smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CC(=O)Nc1ccccc1N/C=C1/C(=O)N=C(S)N(C2CC2)C1=O 103119100 GOSINEYNCWZTRX-FLIBITNWSA-N 344.396 1.758 10 10 EDCE CC(C)(CNCc1ccc(N2CCCC2)cc1)CS(N)(=O)=O 1261851436 UBPYYAJWDHANQM-UHFFFAOYSA-N 325.478 1.691 10 10 EDCE COc1ccc(N2CCN(C=O)CC2)cc1NC(=O)c1ccncc1 62192158 WIKOKECPRCMPAO-UHFFFAOYSA-N 340.383 1.621 10 10 EDCE COC(C)(C)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 188120422 RRDDWEDTZOLSFL-UHFFFAOYSA-N 333.432 1.396 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H]4[C@@H](O)C[C@H]4C3)c(Br)cc21 2358436170 MWWIPUFKYWVNDV-BAJQXQOGSA-N 338.205 1.218 10 10 EDCE OCc1ccc(N2CC[C@]3(C[C@@H](O)CO3)C2)cc1Br 2137136436 VMJRWUGVVQYQTI-OCCSQVGLSA-N 328.206 1.672 10 10 EDCE CN(C)C(=O)CCN1CCN(Cc2cc(Cl)c(F)cc2O)CC1 295398206 QLPVTKNUXBFVGY-UHFFFAOYSA-N 343.830 1.781 10 10 EDCE CNC(=O)[C@H]1CCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C1 817171212 RONUATGMDFKOCP-ZBFHGGJFSA-N 346.475 1.770 10 10 EDCE C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1ccccn1 826707279 RURZSQRXOIVTFJ-CQSZACIVSA-N 340.427 1.684 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C)C(=O)C3CC3)CC2)cc1 733123787 FRDRCFLBVOOBPR-UHFFFAOYSA-N 331.416 1.212 10 10 EDCE NC(=O)c1cn(C2CN(Cc3ccc(N4CCCCC4)cc3)C2)nn1 839145434 ZWNRNJFVSZAQID-UHFFFAOYSA-N 340.431 1.424 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1 838248181 OVNPEMWJGBKORR-AWEZNQCLSA-N 341.367 1.517 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@]3(CCNC3)C2)cc1 844224873 KCUSQLDPYKYTPB-IBGZPJMESA-N 330.476 1.444 10 10 EDCE COC(=O)[C@@H]1CN(C)CCN(C/C=C/c2ccc(N(C)C)cc2)C1 840958651 QZJQBFMDZDLWGJ-FUTAKVPZSA-N 331.460 1.802 10 10 EDCE CCn1c(O)nnc1C1CCN(C(=O)c2ccc(C)c(O)c2O)CC1 843920654 BQHOTPHJJRFWOU-UHFFFAOYSA-N 346.387 1.743 10 10 EDCE CCO[C@@H]1COC[C@H]1NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852374462 NESDWCUOCHYFPK-IAOVAPTHSA-N 349.431 1.377 10 10 EDCE C[C@@H]1C[C@@H](NC[C@@]2(OCCO)CCOC2)c2c(O)ccc(F)c21 850507951 LGJNZZCDPORMJG-NDGTYSDOSA-N 325.380 1.837 10 10 EDCE COc1ccc(N2CCN(C[C@H]3CCCS3(=O)=O)CC2)cc1F 929820473 FQNBHQGIZKEPHM-CQSZACIVSA-N 342.436 1.534 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](NC(N)=O)C(C)(C)C)C2)cc1 855226648 RTZLGLJEUARUEG-WFASDCNBSA-N 348.447 1.473 10 10 EDCE CNC(=O)NC(=O)COC(=O)Cc1cc(C)n(-c2ccccc2)c1C 853933597 GOGLWUJVJYAQFJ-UHFFFAOYSA-N 343.383 1.635 10 10 EDCE CCn1cc(CNC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)nn1 852450485 NDJPCHRBOXRMFB-CYBMUJFWSA-N 344.419 1.385 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)COC3CCOCC3)C2)cc1 855231139 KSXYPKLAQYFJEP-AWEZNQCLSA-N 334.416 1.586 10 10 EDCE Cc1ccc(C(=O)NCCS(=O)(=O)c2ccccc2)c(O)c1O 751533708 BTYNYMAGGJRVGL-UHFFFAOYSA-N 335.381 1.610 10 10 EDCE COCC(O)(CNCc1cc(Br)ccc1O)COC 1875694213 VPIVCLMJWMDKQH-UHFFFAOYSA-N 334.210 1.268 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C[C@H]1F 1117407056 JHRHNQZBDDLNDH-RHSMWYFYSA-N 345.418 1.886 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCO[C@H](Cn3ccnn3)C2)c1O 878985211 GVJCBEKAQNVRNS-AWEZNQCLSA-N 334.351 1.226 10 10 EDCE COC(=O)c1c(CNCCC(=O)N(C)C)c2cc(F)ccc2n1C 894212157 WWLIOTLMPNICKP-UHFFFAOYSA-N 335.379 1.672 10 10 EDCE C[C@H](NC(=O)C(=O)NCCc1ccc(N)cc1)C1CCC(F)CC1 1327843064 UKSJGFABZVYCMC-GRTSSRMGSA-N 335.423 1.961 10 10 EDCE C=C/C=C/CCNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1338861294 LAQIHCARKJLUAY-MBVDDHJVSA-N 343.427 1.639 10 10 EDCE CNC(=O)NCCC(=O)N[C@H]1C[C@H](NCc2ccc(OC)c(C)c2)C1 1265475162 GDDVIGYBRFWMPO-SHTZXODSSA-N 348.447 1.060 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cnn3cc[nH]c23)cc1C 1275421925 PVLBYLZGNXIUCI-ZDUSSCGKSA-N 341.415 1.888 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C2(C)CC=CC2)cc1C 1278147085 KDRHNDLVVGXBMG-MRXNPFEDSA-N 332.444 1.927 10 10 EDCE C[C@@H](O)CN(C)C[C@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1505466317 WKMRCTAFCXXERH-IUODEOHRSA-N 347.419 1.766 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(c2ccccc2)C(=O)C1 1454893633 NDPALOZNKZQTMS-UHFFFAOYSA-N 326.352 1.516 10 10 EDCE CCCC(=O)NC[C@@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1610940387 YGLYPSVDTCFVJA-AWEZNQCLSA-N 334.416 1.795 10 10 EDCE COc1ccc(-n2nnnc2CN[C@@H](C)[C@H](C)NC(=O)C2CC2)cc1 1717395584 NSIAINVXNFENHT-RYUDHWBXSA-N 344.419 1.064 10 10 EDCE NS(=O)(=O)c1cc(C(=O)NCc2cc(Cl)ccc2O)cs1 1557385214 ABFYYGRPNXAESD-UHFFFAOYSA-N 346.817 1.685 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)CCn2cnnn2)cc1C 1717431732 XBNWMXOYADFBAC-KGLIPLIRSA-N 346.435 1.063 10 10 EDCE O=C(C[C@H]1Oc2ccccc2NC1=O)NCc1cc(O)ccc1O 1637123115 WPMXKGNRUREFRU-OAHLLOKOSA-N 328.324 1.504 10 10 EDCE O=C(CNC(=O)c1ccccc1Cl)NCCc1ccc(O)c(O)c1 1630334650 DMPHTAWVBNBXJY-UHFFFAOYSA-N 348.786 1.840 10 10 EDCE CCOC(=O)C1(CC(=O)NCc2ccc(O)cc2O)CCOCC1 1638355859 ADPSFMJUZWXNFO-UHFFFAOYSA-N 337.372 1.464 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccnc1OCCO 1632681623 SAUOTOIUTFXXKM-LLVKDONJSA-N 332.356 1.225 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1nc2cc3c(cc2[nH]1)OCO3 1570224258 KWQDBUQZGVBZMP-UHFFFAOYSA-N 327.296 1.884 10 10 EDCE CCn1nncc1C(=O)NC/C=C/CNCc1ccc(OC)c(C)c1 1699252013 HLPAHEJHDARBGE-AATRIKPKSA-N 343.431 1.691 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)Cc2n[nH]c(C)n2)cc1C 1698749667 UNBMGVWIEVZIJF-GFCCVEGCSA-N 345.447 1.515 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)c2cnccn2)c2nccn2C)cc1 169813721 YPLFGBXOEGAWOE-MRXNPFEDSA-N 336.399 1.796 10 10 EDCE CN[C@H](C)c1ccc(N2CC(CO)(CO)C2)cc1Br 1914971041 NCGFUHZWOSANHF-SNVBAGLBSA-N 329.238 1.521 10 10 EDCE O=C1Nc2cc(N3CC(N4CCC4)C3)c(Br)cc2[C@@H]1O 2152247695 BQNMMNIACSJLAY-ZDUSSCGKSA-N 338.205 1.329 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(O)c(O)c2)[C@H](O)C1 2005084607 JVNFVZHMSJJGLO-SWLSCSKDSA-N 338.404 1.558 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](C(=O)NCCCN=[N+]=[N-])O1 1985099751 RDOXVTKWDRDWJR-QWRGUYRKSA-N 327.385 1.875 10 10 EDCE COc1ccc([C@@H](NCCN=[N+]=[N-])C(N)=O)c(Br)c1 311357160 PODIRRNGNSJDOJ-SNVBAGLBSA-N 328.170 1.884 10 10 EDCE Nc1ccc(OCCC(=O)OCC(=O)NCc2ccccc2)cc1 324578517 WGDPMSCITJRORB-UHFFFAOYSA-N 328.368 1.897 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCCc3ccc4c(c3)CCO4)c2n1 2062330427 GFBNMGHXIFJWPI-UHFFFAOYSA-N 338.367 1.651 10 10 EDCE NCc1ccc(N2C[C@@H](CO)C[C@@H]2CO)c(F)c1Br 2089907568 LPRQLRZEQMWITJ-WCBMZHEXSA-N 333.201 1.226 10 10 EDCE O=C1CN(c2ccc(CO)c(Br)c2)CCN1C1CC1 2114174237 FVGOTRQKQXVQMM-UHFFFAOYSA-N 325.206 1.752 10 10 EDCE Cc1cccc(N2C(=O)C(=CNCCCN(C)C)C(=O)NC2=S)c1 2296173540 KQSOPKVKWKTFAM-UHFFFAOYSA-N 346.456 1.168 10 10 EDCE CSc1ncc(CNC(=O)N[C@@H](CC(F)F)C(=O)O)s1 2284504148 JYNVHCPBBYIPND-LURJTMIESA-N 325.362 1.773 10 10 EDCE CCCCN1C(=O)C(=Cc2nc3ccccc3[nH]2)C(=O)NC1=S 2296931367 HEYWPQQOXFQVQF-UHFFFAOYSA-N 328.397 1.990 10 10 EDCE C[C@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CC[C@H]1O 2310369558 OZZWVAHJNLHLPE-MAUKXSAKSA-N 330.428 1.766 10 10 EDCE O=C(O)C[C@H](C(=O)O)N1C(=O)C(=Cc2ccsc2)SC1=S 2318683558 HMHFQQOHQDQSLK-SSDOTTSWSA-N 343.407 1.877 10 10 EDCE C[C@H](O)[C@H](C(=O)O)N1C(=O)C(=Cc2cccc(O)c2)SC1=S 2323823705 GZHHBUOCCCYKON-WRWORJQWSA-N 339.394 1.427 10 10 EDCE Cc1ccc(CN(C)C[C@H](O)CC(=O)O)c(O)c1Br 2352947363 HVJNPFHIFNDKJX-SNVBAGLBSA-N 332.194 1.731 10 10 EDCE Cc1ccccc1C(=O)NCC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 185385650 WEPJXEDOGDCXGA-ZDUSSCGKSA-N 342.395 1.883 10 10 EDCE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CC[C@](O)(C(N)=O)C2)c1 276508931 QXZPWBNZAOECJW-LJQANCHMSA-N 341.411 1.465 10 10 EDCE CC(C)c1nn(C)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 280832078 WAOQIMYJYJHZDE-UHFFFAOYSA-N 343.431 1.864 10 10 EDCE C[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(C)C1)c1ccc(N(C)C)cc1 807678316 WFGRJAQVSHTPRE-UKRRQHHQSA-N 332.448 1.140 10 10 EDCE COc1ccc(Br)cc1CC(=O)OCC(=O)C(C)=O 808521800 FCXUQXKKSZJQGX-UHFFFAOYSA-N 329.146 1.702 10 10 EDCE C[C@H]1C[C@H](C(=O)O)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 398838347 JIBJLUVHODPBII-IUCAKERBSA-N 335.316 1.473 10 10 EDCE CC[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CCO1 817828643 KVGYQTYIQGCJQH-WBVHZDCISA-N 347.459 1.751 10 10 EDCE CN1CC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 729522970 BEEJDXLUTDDICO-AWEZNQCLSA-N 335.423 1.355 10 10 EDCE Nc1nnc(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)s1 722221647 MJIBUEVAFMRKRK-UHFFFAOYSA-N 341.201 1.934 10 10 EDCE O=C(N(Cc1ccccc1O)C[C@H]1CCCO1)C12CCN(CC1)C2 901177796 UWCXGMMXLSYZNU-MRXNPFEDSA-N 330.428 1.996 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1(C(=O)N(C)C)CC1 839921348 JKVMTLNKPLBIBI-AWEZNQCLSA-N 331.460 1.977 10 10 EDCE COc1ccc(N2CCCN(c3ncncc3C(=O)O)CC2)cc1 844207266 FFIZEXZDJHOSCT-UHFFFAOYSA-N 328.372 1.900 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)NC[C@H]2CN(C3CC3)C(=O)O2)c1 848573036 XGYCVVHGHMNFJB-GWCFXTLKSA-N 334.372 1.813 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCCCNC1 842239125 CYWAEFAKRRNYEY-OAHLLOKOSA-N 333.432 1.389 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)c2ccccc2CCN)cc1 846664020 UXXUXDGTOAMKEK-GOSISDBHSA-N 326.444 1.684 10 10 EDCE O=C(NCc1c(O)cccc1F)NC[C@H]1CCCCS1(=O)=O 921906504 COUHLZLPRUQWFF-SNVBAGLBSA-N 330.381 1.298 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CNC[C@@H]3CCCO3)C2)cc1 851639524 HBFUKKYMUIDXDS-YOEHRIQHSA-N 333.432 1.159 10 10 EDCE Oc1cccc2c1[C@H](N[C@@H]1CCN(c3ccc4nncn4n3)C1)CC2 858490207 VNGHISWVJGCGGA-ZIAGYGMSSA-N 336.399 1.686 10 10 EDCE O=C1NCC[C@@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)[C@H]12 931704764 VVNDIZDFIZPPNN-WMZOPIPTSA-N 329.444 1.624 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1C[C@@H](O)C12CCC2 853474640 JYFROAFIWKTBFT-DLBZAZTESA-N 345.443 1.626 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@H](OC)[C@@H]2CCOC2)cc1 855021096 ZFXBKIDVTFHTPZ-RHSMWYFYSA-N 336.432 1.641 10 10 EDCE Cc1cc(CC(=O)OCCc2nnnn2C)c(C)n1-c1ccccc1 869558164 NZIKOZNJEMSLEP-UHFFFAOYSA-N 339.399 1.946 10 10 EDCE CC(=O)N1CCN(C(=O)NCCCSc2nccs2)[C@@H](C)C1 764360553 NSKURKQNYSYUCM-NSHDSACASA-N 342.490 1.888 10 10 EDCE COC(=O)[C@]1(O)CCN(Cc2cc(C)cc(Br)c2O)C1 895704819 YVRLZOYYCBMOSC-AWEZNQCLSA-N 344.205 1.573 10 10 EDCE COc1ccc(N2CCC(N[C@@H](C)c3nnc(O)n3C)CC2)cc1 895175584 KIYQMYYVFSABLY-LBPRGKRZSA-N 331.420 1.849 10 10 EDCE O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1cc2cc(O)c(O)cc2s1 895989343 ADNJRFXLTUIECM-RYUDHWBXSA-N 348.424 1.906 10 10 EDCE CC[C@H]1CO[C@H](CC)CN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1332075259 VRKGAPZEVUIQMV-UONOGXRCSA-N 332.400 1.650 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](CO)NCCC2CC2)cc1 1278203253 ZMLYKCZYOSIPSH-AWEZNQCLSA-N 333.392 1.329 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cn(-c3cccnc3)nn2)cc1F 1357191435 DVPUCASPRLPUGB-UHFFFAOYSA-N 340.362 1.797 10 10 EDCE CCOCC(=O)NCCN(CC)C(=O)c1ccc(N=NC(N)=O)cc1 1355963193 QUQOBIWMDJZHQZ-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE C[C@@H](O)CNC[C@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1270316152 SVUUODKVETZPIT-BXUZGUMPSA-N 333.392 1.424 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@@H](C[C@H]1COCCO1)C(F)(F)F 1350935426 IJEZQBHPMUVQJT-WDEREUQCSA-N 349.305 1.698 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)CC(F)(F)F)cc1C 1507179806 OXFFDIOJTOYITP-LBPRGKRZSA-N 334.338 1.523 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@@H](c2nncn2C2CC2)C1 1443538917 LYAQKVCEGGBDRO-CYBMUJFWSA-N 342.399 1.973 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCOC[C@@H]1C[C@H](O)c1ccco1 1445635978 ZZQFKNDWAHGQHA-BBRMVZONSA-N 347.367 1.584 10 10 EDCE COCC1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 1916847974 NYASKZCEWQHGCU-LBPRGKRZSA-N 327.178 1.517 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@@H](N2CCOCC2)CC1 1627322231 NQKDLGHFJABGIP-OAHLLOKOSA-N 334.416 1.354 10 10 EDCE CCOc1ccc(C(=O)NCC(=O)NCc2ccc(O)cc2O)cc1 1626833893 PFAKRVSJJLKOHU-UHFFFAOYSA-N 344.367 1.543 10 10 EDCE C[C@@H](O)CNC[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1566913848 VPVSDDBTGOUQRX-OLZOCXBDSA-N 347.419 1.672 10 10 EDCE COC(=O)c1ccn(CC(=O)N[C@@H](C)c2cc(OC)ccc2O)n1 1631543276 SLGBZNBSTWQFSL-JTQLQIEISA-N 333.344 1.261 10 10 EDCE CSCC(=O)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1493882379 AVJOMBMRUXFOEP-LBPRGKRZSA-N 349.416 1.543 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H](C)CC(N)=O)cc1C 1734336305 GPIZMVJCRPXKEL-KBPBESRZSA-N 335.448 1.452 10 10 EDCE COc1ccc(CN[C@H]2CN(C(=O)CN(C)C(C)=O)C[C@@H]2C)cc1C 1570331978 CNTNUPIPFVUCLL-YOEHRIQHSA-N 347.459 1.418 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)cc1Br 2136877647 JAUWKGOJWOUQNP-FZQKWOKYSA-N 330.222 1.824 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCc2cn[nH]c2)cc1C 1732974460 MXBFCNDEWKAFEO-CQSZACIVSA-N 330.432 1.954 10 10 EDCE CC[C@@H](CNC(=O)[C@H](C)OC)NC(=O)c1ccc(N=NC(N)=O)cc1 1759302531 KBDYZXWLSUMZHY-JQWIXIFHSA-N 349.391 1.509 10 10 EDCE CS(=O)(=O)CC1CCC(NC(=O)NCc2ccccc2O)CC1 1673052732 ZUCSQYJMFHWXSB-UHFFFAOYSA-N 340.445 1.795 10 10 EDCE CCOc1ccc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cn1 154413130 ULLPBKWCGKPQSN-UHFFFAOYSA-N 342.399 1.801 10 10 EDCE CC[C@H]1C(=O)NC(=O)CN1c1ccc([C@@H](C)N)c(Br)c1 233947136 CJTZNWGKOIHQJE-PELKAZGASA-N 340.221 1.710 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)[C@@H](O)c2ccccn2)N(C)C)cc1 891246750 CUUUWVRBBDGGNK-ROUUACIJSA-N 342.443 1.600 10 10 EDCE COCC1(C(=O)O)CN(Cc2cc(Br)cc(F)c2O)C1 1973654396 IXQONJHHQZSSDG-UHFFFAOYSA-N 348.168 1.827 10 10 EDCE C[C@@H](COCC(=O)N1CC[C@@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1985101480 SWIFBINEJURDLN-WDEREUQCSA-N 327.385 1.827 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010388713 GCWFIMIPOQZUKC-WDEREUQCSA-N 343.384 1.617 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010393396 RVHJCONHXLISLW-NWDGAFQWSA-N 340.428 1.743 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010404842 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C[C@@H](O)c1ccc(N2CC(OCC(N)=O)C2)cc1Br 2089139174 HWUQRETXTMOFLA-MRVPVSSYSA-N 329.194 1.193 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](COc1nnc(=N)[nH]n1)C(C)(C)C 2210655699 GSGZJGVWGZDRPE-SECBINFHSA-N 326.401 1.245 10 10 EDCE CC(C)(C)OC(=O)N1CCCC[C@H]1CCCOc1nnc(=N)[nH]n1 2213780377 FIYSFHHXTDZCKP-NSHDSACASA-N 338.412 1.628 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CN3CC[C@H]2C3)c1O 2227751948 STSODVFVBAQCFL-JOYOIKCWSA-N 327.222 1.957 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCN(OC)C2)c1O 2227749263 CIGNSVRLQDZHMQ-VIFPVBQESA-N 331.210 1.889 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCN=[N+]=[N-])C[C@H]2OCCC[C@H]21 2250762361 LUTRSIFQOQKSCS-UEKVPHQBSA-N 339.396 1.875 10 10 EDCE Cc1ccc2c(=O)c(C=CC=C3C(=O)NC(=S)NC3=O)coc2c1 2297463375 CIJBJDRWMVRCRO-UHFFFAOYSA-N 340.360 1.572 10 10 EDCE COC(=O)CC1=NN(c2ccccc2)C(=O)C1=C(C)NCCCO 2297471278 MGNPFJGDGGWTJB-UHFFFAOYSA-N 331.372 1.198 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2298024086 XRLISTYTHFYEHZ-USZNOCQGSA-N 339.396 1.874 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2COC[C@@H]2N)c(O)c1Br 2352620205 NUWCKDMSLNWFPI-UWVGGRQHSA-N 329.194 1.053 10 10 EDCE Cc1cc(C(=O)N2CCS(=O)(=O)[C@H](C)C2)c(C)n1-c1ccccn1 122434351 WHMXBENDXHAHEB-CYBMUJFWSA-N 347.440 1.748 10 10 EDCE N#Cc1ccc(Cn2cnc(NC(=O)c3cccc(O)c3O)n2)cc1 193128247 PANCONRLXXJDCP-UHFFFAOYSA-N 335.323 1.862 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)c(Br)c1 2133921068 UVZSAKSSNQZJLM-WTDIUWLJSA-N 328.206 1.404 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2OCCO[C@@H]2C)c(O)c1Br 2381131610 QBMKJVVWYCOADO-RNCFNFMXSA-N 344.205 1.883 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2NCCO[C@H]2C)c(O)c1Br 2381138827 YFCCXXVQSQVLEU-CABZTGNLSA-N 343.221 1.456 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 808484348 BOVUEFHCPDACGM-HZSPNIEDSA-N 349.383 1.054 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1 808527663 KHSQOLPPOMLBQT-AWEZNQCLSA-N 333.340 1.489 10 10 EDCE CC[C@@H](Cn1cncn1)NCc1ccc(N2CCC(O)CC2)c(F)c1 810212882 GDSHNIPVHDMOSU-HNNXBMFYSA-N 347.438 1.947 10 10 EDCE COCCN1CC[C@@H](NC[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 818220620 HQZMNAQWPCEADP-DLBZAZTESA-N 333.476 1.832 10 10 EDCE CN1CCC[C@](O)(CC(=O)N2CCOc3cc(N(C)C)ccc32)C1 900895289 NTOPMSSEXMPRDC-SFHVURJKSA-N 333.432 1.325 10 10 EDCE COC(=O)c1sccc1/C=C1\SC(N2CCOCC2)=NC1=O 901442396 IUBZCAGRGIRABS-NTMALXAHSA-N 338.410 1.837 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CC[C@H](Nc3ncccn3)C2)c1O 843416183 ZQWJAWMXBLUREB-LBPRGKRZSA-N 345.359 1.785 10 10 EDCE CC[C@@](C)(CO)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 847508054 UHCAHQJDBFSLDF-IBGZPJMESA-N 334.460 1.920 10 10 EDCE CN(C)[C@H](CCNC(=O)C(=O)Nc1ccc(N)cc1)C(F)(F)F 927866516 PBNSSDZKYSGMLN-LLVKDONJSA-N 332.326 1.206 10 10 EDCE CCNC(=O)CN(CC)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852455415 SQTIEZOLFVZHDS-CQSZACIVSA-N 348.447 1.442 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCn3ccccc3=O)C2)cc1 855232112 NDQDSKBGZNXPOC-OAHLLOKOSA-N 341.411 1.642 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCNC[C@@H]3C)C2)cc1 851664419 ZDUGFKHKDYZZLJ-ZQIUZPCESA-N 332.448 1.571 10 10 EDCE CCCC(=O)NCC(=O)NCc1ccc(N2CCC(O)CC2)cc1 856210768 PSISXHFLVDYFCP-UHFFFAOYSA-N 333.432 1.180 10 10 EDCE COc1ccc(N(C)C[C@@H](O)COC[C@H]2CCCO2)c(OC)c1 752126480 SUSXLYNNISQBQL-UKRRQHHQSA-N 325.405 1.697 10 10 EDCE COc1cccc(O)c1CNC[C@@]1(CO)COCC2(CCC2)N1C 858223068 WTHZSLGESONLOQ-GOSISDBHSA-N 336.432 1.106 10 10 EDCE COC(=O)N[C@H](C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)C(C)C 855230259 FERLFWBBTQIFNZ-BBRMVZONSA-N 349.431 1.771 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@](O)(C3CC3)C2)cc1 852502466 HPNPKDWNRMIWBR-IBGZPJMESA-N 331.460 1.606 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCO[C@H]([C@H](C)O)C3)C2)cc1 854296625 FJOBQHPVOMKSOA-ZQIUZPCESA-N 349.431 1.065 10 10 EDCE COC(=O)C1(CS(=O)(=O)N2Cc3cccc(O)c3C2)CCCC1 867691200 RMPGUWWSNHCFLX-UHFFFAOYSA-N 339.413 1.771 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(S(N)(=O)=O)cn1 769740840 IAHGXFGBPUYKCZ-UHFFFAOYSA-N 348.428 1.033 10 10 EDCE CNC(=O)CC1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761908812 VGNOWPPYTPLLFA-UHFFFAOYSA-N 348.359 1.278 10 10 EDCE CNCc1ccc(N2CCO[C@H]3COC[C@H]32)c(Br)c1 1877661009 XNEKUFJEWVQBKP-KGLIPLIRSA-N 327.222 1.773 10 10 EDCE CCn1nccc1CN(CCO)Cc1cc(F)cc(C(C)=O)c1O 796474231 SCUVWOLIUDQHLD-UHFFFAOYSA-N 335.379 1.945 10 10 EDCE CC[C@@H](CNC(=O)C[C@H]1CCNC1=O)NCc1ccc(OC)c(C)c1 1318526939 BBKDINDSWXEGEP-CVEARBPZSA-N 347.459 1.514 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2CCNC2=O)cc1C 1317403153 RRGZDPZSZDJBRD-HIFRSBDPSA-N 333.432 1.124 10 10 EDCE CN1CCN(c2ccc(CNC(=O)N3CC[C@@H](C(=O)O)C3)cc2)CC1 1353867024 XQLIIHCLXQSUHJ-OAHLLOKOSA-N 346.431 1.055 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H](C)n2cncn2)cc1C 1270386318 RRHNLOQBJRZMKD-ZFWWWQNUSA-N 345.447 1.698 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)c2cnn(C)c2N)cc1C 1503176067 VDNJWKZVVSILMC-ZDUSSCGKSA-N 345.447 1.618 10 10 EDCE O=C(Nc1c(-c2ccccn2)nc2ccccn12)c1nnc(O)nc1O 1450715821 PTLOKKWTPGJCFX-UHFFFAOYSA-N 349.310 1.245 10 10 EDCE C[C@@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)c1nncn1C 1296585483 OWFNOFABDRZVLC-QMMMGPOBSA-N 332.385 1.975 10 10 EDCE COc1ccc(-n2cc(C(=O)NCc3cc(O)ccc3O)nn2)cc1 1455355129 PYCHPXMAKFPFQT-UHFFFAOYSA-N 340.339 1.617 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccc(Cn2ccnn2)o1 1465981929 SXLTYRPZYSEEKI-UHFFFAOYSA-N 328.328 1.303 10 10 EDCE COCCC(=O)N1CCO[C@H](CNCc2ccc(OC)c(C)c2)C1 1700144070 PRFGUSGHOBAOFK-MRXNPFEDSA-N 336.432 1.357 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCOC[C@H]2[C@H]2CCCO2)cc1 1556550164 LGEPJFVNSIXBLY-UONOGXRCSA-N 332.360 1.869 10 10 EDCE CCOC(=O)[C@@H](c1cccnc1)N(C)C(=O)c1cccc(O)c1O 1651757867 ASAWXPNKELMUHD-CQSZACIVSA-N 330.340 1.869 10 10 EDCE CON(CCNC(=O)OC(C)(C)C)C(=O)Cc1ccc(O)c(O)c1 1653839884 OHHOTZVYVPUGQA-UHFFFAOYSA-N 340.376 1.555 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)Cc2ncc[nH]2)cc1C 1674746405 BLZOGDZPCVYTQI-KBPBESRZSA-N 330.432 1.952 10 10 EDCE COc1ccc(-n2nnnc2CN(C)[C@H](C)CNC(=O)C(C)C)cc1 1674896913 ZMFANEQDAKPXQQ-CYBMUJFWSA-N 346.435 1.263 10 10 EDCE CCC1(C(=O)NC[C@H](C)NC(=O)c2cc(OC)nc(OC)c2)CC1 1688179262 JVHQRAUMWRJREC-NSHDSACASA-N 335.404 1.524 10 10 EDCE COC(=O)[C@@H](N)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951498415 RXTBSFQAMDBOPF-GWCFXTLKSA-N 340.376 1.034 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)NCCCCN=[N+]=[N-] 1985093884 GXDRKRYLOHHIMU-SNVBAGLBSA-N 331.373 1.664 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COCC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985100426 GWOBUTDCLOMAJQ-MNOVXSKESA-N 325.369 1.437 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985101373 RGFLLUVIFYJHMH-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC(N=[N+]=[N-])CC1 1986368252 DNLQSXIIBVGEIO-LLVKDONJSA-N 327.385 1.563 10 10 EDCE C[C@@H]1COC[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)N1C(=O)OC(C)(C)C 2010390473 DTEUJVBKEJRUPM-UTUOFQBUSA-N 339.396 1.922 10 10 EDCE Cn1ncc(I)c1CNCc1ccc(N)cc1 2015739331 UMNXIFGLXVJICE-UHFFFAOYSA-N 342.184 1.897 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(O)C[C@H](C(=O)Nc2ccc(N)cc2)C1 2022912024 IKRVALSZVHHPLK-QQVUYCAZSA-N 335.404 1.873 10 10 EDCE Cc1cccc(CNC(=O)[C@@H](O)[C@H](C)NC(=O)OC(C)(C)C)c1O 2024813376 YFCFHCMLGBSXRP-FZMZJTMJSA-N 338.404 1.591 10 10 EDCE C[C@@H](OCc1ccccc1)[C@H](NC(=O)c1cc(O)nc(O)c1)C(=O)O 705997336 INVJWHNNNVBVJD-BMIGLBTASA-N 346.339 1.281 10 10 EDCE CC(C)(C)OC(=O)N1CC(CCO)(NCc2cc(F)ccc2O)C1 398008232 AEFYCHPOHBZSPZ-UHFFFAOYSA-N 340.395 1.993 10 10 EDCE CC1(C)CN(C2CN(c3ccc(CN)cc3Br)C2)C1=O 2182227783 UBQJGXHLHGZPNV-UHFFFAOYSA-N 338.249 1.965 10 10 EDCE NCc1cc(F)c(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2190458158 LVWQLBSDVLKOBE-DVXMNORISA-N 345.212 1.510 10 10 EDCE NC(=O)c1coc(CNCc2cc(Br)ccc2O)n1 2104343511 YQKJTQJTWROZKE-UHFFFAOYSA-N 326.150 1.531 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](CO)C[C@H]2CO)cc1Br 2089863706 MKNWCVXJVTXWFA-UMNHJUIQSA-N 329.238 1.648 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@H](NC(N)=O)C(C)C)CC2)cc1 102484503 KZCKCKCNOKZKPA-MRXNPFEDSA-N 348.447 1.473 10 10 EDCE CC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 54035723 YXLLSGZENJVQPN-KRWDZBQOSA-N 347.484 1.867 10 10 EDCE COCCN1CCN(C(=O)NCc2ccc(N(C)C)cc2)C[C@H]1C 117398088 PXDITHPAOAFDCS-OAHLLOKOSA-N 334.464 1.615 10 10 EDCE CNC(=O)[C@H](NC(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 178395117 PWNADLAJIFVNDL-MRXNPFEDSA-N 348.447 1.297 10 10 EDCE COc1ccc(N2CCN(CCCNC3=NCCCN3)CC2)cc1 303256309 HXZAGJSQQKSWKI-UHFFFAOYSA-N 331.464 1.146 10 10 EDCE O=C(O)CN(Cc1c(O)cccc1Cl)[C@H]1CCS(=O)(=O)C1 128811004 XMYIFLRLMVJGCH-VIFPVBQESA-N 333.793 1.119 10 10 EDCE O=C1/C(=C\c2cc([N+](=O)[O-])ccc2O)SC(=S)N1CCO 210387273 FBAZUZCGGQAOOC-UXBLZVDNSA-N 326.355 1.494 10 10 EDCE O=C(O)Cc1ccc(S(=O)(=O)NCc2ccccc2O)s1 228403228 NIIDHOWJQFGRLJ-UHFFFAOYSA-N 327.383 1.559 10 10 EDCE Cc1nnc(CN(C)CC(=O)N(C)Cc2ccc(N(C)C)cc2)n1C 132114263 LGRQOEYBTKKJEP-UHFFFAOYSA-N 344.463 1.280 10 10 EDCE Nc1nccc([C@H]2CCCN(Cc3cc4c(cc3O)OCO4)C2)n1 368045811 WTHLRDULMHTTAF-NSHDSACASA-N 328.372 1.873 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2COC[C@H]2N)c(O)c1Br 2380790993 VXIOPQBKCPYASB-GHMZBOCLSA-N 343.221 1.395 10 10 EDCE CC(=O)C(=O)COC(=O)COc1cccc(NC(=O)c2ccco2)c1 808501508 KTEIUOYIAZWGDB-UHFFFAOYSA-N 345.307 1.612 10 10 EDCE CC(=O)C(=O)COC(=O)c1cnc(-c2ccc3c(c2)OCO3)s1 808514495 GGSAKXKDPPIRTO-UHFFFAOYSA-N 333.321 1.854 10 10 EDCE CN1CCc2cc([C@H](NN)c3ncn(C)c3Br)ccc21 2163140034 FFZRLEPCQOLVGB-LBPRGKRZSA-N 336.237 1.728 10 10 EDCE COCCN1CC[C@@H](NC[C@H]2CCN(c3ccc(OC)cc3)C2)C1 818220621 HQZMNAQWPCEADP-IAGOWNOFSA-N 333.476 1.832 10 10 EDCE C[C@@H]1CCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)[C@H]1CO 588553439 OUILPAKJLPNHIP-DYKRAQSHSA-N 330.428 1.766 10 10 EDCE C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@H](c2ccnn2C)C1=O 843308967 VTJLKWAPRIIHHK-XHDPSFHLSA-N 327.388 1.840 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CNCCC1(F)F 842006139 VNHPPXOCDGOJCC-CQSZACIVSA-N 326.391 1.891 10 10 EDCE CCOc1ccc(O)c(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)c1 843425699 FJVHUQCWJPKDBV-MRXNPFEDSA-N 341.429 1.180 10 10 EDCE COC(=O)C[C@H](CNC(=O)NCc1cc(OC)ccc1O)C1CC1 853736759 NIEPALYDEATTAW-GFCCVEGCSA-N 336.388 1.789 10 10 EDCE OCCO[C@@]1(CNCc2ccc(N3CCCCC3)cc2)CCOC1 850357888 XFXQGJCWMDKICV-LJQANCHMSA-N 334.460 1.935 10 10 EDCE Cc1cc(O)c(CN[C@H]2CCN(c3ccc4nncn4n3)C2)cc1C 858243894 QBFOZHFROYYFFR-HNNXBMFYSA-N 338.415 1.815 10 10 EDCE CCN(CCCNC(=O)N[C@@H](C)c1ccccc1O)S(C)(=O)=O 868124351 CNAPHFLIECOHMF-LBPRGKRZSA-N 343.449 1.424 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@@H]3[C@H]4CC[C@@H](NC4)[C@H]3C2)cc1 861549413 HYWKEKXLGYQNLW-XOYOTBSWSA-N 328.460 1.892 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)c1ccc2c(c1)COB2O 863869739 RXWNXBGPGHCXQH-UHFFFAOYSA-N 336.200 1.435 10 10 EDCE CN(C)c1ccc(CNCc2nc(O)c3c(n2)CCOC3)cc1F 865867811 RSHWHSMAKCUIAK-UHFFFAOYSA-N 332.379 1.750 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNCCc2c(C)nn(C)c2C)c1O 774962658 DFHHVNKNWSLCFC-UHFFFAOYSA-N 334.376 1.992 10 10 EDCE CN(CC(C)(C)S(C)(=O)=O)C(=O)/C=C\c1ccc(O)c(O)c1 779539538 GYPUKLXNBQJVCL-VURMDHGXSA-N 327.402 1.393 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)COC(F)F)CC2)cc1 795773647 AOQDSHQBOJCFHD-UHFFFAOYSA-N 343.374 1.173 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cncc2ncn(C)c12 1154027633 XOSVWAMUIDWMCH-SNVBAGLBSA-N 326.356 1.741 10 10 EDCE COC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)c1cccc(O)c1O 1155481803 MWOUJNAXLCFLSM-ZDUSSCGKSA-N 333.315 1.751 10 10 EDCE COc1ccc([C@H](CO)N(C)C(=O)Cc2ccc(O)c(O)c2)cc1 1152726833 NUYWYLSATNEVQC-HNNXBMFYSA-N 331.368 1.841 10 10 EDCE C[C@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1322198278 VIIOOMREIHXTAO-YOEHRIQHSA-N 345.443 1.444 10 10 EDCE COC(=O)[C@H]1C[C@@H](N(C)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1330664136 CYQJHMLVHJHBRG-BETUJISGSA-N 337.395 1.985 10 10 EDCE CC(C)[C@H](NC(N)=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1180180039 UCPCJFXVIMPXKF-HOTGVXAUSA-N 349.479 1.164 10 10 EDCE COC1(CCN)CN(Cc2cc(Br)cc(F)c2O)C1 1916729697 QLWSONJEYJGLQN-UHFFFAOYSA-N 333.201 1.843 10 10 EDCE CN(C(=O)Cn1cccc(Br)c1=O)c1ccc(N)cc1 97909182 FDXSUTCEVZFDHF-UHFFFAOYSA-N 336.189 1.856 10 10 EDCE CCN(CCO)[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1264080828 XEYKRKGBSAMEMO-OAHLLOKOSA-N 347.419 1.768 10 10 EDCE COc1ccc(-n2nnnc2CN2CC(NC(=O)CC(C)C)C2)cc1 1268247519 CAUPLXLAZPKDMQ-UHFFFAOYSA-N 344.419 1.017 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3C[C@@H]4C[C@@H]4C3)ccc21 1349022256 BIBZAYDHIALYKT-MUJYYYPQSA-N 327.428 1.600 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)Cc2cncn2C)cc1C 1700799628 MVVYHFUWBHMKLH-OAHLLOKOSA-N 344.459 1.916 10 10 EDCE Cc1cc2[nH]nc(NC(=O)/C=C\c3ccc(O)c(O)c3)c2c(=O)n1C 1627182911 LCNCQJADXFDNLA-XQRVVYSFSA-N 340.339 1.633 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cc3n(n2)CCO3)cc1C 1480476796 KAASCZRBGNZHGM-CYBMUJFWSA-N 344.415 1.501 10 10 EDCE Cc1nn(CCC(=O)NCc2c(O)cccc2F)c(C)c1[N+](=O)[O-] 1638862563 BIHKKRIKGMGFRE-UHFFFAOYSA-N 336.323 1.959 10 10 EDCE C/C=C(\C)C(=O)NC[C@@H](CC)NC(=O)c1cc(OC)nc(OC)c1 1498994928 HPVGJBQMTUCNHY-ASJRZHAZSA-N 335.404 1.690 10 10 EDCE CN1CCC[C@H]1c1cc(C(=O)NCCc2ccc(O)c(O)c2)n[nH]1 1566370227 RGDKAFWLVXURHR-AWEZNQCLSA-N 330.388 1.560 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H]1CCC2(CCOCC2)[C@H]1O 1634026856 HFFBIXFJHVVKNJ-GUYCJALGSA-N 335.400 1.324 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2nc[nH]n2)C2CC2)cc1C 1731410109 JMAVLJKJBVMFFD-AWEZNQCLSA-N 329.404 1.420 10 10 EDCE C[S@](=O)C[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccccc1 1586034771 HQBQIDPDFSFSEL-PSLXWICFSA-N 333.409 1.876 10 10 EDCE O=C(Cc1csc(-c2nc[nH]n2)n1)N1Cc2cccc(O)c2C1 1650675858 YSCYKWOIZYJFHV-UHFFFAOYSA-N 327.369 1.719 10 10 EDCE O=C1C[C@H](Oc2ccc(NC(=O)c3c(F)ccc(O)c3O)cc2)N1 1654568348 MJJQQICIJMRRRU-ZDUSSCGKSA-N 332.287 1.714 10 10 EDCE CCOC(=O)c1c(NC(=O)[C@@H](N)CC(=O)O)sc2c1CCC2 316349609 ONILRWXAKGYEPV-QMMMGPOBSA-N 326.374 1.154 10 10 EDCE CCN[C@@H](C)c1ccc(N2CC(O)(C(N)=O)C2)cc1Br 1915248317 DWULNYBUNQLWRZ-VIFPVBQESA-N 342.237 1.156 10 10 EDCE COc1ccc(CNCC2(O)CN(C(=O)OC(C)(C)C)C2)c(O)c1 1918697310 PCPVNMLUBIHZLT-UHFFFAOYSA-N 338.404 1.472 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@H](O)[C@H](O)C2)cc1Br 233640586 WMFVVRTXELOVAW-FZQKWOKYSA-N 329.238 1.661 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C[C@@H](O)C(=O)O 1951546582 UVTILTCOGOWCNB-ZWNOBZJWSA-N 341.360 1.369 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2NC(=O)c1ccc(O)c(O)c1 2006278918 SZZOABKVJFPWDO-SUNKGSAMSA-N 334.372 1.835 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985095344 CKZCOZMVHVNFPD-HBNTYKKESA-N 325.369 1.580 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985100627 IEHNHYAWPMRTHO-HBNTYKKESA-N 327.385 1.562 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N(C)Cc1ccccc1O 2010263167 UWVVFGWAPMNWGY-RISCZKNCSA-N 338.404 1.625 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010389041 KPDOXLBZDDJRET-GHMZBOCLSA-N 343.384 1.759 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CCC(N=[N+]=[N-])CC2)C1 2010402218 NTRSVMDGQWBIID-GFCCVEGCSA-N 339.396 1.924 10 10 EDCE O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cc(O)c(O)c(O)c1 2015074191 DJWOSEPRCRJEEE-CQSZACIVSA-N 328.368 1.808 10 10 EDCE NC(=O)N1CC[C@@H](NCc2cc(Br)cc(F)c2O)C1 715719927 HFAIHZTVQRXWNP-SECBINFHSA-N 332.173 1.536 10 10 EDCE Cc1nc(S(=O)(=O)Nc2ccc(N)cc2)c(Br)n1C 388337859 VRWJAPHEEBOBIU-UHFFFAOYSA-N 345.222 1.874 10 10 EDCE CC[C@H](N[C@@H]1C[C@H](O)[C@@H](O)[C@H]1O)c1cc(Br)ccc1O 2165120649 HTTSBHFXIHWLLO-ONCHEJIZSA-N 346.221 1.050 10 10 EDCE OC[C@]1(NCc2ccc(Br)cc2O)C[C@H](O)C12CCC2 2193970193 NHDRUSIZDOLBPL-DZGCQCFKSA-N 342.233 1.910 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccc(N)cc2)[C@@H](CO)C1 2044627792 WZZBQMHJKIPRGD-OAHLLOKOSA-N 349.431 1.252 10 10 EDCE CO[C@@H]1CN(Cc2cc(Cl)cc(Br)c2O)C[C@@H]1N 2058768545 QSJHZMACSVWYKT-WDEREUQCSA-N 335.629 1.966 10 10 EDCE COC(=O)NC[C@@H](C)NCc1c(Br)ccc(OC)c1O 2286118853 CFYWFCJZXHBBFY-MRVPVSSYSA-N 347.209 1.997 10 10 EDCE O=C(NCC1CC1)[C@H]1CCCN(C(=O)C=Cc2ccc(O)c(O)c2)C1 2307986411 VSGZEXOPLTXNQO-HNNXBMFYSA-N 344.411 1.876 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCC[C@H]1CC(N)=O 103286441 HYCDQZOCUOARLP-KRWDZBQOSA-N 346.475 1.441 10 10 EDCE CCCOc1ccc(/C=C2\C(=O)NC(=O)N(C)C2=O)cc1OCC 59861507 CJBAAJSYHOXVPS-FMIVXFBMSA-N 332.356 1.966 10 10 EDCE COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H]3C[C@@H]3C)CC2)cc1 1345185547 GTRQUQCYWHNQQB-KBPBESRZSA-N 345.443 1.552 10 10 EDCE Cc1nc(CN2CCCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)no1 171593328 HKCOBWLPYAUEJM-UHFFFAOYSA-N 347.375 1.700 10 10 EDCE O=C(C[C@H]1CCNC1)NCc1ccc(N2CCC(CO)CC2)cc1 130487550 YLKFCNCGDRPILE-QGZVFWFLSA-N 331.460 1.511 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H]3CCCOC3)CC2)cc1F 84890287 DSWWOXOENWUVMO-CYBMUJFWSA-N 337.395 1.845 10 10 EDCE CC(=O)N[C@H]1CCN(c2ccc(CN)c(Br)c2F)C1 231840655 LPFHPXLTDPYQQC-JTQLQIEISA-N 330.201 1.762 10 10 EDCE CCn1ncc(/C=C2\SC(N3CCN4CCC[C@H]4C3)=NC2=O)c1C 254837992 BALSVSAAXAKYOL-BUYRESAOSA-N 345.472 1.962 10 10 EDCE O=C(c1cccc(O)c1O)N1CCOC[C@@H]1C[C@H](O)c1ccco1 279867914 QKJJFSGYLNDGAJ-FZMZJTMJSA-N 333.340 1.656 10 10 EDCE Cc1ccc(CNC(=O)c2cc(CN)on2)c(O)c1Br 2380739557 LLMBPHXDXJNDPO-UHFFFAOYSA-N 340.177 1.840 10 10 EDCE COc1cccc(O)c1CN[C@@H]1CCC[C@@H]1CNS(C)(=O)=O 800309925 QAQDKOGBFQIKRZ-DGCLKSJQSA-N 328.434 1.208 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3ccoc3)C2)cc1 827044404 MLTLOQVIKRSVQQ-CQSZACIVSA-N 343.383 1.300 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@]3(CCOC3)C2)cc1 832344339 XWPRNNYRKBRJJF-IBGZPJMESA-N 331.460 1.871 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@]3(O)CCCN(C)C3)C2)cc1 912293224 WHBQHKUYLLLMEY-HNAYVOBHSA-N 347.459 1.237 10 10 EDCE COC(=O)/C(C)=C\CNC(=O)NCc1ccc2c(c1)CCCN2C 915390764 PNJOBVSCMKQQBN-JYRVWZFOSA-N 331.416 1.988 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)c(Br)c1 1893326912 YQXUXHJLRJIKDM-QCZZGDTMSA-N 329.238 1.791 10 10 EDCE NCc1cccc2c1N(S(=O)(=O)c1cccc3nonc13)CCC2 858622713 KCASHUNWQNEAGW-UHFFFAOYSA-N 344.396 1.823 10 10 EDCE Cc1cc(Br)cc(CN2CCOC3(CNC3)C2)c1O 853249359 QBWYVVUBNKWJLA-UHFFFAOYSA-N 327.222 1.637 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)COCc3nccn3C)C2)cc1 855223985 DGUMIDDJZZEEPZ-AWEZNQCLSA-N 344.415 1.340 10 10 EDCE C[C@@H]1[C@H](NC(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCN1C 924009661 YFPOLBQASUQTCP-CRAIPNDOSA-N 345.491 1.330 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCC3CC(O)C3)C2)cc1 854298588 GFHSZMCAZWVREZ-BBBYJDLNSA-N 333.432 1.734 10 10 EDCE CO[C@@H]1C[C@H](C(=O)NCCCN=[N+]=[N-])N(C(=O)OC(C)(C)C)C1 1895876666 XGFYMFKYEOYDLK-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H](C(=O)NCCCN=[N+]=[N-])C1 1895876226 SFICEFYOKBPPJX-QWRGUYRKSA-N 327.385 1.421 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)N2C[C@H](O)C[C@H]2C(N)=O)c1C 862682784 HHMTUURYBNESFW-PBHICJAKSA-N 341.411 1.463 10 10 EDCE CCN(C)c1ccc(CN2C[C@@H](C)[C@H](CS(N)(=O)=O)C2)cc1 933701126 XSYKDJQULUBMDQ-HIFRSBDPSA-N 325.478 1.499 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)N2CCNC(C)(C)C2)N(C)C)cc1 1336271315 ACLVWGJVBVJDFQ-QGZVFWFLSA-N 347.507 1.749 10 10 EDCE C[C@@H](NC[C@@]12COCCN1C(=O)OC2)c1cc(Cl)ccc1O 866520604 HADXDZJTTNBHTI-BMIGLBTASA-N 326.780 1.917 10 10 EDCE CCN(CC)c1ccc(CNc2ccc(C(=O)NCCO)nn2)cc1 768517399 VSPCTLSXCKPCMG-UHFFFAOYSA-N 343.431 1.657 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@@H]1C(C)C 1116669152 IDHSPIXXUVSCBX-MCIONIFRSA-N 335.400 1.980 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H](N3CCNC3=O)C2)cc1 1136505869 WJESBHPGMDAADN-CYBMUJFWSA-N 344.375 1.479 10 10 EDCE Cc1cc(N(C)C)ccc1CNCC1(S(=O)(=O)N(C)C)CC1 895810180 HXTGWSRVPJUYDT-UHFFFAOYSA-N 325.478 1.575 10 10 EDCE CN1CCC(n2cc(NC(=O)Cc3ccc(O)c(O)c3)cn2)CC1 1587274046 VSCHQWUEPQSKDQ-UHFFFAOYSA-N 330.388 1.742 10 10 EDCE O=C(C1=CCS(=O)(=O)C1)N(Cc1ccco1)Cc1ccccc1O 1137343128 BBZKWNKLUBKODR-UHFFFAOYSA-N 347.392 1.869 10 10 EDCE COc1cccc(CNC(=O)c2cn(-c3cccnc3)nn2)c1O 1150544017 XDYFGOKTYAZJLM-UHFFFAOYSA-N 325.328 1.307 10 10 EDCE COc1cccc(CNC(=O)c2coc3c2C(=O)NCCC3)c1O 1150544147 YUDHFTYKLRHOTP-UHFFFAOYSA-N 330.340 1.600 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCC[C@@H]1N1CCC(O)CC1 1302835091 NYNIRVWJWXGMKV-CABCVRRESA-N 334.416 1.134 10 10 EDCE O=C(CCc1nc(O)c2ccccc2n1)NCc1cccc(O)c1O 1176564793 FKCQIVLHADRVPU-UHFFFAOYSA-N 339.351 1.996 10 10 EDCE CO[C@H]1COC[C@@H]1N(C)c1ccc(CN)c(Br)c1F 2120773113 CSYMUNRTQUUGDO-QWRGUYRKSA-N 333.201 1.897 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@H]2[C@H]3CC[C@]4(COC(=O)[C@H]24)O3)cc1 1261789148 VKUIIURFUIUSBE-ZXFNITATSA-N 330.384 1.089 10 10 EDCE CN1CCN(c2ccc(CN3CCCn4nncc4C3)cc2F)CC1 1353603950 CPZOPYWNCQMQTQ-UHFFFAOYSA-N 344.438 1.575 10 10 EDCE C[C@H](NC(=O)C(=O)NCc1cncc(O)c1)c1ccc(N(C)C)cc1 1354674524 IOMVFKSQVPHZRM-LBPRGKRZSA-N 342.399 1.347 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H]2CNC(=O)C(F)F)cc1 1285830129 ZYXJLOPAALWDDC-JTQLQIEISA-N 339.302 1.445 10 10 EDCE COc1ccc(CNC(=O)c2cc(C)n(NC(N)=O)c2C)c(O)c1 1448373877 OSCOUSMTCRTCGS-UHFFFAOYSA-N 332.360 1.371 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2c(C)ncnc2O)cc1C 1713330561 BOQFMJLVXXJFAR-LBPRGKRZSA-N 344.415 1.716 10 10 EDCE N=C(O)OC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(O)c(O)c1 1639193675 AWWMBZMWEYXJDK-AWEZNQCLSA-N 344.367 1.877 10 10 EDCE COCCC(=O)NC[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1734737630 PYIHSINCQMLHSM-LLVKDONJSA-N 349.391 1.462 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@H]2CCC(=O)N2C)cc1C 1668995368 LUEVNROBTGXCFP-YIEVGGLXSA-N 345.443 1.386 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2COCCO2)cc1C 1698819333 XBXOPRSRERJRHV-WMLDXEAASA-N 336.432 1.356 10 10 EDCE COc1ccc(N2CCC(NC(=O)NC[C@H](O)C(C)C)CC2)cc1 154529142 TZQMUACNLNKXSZ-KRWDZBQOSA-N 335.448 1.980 10 10 EDCE NC(=O)CC[C@H](N)C(=O)Nc1ccc(Oc2ccc(N)cc2)cc1 1866105416 IXBIEPDURKJABN-HNNXBMFYSA-N 328.372 1.592 10 10 EDCE CNC(=O)[C@@H]1CCCN(c2ccc(CN)cc2Br)C1 232278220 LKCLRGMIQQUBRW-LLVKDONJSA-N 326.238 1.870 10 10 EDCE C[C@@H](CNS(=O)(=O)Cc1ccc(N)cc1)CC1(C)OCCO1 1876529903 USMVMCPWGSDQQG-GFCCVEGCSA-N 328.434 1.477 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)CC[C@@H](C)O)c(Br)cc21 135566008 ALLYNTHIBOEYTG-OQPBUACISA-N 342.237 1.869 10 10 EDCE CN(C)C1(C)CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2160657681 HBVPQAVXXOVADD-LBPRGKRZSA-N 339.237 1.541 10 10 EDCE C[C@H]1C[C@@H](N)CCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2054048999 XWRZURQWCXUODF-RDJZCZTQSA-N 329.444 1.875 10 10 EDCE CNCc1ccc(N2CC[C@H](CC(N)=O)C2)c(Br)c1 690762698 QGKWPDGGHDLLCF-LLVKDONJSA-N 326.238 1.870 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCC[C@@H](C(=O)N(C)C)C3)c2n1 2062317026 ASKJEZYWYOGCQQ-VXGBXAGGSA-N 345.403 1.120 10 10 EDCE COC(=O)Cc1cc(O)n2nc(-c3ccccc3)c(C(=O)O)c2n1 2080933689 RNUYYVUPLFOZEF-UHFFFAOYSA-N 327.296 1.516 10 10 EDCE CO[C@@H]1CN(c2ccc(CO)cc2Br)[C@@H]2COC[C@H]12 2102132794 BWORXZHNPBZSCR-ZLKJLUDKSA-N 328.206 1.791 10 10 EDCE NCc1ccc(N2C[C@@H](CO)[C@@H](CCO)C2)cc1Br 2093495142 FLZIMPCJTYRYBK-RYUDHWBXSA-N 329.238 1.335 10 10 EDCE N[C@@H]1CN(Cc2ccc(Br)cc2O)[C@@]2(CCOC2)C1 2098287996 SSXJQAKAFKRMIY-JSGCOSHPSA-N 327.222 1.847 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1COc1nnc(=N)[nH]n1 2213779144 PRDQEFPPTPLXIT-WDEREUQCSA-N 338.412 1.389 10 10 EDCE COc1ccc(Br)c(CN2CCOCC23CNC3)c1O 2236052804 MAHVDSVGUPZWBA-UHFFFAOYSA-N 343.221 1.338 10 10 EDCE O=C1NC(=S)N(c2ccccc2)C(=O)C1=CNN1CCCCC1 2296124632 MJDHOWJDJCLESZ-UHFFFAOYSA-N 330.413 1.309 10 10 EDCE CSc1ncc(CN[C@@H]2CS(=O)(=O)C[C@@H]2OC(C)C)s1 2284498719 JXSOACTYPDHXJL-MNOVXSKESA-N 336.504 1.545 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC[C@H](O)[C@H]3C)c(Br)cc21 2288932352 UJGNXBZJQBXORL-HYJLZEBJSA-N 340.221 1.621 10 10 EDCE CN(Cc1ccccc1O)C(=O)C=Cc1ccc(OCC(N)=O)cc1 2301491088 HWKKOIDUPVINMH-UHFFFAOYSA-N 340.379 1.928 10 10 EDCE CO[C@@H](CNC(=O)Cc1ccc(N)cc1)CNC(=O)OC(C)(C)C 2301660212 OKQIOUISLJJVRD-AWEZNQCLSA-N 337.420 1.467 10 10 EDCE C[C@H]1CN(C(=O)C=Cc2ccc(O)c(O)c2)CCN1CC(C)(C)O 2310590551 LMMIIMIZZZKPIT-ZDUSSCGKSA-N 334.416 1.415 10 10 EDCE CC(C)N(CC(=O)O)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2311972707 QGEXKBURUPIZDX-UHFFFAOYSA-N 332.400 1.858 10 10 EDCE O=C(NC[C@H]1N[C@H](CO)Cc2cccc(O)c21)OCc1ccccc1 309652734 AQLMNCJLAAWHDE-JKSUJKDBSA-N 342.395 1.866 10 10 EDCE COCCNc1nccc(N2CCN(c3ccc(OC)cc3)CC2)n1 243317095 LLCDYZBEUXAJQJ-UHFFFAOYSA-N 343.431 1.870 10 10 EDCE CC(C)CN1CCO[C@H](CNC(=O)CN(C)Cc2ccccc2O)C1 264627210 TXEBIZBDRLKZNX-QGZVFWFLSA-N 349.475 1.297 10 10 EDCE O=C(NCCCN1CCCC1=O)NCc1ccc(N2CC=CC2)cc1 265882431 CDEVERROJOVGDB-UHFFFAOYSA-N 342.443 1.875 10 10 EDCE Cc1ccc(CN2C[C@H](CN)N3CC[C@H]2C3)c(O)c1Br 2380647261 FYSXSUXNNVOJMX-STQMWFEESA-N 340.265 1.680 10 10 EDCE Cc1ccc(CNCc2cn(CCO)nn2)c(O)c1Br 2381135979 YSLYHXQGYWZHIW-UHFFFAOYSA-N 341.209 1.337 10 10 EDCE CC(=O)C(=O)CSc1nc(O)c2cnn(-c3ccccc3)c2n1 808010527 BORHUMVYVVSYQY-UHFFFAOYSA-N 328.353 1.771 10 10 EDCE CCN(CCCNCc1cc(Cl)c(F)cc1O)S(C)(=O)=O 294205554 KZPCLKBTOZWBFB-UHFFFAOYSA-N 338.832 1.946 10 10 EDCE O=C(NCCCSc1nccs1)C1C[C@H]2CNC[C@@H](C1)C2=O 829527724 CUWCQCRLVLSQNK-YOGCLGLASA-N 339.486 1.556 10 10 EDCE CCn1nnc(C)c1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 822786138 KTSADCKTVRAJNJ-CYBMUJFWSA-N 343.431 1.934 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1cc([C@@H]2CCCNC2)nn1 900600772 KJBHJCLMRQDGAM-MRXNPFEDSA-N 327.432 1.630 10 10 EDCE O=C(NC[C@@]1(O)[C@H]2[C@@H]3C[C@@H]4[C@@H]5C[C@@H]([C@@H]2[C@@H]53)[C@@H]41)c1c(F)ccc(O)c1O 830689806 BTIJOYILVISPOP-XTYTYPHCSA-N 345.370 1.476 10 10 EDCE CO[C@]1(CN[C@H]2C[C@H](C)c3c(F)ccc(O)c32)CCS(=O)(=O)C1 903367129 XSXFKDXUOUXJEK-PKWAYOAASA-N 343.420 1.873 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N(C)Cc1cc[nH]n1 839270027 AVKVIHHKJGPVEP-UHFFFAOYSA-N 330.388 1.513 10 10 EDCE COc1ccc(N2CCCN(C(=O)NCC[C@H]3CCNC3)CC2)cc1 841938041 FXVDIGHXEUGDTE-MRXNPFEDSA-N 346.475 1.917 10 10 EDCE COC/C=C\C(=O)Nc1ccc(O)c(CNC(=O)/C=C/COC)c1 923118881 JYPOKKZCTXHTGQ-UZNMPDEFSA-N 334.372 1.352 10 10 EDCE COC(=O)C(C)(C)CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852200583 YGZCVJTULAXFLA-CYBMUJFWSA-N 349.431 1.772 10 10 EDCE O=C(NCc1cccc(Br)c1O)NCC12CC(CN1)C2 851676439 BBDVGMOSFBTOKY-UHFFFAOYSA-N 340.221 1.706 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCn3ccnc3C)C2)cc1 852190676 DVBZDYPGMVTORG-HNNXBMFYSA-N 343.431 1.778 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1c(C)cnn1C 850374819 RKUZUZGQRZJNRL-UHFFFAOYSA-N 329.404 1.358 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCc3ncccn3)C2)cc1 855225746 LYEFIAGGHNBSSB-CQSZACIVSA-N 326.400 1.813 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCn3ccnc3C)C2)cc1 852190678 DVBZDYPGMVTORG-OAHLLOKOSA-N 343.431 1.778 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)Cc1ccnn1C 769313796 NGOWLBXCNGSNJT-UHFFFAOYSA-N 344.415 1.230 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc([N+](=O)[O-])cn1 762060743 LTKSUCXZNPDKSW-UHFFFAOYSA-N 342.355 1.756 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@H](C)S(N)(=O)=O)c1C 768594606 MMHYGMHEXWRMNW-CYBMUJFWSA-N 349.456 1.809 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1[C@@H](N)Cc1ccc(O)c(O)c1 1953010007 TXMVQKWLVILPJP-STQMWFEESA-N 338.404 1.604 10 10 EDCE OCc1nnn2c1CN(Cc1cc(Cl)cc(Cl)c1O)CC2 894802975 JFHJDQFXUYIARS-UHFFFAOYSA-N 329.187 1.799 10 10 EDCE COCCOCC(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 169813994 SMUNFXWAIKCBKU-QGZVFWFLSA-N 346.431 1.355 10 10 EDCE O=C1NN(c2ccccc2)C(=O)/C1=C\c1cnnn1Cc1ccccc1 792882674 GUXKBFLAWYUTFU-BOPFTXTBSA-N 345.362 1.788 10 10 EDCE Cc1ccc(C(=O)Nc2csc(S(N)(=O)=O)c2)c(O)c1O 1302685003 YGTSNDDKWGJBFC-UHFFFAOYSA-N 328.371 1.367 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CNCc2cccc(O)c2O)C1 1251463446 ZHWRFJSWGOSIGO-KRWDZBQOSA-N 338.404 1.559 10 10 EDCE NS(=O)(=O)c1ccc(C(=O)NCc2c(O)cccc2F)c(F)c1 1178412668 DEVVEKRFKKDZRX-UHFFFAOYSA-N 342.323 1.248 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)c(Br)c1 2126153331 OOXGCAWVGHJIEV-RDBQEKCUSA-N 327.222 1.086 10 10 EDCE C[C@@H]1C[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 1325662081 ARDPAPMMIPIGQQ-UKRRQHHQSA-N 347.484 1.628 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cn3cc(C4CC4)nn3)C2)cc1 1328372323 FHKVCKCNTZDBKW-CQSZACIVSA-N 341.415 1.559 10 10 EDCE CN1CCN(c2ccc(CNc3n[nH]c4c3COCC4)cc2F)CC1 1333683442 SGOWBOBNZPHHNN-UHFFFAOYSA-N 345.422 1.985 10 10 EDCE CCN(C)c1ccc(CN(C)Cc2nnc3n2CCN(C)C3=O)cc1 1197710074 DKZXSMJAMCABFR-UHFFFAOYSA-N 342.447 1.452 10 10 EDCE COCCOc1cccc(CC(=O)NCc2cccc(O)c2O)c1 1349080079 YPRDPFSJKHGSDE-UHFFFAOYSA-N 331.368 1.982 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C2(C3CC3)CC2)cc1C 1278099454 LDXZLLPCZZKDSN-MRXNPFEDSA-N 332.444 1.761 10 10 EDCE CCn1cc(C(=O)N(C)C[C@H](C)NCc2ccc(OC)c(C)c2)nn1 1283694082 RKKRKUBOIRPJSV-AWEZNQCLSA-N 345.447 1.865 10 10 EDCE Cc1nccn1-c1ncccc1CNC(=O)Cc1ccc(O)c(O)c1 1291936851 ORJMFKVALNBINX-UHFFFAOYSA-N 338.367 1.846 10 10 EDCE CCOC(=O)[C@@](C)(O)CNC(=O)c1cc2cc(O)c(O)cc2s1 1296091928 IXSMRGHEWUWWDA-HNNXBMFYSA-N 339.369 1.356 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1cnc(Br)cn1 1467987715 VDFBDASWXNCQSC-UHFFFAOYSA-N 338.161 1.509 10 10 EDCE O=C(CCc1nc(-c2nc[nH]n2)no1)NCc1cc(Cl)ccc1O 1469874068 JVKDYYVMQJZHOX-UHFFFAOYSA-N 348.750 1.463 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CC[C@@H](C(F)(F)F)[C@@H](CO)C1 1472559592 HKRGTFFJZUWPLV-HTQZYQBOSA-N 337.269 1.870 10 10 EDCE C=CCCC(=O)N1CC[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1703430929 LOSOTRAGJPOASI-CYBMUJFWSA-N 333.388 1.396 10 10 EDCE C[C@H](NC(=O)c1ccsc1S(N)(=O)=O)c1ccccc1O 1635804248 RGGIKMWXXBYXAG-QMMMGPOBSA-N 326.399 1.592 10 10 EDCE CC(C)N(CCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 118590032 UDWJBMSGSALSAA-LBPRGKRZSA-N 328.210 1.608 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccnc(O)c1Br 1633599390 ZHWQVALZNFPSDU-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccnc(CO)c1 1641203394 CQVGFSLMYRPHCA-UHFFFAOYSA-N 341.411 1.465 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccnc(O[C@H]2CCOC2)c1 1643882380 UOASIJWYVVOHOW-AWEZNQCLSA-N 330.340 1.591 10 10 EDCE COCCN[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@@H]1C 1676694949 UXMVCKFSCFXLCK-RISCZKNCSA-N 333.392 1.688 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCCN(C[C@H]2CCCO2)CC1 1597697469 ACDGRWBHHZALQU-OAHLLOKOSA-N 334.416 1.354 10 10 EDCE C=CC(=O)NCCC(=O)NCc1ccc(N2CCSCC2)cc1 159179616 OFMMLTKVRQGHLD-UHFFFAOYSA-N 333.457 1.548 10 10 EDCE CNCc1ccc(N2C[C@H](O)C[C@@H]2CN(C)C)cc1Br 234381316 PUXMIFXKEXGRQA-ZIAGYGMSSA-N 342.281 1.670 10 10 EDCE CO[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NCCN=[N+]=[N-])C1 1965101393 CIBQPPUEWRCWMT-MNOVXSKESA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC(CN=[N+]=[N-])CC1 1985102426 GTCQWXCJYOWXRD-NSHDSACASA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)COC1 2014494716 IQEUWERJUHEEBY-NSHDSACASA-N 339.396 1.687 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2010391950 CFQGUZXLBSDGFE-MNOVXSKESA-N 339.396 1.563 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010401379 DRQLZDSMNHOQPW-NWDGAFQWSA-N 339.396 1.780 10 10 EDCE Cn1cc(C(=O)N2CC(N=[N+]=[N-])C2)c(CNC(=O)OC(C)(C)C)n1 2010405256 HADRMUMNEGDQGB-UHFFFAOYSA-N 335.368 1.580 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(N)cc1 2022875911 QWVVFZXDGVZPPX-SMDDNHRTSA-N 337.420 1.501 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](NC(N)=O)C2)c(Br)c1 690736818 SHDAYQFTXUZUTD-WCBMZHEXSA-N 328.210 1.749 10 10 EDCE CCNC(=O)c1cnn(Cc2cc(Br)ccc2O)c1O 2070484835 BMFRTRQLUCZSSF-UHFFFAOYSA-N 340.177 1.855 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3COC[C@@H](C2)C3O)c(Br)c1 2167780716 ZMZUDKQGPMEGAS-JURLDLKRSA-N 342.233 1.946 10 10 EDCE C[P@]1(=O)C[C@@H](O)[C@@H](NCc2c(O)cccc2Br)C1 2057718213 GVEYKMUTXARHFL-GLUANWCPSA-N 334.150 1.980 10 10 EDCE OCC1(CO)CCN1c1ccc(CNC2CC2)c(Br)c1 2194352560 LAVMDYMXDYOOKB-UHFFFAOYSA-N 341.249 1.635 10 10 EDCE CN1CCO[C@@H]2CN(Cc3c(O)cccc3Br)C[C@H]21 2097748662 CIFQHFMRLBEFQS-TZMCWYRMSA-N 327.222 1.670 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])C1 2213588202 OYCLXYNCLXYUPA-WDEREUQCSA-N 339.396 1.706 10 10 EDCE COc1ccc(N2CCN(C(=O)C=Cc3ccnn3C)CC2)cc1 2296959338 RNYQDHGDIMAPBN-UHFFFAOYSA-N 326.400 1.791 10 10 EDCE CO[C@H](C)[C@@H](N)C(=O)NCc1ccc(C)c(Br)c1O 2352950274 QCAJBRGPDNUSJM-LDYMZIIASA-N 331.210 1.442 10 10 EDCE COCCNC(=O)c1ccccc1NC=C1C(=O)OC(C)(C)OC1=O 10123066 DJXMJNYZNRTRAQ-UHFFFAOYSA-N 348.355 1.195 10 10 EDCE CNC(=O)[C@H](NC(=O)/C=C/c1ccc(N2CCOCC2)cc1)C(C)C 178838291 CIJYKEAVZUQRFE-AHKGRUIUSA-N 345.443 1.423 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnnc(C)c1 1343422442 VUFMDWCRUSKUTF-ZDUSSCGKSA-N 345.355 1.100 10 10 EDCE Cn1cc(CN2CCCN(C(=O)c3cccc(O)c3O)CC2)cn1 187075860 ZHONQBQKOUPTOI-UHFFFAOYSA-N 330.388 1.179 10 10 EDCE OCCCN1CCCN(c2ccc(CO)c(Br)c2)CC1 2366571399 VPCNCYRERMJCDB-UHFFFAOYSA-N 343.265 1.836 10 10 EDCE C[C@H]1CS(=O)(=O)CCN1c1ccc(CN)cc1Br 228724647 RMHJNYRFHAIBIP-VIFPVBQESA-N 333.251 1.531 10 10 EDCE Nc1ccc(CS(=O)(=O)Nc2n[nH]cc2Br)cc1 381186289 MLIHZLHVAPMIHG-UHFFFAOYSA-N 331.195 1.696 10 10 EDCE COc1cc([C@H]2N[C@H](C(=O)O)C(C)(C)S2)c(O)c([N+](=O)[O-])c1 83236925 GFRNTDCJDZAKAT-MNOVXSKESA-N 328.346 1.876 10 10 EDCE CN(C)c1ccc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1 92044638 MKVZCMQBQROXQC-QGZVFWFLSA-N 337.489 1.753 10 10 EDCE CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)c1ccc(C)c(O)c1O 370419252 UFYDRKUZGLZIQX-NEPJUHHUSA-N 337.372 1.589 10 10 EDCE c1cc(N2CCOCC2)ccc1CN[C@H]1CCO[C@@]2(CCOC2)C1 371407472 QJUGUYRFKJHZRN-HKUYNNGSSA-N 332.444 1.951 10 10 EDCE O=C(O)[C@@H]1COCCN(Cc2ccc(Br)cc2O)C1 700438766 JSFFJCUUYIBZJO-JTQLQIEISA-N 330.178 1.688 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NC[C@@H]1COCCO1 804969472 GFQUTNCGBUWCCY-LLVKDONJSA-N 345.193 1.369 10 10 EDCE CC(C)OC[C@@H](O)CNCc1ccc(N2CCOCC2)c(F)c1 818967614 XBXKRCZSQIEOJT-HNNXBMFYSA-N 326.412 1.538 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc(N)cc1)C2 818545194 NTLNNIXXBHVHFG-IMJJTQAJSA-N 331.416 1.794 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(C(N)=O)CC2)c(Br)c1 721685467 YCQGFMIOZGESKH-SECBINFHSA-N 328.210 1.703 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC[C@H](C(=O)N2CCCC2)C1 825811176 ZQDJPOTXXYXCLC-NSHDSACASA-N 336.363 1.712 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3CCCOC3)C2)cc1 823093681 GERWBOFWYFNIQM-LSDHHAIUSA-N 333.432 2.000 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)COC2CCC(N)CC2)cc1 846698000 ZXXUBEAIOVUAHT-UHFFFAOYSA-N 349.475 1.876 10 10 EDCE C[C@H]1CN(S(=O)(=O)NCc2cc(Cl)ccc2O)C[C@H](C)O1 845997816 HAZTZWNTEGCRJQ-UWVGGRQHSA-N 334.825 1.489 10 10 EDCE CN1CCO[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@@H]21 826120799 JLDQDVFMZWMZDQ-GXTWGEPZSA-N 327.222 1.670 10 10 EDCE Nc1ccc(NC(=O)C(=O)NCC[C@@H]2CC[C@H](C(F)(F)F)O2)cc1 927866614 BARSHTXRXARZHH-NWDGAFQWSA-N 345.321 1.824 10 10 EDCE COCc1nc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)co1 855225046 IDQYGGVUNUJUOL-LBPRGKRZSA-N 331.372 1.838 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@H](C)C1O 853474919 SXJGRRZEEYPMQU-GJZGRUSLSA-N 347.459 1.682 10 10 EDCE O=S(=O)(Nc1ccc2nn[nH]c2c1)c1cc(F)cc(F)c1O 753014435 JPSJQNHMFPAQNC-UHFFFAOYSA-N 326.284 1.743 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)COCc3cc(C)no3)C2)cc1 855223647 HCBIHAOVZBBOOM-CQSZACIVSA-N 345.399 1.903 10 10 EDCE COC(=O)CCCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852456136 XLIWKVLBFWCCIN-CYBMUJFWSA-N 335.404 1.526 10 10 EDCE CNS(=O)(=O)c1ccc(CCNCc2ccc3c(c2)CCO3)cc1 865819598 XGZYZLOATYLAQF-UHFFFAOYSA-N 346.452 1.862 10 10 EDCE CCN(CC)c1ccc(CN2CCO[C@@H](CNC(=O)NC)C2)cc1 862461778 ROZHXEZTURBDLC-KRWDZBQOSA-N 334.464 1.663 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN(C)C[C@@H]2CCS(=O)(=O)C2)c1O 774903259 LYQNPIVFMJEUJJ-JTQLQIEISA-N 344.389 1.176 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@@H](O)COC[C@@H]2CCCO2)c1 775373516 SXJMDCIFYZVYMP-GUTXKFCHSA-N 325.405 1.608 10 10 EDCE COC(=O)c1c(CN2CC(=O)N[C@H](C)C2)c2cc(F)ccc2n1C 894902555 KUNZHGQUFRWUHG-SNVBAGLBSA-N 333.363 1.424 10 10 EDCE COc1cc(C)cc(CN2CCN([C@@H]3CCNC(=O)CC3)CC2)c1O 894928616 LHHXXCWEZGDKTP-INIZCTEOSA-N 347.459 1.496 10 10 EDCE C[C@H](N[C@@H](C)C1(S(C)(=O)=O)CC1)c1cc([N+](=O)[O-])ccc1O 797070880 NJVVTUWKROOLKY-UWVGGRQHSA-N 328.390 1.917 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCCNC2=O)c1O 1964042811 JWYPNHYULZZOAI-JTQLQIEISA-N 329.194 1.532 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3occc3N)CC2)cc1 1328592917 BHKQAAFMPHJWKF-UHFFFAOYSA-N 344.415 1.422 10 10 EDCE CN(C)C[C@H](O)CN(C)c1ccc(CN)c(Br)c1F 690202064 HZWPHHFIBLWJQJ-JTQLQIEISA-N 334.233 1.406 10 10 EDCE COC(C)(C)[C@@H](C)NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1333430905 YIBFVXTTYYIDMN-QWHCGFSZSA-N 335.448 1.860 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1cnnn1C 1450635774 UCHFPLBETSTNPU-UHFFFAOYSA-N 337.383 1.965 10 10 EDCE O=C1Nc2cc(N3CC=C[C@@H]3CO)c(Br)cc2[C@@H]1O 2119853771 RNRWUUJWVHMIAQ-KRTXAFLBSA-N 325.162 1.172 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3NC(=O)O[C@H]3C2)c(Br)c1 2120405830 NVYPCSUYCIWANM-JWYUURKGSA-N 326.194 1.766 10 10 EDCE N[C@@H]1CN(Cc2cc(Br)cc(F)c2O)CC[C@@H]1CO 2122340558 CLUJVUQPTWASNT-PRHODGIISA-N 333.201 1.435 10 10 EDCE C[C@H](NC(=O)NCc1cccc(Cl)c1O)c1nnc(O)n1C 1471396654 SZWMTAMYDRIUKB-ZETCQYMHSA-N 325.756 1.440 10 10 EDCE NC(=O)[C@@H]1Cc2ccccc2N(C(=O)Cc2ccc(O)c(O)c2)C1 1542837196 IQRBHICAHLEXSL-CYBMUJFWSA-N 326.352 1.331 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)Cn2cncc2C)cc1C 1715988748 PEAAOMCRIFXSIC-AWEZNQCLSA-N 330.432 1.803 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCC1CCOCC1 1491690762 CWJRFINJKMCVOB-LBPRGKRZSA-N 347.419 1.984 10 10 EDCE CC[C@@H](CNC(=O)C1=CCCC1)NC(=O)c1cc(OC)nc(OC)c1 1721461512 PZHLREWZQYOCMI-AWEZNQCLSA-N 347.415 1.834 10 10 EDCE Nc1nnc(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)o1 1639682748 BYZYKBGBVIIFDD-DUXPYHPUSA-N 330.344 1.482 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1ncc(Br)cc1O 1635959866 PDFHPCMHNCMWKE-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)COC(C)(C)C)cc1C 1734364431 HSGNPLDOZDTRRP-OAHLLOKOSA-N 338.448 1.385 10 10 EDCE COC(=O)c1cc2n(n1)CCC[C@@H]2NC(=O)c1c(F)ccc(O)c1O 1654846289 VDYYKEASISNFED-VIFPVBQESA-N 349.318 1.485 10 10 EDCE COC[C@@H](C(N)=O)N(C)Cc1ccc(N2CCC(OC)CC2)cc1 1658789511 PLDPMWSOIDSTIP-KRWDZBQOSA-N 335.448 1.234 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@H](O)[C@@H]3C)c(Br)cc21 1914304178 UJGNXBZJQBXORL-YLJLNXRRSA-N 340.221 1.621 10 10 EDCE Oc1cccc(Br)c1CN1CCO[C@@H]2CCNC[C@@H]21 2129072078 OSHLIBQQBTVQFS-GXTWGEPZSA-N 327.222 1.717 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)CCN1C 221248268 HHVCOPKUUMJJGT-AMIZOPFISA-N 339.237 1.541 10 10 EDCE C[C@H](O)[C@@H]1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 226456287 OVADIXOZUJYCPR-HHURGBBESA-N 340.221 1.608 10 10 EDCE CNCc1ccc(N2CCC[C@@H](C(N)=O)C2)c(Br)c1 234437087 IPNGWUJWENWUFK-LLVKDONJSA-N 326.238 1.870 10 10 EDCE OCCOC1CN(c2ccc(CNC3CC3)c(Br)c2)C1 2152288107 UUPKMMLBCOKYKH-UHFFFAOYSA-N 341.249 1.899 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](OCC(N)=O)C2)cc1Br 2145369455 CCJXKNZQLGCPJX-KOLCDFICSA-N 343.221 1.583 10 10 EDCE Cn1cc(I)c([C@H](N)c2ccccc2O)n1 1983837194 SGMBFTWKRJUUSY-SNVBAGLBSA-N 329.141 1.778 10 10 EDCE C[C@H](NC[C@@H](CO)NC(=O)OC(C)(C)C)c1c(O)cccc1O 1985857660 DWEBLAZWBZGUPH-QWRGUYRKSA-N 326.393 1.634 10 10 EDCE COCCNCc1ccc(N2C[C@@H](O)[C@H](F)C2)c(Br)c1 2149256736 HGEHUMXMRZXFPG-TZMCWYRMSA-N 347.228 1.704 10 10 EDCE C[C@](NC(=O)C(F)(F)F)(C(=O)N1CC[C@H](N=[N+]=[N-])C1)C(F)(F)F 2010405997 OSNLCLHNFAGEGH-XNCJUZBTSA-N 347.219 1.897 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)NCCCN=[N+]=[N-])CO[C@H]2C1 2010401287 CLGMUJBGYLRVQX-UTUOFQBUSA-N 339.396 1.685 10 10 EDCE C[C@@H]1CO[C@H](CO)CN1c1cc(Br)c(CN)cc1F 311414990 MIWRFKZVULCHAD-SCZZXKLOSA-N 333.201 1.633 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](CO)[C@@H](O)C2)c(Br)c1 316634570 ZUSFFKSPZMUIFT-WFASDCNBSA-N 343.265 1.737 10 10 EDCE Oc1ccc(Br)cc1CNCCCCc1nn[nH]n1 708182411 FWCCBOUGAVIHJC-UHFFFAOYSA-N 326.198 1.780 10 10 EDCE CN(C)C[C@@]1(O)CCN(c2ccc(CN)cc2Br)C1 713652549 BOVODKDFTZTNBG-AWEZNQCLSA-N 328.254 1.411 10 10 EDCE Nc1ccc(NC(=O)Nc2nc(O)nc(O)c2Br)cc1 2191525086 HAZMXICABNGGQQ-UHFFFAOYSA-N 340.137 1.877 10 10 EDCE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(C(=O)c2ccc(O)c(O)c2)C1 2054420770 XWBRYENERLGJRM-WPRPVWTQSA-N 346.305 1.627 10 10 EDCE O=S1(=O)CC[C@@H]2CN(Cc3cccc(Br)c3O)C[C@@H]21 2088813734 BLTSQKBRXAWTTQ-SKDRFNHKSA-N 346.246 1.774 10 10 EDCE CC(C)[C@H]1C(=O)NCCN1c1ccc(CO)c(Br)c1 2113704101 UOLJSNCHZGZGOP-ZDUSSCGKSA-N 327.222 1.902 10 10 EDCE Cc1ccc(CNC(CO)(CO)CNC(=O)OC(C)(C)C)c(O)c1 2247110450 TZBSNEWZSWUIDE-UHFFFAOYSA-N 340.420 1.038 10 10 EDCE Cn1cc(CN2CCCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)cn1 171595826 DPDQSWUOCFPVLI-UHFFFAOYSA-N 345.403 1.742 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 171357218 KCOVNZWBDANHLR-HZPDHXFCSA-N 332.400 1.291 10 10 EDCE CCN[C@@H](C)c1ccc(N2CC([C@@H](O)CO)C2)cc1Br 2361913666 OOVUPFVOULJLDP-BONVTDFDSA-N 343.265 1.909 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)c(F)c1Br 2357055340 UTEZVASQUAKTMP-JMLLCIOISA-N 345.212 1.510 10 10 EDCE CN[C@@H](CO)c1cc(I)cc([N+](=O)[O-])c1O 380661177 WHDNCYGPIVWOKX-ZETCQYMHSA-N 338.101 1.158 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C1=O 839953386 PRBQQXBDIBWFDF-NCOADZHNSA-N 341.411 1.080 10 10 EDCE CCOC(=O)[C@@H](CO)NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 831520587 WXINGVAPWHBRTE-QGZVFWFLSA-N 344.411 1.677 10 10 EDCE COc1cccc(N2C[C@@H](NC(=O)c3cc(O)cs3)CC2=O)c1 732282575 QBVUOCXGFGCYJA-JTQLQIEISA-N 332.381 1.998 10 10 EDCE Nc1ccc(CCNS(=O)(=O)CCCC2CCOCC2)cc1 842822176 UJBWIXQCFUCICB-UHFFFAOYSA-N 326.462 1.938 10 10 EDCE COC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)Nc2ccc(N)cc2)C1 841092684 MCOOPERAKRCARP-VXGBXAGGSA-N 348.403 1.190 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN(C)S1(=O)=O 843878530 DAZGOTBYFFLIJG-HNNXBMFYSA-N 340.445 1.555 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(Cl)o2)c1 919810799 HJHUAIBIZOWLQN-UHFFFAOYSA-N 344.776 1.940 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ncn(C(C)C)n2)c1 845857948 WXGITIYSQCKLRT-JTQLQIEISA-N 347.375 1.389 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCO[C@@H]([C@@H](C)O)C1 840484534 PLKMHHXJXJIDKD-HDMKZQKVSA-N 349.475 1.783 10 10 EDCE COc1ccc(N(C)CCN(C)c2cncc(OCCO)n2)cc1 845673160 QKVYJACQDZEMSV-UHFFFAOYSA-N 332.404 1.429 10 10 EDCE COc1ccc(N2CC[C@H](CN3C(=O)N[C@@H](CSC)C3=O)C2)cc1 924951088 QSWZBFSTAWWHAJ-WFASDCNBSA-N 349.456 1.805 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@@H](O)CC3)C2)cc1 854298286 ZPVLBUIPDHJLTK-GDBMZVCRSA-N 333.432 1.830 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CN3CCCCC3=O)C2)cc1 855232182 OZGVTAVPMHIIHR-CQSZACIVSA-N 331.416 1.403 10 10 EDCE CCN(Cc1cc(=O)n2nc(N)[nH]c2n1)c1ccc(OC)c(OC)c1 856728526 BNTVKIWZLGNBCC-UHFFFAOYSA-N 344.375 1.044 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCN(C)[C@H]2C)cc1 925348969 OUVXOKUQQCUERA-WMLDXEAASA-N 334.464 1.865 10 10 EDCE CN1C[C@@H](c2cc(I)ccc2O)NCC1=O 1951859073 XTWZZLJBMKODGG-VIFPVBQESA-N 332.141 1.100 10 10 EDCE CN1CCN(c2ccc(CN3CCO[C@@]4(CCOC4)C3)cc2)CC1 769555876 JXUVLHRGFJZKLS-IBGZPJMESA-N 331.460 1.430 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)NCc2ccc(N(C)C)cc2C)C[C@H]1C 865905182 ZXYPYSGNWQKBOW-DAXOMENPSA-N 334.416 1.644 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@@H](n3cncn3)C2)c([N+](=O)[O-])c1 776840071 VXHKVGHLOCQNMD-HSBHDXMMSA-N 343.343 1.824 10 10 EDCE CCCC[C@@H](NC(=O)NCC)C(=O)NCc1cccc(OC)c1O 771656865 QYNCGBZYYAABNH-CYBMUJFWSA-N 337.420 1.895 10 10 EDCE Cn1ncc(Br)c1CC(=O)NCc1c(O)cccc1F 1303875580 KTFAGONVMUPAJY-UHFFFAOYSA-N 342.168 1.886 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@H](O)C2(C)C)cc1Br 2124801904 QBQOTAOWKQTPEV-WQHBLYJGSA-N 329.238 1.789 10 10 EDCE C[C@@H](O)c1ccc(N2CCC[C@H]2[C@@H](O)CO)cc1Br 2123170526 IGICYNSRGZVRFS-IIMNLJJBSA-N 330.222 1.824 10 10 EDCE COC[C@H](C)N[C@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1266192051 PUJVYYPGXCKODV-NEPJUHHUSA-N 335.408 1.982 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3[C@H]4CCC[C@H]43)C2)cc1 1347617596 SSYFZKRLDJFDFP-VZEFYGNVSA-N 343.427 1.305 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@@H]3CCCN(C)C3=O)CC2)cc1 1353884151 WGAIWAMDLLDMRM-QGZVFWFLSA-N 345.443 1.602 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@H]2CCC2(C)C)cc(OC)n1 1354653990 JJIJPQOZOZHVMF-WCQYABFASA-N 349.431 1.770 10 10 EDCE CN(Cc1nn(C)cc1Br)C(=O)c1cc(O)nc(O)c1 1912486336 MYLQPLHRCNYOIU-UHFFFAOYSA-N 341.165 1.261 10 10 EDCE C[C@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)CCN1C 221248325 HHVCOPKUUMJJGT-ISVAXAHUSA-N 339.237 1.541 10 10 EDCE NC(=O)COc1cccc2c1CCCN2C(=O)/C=C/c1cccnc1 1533720401 RJBBQDSHWGPWCB-CMDGGOBGSA-N 337.379 1.938 10 10 EDCE CCN(C)c1ccc(CN2CCN(CC(F)(F)CO)CC2)cc1 1473598101 QNXYOLNEGVOULX-UHFFFAOYSA-N 327.419 1.888 10 10 EDCE O=C1NCCc2ccc(CNC(=O)c3c(F)ccc(O)c3O)cc21 1611135877 WRRTWRLDIMICKE-UHFFFAOYSA-N 330.315 1.453 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2nnn(C)c2C)cc1C 1714693502 ZXFMNGLMBYBTHN-UHFFFAOYSA-N 331.420 1.302 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2cn(C)nn2)C(C)C)cc1C 1482527878 HTYPMZZEBZTDST-HNNXBMFYSA-N 345.447 1.676 10 10 EDCE C[C@H](CNC[C@@H]1CCCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1715963769 DCDZSXYXZGXZGX-OLZOCXBDSA-N 347.419 1.984 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H](CCO)C2CCOCC2)cc1 1638132956 GDBIJLWJTMWEJJ-AWEZNQCLSA-N 334.376 1.756 10 10 EDCE COc1cccc(-n2cc(C(=O)NCc3ccc(O)c(O)c3)nn2)c1 1566359154 VEHITDDLWFYGOB-UHFFFAOYSA-N 340.339 1.617 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1ncc[nH]1 1632356920 WIMIUFVFPRPDJX-LBPRGKRZSA-N 347.371 1.044 10 10 EDCE COc1ccc(CN[C@H]2CN(C(=O)CNC(C)=O)C[C@H]2C)cc1C 1570329576 AJKLZDWWRVGAFY-CJNGLKHVSA-N 333.432 1.076 10 10 EDCE CCC(=O)N[C@@H](C)C(=O)N(C)C[C@@H](C)NCc1ccc(OC)c(C)c1 1734326438 GKOVKQQWBUXEIB-CABCVRRESA-N 349.475 1.855 10 10 EDCE CO[C@H](C)CNCC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1668326613 SWJYNGDPXGNBOV-NWDGAFQWSA-N 335.408 1.982 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(OC)CCOC1 1694638848 XODAIZXYHNSCGU-GOSISDBHSA-N 346.431 1.988 10 10 EDCE O=C(Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cc(O)c(O)c(O)c1 1865876422 JZHJRMQDBGPNSY-UHFFFAOYSA-N 335.228 1.872 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@](C)(O)C3)c(Br)cc21 234438107 YMWCWGIQROPVML-GXTWGEPZSA-N 340.221 1.623 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1COC[C@@H]1NCc1ccc(O)cc1O 1948516718 CEOSQICTCXLKSV-OCCSQVGLSA-N 338.404 1.727 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@@H]2[C@@H](O)CO)c(Br)c1 2146333618 HLXQZBBCVVQLHF-FZQKWOKYSA-N 345.237 1.027 10 10 EDCE COC[C@]1(C(=O)NCCN=[N+]=[N-])CN(C(=O)OC(C)(C)C)CCO1 1965101742 GZTFEDNJNAURBO-AWEZNQCLSA-N 343.384 1.065 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@@]1(C(=O)NCCCN=[N+]=[N-])CCOC1 1985100639 IJELIXRZNQPRHH-AWEZNQCLSA-N 327.385 1.829 10 10 EDCE CCN1C(=O)C(=Cc2c(NC)nc3ccccn3c2=O)SC1=S 2053515642 DIICFIHTWDUHKX-UHFFFAOYSA-N 346.437 1.957 10 10 EDCE CNCc1ccc(N2CC[C@H](C(=O)NC)C2)cc1Br 398507901 LADNGWPPIGZYPS-NSHDSACASA-N 326.238 1.741 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CCCN(c2ncccn2)C1 2062057870 XQAVGPKMIJDNNF-LBPRGKRZSA-N 328.372 1.421 10 10 EDCE Nc1ccc(CS(=O)(=O)NCC2CCC3(CC2)OCCO3)cc1 2191780355 CIJXMINVEZAWGL-UHFFFAOYSA-N 340.445 1.622 