEBGSA-N 331.416 0.552 10 20 ECCD Cc1nnc(CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1C 1117451772 MFMOFODFJIGFLP-LLVKDONJSA-N 344.419 0.683 10 20 ECCD CCNC(=O)CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 787327439 MLUYYSBQUMOPCR-UHFFFAOYSA-N 346.431 0.498 10 20 ECCD COc1ccc(CNC(=O)Cc2c(C)[nH]c3ccnn3c2=O)c(O)c1 794378542 YDXGSRVNLOCUSS-UHFFFAOYSA-N 342.355 0.904 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCn1cccn1 793743707 FSSGXLMULHKHEW-UHFFFAOYSA-N 329.404 0.724 10 20 ECCD CN(CC(N)=O)[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 980520575 IHOPNHLRHSSHON-LBPRGKRZSA-N 332.364 0.481 10 20 ECCD O=C(NCCC1=CCN(c2cnc(F)cn2)CC1)[C@H]1CCNC1=O 1089854927 ALZROMHGMMKJQE-GFCCVEGCSA-N 333.367 0.395 10 20 ECCD Cc1nccc(N2CC=C(CCNC(=O)[C@H]3C[C@H]3C(N)=O)CC2)n1 1089866473 KTYNMNSDILDCBU-KGLIPLIRSA-N 329.404 0.549 10 20 ECCD CCNC(=O)CNCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1177238415 VHGGZJKLQJWEOC-UHFFFAOYSA-N 334.380 0.695 10 20 ECCD COCCn1cc(NC(=O)C(=O)NCc2cccc(OC)c2O)cn1 1251997600 ZHVQGOCNSBYQLX-UHFFFAOYSA-N 348.359 0.499 10 20 ECCD CCn1cc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)nn1 1333858644 VRVFACVQJHRYLR-UHFFFAOYSA-N 344.419 0.639 10 20 ECCD C[C@H]1C[C@@H](NC(=O)c2c(F)ccc(O)c2O)C(=O)N1c1cnn(C)c1 1344112446 UCTUNMPNVYZZAN-GZMMTYOYSA-N 348.334 0.894 10 20 ECCD COCCCNC(=O)[C@H](C)N1CCN(Cc2ccc(N)cc2)CC1 1352788573 PUVVBJJEFYCRAI-HNNXBMFYSA-N 334.464 0.928 10 20 ECCD COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CC(C(=O)O)=NO3)C2)cc1 1604809597 LRKHNNPAMZVBFR-QMTHXVAHSA-N 333.344 0.620 10 20 ECCD NS(=O)(=O)C1CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])C1 1601193786 IAIKGJBBIMOZSB-RQOWECAXSA-N 327.318 0.170 10 20 ECCD CC[C@H](NCCS(C)(=O)=O)c1cccc(-c2nn[nH]n2)c1O 1604057068 XZGKFFNSQFMDFR-NSHDSACASA-N 325.394 0.658 10 20 ECCD CC(=O)NCC(=O)NCC(=O)NCc1ccc(N2CCCC2)cc1 49978447 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JREQNDISKHWZOG-UHFFFAOYSA-N 327.392 0.870 10 20 ECCD O=C(COC(=O)c1ccc(-c2nn[nH]n2)nc1)c1ccc(O)c(O)c1 1609529567 UKWLUJXIVWEUAM-UHFFFAOYSA-N 341.283 0.713 10 20 ECCD CN(C)CCC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1842822075 MHOCJVXFNHEOGS-UHFFFAOYSA-N 348.403 0.262 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)C(=O)O)nc12 1591279569 QTYSRCDIAIECDQ-ZETCQYMHSA-N 337.288 0.376 10 20 ECCD C[C@@H](NC(=O)CN1CCNCC1=O)c1ccc(N2CCOCC2)cc1 237597821 CPIMENFOVDOMSU-CQSZACIVSA-N 346.431 0.132 10 20 ECCD Cc1c(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)cnn1C 283487488 MQBWANFBLXVSHF-UHFFFAOYSA-N 329.404 0.727 10 20 ECCD CN1CCN(CCNC(=O)c2c(F)ccc(O)c2O)CC1(C)C 295586597 ALOICDSNYRSVQJ-UHFFFAOYSA-N 325.384 0.993 10 20 ECCD CS(=O)(=O)N1CCC[C@H](NC(=O)c2c(F)ccc(O)c2O)C1 294746703 CTZUCTWZALLJLE-QMMMGPOBSA-N 332.353 0.391 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@@H]3C(=O)O)CC2)cc1 738021931 KGLIJHOTIOTULU-HOTGVXAUSA-N 347.415 0.654 10 20 ECCD CN(C)c1ccc(CNC(=O)NCCCN2CCNCC2)cc1F 841760821 LVVJJXFRWVDOER-UHFFFAOYSA-N 337.443 0.986 10 20 ECCD CNS(=O)(=O)CC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 840556958 OBLGCRJHEBDJAM-GFCCVEGCSA-N 327.450 0.657 10 20 ECCD Cc1ccnc2nc(C(=O)NC[C@@H](N)c3ccc(N(C)C)cc3)nn12 844163233 WATLKRHYPPCJDJ-CQSZACIVSA-N 339.403 0.929 10 20 ECCD CCNS(=O)(=O)CCN[C@H](C)c1cc(C(=O)OC)ccc1O 756709866 YUHRFUNTBLQRED-SNVBAGLBSA-N 330.406 0.769 10 20 ECCD CN(CCNS(=O)(=O)c1cnn(C)c1)c1ccc2c(c1)OCO2 756653108 ASKHJLBRNYYUTR-UHFFFAOYSA-N 338.389 0.564 10 20 ECCD COc1cccc(O)c1CN1CCC(n2cc(C(N)=O)nn2)CC1 862483160 HJWSFXOQDMUKIZ-UHFFFAOYSA-N 331.376 0.928 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)C1COC1 788421558 GVMGALGHUVXOIY-UHFFFAOYSA-N 326.418 0.684 10 20 ECCD C[C@@H](NCCN1CCN(S(C)(=O)=O)CC1)c1ccccc1O 783509929 WJDLKRGJWBMNSC-CYBMUJFWSA-N 327.450 0.620 10 20 ECCD CC(=O)NCC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786660470 YEZIQDUKHOGCSE-UHFFFAOYSA-N 332.404 0.107 10 20 ECCD COc1ccc(CNC(=O)NCC2CN(S(C)(=O)=O)C2)c(O)c1 793063936 ZOEMZMWVPJJFOD-UHFFFAOYSA-N 343.405 0.091 10 20 ECCD COc1ccc(CNC(=O)[C@@H]2CCCCN2S(C)(=O)=O)c(O)c1 794383074 JMOXLEZAURFSAO-ZDUSSCGKSA-N 342.417 0.831 10 20 ECCD C[C@H](O)CN1C[C@@H](O)[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1078253617 JNJGDGBANKGQHL-ZWKOPEQDSA-N 335.364 0.005 10 20 ECCD O=C(NCCC1=CCN(c2nccn3nnnc23)CC1)[C@@H]1CC12CC2 1089863732 FOLKWUPTYZFLEB-ZDUSSCGKSA-N 339.403 0.962 10 20 ECCD COc1cc(C(=O)NC2CN(C(=O)c3cc(F)c[nH]3)C2)cc(OC)n1 996378360 IGYJXDYZHJLXRI-UHFFFAOYSA-N 348.334 0.820 10 20 ECCD COc1ccc(N(C)CC(=O)N2CCN(C(C)=O)CC2)cc1OC 64517382 YRVYVYNXOKCSFM-UHFFFAOYSA-N 335.404 0.831 10 20 ECCD CC(=O)N[C@H](C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 98094056 FIIBFFBZCKQFAG-LLVKDONJSA-N 337.395 0.928 10 20 ECCD CC(C)NS(=O)(=O)NCCNC(=O)N(C)Cc1ccccc1O 277117985 QPBBKJCMGIKFDN-UHFFFAOYSA-N 344.437 0.366 10 20 ECCD CCOc1ccc(CN2CCC(NS(=O)(=O)NC)CC2)c(O)c1 811500267 WVPOLWJGNJVJKW-UHFFFAOYSA-N 343.449 0.809 10 20 ECCD CCN1C(=O)C(=CN[C@@H](C(=O)OC)C(C)C)C(=O)N(CC)C1=S 814311795 KDEIEGYVBMIVIC-LLVKDONJSA-N 341.433 0.653 10 20 ECCD CC(C)N(CC(=O)O)C(=O)c1cc(NS(C)(=O)=O)ccc1O 820004072 CPRIJFGNMJQPSE-UHFFFAOYSA-N 330.362 0.699 10 20 ECCD CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](O)C3CC3)cc2)CC1 832795329 ZHJZNQAICWJPRN-KRWDZBQOSA-N 331.416 0.742 10 20 ECCD COc1ccc(N2CCN(CCNC(=O)C3(C(N)=O)CC3)CC2)cc1 731620397 ZQJAXUAKGIVOQL-UHFFFAOYSA-N 346.431 0.199 10 20 ECCD O=C1COc2ccc(NC(=O)C(=O)NCc3ccccc3O)cc2N1 748485529 