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1908252868 HLOVJUJLZUWJOB-TUAOUCFPSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CC(=O)NCCCCN=[N+]=[N-])C1 1908254675 SJGJQEPHSHASEF-VXGBXAGGSA-N 341.412 1.811 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)C3(CO)CC3)c(Br)cc21 2184609302 JDUYGBAXNFSWGN-GFCCVEGCSA-N 340.221 1.623 10 10 EDCE COc1ccc(Br)c(CN[C@H](C(N)=O)C2CC2)c1O 2227747488 AWDWMGORYHBSDX-NSHDSACASA-N 329.194 1.517 10 10 EDCE COc1ccc(Br)c(CNC2(C(N)=O)CC(C)C2)c1O 2240659467 GUHXNUZGPIFIFB-UHFFFAOYSA-N 343.221 1.907 10 10 EDCE CC(C)(C)OC(=O)N1CCOCC[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2249053894 DAENMVZUBMHHJS-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE O=C(O)COc1ccccc1C=C1C(=O)NN(c2ccccc2)C1=O 2293835825 WETAYHSNUOABMC-UHFFFAOYSA-N 338.319 1.611 10 10 EDCE OC[C@@H](O)[C@@H]1CCN1c1ccc(CNC2CC2)cc1Br 2286216244 SNGPBOUCWFUCCZ-LSDHHAIUSA-N 341.249 1.633 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2333239275 MIRHUDLBPKEIJZ-UPJWGTAASA-N 333.201 1.048 10 10 EDCE COC(=O)C1(O)CN(Cc2ccc(C)c(Br)c2O)C1 2352568243 UJVPMIRPGDUIEW-UHFFFAOYSA-N 330.178 1.183 10 10 EDCE Cc1ccc(CNC(=O)N[C@H](C)C(=O)O)c(O)c1Br 2352620577 RFOQDEOQCCVXCD-SSDOTTSWSA-N 331.166 1.735 10 10 EDCE COC[C@H](N)CC(=O)NCc1ccc(C)c(Br)c1O 2352634129 QRPMFMPXAOOIKJ-SNVBAGLBSA-N 331.210 1.443 10 10 EDCE C[C@@H](O)CNC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1269149962 XLRKXWPWVZWKJX-QMTHXVAHSA-N 333.392 1.328 10 10 EDCE OC[C@H](O)C1CN(c2ccc(CNC3CC3)cc2Br)C1 2361905157 FFBLXSIQUHWCRO-HNNXBMFYSA-N 341.249 1.491 10 10 EDCE CCOc1ccnc(N2CCN(Cc3cc(OC)ccc3O)CC2)n1 180110347 ADDWJDMPJQZPON-UHFFFAOYSA-N 344.415 1.912 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)c2cnc(Cl)nc2)cc1 40803672 UUYUIDZJVDMZOB-UHFFFAOYSA-N 326.809 1.675 10 10 EDCE Cc1cccc(C)c1OCC(=O)NCCN1C(=O)CSC1=S 49755983 GLYCKHRTRBXWDS-UHFFFAOYSA-N 338.454 1.659 10 10 EDCE C[C@H]1CCOCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 375003615 HHDQCHHASNRZPL-JTQLQIEISA-N 328.390 1.015 10 10 EDCE CN[C@H]1COC[C@@H]1C(=O)NCc1ccc(C)c(Br)c1O 2380756309 KCMDMZDKEAELEX-QWRGUYRKSA-N 343.221 1.314 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(F)c[nH]3)cc2)CC1 294994705 UJBQJRFJZPXBEJ-UHFFFAOYSA-N 344.390 1.752 10 10 EDCE O=C(NCC[C@H]1CCOC1)C(=O)NCc1ccc(N2CC=CC2)cc1 807292008 RSIVMDNCNGHBQF-INIZCTEOSA-N 343.427 1.222 10 10 EDCE CCOC(=O)C(=O)[C@@H](N)c1cc(Br)cc([N+](=O)[O-])c1O 725396862 BBPCNRLVNXJZML-QMMMGPOBSA-N 347.121 1.195 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CN(C)C(=O)[C@H]3C)C2)cc1 826993639 SSWOMJGDQSMKIA-ZIAGYGMSSA-N 346.431 1.351 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@](O)(C(F)F)C2)cc1F 838028808 DBKPRRIGDDFMNF-OAHLLOKOSA-N 331.338 1.803 10 10 EDCE CCCn1[nH]ccc1=NC(=O)CN[C@@H](C)c1cc(OC)ccc1O 588382566 GKZFWUZDMKVALX-LBPRGKRZSA-N 332.404 1.719 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)CC3COC3)cc2)CC1 907639009 CXQJAEPFKAEMKP-UHFFFAOYSA-N 331.416 1.008 10 10 EDCE CN(C)c1ccc(CNC(=O)CC2(C(=O)O)CCOCC2)cc1F 911301117 WMIYLMAIBJUQGJ-UHFFFAOYSA-N 338.379 1.779 10 10 EDCE CNS(=O)(=O)C1CCN(Cc2c(O)cc(C)cc2Cl)CC1 840918647 WRKCXJWRYCBUTK-UHFFFAOYSA-N 332.853 1.868 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H]2CNCCC2(F)F)cc1F 841760814 LVRYPZBVAHUWTD-CYBMUJFWSA-N 330.354 1.688 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]12C[C@H]3C[C@H](C(=O)N1)[C@H]2C3 845929317 AEMAJNBXAQYGBS-AHPOVHITSA-N 330.384 1.060 10 10 EDCE O=C(/C=C/C1CC1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 742561632 WQECRZITECTFQV-VMPITWQZSA-N 334.441 1.504 10 10 EDCE NC(=O)C1CCN(c2ccc(CN[C@H]3C[C@H](N)C34CCC4)cc2)CC1 925775819 AQSYDGRIKOZMMU-ROUUACIJSA-N 342.487 1.748 10 10 EDCE CN1C[C@H](CCN2C(=O)CN(Cc3ccccc3O)C2=O)CC1=O 925182890 ILVXTBHKQWEQBR-GFCCVEGCSA-N 331.372 1.025 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCO)C3CC3)C2)cc1 854298996 DJKLSWSQZRZIKQ-WMLDXEAASA-N 333.432 1.734 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1C(=O)NCCCCN=[N+]=[N-] 1895875917 OTQIOPDFDYVSIA-MNOVXSKESA-N 327.385 1.875 10 10 EDCE CCO[C@H](CS(=O)(=O)Nc1ccc(O)cc1C(=O)OC)C1CC1 863407199 PPSYZRJOXAXQGR-CQSZACIVSA-N 343.401 1.736 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CO[C@H](C3CC3)C2)c1 863284751 CYBYOPWMAJANTO-RISCZKNCSA-N 340.401 1.061 10 10 EDCE O=C1[C@H]2[C@H]3C[C@H]4[C@@H]2[C@@]2(C(=O)NCc5ccc6cccnc6c5O)[C@@H]4[C@H]3[C@@H]12 862026184 IAOMFUMFQJFYQU-GHYKJLIESA-N 346.386 1.884 10 10 EDCE C[C@@H](NC(=O)C(=O)N[C@@H]1CCNC12CCC2)c1ccc(N(C)C)cc1 861767599 OIRKZZFEMPZZLI-CZUORRHYSA-N 344.459 1.331 10 10 EDCE COC(=O)C(=O)[C@@H](C)OC(=O)c1cc(C)n(-c2ccccn2)c1C 778297147 IGXODAQNVOBECA-GFCCVEGCSA-N 330.340 1.777 10 10 EDCE CN1CCN(c2ccc(CNC(=O)Nc3ccc[n+]([O-])c3)cc2)CC1 1123347376 YALVPOXFUZXJKW-UHFFFAOYSA-N 341.415 1.394 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CC[C@]2(CNC(=O)C2)C1 789024353 JRHSNLZSQKVVAA-SFHVURJKSA-N 330.432 1.483 10 10 EDCE CCO[C@@]1(C)C[C@H]1NC(=O)NCc1ccc(N2CCN(C)CC2)cc1 889661036 PAHLAGWKNXXWTN-MJGOQNOKSA-N 346.475 1.805 10 10 EDCE Cc1cncn1CC(=O)NCc1ccc(N2CCN(C)CC2)cc1 881855019 OFACRLUJTXSEIJ-UHFFFAOYSA-N 327.432 1.260 10 10 EDCE C[C@H](NCc1ccc(Br)cc1O)c1nnc(O)n1C 895172582 ROCLWMFTGBVGJE-ZETCQYMHSA-N 327.182 1.840 10 10 EDCE COc1cc(Cl)cc([C@H]2NC(=O)NC(C(=O)O)=C2Cl)c1O 76256677 OWXHSIBPBPLADH-MRVPVSSYSA-N 333.127 1.943 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1nccc(C)n1 792304614 PVJZQXJCIVTFJW-UHFFFAOYSA-N 349.774 1.959 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@H](N2CCCCC2=O)C1 1170335398 LPPKEQNETJSUFY-AWEZNQCLSA-N 332.400 1.644 10 10 EDCE C[C@@H](CN(C)C(=O)C(=O)N1Cc2cccc(O)c2C1)c1nccs1 1329436503 RDUHYHVXBRNHHR-NSHDSACASA-N 345.424 1.953 10 10 EDCE O=C(C(=O)N(C[C@@H]1CCOC1)C1CC1)N1Cc2cccc(O)c2C1 1348587408 SAVJELOPNCSOGW-LBPRGKRZSA-N 330.384 1.262 10 10 EDCE CC/C(C)=C\C(=O)N1CC[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1284007138 CVQHPBRTZXEMIY-UNJUUPHPSA-N 347.415 1.786 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCNC(=O)C(C)C 1290719668 XETCXCUWQONRSJ-UHFFFAOYSA-N 331.420 1.701 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCCC[C@@H]3CO)c(Br)cc21 221241851 QDRQCKLTWXXGSZ-OQPBUACISA-N 340.221 1.752 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCNC(=O)NC1CCCCC1 1466040435 USCKIQMFPZUHHE-UHFFFAOYSA-N 335.404 1.388 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@H]2COCCO2)cc1C 1700738320 MNRYHNYYMNFUFH-PBHICJAKSA-N 336.432 1.356 10 10 EDCE COC(=O)[C@H]1c2ccccc2CCN1C(=O)Cc1ccc(O)c(O)c1 1630107027 QIAVXENFXFNWIW-GOSISDBHSA-N 341.363 1.939 10 10 EDCE COc1ccc(CNCCC2CCN(C(=O)CC(N)=O)CC2)cc1C 1568083004 KMRQTUWLNXCAPI-UHFFFAOYSA-N 347.459 1.597 10 10 EDCE COc1ccc(CNC[C@@](C)(NC(=O)CNC(C)=O)C2CC2)cc1C 1568012385 FPFBEFIKWLARLK-LJQANCHMSA-N 347.459 1.514 10 10 EDCE CNC(=O)[C@H](C)N[C@@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1734357113 OCCPSFHKBYSWDE-QWRGUYRKSA-N 348.407 1.034 10 10 EDCE Cn1nnc2c(NCc3cccc(Br)c3O)ncnc21 1642658657 HTDIGKUYMSLYPW-UHFFFAOYSA-N 335.165 1.839 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)CCC(=O)O)c2nccn2C)cc1 169813612 CBEOOIDOOMCBJC-MRXNPFEDSA-N 330.388 1.557 10 10 EDCE Cn1nnnc1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 169867116 RYESXQHKUXHKFE-UHFFFAOYSA-N 347.334 1.167 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 1858596474 UNFWTFNQPRTFDA-RAJVOEEQSA-N 325.367 1.039 10 10 EDCE COc1ccc(N2CCN(C(=O)CCC3=NNC(=O)CC3)CC2)cc1 1873831526 QTMXNVZOOJSFTM-UHFFFAOYSA-N 344.415 1.390 10 10 EDCE CCOc1cccc(CNCCC(=O)N(CC)CCC(=O)O)c1O 1857863706 BKWJKSCVXTXOTD-UHFFFAOYSA-N 338.404 1.594 10 10 EDCE COc1cccc(CN[C@@H]2COC[C@H]2NC(=O)OC(C)(C)C)c1O 1944917711 OWONDVKBGWVAKY-CHWSQXEVSA-N 338.404 1.783 10 10 EDCE CN(C)C(=O)CN(Cc1ccccc1)C(=O)Cc1ccc(N)cc1 1946869744 NBHZHEMWNNRIPX-UHFFFAOYSA-N 325.412 1.928 10 10 EDCE C[C@H]1CCN(C(=O)c2cccc(O)c2O)C[C@H]1NC(=O)C(F)(F)F 1965198116 FMBWELRMTQJDST-WCBMZHEXSA-N 346.305 1.627 10 10 EDCE [N-]=[N+]=NCCCN1CCO[C@]2(CCCN(C(=O)C(F)(F)F)C2)C1 2006171530 ORKBYHWLZFDYEA-GFCCVEGCSA-N 335.330 1.943 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2COCC[C@@]2(C(=O)NCCN=[N+]=[N-])C1 2010393181 OYGKDQDOFFLBBM-IAQYHMDHSA-N 339.396 1.687 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)[C@@H](CO)C2)c(Br)c1 704807556 BVLWDCJHUZRXNB-TXEJJXNPSA-N 329.238 1.206 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(CNC(=O)N3C)C2)cc1Br 2177689609 NQSATKNLLOFTEB-SECBINFHSA-N 340.221 1.716 10 10 EDCE CNC(=O)CCN(C)Cc1c(Br)ccc(OC)c1O 1231552574 GTOXDTCOXCOMMK-UHFFFAOYSA-N 331.210 1.731 10 10 EDCE Nc1ccc(CCC(=O)N=c2nc(Br)[nH]s2)cc1 2047598308 NCGLFXPRZBWEBR-UHFFFAOYSA-N 327.207 1.876 10 10 EDCE Oc1ccc(CNC[C@H]2COCCN2Cc2ccccc2)c(O)c1O 2074174207 MCRCEGSGQFLTIV-INIZCTEOSA-N 344.411 1.794 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@@H](O)C2)cc1Br 2105076086 UDDOZJZUTQXTER-BETUJISGSA-N 329.238 1.491 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@H]3CO)c(Br)cc21 2092555538 OBJFFBLIRYTWJT-KRTXAFLBSA-N 326.194 1.233 10 10 EDCE O=C(O)[C@H]1CCOCCN1Cc1c(O)cccc1Br 2269867917 GWZRLLVYBDRWGO-LLVKDONJSA-N 330.178 1.830 10 10 EDCE COC(=O)CN1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2297306427 IJLCSAGADKAMKG-UHFFFAOYSA-N 338.366 1.969 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@H](O)C[C@H]2CO)cc1Br 2335170443 XKMGELCTYAXRFF-ZMLRMANQSA-N 329.238 1.661 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3CS(=O)(=O)[C@H]3C2)c(Br)c1 2336558860 NNANWOXQXLYXCX-FWDPORAESA-N 345.262 1.702 10 10 EDCE Cc1ccc(CN2CCO[C@H](C(N)=S)C2)c(O)c1Br 2352945947 DIKACIDBTRORNO-JTQLQIEISA-N 345.262 1.950 10 10 EDCE C=CC(=O)NCCC(=O)N1CCCN(c2ccc(OC)cc2)CC1 178712021 ZVMPTMHKDRJDJQ-UHFFFAOYSA-N 331.416 1.426 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1cccnc1 118775231 NJJLQVJYTNYKHM-CRAIPNDOSA-N 339.395 1.965 10 10 EDCE CC(C)c1nnnn1CC(=O)NCc1ccc(N2CCCC2)cc1 174086888 QPYFMZRVKQGZSH-UHFFFAOYSA-N 328.420 1.713 10 10 EDCE NC(=O)[C@H]1CCC[C@H](NC(=O)NCCCSc2nccs2)C1 177833227 OLPPJCMAYVWWAN-QWRGUYRKSA-N 342.490 1.969 10 10 EDCE Nc1ncncc1C(=O)NCc1ccc(N2CCSCC2)cc1 185426956 DCAMNMPQWQRARK-UHFFFAOYSA-N 329.429 1.542 10 10 EDCE COc1ccc(O)c(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)c1 121515270 YQYNOLCDDXGTBZ-NSHDSACASA-N 336.413 1.899 10 10 EDCE CNC(=O)CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 184343977 JAPXWASGWQDNMR-INIZCTEOSA-N 333.432 1.396 10 10 EDCE C[C@H](NCCNS(=O)(=O)c1cccnc1)c1ccc(F)cc1O 186142135 UCQRNAWRKQNTSF-NSHDSACASA-N 339.392 1.555 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CCCOC3=O)CC2)cc1 82320417 SJCGURRSBWAJLN-UHFFFAOYSA-N 333.388 1.186 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C[C@@H](O)CCN2)c(O)c1Br 2380751083 HLSBBEHNHHZAHB-WDEREUQCSA-N 343.221 1.192 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cnc(OCC3CC3)cn2)c1 802783586 YEYRYIXGEKFDFZ-UHFFFAOYSA-N 329.356 1.910 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H]3CCCN(C)C3=O)CC2)cc1 822655962 FGWJGVLENGHZBM-QGZVFWFLSA-N 345.443 1.602 10 10 EDCE CCN(C)c1ccc([C@@H](C)NC[C@@]2(OC)CCS(=O)(=O)C2)cc1 903368654 PDDWLCPPIRUEOZ-PBHICJAKSA-N 340.489 1.997 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@H](O)C(F)(F)C3)cc2)CC1 826957862 JLCRCZBGHNISRK-INIZCTEOSA-N 325.403 1.640 10 10 EDCE COc1ccc(N2CCN(C(=O)CC3(O)CCOCC3)CC2)cc1 905103712 CFZXWTYHRCVIGF-UHFFFAOYSA-N 334.416 1.275 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N[C@H](CO)c1ccnn1C 838480578 YNCZBHAOTJSYHT-OAHLLOKOSA-N 331.420 1.327 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1C[C@@H](C)N(CCO)C[C@H]1C 842181469 YGRVRCXWTWYBGS-HZPDHXFCSA-N 348.491 1.658 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CC[C@@H](C2CC2)N1C(=O)OC(C)(C)C 845428150 JCCMQTRSWZSILF-QWHCGFSZSA-N 339.388 1.866 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1CCO[C@H]1CC1(F)F 849359964 HNZRPAYVEMZAAC-LBPRGKRZSA-N 326.299 1.581 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCn3nnc(CO)c3C2)c1O 844334142 UNDZHWIOCXCVIX-UHFFFAOYSA-N 336.779 1.348 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)N[C@H](CSC)C3=O)C2)cc1 924981467 ZPSKIJDQUSIRCY-TZMCWYRMSA-N 335.429 1.557 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cn3ccc(C)cc3=O)C2)cc1 855223302 FEZRRZDLWTXAMD-HNNXBMFYSA-N 341.411 1.560 10 10 EDCE CC(C)OC[C@H](N)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 852805238 SYJCJJSPYWHQST-CVEARBPZSA-N 336.432 1.652 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nc[nH]c4nccc3-4)CC2)cc1 854198041 BSDDLAOVRSLGBD-UHFFFAOYSA-N 337.383 1.881 10 10 EDCE CCN(Cc1coc(S(N)(=O)=O)c1)c1ccc(OC)c(OC)c1 851828172 NOSXBROQCWFRAL-UHFFFAOYSA-N 340.401 1.971 10 10 EDCE CCn1nc(C)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 861676159 ZBLWQCXSSJRNML-UHFFFAOYSA-N 329.404 1.532 10 10 EDCE CN1CCCc2cc(CNCc3cn(C[C@H]4CCOC4)nn3)ccc21 865437833 SXIJFZDJTPDAIN-MRXNPFEDSA-N 341.459 1.987 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](C3CC3)C2)cc1 785427265 BXVGNADQWCTGOS-MRXNPFEDSA-N 331.416 1.006 10 10 EDCE CCCN(CCC)c1ccc(CN2C[C@@H](C(N)=O)[C@@H](C(N)=O)C2)cc1 895314242 KDJQQZBLYXZBBW-CALCHBBNSA-N 346.475 1.332 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)CC(N)=O 1137816519 JJBGSPSJYXLRDY-SECBINFHSA-N 342.779 1.059 10 10 EDCE C[C@@H](NC(=O)[C@]1(C)CCC(=O)NC1)c1ccc(N2CCOCC2)cc1 798409409 XQGKVMSRJZIIDG-AUUYWEPGSA-N 345.443 1.617 10 10 EDCE CCN(Cc1cc(Br)ccc1O)C(=O)C1(O)COC1 1149900794 UKOYKZRZSTUXPJ-UHFFFAOYSA-N 330.178 1.265 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H](C(N)=O)c2ccc(F)cc2)cc1 1153778404 ZNVNPSJYTUQQRI-CYBMUJFWSA-N 343.318 1.945 10 10 EDCE C/C=C/CNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 1331511124 RPHNBDNKJQWJAG-ONEGZZNKSA-N 332.448 1.693 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@@H]2[C@H](O)CO)c(Br)c1 2123209250 HCKUAYORHSPPIJ-OWYVNGRQSA-N 329.238 1.791 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@@H](CO)[C@@H](CCO)C3)ccc21 1518889469 JGBFSBXZLGAUNB-IRXDYDNUSA-N 347.459 1.201 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2COCCN2CC(F)F)c1 1294937371 ODTBNAAZMQWXMX-MFKMUULPSA-N 344.358 1.544 10 10 EDCE O=C(NCc1ncnn1-c1ccccc1)c1c(F)ccc(O)c1O 1558975712 NUWICCVMZORYGC-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccccc1O[C@@H]1CC(=O)N1 1557101931 DIUJWTJEULEHCW-XOWYPZSQSA-N 340.335 1.975 10 10 EDCE C[C@@H](NC(=O)c1cccc(CS(N)(=O)=O)c1)c1ccccc1O 1557966563 HVNQKCJDTYELMI-LLVKDONJSA-N 334.397 1.672 10 10 EDCE CC[C@@H](CN1CCOCC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1558423748 YCMCXFMBZMQMBU-ZDUSSCGKSA-N 333.392 1.690 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@H](O)Cc1cccc(F)c1 1636600756 AVEXVOUNIFXAJI-ZQMJAJRESA-N 331.343 1.970 10 10 EDCE N=C(O)OC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(O)c(O)c1 1639193676 AWWMBZMWEYXJDK-CQSZACIVSA-N 344.367 1.877 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)CNC(=O)C(F)F 1721576132 JCHYOXFGTYCJLL-MRVPVSSYSA-N 341.318 1.596 10 10 EDCE COC(=O)c1cc2n(n1)CCC[C@@H]2NC(=O)c1cccc(O)c1O 1636928634 DMIALZQTXUXEDW-JTQLQIEISA-N 331.328 1.346 10 10 EDCE NC(=O)N[C@H](CC(=O)NCc1cccc(O)c1O)c1cccs1 1643809465 OKEPYRFORCPTOC-SNVBAGLBSA-N 335.385 1.575 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCc1ncc2c(n1)CCOC2 1644499685 VUCZFBRAULRCBO-RQOWECAXSA-N 327.340 1.290 10 10 EDCE CCN(C)C(=O)CNC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1671934232 RUHMXDNUADGDGH-UHFFFAOYSA-N 332.448 1.907 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](CO)c1ncc[nH]1 1686826172 CGQQIINWIDOYMG-CZUORRHYSA-N 345.447 1.748 10 10 EDCE CN1NC(=O)[C@H](CC(=O)Nc2ccc(Oc3ccccc3)cc2)C1=O 169996222 RWUMCTCYZVWJKF-HNNXBMFYSA-N 339.351 1.927 10 10 EDCE CS(=O)(=O)NC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1858603955 CBQUEZVAIRYWAN-UHFFFAOYSA-N 344.348 1.543 10 10 EDCE CNCc1ccc(N2CC(=O)NC(=O)[C@@H]2C)cc1Br 234423007 ONUCFVPJXHWICL-QMMMGPOBSA-N 326.194 1.020 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1NCc1ccc(O)c(O)c1 1943954302 FPVDOSVAUIQHCK-STQMWFEESA-N 338.404 1.870 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](Nc2c(N)cccc2C(N)=O)CCO1 2000859770 AKXMQBXYVHPFPX-JTQLQIEISA-N 336.392 1.721 10 10 EDCE C[C@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985101707 WNSVNQYHRFIRSO-MWLCHTKSSA-N 325.369 1.532 10 10 EDCE NCc1ccc(N2C[C@H](CO)[C@@H](CCO)C2)c(F)c1Br 2149900804 NBSUQIOLBQFUPS-WDEREUQCSA-N 347.228 1.474 10 10 EDCE Nc1ccc(NC(=O)N2C[C@H]3C[C@H]2CN3C(=O)C(F)(F)F)cc1 1999442222 LKWMRFNJUYRXQE-MNOVXSKESA-N 328.294 1.648 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CN(Cc2ccc(N)cc2)CC[C@H]1CO 2009096136 LRHCLWIMRAEHEL-HOCLYGCPSA-N 335.448 1.976 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010396686 OYARFKRUSJLIPH-IAQYHMDHSA-N 339.396 1.660 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2010393501 SYFYOVMZCZICAU-UTUOFQBUSA-N 339.396 1.516 10 10 EDCE NCc1ccc(N2CCN(C3CC3)C(=O)C2)c(F)c1Br 2170581175 JXTMTUCDMIUYES-UHFFFAOYSA-N 342.212 1.858 10 10 EDCE NCc1cc(F)c(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)cc1Br 2173316893 HDXPFVQBJUVOMP-HTXXDJJVSA-N 345.212 1.367 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H](O)C[C@H](F)C3)c(Br)cc21 2234672668 DVEBTMDLUKSWRU-WSFZALMZSA-N 344.184 1.310 10 10 EDCE O=C(O)[C@@]12CC[C@@H](CN(Cc3ccc(Br)cc3O)C1)N2 2287227621 ZAHXOBJEOMSDJX-SMDDNHRTSA-N 341.205 1.546 10 10 EDCE CC[C@@H](N[C@@H]1CCO[C@@H]1C(N)=O)c1cc(Br)ccc1O 2296656957 GPQJKWDYYIOFNS-WZRBSPASSA-N 343.221 1.838 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@@](O)(CNC(=O)OC(C)(C)C)C1 2300525453 GFGDLLVCJOONOM-FUKZOUPISA-N 341.412 1.811 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N=c1nc2ccccn2[nH]1 2307143815 OJNYKLJTYSMGQW-UHFFFAOYSA-N 349.394 1.640 10 10 EDCE COCCN1[C@@H](C)CN(C(=O)C=Cc2ccc(O)c(O)c2)C[C@H]1C 2308005720 BJQPOOMQPXHRLF-OKILXGFUSA-N 334.416 1.679 10 10 EDCE Cc1ccc(CN2C[C@@H](O)C[C@H]2C(=O)O)c(O)c1Br 2352678044 FAXJJDMWFRTNGM-UWVGGRQHSA-N 330.178 1.483 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@H](C)O1 54786341 XHJRBBDKAQVXLS-GJZGRUSLSA-N 333.432 1.842 10 10 EDCE Cc1cc(C(=O)NC[C@H]2CN(C)CCO2)c(C)n1-c1ccccn1 171287357 TZSFOGCMNMVMIM-HNNXBMFYSA-N 328.416 1.550 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(F)(F)[C@@H](CO)C3)cc2N1 404049556 XQMQKBQHGAWHTM-MRVPVSSYSA-N 343.286 1.380 10 10 EDCE CN(C)C(=O)CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 174676203 LIDKNIRKZJSDDL-KRWDZBQOSA-N 347.459 1.739 10 10 EDCE COCCc1cc(NC(=O)NCc2ccc(N(C)C)cc2)n(C)n1 128021778 ZYHSOLAVVQFSFD-UHFFFAOYSA-N 331.420 1.997 10 10 EDCE CN[C@@H](C)c1ccc(N2CCN(S(C)(=O)=O)CC2)cc1Cl 78927754 GMVGHILRUFFOAE-NSHDSACASA-N 331.869 1.702 10 10 EDCE C[C@H](Nc1cncc(OCCO)n1)c1ccc(N2CCOCC2)cc1 131859007 ZCQHVWFGNLFIDS-AWEZNQCLSA-N 344.415 1.857 10 10 EDCE CC(=O)N1CSC[C@@H]1C(=O)NCc1ccc2c(c1)CCCN2C 132920517 YCMSVIIQLGIPCW-MRXNPFEDSA-N 333.457 1.607 10 10 EDCE COC[C@H](O)CCNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255397217 VFTGKBCQESOVOQ-DANOYGIBSA-N 334.416 1.050 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@H]2CNC[C@H]2O)c1C 262382353 XDYBWDKWOADTJS-MAUKXSAKSA-N 327.428 1.713 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnn(CCF)c3)CC2)cc1 287214892 HEDLZZWVXDYHMV-UHFFFAOYSA-N 332.379 1.824 10 10 EDCE Cc1ccc(CN(C)C[C@H](O)CC(=N)NO)c(O)c1Br 2380785650 CVQHHNDCFWQWCF-SNVBAGLBSA-N 346.225 1.602 10 10 EDCE O=C(CN1CCN(Cc2cc(Cl)c(F)cc2O)CC1)NC1CC1 295055158 ZJTLGTWUFSHDGK-UHFFFAOYSA-N 341.814 1.581 10 10 EDCE Cn1cc(CN2CCN(Cc3cc4c(cc3O)CCC4)CC2)cn1 729988134 AQLFUYQHTPWFCF-UHFFFAOYSA-N 326.444 1.932 10 10 EDCE CC(C)(CC(N)=O)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588443548 IIENHGYWBMCGST-YVMONPNESA-N 331.416 1.307 10 10 EDCE C[C@H](NC1CC(CC(N)=O)C1)c1ccc(N2CCOCC2)c(F)c1 903261709 VOUASNKSNHASEA-OPFPJEHXSA-N 335.423 1.967 10 10 EDCE CC1(C)COCCN1CCNC(=O)NCc1c(O)cccc1F 916619864 RRVVQNQDJKKNIT-UHFFFAOYSA-N 325.384 1.441 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CNCC[C@H]2C)cc1 846173855 UQDFRYSBYQGHGA-PBHICJAKSA-N 334.464 1.771 10 10 EDCE COc1cccn2c(=O)n(CN(C)Cc3ccc(N(C)C)cc3)nc12 841674807 QGRYOGFSGNHDSV-UHFFFAOYSA-N 341.415 1.660 10 10 EDCE COCc1cc(O)ccc1NS(=O)(=O)c1ncn(C)c1Cl 840914580 CEEGRPHSTWYEQS-UHFFFAOYSA-N 331.781 1.726 10 10 EDCE C[C@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@H]1CCCO1 918906555 PGRKCYJKDCAPCF-MAUKXSAKSA-N 331.460 1.870 10 10 EDCE CN(Cc1ccccc1O)C(=O)NC1CCC(N2CCNCC2)CC1 841996351 SJPPTEUIBYPUIQ-UHFFFAOYSA-N 346.475 1.750 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCNC[C@@H]1C(F)F 844225181 ZYHFPUMBSXLKIP-OAHLLOKOSA-N 340.418 1.250 10 10 EDCE C[C@H](NC(=O)NC[C@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(N(C)C)cc1 922055996 VLRRMXUYWZPXPO-JFOHDYCDSA-N 333.432 1.917 10 10 EDCE Cn1cc(C[C@@H]2CCC[C@H]2NC(=O)C(=O)Nc2ccc(N)cc2)cn1 850849859 KZMYUTHVIRHWTK-XJKSGUPXSA-N 341.415 1.468 10 10 EDCE Nc1ccc(CCNC(=O)[C@@H](C[C@@H]2COCCO2)C(F)(F)F)cc1 851632794 WSTPUIBQKSYNQE-ZIAGYGMSSA-N 346.349 1.912 10 10 EDCE COc1cc(C)cc(CN2CCN(S(C)(=O)=O)[C@H](C)C2)c1O 853564457 OHYBNVDSVBHTQS-GFCCVEGCSA-N 328.434 1.175 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@](C)(CN)CO 1952204542 MCEQJXGNWBSHNS-RHSMWYFYSA-N 340.420 1.491 10 10 EDCE CCO[C@@H](CS(=O)(=O)Nc1ccc(O)cc1C(=O)OC)C1CC1 863407198 PPSYZRJOXAXQGR-AWEZNQCLSA-N 343.401 1.736 10 10 EDCE CO[C@@H](c1ccc(O)c(O)c1)[C@H](NC(=O)OC(C)(C)C)C(=O)O 1952306011 HBJSJMIUJDXDSS-RYUDHWBXSA-N 327.333 1.763 10 10 EDCE CCN1C[C@H](S(=O)(=O)NCc2cc(Cl)ccc2O)CC1=O 867463901 UIJMMOCAUPUZIM-LLVKDONJSA-N 332.809 1.086 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccn4nccc4n3)CC2)cc1 899940127 GVUSPYAGORJNOG-UHFFFAOYSA-N 337.383 1.700 10 10 EDCE COCCNCc1ccc(N(C)[C@H](C)C(N)=O)c(Br)c1 711090082 KXMUHBPFGLZMFH-SNVBAGLBSA-N 344.253 1.495 10 10 EDCE CN(C)CCN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 92775911 UBOBNDBGAYECIN-GFCCVEGCSA-N 327.226 1.399 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)CNC(C)=O)C2)cc1C 1264413520 SGXMJKAZXQPEPT-WKILWMFISA-N 333.432 1.124 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H]2C[C@H]2C2CC2)cc1C 1268329519 VIKOCQFTFHTQPA-IXDOHACOSA-N 332.444 1.616 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@](O)(C(F)(F)F)C2)cc1 1466859365 BBDJUOTUWABFAF-LBPRGKRZSA-N 330.266 1.988 10 10 EDCE COC(=O)[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)[C@@H]1CCOC1 1472399019 GMSLWJWRORUKSZ-YPMHNXCESA-N 348.359 1.405 10 10 EDCE COCc1nocc1C(=O)N(C)CCNCc1ccc(OC)c(C)c1 1713654019 DXLWMOBYJMVDOX-UHFFFAOYSA-N 347.415 2.000 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCc3nnc(O)n3C2)c1 1631542338 HUBARQCLUMAHSQ-VHSXEESVSA-N 332.360 1.138 10 10 EDCE NC(=O)[C@@H](CNC(=O)Cc1ccc(O)c(O)c1)Cc1ccc(F)cc1 1631222241 GVRWWXYECBIHRF-CYBMUJFWSA-N 346.358 1.240 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)CN2CCCC2=O)cc1C 1725086527 ZWXQGMQOCGSCSH-HUUCEWRRSA-N 347.459 1.609 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@H]2CCC(=O)N2C)cc1C 1569012184 PAVKDLJAZWBQOU-HIFRSBDPSA-N 333.432 1.219 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ncccc2C)cc1C 1732638864 XBDZQJQPLFSFGP-INIZCTEOSA-N 343.427 1.588 10 10 EDCE O=C(Cn1cnc2sccc2c1=O)N1Cc2cccc(O)c2C1 1587929145 XGFCSMNNBKGPOX-UHFFFAOYSA-N 327.365 1.706 10 10 EDCE Nc1ccc(Cc2ccc(NC(=O)[C@H](N)CCC(=O)O)cc2)cc1 1866015981 FSRFYKMJNQOWSJ-MRXNPFEDSA-N 327.384 1.990 10 10 EDCE COc1ccc(CN[C@@H]2COC[C@H]2NC(=O)OC(C)(C)C)c(O)c1 1944917137 IGMOLTXQJSASFP-ZIAGYGMSSA-N 338.404 1.783 10 10 EDCE CN(C)C[C@H]1COC[C@H]1NCc1c(O)cccc1Br 2141464611 KRODOBZNEDFSTM-GXFFZTMASA-N 329.238 1.821 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NCCc1ccc(O)c(O)c1 1944566913 RKDZUFZXAKEJRA-CHWSQXEVSA-N 338.404 1.522 10 10 EDCE CNCc1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)c(Br)c1 2146308619 BNSFXKLDBVKOSY-GJZGRUSLSA-N 341.249 1.350 10 10 EDCE O=C(O)[C@@H]1CO[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@@H]21 2160867878 NTAAJOKAOVCWDP-NQBHXWOUSA-N 342.189 1.686 10 10 EDCE O=C1NC[C@@]2(CCCN(Cc3cc(Br)ccc3O)C2)N1 2177676329 LCJNFQHRQQMECM-CQSZACIVSA-N 340.221 1.802 10 10 EDCE CC(C)NCc1ccc(N2CC[C@H](O)[C@@H](O)C2)c(Br)c1 2188625974 BAQIQMJIKMZBET-GJZGRUSLSA-N 343.265 1.879 10 10 EDCE C[C@H](N)c1ccc(N2CCN3CCOC[C@@H]3C2)c(Br)c1 2185896129 LIEOMHVDZLMSQC-AAEUAGOBSA-N 340.265 1.990 10 10 EDCE CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(N)cc2)cc1 36283899 SFNOHDDACDKDRC-UHFFFAOYSA-N 326.399 1.473 10 10 EDCE N[C@H]1[C@H]2C[C@@H](CN(Cc3c(O)cccc3Br)C2)[C@@H]1CO 2239338548 PNJYODBWJQUOOZ-OUCVZQCGSA-N 341.249 1.542 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1CC[C@@H](O)CN1C(=O)OC(C)(C)C 2246452971 ZKLWYNSXAKJOLM-NEPJUHHUSA-N 341.412 1.906 10 10 EDCE O=C1C(=Cc2ccc(F)cc2)SC(=S)N1CCS(=O)(=O)O 2293223798 SQDXDXYMKRCTCF-UHFFFAOYSA-N 347.414 1.915 10 10 EDCE CSc1ncc(CNc2cccc(N)c2S(N)(=O)=O)s1 2284697994 HSOLLEQRUCKOQT-UHFFFAOYSA-N 330.460 1.707 10 10 EDCE C[C@H](NC(=O)C=Cc1ccc(O)c(O)c1)C(=O)NCc1ccccc1 2307986572 JTOGBAVVOBHFJF-ZDUSSCGKSA-N 340.379 1.932 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3[C@H](C2)CS3(=O)=O)cc1Br 2336301935 ANQGACYVPZEIQE-PRHODGIISA-N 349.225 1.280 10 10 EDCE CN[C@@H](C)c1ccc(N2CC([C@H](O)CO)C2)c(Br)c1 2336781726 YFJGOYDBBVHRAN-LKFCYVNXSA-N 329.238 1.519 10 10 EDCE Cc1ccc(CN[C@H]2[C@H]3CS(=O)(=O)C[C@H]32)c(O)c1Br 2352947170 GUHWONWCLBIHLH-PEGIJTEDSA-N 346.246 1.596 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H](O)[C@H]3C4)c(Br)cc2[C@H]1O 2355623294 FTYCVHZLBYNCJY-YRWCUGRBSA-N 339.189 1.394 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN(CCO)[C@H](C)C2)c([N+](=O)[O-])c1 189395256 HUYRTQICBYXZEX-DIECRNLCSA-N 349.387 1.284 10 10 EDCE CS(=O)(=O)[C@@H]1CSCCN1c1ccc(CNC2CC2)cc1 90923207 FFPWAYGNQZJFBS-OAHLLOKOSA-N 326.487 1.863 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCO[C@H](C2CC2)C1 368889124 OSDUAYLZVDNFSO-SFHVURJKSA-N 331.460 1.822 10 10 EDCE Cc1cc(O)c(CNC[C@H]2CCC[C@@]23NC(=O)N(C)C3=O)cc1C 371083681 DDNYYJLYGIYHMF-RDTXWAMCSA-N 331.416 1.819 10 10 EDCE Cc1cc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)no1 283100772 HIUWHYYQNWQPTI-UHFFFAOYSA-N 348.378 1.463 10 10 EDCE C[C@H](NC(=O)C(=O)N(C)CC1CC1)c1ccc(N2CCOCC2)cc1 803297631 BMPKSIYFBCQNEC-AWEZNQCLSA-N 345.443 1.569 10 10 EDCE Cc1ccc(CNc2nccnc2C(N)=O)c(O)c1Br 2380754255 OJTWXFBUHVJHND-UHFFFAOYSA-N 337.177 1.964 10 10 EDCE CS(=O)(=O)N1CCCC[C@@H]1CNCc1cccc(Cl)c1O 809709376 AJWDUKHFNNBHMD-GFCCVEGCSA-N 332.853 1.949 10 10 EDCE C[C@@H]1C[C@H](C(=O)O)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 398838345 JIBJLUVHODPBII-BDAKNGLRSA-N 335.316 1.473 10 10 EDCE CC[C@@H]1C[C@H]1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 822621105 IAKRCZSRNOBWQT-GDBMZVCRSA-N 336.457 1.584 10 10 EDCE C[C@@H]1Oc2ccc(N)cc2N(OCCOc2ccc(N)cc2)C1=O 821298064 AIVWPVNHCDMXIS-NSHDSACASA-N 329.356 1.976 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC3=CCCC3)C2)cc1 830482304 RGJDJXSPFCVVPS-HNNXBMFYSA-N 343.427 1.617 10 10 EDCE COC(=O)[C@@H]1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 741091071 WSBPXYIMNQLAIU-OAHLLOKOSA-N 329.400 1.767 10 10 EDCE COCc1cc(O)ccc1NS(=O)(=O)c1cnn(CC2CC2)c1 840917267 JOIWDLPTMYKDJU-UHFFFAOYSA-N 337.401 1.946 10 10 EDCE O=C(NCc1c(O)cccc1F)c1ccnc(N2CCOCC2)n1 928712990 ZFVXOSBVLYRYQO-UHFFFAOYSA-N 332.335 1.088 10 10 EDCE c1cc(N2CCOCC2)ccc1CNC[C@@H]1CCN1C1CCOCC1 922952407 YDMXIEBYIHNBPR-FQEVSTJZSA-N 345.487 1.866 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCO[C@H]([C@@H](C)O)C2)cc1 840263419 QLIBOAOXJKWKRS-PBHICJAKSA-N 335.448 1.824 10 10 EDCE COCCC1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 850684591 DISAROYJFIPALY-UHFFFAOYSA-N 333.432 1.206 10 10 EDCE CC(C)[C@H](N)CCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 851690236 CFJDEBFNJVDKHW-MRXNPFEDSA-N 334.464 1.201 10 10 EDCE CCS(=O)(=O)C1(CNC(=O)NCCc2ccc(N)cc2)CC1 851662854 LXXFHVPPBQZVJI-UHFFFAOYSA-N 325.434 1.078 10 10 EDCE CN1C[C@H](CCNC(=O)NCc2cc(Cl)ccc2O)CC1=O 924757845 WEHZGAIHZAFJAY-SNVBAGLBSA-N 325.796 1.713 10 10 EDCE COc1ccc(N2CCC(NC(=O)N(C)CC3CN(C)C3)CC2)cc1 853643456 HIVBKSRZWFCDLB-UHFFFAOYSA-N 346.475 1.867 10 10 EDCE C[C@@H](C(=O)NCc1ccc2cccnc2c1O)N1C(=O)CCC1=O 862028882 NQVRGABVYIFKIY-JTQLQIEISA-N 327.340 1.094 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCN[C@H]1C 861813398 OVWQPVZIMGYQGK-WMLDXEAASA-N 346.475 1.356 10 10 EDCE Cc1cc(N(C)C)ccc1CNC[C@@]1(CO)COCC2(CCC2)N1C 862463932 OYGLMEBCPADJJB-HXUWFJFHSA-N 347.503 1.766 10 10 EDCE Cn1cc(C[C@H](O)C(=O)NCc2ccc(N3CCCC3)cc2)cn1 786764825 UEEKGDNCPRGDKD-KRWDZBQOSA-N 328.416 1.240 10 10 EDCE COc1ccc(N2CCN(C(=O)Nc3cc(OC)nn3C)CC2)cc1 881246026 ITYNTQGSUPSOKL-UHFFFAOYSA-N 345.403 1.791 10 10 EDCE COc1cc(C)cc(CN2CCC[C@@H](CS(N)(=O)=O)C2)c1O 894016668 HRUOQMHIDYIKOH-GFCCVEGCSA-N 328.434 1.210 10 10 EDCE C[C@@H]1CO[C@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 895780345 HWVSNGGHJJVDCF-KSSFIOAISA-N 332.444 1.937 10 10 EDCE COc1cccc(CNC(=O)C[C@@H]2NC(=O)c3ccccc32)c1O 1137473456 KAOGSPRHQNRNKR-AWEZNQCLSA-N 326.352 1.892 10 10 EDCE C[C@@H]1C[C@H]1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1257235004 XQXBLGAFMAJCNR-KBMXLJTQSA-N 346.427 1.672 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOCC[C@H]2C)cc1 1335431867 IIDQGNJSPIFJKS-OAHLLOKOSA-N 347.459 1.786 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](NC(=O)CCCF)C2)cc1 1352921320 SMAVOMRXJXFPOL-ZDUSSCGKSA-N 349.366 1.929 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CC[C@H](C(F)(F)F)NC1=O 1471661626 VQMVWSRDEQNSAY-MWLCHTKSSA-N 332.278 1.171 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H](CO)CC2OCCO2)cc1 1471650441 SPFJKEJYMKJQIT-MRXNPFEDSA-N 344.411 1.948 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2C[C@H]2C(N)=O)cc1C 1714754092 YBDYQGXHBSIMGU-YUELXQCFSA-N 333.432 1.062 10 10 EDCE CN1C(=O)CCc2cc(C(=O)NCc3ccc(O)cc3O)ccc21 1626838206 RMKMHQKBQJKIND-UHFFFAOYSA-N 326.352 1.937 10 10 EDCE COCCCN(C)CCn1c(C)nnc1N(C)Cc1ccccc1O 1555484898 ZJDIHJIALHFUCW-UHFFFAOYSA-N 347.463 1.897 10 10 EDCE COCCn1cc(C(=O)NCc2ccc3cccnc3c2O)cn1 1639624840 MHWQLHYRNBCIEK-UHFFFAOYSA-N 326.356 1.713 10 10 EDCE COC(=O)C[C@](C)(NC(=O)Cc1ccc(O)c(O)c1)c1ccccn1 1567909672 IHUSXQRSABRXOF-SFHVURJKSA-N 344.367 1.630 10 10 EDCE O=C(Cn1cccc(C(F)(F)F)c1=O)NCc1ccc(O)cc1O 1639441341 QUZNWVZMCAXLTN-UHFFFAOYSA-N 342.273 1.595 10 10 EDCE CSc1ncc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(O)n1 1567467961 WQLJJYDNOSSXMY-MRVPVSSYSA-N 335.385 1.676 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(CN2CCCCC2=O)CC1 1565944356 ZKACALZZOATCCQ-UHFFFAOYSA-N 346.427 1.891 10 10 EDCE COC1CCN(c2ccc(CN[C@H](C)c3nnnn3C)cc2)CC1 1648541329 WONRHEIQPPRODN-CYBMUJFWSA-N 330.436 1.676 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)C(=O)NCC2CC2)cc1C 1666640138 BWBRHHFHKQXLOJ-CYBMUJFWSA-N 347.459 1.372 10 10 EDCE Cc1c(OCc2ccc(N)cc2)c(=O)ccn1CCN1CCOCC1 1857909828 NPDCJKXWCUQCAY-UHFFFAOYSA-N 343.427 1.650 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@]1(NC(=O)OC(C)(C)C)CCOC1 1900613021 RHWYJFRZUYVQFE-AWEZNQCLSA-N 327.385 1.829 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)c1ncc(Br)cn1 111786687 URWPIAUHNDITCS-UHFFFAOYSA-N 336.193 1.313 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@](C)(O)CN 1951699902 SIONKVFYRBKJFD-CZUORRHYSA-N 326.393 1.243 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1CNC(=O)C1 1951702656 ZWQLTRJJWWOLAG-VXGBXAGGSA-N 336.388 1.670 10 10 EDCE C[C@H](N[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)c1cc(O)ccc1O 2011487733 PACGBUPNGYPWKC-VZJVUDMVSA-N 338.404 1.729 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1CCc2nncn2C1 2159981542 IZBRHDZJPSZBSY-SNVBAGLBSA-N 341.184 1.990 10 10 EDCE NCc1ccc(N2CCN(CCCO)CC2)c(Br)c1 2113620251 SVOQJNXGABGRFW-UHFFFAOYSA-N 328.254 1.412 10 10 EDCE COc1ccc(Br)c(CN2CCNC[C@H]2C(=O)O)c1O 2236031606 HZFZGPKIDMYLMX-JTQLQIEISA-N 345.193 1.022 10 10 EDCE COc1ccc(Br)c(CNCCCNC(N)=O)c1O 2227748994 DDGANTLPOYSWSR-UHFFFAOYSA-N 332.198 1.311 10 10 EDCE CC(C)(C)OC(=O)N[C@]12CO[C@](C(=O)N3CC[C@H](N=[N+]=[N-])C3)(C1)C2 2247299949 INNZOSNFTXAMQS-LKTVYLICSA-N 337.380 1.724 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cc(CN)oc2C)s1 2284692508 VUZNPESRCWFFAJ-UHFFFAOYSA-N 333.460 1.704 10 10 EDCE C[C@]1(O)Cc2ccc3c(c2C(=O)[C@H]1O)C(=O)c1cccc(O)c1C3=O 104579454 ZGIMJLWQWQRQNJ-MOPGFXCFSA-N 338.315 1.018 10 10 EDCE COc1ccc(N2CCN(C(=O)CSC(=N)NC3CC3)CC2)cc1 29582097 VDQUOCOALHKJMJ-UHFFFAOYSA-N 348.472 1.764 10 10 EDCE 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O=C1CN(Cc2ccccc2O)C(=O)N1[C@@H]1CCc2nc[nH]c2C1 819168943 DHKXNRYEYRLVCJ-GFCCVEGCSA-N 326.356 1.437 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1cc([C@H]2CCCNC2)nn1 900600771 KJBHJCLMRQDGAM-INIZCTEOSA-N 327.432 1.630 10 10 EDCE Cc1cc(CC(=O)N2CC[C@H](NC(N)=O)C2)c(C)n1-c1ccccc1 831450376 VVASBWPNUVMICD-INIZCTEOSA-N 340.427 1.906 10 10 EDCE O=C1C[C@H](CCNC(=O)NCc2ccc(N3CC=CC3)cc2)CN1 919917086 CEVMOELYVUWFNO-HNNXBMFYSA-N 328.416 1.388 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@@H]3C[C@H]2C[S@@]3=O)c([N+](=O)[O-])c1 845735576 YBPNPXNUIDDWJB-WKMVKVCNSA-N 336.369 1.491 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N[C@H]1CNCCC1(F)F 841832004 KQGVXHIPJIIZOE-HNNXBMFYSA-N 336.386 1.859 10 10 EDCE COC(=O)CNC(=O)[C@H]1CCCN1C/C=C\c1ccc(N(C)C)cc1 841892344 GZRLEBZORGVIDM-XQDHMALISA-N 345.443 1.519 10 10 EDCE COc1cc(CN2CCS(=O)(=O)[C@H]3CCC[C@H]32)c(O)cc1C 840146515 PXZPYNUEPDAOOD-CJNGLKHVSA-N 325.430 1.861 10 10 EDCE CCN1CC[C@H]1CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 925094715 CIYQYEXATKABOJ-ZDUSSCGKSA-N 337.807 1.904 10 10 EDCE CO[C@@H](C)CC(=O)NCc1cc(NC(=O)C[C@H](C)OC)ccc1O 923123813 PWEVMXBSIGXCER-RYUDHWBXSA-N 338.404 1.797 10 10 EDCE Cn1ccnc1CN1CCC(C(=O)NCc2c(O)cccc2F)CC1 928706130 RJECDBBXFYSFQC-UHFFFAOYSA-N 346.406 1.793 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)[C@H]4CSCN4C3=O)C2)cc1 924976533 BZBDSYYMLJODNB-TZMCWYRMSA-N 333.413 1.611 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)[C@@](C)(C(=O)OCC(=O)C(C)=O)C1 859989678 YJXMPSHAANJEMX-BDJLRTHQSA-N 343.376 1.102 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCn3c(O)nnc3C2)cc1 853457117 SNCHLVNALPNGSP-UHFFFAOYSA-N 344.419 1.555 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H](C)O[C@@H](CO)C3)C2)cc1 854299099 LEAYYVREBIYVDG-GRDNDAEWSA-N 349.431 1.065 10 10 EDCE COC[C@H](NCC(=O)NCc1ccc(N(C)C)cc1)C1CCOCC1 852321350 MBYHTUQPFOYZSZ-SFHVURJKSA-N 349.475 1.400 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCn4ccnc43)C2)cc1 852360651 JOMKCORODPIPTD-CZUORRHYSA-N 341.415 1.915 10 10 EDCE CO[C@@H]1CCn2cc(C(=O)NCc3ccc(N(C)C)cc3)nc2C1 864573883 SZAPLNFJUOAPMT-OAHLLOKOSA-N 328.416 1.840 10 10 EDCE COC(=O)c1ccc(CC(=O)NCc2ccc(N(C)C)cc2)cn1 864573304 JGHREOZHKFINRR-UHFFFAOYSA-N 327.384 1.793 10 10 EDCE C[C@@H]1CC[C@H](O)CN1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 889659276 SZXHDAMNJZZDBI-QAPCUYQASA-N 346.475 1.493 10 10 EDCE C[C@@H](NCc1ccc(Br)cc1O)c1nnc(O)n1C 895172581 ROCLWMFTGBVGJE-SSDOTTSWSA-N 327.182 1.840 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@](C)(O)Cn2ccccc2=O)c1 790649564 HKGFUIVOKZTYAD-KZULUSFZSA-N 346.383 1.191 10 10 EDCE Cc1cnc2nc(C(=O)NCc3ccc4cccnc4c3O)nn2c1 1142730650 CELIWAFRYDKBPV-UHFFFAOYSA-N 334.339 1.617 10 10 EDCE CN1CCC(CNCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 896053424 FLKHLKDVICXAKR-UHFFFAOYSA-N 344.503 1.820 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@@H](C)NC(N)=O)cc1C 1317240801 IPMRDCGJLALBDG-OLZOCXBDSA-N 336.436 1.045 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)C(C)(C)C(N)=O)C2)cc1C 1316617100 FXYXBKUVZFFLMO-GASCZTMLSA-N 347.459 1.500 10 10 EDCE NS(=O)(=O)C1(CNCc2ccc(Br)cc2O)CC1 713946763 ASQVXWRBXKOEFB-UHFFFAOYSA-N 335.223 1.065 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CNC(=O)C2CC2)cc1C 1274686085 IMHITBFPJNIWPF-CYBMUJFWSA-N 333.432 1.124 10 10 EDCE CC(C)N1CC(CCO)(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1276108979 TVJAMFKBZLZFAT-UHFFFAOYSA-N 333.392 1.424 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccnc4[nH]cnc34)CC2)cc1 1445734390 LASPROHJLFLVCB-UHFFFAOYSA-N 337.383 1.929 10 10 EDCE CCn1ncc(C(=O)N[C@@H](C)[C@H](C)NCc2ccc(OC)c(C)c2)n1 1282124786 QGNDSJMABFYYPG-KBPBESRZSA-N 345.447 1.912 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CC(=O)N(C3CC3)C2)cc1 1295543873 IZMPAJZPVGVZCC-SNVBAGLBSA-N 329.360 1.590 10 10 EDCE COc1ccc(CNC(=O)Cc2ccc(O)c(O)c2)c(OC)c1OC 1464063384 DDPOQHQPAMSVNI-UHFFFAOYSA-N 347.367 1.983 10 10 EDCE CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(C)c(O)c1O 1466866438 OUOKNLLSBQUBBZ-AWEZNQCLSA-N 328.368 1.493 10 10 EDCE CN1C(=O)[C@H](/N=N/[C@@H]2CCC[C@H]([N+](=O)[O-])C2)[C@H](O)[C@@H]2CCCC[C@@H]21 1615013323 IWFZIMAGKPMOOH-LWDLVEIRSA-N 338.408 1.787 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@H](NC(=O)OC)C2)c([N+](=O)[O-])c1 1472874900 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JDISGGVJWOBXOJ-MNOVXSKESA-N 344.205 1.731 10 10 EDCE Cc1ccc(CN(C)C(=O)C2(CO)CNC2)c(O)c1Br 2380764755 HGYGWJZEUPIMEY-UHFFFAOYSA-N 343.221 1.003 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H](CO)C[C@@H](O)C(C)(C)C)cc1 284693377 HCCNOOLUYOSYEI-GDBMZVCRSA-N 337.464 1.710 10 10 EDCE CCOC(=O)C1(C(=O)NCc2ccc(OC)cc2O)CCOCC1 803292193 LAQXDZCKMNQMAV-UHFFFAOYSA-N 337.372 1.377 10 10 EDCE COC(=O)C[C@@H]1C(=O)NCCN1Cc1cc(Cl)c(F)cc1O 294936102 PCUKEBIKRRDTRA-LLVKDONJSA-N 330.743 1.048 10 10 EDCE Nc1ccc(OCCCON2C(=O)COc3cc(N)ccc32)cc1 821299108 HQQGYLWPRPTAIN-UHFFFAOYSA-N 329.356 1.977 10 10 EDCE COc1ccc(N2CCN(C(=O)C34CCN(CC3)C4)CC2)cc1F 901000290 ZZJUXQJZOWBEAE-UHFFFAOYSA-N 333.407 1.579 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@H](N)C(C)(C)C1 903715111 BBSYNUKEPRXPSR-INIZCTEOSA-N 346.475 1.297 10 10 EDCE CC(C)N1CCC([C@@H]2C[C@H]2CNC(=O)c2cc(O)nc(O)c2)CC1 585509672 ZPBATAGAJOBQTO-GJZGRUSLSA-N 333.432 1.979 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@]3(C)C[C@H](O)CN3C)C2)cc1 911277004 QLTDDMUESKHTMY-SIXWZSSISA-N 347.459 1.093 10 10 EDCE NC1(CNC(=O)NCc2cc(Br)ccc2O)CCC1 841966682 FNYJDZJTALMGPL-UHFFFAOYSA-N 328.210 1.835 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CCCN2C(C)=O)cc1 844853335 VUJUOPOSTAUYIZ-KRWDZBQOSA-N 333.432 1.601 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCc1cnn(C)n1 840372946 GLHVZWWKOHWWJQ-CYBMUJFWSA-N 330.436 1.620 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CCCN2CCSC[C@H]12 928088307 GGMYPXTVVGQTSG-GNXSNYGWSA-N 334.441 1.807 10 10 EDCE CC(=O)C(=O)C1(O)[C@H]2CCC[C@H]1CC(NC(=O)OC(C)(C)C)C2 2244161120 XHEJEFJABZUXHY-LZSIIWAZSA-N 325.405 1.979 10 10 EDCE CO[C@@]1(CO)CCCN(C(=O)NCCCSc2nccs2)C1 853855765 FUDSTTYCXRYSMS-AWEZNQCLSA-N 345.490 1.808 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3nnc(C)o3)C2)cc1 853487021 HIUPFYWDULYTTK-GFCCVEGCSA-N 331.376 1.465 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@](C)(O)C(C)C)C2)cc1 854301837 UWRMYBGSJUODKZ-KBXCAEBGSA-N 335.448 1.980 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NOC[C@@H]3CCOC3)C2)cc1 852273764 HHRXOONGIAYZQY-ZIAGYGMSSA-N 335.404 1.541 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](CN(C)C)C3)C2)cc1 854298631 HGIZYOFETQPRTG-CVEARBPZSA-N 346.475 1.867 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCC(CO)(CO)C1 853412131 UJSIOAZCEFXULK-UHFFFAOYSA-N 333.432 1.173 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3n[nH]c4c3CNCC4)C2)cc1 852844367 TUKRDFLGPSYYBR-LBPRGKRZSA-N 341.415 1.073 10 10 EDCE C[C@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H](C)C1O 852501938 YESFFYBBBVWLMI-GJZGRUSLSA-N 333.476 1.660 10 10 EDCE COC1(OC)CCN(Cc2cc(F)cc(C(C)=O)c2O)C[C@H]1O 931638604 GXMHQFVRSNWSOB-CQSZACIVSA-N 327.352 1.290 10 10 EDCE CO[C@@H](CS(=O)(=O)N[C@H](C)c1ccccc1O)C1CCOCC1 867834710 KSHUSFGSRMEDIS-WBMJQRKESA-N 343.445 1.814 10 10 EDCE CCN(C)c1ccc(CN2CCC[C@@H](CS(=O)(=O)NC)C2)cc1 860194821 YGABQXFJTVRYOJ-MRXNPFEDSA-N 339.505 1.904 10 10 EDCE Cc1cc(C(=O)NC[C@@H](O)[C@H]2CCCO2)c(C)n1-c1ccccn1 862652371 XRFVCRALZZBOPM-HZPDHXFCSA-N 329.400 1.759 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3cc(OC)n[nH]3)C2)cc1 861379850 PLMNDTIYRMMENJ-LLVKDONJSA-N 331.376 1.827 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@]12CCOC2 1118063658 KUIGCFMNOUMDDF-GOSISDBHSA-N 331.416 1.598 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCO[C@@H]3C)CC2)cc1 770721833 AMAPTGGXLMLDQE-QAPCUYQASA-N 347.459 1.358 10 10 EDCE COC(=O)[C@H]1C[C@@H]2C[C@H](NC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H]2C1 888465257 FLBSLHCNTCARQM-QGKZYCRSSA-N 331.368 1.815 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2C[C@H](C)Cn3nccc32)c1 893889416 AAGUYTNAMLSPGD-MVZIDQBPSA-N 325.372 1.334 10 10 EDCE CN(C)C(=O)/C=C/C(=O)NCc1cccc(Br)c1O 1139975075 STVRFFKVODOQBH-VOTSOKGWSA-N 327.178 1.415 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN(c2ncc[nH]2)CC1 897578292 OKTIRTXRVOULGZ-UHFFFAOYSA-N 344.396 1.998 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H](O)CC(F)(F)C1 787361231 QJLYNHYDJJXATO-HNNXBMFYSA-N 341.402 1.413 10 10 EDCE COc1cc(Cl)cc(CN[C@@H]2C(=O)NCC23CCOCC3)c1O 895773043 XVEPFJUKKATICV-CQSZACIVSA-N 340.807 1.439 10 10 EDCE CCOc1cc(O)ccc1NS(=O)(=O)c1c(Cl)cnn1C 797432152 OWXGMJGJWQZZSW-UHFFFAOYSA-N 331.781 1.979 10 10 EDCE COc1cc(C)cc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)c1O 795649596 FAODTWUNGZHPNN-AWEZNQCLSA-N 342.461 1.565 10 10 EDCE CCOC(=O)[C@@H]1CC[C@H](NC(=O)NCc2cc(OC)ccc2O)C1 798109627 XSJHDXYTNOHETC-YPMHNXCESA-N 336.388 1.932 10 10 EDCE O=C1Nc2cc(N3C[C@H](F)[C@H](F)C3)c(Br)cc2[C@@H]1O 714602277 ASXBZMDKAACEMM-RNSXUZJQSA-N 333.132 1.931 10 10 EDCE O=S1(=O)C[C@@H]2C(CNCc3c(O)cccc3Br)[C@H]2C1 2117986031 QXIOLUUXQHPBDW-GHMZBOCLSA-N 346.246 1.535 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C 1331950364 LRAQAKMBCJLRJI-MQFWEAQZSA-N 347.411 1.980 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCO[C@@H](C)CC1 1332866557 MEARXZIMXSBZCH-AWEZNQCLSA-N 333.432 1.315 10 10 EDCE COCCn1c([C@@H]2CCC(=O)N2)nnc1N(C)Cc1ccccc1O 1343250272 YWVJDZUCFXTLGW-ZDUSSCGKSA-N 345.403 1.218 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)Cc2cc[nH]n2)C2CC2)cc1C 1269056668 OLHRUDVXRFRXGP-QGZVFWFLSA-N 342.443 1.954 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H](C)n2cccn2)cc1C 1272371470 MABVQMODBBOBPZ-ZBFHGGJFSA-N 346.431 1.028 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCNC(N)=O 1452458726 CZJKQMVDFZEJMY-UHFFFAOYSA-N 328.372 1.305 10 10 EDCE OCC1(CO)CN(c2ccc(CNC3CC3)c(Br)c2)C1 1914989484 BFCIIPMHIIGNPZ-UHFFFAOYSA-N 341.249 1.492 10 10 EDCE O=C(CCN1C(=O)CSC1=S)Nc1ccccc1[N+](=O)[O-] 116788182 ICOXMRBVZLCAPD-UHFFFAOYSA-N 325.371 1.784 10 10 EDCE O=C1Nc2cc(N3CC[C@](F)(CO)C3)c(Br)cc2[C@H]1O 1917136830 WTDMJMNLQXYJHT-DGCLKSJQSA-N 345.168 1.345 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)Cc2ccco2)cc1C 1715610169 VRAVMERSTPFUCK-OAHLLOKOSA-N 332.400 1.406 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@H]2CCCC(=O)N2)cc1C 1714734114 VPLLMQCUOXLVTL-MRXNPFEDSA-N 347.459 1.610 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCN2CCC3(C2)OCCO3)cc1 1629963088 QKDGDJNTJLLBIZ-UHFFFAOYSA-N 347.375 1.028 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccc(F)cn2)cc1C 1717764378 PIRGHQIGTYHTTK-HNNXBMFYSA-N 347.390 1.418 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2cnn(C)c2)cc1C 1716527265 TZTQSGIWIDOWTE-UHFFFAOYSA-N 330.432 1.989 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@@H]2CC2(C)C)cc1C 1717913998 HKXMUOZHTVVENX-CVEARBPZSA-N 334.460 1.959 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1CCNC1=O 1497435710 FECHOGXPEPWACS-HNNXBMFYSA-N 333.432 1.078 10 10 EDCE CCn1cc(C(=O)N[C@@H](C)CCNCc2ccc(OC)c(C)c2)nn1 1732740802 MBQJWYFGNJCTEB-AWEZNQCLSA-N 345.447 1.913 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2coc(C)n2)cc1C 1571427459 PUMWYFIJDRLXSB-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H](C)C(F)(F)F)cc1C 1571437026 LVRWMLWNHBTOEU-YPMHNXCESA-N 348.365 1.769 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H](NCc2ccc(O)cc2O)C1 1946798611 BMQIVKDKEGPKAD-CYBMUJFWSA-N 338.404 1.823 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NCc1c(O)cccc1F 1976861424 WAAVHKFDLYZFSD-OLZOCXBDSA-N 326.368 1.913 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@H]2[C@@H](O)CO)c(Br)c1 2146333620 HLXQZBBCVVQLHF-HERUPUMHSA-N 345.237 1.027 10 10 EDCE CNCc1ccc(N2CCNC(=O)C(F)(F)C2)c(Br)c1 2146739050 MIIQFSATSPGTAP-UHFFFAOYSA-N 348.191 1.740 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCCN(CC(=O)NCCCN=[N+]=[N-])C1 2010389424 PUJDTJVUCIWZOY-LBPRGKRZSA-N 340.428 1.792 10 10 EDCE C[C@H]1CN(C)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 300556296 YVROJIKQJCNAPQ-SDBXPKJASA-N 339.237 1.541 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H](O)[C@H]3C4)c(Br)cc21 2177159340 LRDICHARJIJKQR-BNDHKUSASA-N 338.205 1.361 10 10 EDCE Cc1nnc(CCNCc2ccc(Br)cc2O)n1C 2104135646 IQYMZGOQQSQGEQ-UHFFFAOYSA-N 325.210 1.924 10 10 EDCE C[C@@H]1CCN(c2ccc(CN)c(Br)c2F)[C@H]1C(N)=O 2090256048 LKCRLEPRYZOFBT-JMCQJSRRSA-N 330.201 1.747 10 10 EDCE Oc1cc(Br)ccc1CNCC1CN(C2COC2)C1 2114711744 JFCYEUPXYBPSQY-UHFFFAOYSA-N 327.222 1.575 10 10 EDCE COc1ccc(Br)c(CN2CC[C@@H](N)[C@H](CO)C2)c1O 2236039785 DIPSCPJQUGOKON-JOYOIKCWSA-N 345.237 1.305 10 10 EDCE Nc1ccc(OCC(=O)NCCc2conc2Br)cc1 2238732832 KQNAJKVSVFRBCS-UHFFFAOYSA-N 340.177 1.757 10 10 EDCE COC(=O)C=Cc1ccc(N(C)[C@@H](C)C[S@@](C)=O)c([N+](=O)[O-])c1 2308458510 MSJSCLSYZOVYBB-BSNNYGBQSA-N 340.401 1.984 10 10 EDCE CN(C(=O)C=Cc1cncc(O)c1)c1ccc(N2CCOCC2)nc1 2308698620 XPDMUKWAQZMZKO-UHFFFAOYSA-N 340.383 1.695 10 10 EDCE C[C@@H](CCC(=O)O)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2311977681 QZEAUVOXHXLGJB-AWEZNQCLSA-N 332.400 1.906 10 10 EDCE O=C(N[C@H](CCO)COCc1ccccc1)c1cc(O)c(O)c(O)c1 2320377048 RQLYPAZFNBSIIC-CQSZACIVSA-N 347.367 1.501 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2329332505 MELQUKUGBSFLIO-IJTUBWEGSA-N 327.222 1.399 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2329329703 XNRMVXRKWXLDSE-KUCHZILPSA-N 328.206 1.433 10 10 EDCE CNCc1ccc(N2CC3(COC(=O)N3)C2)cc1Br 2351870320 DSWOKXNVECWOAK-UHFFFAOYSA-N 326.194 1.467 10 10 EDCE CN[C@H]1COCCN(Cc2ccc(C)c(Br)c2O)C1 2352948930 WMEKDTDMABRQEH-GFCCVEGCSA-N 329.238 1.883 10 10 EDCE COc1ccc(O)c(CN2CCN(c3nccc(OC)n3)CC2)c1 179677056 BAUNDFKTTUEVTH-UHFFFAOYSA-N 330.388 1.522 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@](C)(NC(C)=O)C2CC2)cc1 1269596241 LKONMMMFAAVARK-KRWDZBQOSA-N 344.419 1.065 10 10 EDCE CC1=NNC(=O)/C1=C\c1ccc(-c2ccc(S(N)(=O)=O)cc2)o1 33568263 ZVFJTHROTDCPMC-JYRVWZFOSA-N 331.353 1.483 10 10 EDCE COC[C@@](C)(CCO)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 182816167 TVTVWWHSSPUORS-MTCRFPMVSA-N 348.443 1.440 10 10 EDCE CCCN(Cc1ccccc1O)[C@@H](C)C(=O)N(C)CC(=O)NC1CC1 76073996 DFGVEVQWLPAQRW-AWEZNQCLSA-N 347.459 1.730 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@H]3CCOC[C@H]3C)nc12 277316389 DFHHHYQMIGGXLQ-MFKMUULPSA-N 334.376 1.126 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCn3cnnc3[C@H]2C)c([N+](=O)[O-])c1 276596070 CFZIGGGFEHQAKF-DUMNWFOQSA-N 343.343 1.954 10 10 EDCE CCC[C@]1(CO)CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 377154641 ZIFWCLQILKEFNZ-INIZCTEOSA-N 335.360 1.915 10 10 EDCE CCN(Cc1ccc(C)c(Br)c1O)[C@@H]1CC(=O)NC1=O 2380734278 SJORAIWMZIPNFA-SNVBAGLBSA-N 341.205 1.700 10 10 EDCE Cc1ccc(CN2C[C@@H]3CN[C@@H](CO)[C@@H]3C2)c(O)c1Br 2380800713 KTYDITCHNFSTHI-XQQFMLRXSA-N 341.249 1.475 10 10 EDCE CN(Cc1cc(Cl)c(F)cc1O)[C@@H]1CCN(S(C)(=O)=O)C1 293943953 ONRCUEYEGXYINV-SNVBAGLBSA-N 336.816 1.650 10 10 EDCE CCCN(Cc1ccccc1O)C[C@@H]1CCN(S(C)(=O)=O)C1 801518813 VCMOHBLGEOKFSX-AWEZNQCLSA-N 326.462 1.886 10 10 EDCE CN1NN=C2C1=NCC[C@@H]2C(=O)NCc1c(O)ccc2c1CCCC2 816938565 DKQVFLVCLFYODU-ZDUSSCGKSA-N 341.415 1.112 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1ncn(C(C)C)n1 845874208 YHUJEAFDEWEAJP-UHFFFAOYSA-N 344.419 1.488 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](O)C3CCC3)C2)cc1 854297244 LDSJALZFZXUMGI-YOEHRIQHSA-N 333.432 1.734 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cc3nnc(C)s3)C2)cc1 855225624 PDWJCAIXCSOBQY-LBPRGKRZSA-N 332.429 1.793 10 10 EDCE Cc1ccc(C(=O)N[C@H](C)C(N)=O)cc1-n1c(C)cc(C=O)c1C 858210613 BWEVCYOYTIRVON-GFCCVEGCSA-N 327.384 1.819 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)C[C@@]2(C)CO)c(Br)c1 698134488 AZNGAFFHKAIKCR-CHIMOYNISA-N 329.238 1.791 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2cccc(OC)c2O)C1 862550992 IYOJQLKXHLRWLQ-GFCCVEGCSA-N 328.434 1.162 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NCC[C@]1(C)CC1(F)F 1118499777 MQLSTJOOWHMEOA-OAHLLOKOSA-N 326.343 1.902 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1cc(C)ccc1O)[C@H]1CCOC1 1118821520 HLPFZEBGZSIKIX-SWLSCSKDSA-N 329.418 1.172 10 10 EDCE Cc1cc(O)c(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1Cl 1118640670 NPTHHPWZDMBGOO-HNNXBMFYSA-N 345.848 1.744 10 10 EDCE C[C@@H](C(=O)N(C)CC(=O)N1Cc2cccc(O)c2C1)n1cccn1 871201666 YCDHNECQSAWRHC-LBPRGKRZSA-N 328.372 1.151 10 10 EDCE CC(=O)N/C(=C\c1ccccc1)C(=O)NCc1cc(O)ccc1O 1153879362 LVJZQNMXHGVFGF-SXGWCWSVSA-N 326.352 1.891 10 10 EDCE CC(=O)c1cc(F)cc(CN2CC[C@@H](c3cc(O)nc(O)n3)C2)c1O 1307891822 XKOXQMZVXKLQQM-SNVBAGLBSA-N 347.346 1.925 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2ccc(O)nn2)cc1C 1319154607 PBGNKXWMZYIAJT-LBPRGKRZSA-N 344.415 1.655 10 10 EDCE O=C(C(=O)N1CCOC2(CCCCC2)C1)N1Cc2cccc(O)c2C1 1329408865 DJGSWEXVGGCXEV-UHFFFAOYSA-N 344.411 1.796 10 10 EDCE Cc1cccc(CNC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c1O 715577045 YXVNAJYISAGHEF-UHFFFAOYSA-N 335.404 1.265 10 10 EDCE COc1ccc(CNC[C@H]2C[C@H](NC(=O)C(C)(C)C(N)=O)C2)cc1C 1276995403 FQKKXDOELKPCDO-SHTZXODSSA-N 347.459 1.500 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCOC[C@H]1C[C@@H](O)c1ccco1 1445635980 ZZQFKNDWAHGQHA-CZUORRHYSA-N 347.367 1.584 10 10 EDCE CC(C)N1CCC(N2CCN(C(=O)c3cccc(O)c3O)CC2)CC1 1295248401 DHBFRPRBINTNSA-UHFFFAOYSA-N 347.459 1.728 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2CCCNC2=O)cc1C 1700752868 APXPZXCMIGCXJF-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE Cc1c(I)c(=O)n(-c2ccc(N)cc2)n1C 1614949576 KBJYXUKLDJWNGG-UHFFFAOYSA-N 329.141 1.671 10 10 EDCE CCn1c(=O)n(CC(=O)NCc2cc(O)ccc2O)c2ccccc21 1471661090 HJYLTYNEDVGLRQ-UHFFFAOYSA-N 341.367 1.551 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@@H]1CCCN1C(=O)C(F)(F)F 1545636736 DYPHAEORIMMBEV-VIFPVBQESA-N 332.278 1.267 10 10 EDCE CC[C@H](CNC(=O)CN1CCOCC1)NCc1ccc(OC)c(C)c1 1714069274 ZBOPIMWTFUHGGW-QGZVFWFLSA-N 349.475 1.320 10 10 EDCE COC(=O)C1=S=C(NC(=O)c2ccc(N=NC(N)=O)cc2)C=C1 1625063987 HQLDRSXLQKUDFZ-UHFFFAOYSA-N 332.341 1.357 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC(OC[C@H]2CCOC2)CC1 1558957074 PGHGHGGUFBGVCX-NSHDSACASA-N 339.363 1.895 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@H]2CC[C@@H](F)C2)cc1 1720146616 WBPIDRFKKBDMDI-NWDGAFQWSA-N 349.366 1.833 10 10 EDCE Cc1ccc(S(N)(=O)=O)c(C(=O)N[C@H](C)c2ccccc2O)c1 1635794078 VIBCYYVTEDYEDZ-LLVKDONJSA-N 334.397 1.839 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@]2(C)CCNC2=O)cc1C 1568918614 QSTIJFVIHLMAQQ-VZSQWMKGSA-N 345.443 1.292 10 10 EDCE CCCCC(=O)N1CSC[C@@H]1C(=O)NCc1c(O)cccc1O 1647270142 NCCJXKRSDSUQAV-GFCCVEGCSA-N 338.429 1.806 10 10 EDCE CCOC(=O)[C@H](NC(=O)c1cc(O)cs1)[C@H](O)c1cccnc1 1587187487 WVIMLLPOWWFQRF-CHWSQXEVSA-N 336.369 1.244 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)CCCC(=O)O)c2nccn2C)cc1 169813965 LWBLAIBXUNGNET-KRWDZBQOSA-N 344.415 1.947 10 10 EDCE Nc1ccc(Cc2ccc(NC(=O)CC[C@@H](N)C(=O)O)cc2)cc1 1866016140 LLJPOLNOQAZBLY-MRXNPFEDSA-N 327.384 1.990 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@](O)([C@@H](N)c2ccccc2O)C1 1920324353 JWXZXPZQXYPXRR-YOEHRIQHSA-N 338.404 1.390 10 10 EDCE CC(C)CNCc1ccc(N2C[C@H](O)[C@H](O)C2)c(Br)c1 232638627 PUWPAAURZNADTE-GASCZTMLSA-N 343.265 1.737 10 10 EDCE CC(C)(C)OC(=O)N1CCS(=O)(=O)CCN1c1ccc(N)cc1 1977967737 JMGYRHLFHQANKF-UHFFFAOYSA-N 341.433 1.656 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1NC(=O)CCOc1ccc(N)cc1 1999127971 JIDNQQUPJFERTL-UONOGXRCSA-N 335.404 1.820 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(CCC(=O)N2CC(N=[N+]=[N-])C2)CCOC1 2010404402 RPXSLIKUHOPNIE-HNNXBMFYSA-N 339.396 1.972 10 10 EDCE CC(=O)N[C@H]1CCN(c2cc(Br)c(CN)cc2F)C1 311528519 VPNIUCGSTCXTAZ-JTQLQIEISA-N 330.201 1.762 10 10 EDCE O=C1NC(=O)[C@H]2CN(c3ccc(CO)cc3Br)CC[C@@H]12 2158789545 MOFIYHBFLZLDHB-ZJUUUORDSA-N 339.189 1.040 10 10 EDCE NCc1cc(F)c(N2CCC(O)(CO)CC2)cc1Br 313651634 FQPXZWFGMYIWBC-UHFFFAOYSA-N 333.201 1.371 10 10 EDCE Cn1nnnc1CNCc1cc(Cl)cc(Br)c1O 708138080 HGQGKKSSJMUJFS-UHFFFAOYSA-N 332.589 1.621 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NC(=O)Cc2ccc(N)cc2)C1 2063348643 OMAJHFRBSSLVSK-CABCVRRESA-N 349.431 1.298 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@H]2CO)c(OC)c1Br 2226538481 NPCONWQAUCPDLS-IUCAKERBSA-N 332.194 1.398 10 10 EDCE COC[C@@H](O)CCNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2305338704 VFTGKBCQESOVOQ-KRWDZBQOSA-N 334.416 1.050 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2329333925 ZOJRWECEBDIRNK-HBEIAFGSSA-N 327.222 1.099 10 10 EDCE Cc1ccc(CN2CC3(CNC(=O)C3)C2)c(O)c1Br 2352652198 PLJOLIZQPFEAMG-UHFFFAOYSA-N 325.206 1.785 10 10 EDCE CN1CCCc2cc(CNC(=O)CNC(=O)c3ccccn3)ccc21 172530827 WCWYAXQPJGDVND-UHFFFAOYSA-N 338.411 1.510 10 10 EDCE COc1cccc(CNC(=O)CNC(=O)c2ccccc2C)c1O 68488458 TXHYQQPCZWQWBW-UHFFFAOYSA-N 328.368 1.755 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cccn(C)c2=O)cc1C 1267457800 VKSNLPWQYXMWCG-UHFFFAOYSA-N 343.427 1.564 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@@H]2CCN(C)C2=O)cc1C 1265812969 HWZCERSNZQSSOI-ZFWWWQNUSA-N 333.432 1.076 10 10 EDCE CN1CCC(CN(C)c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 301701314 SQYKKDZGYCAZPG-UHFFFAOYSA-N 334.376 1.704 10 10 EDCE Cc1nc(CNS(=O)(=O)CCOc2ccc(N)cc2)cs1 70490750 IFULBODQNKDJLK-UHFFFAOYSA-N 327.431 1.532 10 10 EDCE CCOC(=O)C[C@H](C)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255548062 CKWLQCCHTUBQDG-AJHXJQRKSA-N 346.427 1.994 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@@H](n3cncn3)C2)c([N+](=O)[O-])c1 368785614 VXHKVGHLOCQNMD-MASHWEEQSA-N 343.343 1.824 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCOC[C@@H]1[C@H]1CCCO1 377709662 ZFHZDVDZUVURLV-RTBURBONSA-N 332.444 1.903 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCN3CCOC[C@H]3C2)cc1F 376893758 DYAFTMGOKDBOGT-CQSZACIVSA-N 336.411 1.118 10 10 EDCE CO[C@@H]1COCC[C@@H]1CC(=O)NCc1ccc(N2CCOCC2)cc1 294438294 GVAQQETWZHJQOQ-SJLPKXTDSA-N 348.443 1.581 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CCOC[C@H]1C 819698828 TYAFJZPKJQRYCX-HIFRSBDPSA-N 335.400 1.957 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCNC(=O)CC3)CC2)cc1 814722184 NRECBIUPPQFVFC-CQSZACIVSA-N 331.416 1.260 10 10 EDCE COC[C@@]1(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CCOC1 825373246 FZCSOSPNVMROJC-IBGZPJMESA-N 348.443 1.787 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Nc3cc(OC)ncn3)C2)cc1 822122411 QLYKPPIGVJVMKI-LBPRGKRZSA-N 343.387 1.894 10 10 EDCE COCC1(CNC(=O)NCc2c(O)cccc2F)CCOCC1 922569080 CRYLUHPNPYWLFS-UHFFFAOYSA-N 326.368 1.774 10 10 EDCE C[C@H](NC(=O)NC[C@@H]1CCC(=O)N1)c1ccc(N2CCOCC2)cc1 853487874 ZMHQLGQHBXUERO-ZFWWWQNUSA-N 346.431 1.162 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)[C@@H]2COC(C)(C)C2)cc1F 858925695 NJJWCOOVJGJZPP-LBPRGKRZSA-N 330.425 1.879 10 10 EDCE CN1CCOC[C@@]1(CO)CNCc1cc(Cl)cc(Cl)c1O 922535639 KKMXMFQWXGNVME-AWEZNQCLSA-N 335.231 1.482 10 10 EDCE CCCN1C[C@H](C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 855222941 DLQIPCACWAVGEV-HUUCEWRRSA-N 345.443 1.649 10 10 EDCE O=C(COCC(F)F)NCc1ccc(N2CCOCC2)c(F)c1 858626086 ODFBJPJPHXPNPM-UHFFFAOYSA-N 332.322 1.560 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@H]1CC(=O)N(C2CC2)C1 862028935 PMLAGMOFVXCBTN-ZDUSSCGKSA-N 325.368 1.568 10 10 EDCE COCc1nc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)co1 775764012 AFJSCYUHBQIDPN-UHFFFAOYSA-N 331.372 1.792 10 10 EDCE CCN1CCO[C@H](CNCc2c(O)cccc2Br)C1 706809451 ZQWQDZZVZRZVLG-LLVKDONJSA-N 329.238 1.965 10 10 EDCE COc1ccc(CNC(=O)C(=O)Nc2cnn(C)c2C2CC2)c(O)c1 797388081 TXUQKBHERGDTMX-UHFFFAOYSA-N 344.371 1.267 10 10 EDCE O=C(NCc1cc(O)ccc1O)C1CCN([C@@H]2CCSC2)CC1 1303225705 NUPSFMWUQIGZNF-CQSZACIVSA-N 336.457 1.932 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](C(C)(C)O)C3)nc12 1308049433 KHMDEUJFQDPRQX-NSHDSACASA-N 348.403 1.204 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1CC(=O)N(C)C1)NCc1ccc(OC)c(C)c1 1318531600 VSWJLUFONDDNCH-CVEARBPZSA-N 347.459 1.466 10 10 EDCE C[C@@H](N)c1ccc(N2CC3(CNC(=O)N3)C2)cc1Br 2121210061 YVSLPLRGXCRAFS-MRVPVSSYSA-N 325.210 1.340 10 10 EDCE C[C@@H](NC(=O)C1CC2(C1)CS(=O)(=O)C2)c1ccc(N(C)C)cc1 1263777684 TWWCEESLRAUPBQ-GFCCVEGCSA-N 336.457 1.755 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@@H]2CCCN2C)cc1C 1278737286 KUKNWEICECIZAU-SJORKVTESA-N 349.475 1.007 10 10 EDCE COc1ccc(N2CCC(NC(=O)CCc3cnn(C)n3)CC2)cc1 1359816229 HEPWDHVQXVGHHL-UHFFFAOYSA-N 343.431 1.542 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2ncccn2)cc1C 1501501349 YWKCATRCVFYVOV-UHFFFAOYSA-N 344.415 1.018 10 10 EDCE COC(=O)COc1ccc(CN(C)C(=O)c2cccc(O)c2O)cc1 1296661717 OLBOSIIHTKXBDG-UHFFFAOYSA-N 345.351 1.922 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3n[nH]c(C)c3O)CC2)cc1C 1483727400 PJLPCFBUBPHBPR-UHFFFAOYSA-N 344.415 1.793 10 10 EDCE COc1ccc(N(C)C(=O)c2ccnc3c2CC(=O)N3)cc1OC 1542501379 LQZDYECXDHLIKF-UHFFFAOYSA-N 327.340 1.870 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCS(=O)(=O)CC2CC2)cc1 1635609021 CYHJIGLQFYUBDV-UHFFFAOYSA-N 338.389 1.404 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1ccnc2[nH]c(O)nc12 1638573374 UEALHWNIEBTMKE-UHFFFAOYSA-N 335.323 1.847 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CNC(=O)c1cccc(O)c1 1634944266 QHSKATXHGFTWKB-UHFFFAOYSA-N 349.383 1.630 10 10 EDCE CC[C@H](F)CN[C@@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1734386364 UTCJUINAZJNPGO-WCQYABFASA-N 339.371 1.277 10 10 EDCE C[C@@H](O)c1cn(CC(=O)N(C)Cc2ccc(N3CCCC3)cc2)nn1 1587552334 OZZYKDAFEUUVHA-CQSZACIVSA-N 343.431 1.590 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@H]4OCCC[C@@H]4C3)cc2N1 152433613 ALSDWARYGBMAIH-YGRLFVJLSA-N 333.344 1.931 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NCc1cccc(F)c1O 1937553635 SWPIIYXMVZDKOW-STQMWFEESA-N 326.368 1.913 10 10 EDCE CC[C@H]1C(=O)NC(=O)CN1c1ccc(CNC)c(Br)c1 233945733 NJRQGWSSSDTNNT-LBPRGKRZSA-N 340.221 1.410 10 10 EDCE COC(=O)c1ccc(NC(=O)c2nnn(-c3ccc(N)cc3)n2)cc1 1857878431 BOIUHHOPYYXXSO-UHFFFAOYSA-N 338.327 1.283 10 10 EDCE C[C@H](NCc1cccc(Br)c1O)C(=O)N1CCOCC1 134634757 ZLOPDWBDETZTDD-JTQLQIEISA-N 343.221 1.492 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1COC[C@@H]1NCc1cccc(O)c1O 1948520437 VDDNYRFAJCGHID-OLZOCXBDSA-N 338.404 1.727 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@@](O)(CNC(=O)OC(C)(C)C)C1 1985101211 PDMHUUAZEQAWGF-YPFXGUDJSA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@](O)(C(=O)N2CC(N=[N+]=[N-])C2)C1 1986139746 BJERWJGRVFZJRG-CQSZACIVSA-N 325.369 1.270 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1986369478 SYFNTEWRNJINBC-MNOVXSKESA-N 327.385 1.421 10 10 EDCE CN(C)c1ccc([C@H](O)[C@H](N)c2c(Br)nnn2C)cc1 2148220372 QGOLXDYXXRUNRF-PWSUYJOCSA-N 340.225 1.377 10 10 EDCE COc1ccc(O)c(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)c1 2011488454 WTKPMGACHAYCEG-UKRRQHHQSA-N 338.404 1.471 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NCc2ccc(O)c(O)c2)C1 2011918195 PFSPBKXKCVNXDG-OLZOCXBDSA-N 338.404 1.558 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@@]4(CCCO4)[C@H]3C3CC3)c2n1 2062490403 VUFOVYWGJPMKLC-PBHICJAKSA-N 328.372 1.527 10 10 EDCE CS(=O)(=O)c1cnn(Cc2c(O)cccc2Br)c1O 2070259683 JQVLWUSFUNJUJX-UHFFFAOYSA-N 347.190 1.509 10 10 EDCE N[C@@H]1CC(C(=O)N2CCCc3ccc(Br)cc32)=C[C@@H]1O 2188018578 DSOHFDOACWWQRE-OCCSQVGLSA-N 337.217 1.747 10 10 EDCE NCc1ccc(N2CC[C@H]3CS(=O)(=O)C[C@@H]32)cc1Br 2094931375 SEDHOFXXVACELD-GWCFXTLKSA-N 345.262 1.531 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2210534675 JIOKVEFSARXRHV-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE NCc1cc(F)c(N2CC[C@]3(C[C@H](O)CO3)C2)cc1Br 2201772201 NXZRLXSETMLGOI-HZMBPMFUSA-N 345.212 1.777 10 10 EDCE OCc1ccc(N2CCc3nnc(O)cc3C2)c(Br)c1 2206097651 DVSRHWQDBHTIAL-UHFFFAOYSA-N 336.189 2.000 10 10 EDCE COc1ccc(Br)c(CNCC[C@@H]2COC[C@H]2O)c1O 2236056508 VWPUPIKMMWLOTN-BXKDBHETSA-N 346.221 1.650 10 10 EDCE O=C1Nc2cc(N3CC(CCCO)C3)c(Br)cc2[C@H]1O 2238723980 HJCOJYNDVOVVEQ-CYBMUJFWSA-N 341.205 1.643 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)NCCCN=[N+]=[N-])[C@@H]1CCOC1 2244947133 NCVQJCKYBBBVPL-LLVKDONJSA-N 327.385 1.829 10 10 EDCE CCCNC[C@@H](C)CS(=O)(=O)NCc1cnc(SC)s1 2284687323 FSGPNFLJNRNSIG-SNVBAGLBSA-N 337.536 1.920 10 10 EDCE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1ccc(O)c(O)c1 2296390105 MKNIVHULQGCZFQ-UHFFFAOYSA-N 342.282 1.903 10 10 EDCE NC(=O)[C@H]1CN(c2ccc(CO)cc2Br)CC12CC2 2344332363 KCAKXIIPTQANPX-SNVBAGLBSA-N 325.206 1.643 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C=C[C@H](N)C2)c(O)c1Br 2352624600 KZWOLUKEDFBCNI-ONGXEEELSA-N 325.206 1.983 10 10 EDCE Cc1ccc(CN2C[C@@H](CO)[C@H](CO)C2)c(O)c1Br 2352678890 JEDMTOTZZUVBJN-RYUDHWBXSA-N 330.222 1.496 10 10 EDCE COc1ccc(O)c(CNC(=O)NCc2cccnc2N(C)C)c1 114587273 SCHXBGWLHAHQFO-UHFFFAOYSA-N 330.388 1.861 10 10 EDCE CCn1cc([C@@H]2CN(Cc3cc4c(cc3O)OCO4)CCO2)cn1 189845288 GTLQLJOTLHZZMK-KRWDZBQOSA-N 331.372 1.911 10 10 EDCE C[C@H]1SCCN(S(=O)(=O)CCOc2ccc(N)cc2)[C@@H]1C 132038878 VSOPSDIQAREGLL-VXGBXAGGSA-N 330.475 1.803 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)c(Br)c1 2133921066 UVZSAKSSNQZJLM-NZPIUUIZSA-N 328.206 1.404 10 10 EDCE N[C@@H](c1cc(I)ccc1O)C(F)(F)C(=O)O 95780769 ZBXTYYXYWDAPTK-ZETCQYMHSA-N 343.067 1.717 10 10 EDCE COC(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255715056 FONZNWIHACHZHK-UXHZXRBQSA-N 344.411 1.700 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3COCCC3=O)ccc21 628873413 KPSVDFCAJAVBBS-MRXNPFEDSA-N 344.411 1.992 10 10 EDCE CC(C)(C)OC(=O)c1cnc(C(=O)NCc2ccc(O)c(O)c2)cn1 284291403 GCMFHHIHFLRZEE-UHFFFAOYSA-N 345.355 1.773 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CC1=O 819170973 QZRWGMJGTSAFQR-XBFCOCLRSA-N 343.383 1.166 10 10 EDCE CN(C)C(=O)CN1CCN(C/C=C\c2ccc(N(C)C)cc2)CC1 835025230 GNVRDBKKORHPDB-WAYWQWQTSA-N 330.476 1.472 10 10 EDCE C[C@H](NC(=O)[C@@H]1CC[C@@H]1C(=O)O)c1ccc(N2CCOCC2)cc1 911290908 FYZMDMZEIDUEJS-MAZHCROVSA-N 332.400 1.811 10 10 EDCE CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)NCc2c(O)cccc2F)C1 918844445 DMBKRRGQVYVHDC-RYUDHWBXSA-N 337.395 1.978 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=S)NC3CCOCC3)C2)cc1 849270848 QWLHHFCHZQMTPG-CQSZACIVSA-N 335.473 1.917 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](CO)C(C)C)C2)cc1 854297105 KCEMIEINTNPBQD-GJZGRUSLSA-N 335.448 1.838 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CS(=O)(=O)C(C)C)C2)cc1 855228691 DBHXKEWOZQOTMS-CYBMUJFWSA-N 340.445 1.213 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CC[C@@](CO)(C(F)(F)F)C1 924456090 KZOIUOWHBTWOJN-KWEXDPCDSA-N 331.290 1.884 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C[C@@H](O)C1(O)CCOCC1 929294057 CITOOTXPVKFXIU-GOSISDBHSA-N 336.476 1.865 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnc4n3CCOC4)C2)cc1 855227185 UDSVLYZOMBAMMS-ZDUSSCGKSA-N 342.399 1.431 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)C[C@H]2COCCO2)c([N+](=O)[O-])c1 853829949 PHHNSPXROZUTCV-AGLBCWCQSA-N 336.344 1.633 10 10 EDCE COc1cc(C)cc(CN2CCN(c3nccn(C)c3=O)CC2)c1O 754737654 UMHKABOGHWFOMJ-UHFFFAOYSA-N 344.415 1.125 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)CC3(C)COC3)C2)cc1 858597972 AFJDOPCRILYJRS-CQSZACIVSA-N 333.432 1.952 10 10 EDCE CN(C)[C@@H](C(=O)NCc1ccc2cccnc2c1O)c1cncn1C 862026409 NLOMYYZBTNWUJA-MRXNPFEDSA-N 339.399 1.593 10 10 EDCE CN(C)c1cc(F)c(CN2CCC[C@H](CS(N)(=O)=O)C2)cc1F 862242775 QNKMIGWSFHWOBH-NSHDSACASA-N 347.431 1.531 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN(C)CC(=O)NC(C)(C)C)c1O 774821105 MJBJRXJMFOEZCL-UHFFFAOYSA-N 325.365 1.656 10 10 EDCE C[C@H](NCc1cccc(Br)c1O)c1nnc(O)n1C 895179313 GJFPDXUQUNLWRH-ZETCQYMHSA-N 327.182 1.840 10 10 EDCE C[C@H](NC(=O)[C@@]1(C)CCC(=O)NC1)c1ccc(N2CCOCC2)cc1 798409412 XQGKVMSRJZIIDG-LIRRHRJNSA-N 345.443 1.617 10 10 EDCE CC(C)(C)OC(=O)c1n[nH]cc1NC(=O)Cc1ccc(O)c(O)c1 1163317083 RGUSQWKKOIBWFD-UHFFFAOYSA-N 333.344 1.957 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCOC[C@@H]1C 1261119206 JDLZXWJUFPAUTK-ZFWWWQNUSA-N 334.416 1.672 10 10 EDCE COc1cc(NCCCNC(=O)/C=C/c2ccc(O)c(O)c2)ncn1 1469301562 AIOYGEQJUKOYNU-GQCTYLIASA-N 344.371 1.528 10 10 EDCE NCc1nnc2n1CCN(Cc1ccc(Br)cc1O)C2 2203314674 AYWJAVDPRGAAJE-UHFFFAOYSA-N 338.209 1.221 10 10 EDCE O=C(NCCN1C(=O)CCC1=O)c1cc2cc(O)c(O)cc2s1 1633779013 AHTLGFWFVDWCOS-UHFFFAOYSA-N 334.353 1.191 10 10 EDCE COc1cccc(-n2cc(C(=O)NCc3ccc(O)cc3O)nn2)c1 1643103642 DHCUNCJHYPTAIY-UHFFFAOYSA-N 340.339 1.617 10 10 EDCE Cc1nnnn1-c1ccc(C(=O)NCc2cc(O)ccc2O)c(F)c1 1651225827 ZQXRIOPWKKILHI-UHFFFAOYSA-N 343.318 1.451 10 10 EDCE C[C@@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 1914411349 LTJLYRWAMZQEJR-LNCSFIOASA-N 327.178 1.394 10 10 EDCE CNC(=O)c1ccc(OC)c(NC(=O)Cc2ccc(O)c(O)c2)c1 1596313467 PPESDOOWFVUGGW-UHFFFAOYSA-N 330.340 1.647 10 10 EDCE COc1ccc(N2CCN(C(=O)CNC(=O)C(F)(F)F)CC2)cc1 1861965670 UJSNFPAVGVMCDK-UHFFFAOYSA-N 345.321 1.022 10 10 EDCE NCc1ccc(N2CCN(CCO)CC2)c(F)c1Br 231839076 TULDXLKDSCJHEG-UHFFFAOYSA-N 332.217 1.161 10 10 EDCE C[C@H](N)[C@](C)(O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952209567 VWJGYGARLGTDRX-NCHVAJSOSA-N 340.420 1.632 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985096726 VWFQRTFPJFJSNZ-GHMZBOCLSA-N 325.369 1.389 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985102469 HQACDKHLXRGAAT-DCAQKATOSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)COC1 1985102725 KZCDKMYLBVITTC-JTQLQIEISA-N 325.369 1.581 10 10 EDCE COCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC(N=[N+]=[N-])C1 1985103003 OSQYDIZPPPYOOZ-NSHDSACASA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1987701243 DIXAVMGRIZTTQJ-WDEREUQCSA-N 327.385 1.421 10 10 EDCE NCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@@H]32)c(F)c1Br 2146702727 LUNQOHGPVNZACB-JBLDHEPKSA-N 345.212 1.775 10 10 EDCE CC(C)NCc1ccc(N2CC[C@@](O)(CO)C2)c(Br)c1 313898477 RJOIQJPSCHDEEN-HNNXBMFYSA-N 343.265 1.881 10 10 EDCE COc1cccc(O)c1[C@@H](C)N[C@@H]1CCCN(S(C)(=O)=O)C1 2064901841 NQKJHRDNGNVAIA-VXGBXAGGSA-N 328.434 1.475 10 10 EDCE CC[C@@H](NC1CN(CC(=O)O)C1)c1cc(Br)ccc1O 2169313589 LWHFSZCQPGKPKF-GFCCVEGCSA-N 343.221 1.964 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)c(Br)c1 2182555278 IDMAMQROHFCBHP-BAESOJJISA-N 341.249 1.346 10 10 EDCE CN1CCO[C@H]2CCN(c3ccc(CO)c(Br)c3)C[C@H]21 2185530520 UTSHGMWPKOYSDV-CABCVRRESA-N 341.249 1.851 10 10 EDCE CC(C)(C)OC(=O)NCCc1nc(=NCc2cccc(O)c2O)[nH][nH]1 2063192557 KBUUPNZBAUCAKQ-UHFFFAOYSA-N 349.391 1.317 10 10 EDCE CCN1CCN(C[C@@H](C)CNC(=O)C=Cc2ccc(O)c(O)c2)CC1 2307987398 ZRURTJJFADRZPY-HNNXBMFYSA-N 347.459 1.501 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2NC(=O)COc1ccc(N)cc1 2311829023 PJNLOZACAXUMLG-HZUKXOBISA-N 347.415 1.772 10 10 EDCE O=S1(=O)C[C@H]2CN(c3ccc(CO)c(Br)c3)C[C@@H]21 2314891882 QWZNLFOFXBFKQP-SKDRFNHKSA-N 332.219 1.175 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C[C@H](F)CN2)c(O)c1Br 2352628123 SNCNPMHSMUWCGJ-VHSXEESVSA-N 331.185 1.779 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cc2nnc(C)o2)cc1C 1266690293 RXZAKTSBAJDAQC-UHFFFAOYSA-N 332.404 1.486 10 10 EDCE CC1(C)SC[C@@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 276677323 VSBFHWHYBBPRTG-NSHDSACASA-N 330.431 1.388 10 10 EDCE O=C1CC[C@H](C(=O)NCc2cc(Br)ccc2O)CN1 804737974 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FWTCIYFELMTBKL-HUUCEWRRSA-N 340.427 1.894 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NC[C@@H](O)c2ccnn2C)cc1 914254279 DWFYUXFRYSHYIL-QGZVFWFLSA-N 345.447 1.799 10 10 EDCE C[C@H](O)[C@@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 840305853 XVVCUAOXWCFYFV-YOEHRIQHSA-N 331.416 1.354 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@]23CNC[C@H]2COC3)cc1F 846672457 GULAWOLBGHHFEE-KSSFIOAISA-N 335.423 1.524 10 10 EDCE O=C1N[C@]2(C(=O)NCCCSc3nccs3)C[C@H]3C[C@@H]1[C@H]2C3 845505726 KEFMWUHQXIGHAG-MYQWFSQQSA-N 337.470 1.656 10 10 EDCE CC[C@@](C)(CO)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 847539116 LVSKLQQYELAPLG-SFHVURJKSA-N 338.423 1.812 10 10 EDCE O=S(=O)(NCc1cc(Cl)ccc1O)c1cnc2n1CCC2 845996795 ULMJHLPPVGNMBL-UHFFFAOYSA-N 327.793 1.667 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3C)C2)c1 756731832 IYOHIWYBCIALDD-MEDZGJRSSA-N 332.400 1.839 10 10 EDCE COC[C@](C)(CC(=O)OC)NCc1ccc(N2CCOCC2)cc1 757921506 WCPCTXFVHBBCHR-SFHVURJKSA-N 336.432 1.581 10 10 EDCE COCCn1cc(C(=O)NCc2c(O)cccc2F)c(=O)cc1C 928708735 RSYPXGRIDXBYMZ-UHFFFAOYSA-N 334.347 1.578 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN4CCC3CC4)C2)cc1 852451605 OCVZJKPVNDIBMQ-OAHLLOKOSA-N 344.459 1.764 10 10 EDCE C[C@H]1CCCN(S(=O)(=O)NNc2nc3cccnc3s2)C1 857225655 PFBCCIAHQDLKQM-VIFPVBQESA-N 327.435 1.585 10 10 EDCE CCN1CC[C@H](NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1=O 852315545 YJVDAGJRPGWQFP-CJNGLKHVSA-N 346.431 1.194 10 10 EDCE CC(C)OC[C@H](N)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 852805239 SYJCJJSPYWHQST-HOTGVXAUSA-N 336.432 1.652 10 10 EDCE CC(C)(C)OC(=O)N=c1[nH][nH]cc1[C@H](N)Cc1ccc(O)c(O)c1 1952711447 RPBSPLOERBIDNJ-LLVKDONJSA-N 334.376 1.832 10 10 EDCE CO[C@H]1CN2C(=O)N(Cc3ccc(N(C)C)c(F)c3)C(=O)[C@]2(C)C1 865301183 IRWIJAWDQXBOGY-PXAZEXFGSA-N 335.379 1.833 10 10 EDCE COC(=O)[C@@]1(OC)CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 862473585 BBDAVLUFOWLVSQ-CQSZACIVSA-N 344.751 1.718 10 10 EDCE COCCN(CC1CCN(C)CC1)C(=O)C(=O)Nc1ccc(N)cc1 868261294 PYZJMKXFVIZURD-UHFFFAOYSA-N 348.447 1.024 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](O)c3cnc[nH]3)C2)cc1 868955126 IXXDZFOLCAYRNT-LRDDRELGSA-N 330.388 1.094 10 10 EDCE O[C@H](CNCCCSc1nccs1)CC1(O)CCOCC1 872202199 YKPBENYCANJILN-LBPRGKRZSA-N 332.491 1.507 10 10 EDCE COc1ccc(N2CCN(CCNC(=S)NC3(C)CC3)CC2)cc1 789207079 CLSSYIHOUXIYOU-UHFFFAOYSA-N 348.516 1.834 10 10 EDCE COC(=O)N[C@H]1CCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 895851465 XGXGTPBGYOTUPL-AWEZNQCLSA-N 337.395 1.593 10 10 EDCE COc1cc(NS(=O)(=O)c2cc(Cl)cnc2N)ccc1O 797820467 ZBKCSTHWAPZVNG-UHFFFAOYSA-N 329.765 1.832 10 10 EDCE C[C@H](C(=O)O)N1CCN(Cc2ccc(Br)cc2O)CC1 691422290 HEDLQNUJZKBTSZ-SNVBAGLBSA-N 343.221 1.745 10 10 EDCE O=C1CC[C@@H](c2ccc(C(=O)NCc3ccc(O)c(O)c3)cc2)N1 1150378856 XNMWPSSQUFSVSS-AWEZNQCLSA-N 326.352 1.979 10 10 EDCE Nc1c(C(=O)NCc2c(O)cccc2O)cnn1Cc1ccccc1 1156885740 MUZSKMSCLDIMHQ-UHFFFAOYSA-N 338.367 1.855 10 10 EDCE CN(C)C(=O)OC[C@H]1CCCCN1C(=O)Cc1ccc(O)c(O)c1 1157231969 JXWLXLPNFKYWKS-CYBMUJFWSA-N 336.388 1.720 10 10 EDCE CN(CCNCc1cnsn1)C(=O)c1ccc(N=NC(N)=O)cc1 1317665913 SGCOAEKQAFHUJS-UHFFFAOYSA-N 347.404 1.562 10 10 EDCE C[C@@]1(C2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)COC(=O)N1 1178032661 XIBSGOALIGMJMQ-KRWDZBQOSA-N 334.372 1.377 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C 1331950362 LRAQAKMBCJLRJI-GZENYHORSA-N 347.411 1.980 10 10 EDCE COC[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)C(C)C 1334048346 FKUNUVKIMXSFJK-INIZCTEOSA-N 349.475 1.712 10 10 EDCE O=C(C(=O)N(Cc1cccnc1)C1CC1)N1Cc2cccc(O)c2C1 1331987071 XHVHFJSHPABEBG-UHFFFAOYSA-N 337.379 1.821 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCCC2(C)C)cc1 1346246536 ZLGZLLSNIWUWSR-UHFFFAOYSA-N 347.459 1.991 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cc[n+]([O-])cc2)cc1C 1267976784 ZNBFUQFWFOGDFG-AWEZNQCLSA-N 343.427 1.793 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cc2ncc[nH]2)cc1C 1268610095 UQSYFDCWZDVWAJ-ARJAWSKDSA-N 328.416 1.731 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)c2c[nH]c(=O)cn2)cc1C 1275472503 XCOWFVKBTXDRBZ-STQMWFEESA-N 344.415 1.384 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cccc(CN2CCOCC2)c1 1455357901 WVZORUQHKTZVBE-UHFFFAOYSA-N 342.395 1.860 10 10 EDCE CC(C)(C)[S@@](C)(=O)=NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1456053249 KBIKLYJIYLQALC-OAQYLSRUSA-N 348.446 1.800 10 10 EDCE CC(=O)N1CCN(CCNCc2c(C)c3ccccc3n2C)CC1 1461043624 TUHVWMTUWOCWAX-UHFFFAOYSA-N 328.460 1.740 10 10 EDCE Cc1cn2nc(C(=O)NCc3ccc(N(C)C)c(F)c3)cc2c(=O)[nH]1 1464538613 DKHOSMROSCOZLC-UHFFFAOYSA-N 343.362 1.466 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN(C[C@H]2CCOC2)CC1 1544028224 RAORCHLNRRWGDP-CQSZACIVSA-N 334.416 1.257 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1nc(CN2CCOCC2)cs1 1544638323 FGILNVQWALRIGX-UHFFFAOYSA-N 349.412 1.568 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CCN(C)C2=O)cc1C 1714724268 LJTGFEFKXVMRQV-ZBFHGGJFSA-N 347.459 1.418 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1ccnc(N2CCCC2)c1 1629301521 OXAZNLGNEYFGRM-UHFFFAOYSA-N 327.384 1.952 10 10 EDCE CC[C@@H](NC(C)=O)C(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 1499357101 NWTBOGDDUZRHIJ-MRXNPFEDSA-N 347.459 1.657 10 10 EDCE O=C1Cc2c(C(=O)N3CCOc4cc(F)c(F)cc43)ccnc2N1 1640635306 QCQZDVHLSFBXOJ-UHFFFAOYSA-N 331.278 1.894 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@](C)(O)C2)cc1Br 2136828219 ICLIFKPBUMNJJJ-QCZZGDTMSA-N 329.238 1.791 10 10 EDCE C[C@H](NC(=O)c1ccc(F)c(S(N)(=O)=O)c1)c1ccccc1O 1587451312 PJESCOUNNFRIJZ-VIFPVBQESA-N 338.360 1.670 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@@]23CCC[C@@H]2C3)cc(OC)n1 1758786771 REWYOWYNFCZELQ-AEDCBLDQSA-N 347.415 1.524 10 10 EDCE O=C(NCc1cccc(Cl)c1O)N[C@@H]1CCc2nnnn2CC1 1686830218 JXXQYYLGBFYVJE-SNVBAGLBSA-N 336.783 1.236 10 10 EDCE CNC(=O)CN(C)c1ccc(CNC2CC2)c(Br)c1 234367987 ATSCFRGOSLVJFB-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE C[C@H](N)c1ccc(N2CC(=O)NC(=O)C2(C)C)cc1Br 235503574 GHJHLAURLGAGRA-QMMMGPOBSA-N 340.221 1.710 10 10 EDCE NCc1ccc(N2CC[C@@H]3C(=O)NC(=O)[C@H]3C2)cc1Br 2158786500 WMLKQSKXSZUVLV-QWRGUYRKSA-N 338.205 1.007 10 10 EDCE COc1cccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)c1O 2011488216 UNMGNVOWDLDAPR-CHWSQXEVSA-N 338.404 1.471 10 10 EDCE COc1ccc(O)c([C@H](C)N[C@H](CO)CNC(=O)OC(C)(C)C)c1 2011424359 HRZMTXWGQUBANC-RYUDHWBXSA-N 340.420 1.937 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNCc2cccc(F)c2O)C1 702811892 RCZJBBFULXAYNR-TZMCWYRMSA-N 340.395 1.849 10 10 EDCE CN(CC(=O)NC1CC1)c1cc(Br)c(CN)cc1F 388222906 FUEKWVCPTFZJAW-UHFFFAOYSA-N 330.201 1.762 10 10 EDCE CCNCc1ccc(N2CC(C(=O)NC)C2)c(Br)c1 382054178 FTIFXXPFUWFSMQ-UHFFFAOYSA-N 326.238 1.741 10 10 EDCE CC(C)NCc1ccc(N2CC(C(N)=O)C2)c(Br)c1 382058721 BVLODIONTHLKNE-UHFFFAOYSA-N 326.238 1.869 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCCCC34OCCO4)c2n1 2062824351 JXCPIPAKIYTSCP-GFCCVEGCSA-N 332.360 1.159 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2CN3C(N)=O)c(Br)c1 2192297511 CANRIOXZVAWEJM-QWRGUYRKSA-N 339.237 1.510 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)C[C@@H](O)C2)c(Br)c1 2105075435 RCNWLOYXEMVBBB-JLLWLGSASA-N 329.238 1.661 10 10 EDCE Nc1ccc(OCCN=c2[nH]c(F)ncc2Br)cc1 2106070337 WERKVQWRIBVBSG-UHFFFAOYSA-N 327.157 1.873 10 10 EDCE OCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@@H]32)c(Br)c1 2090533812 IBAIITOHLWSTID-LEWSCRJBSA-N 328.206 1.670 10 10 EDCE O=C1C(=Cc2ccccc2O)SC(=S)N1CCS(=O)(=O)O 2293438697 XEROAONKYBFVHN-UHFFFAOYSA-N 345.423 1.481 10 10 EDCE COC(=O)C=Cc1ccc(N2CCCN(CCO)CC2)c([N+](=O)[O-])c1 2297488285 QUAFSSUCQAWJFU-UHFFFAOYSA-N 349.387 1.285 10 10 EDCE Cc1ccc(CN(C)C[C@H]2CNCCO2)c(O)c1Br 2352660269 GTBQXABRKYVCLM-GFCCVEGCSA-N 329.238 1.883 10 10 EDCE Cc1ccc(CN[C@H]2CC(=O)N(C)C2=O)c(O)c1Br 2352692968 NYQHFYGOMFIFED-VIFPVBQESA-N 327.178 1.310 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1C[C@@H]2C[C@H]1[C@H](O)[C@H]2O 2355465295 XSTITNZOLDXURF-QPTZUFNXSA-N 342.233 1.622 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccncc1O 176695300 YXEGFYGOQQBQDC-UHFFFAOYSA-N 327.384 1.896 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CC(=O)N(CC(F)(F)F)C2)c(O)c1O 177687310 HUTBLKBFUYCDGD-MRVPVSSYSA-N 332.278 1.299 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N(C)C)cc1)C(=O)NCc1ccco1 126790282 OEDIWYLJBSMSMA-ZDUSSCGKSA-N 344.415 1.850 10 10 EDCE CO[C@H](CCN)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380788341 AKOXFZFAJLFDED-LLVKDONJSA-N 345.237 1.785 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)NCCOC(C)(C)C)ccc21 803688416 YVKOBQCGXQDYEU-UHFFFAOYSA-N 347.459 1.617 10 10 EDCE CC(=O)C(=O)COC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1 808496091 ZSOMLCMKMVUIRB-UHFFFAOYSA-N 333.384 1.805 10 10 EDCE CC(C)OC[C@H](O)CNCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 818967991 HJRIMCDDHGBZLU-SJLPKXTDSA-N 349.475 1.264 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3cc(Cl)ccc3O)C[C@@H]12 827390543 XFCQENZBEAGGEW-YUTCNCBUSA-N 331.821 1.289 10 10 EDCE COC(=O)CC[C@H](N)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 828353232 LEKCDDRXSCNHHA-INIZCTEOSA-N 349.431 1.061 10 10 EDCE C[C@]1([C@H]2CCCN(Cc3cc4c(cc3O)OC[C@@H]4O)C2)COC(=O)N1 905700637 IPUPHPWZJLPFQY-XLWVJDPXSA-N 348.399 1.529 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@H](CN3CCOC3=O)C2)cc1 836220338 UACPDBNZSWGZCH-HNNXBMFYSA-N 346.431 1.736 10 10 EDCE C[C@@H](NC(=O)[C@@H]1CC[C@H]1C(=O)O)c1ccc(N2CCOCC2)cc1 901949310 FYZMDMZEIDUEJS-DAXOMENPSA-N 332.400 1.811 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C\c1ccc2nc(O)[nH]c2c1 901442834 LUONGYREWBGJDO-WQLSENKSSA-N 330.369 1.571 10 10 EDCE CCC/C=C/[C@H](O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 912709651 RGUCTLTZPRYYNV-WRFKIARRSA-N 332.444 1.981 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)N4CC5CC4(C5)C3=O)C2)cc1 849357151 KJZOJYCGDZNWKB-FHBSJOOWSA-N 327.384 1.701 10 10 EDCE CC[C@@H]1C[C@H](NCCN2CCN(c3ccc(OC)cc3)CC2)CO1 850091152 ZEVHKMBXZLJJLJ-FUHWJXTLSA-N 333.476 1.974 10 10 EDCE CCOC(=O)CCCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 851932047 BLPSBFWJENRLOA-CQSZACIVSA-N 349.431 1.916 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)N3CCN(C)CC3)C2)cc1 855230296 FVKGPUOLQLJOJL-JKSUJKDBSA-N 346.475 1.026 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCN3CCOC3=O)C2)cc1 855230144 NSUUIBGDYWLZOX-ZDUSSCGKSA-N 333.388 1.232 10 10 EDCE CN1CCCC[C@H](N(C)Cc2ccc(N3CCOCC3)cc2)C1=O 931470897 GGKKCOHBSLEDBT-SFHVURJKSA-N 331.460 1.966 10 10 EDCE CC(=O)c1cc(F)cc(CN2C[C@H]3CS(=O)(=O)C[C@H]3C2)c1O 933729570 XUSWSMGUFYWZEZ-TXEJJXNPSA-N 327.377 1.210 10 10 EDCE C[C@H](NC(=O)NCc1ncc2c(n1)CCOC2)c1ccccc1O 868740717 RACDVSSHJAIJFL-NSHDSACASA-N 328.372 1.815 10 10 EDCE CC(C)(C(=O)NCc1ccc2cccnc2c1O)S(=O)(=O)C1CC1 862026022 FGRUPXSVLJKETO-UHFFFAOYSA-N 348.424 1.912 10 10 EDCE CC[S@@](=O)CCNC(=O)NCc1cccc(Br)c1O 764782617 GOCFWLBSDAFECA-LJQANCHMSA-N 349.250 1.723 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@H]3CC3(C)C)C2)cc1 1118683375 WOMCBLZEBZOGJE-KBPBESRZSA-N 345.443 1.552 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCO1 776237751 IJFXSWPDQAIVGF-DOMZBBRYSA-N 335.404 1.397 10 10 EDCE COCC1(O)CN(Cc2c(C(=O)OC)n(C)c3ccc(F)cc23)C1 894980634 UERDXPURZAAKPA-UHFFFAOYSA-N 336.363 1.297 10 10 EDCE Cc1nc(Cn2cc(C(=O)NCc3cc(Cl)ccc3O)nn2)no1 1146233606 XWGZDWQZSMNGCW-UHFFFAOYSA-N 348.750 1.307 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@@H](C(=O)NCCCN=[N+]=[N-])C1 1964882795 GYQWDAXPUSXUNI-WDEREUQCSA-N 327.385 1.875 10 10 EDCE O=C(NCc1nc(C2CCOCC2)n[nH]1)NCc1c(O)cccc1F 1234273063 GZMZKWRYTMVDCK-UHFFFAOYSA-N 349.366 1.543 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@@H](C(F)F)CC1 1329518468 DPIMLIRRTRXZEZ-CYBMUJFWSA-N 342.342 1.233 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3[C@H]4CCC[C@H]43)ccc21 1329912517 NNNXLXYZRKNOKP-SCAQPMJSSA-N 327.428 1.600 10 10 EDCE O=C(O)[C@@H]1CO[C@H](CNCc2ccc(Br)cc2O)C1 714014641 KIJHXHHBYSJLPE-ONGXEEELSA-N 330.178 1.734 10 10 EDCE CN1CCN(c2ccc(CNC[C@@]3(O)C[C@H]4C=C[C@H]3C4)cc2F)CC1 1327583913 WKTCNEHMESTKRS-KNBMTAEXSA-N 345.462 1.994 10 10 EDCE O=C(C(=O)N1CCc2cccc(F)c2C1)N1Cc2cccc(O)c2C1 1331974322 QIZJVVYSPCAJJJ-UHFFFAOYSA-N 340.354 1.958 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@H](O)CN(C)CC(F)(F)F)c1 1192780994 ODEWWAWIAPSWLE-QWRGUYRKSA-N 336.354 1.906 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)C(=O)C1CC1 1280504732 WUOYDEZJLATZAU-JTQLQIEISA-N 331.376 1.836 10 10 EDCE C[C@@H](CN(C)C(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H]1CCOC1 1283724355 SCGCDYSIVGQTND-STQMWFEESA-N 347.419 1.936 10 10 EDCE Cc1cc(CC(=O)NCc2nc(=O)o[nH]2)c(C)n1-c1ccccc1 1295432582 GKOKHZVJUZCZKH-UHFFFAOYSA-N 326.356 1.629 10 10 EDCE CO[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@H]1C 1298140809 WWIMJJDWLDITPZ-YGRLFVJLSA-N 342.417 1.261 10 10 EDCE O=C(NCc1cccc(O)c1O)c1ccc(S(=O)(=O)C2CC2)cc1 1471642133 LATMYPKFUNJAJL-UHFFFAOYSA-N 347.392 1.964 10 10 EDCE C/C=C(/C)C(=O)NC[C@H](C)NCc1nnnn1-c1ccc(OC)cc1 1480442478 SKNNUDHEEQXRBR-XLVZXTRVSA-N 344.419 1.231 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCc3nc(N)ncc3C2)cc1 1556252575 BREVKDYNKNCWKL-UHFFFAOYSA-N 325.332 1.420 10 10 EDCE COc1ccc(CNCC[C@H]2[C@@H](C)CCCN2C(=O)C(N)=O)cc1C 1565938450 IPEXPABRWXYKLQ-BBRMVZONSA-N 347.459 1.596 10 10 EDCE C[C@@H](NC(=O)CNC(=O)c1ncccc1O)c1ccc(N(C)C)cc1 1634448266 OBESALHIHUMBAX-GFCCVEGCSA-N 342.399 1.460 10 10 EDCE Cc1c[nH]c(CC(N)=O)c1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1632681910 XGRYPLJJTKPFPC-SNVBAGLBSA-N 331.372 1.123 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1 1641673925 UYLQXDYREMTWDW-KXBFYZLASA-N 345.370 1.967 10 10 EDCE CCOC(=O)CC1(NC(=O)c2ccc(N=NC(N)=O)cc2)COC1 1648313488 JNNUTQAMNYAOTI-UHFFFAOYSA-N 334.332 1.301 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccc(Cn2ccccc2=O)o1 1652623225 QLIKRMLRMBVCDV-UHFFFAOYSA-N 340.335 1.831 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NC[C@@H]2CCCCS2)cc1 156315907 ZZLSPKKKXFZMBE-AWEZNQCLSA-N 330.475 1.853 10 10 EDCE O=C(CCN1C(=O)CSC1=S)NCCc1nc2ccccc2[nH]1 1865767691 BJXYULQBVPJRFS-UHFFFAOYSA-N 348.453 1.472 10 10 EDCE N=c1[nH]c(=NCCc2ccc(O)c(O)c2)[nH]cc1Br 2136033475 DQAYBUSSRMMSOY-UHFFFAOYSA-N 325.166 1.139 10 10 EDCE CNC(=O)CN(CC(=O)c1ccc(O)c(O)c1)Cc1ccccc1 1946869691 MTZMTUSVLHJTMR-UHFFFAOYSA-N 328.368 1.529 10 10 EDCE CN[C@@H](C)c1ccc(N2CCOC[C@H]2CO)c(Br)c1 253073603 OYNPLXMVGQTMMC-CMPLNLGQSA-N 329.238 1.927 10 10 EDCE Nc1ccc(CN=c2ccc(I)n[nH]2)cc1 1981418623 NDJXROUDCWEWRA-UHFFFAOYSA-N 326.141 1.697 10 10 EDCE OCc1ccc(N2C[C@@]3(CO)CC[C@]3(CO)C2)c(Br)c1 2145745218 GADHGLKBDMFYQT-HUUCEWRRSA-N 342.233 1.513 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CC(=O)NCCCN=[N+]=[N-])C1 1985101605 VBJFPQQNWTTWRH-MNOVXSKESA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)N2CC(N=[N+]=[N-])C2)C1 1985100113 DCTNZOFMPPYICS-LLVKDONJSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@]1(C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2023012476 VCWPOBPPGBFQLP-PRXAMGSTSA-N 340.420 1.278 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N(CC(N)=O)Cc3ccccc3)ccc21 2034755989 MHFAPLDGUJKPTE-GOSISDBHSA-N 338.411 1.781 10 10 EDCE Oc1cc(Br)ccc1CNCCCCc1nn[nH]n1 708182950 VNABHNVPGWGWBZ-UHFFFAOYSA-N 326.198 1.780 10 10 EDCE CN(C)C[C@H]1C[C@H](O)CN1c1cc(Br)c(CN)cc1F 380293328 DVNIODDBYBPCKB-MNOVXSKESA-N 346.244 1.548 10 10 EDCE CN[C@@H](C)c1ccc(N(C)[C@H]2CC(=O)NC2=O)c(Br)c1 2171209988 ZBPYJGBZBDTTDT-UFBFGSQYSA-N 340.221 1.581 10 10 EDCE OCc1ccc(N2C[C@H]3COC[C@@H](C2)C3O)cc1Br 2111478138 NSCJBGFTKBJWDM-BVUQATHDSA-N 328.206 1.385 10 10 EDCE COc1ccc(Br)c(CNCC[C@H]2COC[C@H]2O)c1O 2236056510 VWPUPIKMMWLOTN-JOYOIKCWSA-N 346.221 1.650 10 10 EDCE CN(Cc1nn(C)nc1Br)c1ccc(CO)cc1F 2226967029 ZLAYNUIVNYGQEP-UHFFFAOYSA-N 329.173 1.845 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cc(C(=O)O)co2)s1 2284543767 JESYLYKHFGHFHJ-UHFFFAOYSA-N 334.400 1.635 10 10 EDCE C[C@@H](C[S@@](C)=O)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2308436000 MGMHKIWUGILBMZ-LFVRLGFBSA-N 336.457 1.420 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)c(Br)c1 2336558861 NNANWOXQXLYXCX-GMOODISLSA-N 345.262 1.702 10 10 EDCE CCN1CCN(Cc2ccc(C)c(Br)c2O)S1(=O)=O 2352946770 CKGQTKJYNYOUAB-UHFFFAOYSA-N 349.250 1.845 10 10 EDCE CCn1nc(Br)nc1[C@@H](O)[C@H](N)c1ccccc1O 2353740258 PRFAWIOAUZUMLH-ZJUUUORDSA-N 327.182 1.500 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)c(Br)c1 2355338502 BVUPWACLWUUMEU-PTPDJHTLSA-N 342.233 1.823 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H](N4CC=CC4)C3)cc2N1 301627287 ABTSZLJDGQEODR-NSHDSACASA-N 330.344 1.376 10 10 EDCE CCN(CC(N)=O)c1ccc(/C=C\C(=O)O)c(Br)c1 311267757 AFIPTZPPMBFLQQ-XQRVVYSFSA-N 327.178 1.859 10 10 EDCE O=C(c1cccnc1)N1CCN(c2ccc3c(c2)OCCO3)CC1 41380139 IMWGRZNABNEOQR-UHFFFAOYSA-N 325.368 1.815 10 10 EDCE COc1ccc(N2CCN(CCC(=O)NC[C@H]3CCCO3)CC2)cc1 243583970 OQBOSQYHFPFUDQ-GOSISDBHSA-N 347.459 1.503 10 10 EDCE O=C1C[C@H]([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2)CN1 368049650 XFWLQIQUEOBDQR-MPCGPATOSA-N 330.384 1.628 10 10 EDCE C[C@H]1OCC[C@@]12CN(c1cc3c(cc1[N+](=O)[O-])OCC(=O)N3)CCO2 366501301 AXYZGEXZAIOBIW-QLJPJBMISA-N 349.343 1.310 10 10 EDCE Cc1ccc(CN2C[C@@H](N)C[C@@H](C(N)=O)C2)c(O)c1Br 2381130939 GVUAFAUYGKJTKJ-MNOVXSKESA-N 342.237 1.098 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CO[C@@H](C)CN2)c(O)c1Br 2380746834 QIIPLRVWXVGSBF-ONGXEEELSA-N 343.221 1.456 10 10 EDCE CN1CC[C@H](NC(=O)NCc2cc(Br)ccc2O)C1=O 805144041 SNWJNYGYOIIQDA-JTQLQIEISA-N 342.193 1.185 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cnn(CC)n1 819698067 IOXPQYZARGPFRH-UHFFFAOYSA-N 332.360 1.209 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2c3n(c(=O)n2C)CCCC3)c1 825736993 OZEOXBOYFYLVAF-NSHDSACASA-N 345.399 1.728 10 10 EDCE Cn1ccnc1CN1CCC[C@@H](N[C@H]2CCc3cccc(O)c32)C1=O 834759802 FWTCIYFELMTBKL-LSDHHAIUSA-N 340.427 1.894 10 10 EDCE C[C@H](NC(=O)N[C@H]1CCNC[C@@H]1C)c1ccc(N2CCOCC2)cc1 841739971 CUIYTEZNUCYYOI-MPGHIAIKSA-N 346.475 1.881 10 10 EDCE Nc1ccc(CCNC(=O)NCC2(O)Cc3ccccc3C2)cc1 841954096 HVCRDMQQODGYOT-UHFFFAOYSA-N 325.412 1.640 10 10 EDCE C[C@@H]([C@@H](C)NC(=O)NCc1c(O)cccc1F)N1CCOCC1 917015209 FYLXOUIZISTZSY-NEPJUHHUSA-N 325.384 1.440 10 10 EDCE CC1(OCC(=O)NCc2ccc(N3CCSCC3)cc2)CNC1 844173775 WQHDGTLSSHCLGS-UHFFFAOYSA-N 335.473 1.235 10 10 EDCE Cc1cc(CCN2C(=O)CN(Cc3ccccc3O)C2=O)nn1C 925215224 AQIRMDCZTDJTPP-UHFFFAOYSA-N 328.372 1.441 10 10 EDCE CNC(=O)C1(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CCC1 855231701 NKOBONSDUKPBMM-CYBMUJFWSA-N 331.416 1.306 10 10 EDCE COC[C@@H](CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)OC 853974392 XFCGZNAKHSICCW-XJKSGUPXSA-N 337.420 1.235 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@@H]1COCCN1C 858544175 QWCPAZMCCBQCDI-MAUKXSAKSA-N 348.491 1.622 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](O)C1(N)CC1 1952667985 ANABTRKGTPZFKW-BXUZGUMPSA-N 338.404 1.386 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@@]12CCOC2 1118063659 KUIGCFMNOUMDDF-SFHVURJKSA-N 331.416 1.598 10 10 EDCE C[C@@H]1CO[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 895786985 IMBQMGFLBFYWKG-SJCJKPOMSA-N 336.407 1.828 10 10 EDCE COc1cccc(Cc2nn(Cc3ccc(N)cc3)c(=O)nc2O)c1 82720960 CJVTXCCZWPTBEC-UHFFFAOYSA-N 338.367 1.574 10 10 EDCE CC1(C)CN(Cc2cc3c(cc2O)OC[C@@H]3O)C[C@@]2(CCOC2)O1 794695495 QZMVAGGAAPHRBA-MAUKXSAKSA-N 335.400 1.588 10 10 EDCE CC(C)N(CCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 92775588 UDWJBMSGSALSAA-GFCCVEGCSA-N 328.210 1.608 10 10 EDCE C[C@H](N)c1ccc(N2CC(=O)NC(=O)[C@H]2C)c(Br)c1 97292565 GCRCHOACHPBSNJ-JGVFFNPUSA-N 326.194 1.320 10 10 EDCE COC(=O)[C@H](C[C@@H]1CCCO1)NC(=O)/C=C/c1ccc(O)c(O)c1 1177476392 RBVOSQFHEFRPEO-YTDWTQRBSA-N 335.356 1.338 10 10 EDCE Cn1cc(CCC(=O)NCc2ccc(N3CCC(O)CC3)cc2)nn1 1328432679 SMZZADSJNHTESM-UHFFFAOYSA-N 343.431 1.025 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2[nH]ccc2C)cc1C 1331709984 ZRJOLPYAOXRGNJ-HNNXBMFYSA-N 331.416 1.521 10 10 EDCE CCOc1ccc(N2CCN(C[C@@H]3CCCS3(=O)=O)CC2)cc1 1333142095 HZDORLGBDNHPOP-KRWDZBQOSA-N 338.473 1.785 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)C[C@H]2COC(=O)C2)cc1C 1277793806 VUKVBMYLHNTIQX-GDBMZVCRSA-N 348.443 1.893 10 10 EDCE Cn1cnnc1[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1441233177 ACVNQZDJUUICLN-LBPRGKRZSA-N 341.375 1.997 10 10 EDCE C[C@@H](CNC(=O)[C@H]1CCCO1)NC(=O)c1ccc(N=NC(N)=O)cc1 1526372030 GSHPSYLRXDBUBC-GXFFZTMASA-N 347.375 1.263 10 10 EDCE CO[C@H](CS(=O)(=O)Nc1ccc(O)cc1C(N)=O)C1CCCC1 1615587690 JBYDQDIAALJANX-CQSZACIVSA-N 342.417 1.438 10 10 EDCE COCCN(C)C[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1714906378 DMSUFOROAULCTE-CYBMUJFWSA-N 347.419 1.889 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CO[C@@H]2CCOC2)cc1C 1714236522 PTCNQRMPEMACTF-GOEBONIOSA-N 336.432 1.403 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H](Cn3ccnn3)C2)cc1 1636871786 WKCYWQRFVCCQCM-GFCCVEGCSA-N 341.375 1.993 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@@H]2CCN(C)C2)C2CC2)cc1C 1733189105 AWEKFAHDOOVNQP-QZTJIDSGSA-N 345.487 1.940 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2cn(C)cn2)cc1C 1676331726 YLCDUUWKPVQPML-CQSZACIVSA-N 330.432 1.987 10 10 EDCE CCN1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])CC1=O 1772914738 IUXZWUPQUFNUEV-ALCCZGGFSA-N 333.344 1.450 10 10 EDCE COCCNC[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1690759677 GHRFELIZDDZJLR-LBPRGKRZSA-N 333.392 1.547 10 10 EDCE C[C@H](C(=O)NCC(=O)O)N1C(=O)/C(=C/c2ccco2)SC1=S 15047803 NLMXUHSULGKXSU-WVXOVRIESA-N 340.382 1.070 10 10 EDCE CCOC(=O)C[C@H](O)CN1CCN(c2ccc(OCC)cc2)CC1 1118815451 JHUCHJFJYMFVDS-INIZCTEOSA-N 336.432 1.521 10 10 EDCE COc1ccc(Br)c(CNCCOCCCO)c1O 1964051559 CIQGPNAQAVCFAA-UHFFFAOYSA-N 334.210 1.652 10 10 EDCE CNC(=O)CCCNCc1c(Br)ccc(OC)c1O 1964034519 GBZQDEHNBIPNCJ-UHFFFAOYSA-N 331.210 1.779 10 10 EDCE [N-]=[N+]=NCCCCNS(=O)(=O)N1CC(OCc2ccccc2)C1 1977424833 IIQDXYNTTHAXQR-UHFFFAOYSA-N 339.421 1.812 10 10 EDCE CN1CCc2cc([C@@H](N)C3(NC(=O)OC(C)(C)C)COC3)ccc21 2005297849 QVGRKSNTFQUUBX-OAHLLOKOSA-N 333.432 1.972 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@@H]1CCCO1 1985102576 IRURBPKTBBMRJK-WDEREUQCSA-N 325.369 1.580 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@H]1COC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985101559 UOQABOZKKBAJIT-QWRGUYRKSA-N 325.369 1.389 10 10 EDCE CO[C@@H]1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C[C@@H]1F 2146474419 VDLSYLRFRIZWPJ-XXILOJSOSA-N 345.168 1.608 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)Cn1cc(CNC(=O)OC(C)(C)C)nn1 2010406702 XZFDCRLICYYCJN-UHFFFAOYSA-N 338.372 1.072 10 10 EDCE C[C@@H]1C[C@H](CO)CN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2156550984 KIBAMGGAOFFHCD-BFHDXFOESA-N 341.205 1.642 10 10 EDCE CN(CCNCc1cc(Cl)cc(Cl)c1O)S(C)(=O)=O 692487848 CLEDXNCYNTTXJJ-UHFFFAOYSA-N 327.233 1.680 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@]1(O)CCc2cc(F)ccc21 2062521479 KQJYEGITFFCFAU-GOSISDBHSA-N 331.343 1.730 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1CCN(C2COC2)C1 2169579070 HJRCDQSSIKZLCL-LLVKDONJSA-N 345.212 1.857 10 10 EDCE Cc1nn(C)c(CNCc2ccc(O)c(O)c2O)c1Br 2192410023 HUSCTGVGUYEZGA-UHFFFAOYSA-N 342.193 1.898 10 10 EDCE CN(CC1CN(C(=O)OC(C)(C)C)C1)C(=O)COc1ccc(N)cc1 2044645222 YZKJCFKBONALST-UHFFFAOYSA-N 349.431 1.973 10 10 EDCE C[P@]1(=O)C[C@H](O)[C@@H](NCc2c(O)cccc2Br)C1 2057718214 GVEYKMUTXARHFL-KWFDTGPKSA-N 334.150 1.980 10 10 EDCE O=C1NC[C@@H]2CN(c3ccc(CO)cc3Br)CC[C@H]12 2100940128 FOJDIWUOUBUEFE-MNOVXSKESA-N 325.206 1.514 10 10 EDCE C[C@H](O)c1ccc(N2CC(=O)N[C@H]3CC[C@@H]32)cc1Br 2112060446 FFBULDRWFRCFFD-HJIKLVIJSA-N 325.206 1.970 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3COC[C@]3(CO)C2)cc1Br 2234557519 BPMMKXGNUOJMSR-QMTHXVAHSA-N 345.212 1.492 10 10 EDCE COc1ccc(N2C[C@H](O)C[C@]2(C)CO)c(OC)c1Br 2234881158 OOVBMCKOUKOVLY-YMTOWFKASA-N 346.221 1.788 10 10 EDCE C[C@H]1OC2(C(=O)N(C)CCN=[N+]=[N-])CC1(NC(=O)OC(C)(C)C)C2 2247287600 PNVADDMIPBEXSA-SFNBMPIDSA-N 339.396 1.970 10 10 EDCE COCCNC(C)=C1C(=O)N(c2ccccc2)N=C1CC(=O)OC 2294492908 RUYMIIDMHBLBRN-UHFFFAOYSA-N 331.372 1.462 10 10 EDCE O=C(O)C[C@H](C(=O)O)N1C(=O)C(=Cc2ccco2)SC1=S 2293202071 JCEUAIVUPQJNHL-SSDOTTSWSA-N 327.339 1.409 10 10 EDCE O[C@H]1COC2(CN(c3ccc(OCc4ccccc4)cc3)C2)[C@@H]1O 2299525790 QWYUDVYVWYHXNN-ZWKOTPCHSA-N 327.380 1.576 10 10 EDCE C[C@@H]1CN(CCCNC(=O)CN(C)Cc2ccccc2O)C[C@@H](C)O1 171936612 CMZLROYESAMYGT-HZPDHXFCSA-N 349.475 1.440 10 10 EDCE NC(=O)CCCNC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 175308217 KOMUONWYCUDHMX-UHFFFAOYSA-N 336.347 1.457 10 10 EDCE Cc1cccc(N2CCN(C(=O)CN3C(=O)CSC3=S)CC2)c1 82314501 HHNHMTFEHUVEJP-UHFFFAOYSA-N 349.481 1.504 10 10 EDCE O=C(O)c1cc(O)ccc1NS(=O)(=O)c1cccnc1Cl 48847201 BLSUHONMJBNMFE-UHFFFAOYSA-N 328.733 1.940 10 10 EDCE COc1ccc(N2CCN(CC(=O)N3C[C@H](C)O[C@H](C)C3)CC2)cc1 97653833 CJAGYZYTENYLGH-IYBDPMFKSA-N 347.459 1.453 10 10 EDCE OC[C@@]1([C@H](NCc2ccc(N3CCOCC3)cc2)C2CC2)CCCO1 816667054 BBGATKICBQLSKS-WOJBJXKFSA-N 346.471 1.933 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CCC(O)CC3)c(Br)cc21 118711308 UIXPRHYZWZCLGE-CYBMUJFWSA-N 340.221 1.623 10 10 EDCE O=C(O)c1ccc(COn2c(=O)c(=O)oc3ccc(Cl)cc32)o1 821297096 LRECIORPOMODNW-UHFFFAOYSA-N 337.671 1.528 10 10 EDCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)C[C@@H](OC)C2CC2)c1 827195304 YPUJATFBDWUBCR-MEBBXXQBSA-N 329.418 1.806 10 10 EDCE CS[C@@H]1CC[C@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 822455351 DLJXVVAMABXUOC-HZPDHXFCSA-N 340.514 1.905 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CC[C@H]2C[C@@H]2C1 834774563 AZEPTNHYRJFICV-GVDBMIGSSA-N 339.439 1.984 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(C)[C@@H](CO)C1 913552211 IQQDMKHWTUSLRO-CQSZACIVSA-N 333.457 1.904 10 10 EDCE COCC1(S(=O)(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 849417214 LWIWAYKWBXPZEV-CYBMUJFWSA-N 340.445 1.372 10 10 EDCE CO[C@H](CS(=O)(=O)Nc1ccc(O)cc1C)C1CCOCC1 842585094 RFANNHKIGRNDNC-OAHLLOKOSA-N 329.418 1.884 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C4CCC3(C(N)=O)CC4)ccc21 915390458 NAZDETSHUHRZIM-UHFFFAOYSA-N 342.443 1.761 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CC[C@@H]1C[C@H](C(=O)O)CO1 911409013 FCPNCSWOOCPZFL-GOEBONIOSA-N 334.416 1.947 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnn4ncccc34)C2)cc1 855225542 KLZAOCLOSDCQLZ-ZDUSSCGKSA-N 337.383 1.747 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCC(C)(C)CO)C2)cc1 854298168 XKCXJMLXJPRGFO-AWEZNQCLSA-N 335.448 1.982 10 10 EDCE COCCN(CCF)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852450749 UMGJPMYYYLNMSJ-CQSZACIVSA-N 339.411 1.901 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC(C)(C)CN(C)C)C2)cc1 854296838 HBGDZVFKMZQCFP-CQSZACIVSA-N 334.464 1.913 10 10 EDCE COC(=O)[C@]1(OC)CCN(Cc2ccc(N3CCOCC3)cc2)C1 862473639 CTKYVHSFRRPTAF-SFHVURJKSA-N 334.416 1.287 10 10 EDCE Cc1cc(C(=O)COC(=O)CC(N)=O)c(C)n1-c1ccc(F)cc1 787943602 NLLRVSMXSOVEEM-UHFFFAOYSA-N 332.331 1.835 10 10 EDCE Cn1nccc1C1=CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 795656489 OSAXNZRCYRZFGN-KRWDZBQOSA-N 327.384 1.841 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@]3(C)CCC(=O)NC3)CC2)cc1 798350417 IDLOTXQGZKFIDV-SFHVURJKSA-N 331.416 1.260 10 10 EDCE COc1ccc(CNC(=O)c2cccc3nc(CO)[nH]c23)c(O)c1 1155573928 DHCSZIJNGZHXLN-UHFFFAOYSA-N 327.340 1.699 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CCS(=O)(=O)c2ccccc21 1304053592 OXEZMZYTEOGPDN-LBPRGKRZSA-N 347.392 1.675 10 10 EDCE CC12CC(CN1C(=O)C(=O)NCc1ccc(N3CC=CC3)cc1)C2 1328396352 XADXXYRPQSKNQL-UHFFFAOYSA-N 325.412 1.690 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2[nH]ccc2C)cc1C 1331709986 ZRJOLPYAOXRGNJ-OAHLLOKOSA-N 331.416 1.521 10 10 EDCE Cc1cnc2c(cnn2CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 1296245073 BRCVVGASEBSMQR-LBPRGKRZSA-N 340.383 1.898 10 10 EDCE COc1ccc(C(=O)NCc2cc(O)ccc2O)cc1-n1cnnn1 1471661645 WGGFUDLIRWNFDJ-UHFFFAOYSA-N 341.327 1.012 10 10 EDCE COC(=O)Cc1ccccc1CNC(=O)Cc1ccc(O)c(O)c1 1627328276 VDSQKIVARGHRIT-UHFFFAOYSA-N 329.352 1.672 10 10 EDCE Cn1ccnc1N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1629921242 WRYNDIRACQJGDV-UHFFFAOYSA-N 341.375 1.545 10 10 EDCE CC[C@H](CNC(=O)[C@H](C)NC(N)=O)NCc1ccc(OC)c(C)c1 1715061363 ULOBYELLPARHOD-GXTWGEPZSA-N 336.436 1.045 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)c(Br)c1 2136835873 ZSOHQAGAQZGDCM-FZZIBODNSA-N 329.238 1.791 10 10 EDCE COc1ccc(CNC[C@@H]2CN(C(=O)CNC(C)=O)C[C@@H]2C)cc1C 1724569671 JAOANRVARQMYMI-WMLDXEAASA-N 347.459 1.324 10 10 EDCE CCO[C@H]1C[C@H](O)C12CCN(C(=O)Cc1ccc(O)c(O)c1)CC2 1565910813 GVPLXFAMJDHKBB-HOTGVXAUSA-N 335.400 1.419 10 10 EDCE NCc1ccc(N2CC[C@]3(C[C@H](O)CO3)C2)c(Br)c1 2137139566 ZGNPHHJGRKYEIH-FZMZJTMJSA-N 327.222 1.638 10 10 EDCE CCS(=O)(=O)C[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1633698946 YSEPVHCRXBAHCQ-JTQLQIEISA-N 340.405 1.744 10 10 EDCE CC[C@@H](CNC(=O)C(C)(F)F)NC(=O)c1cc(OC)nc(OC)c1 1738099426 CFSYEGRPRNKPMI-JTQLQIEISA-N 345.346 1.379 10 10 EDCE CN1[C@@H](CNCc2ccc(Br)cc2O)CCS1(=O)=O 1967746175 DQOGINWXOHHQKF-LLVKDONJSA-N 349.250 1.278 10 10 EDCE CN(C)c1ccc([C@@H](O)CN2CC(NC(=O)OC(C)(C)C)C2)cc1 2003462343 ZIDCOTFJKWWPBE-INIZCTEOSA-N 335.448 1.995 10 10 EDCE C[C@H]1CN(Cc2cc(Br)cc(F)c2O)[C@H](C(=O)O)CO1 1968206199 TZIIKVVLMKVUOY-CPCISQLKSA-N 348.168 1.968 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)OC(C)(C)C)c(O)c1 1985776834 CRNJLNOTRAFPIC-GFCCVEGCSA-N 326.393 1.376 10 10 EDCE CC(C)(C)OC(=O)NC1CN(CC(=O)N2CC[C@H](CN=[N+]=[N-])C2)C1 2010388954 JJTXQUZIYZWPOJ-LLVKDONJSA-N 338.412 1.354 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010402699 UTRUTKKPSHIVST-NWDGAFQWSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NCc2ccc(F)cc2O)C1 2024891748 BICTYMIGNIWUDC-KGLIPLIRSA-N 340.395 1.991 10 10 EDCE CCN[C@@H](C)c1ccc(N(C)C(CO)CO)cc1Br 311803752 ZZULOSICFCTUDG-JTQLQIEISA-N 331.254 1.909 10 10 EDCE CN(CCO)CCN(C)c1cc(Br)c(CN)cc1F 691298557 RLCNJSUTYPDOHD-UHFFFAOYSA-N 334.233 1.407 10 10 EDCE C[C@@H]1C[C@@H]2CN(c3ccc(CO)cc3Br)CCN2C1=O 2181181930 KFQDTLCTIVKBBT-ZYHUDNBSSA-N 339.233 1.998 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2210540320 NFPJFZUZKGDHLD-QWRGUYRKSA-N 327.385 1.875 10 10 EDCE NC1CN(C2CCN(Cc3c(O)cccc3Br)CC2)C1 2233401476 QIJKUJAOWFTMPP-UHFFFAOYSA-N 340.265 1.762 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)C[C@H]2CO)c(Br)c1 2335184081 ZQSYCODGMUJSNR-DLOVCJGASA-N 329.238 1.661 10 10 EDCE COc1ccc(Br)c(CN(C)[C@@H]2CNC[C@@H]2F)c1O 2343638333 BDRPEPZAILUFNB-WDEREUQCSA-N 333.201 1.905 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H]3[C@@H]4CO)c(Br)cc21 2358071357 REIXOHBKYWUFLF-ISSWRMLHSA-N 338.205 1.218 10 10 EDCE Cc1cccn2c(=O)c(C(=O)NCc3ccc(O)c(O)c3)cnc12 182537393 QHIUSBPKTRMHCH-UHFFFAOYSA-N 325.324 1.344 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H]3C(=O)NCC[C@@H]3C)CC2)cc1 194036212 GZAZSSDBOBFBDQ-BBRMVZONSA-N 346.431 1.051 10 10 EDCE CNC(=O)[C@]1(C)CCN(c2ccc(CN)c(Br)c2)C1 230893139 GETXREULPUXTOZ-CQSZACIVSA-N 326.238 1.870 10 10 EDCE Cc1ccc(CN2CCO[C@@H]3[C@H](C(=O)O)[C@H]32)c(O)c1Br 2380809850 CXYGGCFEOVPORZ-IRUJWGPZSA-N 342.189 1.747 10 10 EDCE CCO[C@@H](CN)CC(=O)NCc1ccc(C)c(Br)c1O 2381136185 BQLHZJLUJMPZRI-LLVKDONJSA-N 345.237 1.833 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](CO)[C@H](CO)C2)c(Br)c1 704786545 WQTBFEHYTRQKDG-DRZSPHRISA-N 343.265 1.767 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CCC[C@@H](CO)C1 298249536 MVAPPRRDDLQYKS-SJORKVTESA-N 347.459 1.874 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@@H](C(F)F)C2)cc1 801560628 RTZUCWVMNKZTHH-CQSZACIVSA-N 327.375 1.335 10 10 EDCE Cn1ccnc1COCC(=O)NCc1ccc(N2CCCC2)cc1 816867358 MTMFNINYCRXBTL-UHFFFAOYSA-N 328.416 1.853 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](C)CF)CC2)cc1 817119198 XBDDPBNVJOZRPF-DANTVBBOSA-N 349.406 1.374 10 10 EDCE CN1CCCc2cc(CNC(=O)c3nnn(C(C)(C)C)n3)ccc21 824676584 MVOPOMLIIOOZRM-UHFFFAOYSA-N 328.420 1.741 10 10 EDCE CN1CCC(N(C)CCN(C)C(=O)/C=C\c2ccc(O)c(O)c2)CC1 588406458 BCLNMVJKIUHTGX-ALCCZGGFSA-N 347.459 1.595 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H]2CCc3nnn(C)c3C2)cc1 913926498 FALYTYIQPDQFQM-CYBMUJFWSA-N 328.420 1.238 10 10 EDCE CN(C)CCN1CCN(C/C=C/c2ccc(N(C)C)cc2)CC1=O 846012438 AWIWQAGUQVRNDT-AATRIKPKSA-N 330.476 1.472 10 10 EDCE COCc1n[nH]c(CNCc2cccc(Br)c2O)n1 850360265 FRABRBVEHXBUDC-UHFFFAOYSA-N 327.182 1.709 10 10 EDCE COC(=O)CN(CCc1cn(C)nn1)Cc1cc(Cl)ccc1O 859189556 VGBNBBWRJBQSTE-UHFFFAOYSA-N 338.795 1.392 10 10 EDCE OC1CCN(c2ccc(CNC[C@@H](O)c3cccnc3)cc2)CC1 853122911 VTRLUGXXXBNFLC-LJQANCHMSA-N 327.428 1.866 10 10 EDCE COC(=O)C1(CS(=O)(=O)NCc2ccc(N(C)C)cc2C)CC1 866797951 WZUZQKVCCBQICQ-UHFFFAOYSA-N 340.445 1.434 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1C[C@@H](C(N)=O)C1 862129109 MRTOERICFQQGRY-OTVXOJSOSA-N 339.395 1.900 10 10 EDCE CNC(=O)CCOC1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779529325 OCAJEUIOUMREFQ-HWKANZROSA-N 348.399 1.255 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)c1cnn(C(C)(C)C)c1 773739517 BCQYUCOPXJFVEM-LLVKDONJSA-N 345.399 1.979 10 10 EDCE CN1CCCc2cc(CNC(=O)C3CN([C@@H]4CCOC4)C3)ccc21 895979916 DPPHWHBLYJVPPM-QGZVFWFLSA-N 329.444 1.406 10 10 EDCE CCCN1C[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1=O 1162249198 OWYFEAMFKUVMPN-LLVKDONJSA-N 331.376 1.837 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)[C@@H](CO)C2)cc1Br 704451518 KBTVKGGIWVEDSC-MXWKQRLJSA-N 330.222 1.539 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)[C@@H]1CCC[C@H]1O 708603204 YEIWPZUYMJUHNN-RTXFEEFZSA-N 341.205 1.784 10 10 EDCE CCOCC(=O)NC[C@H](CC)NC(=O)c1ccc(N=NC(N)=O)cc1 1297349230 HSENORQKIHPYAK-LBPRGKRZSA-N 349.391 1.510 10 10 EDCE COC(=O)c1ccc(NC(=O)c2ccc(C3=S=CC=C3)o2)nn1 1524447721 XBTKFPPCVDOIDA-UHFFFAOYSA-N 329.337 1.734 10 10 EDCE CC(=O)N1CC[C@](C)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1536925690 POIWLVDYUIBENG-MRXNPFEDSA-N 331.376 1.837 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2oncc2C)cc1C 1700826491 VXADRMMIKCBOPA-CQSZACIVSA-N 333.388 1.181 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC(N3CCNC3=O)CC2)cc1 1544867529 HLSCYCLEOPLENU-UHFFFAOYSA-N 344.375 1.479 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2[nH]nnc2C)cc1C 1715351831 LMUCQONQSOUNGW-LBPRGKRZSA-N 331.420 1.680 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccccn2)cc1C 1715577062 ZFJSPWYETJCXPD-OAHLLOKOSA-N 329.400 1.279 10 10 EDCE Cn1cc([C@@H](NC(=O)Cc2ccc(O)c(O)c2)C2(CO)CCC2)cn1 1569506630 SBKYVKVOZCIJAQ-QGZVFWFLSA-N 345.399 1.394 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@H](O)C2(C)C)c(Br)c1 2124799976 JGHGNYOVVNNBEM-WQHBLYJGSA-N 329.238 1.789 10 10 EDCE Cc1c(O)nc(CCN(C)C(=O)/C=C\c2ccc(O)c(O)c2)nc1O 1597548607 ISEVMOVTLUJSPE-XQRVVYSFSA-N 345.355 1.322 10 10 EDCE O=C(CCN1C(=O)CSC1=S)Nc1ccc(F)cc1[N+](=O)[O-] 1865767713 CECQDBQAKFBITG-UHFFFAOYSA-N 343.361 1.923 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](C(=O)NCCN=[N+]=[N-])OCC12CC2 1986284444 IVPYFEVLOIZZNT-SNVBAGLBSA-N 325.369 1.581 10 10 EDCE CC(C)(C)OC(=O)NCc1cn(C2CN(CCCN=[N+]=[N-])C2)nn1 2006174832 LVFGAIDIRKOZJU-UHFFFAOYSA-N 336.400 1.860 10 10 EDCE Nc1ccc(N2C(=O)[C@H]3[C@@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1Br 2153256018 PHLPXCSTTIBHMQ-USZNOCQGSA-N 337.173 1.698 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N2CC[C@H](CN=[N+]=[N-])C2)C1 2010389034 KMKYVXYOUQUHII-LLVKDONJSA-N 339.396 1.781 10 10 EDCE C[C@H](NC(=O)[C@@H](CO)CNC(=O)OC(C)(C)C)c1ccccc1O 2017519243 QMJQRVJAZHCYIK-NWDGAFQWSA-N 338.404 1.703 10 10 EDCE O=S(=O)(NCCNCc1ccc(Cl)cc1O)C(F)(F)F 2159529735 XLPHTADVXXNXDG-UHFFFAOYSA-N 332.731 1.574 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@@H]2O 2174411405 DJPSSSOQCIFMJE-LGIWVTCOSA-N 342.233 1.622 10 10 EDCE COC(=O)[C@H](CC(=O)OC(C)(C)C)NCc1cc(F)ccc1O 2070353274 VLRCGEVVEIZQGX-LBPRGKRZSA-N 327.352 1.894 10 10 EDCE CNCc1ccc(N2C[C@@H]3OC(=O)N(C)[C@@H]3C2)cc1Br 2176933058 MGLYEYALMGJMEY-OLZOCXBDSA-N 340.221 1.808 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@@H]2OCC[C@@H]2N1C(=O)OC(C)(C)C 1908253517 UZGBZLKKBLXWIH-SRVKXCTJSA-N 339.396 1.922 10 10 EDCE C[C@@H](O)c1ccc(N2CC(CS(C)(=O)=O)C2)c(Br)c1 2103222692 VQBNSISVLHWQPR-SECBINFHSA-N 348.262 1.983 10 10 EDCE C[C@H](O)c1ccc(N(C)[C@H]2CC(=O)NC2=O)cc1Br 2114727955 UOBFVZQGMGIREQ-CPCISQLKSA-N 327.178 1.354 10 10 EDCE Cn1nc(Br)c(C(=O)Nc2ccc(O)cc2C(=O)O)n1 2235275867 AVQHXNJIQXWEQL-UHFFFAOYSA-N 341.121 1.234 10 10 EDCE O=CN1CCC(OC(=O)C=Cc2ccc(N3CCOCC3)cc2)CC1 2307891020 JHWKDHJCAMJLQB-UHFFFAOYSA-N 344.411 1.700 10 10 EDCE Cc1ccc(CN2CCOC[C@@H]2C(=O)O)c(O)c1Br 2352682268 YXYQYAIMICVAFD-SNVBAGLBSA-N 330.178 1.749 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@H](C)[C@@H]3CCCO3)CC2)cc1 183152413 PGVHCBMCHFHOOB-QAPCUYQASA-N 347.459 1.501 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)[C@H]3CCO[C@@H]3C)CC2)cc1 189940039 VEDOVQDPLDNMBP-CJNGLKHVSA-N 340.445 1.324 10 10 EDCE CCS(=O)(=O)NC1CCN(Cc2cc3c(cc2O)CCC3)CC1 193386889 LETAKXCTZCWPED-UHFFFAOYSA-N 338.473 1.785 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@H]3[C@H](CCCN3C)C2)cc1 252653402 YTRGFEOQRNFBGF-IEBWSBKVSA-N 344.503 1.785 10 10 EDCE COc1ccc([C@@H]2[C@@H](C(=O)OCC(=O)C(C)=O)CCC(=O)N2C)cc1 808518260 FESMHEDZODCCTP-WMLDXEAASA-N 347.367 1.306 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC[C@H](O)CN1CCN(C)CC1 819376733 IKIUIBHWQWWJKB-XLIONFOSSA-N 348.535 1.190 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC[C@H](O)C3(C)C)CC2)cc1 812864278 CWVSWLHFSWSDBV-KRWDZBQOSA-N 347.459 1.189 10 10 EDCE CCn1nnc(C)c1C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 819591017 NEBJXWHUVYXBFV-CQSZACIVSA-N 343.431 1.871 10 10 EDCE CCN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1cccc(Cl)c1 490638744 JJPWJBYFMAXKPR-CMDGGOBGSA-N 347.802 1.804 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)N1C(=O)[C@@H]2[C@@H](O)CCCN2C1=O 842264546 KFGNNPRRUAIAMR-JQFCIGGWSA-N 345.443 1.780 10 10 EDCE CC(C)C[C@H](NC(=O)Nc1ccc(N)cc1)C(=O)NCCN(C)C 841298197 NMLOLUBRFARAIE-HNNXBMFYSA-N 335.452 1.483 10 10 EDCE O=S(=O)(C[C@@]12CCCN(CC1)C2)NCc1c(O)cccc1F 921450695 CZSXILNURIYUSB-HNNXBMFYSA-N 328.409 1.437 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCOC[C@H](C)C3)C2)cc1 854300492 UQKZATOKOAUAND-CABCVRRESA-N 333.432 1.952 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC1CC(CC(N)=O)C1 922912464 INCFAOAPYOEPPR-HLIUYOAVSA-N 346.475 1.945 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@](F)(CO)C3)C2)cc1 854297268 LNNLULFUDCBBLI-DYVFJYSZSA-N 337.395 1.390 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCCN(C)C3=O)C2)cc1 855227774 YUFAIKFDJIMAMY-CJNGLKHVSA-N 331.416 1.259 10 10 EDCE CNC(=O)CCCCC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855228237 YBWSDJDAMGUVBB-AWEZNQCLSA-N 333.432 1.697 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](C)[C@H](CO)C3)C2)cc1 856920273 RZLOCRJRGUXNQA-JYJNAYRXSA-N 347.459 1.934 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CC3CSC3)cc2)C1 864954201 MNCYIUMZXUNHBR-OAHLLOKOSA-N 347.484 1.758 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)c3nccn3C)cc2)CC1 786173100 IHJVAHSNELVORB-UHFFFAOYSA-N 341.415 1.019 10 10 EDCE CN(C)c1ccc(CN2C[C@H](O)C[C@H]2C(N)=O)c(C(F)(F)F)c1 895367298 AVEBADCZDZEXEB-YPMHNXCESA-N 331.338 1.192 10 10 EDCE C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H](C)[C@@H](C)O1 783814054 NQMWKAFQMIWCCK-GMTAPVOTSA-N 342.417 1.402 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1CN([C@@H]2CCOC2)C1 897984314 VJVQEBDZLFCHKC-DNVCBOLYSA-N 345.487 1.829 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CC[C@@H](C(N)=O)C3)C2)cc1 1130826782 JNAHCIACNILVNK-RDBSUJKOSA-N 331.416 1.292 10 10 EDCE CN(C)C(=O)N1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 895695486 YAQUCSBRCNEMLI-UHFFFAOYSA-N 349.412 1.752 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCOC[C@H]1CC1CCOCC1 1304631147 DADAXBUHGASPII-OAHLLOKOSA-N 335.400 1.684 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@@H](C)[C@H](O)C3)C2)cc1 1312901766 HSOCGZFTFJGXSL-IIDMSEBBSA-N 347.459 1.934 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC([C@@H](C)O)C3)c(Br)cc21 719789301 DORTUMYONSJOEI-FUXBKTLASA-N 340.221 1.479 10 10 EDCE O=C1C[C@@H](C(F)(F)F)[C@H](C(=O)NCc2cccc(O)c2O)CN1 1347542169 KSQXKPSRENIWKF-RKDXNWHRSA-N 332.278 1.029 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3C=CCCC3)C2)cc1 1350766497 FSQVSLKYCUQYPF-CABCVRRESA-N 343.427 1.615 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@@H]2CC2(F)F)cc1C 1284399813 IQMNBVKAPDPJRO-KBPBESRZSA-N 342.386 1.568 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CC1=O 1294085433 YMLOKCRBSSTCBS-ICCXJUOJSA-N 329.360 1.588 10 10 EDCE CO[C@@H](C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1)C(C)C 1292894289 JVHZPVWRBWNPNQ-CYBMUJFWSA-N 349.391 1.366 10 10 EDCE COCCOc1cccc(CC(=O)NCc2c(O)cccc2O)c1 1472064500 ZFZFTGFLXRVVRK-UHFFFAOYSA-N 331.368 1.982 10 10 EDCE CO[C@H](C)C(=O)N[C@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1701632542 UUQLZPMYBJEOBD-GHMZBOCLSA-N 349.391 1.461 10 10 EDCE CC[C@@H](CN[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1)OC 1491691402 GMYXNIYYUNSGSZ-FZMZJTMJSA-N 335.408 1.982 10 10 EDCE CNCc1ccc(N(C)Cc2nnn(C)n2)cc1Br 1892993010 PVIQGUBZAJDCBT-UHFFFAOYSA-N 325.214 1.328 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)CCn2cncn2)cc1C 1733962376 JXASBTBFIBJXNU-HUUCEWRRSA-N 345.447 1.668 10 10 EDCE COC(=O)N1C[C@H]2C=C[C@H]1[C@@H](C(=O)NCc1cc(O)ccc1O)C2 1643882075 MNIGUNRSOJETAI-BPNCWPANSA-N 332.356 1.357 10 10 EDCE COc1ccc(CNC[C@@H]2CCN(C(=O)CN(C)C(C)=O)C2)cc1C 1662597151 PLBYPDMDAYXRQD-KRWDZBQOSA-N 347.459 1.420 10 10 EDCE C[C@H](Oc1ccc(N)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1 1860079208 XKCLTBQLECHSSI-JTQLQIEISA-N 335.385 1.322 10 10 EDCE CNCc1ccc(N2CC(=O)NC(=O)[C@H]2C)cc1Br 234423170 ONUCFVPJXHWICL-MRVPVSSYSA-N 326.194 1.020 10 10 EDCE C[C@@H](N)c1ccc(N2CC(=O)NC(=O)C2(C)C)cc1Br 235211008 GHJHLAURLGAGRA-MRVPVSSYSA-N 340.221 1.710 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)c(Br)c1 2149912517 DKSXBNDNUFDIQM-RAIGVLPGSA-N 343.265 1.896 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)[C@@H]1CCCO1 2004956460 DWADSJIEVKIBBV-IMIFBBOLSA-N 340.420 1.324 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985093896 HARBKRUZRZAOTK-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NCc2cccc(F)c2O)[C@H](O)C1 1985826525 AMOCBKLPHULGLT-QWHCGFSZSA-N 326.368 1.601 10 10 EDCE CC(C)(C)OC(=O)NC/C=C/CNC(=O)COc1ccc(N)cc1 1999146227 JKCLYLXHKZGBNS-SNAWJCMRSA-N 335.404 1.845 10 10 EDCE CC1(C)C[C@@H](O)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2154834264 ZXZISQSURMRQAX-JMCQJSRRSA-N 340.221 1.751 10 10 EDCE CN[C@H](C)c1ccc(N(C)[C@H]2CC(=O)NC2=O)cc1Br 2171205691 RBJFRFZANQUNIB-PELKAZGASA-N 340.221 1.581 10 10 EDCE CCOC(=O)Cc1cc(O)n2nc(C(F)(F)F)c(C(=O)O)c2n1 2080924802 YIKSRUYSEKFCEH-UHFFFAOYSA-N 333.222 1.258 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1907494084 PHZIKVVOWQFVCK-ZDEQEGDKSA-N 340.420 1.182 10 10 EDCE Cn1c(Br)nnc1CCNCc1cc(F)cc(F)c1O 2185200977 PIUJROOGPDDKJJ-UHFFFAOYSA-N 347.163 1.894 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NC(=O)CCc1ccc(N)cc1 2044227577 YVGXSHWKGFKWQG-LSDHHAIUSA-N 349.431 1.610 10 10 EDCE CN1CCc2cc([C@H](N)CN3CC(NC(=O)OC(C)(C)C)C3)ccc21 2050180351 QPTCJNKJVQRSIB-MRXNPFEDSA-N 346.475 1.888 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCc2ccc(N)cc2)C[C@H](CO)C1 2073596135 DRWWMPZSZFXFTE-QGGXVJLZSA-N 349.431 1.551 10 10 EDCE CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=CNC[C@H]1CCCO1 2293031376 GRZJLYNWHJBCAU-CQSZACIVSA-N 330.344 1.970 10 10 EDCE COc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3C)C2=O)cc1 2296668920 SLRHAGOQJRIGGA-UHFFFAOYSA-N 325.324 1.700 10 10 EDCE CCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1cccc(C)c1 490702849 OBBAACKVHDMIRL-KTKRTIGZSA-N 327.384 1.459 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2329326114 MELQUKUGBSFLIO-NTPXCIOMSA-N 327.222 1.399 10 10 EDCE Cc1ccc(CN[C@@H]2CO[C@H]3COC[C@H]23)c(O)c1Br 2352944537 JFJCETUDRSAWDD-UTUOFQBUSA-N 328.206 1.967 10 10 EDCE Cc1ccc(CN2CC(OCC(N)=O)C2)c(O)c1Br 2352946956 FBGFNOXCJGDVDK-UHFFFAOYSA-N 329.194 1.149 10 10 EDCE COC(=O)c1ccccc1N/C=C1\C(=O)NC(=O)N(C(C)(C)C)C1=O 59383123 IOFISEXSSOXQDD-PKNBQFBNSA-N 345.355 1.646 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2357592853 OMMZMMCTXLEQQK-AMPPCDIJSA-N 341.249 1.789 10 10 EDCE COc1ccc(CN2CCCC[C@H]2C(=O)N2CCOCC2)c(O)c1 93014972 JATPUGGWSNSTFY-INIZCTEOSA-N 334.416 1.614 10 10 EDCE COc1cc(O)c(CN2CC[C@H]3CC[C@@H](C2)[S@@]3=O)cc1OC 529675819 JRXZFGULMJKRRQ-GPAUDHNESA-N 325.430 1.895 10 10 EDCE Cc1cc(C(=O)NC[C@H]2CNC[C@@H]2O)c(C)n1-c1ccc(F)cc1 262252123 LQSDPPUHJHPXDF-DYVFJYSZSA-N 331.391 1.543 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1[C@@H]2CCCO[C@H]21 819697279 UMGMQATWJZESHA-IAOVAPTHSA-N 333.384 1.709 10 10 EDCE CN[C@H](C)c1ccc(N2CCOC[C@@H]2C(N)=O)cc1Br 723150706 LHKBFYVORDERER-NOZJJQNGSA-N 342.237 1.420 10 10 EDCE CNC(=O)[C@@H]1CCCN1C(=O)c1csc(Cc2ccc(N)cc2)n1 825541686 LLKXJFZPGMBGEF-AWEZNQCLSA-N 344.440 1.667 10 10 EDCE Cc1ccc(C(=O)OCC(=O)N2CCO[C@H]3CCCC[C@H]32)c(O)c1O 727004368 UKKPYTUSNNJHFR-KGLIPLIRSA-N 349.383 1.733 10 10 EDCE CC[C@@H](O)CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 822660079 JUJDZLAZPZOVPW-GOEBONIOSA-N 333.432 1.166 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C[C@]1(O)CCCN(C)C1 900400157 LCPJTVSQYQYVAT-LJQANCHMSA-N 333.476 1.948 10 10 EDCE COC(C)(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 837709648 MBVLWVDTVJIWCV-UHFFFAOYSA-N 328.359 1.843 10 10 EDCE CN1CCCc2cc(CNC(=O)[C@@]34C[C@H]5C[C@@H](C(=O)N3)[C@H]4C5)ccc21 844356371 HNVOPGWOORVQIQ-MNFOOTCESA-N 339.439 1.600 10 10 EDCE CC1(C)CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])C[C@@H](CO)O1 844214816 VENGHUAXMBGXNM-RNZFLTOJSA-N 336.344 1.669 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@]3(CCCCN3)C2)cc1 923532976 DEHWOPGBCDUDPF-IBGZPJMESA-N 330.476 1.587 10 10 EDCE COc1cc(Cl)cc(CN2C[C@@H](C)N(CCO)C[C@@H]2C)c1O 841890399 AKRKGSLDPDPDPE-NEPJUHHUSA-N 328.840 1.941 10 10 EDCE C[C@@H]1CC[C@@H](NCc2ccc(N3CCOCC3)cc2)CS1(=O)=O 850367983 GMCAZWQXQDWAAW-GDBMZVCRSA-N 338.473 1.579 10 10 EDCE Oc1cc2c(cc1CN1CCN(c3nccnn3)CC1)CCCC2 863271875 KDMACDNHRHFJIW-UHFFFAOYSA-N 325.416 1.778 10 10 EDCE CCn1ncc(CNCc2ccc(N3CCN(C)CC3)c(F)c2)n1 1118943122 XXMSNQVDLUSIJQ-UHFFFAOYSA-N 332.427 1.479 10 10 EDCE COc1ccc(CN[C@@H](C)c2nnc(O)n2C)cc1Cn1cccn1 895172970 YGXCFYZFYYOHNG-LBPRGKRZSA-N 342.403 1.625 10 10 EDCE NC(=O)[C@@H]1CC[C@H](C(=O)NCc2cc(Br)ccc2O)C1 897747018 BEAYQNQUOWUOOD-BDAKNGLRSA-N 341.205 1.673 10 10 EDCE NCc1cc(F)c(N2CC[C@H](NC(N)=O)C2)cc1Br 690786806 WGAJXULZTKJJSC-QMMMGPOBSA-N 331.189 1.294 10 10 EDCE O=C(c1cccc(O)c1O)N1CC(n2cc(Br)cn2)C1 1965364123 AMUMZUXDSJTFSR-UHFFFAOYSA-N 338.161 1.754 10 10 EDCE C[C@@H]1C[C@@H]1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1257235002 XQXBLGAFMAJCNR-BMFZPTHFSA-N 346.427 1.672 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)CCN(C)C)C2)cc1C 1263871898 ROFQLYJZLXIDJP-QAQDUYKDSA-N 333.476 1.940 10 10 EDCE CCS(=O)(=O)CC(=O)N[C@@H](C)CNCc1ccc(OC)c(C)c1 1268716906 MRBCZXYJMONYQP-ZDUSSCGKSA-N 342.461 1.033 10 10 EDCE CO[C@@H](C)C(=O)NC[C@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1505632111 FEQLPKSLRVRNJL-GXFFZTMASA-N 347.375 1.215 10 10 EDCE Cn1nc(C(=O)OC(C)(C)C)cc1C(=O)NCc1ccc(O)c(O)c1 1294869467 NIWOTAZVLCAKCZ-UHFFFAOYSA-N 347.371 1.717 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])N(C)C)cc1 1603555858 TYYIYCLBAKADEP-AWEZNQCLSA-N 346.391 1.417 10 10 EDCE C[C@@H]1[C@@H](CO)CCN1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1471547197 JXANYUUSQFDMBL-KYJSFNMBSA-N 348.491 1.768 10 10 EDCE CC[C@@H]1C[C@H]1C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1703235241 HYKVMQNOTMFTEO-ZWNOBZJWSA-N 331.376 1.741 10 10 EDCE Cc1ccc(C(=O)Nc2ccc(O[C@H]3CC(=O)N3)cc2)c(O)c1O 1627428805 MBHIEKBIVXTJNE-AWEZNQCLSA-N 328.324 1.883 10 10 EDCE Cn1c(=O)n(CC(=O)NCc2c(O)cccc2F)c2ccccc21 1558454706 KNPOXTMQRQYMEO-UHFFFAOYSA-N 329.331 1.501 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2cn(C)nn2)C(C)C)cc1C 1482527879 HTYPMZZEBZTDST-OAHLLOKOSA-N 345.447 1.676 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cc2cnn(C)c2C)cc1C 1713598914 HJWDVJLTNLDKPV-UHFFFAOYSA-N 344.459 1.836 10 10 EDCE COc1ccccc1C(=O)NCC(=O)N1Cc2cccc(O)c2C1 1558036014 OQKVEAGEIDFEGA-UHFFFAOYSA-N 326.352 1.673 10 10 EDCE C[C@H](O)c1cn(CC(=O)NCc2c(O)ccc3ccccc23)nn1 1635965242 RYIQVHXWOWCORL-NSHDSACASA-N 326.356 1.507 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@@H]2CC[C@@H](F)C2)cc1 1720146618 WBPIDRFKKBDMDI-VXGBXAGGSA-N 349.366 1.833 10 10 EDCE NC(=O)Cc1cccc2c1CCN(C(=O)c1cccc(O)c1O)C2 1635496105 LULYSIGAAWHNMI-UHFFFAOYSA-N 326.352 1.324 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)Cn3cccn3)C2)cc1C 1565860543 MBUJEWXTZJBPAB-QAQDUYKDSA-N 342.443 1.885 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CCN(C)C2)cc1C 1568317413 OFJCQYOFOHTCAP-RDJZCZTQSA-N 333.476 1.892 10 10 EDCE C[C@H](NC(=O)CNS(=O)(=O)c1ccccc1N)c1ccccc1O 1642830193 ADBANVUGIIFLAP-NSHDSACASA-N 349.412 1.130 10 10 EDCE CC[C@@H](CNCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1)OC 1731988212 BEVGNCUHISHDRG-AWEZNQCLSA-N 335.408 1.936 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H](c1ccccc1)c1nc[nH]n1 1640630179 URFMGWDWUQDEQQ-AWEZNQCLSA-N 338.367 1.707 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2ccc(-n3cnnn3)cn2)c1 1595806882 YVADASXAPWYAKK-JTQLQIEISA-N 340.343 1.263 10 10 EDCE COCCN1[C@@H](C)CN(Cc2cc(OC)c(OC)cc2O)C[C@@H]1C 160476869 XXCVMDSOSBPAKI-KBPBESRZSA-N 338.448 1.950 10 10 EDCE COCCN1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)C(C(=O)OC)=C1C 6172123 BDGKBMPVLQCALN-GXDHUFHOSA-N 346.339 1.914 10 10 EDCE Cc1ccc(O)c(CN2CCN(S(=O)(=O)c3cccnc3)CC2)c1 159904483 YFEPMRVXVORKRK-UHFFFAOYSA-N 347.440 1.602 10 10 EDCE CC(C)N(CCCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 118712127 KPJPCJNIIGWYMV-ZDUSSCGKSA-N 342.237 1.998 10 10 EDCE COCCNCc1ccc(N(C)CC(N)=O)c(Br)c1 234647124 IFMBVPWSDIJATD-UHFFFAOYSA-N 330.226 1.107 10 10 EDCE NCc1ccc(N2C[C@@H]3CCC[C@]3(C(N)=O)C2)cc1Br 2144089992 FETBOVVBLJYUOT-NHYWBVRUSA-N 338.249 2.000 10 10 EDCE CO[C@@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CCN(C(=O)OC(C)(C)C)C1 2003172801 QNNTZGBCNRPUGZ-PRXAMGSTSA-N 340.420 1.278 10 10 EDCE CN(C[C@H](O)C1CC1)c1cc2c(cc1Br)[C@H](O)C(=O)N2 690240317 KUTHGXABRBLEPJ-STQMWFEESA-N 341.205 1.642 10 10 EDCE O=C1CC[C@H](NCc2cc(Cl)cc(Br)c2O)C(=O)N1 708087870 DBXWERPIISVHCF-VIFPVBQESA-N 347.596 1.703 10 10 EDCE C[C@H](N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)c1ccc(O)cc1O 1908511069 LHBOXNMMJNPQHP-ZBINZKHDSA-N 338.404 1.729 10 10 EDCE NCc1cc(F)c(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)cc1Br 2190458163 LVWQLBSDVLKOBE-XBEUXYKBSA-N 345.212 1.510 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)c(Br)c1 2190456234 GBLSXPWNIMXTCR-HJPIBITLSA-N 341.249 1.631 10 10 EDCE NCc1ccc(N2CC[C@@]3(O)CCOC[C@H]3C2)c(Br)c1 2194550428 FQVNPOHXYRSNIQ-IUODEOHRSA-N 341.249 1.886 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@@H](CO)C[C@H]32)cc1Br 2199786207 MELYCWYFVXTULB-COLVAYQJSA-N 341.249 1.884 10 10 EDCE COC1(C(N)=O)CN(c2ccc([C@H](C)N)cc2Br)C1 2104900019 IDIRMTQGLQBAMK-QMMMGPOBSA-N 328.210 1.159 10 10 EDCE CN[C@H](C)c1ccc(N2CC(S(C)(=O)=O)C2)c(Br)c1 2095963929 ADMIQOXIXZPRKR-SECBINFHSA-N 347.278 1.963 10 10 EDCE COc1ccc(Br)c(CN2CC[C@H](N)[C@H](CO)C2)c1O 2236039781 DIPSCPJQUGOKON-CABZTGNLSA-N 345.237 1.305 10 10 EDCE COc1ccc(Br)c(CNCc2nccc(O)n2)c1O 2236053957 CJVBRSDWBBRAJB-UHFFFAOYSA-N 340.177 1.949 10 10 EDCE CC(C)(C)OC(=O)NC(CF)(CF)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2245989384 ZHGJEJFCIHQHOJ-MGCOHNPYSA-N 334.363 1.455 10 10 EDCE CNCc1ccc(N2CCC[C@H]3CNC(=O)[C@@H]32)c(Br)c1 2279281226 RVNFHHASKAOKKF-SMDDNHRTSA-N 338.249 1.883 10 10 EDCE C[C@@H](N)c1ccc(N2CC3(CNC(=O)CO3)C2)cc1Br 2289733760 UDAONBNJNVEOGM-SECBINFHSA-N 340.221 1.174 10 10 EDCE Cc1ccsc1C=C1SC(N2CCN(CCO)CC2)=NC1=O 2297498995 GOUFKQZTZLYDNZ-UHFFFAOYSA-N 337.470 1.637 10 10 EDCE CN(C)c1ccc(C=Cc2nc3ncnn3c(O)c2[N+](=O)[O-])cc1 2297533299 NCXKHJQLVYHAJZ-UHFFFAOYSA-N 326.316 1.975 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]2c2cnn(C)c2)cc1 173315893 TWGZYOSPDJOOGA-GOSISDBHSA-N 341.459 1.939 10 10 EDCE COC(=O)[C@H]1C[C@@H]1C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 177282245 MAEYUEYVVXJNIS-STQMWFEESA-N 336.363 1.292 10 10 EDCE O=C(NC[C@@H]1N[C@@H](CO)Cc2cccc(O)c21)OCc1ccccc1 309652730 AQLMNCJLAAWHDE-CVEARBPZSA-N 342.395 1.866 10 10 EDCE Cc1nn(C)c(C)c1CCNC(=O)[C@H](C)Cc1ccc(O)c(O)c1 170039220 IWZNPBGQPBRYNE-LLVKDONJSA-N 331.416 1.986 10 10 EDCE CCOc1ccc(O)c(CN2CCC(NS(C)(=O)=O)CC2)c1 123499758 BIZXQTMCYQMELY-UHFFFAOYSA-N 328.434 1.305 10 10 EDCE CCS(=O)(=O)N1C[C@H]2CN(Cc3ccc(N(C)C)cc3)C[C@@H]2C1 96094140 KOPTWENAKWQRGD-HZPDHXFCSA-N 337.489 1.466 10 10 EDCE O=C(NCc1ccncc1)N1CCN(c2ccc3c(c2)OCO3)CC1 243022403 HYCKRBSDSHFYOZ-UHFFFAOYSA-N 340.383 1.842 10 10 EDCE Cc1nn(C)c(C)c1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 276257378 ZQWCTOZXIZUILA-VIFPVBQESA-N 346.387 1.134 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCC2(F)CCC2)c1 807800609 KFLNKCXTWLLEBU-UHFFFAOYSA-N 330.381 1.776 10 10 EDCE CCN1CCO[C@H](C(=O)NCc2cc(Br)ccc2O)C1 804737852 REYUIGORRMTVBM-ZDUSSCGKSA-N 343.221 1.492 10 10 EDCE CC[C@@H](NCc1cc(Cl)c(F)cc1O)C(=O)N1CCOCC1 293559706 HYPPTNFOUZBGSC-CYBMUJFWSA-N 330.787 1.912 10 10 EDCE CO[C@H]1CCCC[C@@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 807073177 FTRLVFMHGDIITE-IRXDYDNUSA-N 347.459 1.785 10 10 EDCE CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@H]1CCN(C)C1 828438472 WTYHIWZBFPSTMT-KRWDZBQOSA-N 346.475 1.230 10 10 EDCE O=C1NCCC[C@@H]1NCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 725850134 MFMRCTJGNCCTCX-AWEZNQCLSA-N 332.404 1.953 10 10 EDCE CO[C@@]1(CN[C@H](C)c2cc(Cl)ccc2O)CCS(=O)(=O)C1 903365810 QLFKMZPFWFQJTF-QMTHXVAHSA-N 333.837 1.900 10 10 EDCE CSC[C@H]1NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 904148200 SDGCHJVVYVUIHE-CQSZACIVSA-N 335.429 1.307 10 10 EDCE COC[C@]1(C(=O)NCc2cccc(Br)c2O)CCOC1 830530264 YAWYIKXXVNMVMF-CQSZACIVSA-N 344.205 1.824 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](C(C)C)[C@H](C)NC(=O)OC(C)(C)C 842135767 RHJGLUVBGQYJFB-GWCFXTLKSA-N 329.393 1.873 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)N3CCC[C@H]3C)C2)cc1 849416063 KBYJTZWAHVJNSA-KGLIPLIRSA-N 339.461 1.593 10 10 EDCE C[C@@H](CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)NC(N)=O 847393922 RHWIKTOHMKBVGY-STQMWFEESA-N 334.420 1.147 10 10 EDCE CNC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)c2cccc(O)c2O)C1 844097623 RPCZSCHXBMTRGS-CYBMUJFWSA-N 332.278 1.238 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@H]2C[C@@H]3COC[C@@H]3O2)c1 926648567 ASHBSCFGNFSHBI-MSIPSHCFSA-N 336.388 1.565 10 10 EDCE C[C@@H](NC(=O)N1CCn2c(O)nnc2C1)c1ccc(N(C)C)cc1 854003429 HVUQVZWRXGZTQD-LLVKDONJSA-N 330.392 1.336 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@H]3CCO)C2)cc1 854297880 SPILEUDIQTXDKT-GOEBONIOSA-N 333.432 1.830 10 10 EDCE CCOC(=O)[C@@H]1NCC[C@@H]1N[C@@H]1CCN(c2ccc(OC)cc2)C1 854218607 ZEAKAFWWNUFQNP-XOKHGSTOSA-N 333.432 1.157 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC(O)(CO)C2)c1 861849650 SLOHXFWJUQHDGE-UHFFFAOYSA-N 328.368 1.086 10 10 EDCE CN(C)CCn1cc(C(=O)NCc2ccc3cccnc3c2O)cn1 868937103 HDKVUESNSQJAMC-UHFFFAOYSA-N 339.399 1.629 10 10 EDCE CC[S@@](C)(=O)=NS(=O)(=O)NCc1ccc(N(C)C)cc1C 866798216 XSDBFBXYQKBNAX-HXUWFJFHSA-N 333.479 1.513 10 10 EDCE O=C(c1cc(N2CCOCC2)ncn1)N1Cc2cccc(O)c2C1 871207535 PRTJYHKRLYUHBQ-UHFFFAOYSA-N 326.356 1.175 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(=O)N(C)C[C@H]2C)c([N+](=O)[O-])c1 782399186 MAMDRPKWGYHYLO-JPVGGKMYSA-N 333.344 1.448 10 10 EDCE Nc1ccc(Cn2c(=O)c(Cc3cccs3)nn3cnnc23)cc1 82719390 HXAIJSULBBWIMH-UHFFFAOYSA-N 338.396 1.569 10 10 EDCE COC(=O)[C@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)CCO1 896151920 IOALYTWNSFQATF-LLVKDONJSA-N 337.353 1.327 10 10 EDCE CN(CC(=O)NCc1c(O)cccc1O)c1ccccc1[N+](=O)[O-] 1304053292 GWJJWIXFGWLQSU-UHFFFAOYSA-N 331.328 1.759 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CC(CC3CC3)C2)cc1F 1328600128 UEELLHUYQSTHQK-UHFFFAOYSA-N 333.407 1.766 10 10 EDCE COC(=O)[C@@H]1C[C@H](O)CN1Cc1cc(C)cc(Br)c1O 1320674004 DHCHCEZJTGLWSU-JQWIXIFHSA-N 344.205 1.571 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H]3CC[C@@H](O)[C@H]3C2)c([N+](=O)[O-])c1 1187606558 BXHVFGCSBJJDEY-DDKWGIOYSA-N 332.356 1.988 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)Cc2nc[nH]n2)C2CC2)cc1C 