JFDQMCNXWDHHBM-UHFFFAOYSA-N 341.323 0.978 10 20 ECCD COC(=O)CNC(=O)[C@@H](C)N(C)CCN(C)c1ccc(OC)cc1 844400928 IDWPLPZXDUREKD-CYBMUJFWSA-N 337.420 0.741 10 20 ECCD CNC[C@@H]1CCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1C 842152049 DVJSNRYGUWPXCA-INIZCTEOSA-N 332.448 0.888 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)NCCO[C@@H]2CCOC2)cc1 929237003 PBQBIJMABCYRQY-OAHLLOKOSA-N 335.404 0.291 10 20 ECCD C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@]1(C)CO 856251613 QDELTBDQDDVXIX-BMIGLBTASA-N 342.417 0.854 10 20 ECCD O=S1(=O)CC[C@H](N(Cc2cc3c(cc2O)OC[C@@H]3O)C2CC2)C1 768441478 JDFDSXODRUASDM-WFASDCNBSA-N 339.413 0.970 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@](O)(C3CC3)C2)cc1F 1117165304 TYUVQJATTKXYSY-GOSISDBHSA-N 349.406 0.881 10 20 ECCD COCc1nc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)no1 883146345 JIGQKHCSZAZVGS-UHFFFAOYSA-N 345.403 0.898 10 20 ECCD C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)O 780444546 CFIBIHSTWSWDQV-SNVBAGLBSA-N 325.340 0.935 10 20 ECCD Cc1ccc(N2CC=C(CCNC(=O)CC(=O)N(C)C)CC2)nn1 1089867589 ORJNULHDAQRWHL-UHFFFAOYSA-N 331.420 0.906 10 20 ECCD CCO[C@H](C)C(=O)NCCC1=CCN(c2ccc3nnnn3n2)CC1 1089810609 UKFWFGYIBHZHNI-GFCCVEGCSA-N 345.407 0.587 10 20 ECCD CS(=O)(=O)C[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 1324101216 KDIUAJVUERYJAV-QMTHXVAHSA-N 327.402 0.685 10 20 ECCD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2nc(C)n(C)n2)c1 1324287565 XUNCAQBDAYTKGD-MRVPVSSYSA-N 333.348 0.654 10 20 ECCD CCn1nc(C)c(CNC(=O)C(=O)N(C)Cc2ccccc2O)n1 1326714596 NOGJGZDKWUURMK-UHFFFAOYSA-N 331.376 0.587 10 20 ECCD COCCOC[C@H](C)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 1327318733 LCFGBWLEBDZDOQ-ZDUSSCGKSA-N 337.420 0.537 10 20 ECCD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCOC[C@H]1CCO 1333309405 BCMONLMCJJDQSO-MRXNPFEDSA-N 349.431 0.287 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@H](CC(N)=O)C1 1344624107 RPUOXXMGPICYJE-CQSZACIVSA-N 346.431 0.435 10 20 ECCD COc1ccc(CNC(=O)NCCC(=O)NCCC(=O)O)c(O)c1 1607259395 OXFDAACDERGKII-UHFFFAOYSA-N 339.348 0.181 10 20 ECCD CCOCc1cc(CN[C@@H](CS(C)(=O)=O)C(=O)O)ccc1OC 1776907290 YBCQEVONALGTRL-ZDUSSCGKSA-N 345.417 0.819 10 20 ECCD CN1CCCc2cc(CNC(=O)CCS(=O)(=O)N(C)C)ccc21 136730897 ISMZXOSDEOOMLO-UHFFFAOYSA-N 339.461 0.967 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)Cn3cccn3)nc12 265088522 SIQGOLACQJGNSR-NSHDSACASA-N 344.375 0.986 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CC[C@@H]3COC(=O)N[C@H]3C2)cc1 281217261 BLROEUSUWXXWQY-ZBFHGGJFSA-N 346.431 0.799 10 20 ECCD O=C(NCCCSc1nccs1)C(=O)N1CCC[C@H]1CO 806276202 KZPYOUISOCPDMR-JTQLQIEISA-N 329.447 0.725 10 20 ECCD CC(C)CN1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)CC1 