1265376581 QJVOCVQOJJWBRH-OAHLLOKOSA-N 343.431 1.349 10 10 EDCE CN(CCO)C[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1265401510 WTNARDDUAAMOPW-CYBMUJFWSA-N 347.419 1.625 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)/C=C\c2ccc[nH]2)cc1C 1272405734 AELFGXLFASBMDQ-QLBOMPFWSA-N 343.427 1.612 10 10 EDCE COc1ccc(CN[C@H](C(=O)O)[C@H]2CCCO2)cc1Cn1cccn1 1352081007 IRLUKQWZFZENEV-SJORKVTESA-N 345.399 1.662 10 10 EDCE COc1ccc(CNC(=O)c2cccc3c2NC(=O)CO3)c(O)c1 1448371527 JCKMNXAIFIUIAW-UHFFFAOYSA-N 328.324 1.662 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCc2nncn2CC1 1447566430 XKOKTKCLVAOSKW-YPMHNXCESA-N 330.388 1.389 10 10 EDCE Cc1ccc(C(=O)N2CCc3c(CC(N)=O)cccc3C2)c(O)c1O 1454676749 DVDQPTBJJNLIEA-UHFFFAOYSA-N 340.379 1.633 10 10 EDCE CCNCc1ccc(N2CC(C)(C(N)=O)C2)c(Br)c1 1914221215 PKKZNYAOYTZOPZ-UHFFFAOYSA-N 326.238 1.870 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)C3COC3)c(Br)cc21 1915667267 MONICOBSEUUGOH-LBPRGKRZSA-N 326.194 1.497 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CCCc1nn[nH]n1 1539468767 QBAZJWQXYIRWKD-UHFFFAOYSA-N 328.420 1.781 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(c2ccc(O)cc2)CC1 1540317610 ZAPNSLGANVUVDK-UHFFFAOYSA-N 328.368 1.695 10 10 EDCE COC(=O)[C@@H](Cc1cncs1)NC(=O)/C=C/c1ccc(O)c(O)c1 1471710440 BIOYVWMDWXMSIR-OGOUPESXSA-N 348.380 1.468 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H](C)n2cncn2)cc1C 1483220917 OOEDXPDDPXHFKM-UONOGXRCSA-N 331.420 1.451 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CCN(C(=O)c2ccccc2)C1 1639292858 TXJGULQYXBKEDO-AWEZNQCLSA-N 340.379 1.876 10 10 EDCE Nc1nnc(CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 1631219068 LZMYGJNVWNQNOD-LBPRGKRZSA-N 348.428 1.576 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cccc(N2C(=O)CCC2=O)c1 1635843315 LXUZGYRSBYPZHC-UHFFFAOYSA-N 340.335 1.681 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@H](NC(=O)CC3(C)CC3)C2)cc(OC)n1 1737456491 AMWAGWRQTCOLME-JOCQHMNTSA-N 347.415 1.666 10 10 EDCE O=C(CCc1nc(-c2ccccn2)no1)NCc1cc(O)ccc1O 1651222725 NWEHOSUOSLHPBU-UHFFFAOYSA-N 340.339 1.792 10 10 EDCE C[C@H]1CN(CCCCNC(=O)Cc2ccc(O)c(O)c2)C[C@H](C)O1 1587590790 HUHFDLDMHZYZCY-KBPBESRZSA-N 336.432 1.646 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@@H](C)N1CCOCC1 1585549836 ISBYXJSFFJOYJC-NWDGAFQWSA-N 333.392 1.688 10 10 EDCE COc1cccc(CNC(=O)c2ccsc2S(N)(=O)=O)c1O 1595799628 BQRXHQHPOCIIRG-UHFFFAOYSA-N 342.398 1.040 10 10 EDCE O=C(NCc1nc(C2CCOCC2)n[nH]1)N1Cc2cccc(O)c2C1 1687278117 AWDZTXOLWFONBF-UHFFFAOYSA-N 343.387 1.630 10 10 EDCE COc1cccc(/C=C2/SC(=S)NC2=O)c1OCC(=O)O 2824047 WXPSMJWFXALCSG-WEVVVXLNSA-N 325.367 1.647 10 10 EDCE Nc1ccc(CNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]23)cc1 1263303553 AGEWMIKJLGOOBX-OFQRWUPVSA-N 348.472 1.611 10 10 EDCE CNC(=O)COc1c(C)n(CCCOc2ccc(N)cc2)ccc1=O 1857919486 JAYBNAGKALSZQV-UHFFFAOYSA-N 345.399 1.333 10 10 EDCE [N-]=[N+]=NCCN[C@]1(C(N)=O)CN(Cc2ccccc2)C2(CCC2)C1 1949694328 QOGPXZBLLUKIJO-KRWDZBQOSA-N 328.420 1.939 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNCc1ccc(O)cc1O 1985189989 IWBCUDZVZMWDKK-MRXNPFEDSA-N 326.393 1.463 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003166927 KOYVNUAJPKHRRM-JHJVBQTASA-N 340.420 1.278 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C1 2010390995 LDZNGHLFTMFPNU-NSHDSACASA-N 339.396 1.517 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010391512 RVHJCONHXLISLW-VXGBXAGGSA-N 340.428 1.743 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010402754 VPCDVPLSORRUBY-UTUOFQBUSA-N 341.412 1.952 10 10 EDCE CNCc1ccc(N2C[C@H]3OCCN(C)[C@@H]3C2)c(Br)c1 2153992672 WLWSVURPNQDEFC-HUUCEWRRSA-N 340.265 1.688 10 10 EDCE CC1(C)C[C@@H](O)CN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2154827027 BZJOELYCSKBINO-KRTXAFLBSA-N 341.205 1.784 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N(C3CC3)C3COC3)c(Br)cc21 2161345181 JOFSBZXTZVVOHV-ZDUSSCGKSA-N 338.205 1.769 10 10 EDCE OCCN1CCC[C@H](NCc2cccc(Br)c2O)C1 384362904 GHVVOMHNHAQESY-LBPRGKRZSA-N 329.238 1.701 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCCc3cn4c(n3)CCCC4)c2n1 2062011394 LXJROVAGIOWGRN-UHFFFAOYSA-N 340.387 1.249 10 10 EDCE COCCOC1CCN(C(=O)c2cnn3c(O)cc(C)nc23)CC1 2063121223 YDZHPXMXFSIORJ-UHFFFAOYSA-N 334.376 1.011 10 10 EDCE CC(C)(C)OC(=O)NCCc1nc(=NCc2ccc(O)c(O)c2)[nH][nH]1 2063192068 BUFYNVDQBAWKPS-UHFFFAOYSA-N 349.391 1.317 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2104424375 NDGLWLGBOQPOSX-SMGVIWHKSA-N 327.222 1.399 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3COC[C@]3(CO)C2)cc1Br 2234546823 CCSYKJBMRJVFOC-JRPNMDOOSA-N 341.249 1.914 10 10 EDCE NCc1ccc(N2C[C@@H]3CC[C@H](CO)O[C@@H]3C2)c(Br)c1 2289196880 GTYUSLNTZAFNSA-YWPYICTPSA-N 341.249 1.884 10 10 EDCE CNC(=O)c1cncc(C=CC(=O)N2CCOc3nc(C)ccc32)c1 2306882082 SGFGFCUMAXRVDQ-UHFFFAOYSA-N 338.367 1.583 10 10 EDCE C[C@H](O)[C@@H](C(=O)O)N1C(=O)C(=Cc2cccc(O)c2)SC1=S 2323823702 GZHHBUOCCCYKON-CPCISQLKSA-N 339.394 1.427 10 10 EDCE Cc1ccc(CN(C)CCN(C)CCO)c(O)c1Br 2352944415 HOJPSACTYDPJNG-UHFFFAOYSA-N 331.254 1.819 10 10 EDCE O=C1Nc2cc(N3C[C@@H](F)[C@H](CO)C3)c(Br)cc2[C@H]1O 2355617388 HTRAUENDQLJOCN-PNLAZUSQSA-N 345.168 1.201 10 10 EDCE CC(=O)NCCNC(=O)CN1CCCc2cc(OC(F)F)ccc21 55026345 JXIVXDSGGMSLEX-UHFFFAOYSA-N 341.358 1.293 10 10 EDCE CC(=O)NN1C(=O)/C(=C/c2cnc3ccccc3n2)SC1=S 102720369 AUHFYZWGJYKOEM-SDQBBNPISA-N 330.394 1.882 10 10 EDCE COC(=O)c1ccccc1NC(=O)[C@@]12CC[C@@H](C(=O)C1=O)C2(C)C 101104031 DNUANEDNRLSFQO-BBATYDOGSA-N 329.352 1.986 10 10 EDCE COC(=O)CCCNC(=O)CN(C)c1ccc(OC)c(Cl)c1 177071258 CBYVKPNERBDUFM-UHFFFAOYSA-N 328.796 1.854 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)cc1Br 2357057955 GTYRXKYPZQGHPF-FAAHXZRKSA-N 341.249 1.631 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CC[C@@H](C4CC4)N3)CC2)cc1 407310075 NIEFWGONRLTWEP-ROUUACIJSA-N 329.444 1.874 10 10 EDCE COc1cc(N2CCC[C@@](CO)(OC)C2)c([N+](=O)[O-])cc1OC 401913798 VGUGTOVYYQJYDI-OAHLLOKOSA-N 326.349 1.590 10 10 EDCE C[C@@H]1COC[C@H](C(=O)N2CC(N=[N+]=[N-])C2)N1C(=O)OC(C)(C)C 1895874660 BCWVJIDQPCNEQV-MWLCHTKSSA-N 325.369 1.532 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCO[C@@]2(CCOC2)C1 184410468 VJUMZMIJYKTXFT-IBGZPJMESA-N 345.443 1.988 10 10 EDCE OCCCN1CCCN(c2ccc(CO)cc2Br)CC1 2366569140 IDDHNWOANQRKLX-UHFFFAOYSA-N 343.265 1.836 10 10 EDCE CN1CCCc2cc(CNC(=O)N(CCO)CC(F)F)ccc21 192527251 KDCSFKULCZKTPD-UHFFFAOYSA-N 327.375 1.838 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)N2CCOc3cc(N(C)C)ccc32)C[C@H]1C 601261185 KWQKNDJOPJRMSL-HFBAOOFYSA-N 348.399 1.445 10 10 EDCE Cc1ccc(CN(C)C(=O)Cn2cncn2)c(O)c1Br 2381143177 PDRSNONNWKXXIJ-UHFFFAOYSA-N 339.193 1.713 10 10 EDCE COc1cc(Br)cc(CN2CC(=O)N(C)[C@@H](C)C2)c1O 800537599 BCINIDFMAJUKIK-VIFPVBQESA-N 343.221 1.826 10 10 EDCE N#Cc1c(F)cccc1S(=O)(=O)Nc1ccc(O)cc1C(=O)O 390266322 ZNLZVWRLQBJLEN-UHFFFAOYSA-N 336.300 1.902 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)c1cn([C@@H]2CCCNC2)nn1 818103621 ULRYEWFADHDMIA-OAHLLOKOSA-N 343.431 1.961 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H]3COC[C@H]3C2)cc1F 827575716 TTWHSOZECDGZDS-UONOGXRCSA-N 349.406 1.003 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@H](NC(N)=O)C2)c(Br)c1 723183182 RCSZTZHVNGKSDQ-KOLCDFICSA-N 341.253 1.977 10 10 EDCE COc1cccc(N2C[C@H](NC(=O)c3cc(O)cs3)CC2=O)c1 732282577 QBVUOCXGFGCYJA-SNVBAGLBSA-N 332.381 1.998 10 10 EDCE O=C1N[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)CS1 740750343 PBQVFVFEBISOIG-ZDUSSCGKSA-N 337.470 1.681 10 10 EDCE N[C@@H]1CCO[C@H]([C@@H]2CCCCN2Cc2cc3c(cc2O)OCO3)C1 844911992 QOABTJSLQKKHGC-YCPHGPKFSA-N 334.416 1.982 10 10 EDCE COc1cccc([C@H](C)NC[C@@H]2CCCCN2S(C)(=O)=O)c1O 846173661 UNSHBSQDLOURHY-STQMWFEESA-N 342.461 1.866 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)C(=O)NCc1c(O)cccc1F 928709982 JRMYMSASKCUTGC-ZDUSSCGKSA-N 342.367 1.687 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@H]([C@@]3(C)COC(=O)N3)C2)c(O)c1O 928030043 XAIGGJTWSWDTBT-APPDUMDISA-N 334.372 1.757 10 10 EDCE C[C@H](C1CC1)n1[nH]ccc1=NC(=O)COC(=O)c1cccc(O)c1O 758559932 UDLZGQGFWGKGCN-SNVBAGLBSA-N 345.355 1.483 10 10 EDCE O=C(NCCCSc1nccs1)N1CCN2CCOC[C@@H]2C1 758580382 SYKQDZSLRRKXGC-LBPRGKRZSA-N 342.490 1.351 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnc(C)nc3N)C2)cc1 855226843 URIZXZKINOOOFB-LBPRGKRZSA-N 327.388 1.385 10 10 EDCE CO[C@@]1(CNCc2cc(F)c(N(C)C)cc2F)CCS(=O)(=O)C1 922617838 WGSGWDJOOJFZRZ-OAHLLOKOSA-N 348.415 1.324 10 10 EDCE CO[C@@H](C(=O)OCC(=O)C(C)=O)c1ccc(Br)s1 923520197 KGOITVCKBIEIJR-SNVBAGLBSA-N 335.175 1.899 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(CO)(CO)C1 854176505 HEEXVTYQBBLCAN-OAHLLOKOSA-N 349.475 1.378 10 10 EDCE COCCCOCCC(=O)N1CCN(c2ccc(OC)cc2)CC1 854198043 BUSKKUBKXRZTLJ-UHFFFAOYSA-N 336.432 1.787 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)COC3CCC(N)CC3)C2)cc1 851639690 JTTFPZKMTKUJOA-CSLYMUCUSA-N 347.459 1.677 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCNC(=O)CC2)c1 859172736 JHSOFEXPSRWJDE-UHFFFAOYSA-N 339.395 1.869 10 10 EDCE CC(C)OC[C@H](N)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 852777786 XXALRWQYKHVXNT-KRWDZBQOSA-N 335.448 1.234 10 10 EDCE CO[C@H](C(=O)NCc1cc(Br)ccc1O)[C@H]1CCOC1 854442424 RJQWTFHUBOARNN-ZANVPECISA-N 344.205 1.822 10 10 EDCE C[C@@H](NC[C@H](O)C1(O)CCCC1)c1ccc(N2CCOCC2)cc1 930211340 SXIJBTYQVUINKJ-QAPCUYQASA-N 334.460 1.840 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O 863049108 BDYUDVSIRVGYDJ-PROVMUHDSA-N 337.397 1.289 10 10 EDCE COC(=O)[C@@H](CNC(=O)C(=O)Nc1ccc(N)cc1)C1CCCCC1 861518222 VCOQABKENIZOLK-HNNXBMFYSA-N 347.415 1.693 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCN3C(=O)OCC[C@@H]3C2)cc1 763484600 FFOLIWCYYHGDRT-OAHLLOKOSA-N 332.404 1.489 10 10 EDCE CCOc1ccc(CN[C@H]2CCN(C3CCOCC3)C2=O)c(O)c1 776229755 CTWLWEUQKGHPJJ-INIZCTEOSA-N 334.416 1.660 10 10 EDCE Cc1ccc(C(=O)NC[C@@H](O)[C@H](C)O)cc1-n1c(C)cc(C=O)c1C 871144071 UPYBBOWQUSYTFE-KBXCAEBGSA-N 344.411 1.687 10 10 EDCE C=CC(=O)Nc1ccc(O)c(C(=O)NCCc2ccc(O)c(O)c2)c1 1137464656 JQQJAULGIOGIEF-UHFFFAOYSA-N 342.351 1.900 10 10 EDCE C[C@@]1(C(=O)NCc2ccc(N3CCSCC3)cc2)CCC(=O)NC1 798895503 AEACKUIKPBFPIT-GOSISDBHSA-N 347.484 1.772 10 10 EDCE Cc1nn(C)c(Br)c1[C@@H](O)[C@H](N)c1ccccc1O 1890613624 XIEWNDKXJAPZEY-VXGBXAGGSA-N 326.194 1.930 10 10 EDCE CNC(=O)[C@@H](C)N(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 1916788479 TUKCXCHQIAGILB-KBUNVGBDSA-N 342.193 1.005 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cncc(O)c1 1354594373 JDSOEAFUNJFLAH-UHFFFAOYSA-N 342.399 1.094 10 10 EDCE CN1CCN(c2ccc(CNC(=O)N3CC[C@H](C(=O)O)C3)cc2)CC1 1353867023 XQLIIHCLXQSUHJ-HNNXBMFYSA-N 346.431 1.055 10 10 EDCE CN1CCC(O)(CNC(=O)c2cc3cc(O)c(O)cc3s2)CC1 1353884989 APQZKCTZIFVULW-UHFFFAOYSA-N 336.413 1.499 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2c[nH]cc2C)cc1C 1700958742 QIDKGZYPMPMDOR-INIZCTEOSA-N 345.443 1.863 10 10 EDCE CN1C(=O)[C@H](NC(=O)NCc2ccccc2O)Cc2ccccc21 1478955173 DCDFFOYDQAAKSF-CQSZACIVSA-N 325.368 1.779 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@@H]2CCC(=O)N2)cc1C 1714768784 UNTXFYVSRDSQLL-HNNXBMFYSA-N 333.432 1.220 10 10 EDCE C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1633092323 PUWMADPHROGOAK-GFCCVEGCSA-N 347.419 1.766 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)CCNC(N)=O)cc1C 1725134009 UUDLLSJMASCTEA-QWHCGFSZSA-N 336.436 1.045 10 10 EDCE CC(C)COC1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1630174101 BIICGTJNZWXIOG-UHFFFAOYSA-N 342.417 1.261 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccc(F)c2O)c1 1643685580 BCFBPMUPAYCONR-UHFFFAOYSA-N 340.332 1.861 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3n[nH]cc3F)cc2)C1 1597004581 SQKQLXCXQZWMOC-GFCCVEGCSA-N 345.378 1.181 10 10 EDCE OC[C@@]12CC[C@@](NCc3ccc(Br)cc3O)(CO1)C2 2133668721 YYISXJFWGSRCLK-KBPBESRZSA-N 328.206 1.928 10 10 EDCE CCOc1cccc(CNCC(=O)Nc2nnc(CC)s2)c1O 1857854136 PTNFAPUXQBKRHQ-UHFFFAOYSA-N 336.417 1.933 10 10 EDCE CO[C@H](CN)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951695566 IYFUXVRLAAWSQF-SMDDNHRTSA-N 326.393 1.507 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](OCC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010405672 KOPRRLRTLJQYTA-NWDGAFQWSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H]([C@H](O)[C@@H](N)c2ccccc2O)C1 2022706686 JIPIMLVEHCYVOG-KKUMJFAQSA-N 338.404 1.389 10 10 EDCE O=C(O)[C@@H]1CO[C@H]2CN(Cc3ccc(Br)cc3O)C[C@H]12 2160867879 NTAAJOKAOVCWDP-WZRBSPASSA-N 342.189 1.686 10 10 EDCE C[C@H]1CS(=O)(=O)C[C@@H]1NCc1cccc(Br)c1O 711724742 XDXSMHXBUIXYOY-KWQFWETISA-N 334.235 1.677 10 10 EDCE NCc1cc(F)c(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2199532605 QPUVPPHNKUMKCM-VTCIIQITSA-N 345.212 1.367 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](COc2nnc(=N)[nH]n2)C[C@H]2CCC[C@H]21 2213778084 BWDYUGSXVAJOQN-OUAUKWLOSA-N 336.396 1.236 10 10 EDCE COc1ccc(Br)c(CNCC[C@H]2COC[C@@H]2O)c1O 2236056509 VWPUPIKMMWLOTN-CABZTGNLSA-N 346.221 1.650 10 10 EDCE OC[C@@H]1NC[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]21 2227311132 AIUODBZGLWQQJH-WXHSDQCUSA-N 327.222 1.167 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@H](CN)C2)c1O 2227747912 HCJMTACRTHUUAM-SECBINFHSA-N 331.210 1.323 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N[C@@H]1CC[C@H](C(=O)O)C1 2312479577 YLZIWBSPPGHYAR-JKSUJKDBSA-N 344.411 1.906 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2329329378 UEWXVWRUKHUVPS-YYCCRBMRSA-N 328.206 1.433 10 10 EDCE Cc1ccc(CNCCNC(=O)N(C)C)c(O)c1Br 2352951272 FHCRYBZJABUCTA-UHFFFAOYSA-N 330.226 1.824 10 10 EDCE COc1cc(N2CCN(Cc3cccc(OC)c3O)CC2)ncn1 184435288 KUGNMOMJMIVUHP-UHFFFAOYSA-N 330.388 1.522 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)NC1C[C@@H]2CC[C@H](C1)N2 129622555 PFGDJJADSXIUIN-GQFUNTGSSA-N 341.455 1.936 10 10 EDCE Cn1cccc(NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)c1=O 255509891 GYJCPECZKAFMOD-TWGQIWQCSA-N 339.395 1.874 10 10 EDCE Cc1ccc(CNC(=O)C[C@@H]2COC[C@H]2N)c(O)c1Br 2380751837 OYRVOLVSEUVOTN-GHMZBOCLSA-N 343.221 1.443 10 10 EDCE COC[C@@H](O)CNC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 801968937 IBYMQRPBVXYZKV-SFHVURJKSA-N 345.443 1.943 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)C[C@@H]1CCCO1 807095423 APVZJGQRXDZBJL-INIZCTEOSA-N 333.432 1.315 10 10 EDCE Cc1cc(CC(=O)N[C@@H]2CCO[C@@H]2C(=O)O)c(C)n1-c1ccccc1 826535554 ZXVKNTOALQSNQJ-AEFFLSMTSA-N 342.395 1.995 10 10 EDCE COC(=O)[C@@H]1CC[C@@H]1C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 824380187 QAPCNKXXLXULNL-VBNZEHGJSA-N 332.400 1.589 10 10 EDCE C[C@]1([C@@H]2CCCN(Cc3cc4c(cc3O)OC[C@@H]4O)C2)COC(=O)N1 905700632 IPUPHPWZJLPFQY-HNJNHCNJSA-N 348.399 1.529 10 10 EDCE CC[S@](=O)CCNC(=O)NCc1ccc(N2CCOCC2)cc1 735095497 UXYFZCQPZCAWBT-QHCPKHFHSA-N 339.461 1.091 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccn2nccc2n1 900337310 FXBFRWLKXQDXAK-UHFFFAOYSA-N 337.383 1.496 10 10 EDCE C[C@@H]1CCn2cc(C(=O)N(CC(=O)O)Cc3ccccc3O)nc2C1 911494194 SSYAMZNMQYSBRS-GFCCVEGCSA-N 343.383 1.898 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCO[C@H](CF)C3)C2)cc1 852449590 ULLOMPUQELYGJD-CZUORRHYSA-N 337.395 1.654 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC(=O)N(C)[C@@H](C)C3)C2)cc1 852450966 AJVHBUYTTUFVAD-UONOGXRCSA-N 346.431 1.146 10 10 EDCE OCCO[C@]1(CNCc2ccc(N3CCCCC3)cc2)CCOC1 850357887 XFXQGJCWMDKICV-IBGZPJMESA-N 334.460 1.935 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@@H](C)C1O 853474920 SXJGRRZEEYPMQU-HUUCEWRRSA-N 347.459 1.682 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NC[C@@H]3CCC(=O)N3)C2)cc1 854187044 GBIMELOQECBZJJ-KGLIPLIRSA-N 346.431 1.099 10 10 EDCE CCc1nn(C)c(CC)c1S(=O)(=O)N1Cc2cccc(O)c2C1 867690241 FHCHUCCWDQUZMH-UHFFFAOYSA-N 335.429 1.955 10 10 EDCE Cc1ccc(O)c(CNC(=O)C(=O)Nc2cnn(C)c2C(F)F)c1 862026142 XFTFLVXZOMHPEC-UHFFFAOYSA-N 338.314 1.627 10 10 EDCE C[C@H]1NC(=O)N(Cc2ccc(N3CCN(CC4CC4)CC3)cc2)C1=O 777674220 XEJIVHQOACZYSR-CQSZACIVSA-N 342.443 1.659 10 10 EDCE COC(=O)c1c(CNCC(F)(F)CO)c2cc(F)ccc2n1C 894474967 GQVJCTQTCIWBPD-UHFFFAOYSA-N 330.306 1.821 10 10 EDCE COC(=O)[C@@H](Cc1cncs1)NC(=O)c1ccc(C)c(O)c1O 1154183204 PBTDYWVCSSIRNU-LLVKDONJSA-N 336.369 1.377 10 10 EDCE COc1ccc(CNC[C@H]2CCCN2C(=O)CNC(C)=O)cc1C 1319049224 RDQUZWTWWRGCQI-MRXNPFEDSA-N 333.432 1.220 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@H]2CCNC2=O)C2CC2)cc1C 1317023755 CALGNDWSVIJJAV-HOTGVXAUSA-N 345.443 1.124 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CON(C(=O)OC(C)(C)C)C2)c(O)c1O 1179766827 OUUOAGUUNQMVAA-JTQLQIEISA-N 338.360 1.687 10 10 EDCE C[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)[C@@H]1CCO 1329872281 APYDTUVHETWMJL-IUODEOHRSA-N 332.400 1.244 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)[C@H]1CCC[C@@H]1O 708603201 YEIWPZUYMJUHNN-DRZSPHRISA-N 341.205 1.784 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@@H]2CCNC2=O)C2CC2)cc1C 1323050246 GLXIMKKVLSGGMC-HZPDHXFCSA-N 345.443 1.124 10 10 EDCE CCC1(C(=O)N(C)C[C@H](C)NC(=O)c2cc(OC)nc(OC)c2)CC1 1337438398 SBFSCMRPFBDKBU-LBPRGKRZSA-N 349.431 1.866 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](C)C(O)[C@H](C)C1 1261610636 VZOFWEXGCKKWEO-ZIAGYGMSSA-N 348.443 1.606 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1nsnc1O 1444660115 BKAJWSJDNNZSTN-UHFFFAOYSA-N 348.428 1.382 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCCN(C(=O)N2CCCC2)C1 1297731499 ZKZXJDHDNZWSET-CQSZACIVSA-N 347.415 1.437 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cccc(-n2cncn2)n1 1299724729 IFGVVDOPTHEGFW-UHFFFAOYSA-N 346.350 1.846 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cccn(CC(F)(F)F)c1=O 1558535804 OTKWAUZXKQMKKR-UHFFFAOYSA-N 342.273 1.752 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1715823494 JPLCVZLFDZNIDQ-YIEVGGLXSA-N 345.443 1.244 10 10 EDCE COc1ccc(CNC[C@@H]2CCCN2C(=O)[C@H](C)CC(N)=O)cc1C 1499915984 KVYKENGLAFVCSA-ZBFHGGJFSA-N 347.459 1.596 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCc2cn[nH]c2)cc1C 1491605104 VINKDVYMKIMCOP-AWEZNQCLSA-N 330.432 1.954 10 10 EDCE C[C@@H](O)CNC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CCCC1 1568247765 PJZOKLUVGOWBOZ-GFCCVEGCSA-N 347.419 1.862 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CCOCCCO 1762871361 VTUQBAMQGYSMHZ-UHFFFAOYSA-N 334.420 1.582 10 10 EDCE OCc1ccc(N2C[C@@H](CO)OCC23CC3)c(Br)c1 2127538486 LQTFRLBYDYDOIJ-NSHDSACASA-N 328.206 1.672 10 10 EDCE O=C(NCc1ccc(N2CCNC2=O)cc1)NCc1ccccc1O 1687431815 GJASAISXNMDJLY-UHFFFAOYSA-N 340.383 1.921 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCc2cnc[nH]2)cc1C 1690584377 LPXQIHVGERRWKO-AWEZNQCLSA-N 330.432 1.954 10 10 EDCE Cn1ncnc1NC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 162923947 MRPXNAPJFZEUKY-UHFFFAOYSA-N 332.319 1.843 10 10 EDCE NS(=O)(=O)c1ccc(CNCc2cccc(Cl)c2O)cc1 164927325 RGGZXBSEPRBORQ-UHFFFAOYSA-N 326.805 1.983 10 10 EDCE COC(=O)c1ccc(/C=C2/SC(=S)N(NC(C)=O)C2=O)cc1 207044398 AFXLAAOVBJHHTA-YRNVUSSQSA-N 336.394 1.726 10 10 EDCE Cc1cc(=O)c(OCC(N)=O)cn1CCCOc1ccc(N)cc1 1857916373 RGJUKYXRZQWWLI-UHFFFAOYSA-N 331.372 1.072 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)[C@H](O)C2)c(Br)c1 232728995 CMCAXCALWJFNAS-ZIAGYGMSSA-N 329.238 1.489 10 10 EDCE CO[C@H](c1ccc(O)c(O)c1)[C@H](NC(=O)OC(C)(C)C)C(=O)O 1952306010 HBJSJMIUJDXDSS-NWDGAFQWSA-N 327.333 1.763 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985103839 AWFFHYWPECTCTE-MXWKQRLJSA-N 327.385 1.419 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@H](N(C)C)C2)c(Br)c1 2146153311 ICBFZBHGDJHTGL-CABCVRRESA-N 342.281 1.670 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC(CCO)C3)c(Br)cc21 2152300782 ODIFVPDOQYWUCI-CYBMUJFWSA-N 340.221 1.480 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010393500 SYFYOVMZCZICAU-TUAOUCFPSA-N 339.396 1.516 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(CO)CNCc1ccc(O)c(O)c1O 2010527510 AQFLGULTGYVGNX-INIZCTEOSA-N 342.392 1.169 10 10 EDCE CNCc1ccc(N2CCC[C@@H]3C(=O)NC[C@H]32)cc1Br 300496099 VFSBIXKMYOJKRS-GXTWGEPZSA-N 338.249 1.883 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3CCc4ncsc4C3)c2n1 2063667191 IJEBBBDJMXBZNQ-VIFPVBQESA-N 329.385 1.487 10 10 EDCE Nc1ccc(OCCCn2c(O)nnc(Br)c2=O)cc1 2175190154 PKCVIQMFXKUEAV-UHFFFAOYSA-N 341.165 1.158 10 10 EDCE C[S@@](=O)CC1CN(c2cc(Br)c(CN)cc2F)C1 2047848515 UKIMBGTYTVDGED-GOSISDBHSA-N 335.242 1.862 10 10 EDCE O=C(O)[C@H](NCc1cc(Br)cc(F)c1O)C1COC1 2104897018 UKWWZGKQTREWFW-SNVBAGLBSA-N 334.141 1.483 10 10 EDCE COc1ccc(Br)c(CNCCc2cnnn2C)c1O 2236056557 WMAMDGTXGGHMIN-UHFFFAOYSA-N 341.209 1.624 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2236635949 LISXGMPLLIRXTB-SDDRHHMPSA-N 344.249 1.930 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccc(CN)s2)s1 2269305770 ZMQSCRMZAXHPGO-UHFFFAOYSA-N 335.501 1.864 10 10 EDCE Cc1ccc(CNC(=O)[C@H](N)C(C)(C)O)c(O)c1Br 2352641043 PJGJPTYOFONLRR-NSHDSACASA-N 331.210 1.178 10 10 EDCE Cc1ccc(CN2CC(OCC(=O)O)C2)c(O)c1Br 2352686525 KPVYONRMRVHOMI-UHFFFAOYSA-N 330.178 1.749 10 10 EDCE Cc1ccc(CN(C)C[C@H](O)CN(C)C)c(O)c1Br 2352944085 CLBDAWHNWRIGKO-GFCCVEGCSA-N 331.254 1.817 10 10 EDCE COC(=O)c1ccc(/C=C2\SC(=S)N(NC(C)=O)C2=O)cc1 34407978 AFXLAAOVBJHHTA-XFFZJAGNSA-N 336.394 1.726 10 10 EDCE O=C(CN1C(=O)/C(=C\c2ccccc2F)SC1=S)NCCO 210393684 LMFONLIZKZIPES-YRNVUSSQSA-N 340.401 1.135 10 10 EDCE COc1ccc(N2CCN(C)CC2)cc1NC(=O)c1cnccn1 74586697 ZIJNEVIJIKYNIF-UHFFFAOYSA-N 327.388 1.489 10 10 EDCE C[C@H](O)CN(CCNCc1ccc(O)cc1O)C(=O)OC(C)(C)C 379691949 NXTRKEOLZITJSR-LBPRGKRZSA-N 340.420 1.805 10 10 EDCE Cc1ccc(O)c(CN2CCN(c3ccc4nnc(C)n4n3)CC2)c1 93273038 FDIWZGKOJQAKRG-UHFFFAOYSA-N 338.415 1.769 10 10 EDCE O=S1(=O)CC[C@H]2CN(Cc3cc(Br)ccc3O)C[C@H]21 377698921 MYNBUMLLEPOVNO-TVQRCGJNSA-N 346.246 1.774 10 10 EDCE CC(=O)N[C@@H](CNCc1ccc(C)c(Br)c1O)C(=O)O 2380739218 HQBMVZJHHIPGMY-JTQLQIEISA-N 345.193 1.142 10 10 EDCE CN(C)c1ccc(/C=C/CNC2CCC3(CC2)NC(=O)NC3=O)cc1 835053495 NKYLHMMYQRXZSL-ONEGZZNKSA-N 342.443 1.876 10 10 EDCE C[C@@H](O)c1cn(C2CN(C/C=C/c3ccc(N(C)C)cc3)C2)nn1 835045038 RKEOABIRBAJZJH-ISZGNANSSA-N 327.432 1.968 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCCN(S(C)(=O)=O)CC2)cc1 835026510 YPFUQNVOBGHLPC-XQRVVYSFSA-N 337.489 1.733 10 10 EDCE CCC(C)(C)[C@H](O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 918838889 MGXGVWYUZNFRQU-QGZVFWFLSA-N 333.476 1.852 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C1CC1)[C@@H]1CCNC1 844220760 ANHLXGCZNFJRQC-GOSISDBHSA-N 330.476 1.537 10 10 EDCE COc1cc(Br)cc([C@H](C)NC[C@]2(O)CCOC2)c1O 848535596 DWTUPGALMXHCLH-LKFCYVNXSA-N 346.221 1.965 10 10 EDCE O=C(NCc1c(O)cccc1F)NC[C@@H]1CCN1C1CCOCC1 927631423 STEBPGGOOUQJCU-ZDUSSCGKSA-N 337.395 1.584 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccnn1 859734132 LHMVOALQWSGVPV-UHFFFAOYSA-N 330.363 1.507 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3ccc(=O)n(C)c3)C2)cc1 853818852 ZUBXXJQWSCAMOF-CQSZACIVSA-N 342.399 1.794 10 10 EDCE CC[C@@H]1C[C@@H](NCCN2CCN(c3ccc(OC)cc3)CC2)CO1 850091154 ZEVHKMBXZLJJLJ-SJLPKXTDSA-N 333.476 1.974 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCc3nc(C)no3)C2)cc1 855231270 JPXMFWKBKGAFND-CYBMUJFWSA-N 330.388 1.714 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)CC2CS(=O)(=O)C2)cc1 869142501 CEDMRFPANSRALX-UHFFFAOYSA-N 340.445 1.025 10 10 EDCE CCc1cc(O)ccc1NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 863407422 CRICZWTVHJVJCH-UHFFFAOYSA-N 326.334 1.397 10 10 EDCE COC(=O)[C@H](C[C@H]1CCCOC1)NC(=O)/C=C\c1ccc(O)c(O)c1 862995992 GHIXBJPHDFOTCC-RKWPFYGESA-N 349.383 1.586 10 10 EDCE COc1cccc(CNC(=O)c2ccn(C3CCOCC3)n2)c1O 860241440 RAVWQZAGCCRFSJ-UHFFFAOYSA-N 331.372 1.879 10 10 EDCE CS(=O)(=O)C[C@H](C(=O)NCc1ccc(O)c(O)c1)c1ccccc1 1137443303 KQPJZPPCHREDBJ-AWEZNQCLSA-N 349.408 1.542 10 10 EDCE CCOc1ccc(O)c(CNC[C@@H]2CCCCN2S(C)(=O)=O)c1 796513054 JCFUSWSRAVXSDV-AWEZNQCLSA-N 342.461 1.695 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC1=NCC(=O)N1C 1149341015 ZUXLBDUBONVVKZ-UHFFFAOYSA-N 338.367 1.464 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N1CC[C@H](NC(N)=O)C1 690733515 RLFZUDLFJZTCHN-SCZZXKLOSA-N 328.210 1.958 10 10 EDCE OCCN1CCC[C@H](NCc2ccc(Br)cc2O)C1 691476123 GXVCCDWJRQOQEN-ZDUSSCGKSA-N 329.238 1.701 10 10 EDCE COc1cc(N(C)CC(=O)N=c2cc[nH]cc2)cc(OC)c1OC 1307471209 CHWKJTNQMMQFQG-UHFFFAOYSA-N 331.372 1.604 10 10 EDCE O=C1Nc2cc(N3CCO[C@@H]4C[C@H]43)c(Br)cc2[C@H]1O 2115219383 GVUXYTWKWSYJGZ-IJLUTSLNSA-N 325.162 1.412 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1CCC2(CCC2)CO1 1334707501 PHCPZYGIBPNQMH-OAHLLOKOSA-N 346.427 1.816 10 10 EDCE CO[C@@]1(C)CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1351922052 OXLKKOUISNRMLN-SFHVURJKSA-N 332.400 1.652 10 10 EDCE C[C@H]1CN(Cc2cc(Br)cc(F)c2O)CC(=O)N1C 1350319206 DFGREQVYUOYFHK-QMMMGPOBSA-N 331.185 1.956 10 10 EDCE COCCNC[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1283111105 NVYDCGRZZZSPNX-YEORSEQZSA-N 333.392 1.593 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCN(c2ccccc2)C1=O 1292912144 GIWHHTMIQLACAW-AWEZNQCLSA-N 326.352 1.562 10 10 EDCE Cc1cc(N2CCC(NC(=O)Cc3ccc(O)c(O)c3)CC2)n[nH]1 1296649186 CGBANHXJULSYAH-UHFFFAOYSA-N 330.388 1.457 10 10 EDCE O=C(N[C@@H]1CCS(=O)(=O)C2(CCC2)C1)c1c(F)ccc(O)c1O 1611668839 AMQLHALZWPEWIZ-SECBINFHSA-N 343.376 1.467 10 10 EDCE CC(=O)c1cc(F)cc(CN2C[C@H]3CS(=O)(=O)C[C@@]3(C)C2)c1O 1473857719 CIFRBOLFSHWYKW-BLLLJJGKSA-N 341.404 1.600 10 10 EDCE CC(C)(C)OC(=O)c1cnc(C(=O)NCc2ccc(O)cc2O)cn1 1626850095 OOVQKMQPAXJICK-UHFFFAOYSA-N 345.355 1.773 10 10 EDCE CC[C@@H](CN[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1)OC 1491691403 GMYXNIYYUNSGSZ-RISCZKNCSA-N 335.408 1.982 10 10 EDCE CCC(=O)NCC(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)C1 1491717799 LCKSYXHBSCELCM-HNNXBMFYSA-N 333.432 1.220 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2ccc[nH]2)cc1C 1734505171 FWJVXCPLJFYWIP-OAHLLOKOSA-N 331.416 1.554 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)CN(C)C(C)=O)C2)cc1C 1688925265 YFWDLCJGMYIGGH-QAQDUYKDSA-N 347.459 1.466 10 10 EDCE CNCc1ccc(N2CCO[C@@H]3COC[C@@H]32)c(Br)c1 1877661010 XNEKUFJEWVQBKP-UONOGXRCSA-N 327.222 1.773 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCO[C@H]2COC[C@H]21 1877615404 UQOIHNWYHZMXIQ-NEPJUHHUSA-N 332.169 1.893 10 10 EDCE COCC[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980377988 RBUOKNDPTZWRNM-SRVKXCTJSA-N 328.409 1.182 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](OCC(N)=O)C2)cc1Br 2145374764 GVJAQKFIMKPNIJ-GXSJLCMTSA-N 342.237 1.549 10 10 EDCE CO[C@]1(C(=O)NCCN=[N+]=[N-])CCCN(C(=O)OC(C)(C)C)C1 1985094647 RRRDXCUBNANGQW-CQSZACIVSA-N 327.385 1.829 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 1985102931 NVQMLTYYRUELOD-KOLCDFICSA-N 325.369 1.125 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]1(NC(=O)OC(C)(C)C)C[C@@H](CO)C1 1990179302 NWYZIQICANFKFL-WJONMLJTSA-N 327.385 1.421 10 10 EDCE CC[C@H](CNC(=O)OC(C)(C)C)NC(=O)c1cc(O)c(O)c(O)c1 2015123237 QYJCCZQPTHBPLB-SNVBAGLBSA-N 340.376 1.837 10 10 EDCE CN(c1ccc(N)cc1)C(=O)[C@]1(NC(=O)OC(C)(C)C)C[C@@H](O)C1 2018061487 POWBVUIDZLIQSL-XFHMXUHZSA-N 335.404 1.650 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)CCO1 92774826 JUVUEZDCKRLCBM-KRTXAFLBSA-N 326.194 1.626 10 10 EDCE CNCc1ccc(N2CCC[C@@H](CO)[C@@H]2CO)c(Br)c1 709822404 HDJVJXJDWAHXHN-WFASDCNBSA-N 343.265 1.738 10 10 EDCE CN(C[C@H]1CCOC1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 398992678 PQQSCQLEZJVPNS-AMIZOPFISA-N 340.221 1.874 10 10 EDCE Cc1cc(Br)cc(CN2C[C@H]3OCCN(C)[C@@H]3C2)c1O 775716586 DKWYGUFCOJRYLV-ZIAGYGMSSA-N 341.249 1.978 10 10 EDCE N[C@H]1CC(C(=O)N2CCCc3ccc(Br)cc32)=C[C@@H]1O 2188018577 DSOHFDOACWWQRE-JSGCOSHPSA-N 337.217 1.747 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)c(Br)c1 2182559131 IDMAMQROHFCBHP-BAESOJJISA-N 341.249 1.346 10 10 EDCE O=C(O)[C@H]1CN(Cc2cc(Br)ccc2O)C2(CC2)CO1 2183995739 IIQRWTXBZGIFCL-GFCCVEGCSA-N 342.189 1.973 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)c1nc(=NCc2ccc(O)c(O)c2)[nH][nH]1 2066590412 NDWDFIHHRCOIMD-SECBINFHSA-N 349.391 1.836 10 10 EDCE CC(C)CCN(CCOc1nnc(=N)[nH]n1)C(=O)OC(C)(C)C 2210654261 SBCMHLZDTYZWIY-UHFFFAOYSA-N 326.401 1.341 10 10 EDCE CNCc1ccc(N2CCC[C@@H]3CNC(=O)[C@H]32)cc1Br 2279266291 CRYLICSGRDNSQT-RISCZKNCSA-N 338.249 1.883 10 10 EDCE CNCc1ccc(N2CCC[C@H]3CNC(=O)[C@@H]32)cc1Br 2279266293 CRYLICSGRDNSQT-SMDDNHRTSA-N 338.249 1.883 10 10 EDCE CSc1ncc(CNS(=O)(=O)CC2(C(N)=S)CC2)s1 2269310391 GVANYWHLVLEGCR-UHFFFAOYSA-N 337.517 1.351 10 10 EDCE O=C(O)C[C@H](C(=O)O)N1C(=O)C(=Cc2cccnc2)SC1=S 2294871902 DWQANUCFCDJFST-MRVPVSSYSA-N 338.366 1.211 10 10 EDCE COC[C@](C)(CCO)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2307687305 TVTVWWHSSPUORS-IBGZPJMESA-N 348.443 1.440 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]21 2314965711 VMXANXHPEARWGE-CABZTGNLSA-N 332.219 1.384 10 10 EDCE COC[C@@H](O)CNC(=O)NCc1ccc(N2CCC(C)CC2)cc1 118073778 KPOANPBBOLXXPJ-KRWDZBQOSA-N 335.448 1.729 10 10 EDCE COCC(=O)N(C)CC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1349120752 YOXUSIXVMUUVMM-UHFFFAOYSA-N 333.432 1.350 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@@H](CCO)[C@@H](CO)C2)cc1F 1346266690 HPMLTLQJSZOMMR-ZIAGYGMSSA-N 339.411 1.024 10 10 EDCE COc1ccc(O)c(CN2CCCN(Cc3cnn(C)c3)CC2)c1 180111500 KQTFETFKOASMHC-UHFFFAOYSA-N 330.432 1.842 10 10 EDCE O=C(NCCN1C(=O)CSC1=S)c1ccc(F)c(F)c1F 49756707 VYDQKLXDNNQMOB-UHFFFAOYSA-N 334.344 1.694 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1CNCc1cccc(O)c1O 382737740 PWTBDJOQPHOYKS-ZDUSSCGKSA-N 338.404 1.823 10 10 EDCE C[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@H]1N1CCOCC1 245759711 PJPBBIRPWMPIIM-YLJYHZDGSA-N 345.487 1.676 10 10 EDCE CN(c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)C1C[C@@H]2CC[C@H](C1)N2C 376235115 OBZDKIRNBKIXPC-FOSCPWQOSA-N 346.387 1.987 10 10 EDCE O=C1[C@H]2[C@H]3C[C@H]4[C@@H]2[C@]2(C(=O)NCCc5ccc(O)c(O)c5)[C@H]1[C@H]3[C@@H]42 800519190 NBMNPPAKEVXNHP-NONANHNLSA-N 325.364 1.084 10 10 EDCE CCOc1cccc(CN[C@H]2CCC[C@H]2CNS(C)(=O)=O)c1O 800309044 BVEPTMGIQIXFEB-JSGCOSHPSA-N 342.461 1.598 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3C(=O)NC[C@H]3C2)c(Br)c1 723182804 OWJKTIFYWKWGGR-KOLCDFICSA-N 339.237 1.683 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C12CCN(CC1)C2 900756952 XPBMZZYREBJDIF-UHFFFAOYSA-N 343.471 1.607 10 10 EDCE Cc1ccc(C(=O)N[C@H]2C[C@@H](N3CCOCC3)C2(C)C)c(O)c1O 911843362 LUNIBNBOPVHJJC-UONOGXRCSA-N 334.416 1.635 10 10 EDCE C[C@@H](NC(=O)C(=O)NCC[C@@H]1CCCNC1)c1ccc(N(C)C)cc1 842203850 XWXFYMNZJDYOIV-CABCVRRESA-N 346.475 1.436 10 10 EDCE COCCN1CCC[C@@H]1CN[C@H](C)c1cc(C(=O)OC)ccc1O 756535648 NVTDMVFJNAEVAY-UKRRQHHQSA-N 336.432 1.940 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@]3(C)CCCNC3)C2)cc1 851662908 NMNGIKZKYJKLAK-HNAYVOBHSA-N 346.475 1.963 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3C(=O)NCC[C@H]3C)C2)cc1 852308597 JQBFVACXBZFRBL-WWGRRREGSA-N 346.431 1.098 10 10 EDCE C[C@@]12COC[C@@H]1CN(C(=O)NCc1ccc(N3CCOCC3)cc1)C2 852005362 SSCKVKXXYJBYGV-QFBILLFUSA-N 345.443 1.701 10 10 EDCE O=C1C[C@@H](S(=O)(=O)NCc2cc(Cl)ccc2O)CN1C1CC1 867463154 HONRPYREVLGBGC-GFCCVEGCSA-N 344.820 1.228 10 10 EDCE Cc1cc(Br)cc(CN2CCO[C@H](CC(N)=O)C2)c1O 862535405 LUTXBVHYIWDPFW-GFCCVEGCSA-N 343.221 1.539 10 10 EDCE C[C@@H](NC[C@]12COCCN1C(=O)OC2)c1cc(Cl)ccc1O 866520608 HADXDZJTTNBHTI-MEBBXXQBSA-N 326.780 1.917 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3nnc(C)n3C)C2)cc1 1118561272 IVQKLSUIUWNLHQ-ZDUSSCGKSA-N 344.419 1.210 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NOCCO)C1 768215803 MAEVISGTOGTURZ-UHFFFAOYSA-N 331.416 1.448 10 10 EDCE C[C@H](O)c1ccc(N(C)C[C@H](O)CN(C)C)cc1Br 690314600 DBTPKOUFCZBXAN-CMPLNLGQSA-N 331.254 1.861 10 10 EDCE COC(=O)C1=NO[C@@]2(CCN(Cc3cc(F)cc(F)c3O)C2)C1 895455637 YWKFMTPJLJRULT-HNNXBMFYSA-N 326.299 1.564 10 10 EDCE CCOC(=O)[C@@H]1CSCN1C(=O)c1ccc(N=NC(N)=O)cc1 1139946695 HHZJQWSPPLYNBY-NSHDSACASA-N 336.373 1.927 10 10 EDCE CN1CCCc2cc(CNC(=O)CC[C@H]3CC[C@@H](C(N)=O)O3)ccc21 1136437075 VLVFNBMVGOVUHK-WBVHZDCISA-N 345.443 1.498 10 10 EDCE CC(=O)N1CCC[C@H]1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891246810 POLIWVBZBPGCJJ-ZWKOTPCHSA-N 346.475 1.482 10 10 EDCE COCCNc1nc(CC(=O)NCc2ccc(O)cc2O)cs1 1142533208 HAILALMCHCDJLS-UHFFFAOYSA-N 337.401 1.472 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@](O)(CN(C)C)C2)cc1Br 713709449 UTDQRCIFRGKSKS-XHDPSFHLSA-N 342.281 1.972 10 10 EDCE CN1CCN(c2ccc(CNC(=O)c3ccc(CO)nc3)cc2)CC1 1303085030 KSIPWEUTVYQBIQ-UHFFFAOYSA-N 340.427 1.256 10 10 EDCE CCOC(=O)[C@H](C[C@H]1CCCO1)NC(=O)c1ccc(C)c(O)c1O 1177476344 QFWNXTQOJUUTRD-YPMHNXCESA-N 337.372 1.637 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(NC(=O)OC)C2)c([N+](=O)[O-])c1 1320299877 VXCITOXWXIZIRW-XQRVVYSFSA-N 335.316 1.326 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cn(C[C@@H]3CCOC3)nn2)cc1 1331865768 ISXQYNPIDHXBEW-AWEZNQCLSA-N 329.404 1.311 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1[C@H]2CCC[C@H]21 1346591525 PYEVGKMMEGDUBN-FVQHAEBGSA-N 325.412 1.594 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1912155864 MYXRBUIACCXPOI-SSDOTTSWSA-N 349.214 1.646 10 10 EDCE Cn1cc([C@@H](O)C(=O)NCc2ccc(N3CCSCC3)cc2)cn1 1291627625 NGVHMBRVSVCBBI-MRXNPFEDSA-N 346.456 1.323 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCN2CCCCC2=O)cc1 1464959589 BNDHXRDMIFMANQ-UHFFFAOYSA-N 331.376 1.981 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1[nH]cnc1CC 1466674288 OVEKCMUSCRXLQD-LBPRGKRZSA-N 347.371 1.288 10 10 EDCE C[C@@H](NCc1cccc(F)c1O)C1(O)CN(C(=O)OC(C)(C)C)C1 1918691711 BSRBXBUHGFCCGL-LLVKDONJSA-N 340.395 1.991 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NCc2nc3ncccn3n2)c1 1478840225 RJYMURVWCIYOQF-SNVBAGLBSA-N 342.359 1.399 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@H]2CCNC2=O)cc1C 1491476615 ARJVYQVKKIZQMZ-DZGCQCFKSA-N 333.432 1.124 10 10 EDCE NCc1ccc(N2CC[C@]3(C[C@@H](O)CO3)C2)c(Br)c1 2137139568 ZGNPHHJGRKYEIH-RISCZKNCSA-N 327.222 1.638 10 10 EDCE O=C(NCc1cccc(Cl)c1O)c1cnc2n(c1=O)CCS2 1640402480 TUEOJYTZYDGBDK-UHFFFAOYSA-N 337.788 1.638 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cnc2[nH]c(O)nc2c1 1643285222 ULVRPLZCXFKBKA-UHFFFAOYSA-N 335.323 1.847 10 10 EDCE Cc1cc(C(=O)N[C@@H](C)c2ccccc2O)nc2nc(O)nc(O)c12 1643742297 XQIIDWNZLUQDDC-VIFPVBQESA-N 340.339 1.941 10 10 EDCE CN(CCN(C)C(=O)C1CC1)C(=O)c1ccc(N=NC(N)=O)cc1 1738344174 JSQQMBUPGVQIRM-UHFFFAOYSA-N 331.376 1.789 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CCN(C)C(=O)C2)cc1C 1733002294 OZFIVRPVAZMYPP-GOEBONIOSA-N 347.459 1.466 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccc(Br)nc1O 1645366554 SDTVLGVALGJBPR-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1ccc(N2CCNC2=O)cc1 1643565191 DSVYOIJJSUUQGJ-UHFFFAOYSA-N 341.367 1.486 10 10 EDCE Cc1ccc(-n2c(C)cc(C(=O)Cn3nnn(C)c3=O)c2C)cc1F 1652109591 ILZLLFDUXZFOSZ-UHFFFAOYSA-N 343.362 1.715 10 10 EDCE C[C@@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CCS1(=O)=O 1652551440 CWFRPEHMVCUYMQ-BXKDBHETSA-N 338.389 1.545 10 10 EDCE COc1ccc(-n2nnnc2CN(CCCNC(C)=O)C2CC2)cc1 1660634597 BHOJSFLQALGHPF-UHFFFAOYSA-N 344.419 1.162 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@@H](C(=O)OC)C2)c([N+](=O)[O-])c1 1772824318 CYBFNYPQTKOTRK-TXNVCOODSA-N 334.328 1.780 10 10 EDCE CN1C(=O)/C(=C\c2ccccc2OS(C)(=O)=O)SC1=S 6343683 GIXPNKIYBXMBGC-JXMROGBWSA-N 329.424 1.856 10 10 EDCE CCOCCOCCOC(=O)CCNCc1cc(C)ccc1O 1857869997 DKBYQJCLFDXIPZ-UHFFFAOYSA-N 325.405 1.777 10 10 EDCE C[C@]1(O)CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 235729094 SOFWYSVLAQLHPD-YPMHNXCESA-N 326.194 1.362 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H](NCc2ccc(O)cc2O)C1 1946798612 BMQIVKDKEGPKAD-ZDUSSCGKSA-N 338.404 1.823 10 10 EDCE CO[C@@H](C)[C@H](CC(=O)C(=O)C[C@H]1C[C@H](N)C1)NC(=O)OC(C)(C)C 2003166548 HWSAESZGTFWGIQ-CYDGBPFRSA-N 342.436 1.570 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@H](CN=[N+]=[N-])C2)C1 2010398649 WIEOVMCDCRQURA-NEPJUHHUSA-N 339.396 1.781 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OC(C)(C)C 2010389138 LUVLNQKBYXGQFI-NSHDSACASA-N 337.384 1.614 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)([C@@H](F)C(=O)NCCCCN=[N+]=[N-])C1 2010399023 XVGOQXNJWLYKOY-JTQLQIEISA-N 345.375 1.513 10 10 EDCE CC(C)CN(CCO)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2154248369 MEYIOBNTKUDEPF-ZDUSSCGKSA-N 343.221 1.889 10 10 EDCE CN(Cc1c(O)cccc1Br)[C@@H]1COC[C@@H]1C(=O)O 706649259 KJIQCYQOWKBKTM-GXSJLCMTSA-N 330.178 1.686 10 10 EDCE CNCc1ccc(N2C[C@H](O)C[C@]2(C)CO)c(Br)c1 698226790 HLNMWDSUCAHSRT-BXUZGUMPSA-N 329.238 1.491 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)c(Br)c1 2182557117 SENBRMLAJNFQGC-IYTZEYEFSA-N 341.249 1.647 10 10 EDCE CCCNCc1ccc(N2CCC2(CO)CO)cc1Br 2194355193 YTVGRBCJGGFXJJ-UHFFFAOYSA-N 343.265 1.882 10 10 EDCE C[C@]1(CO)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2097247573 OEELVQRLUPBKFP-WCQYABFASA-N 327.178 1.396 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CN(c3ccc(N)cc3)C[C@@H]2[C@H]1CO 2214630012 DBQGIOMROXLQGA-VBNZEHGJSA-N 333.432 1.933 10 10 EDCE COc1ccc(Br)c(CNC[C@@]2(C)CCNC2=O)c1O 2236054270 GUASMOPHVGGPDI-CQSZACIVSA-N 343.221 1.779 10 10 EDCE C[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2273221530 ASSUMBKPPAWWOY-QNRPFLCFSA-N 326.194 1.361 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@]4(O)C[C@H]4C3)c(Br)cc21 2280028207 OFESZZXLVSTCKU-FMCKTDMXSA-N 338.205 1.362 10 10 EDCE O=C1NC(=S)N(C2CCCCC2)C(=O)C1=CNN1CCCCC1 2296124865 YONJYNNFTHJMOO-UHFFFAOYSA-N 336.461 1.437 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCCN(c2cccnn2)CC1 2307987771 KGRXSTPGSADEPJ-UHFFFAOYSA-N 340.383 1.640 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CCC(=O)N2)c(O)c1Br 2352627384 POIGJSNAZLJHRM-VIFPVBQESA-N 327.178 1.358 10 10 EDCE Cc1ccc(CN=c2[nH]c(=N)[nH]cc2F)c(O)c1Br 2352639011 ZYTQQUFVOROCBZ-UHFFFAOYSA-N 327.157 1.839 10 10 EDCE O=C1NC(=S)N(c2ccccc2F)C(=O)/C1=C\NCc1ccco1 104797252 JDBNYYQULRTHOU-LUAWRHEFSA-N 345.355 1.840 10 10 EDCE O=C(/C=C\c1ccccn1)NCc1ccc(N2CCNC(=O)C2)cc1 55347650 BBDHZCMICTXPKG-TWGQIWQCSA-N 336.395 1.347 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NCC1(O)CCOCC1 304441583 WUXULEXCOPNSES-UHFFFAOYSA-N 329.356 1.522 10 10 EDCE CN(C[C@@H]1CCCC[C@H]1O)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 302044339 MKKPDOJMMQFLJH-IINYFYTJSA-N 335.360 1.913 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)NC(=O)c1ccco1 183415809 PSJAMKQUJDQOFJ-WDEREUQCSA-N 332.356 1.557 10 10 EDCE CCn1cc([C@H]2CN(C(=O)c3ccc(C)c(O)c3O)CCO2)cn1 191779527 OCXOSAWHLBVEAM-CQSZACIVSA-N 331.372 1.836 10 10 EDCE CN1C2(CCC2)COC[C@]1(CO)CNCc1cc(Cl)ccc1O 527752013 FJQPLOGZYATXLG-QGZVFWFLSA-N 340.851 1.751 10 10 EDCE COC[C@H]1CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CCO1 255005077 QROTTWCSIKVLMM-NCRRVARUSA-N 346.427 1.410 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCC(N)=O)C1 444258176 GTKLCGDWILGCJG-UHFFFAOYSA-N 342.443 1.399 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)CCS(C)(=O)=O)c([N+](=O)[O-])c1 263934018 BIVZVIHBACGDGK-FNORWQNLSA-N 342.373 1.262 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2CC(=O)N1CCOC[C@@H]1C1CC1 376149060 MXTZGKUZXVCGGZ-QGZVFWFLSA-N 345.443 1.589 10 10 EDCE CCS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)C(C)=O)c1 808516970 SRVCWUXANOYRQA-UHFFFAOYSA-N 332.761 1.449 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CC[C@@H](CN)O2)c(O)c1Br 2380725578 LSYSTJOQSPBFLT-WDEREUQCSA-N 343.221 1.586 10 10 EDCE Cc1ccc(CN(C)[C@H]2COC[C@H]2C(=O)O)c(O)c1Br 2380812679 YBVPCRIFLVGGSE-MNOVXSKESA-N 344.205 1.995 10 10 EDCE Cc1cc(NC(=O)NCCc2ccc(O)c(O)c2)c(N(C)C)nn1 824529533 MJYHGCHILFHCHP-UHFFFAOYSA-N 331.376 1.626 10 10 EDCE Cc1nccc(O[C@@H]2CCCN(C(=O)c3cc(O)nc(O)c3)C2)n1 585346509 PMGIQYHJVSODQV-GFCCVEGCSA-N 330.344 1.275 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(C(N)=O)CC2)cc1Br 722195760 FIKRSXZLHCILEY-SNVBAGLBSA-N 341.253 1.930 10 10 EDCE C[C@H](NC[C@]1(CO)COCCN1C)c1ccc2ccccc2c1O 903278377 FNVBMNQPBMRUCM-LIRRHRJNSA-N 330.428 1.889 10 10 EDCE CCN(C)C(=O)CNCc1c(Br)ccc(OC)c1O 1964078472 DTHBDIULYPUXID-UHFFFAOYSA-N 331.210 1.731 10 10 EDCE CC(=O)c1cc(F)cc(Cn2cc(CN3CCC(N)CC3)nn2)c1O 905784303 QQAZDYCXLHGYQF-UHFFFAOYSA-N 347.394 1.297 10 10 EDCE CN1CC[C@H](NC(=O)C(=O)Nc2ccc(N)cc2)[C@@H]1c1ccccc1 841081562 SZYYGTMVUGKYBA-IRXDYDNUSA-N 338.411 1.769 10 10 EDCE O=S1(=O)CC[C@]2(CN(Cc3cc4c(cc3O)CCC4)CCO2)C1 842633018 NHPFSNWNPPHDPN-KRWDZBQOSA-N 337.441 1.270 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C[C@H](O)C1(O)CCOCC1 929294058 CITOOTXPVKFXIU-SFHVURJKSA-N 336.476 1.865 10 10 EDCE NCC(F)(F)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 846672791 LBDPSKQREKVXSC-UHFFFAOYSA-N 331.338 1.263 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cn3nc(C)cc3C)C2)cc1 855228373 BAOBSAMAMQPFAC-HNNXBMFYSA-N 328.416 1.904 10 10 EDCE Cn1nccc1[C@@H]1C[C@@H](NC(=O)NCc2c(O)cccc2F)CCO1 922749511 QCEUORWSSXARDW-ZBEGNZNMSA-N 348.378 1.984 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H]4COC[C@H]4C3)nc12 852669496 STIIXLBRZREIIC-NWDGAFQWSA-N 346.387 1.080 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@](C)(C(N)=O)C3)C2)cc1 852451925 RBUPTVYOXWCHJM-ACJLOTCBSA-N 346.431 1.181 10 10 EDCE CN(Cc1cc2c(cc1O)OC[C@@H]2O)CC(C)(C)S(C)(=O)=O 768465407 LAIKANZWVUPHTM-ZDUSSCGKSA-N 329.418 1.073 10 10 EDCE CC[S@](=O)CCNC(=O)NCc1cccc(Br)c1O 764782615 GOCFWLBSDAFECA-IBGZPJMESA-N 349.250 1.723 10 10 EDCE CN(C)C(=O)CCN1CCN(Cc2cc(Cl)cc(F)c2O)CC1 775725549 PYTJVQAYZSQHJL-UHFFFAOYSA-N 343.830 1.781 10 10 EDCE CN(CCNCc1ccc(Br)cc1O)CCOCCO 895663531 YJFXRXZCJVEBFI-UHFFFAOYSA-N 347.253 1.185 10 10 EDCE COC(=O)[C@@]1(O)CCN(Cc2cc(Br)cc(C)c2O)C1 895703727 OGVRGKNKIJTMAF-CQSZACIVSA-N 344.205 1.573 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H]2CNCCCO)cc1 1324285612 KXQDCUICQYTKEY-AWEZNQCLSA-N 333.392 1.426 10 10 EDCE Cc1cc(C(=O)N2CC[C@H](O)[C@H](CO)C2)c(C)n1-c1ccccn1 1299450501 MLNSXAACESLXIL-HOCLYGCPSA-N 329.400 1.304 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@@H](C)SC)cc1C 1717911332 JGTBNCHAIGWONL-UKRRQHHQSA-N 340.489 1.664 10 10 EDCE CCNC(=O)CC(=O)N1CCC[C@@H]1CNCc1ccc(OC)c(C)c1 1482057254 YVVBKGYAGDYJMM-MRXNPFEDSA-N 347.459 1.610 10 10 EDCE COC(=O)NCC(=O)N[C@H](C)[C@H](C)NCc1ccc(OC)c(C)c1 1717401205 OQRBBSYESSSUJE-QWHCGFSZSA-N 337.420 1.342 10 10 EDCE O=C(Cn1cc(Br)cn1)NCc1ccc(O)cc1O 1626837858 HHCFQNOZIAOTLM-UHFFFAOYSA-N 326.150 1.373 10 10 EDCE COc1ccc(CNC(=O)[C@H]2CCN(c3ccncc3)C2)c(O)c1 1638622920 DBYKPFGOROVCJT-AWEZNQCLSA-N 327.384 1.939 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@@H]2COC(=O)C2)cc1C 1567010629 XQAPUNLQWFBKDR-ZFWWWQNUSA-N 334.416 1.551 10 10 EDCE CON(C(=O)Cc1ccc(O)c(O)c1)[C@@H](C)C(=O)OC(C)(C)C 1635961118 KRISNQHPVOZOCF-JTQLQIEISA-N 325.361 1.761 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cnc(C)n2C)cc1C 1731617519 RQWLNZLTIQVXOK-ZDUSSCGKSA-N 330.432 1.954 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CCS(=O)(=O)C3(CCC3)C2)c(O)c1O 1645143705 LEUSPTLLFLEIGS-LLVKDONJSA-N 339.413 1.636 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3ccncn3)CC2)cc1C 1733257285 MFSVSHKJMPUPRJ-UHFFFAOYSA-N 326.400 1.846 10 10 EDCE C/C=C(\C)C(=O)NCCN(C)Cc1nnnn1-c1ccc(OC)cc1 1731767772 QRZFIGNSWMDLHB-WLRTZDKTSA-N 344.419 1.185 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cn(Cc2cccc(F)c2)nn1 1645362912 FOYIZMBAJFPAHE-UHFFFAOYSA-N 342.330 1.807 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)C[C@]2(C)CCS(=O)(=O)N2)c1 1595806339 HHAALNYPYNSHKF-BONVTDFDSA-N 342.417 1.050 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)CCc2cnn[nH]2)cc1C 1674729993 YMMCTXALCCQCNK-ZIAGYGMSSA-N 345.447 1.737 10 10 EDCE CC[C@H](CNC(=O)c1cc[nH]c1)NC(=O)c1cc(OC)nc(OC)c1 1688749613 QVMRGQWXMZMENJ-CYBMUJFWSA-N 346.387 1.365 10 10 EDCE COC[C@H](OC)C(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)C1 1690246797 WYZOHJAVXHFUOA-RDJZCZTQSA-N 336.432 1.356 10 10 EDCE NCc1ccc(N2CCN3C(=O)CC[C@H]3C2)c(F)c1Br 231840510 HHQRCTFJSPLKDY-JTQLQIEISA-N 342.212 1.858 10 10 EDCE CCOC(=O)C[C@@H](C)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 160054408 CKWLQCCHTUBQDG-RZIFZGNASA-N 346.427 1.994 10 10 EDCE Nc1ccc(Nc2nc[nH]c(=O)c2I)cc1 165696412 QTEHDGJGEHKAMU-UHFFFAOYSA-N 328.113 1.700 10 10 EDCE CCOc1cccc(/C=C2/SC(=S)N(CCO)C2=O)c1O 1858588229 VTNCWTYRFMMZTQ-DHZHZOJOSA-N 325.411 1.984 10 10 EDCE C[C@]1(O)CCN(c2ccc(CO)c(Br)c2)C[C@]1(C)O 1880703314 NUJPOFUMYOLTHB-KBPBESRZSA-N 330.222 1.654 10 10 EDCE [N-]=[N+]=NCCN[C@@]1(C(N)=O)CN(Cc2ccccc2)C2(CCC2)C1 1949694331 QOGPXZBLLUKIJO-QGZVFWFLSA-N 328.420 1.939 10 10 EDCE CO[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NCCN=[N+]=[N-])C1 1965101394 CIBQPPUEWRCWMT-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985103203 RNPVNYZIHFXKRZ-QWRGUYRKSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)NCc1cn(CC(=O)NCCCN=[N+]=[N-])nn1 2010406615 WUKCHCGEJUFYPW-UHFFFAOYSA-N 338.372 1.119 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010402811 WGSJQAGJUUGFCW-NEPJUHHUSA-N 341.412 1.954 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@@H](CO)C2)c(Br)c1 396893960 WZCVZYRNFDLKHQ-IUODEOHRSA-N 343.265 1.738 10 10 EDCE CS(=O)(=O)c1cnn(Cc2ccc(Br)cc2O)c1 2070207577 SJHHWOCFLYKJGQ-UHFFFAOYSA-N 331.191 1.803 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@H]4[C@@H]3C[C@H]4O)c(Br)cc21 2178170614 XFUDEJQRANFMOX-VWSRCUEZSA-N 338.205 1.361 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)c(Br)c1 2190462180 VSHVOIBIAJWZBJ-PDRAWDMGSA-N 341.249 1.932 10 10 EDCE CS(=O)(=O)C[C@@H]1CCN(c2ccc(CO)c(Br)c2)C1 2087365312 UXVRWESEAKOPDM-SNVBAGLBSA-N 348.262 1.812 10 10 EDCE C[C@@H](O)c1ccc(N2CC(OCC(N)=O)C2)c(Br)c1 2089139160 HSVQXCSWQMCFDT-MRVPVSSYSA-N 329.194 1.193 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)C[C@H](CO)C2)c(Br)c1 2236633509 AOQWGOAINJUKTC-WOPDTQHZSA-N 344.249 1.930 10 10 EDCE CC[C@H](C)NCc1ccc(N2C[C@H](O)[C@@H](O)C2)cc1Br 2240086247 RKIGJHNMKBUZPG-LKTVYLICSA-N 343.265 1.879 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)C(=O)C[C@H]1C[C@H](N)C1)[C@H]1CCOC1 2250668586 MDFAWTPDPPVZIK-AVGNSLFASA-N 340.420 1.278 10 10 EDCE CC(C)CN1C(=O)C(=CNCc2ccccc2F)C(=O)NC1=S 2295113164 BZXJQXYNIPVQKV-UHFFFAOYSA-N 335.404 1.699 10 10 EDCE CC(C)CN1C(=O)C(=CNCCc2ccccc2F)C(=O)NC1=S 2295113171 DEIYXXNVTOQZJT-UHFFFAOYSA-N 349.431 1.741 10 10 EDCE Cc1ccc(CNC(=O)COC[C@@H](C)N)c(O)c1Br 2352640638 LCPMFZQVJHQNKW-SECBINFHSA-N 331.210 1.443 10 10 EDCE CNC(=O)C(=O)NCC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 9114191 LERMFJNMBDWYQV-UHFFFAOYSA-N 347.802 1.792 10 10 EDCE Cc1ccc(C(=O)N2CCCN(c3cccnn3)CC2)c(O)c1O 179506288 VGFYZZLGMUBIBO-UHFFFAOYSA-N 328.372 1.549 10 10 EDCE Cn1cc(/C=C2/SC(Nc3ccccc3)=NC2=O)c(=O)n(C)c1=O 193101779 UZCKLAONIJQCSW-XYOKQWHBSA-N 342.380 1.166 10 10 EDCE CS(=O)(=O)C[C@H](N)c1ccc(I)cc1O 95770491 DLQUEOFDAREROE-QMMMGPOBSA-N 341.170 1.041 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2cc(Cl)cc(C)c2O)CCO1 529639484 DCEXWPKMNJRNGH-ZDUSSCGKSA-N 327.812 1.484 10 10 EDCE CN1CCc2cc([C@@H](NN)c3c(Br)cnn3C)ccc21 2163158739 SAXABLZZRUQSOI-CYBMUJFWSA-N 336.237 1.728 10 10 EDCE CO[C@]1(C(=O)O)CCN(Cc2ccc(N3CCN(C)CC3)cc2)C1 901540383 CUNZWLYXKNKMJP-GOSISDBHSA-N 333.432 1.114 10 10 EDCE CCOc1ccc(CN2CCS(=O)(=O)[C@@H]3CCC[C@H]32)c(O)c1 825201361 JYQQRQGPSARCHO-GDBMZVCRSA-N 325.430 1.942 10 10 EDCE CO[C@]1(CN[C@H](C)c2ccc(N(C)C)cc2)CCS(=O)(=O)C1 903369619 YTWKCGDDTPHGSG-CJNGLKHVSA-N 326.462 1.607 10 10 EDCE NS(=O)(=O)CCCCCCC(=O)NCc1cc(Cl)ccc1O 846661253 OZUFFVYHRXDUNN-UHFFFAOYSA-N 348.852 1.901 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3c4c(nn3C)CCC4)C2)cc1 912292063 IDZFMBSQULBOTK-ZDUSSCGKSA-N 340.427 1.926 10 10 EDCE COCCN1CCC[C@H]1CNC(=O)NCc1cccc(OC)c1O 745813266 ZXRZPEBAEBTHNL-AWEZNQCLSA-N 337.420 1.311 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)c3ncnn3C)C2)cc1 852274830 NGMHXERFYGCLLB-QWHCGFSZSA-N 344.419 1.463 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC(=O)N(C)C[C@H]3C)C2)cc1 852451161 FFGIMQNVMQXMNY-KGLIPLIRSA-N 346.431 1.146 10 10 EDCE COC[C@@H](NC(=O)NCc1cc(OC)ccc1O)C1CCOCC1 853736821 PPALIBPTBZQEEN-OAHLLOKOSA-N 338.404 1.642 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](CN)CO 1952116552 ZSMKZQYWHILHNF-NWDGAFQWSA-N 326.393 1.101 10 10 EDCE C[C@H](NC[C@]12COCCN1C(=O)OC2)c1cc(Cl)ccc1O 866520609 HADXDZJTTNBHTI-ZUZCIYMTSA-N 326.780 1.917 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C[C@H]1F 1117163936 DLVVPFNVBAHOCK-CZUORRHYSA-N 347.434 1.892 10 10 EDCE O=C1C[C@H]([C@@H]2CCCCN2C(=O)/C=C\c2ccc(O)c(O)c2)CN1 779541241 XFWLQIQUEOBDQR-XVMAMZMSSA-N 330.384 1.628 10 10 EDCE CCCN(CCC)c1ccc(CN2C[C@@H](C(N)=O)[C@H](C(N)=O)C2)cc1 895314243 KDJQQZBLYXZBBW-IAGOWNOFSA-N 346.475 1.332 10 10 EDCE CCOc1ccc(CNC[C@H]2CCCCN2S(C)(=O)=O)c(O)c1 796512152 CUYMNIRLEJMQLO-CQSZACIVSA-N 342.461 1.695 10 10 EDCE CNCc1ccc(N2CCC(CO)(CO)C2)cc1Br 694684261 VKHYPBJFIITCNO-UHFFFAOYSA-N 329.238 1.350 10 10 EDCE CC[C@H](CNC(=O)C(C)(C)C(N)=O)NCc1ccc(OC)c(C)c1 1318537848 MTMYAFIZUURTCH-CQSZACIVSA-N 335.448 1.500 10 10 EDCE CNC[C@H](C)CNC(=O)NCc1cc(Br)ccc1O 1325367067 UVPODKLIAMDOLS-VIFPVBQESA-N 330.226 1.809 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1Cc2cccnc2C1 1348571290 XHOFXOHLFWFDOL-QGZVFWFLSA-N 337.423 1.949 10 10 EDCE O=C(NCC[C@@H]1CC1(F)F)C(=O)NCc1ccc(N2CC=CC2)cc1 1347951593 IQHHPSASZUPFNS-CQSZACIVSA-N 349.381 1.841 10 10 EDCE CCCN1C[C@@H](C(=O)N(C)CCN(C)c2ccc(OC)cc2)CC1=O 1278288211 HIWFLYVCHPKCRZ-HNNXBMFYSA-N 347.459 1.848 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H](C)n2cccn2)cc1C 1272371465 MABVQMODBBOBPZ-GDBMZVCRSA-N 346.431 1.028 10 10 EDCE CCN(CCNCc1cnon1)C(=O)c1ccc(N=NC(N)=O)cc1 1273778152 BHABQAQZIMKVQD-UHFFFAOYSA-N 345.363 1.484 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@]2(C)CCNC(=O)C2)cc1C 1275201813 ATTVWDKQODXCKW-LIRRHRJNSA-N 347.459 1.514 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2CCC(=O)N2)cc1C 1283581425 HMODVHPKRCRTBM-DZGCQCFKSA-N 333.432 1.219 10 10 EDCE Cn1nccc1[C@@H]1C[C@H](NC(=O)Cc2ccc(O)c(O)c2)CCO1 1297999338 IZXGFUROKBQFQI-WBMJQRKESA-N 331.372 1.410 10 10 EDCE O=C1Nc2cc(N3CCC4(COC4)C3)c(Br)cc2[C@H]1O 1915334707 UTZJZNYRPPBDKU-GFCCVEGCSA-N 339.189 1.661 10 10 EDCE O=C(Cn1nc(-c2ccccc2)oc1=O)NCc1cc(O)ccc1O 1558174173 GTYAZDCYMBITMN-UHFFFAOYSA-N 341.323 1.231 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1CCNC(=O)C1 1715728187 YSOAQPHTKVMFDC-MRXNPFEDSA-N 347.459 1.468 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cn(CCc2ccccc2)nn1 1644753986 MKYJXHVZIXIGKY-UHFFFAOYSA-N 338.367 1.862 10 10 EDCE C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H](C)S1(=O)=O 1641951942 XGBGKIIMXLOQNF-NXEZZACHSA-N 338.389 1.497 10 10 EDCE C[C@@H](CNC(=O)c1ccco1)NC(=O)c1ccc(N=NC(N)=O)cc1 1738591562 ZHLJKGMZIDYHCW-JTQLQIEISA-N 343.343 1.990 10 10 EDCE COc1cc(N2CCC(CNC(C)=O)CC2)c([N+](=O)[O-])cc1OC 1650674086 OXLNLNFNKRJKAL-UHFFFAOYSA-N 337.376 1.965 10 10 EDCE C[C@@H](CCNC(=O)NCc1ccc(N(C)C)c(F)c1)[S@](C)=O 165582139 AFYFGHNCUCSRBA-KPWVOAKYSA-N 329.441 1.848 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)C(C)(C)O 1900612509 JJOBNECKTPKNOJ-JTQLQIEISA-N 329.401 1.809 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985100625 IEHNHYAWPMRTHO-GARJFASQSA-N 327.385 1.562 10 10 EDCE OC[C@@H]1C[C@@H](O)CN1c1ccc(CNC2CC2)cc1Br 698202119 VWTDUTWXLZUEOE-QWHCGFSZSA-N 341.249 1.633 10 10 EDCE COc1ccc(CNC(=O)[C@@H]2CN(C)C[C@H]2C(F)(F)F)c(O)c1 2063978327 MAZWIMNBIVNIMG-VXGBXAGGSA-N 332.322 1.757 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CNCc2cccc(F)c2O)C1 895208445 TUTSBGWIRBZQKF-UHFFFAOYSA-N 326.368 1.603 10 10 EDCE CNC(=O)[C@H]1[C@@H](C)CCN1c1ccc(CO)cc1Br 2090263081 TYXCUSHZSWZKPW-TVQRCGJNSA-N 327.222 1.902 10 10 EDCE NCc1ccc(N2C[C@H]3OCCO[C@@H]3C2)c(F)c1Br 2093346288 VHQADYNHTBKSCJ-GHMZBOCLSA-N 331.185 1.651 10 10 EDCE NCc1ccc(N2C[C@H]3CCO[C@@]3(CO)C2)cc1Br 2231367623 BIHJBGGWQXGSNU-BXUZGUMPSA-N 327.222 1.495 10 10 EDCE C[C@H](O)c1ccc(N2CC3(CCC(=O)N3)C2)cc1Br 2229684840 SADLSDAZOMKBEF-VIFPVBQESA-N 325.206 1.971 10 10 EDCE CC(C)(C)OC(=O)N1CC(N2CCC[C@@H]2C(=O)NCCN=[N+]=[N-])C1 2250174577 PNPUCUGMWOSXTG-GFCCVEGCSA-N 338.412 1.497 10 10 EDCE OCc1ccc(N2C[C@@H]3CC[C@H](CO)O[C@@H]3C2)c(Br)c1 2289341575 WHJSCZCFHJPOAT-YWPYICTPSA-N 342.233 1.918 10 10 EDCE COC(=O)CC(C)(C)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297631499 TVTXQBHSNAJOPR-UHFFFAOYSA-N 346.427 1.994 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCC1(CCO)CC1 2310380772 QPQDCYQUZWLNSQ-UHFFFAOYSA-N 330.428 1.815 10 10 EDCE COC(=O)CC(=O)N(C)Cc1ccc(C)c(Br)c1O 2352646865 YOWNUPVIHFIOSJ-UHFFFAOYSA-N 330.178 1.985 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2cn(C)c(O)n2)cc1C 1268082713 FTXKWGUODUWDMT-CYBMUJFWSA-N 346.431 1.693 10 10 EDCE COC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N(C)C)c(F)c2)C1 265767587 RZWZOJYJTAXRKQ-ZDUSSCGKSA-N 337.395 1.986 10 10 EDCE O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NCc1ccccc1O 269125120 GXBDKTLJALJWJN-INWMFGNUSA-N 349.456 1.734 10 10 EDCE CCOc1cccc(CN2CCC(CNS(C)(=O)=O)CC2)c1O 289366882 KXOCOVWEEVPLNL-UHFFFAOYSA-N 342.461 1.552 10 10 EDCE Cn1cc(C(=O)C(=O)NCc2cc(Br)ccc2O)cn1 804736736 ZGQJKROYAKOOTE-UHFFFAOYSA-N 338.161 1.387 10 10 EDCE C[C@H](C(N)=O)N(C)c1ccc(/C=C/C(=O)O)c(Br)c1 711183591 DUOAZGIVAZSWKC-YZCDNWJKSA-N 327.178 1.857 10 10 EDCE COc1cccc(C(=O)COC(=O)/C=C/c2ccc(O)c(O)c2)n1 811156577 NWDSTWUEZXHQRO-SOFGYWHQSA-N 329.308 1.941 10 10 EDCE COc1ccc(N2CCCN(C(=O)CC(F)(F)CN)CC2)cc1 846672068 BTOLIVFIZOJLJZ-UHFFFAOYSA-N 327.375 1.718 10 10 EDCE C[C@@H](O)c1ccc(N(C)Cc2nnn(C)n2)cc1Br 1892990511 AARZHDIWYZSJAR-MRVPVSSYSA-N 326.198 1.662 10 10 EDCE Cc1cc(C(=O)NC2CC(CC(N)=O)C2)c(C)n1-c1ccccn1 928049446 QLIZZQPHLWDJMU-UHFFFAOYSA-N 326.400 1.873 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCC[C@@H]3CO)C2)cc1 854297893 SUARBWGSQMAEOR-CKEIUWERSA-N 333.432 1.734 10 10 EDCE COC[C@@]1(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CCOC1 855225679 PRXJHJYEEQDVJH-KDOFPFPSSA-N 334.416 1.443 10 10 EDCE COCC1(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 852402021 HSEBFMPWJXTUCT-UHFFFAOYSA-N 347.459 1.874 10 10 EDCE Oc1cccc(Cl)c1CN[C@H]1CCN(c2ccc3nncn3n2)C1 858243452 HWTNUCMIHPKMHW-NSHDSACASA-N 344.806 1.852 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3CCOCC3)C2)cc1 852181404 AWSLCIYURIGQTH-OAHLLOKOSA-N 333.432 2.000 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC(O)(C(C)C)C3)C2)cc1 854297061 JHMKEJUFXFNFSP-CQSZACIVSA-N 333.432 1.686 10 10 EDCE CO[C@](C)(CNC(=O)OC(C)(C)C)[C@H](N)Cc1ccc(O)c(O)c1 1952913264 XTQNXSWSQYLKSI-RHSMWYFYSA-N 340.420 1.897 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)Nc2ccc(C(N)=O)nc2)c1 766461017 NQZMVSSJTUGWQO-SECBINFHSA-N 330.344 1.777 10 10 EDCE CCOC[C@H](C)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1117619357 MCLZYHUOQRVCDI-ZDUSSCGKSA-N 333.432 1.226 10 10 EDCE COC(=O)c1cncc(NC(=O)NCc2cccc(OC)c2O)c1 769231560 XWLMRIJZNDLWPJ-UHFFFAOYSA-N 331.328 1.904 10 10 EDCE COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H]3C[C@@H]3C)CC2)cc1 1117084912 UDIHAFFIFAETSS-LSDHHAIUSA-N 345.443 1.506 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)NCCc2nnnn2C)c1C 771781733 PRVWKYZZCXEONI-UHFFFAOYSA-N 338.415 1.899 10 10 EDCE COC(=O)c1c(CNCCS(C)(=O)=O)c2cc(F)ccc2n1C 894207080 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AAWCZIKRCIIPON-KBPBESRZSA-N 335.448 1.980 10 10 EDCE COC(=O)[C@@H]1[C@H]2CN(Cc3ccc(N4CCN(C)CC4)c(F)c3)C[C@H]21 1117685923 CANXSKCXUJWETL-HWWDLCQESA-N 347.434 1.428 10 10 EDCE OCC12COC(CNCc3c(O)cccc3Br)(C1)C2 1967814501 HRWSSUJKQJKSPM-UHFFFAOYSA-N 328.206 1.786 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](OCC(N)=O)C2)cc1Br 2145369458 CCJXKNZQLGCPJX-MWLCHTKSSA-N 343.221 1.583 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985101414 RUYBMCVMIGYHSH-JTQLQIEISA-N 327.385 1.733 10 10 EDCE CCO[C@H](CNC(=O)OC(C)(C)C)CC(=O)N1CC(N=[N+]=[N-])C1 1985102652 KBIIDOCZSNJQHP-NSHDSACASA-N 327.385 1.827 10 10 EDCE C[C@H](N[C@H](CO)CNC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985776997 GDAKXRBRCPDADK-QWRGUYRKSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CN(Cc2ccc(N)cc2)CC[C@@H]1CO 2009096129 LRHCLWIMRAEHEL-GDBMZVCRSA-N 335.448 1.976 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)[C@H](CO)C2)cc1Br 316619705 XJHWAXAZINMJIB-SWLSCSKDSA-N 343.265 1.738 10 10 EDCE CN1CCc2cc([C@H](NN)c3cnn(C)c3Br)ccc21 2163140619 LKNUQBFVNRGDLL-ZDUSSCGKSA-N 336.237 1.728 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2182551555 VIZPGOOEQALJKI-LPQAMYBRSA-N 345.212 1.225 10 10 EDCE O=C(N=c1nc(Br)[nH]s1)c1cc(O)c(O)c(O)c1 2068618256 OWMUVPKXOCSXCC-UHFFFAOYSA-N 332.135 1.092 10 10 EDCE CN(C[C@H]1CCN1C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2186456657 DKHZEPFYENFAMO-AMIZOPFISA-N 339.237 1.541 10 10 EDCE CNCc1ccc(N2C[C@@H](OC)C[C@@H](O)C2)cc1Br 2109023083 WKNRAGGLSZWFDC-OLZOCXBDSA-N 329.238 1.755 10 10 EDCE O=C1OC[C@@H]2CN(c3ccc(CO)cc3Br)CCN12 2114273998 IJRXLNOHHHYCLP-JTQLQIEISA-N 327.178 1.582 10 10 EDCE CC(C)(C)OC(=O)NCCc1n[nH]cc1C(=O)NCCCN=[N+]=[N-] 2214421009 UGYHMFPYVCEOFW-UHFFFAOYSA-N 337.384 1.907 10 10 EDCE CCON(Cc1c(Br)ccc(OC)c1O)C1CNC1 2227741018 JPSCCEKXYPKDJE-UHFFFAOYSA-N 331.210 1.889 10 10 EDCE COC[C@@]1(CO)C=CCN1c1ccc(CO)c(Br)c1 2351777962 FCRJDEWQYHPEDI-AWEZNQCLSA-N 328.206 1.695 10 10 EDCE Cc1ccc(CNC(=O)[C@@]23CNC[C@H]2C3)c(O)c1Br 2352623337 ASVTTZXUTIHSLQ-YGRLFVJLSA-N 325.206 1.689 10 10 EDCE Cc1ccc(CN(C)C[C@]2(O)CCNC2)c(O)c1Br 2352641023 PDOSYUZPGHRDPI-AWEZNQCLSA-N 329.238 1.619 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN2CCCC[C@@H]2C1 177761383 GITJPJZGKAGKIK-LJQANCHMSA-N 344.503 1.881 10 10 EDCE CCOC(=O)CC[C@H](C)NC(=O)C(=O)N(C)Cc1ccccc1O 1346753436 LSPOYNNCVDONDG-LBPRGKRZSA-N 336.388 1.199 10 10 EDCE NC(=O)c1cncc(NCc2ccc(N3CCC(CO)CC3)cc2)n1 301425356 BWPCEUXZHCKZMU-UHFFFAOYSA-N 341.415 1.396 10 10 EDCE CNC(=O)Cc1nc(CN[C@@H](C)c2cc(OC)ccc2O)cs1 182348411 XLGDUERKGFOTNL-JTQLQIEISA-N 335.429 1.997 10 10 EDCE CNC(=O)C[C@@H]1CNCCN1Cc1ccc(Br)cc1O 2369382891 ZCXRLSHNGFCYFY-GFCCVEGCSA-N 342.237 1.065 10 10 EDCE CN1C(=O)[C@H](N=N[C@@H]2CCC[C@H]([N+](=O)[O-])C2)[C@H](O)[C@H]2CCCC[C@H]21 299804215 IWFZIMAGKPMOOH-YXJLRHLOSA-N 338.408 1.787 10 10 EDCE O=C1CC2(CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC2)CN1 361816534 TVDDEWGXHOPIMU-UHFFFAOYSA-N 346.343 1.032 10 10 EDCE CCOC(=O)c1nn(C)cc1/C=C1\SC(=S)N(CC)C1=O 292519630 BPVCCCDJRSIYLQ-TWGQIWQCSA-N 325.415 1.818 10 10 EDCE CC1(C)CN(C(=O)c2c(F)ccc(O)c2O)C[C@@]2(CCOC2)O1 295184904 QGEYEOMHCJQOEJ-MRXNPFEDSA-N 325.336 1.647 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CNC3C[C@@H]4C[C@H]4C3)CC2)cc1 819383865 SPXXOGASJBBUDU-TXPKVOOTSA-N 345.487 1.566 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cn([C@H]3CCCNC3)nn2)c1 818213603 IYOAZZLAKOCUMG-RYUDHWBXSA-N 345.403 1.408 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCN2C(C)(C)C)cc1 826705943 DCPYDQUPSQBNJJ-INIZCTEOSA-N 346.475 1.358 10 10 EDCE O=C(c1cc(O)nc(O)c1)N1CCN(c2ccc(C3CC3)nn2)CC1 585414401 TWEXYOFOAMZMOJ-UHFFFAOYSA-N 341.371 1.123 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)C[C@H](C)OC)CC2)cc1 749598248 HPEMPKMDLVDIKT-HNNXBMFYSA-N 335.448 1.358 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)Cc3cnc[nH]3)C2)cc1 855225156 OPOUXWFAFIFXTC-KBPBESRZSA-N 328.416 1.992 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(C)(C)n2cc(N)cn2)cc1 851642427 VOBQIJYGFGDELQ-UHFFFAOYSA-N 345.447 1.804 10 10 EDCE COC(=O)[C@@H]1CN(Cc2ccc(Br)cc2O)C[C@@H](C)O1 862487234 MQCDDCIKBCHBPM-RNCFNFMXSA-N 344.205 1.917 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2OCCO[C@@H]2C(F)(F)F)c1 866765760 ZEERYPARKQJWNJ-CKLFPEKLSA-N 349.305 1.924 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1C[C@@H](OC)C1 1118875548 NOVDMHGCVVPOKJ-WOVMCDHWSA-N 347.459 1.642 10 10 EDCE O=C(CO[C@H]1CCOC1)NCc1cc(Br)ccc1O 1341862546 DCCRIPJSNFCNOZ-NSHDSACASA-N 330.178 1.576 10 10 EDCE O=C1N(CCNCc2cc3c(cc2O)OCO3)C[C@H]2CCCCN12 895345123 XTBQLQASWQYQIG-CYBMUJFWSA-N 333.388 1.501 10 10 EDCE C[C@H](O)c1ccc(N2CCN(CC(N)=O)CC2)c(Br)c1 700786166 PARYBMDIROKXEK-JTQLQIEISA-N 342.237 1.110 10 10 EDCE CCc1noc(COCC(=O)N[C@@H](C)c2cc(OC)ccc2O)n1 1137473669 QXSBQAVZDAGOPS-JTQLQIEISA-N 335.360 1.740 10 10 EDCE NCc1ccc(N2CCC[C@@H](CO)[C@H]2CO)cc1Br 709811563 RUQBQDIJMDKGTK-SMDDNHRTSA-N 329.238 1.477 10 10 EDCE Cc1ccc(C(=O)NOC[C@@H](C)NC(=O)OC(C)(C)C)c(O)c1O 1151184140 DNPJCJHAVRWQQN-SNVBAGLBSA-N 340.376 1.981 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H]2CCCNC2=O)cc1C 1317400151 YNFPOJGPTUPORT-ZBFHGGJFSA-N 347.459 1.514 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3NC(=O)O[C@@H]3C2)cc1Br 2120402313 GHUOBSUOHQBVJB-VSYUYLJXSA-N 326.194 1.766 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC3(CC2)COCCO3)cc1 1175827927 FDYVBJKQPCHYLA-UHFFFAOYSA-N 332.360 1.871 10 10 EDCE C[C@@H](NC(=O)[C@H](O)[C@H](O)c1nc2ccccc2[nH]1)c1ccccc1O 1171722988 IMAHOMKRQWIFEH-HPEXNQPKSA-N 341.367 1.540 10 10 EDCE C[C@H](O)[C@@H]1CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2125807645 ACZYVXBPUKNSJK-IAOBUDJDSA-N 327.178 1.394 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C[C@@H]1F 1346326539 INRSVNWJLCHERM-MNOVXSKESA-N 345.465 1.948 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)C[C@@H]2CCNC2=O)cc1C 1270420649 VUEOVAVCWHIDCN-CJNGLKHVSA-N 347.459 1.372 10 10 EDCE CCCC(=O)N(C)C[C@@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1281238226 CJZQEVGDGOSYIW-ZDUSSCGKSA-N 349.391 1.198 10 10 EDCE COC(=O)c1ccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)cn1 1294283053 XJUWQLDLYYTWBQ-DAXSKMNVSA-N 328.324 1.609 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCN(c2ccccc2F)C1=O 1543268941 WBBZUZXTDVDPLT-ZDUSSCGKSA-N 344.342 1.701 10 10 EDCE COC(=O)N1CCC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1627714208 XVRLOIZDJOWLEE-GFCCVEGCSA-N 333.348 1.810 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2[nH]nnc2C)C(C)C)cc1C 1715726585 MPHSSIPEDMNXQG-OAHLLOKOSA-N 345.447 1.974 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@H]2CCC(=O)NC2)cc1C 1568877127 GPJYHFJLFGEZFU-QGZUEGPWSA-N 345.443 1.292 10 10 EDCE CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)O1 1637490017 DDALGSLNXLWIHR-STQMWFEESA-N 347.375 1.215 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@]3(CCS(=O)(=O)C3)C2)c(O)c1O 1569161824 GBKFLBAPJBMAFC-INIZCTEOSA-N 339.413 1.447 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2cc(S(N)(=O)=O)c(Cl)o2)c1 1640800892 XQXASVAOSAXVQD-UHFFFAOYSA-N 344.776 1.524 10 10 EDCE C[C@H](NC(=O)CCCn1cnc2c(N)ncnc21)c1ccccc1O 1648893875 FLISESXNMPVBDY-NSHDSACASA-N 340.387 1.772 10 10 EDCE O=C(Cc1c(O)ncnc1O)NCc1c(O)ccc2ccccc12 1652708833 OCAHPFYJVOBDGR-UHFFFAOYSA-N 325.324 1.606 10 10 EDCE Cn1cc(CCNC(=O)Cc2ccc(O)c(O)c2)c2cccnc21 1587567320 PJCQYSBFUOERIW-UHFFFAOYSA-N 325.368 1.886 10 10 EDCE CC(C)OCC(=O)NCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1745070780 TVXYERXIJMDKHG-UHFFFAOYSA-N 349.391 1.462 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@@H]2CCN(C)C2=O)cc1C 1669588128 SSAYTENBMGGQMN-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE COc1cc(/C=C2\SC(N3CCOCC3)=NC2=O)cc2c1OCO2 14110500 QDDUKFFMQIZZJH-JYRVWZFOSA-N 348.380 1.726 10 10 EDCE COc1cc(CN2C[C@@H](C(N)=O)O[C@H](C)C2)c(O)c(C(C)(C)C)c1 164499771 PKBVXSIRPCSUSU-ABAIWWIYSA-N 336.432 1.773 10 10 EDCE C[C@@H](Cn1cncn1)NC(=O)NCCCSc1nccs1 152998423 KBLVPKMZTMIXSO-JTQLQIEISA-N 326.451 1.605 10 10 EDCE O=C(CCn1cnnn1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874179852 SAYFJHIZLNYRLP-UHFFFAOYSA-N 347.334 1.477 10 10 EDCE CC[C@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)C(=O)OC 881853634 DAXMZWHIIPYOCV-MRXNPFEDSA-N 333.432 1.254 10 10 EDCE COc1ccc(Br)c(CNC[C@](C)(O)CN(C)C)c1O 1964060034 XAHFREWOEYOYDZ-AWEZNQCLSA-N 347.253 1.566 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CCO[C@H](C)C3)c(Br)cc21 252591731 DRVOPHZKNFHOSO-AMIZOPFISA-N 340.221 1.887 10 10 EDCE C[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)Cc1ccc(N)cc1 1977693724 WJUJAINXVWWPFK-NSHDSACASA-N 343.449 1.601 10 10 EDCE CO[C@H]1C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)C1 1985094586 QVPMXJACJWLEJY-WDEREUQCSA-N 325.369 1.532 10 10 EDCE C[C@@H]1COC[C@@H](C(=O)NCCCN=[N+]=[N-])N1C(=O)OC(C)(C)C 1985096876 XNABPGSWVIFAOF-MNOVXSKESA-N 327.385 1.827 10 10 EDCE CN[C@@H](c1cn(CCNC(=O)OC(C)(C)C)nn1)c1ccccc1O 2029559947 RHQDBJWUABKCMB-OAHLLOKOSA-N 347.419 1.817 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@@](O)(CO)C2)cc1Br 314018321 RFFUFCRZCIAQSU-HZMBPMFUSA-N 329.238 1.792 10 10 EDCE CO[C@@H]1CN(Cc2c(O)cccc2Br)C[C@@H]1C(=O)O 706627962 JWUZLUOBIWOXQR-JOYOIKCWSA-N 330.178 1.686 10 10 EDCE CN(C)C[C@@H](CO)NCc1cc(Cl)cc(Br)c1O 708056829 PYTURUDWVFLKSZ-JTQLQIEISA-N 337.645 1.820 10 10 EDCE CN1C(=O)N[C@@H]2CN(c3ccc(CN)cc3Br)CC[C@@H]21 2171304546 HKEXFDBRTTXMKP-YPMHNXCESA-N 339.237 1.510 10 10 EDCE CN[C@@H](C)c1ccc(N2CCC(CO)(CO)C2)cc1Br 694726408 GXJYZARJBCYXNV-NSHDSACASA-N 343.265 1.911 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCOC4(CCOCC4)CC3)c2n1 2064190549 BXVAHVRQWGLZNM-UHFFFAOYSA-N 346.387 1.155 10 10 EDCE COC(=O)c1cn(Cc2ccc(Br)cc2O)nc1O 2070614196 HHZOMSMVOPGYEC-UHFFFAOYSA-N 327.134 1.892 10 10 EDCE CN1CCN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)[C@@H]2C[C@@H]21 2168397035 VBPZWWVWZYXLED-XQQFMLRXSA-N 338.205 1.327 10 10 EDCE C[C@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1C(=O)Cc1ccc(N)cc1 2044623783 YGQSACNMJDIRDN-GWCFXTLKSA-N 343.349 1.869 10 10 EDCE Cc1nn(C)c(Br)c1CNC(=O)c1cccc(O)c1O 2185788354 PHWOSTGIVBFDRF-UHFFFAOYSA-N 340.177 1.832 10 10 EDCE COc1ccc(N(C)Cc2c(Br)nnn2C)c(N)c1 2100244077 OTXFPZOYXWQDMF-UHFFFAOYSA-N 326.198 1.805 10 10 EDCE COCC[S@@](=O)CCNCc1c(O)cccc1Br 2085948992 UINUFVJAHGLUAH-SFHVURJKSA-N 336.251 1.639 10 10 EDCE CN(C[C@@H]1CCS(=O)(=O)C1)c1ccc(CO)c(Br)c1 2092346823 SPCYNLCNAPELLW-JTQLQIEISA-N 348.262 1.812 10 10 EDCE CC1(C)C[C@@H](COc2nnc(=N)[nH]n2)CN(C(=O)OC(C)(C)C)C1 2213784662 DTUMHONNHCJAGF-SNVBAGLBSA-N 338.412 1.341 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)C[C@H](CO)C2)c(Br)c1 2236634447 VHZMQZACYHYJDQ-STQMWFEESA-N 343.265 1.596 10 10 EDCE Cc1cc(C=C2SC(=S)N([C@@H](CO)C(=O)O)C2=O)ccc1F 2323831667 PQRTXGFRVSABFV-JTQLQIEISA-N 341.385 1.781 10 10 EDCE CN1CCN(c2ccc(N=NN3CCC(C(N)=O)CC3)cc2)CC1 2330323016 MJIXSPMDNXVTDO-UHFFFAOYSA-N 330.436 1.634 10 10 EDCE Cc1ccc(CN(C)C[C@@H]2COCCN2)c(O)c1Br 2352676046 MBLVKMJEZHNRIY-GFCCVEGCSA-N 329.238 1.883 10 10 EDCE COc1ccc(N2CCCN(C[C@H](O)CN3CCCC3=O)CC2)cc1 111684638 WWWRUUJWYSWDOX-KRWDZBQOSA-N 347.459 1.191 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)cc1Br 2357056512 KNLOKVZNYDKAAK-AMPPCDIJSA-N 341.249 1.932 10 10 EDCE CN(C)c1ccc(/C=C\c2nc3ncnn3c(O)c2[N+](=O)[O-])cc1 34896880 NCXKHJQLVYHAJZ-YVMONPNESA-N 326.316 1.975 10 10 EDCE Cc1cc(N2CCC[C@H](NCc3cc(F)ccc3O)C2=O)n(C)n1 180810813 PIUCODKOZZXTMP-AWEZNQCLSA-N 332.379 1.858 10 10 EDCE CCNC(=O)N1CC[C@@H](NC(=O)NCc2ccc(N(C)C)cc2C)C1 132663827 ZEHABCZXCOXSRB-OAHLLOKOSA-N 347.463 1.664 10 10 EDCE CN(C)Cc1cc(I)c2c(c1O)CNC2=O 89211077 KUTZWVUKLUSTPS-UHFFFAOYSA-N 332.141 1.302 10 10 EDCE COc1ccc(Br)cc1[C@@H](NCCN=[N+]=[N-])C(N)=O 90257739 BBKLCKGFUMQXJC-SNVBAGLBSA-N 328.170 1.884 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C)C[C@H]2CCCO2)cc1 283901681 GILQONJFVGTWNI-QGZVFWFLSA-N 347.459 1.786 10 10 EDCE C[C@H]1[C@@H](C)O[C@H](C)CN1C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807677065 LAZXAPVNJIFTTE-APIJFGDWSA-N 347.459 1.954 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2C[C@H]3COC[C@@H](C2)O3)cc1 800998435 CVLKOIFWJXSUPN-CALCHBBNSA-N 333.432 1.842 10 10 EDCE COc1ccc(CNCCN2C(=O)c3ccccc3C2=O)c(O)c1 725849283 ZACKKOXILZKPTA-UHFFFAOYSA-N 326.352 1.787 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@]2(OC)CCS(=O)(=O)C2)c1 903364974 GCGXISXBEKBXQS-IAQYHMDHSA-N 329.418 1.255 10 10 EDCE CN1CCN(c2ccc(CN3C[C@H]4CC[C@H]3[C@@H]3CNC[C@@H]43)cc2)CC1 903962029 HKUICRHUHWLGMU-PMXSJFBMSA-N 340.515 1.868 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N(C)C)c(F)c1)c1nnc(O)n1C 915371384 AZYRYJGLXPVARA-SECBINFHSA-N 336.371 1.286 10 10 EDCE CCOC1(CS(=O)(=O)NCc2c(O)cccc2F)CCOCC1 921451628 SXKKSBAVLSAFRW-UHFFFAOYSA-N 347.408 1.536 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCC[C@H]2CS(N)(=O)=O)c1O 750044345 FUZCUUKGXIHXBT-LBPRGKRZSA-N 346.836 1.501 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@@H]2CC2(F)F)c1 857351024 XFFHWDLPKMTPCZ-MRVPVSSYSA-N 334.344 1.539 10 10 EDCE CC(C)OC[C@H](N)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 852868432 FJEOOMINQRAVOK-KRWDZBQOSA-N 335.448 1.016 10 10 EDCE CNC(=O)Cc1nc(COC(=O)/C=C/c2ccc(O)c(O)c2)cs1 759594904 OEKRRHYIJONRND-HWKANZROSA-N 348.380 1.599 10 10 EDCE CON(C)C(=O)[C@H](C)NC(=O)c1cc(C)n(-c2ccccn2)c1C 863625514 DPPMXBIZHMWTLS-LBPRGKRZSA-N 330.388 1.627 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@@H]2CNCC[C@@H]21 866717090 VNEGXBZWKSUDEN-MJGOQNOKSA-N 344.503 1.785 10 10 EDCE Cc1cc(C(=O)NC[C@H](O)[C@@H]2CCCO2)c(C)n1-c1ccccn1 862652370 XRFVCRALZZBOPM-HOTGVXAUSA-N 329.400 1.759 10 10 EDCE CN1CCN(c2ccc(CN3CCCC[C@@H]3CC(N)=O)cc2)CC1 775664596 NGOACFVFHAIKBT-GOSISDBHSA-N 330.476 1.668 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCCCc2ccccn2)cc1 785423940 IUBQZPFKEUSHOH-UHFFFAOYSA-N 340.427 1.513 10 10 EDCE C[C@H](NCc1ccc(N2CCC(O)CC2)cc1)c1nnc(O)n1C 895171950 NGERZEOSVSQGKY-LBPRGKRZSA-N 331.420 1.333 10 10 EDCE CN1CCN(CCCNC(=O)c2cc3cc(O)c(O)cc3s2)CC1 899991478 OIBCVMWJGZGZAC-UHFFFAOYSA-N 349.456 1.680 10 10 EDCE CNC(=O)[C@H]1CCN(Cc2c(C(=O)OC)n(C)c3ccc(F)cc23)C1 895034013 OKJIRVYMPJWFRL-NSHDSACASA-N 347.390 1.672 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccc(Br)nc1O 1303226308 ANZZHHLLSIWXSO-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE COC(=O)[C@H](CNC(=O)OC(C)(C)C)N(C)Cc1ccccc1O 1963398575 DFPOMIWZNRJGIA-ZDUSSCGKSA-N 338.404 1.890 10 10 EDCE C[C@@H](N)c1ccc(N2CC(=O)NC(=O)[C@H]2C)c(Br)c1 97292481 GCRCHOACHPBSNJ-HTQZYQBOSA-N 326.194 1.320 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H]2C[C@H]3C=C[C@H]2O3)cc1C 1266750010 YILFUYMUQDBCTB-SOLBZPMBSA-N 330.428 1.895 10 10 EDCE CN1CC[C@@H]2[C@@H](CCCN2C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1351857200 WZOWVGBQUSZLKW-GOEBONIOSA-N 343.427 1.177 10 10 EDCE COC(=O)Cc1occc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1611431703 QYUMNDYABYEHSW-SNVBAGLBSA-N 333.340 1.767 10 10 EDCE C[C@@H](NC(=O)CCCn1c(O)nnc1O)c1ccc(N(C)C)cc1 1616835135 RNRUILCLLIXKME-LLVKDONJSA-N 333.392 1.413 10 10 EDCE C[C@@H](O)c1ccc(N2CCC[C@H]2[C@H](O)CO)cc1Br 2123170510 IGICYNSRGZVRFS-BIGNPOOSSA-N 330.222 1.824 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1ccc(N2CCOCC2)cc1 1626698546 OKWJFYCYPLNDKA-UHFFFAOYSA-N 342.395 1.793 10 10 EDCE CS(=O)(=O)c1cccc(CNC(=O)c2c(F)ccc(O)c2O)c1 1558982358 XTWSKLQUMXSLOE-UHFFFAOYSA-N 339.344 1.570 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H](O)[C@@H]3C)c(Br)cc21 2126120033 QDDZFTNNQKFSCS-GHGOGRRBSA-N 326.194 1.231 10 10 EDCE C[C@@H]1C[C@@H]1C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1686871233 RIRAFZVKBWRANF-MFKMUULPSA-N 331.376 1.741 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CCC[C@H]3CO)c(Br)cc21 252599877 LDIMATJXFROJKP-ISVAXAHUSA-N 340.221 1.623 10 10 EDCE [N-]=[N+]=N[C@@H]1CCCN(C[C@@H](O)CN2C(=O)c3ccccc3C2=O)CC1 1934380324 DYRHRXJMUUOLEE-CHWSQXEVSA-N 343.387 1.808 10 10 EDCE CNCc1ccc(N2CC[C@@](C)(C(N)=O)C2)cc1Br 234373994 BMKZWDBFTUXJMZ-CQSZACIVSA-N 326.238 1.870 10 10 EDCE CN(C)CCN(CC(=O)N(C)CCN=[N+]=[N-])C(=O)OC(C)(C)C 1985094451 PANDNGREOKWCBP-UHFFFAOYSA-N 328.417 1.554 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](CO)[C@@H](CCO)C2)cc1Br 2149908167 QMAGTSUZZBIECF-GRYCIOLGSA-N 344.249 1.930 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](CO)[C@@H](CCO)C2)c(Br)c1 2149906867 BBIRGAGUJPWNIS-WCFLWFBJSA-N 344.249 1.930 10 10 EDCE CN[C@@H](C)c1ccc(N2CCOC[C@@H]2CO)c(Br)c1 168243042 OYNPLXMVGQTMMC-JQWIXIFHSA-N 329.238 1.927 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010393784 XPECKAKEIPGZAM-NEPJUHHUSA-N 341.412 1.954 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2010402024 LDZJFTIFNZTNMC-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE COc1ccc(N(C)[C@H](CN)c2c(Br)nnn2C)cc1 312393755 OKHYGYYJVVGKKA-LLVKDONJSA-N 340.225 1.722 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](CO)[C@@H](O)C2)c(Br)c1 316967136 IBWGPYTUBYPNNF-PUYPPJJSSA-N 329.238 1.519 10 10 EDCE O=C(O)C[C@]1(O)CCCN(Cc2cc(Br)ccc2O)C1 2160855056 WZYFFMNHSHSBPX-CQSZACIVSA-N 344.205 1.956 10 10 EDCE C[C@]1(CO)CN(c2ccc(CO)c(Br)c2)C[C@]1(C)CO 704268201 LZQLRYYZADBHOA-HUUCEWRRSA-N 344.249 1.759 10 10 EDCE CN(C)c1ccc([C@@H](O)C(=O)c2nc(Br)nn2C)cc1 2173163297 KDQZIYVLDAYTBI-SNVBAGLBSA-N 339.193 1.560 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N1CC[C@@]2(CNC(=O)N2)C1 2177680596 OHAXWWYNHRJNEE-YMTOWFKASA-N 340.221 1.973 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@H](O)[C@H](CO)C2)c(Br)c1 396790439 AEXZNCVNIGAEGZ-GMXABZIVSA-N 343.265 1.909 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCc3nn(C)cc3C(F)F)c2n1 2063795414 KNWLRACNRAXEAN-UHFFFAOYSA-N 336.302 1.344 10 10 EDCE CN1CCc2cc(CC(=O)NCc3c(O)cc(O)cc3O)ccc21 2064453175 UPGMRDUDEYXPCD-UHFFFAOYSA-N 328.368 1.655 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC4(CC[C@H]4O)C3)c(Br)cc21 2179703366 KZJXGIVXKOALCE-NEPJUHHUSA-N 338.205 1.362 10 10 EDCE O=C1Nc2cc(N3CC=CC[C@H]3CO)c(Br)cc2[C@@H]1O 2176377907 MUXSZXVCXFGNGZ-SDBXPKJASA-N 339.189 1.562 10 10 EDCE CN(C)C[C@@H]1COCCN1c1ccc(CO)cc1Br 2096926025 ONPMOXFIPLQBMC-GFCCVEGCSA-N 329.238 1.708 10 10 EDCE COCCN1CCN(c2ccc(CN)cc2Br)CC1 2098503594 FSQOJDRHLGDSJT-UHFFFAOYSA-N 328.254 1.676 10 10 EDCE Cn1nnc(Br)c1C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2099335660 BHFGOCPZMVXUPP-SSDOTTSWSA-N 328.174 1.883 10 10 EDCE CN(c1ccc(CN)c(Br)c1)[C@H]1COC2(COC2)C1 2270767306 HAIOKSGBWDEORM-GFCCVEGCSA-N 327.222 1.902 10 10 EDCE COc1cc(C=C2C(=O)NN(c3ccccc3)C2=O)cc(OC)c1O 2294732758 LWYOGMGPRDGGMT-UHFFFAOYSA-N 340.335 1.871 10 10 EDCE CCCCN(CC(N)=O)c1ccc(C=CC(=O)OC)cc1[N+](=O)[O-] 2302204728 XODPOZJEAFVIHK-UHFFFAOYSA-N 335.360 1.873 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCC[S@@](C)=O)CC2)cc1 172072511 ZCVFCHKDGBGFOJ-HSZRJFAPSA-N 339.461 1.295 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Nc3ccc[n+]([O-])c3)C2)cc1 1345920872 LQXGXBYLRSHEOK-AWEZNQCLSA-N 328.372 1.729 10 10 EDCE COc1ccc(N2CCN(C=O)CC2)cc1NC(=O)c1ccco1 62192126 MJXOIMYTOXDMLO-UHFFFAOYSA-N 329.356 1.819 10 10 EDCE CN(C)c1ccc(/C=C\c2c([N+](=O)[O-])c(=O)n(C)c(=O)n2C)cc1 33248320 FMSNSFZRTNIQNG-YFHOEESVSA-N 330.344 1.229 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCO[C@@H](Cn2cccn2)C1 181069051 CYBDKBMFFGAZOD-LYKUJDHUSA-N 329.356 1.235 10 10 EDCE Cc1ccc(CN(C)CCC(=O)NC(N)=O)c(O)c1Br 2380769534 TZLUWWVXKKZHAV-UHFFFAOYSA-N 344.209 1.480 10 10 EDCE Cn1nc(C(=O)NCc2cc(Br)ccc2O)ccc1=O 804734978 GJCFECQHJAXDKD-UHFFFAOYSA-N 338.161 1.178 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@@H](C(=O)OC)C2)c([N+](=O)[O-])c1 298695067 CYBFNYPQTKOTRK-FVOPLDGLSA-N 334.328 1.780 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCc2nc[nH]c2C1 823296666 ZJSWPQXZYCKZQG-OAHLLOKOSA-N 340.427 1.668 10 10 EDCE CN(C)c1ccc(/C=C\CN(C)[C@H]2CCN(S(C)(=O)=O)C2)cc1 835055483 KSLDFSWOSYWELQ-OSJSJHBBSA-N 337.489 1.732 10 10 EDCE CSC[C@H](NC(=O)NCc1ccc(N2CCCC2)cc1)C(=O)O 908847116 IOAQWQZERKIJBC-AWEZNQCLSA-N 337.445 1.902 10 10 EDCE CSCCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917833920 VRNQRTDLECHZPV-AWEZNQCLSA-N 335.473 1.758 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@@]2(C)C[C@H](O)CN2C)cc1 911890932 DMQZKURDIPMSFY-MAUKXSAKSA-N 335.448 1.045 10 10 EDCE CCc1cccc(CN2CCCN(S(=O)(=O)N(C)C)CC2)c1O 848913116 OSBZRHBZEQNKQI-UHFFFAOYSA-N 341.477 1.269 10 10 EDCE Cn1nccc1[C@@H](O)CNC(=O)NCc1ccc(N2CCCC2)cc1 914180630 SSTQRVUHNRQRKZ-KRWDZBQOSA-N 343.431 1.553 10 10 EDCE O=C(Cn1c(O)nc2ccccc2c1=O)NCc1ccccc1O 748345220 ABJUXEJDSFRHRJ-UHFFFAOYSA-N 325.324 1.124 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCCN1C[C@H]2CCCCN2C1=O 856143564 NJCHERFOQTZASO-HZRUHFOJSA-N 345.399 1.517 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCNC[C@H]3C)C2)cc1 851664418 ZDUGFKHKDYZZLJ-KEYYUXOJSA-N 332.448 1.571 10 10 EDCE CN1CCC[C@H]1CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 925288673 MQEXFUNGORAWIB-ZDUSSCGKSA-N 337.807 1.904 10 10 EDCE CN1CCCc2cc(CN3C(=O)N[C@@H](CC4OCCO4)C3=O)ccc21 924543736 SRRFWVJIVYHRQN-AWEZNQCLSA-N 345.399 1.252 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@]3(C)CCOC3)C2)cc1 852108375 CUFDBTHFYCEQNM-RDTXWAMCSA-N 333.432 2.000 10 10 EDCE COC(=O)[C@@H]1CN(Cc2cc(F)cc(C(C)=O)c2O)C[C@@H](C)O1 859650134 VNWWQPSTVGFELX-OTYXRUKQSA-N 325.336 1.496 10 10 EDCE COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)N1Cc2cccc(O)c2C1 867691297 VEXFJWJWAXBHCK-DOMZBBRYSA-N 339.413 1.769 10 10 EDCE CNC(=O)NC[C@H]1CN(C/C=C/c2ccc(N(C)C)cc2)CCO1 862459106 MMXOMDJUWJNRHM-BDUNBXCCSA-N 332.448 1.396 10 10 EDCE C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)CC(F)F 1118206921 CPXCCXOOZRPBOZ-LLVKDONJSA-N 327.375 1.776 10 10 EDCE O=C(Cn1ncc2ccccc21)OCC(=O)c1ccc(O)c(O)c1 783551059 KQZRAFLGHOCKCB-UHFFFAOYSA-N 326.308 1.874 10 10 EDCE COC(=O)c1cncnc1NCc1ccc(N2CCOCC2)c(F)c1 786576529 UBHLYSNVQJFOCO-UHFFFAOYSA-N 346.362 1.851 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CC(F)(F)C[C@H]1CO 780468443 LVSKUTPJHDONHS-AWEZNQCLSA-N 327.375 1.973 10 10 EDCE Cn1ncc(C(=O)NCc2cccc(O)c2O)c1Br 1153797923 ILXLODDXAXNOPI-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE CO[C@H]1C[C@H](C(=O)O)N(Cc2cc(Br)ccc2O)C1 1964720598 MAFANAUHVXQNHX-WDEREUQCSA-N 330.178 1.829 10 10 EDCE CO[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 1325972304 UTEJHBMVEWSMRB-JKSUJKDBSA-N 345.443 1.369 10 10 EDCE Cn1cc(N2CC[C@@H](NC(=O)NCc3c(O)cccc3F)C2)cn1 1334309912 TVWZZQVWQCNZMU-LLVKDONJSA-N 333.367 1.343 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CN1CCOCC1=O 1264287044 IIXQPOMXKJDMFF-UHFFFAOYSA-N 331.416 1.104 10 10 EDCE CC[C@@H](C)C(=O)N[C@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1268638196 IPCFYFXJNMQGTO-CHWSQXEVSA-N 346.435 1.311 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3COCCO3)CC2)cc1C 1269380325 YXMYRSVPLQXPTR-INIZCTEOSA-N 334.416 1.157 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC([C@@H]2CCOC2)CC1 1348640048 RMBNVUKWERCMDX-OAHLLOKOSA-N 344.411 1.510 10 10 EDCE Cc1cc(C)n(CC(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(=O)n1 1467260873 VPUAWBBMRUGFRF-CQSZACIVSA-N 328.416 1.804 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CC[C@H]1C(=O)OC 1469230127 GGVJCJBZZSUSOV-UONOGXRCSA-N 349.383 1.483 10 10 EDCE COc1ccc(CNCCC[C@H](C)NC(=O)[C@H]2CCNC2=O)cc1C 1485732742 NVFVSJJUVNERHC-HOCLYGCPSA-N 347.459 1.514 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2cnn(C)n2)C(C)C)cc1C 1715676863 NDMKHKXQIASHSS-HNNXBMFYSA-N 345.447 1.676 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCc1nc(C(F)(F)F)no1 1556152240 IYGYKLRMGAREMD-DUXPYHPUSA-N 329.234 1.829 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1nc(-c2ccccn2)n[nH]1 1624139727 LYTULVLUWKCTIB-UHFFFAOYSA-N 325.328 1.137 10 10 EDCE COCc1nn(C)cc1C(=O)NCc1ccc(N2CCOCC2)cc1 1626692680 AERFITNBXMISSZ-UHFFFAOYSA-N 344.415 1.333 10 10 EDCE C[C@@H](NCCO)[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1496459481 IYIXFJZPCYTQOV-OCCSQVGLSA-N 347.419 1.672 10 10 EDCE CC[C@H](CNC(=O)[C@H]1CCC(=O)N1C)NCc1ccc(OC)c(C)c1 1567973123 ABDJLEOYCMFDSS-HZPDHXFCSA-N 347.459 1.609 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H]2C[C@H]2C(N)=O)cc1C 1567230356 GFTZIOSCVDWYMR-YUELXQCFSA-N 333.432 1.109 10 10 EDCE O=C(Cn1cccc(C(F)(F)F)c1=O)NCc1c(O)cccc1O 1635842952 BYGCQDXMSVHEQD-UHFFFAOYSA-N 342.273 1.595 10 10 EDCE O=C(CN1CCC(CO)CC1)NCc1c(O)ccc2ccccc12 1647795097 WLCREPFNKZKLSV-UHFFFAOYSA-N 328.412 1.866 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccc(N2CCOC2=O)cc1 1643101259 ZVRRNWORRMHGKG-UHFFFAOYSA-N 328.324 1.984 10 10 EDCE Cc1ccc2c(c1)C(=O)N(CC(=O)NCc1c(O)cccc1F)C2=O 1646028181 BEKRGJOAFIWLJQ-UHFFFAOYSA-N 342.326 1.752 10 10 EDCE C[C@H](F)CCNC[C@@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1732667103 OIRZHNPXWDGHKB-GXFFZTMASA-N 339.371 1.277 10 10 EDCE CNC(=O)C1(C(=O)N[C@H](C)[C@@H](C)NCc2ccc(OC)c(C)c2)CC1 1733994526 SQASBICMZILUDZ-ZIAGYGMSSA-N 347.459 1.513 10 10 EDCE CC1(CNCc2c(O)cccc2Br)CS(=O)(=O)C1 1967852726 RBCUHABLLPIQBT-UHFFFAOYSA-N 334.235 1.679 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NCc1ccc(O)c(O)c1O 1944916647 BFBYDCGIPQZFPT-QWRGUYRKSA-N 340.376 1.185 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985100088 CWEGMUIPQJBVIW-VHSXEESVSA-N 327.385 1.467 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)C(C)(F)F 1986643698 ZWBUOMQJMGJXDA-AUTRQRHGSA-N 334.363 1.801 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1987701649 IXUWBNDQHQLBBH-QWRGUYRKSA-N 327.385 1.278 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)cc1Br 2146307294 YSCRJTQUVFJYTP-ONERCXAPSA-N 341.249 1.650 10 10 EDCE Nc1cc(O)ccc1NS(=O)(=O)N1CC(OCc2ccccc2)C1 1998737300 ARVOILDAHQPYCK-UHFFFAOYSA-N 349.412 1.532 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010390711 HLOVJUJLZUWJOB-SRVKXCTJSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCC1(CN=[N+]=[N-])CC1)C1COC1 2010402491 RCVDOXYHHVNNRO-NSHDSACASA-N 339.396 1.733 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(CO)CNC(=O)c1cccc(O)c1O 2010537172 NWXMDFNFBNXNKK-INIZCTEOSA-N 340.376 1.103 10 10 EDCE CN1CCCc2cc(C=CC(=O)NCCN3CCOCC3)ccc21 2041449196 WLFIUGKMEGEAGC-UHFFFAOYSA-N 329.444 1.531 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@@](O)(CO)C2)c(Br)c1 313787830 DFIGGDWIBBJOHU-YGRLFVJLSA-N 329.238 1.792 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCO[C@H](CF)C3)c(Br)cc21 2172041860 QHPSEPCUGITYQE-KRTXAFLBSA-N 344.184 1.576 10 10 EDCE O=C(NCCCn1cc(Br)cn1)c1ccc(O)c(O)c1 379985279 KPZDRVILGFZKBK-UHFFFAOYSA-N 340.177 1.877 10 10 EDCE CCn1cc(Br)c(CNC(=O)c2cc(O)nc(O)c2)n1 2181202233 YRQPAZCRYHLORM-UHFFFAOYSA-N 341.165 1.402 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3[C@H]4COC[C@H]3C4)c(Br)cc21 2198577391 HNVMEOUGFFKMHN-RBDZCENOSA-N 338.205 1.639 10 10 EDCE N[C@H]1CC(C(=O)N2CCCc3c(Br)cccc32)=C[C@H]1O 2188021631 NWPFOMKYUMAKBF-GXTWGEPZSA-N 337.217 1.747 10 10 EDCE Cc1c(C(=O)NCc2cc(N)ccc2O)c(Br)nn1C 2188154949 XUHCQUVNCMNRCG-UHFFFAOYSA-N 339.193 1.709 10 10 EDCE N[C@@H]1CN(Cc2cc(Br)cc(F)c2O)[C@@H]2COC[C@H]12 2102138794 XLHVQBSMTDMYCC-YUSALJHKSA-N 331.185 1.452 10 10 EDCE CS(=O)(=O)C[C@@H]1CCCN1c1ccc(CN)c(Br)c1 2094926766 KBEYFHOJFZGAII-LBPRGKRZSA-N 347.278 1.921 10 10 EDCE O=C(O)[C@@]1(CO)CCCN1Cc1cc(Br)cc(F)c1O 2201057418 VBBYKGIAYCBBEH-ZDUSSCGKSA-N 348.168 1.705 10 10 EDCE Oc1cc(Br)ccc1CNC1CN([C@@H]2CCOC2)C1 2113051218 ALTZMOXIYDBVGF-CYBMUJFWSA-N 327.222 1.717 10 10 EDCE COc1ccc(Br)c(CN(C)[C@@H](C)CC(N)=O)c1O 2227778007 JFNUEAIRNPNNEZ-QMMMGPOBSA-N 331.210 1.859 10 10 EDCE CSc1ncc(CNS(=O)(=O)N2CCCC[C@@H]2CN)s1 2284693075 WZYNQFALJLQMQO-SECBINFHSA-N 336.508 1.013 10 10 EDCE O=C(O)[C@]12CCO[C@@H]1CN(Cc1cc(Br)ccc1O)C2 2296424092 YFGUWSYGIOTNBM-OCCSQVGLSA-N 342.189 1.830 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCO[C@H](Cn2cccn2)C1 2308001135 CYBDKBMFFGAZOD-AWEZNQCLSA-N 329.356 1.235 10 10 EDCE Cc1ccc(CNC[C@@](C)(O)CN(C)C)c(O)c1Br 2352951548 HUMVDJRQVWIMSJ-CQSZACIVSA-N 331.254 1.865 10 10 EDCE C[C@@H]1CN(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)[C@H](C)CO1 173078837 UZAOPGSWWAYMOB-VXGBXAGGSA-N 345.440 1.335 10 10 EDCE Cc1ccc(C(=O)NCCN2CCc3ccccc3C2=O)c(O)c1O 191302768 RVPYIAQTKCVTKS-UHFFFAOYSA-N 340.379 1.835 10 10 EDCE CS(=O)(=O)[C@@H]1CSCCN1c1ccc(/C=C/C(=O)O)cc1 90923223 GNMKLGHONFCHHP-WXJAXGNASA-N 327.427 1.708 10 10 EDCE CCOc1cccc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)c1O 289379162 MICYWNVUIKXZDE-CQSZACIVSA-N 342.461 1.647 10 10 EDCE Oc1n[nH]c(C2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)n1 813331325 JDAKRFPPZLMOGX-UHFFFAOYSA-N 343.431 1.727 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](O)C1CCC1 828519024 AZIPEOVHDPBMCE-OAHLLOKOSA-N 341.791 1.708 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)c2ccn3nccc3n2)cc1 911891982 HRXUYQRRFWUNCC-UHFFFAOYSA-N 339.399 1.946 10 10 EDCE COc1cc(Br)cc(CN2CCn3nncc3C2)c1O 848921812 GZXSPYODMMYWPW-UHFFFAOYSA-N 339.193 1.771 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCNC[C@@H]1C 842265703 LZVQWNHGMMOHTI-YOEHRIQHSA-N 346.475 1.215 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@@H]2CC[C@@H]3C[C@H]23)c1 927481272 CATSQPGRWAIRJG-DMDPSCGWSA-N 338.429 1.930 10 10 EDCE O=C(NCCCSc1nccs1)c1c[nH]nc1[C@H]1CCNC1 852805792 MMPIZTZTZQVPEP-JTQLQIEISA-N 337.474 1.855 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3[C@H]4CC[C@H]3CC(O)C4)C2)cc1 854300781 AEMFDGDPJWTHCN-BPUTZDHNSA-N 345.443 1.971 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@H]3C[C@H](C(N)=O)C3)CC2)cc1 858772646 KSVJIQGYWQYMNZ-MQMHXKEQSA-N 346.431 1.227 10 10 EDCE C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H](C)C1=O 855580570 VFWSXJPSXRFDPK-NXEZZACHSA-N 340.401 1.061 10 10 EDCE C[C@H](N)[C@@H](O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952207702 FFDLYCBGXJYHGW-NURSFMCSSA-N 326.393 1.242 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nccn3C)CC2)c(OC)c1 866127896 OQJNMFJCBDDFGL-UHFFFAOYSA-N 330.388 1.400 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccsc2)cc1 1116996113 CHFGETOPNKNTQG-UHFFFAOYSA-N 331.441 1.789 10 10 EDCE COC(=O)CCNC(=O)CCNCc1ccc(N2CCCC2)cc1 1118805719 HBERKRKZIWHYNC-UHFFFAOYSA-N 333.432 1.446 10 10 EDCE Nc1ccc(Cn2c(=O)c(Cc3ccccc3)nn3cnnc23)cc1 82719392 BJNPHQJHTGLUEH-UHFFFAOYSA-N 332.367 1.507 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)c2c(Cl)cnn2C)cc1 797441595 OJJHUQWMVIPXTF-UHFFFAOYSA-N 328.825 1.618 10 10 EDCE NS(=O)(=O)c1cc(C(=O)NCc2cc(Cl)ccc2O)co1 1146231621 FGNIFFJZGBWRSN-UHFFFAOYSA-N 330.749 1.216 10 10 EDCE C[C@H](NC(=O)c1cccc(O)c1O)[C@@H](C)C(=O)Nc1ncccc1O 1306836931 FYBOEVMJGQAUPH-ZJUUUORDSA-N 345.355 1.592 10 10 EDCE CCN[C@@]1(CO)CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1327606215 BRXKZXTVOQEOHK-INIZCTEOSA-N 333.392 1.426 10 10 EDCE COC(=O)COCCNC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1253941259 XJQSRCINRWUZDU-UHFFFAOYSA-N 349.431 1.618 10 10 EDCE Cc1ncc(CN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)s1 1330396775 PICXLYWRPCJOGW-UHFFFAOYSA-N 331.397 1.658 10 10 EDCE COc1ccc(CNCC2CC(NC(=O)C(C)(C)C(N)=O)C2)cc1C 1505503396 FQKKXDOELKPCDO-UHFFFAOYSA-N 347.459 1.500 10 10 EDCE COc1ccc(CNC(=O)NCc2nc(C(F)(F)F)no2)c(O)c1 1479204886 ORWFLWHVVZWDDI-UHFFFAOYSA-N 346.265 1.802 10 10 EDCE COCC(=O)Nc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1540330786 WIXFTQGDNYOCBV-UHFFFAOYSA-N 330.340 1.864 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)Cc2nnc(C)o2)cc1C 1480762120 UWGPWLROKLQBAF-CYBMUJFWSA-N 346.431 1.922 10 10 EDCE COCCCNC[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1714877164 JZNJXENMOACDHD-LBPRGKRZSA-N 335.408 1.936 10 10 EDCE CNC(=O)C1(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)CC1 1731622426 IIQFRBWAIWVZHT-ZDUSSCGKSA-N 333.432 1.124 10 10 EDCE C[C@@H]([C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1)N1CCOCC1 1585549835 ISBYXJSFFJOYJC-NEPJUHHUSA-N 333.392 1.688 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H](C)SC)cc1C 1676504756 CJSTULLVMGLIRM-TZMCWYRMSA-N 326.462 1.322 10 10 EDCE CC[C@@H](Nc1cnn(CC(=O)NCCOC)c1)c1ccccc1O 157870323 RMJMFWXNGOMMCI-OAHLLOKOSA-N 332.404 1.915 10 10 EDCE COc1ccc(CN[C@@H]2COC[C@@H]2NC(=O)OC(C)(C)C)c(O)c1 1944917135 IGMOLTXQJSASFP-KGLIPLIRSA-N 338.404 1.783 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 1985095600 GTEZEXSVHMAPPO-JTQLQIEISA-N 325.369 1.270 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@@H]2OCCN(C(=O)OC(C)(C)C)[C@@H]21 1985093788 FNBHSSKZICRSEZ-AXFHLTTASA-N 325.369 1.389 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010392659 IDGYWYZDTWLQLK-IJLUTSLNSA-N 339.396 1.658 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010393340 QYZNBINZIDTOOR-NWDGAFQWSA-N 341.412 1.811 10 10 EDCE NCCCN(Cc1ccccc1)c1cc2c(cc1N)OCC(=O)N2 2016940800 SSNWDCKJZSXTDS-UHFFFAOYSA-N 326.400 1.955 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCOc2ccc(N)cc2)C(=O)C1 2021568939 CAQVQCYWNHCLCN-UHFFFAOYSA-N 335.404 1.727 10 10 EDCE CNCc1ccc(N2CCN3C[C@H](O)C[C@@H]3C2)cc1Br 405201078 CRVYXVMAMSVZFO-ZIAGYGMSSA-N 340.265 1.424 10 10 EDCE CN[C@H](C)c1ccc(N(C)[C@@H]2CC(=O)NC2=O)cc1Br 2171205695 RBJFRFZANQUNIB-PRHODGIISA-N 340.221 1.581 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC(O)(C4CC4)C3)c(Br)cc21 384067616 SFMWEYNCPCZYDK-GFCCVEGCSA-N 338.205 1.362 10 10 EDCE COc1cccc(Cn2cc(I)c(O)n2)c1O 2070640458 OGOPIWBYCOPLRV-UHFFFAOYSA-N 346.124 1.956 10 10 EDCE NCc1cc(F)c(N2CC[C@@]3(CNC(=O)N3)C2)cc1Br 2177695887 LHNWNFFGTDLLAY-CYBMUJFWSA-N 343.200 1.309 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@@H]3COC[C@@H]32)cc1Br 2102176380 BUMZANOQOZZGSP-KNEYZDPSSA-N 328.206 1.698 10 10 EDCE CCCN1CCN(c2ccc(CO)c(Br)c2)CC1=O 2102565518 NBEWNHIHAFBGOO-UHFFFAOYSA-N 327.222 2.000 10 10 EDCE CC1(C)[C@H](CO)OCCN1c1ccc(CN)c(Br)c1 2103380683 BMJYNCAUSRUSEC-ZDUSSCGKSA-N 329.238 1.884 10 10 EDCE NCCCN1CCN(Cc2c(O)cccc2Br)CC1 2226069339 REFNFTSYRNWISJ-UHFFFAOYSA-N 328.254 1.621 10 10 EDCE O=C1NC(=O)N(c2ccccc2F)C(=O)C1=CNN1CCCCC1 2296132726 GOOCFIWLGILKEU-UHFFFAOYSA-N 332.335 1.283 10 10 EDCE COC[C@@H]1[C@@H](O)[C@H](O)CN1c1ccc(OCc2ccccc2)cc1 2299508022 NYTPZIUDDRJSGL-GUDVDZBRSA-N 329.396 1.822 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N1CCC[C@H]1CN=[N+]=[N-] 2303215612 WTEMGNRMWBHPLZ-LBPRGKRZSA-N 341.412 1.907 10 10 EDCE O=C(O)CCN(CCCO)Cc1cc(Br)ccc1O 2342688230 QYUGIMPEFCDTLJ-UHFFFAOYSA-N 332.194 1.814 10 10 EDCE Cc1ccc(CN(C)[C@@H]2C[C@@H](N)C[C@@H]2O)c(O)c1Br 2352643243 MTTCPLZGMZWQCZ-UTUOFQBUSA-N 329.238 1.746 10 10 EDCE Cc1ccc(CN2CCN[C@@H](CCO)C2)c(O)c1Br 2352683612 JJSCUBVZPGYFIW-LBPRGKRZSA-N 329.238 1.619 10 10 EDCE COc1ccc(N2CCN(C=O)CC2)cc1NC(=O)[C@@H](C)C1CC1 62275235 HJHHTACFOXSUCB-ZDUSSCGKSA-N 331.416 1.958 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CN2CCC(CN3CCOCC3)CC2)c1 170917249 MADFOVTZEFWLMJ-UHFFFAOYSA-N 335.404 1.845 10 10 EDCE CC(C)(C)OC(=O)NCCNC(=O)Nc1cc(O)c(O)c(O)c1 217279015 QQSVMBJLGVBFGL-UHFFFAOYSA-N 327.337 1.450 10 10 EDCE COc1ccc(N2CCN(C)CC2)cc1NC(=O)[C@@H]1CSCN1 74586710 PYBWOXGPZZVJGY-AWEZNQCLSA-N 336.461 1.048 10 10 EDCE O=CN1CCC(OC(=O)/C=C/c2ccc(N3CCOCC3)cc2)CC1 181915572 JHWKDHJCAMJLQB-ZZXKWVIFSA-N 344.411 1.700 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N1CCN(C2CC2)CC1 255871106 PNJKSKPCZNWBLT-BAQGIRSFSA-N 341.455 1.843 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@@H](CO)c2cccnc2)c1O 809778742 VMPCBCTUCGSTHB-ZDUSSCGKSA-N 333.344 1.570 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1 808547239 KHSQOLPPOMLBQT-CQSZACIVSA-N 333.340 1.489 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@H]1CCn2ncnc2C1 2165205656 ZKTPOSCGBZXHQX-JTQLQIEISA-N 341.184 1.990 10 10 EDCE COc1ccc(-c2cnc(CCC(=O)OCC(=O)C(C)=O)o2)cc1 808510555 YGHBHJGRIPQZMG-UHFFFAOYSA-N 331.324 1.984 10 10 EDCE CC1(C)OC[C@H]2C[C@]21C(=O)NCc1ccc(N2CCOCC2)cc1 823291272 DWPWRNJGBVDEDM-DNVCBOLYSA-N 330.428 1.955 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CCNC(=O)CC3)C2)cc1 824694414 QHBYESDEXNPKGP-CQSZACIVSA-N 346.431 1.053 10 10 EDCE CC[C@H](NC[C@@]1(OC)CCS(=O)(=O)C1)c1ccc(C)cc1O 903363391 NTMPYPYDCUGYJV-HOCLYGCPSA-N 327.446 1.945 10 10 EDCE Cc1cc(CC(=O)N(C)[C@H]2CCNC2=O)c(C)n1-c1ccccc1 831345752 BFUDRSGSRBRZKB-KRWDZBQOSA-N 325.412 1.984 10 10 EDCE CN1CCN(c2ccc(CN3C[C@H]4CC[C@H]3[C@H]3CNC[C@H]43)cc2)CC1 903962028 HKUICRHUHWLGMU-PBASOCQRSA-N 340.515 1.868 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C)C3CCOCC3)CC2)cc1 746667307 HLYDIWVXWBQKIB-UHFFFAOYSA-N 347.459 1.455 10 10 EDCE COc1ccc(N2CCCN(C(=O)c3cc(C(=O)O)on3)CC2)cc1 911246303 CUFFCEUTLXNEPZ-UHFFFAOYSA-N 345.355 1.734 10 10 EDCE C[C@@]1(F)CNCCN(C(=O)NCCCSc2nccs2)C1 841856358 IYCGULFQJNJDEK-CYBMUJFWSA-N 332.470 1.968 10 10 EDCE C[C@@H]1CCCN(S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)C1 842783913 FJXYQZQWSHPHMK-CZUORRHYSA-N 340.493 1.319 10 10 EDCE O=C1NCc2cccc(NS(=O)(=O)c3cc(F)cc(F)c3O)c21 753018216 KVZILPITYNLOOJ-UHFFFAOYSA-N 340.307 1.715 10 10 EDCE CC(C)O[C@@]1(CN2C(=O)CN(Cc3ccccc3O)C2=O)CCOC1 925201140 AYPLHBRKDAOTBL-GOSISDBHSA-N 348.399 1.741 10 10 EDCE CCON(CC)C(=O)CNC(=O)NCc1ccc(N(C)C)c(F)c1 858712851 TWXMFCRMHJAKAT-UHFFFAOYSA-N 340.399 1.491 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H]3COC(C)(C)O3)C2)cc1 853977780 RRFWZYIHXFFJSH-CZUORRHYSA-N 349.431 1.725 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1c(C)cnn1C 850423120 NYNRDRNGPMRJOX-UHFFFAOYSA-N 330.388 1.811 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CO)C3CCC3)C2)cc1 852447834 FHIVPNPASCZLDR-WMLDXEAASA-N 333.432 1.734 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@](C)(O)CO 861485335 KAGNWXLEGJGQHE-SFHVURJKSA-N 330.384 1.380 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cn4c(n3)COCC4)C2)cc1 862159966 ZQXMTUYTKGCCQA-CYBMUJFWSA-N 342.399 1.431 10 10 EDCE CCCCn1nnnc1COc1ccc(N(C)C)c(C(=O)OC)c1 865396130 LGICOYTVDORZTG-UHFFFAOYSA-N 333.392 1.905 10 10 EDCE Cc1nc2ncnn2c(C)c1CCC(=O)N1Cc2cccc(O)c2C1 871200102 ZAMTWRSICJKEHK-UHFFFAOYSA-N 337.383 1.922 10 10 EDCE NC(=O)N[C@H]1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 770379105 IQHBLEHUACNZLG-AWEZNQCLSA-N 347.419 1.828 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)N2CC[C@@]3(O)C[C@H]3C2)N(C)C)cc1 899097682 DZQSQVXNZTYILF-VDZJLULYSA-N 346.475 1.522 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C2CN([C@H]3CCOC3)C2)cc1 898275483 UQTZAULGQLOPKJ-KRWDZBQOSA-N 347.459 1.311 10 10 EDCE COc1cc(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3)ccc1O 797820461 YQTOCAVPZAJKJW-UHFFFAOYSA-N 334.353 1.696 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccnc(O[C@H]2CCOC2)c1 1304053854 UHRYLHDKHYHKIP-LBPRGKRZSA-N 330.340 1.591 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N[C@H](C)C(=O)N(C)C 1317291114 VCWRVGRKWDWACZ-GHMZBOCLSA-N 348.407 1.034 10 10 EDCE Cc1nn(C)c(-n2ccnc2C)c1C(=O)NCc1cc(O)ccc1O 1176754998 JYTOHWDNACZINF-UHFFFAOYSA-N 341.371 1.564 10 10 EDCE CN(Cc1cnn(C)n1)c1ccc(CN)c(Br)c1F 2115774392 QPMWNSUPBLSYNU-UHFFFAOYSA-N 328.189 1.812 10 10 EDCE CNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCN1CCN=[N+]=[N-] 1902747248 VRIMLPULFNTQSQ-NSHDSACASA-N 326.401 1.354 10 10 EDCE Cc1cc(N[C@@H](C)Cc2ccc(O)c(O)c2)nc(S(C)(=O)=O)n1 1186078889 FNNHGHLKXZJDFR-VIFPVBQESA-N 337.401 1.643 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/[C@H]1CCCO1 1331970254 HXOOXMAULHEQRX-RNUUNTDPSA-N 349.383 1.423 10 10 EDCE CN1CCN(c2ccc(CN[C@@H]3CCc4nc[nH]c4C3)cc2F)CC1 1261201559 GTJAYLUVHDIWLS-OAHLLOKOSA-N 343.450 1.948 10 10 EDCE CN1C[C@@H](N(C)Cc2cc(Br)cc(F)c2O)CC1=O 2131933496 DDWBCHISGINDCE-JTQLQIEISA-N 331.185 1.956 10 10 EDCE COc1ccc(CNC[C@H]2CC[C@H](CNC(=O)C(N)=O)CC2)cc1C 1279273551 RQWCITFOQDWIKB-SHTZXODSSA-N 347.459 1.501 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)c2cnnn2C)cc1C 1275394283 JXEHQWDBZJYHQY-STQMWFEESA-N 331.420 1.429 10 10 EDCE NS(=O)(=O)c1ccc(CC(=O)NCc2c(O)cccc2F)s1 1456102961 VEEHYRAAGUWGEZ-UHFFFAOYSA-N 344.389 1.099 10 10 EDCE NC(=O)c1ccc2c(n1)N(C(=O)/C=C\c1cncc(F)c1)CCC2 1531635834 GFPWYTIZPRCNRY-UTCJRWHESA-N 326.331 1.707 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C2=NN(CCO)C(=O)CC2)cc1 1542089388 LRHXDDLAVQPGGW-UHFFFAOYSA-N 346.431 1.120 10 10 EDCE CCCN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CC(=O)N(C)C1=O 1625953343 LBRSMKDKBQLUFG-LBPRGKRZSA-N 345.359 1.459 10 10 EDCE O=C(NCc1cccc(Br)c1O)c1ccc2nn[nH]c2n1 1623364843 UWDHOIVIJRNSQV-UHFFFAOYSA-N 348.160 1.751 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2CCN(C)C2=O)cc1C 1714724266 LJTGFEFKXVMRQV-GOEBONIOSA-N 347.459 1.418 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cc2c(c([N+](=O)[O-])c1)OCO2 1635847141 IMGPUMAQPFJOSN-UHFFFAOYSA-N 332.268 1.665 10 10 EDCE 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CCN(CC)c1ccc(CNCCC(=O)N(C)CCC(=O)O)cc1 1857863449 POZMOLDUERAJEB-UHFFFAOYSA-N 335.448 1.946 10 10 EDCE CN(C)C(=O)NCCCNCc1ccc(Br)cc1O 1964611732 KRPIJWNBYAIDJQ-UHFFFAOYSA-N 330.226 1.906 10 10 EDCE CC(C)(C)OC(=O)N1CCOCCN1C(=O)Cc1ccc(N)cc1 1999441788 IILFUJBUEULQHL-UHFFFAOYSA-N 335.404 1.822 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2COCC[C@@]2(C(=O)NCCN=[N+]=[N-])C1 2010393183 OYGKDQDOFFLBBM-XHDPSFHLSA-N 339.396 1.687 10 10 EDCE CC(C)(C)OC(=O)NC1CN(CC(=O)NCC2(CN=[N+]=[N-])CC2)C1 2010388989 JWGJGAICYKABAE-UHFFFAOYSA-N 338.412 1.402 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@H](O)CNC(=O)OC(C)(C)C)c1 2011422464 SGHCEUJPNAIHOU-RYUDHWBXSA-N 340.420 1.937 10 10 EDCE CC(C)(C)OC(=O)NCc1n[nH]c(=NCc2c(O)cccc2F)o1 2024256070 FZFMQQSZXMBUNC-UHFFFAOYSA-N 338.339 1.973 10 10 EDCE CC1(OCC(=O)O)CN(Cc2c(O)cccc2Br)C1 706647169 FDZCXXSYMLPBNH-UHFFFAOYSA-N 330.178 1.830 10 10 EDCE Cc1ccc(CN=c2nc(CNC(=O)OC(C)(C)C)[nH]n2C)c(O)c1 2084072545 VZHRTPCSURKRTF-UHFFFAOYSA-N 347.419 1.888 10 10 EDCE 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Nc1nc(O)c2nc(N=Nc3ccc(S(=O)(=O)O)cc3)[nH]c2n1 254407908 WLZVIPJWGHVKJK-UHFFFAOYSA-N 335.305 1.303 10 10 EDCE CC(=O)C(=O)COC(=O)C1(CNC(=O)OC(C)(C)C)CCCC1 808526302 NMOAQLCZMNYVEC-UHFFFAOYSA-N 327.377 1.773 10 10 EDCE Cc1ccc(CN(C)C(=O)c2cn(C)nn2)c(O)c1Br 2380775039 UTWPCVZHAXUMTK-UHFFFAOYSA-N 339.193 1.864 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1cccc(Cl)c1 808519225 XKVVWYLQOJWOKV-IUODEOHRSA-N 337.759 1.561 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Nc3ccnc(OC)n3)C2)cc1 822759416 POOOWNDWTNDYHT-LBPRGKRZSA-N 343.387 1.894 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3COC(C)(C)C3)ccc21 827580041 ORKMKKWBSXZZHZ-OAHLLOKOSA-N 345.443 1.369 10 10 EDCE CCO[C@@H]1C[C@H](NC(=O)c2c(F)ccc(O)c2O)[C@@H]1n1cccn1 832932925 DGZWAUSSORPFGX-SUHUHFCYSA-N 335.335 1.582 10 10 EDCE Cn1cc(CCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nn1 830900532 ZKNWPMZJJGMQTJ-INIZCTEOSA-N 344.415 1.661 10 10 EDCE Cc1cc(C(=O)N2CC(O)(C(N)=O)C2)c(C)n1-c1cccc(Cl)c1 913075523 XYYVGOWOYDOXQP-UHFFFAOYSA-N 347.802 1.420 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCN(c3nncn3C)CC2)c1O 847040529 SJLIIXLSYOJLMM-UHFFFAOYSA-N 333.367 1.185 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCn3nncc3C2)cc1 847292215 QNTZSIDCFROSNC-UHFFFAOYSA-N 328.420 1.850 10 10 EDCE C[C@H](O)[C@@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 840259874 SWBOHGCSHVYHKI-YOEHRIQHSA-N 333.432 1.578 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N[C@@H]2CCc3ccccc3C2)cc1 842036883 QYEKQWNNSUIYAH-GOSISDBHSA-N 337.423 1.601 10 10 EDCE C[C@H]1CCn2ncc(C(=O)NC[C@H](N)c3ccc(N(C)C)cc3)c2C1 843296576 BEXHVAQWCUOOJM-GUYCJALGSA-N 341.459 1.961 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@]3(C)CO)C2)cc1 854300043 TYMMFYBAGZVSNN-RDTXWAMCSA-N 333.432 1.830 10 10 EDCE Nc1nnc([C@@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)o1 931004685 AVDDRNXMNQEITB-OAHLLOKOSA-N 343.431 1.868 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)c3ncn(C)n3)C2)cc1 852268134 GVSLBPXWYFQBCF-STQMWFEESA-N 344.419 1.463 10 10 EDCE C[C@@H](Sc1nncn1C)C(=O)NCc1ccc2cccnc2c1O 862029300 UYRRIXHUYJUXCS-SNVBAGLBSA-N 343.412 1.866 10 10 EDCE COc1ccc(N2CCN(C(=O)C3CCN(OC)CC3)CC2)cc1 864470800 QGSIBBBQGVAWHH-UHFFFAOYSA-N 333.432 1.617 10 10 EDCE COC1(CS(=O)(=O)N[C@@H](C)c2ccccc2O)CCOCC1 867836044 CCCIXGMMQBTARW-LBPRGKRZSA-N 329.418 1.568 10 10 EDCE Cc1cc(C(=O)NCC(=O)N2CCCO2)c(C)n1-c1ccccn1 862083675 USIFVQHCOZUVLN-UHFFFAOYSA-N 328.372 1.383 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc(Br)cc2c1OCCO2 1118475694 DQKNOZWCRHOEFC-UHFFFAOYSA-N 343.129 1.535 10 10 EDCE C[C@H]1CN(Cc2cc(Br)cc(F)c2O)CCN1CCO 894503075 GUBRFSNVOJUOHP-JTQLQIEISA-N 347.228 1.792 10 10 EDCE COc1cccc(CNC(=O)c2ccc(Cn3ccnn3)o2)c1O 1137473297 FJZJSKDEMSKZDZ-UHFFFAOYSA-N 328.328 1.564 10 10 EDCE CN(C)C(=O)COc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1141425549 ROXIWFQPRDPEFG-UHFFFAOYSA-N 344.367 1.746 10 10 EDCE O=C1C[C@@](C(=O)NCc2c(O)cccc2O)(c2ccccc2)CN1 1156885750 NBTJHOFEIQGNLI-SFHVURJKSA-N 326.352 1.172 10 10 EDCE CN(C[C@H](O)COCc1ccccc1)c1ccc2c(c1)NC(=O)[C@@H]2O 1916383245 GFGJKTQNSREFIY-MAUKXSAKSA-N 342.395 1.686 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(O)cc2O)c1 1303181893 ZAWGINWQYRWGBU-UHFFFAOYSA-N 338.341 1.427 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2cc[n+]([O-])cc2)cc1C 1328978790 UQKBCBTWAAXGBL-LSDHHAIUSA-N 343.427 1.934 10 10 EDCE O=C1Nc2cc(N3CCO[C@@H]4C[C@H]43)c(Br)cc2[C@@H]1O 2115219386 GVUXYTWKWSYJGZ-UTUOFQBUSA-N 325.162 1.412 10 10 EDCE C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1ccncc1 1332583768 RIOGEAPXBOFBMY-AWEZNQCLSA-N 340.427 1.684 10 10 EDCE CCOC(=O)C1CCN(C(=O)CCN2C(=O)CSC2=S)CC1 1865765560 CNTGDNBHJXXESN-UHFFFAOYSA-N 344.458 1.039 10 10 EDCE O=C(CCN1C(=O)CSC1=S)Oc1cccc([N+](=O)[O-])c1 1865774720 YLZVILAFTXQBTA-UHFFFAOYSA-N 326.355 1.751 10 10 EDCE CC[C@@H](C)CN[C@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1507266761 IADHTXCDTDLMEI-RISCZKNCSA-N 335.408 1.575 10 10 EDCE CS(=O)(=O)Cc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1442388261 CCPNBMIADMHHSM-UHFFFAOYSA-N 335.381 1.824 10 10 EDCE C[C@H](NC(=O)[C@@H](O)c1cnn(C)c1)c1ccc(N2CCOCC2)cc1 1442406244 AEPPLVJJWBNWOE-GUYCJALGSA-N 344.415 1.168 10 10 EDCE C[C@@H](CNC(=O)C1(CF)CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1534213749 BQYVOKHJIIMOSG-JTQLQIEISA-N 349.366 1.833 10 10 EDCE COC(=O)Cc1occc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 1611431702 QYUMNDYABYEHSW-JTQLQIEISA-N 333.340 1.767 10 10 EDCE O=C(CCCc1nn[nH]n1)Nc1c(-c2ccccn2)nc2ccccn12 1629107210 DXPVKKIHTDGYBO-UHFFFAOYSA-N 348.370 1.871 10 10 EDCE C[C@@H]1CN(C(C)(C)CNC(=O)Cc2ccc(O)c(O)c2)C[C@@H](C)O1 1629103197 MBAUSGSODRZDOM-CHWSQXEVSA-N 336.432 1.644 10 10 EDCE NCc1ccc(N2CC[C@@H](N3CCOCC3)C2)cc1Br 228152384 RSNRMIBIMAXSIN-CQSZACIVSA-N 340.265 1.819 10 10 EDCE Cn1cc([C@H](CO)NC(=O)c2cc3cc(O)c(O)cc3s2)cn1 1633107277 JWDRLBPWHRVVFG-JTQLQIEISA-N 333.369 1.509 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC(CO)(CO)C2)c1 1637849813 FTGVFIMSZCIUER-UHFFFAOYSA-N 342.395 1.333 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2c(C)cnn2C)cc1C 1567046137 PQLJTIJWUSBNLH-AWEZNQCLSA-N 330.432 1.954 10 10 EDCE CC[C@@H](F)C(=O)N[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1736999045 YVUPLLHUWMDMJX-CHWSQXEVSA-N 349.366 1.928 10 10 EDCE C=C/C=C/CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1641098019 NMRFIMYQSIZIRA-ONEGZZNKSA-N 334.441 1.670 10 10 EDCE CCO[C@@H](C)C(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1744688096 KFSVTLSCJNESKA-MNOVXSKESA-N 349.391 1.509 10 10 EDCE CN(Cc1ccccc1O)c1nnc(C2CC2)n1CCn1cncn1 1747749869 FGMWEHUUKYDHIE-UHFFFAOYSA-N 339.403 1.789 10 10 EDCE Cc1ccc(C(=O)NCc2cn(C(C)C)c(=O)nc2O)c(O)c1O 1588231359 SZIZIMVPWXWWQU-UHFFFAOYSA-N 333.344 1.179 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)c2cnccn2)c2nccn2C)cc1 169813723 YPLFGBXOEGAWOE-INIZCTEOSA-N 336.399 1.796 10 10 EDCE C[C@H](NCCNS(C)(=O)=O)c1ccc(N2CCCCC2)cc1 158236534 HMLMCKDXNUMCMS-AWEZNQCLSA-N 325.478 1.877 10 10 EDCE CNC(=O)[C@H](C)CN(C)Cc1c(Br)ccc(OC)c1O 1964595195 SMQIKRCMTIRMQX-SECBINFHSA-N 345.237 1.977 10 10 EDCE C[C@@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)Cc1ccc(N)cc1 1977701574 WJUJAINXVWWPFK-NSHDSACASA-N 343.449 1.601 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985094889 VNZAHWUIAHQCKR-MNOVXSKESA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985095064 YIPFGQOXENMIDY-GMTAPVOTSA-N 325.369 1.268 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 1985102543 IHNWBGPMEOVLDZ-MNOVXSKESA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1986369477 SYFNTEWRNJINBC-GHMZBOCLSA-N 327.385 1.421 10 10 EDCE CN1C(=O)O[C@H]2CN(c3cc(Br)c(CN)cc3F)C[C@H]21 2176925300 YPSILNKSJXBJMZ-NEPJUHHUSA-N 344.184 1.686 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@H](CO)C2)c(Br)c1 396818451 XJUWDUQXOKNMMY-PUYPPJJSSA-N 329.238 1.648 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC[C@H](C4CCOCC4)C3)c2n1 2064859100 ASJTXYFBAPJAHQ-ZDUSSCGKSA-N 330.388 1.632 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cccc(O)c2O)[C@H](O)C1 1908521516 UCSYGDIVWINQRF-TZMCWYRMSA-N 338.404 1.558 10 10 EDCE CO[C@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@@H]1NC(=O)OC(C)(C)C 2058774564 FQXMKOSCZLAJSL-GJZGRUSLSA-N 349.431 1.562 10 10 EDCE CNCc1ccc(N2C[C@H](CO)C[C@@H]2CO)c(Br)c1 2089870484 PUNCRNBOUXCRJE-VXGBXAGGSA-N 329.238 1.348 10 10 EDCE CN(C)[C@H]1CN(c2cc(Br)c(CN)cc2F)C[C@@H]1O 2089923361 OGKKAFUEZNHPEX-STQMWFEESA-N 332.217 1.158 10 10 EDCE CN(C)C[C@@H]1COCCN1c1ccc(CN)c(Br)c1 2096927168 BHJVXQOZIDOXFU-CYBMUJFWSA-N 328.254 1.675 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210530756 HWQWDABXWCNVRP-DBIOUOCHSA-N 327.385 1.608 10 10 EDCE CNCc1ccc(N2CC[C@H](O)[C@@H](O)CC2)c(Br)c1 2269139553 TYZDHCHBLBVIQB-KBPBESRZSA-N 329.238 1.491 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(COc2nnc(=N)[nH]n2)C[C@H]2CC[C@H]1C2 2248372754 FPOSSOLKQVOZHJ-AMJWSMQMSA-N 336.396 1.141 10 10 EDCE COC[C@@H]1C[C@@H](CN)N(Cc2c(O)cccc2Br)C1 2273873354 FESPFLVNOYAUNQ-MNOVXSKESA-N 329.238 1.950 10 10 EDCE CSc1ncc(CNC(=O)N2[C@@H](C(=O)O)CS[C@@H]2C)s1 2284542767 BFQJBCSIMJHESS-HTRCEHHLSA-N 333.460 1.923 10 10 EDCE CC(C)[C@@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)C(=O)O 2301537038 MTLXEFDLBGAXAN-QGZVFWFLSA-N 332.400 1.762 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H]2CCc3ncnn3C2)cc1F 112746877 TXVAEESXCINUCJ-GFCCVEGCSA-N 332.383 1.297 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cccc(O)c2C1 1263873141 JSOOSOXGGMYFMV-YGRLFVJLSA-N 336.388 1.509 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H](C(N)=O)CC[C@@H]2C)c([N+](=O)[O-])c1 301061899 CLPNIFUBNFGDTK-PJKPIPPESA-N 347.371 1.871 10 10 EDCE O=C1N[C@@H](C(=O)NCc2cccc(Br)c2O)CS1 277420407 CWKQBIRWFWXSDW-MRVPVSSYSA-N 331.191 1.596 10 10 EDCE Cc1ccc(Cn2cc(COCCO)nn2)c(O)c1Br 2381140996 SNDNOLZHMYVDPA-UHFFFAOYSA-N 342.193 1.612 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2COC[C@@H]2N)c(O)c1Br 2380760230 VXIOPQBKCPYASB-MNOVXSKESA-N 343.221 1.395 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](C)Oc1ccccc1Br 808516648 JFYVBMPSQXDANY-SECBINFHSA-N 329.146 1.918 10 10 EDCE CC1(C)OCC[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 296192890 CJSINJKQMCQIMN-MRXNPFEDSA-N 333.432 1.890 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)CN1C(=O)NC(=O)C1(C)C 801548307 DZMHHUWZTALWCQ-UHFFFAOYSA-N 347.415 1.851 10 10 EDCE C[C@@H](NC(=O)[C@@H](N)C(F)(F)F)c1ccc(N2CCOCC2)cc1 827726348 XOURNWJESRUPHF-ZWNOBZJWSA-N 331.338 1.590 10 10 EDCE O[C@]1(C(F)F)CCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 824726862 XKRSCXGTJHIBNL-MRXNPFEDSA-N 330.350 1.864 10 10 EDCE CO[C@]1(CN[C@@H](C)c2cc(F)cc(F)c2O)CCS(=O)(=O)C1 903365421 NECSUHZGBINNTO-XPTSAGLGSA-N 335.372 1.525 10 10 EDCE CN(C)c1ccc(/C=C/CN(C)[C@@H]2CCN(S(C)(=O)=O)C2)cc1 835055481 KSLDFSWOSYWELQ-FUTAKVPZSA-N 337.489 1.732 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CC[C@@H]2C[C@H]2C1 834774566 AZEPTNHYRJFICV-IXDOHACOSA-N 339.439 1.984 10 10 EDCE Cn1nncc1CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 830899750 LGMCYVYDSMIZAM-HNNXBMFYSA-N 330.388 1.271 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3C[C@H]4CC(=O)[C@@H]3C4)CC2)cc1 837309234 FWIMSTRFKVFSCF-XKQJLSEDSA-N 328.412 1.959 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840554330 GBHVQYRTUVKHQS-BBRMVZONSA-N 336.432 1.422 10 10 EDCE NC(=O)[C@H]1C[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 845446800 DNLLLZQQNDVDGH-KZCWHLCOSA-N 332.187 1.762 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)CN3CC[C@H](C)C3)C2)cc1 848229073 GNHXTOMXXJFUQX-HOTGVXAUSA-N 331.460 1.980 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)/C=C/C3CC3)cc2)C1 742566614 OEYPRSPIOWZILZ-OJXHRBAXSA-N 327.428 1.971 10 10 EDCE CC(C)OC[C@H](CO)N(C)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 844216188 CAHUQRZPMGJWGB-VGVVRCBHSA-N 338.360 1.915 10 10 EDCE CN1CC[C@@H](NC(=O)C(=O)Nc2ccc(N)cc2)[C@H]1c1ccccc1 841081558 SZYYGTMVUGKYBA-IAGOWNOFSA-N 338.411 1.769 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@@H]1CNC(=O)C1 926971035 VZKHHJLZGGUZDL-HNNXBMFYSA-N 332.448 1.810 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cnn(CC)n1 859320474 YEPXUDQEDFPDFF-UHFFFAOYSA-N 345.403 1.059 10 10 EDCE COC(=O)[C@H]1C[C@]1(N)c1cc(I)ccc1O 1952776018 SAOYNRPZASRDJO-KCJUWKMLSA-N 333.125 1.344 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3csc(CO)n3)C2)cc1 869227918 CZUPIMTXFJGZBL-NSHDSACASA-N 333.413 1.653 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@H]3CC[C@H]2[C@H]2CNC[C@@H]32)cc1 866696384 IKHIWGAXBRIZLS-BVBHFADKSA-N 342.487 1.299 10 10 EDCE CO[C@H]1C[C@H](CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 1119552377 FJKJCBUWJNYLQV-KOMQPUFPSA-N 345.443 1.226 10 10 EDCE COc1ccc(N2CCCN(C(=O)C(=O)NC[C@H]3C[C@H]3C)CC2)cc1 1117084911 UDIHAFFIFAETSS-HUUCEWRRSA-N 345.443 1.506 10 10 EDCE COc1cccc([C@@H]2CN(C(=O)Cc3ccc(O)c(O)c3)CCN2)c1 1454480104 YEGRYFCLHGDSEO-INIZCTEOSA-N 342.395 1.822 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNCc2cc(F)ccc2O)C1 702807113 AINSUHBULZCTPL-SWLSCSKDSA-N 340.395 1.849 10 10 EDCE Cn1nc(C(=O)NCc2ccc(O)c(O)c2)cc1Br 1150376670 ANSZVUPNTCVDBC-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cnccn3)CC2)cc1C 1323383079 LASHBDMETHJWSS-UHFFFAOYSA-N 326.400 1.846 10 10 EDCE C[C@@H]1C[C@@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)CCN1C 1348613386 IABAUYUPGWJQQT-OCCSQVGLSA-N 331.416 1.176 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2cocc2C)cc1C 1507220729 BWFLGZDOFJGNOV-OAHLLOKOSA-N 332.400 1.786 10 10 EDCE CN(CC1(O)CCC1)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 1914603202 ZDCCURLHSFFETH-GFCCVEGCSA-N 341.205 1.786 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)C(=O)NCc1c(O)cccc1F 1456029971 PGNRQGSMHSZNBW-LBPRGKRZSA-N 328.340 1.033 10 10 EDCE Cc1ccc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)nc1 1469396363 UZCLJEQZPNTHKN-UHFFFAOYSA-N 335.385 1.397 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CN2CCN1C[C@@H]2C 1542169774 ASZGRXQYNNCVMX-LPHOPBHVSA-N 344.503 1.878 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CC[C@@H]1COCCO1 1709038624 LJHQZLFIRYKKTH-OAHLLOKOSA-N 346.431 1.988 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)C1CC2(C1)CS(=O)(=O)C2 1558555319 XYIRIMZAVQMGQY-UHFFFAOYSA-N 345.420 1.986 10 10 EDCE CC[C@@H](NC(C)=O)C(=O)N[C@@H](C)CNCc1ccc(OC)c(C)c1 1498119784 UUXGIDWNQMFMSK-XJKSGUPXSA-N 335.448 1.513 10 10 EDCE CC[C@@H](C)CC(=O)N1CC[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1720339639 RLRVMKJKFXVDCO-TZMCWYRMSA-N 349.431 1.866 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@]2(C)CCC(=O)NC2)cc1C 1569076520 VUSYHIJQCDJSMC-IFXJQAMLSA-N 347.459 1.514 10 10 EDCE CC[C@@H](F)C(=O)NCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1737764725 JJCCHSMVILKEQS-GFCCVEGCSA-N 337.355 1.785 10 10 EDCE C[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1noc(C(F)(F)F)n1 1570581613 BZGVKIAFTKFAEP-LURJTMIESA-N 331.250 1.920 10 10 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CC(C)(C)OC(=O)N1CCC[C@@]1(CO)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010389927 WEXAKWNJBNVAKR-IAQYHMDHSA-N 339.396 1.660 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)N1CCC(N=[N+]=[N-])CC1 2010401650 GMDKWYKCPZPMER-LBPRGKRZSA-N 341.412 1.954 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)NCC1(CN=[N+]=[N-])CC1 2010405653 KHADIMIHTHKUPB-UHFFFAOYSA-N 340.428 1.650 10 10 EDCE C[C@H](NC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)c1ccccc1O 2017518539 IOSNIFOELJBMQU-FZMZJTMJSA-N 338.404 1.845 10 10 EDCE O=C(O)[C@@H]1CO[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@H]21 2160867876 NTAAJOKAOVCWDP-DMDPSCGWSA-N 342.189 1.686 10 10 EDCE NCc1cc(F)c(N2CC[C@@H](CC(N)=O)C2)cc1Br 690770182 HDHVDKDECVZKTQ-QMMMGPOBSA-N 330.201 1.749 10 10 EDCE Nc1ccc(OCC(=O)NCc2cc(Br)no2)cc1 718890194 QRXKBOPNANUAOD-UHFFFAOYSA-N 326.150 1.715 10 10 EDCE CS(=O)(=O)c1cnn(Cc2cc(C(F)(F)F)ccc2O)c1O 2070261560 ZZKLHBDMYOCPCF-UHFFFAOYSA-N 336.291 1.765 10 10 EDCE C[C@@H](N=c1nc(CNC(=O)OC(C)(C)C)[nH][nH]1)c1c(O)cccc1O 2063196321 QQHSRZLAFZRQBR-SECBINFHSA-N 349.391 1.836 10 10 EDCE CC(C)(C)OC(=O)N1CC(c2nc(=NCc3ccccc3O)[nH][nH]2)C1 2064224538 KNECXWTZAHXLQT-UHFFFAOYSA-N 345.403 1.879 10 10 EDCE NCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(F)c1Br 2199531732 LOLNESDBYYDTBP-MHWWPZMWSA-N 345.212 1.367 10 10 EDCE O=C(NC[C@H]1CNCCN1Cc1ccccc1)c1cccc(O)c1O 2084716761 YBCKHEIPDXNLCG-OAHLLOKOSA-N 341.411 1.302 10 10 EDCE CC[C@@H](O)CN(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2106613045 HSYGZUUWNJKYAB-JMCQJSRRSA-N 329.194 1.642 10 10 EDCE Oc1cc(Br)ccc1CN1CCOCCC12CNC2 2111333791 NGQOUWJBEAPHGR-UHFFFAOYSA-N 327.222 1.719 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCC1(Br)CC1 2111878601 TWILYDPYJXNULF-VIFPVBQESA-N 329.194 1.011 10 10 EDCE Oc1cccc(Br)c1CNCC1CN(C2COC2)C1 2114713923 NHEQIFRLYVVFSV-UHFFFAOYSA-N 327.222 1.575 10 10 EDCE CCN(c1ccc(CNC)cc1Br)[C@H]1CCNC1=O 2114768086 VKZRMQBQJYIZAF-ZDUSSCGKSA-N 326.238 1.883 10 10 EDCE COc1ccc(N(CCO)CCCN)c(OC)c1Br 2266418325 QJDYFCRSVKFJDZ-UHFFFAOYSA-N 333.226 1.614 10 10 EDCE COc1ccc(N2CC[C@H](O)[C@@H](O)CC2)c(OC)c1Br 2284570630 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328.434 1.223 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@H](NC(C)=O)C3)C2)cc1 852447839 FLJJRMZDTLPCDX-LSDHHAIUSA-N 346.431 1.194 10 10 EDCE C[C@H]1CC[C@@H](NC(=O)NCCc2ccc(N)cc2)CS1(=O)=O 851662949 OQDZFCULKSMAJP-SMDDNHRTSA-N 325.434 1.076 10 10 EDCE C[C@H]1CCC[C@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)O1 850602266 SREVGVADZSTUQF-WMLDXEAASA-N 347.459 1.785 10 10 EDCE CCOC(=O)[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)CCO1 769467183 MZEMJIGQTZSMFC-KRWDZBQOSA-N 334.416 1.287 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCO[C@@H](CC(N)=O)C2)c1 862535610 SUBFYNFOLMXGSS-NSHDSACASA-N 343.221 1.539 10 10 EDCE Cc1cc(CCNC(=O)C(=O)N(C)CCO)c(C)n1-c1ccccc1 1118854563 LJJMEUMSGCHOMP-UHFFFAOYSA-N 343.427 1.204 10 10 EDCE O=C(NCc1ccccc1O)c1ccc(CN2CCOCC2)cn1 774067099 XIJKMFHANGDILV-UHFFFAOYSA-N 327.384 1.549 10 10 EDCE CN(c1ccc(CNC2CC2)c(Br)c1)[C@H]1COC[C@@H]1O 708112348 FYCNYZBOQYRVGG-GJZGRUSLSA-N 341.249 1.897 10 10 EDCE CN[C@H](C)c1ccc(N2CCS(=O)(=O)CC2)c(Br)c1 61695445 JZAZCEJMBUHMIC-SNVBAGLBSA-N 347.278 1.964 10 10 EDCE CCOc1ccc(CN2C[C@H]3COCC[C@@]3(C(=O)OC)C2)c(O)c1 793344276 LFZFAJVTXHHDLL-KBXCAEBGSA-N 335.400 1.802 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H](CO)C[C@H](O)c1ccccc1 1153511053 ASDGPNKFTSHQPA-ZBFHGGJFSA-N 331.368 1.241 10 10 EDCE CC(C)(C)C(=O)N1CSC[C@H]1C(=O)NCc1cccc(O)c1O 1347542063 IFAIDFJZXDUNES-NSHDSACASA-N 338.429 1.662 10 10 EDCE CCS(=O)(=O)[C@@H]1CCN(c2ccc(CO)cc2Br)C1 2123307136 AXRMSRPUYSGRSW-LLVKDONJSA-N 348.262 1.955 10 10 EDCE O=C(C(=O)N1CCOC[C@H]1C1CCC1)N1Cc2cccc(O)c2C1 1335623715 ZAUCUXIMZHMEKZ-HNNXBMFYSA-N 330.384 1.262 10 10 EDCE Cn1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C=O 1333459502 VKTGXCDTEKZMCY-UHFFFAOYSA-N 345.374 1.743 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CO[C@@H](C2CC2)C1 1331277976 WWAJVMZHMOYGJI-FUHWJXTLSA-N 345.443 1.890 10 10 EDCE C[C@H](NC(=O)c1ccc(NS(C)(=O)=O)nc1)c1ccccc1O 1454812476 ADCBSIKNIMNDLM-JTQLQIEISA-N 335.385 1.650 10 10 EDCE COC[C@H](C)N[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1480069642 QVXCEZVKJGYTKO-NHYWBVRUSA-N 347.419 1.982 10 10 EDCE 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CO[C@@H]1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C[C@H]1F 2146474417 VDLSYLRFRIZWPJ-FXAINCCUSA-N 345.168 1.608 10 10 EDCE CN(CC1(O)CCOCC1)c1ccc(CN)cc1Br 161220790 PWHZHRSSNDRKHO-UHFFFAOYSA-N 329.238 1.886 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)C[C@H]2C1 2006009003 GACMAEYOXIILGE-PEDHHIEDSA-N 336.432 1.755 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)c1cnn(C)c1CNC(=O)OC(C)(C)C 2010388702 GASASOLDIWRMGE-UHFFFAOYSA-N 337.384 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)c2cc(O)c(O)c(O)c2)C1 2015118967 FTTJDUSOCYTARI-JTQLQIEISA-N 338.360 1.543 10 10 EDCE NC(=O)CCN(Cc1ccccc1)c1cc2c(cc1F)[C@@H](O)C(=O)N2 2034745960 HFSIMTKCZJRJTD-QGZVFWFLSA-N 343.358 1.693 10 10 EDCE CO[C@@]1(CO)CCN(c2cc(Br)c(CN)cc2F)C1 402889660 DPACXDMKISVENF-ZDUSSCGKSA-N 333.201 1.635 10 10 EDCE CN[C@@H](C)c1ccc(N2CCOC[C@@H](O)C2)cc1Br 399857158 KDALETWVIPWDEJ-JQWIXIFHSA-N 329.238 1.927 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)cc1Br 2173320649 RJDMAUDHQFQHBI-SEWBAHNZSA-N 341.249 1.489 10 10 EDCE COCCn1nnnc1CNCc1cc(Br)ccc1O 2169374655 KFXOBBAKXOTHKQ-UHFFFAOYSA-N 342.197 1.077 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CN(CC(=O)Nc3ccc(N)cc3)C[C@@H]21 2045667103 YZCNSZPDSVHWMI-MIFYACCESA-N 346.431 1.662 10 10 EDCE O=S1(=O)C[C@@H]2[C@H](NCc3ccc(Br)cc3O)[C@@H]2C1 2054277722 JHVFUAUUQXQOEX-PEGIJTEDSA-N 332.219 1.287 10 10 EDCE O=C1NC[C@H]2CN(Cc3cccc(Br)c3O)CC[C@@H]12 2100946536 YYIGGAKBTYVCQT-WDEREUQCSA-N 325.206 1.723 10 10 EDCE Cn1cnc(CCNCc2ccc(O)c(O)c2)c1Br 2088310587 HSXMRJZQQDQYBZ-UHFFFAOYSA-N 326.194 1.926 10 10 EDCE NCc1ccc(N2CC[C@@H]3OCCO[C@@H]3C2)c(Br)c1 2095386731 UMESQRBZEGYAPT-UONOGXRCSA-N 327.222 1.902 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCN(C)C2=O)c1O 2227746750 QABXBDMYULRNFT-SNVBAGLBSA-N 329.194 1.484 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccsc2CN)s1 2269279220 JSHAXLHKZGQQLG-UHFFFAOYSA-N 335.501 1.864 10 10 EDCE CN1C(=O)C(=CC=Cc2ccccc2[N+](=O)[O-])C(=O)N(C)C1=S 2294196290 LJRYMGCHYKNKND-UHFFFAOYSA-N 331.353 1.750 10 10 EDCE NC(=O)c1cc(NC(=O)C=Cc2ccc(N3CCOCC3)cc2)c[nH]1 2298491470 RSNXWQZFDDZODZ-UHFFFAOYSA-N 340.383 1.602 10 10 EDCE CC=CC[C@H](CO)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2309668789 PYPFQFJLNQUIQD-QGZVFWFLSA-N 330.428 1.980 10 10 EDCE C[C@H](O)[C@H](C(=O)O)N1C(=O)C(=Cc2ccsc2)SC1=S 2323823469 KZNJOTIHVBKYSP-IMTBSYHQSA-N 329.424 1.783 10 10 EDCE CC1=NNC(=O)/C1=C/c1ccc(-c2ccc(S(N)(=O)=O)cc2)o1 105911325 ZVFJTHROTDCPMC-MDWZMJQESA-N 331.353 1.483 10 10 EDCE CC(=O)c1cc(F)cc(CN2C[C@@H](C)[C@@H](N3CCOCC3)C2)c1O 177256654 BUZXXFGVOYSVCQ-PXAZEXFGSA-N 336.407 1.886 10 10 EDCE O=C(N[C@H](C(=O)O)c1ccc(O)c(O)c1O)OCc1ccccc1 1951401197 BWXKLEKUTQISGC-LBPRGKRZSA-N 333.296 1.856 10 10 EDCE CNC(=O)c1ccc(N[C@H](C)c2ccc(N3CCOCC3)cc2)nn1 74743431 QSTIJSDNXKZQFN-CYBMUJFWSA-N 341.415 1.846 10 10 EDCE COC(=O)CC[C@@H](N)c1cc(I)ccc1O 95780765 LPMIGSTYXQDJNK-SECBINFHSA-N 335.141 1.950 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(C)CCCO3)cc2)CC1 276167503 RWKYFEFHSXUISN-LJQANCHMSA-N 345.443 1.540 10 10 EDCE Cc1ccc(CN2CCN3CCOC[C@@H]3C2)c(O)c1Br 2381130086 UBXLIQRJMXRYCM-ZDUSSCGKSA-N 341.249 1.980 10 10 EDCE CC(=O)C(=O)COC(=O)c1nn(-c2cccc(F)c2F)c2c1CCC2 817195669 IQLYTUDEBKNVIO-UHFFFAOYSA-N 348.305 1.954 10 10 EDCE COC[C@]1(C(=O)OC)CCCN1Cc1cc(OC)c(OC)cc1O 827488450 HLSXCXVZRGPFKG-KRWDZBQOSA-N 339.388 1.563 10 10 EDCE CCO[C@@H]1C[C@H](NC(=O)NCc2ccccc2O)[C@@H]1n1cccn1 836495938 OZRJRZXFZXJPIJ-IMJJTQAJSA-N 330.388 1.807 10 10 EDCE CC[C@@H](C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(O)cc1O 910956443 WEPHPWHGINWHQY-ZWNOBZJWSA-N 338.429 1.662 10 10 EDCE C[C@@H]1CCNC[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 841731171 ZVPBKWUXMIGSFN-RHSMWYFYSA-N 332.448 1.320 10 10 EDCE CCn1cnnc1CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849225388 SVBICSNXBDQTAF-CYBMUJFWSA-N 344.419 1.385 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCC[C@@H]2CC(=O)N(C)C2)c1 924737529 QHUPRANDMDEOMQ-NWDGAFQWSA-N 335.404 1.629 10 10 EDCE CSC[C@H](NC(=O)N[C@H](C)c1ccc(N(C)C)cc1)C(=O)O 929046432 UCOHANSXMZXNMD-MFKMUULPSA-N 325.434 1.929 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H](CN)[C@H](C)C1 926327955 KOGAVVJVXUFCTC-HUUCEWRRSA-N 347.459 1.574 10 10 EDCE C[C@@H](C1CC1)n1[nH]ccc1=NC(=O)COC(=O)c1cccc(O)c1O 758559927 UDLZGQGFWGKGCN-JTQLQIEISA-N 345.355 1.483 10 10 EDCE COC(=O)C12CC(CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1)C2 852442091 XNOBOWIISABVCN-UHFFFAOYSA-N 345.443 1.348 10 10 EDCE CCNC(=O)[C@H](C)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 851947355 ZNDOLPYXTAKFBI-QWHCGFSZSA-N 334.420 1.098 10 10 EDCE Cc1cc(C(=O)N2CC(O)(CO)C2)c(C)n1-c1cccc(Cl)c1 854672118 DLEMRVOQODVJLP-UHFFFAOYSA-N 334.803 1.927 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2ncc3c(n2)CCOC3)c1 858579202 OKUSOSSFZQRLCM-UHFFFAOYSA-N 328.372 1.563 10 10 EDCE CN(C[C@@H]1CCCO1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788933474 VQZMKQYFHWDOBR-KRWDZBQOSA-N 345.443 1.540 10 10 EDCE CS(=O)(=O)Nc1cccc(C(=O)NCc2cc(O)ccc2O)c1 1153879732 WLWLQMZIURJVQO-UHFFFAOYSA-N 336.369 1.399 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H]2CCCNC2=O)cc1C 1319201994 LXNKFTNWHJXTRD-BBRMVZONSA-N 347.459 1.372 10 10 EDCE CN(Cc1ccccc1O)c1nnc(C2CC2)n1Cc1cnnn1C 1314752997 JOEBBSREAUGRKR-UHFFFAOYSA-N 339.403 1.674 10 10 EDCE NC[C@]12CN(Cc3ccc(Br)cc3O)C[C@@H]1CCO2 2118556102 NHMJQSWGPDOSBL-FZMZJTMJSA-N 327.222 1.704 10 10 EDCE C[C@@H](CNC[C@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1322094009 PLTDYHHENQCIRO-NWDGAFQWSA-N 333.392 1.593 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@H](O)[C@H]3C)c(Br)cc21 2126120035 QDDZFTNNQKFSCS-LNCSFIOASA-N 326.194 1.231 10 10 EDCE O=S1(=O)C[C@H]2[C@H](CNCc3c(O)cccc3Br)[C@H]2C1 2117988825 QXIOLUUXQHPBDW-UIKWRGBMSA-N 346.246 1.535 10 10 EDCE O=S1(=O)C[C@H]2C(CNCc3cccc(Br)c3O)[C@@H]2C1 2117988673 QDMGWYGGFXDUMG-QWRGUYRKSA-N 346.246 1.535 10 10 EDCE C[C@@H](C(=O)O)N1CC(NCc2ccc(Br)cc2O)C1 2131772668 YWAUNBGWFQZRPR-QMMMGPOBSA-N 329.194 1.402 10 10 EDCE CN(C[C@@H]1CCCC[C@H]1O)C(=O)C(=O)N1Cc2cccc(O)c2C1 1332019522 QTKZOPSIVKAHKT-DZGCQCFKSA-N 332.400 1.244 10 10 EDCE NC(=O)[C@@H]1CCN(c2ccc(C=CC(=O)O)cc2Br)C1 1911972761 AUFYSLQJVUXNGH-SNVBAGLBSA-N 339.189 1.859 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CNC(=O)c1ccc(Br)cc1 1912150997 BHURXIQFIUOYGO-UHFFFAOYSA-N 340.181 1.948 10 10 EDCE C[C@H](O)CN(Cc1ccccc1)C[C@H](O)COc1ccc(N)cc1 1914616654 FJDYOOJLSGEFNU-YJBOKZPZSA-N 330.428 1.892 10 10 EDCE COC(=O)c1ccc2c(c1)CCN2C(=O)c1c(C)c[nH]c1CC(N)=O 1451922708 CPEYHVHYPVLUMT-UHFFFAOYSA-N 341.367 1.340 10 10 EDCE O=C(C[C@H]1CCNC1=O)Nc1c(-c2ccccn2)nc2ccccn12 1524853977 VGVQHQHGDYJBMA-GFCCVEGCSA-N 335.367 1.861 10 10 EDCE CC(C)OCCN1CC(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1481661116 ALNAXGGUYSDKOG-UHFFFAOYSA-N 347.419 1.936 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2CCNC(=O)C2)cc1C 1485868095 RNOCTHRNZAEQLJ-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE CC(C)n1c(S)nnc1CCNC(=O)Cc1ccc(O)c(O)c1 1633595828 NUGAKTYUYGQYMO-UHFFFAOYSA-N 336.417 1.460 10 10 EDCE COCCN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C(C)C 1725759957 SHYFBMGJXGVISD-UHFFFAOYSA-N 335.408 1.936 10 10 EDCE NC(=O)[C@@]1(c2ccccc2)CCN(C(=O)c2c(F)ccc(O)c2O)C1 1638800888 SSFCDSYEUHGUIP-SFHVURJKSA-N 344.342 1.506 10 10 EDCE Cc1ccc(-c2nnn(CC(=O)N3Cc4cccc(O)c4C3)n2)cc1 1644088153 HUZOVCFPUXXUCM-UHFFFAOYSA-N 335.367 1.897 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(S(N)(=O)=O)o1 1640259931 KASKTXBLJZTFLN-UHFFFAOYSA-N 345.373 1.048 10 10 EDCE Cc1cccc(C)c1OC[C@H](O)CNC(=O)Cc1ccc(O)c(O)c1 1595399744 JDKWGJSDRLHDBX-OAHLLOKOSA-N 345.395 1.813 10 10 EDCE O=C(Cn1ccc(=O)c2ccccc21)NCCc1ccc(O)c(O)c1 156580990 SQAIJUJGQWKDEG-UHFFFAOYSA-N 338.363 1.772 10 10 EDCE CC(C)(C)OC(=O)NCCONCc1cc2c(cc1O)OCO2 1937013130 SYVIRCRXWLHVLF-UHFFFAOYSA-N 326.349 1.667 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)NCCN=[N+]=[N-])OC(C)(C)C1 1965102886 VJAPYZMJZMADFH-JTQLQIEISA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N1CCC(N=[N+]=[N-])CC1 1985094976 XDWHFVDPXZIDPE-UHFFFAOYSA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010406622 WVNSWYDSFMBNEL-UTUOFQBUSA-N 339.396 1.827 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1ccc2c(c1)N(C)C(=O)[C@H]2O 2034790873 WKWKJIWVSDYNEK-SFHVURJKSA-N 339.395 1.449 10 10 EDCE NCc1cc(F)c(N2CCCC[C@@H]2C(N)=O)cc1Br 311407644 JPTQRUYTOOWWAB-LLVKDONJSA-N 330.201 1.891 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CNCc2cccc(F)c2O)[C@@H](O)C1 702811430 RCZJBBFULXAYNR-JSGCOSHPSA-N 340.395 1.849 10 10 EDCE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1c(C)nn(C)c1Br 2197473444 MJSCAYWOAVWCBK-SECBINFHSA-N 345.201 1.995 10 10 EDCE O=C1Nc2cc(N3C[C@H](O)C34CCC4)c(Br)cc2[C@H]1O 2201417316 UJZZNLRBRZTSET-NWDGAFQWSA-N 339.189 1.538 10 10 EDCE CN(C)C(=O)[C@H]1CCCN1c1ccc(CO)cc1Br 2087358213 YRBPIFPCUUWCOG-CYBMUJFWSA-N 327.222 1.998 10 10 EDCE C[C@H](NCc1c(Br)nnn1C)c1c(O)cccc1O 2089352469 MSQXEGQDWFUXLV-ZETCQYMHSA-N 327.182 1.840 10 10 EDCE Cn1nc(Br)cc1CNCCc1ccc(O)c(O)c1 