842242367 RKDGZDYXQBIQBX-UHFFFAOYSA-N 332.448 0.728 10 20 ECCD COC(=O)c1ccc(O)c([C@H](C)NCCC(=O)N2CCN(C)CC2)c1 756536269 UGPRUCVQPQKYIL-ZDUSSCGKSA-N 349.431 0.994 10 20 ECCD COCCN(C)C[C@@H](O)Cn1cc(COc2ccc(N)cc2)nn1 881418040 DOZYUBIBRGDRMO-OAHLLOKOSA-N 335.408 0.378 10 20 ECCD CO[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 788615369 RQZXZSZVHOOKOK-LBPRGKRZSA-N 330.362 0.209 10 20 ECCD COc1cc(C(=O)N[C@H]2C[C@H](NC(=O)[C@H]3CCOC3)C2)cc(OC)n1 973081276 NWEBJAGONAPKRS-DRZSPHRISA-N 349.387 0.512 10 20 ECCD COc1cc(C(=O)N[C@@H](C)CCNC(=O)c2ncc[nH]2)cc(OC)n1 1076403778 OPLYGXSYVJVETM-JTQLQIEISA-N 347.375 0.760 10 20 ECCD O=C(NCCC1=CCN(c2ccc3nnnn3n2)CC1)C1(CF)CC1 1089861821 HAVSUCYNTOSRNU-UHFFFAOYSA-N 345.382 0.912 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)NC2(CCO)CNC2)N(C)C)cc1 1578424816 XHYOPLLNCCBPMZ-MRXNPFEDSA-N 349.479 0.379 10 20 ECCD O=C(c1cocn1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249651 HVVDFGMMGSZBCS-UHFFFAOYSA-N 344.327 0.612 10 20 ECCD COc1ccc(N2CCN(C(=O)Cn3nnc(C4CC4)n3)CC2)cc1 193719569 AKCYNCZUUYFHRC-UHFFFAOYSA-N 342.403 0.908 10 20 ECCD CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@](F)(CO)C3)nc12 802013569 FVTHZYASEMPFAR-HNNXBMFYSA-N 338.339 0.518 10 20 ECCD COc1ccc(CN[C@H]2CCN(C(=O)[C@@H]3CN(C)C(=O)N3)C2)cc1C 1019240454 MRBBDALRTAARLL-GJZGRUSLSA-N 346.431 0.718 10 20 ECCD C[C@]1(CN)CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 842170552 IPOOPSKCYHWLMY-LJQANCHMSA-N 342.443 0.876 10 20 ECCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H](CCCO)C2)c1 857531214 GDIHYKWCDYVERO-NSHDSACASA-N 342.417 0.998 10 20 ECCD COc1ccc(CN[C@H]2C[C@H](NC(=O)[C@H]3C[C@H]3C(N)=O)C2)cc1C 1020597398 PFQDFLPHZREIRP-TUVASFSCSA-N 331.416 0.862 10 20 ECCD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cn(C)cn1 933865098 NGFGYMCXDLPEEX-UHFFFAOYSA-N 329.404 0.761 10 20 ECCD O=S1(=O)CC[C@@H](N(Cc2cc3c(cc2O)OC[C@@H]3O)C2CC2)C1 768441471 JDFDSXODRUASDM-DOMZBBRYSA-N 339.413 0.970 10 20 ECCD COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3COCC[C@H]3O)C2)cc1 875680131 UANSRRGXNSMJHT-IAOVAPTHSA-N 349.431 0.971 10 20 ECCD COc1ncncc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 782823177 OFESZKVZOFJPBX-UHFFFAOYSA-N 332.316 0.194 10 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CCC[C@@H](NC(N)=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 918862393 YWNRDDSITYTPDL-MRXNPFEDSA-N 347.463 0.892 10 20 ECCD CCNCCNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 842231575 LNDOXKQMGYAMHX-UHFFFAOYSA-N 332.448 0.969 10 20 ECCD C[C@H](OC(=O)c1cccc(O)c1O)C(=O)N1CCC[C@H](C(N)=O)C1 758562303 QIFBLDDLRLPYSL-UWVGGRQHSA-N 336.344 0.367 10 20 ECCD COC(=O)[C@](C)(CO)NCc1ccc(OC)c(Cn2cccn2)c1 894971279 