2091757805 BCCOGESOQSPEHH-UHFFFAOYSA-N 326.194 1.926 10 10 EDCE C[C@@H](O)c1ccc(N2CC(=O)N[C@H]3CC[C@H]32)c(Br)c1 2112061630 MKSBVZIASRNGMW-YDEJPDAXSA-N 325.206 1.970 10 10 EDCE OCc1ccc(N2CC[C@@H](C(CO)CO)C2)cc1Br 2114244280 IUEHNAKSNSLNPR-SNVBAGLBSA-N 330.222 1.369 10 10 EDCE OC[C@H](O)[C@H]1CCN1c1ccc(CNC2CC2)c(Br)c1 2286208956 MTVVLQKWTBEWGB-CABCVRRESA-N 341.249 1.633 10 10 EDCE COc1ccc(N2CC[C@H]2[C@@H](O)CO)c(OC)c1Br 2270692704 BVGJECRNCFFYQT-WPRPVWTQSA-N 332.194 1.398 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)[C@H](O)CC2)c(Br)c1 2269122313 BGTCLYPJXVNJFF-QCZZGDTMSA-N 330.222 1.824 10 10 EDCE CC1=NN(c2nc3ccccc3[nH]2)C(=O)C1=CNCCc1cnc[nH]1 2294317152 AIMAJZRTBMINHV-UHFFFAOYSA-N 335.371 1.725 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H](C3)[C@@H]4O)c(Br)cc21 2286234590 DAZLYAGUJLXESX-JJNRPBTQSA-N 338.205 1.218 10 10 EDCE COC(=O)[C@H]1CN(C(=O)/C=C/c2cncc(O)c2)c2ccccc2O1 492521744 RBPINBAYEJCQPY-FYCOFBDGSA-N 340.335 1.768 10 10 EDCE C[C@H]1CN(CCCNC(=O)C=Cc2ccc(O)c(O)c2)C[C@@H](C)O1 2307982078 MQRMIFIJTKWMJN-OKILXGFUSA-N 334.416 1.727 10 10 EDCE O=C1c2cc(O)cc(O)c2C(=O)c2c1cc1c(c2O)[C@@H]2C=CO[C@@H]2O1 5372224 SJNDYXPJRUTLNW-ULCDLSAGSA-N 338.271 1.925 10 10 EDCE biogenic,in-vitro CN(C)c1ccc(CNS(=O)(=O)c2cccc(C(N)=O)c2)cc1 79243626 UDXJSRFFGRMGKF-UHFFFAOYSA-N 333.413 1.330 10 10 EDCE COc1c(C(=O)NCc2ccc(N(C)C)cc2)cnc2c1cnn2C 181644661 WQXWPKJANOZRKB-UHFFFAOYSA-N 339.399 1.973 10 10 EDCE CCn1nc(Br)c(COC(=O)Cc2ccc(N)cc2)n1 2379956027 ISGWJYMKWPETEQ-UHFFFAOYSA-N 339.193 1.929 10 10 EDCE Cc1ccc(CN(C)C(=O)C[C@H](N)C(=O)O)c(O)c1Br 2380759391 NRCPROOGPYHBCY-VIFPVBQESA-N 345.193 1.224 10 10 EDCE COc1ccc(O)c(CN[C@@H]2CCC[C@H]2CNS(C)(=O)=O)c1 800541946 WWAMEKYIKDXJMC-SMDDNHRTSA-N 328.434 1.208 10 10 EDCE CN(CC1CC1)C(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 297708433 CLHAWTLRICHRSD-MRXNPFEDSA-N 346.427 1.768 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CNCCCCF)CC2)cc1 819325458 DFAYKIKNXXQBRV-QGZVFWFLSA-N 339.455 1.517 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)CCCCC(N)=O)C2)cc1 819586768 BVOPVFKWUFJYBZ-AWEZNQCLSA-N 333.432 1.683 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CO[C@H](CCC(=O)O)C1 901605312 QYUXRLGBNMPVQW-GOEBONIOSA-N 334.416 1.981 10 10 EDCE C[C@@]1(C2CCN(Cc3cc4c(cc3O)OCO4)CC2)COC(=O)N1 905705065 LQRKLOXXYHPTLB-KRWDZBQOSA-N 334.372 1.831 10 10 EDCE COc1ccc(N2CCN(C[C@H]3CN(C4CC4)C(=O)O3)CC2)cc1 844267641 IGZSCCSJHDHBAN-KRWDZBQOSA-N 331.416 1.800 10 10 EDCE C[C@H]1CN(CCO)[C@H](C)CN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 841892357 XVZOBZYYENFCCB-MNOVXSKESA-N 343.811 1.841 10 10 EDCE C[C@@H]1COC[C@@H]1N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 688243187 LGPBOFCAWZUQKO-HYJLZEBJSA-N 340.221 1.872 10 10 EDCE COC[C@H](NC(=O)NCc1c(O)cccc1F)[C@H]1CCCOC1 924050558 BQGWHSVSWQGSDQ-FZMZJTMJSA-N 326.368 1.772 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCN(C)[C@H]3C)C2)cc1 923185915 QOKGDINDJIIZGW-GRDNDAEWSA-N 332.448 1.666 10 10 EDCE COC(=O)c1nc(=N[C@H]2CCN(c3ccc(OC)cc3)C2)cc[nH]1 853760337 JSTPBCRXPDWNOV-LBPRGKRZSA-N 328.372 1.385 10 10 EDCE NC(=O)c1cc(F)ccc1N1CCN(Cc2ccccc2O)CC1 857067352 KIKLBLHPQOVQKX-UHFFFAOYSA-N 329.375 1.952 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCC1(C(=O)O)CCC1 851686947 KOWASLBVUADRNI-UHFFFAOYSA-N 348.399 1.502 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCn4ncnc4C3)C2)cc1 854300070 UJBJTOPGFQSBPL-CYBMUJFWSA-N 342.403 1.091 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@@H]2OCCO[C@@H]2C(F)(F)F)c1 866766933 FNWVCAPAOQWGLF-NEPJUHHUSA-N 335.278 1.363 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)c3conc3C)C2)cc1 867496407 CMYZUIMFIGHRCT-LBPRGKRZSA-N 337.401 1.549 10 10 EDCE CN(C)C(=O)Cn1ccc(NC(=O)NCc2c(O)cccc2F)n1 930107570 LONZXPFVBJGWJO-UHFFFAOYSA-N 335.339 1.138 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CNC(=O)c2ccccc21 860697280 RLMYVXPYXBUQIU-XHDPSFHLSA-N 340.379 1.672 10 10 EDCE O=S1(=O)CCc2ccc(S(=O)(=O)Nc3ccc(O)cc3)cc21 776744727 OTEVNNAZAJYSJQ-UHFFFAOYSA-N 339.394 1.523 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C)[C@H](CO)C2)cc1Br 687618104 ALPYUSLICUEPFE-PWSUYJOCSA-N 328.254 1.582 10 10 EDCE CN1CCN(c2cc(Br)c(CN)cc2F)CCC1=O 688929790 DGACWFGSQXPXHZ-UHFFFAOYSA-N 330.201 1.715 10 10 EDCE Cc1oc(C(=O)NCc2cc(Cl)ccc2O)cc1S(N)(=O)=O 1300396343 OSLWFOXPGSONTK-UHFFFAOYSA-N 344.776 1.524 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@H](OCc2ccccn2)C1 1150052764 KCHHTTVAALOQEP-HNNXBMFYSA-N 328.368 1.853 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cccn2c(O)nnc12 1162607436 QJDKVAMEBKLHNI-UHFFFAOYSA-N 335.323 1.619 10 10 EDCE CC(C)[C@@H]1CNC(=O)CN1c1ccc(CN)cc1Br 2124752757 YYIPIWJOSHZFAY-ZDUSSCGKSA-N 326.238 1.869 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC(=O)NCC(C)C)C2)cc1 1327882950 XPIXIDGFDVYHHJ-AWEZNQCLSA-N 348.447 1.345 10 10 EDCE CN1CCN(c2ccc(CN3C[C@@H]4C[C@H]3C[S@]4=O)cc2F)CC1 1332609619 BRRYIZGXGYPYRF-XAPDGSRCSA-N 337.464 1.283 10 10 EDCE COC1CC(CCNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 1330498446 BMOLLBGGLCTEGI-UHFFFAOYSA-N 347.459 1.609 10 10 EDCE CC[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)[C@H](CC)CO1 1332075257 VRKGAPZEVUIQMV-KGLIPLIRSA-N 332.400 1.650 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2ccn(C)n2)cc1C 1276386839 PGIAVNYRUICBGQ-UHFFFAOYSA-N 330.432 1.989 10 10 EDCE Cc1cc(C)n(CC(=O)NCc2ccc(N3CCCC3)cc2)c(=O)n1 1441186687 NAEXQWOOJBJOGH-UHFFFAOYSA-N 340.427 1.777 10 10 EDCE CCOC(=O)c1[nH]cnc1CNC(=O)/C=C\c1ccc(O)c(O)c1 1456398734 HMPWHRYHWZXXCC-XQRVVYSFSA-N 331.328 1.327 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1ccc(N2CCOCC2)nc1 1539719197 WDHAMAUJFFOANT-UHFFFAOYSA-N 343.383 1.188 10 10 EDCE CC[C@@H](CNC(=O)c1cn(CC)nn1)NCc1ccc(OC)c(C)c1 1481864527 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337.420 1.815 10 10 EDCE CC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(CO)c(Br)c1 1877075571 ACPSMTXJJOWUAB-STQMWFEESA-N 325.206 1.751 10 10 EDCE CC(C)(C)OC(=O)N1CCSC[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980379032 ZRUGKJRCXRPRCV-SRVKXCTJSA-N 342.461 1.605 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CS(=O)(=O)C[C@@H]1Oc1ccc(N)cc1 1992470268 IWNPANFEWJNOEZ-STQMWFEESA-N 342.417 1.338 10 10 EDCE C[C@H]1C[C@H]2CN(c3ccc(CO)cc3Br)CCN2C1=O 2181181925 KFQDTLCTIVKBBT-JQWIXIFHSA-N 339.233 1.998 10 10 EDCE C[C@H](N)c1ccc(N2CC(OCC(N)=O)C2)c(Br)c1 2089135528 OERNMPKLNVIMCR-QMMMGPOBSA-N 328.210 1.159 10 10 EDCE COCCN1CCN(c2ccc(CN)c(Br)c2)CC1 2098505192 VFHKVMNNZIDTCL-UHFFFAOYSA-N 328.254 1.676 10 10 EDCE CN(CCN1CCCC1=O)c1ccc(CN)c(Br)c1 2114622268 NLIWOEOYVZUPKQ-UHFFFAOYSA-N 326.238 1.966 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@@H](O)CCN1C(=O)OC(C)(C)C 2300526392 RXMGSIDPHAWXPD-NWDGAFQWSA-N 341.412 1.906 10 10 EDCE CSC[C@H](N)C(=O)NCc1ccc(C)c(Br)c1O 2327591578 KLXSKHCFBVPHSK-VIFPVBQESA-N 333.251 1.770 10 10 EDCE Cc1ccc(CN2C[C@H](N)[C@@H]3COC[C@H]32)c(O)c1Br 2352674872 ABAXBHIZBQBMQE-SDDRHHMPSA-N 327.222 1.621 10 10 EDCE Cc1cc(N2CCC[C@H](NCc3ccc4c(c3)CCO4)C2=O)n(C)n1 173849703 HWABERQUWBIZCY-INIZCTEOSA-N 340.427 1.949 10 10 EDCE CN(C)S(=O)(=O)c1ccc(CNC(=O)Cc2ccc(N)cc2)cc1 178427002 CTLXKCCEJIJDHA-UHFFFAOYSA-N 347.440 1.378 10 10 EDCE C[C@@H](N[C@@H]1CCc2ncnn2C1)c1ccc(N2CCOCC2)c(F)c1 180605711 MTPZMFFPUSTZKR-UKRRQHHQSA-N 345.422 1.919 10 10 EDCE O=C(CCCNC(=O)c1ccco1)NCCc1ccc(O)c(O)c1 122014386 NEZDRHRDZJHEJN-UHFFFAOYSA-N 332.356 1.560 10 10 EDCE N#Cc1cccc(CS(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c1 320169932 MLHHTYZZQIXCDO-UHFFFAOYSA-N 332.337 1.904 10 10 EDCE CCCCS(=O)(=O)N1CCN(c2ccc(OC)c(OC)c2)CC1 41379826 YWHLZIZVTWEWEG-UHFFFAOYSA-N 342.461 1.956 10 10 EDCE c1cc(N2CCOCC2)ccc1CN[C@H]1CCO[C@]2(CCOC2)C1 371407475 QJUGUYRFKJHZRN-PKOBYXMFSA-N 332.444 1.951 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1 808521775 DCMOLGGIDXHNDF-LLVKDONJSA-N 347.396 1.609 10 10 EDCE O=[N+]([O-])c1cc(NS(=O)(=O)CCOCC(F)(F)F)ccc1O 811695657 BWZJOQCTWFIORE-UHFFFAOYSA-N 344.267 1.621 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](O)C3CCOCC3)C2)cc1 819584115 DIJIIKQSJNVXCO-KSSFIOAISA-N 348.443 1.425 10 10 EDCE COc1ccc([C@]2(C(=O)NCc3ccc(O)c(O)c3)C[C@H](O)C2)cc1 901132129 QIYQAOWIAHQVEB-QUWSVYMGSA-N 343.379 1.815 10 10 EDCE NC[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)C(F)(F)F 848594668 FQSIZRWXKJTBEY-ZDUSSCGKSA-N 346.353 1.212 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NCC[C@]2(O)CCOC2)cc1 844899135 UAMDWBKARNCKEB-SFHVURJKSA-N 335.448 1.874 10 10 EDCE COc1cccc(CNC(=O)NC[C@@H]2CN(C3CC3)C(=O)O2)c1O 847458589 JRJZXUMZIYOIHM-GFCCVEGCSA-N 335.360 1.183 10 10 EDCE Cc1cc(N(C)C)ccc1CN1C(=O)N[C@H](CCC2OCCO2)C1=O 924671853 NIIUHRDWBGOUHY-OAHLLOKOSA-N 347.415 1.635 10 10 EDCE COCc1n[nH]c(CNCc2cc(Br)ccc2O)n1 850360510 KFMXGXTXDNDMMC-UHFFFAOYSA-N 327.182 1.709 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C3CN(CC(F)F)C3)C2)cc1 855223170 CCPJPTPGJRNEIK-ZDUSSCGKSA-N 339.386 1.587 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@H](N)COC(C)C)CC2)cc1 851630802 RUJFBGRXUGFVSM-KRWDZBQOSA-N 335.448 1.533 10 10 EDCE CCNC(=O)[C@@H](C)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 851947353 ZNDOLPYXTAKFBI-CHWSQXEVSA-N 334.420 1.098 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnc(N(C)C)cn3)C2)cc1 855233645 JWZBYHLBODOWCA-ZDUSSCGKSA-N 341.415 1.560 10 10 EDCE CO[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCOC1 856208209 AJGPYJFXOYQLHD-MAUKXSAKSA-N 348.443 1.315 10 10 EDCE O=C(O)[C@H]1CCN[C@H]1c1cc(I)ccc1O 1952825444 KCMJODIUCVVIJU-OIBJUYFYSA-N 333.125 1.732 10 10 EDCE NC(=O)c1ccc(CC(=O)NCc2c(O)ccc3c2CCCC3)cn1 860242594 AQIVFXLPXHFFNV-UHFFFAOYSA-N 339.395 1.624 10 10 EDCE O=C1CC[C@@]2(C(=O)NCc3ccc4cccnc4c3O)SCCN12 862028522 BRIGGYZCXDTFQI-KRWDZBQOSA-N 343.408 1.622 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCC[C@@H]2NCC[C@H]21 868420401 VXOYSRZGAXOIAP-DLBZAZTESA-N 344.459 1.064 10 10 EDCE COc1ccc(N2CCN(c3nc(C)nc(N)n3)CC2)c(OC)c1 866137559 BLTCKUJLROQCKR-UHFFFAOYSA-N 330.392 1.106 10 10 EDCE COc1ccc(O)c([C@@H](C)NCC(=O)NC2CCN(C3CC3)CC2)c1 775376393 VTVXPUFDNXYZLO-CYBMUJFWSA-N 347.459 1.794 10 10 EDCE CCOC(=O)[C@H]1CSCN1C(=O)c1ccc(N=NC(N)=O)cc1 1139946694 HHZJQWSPPLYNBY-LLVKDONJSA-N 336.373 1.927 10 10 EDCE C[C@H](C(=O)Nc1ncccc1O)[C@@H](C)NC(=O)c1cccc(O)c1O 1306836930 FYBOEVMJGQAUPH-VHSXEESVSA-N 345.355 1.592 10 10 EDCE C[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@@H](C2CC2)O1 1335602137 KHNXTWIOWDRYQR-ZBEGNZNMSA-N 330.384 1.260 10 10 EDCE CCCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)C1CCNCC1 1332127620 IXURAUVCSXKBBU-UHFFFAOYSA-N 331.416 1.225 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@H]2CCC2(C)C)cc(OC)n1 1354653989 JJIJPQOZOZHVMF-DGCLKSJQSA-N 349.431 1.770 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)C1CC2(C1)CS(=O)(=O)C2 1528409995 QRYBHDRQHBXGND-UHFFFAOYSA-N 344.429 1.319 10 10 EDCE O=C(NCCCNC(=O)c1c(F)ccc(O)c1O)c1ccccc1 1457747113 DIVLQIHLLNIPMY-UHFFFAOYSA-N 332.331 1.787 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@]1(C)C[C@@H](O)CN1C 1540567385 KNGQQJFOMJHVAJ-IEBWSBKVSA-N 331.460 1.700 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2nonc2C)cc1C 1714456810 FBVJDSZSFGRGNW-LLVKDONJSA-N 332.404 1.851 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N(CC)CCO)c(Br)cc21 118711785 BPWJJWNXCXYKOZ-CYBMUJFWSA-N 342.237 1.870 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2ccc(O)nn2)cc1C 1725485507 ZPHCHDBTLLPLBC-ZDUSSCGKSA-N 344.415 1.750 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@]2(C)CCC(=O)N2)cc1C 1497903558 YCDPIMLCSIFKFF-ACJLOTCBSA-N 333.432 1.267 10 10 EDCE Cc1ccc(C(=O)N2CC[C@@H](C(=O)Nc3cn[nH]c3)C2)c(O)c1O 1641140762 GJVUDTNHPSZWBE-SNVBAGLBSA-N 330.344 1.230 10 10 EDCE CC(C)OCCNC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1733025540 ZRUUBFREZVDRSE-LBPRGKRZSA-N 335.408 1.982 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)CC(C)C)C2)cc(OC)n1 1578752418 ISPCOMUVGCFZNZ-BETUJISGSA-N 335.404 1.522 10 10 EDCE CN(CCCNC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)C(F)F 1758396626 WIGQNNPINXIETF-UHFFFAOYSA-N 341.318 1.692 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)CCS(C)(=O)=O)c([N+](=O)[O-])c1 1772826015 BIVZVIHBACGDGK-ALCCZGGFSA-N 342.373 1.262 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3nc[nH]n3)CCCC2)cc1C 1698807406 NCWRXHDFNLHFDV-UHFFFAOYSA-N 343.431 1.954 10 10 EDCE CCNCc1ccc(N2C[C@H](N(C)C)[C@H](O)C2)cc1Br 2146148307 AKXYBGXTUOUCSC-LSDHHAIUSA-N 342.281 1.670 10 10 EDCE C[C@H](O)c1ccc(N2CCOC[C@@H]2[C@H](O)CO)c(Br)c1 2146324178 SPLWICDAIJUXLB-CUOATXAZSA-N 346.221 1.061 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)c(Br)c2F)[C@H]2COC[C@H]12 2158361611 JODOSNFQQSJEND-ZMLRMANQSA-N 345.212 1.897 10 10 EDCE CCNCc1ccc(N2CC[C@@](O)(CO)C2)cc1Br 314156947 KCQWQSLBZVEFOX-AWEZNQCLSA-N 329.238 1.492 10 10 EDCE C[C@@H]1C[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 705142668 ULSTUDONQMROKB-OTPXZMOZSA-N 341.205 1.784 10 10 EDCE CC[C@@H](NCCc1nn[nH]n1)c1cc(Br)ccc1O 388702908 FWTLAVPUOWWEER-SNVBAGLBSA-N 326.198 1.951 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3Cc4ccccc4N(C)C3)c2n1 2063208940 RAVBKIOQLUQWQR-ZDUSSCGKSA-N 337.383 1.534 10 10 EDCE COCCNCc1ccc(N2CC=C[C@@H]2CO)c(Br)c1 2176342874 IYVSTEUBDLSZSJ-CYBMUJFWSA-N 341.249 1.922 10 10 EDCE CNCc1ccc(N2CC[C@@H](OCCO)C2)c(Br)c1 2109109780 MOQBSSJSNZPUIS-GFCCVEGCSA-N 329.238 1.756 10 10 EDCE NCc1ccc(N2CC[C@H]3CS(=O)(=O)C[C@H]32)cc1Br 2094931376 SEDHOFXXVACELD-GXFFZTMASA-N 345.262 1.531 10 10 EDCE CN(CCN1CCCC1=O)c1ccc(CO)cc1Br 2114619220 HFUGVWVAMSFLCM-UHFFFAOYSA-N 327.222 2.000 10 10 EDCE Cn1nc(Br)c(CNCc2ccc(F)c(F)c2O)n1 2226965470 FYAGKRZDFSQSIT-UHFFFAOYSA-N 333.136 1.851 10 10 EDCE OCc1ccc(N2C[C@@H]3OCC[C@@]3(CO)C2)cc1Br 2278878480 JPKQOQYOZUAOTF-KBPBESRZSA-N 328.206 1.529 10 10 EDCE COc1ccc(NC=C2C(=O)NC(=O)N(C[C@@H]3CCCO3)C2=O)cc1 2297317927 KRFQNBVPPAIKLX-ZDUSSCGKSA-N 345.355 1.248 10 10 EDCE Cc1ccc(CNCCc2cnnn2C)c(O)c1Br 2352679049 HYUFTYXOGQFIQL-UHFFFAOYSA-N 325.210 1.924 10 10 EDCE Cc1nc(CC(=O)N2CCc3cc(N4CCOCC4)ccc32)no1 62526609 IDSJOXBGDDZDFM-UHFFFAOYSA-N 328.372 1.346 10 10 EDCE O=C(O)CNC(=O)CCN1C(=O)/C(=C\c2ccco2)SC1=S 210702702 PNJLYHNLXBKZTI-RMKNXTFCSA-N 340.382 1.072 10 10 EDCE CCOC(=O)C1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 327387422 XHFNLJRVADEIDA-UHFFFAOYSA-N 349.343 1.705 10 10 EDCE Cc1ccc(CNC(=O)[C@]2(C)CNCCO2)c(O)c1Br 2381139849 BSJCJOJNXXMXQU-AWEZNQCLSA-N 343.221 1.458 10 10 EDCE CO[C@@H](CCN)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951836400 YTUWJJGKJXXXHL-DOMZBBRYSA-N 340.420 1.897 10 10 EDCE CC1(C)C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CO1 827159177 YOSVIWOFYQIMFF-OAHLLOKOSA-N 345.443 1.587 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2c3n(c(=O)n2C)CCCC3)c1 825736992 OZEOXBOYFYLVAF-LLVKDONJSA-N 345.399 1.728 10 10 EDCE CN1CCN(c2ccc(CNC(=S)NC[C@@H]3CCCO3)cc2)CC1 905528647 GWNHZVNDLXKRDW-KRWDZBQOSA-N 348.516 1.582 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)C3CCC3)C2)cc1 828309573 LEUCQCXDTYWRRN-ZFWWWQNUSA-N 345.443 1.695 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1C[C@H](C)CO1 901326007 CZKANEFKHBMUAI-HZMBPMFUSA-N 341.791 1.972 10 10 EDCE CC(=O)C(=O)COC(=O)[C@](C)(O)c1ccc(F)c(Br)c1 909940386 UBTKHWTZTHAVOF-CYBMUJFWSA-N 347.136 1.497 10 10 EDCE COc1cccc(CNS(=O)(=O)CC2(OC)CCOCC2)c1O 845870024 KTFVZWWBOCYQNO-UHFFFAOYSA-N 345.417 1.016 10 10 EDCE O=C(c1cc(O)cs1)N1CCN(c2cccc3nc(O)[nH]c23)CC1 928925136 IJKWOKRPXCHHFS-UHFFFAOYSA-N 344.396 1.998 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1c(O)cccc1F)[C@@H]1CCOC1 921450607 BNZSXYZDNRZEOK-QMTHXVAHSA-N 333.381 1.002 10 10 EDCE COc1ccc(N2CCC(NC(=O)N3CC4CC3(CN)C4)CC2)cc1 851656563 LWJXIGXWVIAIED-UHFFFAOYSA-N 344.459 1.797 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](O)CC[C@@H]3C)C2)cc1 852448161 HAMGFWKPKYOZBF-DZKIICNBSA-N 333.432 1.829 10 10 EDCE CCOc1ccc(O)c(CNCCS(=O)(=O)CC(F)(F)F)c1 850363569 AEMBOKYRCHCQKI-UHFFFAOYSA-N 341.351 1.858 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2C[C@H]3[C@H]4CC[C@@H](NC4)[C@H]3C2)c1O 863650895 BOGOOWPUXSWCIW-DOERSZECSA-N 333.388 1.739 10 10 EDCE O=C(Nc1ccc2c(c1)CNCC2)C(=O)N1Cc2cccc(O)c2C1 868299625 KIQGDDSJWAGDMP-UHFFFAOYSA-N 337.379 1.519 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)Cc1nnnn1C(C)(C)C 766106359 GWKPWAHHNMRWPI-UHFFFAOYSA-N 344.463 1.897 10 10 EDCE COC(=O)C(=O)[C@H](C)OC(=O)c1cc(C)n(-c2ccccn2)c1C 778297149 IGXODAQNVOBECA-LBPRGKRZSA-N 330.340 1.777 10 10 EDCE OCc1nnn2c1CN(Cc1ccc(N3CCCCC3)cc1)CC2 894802287 CFPNOZHXBJDPID-UHFFFAOYSA-N 327.432 1.777 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)Nc2ncn(C(C)(C)C)n2)cc1 784621394 PHOVUFAESCHNOV-UHFFFAOYSA-N 344.419 1.354 10 10 EDCE O=S(=O)(NCc1cc(Br)ccc1O)[C@H]1CCOC1 796191231 RIKZHSZYJXVDCZ-JTQLQIEISA-N 336.207 1.363 10 10 EDCE COC(=O)C[C@H]1CSCCN1C(=O)Cc1ccc(O)c(O)c1 1147844186 YEJRZPJSIQXTMW-NSHDSACASA-N 325.386 1.147 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)NC[C@H]3C[C@H]3C)CC2)cc1F 1321886463 VFGUOSWZNASCEH-CHWSQXEVSA-N 349.406 1.255 10 10 EDCE CCNCc1ccc(N2CC(=O)NC[C@H]2C)cc1Br 2124762457 RDWNAAICYHEKOL-SNVBAGLBSA-N 326.238 1.883 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)cc1Br 2126160788 CSZXIXDJKICSJB-DJBIQUGXSA-N 327.222 1.086 10 10 EDCE CON(CC1CCOCC1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329415102 ZSTRMDLFTGNZJW-UHFFFAOYSA-N 334.372 1.051 10 10 EDCE CN1C[C@H](N(C)c2ccc(CO)cc2Br)CCC1=O 2131954836 IBGHFDIAOZDNEF-LLVKDONJSA-N 327.222 1.998 10 10 EDCE C[C@H]1CN(CCO)[C@H](C)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1451746580 RYURYHOSLVEYRF-NEPJUHHUSA-N 333.392 1.376 10 10 EDCE O=C(NCc1cccc(Cl)c1O)c1ccc(-n2cnnn2)cc1 1606861019 WKEBZSFFPBYBKW-UHFFFAOYSA-N 329.747 1.951 10 10 EDCE C[C@H](O)[C@H]1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 226456298 OVADIXOZUJYCPR-UVPNAGLESA-N 340.221 1.608 10 10 EDCE C[C@H]1COCCN1CCN[C@H](C)c1ccc(N2CCOCC2)cc1 1559709877 UQLBQRZRTIXXRA-DLBZAZTESA-N 333.476 1.895 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H](CO)NC/C=C\Cl)cc1 1717785051 RZURYSVSCKOMIO-YSZAJKDKSA-N 339.783 1.282 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccnc(O)c1 1557114228 LGRTXRPTHZVKDP-UHFFFAOYSA-N 330.340 1.698 10 10 EDCE O=C(CCc1nn[nH]n1)N(Cc1ccccc1O)C[C@H]1CCCO1 1636951588 UOJNZFHUKRCVBH-CYBMUJFWSA-N 331.376 1.046 10 10 EDCE O=C(c1nnc(O)nc1O)N(Cc1ccco1)Cc1ccccc1O 1566303020 UOFHPNFGSWCTLH-UHFFFAOYSA-N 342.311 1.424 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2CC[C@@H]2C(N)=O)cc1C 1670205345 WZUKIZHGIBCHRI-JKSUJKDBSA-N 347.459 1.453 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccnc(C)c2)cc1C 1676592444 LNIRSNIENOPTPP-QGZVFWFLSA-N 343.427 1.588 10 10 EDCE CCn1cc(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)nn1 1774042904 RWSOUQVYIRBVQI-CYBMUJFWSA-N 331.420 1.523 10 10 EDCE CC(=O)N1CCN(c2ccc(OCC3(O)CCOCC3)cc2)CC1 153179896 QTWXJNZEKODHIP-UHFFFAOYSA-N 334.416 1.275 10 10 EDCE CCOCCOCCOC(=O)CNCc1cccc(OCC)c1O 1857872576 RDBYWUBXQWKJMQ-UHFFFAOYSA-N 341.404 1.477 10 10 EDCE CC(C)(C)OC(=O)N1CCC12CN(C(=O)c1cccc(O)c1O)C2 1965287352 UJVDTRUFJYYRIH-UHFFFAOYSA-N 334.372 1.933 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC(N=[N+]=[N-])CC1 1985102625 JTMPQCWQBQTIPW-KOLCDFICSA-N 327.385 1.562 10 10 EDCE COc1ccc(O)c(CNC[C@](C)(CO)NC(=O)OC(C)(C)C)c1 2010530168 OBFGDCJDJLWTJW-QGZVFWFLSA-N 340.420 1.766 10 10 EDCE CCNCc1ccc(N2CCC[C@](O)(CO)C2)cc1Br 314375275 LDGBEOUZKVRRFS-OAHLLOKOSA-N 343.265 1.882 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H](C4(C)OCCO4)C3)c2n1 2063493682 IZWKHHRSFKKZEY-LBPRGKRZSA-N 346.387 1.359 10 10 EDCE C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)CC[C@@H]1NC(=O)C(F)(F)F 2044627196 PNPHLKQVWPZQSI-MFKMUULPSA-N 343.349 1.727 10 10 EDCE CCNCc1ccc(N2C[C@H](O)C[C@@H](O)C2)cc1Br 2105075575 UDDOZJZUTQXTER-CHWSQXEVSA-N 329.238 1.491 10 10 EDCE C[C@@H](O)c1ccc(N2CCOC[C@H](CO)C2)c(Br)c1 2098242053 GYXXACHGURBJIG-MNOVXSKESA-N 330.222 1.948 10 10 EDCE C[C@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CC[C@@H]1O 2310369560 OZZWVAHJNLHLPE-YJBOKZPZSA-N 330.428 1.766 10 10 EDCE O=C(O)CCN(CCCO)Cc1ccc(Br)cc1O 2342673290 RHKGWYKQRBSFMQ-UHFFFAOYSA-N 332.194 1.814 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@H](CO)[C@@H](CCO)C1 1348569802 FUDXZTWZIOOFAE-DLBZAZTESA-N 345.443 1.195 10 10 EDCE O=C1CCc2cc(N3CCN(C(=O)c4cccnc4)CC3)ccc2N1 39429349 IBYIWCBPTKBYJA-UHFFFAOYSA-N 336.395 1.929 10 10 EDCE O=C(Cc1cncnc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 278774464 GYOMHQAVSPXUAS-INIZCTEOSA-N 327.384 1.933 10 10 EDCE CCc1c(-c2ccncc2)n[nH]c1NC(=O)C1=S=c2cc[nH]c2=C1 368440231 BFNAYYKWIBCPAO-UHFFFAOYSA-N 337.408 1.951 10 10 EDCE COc1ccc(N2CCN(Cc3nnc4n3CCOC4)CC2)cc1 280984591 DIQDRVNSTMRCNQ-UHFFFAOYSA-N 329.404 1.139 10 10 EDCE CC1CCN(c2ccc(CNC(=O)C(=O)N(C)CCCO)cc2)CC1 288289566 VISDIDBKUPVLOH-UHFFFAOYSA-N 347.459 1.380 10 10 EDCE C[C@@H]1CCN(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c2ccccc21 132554068 VKQXOPODMWPTEQ-MMQHEFTJSA-N 339.395 1.638 10 10 EDCE COC(=O)c1cnc(CNC(=O)NCc2ccc(N(C)C)cc2)s1 902893369 XYQHYBIZTSNVID-UHFFFAOYSA-N 348.428 1.995 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](O)C1CCC1 828519023 AZIPEOVHDPBMCE-HNNXBMFYSA-N 341.791 1.708 10 10 EDCE C[C@](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)(C(=O)O)C1CC1 588592708 UCKWCHJPEFKMTF-ZONXLDJSSA-N 344.411 1.906 10 10 EDCE Fc1cc(CNC[C@H]2CNCCC2(F)F)ccc1N1CCOCC1 903954510 CZCDKKOAOYUMEF-CQSZACIVSA-N 343.393 1.997 10 10 EDCE CN1CCCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1=O 588556535 PDWQLCHNQKHWFB-YVMONPNESA-N 343.427 1.227 10 10 EDCE NC[C@@H](NC(=O)NCc1ccc(N2CCCC2)cc1)C(F)(F)F 848595564 LXJDNKAIANSZMF-CYBMUJFWSA-N 330.354 1.976 10 10 EDCE NC(=O)C1CCN(c2ccc(CN[C@@H]3CN4CCC[C@H]3C4)cc2)CC1 926872347 DIRRFKYRAHVOOA-PKOBYXMFSA-N 342.487 1.572 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCc4nccn4C3)C2)cc1 855223889 CMQDFCHSWOIXSH-HUUCEWRRSA-N 340.427 1.849 10 10 EDCE COc1ccc(N2CCC(N[C@@H](CO)c3ccnn3C)CC2)cc1 858434443 HAMAKDVGRGZFQR-KRWDZBQOSA-N 330.432 1.721 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CC[C@@](CO)(C(F)(F)F)C1 924456089 KZOIUOWHBTWOJN-CTGSTSKSSA-N 331.290 1.884 10 10 EDCE CC(=O)C(=O)COC(=O)C(F)(F)c1ncccc1Br 923395141 JBRDKYRHRXDFNK-UHFFFAOYSA-N 336.088 1.637 10 10 EDCE CCCn1cc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)nn1 855234101 SCYVJZIQKJSJOS-ZDUSSCGKSA-N 329.404 1.705 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@@H](O)C(F)(F)C2)c([N+](=O)[O-])c1 853802791 GUNIYOJFUPFCPF-HSBHDXMMSA-N 342.298 1.987 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)CC3(C)COC3)C2)cc1 858597970 AFJDOPCRILYJRS-AWEZNQCLSA-N 333.432 1.952 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1nnnc1N1C[C@H]2C[C@@H]2C1 1334522848 FENNOHMUNMOHBZ-HUUCEWRRSA-N 326.404 1.014 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCN=[N+]=[N-])C[C@@H]2OCC[C@@H]21 1895875507 KMXPWEOKBORWQG-DCAQKATOSA-N 325.369 1.580 10 10 EDCE CN1CCN(c2ccc(CN3C[C@]4(C)CNC[C@]4(C)C3)cc2)CC1 863651836 NGSCOQCGGBPUJG-BGYRXZFFSA-N 328.504 1.870 10 10 EDCE CN(C)c1ccc(/C=C\CN[C@@H](Cc2ncccn2)C(=O)O)cc1 1119550779 YQUZTNDQTQMRIZ-IMMZDGJCSA-N 326.400 1.841 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CO[C@H](CCC(=O)OC(C)(C)C)C1 884995672 YKZAOCNAGGWMPW-VXGBXAGGSA-N 328.361 1.215 10 10 EDCE CO[C@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)C(=O)OC(C)(C)C 1138152999 VJYPVNYFGLAGHR-QMTHXVAHSA-N 339.388 1.502 10 10 EDCE C[C@H]1CO[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 895786989 IMBQMGFLBFYWKG-SJKOYZFVSA-N 336.407 1.828 10 10 EDCE O=C(CCC(F)F)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 793127709 WDRKXAJJVSMPAR-UHFFFAOYSA-N 346.399 1.583 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2C(C)(C)C2(F)F)cc1 1327899884 ILLQLRCJLQRYAW-CYBMUJFWSA-N 339.386 1.776 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCc1nnn(C)n1 1248372801 IPCTVOLPNUVSCD-UHFFFAOYSA-N 329.408 1.152 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCO[C@H](C)CC1 1332866558 MEARXZIMXSBZCH-CQSZACIVSA-N 333.432 1.315 10 10 EDCE NCc1ccc(N2CC[C@H](N3CCOCC3)C2)c(Br)c1 212982305 VSSBPTFSGRZBAQ-ZDUSSCGKSA-N 340.265 1.819 10 10 EDCE O=C(CNC(=O)c1ncccc1O)NCc1cccc(Cl)c1O 1457037683 RONNNROEGCCJPI-UHFFFAOYSA-N 335.747 1.192 10 10 EDCE COC(=O)[C@H](CNC(=O)Cc1ccc(O)c(O)c1)Cc1ccncc1 1293052014 PMVGGLYTRKPVBD-AWEZNQCLSA-N 344.367 1.183 10 10 EDCE CC(C)CN1C[C@@H]2C[C@H](O)CN2C2(C1)CN(Cc1ccccc1O)C2 1615258760 YKQDCROYABYQEE-ROUUACIJSA-N 345.487 1.353 10 10 EDCE CC[C@H](CNC(=O)Cc1nnc(C)o1)NCc1ccc(OC)c(C)c1 1715059557 WYYNNTJCFXMSSZ-OAHLLOKOSA-N 346.431 1.922 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cc(=O)n(C)cn2)cc1C 1483136916 HDPMQTYVNJXCIW-CYBMUJFWSA-N 344.415 1.005 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)Cc1c(O)ncnc1O 1639522736 SLEOYWHHVLQEEC-UHFFFAOYSA-N 331.372 1.965 10 10 EDCE C[C@H]1[C@H](NCCCO)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1725575436 QBSMOSJODREXTL-SMDDNHRTSA-N 333.392 1.424 10 10 EDCE COc1ccc(CNCC[C@@H]2CCN(C(=O)c3cnn[nH]3)C2)cc1C 1569988810 VQBQMYPSPGIGNJ-CQSZACIVSA-N 343.431 1.764 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCc1ncc2c(n1)CCOC2 1644499684 VUCZFBRAULRCBO-DUXPYHPUSA-N 327.340 1.290 10 10 EDCE Cc1cnn(-c2c(C(=O)NCc3cc(O)ccc3O)c(C)nn2C)c1 1643882368 TVZXRWUJSHCBQE-UHFFFAOYSA-N 341.371 1.564 10 10 EDCE O=C(NCc1c(O)cccc1O)c1c[nH]c(C(=O)N2CCCC2)c1 1652622749 HPPXOWNJSNBJCT-UHFFFAOYSA-N 329.356 1.592 10 10 EDCE CN(CCO)C[C@@H]1CCCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1750930546 RWPLDGFYOSNPIH-HNNXBMFYSA-N 347.419 1.768 10 10 EDCE CC[C@@H]1C(=O)NC(=O)CN1c1ccc(CN)c(Br)c1F 231840251 VQOBKWZHBOMVRQ-MRVPVSSYSA-N 344.184 1.288 10 10 EDCE O=C1C[C@@]2(CCN(Cc3ccc(Br)cc3O)C2)CN1 825732003 NKUNLONAHWALJZ-AWEZNQCLSA-N 325.206 1.867 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985103523 WOBHEIPIDHXTCS-NXEZZACHSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CN(CCCN=[N+]=[N-])CCN2C1=O 2006170761 OJHBKNUTMZVBPM-VXGBXAGGSA-N 338.412 1.497 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010390599 GFETZEMKBDWKKE-RYUDHWBXSA-N 340.428 1.600 10 10 EDCE CNCc1ccc(N(C)C[C@H]2CN(C)CCO2)c(Br)c1 707887541 UOSRITSTIODOJD-CYBMUJFWSA-N 342.281 1.935 10 10 EDCE NCc1cc(F)c(N2CCSC[C@@H]2CO)cc1Br 387813330 SXNQKGRJEDQZGQ-VIFPVBQESA-N 335.242 1.961 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC(F)(CO)C3)c(Br)cc21 2172924717 MBGJSJRTICHTSN-LLVKDONJSA-N 344.184 1.182 10 10 EDCE Cc1nn(C)c(CNC(=O)Cc2ccc(N)cc2)c1Br 2192416648 GNIZJJLHMMWAHJ-UHFFFAOYSA-N 337.221 1.932 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@@]2(CO)CO3)c(Br)c1 2094652656 CSKRJQUDOUGMSS-BXUZGUMPSA-N 327.222 1.509 10 10 EDCE CCN(Cc1ccc(Br)cc1O)[C@@H]1CC(=O)NC1=O 2114731496 DOMRNPDHDXVNSE-SNVBAGLBSA-N 327.178 1.392 10 10 EDCE CCN(c1ccc(CN)cc1Br)[C@H]1CC(=O)NC1=O 2114736292 YVLHTXAJBVFCSI-NSHDSACASA-N 326.194 1.149 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCc1cc(Br)no1 2237096782 ZZIUEUTZWVFFBX-UHFFFAOYSA-N 341.161 1.750 10 10 EDCE N[C@@H]1CCCC[C@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2301609943 LYLIOVGNDUYQSF-QZTJIDSGSA-N 329.444 1.923 10 10 EDCE Cc1ccc(CNCCNS(C)(=O)=O)c(O)c1Br 2327802426 YZDHEYQYNZTUKP-UHFFFAOYSA-N 337.239 1.102 10 10 EDCE Cc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)c(O)c1Br 2352650240 SCDOAJPRMARKOK-URLYPYJESA-N 325.206 1.626 10 10 EDCE CNC(=O)C1CCC(NC(=O)NCc2ccc(N(C)C)cc2)CC1 63321071 GIHJJIIRNDFOIT-UHFFFAOYSA-N 332.448 1.857 10 10 EDCE Nc1ncncc1C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 185444359 WGFMKYYLVLMDTR-ZDUSSCGKSA-N 328.372 1.586 10 10 EDCE O=S(=O)(CCN1CCCC1)NCc1ccc(N2CCCC2)cc1 192494372 XGFODLGRUFTICB-UHFFFAOYSA-N 337.489 1.802 10 10 EDCE COCCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 92010815 VVMHCISLYHQYBB-UHFFFAOYSA-N 331.460 1.871 10 10 EDCE CCCC(=O)NCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 98093918 NJNDQONOXOYYQJ-UHFFFAOYSA-N 347.459 1.428 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccnnc1 269205469 TXGQDOGIEXUOSH-UHFFFAOYSA-N 330.363 1.507 10 10 EDCE CS(=O)(=O)CC[C@@H]1CCCCN1Cc1cc2c(cc1O)OCO2 366533635 IFZJWYQKVINACS-ZDUSSCGKSA-N 341.429 1.910 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3C[C@@H]4CCC[C@H](C3)C4O)cc2N1 370540850 YBMIYSRHZCHILK-BDTYORIJSA-N 333.344 1.523 10 10 EDCE Cc1ccc(C(=O)N2CCOC[C@H]2c2c(C)nn(C)c2C)c(O)c1O 378558785 JCVHWEZWLFQRRB-AWEZNQCLSA-N 345.399 1.970 10 10 EDCE Cc1ccc(CNCc2noc(C(N)=O)n2)c(O)c1Br 2381133420 OHFNBPKYWYPZEL-UHFFFAOYSA-N 341.165 1.235 10 10 EDCE Nc1cccnc1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 392393995 FJXOEVGVYZUCOC-UHFFFAOYSA-N 330.363 1.570 10 10 EDCE OC[C@@H]1CCCN(c2cc(NCCc3ccc(O)c(O)c3)ncn2)C1 811810856 GIPIGJIPWFOCRM-CQSZACIVSA-N 344.415 1.751 10 10 EDCE CC(C)OC[C@H](O)CNCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 818967990 HJRIMCDDHGBZLU-FUHWJXTLSA-N 349.475 1.264 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@]3(CCSC3)C2)cc1 829286174 IUKNUTWTVGMJIX-GOSISDBHSA-N 349.500 1.577 10 10 EDCE COCc1n[nH]c(CNC(=O)N[C@H](C)c2cc(OC)ccc2O)n1 821177840 OZNJXKYYHUBHBW-SECBINFHSA-N 335.364 1.226 10 10 EDCE C[C@@H](NC(=O)[C@H](N)C(F)(F)F)c1ccc(N2CCOCC2)cc1 827726347 XOURNWJESRUPHF-MFKMUULPSA-N 331.338 1.590 10 10 EDCE CO[C@@]1(CN[C@H](C)c2c(C)cc(C)cc2O)CCS(=O)(=O)C1 903363061 LTXKYHQXGNPZHM-CZUORRHYSA-N 327.446 1.863 10 10 EDCE CN(C)c1ccc(/C=C\CN2CC(n3cc(C(N)=O)nn3)C2)cc1 839142250 FFMKDCWEPFNGKA-ARJAWSKDSA-N 326.404 1.013 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@]2(CO)COCCN2)cc1 913190968 KJLVNPJWDVJPKB-LJQANCHMSA-N 343.427 1.175 10 10 EDCE CCN(CC)C(=O)CCCNC(=O)NCc1c(O)cccc1F 914166678 PWNNPPVSMRMPJE-UHFFFAOYSA-N 325.384 1.979 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN(C[C@H]2CCC(=O)N2)C(C)C)c1O 840976723 QICFZYNPADFTTK-GFCCVEGCSA-N 337.376 1.798 10 10 EDCE COC/C=C\C(=O)NCc1cc(NC(=O)/C=C/COC)ccc1O 923118878 JYPOKKZCTXHTGQ-CIIODKQPSA-N 334.372 1.352 10 10 EDCE C[C@H](N)[C@@H](O)C[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952403821 VCNIDRIFXDWFRU-JKOKRWQUSA-N 340.420 1.632 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CNC(=O)OC(C)(C)C)C2)cc1 855231605 WWNRZBSOSSCAOG-CYBMUJFWSA-N 349.431 1.915 10 10 EDCE Fc1cc(CN2CCN3CCOC[C@H]3C2)ccc1N1CCOCC1 757928074 MGYFJFWFUDKJBG-MRXNPFEDSA-N 335.423 1.179 10 10 EDCE CCC(=O)N1CC[C@H](C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 855234031 QVHXZUMWHQDOLK-LSDHHAIUSA-N 345.443 1.649 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc(O)cs2)[C@@H](O)C1 871181305 PANOLDXOFCSCGL-MNOVXSKESA-N 342.417 1.554 10 10 EDCE COC(=O)COc1ccc(N(C)C[C@H]2[C@@H](C(=O)OC)C2(F)F)cc1 894445990 SKEJYQYETRBQGN-JSGCOSHPSA-N 343.326 1.729 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1n[nH]cc1Br 1565662346 DCUMJLUCNRGIMQ-UHFFFAOYSA-N 326.150 1.442 10 10 EDCE CN1CCN(c2ccc(CNC(=O)[C@]34C[C@H]3COC4(C)C)cc2)CC1 893608480 VDKQDDMTQDUZGX-JXFKEZNVSA-N 343.471 1.870 10 10 EDCE C[C@H](NC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1)c1ccccc1O 1302532884 SXNOJQSKJUBCEA-ZUZCIYMTSA-N 347.396 1.300 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)cc1Br 2126160789 CSZXIXDJKICSJB-IOQCUFBNSA-N 327.222 1.086 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CCCNC2=O)cc1C 1275189496 LNTITHNOVTUOIH-DZGCQCFKSA-N 333.432 1.124 10 10 EDCE CO[C@H](C)C(=O)N(C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1280987823 ZJLRHTHWBGSHGR-WDEREUQCSA-N 349.391 1.461 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC[C@@H](O)C3)c(Br)cc21 221246741 XTQUEDDFUGHJLU-JMCQJSRRSA-N 326.194 1.233 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)Cc2ccoc2)cc1C 1700936758 GZTKGVZBROVZJN-KRWDZBQOSA-N 346.427 1.748 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H](C)n2cncn2)cc1C 1482999605 LZKKHTULWMUUFB-FOSCPCJNSA-N 343.431 1.618 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)c2[nH]nnc2C)cc1C 1715670910 NVTVSSFXCHTFMH-LBPRGKRZSA-N 331.420 1.728 10 10 EDCE CCCCC(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1737470109 SIXFGTAPTGYBTA-BETUJISGSA-N 335.404 1.666 10 10 EDCE COCCOc1ccccc1CNC(=O)Cc1ccc(O)c(O)c1 1597208220 RNPRSHIQJZIGLG-UHFFFAOYSA-N 331.368 1.982 10 10 EDCE C[C@H]1CN(c2ccc(CN)c(Br)c2F)C[C@@H](CO)O1 231840929 GOPNBXQDQRSNMA-WPRPVWTQSA-N 333.201 1.633 10 10 EDCE CCOc1ccc(/C=C2/C(=O)N(c3nn[nH]n3)N=C2C)cc1OC 5959601 PDBKWJJTDAHEQZ-YRNVUSSQSA-N 328.332 1.413 10 10 EDCE Cc1c(OCC(=O)c2ccc(O)c(O)c2)c(=O)ccn1CCC(=O)O 1857919176 VQAFIZFWJLCDBQ-UHFFFAOYSA-N 347.323 1.304 10 10 EDCE COc1ccc(Br)c(CN(CC(N)=O)C(C)C)c1O 1964539357 YXJQCOJCYVFHIF-UHFFFAOYSA-N 331.210 1.859 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](CO)C[C@H]2CO)cc1Br 2146084078 XHNZZRAIQUBXSX-WZRBSPASSA-N 343.265 1.909 10 10 EDCE CN1CC2(C1)CN(c1cc3c(cc1Br)[C@H](O)C(=O)N3)C2 2152254379 DNCYADSCCWNQBC-LBPRGKRZSA-N 338.205 1.186 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1C(=O)NCc1ccccc1O 2010273655 WIQMEEAQTMZBDY-STQMWFEESA-N 336.388 1.548 10 10 EDCE CNCc1ccc(N2CCS(=O)(=O)[C@@H](C)C2)cc1Br 707141021 GKWOTENACNYDKB-JTQLQIEISA-N 347.278 1.792 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C(=O)NC(=O)[C@@H]3C2)cc1Br 387428266 NWWLKOWTNCOWDH-AVPPRXQKSA-N 338.205 1.178 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H](C)CN3C[C@@H](C)C[C@@H](C)C3)c2n1 2062005997 JBWDDTKXYPRILR-SCRDCRAPSA-N 345.447 1.840 10 10 EDCE COC[C@@H]1C=CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2182334192 XCDSBHYDVINVQF-SDBXPKJASA-N 339.189 1.826 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)c(Br)c1 2190456233 GBLSXPWNIMXTCR-FBUXBERBSA-N 341.249 1.631 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CN(Cc2cc(N)ccc2O)[C@H]2COC[C@@H]12 2044665474 IPPODTUWGHNYNV-ZNMIVQPWSA-N 349.431 1.698 10 10 EDCE Cn1nncc1C1(Oc2ccc(N)cc2)CN(C(=O)OC(C)(C)C)C1 2078127642 HROOLGQYFPWYDF-UHFFFAOYSA-N 345.403 1.922 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NCC/C=C/Br)cc1 2114286771 JIKZUSFTVHBDSL-LREOWRDNSA-N 349.250 1.866 10 10 EDCE CC(C)(C)OC(=O)N1CCC([C@@H](F)COc2nnc(=N)[nH]n2)CC1 2213787053 GHXRVWZSVMBHCC-JTQLQIEISA-N 342.375 1.043 10 10 EDCE CCN(CC)CCNC=C1C(=O)NC(=O)N(c2ccccc2C)C1=O 2296125860 QVZBWCCBGQIKBU-UHFFFAOYSA-N 344.415 1.393 10 10 EDCE CC[C@@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2288917894 WYDSHDYKWIDMMP-WXHSDQCUSA-N 341.205 1.784 10 10 EDCE COc1ccc(C=C2SC(N3CCN(C)CC3)=NC2=O)cc1OC 2296680766 UFGZHNAAQZTLQP-UHFFFAOYSA-N 347.440 1.922 10 10 EDCE CC(=O)Nc1ccccc1NC=C1C(=O)NC(=S)N(C2CC2)C1=O 2296938880 GOSINEYNCWZTRX-UHFFFAOYSA-N 344.396 1.347 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)c1cccc(O)c1O 2301662021 LROTYXYAQXCMCO-SNVBAGLBSA-N 340.376 1.367 10 10 EDCE C[C@@H](O)[C@@H](C(=O)O)N1C(=O)C(=Cc2cccc(O)c2)SC1=S 2323823703 GZHHBUOCCCYKON-HQJQHLMTSA-N 339.394 1.427 10 10 EDCE N[C@@H](COCc1ccccc1)C(=O)N1CCc2cc(O)c(O)cc2C1 2318624474 CWDIAKKJZVAUSA-INIZCTEOSA-N 342.395 1.527 10 10 EDCE Cc1ccc(CN2C[C@@H](O)[C@H](N(C)C)C2)c(O)c1Br 2352687082 NSLJLZAODQAIKP-VXGBXAGGSA-N 329.238 1.570 10 10 EDCE CN[C@H](c1ccccc1O)[C@H](O)c1nc(Br)nn1C 2353741213 ZHGIOGYCGKZNBJ-ZJUUUORDSA-N 327.182 1.277 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCN(C)C(C)C)CC2)cc1 171248887 MLYATHAWSPAGQR-UHFFFAOYSA-N 334.464 1.867 10 10 EDCE COC[C@H](C)N(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 193889152 QEPVOHSTWKRTCP-HNNXBMFYSA-N 335.448 1.311 10 10 EDCE COc1cc(O)c(CN2CCCC[C@H]2[C@@H]2CNC(=O)C2)cc1OC 373218811 VDRKTGHWDIKESV-JSGCOSHPSA-N 334.416 1.900 10 10 EDCE CS(=O)(=O)NC[C@H]1CCC[C@@H]1NCc1cc(Cl)ccc1O 800310106 SBTYUQXGAPRKDS-MFKMUULPSA-N 332.853 1.853 10 10 EDCE CCN1CCOC[C@@H]1C(=O)NCc1cc(Br)ccc1O 804737831 ZVNKTPZZURCGQO-GFCCVEGCSA-N 343.221 1.492 10 10 EDCE CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)OCC(=O)C(C)=O 808517902 RFYFLFZYIOGVOQ-WBMJQRKESA-N 345.395 1.687 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Nc3nc(C)n(C)n3)C2)cc1 823508912 ZSDNRVTVYWNXPW-LBPRGKRZSA-N 330.392 1.533 10 10 EDCE Cc1cc(CC(=O)N2CC[C@](O)(C(=O)O)C2)c(C)n1-c1ccccc1 910523943 YQMLYYOPHWZXDS-LJQANCHMSA-N 342.395 1.685 10 10 EDCE COc1cnc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)nc1 845924864 PKWOGQGFSCFYTH-LLVKDONJSA-N 343.387 1.367 10 10 EDCE COc1cccc(CNC(=O)NC[C@H]2CN(C3CC3)C(=O)O2)c1O 847458590 JRJZXUMZIYOIHM-LBPRGKRZSA-N 335.360 1.183 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCc3nc(C)no3)C2)cc1 852036993 FSRJRMGBNBKNJZ-ZDUSSCGKSA-N 345.403 1.507 10 10 EDCE CON(C)C(=O)CNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 854965406 HPANZMBTOSVRSZ-UHFFFAOYSA-N 329.400 1.773 10 10 EDCE C[C@@H]1COC[C@H](C(=O)NCCCN=[N+]=[N-])N1C(=O)OC(C)(C)C 1895876678 XNABPGSWVIFAOF-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE COc1ccc(N2CC[C@H](NCc3cnc(N(C)C)n3C)C2)cc1 850346254 DGQLWRIHQQNJMJ-AWEZNQCLSA-N 329.448 1.863 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@](C)(N)C(=O)O 1952122354 UEHKVZWGDAXXCD-BLLLJJGKSA-N 340.376 1.336 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CCNC12CCC2 861564044 DWIBPRNUYMMLQV-QGZVFWFLSA-N 344.459 1.607 10 10 EDCE C[C@H](C(=O)NCc1ccc2cccnc2c1O)N1CCN(C)CC1 862028401 YDOYTYPHANXUAV-CYBMUJFWSA-N 328.416 1.193 10 10 EDCE C[C@@H](CO)COC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O 766659442 CGANESHMITXSQM-JTQLQIEISA-N 339.347 1.829 10 10 EDCE COC(=O)c1oc(S(=O)(=O)N2Cc3cccc(O)c3C2)cc1C 867690178 BREANMWTMMBOPR-UHFFFAOYSA-N 337.353 1.785 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@@H]2CNCC[C@H]21 866717089 VNEGXBZWKSUDEN-IEBWSBKVSA-N 344.503 1.785 10 10 EDCE COc1ccc(Cn2[nH]nnc2=NCc2ccc(N(C)C)cc2)cc1 865415458 NFROHOZRMNSSKH-UHFFFAOYSA-N 338.415 1.830 10 10 EDCE CC(=O)C(=O)COC(=O)[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2 873464623 BWIWZRHODMZULF-DYVFJYSZSA-N 339.388 1.867 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](O)[C@H](C)O)cc1 871142956 MPXLRYWRROLKFJ-KBXCAEBGSA-N 344.411 1.307 10 10 EDCE C[C@@H](NC(=O)CCCCC(N)=O)c1ccc(N2CCOCC2)cc1 779748393 CWFPKKCIEWCUQD-CQSZACIVSA-N 333.432 1.746 10 10 EDCE CC(=O)N1CCN(Cc2ccc(N3CCN(C)CC3)cc2)[C@H](C)C1 775707187 FASIFBDEVNGQPR-MRXNPFEDSA-N 330.476 1.491 10 10 EDCE CN1CCN(c2ccc(CN3CCC(C(=O)N(C)C)CC3)cc2)CC1 775646203 IBHBEBRCSSWSFG-UHFFFAOYSA-N 344.503 1.739 10 10 EDCE COC(=O)[C@@]1(O)CCN(Cc2cc(Br)cc(F)c2O)C1 895702339 NNVJZICNUUJZBD-CYBMUJFWSA-N 348.168 1.404 10 10 EDCE C[C@@H]1OCCN(Cc2c(O)cccc2Br)[C@@H]1C(=O)O 706647159 DDYAEZWPFVCMAR-UFBFGSQYSA-N 330.178 1.829 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(=O)NC(=O)C2)c(Br)c1 97268839 SGHJRLGXMBGHOX-QMMMGPOBSA-N 326.194 1.192 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CO[C@H](C2CC2)C1 1331277978 WWAJVMZHMOYGJI-WMZOPIPTSA-N 345.443 1.890 10 10 EDCE CC[C@H](F)C(=O)N(C)C[C@@H](O)CNCc1ccc(OC)c(C)c1 1332552851 RDPLYQCPVWLQAB-GJZGRUSLSA-N 326.412 1.661 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccc(C)n2C)cc1C 1272362027 KRKYJSVPLIPDOA-MRXNPFEDSA-N 345.443 1.531 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@@H]2CC[C@@H]3C[C@H]23)cc1 1351089777 GJLZDCNFJMSUDX-ZMSDIMECSA-N 329.444 1.921 10 10 EDCE O=C(Cc1c(O)ncnc1O)NCCCSc1nccs1 1443487285 GUKVTCJUQQSJBS-UHFFFAOYSA-N 326.403 1.185 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)c2cn(C)nn2)C2CC2)cc1C 1483559180 ZISQLLRLGTYKGK-HNNXBMFYSA-N 343.431 1.430 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C[C@@H]2C=CCC2)cc1C 1496938458 LJVJUAVJNXARMX-NVXWUHKLSA-N 332.444 1.927 10 10 EDCE CC[C@@H](CNC(=O)C(C)(C)C)NC(=O)c1cc(OC)nc(OC)c1 1499355651 VXSCEIVHIKKUCR-LBPRGKRZSA-N 337.420 1.770 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H](O)CNCCC2CC2)cc1 1568594963 GUZCDGVQRFRKLO-CQSZACIVSA-N 333.392 1.329 10 10 EDCE CCN(C)C(=O)CN[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1731640523 WQADRNGGABVATC-NSHDSACASA-N 348.407 1.035 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1ccc2c(c1)C(=O)NCCO2 1595596136 QPGGOZFWHFSNCF-UHFFFAOYSA-N 328.324 1.150 10 10 EDCE O=C(O)/C=C/C(=O)Nc1cc2c(cc1O)C(=O)c1ccccc1C2=O 207280200 BWTAYPFISHURPW-AATRIKPKSA-N 337.287 1.747 10 10 EDCE C[C@H](Oc1ccc(N)cc1)C(=O)Nc1ccc(N2CCOCC2)nc1 1860076084 QRQCGMUEYVYKSJ-ZDUSSCGKSA-N 342.399 1.906 10 10 EDCE CNCc1ccc(N2CCN(C(C)=O)CC2)c(Br)c1 234446365 FWDBXWYKUUGWPW-UHFFFAOYSA-N 326.238 1.837 10 10 EDCE Cc1c(OCCOc2ccc(N)cc2)c(=O)ccn1CCC(=O)O 1857911331 ZRHMIDDYQFDIEJ-UHFFFAOYSA-N 332.356 1.671 10 10 EDCE CCNCc1ccc(N2C[C@H](CO)C[C@@H]2CO)cc1Br 2146073997 VCVWEKAAEGSPDZ-BXUZGUMPSA-N 343.265 1.738 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)NCCN=[N+]=[N-])O2)C1 1994655135 MDVKREBNNJYQDI-JTQLQIEISA-N 325.369 1.581 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCN(CC(=O)NCCCCN=[N+]=[N-])C1 2010393878 YPMSENHLFMZSDU-LBPRGKRZSA-N 340.428 1.792 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2011939934 SJJNFLPWPDHXRG-ABAIWWIYSA-N 339.396 1.660 10 10 EDCE O=C(NC[C@H]1CCN1Cc1ccccc1)c1cc(O)c(O)c(O)c1 2015075886 XMSGZQLLSJZQIB-CQSZACIVSA-N 328.368 1.808 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)CC(O)C1 2018045794 KLWVDIONZVQQMF-NLTNOIMHSA-N 339.396 1.563 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1ccncn1 2022936573 TWMZHLGFUWETCK-NEPJUHHUSA-N 334.376 1.024 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C12CC(CNC(=O)OC(C)(C)C)(CO1)C2 2026195131 PSXLYFGNQCNWDU-UHFFFAOYSA-N 339.396 1.829 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3C[C@@H](O)C[C@H]3C2)c(Br)c1 405535610 ZPVVOVKNQDMIKG-WXHSDQCUSA-N 340.265 1.724 10 10 EDCE O=C(O)[C@H]1OCC[C@@H]1CNCc1cc(Br)ccc1O 716163941 HNPZZLXNACXZGL-PELKAZGASA-N 330.178 1.734 10 10 EDCE COC(=O)N1CCN(c2cc(Br)c(CN)cc2F)CC1 387189909 MFBNOMFUAKPCHZ-UHFFFAOYSA-N 346.200 1.935 10 10 EDCE C[C@H](O)c1ccc(N2CC3(CNC(=O)N3C)C2)cc1Br 2177689610 NQSATKNLLOFTEB-VIFPVBQESA-N 340.221 1.716 10 10 EDCE CN1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)[C@H]2C[C@H]21 2168356338 WMUOWMHVTJYIDW-AGIUHOORSA-N 337.221 1.294 10 10 EDCE CCc1nn([C@H](c2ccc(OC)cc2O)C2CC2)c(N)c1C(N)=O 2079986165 NFLSXKBWQSRJRC-HNNXBMFYSA-N 330.388 1.840 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4COCC[C@H]43)c(Br)cc21 2193267232 CRWBUKWJCBXVLR-CQOUMUIBSA-N 338.205 1.626 10 10 EDCE Nc1ccc(NC(=O)CCCN2CC(NC(=O)C(F)(F)F)C2)cc1 2044669539 PERMKZCPOVNAAB-UHFFFAOYSA-N 344.337 1.350 10 10 EDCE C[C@H](O)c1ccc(N2CCOC[C@@H](CO)C2)c(Br)c1 2098242055 GYXXACHGURBJIG-WDEREUQCSA-N 330.222 1.948 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@H]([C@@H](C)N)C2)c1O 2236033286 ORPKKEIIUMPPHI-RNCFNFMXSA-N 345.237 1.711 10 10 EDCE COC[C@@H]1C[C@H](CN)N(Cc2cc(Br)ccc2O)C1 2273809128 HMAGRWCNWVPHJT-ZWNOBZJWSA-N 329.238 1.950 10 10 EDCE CNC(=O)[C@H]1CNCCN1c1ccc(OCc2ccccc2)cc1 2299527384 HLNSWLVUKYAZGH-GOSISDBHSA-N 325.412 1.790 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@@H](F)CN2)c(O)c1Br 2352628128 SNCNPMHSMUWCGJ-ZJUUUORDSA-N 331.185 1.779 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCCOC1 171619451 LCNDHCRNLPRKIN-INIZCTEOSA-N 333.432 1.844 10 10 EDCE COCCN1CCN(Cc2ccc(N3CCOCC3)cc2)C[C@@H]1C 120808507 AQFWDZYGRFQRFT-KRWDZBQOSA-N 333.476 1.676 10 10 EDCE COc1cccc(CNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3C)C2)c1O 374201223 IAOQBSUVMVLICI-RTXFEEFZSA-N 333.388 1.209 10 10 EDCE Cc1ccc(CN2C[C@@H](CO)[C@H](CCO)C2)c(O)c1Br 2381134492 CVUXTIIBRYTEOK-YPMHNXCESA-N 344.249 1.886 10 10 EDCE COc1ccc(N(C)C[C@@H]2CNCCO2)c(OC)c1Br 2162632913 TXBVWRMYEVCPQM-JTQLQIEISA-N 345.237 1.891 10 10 EDCE COc1ccc(N2CCN(C(=O)COCc3cccnc3)CC2)cc1 805152007 FNLUUIXDWQXDST-UHFFFAOYSA-N 341.411 1.956 10 10 EDCE CN1C[C@@H](C(=O)NCc2cc(Br)ccc2O)CC1=O 804739625 MJQDHXJBBIQQMU-VIFPVBQESA-N 327.178 1.249 10 10 EDCE Cc1cnn(C)c1NC(=O)NCc1ccc(N2CCOCC2)cc1 824381197 UNJUIULKKDVNOF-UHFFFAOYSA-N 329.404 1.887 10 10 EDCE O=C(/C=C\Cn1cncn1)NCc1ccc(N2CCOCC2)c(F)c1 900269133 KDYQMCOTVROBAK-UPHRSURJSA-N 345.378 1.126 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4C[C@H]3CS4)nc12 839201377 JFEBWNAAOPECFF-QWRGUYRKSA-N 334.401 1.301 10 10 EDCE Nc1c(C(=O)OCCCCO)ccc2c1C(=O)c1ccccc1C2=O 733385904 QTALJVZRJLHLID-UHFFFAOYSA-N 339.347 1.974 10 10 EDCE Cc1cc(C(=O)CN2C[C@@H](O)[C@@H](CO)C2)c(C)n1-c1ccc(F)cc1 839171906 LYZZIRPSOKCMPH-RDTXWAMCSA-N 346.402 1.701 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2CCn1nc2ccccn2c1=O 746496957 KVRPSSYYFCMQEL-UHFFFAOYSA-N 339.399 1.461 10 10 EDCE COC[C@@H]1CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 849416396 QSZANZPCXKVIHA-CABCVRRESA-N 333.432 1.952 10 10 EDCE C[C@H]1CN([C@H](C)CNC(=O)/C=C/c2ccc(O)c(O)c2)C[C@@H](C)O1 848295261 MDFSIYAKGZXLCS-NUMNOVEKSA-N 334.416 1.725 10 10 EDCE c1cnc(N[C@H]2CCN(Cc3ccc(N4CCOCC4)cc3)C2)nc1 843414916 GALDBUGHQJRLQP-KRWDZBQOSA-N 339.443 2.000 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)c3ccccc3O)C2)cc1 849417463 RLIUWZHRZJJUSS-ZDUSSCGKSA-N 348.424 1.958 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])cn3C)C2)cc1 853818382 WIIQXTQWMBKWEN-GFCCVEGCSA-N 344.371 1.951 10 10 EDCE Cc1cc(N(C)C)ccc1CN1C(=O)N[C@H](CC2OCCO2)C1=O 924673053 UMJLEXXXIYRQRM-CQSZACIVSA-N 333.388 1.244 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CO[C@@H]([C@H](N)Cc2ccc(O)c(O)c2)C1 1952997542 NTVLCUUTRJMJME-YWPYICTPSA-N 338.404 1.650 10 10 EDCE CCc1ncc(CNC(=O)CN(CC(=O)O)c2ccc(OC)cc2)o1 853011100 SLHVQJAVYVRNIU-UHFFFAOYSA-N 347.371 1.453 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cnn2c1CCCC2 867303110 ZBRDMNVJSWARJT-GFCCVEGCSA-N 329.400 1.921 10 10 EDCE CN(Cc1ccc(S(C)(=O)=O)cc1)C(=O)Cc1ccc(O)c(O)c1 1136924007 LPWHSMQVWFFMNS-UHFFFAOYSA-N 349.408 1.702 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N[C@@H]2C[C@H]2c2ccsc2)cc1 1329456961 QAVHOCHKMRSTAA-LSDHHAIUSA-N 329.425 1.661 10 10 EDCE C[C@H](NC(=O)c1cccc(CS(N)(=O)=O)c1)c1ccccc1O 1171729789 HVNQKCJDTYELMI-NSHDSACASA-N 334.397 1.672 10 10 EDCE O=C(CCCNC(=O)c1ccsc1)NCc1cccc(O)c1O 1347530592 DXIMUSPNSTVWDQ-UHFFFAOYSA-N 334.397 1.986 10 10 EDCE CN1CCN(c2ccc(C=CC(=O)O)cc2Br)CC1=O 1911908459 SWPZVSPYWNXXEM-UHFFFAOYSA-N 339.189 1.825 10 10 EDCE CCC(=O)N(CCNC(=O)c1ccc(N=NC(N)=O)cc1)CCOC 1288246860 REXDIABBWOUMIK-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1ccc(O)cc1O 1299574020 NWVXQGJEGIDWRN-INIZCTEOSA-N 326.352 1.692 10 10 EDCE COc1cccc(CNC(=O)c2c(Br)cnn2C)c1O 1294924441 DWAOXQOTNJFJTO-UHFFFAOYSA-N 340.177 1.827 10 10 EDCE COc1ccc(N2CCN([C@H](C)C(=O)NC(=O)NC(C)C)CC2)cc1 8340656 FSHWJMKECHSMMM-CQSZACIVSA-N 348.447 1.440 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(C)cnn1C 1296054165 GFWAZNWKTIRMHQ-LBPRGKRZSA-N 347.371 1.044 10 10 EDCE CCN(CC)CCOCCNC(=O)c1ccc(N=NC(N)=O)cc1 1556129216 WRIOYCYPQBXFCV-UHFFFAOYSA-N 335.408 1.937 10 10 EDCE Cc1cc(C)cc(C(=O)NCC(=O)NCc2ccc(O)cc2O)c1 1639441584 ZDMKLRNLTVYXLL-UHFFFAOYSA-N 328.368 1.761 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2c(C)noc2C)cc1C 1568549987 HLYIRRQOOWMIGZ-HNNXBMFYSA-N 347.415 1.489 10 10 EDCE CCOC(=O)CN(Cc1nc(CCOC)no1)Cc1ccccc1O 1654806002 MWEJOGXBCFZCKY-UHFFFAOYSA-N 349.387 1.529 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CCN2C(=O)CCCF)cc1 1689537819 RLNFTXDGHSCDGM-CYBMUJFWSA-N 349.366 1.929 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CNCc1cc(F)cc(F)c1O 1985771938 ONBNORAAMHMITG-LLVKDONJSA-N 332.347 1.646 10 10 EDCE CC1(C)CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)[C@H]1CO 2148967163 ZVHPLRMTADTQHK-NWDGAFQWSA-N 340.221 1.608 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2010396946 QERMTCIAGNHJKV-NEPJUHHUSA-N 341.412 1.811 10 10 EDCE CC[C@@H](CNC(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 2015118434 ARHQBMAAQXBDSQ-JTQLQIEISA-N 340.376 1.837 10 10 EDCE Nc1ccc(CCC(=O)N[C@@H](COCc2ccccc2)C(=O)O)cc1 2034491338 RAKWKYGEPAMYPF-KRWDZBQOSA-N 342.395 1.988 10 10 EDCE CNC(=O)N[C@H]1CCCN(c2ccc(CN)cc2Br)C1 702153655 RMGMPBZGZUQIDJ-NSHDSACASA-N 341.253 1.806 10 10 EDCE NCc1ccc(N2CCN([C@H]3CCOC3)CC2)c(Br)c1 2171292042 BXWCPTMKHALAAX-ZDUSSCGKSA-N 340.265 1.819 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)cc1Br 2102192521 YCRCVZPOACPPDE-GFCLTOETSA-N 327.222 1.665 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](COc1nnc(=N)[nH]n1)[C@@H]1CC=CCC1 2213789462 IRNBUYKTXHJCMF-MNOVXSKESA-N 336.396 1.308 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H](O)C[C@H](F)C3)c(Br)cc21 2234672665 DVEBTMDLUKSWRU-DJOAAKCGSA-N 344.184 1.310 10 10 EDCE CN(C)c1ccc(OC[C@](N)(C(N)=O)C2(Br)CC2)cc1 2237684509 KCAFENYIDCPAID-AWEZNQCLSA-N 342.237 1.242 10 10 EDCE CN1C(=O)NC(=O)C(=Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1=O 2297329654 HMUVCJNWVNEJHR-UHFFFAOYSA-N 341.279 1.946 10 10 EDCE COC[C@@H](O)CN(C)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297786143 QKISMPHCALXDAF-KRWDZBQOSA-N 334.416 1.002 10 10 EDCE CN(CC(=O)NC(=O)NCCc1cccs1)Cc1ccccc1O 171927006 FODRUIXSASDMJL-UHFFFAOYSA-N 347.440 1.954 10 10 EDCE C[C@H](Cn1ncc2ccccc2c1=O)NC(=O)c1cccc(O)c1O 193150345 SPLCDSJEIWFIMA-LLVKDONJSA-N 339.351 1.626 10 10 EDCE CCC(=O)N(C)C1CN(c2ccc(CN)cc2Br)C1 2352388425 YVRDJWXSZHEEBE-UHFFFAOYSA-N 326.238 1.965 10 10 EDCE CC(=O)N[C@H](C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380763566 WGXPRFYVBLCVIA-SECBINFHSA-N 343.221 1.946 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N1CCC(CN)CC1 817973132 CDMRKECPSRHUQJ-UHFFFAOYSA-N 347.459 1.718 10 10 EDCE O=C1OCCN1[C@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 826995712 ZOLBHHIUAJCQBA-KRWDZBQOSA-N 331.416 1.550 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN[C@H]2CC[C@@H](C)S(=O)(=O)C2)c1O 827164363 GNEDFNRCZPXLGG-KOLCDFICSA-N 344.389 1.364 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@H](OC)[C@@H]3CCOC3)CC2)cc1 822918943 GFHRYUHKLFHJIH-CRAIPNDOSA-N 348.443 1.785 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)C(=O)N(C)CCCCO)cc1 839224039 MFSJQPJJDJXXTE-UHFFFAOYSA-N 349.475 1.722 10 10 EDCE CC1(C)CN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])CCN1CCO 844214913 LFCVFGKIMIFZOA-GQCTYLIASA-N 349.387 1.586 10 10 EDCE CC1(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)CC1 844784767 QQVXCWZLJSTZMM-UHFFFAOYSA-N 348.402 1.051 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)Cn3ccnc3)C2)cc1 849225070 NATSWRIIQPVZQJ-LSDHHAIUSA-N 343.431 1.858 10 10 EDCE CN1CCN(c2ccc(CNC[C@@H]3CN(C4CC4)C(=O)O3)cc2)CC1 848577746 QGDVYXBNHTXKKL-GOSISDBHSA-N 344.459 1.511 10 10 EDCE Cc1ccc(C(=O)N[C@@]2(C(=O)OC(C)(C)C)CCOC2)c(O)c1O 855641357 WUCOEUZZYIZMJZ-KRWDZBQOSA-N 337.372 1.637 10 10 EDCE CC[C@@H](NCC[C@H]1CNCCS1(=O)=O)c1ccc(N(C)C)cc1 925796518 OVHBBBQSVXFAAM-DLBZAZTESA-N 339.505 1.570 10 10 EDCE O=S(=O)(NCc1c(O)cccc1F)c1cnn(CC2CC2)c1 921452357 MPVKFJYQTSZAEQ-UHFFFAOYSA-N 325.365 1.616 10 10 EDCE C[C@@H]1[C@H](C(F)(F)F)OCCN1C(=O)C(=O)Nc1ccc(N)cc1 850850672 CQNWEWWQSAXXJS-LDYMZIIASA-N 331.294 1.386 10 10 EDCE CNC(=O)C[C@H](C)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852374746 XQCGHVSPQHERSQ-QWHCGFSZSA-N 334.420 1.098 10 10 EDCE COc1ccc(N2CCN(C(=O)C(C)(C)n3cc(N)cn3)CC2)cc1 851629803 YBLZHAHLHSKZOF-UHFFFAOYSA-N 343.431 1.558 10 10 EDCE CN(C)c1cc(F)c(CN(C)[C@@H]2CCN3CCO[C@H]2C3)cc1F 862382038 OFZMJAADFFOSIA-WBVHZDCISA-N 325.403 1.936 10 10 EDCE O=C([C@@H](O)c1cnc[nH]1)N(Cc1ccccc1O)C[C@H]1CCCO1 866899145 DTUNWZACJIXAPY-CJNGLKHVSA-N 331.372 1.357 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2nc3cnccc3[nH]2)c1 760953044 ZCRTWMKSXAXZQI-UHFFFAOYSA-N 347.356 1.287 10 10 EDCE CCOc1ccc(CN2CCN(c3nccc(OC)n3)CC2)c(O)c1 768265300 WQABDQZFTNMPOA-UHFFFAOYSA-N 344.415 1.912 10 10 EDCE COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H]3C[C@H]3C)CC2)cc1 1117084909 UDIHAFFIFAETSS-CABCVRRESA-N 345.443 1.506 10 10 EDCE COC(=O)[C@@H]1CC[C@@H]1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 874197320 QSEQIJCHNUFOJY-XOKHGSTOSA-N 346.427 1.900 10 10 EDCE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(OC)ccc1O 775739792 SBCOXDBHYVGYDH-XOUADPBQSA-N 349.383 1.326 10 10 EDCE COC(C)(C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 894596890 GCVVVSIIBNOVNO-UHFFFAOYSA-N 333.432 1.430 10 10 EDCE CCOCCS(=O)(=O)NCc1cc(Br)ccc1O 796191573 LUHAOPNKJHWYSB-UHFFFAOYSA-N 338.223 1.611 10 10 EDCE COc1ccc(CNC(=O)Cn2c(O)nc3ccccc32)c(O)c1 794377028 KPCANGIXVUYWIU-UHFFFAOYSA-N 327.340 1.773 10 10 EDCE CN1CCN(c2cc(Br)c(CN)cc2F)C[C@H]1CO 687611654 NSYNLWPZPMWAQU-JTQLQIEISA-N 332.217 1.160 10 10 EDCE O=C(CCSc1ncnc2[nH]cnc12)NCc1cc(O)ccc1O 1153885348 LZYAFDXZMUPLRZ-UHFFFAOYSA-N 345.384 1.563 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)CCN1C 92775883 HHVCOPKUUMJJGT-OQPBUACISA-N 339.237 1.541 10 10 EDCE CC[C@H]1C(=O)NC(=O)CN1c1ccc([C@@H](C)N)cc1Br 97319311 CAFUYZDYVIAQIP-KCJUWKMLSA-N 340.221 1.710 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1NCCCO 1327955498 ATWBDEKKJVUTKP-SMDDNHRTSA-N 333.392 1.282 10 10 EDCE NCc1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2134821298 SHACYTULFLPQGC-OLRMPSLUSA-N 327.222 1.228 10 10 EDCE C[C@H](O)CN(Cc1ccccc1)C[C@@H](O)COc1ccc(N)cc1 1914616650 FJDYOOJLSGEFNU-MAUKXSAKSA-N 330.428 1.892 10 10 EDCE COCCN(C[C@@H](O)C(F)(F)F)C(=O)Cc1ccc(O)c(O)c1 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C[C@@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)NCC1(CN=[N+]=[N-])CC1 1985103197 RMNBIFQNZYBGMS-NXEZZACHSA-N 327.385 1.467 10 10 EDCE CN(C)c1ccc(CN[C@@H](CNC(=O)OC(C)(C)C)C(=O)O)cc1 2022034002 PKKTZXRXGBYLEV-AWEZNQCLSA-N 337.420 1.820 10 10 EDCE COC(=O)[C@@H]1C[C@H](OC)CN1C(=O)C=Cc1ccc(N(C)C)cc1 2053622075 KROJOKOTJBECFK-HOTGVXAUSA-N 332.400 1.555 10 10 EDCE COc1ccc(N2CCN(CCN)CC2)c(OC)c1Br 2162639631 HNUMDDHAKGPDTM-UHFFFAOYSA-N 344.253 1.547 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N(C)[C@@H](C)C3CCN(C)CC3)c2n1 2065033358 KWMQOUPGZTZABA-LBPRGKRZSA-N 331.420 1.546 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)cc1Br 2178086652 MQSUGAIOWARCAZ-MJVIGCOGSA-N 341.249 1.912 10 10 EDCE CNC(=O)c1nn(Cc2cccc(C)c2O)c(C(F)(F)F)c1N 2079260649 KHKRISGAHXJUJO-UHFFFAOYSA-N 328.294 1.906 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4COCC[C@H]43)c(Br)cc2[C@H]1O 2193275678 PTNJXMCTPRZXEF-TWPQKTAQSA-N 339.189 1.660 10 10 EDCE CC(C)(C)OC(=O)N1CCC12CN(C(=O)COc1ccc(N)cc1)C2 2044648405 NFRHLRCROHZHMM-UHFFFAOYSA-N 347.415 1.869 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3C(C(=O)O)[C@H]3C2)c1O 2236047083 XSWCLDOIRYGRTC-YUMQZZPRSA-N 342.189 1.926 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)C[C@H]3C2)cc1Br 2236991415 XADPFTOVUYOBOF-AGCIHXOGSA-N 342.233 1.509 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCC(N(C)C)CC3)nc12 127902824 BQPHIIZGDMGQAJ-UHFFFAOYSA-N 347.419 1.138 10 10 EDCE Cc1ccc(C(=O)N2CCCC[C@@H](N3CCN(C)CC3)C2)c(O)c1O 182519808 VPBVFUNPNFFOHY-OAHLLOKOSA-N 347.459 1.648 10 10 EDCE COC(=O)c1c(C)cccc1S(=O)(=O)NCCc1ccc(N)cc1 193338043 QXRZHRLTPFHRQH-UHFFFAOYSA-N 348.424 1.885 10 10 EDCE O=C(O)[C@@H]1CCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255196322 ILFBLSDZMPXDTG-OMVNSRBRSA-N 330.384 1.470 10 10 EDCE CNC(=O)CCN(C)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255414011 UXBHEXBOPMTTRS-YVMONPNESA-N 331.416 1.131 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@H]1CCC[C@@H]1O 266787570 SLMUNVMMARTVNW-WBVHZDCISA-N 333.432 1.483 10 10 EDCE Cc1cc(Cl)cc(CN2CCC3(CC2)NC(=O)N(C)C3=O)c1O 289487084 RFVKJPPRFIUFCB-UHFFFAOYSA-N 337.807 1.870 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(O)c(O)c1)C2 819397442 CPGPFBFJGLJGDO-XQQFMLRXSA-N 334.372 1.581 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@@H]2C(N)=O)cc1Br 723202473 VLOUENOLVKKJDM-PRHODGIISA-N 328.210 1.159 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](C(=O)O)C3CC3)CC2)c(OC)c1 902413038 RXFHTPVPRHIHIU-INIZCTEOSA-N 348.399 1.463 10 10 EDCE CN1CCN(c2ccc(CNC[C@@H]3CNCCC3(F)F)cc2)CC1 903955232 NLKAZOCAFWZAQJ-INIZCTEOSA-N 338.446 1.773 10 10 EDCE Cn1nccc1[C@H](O)CNC(=O)NCc1ccc(N2CC=CC2)cc1 919918549 OMXNPVIERUUENL-QGZVFWFLSA-N 341.415 1.329 10 10 EDCE C[C@H](CN)NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 841867135 SGMAJXNZMJYWCJ-OAHLLOKOSA-N 345.491 1.365 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCCc1nnnn1C 840337540 ZPIRUNBLUWXDDI-ZDUSSCGKSA-N 345.451 1.057 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)NCc2c(O)cccc2F)CS1(=O)=O 923270359 RKZAPSQEWWDPTF-ZJUUUORDSA-N 330.381 1.296 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@](C)(O)[C@H](O)C2)cc1Br 1893332429 RHGBULMBGZKFKC-OWYVNGRQSA-N 330.222 1.824 10 10 EDCE C[C@@H](NC[C@@H](O)CS(C)(=O)=O)c1cc(Cl)c(Cl)cc1O 927024436 KNSAFQQQYRFQDN-HTQZYQBOSA-N 342.244 1.755 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)CN1CC(F)(F)CC1=O 841673773 DMVJEUSWOBXSTD-UHFFFAOYSA-N 339.386 1.780 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](NC(N)=O)C(C)(C)C)C2)cc1 855226647 RTZLGLJEUARUEG-SWLSCSKDSA-N 348.447 1.473 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](O)[C@@H](C)C3)C2)cc1 854297215 KQLMTOBCXWAEKQ-GRDNDAEWSA-N 333.432 1.686 10 10 EDCE CN(C)c1ccc(CNC[C@@]2(CO)COCC3(CCC3)N2C)cc1 858222516 QZZSVABRDQXGPN-LJQANCHMSA-N 333.476 1.458 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)C(=O)NC(C)C)C2)cc1 854296626 FJYHMPYVEQYGIA-KBPBESRZSA-N 348.447 1.486 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 862550048 BHVFUHJPXTYCFM-LLVKDONJSA-N 332.853 1.807 10 10 EDCE O=C1NCCO[C@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)[C@H]12 931562507 LKLFPZWDRQQQDY-ROUUACIJSA-N 345.443 1.003 10 10 EDCE O=S(=O)(CCCC1CCOCC1)NCc1ccc(O)cc1O 867416409 DFYQOZANKKHXKZ-UHFFFAOYSA-N 329.418 1.724 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CN1 861652669 JVLQCPAGKWALIW-ZBFHGGJFSA-N 346.475 1.587 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](C)CC2)cc1 1119755174 WBPWMQWEJLFZAU-HNNXBMFYSA-N 347.459 1.786 10 10 EDCE CN1CC(=O)N(Cc2ccc(N3CCN(CC4CC4)CC3)cc2)C1=O 777673989 UFINUJNZCYAIKE-UHFFFAOYSA-N 342.443 1.613 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCC(O)(COCCO)CC2)cc1 895830559 XOIJUYWWMHEZRV-ARJAWSKDSA-N 334.460 1.602 10 10 EDCE COC(=O)[C@@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CC1 781588870 ARZCDIJPLLPVLT-RDJZCZTQSA-N 345.443 1.430 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CSc1n[nH]c(O)n1 1135800928 WAXLHUYHDZHMCX-UHFFFAOYSA-N 347.444 1.861 10 10 EDCE Oc1cccc(Br)c1CN1CCO[C@]2(CCNC2)C1 717499748 ZRINVHBDUVJNMC-AWEZNQCLSA-N 327.222 1.719 10 10 EDCE C[C@H](NC(=O)c1cccc(O)c1O)[C@H](C)C(=O)Nc1ncccc1O 1306836929 FYBOEVMJGQAUPH-UWVGGRQHSA-N 345.355 1.592 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cccc(Nc2nn[nH]n2)c1 1303194585 GIBXKBTZBKFAGC-UHFFFAOYSA-N 326.316 1.285 10 10 EDCE 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COc1ccc(CNC2(CNC(=O)[C@]3(F)CCOC3)CC2)cc1C 1733254370 VQFIIMJNHANIAX-SFHVURJKSA-N 336.407 1.871 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccc(O[C@@H]2CC(=O)N2)cc1 1640603274 UMNAZGACOHJBHN-ZHLNUILUSA-N 340.335 1.975 10 10 EDCE CO[C@H](C)C(=O)NCC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1745952730 OPLJRAARHUAQII-SNVBAGLBSA-N 347.375 1.072 10 10 EDCE CO[C@H]1COCC[C@@H]1Cn1c(C)nnc1N(C)Cc1ccccc1O 1697695359 DVBPNHKUHUCOIQ-WBVHZDCISA-N 346.431 1.980 10 10 EDCE [N-]=[N+]=NC[C@@H]1CCCN1C[C@@H](O)CN1C(=O)c2ccccc2C1=O 1885288125 TWFDRNQAJKBYIS-NWDGAFQWSA-N 329.360 1.418 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1 1985103314 SVTMTIPUAVPCJX-LLVKDONJSA-N 327.385 1.781 10 10 EDCE COC[C@@](C)(NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985101137 OEPZGQVATHMPEZ-IINYFYTJSA-N 327.385 1.827 10 10 EDCE COc1cccc(CNC[C@@H](CO)NC(=O)OC(C)(C)C)c1O 1985859758 VODSNGQTSZKHTE-LBPRGKRZSA-N 326.393 1.376 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CN(Cc2ccc(N)cc2)[C@@H]2COC[C@H]12 1999483038 FKRGMXABGAOJLW-BZUAXINKSA-N 333.432 1.993 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H]2[C@@H]1[C@H]2C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010393163 OPNBLCXMFQENNR-WISYIIOYSA-N 337.380 1.532 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1 2010394882 FWLLSROSQPJJRF-HNNXBMFYSA-N 341.412 1.907 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)COC1 2010403391 CZZLXTLZZJQMON-NSHDSACASA-N 339.396 1.972 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CCCO1 2010401324 CZFMLSIHFJJXOM-NHYWBVRUSA-N 339.396 1.972 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)NCCCCN=[N+]=[N-] 2025611089 JRPKQGLDNYRSST-JTQLQIEISA-N 342.400 1.352 10 10 EDCE CNC(=O)CN(Cc1ccccc1)[C@@H](C)C(=O)Nc1ccc(N)cc1 2034782211 JOMZFYAYCNZPFQ-AWEZNQCLSA-N 340.427 1.844 10 10 EDCE Cc1nc(S(=O)(=O)NCCCN=[N+]=[N-])c(Br)n1C 310888394 JWNXTGAGYBHSBT-UHFFFAOYSA-N 337.203 1.470 10 10 EDCE CN1CCO[C@H](CN(C)c2ccc(CN)c(Br)c2F)C1 707829000 DHPUDJLRNWTXDJ-NSHDSACASA-N 346.244 1.814 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC[C@H](c4nccn4C)C3)c2n1 2062506554 MACMDKZJUCBFMT-NSHDSACASA-N 326.360 1.107 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@H](CO)Cc4ccccc43)c2n1 2064681683 BZAOFFOSQPXRMA-GFCCVEGCSA-N 338.367 1.555 10 10 EDCE N[C@H]1CC(C(=O)N2CCCc3c(Br)cccc32)=C[C@@H]1O 2188021633 NWPFOMKYUMAKBF-JSGCOSHPSA-N 337.217 1.747 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4COCC[C@@H]43)c(Br)cc21 2193267234 CRWBUKWJCBXVLR-RESLBDFXSA-N 338.205 1.626 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC4(C=CCO4)C3)c(Br)cc21 2183724279 HPCUYMDYZYBCEU-LBPRGKRZSA-N 336.189 1.546 10 10 EDCE CN(Cc1cc(Br)cc(F)c1O)[C@H]1CC(=O)NC1=O 2114733124 UCYNCJBHESDXSS-VIFPVBQESA-N 331.141 1.141 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N2CCC[C@@H]2CN=[N+]=[N-])n1 2121909850 IFZZZGVYPRIDOK-SSDOTTSWSA-N 349.214 1.646 10 10 EDCE CNCc1ccc(N2CC[C@H]([C@](C)(O)CO)C2)cc1Br 2202853775 RSZAHSSTLXGMOX-SWLSCSKDSA-N 343.265 1.738 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2225801028 RUCJHSXAUSDPHU-BQBZGAKWSA-N 349.214 1.692 10 10 EDCE CN[C@H](c1ccccc1O)[C@](O)(CF)CNC(=O)OC(C)(C)C 2242773598 WAJWZEAKTYPQIW-CJNGLKHVSA-N 328.384 1.878 10 10 EDCE CNCC(F)(F)CCS(=O)(=O)NCc1cnc(SC)s1 2284687022 CPBBIXHSROLLFE-UHFFFAOYSA-N 345.462 1.529 10 10 EDCE OC[C@@H](O)[C@H]1CCN1c1ccc(CNC2CC2)cc1Br 2286216243 SNGPBOUCWFUCCZ-HUUCEWRRSA-N 341.249 1.633 10 10 EDCE COc1cc(C=C2C(=O)NC(=O)N(C3CCCC3)C2=O)ccc1O 2297707539 WGVHWXXXGNQRFH-UHFFFAOYSA-N 330.340 1.805 10 10 EDCE COc1ccc(N(CC(=O)N[C@@H](C)C(=O)N(C)C)[C@H](C)C2CC2)cc1 111236669 PPDUCUYCHOUHMV-UONOGXRCSA-N 347.459 1.893 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cc3nnc(N)s3)C2)cc1 1347107602 BZFFIDDIPDGOEF-JTQLQIEISA-N 333.417 1.067 10 10 EDCE COC(=O)c1cncc(N2CCN(c3ccc(OC)cc3)CC2)n1 325714570 SANZPKFGAYUKFK-UHFFFAOYSA-N 328.372 1.598 10 10 EDCE COC(=O)C1=S=C(NC(=O)c2ccc(-c3ncon3)cc2)C=C1C 609972631 HYTKQBPHAJWSAD-UHFFFAOYSA-N 343.364 1.635 10 10 EDCE COC(=O)c1cccc2c1OCCN2C(=O)/C=C\c1cnn(C)c1C 255275975 CBXDICPGULSAKL-FPLPWBNLSA-N 341.367 1.954 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2OCC[C@H]2CN)c(O)c1Br 2381140894 RFJDMURMYGWLBO-TVQRCGJNSA-N 343.221 1.443 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CNCCCCF)CC2)cc1 819325457 DFAYKIKNXXQBRV-KRWDZBQOSA-N 339.455 1.517 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CNCC[C@@H](C)F)CC2)cc1 819334148 VTSMQSMBDDFUFQ-NVXWUHKLSA-N 339.455 1.516 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@@](O)(C(F)F)C2)c([N+](=O)[O-])c1 828752380 WMNULPDWUGGZBE-QTLSWZBMSA-N 342.298 1.987 10 10 EDCE Cc1cc(CCNC(=O)[C@H]2COC(=O)N2)c(C)n1-c1ccccc1 822273092 ARZSOQXGZSGPCX-MRXNPFEDSA-N 327.384 1.861 10 10 EDCE CC[C@H](NC[C@@]1(CO)COCCN1C)c1cccc(Cl)c1O 903277417 GZZVNVYCYCZHAC-GOEBONIOSA-N 328.840 1.779 10 10 EDCE O=C(O)/C=C/c1ccc(N2CCO[C@@H](C(=O)C3CC3)C2)c([N+](=O)[O-])c1 844212793 BEADYTSNLUIJGC-OYLQIYHASA-N 346.339 1.877 10 10 EDCE CC(C)n1cnc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 845925406 UNVKZERGRWXXFP-GFCCVEGCSA-N 344.419 1.741 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](O)C3CCOCC3)CC2)cc1 746093995 PUOIGELMKFTFSC-KRWDZBQOSA-N 334.416 1.131 10 10 EDCE Cc1cc(O)c(CN2CCN(c3nccn(C)c3=O)CC2)c(Cl)c1 840917415 JZHKCBFSCJKAJW-UHFFFAOYSA-N 348.834 1.770 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(C(=O)NCc2c(O)cccc2F)C1 928706661 UJXYNHVOMVIIEQ-UHFFFAOYSA-N 340.351 1.129 10 10 EDCE NCC1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 851679916 FCBNNSJAPFHVSB-UHFFFAOYSA-N 346.475 1.528 10 10 EDCE CN1CCN(c2ccc(CNc3ncc4c(n3)CCOC4)cc2)CC1 865294189 IVTLSXICHYLNCB-UHFFFAOYSA-N 339.443 1.913 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@](C)(O)CO)c1 861486147 SCNJQYNMQNSWCV-SFHVURJKSA-N 330.384 1.380 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NCc1c(O)cccc1Br 862410152 NZIYUBSHCVNSRS-CMPLNLGQSA-N 330.178 1.575 10 10 EDCE CCn1nc(C)cc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 863379813 HMUJNNZICRHMBI-UHFFFAOYSA-N 338.389 1.541 10 10 EDCE CCN1C[C@@H](S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)CC1=O 866842164 SKOHPRBONOQZJN-JQWIXIFHSA-N 342.417 1.002 10 10 EDCE COc1ccc(O)c(CN[C@H]2CCN(c3ccc4nncn4n3)C2)c1 862482360 SIFUJKKEYYYPJJ-ZDUSSCGKSA-N 340.387 1.207 10 10 EDCE C[C@H](O)c1ccc(N(C)Cc2nnnn2C)c(Br)c1 707629792 GVUVEINCZKHDHK-QMMMGPOBSA-N 326.198 1.662 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H]2C[C@H](OC)C2)cc1 1332095939 HBAYRTHWCUBPCG-JCNLHEQBSA-N 347.459 1.690 10 10 EDCE COC(C)(C)[C@H](C)NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1333430903 YIBFVXTTYYIDMN-OLZOCXBDSA-N 335.448 1.860 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC3CC(OC)(OC)C3)C2)cc1 1346437501 RPNYSTJLOTXJEQ-CYBMUJFWSA-N 349.431 1.725 10 10 EDCE Cc1cccc(CNC2(C(=O)O)CN(C(=O)OC(C)(C)C)C2)c1O 1913943750 IJEDBHZBMYDXOW-UHFFFAOYSA-N 336.388 1.864 10 10 EDCE O=S(=O)(Nc1cc(Cl)c(O)c(Cl)c1)N1CC[C@@H](O)C1 1914124886 UXWPTXLRZARRQX-SSDOTTSWSA-N 327.189 1.422 10 10 EDCE CC(C)[C@@H](C)C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1292893728 BNOQLMASOYDTFP-LLVKDONJSA-N 333.392 1.987 10 10 EDCE C[C@H]1[C@@H](O)CCCN1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1471546852 GBKAYPAWMQIGRJ-WBAXXEDZSA-N 348.491 1.910 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CC(=O)N(c2ccccc2)C1 1558174267 IPNBYSPPJDLFAA-ZDUSSCGKSA-N 326.352 1.767 10 10 EDCE C[C@H](C(=O)NCc1c(O)cccc1O)n1nnc(-c2ccccc2)n1 1635846783 BFFCGGKYBHZARK-LLVKDONJSA-N 339.355 1.629 10 10 EDCE CCn1cc(C(=O)N[C@H](C)CCNCc2ccc(OC)c(C)c2)nn1 1732740803 MBQJWYFGNJCTEB-CQSZACIVSA-N 345.447 1.913 10 10 EDCE CS(=O)(=O)c1cc(C(=O)NCc2cccc(Cl)c2O)co1 1653567309 UBEATXMEBVNKSZ-UHFFFAOYSA-N 329.761 1.972 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CN(Cc2ccccc2)CCO1 1651222288 DSRBQKNUCYSVCW-SFHVURJKSA-N 342.395 1.615 10 10 EDCE Nc1ccc(OCC(=O)NCCNC(=O)OCc2ccccc2)cc1 1959369922 IPDGXSUEZZSMEX-UHFFFAOYSA-N 343.383 1.690 10 10 EDCE Cc1nc(CNC(=O)NCc2cccc(Br)c2O)n[nH]1 1685566253 ZQHHBZIBJSUUQZ-UHFFFAOYSA-N 340.181 1.581 10 10 EDCE COCCN[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1C 1698899269 AYMMFQJZRNJZQF-IUODEOHRSA-N 347.419 1.936 10 10 EDCE NC(=S)c1sc(=NCCc2ccc(O)c(O)c2)[nH]c1Cl 2148011704 LAVHQEYRVBFEIR-UHFFFAOYSA-N 329.834 1.918 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1990024743 UWFUHWHPCTXYGR-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE COC1(CNC(=O)OC(C)(C)C)CC(C(=O)N2CC(N=[N+]=[N-])C2)C1 2010402329 PNBCYRCZDYNMNJ-UHFFFAOYSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N1Cc2nncn2C[C@H]1[C@@H](N)c1ccccc1O 2029556691 VBYJIMIGSYRQGM-WFASDCNBSA-N 345.403 1.803 10 10 EDCE C[C@H](N)c1ccc(N(C)CC(C)(CO)CO)c(Br)c1 689676233 SWRJTMSQKPKVBK-JTQLQIEISA-N 331.254 1.896 10 10 EDCE O=C(O)[C@@H]1COCCN(Cc2cc(Br)cc(F)c2O)C1 715791628 IMMUQNRGBTZGRO-VIFPVBQESA-N 348.168 1.827 10 10 EDCE C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)CC[C@H]1NC(=O)C(F)(F)F 2044627197 PNPHLKQVWPZQSI-ZWNOBZJWSA-N 343.349 1.727 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 2080576712 BKSJBDLMFPHOLJ-HUUCEWRRSA-N 349.431 1.598 10 10 EDCE COCc1nc(CNCc2ccc(Br)cc2O)no1 2089354664 OQNPPLSNHYBBEW-UHFFFAOYSA-N 328.166 1.974 10 10 EDCE OCC[C@H]1CN(c2ccc(CO)c(Br)c2)C[C@@H]1CO 2093502366 YCGGJOHRJOTTNE-CMPLNLGQSA-N 330.222 1.369 10 10 EDCE NCc1ccc(N2CC[C@H](C(CO)CO)C2)c(Br)c1 2114235936 OEFXATUBEOQXTA-NSHDSACASA-N 329.238 1.335 10 10 EDCE C[C@@H](O)c1ccc(N(C)[C@H]2CC(=O)NC2=O)c(Br)c1 2114727466 PRVNBIXZDAVZGN-HQJQHLMTSA-N 327.178 1.354 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2C[C@H](O)CCO2)c1O 2236056816 XSHBUOBMAOPQCP-NXEZZACHSA-N 346.221 1.793 10 10 EDCE COc1ccc(Br)c(CN[C@H]2COC[C@@H]2CO)c1O 2227748198 LHRAKCRXPIBTAZ-KWQFWETISA-N 332.194 1.260 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2329326244 NDGLWLGBOQPOSX-OAVNSQIMSA-N 327.222 1.399 10 10 EDCE Cc1ccc(CNC2CN(C3COC3)C2)c(O)c1Br 2352670293 IDUVUQBMKAAWBW-UHFFFAOYSA-N 327.222 1.636 10 10 EDCE COc1ccnc(N2CCN(Cc3cccc(OC)c3O)CC2)n1 180015069 XPMIWQLUFCGKBP-UHFFFAOYSA-N 330.388 1.522 10 10 EDCE Nc1ccnc(CNC(=O)/C=C/c2ccc(N3CCOCC3)cc2)n1 181437864 PLTWNMLDOPQTTH-ZZXKWVIFSA-N 339.399 1.225 10 10 EDCE CNC(=O)C1CN(c2ccc(/C=C/C(=O)O)cc2Br)C1 381880787 GMMLRBMSFHAISE-HWKANZROSA-N 339.189 1.729 10 10 EDCE CC(=O)C(=O)COC(=O)CO[C@H]1CCCN(C(=O)OC(C)(C)C)C1 808527372 FSISDBZRIHDGRX-LBPRGKRZSA-N 343.376 1.104 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)NCc1cc(Cl)cc(Cl)c1O 813686262 XGJVTZQJHSYISY-SNVBAGLBSA-N 336.171 1.629 10 10 EDCE CCn1ncc(/C=C2/OCCn3c2nc(Br)c3C=O)n1 901573811 BYAAXAQPJZIOKG-BJMVGYQFSA-N 338.165 1.598 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H](C[C@H]2CCCOC2)C(=O)O)cc1 908758385 JSIFLLCSTGLKPV-ZBFHGGJFSA-N 349.431 1.822 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H](CN)C(=O)O 1951828633 DQNXNIJQEJECLD-QWRGUYRKSA-N 340.376 1.193 10 10 EDCE CO[C@H]1CN(Cc2cc(Br)ccc2O)C[C@H]1C(=O)O 690085748 FPTZHSFXOPNGOS-PWSUYJOCSA-N 330.178 1.686 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCCC[C@]2(C)C(N)=O)cc1 839557720 YDVAVOHUNTZZCZ-GOSISDBHSA-N 332.448 1.099 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H]2CCc3nnn(C)c3C2)cc1F 915367046 VCZZQVBKYIELLL-GFCCVEGCSA-N 346.410 1.377 10 10 EDCE CN1CCC[C@@](O)(CC(=O)NCc2ccc3cccnc3c2O)C1 911262087 OGDKHRXUKPDMRH-GOSISDBHSA-N 329.400 1.403 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCCCNC1 842214407 RCMMPYUIKBYYEW-MRXNPFEDSA-N 344.459 1.161 10 10 EDCE CC[C@]1(O)CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 854299733 REJYYAGNSFVQRA-KDOFPFPSSA-N 333.432 1.830 10 10 EDCE COCC[C@H](NC(=O)OC(C)(C)C)[C@@H](N)Cc1ccc(O)c(O)c1 1952829920 QNQZQDWXUIBRSI-STQMWFEESA-N 340.420 1.897 10 10 EDCE COC(=O)CCCCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852017178 VOQMUNCKVFGYDY-AWEZNQCLSA-N 349.431 1.916 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc(C=O)n3C)C2)cc1 855225621 PDPGNQZCNDMZGM-ZDUSSCGKSA-N 327.384 1.855 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)C(=O)NC(C)C)C2)cc1 854296627 FJYHMPYVEQYGIA-KGLIPLIRSA-N 348.447 1.486 10 10 EDCE NC(=O)C[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 761908858 XDBRLVWWNUPGBW-VIFPVBQESA-N 334.332 1.018 10 10 EDCE Nc1ccc(Cc2noc(-c3ccnc(N4CCOCC4)n3)n2)cc1 863655390 CXHWDVQRSNMIJG-UHFFFAOYSA-N 338.371 1.536 10 10 EDCE C[C@H]1C[C@@H](COC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 783152010 MCCQZDCRIQZELH-QWRGUYRKSA-N 343.401 1.736 10 10 EDCE C[C@H]1[C@@H](C)O[C@H](C)CN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 785427589 DDWUGPVNNGXBMW-HZSPNIEDSA-N 333.432 1.393 10 10 EDCE O=C1Nc2cc(N3C[C@H]4COC[C@H]4C3)c(Br)cc2[C@@H]1O 718311167 OYIGTMSWCGXKHZ-DAROEXNTSA-N 339.189 1.517 10 10 EDCE N[C@@]1(C(=O)NCc2ccccc2O)CCN(Cc2ccccc2)C1 693874441 ZRZGOQKZYFHAJL-IBGZPJMESA-N 325.412 1.612 10 10 EDCE CCN(CCOC)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 92775528 XRQYBXZLSLUHOZ-GFCCVEGCSA-N 328.210 1.874 10 10 EDCE COC(=O)COc1ccc(C(=O)NCc2cc(O)ccc2O)cc1 1303223585 WDFFUXFJHLCILR-UHFFFAOYSA-N 331.324 1.580 10 10 EDCE C[C@@H](NC(=O)CCc1ccccc1)C(=O)NCc1c(O)cccc1O 1304053064 BDXXAICRYGAHPF-CYBMUJFWSA-N 342.395 1.852 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cc(C)[nH]c2C)cc1C 1320283901 ZMGRXEFNYBUMMZ-MRXNPFEDSA-N 345.443 1.829 10 10 EDCE COc1c(C(=O)NCc2ccc(N3CCSCC3)cc2)cnn1C 1325996425 SBZIHEIJNRSVIT-UHFFFAOYSA-N 346.456 1.912 10 10 EDCE C[C@H](NCc1cc(Br)cc(F)c1O)c1nc(=O)o[nH]1 2121353116 KUVXNNHQZUSSNN-YFKPBYRVSA-N 332.129 1.821 10 10 EDCE O=C1Nc2cc(N3CC4(CCO4)C3)c(Br)cc2[C@@H]1O 2115260709 BXCIHVPJKDZEDG-NSHDSACASA-N 325.162 1.414 10 10 EDCE O=C(O)CCN(c1ccccc1)S(=O)(=O)c1cccc2nonc12 1255250301 MDTDNLNGQSDBAB-UHFFFAOYSA-N 347.352 1.893 10 10 EDCE COc1c(C)cccc1CNC(=O)C(=O)N(C)Cc1ccccc1O 1261556042 WMCIEMBRDXKCLG-UHFFFAOYSA-N 342.395 1.984 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccc2nc(CO)[nH]c2c1 1445935636 DCSIHXNWGHCVGY-UHFFFAOYSA-N 327.340 1.439 10 10 EDCE O=C(C[C@@H]1COCCN1C(=O)Cc1ccc(O)c(O)c1)c1ccco1 1294655006 JQCXTHSZOZUXIU-CYBMUJFWSA-N 345.351 1.734 10 10 EDCE COc1ccc(-n2cc(C(=O)NCc3cccc(O)c3O)nn2)cc1 1455315516 KXYXFIQLAHIHAA-UHFFFAOYSA-N 340.339 1.617 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@]2(C)CCNC2=O)cc1C 1714755254 BYPZJYNYINQKBR-SFHVURJKSA-N 333.432 1.078 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2cnn(C)c2N)cc1C 1485139857 XCVUMHQBYFTELL-QWHCGFSZSA-N 345.447 1.616 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCC[C@H](NCCCO)C2)cc1 1491897580 XQKSDHIFJRZUQK-LSDHHAIUSA-N 347.419 1.862 10 10 EDCE CCCOCC(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1721920569 NGMNKBGBDKSMTG-LLVKDONJSA-N 349.391 1.510 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)CN2CCCC2=O)cc1C 1725086430 ZWXQGMQOCGSCSH-CABCVRRESA-N 347.459 1.609 10 10 EDCE CC(=O)NCCOCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1726349220 YEMHPVCWIJODBZ-UHFFFAOYSA-N 335.364 1.074 10 10 EDCE CCC[C@@H](C)C(=O)NC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1744638020 LZXFAMCRGFKYMX-VXGBXAGGSA-N 337.420 1.770 10 10 EDCE COc1ccccc1-n1c(C)cc(C(=O)NCCCNC=O)c1C 1874027931 PYFNLFOMGFRWAA-UHFFFAOYSA-N 329.400 1.969 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](OCC(N)=O)C2)c(Br)c1 2145376096 XCSRYKLXFBYGKS-KOLCDFICSA-N 342.237 1.549 10 10 EDCE O=C1Nc2cc(N3CC4(CC(O)C4)C3)c(Br)cc2[C@H]1O 2146329868 SNQPROKSNGYHKE-GFCCVEGCSA-N 339.189 1.396 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(C)c1O 2024813237 ULKYFDVGTIXVQO-ZDUSSCGKSA-N 338.404 1.857 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@@H](CO)C2)c(Br)c1 316808927 WXNHDBNPVPQUKC-RISCZKNCSA-N 329.238 1.348 10 10 EDCE CC(C)(C)OC(=O)N1CC(CCO)(NCc2cccc(O)c2O)C1 397988146 HMGWDIZNEHGADI-UHFFFAOYSA-N 338.404 1.559 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H](N4CCCC4)CC3)c2n1 2064650753 BYJIMQKQZIKYML-CQSZACIVSA-N 343.431 1.834 10 10 EDCE Cn1cc([C@H](NC(=O)OC(C)(C)C)C(=O)N2CC[C@@H](N=[N+]=[N-])C2)cn1 2060635656 NXXBSJSZMKRAMB-NEPJUHHUSA-N 349.395 1.897 10 10 EDCE Cn1nccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2060621777 RJGKAETYGGRYGS-ZYHUDNBSSA-N 349.395 1.897 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](N(C)C)[C@H](O)C2)cc1Br 2089926810 NCAPQIIAOFDPEH-QCZZGDTMSA-N 328.254 1.580 10 10 EDCE CC[C@H](N[C@@H]1CN(C)C[C@@H]1O)c1cc(Br)ccc1O 2090335300 YJIRJOGQHVIYIM-SCRDCRAPSA-N 329.238 1.870 10 10 EDCE NCc1ccc(N2CCN3C(=O)OC[C@@H]3C2)cc1Br 2114271794 LCYDQHUEUFCURM-NSHDSACASA-N 326.194 1.549 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H](F)C[C@@H](O)C3)c(Br)cc21 2234672666 DVEBTMDLUKSWRU-KJNMHVQDSA-N 344.184 1.310 10 10 EDCE Nc1ccc(NC(=O)CN2CCC(NC(=O)C(F)(F)F)CC2)cc1 2258226059 MMLQDJCUUGIOPJ-UHFFFAOYSA-N 344.337 1.350 10 10 EDCE OCc1ccc(N2C[C@@H]3CC[C@H](CO)O[C@H]3C2)cc1Br 2289170907 ZIRSEQXFBSRCEL-ZBINZKHDSA-N 342.233 1.918 10 10 EDCE Cc1ccc(CNC[C@H]2CNCCOC2)c(O)c1Br 2352947792 KNZGXKSVYKJSCW-LLVKDONJSA-N 329.238 1.789 10 10 EDCE CC(C)[C@@H](Sc1nccs1)C(=O)N1CCC(C(N)=O)CC1 52914600 STYLZGRYDJZLTR-LLVKDONJSA-N 327.475 1.984 10 10 EDCE CCC[C@H](NC(N)=O)C(=O)N1CCN(c2ccc(OC)cc2)CC1 63628428 JMCDUFGEQQTMRJ-HNNXBMFYSA-N 334.420 1.181 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCN(CC(F)F)CC2)cc1F 64229097 WWEHUOMBMDZNEP-UHFFFAOYSA-N 344.381 1.984 10 10 EDCE CCN(CC)C(=O)Nc1cc(N2CCN(C=O)CC2)ccc1OC 62192168 RTOJAVDZIYHMJN-UHFFFAOYSA-N 334.420 1.847 10 10 EDCE C[C@@H](NCCNC(=O)C1CC1)c1ccc(N2CCC(O)CC2)cc1 178211020 UXJZQVQFPBVPTI-CQSZACIVSA-N 331.460 1.825 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)NC[C@@]1(CCO)CCOC1 130750724 XCTHLEBLLNSQOQ-LJQANCHMSA-N 345.443 1.651 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[C@H]1C(=O)O 326296465 HRZSMRGOTRFLFK-RKDXNWHRSA-N 335.316 1.473 10 10 EDCE C[C@H](NC[C@H]1CCN(S(C)(=O)=O)C1)c1ccc(N(C)C)cc1 90796986 UYCPSUJSPGEJPK-UONOGXRCSA-N 325.478 1.685 10 10 EDCE Cc1nc([C@@H]2COCCN2C(=O)/C=C/c2ccc(O)c(O)c2)no1 369461100 HUMNUISJJDUNCW-PYEVWLCESA-N 331.328 1.403 10 10 EDCE Cc1ccc(CNC(=O)N2CCCNCC2)c(O)c1Br 2381127910 MBJWZNJAISMXTM-UHFFFAOYSA-N 342.237 1.968 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)N2CC(CO)C2)CCCC1 651714971 UYMIQJYZKNPOGS-UHFFFAOYSA-N 328.412 1.979 10 10 EDCE Cc1cc(=NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)[nH]c(O)n1 588422267 YIMPJQWHODGKLR-DAXSKMNVSA-N 340.383 1.401 10 10 EDCE CN1CCN(C)CC(C(=O)NCc2ccc(N3CCCCC3)cc2)C1 906432143 AKAAAGLRZLOPLB-UHFFFAOYSA-N 344.503 1.787 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)cc1 836226392 DTLUORLUXHNPDI-NXHRZFHOSA-N 347.459 1.824 10 10 EDCE C[C@H](N)[C@H](C)NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 841915655 SPNPKSPMVQSAOG-QWRGUYRKSA-N 342.390 1.336 10 10 EDCE CNC(=O)C[C@@H](NC(=O)NCCc1ccc(N)cc1)c1ccccc1 841892122 FGJWDCLKDXWDPR-QGZVFWFLSA-N 340.427 1.988 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnc(N(C)C)cn3)C2)cc1 855233644 JWZBYHLBODOWCA-CYBMUJFWSA-N 341.415 1.560 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)C(OC)OC)C2)cc1 923186845 KDKGETKNSABNMH-QWHCGFSZSA-N 337.420 1.581 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CO)CC3CC3)C2)cc1 852451962 RQZRGHLUVFPMCW-GJZGRUSLSA-N 333.432 1.734 10 10 EDCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 861765899 ANDHXZYXNIOAAJ-VBNZEHGJSA-N 332.448 1.187 10 10 EDCE Cc1ccc([C@H](C)NC[C@@]23COCCN2C(=O)COC3)c(O)c1C 866551836 CRSDPLUSPKYHBD-KSSFIOAISA-N 334.416 1.287 10 10 EDCE C[C@H]1CCCN1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 769859816 PMOPGOCLCXMVHO-JTQLQIEISA-N 333.435 1.199 10 10 EDCE O=C(C(=O)N1CCC[C@H](OCC2CC2)C1)N1Cc2cccc(O)c2C1 1118945545 CAXUNKZIEGKGQO-HNNXBMFYSA-N 344.411 1.652 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCCOCC2CCC2)cc1 1118129889 FYXJSFOMAIEETR-UHFFFAOYSA-N 333.432 1.302 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3COC[C@@]3(C)C2)cc1F 1118669020 NJGWVLIDCBDSST-FZKQIMNGSA-N 349.406 1.003 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccnc(CO)c1 1142691041 SWRBKPOKZPDQLZ-UHFFFAOYSA-N 344.367 1.485 10 10 EDCE Cc1cnc(C2(NC(=O)Cc3ccc(O)c(O)c3)CCOCC2)[nH]1 1304120942 DSJLPAMJJQVZQK-UHFFFAOYSA-N 331.372 1.494 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H]1CCN(CC(F)F)C1 1175685653 HYAJOUZXTXHHKR-FXMSTWTQSA-N 326.343 1.814 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3C=CCC3)C2)cc1 1330652825 HRQMDPGZHDOPJK-KGLIPLIRSA-N 329.400 1.225 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2csnc2C)cc1C 1272398314 OQUSRPULPNYIKA-AWEZNQCLSA-N 349.456 1.649 10 10 EDCE CNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc(C)c(O)c1O 1466866439 OUOKNLLSBQUBBZ-CQSZACIVSA-N 328.368 1.493 10 10 EDCE O=C(NCc1cccc(O)c1O)c1ccc(-n2ccnc2O)cc1 1471642423 SXVYSHVSJBHDOW-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE CCN(CCNC(=O)[C@@H](C)OC)C(=O)c1ccc(N=NC(N)=O)cc1 1704266896 JLAZPMOUVQYIMO-LLVKDONJSA-N 349.391 1.462 10 10 EDCE CN(C)[C@@H]1COC[C@H]1NCc1cc(Br)cc(F)c1O 1921985881 CROTXZFRQMUVID-VXGBXAGGSA-N 333.201 1.712 10 10 EDCE Cn1ncc(Br)c1C(=O)NCc1c(O)cccc1F 1635366896 QIOZXYVGBHHHRF-UHFFFAOYSA-N 328.141 1.957 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](O)CNCCC2CC2)cc1 1568594962 GUZCDGVQRFRKLO-AWEZNQCLSA-N 333.392 1.329 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)Cn3cncn3)C2)cc1C 1565878731 OQRBXXGBQKEYKK-WKILWMFISA-N 343.431 1.280 10 10 EDCE COc1nn(C)cc1CNC(=O)c1cc2cc(O)c(O)cc2s1 1648556039 WELGJYVQNGJXMV-UHFFFAOYSA-N 333.369 1.985 10 10 EDCE O=C(NCc1ncc(Br)cn1)c1c(F)ccc(O)c1O 1651254676 IYNVCPYZHWAZAJ-UHFFFAOYSA-N 342.124 1.719 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1662924252 FVRARFCUGWTSSG-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE CN1C(=O)NC(=O)/C(=C/c2ccc(-c3ccccc3C(=O)O)o2)C1=O 5792909 JQXSVPPVVUUSMN-WQLSENKSSA-N 340.291 1.736 10 10 EDCE Nc1ccc(OCCCN2CCC[C@@H](NC(=O)[C@@H]3CCCO3)C2)cc1 586064817 LYIDKBXTDHKUKB-AEFFLSMTSA-N 347.459 1.797 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCC(=O)N(C)C2)c1O 1964037750 BHCXIIUOCOHODN-VIFPVBQESA-N 343.221 1.874 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H](O)CN(CCc2ccc(N)cc2)C1 2002704910 XMZYJJGWDIZJHK-JKSUJKDBSA-N 335.448 1.771 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985103107 QLCPSCAVMMLIJQ-AXFHLTTASA-N 327.385 1.419 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)[C@@H]3CCOC3)c(Br)cc21 159732851 DJDVMDNHLWZAPN-OQPBUACISA-N 340.221 1.887 10 10 EDCE COc1ccc([C@@H](C)NC[C@@H](CO)NC(=O)OC(C)(C)C)c(O)c1 2011516527 IYWSKLFPETXPDC-NEPJUHHUSA-N 340.420 1.937 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NCc2ccc(O)c(O)c2)C1 2011918197 PFSPBKXKCVNXDG-STQMWFEESA-N 338.404 1.558 10 10 EDCE C[C@@H](NC(=O)[C@H](O)CCNC(=O)OC(C)(C)C)c1ccccc1O 2017518538 IOSNIFOELJBMQU-BXUZGUMPSA-N 338.404 1.845 10 10 EDCE CN(Cc1c(Br)cnn1C)C(=O)Cc1ccc(N)cc1 2156479264 ZKRBOYQBTATLAQ-UHFFFAOYSA-N 337.221 1.966 10 10 EDCE NS(=O)(=O)C1(CNCc2cccc(Br)c2O)CC1 713924057 ZXTOIQYZFRSJPV-UHFFFAOYSA-N 335.223 1.065 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)cc1Br 2173357566 NRYWULHGYCXGKD-LFNVJSRFSA-N 342.233 1.823 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213583407 RKCAZRPCDHZPMQ-MXWKQRLJSA-N 343.384 1.805 10 10 EDCE Cn1nccc(NCc2cc(Br)cc(F)c2O)c1=O 2227233758 VERDLEGWBCQTTP-UHFFFAOYSA-N 328.141 2.000 10 10 EDCE CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=CNC[C@@H]1CCCO1 2293031375 GRZJLYNWHJBCAU-AWEZNQCLSA-N 330.344 1.970 10 10 EDCE NCc1ccc(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)c(Br)c1 2314962781 KLTHYGODKGKYOP-JOYOIKCWSA-N 331.235 1.141 10 10 EDCE Cc1c(C=C2SC(N3CCN4CCC[C@@H]4C3)=NC2=O)cnn1C 2328652408 DNRQMJJYDIDZKA-CYBMUJFWSA-N 331.445 1.479 10 10 EDCE CC(C)CN1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 301696284 PVPUYVGFXOTBCZ-UHFFFAOYSA-N 334.376 1.704 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CCO[C@]4(CCOC4)C3)ccc21 187238427 REHUDIRAJQWMDE-LJQANCHMSA-N 345.443 1.770 10 10 EDCE CSc1ncc(CN[C@](C)(C(=O)O)[C@H](C)S(C)(=O)=O)s1 2372948212 LHPQGXBYXXWLSO-CPCISQLKSA-N 338.476 1.231 10 10 EDCE Cc1ccc(CN2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)c(O)c1Br 2380802060 BNEFIKOTVPLCED-AGIUHOORSA-N 342.233 1.902 10 10 EDCE CC(=O)C(=O)COC(=O)c1nnn(-c2cccc3ncccc23)c1C 808516133 ARHGKHKVWBOTMP-UHFFFAOYSA-N 338.323 1.439 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CSC(=O)N1 819692899 IRWPHFUDNASBEM-LLVKDONJSA-N 338.385 1.109 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)c2cc(C(N)=O)cn2C)cc1 844855405 VOKSJGHCVOGMNV-UHFFFAOYSA-N 344.415 1.341 10 10 EDCE Nc1ccc(CC(=O)N2CCC(c3nnc4n3CCC4)CC2)cc1 746314166 SQXYWJORPBNDTA-UHFFFAOYSA-N 325.416 1.755 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN3C[C@H](O)C[C@H]3C2)c([N+](=O)[O-])c1 848767909 SAQOAWJEABVOAZ-SVDKCWMDSA-N 347.371 1.036 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCN(C4CC4)CC3)C2)cc1 854302049 XHCLTQNNHPAFKC-HNNXBMFYSA-N 344.459 1.764 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1nnnc1N1C[C@H]2C[C@H]2C1 1334522844 FENNOHMUNMOHBZ-GASCZTMLSA-N 326.404 1.014 10 10 EDCE COC(=O)[C@@H]1CN(Cc2ccc([N+](=O)[O-])c(OC)c2O)C[C@@H](C)O1 862486662 GRVVLCANPBMMSS-SKDRFNHKSA-N 340.332 1.071 10 10 EDCE N[C@]1(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1(F)F 867961770 HJZSLEAUWWFJFK-AWEZNQCLSA-N 329.322 1.015 10 10 EDCE CN1CCN(c2ccc(CN[C@H](CO)C[C@@H](O)C(C)(C)C)cc2)CC1 790618508 IJHMNAGMTHALSF-PKOBYXMFSA-N 349.519 1.686 10 10 EDCE COC[C@H](C)S(=O)(=O)NCc1cc(Br)ccc1O 796190973 OHKQIOCFIGNZFY-QMMMGPOBSA-N 338.223 1.609 10 10 EDCE CN(C1COC1)C1CN(c2ccc(CN)cc2Br)C1 2116495270 UQDKOOAKLZNICR-UHFFFAOYSA-N 326.238 1.427 10 10 EDCE CC[C@@H](CNC(=O)C1(C(=O)NC)CC1)NCc1ccc(OC)c(C)c1 1267821900 IWRAEVOODGMFMU-HNNXBMFYSA-N 347.459 1.514 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)c2cn(C)c(O)n2)cc1C 1505687035 YEZLVNZNCQVOOQ-CHWSQXEVSA-N 346.431 1.739 10 10 EDCE COc1ccc(N2CCN(C(=O)C3=C[S@](=O)CCC3)CC2)cc1 1465889494 FHFANGBSWMMLNO-HSZRJFAPSA-N 334.441 1.770 10 10 EDCE NC(=O)N1CCc2cc(NC(=O)Cc3ccc(O)c(O)c3)ccc21 1466088802 JZKUVCSMLMXDRK-UHFFFAOYSA-N 327.340 1.720 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(-n2cnnn2)cn1 1530833787 UMZDWVMCOLRQMS-UHFFFAOYSA-N 337.387 1.362 10 10 EDCE CN(C)[C@@H](CNC(=O)Cc1ccc(O)c(O)c1)Cc1ccccc1 1540527399 JGBRNWIOKOYUCT-MRXNPFEDSA-N 328.412 1.929 10 10 EDCE C[C@H](O)CNCCC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1485752457 WKBVSLVFZDVRLN-NEPJUHHUSA-N 335.408 1.718 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N1CCN(C)CC1 1628264777 GUBMSACCCVSPGM-GFCCVEGCSA-N 332.408 1.215 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CNC(=O)c1ncccc1O 1565701873 ODEWPJFJIFWDSK-UHFFFAOYSA-N 342.399 1.208 10 10 EDCE CC[C@@H](CNC(=O)C1CC(C)C1)NC(=O)c1cc(OC)nc(OC)c1 1721460685 ZWALBFLEPLICJI-YIZWMMSDSA-N 349.431 1.770 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1nccc(C(F)(F)F)n1 1639227594 ZPGRKYNYBDREGG-UHFFFAOYSA-N 327.262 1.766 10 10 EDCE CC[C@@H](CNC(=O)[C@@H](C)C1CC1)NC(=O)c1cc(OC)nc(OC)c1 1721458729 SMLNFLGGEOAOBI-FZMZJTMJSA-N 349.431 1.770 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1648781397 MGMCTNPJTQPHSZ-TXEJJXNPSA-N 336.388 1.812 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cnc(O)n3C)CC2)cc1C 1733251224 RTBPNWKDQPQQRP-UHFFFAOYSA-N 344.415 1.495 10 10 EDCE CC[C@H](CNC(=O)[C@@]1(C)CCNC1=O)NCc1ccc(OC)c(C)c1 1698612238 ICIUWNAHGXLQBA-BEFAXECRSA-N 347.459 1.514 10 10 EDCE CCOC(=O)[C@@H]1CCCN(C(=O)CCN2C(=O)CSC2=S)C1 1865765538 AYTFNAQOLJTVAA-SNVBAGLBSA-N 344.458 1.039 10 10 EDCE COc1ccc(N2CCN(CCNc3nc(C)cc(N)n3)CC2)cc1 892083401 GWTFGGYWMNOECX-UHFFFAOYSA-N 342.447 1.610 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NCCN=[N+]=[N-])C1 1963808774 FLDSHLUJYKFUDO-NSHDSACASA-N 327.385 1.829 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@H](C(=O)NCCCN=[N+]=[N-])CO1 1964885305 YVQHXCAIPBNANT-WDEREUQCSA-N 327.385 1.733 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@](C)(NC(=O)OC(C)(C)C)C(C)(C)O 1985104869 MCHGCWGLKWOAJL-AWEZNQCLSA-N 329.401 1.809 10 10 EDCE C[C@@H]1CN(Cc2cc(N)ccc2O)CC[C@@H]1NC(=O)C(F)(F)F 1999437670 RNFADRAABBPOPG-SKDRFNHKSA-N 331.338 1.863 10 10 EDCE Nc1ccc(O)c(CN2CCC[C@@H](CNC(=O)C(F)(F)F)C2)c1 1999433489 AWVUXUHUVXIABP-JTQLQIEISA-N 331.338 1.865 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H](CC(=O)N2CC(N=[N+]=[N-])C2)O1 2010405353 YJGRPEGERKEIOA-ZYHUDNBSSA-N 339.396 1.922 10 10 EDCE COc1ccc([C@@H](C)NC[C@H](CO)NC(=O)OC(C)(C)C)c(O)c1 2011516530 IYWSKLFPETXPDC-VXGBXAGGSA-N 340.420 1.937 10 10 EDCE CCNCc1ccc(N2C[C@@H]3OC(=O)N[C@@H]3C2)c(Br)c1 2176922226 WUOJGWRVBDUHQR-YPMHNXCESA-N 340.221 1.856 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C(=O)NC(=O)[C@H]3C2)cc1Br 387428270 NWWLKOWTNCOWDH-ONOSFVFSSA-N 338.205 1.178 10 10 EDCE CO[C@@H]1C=CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2165073153 HZOVOPFDEQBSFO-AMIZOPFISA-N 338.205 1.792 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H]3CN3CCCCC3)c2n1 2063351629 MVSSDGPTANCNEQ-AWEZNQCLSA-N 343.431 1.834 10 10 EDCE CN(C)c1ccc([C@H](N)[C@H](O)c2nn(C)nc2Br)cc1 2167724640 SSDFOCZNIJLVRS-JQWIXIFHSA-N 340.225 1.377 10 10 EDCE N=c1cc(C(=O)NCCc2ccc(N)cc2)c(Br)c[nH]1 2191749638 MACFXKAEXINXSP-UHFFFAOYSA-N 335.205 1.811 10 10 EDCE NCc1cc(F)c(N2CC(=O)N[C@@H]3CC[C@H]32)cc1Br 2112067711 WHBVUFUXLWBBTD-GHMZBOCLSA-N 328.185 1.514 10 10 EDCE O=C(O)[C@@H]1[C@@H]2OCCN(Cc3c(O)cccc3Br)[C@H]21 2092839050 XBRKETBDGMGEOV-SRVKXCTJSA-N 328.162 1.439 10 10 EDCE CC(=O)C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1 2245899365 YKXMYWFRVPQFNL-TVQRCGJNSA-N 339.310 1.837 10 10 EDCE Cn1cc(C=CC(=O)N2CC3(CC3)c3ccccc32)c(=O)n(C)c1=O 2297621092 WXYZPAOSOMVXCL-UHFFFAOYSA-N 337.379 1.176 10 10 EDCE C[C@@H](CN(C)C(=O)C=Cc1ccc(N2CCOCC2)cc1)C(=O)O 2311973821 TYPGZEZUNJUSEV-AWEZNQCLSA-N 332.400 1.716 10 10 EDCE CC(C)(C)OC(=O)N1CC([C@@H]2C(=O)NCCN2CCCN=[N+]=[N-])C1 2306857014 QDDFLTBEQZPBLK-GFCCVEGCSA-N 338.412 1.354 10 10 EDCE C[C@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C[C@@H]1O 2341300343 FCQPWWKPXQUSIE-HQDFOZKBSA-N 326.194 1.218 10 10 EDCE C[C@@H](Nc1cncc(OCCO)n1)c1ccc(N2CCOCC2)cc1 131859194 ZCQHVWFGNLFIDS-CQSZACIVSA-N 344.415 1.857 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCO[C@]3(CCOC3)C2)c([N+](=O)[O-])c1 274390641 KPXVKMLUTPZMKS-NJELEJDNSA-N 348.355 1.777 10 10 EDCE CN1CCCc2cc(CNC(=O)C3C[C@H]4CNC[C@@H](C3)C4=O)ccc21 373343185 AOBOQUHNNTXPGT-ALOPSCKCSA-N 341.455 1.500 10 10 EDCE COCCN1CN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])CC1=O 282977233 LVIZSHWNKQYGRN-GQCTYLIASA-N 349.343 1.034 10 10 EDCE COC(=O)C1(CS(=O)(=O)Nc2ccc(O)cc2C(=O)O)CCC1 290905862 FQVBBYYMIUGGFR-UHFFFAOYSA-N 343.357 1.175 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCCCNC1 842214406 RCMMPYUIKBYYEW-INIZCTEOSA-N 344.459 1.161 10 10 EDCE C[C@@H]1CCN(Cc2ccc(N3CCN(C)CC3)cc2)C[C@H]1C(=O)O 843041606 UICQBYSTYSKPTL-CRAIPNDOSA-N 331.460 1.981 10 10 EDCE Cc1cc(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)ccc1N(C)C 923415477 QKHBFBFOMWHFLE-NXHRZFHOSA-N 344.459 1.428 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)N3CC[C@@H](C)C3)C2)cc1 849416165 LIMWARZTCQERHW-KGLIPLIRSA-N 339.461 1.450 10 10 EDCE O=S1(=O)CCN(c2ccc(CN[C@H]3CCCSC3)cc2)CC1 850355887 MMLXUDZQIJZEKL-HNNXBMFYSA-N 340.514 1.907 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@@H]3CCC(=O)N3)C2)cc1 854187043 GBIMELOQECBZJJ-KBPBESRZSA-N 346.431 1.099 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnc4n3CCC4)C2)cc1 855224545 LRUALUORVSWOCQ-ZDUSSCGKSA-N 326.400 1.847 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3nccn4ccnc34)C2)cc1 855227764 YRRXRDJQQKJROU-CYBMUJFWSA-N 337.383 1.747 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](CO)CC3CC3)C2)cc1 852451963 RQZRGHLUVFPMCW-HUUCEWRRSA-N 333.432 1.734 10 10 EDCE CC(=O)c1cc(F)cc(CN[C@@H]2C(=O)NCC23CCOCC3)c1O 933040010 YCERYJJVKQMPQC-OAHLLOKOSA-N 336.363 1.119 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)c2ccnc3c2CC(=O)N3)cc1 852791740 LHXBIMNNXSFEPU-OAHLLOKOSA-N 339.399 1.072 10 10 EDCE Cn1ccc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)n1 765659683 QHEGFTSTDJKUHL-UHFFFAOYSA-N 345.472 1.973 10 10 EDCE COc1cccc(CNC(=O)c2cn3c(n2)C[C@H](OC)CC3)c1O 866765030 ZYPFITJEFVOGLB-GFCCVEGCSA-N 331.372 1.489 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@]12COC[C@@H]1C2 889372552 BKNUWBWDZBTCMP-KSSFIOAISA-N 331.416 1.236 10 10 EDCE C[C@@H](NCc1c(O)cccc1Br)[C@H]1CN(C)CCN1C 1462587045 DRWBLPZQQMHEMA-BXUZGUMPSA-N 342.281 1.879 10 10 EDCE COc1cccc(CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)c1O 1137473185 BIDLYQRGVRRGCM-OAHLLOKOSA-N 332.312 1.659 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCCOCC3)c(Br)cc21 92775813 FCKJEKGRCJHAPU-LBPRGKRZSA-N 326.194 1.628 10 10 EDCE CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCc1cc(O)ccc1O 1153879167 HZMLGWKMFRAKAS-KRWDZBQOSA-N 340.379 1.687 10 10 EDCE Cn1nc(C(=O)NCc2cc(O)ccc2O)c2ccccc2c1=O 1303223161 CSEWTFNSHQBXKD-UHFFFAOYSA-N 325.324 1.275 10 10 EDCE N[C@H]1CCN(Cc2cc(Br)cc(F)c2O)C[C@@H]1CO 2122373848 GDZZIZRMBAQUON-SKDRFNHKSA-N 333.201 1.435 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cn2cccn2)cc1C 1320970827 PEMSXHIYBQFKLZ-ONEGZZNKSA-N 328.416 1.662 10 10 EDCE CNCc1ccc(N2CC(=O)NCC2(C)C)cc1Br 2119099252 POPIUSWYPUAAKL-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE CN(Cc1ccccc1O)c1nnc(-c2ncn(C)n2)n1CC1CC1 1347040887 NNJRAUHWWNLDNS-UHFFFAOYSA-N 339.403 1.826 10 10 EDCE COc1cc(OC)nc(C(=O)NCc2ccc3c(c2)CCCN3C)n1 1442386982 OFHOORSDJMBUTG-UHFFFAOYSA-N 342.399 1.806 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@@H](C)NC(=O)C1CC1 1701115891 NEDRSFMXXMEMAH-ZJUUUORDSA-N 331.376 1.882 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2[nH]nnc2C)C2CC2)cc1C 1713114202 FSTPNEGMBTXTDJ-OAHLLOKOSA-N 343.431 1.728 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@]23COC[C@@H]2C3)cc1C 1495668973 PLQFJQDOTZJEPV-AXHNFQJDSA-N 332.444 1.882 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@]2(C)CCNC2=O)cc1C 1725509488 XOUMAWIYZUXUEK-IFXJQAMLSA-N 347.459 1.466 10 10 EDCE Cc1cc(C)cc(C(=O)NCC(=O)NCc2c(O)cccc2O)c1 1645360788 IXYRYYXGRKQIFV-UHFFFAOYSA-N 328.368 1.761 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC[C@H](CC(N)=O)C2)c([N+](=O)[O-])c1 1772835900 JASNWRZYACXLON-SCXUMTSISA-N 347.371 1.873 10 10 EDCE C=CC(=O)NCCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 154013861 XNWLVAOABJBSDJ-OAHLLOKOSA-N 332.400 1.592 10 10 EDCE CN1CCc2cc(CN[C@@H]3CC(=O)N(C)[C@H]3c3ccnn3C)ccc21 583616558 LGNRQMHQRNVVDT-DNVCBOLYSA-N 339.443 1.474 10 10 EDCE CNCc1ccc(N2C[C@H](CO)OC[C@@H]2C)cc1Br 234381255 YPXMNKRBKXONIR-GXFFZTMASA-N 329.238 1.755 10 10 EDCE Oc1ccc(Br)cc1CN1CC(N2CCNCC2)C1 236614848 WGXOKAMNCDQOJL-UHFFFAOYSA-N 326.238 1.244 10 10 EDCE CN(c1ccc(CN)cc1)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C[C@@H]1O 2001271729 QEBUPQYMDIYCSS-BMFZPTHFSA-N 335.448 1.998 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985100561 HQACDKHLXRGAAT-GMTAPVOTSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CCNCc2c(O)cccc2F)C1 1997955507 BPASAIRXNKFFBB-UHFFFAOYSA-N 340.395 1.993 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1NC(=O)COc1ccc(N)cc1 2009325714 CGLLMQVFLMSRGD-FZMZJTMJSA-N 335.404 1.677 10 10 EDCE C[C@@H](CN(C)C(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 2015118394 AGORJCNLDYVCEI-VIFPVBQESA-N 340.376 1.789 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@](Oc2ccc(N)cc2)(C(N)=O)C1 2021610650 VCTFPFONUYMQAY-QGZVFWFLSA-N 335.404 1.903 10 10 EDCE NC(=O)CCN(Cc1ccccc1)C(=O)[C@@H]1CNc2ccccc2N1 2034754014 JVCBBNFQCBOGSY-KRWDZBQOSA-N 338.411 1.797 10 10 EDCE Nc1ccc(NC(=O)CNC(=O)c2ccc(Br)o2)cc1 700309084 VUKKULLSISVHAP-UHFFFAOYSA-N 338.161 1.993 10 10 EDCE NCc1ccc(N2CCC[C@H](CO)[C@@H]2CO)c(F)c1Br 709805726 KQIMYNQIATUYKO-PWSUYJOCSA-N 347.228 1.617 10 10 EDCE CNC(=O)c1nn(Cc2cc(C)ccc2O)c(C(F)(F)F)c1N 2079260751 NLDANDYJHBMGGY-UHFFFAOYSA-N 328.294 1.906 10 10 EDCE COCC[S@@](=O)CCNCc1cccc(Br)c1O 2085938548 LMHOUMIWXVYNJE-SFHVURJKSA-N 336.251 1.639 10 10 EDCE CN1CCN(c2ccc(CN)c(Br)c2F)[C@@H](CCO)C1 2202820773 OAWIOZSZKYRVON-NSHDSACASA-N 346.244 1.550 10 10 EDCE CCn1nc(Br)nc1[C@@H](O)[C@@H](N)c1ccccc1O 2353740256 PRFAWIOAUZUMLH-UWVGGRQHSA-N 327.182 1.500 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(F)c1Br 2355335292 ZACMVFHHEMOBKY-MYMXGEOPSA-N 345.212 1.367 10 10 EDCE CN(Cc1ccccc1O)C(=O)Cn1c(=O)[nH]c2ccccc2c1=O 53916037 DTRMSOQFIODBRP-UHFFFAOYSA-N 339.351 1.054 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@H](c3cnn(C)c3)C2)cc1 116312902 JZDGKTIPXCNAFD-INIZCTEOSA-N 341.459 1.592 10 10 EDCE CC(=O)N(C(=O)C(=O)N1CCc2ccccc2C1)c1ccc(N)cc1 170318660 PMJPAVGPFMGFKP-UHFFFAOYSA-N 337.379 1.733 10 10 EDCE CCN1CCS/C1=C\C=C1/SC(=S)N(CC(=O)O)C1=O 31320070 QGVPJCPOTBNOCZ-ZATFKQDHSA-N 330.456 1.725 10 10 EDCE Cn1nnc(Br)c1S(=O)(=O)Nc1ccc(O)cc1 236102846 LGWPYZWMALYFST-UHFFFAOYSA-N 333.167 1.084 10 10 EDCE CCNCc1ccc(N2CCSC[C@@H]2S(C)(=O)=O)c(F)c1 90923195 LDUNPQFRVYXMSI-AWEZNQCLSA-N 332.466 1.859 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN[C@@H](CO)C[C@H](O)C(C)(C)C)c1O 285281802 UYJNESWSEYEDBH-YPMHNXCESA-N 342.392 1.557 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2[C@H]3CNC[C@H]32)c(O)c1Br 2380791703 BKGHRZFBDXBVPF-GDNZZTSVSA-N 339.233 1.887 10 10 EDCE 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DUTBYMQTMRHFBK-OAHLLOKOSA-N 327.432 1.299 10 10 EDCE C[C@H](NCCc1nnnn1C)c1cc(Br)ccc1O 756676932 NIGXZEPHRFWPHJ-QMMMGPOBSA-N 326.198 1.572 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3(CCO)CC3)C2)cc1 854298513 DKWOXJAEXKEYSO-AWEZNQCLSA-N 333.432 1.736 10 10 EDCE O=C(NCCCSc1nccs1)c1ccc2c(c1)COB2O 863872158 AWJABUWGELKRJZ-UHFFFAOYSA-N 334.231 1.273 10 10 EDCE C[C@H](NC(=O)N[C@H]1CCN(C2CCN(C)CC2)C1)c1ccccc1O 868290309 LSKWEDCNZVQVRZ-GJZGRUSLSA-N 346.475 1.921 10 10 EDCE O=S(=O)(CC1Cc2ccccc2C1)NCc1ccc(O)cc1O 867417059 LUWZYAVIOWYRKG-UHFFFAOYSA-N 333.409 1.932 10 10 EDCE C[C@H](NC(=O)C(=O)NC[C@H]1CCOC1(C)C)c1ccc(N(C)C)cc1 1118631866 PFNJUICMGAAYQK-DZGCQCFKSA-N 347.459 1.861 10 10 EDCE O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N1Cc2cccc(O)c2C1 871200055 YMUYBFKTAGRRLV-BNBDDXAPSA-N 338.363 1.042 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@H]1CSC1(C)C)c1ccc(N(C)C)cc1 1117729558 OYPGMVPWYJHETA-FZMZJTMJSA-N 335.473 1.940 10 10 EDCE COCCN(Cc1cc(C)cc(Br)c1O)[C@H](C)C(N)=O 781912614 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349.408 1.921 10 10 EDCE Cc1cc(C(=O)NCC(=O)c2cnn(C)c2)c(C)n1-c1ccccn1 1558629650 GYFUCLQTVQIYHA-UHFFFAOYSA-N 337.383 1.835 10 10 EDCE CC[C@H](F)CN[C@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1734386362 UTCJUINAZJNPGO-AAEUAGOBSA-N 339.371 1.277 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@](C)(O)C2)cc1Br 2136828214 ICLIFKPBUMNJJJ-OWYVNGRQSA-N 329.238 1.791 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2ccco2)cc1C 1677052713 WMHYKNRYWNAPRW-HNNXBMFYSA-N 332.400 1.819 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2ncccn2)cc1C 1691522103 CBODHGNJTLRAQK-UHFFFAOYSA-N 342.443 1.974 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cc2ccn(C)n2)cc1C 1691316849 DTPXINBDUACFSX-UHFFFAOYSA-N 330.432 1.528 10 10 EDCE CO[C@@H]1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 234949122 MFNZQYKCMCITLR-JMCQJSRRSA-N 326.194 1.626 10 10 EDCE COc1ccc(CNCCn2cc(Br)nn2)c(O)c1 1878210271 SABCXQUFWAFYRS-UHFFFAOYSA-N 327.182 1.545 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NCCCN=[N+]=[N-])C1 1963697296 BOFPJBILWRQVJU-LLVKDONJSA-N 327.385 1.829 10 10 EDCE CC(C)(C)OC(=O)NCC=CCNC(=O)COc1ccc(N)cc1 1999124806 JKCLYLXHKZGBNS-UHFFFAOYSA-N 335.404 1.845 10 10 EDCE CC(C)(C)OC(=O)N=c1cc(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)[nH][nH]1 2010390736 HXCSZPNHUAPZJM-SECBINFHSA-N 335.368 1.951 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CNC(=O)CCc1ccc(N)cc1 2011425556 ZZCANUWOYGDXSG-AWEZNQCLSA-N 337.420 1.203 10 10 EDCE CN[C@H](Cn1cc(CNC(=O)OC(C)(C)C)nn1)c1ccccc1O 2029550823 SSBKATPVBOSANG-CQSZACIVSA-N 347.419 1.969 10 10 EDCE C[C@@H](OCc1ccccc1)[C@@H](NC(=O)c1cccc(O)c1O)C(=O)O 706115512 UAOREEAQHYNOHC-IAQYHMDHSA-N 345.351 1.886 10 10 EDCE NCc1ccc(N2CC[C@H]3OCC(=O)N[C@@H]3C2)cc1Br 2185523885 ZQMDNJKQODRXQD-CHWSQXEVSA-N 340.221 1.002 10 10 EDCE CCNCc1ccc(N2CC(CNC(N)=O)C2)c(Br)c1 2187296949 BNPCLHLTRYBMPL-UHFFFAOYSA-N 341.253 1.663 10 10 EDCE CN1C[C@H]2C[C@H]1CN2c1cc2c(cc1Br)[C@H](O)C(=O)N2 2187612419 HNZPTLFUTDWKOP-DAROEXNTSA-N 338.205 1.327 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](N(C)C)[C@H](O)C2)cc1Br 2089926803 NCAPQIIAOFDPEH-BIGNPOOSSA-N 328.254 1.580 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H]3[C@H](C(N)=O)[C@@H]3C2)cc1Br 2201284779 PBNQKVUUUXNRMZ-VVHPZPEWSA-N 338.249 1.897 10 10 EDCE CC(C)(C)OC(=O)N1CC(F)(F)C[C@]1(C)COc1nnc(=N)[nH]n1 2213782407 DUUZDXPVVQMZKO-GFCCVEGCSA-N 346.338 1.093 10 10 EDCE Nc1ccc(CNCCn2cnc(I)c2)cc1 2215643942 QNDFHEYZXHAGLA-UHFFFAOYSA-N 342.184 1.860 10 10 EDCE O=C1NC[C@H]2CCCN(c3ccc(CO)c(Br)c3)[C@@H]12 2264603236 UMOUDPJUZRDEMD-NOZJJQNGSA-N 325.206 1.656 10 10 EDCE O=C(O)[C@]12CCO[C@H]1CN(Cc1cc(Br)ccc1O)C2 2296424091 YFGUWSYGIOTNBM-JSGCOSHPSA-N 342.189 1.830 10 10 EDCE COc1ccc(NC=C2C(=O)N([C@@H]3CCS(=O)(=O)C3)N=C2C)cc1 2297471728 CLZRMUPGLRLKAJ-CYBMUJFWSA-N 349.412 1.396 10 10 EDCE COC[C@@](C)(CCO)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2307687306 TVTVWWHSSPUORS-LJQANCHMSA-N 348.443 1.440 10 10 EDCE Cc1cc(C(=O)CN2C[C@H](O)C[C@@H]2CO)c(C)n1-c1ccc(F)cc1 184734891 XNDSVYXQCNUIQY-IAGOWNOFSA-N 346.402 1.843 10 10 EDCE CCCN(Cc1ccccc1O)[C@H](C)C(=O)N(C)CC(=O)NC1CC1 76073997 DFGVEVQWLPAQRW-CQSZACIVSA-N 347.459 1.730 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@H](Cn2cncn2)C1 181107718 NBSLKHBQESKUOU-YVZNUBBCSA-N 328.372 1.641 10 10 EDCE Cc1ccc(CN2CCN(C)C[C@H]2CCO)c(O)c1Br 2381140685 OLWIFHFEFPDMOU-CYBMUJFWSA-N 343.265 1.962 10 10 EDCE CCO[C@@H]1C[C@@H]1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 299307447 DTWIVFJUDXSHBW-ZWKOTPCHSA-N 347.459 1.358 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C)c1c(C)nn(CC(F)(F)F)c1C 808534485 ODJQWGDGQXAMKQ-SSDOTTSWSA-N 334.294 1.867 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@H](O)C(C)C)C2)cc1 824694182 PHDUBSBDWJHQDR-YOEHRIQHSA-N 335.448 1.838 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@@H]2CCN2C2CCOCC2)cc1 913927038 SKIPTQKNGGIWPH-SFHVURJKSA-N 346.475 1.805 10 10 EDCE C[C@H]1CN(Cc2ccc(N3CCN(C)CC3)cc2)[C@@H](C)CN1CCO 841891113 IUQBHYGECJJWPK-ROUUACIJSA-N 346.519 1.325 10 10 EDCE COc1ccc(N2CC[C@H](CN3C(=O)N[C@H](CCF)C3=O)C2)cc1 844725278 KFNDVXKDQYBZCX-SWLSCSKDSA-N 335.379 1.802 10 10 EDCE COc1cc(C)cc(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1O 842634388 VAMBYDLLHUGFCU-INIZCTEOSA-N 341.429 1.099 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CCCN(C)C2=O)cc1 846444420 CSGDTQDXCSZSHJ-INIZCTEOSA-N 333.432 1.458 10 10 EDCE COc1ccc(N2CCCN(C(=O)N[C@@H]3CCNC[C@@H]3C)CC2)cc1 841985980 COOZSMBTNAOBCZ-MAUKXSAKSA-N 346.475 1.915 10 10 EDCE C/C=C\CNC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 858606842 NCVFCVWZMFBKRQ-IHWYPQMZSA-N 337.445 1.297 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(C)c3OC)C2)cc1 855222933 DJNXAFPCSATZJQ-GFCCVEGCSA-N 330.388 1.446 10 10 EDCE COc1ccc(N2CCCN(C[C@H](O)CC3(O)CCC3)CC2)cc1 859086797 OKEXAQXTCXAVBK-QGZVFWFLSA-N 334.460 1.873 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)[C@H]3CCCNC3)C2)cc1 851661445 JTXQCNKNUDFFIR-PMPSAXMXSA-N 346.475 1.961 10 10 EDCE CCOCCO[C@@H](C)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855231919 YPPJJHZVERBJEK-LSDHHAIUSA-N 336.432 1.832 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)C[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1895875424 JIMNGCKXQKZALH-MNOVXSKESA-N 325.369 1.268 10 10 EDCE COC(=O)C[C@H](C)CC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855226693 PWYVPXWZCKLCAZ-ZIAGYGMSSA-N 334.416 1.979 10 10 EDCE COC/C=C/C(=O)NCc1cc(NC(=O)/C=C/COC)ccc1O 923118879 JYPOKKZCTXHTGQ-GGWOSOGESA-N 334.372 1.352 10 10 EDCE CNC(=O)C(C)(C)CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852221279 ULUMPGDHWGAWSM-ZDUSSCGKSA-N 348.447 1.345 10 10 EDCE CC(C)(O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 756893400 OXONQNANCHARPX-UHFFFAOYSA-N 331.460 1.606 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(CN)CC2)N(C)C)cc1 1338776462 CXMLLHPBSXRIJQ-GOSISDBHSA-N 347.507 1.736 10 10 EDCE CCOC(=O)C[C@H](O)COc1ccc(N(C)C)c(C(=O)OC)c1 865395611 YQFXHOMXDJVVRB-NSHDSACASA-N 325.361 1.232 10 10 EDCE CCO[C@@H](C(=O)N1CCOc2cc(N(C)C)ccc21)[C@@H]1CCOC1 866208874 WIVMMDCRNGFOEO-CXAGYDPISA-N 334.416 1.920 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@H]3C=CCC3)C2)cc1 1119569932 CWWNDWSDPUSPGP-LSDHHAIUSA-N 343.427 1.473 10 10 EDCE CC[C@@]1(C(=O)O)CCCN(C(=O)C(=O)N(C)Cc2ccccc2O)C1 1119703225 MMPGLMVOUWEPQF-GOSISDBHSA-N 348.399 1.454 10 10 EDCE COC(=O)C(C)(C)N1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779170090 YVUQLVFXWUPBTH-FNORWQNLSA-N 348.399 1.207 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCN(C(=O)C2CCCC2)C1 1137501022 UUYYZFRAEHNNPO-CQSZACIVSA-N 332.400 1.548 10 10 EDCE COc1ccc(CNC(=O)C(=O)Nc2ncn(C(C)(C)C)n2)c(O)c1 797389046 MUAZXACEZIDQPQ-UHFFFAOYSA-N 347.375 1.002 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@](C)(O)Cn2ccccc2=O)c1 790649563 HKGFUIVOKZTYAD-KPZWWZAWSA-N 346.383 1.191 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H](C[C@H]1COCCO1)C(F)(F)F 1304053985 ZAJZYERLSZPPOD-GXSJLCMTSA-N 349.305 1.698 10 10 EDCE NS(=O)(=O)c1cc(C(=O)NCc2ccccc2O)oc1Cl 1150535577 DXWCBRNEMGPBJA-UHFFFAOYSA-N 330.749 1.216 10 10 EDCE Cc1ccc(C(=O)NCC(=O)NCc2cccc(O)c2O)cc1C 1153792074 OCSHLWPVRPNXIJ-UHFFFAOYSA-N 328.368 1.761 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N(C)C[C@@H](C)O)c(Br)cc21 92775755 LYGJZMKQPSIESP-OQPBUACISA-N 342.237 1.869 10 10 EDCE NC(=O)[C@H]1OCC[C@@H]1NCc1cc(Br)cc(F)c1O 2117459078 ISHVUMAPESULCG-ONGXEEELSA-N 333.157 1.026 10 10 EDCE COC(C)(C)CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1174562863 SDAZDURTJFNNKS-UHFFFAOYSA-N 330.406 1.309 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnn4ccncc34)C2)cc1 1330888716 YAGZTKOLZXJCHZ-ZDUSSCGKSA-N 337.383 1.747 10 10 EDCE CN(c1cc(Br)c(CN)cc1F)C1COCCOC1 2131499401 XDPMFFDHWGWAKR-UHFFFAOYSA-N 333.201 1.899 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ncoc2C)cc1C 1272372337 PLTRZUNQLIODKQ-CQSZACIVSA-N 333.388 1.181 10 10 EDCE COc1ccc(O)c([C@H](C)N[C@@H](C)c2nc(N)nc(N(C)C)n2)c1 1459849050 KAELMGZTECFDOS-UWVGGRQHSA-N 332.408 1.646 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC(N3CC[C@@H](O)C3)CC2)cc1 1453729062 AXDQWCAHDQJWMZ-OAHLLOKOSA-N 345.403 1.520 10 10 EDCE CC(C)(C)[C@@H](O)C[C@H](CO)NC(=O)c1ccc(N=NC(N)=O)cc1 1467973221 VHZKDEPYAOJULN-OLZOCXBDSA-N 336.392 1.737 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cccn2nnnc12 1540488287 LYEOJXQIYHRDIL-UHFFFAOYSA-N 336.399 1.997 10 10 EDCE CC(C)(C)[C@@H](CNCCCO)NC(=O)c1ccc(N=NC(N)=O)cc1 1717974342 YYEKKQGCKMWJHN-CQSZACIVSA-N 349.435 1.966 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2CCC(=O)NC2)cc1C 1714477016 ZWIZBGHCOSTGFK-HOCLYGCPSA-N 347.459 1.514 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1[C@H]2COC[C@H]21)NCc1ccc(OC)c(C)c1 1715071996 QZGXRIWVACQYOE-CBZIJGRNSA-N 332.444 1.880 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)CC(C)(C)O)cc1C 1734513753 RGYFHMZXYJFXJQ-OAHLLOKOSA-N 338.448 1.074 10 10 EDCE O=C(Cn1nnnc1-c1ccccc1)NCc1c(O)cccc1F 1596917190 YOHZGVXXGJFOFJ-UHFFFAOYSA-N 327.319 1.501 10 10 EDCE NC(=O)c1ccc(NC(=O)NCc2ccc(N3CC=CC3)cc2)cn1 164300237 JTYIDLGGVJUKGJ-UHFFFAOYSA-N 337.383 1.878 10 10 EDCE COCCN1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)C(C(=O)OC)=C1C 6172104 QLPPWOLWVBFCPN-GXDHUFHOSA-N 346.339 1.914 10 10 EDCE CCn1c(-c2ccc(N(C)C)cc2)nc2c1c(=O)[nH]c(=O)n2CC 154527900 XAWNFCKIIOMIGR-UHFFFAOYSA-N 327.388 1.659 10 10 EDCE CNCc1ccc(N2C[C@H](CO)[C@@H](CCO)C2)cc1Br 2149910913 BLJZTYRNVPJWGO-QWHCGFSZSA-N 343.265 1.596 10 10 EDCE C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)c1cc(O)c(O)c(O)c1 1988130351 JMRRJPFNVABLJD-QMMMGPOBSA-N 326.349 1.446 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010393397 RVHJCONHXLISLW-VXGBXAGGSA-N 340.428 1.743 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2012344309 YDPPOQDXTCXTQH-NWDGAFQWSA-N 341.412 1.811 10 10 EDCE O=C(O)[C@@]12COC[C@@H]1CN(Cc1ccc(Br)cc1O)C2 2160994953 JXWNRUWPBWXPIV-HZMBPMFUSA-N 342.189 1.688 10 10 EDCE OC[C@@]1(O)CCN(c2ccc(CNC3CC3)cc2Br)C1 313806398 GUYFHVAOZHGIMM-OAHLLOKOSA-N 341.249 1.635 10 10 EDCE CCN[C@@H](C)c1ccc(N2CC(NC(N)=O)C2)c(Br)c1 2163214937 BVJPLYOTNLDMNM-VIFPVBQESA-N 341.253 1.977 10 10 EDCE NC(=O)NC1CN(c2ccc(C=CC(=O)O)c(Br)c2)C1 2163219641 KATWVITYMYIVHN-UHFFFAOYSA-N 340.177 1.404 10 10 EDCE O=C1Nc2cc(N3CCCC[C@@H](O)C3)c(Br)cc2[C@@H]1O 2169201064 DGPISXOJEVNHNX-OQPBUACISA-N 341.205 1.786 10 10 EDCE CCOC(=O)Cc1cc(O)n2nc(C3CCC3)c(C(=O)OC)c2n1 2080924579 VHLOICZQUWZODC-UHFFFAOYSA-N 333.344 1.595 10 10 EDCE COc1ccc(N2C[C@H](N)C[C@@H](O)C2)c(OC)c1Br 2111801276 PPPNBTROLYLMLV-RKDXNWHRSA-N 331.210 1.365 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H](O)C34CCC4)c(Br)cc21 2201413680 QNOUSVRYABICQI-VXGBXAGGSA-N 338.205 1.505 10 10 EDCE CC(C)(C)OC(=O)NCC1(O)CN(c2ccc3c(c2)OCCO3)C1 2214211661 JHSMNHDTPRJHPH-UHFFFAOYSA-N 336.388 1.534 10 10 EDCE COc1ccc(Br)c(CN[C@]2(CO)C[C@H](OC)C2)c1O 2208912094 XFXDZDZFWGQSHO-DEZZCRIOSA-N 346.221 1.793 10 10 EDCE COc1ccc(Br)c(CN(C)CC[S@](C)=O)c1O 2220484101 YOWPWSLBJQDTNR-SFHVURJKSA-N 336.251 1.974 10 10 EDCE OCc1ccc(N2C[C@@H]3COC[C@@]3(CO)C2)cc1Br 2226176842 SYMLZYDEGUVKIZ-RISCZKNCSA-N 328.206 1.387 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cnc(O)c(F)c2)s1 2284696902 DLDBTJGWBKCOTA-UHFFFAOYSA-N 335.407 1.583 10 10 EDCE COC(=O)[C@@](O)(CNCc1cnc(SC)s1)C(F)(F)F 2284540600 CYKZSMYBKZVJCM-VIFPVBQESA-N 330.353 1.421 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@@H](O)CCN1C(=O)OC(C)(C)C 2300526393 RXMGSIDPHAWXPD-RYUDHWBXSA-N 341.412 1.906 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2329326113 MELQUKUGBSFLIO-MOJTXTBVSA-N 327.222 1.399 10 10 EDCE Cc1ccc(CN2CCOC[C@@H]2C(N)=S)c(O)c1Br 2352672766 OGLHDAHVSWZPBR-SNVBAGLBSA-N 345.262 1.950 10 10 EDCE Cc1ccc(/C=C2/SC(=S)N(CC(=O)NCCCO)C2=O)o1 210393893 DKSDDFDJKIKCJD-YRNVUSSQSA-N 340.426 1.288 10 10 EDCE Cc1cc(C)n(C[C@H]2CN(C(=O)c3cccc(O)c3O)CCO2)n1 193062341 VGIOVTPWJBTPHY-CYBMUJFWSA-N 331.372 1.452 10 10 EDCE C[C@H](N)c1ccc(N2CCS(=O)(=O)CC2)cc1Br 235511678 WXXPKEYAXYUAFQ-VIFPVBQESA-N 333.251 1.704 10 10 EDCE CCOc1ccc(CN2CC[C@H]3CC[C@@H](C2)S3(=O)=O)c(O)c1 529678914 YPMKECPQHFFVSU-CABCVRRESA-N 325.430 1.942 10 10 EDCE Cc1cc(C(=O)CN2C[C@H](O)C[C@H]2CO)c(C)n1-c1cccc(F)c1 249274520 CIHDPQGVNINGBC-DLBZAZTESA-N 346.402 1.843 10 10 EDCE CN1C2(CCC2)COC[C@@]1(CO)CNCc1cccc(Cl)c1O 529646269 XZRPZNPTAJYAEF-KRWDZBQOSA-N 340.851 1.751 10 10 EDCE CC(=O)C(=O)COC(=O)c1nn(-c2cccc(Cl)c2)c(C)cc1=O 808521454 RXBXTPWZFSZBSN-UHFFFAOYSA-N 348.742 1.509 10 10 EDCE CCN1CC[C@H](NC(=O)NCc2ccc(N3CCCC3)cc2)C1=O 801745691 QQKNPVJOAMZZLH-INIZCTEOSA-N 330.432 1.707 10 10 EDCE C[C@@H](NC(=O)NC1COCCOC1)c1ccc(N2CCOCC2)cc1 813606346 PPOUWOQWTGENMG-CQSZACIVSA-N 349.431 1.299 10 10 EDCE Cc1noc(CCNC(=O)c2csc(Cc3ccc(N)cc3)n2)n1 817929587 QJTNUTCCRHPLFM-UHFFFAOYSA-N 343.412 1.980 10 10 EDCE CNCc1ccc(N(C)C[C@]2(O)CCOC2)c(Br)c1 2129430343 CLSILJXQEKEHRB-CQSZACIVSA-N 329.238 1.756 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NC[C@@H]3CCCN3C)C2)cc1 823247773 KCHOABHKBGOZNJ-WBVHZDCISA-N 346.475 1.915 10 10 EDCE CC[C@@H]1[C@@H](CO)CCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 830707483 FTKZBKLNVGIWQB-SJLPKXTDSA-N 333.476 1.804 10 10 EDCE COC[C@@](C)(O)CCNC(=O)N[C@H](C)c1cc(OC)ccc1O 836535205 ZEPXUDJMBBBXMM-BZNIZROVSA-N 326.393 1.549 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]4CC(=O)[C@@H]3C4)CC2)cc1 837309233 FWIMSTRFKVFSCF-IAOVAPTHSA-N 328.412 1.959 10 10 EDCE CN1CCN=C1NCc1ccc(N2CCN(CC3CC3)CC2)cc1 849052981 YJGBWEDZNQLAAQ-UHFFFAOYSA-N 327.476 1.610 10 10 EDCE COCC[C@@H](C)S(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849415666 DLRPCYJCMDARGO-KGLIPLIRSA-N 342.461 1.618 10 10 EDCE O=C1N[C@@H]2CN(Cc3ccc(N4CCOCC4)cc3)CC[C@H]2CO1 843434368 DZVKZZRXXBLXAK-DOTOQJQBSA-N 331.416 1.454 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Cc3ccon3)cc2)C1 746147258 MYAVAPQULLUUBR-AWEZNQCLSA-N 342.399 1.235 10 10 EDCE COCCN(C[C@@H]1C[C@@H]2COC[C@H]2O1)c1ccc(OC)c(OC)c1 929995153 BGOSQKDTENRRGL-QIIPPGSGSA-N 337.416 1.961 10 10 EDCE COc1cc(N(C)C[C@H](C)CS(C)(=O)=O)cc(OC)c1OC 757845283 SMTOPFUDWVSLOL-NSHDSACASA-N 331.434 1.829 10 10 EDCE CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)NCc2c(O)cccc2F)C1 920031135 YOSCCDVTPUOLLU-WDEREUQCSA-N 344.408 1.686 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC4(C3)OCCO4)C2)cc1 854299992 NPPVCQOVTWIBBA-CQSZACIVSA-N 347.415 1.432 10 10 EDCE Cc1cc(C)c([C@H](C)NC2CN(S(=O)(=O)N(C)C)C2)c(O)c1 858572263 RIAQCQYHIXQTPE-LBPRGKRZSA-N 327.450 1.150 10 10 EDCE CC1CCN(c2ccc(CNC(=O)C3=NO[C@@H](CN)C3)cc2)CC1 852866216 GSLLJSWFWHTPLR-MRXNPFEDSA-N 330.432 1.643 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](O)[C@H](C)C3)C2)cc1 854297217 KQLMTOBCXWAEKQ-KEYYUXOJSA-N 333.432 1.686 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)[C@@H]1[C@H]2CC[C@]3(COC(=O)[C@H]13)O2 862130821 MYCSEXLMUARLBB-NFFDBFGFSA-N 337.759 1.382 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN3C(=O)OC[C@@H]3C2)c([N+](=O)[O-])c1 763390922 HATYMAKIBGRAPI-FHMRSRPSSA-N 347.327 1.422 10 10 EDCE O=C(/C=C/CN1CCOCC1)NCc1ccc2cccnc2c1O 868938078 PVQWPDULVGCXAC-DUXPYHPUSA-N 327.384 1.445 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)c1cnn2c(=O)cc[nH]c12 774441431 ZJFMXLCMKLCUJD-UHFFFAOYSA-N 338.367 1.537 10 10 EDCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(C)c1O 775739220 NBQVODSSTPYQNY-KBXIAJHMSA-N 333.384 1.626 10 10 EDCE CCc1nc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)no1 775378068 SHZWBJQRKVKXKF-UHFFFAOYSA-N 344.415 1.771 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@H](O)C2)c(Br)c1 2132135726 SZSSSAPJVZMDOK-UONOGXRCSA-N 329.238 1.491 10 10 EDCE Cn1ccnc1CNCc1ccc(N2CCC(C(N)=O)CC2)cc1 1350292770 CHTGDLFSNKEAOZ-UHFFFAOYSA-N 327.432 1.412 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2nccnc2N)cc1C 1270921606 NVBBXZWTXIIVGN-ZDUSSCGKSA-N 343.431 1.626 10 10 EDCE CN1CC[C@H]2[C@@H](CCCN2C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1351857201 WZOWVGBQUSZLKW-HOCLYGCPSA-N 343.427 1.177 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2COC3(CCOCC3)O2)cc1 1295731904 MCRJFONKPIIMGH-CYBMUJFWSA-N 348.359 1.501 10 10 EDCE COc1ccc(CNC(=O)/C=C/C(=O)NCc2ccccc2O)cc1 1465990376 KCYVMNKWVMAOCT-ZHACJKMWSA-N 340.379 1.890 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)Cc2nnc(C)o2)cc1C 1700390962 CWNCDDCTLOUALG-OLZOCXBDSA-N 346.431 1.921 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CC(=O)N(c2cccc(F)c2)C1 1471660862 BWYMRJMYVNNGBT-GFCCVEGCSA-N 344.342 1.906 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@H]2CCNC2=O)cc1C 1482860753 MBURIQPVJVQDJC-ZFWWWQNUSA-N 333.432 1.124 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2oc(C)nc2C)cc1C 1485982178 JCTKGXIMPDRNDS-OAHLLOKOSA-N 347.415 1.489 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(Cn2ccnn2)o1 1556158120 SFQYLIZHARPTJY-NSHDSACASA-N 342.355 1.692 10 10 EDCE CCO[C@H](C)C(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1494615785 WVFMQRALUGHXOP-WDEREUQCSA-N 349.391 1.509 10 10 EDCE CCOC(=O)c1cnc(C)c(C(=O)NCc2c(O)cccc2O)c1 1558534139 OAVHWLBAISUKPO-UHFFFAOYSA-N 330.340 1.908 10 10 EDCE CCNC(=O)[C@@H]1COCCN1c1ccc(CN)c(Br)c1 228155022 YNBXBGTVJAHVRY-ZDUSSCGKSA-N 342.237 1.249 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccc(Br)nc1O 1639447796 JRWPVVYUKCUQNL-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE Cc1nc([C@@H](NC(=O)c2ccc(C)c(O)c2O)c2cnn(C)c2)no1 1637763560 REBDSZOWLZBMNU-LBPRGKRZSA-N 343.343 1.351 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@H](C)n2cccn2)cc1C 1734359912 COLBAEIQHYLYMK-GOEBONIOSA-N 346.431 1.028 10 10 EDCE CS(=O)(=O)c1ccc(CNC(=O)c2c(F)ccc(O)c2O)s1 1648712937 BDAPUEXRYNLOGM-UHFFFAOYSA-N 345.373 1.632 10 10 EDCE CC[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)CCOC 1746166903 OBDVPTMZJCNDSX-LBPRGKRZSA-N 349.391 1.510 10 10 EDCE CCn1ncc(C(=O)NC[C@H](C)CNCc2ccc(OC)c(C)c2)n1 1666540431 JCQJRWNAGMSPSG-CYBMUJFWSA-N 345.447 1.771 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2cn(C)cn2)cc1C 1666881452 CIYVUGVVKGKRQL-AWEZNQCLSA-N 330.432 1.987 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](CO)[C@H]1CCOC1 1683421404 OAXAXIIZOXJQKT-ZVZYQTTQSA-N 349.475 1.689 10 10 EDCE C[C@H](N)c1ccc(N2CC(=O)NC(=O)[C@@H]2C)cc1Br 235503661 OWEPYTCBFNIBEV-YUMQZZPRSA-N 326.194 1.320 10 10 EDCE C[C@@H](NCCn1cc(Br)nn1)c1ccc(O)cc1O 1878211422 VJZNACQNYHMOAC-MRVPVSSYSA-N 327.182 1.803 10 10 EDCE O=S(=O)(NCc1ccccc1O)c1cccc(C2OCCO2)c1 1963991899 VEKPETFSHXGJDV-UHFFFAOYSA-N 335.381 1.916 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985093763 FFNSYVUFAFNWRW-LLVKDONJSA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)NCCCN=[N+]=[N-])CCOCC1 1985100868 KBLVDVOCMWATKH-UHFFFAOYSA-N 327.385 1.877 10 10 EDCE CC1(C)CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)[C@H]1CO 2148961450 DPLAPDNUCDDALW-NWDGAFQWSA-N 341.205 1.642 10 10 EDCE CO[C@@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCCN(C(=O)OC(C)(C)C)C1 2010389075 LAOZTQOBXXPNKY-HNNXBMFYSA-N 339.396 1.924 10 10 EDCE NCc1cc(F)c(N2CCN3C(=O)OC[C@@H]3C2)cc1Br 2170716490 HKRBFCFLIDCUFV-VIFPVBQESA-N 344.184 1.688 10 10 EDCE COc1cc2c(c(OC)c1)N(C(=O)c1ccoc1CC(N)=O)CCC2 2063924816 DXHHKSGMXCPCAD-UHFFFAOYSA-N 344.367 1.918 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@H]2C3)c(Br)c1 2173320395 OWCRJFDWJUDZFB-QPKOPYBWSA-N 341.249 1.489 10 10 EDCE COC(=O)c1cnn(Cc2c(O)cccc2Br)c1O 2070462074 NWJRABVKIRXTPW-UHFFFAOYSA-N 327.134 1.892 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CC(C(=O)N2CCc3cccnc32)=C[C@@H]1O 2080945647 HIBIYHRRNKNHEZ-KBPBESRZSA-N 345.399 1.555 10 10 EDCE C[C@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1CCOc1nnc(=N)[nH]n1 2213790060 PORGITSALKGDLZ-WDEREUQCSA-N 338.412 1.484 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2205600291 PKWAXLVCYODCSR-AIUZOBBOSA-N 347.228 1.609 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)[C@@H](O)CC2)c(Br)c1 2269120104 BGTCLYPJXVNJFF-HERUPUMHSA-N 330.222 1.824 10 10 EDCE Cn1cnnc1-c1cncc(NC(=O)C=Cc2ccc(O)c(O)c2)c1 2308005952 NWPYBTMPKGGWMS-UHFFFAOYSA-N 337.339 1.940 10 10 EDCE CN(CC1CC(O)C1)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2310979601 HSWGHXJNPICPJJ-UHFFFAOYSA-N 330.428 1.766 10 10 EDCE Cc1nc(Br)c([C@H](O)[C@@H](N)c2ccccc2O)n1C 2337358925 KYXGNRHXDARCEF-CMPLNLGQSA-N 326.194 1.930 10 10 EDCE CNC1(C(=O)NCc2ccc(C)c(Br)c2O)COC1 2352940330 DFCCTXOUGOJEKF-UHFFFAOYSA-N 329.194 1.068 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)cc1Br 2355340221 NRYWULHGYCXGKD-VWQNXBSZSA-N 342.233 1.823 10 10 EDCE COc1cc([N+](=O)[O-])c(OC)c([C@H]2N[C@@H](C(=O)O)CS2)c1O 83236704 HSVKCHGGRCGOJQ-GCXOYZPQSA-N 330.318 1.106 10 10 EDCE N[C@H](c1ccc(I)cc1O)C(F)(F)C(=O)O 95770494 ZURAZHQQFKDBPS-SSDOTTSWSA-N 343.067 1.717 10 10 EDCE Cc1ccc(CN=c2ccc(C(N)=O)c[nH]2)c(O)c1Br 2381129012 CVHMTJUXKJLOPG-UHFFFAOYSA-N 336.189 1.991 10 10 EDCE C[C@@H]1C[C@H]1N(CCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2167109742 PXNOVCFZDICTDK-QUUYKZCZSA-N 340.221 1.608 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC4(CCOC4)CC3)cc2N1 811841338 BNQNUXWOVNFFJU-UHFFFAOYSA-N 333.344 1.933 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H](O)C1CCC1 826672073 WNLTWOKYYXSEMD-KRWDZBQOSA-N 336.407 1.564 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccc(Cc2nn[nH]n2)cc1 588404821 IPMRZMDMHGANID-YWEYNIOJSA-N 337.339 1.854 10 10 EDCE CC(C)(C)OC(=O)N1CC(CCO)(NC(=O)c2cc(O)cs2)C1 839913961 XDXFKBXFBOXQDF-UHFFFAOYSA-N 342.417 1.555 10 10 EDCE CN1CCO[C@H](CSCC(=O)NCc2ccc(N(C)C)cc2)C1 842651922 DJSHJBAWVGOHMF-INIZCTEOSA-N 337.489 1.433 10 10 EDCE CCO[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2C)C[C@H]1CN 846146824 RYOMHXUTLJPSDK-NVXWUHKLSA-N 334.464 1.566 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1895031229 CFOKQUPXGSARHY-OPRDCNLKSA-N 334.363 1.801 10 10 EDCE COC[C@@H](O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951700328 UCASIEULAXMZHR-SMDDNHRTSA-N 327.377 1.541 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCc4nc[nH]c4C3)C2)cc1 855226676 PRXHCYMMCLETGR-UONOGXRCSA-N 340.427 1.918 10 10 EDCE C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@H]1CN 926288506 MWINYJJBQWRLOT-HOCLYGCPSA-N 346.475 1.154 10 10 EDCE CC1(C)CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCN1 851680018 GDNNZZRQRBCJSG-UHFFFAOYSA-N 346.475 1.541 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)N[C@@H](CSC)C3=O)C2)cc1 924981466 ZPSKIJDQUSIRCY-OCCSQVGLSA-N 335.429 1.557 10 10 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N[C@H]1CN(Cc2cc(Br)cc(F)c2O)[C@@]2(CCOC2)C1 2154540285 IPZXHIUCCKUHTP-RISCZKNCSA-N 345.212 1.986 10 10 EDCE Oc1c(Br)cc(Cl)cc1CNC[C@@H]1COC[C@H]1O 2036575495 FIDLNJNBJDZIFK-LDYMZIIASA-N 336.613 1.905 10 10 EDCE NCc1cc(F)c(N2CC3(C2)OCCC[C@@H]3O)cc1Br 2159646802 JMDSPLRSJBFMKH-ZDUSSCGKSA-N 345.212 1.777 10 10 EDCE C[C@H]1CN(c2ccc(CO)cc2Br)CCS1(=O)=O 707379301 QSTXROCPUALBPA-VIFPVBQESA-N 334.235 1.565 10 10 EDCE COC[C@H]1C=CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2182373222 VLOKENVYGGASQC-OQPBUACISA-N 338.205 1.792 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CC(C(=O)NCc2ccccc2O)=C[C@@H]1O 2067793010 QQKBEAFEXRKPEB-ZFWWWQNUSA-N 348.399 1.593 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](C(=O)O)N1CCCc2cc(CN)ccc21 2078702210 DKMBKGJYXJKERU-HNNXBMFYSA-N 349.431 1.876 10 10 EDCE CO[C@H]1CN(C)C[C@H]1NCc1cc(Br)cc(F)c1O 2095433330 GLARTYRWSPTBTH-NEPJUHHUSA-N 333.201 1.712 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)C[C@@H]2CO)c(Br)c1 2200834779 YOOAYUWDYZWITG-CHWSQXEVSA-N 343.265 1.881 10 10 EDCE C[C@@]1(CO)COCCN1c1ccc(CN)c(Br)c1F 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CON1CCC(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 869295364 SQPQWKDBYGAXGA-UHFFFAOYSA-N 347.459 1.537 10 10 EDCE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1nc[nH]n1 761981137 GVWVCFPLLPDVEF-GFCCVEGCSA-N 335.795 1.558 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NCc2cc(C(N)=O)co2)c1 779669786 HRSBZGGUTQAVKX-SECBINFHSA-N 333.344 1.653 10 10 EDCE COC1=C(C(=O)O)NC(=O)N[C@@H]1c1cc(Cl)cc(OC)c1O 76256680 ONUVAUFOJSEUPI-MRVPVSSYSA-N 328.708 1.351 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CN(C)[C@@H]1CCC[C@H]1O 1140198396 BVYAZGFSLJDUJS-CHWSQXEVSA-N 327.421 1.339 10 10 EDCE COc1cccc(C(=O)NCC(=O)NCc2c(O)cccc2F)c1 1303878969 SAGWGPPXUQNMNR-UHFFFAOYSA-N 332.331 1.586 10 10 EDCE Cn1cc(Br)c(CNC(=O)c2c(F)ccc(O)c2O)n1 1183495452 OWZRICONSCMUGJ-UHFFFAOYSA-N 344.140 1.663 10 10 EDCE CCS(=O)(=O)[C@@H]1CCN(c2ccc(CN)c(Br)c2)C1 2123321234 QMGJWLPWYOXPBV-GFCCVEGCSA-N 347.278 1.921 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@H](O)C(F)(F)C2)cc1F 1330045484 LCTSPDGBHDKVEY-ZDUSSCGKSA-N 331.338 1.803 10 10 EDCE CCCN(Cc1ccccc1O)c1nnnn1CCN1CCOCC1 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1.185 10 10 EDCE C[C@@H]1[C@@H](C)[S@@](=O)CCN1C(=O)NCc1ccc(N(C)C)c(F)c1 265524264 AMKOZBQXJOZKJM-MNDBLIDSSA-N 341.452 1.943 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccn([C@@H]2CCCNC2)n1 262855933 VUSISWGUEFXXMG-CYBMUJFWSA-N 330.388 1.191 10 10 EDCE Cc1ccc(CN2CCOC[C@@H](C(=O)O)C2)c(O)c1Br 2381135965 YQSKLQRJYUKYEP-NSHDSACASA-N 344.205 1.996 10 10 EDCE CC(=O)N[C@@H](C(=O)NCc1cc(Br)ccc1O)C(C)C 804736407 VBKCIPKPQKVTGP-CYBMUJFWSA-N 343.221 1.932 10 10 EDCE Nc1ccc(Cc2nc(C(=O)NCCCn3ccnn3)cs2)cc1 817996714 GJMZREGMLHCPOP-UHFFFAOYSA-N 342.428 1.728 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H](O)C3CCC3)cc2)C1 825373112 CTURETQQBAQMKG-NVXWUHKLSA-N 345.443 1.166 10 10 EDCE COC[C@]1(C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCOC1 823555292 TZMNLRWZFVOKBR-GOSISDBHSA-N 334.416 1.397 10 10 EDCE C[C@@H](CN(C)CCCN(C)C)NC(=O)N(C)Cc1ccccc1O 820067638 AXRNPMYZUFDBJA-HNNXBMFYSA-N 336.480 1.806 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CC[C@H]4C[C@@H]4C3)ccc21 834677062 CYRUKIMXVPFQFA-USXIJHARSA-N 341.455 1.990 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3nc(C4CC4)nn3C)C2)cc1 853817433 DUVRWPIHPYTMDS-ZDUSSCGKSA-N 341.415 1.710 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NO[C@H](CO)C(C)C)C2)cc1 854296583 DZUKHNFRWJJXDK-CZUORRHYSA-N 337.420 1.522 10 10 EDCE COCCN1C[C@@H](C(=O)NCc2ccc3cccnc3c2O)CC1=O 862029579 ZQDBJNNIUPTWPE-AWEZNQCLSA-N 343.383 1.052 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2cc3c(cc2O)CCC3)C1 863339678 FIJQHKFXCWNYEJ-ZDUSSCGKSA-N 338.473 1.642 10 10 EDCE COc1ccc(N2CCN(C(=O)COC(=O)C34CC(C3)C4)CC2)cc1 860272334 MRCKQIFABDSCCE-UHFFFAOYSA-N 344.411 1.687 10 10 EDCE CN1CCN(c2ccc(CN[C@H]3CCO[C@@]4(CCOC4)C3)cc2)CC1 771873223 VEDPTADLYPSGGV-ICSRJNTNSA-N 345.487 1.866 10 10 EDCE C[C@H](NCc1ccc(N2CCN(C)CC2)cc1)c1nnc(O)n1C 895176827 PCCBLXLVFGIEQQ-ZDUSSCGKSA-N 330.436 1.123 10 10 EDCE COC(=O)c1c(CN(CCO)CCCO)c2cc(F)ccc2n1C 894022439 ZLKZGYYUTGSDMG-UHFFFAOYSA-N 338.379 1.281 10 10 EDCE COC(=O)C[C@@]1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCOC1 1138102801 CFZQRGNFLDZFNQ-HNNXBMFYSA-N 334.332 1.301 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cocn3)cc2)CC1 1133846973 ATIFMYKVWXFDRK-UHFFFAOYSA-N 328.372 1.306 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](CO)[C@@H](CO)C2)c(Br)c1 704817266 WQTBFEHYTRQKDG-RAIGVLPGSA-N 343.265 1.767 10 10 EDCE COC(=O)c1ccc2c(c1)N(C(=O)c1ccoc1CC(N)=O)CCC2 1303187337 YBVCNIJLFRVMOP-UHFFFAOYSA-N 342.351 1.687 10 10 EDCE CC[C@@H](CNC(=O)c1cnnn1C)NCc1ccc(OC)c(C)c1 1318517156 BGUUDEVZVPLDHC-AWEZNQCLSA-N 331.420 1.430 10 10 EDCE CCC(=O)N[C@@H](C)C(=O)NC[C@H](C)NCc1ccc(OC)c(C)c1 1317242290 QGTBRMFWTAZNFV-KBPBESRZSA-N 335.448 1.513 10 10 EDCE CC[C@H](CNC(=O)C[C@@H]1CCNC1=O)NCc1ccc(OC)c(C)c1 1318526945 BBKDINDSWXEGEP-JKSUJKDBSA-N 347.459 1.514 10 10 EDCE CC[C@@H](C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1347655397 