CXUFHINOZLMGGV-KRWDZBQOSA-N 333.388 0.954 10 20 ECCD CCOCCC(=O)NCCC1=CCN(c2nccn3nnnc23)CC1 1089813623 WRVUOHJYAPPEKG-UHFFFAOYSA-N 345.407 0.589 10 20 ECCD Nc1ccc(CCNS(=O)(=O)C[C@@H]2CCCS(=O)(=O)C2)cc1 1326983779 GDJSUGMFNJGIAC-CYBMUJFWSA-N 346.474 0.556 10 20 ECCD O=C(O)CNC(=O)[C@H]1CCCN1C(=O)/C=C/c1ccc(O)c(O)c1 1602064268 NJYVMLDHEHDZJD-DUMNWFOQSA-N 334.328 0.303 10 20 ECCD C[C@@H](NCCCc1cnn(C)n1)c1cccc(-c2nn[nH]n2)c1O 1589960746 GIYHJUDAFZLJDZ-SNVBAGLBSA-N 328.380 0.984 10 20 ECCD COCCNC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 849226418 UCLXXQVMKXHAQZ-UHFFFAOYSA-N 341.433 0.367 10 20 ECCD COc1cc(O)c(CN[C@H]2CCN(S(C)(=O)=O)C2)cc1OC 846035551 WBZJHVIVOZXFCG-NSHDSACASA-N 330.406 0.533 10 20 ECCD CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3CCC[C@@]3(N)C2)cc1F 857102634 HNXBKDBNTOKTNJ-FZKQIMNGSA-N 348.422 0.848 10 20 ECCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C[C@H]1CC(=O)NC1=O 929537855 VHPIFYKHNHQSAC-CQSZACIVSA-N 345.399 0.534 10 20 ECCD C[C@H]1COC[C@H]1NC(=O)C(=O)NCCCSc1nccs1 930198388 OOWPBBITIUCIMW-VHSXEESVSA-N 329.447 0.893 10 20 ECCD Oc1cc2c(cc1CN1CCN(c3ncccn3)CC1)[C@@H](O)CO2 768438632 WHHSVWDIHMQJPT-HNNXBMFYSA-N 328.372 0.930 10 20 ECCD NC(=O)c1cccnc1N1CCN(C(=O)c2cccc(O)c2O)CC1 776640834 OGZUYPYSUPBZFC-UHFFFAOYSA-N 342.355 0.554 10 20 ECCD CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H]3C[C@H]2CN3)cc1 884638308 UABDIVVYNYKMKL-HOCLYGCPSA-N 330.432 0.722 10 20 ECCD COc1ccc(CNC(=O)CCC(=O)NCCNC(C)=O)c(O)c1 794378483 VYVSJPHDFRJASU-UHFFFAOYSA-N 337.376 0.050 10 20 ECCD NC(=O)[C@@H]1CC[C@@H]1C(=O)NCCC1=CCN(c2nccnc2F)CC1 1089855466 LYKZVXITTIIOAW-OLZOCXBDSA-N 347.394 0.770 10 20 ECCD Cc1cc(N2CC=C(CCNC(=O)[C@H](O)C(C)C)CC2)nc(CO)n1 1089829869 YXZYQCBLMGTOJA-QGZVFWFLSA-N 348.447 0.937 10 20 ECCD COCCn1cc(NC(=O)C(=O)NCc2ccccc2O)ccc1=O 1318077777 MDEWXUWTQSTFSP-UHFFFAOYSA-N 345.355 0.455 10 20 ECCD COCC(=O)N1CCN(c2nnc(-c3sccc3O)n2C)CC1 1519504131 DEQHYGPPRBLWPJ-UHFFFAOYSA-N 337.405 0.544 10 20 ECCD CN(C)c1ccc(CNS(=O)(=O)CCCN2CCOCC2)cc1 272578106 URQDFOUVQRHFCG-UHFFFAOYSA-N 341.477 0.894 10 20 ECCD CCOC(=O)CN(Cc1ccccc1O)C(=O)CS(C)(=O)=O 819696001 HPGXLNMZRMTSQV-UHFFFAOYSA-N 329.374 0.329 10 20 ECCD C[C@@H](NC(=O)CNS(=O)(=O)N(C)C)c1ccc(N(C)C)cc1 832431459 PLCVBXVQAXVFIC-LLVKDONJSA-N 328.438 0.326 10 20 ECCD CN(C)c1ccc([C@@H](CNC(=O)C(=O)N2CC[C@H](N)C2)N(C)C)cc1 911577346 CAVGHGUZEGLNAG-GOEBONIOSA-N 347.463 0.031 10 20 ECCD CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCN 842222716 RIKRSTILPOCFQL-UHFFFAOYSA-N 344.209 0.578 10 20 ECCD COc1ccc(N2CC[C@H](CNC(=O)[C@H](N)CCN(C)C)C2)cc1 846682821 MLPYMNWVYUIHJZ-RHSMWYFYSA-N 334.464 0.917 10 20 ECCD CN(C)c1ccc(CNC(=O)CN2CCc3cnc(N)nc3C2)cc1 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