OHHZWLLUTBJFHK-HUUCEWRRSA-N 347.459 1.943 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1912193414 NXYDZUGAFMMSJQ-ZETCQYMHSA-N 349.214 1.504 10 10 EDCE C[C@H](C(=O)NCc1cc(O)ccc1O)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 1455350797 VEVGAUHSSPRTAP-LERXQTSPSA-N 346.383 1.278 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@](O)(C(F)(F)F)C2)cc1 1466859364 BBDJUOTUWABFAF-GFCCVEGCSA-N 330.266 1.988 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCOC[C@@H]2[C@@H]2CCCO2)cc1 1556550163 LGEPJFVNSIXBLY-KGLIPLIRSA-N 332.360 1.869 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@H]1Cc2cc(F)ccc2NC1=O 1622664047 DTOBHPWAGCYSKT-GFCCVEGCSA-N 330.315 1.664 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccns2)cc1C 1715587585 LSGOSDJXRXEEAX-CYBMUJFWSA-N 335.429 1.341 10 10 EDCE CC[C@@H](C(=O)NCCc1ccc(O)c(O)c1)N1CCO[C@H](CC)C1 1630335061 JYCUPNXJYHTZQJ-CABCVRRESA-N 336.432 1.646 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)Cc2cnc[nH]2)cc1C 1725008069 YZPANOPSOFAZSD-AWEZNQCLSA-N 330.432 1.954 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCO[C@@H]([C@H]3CCCO3)C2)cc1 1595938207 RBDQXQGKQZESOS-ZIAGYGMSSA-N 332.360 1.869 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccc(-n2cncn2)c(F)c1 156736581 ILENWRAWMPVRJB-UHFFFAOYSA-N 342.330 1.790 10 10 EDCE CN(C)c1ncc(/C=C/C(=O)N(C)c2ccc(C(=O)O)cc2)cn1 1866371528 JZMKIAKWCKIDQH-RUDMXATFSA-N 326.356 1.917 10 10 EDCE CC(C)(C)OC(=O)N1CCCN(CC(=O)NCCN=[N+]=[N-])CC1 1985096517 SGSMUMHRKJJBPL-UHFFFAOYSA-N 326.401 1.356 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCN(CC(=O)Nc2ccc(N)cc2)C1 1999435751 ZMQGGNDVWANOOE-CQSZACIVSA-N 334.420 1.806 10 10 EDCE O=C1NC[C@@H]2CN(Cc3cc(Br)cc(F)c3O)CC[C@H]12 2157179449 PBIIZBXHEUTSJI-KOLCDFICSA-N 343.196 1.862 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@H](CO)C2)c(Br)c1 396893962 WZCVZYRNFDLKHQ-WFASDCNBSA-N 343.265 1.738 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 1908252664 CFQGUZXLBSDGFE-QWRGUYRKSA-N 339.396 1.563 10 10 EDCE O=S1(=O)C[C@@H]2C(NCc3ccc(Br)cc3O)[C@H]2C1 2054272649 JHVFUAUUQXQOEX-UWVGGRQHSA-N 332.219 1.287 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@H]3CNC[C@@H]32)c1O 2236053596 XCPFAUSIDIXTMU-AAEUAGOBSA-N 343.221 1.336 10 10 EDCE COc1ccc(Br)c(CN[C@H]2COCC[C@@H]2O)c1O 2227749937 HSFXWSGFNVELHY-QWRGUYRKSA-N 332.194 1.403 10 10 EDCE CNCc1ccc(N2CCC[C@@H]3CNC(=O)[C@@H]32)cc1Br 2279266283 CRYLICSGRDNSQT-BXUZGUMPSA-N 338.249 1.883 10 10 EDCE Cc1ccc(CN2CCO[C@H]3CNC[C@@H]32)c(O)c1Br 2352940785 IFICGUJUXKUDNF-RYUDHWBXSA-N 327.222 1.636 10 10 EDCE Cc1ccc(CNS(=O)(=O)[C@@H]2CC[C@@H]2N)c(O)c1Br 2352945315 ULYGWXSCELMKOP-VHSXEESVSA-N 349.250 1.372 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(CCCO)CC1 1261859499 WOWYTTRJPUINQV-UHFFFAOYSA-N 332.400 1.246 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(=O)C(=O)O)Cc1ccc(O)c(O)c1 1951498131 QAGFMPLSEMSYHB-SNVBAGLBSA-N 339.344 1.577 10 10 EDCE CN1CCO[C@H]2CN(Cc3c(O)cccc3Br)C[C@H]21 1140100054 CIFQHFMRLBEFQS-OCCSQVGLSA-N 327.222 1.670 10 10 EDCE COCCNc1cnnc(N2CCN(c3ccc(OC)cc3)CC2)n1 243560565 OLSTVYPEPFDBCJ-UHFFFAOYSA-N 344.419 1.265 10 10 EDCE C[S@](=O)CCNC(=O)NCc1cc(Br)ccc1O 805127181 ORDAPPGDXFVUSV-SFHVURJKSA-N 335.223 1.332 10 10 EDCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1C[C@@H]2C[C@@H]2C1 822759183 KHRDKABYUXINCH-ZSHCYNCHSA-N 348.468 1.584 10 10 EDCE Cn1cnc(CCCNC(=O)NCc2c(O)ccc3c2CCCC3)n1 827376034 KRUXSCMKZKPTCT-UHFFFAOYSA-N 343.431 1.832 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)COC2CCC(N)CC2)cc1 832265912 BKNQUTYQLAERTM-PREGVCBESA-N 334.464 1.155 10 10 EDCE C[C@H]1CCCN(S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)C1 842783910 FJXYQZQWSHPHMK-BBRMVZONSA-N 340.493 1.319 10 10 EDCE COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(C)c(C)cc1O 747830520 WBAXXIFGTUZZRD-MUIFIZLQSA-N 347.411 1.934 10 10 EDCE Cn1cc([C@H](NC(=O)c2cccc(O)c2O)C2(CO)CCC2)cn1 846203940 OODHXUYWSCXVBM-HNNXBMFYSA-N 331.372 1.465 10 10 EDCE CC(=O)C(=O)COC(=O)c1cnc2c(c1)c(C(F)(F)F)nn2C 924401679 NINDIQCSECIEIR-UHFFFAOYSA-N 329.234 1.302 10 10 EDCE COC[C@H](NC(=O)NCc1c(O)cccc1F)C1CCOCC1 923194208 DPGQXAMYZUWBAF-AWEZNQCLSA-N 326.368 1.772 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C[C@@H](OC)[C@@H]1CCOC1 852192534 SHIPUBDZLAAUPQ-NVXWUHKLSA-N 337.416 1.809 10 10 EDCE Cc1cn(C)nc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 850343060 YMKLPNQSXZRQRR-UHFFFAOYSA-N 341.415 1.584 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H](O)C1(N)CC1 1952667992 ANABTRKGTPZFKW-SMDDNHRTSA-N 338.404 1.386 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@]3(C)CCC(=O)N3)C2)cc1 852379501 RHRXNGMBJXTTKW-FZKQIMNGSA-N 346.431 1.242 10 10 EDCE C[C@@H]1CCC[C@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)O1 855793394 MEDAMMBQMBXDBV-ZYHUDNBSSA-N 342.417 1.451 10 10 EDCE COCC[C@](C)(O)CNC(=O)c1cc2cc(O)c(O)cc2s1 896833303 DCHPEVHMXKJJTM-HNNXBMFYSA-N 325.386 1.830 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C)[C@@H](CO)C2)cc1Br 687618105 ALPYUSLICUEPFE-ZYHUDNBSSA-N 328.254 1.582 10 10 EDCE CO[C@H]1CS(=O)(=O)C[C@H]1Nc1c(N)cccc1Br 697459561 DVSRWUPPHGSNEK-ZJUUUORDSA-N 335.223 1.255 10 10 EDCE C[C@@]1(CO)C[C@@H](O)CN1c1cc(Br)c(CN)cc1F 698199621 GVDJKVVFSCOOIO-RNCFNFMXSA-N 333.201 1.369 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2ncoc2C)cc1C 1325983823 JCYPPCJQZPGINI-UHFFFAOYSA-N 347.415 1.524 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@H]4CN(C)C[C@H]43)cc2F)CC1 1324821599 DNKWDDVTYZZMDA-QFBILLFUSA-N 332.467 1.713 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cnc(C)n2C)cc1C 1266815494 VIQLWCGCQLKVSP-UHFFFAOYSA-N 330.432 1.907 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)C2CN(C(C)=O)C2)cc1C 1270948172 PRHGGYFNZDFUAJ-AWEZNQCLSA-N 347.459 1.418 10 10 EDCE Cn1c(CO)nc2cc(C(=O)NCc3c(O)cccc3F)ccc21 1471975675 CMYUKGBYXGLBFZ-UHFFFAOYSA-N 329.331 1.840 10 10 EDCE C[C@@]1(C(=O)O)COCCN1Cc1c(O)cccc1Br 2136506021 WSNPTDFWYQMUHW-ZDUSSCGKSA-N 330.178 1.830 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@@H](CO)Cc1cccnc1 1626908398 CMOCHRJIUKXCGX-VOKGJARPSA-N 328.368 1.473 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2ccc3nc(O)[nH]c3n2)c1 1630365674 CUYWOSFXACMZIP-QMMMGPOBSA-N 328.328 1.869 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(C)C1=O 1564620751 CRYUMOKYRVFMLV-INIZCTEOSA-N 330.432 1.659 10 10 EDCE C[C@H](CNC[C@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1732985512 PLTDYHHENQCIRO-VXGBXAGGSA-N 333.392 1.593 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H]2CCC(=O)N2)cc1C 1734351855 HMODVHPKRCRTBM-ZFWWWQNUSA-N 333.432 1.219 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@H]2CC(C(=O)OC(C)(C)C)=NO2)cc1 1587316569 KDUKXHNKDQOUAQ-HNNXBMFYSA-N 347.415 1.855 10 10 EDCE C[C@H]1CN(C2CCN(Cc3cc4c(cc3O)OCO4)CC2)CCO1 152004120 AAZIMIUKDHQOBW-ZDUSSCGKSA-N 334.416 1.806 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)C1(C)COC1 2143191831 IMTQZIASYAMDDP-NSHDSACASA-N 326.194 1.626 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@]1(C)C(=O)N1CC(N=[N+]=[N-])C1 1985101467 SUOVRDFHCOLXAA-QMTHXVAHSA-N 325.369 1.437 10 10 EDCE C[C@@H]1COC[C@@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)N1C(=O)OC(C)(C)C 2010390474 DTEUJVBKEJRUPM-WOPDTQHZSA-N 339.396 1.922 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010404965 WBAWYSUINSHBQC-TUAOUCFPSA-N 341.412 1.809 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1cccnn1 2022930169 RDIGCHCVRJWBNY-NEPJUHHUSA-N 334.376 1.024 10 10 EDCE CNC(=O)CN(CC(=O)N(C)c1ccc(N)cc1)Cc1ccccc1 2034780771 BBJSMIYPXNDLGI-UHFFFAOYSA-N 340.427 1.480 10 10 EDCE COc1ccc(CNC(=O)[C@H]2CN(C)C[C@@H]2C(F)(F)F)c(O)c1 2063978326 MAZWIMNBIVNIMG-RYUDHWBXSA-N 332.322 1.757 10 10 EDCE CNCc1ccc(N2CC[C@]3(CNC(=O)N3)C2)cc1Br 2177687020 FZLUOCKDPOQEFX-AWEZNQCLSA-N 339.237 1.430 10 10 EDCE COCC1(O)CCN(c2ccc(CN)c(Br)c2)CC1 2095540594 LPTXCOQRFWDJDP-UHFFFAOYSA-N 329.238 1.886 10 10 EDCE C[C@H](CO)N1CCN(c2ccc(CO)c(Br)c2)CC1 2113064728 UFAZVESJHLAYEM-LLVKDONJSA-N 329.238 1.444 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1COc1nnc(=N)[nH]n1 2213779143 PRDQEFPPTPLXIT-QWRGUYRKSA-N 338.412 1.389 10 10 EDCE OC[C@@H]1NC[C@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@H]21 2235576899 UZLLEXZVMVEEBV-NDMJEZRESA-N 345.212 1.306 10 10 EDCE COc1ccc(N2C(=O)C(=CN3CCCCC3)C(=O)NC2=S)cc1 2297560263 ILWMBEMMJRAJNL-UHFFFAOYSA-N 345.424 1.813 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@@H]3[C@H]4CO)c(Br)cc2[C@@H]1O 2358060594 VKVFVBGIRNGYLT-PSJVCNGCSA-N 339.189 1.252 10 10 EDCE C[C@@H]1C[C@@H](O)CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 401693420 HVOAUEGEWQISMM-OTPXZMOZSA-N 340.221 1.608 10 10 EDCE C[C@@]1(c2cc(I)ccc2O)COCC(=O)N1 1951665727 IDVBFCQOMYCAQM-NSHDSACASA-N 333.125 1.358 10 10 EDCE CNC(=O)N1CCN(c2ccc(CO)c(Br)c2)CC1 721688584 QWNICCVZCXFZSM-UHFFFAOYSA-N 328.210 1.403 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CCOC[C@@H]1C 819698923 TYAFJZPKJQRYCX-ZFWWWQNUSA-N 335.400 1.957 10 10 EDCE COCCNC1CCN(Cc2ccc(N3CCN(C)CC3)cc2)CC1 844899857 HCVIPHHHJQCMKU-UHFFFAOYSA-N 346.519 1.639 10 10 EDCE COC[C@H]1C(=O)N[C@@H](c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)N1C 840828020 FDANWYDBJLIEEJ-JKSUJKDBSA-N 348.403 1.660 10 10 EDCE CCn1nnc(CNCc2cc(Br)cc(F)c2O)n1 1893033707 BMOCOHDQCDMXJB-UHFFFAOYSA-N 330.161 1.590 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](CC(C)C)C(N)=O)C2)cc1 855224514 LFTMJVZRQBIFLJ-XJKSGUPXSA-N 333.432 1.538 10 10 EDCE Cn1nccc1[C@@H](O)CNCc1c(O)cccc1Br 922970523 PMWYFZRLPUSOLL-ZDUSSCGKSA-N 326.194 1.711 10 10 EDCE COC[C@H]1CN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CCO1 852452604 BPJSAYCEJGPNLN-RHSMWYFYSA-N 349.431 1.331 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CC[C@@H](O)C3)C2)cc1 854299672 QPCKKMIWHZAVCL-OFQRWUPVSA-N 333.432 1.734 10 10 EDCE C[C@@H](NC[C@@]1(OCCO)CCOC1)c1cc([N+](=O)[O-])ccc1O 850508011 LMENYLZHCPZKPM-ABAIWWIYSA-N 326.349 1.119 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)N[C@H](CC(F)F)C3=O)C2)cc1 924977276 HPOJSICOSLRCKZ-DGCLKSJQSA-N 339.342 1.850 10 10 EDCE CCN1CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 852453447 JFGVAWMSUVMKQF-AWEZNQCLSA-N 346.431 1.148 10 10 EDCE O=C1Nc2cc(N3[C@H]4COC[C@H]3C4)c(Br)cc2[C@H]1O 1899612597 AWJRMWQJOPNSAR-NQYJQULFSA-N 325.162 1.412 10 10 EDCE COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CC3(C)C)CC2)cc1 751801112 ZAFPHJNFFJZVBP-INIZCTEOSA-N 346.427 1.933 10 10 EDCE CCOC(=O)CC1(S(=O)(=O)N[C@@H](C)c2ccccc2O)CC1 867836096 FIEZEKJXPSLGEH-NSHDSACASA-N 327.402 1.858 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCCS(=O)(=O)C[C@@H]2C)c1O 933318351 WENBYMGBIJHCHK-JTQLQIEISA-N 329.393 1.743 10 10 EDCE C[C@H](Nc1ccc(C(=O)NCCO)nn1)c1ccc(N(C)C)cc1 772299129 BOQDWMAWERMQAQ-LBPRGKRZSA-N 329.404 1.438 10 10 EDCE O=C1Nc2cc(N3CC4(CN(Cc5ccccc5)C4)C3)ccc2[C@@H]1O 706203198 KYNZWNLOAIIYTP-SFHVURJKSA-N 335.407 1.994 10 10 EDCE C[C@H](O)c1ccc(N(C)CCN(C)CCO)c(Br)c1 691271965 MXMAEMXLVOWDDB-NSHDSACASA-N 331.254 1.863 10 10 EDCE CCN1CC[C@H]1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1155603921 LMSSRVRBUIGOMN-KRWDZBQOSA-N 344.459 1.099 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCc1nc(-c2ccccc2)n[nH]1 1153885780 CZRJOCGWPXJNNK-UHFFFAOYSA-N 338.367 1.784 10 10 EDCE C[C@@H](C(=O)NCc1ccc(O)cc1O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1162271653 MJNRWGMRMGWBCC-LEWSCRJBSA-N 346.383 1.278 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC(Cc2ccco2)C1 1331446416 HONVTULIHKTFQZ-UHFFFAOYSA-N 328.368 1.645 10 10 EDCE O=C1N[C@H]2CN(C(=O)c3cc4cc(O)c(O)cc4s3)CC[C@@H]2CO1 1333878633 BLBPMHPHLYDXGU-SCZZXKLOSA-N 348.380 1.883 10 10 EDCE CCOc1ccc(N2CCN(C(=O)/C=C\Cn3cncn3)CC2)cc1 1331929524 TUURISUVTONZRE-ARJAWSKDSA-N 341.415 1.582 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C2(C(N)=O)CC2)cc1C 1274325210 KXINQJPXWNIGDF-ONEGZZNKSA-N 331.416 1.031 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H](C[C@@H]1COCCO1)C(F)(F)F 1455355183 QQYCLRVKLFCHNN-NEPJUHHUSA-N 349.305 1.698 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1nnc(C2CC2)n1C1CC1 1466674492 XKMBEPWVBHTTCG-UHFFFAOYSA-N 328.372 1.761 10 10 EDCE CN(C)C(=O)/C=C\C(=O)NCc1ccc(N2CCSCC2)cc1 1541081092 SAQVCKWYLMYSTD-FPLPWBNLSA-N 333.457 1.500 10 10 EDCE COC(=O)[C@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)[C@@H]1CCOC1 1472399716 JKCADBYOJALCAI-UXOHQCDBSA-N 335.356 1.053 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cnc(C)s2)cc1C 1482712601 FPJHCYPBODKYFY-CQSZACIVSA-N 349.456 1.649 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3CCNC(=O)C3)CC2)cc1C 1499200011 ZOSIXPYNFNSBFX-OAHLLOKOSA-N 345.443 1.268 10 10 EDCE C[C@H]1CCN1C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1119436571 CCHUFMBASAAYSZ-UONOGXRCSA-N 331.416 1.321 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985100622 IEARHZZWCMPUAH-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)NOCCNC(=O)CCOc1ccc(N)cc1 1999128741 PHFMMGXGMDHBJF-UHFFFAOYSA-N 339.392 1.610 10 10 EDCE CCn1nnc(Br)c1[C@H](O)[C@H](NC)c1ccccc1O 2156519837 FYKPAMDTRQOSEL-ZYHUDNBSSA-N 341.209 1.760 10 10 EDCE CN(CC1(C)COC1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 702975934 ADDBTPGUEPTCPA-LBPRGKRZSA-N 340.221 1.874 10 10 EDCE CN1C(=O)N[C@@H]2CN(c3ccc(CO)c(Br)c3)CC[C@H]21 2171297996 SZWMSDPIKDSVCG-CHWSQXEVSA-N 340.221 1.544 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H](C)c3cc4n(n3)CCCC4)c2n1 2062257237 QGGQELITXRDEKS-NSHDSACASA-N 340.387 1.767 10 10 EDCE O=C1Nc2cc(N3CCOC4(CC4)C3)c(Br)cc2[C@H]1O 2168294199 OZVRRBBPGVURLV-GFCCVEGCSA-N 339.189 1.804 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4[C@H](CO)[C@@H]4C3)c(Br)cc2[C@H]1O 2182047539 HDYYRNLLETVYAJ-LOKDSWTASA-N 339.189 1.109 10 10 EDCE NC(=O)CCN1CCC(Nc2c(N)cccc2Br)CC1 2187330954 NZHHAPHMNOSOCO-UHFFFAOYSA-N 341.253 1.783 10 10 EDCE O=S1(=O)C[C@H]2CN(c3ccc(CO)c(Br)c3)C[C@@H]2C1 2087855645 FDHKDMCQJGQOCR-GHMZBOCLSA-N 346.246 1.422 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@@]2(CO)CO3)cc1Br 2094650221 ZXBZJECJHULCNC-TZMCWYRMSA-N 327.222 1.509 10 10 EDCE COc1ccc(Br)c(CN2CC[C@](N)(C(=O)O)C2)c1O 2236034982 WVLBWEVVZLEZQY-CYBMUJFWSA-N 345.193 1.151 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@H](O)C2)c(OC)c1Br 2226544144 GIFLTWNSPUIFPX-IUCAKERBSA-N 332.194 1.398 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CC(=O)N(CC(F)(F)F)C2)c(O)c1O 177687319 HUTBLKBFUYCDGD-QMMMGPOBSA-N 332.278 1.299 10 10 EDCE CCN(CCO)C(=O)C(=O)N(c1ccccc1)c1ccc(N)cc1 170388130 KREQLGKXJRVMEU-UHFFFAOYSA-N 327.384 1.774 10 10 EDCE CCN(Cc1cc([N+](=O)[O-])ccc1O)[C@@H](C)CS(=O)(=O)CC 173394651 VUGUNMBTGHAQCX-NSHDSACASA-N 330.406 1.946 10 10 EDCE CCOc1ccc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1 61978277 HIGUWBFCVOKYFG-UHFFFAOYSA-N 342.399 1.846 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCN(C)C)CC2)c(OC)c1 243821719 QVPAGIAXHKBNKQ-UHFFFAOYSA-N 336.436 1.097 10 10 EDCE C[C@@H]1[C@@H](C)[S@](=O)CCN1C(=O)NCc1ccc(N(C)C)c(F)c1 265524266 AMKOZBQXJOZKJM-VXEWELBQSA-N 341.452 1.943 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCS(=O)(=O)C(C)(C)C2)c1O 278207426 JTKFDACOHNUXJX-UHFFFAOYSA-N 344.389 1.318 10 10 EDCE CC(=O)C(=O)COC(=O)C[C@H]1CSCCN1C(=O)OC(C)(C)C 808529739 RCJIYRXOFKKTLS-NSHDSACASA-N 345.417 1.430 10 10 EDCE C[C@H](NC(=O)C(=O)N1CCO[C@@H](C2CC2)C1)c1ccc(N(C)C)cc1 807677694 RTRQSCUSLFRWOU-SUMWQHHRSA-N 345.443 1.567 10 10 EDCE Cc1cc(O)c(CN[C@@H]2CCC[C@H]2CNS(C)(=O)=O)cc1C 800309813 SBWJZHYQCGRFEX-DZGCQCFKSA-N 326.462 1.817 10 10 EDCE C[C@@H]1CCN(C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c2ccccc21 132553889 VKQXOPODMWPTEQ-LJTDUEICSA-N 339.395 1.638 10 10 EDCE COc1ccc(N2CCC(NC(=O)NCc3ccnn3C)CC2)cc1 726612681 DFYGOJNYVWWWPK-UHFFFAOYSA-N 343.431 1.897 10 10 EDCE NCC(F)(F)CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 846678314 XZVKVVGXNOWAMO-ZDUSSCGKSA-N 328.359 1.884 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@](C)(CCF)C(=O)O)cc1F 849237285 UWITVTHVRPNJKF-HNNXBMFYSA-N 329.347 1.894 10 10 EDCE COc1ccc(N2CCN(CCN[C@H](C)c3ccnnc3)CC2)cc1 924833559 XRKIFVQAEQCGSM-MRXNPFEDSA-N 341.459 1.958 10 10 EDCE Cc1ccc(C(=O)NC[C@H](O)C(F)(F)C(F)(F)F)c(O)c1O 922242681 NIXFTPNLBMGHBP-ZETCQYMHSA-N 329.221 1.695 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCCCCNC(N)=O)C2)cc1 857302593 WEKDLXFUCUEANL-AWEZNQCLSA-N 348.447 1.619 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CCCN(C)C3)C2)cc1 852188738 LQERWWSVWRGZQR-HOTGVXAUSA-N 346.475 1.915 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3C[C@@H]4CCC[C@]4(CO)C3)cc2N1 858804328 OLUCBCLKHLBOHE-MGPLVRAMSA-N 333.344 1.525 10 10 EDCE CO[C@@H]1CS(=O)(=O)C[C@@H]1Nc1c(N)cccc1Br 697459560 DVSRWUPPHGSNEK-VHSXEESVSA-N 335.223 1.255 10 10 EDCE COc1cc(N2CCC[C@](O)(CN(C)C)C2)c([N+](=O)[O-])cc1OC 865923718 AIXFXUFGIMKLLA-INIZCTEOSA-N 339.392 1.505 10 10 EDCE COCCc1nc(COc2ccc(N(C)C)c(C(=O)OC)c2)no1 865395376 PLHBQCFTDBVVBV-UHFFFAOYSA-N 335.360 1.690 10 10 EDCE CN(CC(=O)NCc1ccc2cccnc2c1O)[C@H]1CCSC1 862026993 GKVPSTFQXYCXBQ-AWEZNQCLSA-N 331.441 1.994 10 10 EDCE O=C(Cc1csc(N2CCOCC2)n1)N1Cc2cccc(O)c2C1 871204544 GGJCBISVRJFHDK-UHFFFAOYSA-N 345.424 1.770 10 10 EDCE COc1cc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)ccc1O 797819268 CMCOVWSTWDOILT-UHFFFAOYSA-N 335.341 1.784 10 10 EDCE C[C@H]1CN(c2ccc(CO)c(Br)c2)CCS1(=O)=O 707379916 WODROPIWEPWKPB-VIFPVBQESA-N 334.235 1.565 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@H]1CC(=O)N(c2ccccc2F)C1 1162277904 CYMIORCFEVWPKX-LBPRGKRZSA-N 344.342 1.906 10 10 EDCE CCOc1ccc(N2CCN(S(=O)(=O)N(C)C3CC3)CC2)cc1 1324585190 WPJHVJCQRAFGMK-UHFFFAOYSA-N 339.461 1.546 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)c(Br)c1 2126153887 AVRXTJXJPKRRAT-DJBIQUGXSA-N 328.206 1.119 10 10 EDCE CN1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)CCC1=O 1330045855 LZPDNWZDRFPNCA-UHFFFAOYSA-N 330.432 1.443 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1Cc2cnccc2NC1=O 1455338526 INIDHPRYCVOHOF-CXLRFSCWSA-N 325.324 1.186 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@]1(C)C[C@H](O)CN1C 1540567384 KNGQQJFOMJHVAJ-HKUYNNGSSA-N 331.460 1.700 10 10 EDCE CC(C)[S@](C)(=O)=NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1638932958 LZEABZULWVTOMK-FQEVSTJZSA-N 334.419 1.410 10 10 EDCE COc1nsc(OC)c1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 1632681300 PAHMCSJIZSPBMX-QMMMGPOBSA-N 338.385 1.933 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1ccc2nc(O)[nH]c2n1 1638573441 XLMRTKPZSHEXEN-UHFFFAOYSA-N 335.323 1.847 10 10 EDCE C[C@@H]1CN(c2ccc(CN)c(Br)c2F)CC(=O)N1C 1925966450 CWTXBKZGLKOCSR-MRVPVSSYSA-N 330.201 1.714 10 10 EDCE CCn1nncc1C(=O)N(C)C[C@@H](C)NCc1ccc(OC)c(C)c1 1734323010 BVYZRNFZCWICRA-CQSZACIVSA-N 345.447 1.865 10 10 EDCE COc1ccc(CNC[C@@]2(NC(=O)C(N)=O)CCCC[C@H]2C)cc1C 1732259028 SCUVMHSGTYGLND-KUHUBIRLSA-N 347.459 1.644 10 10 EDCE Cn1cc(Cl)c(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 1645087974 OWAWQTMNYRTGTP-UHFFFAOYSA-N 344.780 1.403 10 10 EDCE CO[C@@H](C)CC(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1579747149 ALQYEGWIWDQPEC-MNOVXSKESA-N 349.391 1.509 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2nc[nH]n2)cc1 1583521149 KBJUTBXQTWMJLI-UHFFFAOYSA-N 337.383 1.884 10 10 EDCE c1cc2c(cc1CN[C@@H]1CCN(CCN3CCOCC3)C1)CCO2 1655597665 VHYVHCOAXHMOJO-GOSISDBHSA-N 331.460 1.118 10 10 EDCE Cc1ccc(S(=O)(=O)N(C)C)cc1C(=O)NCc1ccccc1O 1595792682 LMDHJXWFFFGVAA-UHFFFAOYSA-N 348.424 1.881 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2COC(=O)N2)cc1C 1670079274 AJVCEXWMCDEUDE-AWEZNQCLSA-N 335.404 1.050 10 10 EDCE CCN(C(=O)c1cc(C)n(-c2ccccc2)c1C)[C@@H]1CC(=O)NC1=O 162542682 CVJVVHZLOLXLAA-MRXNPFEDSA-N 339.395 1.971 10 10 EDCE COC[C@](C)(CO)CNCc1c(Br)ccc(OC)c1O 1966040266 OMVHWVVHSAGJHZ-AWEZNQCLSA-N 348.237 1.898 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985093827 FYKQOGQVIFMGPT-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNCc1ccc(O)c(O)c1 1985190452 PNORRTVNHVQPTJ-MRXNPFEDSA-N 326.393 1.463 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2c(O)cccc2F)[C@@H](O)C1 2005089250 ODFUDFZLJKKZMU-HIFRSBDPSA-N 340.395 1.991 10 10 EDCE CNCc1ccc(N2CC[C@@H](N3CC(O)C3)C2)c(Br)c1 2158750381 DYPXVIOOLVMJDJ-GFCCVEGCSA-N 340.265 1.424 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2010391784 UXVPMUURVGBDOD-NWDGAFQWSA-N 339.396 1.970 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010391509 RVHJCONHXLISLW-NEPJUHHUSA-N 340.428 1.743 10 10 EDCE COC1(C(=O)N2CCC(N=[N+]=[N-])CC2)CN(C(=O)OC(C)(C)C)C1 2010404968 WBSUZVKSXHNRPC-UHFFFAOYSA-N 339.396 1.924 10 10 EDCE COc1ccc(N2CC[C@H](CO)[C@H](N)C2)c(OC)c1Br 2178906469 KFELKJJGTSOWKW-NXEZZACHSA-N 345.237 1.612 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NCc3ccc(N)cc3)CO[C@H]2C1 1907852278 USXSFZHBWNKBRY-XHSDSOJGSA-N 333.432 1.993 10 10 EDCE O=S1(=O)C[C@H]2CN(Cc3cccc(Br)c3O)C[C@@H]2C1 2087858510 NEURGTVLFQQCPO-GHMZBOCLSA-N 346.246 1.631 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)C[C@H]2CO)c(Br)c1 2089862710 CEBRDCZIVFIULX-NHCYSSNCSA-N 329.238 1.648 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H]3CO)c(Br)cc21 2092555539 OBJFFBLIRYTWJT-MADCSZMMSA-N 326.194 1.233 10 10 EDCE O=C(O)[C@H]1[C@H]2[C@@H]1OCCN2Cc1cc(Br)ccc1O 2092840762 HYFTZFJWTNFUKA-SDDRHHMPSA-N 328.162 1.439 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@@]2(CO)CO3)c(Br)c1 2094647620 WRBARAZFRPSTDG-GLXFQSAKSA-N 327.222 1.809 10 10 EDCE NCc1ccc(N2CC[C@@H]3OCCO[C@@H]3C2)cc1Br 2095385773 IMLKXOSPVBBSKK-UONOGXRCSA-N 327.222 1.902 10 10 EDCE COc1ccc(N2CCO[C@H](CO)C2)c(OC)c1Br 2226547391 QCKCUOZJRIKKDL-VIFPVBQESA-N 332.194 1.664 10 10 EDCE O[C@H]1CN(c2ccc(CNC3CCC3)c(Br)c2)C[C@@H]1O 2239980980 GAFDLSQVIGWEQM-GJZGRUSLSA-N 341.249 1.633 10 10 EDCE CC1(C)OCCN(c2ccc(CN)cc2Br)[C@H]1CO 2267738761 KSRVJMZCNMJDGT-ZDUSSCGKSA-N 329.238 1.884 10 10 EDCE CC(C)CN1C(=O)C(=CNc2ccc3c[nH]nc3c2)C(=O)NC1=S 2295113212 NNSKIGTVUIRSLA-UHFFFAOYSA-N 343.412 1.758 10 10 EDCE O=C1C(=Cc2ccncc2)SC(=S)N1CCS(=O)(=O)O 2293438629 HBHHXTGZYXZJOL-UHFFFAOYSA-N 330.412 1.171 10 10 EDCE CSc1ncc(CNC(=O)N[C@@](C)(C(=O)O)C(F)F)s1 2284503809 HBQJUPKFHWIYRJ-SNVBAGLBSA-N 325.362 1.773 10 10 EDCE CC(C)NCc1ccc(N2CC[C@H]2[C@@H](O)CO)cc1Br 2286209013 MXDXLEWONIUADT-GJZGRUSLSA-N 343.265 1.879 10 10 EDCE CCN(CC)C(=O)[C@H]1CCCN1C(=O)C=Cc1ccc(O)c(O)c1 2308001116 ARKSGJCYGOWIQA-CQSZACIVSA-N 332.400 1.970 10 10 EDCE CN1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)[C@@H]2C[C@@H]21 2355080995 WMUOWMHVTJYIDW-YNEHKIRRSA-N 337.221 1.294 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCO[C@H](CN(C)C)C2)c([N+](=O)[O-])c1 105796400 ODPZMRXLVLUWMD-HZRUHFOJSA-N 349.387 1.548 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]23)c1 246878106 DMZQUDJWQNIKAM-QYAIJTBZSA-N 336.413 1.538 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CN(C)CCO2)c(O)c1Br 2380748524 FRJKEBVZNDTUPV-LLVKDONJSA-N 343.221 1.410 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC(C(=O)NCc2ccccc2O)=NO1 282680918 JHCBIUCKWROCHG-LBPRGKRZSA-N 349.387 1.678 10 10 EDCE Cc1ccc(CNC(=O)CCn2cnnc2)c(O)c1Br 2380749657 QNVOZAGDINOYIA-UHFFFAOYSA-N 339.193 1.761 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc(C)ccc1I 808512368 RWNMQMJZIHEVPF-UHFFFAOYSA-N 346.120 1.915 10 10 EDCE COC1CCN(c2ccc(CN3CCn4c(O)nnc4C3)cc2)CC1 828873004 GJUXBXQBVBFCGI-UHFFFAOYSA-N 343.431 1.615 10 10 EDCE COC[C@@]1(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCOC1 825421009 ASHNNPCSKWNDOD-BEFAXECRSA-N 348.443 1.754 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)Cc1cc[nH]n1 839218755 AEKWTEROVXKOEG-UHFFFAOYSA-N 329.404 1.093 10 10 EDCE CCOC(=O)[C@@H](F)[C@H]1CCN(C(=O)c2ccc(C)c(O)c2O)C1 912251810 CNCVGGJNVORUNL-JQWIXIFHSA-N 325.336 1.770 10 10 EDCE Cc1cc(O)c(CN2CCN(CCC(=O)N(C)C)CC2)c(Cl)c1 840915632 DTHUANKDCNDYQP-UHFFFAOYSA-N 339.867 1.950 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CNCC[C@@H]2C)cc1 846173861 UQDFRYSBYQGHGA-WMLDXEAASA-N 334.464 1.771 10 10 EDCE COc1ccc(CCC(=O)N(CC(=O)O)Cc2ccccc2O)cn1 923109712 MIQLSDVXYWOYJG-UHFFFAOYSA-N 344.367 1.842 10 10 EDCE C[C@H](N)[C@@](C)(O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952209566 VWJGYGARLGTDRX-NCAQKEMTSA-N 340.420 1.632 10 10 EDCE O=C(NCc1c(O)cccc1F)c1ccc(N2CCOCC2)nc1 928709655 KILRNEOICXRQOI-UHFFFAOYSA-N 331.347 1.693 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H]1CC(=O)CO1 1952400408 GKAHREGIVMJAEV-SWLSCSKDSA-N 337.372 1.892 10 10 EDCE CC(C)(CNC(=O)N1Cc2cccc(O)c2C1)CS(C)(=O)=O 926747001 IJHIUCBHTXOROR-UHFFFAOYSA-N 326.418 1.488 10 10 EDCE C[C@@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCO1 923337449 PLMALSIAVDQUIW-OAHLLOKOSA-N 347.459 1.968 10 10 EDCE Cc1nnc(CN(C)c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)s1 853980641 WHTXAVCRAIZNIX-UHFFFAOYSA-N 335.345 1.722 10 10 EDCE Cn1cc(CCC(=O)NCc2cc(Br)ccc2O)nn1 854442345 OVIUIKQRKMNQDF-UHFFFAOYSA-N 339.193 1.532 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cn3nnnc3C(C)C)C2)cc1 855232783 XTHBNESMKUNGDS-ZDUSSCGKSA-N 344.419 1.200 10 10 EDCE C[C@@H](NC[C@H](O)CC1(O)CCC1)c1ccc(N2CCOCC2)cc1 859230353 VEAFOFDRBKJDHP-CRAIPNDOSA-N 334.460 1.840 10 10 EDCE CCC(=O)N1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 939922461 WQDRYPXBRSACHX-UHFFFAOYSA-N 331.376 1.934 10 10 EDCE COCc1ncc2c(n1)CCN(C(=O)/C=C\c1ccc(O)c(O)c1)C2 869683839 KGQSJFQCSSUULV-HYXAFXHYSA-N 341.367 1.632 10 10 EDCE COC(=O)[C@@]1(C)C[C@@H](OC)CN1Cc1ccc(N2CCOCC2)cc1 931382993 PIRTWEKJGVVQDI-IEBWSBKVSA-N 348.443 1.676 10 10 EDCE c1cnc(N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)nn1 862436375 DDUBCGJCHZDOTL-UHFFFAOYSA-N 340.431 1.030 10 10 EDCE CCON(CC)C(=O)CNCc1ccc([N+](=O)[O-])c(OC)c1O 862454700 XEXZWHNUQILRDK-UHFFFAOYSA-N 327.337 1.199 10 10 EDCE COC(=O)[C@]1(OC)CCN(Cc2c(O)cccc2Br)C1 862475244 DZSIYPMHJRMPES-AWEZNQCLSA-N 344.205 1.919 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N3CC=CC3)CC2)cc1 875171553 FPVLFGCKDOJXBU-UHFFFAOYSA-N 330.432 1.399 10 10 EDCE O=C1OCC[C@H]1CCCN1C(=O)CN(Cc2ccccc2O)C1=O 871908198 FXFODJBVHJCQGJ-GFCCVEGCSA-N 332.356 1.500 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nc(C)ns3)CC2)cc1F 790058505 OQQYHTVOIPKNOK-UHFFFAOYSA-N 336.392 1.957 10 10 EDCE O=C(NCc1nc(-c2ccccc2)n[nH]1)c1c(F)ccc(O)c1O 1182568579 KGFPPJVOOUIXIM-UHFFFAOYSA-N 328.303 1.952 10 10 EDCE N[C@@H]1CC[C@H](C(=O)O)N(Cc2c(O)cccc2Br)C1 2132273887 NSPOTWVTZUYCPI-LDYMZIIASA-N 329.194 1.531 10 10 EDCE C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)CC(F)F 1349194693 STPOTMCEDIGVPJ-SNVBAGLBSA-N 345.365 1.915 10 10 EDCE C[C@H]1CN(c2ccc(C=CC(=O)O)cc2Br)CC(=O)N1 1912028368 TZWYOIOFUMLFMZ-VIFPVBQESA-N 339.189 1.872 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccncc2)cc1C 1272353264 XFXLCVXIRUUJKX-MRXNPFEDSA-N 329.400 1.279 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCc2c(F)cccc2C1 1351837216 UCKVQYZEPPZZEX-UHFFFAOYSA-N 340.354 1.958 10 10 EDCE CO[C@H]1C[C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 1353691946 SETFKSRRQUTRKH-SAZUREKKSA-N 333.432 1.218 10 10 EDCE CC1(NCc2cc(Br)cc(F)c2O)CS(=O)(=O)C1 1918418380 GPCPCHJXYITTTQ-UHFFFAOYSA-N 338.198 1.571 10 10 EDCE C[C@H](NC(=O)/C=C/C(=O)N(C)C)c1ccc(N2CCOCC2)cc1 1544214570 AUCBBKNLXQPRNY-VFNNOXKTSA-N 331.416 1.345 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1C(=O)NCc1ccc(O)c(O)c1 1545639256 HYHVFDOCKMPTQF-RYUDHWBXSA-N 336.388 1.875 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCn2ncnc21 1626692829 CLAQVLHJRLLLMJ-INIZCTEOSA-N 341.415 1.309 10 10 EDCE CCOCCN1CC([C@H](C)NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1717565084 SQGLSGMQHZBGRG-LBPRGKRZSA-N 347.419 1.936 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC(=O)Nc1ccc(F)c(F)c1 1628279389 MGQUIZPWMYSOAJ-UHFFFAOYSA-N 336.294 1.673 10 10 EDCE COc1ccc(CNCC[C@@H]2[C@@H](C)CCCN2C(=O)C(N)=O)cc1C 1565938453 IPEXPABRWXYKLQ-XJKSGUPXSA-N 347.459 1.596 10 10 EDCE C[C@@]1(O)CN(c2ccc(CN)c(Br)c2F)CC[C@@H]1O 2136845631 KAQHPAYWUBWYIE-GXFFZTMASA-N 333.201 1.369 10 10 EDCE COCCOCC(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)C1 1566762151 LBVLDZKVFMNZHP-INIZCTEOSA-N 336.432 1.357 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2n(n1)CCCC2=O 1567467425 JCWFPJUOBKRMBP-JTQLQIEISA-N 329.356 1.632 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)c2cnc(O)n2C)cc1C 1725132776 MIJLONXZWSJIHD-STQMWFEESA-N 346.431 1.739 10 10 EDCE COCCCNC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1569431986 KMFPQMHLSHNIDO-UHFFFAOYSA-N 333.392 1.738 10 10 EDCE NS(=O)(=O)c1cc(C(=O)N2Cc3cccc(O)c3C2)c(Cl)o1 1632709258 QLTAQVUQMSLXHF-UHFFFAOYSA-N 342.760 1.442 10 10 EDCE CCOC(=O)[C@@]1(CNC(=O)c2ccc(C)c(O)c2O)CCCOC1 1641723295 PVDZTHZTNQTAKJ-QGZVFWFLSA-N 337.372 1.496 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)Cc2nnc(O)o2)c([N+](=O)[O-])c1 1651959525 VAYBNPHDUPNTJM-XQRVVYSFSA-N 334.288 1.506 10 10 EDCE C[C@H](NC(=O)N1CC[C@H]2COC(=O)N[C@@H]2C1)c1ccc(N(C)C)cc1 1671852266 VDUXZKSOLPJOJL-DUVNUKRYSA-N 346.431 1.954 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985102203 CWEGMUIPQJBVIW-UWVGGRQHSA-N 327.385 1.467 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@@H]2[C@@H](O)CO)cc1Br 2146335822 ZNSWPFXGXQAXPV-FZZIBODNSA-N 345.237 1.027 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1ccccc1O 2017514752 KCBLFBFNMZHQBF-UHIISALHSA-N 338.404 1.844 10 10 EDCE NCc1ccc(N2CCN3C[C@H](O)C[C@@H]3C2)c(F)c1Br 405226665 DKVYWTDSTNZSMO-GHMZBOCLSA-N 344.228 1.302 10 10 EDCE C[C@@]1(C(=O)O)CN(Cc2cc(Br)ccc2O)CCO1 711529016 WIMNODYTFOUPEL-ZDUSSCGKSA-N 330.178 1.830 10 10 EDCE CO[C@@H]1C[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)C1 1908252541 AEFYVMHOJGNKNQ-IJLUTSLNSA-N 339.396 1.922 10 10 EDCE COc1ccc(Br)c(CN2CC[C@@H]3CNC[C@@H]32)c1O 2227743049 NHSCNUKLCANGMV-SKDRFNHKSA-N 327.222 1.957 10 10 EDCE COc1ccc(Br)c(CN2CC[C@H]3CNC[C@H]32)c1O 2227743048 NHSCNUKLCANGMV-JOYOIKCWSA-N 327.222 1.957 10 10 EDCE CSc1ncc(CN[C@H]2CS(=O)(=O)C[C@H]2OC(C)C)s1 2284498721 JXSOACTYPDHXJL-WDEREUQCSA-N 336.504 1.545 10 10 EDCE OCc1ccc(N2CCC(C3(O)COC3)CC2)cc1Br 2287059861 SIZULODJOMCTTI-UHFFFAOYSA-N 342.233 1.919 10 10 EDCE CNC(=O)[C@@H]1CCCN1c1ccc(C=CC(=O)OC)cc1[N+](=O)[O-] 2297555652 CZTQENZJLMJENC-ZDUSSCGKSA-N 333.344 1.496 10 10 EDCE CC(C)C[C@H](CNC(=O)C=Cc1ccc(O)c(O)c1)N1CCOCC1 2307982245 VNQDIIYAGZXBEM-MRXNPFEDSA-N 348.443 1.974 10 10 EDCE CCOCCN1CCN(C(=O)C=Cc2ccc(O)c(O)c2)C[C@@H]1C 2308001490 NBRDCUJDRJDXKL-AWEZNQCLSA-N 334.416 1.680 10 10 EDCE C[C@@H](CNC(=O)C=Cc1ccc(N2CCOCC2)cc1)CC(=O)O 2311977760 HREBTRGCWKIRDF-CQSZACIVSA-N 332.400 1.763 10 10 EDCE Cc1ccc(CNCCCS(C)(=O)=O)c(O)c1Br 2327623164 DWSVECJKURNODW-UHFFFAOYSA-N 336.251 1.987 10 10 EDCE CNCc1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)c(Br)c1 2336475236 GCBCEMNRSWWIAH-MFKMUULPSA-N 345.262 1.402 10 10 EDCE COCCn1nc(Br)nc1[C@H](N)c1ccccc1O 2353783697 LEHJPPKNDREGTB-SNVBAGLBSA-N 327.182 1.441 10 10 EDCE Cc1cc(NC(=O)/C=C/c2ccc(N3CCOCC3)cc2)nc(=O)[nH]1 181880824 YIMPJQWHODGKLR-QPJJXVBHSA-N 340.383 1.567 10 10 EDCE CCNC(=O)N1CC[C@H](NC(=O)NCc2cccc(OC)c2O)C1 268563596 SZKAMLNZRRPEHT-LBPRGKRZSA-N 336.392 1.004 10 10 EDCE CCOC(=O)C1(C(=O)NCc2cc(OC)ccc2O)CCOCC1 802783299 MPPACNOAOUFPBC-UHFFFAOYSA-N 337.372 1.377 10 10 EDCE CO[C@@H]1C=CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2165073155 HZOVOPFDEQBSFO-OQPBUACISA-N 338.205 1.792 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@H]1CCc2nnc(C3CC3)n2C1 815834147 VBDFRWIRVHYIDT-ZDUSSCGKSA-N 342.399 1.488 10 10 EDCE C[C@@H]1C[C@H]1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 727846467 LUXNDWPDYXPNDS-IVMMDQJWSA-N 330.432 1.596 10 10 EDCE COC(=O)C[C@H](N)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 828987809 FKJZXNYBLBEBIQ-INIZCTEOSA-N 333.432 1.430 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](C)n3ncccc3=O)CC2)cc1 585200992 UAJGUSPMLCITCO-CQSZACIVSA-N 342.399 1.162 10 10 EDCE C[C@H]1CN(c2ccc(CNC(=O)NCCCN)cc2F)C[C@H](C)O1 841718994 YCXBWSFLFGOTDU-STQMWFEESA-N 338.427 1.587 10 10 EDCE COc1cc(O)c(CN2CCOC[C@@H]2c2ccnn2C)cc1OC 844758299 UVCOFGMSMPBMPM-CQSZACIVSA-N 333.388 1.716 10 10 EDCE Cc1cc(O)c(CNC2CCN(S(C)(=O)=O)CC2)c(Cl)c1 840876777 YZGFGWCBEGZYCV-UHFFFAOYSA-N 332.853 1.868 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1C[C@]12CCCN(C(=O)OC(C)(C)C)C2 848826809 QZKJXAUFHAUPFG-PXAZEXFGSA-N 339.388 1.725 10 10 EDCE CN(C)c1ccc(CN(CC2CN(S(C)(=O)=O)C2)C2CC2)cc1 929293996 BDECTUJVOSFUNC-UHFFFAOYSA-N 337.489 1.608 10 10 EDCE CCc1cccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)c1O 848889815 MUXJHIZAFKROEQ-VGWMRTNUSA-N 347.411 1.880 10 10 EDCE C[C@H](N)c1ccc(N2CCN(C)C[C@H]2CO)c(Br)c1 699486176 IANYNLJIQPSKOK-JQWIXIFHSA-N 328.254 1.582 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C)[C@@H](O)[C@H](C)C3)nc12 852503461 OTFAULOAYUMNRP-HBYGRHMLSA-N 348.403 1.060 10 10 EDCE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N(C)Cc1ccccc1O 860048184 RAJHGPHBWXFELQ-UHFFFAOYSA-N 349.431 1.160 10 10 EDCE Cc1ccc(O)c(CNC(=O)CCCCCCS(N)(=O)=O)c1 862756509 ZHYCXOGNDXBPEG-UHFFFAOYSA-N 328.434 1.556 10 10 EDCE CCN1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C(C)(C)C1=O 1138697891 DIXFFXIXAWTFBI-UHFFFAOYSA-N 331.376 1.932 10 10 EDCE COc1ccnc(OC)c1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1138152579 KVZJFBCDGTZJNK-SNVBAGLBSA-N 332.356 1.871 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)[C@@H]1CCC[C@@H]1O 708603212 YEIWPZUYMJUHNN-WXHSDQCUSA-N 341.205 1.784 10 10 EDCE CN(C(=O)/C=C/c1cncc(O)c1)c1ccc(N2CCOCC2)nc1 184800912 XPDMUKWAQZMZKO-GORDUTHDSA-N 340.383 1.695 10 10 EDCE COc1cc(N2CCC([C@H](F)C(N)=O)CC2)c([N+](=O)[O-])cc1OC 1163929912 LJVGNSMMTABEHS-AWEZNQCLSA-N 341.339 1.652 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CCC(C)(C)O1 1325767666 PZZNVEIAWXPWLJ-INIZCTEOSA-N 347.459 1.785 10 10 EDCE COc1nn(C)cc1NCc1ccc(N2CCN(C)CC2)c(F)c1 1324467414 RMZADXOAMQPYPP-UHFFFAOYSA-N 333.411 1.932 10 10 EDCE Cc1cc(N[C@H](C)Cc2ccc(O)c(O)c2)nc(S(C)(=O)=O)n1 1186078888 FNNHGHLKXZJDFR-SECBINFHSA-N 337.401 1.643 10 10 EDCE CC[C@@H](CO)N1CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 1185555267 MYAVBLAIGGNLDM-LBPRGKRZSA-N 339.392 1.505 10 10 EDCE COc1cc(C(=O)N2Cc3cccc(O)c3C2)ccc1OCC(N)=O 1455037705 UAHKRGNHTHUHGS-UHFFFAOYSA-N 342.351 1.421 10 10 EDCE C[C@@H](NC(=O)c1cc(S(N)(=O)=O)ccc1F)c1ccccc1O 1471194249 REULHORMYAMIJQ-SECBINFHSA-N 338.360 1.670 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C(C(N)=O)[C@@H]3C2)cc1Br 2136584473 CGEKIXYICGTKPM-WHGOUJPWSA-N 325.206 1.670 10 10 EDCE COc1cccc([S@@](=O)CC(=O)NCCc2ccc(O)c(O)c2)c1 1566369415 FBMVBVQJVVJRTL-DEOSSOPVSA-N 349.408 1.573 10 10 EDCE CC[C@H](CNS(C)(=O)=O)NC(=O)N[C@@H](C)c1ccccc1O 1564781445 HEBVGAJUUYVWEH-WDEREUQCSA-N 329.422 1.080 10 10 EDCE O=C(C1CC1)N1CC(NCc2ccc(Br)cc2O)C1 1926289427 FFGRFZPQRMJLGC-UHFFFAOYSA-N 325.206 1.865 10 10 EDCE COC1CCN(c2ccc(CN3CCOC[C@@H]3CC(N)=O)cc2)CC1 1653920681 DAFQHSVDKBDBJM-KRWDZBQOSA-N 347.459 1.378 10 10 EDCE O=C1NCC[C@@H]1CCNCc1cc(Br)cc(F)c1O 1887179163 FZJUUGQRAPFFKU-QMMMGPOBSA-N 331.185 1.910 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)NCCCCN=[N+]=[N-])C1 1964942697 GOAYLZFYLRXNQK-UHFFFAOYSA-N 327.385 1.565 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 1985100895 KLRBOOTXIOJGEA-QWRGUYRKSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCO[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003172864 RAMVKXPDIPBGLV-RTWAVKEYSA-N 340.420 1.182 10 10 EDCE CC[C@@]1(O)CCN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2150760199 LCZQZHRGISRNSM-TZMCWYRMSA-N 341.205 1.786 10 10 EDCE COC(=O)[C@H](CC(=O)N1CC[C@@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 2010394123 AJRALRPZNLBLGY-ZJUUUORDSA-N 341.368 1.354 10 10 EDCE COc1ccc(O)c(Cn2ncc(I)c2O)c1 2070498002 FPXZTSPBUQNCSL-UHFFFAOYSA-N 346.124 1.956 10 10 EDCE O=C1Nc2cc(N3CC4(CC[C@@H]4O)C3)c(Br)cc2[C@H]1O 2179697155 JAOPCYSAJDYREI-NWDGAFQWSA-N 339.189 1.396 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)cc1Br 2190452458 DWQRSCAAJRNHQH-VJMWFJFBSA-N 342.233 1.965 10 10 EDCE CN(C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1ccc(O)cc1 2067785974 ARVAJCANSCJJMK-HUUCEWRRSA-N 348.399 1.939 10 10 EDCE N[C@@H]1CN(Cc2c(O)cccc2Br)[C@@]2(CCOC2)C1 2098287778 RTRVFKUIMCUZJN-HZMBPMFUSA-N 327.222 1.847 10 10 EDCE COc1ccc(N2CC(O)(CNC(=O)OC(C)(C)C)C2)cc1OC 2214261076 QEFTYJPNTDMJSU-UHFFFAOYSA-N 338.404 1.780 10 10 EDCE COc1ccc(Br)c(CN2CC=C[C@@H]2C(=O)O)c1O 2227745423 WSJSNMKSOHRORC-SNVBAGLBSA-N 328.162 1.988 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3OCC[C@]3(CO)C2)cc1Br 2296392926 RTIGDBDSPKBUNW-UONOGXRCSA-N 345.212 1.635 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@@H](O)CN(C(=O)OC(C)(C)C)C1 2300531861 MZUKGCMUIUBGMU-NWDGAFQWSA-N 341.412 1.763 10 10 EDCE Cc1ccc(CNCc2cc(CO)n[nH]2)c(O)c1Br 2352677776 BCDNGUVNOPMKQJ-UHFFFAOYSA-N 326.194 1.968 10 10 EDCE C[C@@H](O)CN1CCC(CN(C)C(=O)/C=C/c2ccc(O)c(O)c2)CC1 181153339 RTMFRCSYOOOJGB-YVARQFDVSA-N 348.443 1.662 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCO[C@H](Cn2cccn2)C1 181069036 CYBDKBMFFGAZOD-KQIUPUNMSA-N 329.356 1.235 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3[C@@H](C)COC[C@@H]3C)CC2)cc1 77365671 WZEBKWYRFQNXEP-HOTGVXAUSA-N 347.459 1.453 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[C@@H]1C(=O)O 326296462 HRZSMRGOTRFLFK-BDAKNGLRSA-N 335.316 1.473 10 10 EDCE COC(=O)c1cc(S(=O)(=O)NCCc2ccc(N)cc2)ccc1C 193338950 RIYPVJQMEHHNNG-UHFFFAOYSA-N 348.424 1.885 10 10 EDCE COC[C@H]1CN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])CCO1 266295975 XMJOQWLBQYLXQG-DIECRNLCSA-N 336.344 1.633 10 10 EDCE Cc1ccc(CN2CC[C@H](N3CC(O)C3)C2)c(O)c1Br 2380806198 TWDSABJLBNTHNK-LBPRGKRZSA-N 341.249 1.714 10 10 EDCE COc1cc(C(=O)OCC(=O)C(C)=O)cc(Br)c1OC 808548992 NXGIQYWYMCRMDK-UHFFFAOYSA-N 345.145 1.781 10 10 EDCE CN(Cc1cc[nH]n1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803688090 KUPQVLMSBBMOKH-UHFFFAOYSA-N 341.415 1.067 10 10 EDCE COc1cncc(C(=O)NCc2cc(Br)ccc2O)n1 804736069 MYALOCWNYVVIGP-UHFFFAOYSA-N 338.161 1.883 10 10 EDCE Cc1cccc2c1CCCN2C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 733990051 MOTMIBCCUFTSHU-KTKRTIGZSA-N 339.395 1.385 10 10 EDCE CN(Cc1ccccc1O)C[C@H](O)COc1ccc2c(c1)OCO2 731843024 NRZXUIKEJUHKJS-AWEZNQCLSA-N 331.368 1.993 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cn([C@@H]2CC[C@H]2O)nn1 900025665 DNTNYAZJKRTFEQ-HZPDHXFCSA-N 329.404 1.312 10 10 EDCE COC(=O)C1CC2(C1)CN(Cc1cccc(C)c1O)C[C@H]2C(=O)O 903695130 PKHLTFJQGAKUAI-FVRSWCFKSA-N 333.384 1.786 10 10 EDCE Cc1cc(COCC(=O)NC[C@H](N)c2ccc(N(C)C)cc2)on1 832286369 YRDITQUVQWGTLS-INIZCTEOSA-N 332.404 1.382 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CC(F)(F)CN 846674059 ZQGMJEGWXDBQQO-UHFFFAOYSA-N 327.375 1.466 10 10 EDCE COC(=O)[C@@H](NCc1ccc(N2CCOCC2)cc1)c1ccnn1C 843430431 UOPSIHLKNALVCL-KRWDZBQOSA-N 344.415 1.261 10 10 EDCE COC(=O)/C=C\c1ccc(N2Cc3nn(C)c(N)c3C2)c([N+](=O)[O-])c1 856764494 CJGRNKYUOXYCRQ-XQRVVYSFSA-N 343.343 1.617 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3ccn(C)n3)C2)cc1 852235480 ZPYIZTYKFHIHNH-AWEZNQCLSA-N 329.404 1.507 10 10 EDCE CCOC(=O)[C@@H](N)C(=O)NCc1ccc(N(CC)CC)c(F)c1 852866451 HJIOEJMULJRJNZ-AWEZNQCLSA-N 325.384 1.179 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H](C)O[C@H](CO)C3)C2)cc1 854299102 LEAYYVREBIYVDG-ZQIUZPCESA-N 349.431 1.065 10 10 EDCE Cc1cc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2C)no1 774206068 IQPHHFDNFICOJW-UHFFFAOYSA-N 344.415 1.632 10 10 EDCE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(C)ccc1O 770373305 HCDKHCMYMHKBPG-XOUADPBQSA-N 333.384 1.626 10 10 EDCE Cc1nnc(CN(C)CC(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1C 775412593 ZPKHACXCBZUKMX-CYBMUJFWSA-N 344.463 1.499 10 10 EDCE C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 899414301 QYPSIGQOQZRFLE-RSLMWUCJSA-N 338.429 1.786 10 10 EDCE O=S(=O)(Nc1cccc2c1OCC[C@@H]2O)c1cccc2nonc12 795346957 BFPZYHWTAQEFJW-LBPRGKRZSA-N 347.352 1.840 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cc[nH]n3)cc2)CC1 1155603524 DGWLHTWLORHACF-UHFFFAOYSA-N 327.388 1.041 10 10 EDCE CS(=O)(=O)c1cc(C(=O)NCc2c(O)cccc2O)ccc1F 1156885560 JMTSZAXCPCMGHS-UHFFFAOYSA-N 339.344 1.570 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)NCc2nnc(O)n2C)cc1 1163561320 BAKWRPMGBOVIJG-UHFFFAOYSA-N 325.372 1.858 10 10 EDCE O=C(NCc1c(O)cccc1F)N[C@@H]1CCN(c2cc(O)ncn2)C1 1251451223 SBODZEXSUVJZMX-SNVBAGLBSA-N 347.350 1.105 10 10 EDCE Cc1cc([C@@H]2CCCN2C(=O)C(=O)N2Cc3cccc(O)c3C2)no1 1329405638 WRBRGAKQANAEOS-HNNXBMFYSA-N 341.367 1.895 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1C[C@H](CO)[C@@H](CCO)C1 1346297754 ZGMJXFCHPLQECV-JKSUJKDBSA-N 335.448 1.193 10 10 EDCE C[C@H](O)C(C)(C)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1348861174 RGIKPPZIPMOYIE-AWEZNQCLSA-N 349.475 1.854 10 10 EDCE Cn1ncc(Br)c1NC(=O)c1cc(O)c(O)c(O)c1 2132404433 RTVXGQWJBIZMHX-UHFFFAOYSA-N 328.122 1.552 10 10 EDCE CC[C@@H](F)C(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1354638329 JZJFKMRVHLVOBG-JOYOIKCWSA-N 337.355 1.832 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(O)cn1 1539301729 FYTQTBVNHHCTNI-UHFFFAOYSA-N 327.384 1.896 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccnc4[nH]nnc34)CC2)cc1 1465890070 ULEAZGACGUFLPS-UHFFFAOYSA-N 338.371 1.324 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@H]2CCCNC2=O)cc1C 1700752866 APXPZXCMIGCXJF-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)/C=C/c2ccco2)cc1C 1485970913 WPAFAQPSBXFOQB-IQIBNGDESA-N 344.411 1.877 10 10 EDCE C[C@]1(O)CN(c2cc(Br)c(CN)cc2F)CC[C@H]1O 2136847610 NRNPHVLSTGZIKN-OLZOCXBDSA-N 333.201 1.369 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H](C)S1(=O)=O 1641951941 XGBGKIIMXLOQNF-AOOOYVTPSA-N 338.389 1.497 10 10 EDCE CCn1ncc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1C 1651295236 JBXHUSCDOWEFIU-UHFFFAOYSA-N 338.389 1.541 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC/C=C\CNC(=O)C2CC2)cc1 1759617154 GNBWFKDVTZYSKT-NNTZTVAXSA-N 329.360 1.661 10 10 EDCE CCOC(=O)/C(=C\c1cnc(N2CCOCC2)s1)c1nccn1C 1772825967 BARGWKCSIAGJIN-RAXLEYEMSA-N 348.428 1.817 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2COCCO2)cc1C 1698819334 XBXOPRSRERJRHV-YOEHRIQHSA-N 336.432 1.356 10 10 EDCE COc1cc(NC(=O)CCN2C(=O)CSC2=S)cc(OC)c1 1865768399 LPIATGVLXKLQOG-UHFFFAOYSA-N 340.426 1.893 10 10 EDCE CNCc1ccc(N2CC[C@H](NC(C)=O)C2)cc1Br 234376409 WXLPOFUCECFQNH-LBPRGKRZSA-N 326.238 1.883 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)([C@H](F)C(=O)NCCCN=[N+]=[N-])C1 1985098819 BFXJADGTJQIHJI-SECBINFHSA-N 331.348 1.123 10 10 EDCE COc1cccc(O)c1CN[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 2011487468 MNEPYOZPMOZVOI-TZMCWYRMSA-N 338.404 1.471 10 10 EDCE NC(=O)CCN(Cc1ccccc1)c1cc2c(cc1N)OCC(=O)N2 2034749361 ULUHMEVMFAFTLB-UHFFFAOYSA-N 340.383 1.482 10 10 EDCE O=C(O)CN1CCC[C@H](NCc2c(O)cccc2Br)C1 2169326219 YYMGQOTUMPHDTN-JTQLQIEISA-N 343.221 1.793 10 10 EDCE O=C(O)C[C@@]1(O)CCCN(Cc2cc(Br)ccc2O)C1 2160855055 WZYFFMNHSHSBPX-AWEZNQCLSA-N 344.205 1.956 10 10 EDCE CC1(C)[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 380770026 QBUWLPMEVFGTNQ-NWDGAFQWSA-N 340.221 1.751 10 10 EDCE COc1ccc2c(c1)CN(C(=O)c1cnn3c(O)cc(C)nc13)CC2 2063819429 FFBRIYMQRVZLQR-UHFFFAOYSA-N 338.367 1.950 10 10 EDCE O=C1NC[C@]2(CCCN(Cc3cccc(Br)c3O)C2)N1 2177676356 LJROLLGDWJPDEM-AWEZNQCLSA-N 340.221 1.802 10 10 EDCE C[C@H](N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)c1c(O)cccc1O 1908512389 XTNWTPYVXANWHR-WDMOLILDSA-N 338.404 1.729 10 10 EDCE O=c1nc(CNCc2cc(Cl)cc(Br)c2O)[nH]o1 2052630864 BMXDKGBAYPZKTE-UHFFFAOYSA-N 334.557 1.774 10 10 EDCE O=C1Nc2cc(N3CC=C[C@H](O)C3)c(Br)cc2[C@@H]1O 2108771873 BAVFMPZMGPZGRQ-MADCSZMMSA-N 325.162 1.172 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])n1 2225792692 PGXFVKPGALBINY-SFYZADRCSA-N 349.214 1.692 10 10 EDCE NC(=O)[C@@H]1CCCCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297553732 FULLBDWBCMXKHE-KRWDZBQOSA-N 343.427 1.403 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(C[C@H]2CCOC2)CC1 2308001779 ONDVRUAUQBVLIN-OAHLLOKOSA-N 332.400 1.292 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3cccc(Br)c3O)C[C@H]21 2314965109 TYEJMWLAUWKPMP-GXSJLCMTSA-N 332.219 1.384 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H]2CCCn3ncnc32)c1 177321802 PPWNVZILSDNHNK-ZWNOBZJWSA-N 331.376 1.888 10 10 EDCE Cc1ccc2c(c1)/C(=C1\SC(=S)N([C@H](C)C(=O)O)C1=O)C(=O)N2 38185651 VWBAEVPDXVDJPP-XQTQKYGKSA-N 348.405 1.992 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cc3c(=O)[nH]cnc3cn2)cc1F 187273880 BAIZXBODBOAEBM-UHFFFAOYSA-N 341.346 1.453 10 10 EDCE C[C@H]1C(=O)NCCN1c1ccc(/C=C/C(=O)O)cc1Br 235351708 HHTHEVHCCZKBSX-SGRBOOSSSA-N 339.189 1.872 10 10 EDCE COc1cc(Cl)cc(CN2CCC[C@@H](CS(N)(=O)=O)C2)c1O 273703622 DXZNGAQSQBIHAI-SNVBAGLBSA-N 348.852 1.555 10 10 EDCE CNC(=O)C1CN(c2ccc(/C=C/C(=O)O)c(Br)c2)C1 381877897 CVAMYYCSQJKZDT-HWKANZROSA-N 339.189 1.729 10 10 EDCE CN(C[C@H]1C[C@@H](O)C1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 703878037 KBBRBABOKOHJRA-DAROEXNTSA-N 340.221 1.608 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN1c1ncnc2sccc12 808514491 GCQAWVBAVNQHKB-NSHDSACASA-N 333.369 1.361 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@]23[C@H]4C(=O)[C@H]5[C@H]6C[C@@H]([C@@H]52)[C@@H]3[C@H]64)c1 800519999 YKGZHIQMSRCRSS-JOAVENAKSA-N 325.364 1.344 10 10 EDCE CN(C[C@]1(O)CCOC1)c1ccc(CN)c(Br)c1F 2129437437 RHBPJTXWDSFVKR-CYBMUJFWSA-N 333.201 1.635 10 10 EDCE C[C@@H](C(N)=O)N(C)c1ccc(/C=C/C(=O)O)c(Br)c1 711183588 DUOAZGIVAZSWKC-JQTRYQTASA-N 327.178 1.857 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C[C@@H](C)CS(C)(=O)=O 823581366 HNJXJVWXPZAXAN-CYBMUJFWSA-N 343.445 1.438 10 10 EDCE COC(=O)N1CCC[C@@H]([C@H](C)NC(=O)c2c(F)ccc(O)c2O)C1 828857435 CBSQAECYCCMMSV-VHSXEESVSA-N 340.351 1.834 10 10 EDCE Cc1c(S(=O)(=O)NCc2ccccc2O)coc1C(=O)N(C)C 827187639 HRZBOKHQANJVAH-UHFFFAOYSA-N 338.385 1.474 10 10 EDCE COc1ccc(N2CCN(C(=O)COCc3cn[nH]c3)CC2)cc1 902585506 XUEZSRKYXJTNIN-UHFFFAOYSA-N 330.388 1.284 10 10 EDCE C[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)C[C@@H]1N1CCOCC1 588405733 NPBCHQGCZFBYDE-QLGVYERUSA-N 332.400 1.290 10 10 EDCE C[C@H]1c2nncn2CCN1c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 844214034 NPWMPBZIHDVTMA-ATPLWMGHSA-N 329.316 1.865 10 10 EDCE C[C@@]1(O)CCN(c2cc(Br)c(CN)cc2F)C[C@H]1O 1893300272 MBHAYJPKKGDUKA-CHWSQXEVSA-N 333.201 1.369 10 10 EDCE C[C@@H](NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1[C@H]2CN[C@H]1C2 925501341 IFOVSNXVYJJRBA-SIKIZQCASA-N 329.488 1.981 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C(N)=O)C(C)(C)C)C2)cc1 854299602 PYPSASLEZYLPPJ-SWLSCSKDSA-N 348.447 1.473 10 10 EDCE C[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[S@@]1=O 758161739 WKYQZTLMCSJYJE-WBNWAKSLSA-N 339.373 1.273 10 10 EDCE O=C1N[C@H](CC2OCCO2)C(=O)N1CCCSc1nccs1 924639185 DSLRHJHPSXSJRR-SECBINFHSA-N 343.430 1.309 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCC3(C)OCCO3)C2)cc1 852252089 CMFXFZYYGMBQSV-AWEZNQCLSA-N 349.431 1.726 10 10 EDCE CO[C@H](CS(=O)(=O)N[C@@H](C)c1ccccc1O)[C@@H]1CCOC1 867836169 IHYLKCMJYOUTPC-YWPYICTPSA-N 329.418 1.424 10 10 EDCE COc1ccc2c(n1)N(C)CCN2C(=O)c1ccnc2c1CC(=O)N2 1119642178 RIEAYDGVPJIFQL-UHFFFAOYSA-N 339.355 1.076 10 10 EDCE C[C@H](O)CN1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 896207732 RHJRCZOMOOACSH-JTQLQIEISA-N 336.413 1.451 10 10 EDCE CN1C[C@@H](C(=O)NCc2c(O)cccc2O)c2ccccc2C1=O 1156885617 KYNGPDYRJBXJKU-CQSZACIVSA-N 326.352 1.583 10 10 EDCE NC(=O)[C@H]1C[C@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 1313020983 JAGUHIZYGMBNQO-RBSFLKMASA-N 347.415 1.347 10 10 EDCE C=CC(=O)NCc1ccc(C(=O)NCc2c(O)cccc2O)cc1 1178906256 ZSUUIXLJOVYNEG-UHFFFAOYSA-N 326.352 1.830 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)[C@H](O)C2(C)C)cc1Br 2124801900 QBQOTAOWKQTPEV-CKLFPEKLSA-N 329.238 1.789 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC/C=C\CNC[C@@H]2CCOC2)cc1 1268631986 GJXKBZVIMVSFND-LDWPIZCPSA-N 345.403 1.761 10 10 EDCE CC1(C)C[C@H](O)[C@@H](O)CN1c1ccc(CO)cc1Br 2132174009 MULJJOHTWPZBCQ-STQMWFEESA-N 330.222 1.652 10 10 EDCE C[C@@H]1C[C@@H](C(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)CO1 1283079817 YJDLMNWMHPIWID-ZYHUDNBSSA-N 347.375 1.120 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)CC(C)(C)C)cc(OC)n1 1284198431 DYGIGVBAYHLRJG-LLVKDONJSA-N 337.420 1.770 10 10 EDCE C[C@H](c1ccc(O)cc1O)N(Cc1ccccc1)CC1(O)CNC1 1915508129 GWGIKNJWJBRZMG-CQSZACIVSA-N 328.412 1.995 10 10 EDCE CSCC[C@H](NC(N)=O)C(=O)NCc1c(O)ccc2ccccc12 1456308585 JLZDIYQWDXCELF-AWEZNQCLSA-N 347.440 1.952 10 10 EDCE CCC(=O)NC[C@H]1CC[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1702514519 OXJWFAHAKFGDLH-WCQYABFASA-N 335.404 1.524 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@]2(C)CCNC2=O)cc1C 1715359514 HRDDEERXSFFGSU-IFXJQAMLSA-N 347.459 1.466 10 10 EDCE CCn1nncc1C(=O)N(C)CCNCc1ccc(OC)c(C)c1 1713590221 WSLLUWJJCBLDCU-UHFFFAOYSA-N 331.420 1.477 10 10 EDCE CC[C@H](CN[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1)OC 1491691595 GMYXNIYYUNSGSZ-SMDDNHRTSA-N 335.408 1.982 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1nc(=O)o[nH]1 1566718641 WUVPGDYKKCVZGT-UHFFFAOYSA-N 340.339 1.513 10 10 EDCE CCC(=O)NCc1nc(O)cc(CNCc2ccc(OC)c(C)c2)n1 1656634500 BLTUVJWIENONDZ-UHFFFAOYSA-N 344.415 1.815 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C(=O)NCC2CC2)cc1C 1669434124 CAUWBUVFLPWUGW-CYBMUJFWSA-N 333.432 1.124 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)CC2CC2)cc(OC)n1 1679882573 VYRDXCULCMYBIT-LLVKDONJSA-N 335.404 1.476 10 10 EDCE CC[C@H](CNC(=O)c1cnnn1CC)NCc1ccc(OC)c(C)c1 1698598956 OCPGBNXOOSWMHA-OAHLLOKOSA-N 345.447 1.913 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCC(=O)N(C)C1 162982861 OTAHLJAZPDUJTG-HNNXBMFYSA-N 332.448 1.905 10 10 EDCE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@@H]3C[C@H](O)CN3)cccc21 1866040631 SWSHWCUIASIVJC-BONVTDFDSA-N 336.347 1.123 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C1(C)COC1 2143191828 IMTQZIASYAMDDP-LLVKDONJSA-N 326.194 1.626 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@](O)(CC(=O)NCCN=[N+]=[N-])C1 1963815619 ATORAXPKCVHWBH-CQSZACIVSA-N 327.385 1.565 10 10 EDCE CCCN(CCCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2149422629 JPTRGLNMRUHIKR-CYBMUJFWSA-N 342.237 2.000 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2cccc(O)c2O)[C@@H](O)C1 2005086159 UCSYGDIVWINQRF-JSGCOSHPSA-N 338.404 1.558 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(Cc2cc(N)ccc2O)C1 2002701027 LGGZODDQHFAUFD-KGLIPLIRSA-N 337.420 1.434 10 10 EDCE C[C@@H](COCC(=O)N1CC[C@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1985101479 SWIFBINEJURDLN-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE O=C(O)[C@H]1[C@H]2[C@@H]1OCCN2Cc1cc(Br)cc(F)c1O 2149275432 HJPKANIKVBIOEI-JBLDHEPKSA-N 346.152 1.578 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)N2CCC(N=[N+]=[N-])CC2)COC1 2010401578 FNRNWZLFGAUTDY-UHFFFAOYSA-N 339.396 1.924 10 10 EDCE Nc1ccc(CC(=O)NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1 702601409 ZBNUNUMYQRDNHN-FQEVSTJZSA-N 339.439 1.565 10 10 EDCE C[C@H]1CN(Cc2c(O)cccc2Br)CCS1(=O)=O 707144771 TZUJWGAHMPOXME-VIFPVBQESA-N 334.235 1.774 10 10 EDCE C[C@H]1CS(=O)(=O)C[C@H]1NCc1cccc(Br)c1O 711724739 XDXSMHXBUIXYOY-GZMMTYOYSA-N 334.235 1.677 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@]4(CCCO4)[C@@H]3C3CC3)c2n1 2062490405 VUFOVYWGJPMKLC-WMLDXEAASA-N 328.372 1.527 10 10 EDCE CSCCS(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C)c1 2174048840 ZWPGNIIJRRZGNE-UHFFFAOYSA-N 338.476 1.471 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H]1CNC(=O)c1cc(O)c(O)c(O)c1 1909117947 NWAKPYWHEJDGCV-VHSXEESVSA-N 338.360 1.446 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C1CC(CO)C1 2193578663 LXUWTUMQFCGFKK-KTRLOWJHSA-N 340.221 1.608 10 10 EDCE C[C@H]1CC[C@H](NC(=O)C(F)(F)F)CN1C(=O)Cc1ccc(N)cc1 2044625729 YMPRWTCWMFLMMG-GWCFXTLKSA-N 343.349 1.869 10 10 EDCE CC(C)(C)OC(=O)N[C@]12C[C@H]1CN(CC(=O)Nc1ccc(N)cc1)C2 2044675857 CNTHVZXQOYOJQT-SGTLLEGYSA-N 346.431 1.806 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CN(Cc2cc(N)ccc2O)[C@@H]2COC[C@H]12 2044665472 IPPODTUWGHNYNV-RBSFLKMASA-N 349.431 1.698 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@H](O)C3)cc1Br 2190456383 GTYRXKYPZQGHPF-SPWCGHHHSA-N 341.249 1.631 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@H](CNC(=O)c3ccc(O)c(O)c3)[C@H]2C1 2054397951 OQJOSVWMJUXPIR-XYYAHUGASA-N 348.399 1.941 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(C(=O)NCCN=[N+]=[N-])CO[C@H]1C2 2243126649 LEROALQFPDLFSB-BFVZDQMLSA-N 325.369 1.485 10 10 EDCE CSc1ncc(CNc2snc(N)c2S(C)(=O)=O)s1 2269276291 CVKYNYHTXXXEEX-UHFFFAOYSA-N 336.489 1.919 10 10 EDCE COC(=O)[C@H](O)CN(C)Cc1ccc(C)c(Br)c1O 2352639960 DLUUXOIJTGOOMF-SNVBAGLBSA-N 332.194 1.429 10 10 EDCE COC[C@@H]1CNCCN1Cc1ccc(C)c(Br)c1O 2352683329 GVNZZMISVHBAJC-LBPRGKRZSA-N 329.238 1.883 10 10 EDCE c1ncn([C@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)n1 119504430 RZQHPVFJLVGACF-SFHVURJKSA-N 327.432 1.952 10 10 EDCE CC(=O)N1CC[C@@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 175267660 ZZSKMBOPEALJPF-IAGOWNOFSA-N 346.427 1.768 10 10 EDCE O=C1CN(C(=O)CNc2ccccc2C(=O)c2ccccc2)CCN1 175597358 ZUVIDKKIMSOEKZ-UHFFFAOYSA-N 337.379 1.288 10 10 EDCE CC(C)(CO)NC(=O)C(=O)N(c1ccccc1)c1ccc(N)cc1 170389208 FPBKNXJBLLRYIZ-UHFFFAOYSA-N 327.384 1.821 10 10 EDCE O=C1CCCC[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)N1 194394252 FWPMBGCHUSRFFW-HZPDHXFCSA-N 346.427 1.959 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](CN)C(=O)O 1951828631 DQNXNIJQEJECLD-GHMZBOCLSA-N 340.376 1.193 10 10 EDCE O=C(O)/C=C/c1ccc(N2CCCNC(=O)C2)cc1Br 236466673 HNVZOZIBANFIEI-HWKANZROSA-N 339.189 1.873 10 10 EDCE O=C1CN(Cc2cc3c(cc2O)OCO3)CCN1CC(F)(F)F 285216690 UPKKEDRJOVSFBD-UHFFFAOYSA-N 332.278 1.327 10 10 EDCE C[C@H](C(=O)NCc1cc(Br)ccc1O)S(C)(=O)=O 804733578 UOLBVYRKSGUBBV-SSDOTTSWSA-N 336.207 1.204 10 10 EDCE COCC[C@@H](COC)NC(=O)NCc1ccc(N(C)C)c(F)c1 811957437 CQUFUBZGJQAFDR-ZDUSSCGKSA-N 327.400 1.742 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN(CCO)[C@H]2CCO[C@H]2C)c1O 825129821 FZWVDNJXBAXBHO-JQWIXIFHSA-N 326.349 1.281 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3[C@H]4COC[C@H]43)C2)cc1 824535763 JFHABGUDPSDJAC-VZEFYGNVSA-N 331.416 1.466 10 10 EDCE OCCO[C@]1(CNCc2ccc(Br)cc2O)CCOC1 826943293 WISWIQBZVLULAU-AWEZNQCLSA-N 346.221 1.412 10 10 EDCE NCc1ccc2c(c1)CCCN2Cc1nnnn1CC1CCOCC1 843349984 HBNMHBKJFGQEPQ-UHFFFAOYSA-N 342.447 1.511 10 10 EDCE CN1C2(CCC2)COC[C@]1(CO)CNCc1ccc2c(c1)CCCO2 922286384 KPUVVPTXIZFLQZ-HXUWFJFHSA-N 346.471 1.717 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]12C[C@H]3C[C@@H](C(=O)N1)[C@H]2C3 845929318 AEMAJNBXAQYGBS-CIHBEFARSA-N 330.384 1.060 10 10 EDCE C[C@@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(C)(C)CO 924726836 QWDTUYWCFXANTE-ZBFHGGJFSA-N 333.476 1.885 10 10 EDCE CC[C@H]1C[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CO1 850135939 SKPOQPYPISMCBB-WBVHZDCISA-N 338.473 1.579 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C[C@H]1CCC2(CNC2)O1 852746110 IMJFIPFBDRYHLH-GOSISDBHSA-N 331.460 1.476 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCO[C@]2(CCOC2)C1 769509525 ISWSRMIJIMFORN-GOSISDBHSA-N 333.432 1.762 10 10 EDCE CCO[C@@H](CS(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1)C1CC1 863406490 DIDQIIRQWSENIY-ZDUSSCGKSA-N 330.362 1.857 10 10 EDCE Cc1ncc(NCc2ccc(N3CCN(C)CC3)cc2)cc1C(N)=O 865296340 WVKBPBDNTGOSPB-UHFFFAOYSA-N 339.443 1.853 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CC[C@H](C)NC1 861804442 JHOLDXYPEXRVEA-GOEBONIOSA-N 347.459 1.778 10 10 EDCE C[C@@H]1CN(C(=O)c2cn(C)nc2-c2cnn(C)c2)c2ccnn2C1 893883642 QBICHALXZFKMRO-LLVKDONJSA-N 325.376 1.314 10 10 EDCE NCc1ccc(N2CC[C@H](NC(N)=O)C2)c(F)c1Br 690785407 NWKFDZCYKOMHOA-QMMMGPOBSA-N 331.189 1.294 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@H](C)CO1 1153664237 RRWCAGBHKUYPFA-WBIUFABUSA-N 337.372 1.113 10 10 EDCE Cc1ccc(O)c(CNC(=O)N[C@@H]2CCN(c3cc(O)ncn3)C2)c1 1313387200 BVSXEEAQCRQSMR-CYBMUJFWSA-N 343.387 1.274 10 10 EDCE CN(CCCN1CCCC1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329360990 NMDFNFLDRJRNQV-UHFFFAOYSA-N 331.416 1.179 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N2[C@H]3CC[C@H]2CC2(CC2)C3)cc1 1331744243 LWIDOTNUFNSMAJ-HOTGVXAUSA-N 327.428 1.861 10 10 EDCE COc1ccc(CNC[C@H]2CCN(C(=O)CCCC(N)=O)C2)cc1C 1713365004 AYTSWFIUBAIDQF-MRXNPFEDSA-N 347.459 1.597 10 10 EDCE NS(=O)(=O)CCCCNC(=O)c1cc2cc(O)c(O)cc2s1 1625195677 WDMJIPLZMMPLPX-UHFFFAOYSA-N 344.414 1.111 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2c(C)ncn2C)cc1C 1714714331 JWAZIZAMWCNMKU-UHFFFAOYSA-N 330.432 1.907 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](CN3CCCC3=O)C2)cc1 1633352638 XUJGWXNWNZIFPB-GFCCVEGCSA-N 343.387 1.934 10 10 EDCE C[C@@H](NC(=O)c1cn(C(F)(F)CO)nn1)c1ccc(N(C)C)cc1 1638957794 XECZODCEVBOTJS-SNVBAGLBSA-N 339.346 1.377 10 10 EDCE CCOC(=O)[C@H](C[C@H]1CCCO1)NC(=O)/C=C/c1ccc(O)c(O)c1 1644419740 BRHXEDACPYUNHR-RNUUNTDPSA-N 349.383 1.728 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)cc1C 1569414026 FOAAHVBRAOJQRE-QLPKVWCKSA-N 330.428 1.634 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C1=C[S@](=O)CCC1 1641203942 MFLPECFVOGGMDX-XMMPIXPASA-N 348.468 1.690 10 10 EDCE C[C@]1(CCCC(=O)NCc2cccc(Cl)c2O)NC(=O)NC1=O 1640404457 AXNLGEKCBWUZJT-OAHLLOKOSA-N 339.779 1.430 10 10 EDCE Cc1ccc(C(=O)NCCC(=O)NCc2cccc(O)c2O)c(O)c1 1651175758 LTALXXLWKKAVBC-UHFFFAOYSA-N 344.367 1.548 10 10 EDCE C[C@@]1(C(=O)NCCc2ccc(O)c(O)c2)Oc2ccccc2NC1=O 1595752011 LVYZGVRSTLHRAJ-SFHVURJKSA-N 342.351 1.546 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)C[C@H]2CN(C)C)cc1Br 300522561 ZBJYAEICRWWEQE-DRZSPHRISA-N 342.281 1.970 10 10 EDCE Cc1cc(Br)cc(CN2CC[C@@]3(CNC(=O)N3)C2)c1O 2177680122 JSOWMLRYQIVKRK-CQSZACIVSA-N 340.221 1.720 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C(=O)NC(=O)[C@H]3C2)cc1Br 387428267 NWWLKOWTNCOWDH-BKDNQFJXSA-N 338.205 1.178 10 10 EDCE CN[C@H](c1ccc2c(c1)CCN2C)c1nc(Br)nn1C 2173163205 JIVKBHGVPZUHBD-GFCCVEGCSA-N 336.237 1.879 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H]3C3CCOCC3)c2n1 2064652903 VCILUFVERYCTSR-AWEZNQCLSA-N 330.388 1.775 10 10 EDCE C[C@@H]1COC[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)N1C(=O)OC(C)(C)C 1906906390 QZCMRPSISRCRQM-FDYHWXHSSA-N 340.420 1.276 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3C[C@H]4[C@@H](N)[C@H]4C3)ccc(N)c2C1 2071608687 ZKPZPHLFZWMKPC-XOIINTDNSA-N 344.459 1.955 10 10 EDCE CN[C@@H](c1ccccc1O)[C@@H](O)c1nn(C)nc1Br 2111421690 BOFSXPPHWGMTBW-GXSJLCMTSA-N 327.182 1.277 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@@H](O)CC2)c(Br)c1 2269136883 CNERMTRAVIINOH-IIMNLJJBSA-N 329.238 1.791 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccccc2CN)s1 2284692262 VJFCEWXDKYVFIK-UHFFFAOYSA-N 329.472 1.802 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)/C=C/c2cncc(O)c2)c2ccccc2O1 492521745 RBPINBAYEJCQPY-MOEXGYKKSA-N 340.335 1.768 10 10 EDCE CC(C)(C)OC(=O)N1CCN(c2ccc(N)cc2)[C@H](CC(N)=O)C1 2303454097 ZQUQJESHWRWZCF-CQSZACIVSA-N 334.420 1.570 10 10 EDCE OCc1ccc(N2C[C@H]3OC[C@@H](CO)[C@H]3C2)c(Br)c1 2330879847 QACIMTBRRUHZEC-JTNHKYCSSA-N 328.206 1.385 10 10 EDCE COc1cc(OC)c(C=C2C(=O)N(C)C(=O)N(C)C2=O)c(OC)c1 103235072 CHWLCHOOVOAQRE-UHFFFAOYSA-N 334.328 1.146 10 10 EDCE CCN(CC)c1ccc(/C=c2\sc3nc(=O)c(C)nn3c2=O)cc1 20035409 PGYVIYIAFNCFGP-UVTDQMKNSA-N 342.424 1.214 10 10 EDCE CNC(=O)Cc1nc(CN2CCOc3cc(N(C)C)ccc32)cs1 130451419 CJJKLXSGNBZFBH-UHFFFAOYSA-N 346.456 1.897 10 10 EDCE O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)c1cccc(O)c1O 365948404 WPSUFLSFHCWTEG-CYBMUJFWSA-N 327.340 1.418 10 10 EDCE Cc1ccc(CN2C[C@@H](O)[C@@H](CC(=O)O)C2)c(O)c1Br 2381137787 QJDNKZFPKNMBJK-WDEREUQCSA-N 344.205 1.731 10 10 EDCE Cn1ccnc1N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 827892137 SFZYKRWGKLUUJB-UHFFFAOYSA-N 341.459 1.579 10 10 EDCE CC[C@H](NC[C@]1(CO)COCCN1C)c1cc(Cl)ccc1O 903278674 MRDIGGANMNODFC-HOCLYGCPSA-N 328.840 1.779 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)c1cn([C@@H]2CC[C@H]2O)nn1 901051432 DOJSQYGVTHLJGT-GDBMZVCRSA-N 330.388 1.732 10 10 EDCE Cc1cc(O)c(CN2CCC[C@@H](CS(N)(=O)=O)C2)c(Cl)c1 840916692 BHKZJQJIUXAHDS-LLVKDONJSA-N 332.853 1.855 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC1COCCOC1 840381199 GDGPWGZQSDXKCP-CQSZACIVSA-N 335.448 1.707 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](C)Cn1cncn1 840276164 AFLXSEJFHOJNMI-LSDHHAIUSA-N 344.463 1.971 10 10 EDCE C[C@@H]1CN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])CC[S@](=O)C1 844220268 YIACVTOBXWAARW-HSSSCUJESA-N 338.385 1.897 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NCCC3(CN)CC3)C2)cc1 846180674 WOICVZYPGVWRCU-HNNXBMFYSA-N 346.475 1.950 10 10 EDCE COC(=O)/C(C)=C\CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 923183010 JXDNHWQKYIMUJZ-MQJVFOOVSA-N 347.415 1.692 10 10 EDCE CO[C@@H](CO)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951699252 QWRIWCJCAWTDDG-RISCZKNCSA-N 327.377 1.541 10 10 EDCE CN(C)c1ccc(/C=C\CNCCCN2CCC[C@H]2C(N)=O)cc1 858228104 YTCRHWDOGILLLS-CJISVDGZSA-N 330.476 1.695 10 10 EDCE CN1C(=O)N[C@@]2(CCC[C@@H]2CNCc2ccc3c(c2)CCCO3)C1=O 921813101 BLEKYFUEKMCAEZ-DNVCBOLYSA-N 343.427 1.822 10 10 EDCE CN(c1ccc2c(c1)OCO2)[C@H]1CCN(CC(=O)OC(C)(C)C)C1=O 851867528 IDTUAPCLEHXOEP-ZDUSSCGKSA-N 348.399 1.794 10 10 EDCE CO[C@H](CN)C[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951993726 QSKCJQYPMXKCNN-STQMWFEESA-N 340.420 1.897 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCC[C@@H](N)C3)C2)cc1 851664081 QODDCRDMKFHQCJ-KFWWJZLASA-N 332.448 1.843 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCCCc3cnn[nH]3)C2)cc1 855226362 OGDMIWMZOGJHEH-OAHLLOKOSA-N 343.431 1.921 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)c3ccc(C)nn3)C2)cc1 867498371 YUFRVXQTZAXSEU-ZDUSSCGKSA-N 348.428 1.351 10 10 EDCE CC(C)(CNC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)N1CCCC1 863150343 SEJKHSLWFOLKAS-VURMDHGXSA-N 332.400 1.876 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(C3COC3)CC2)c([N+](=O)[O-])c1 769250227 SLRBUHWAVLXALY-HYXAFXHYSA-N 347.371 1.302 10 10 EDCE COC(=O)[C@@H]1CN(Cc2cc(F)c(N(C)C)cc2F)C[C@@H](C)O1 862487466 PYAOJPMPCICPFC-BMIGLBTASA-N 328.359 1.793 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3nnc(C)n3C)C2)cc1 1118561271 IVQKLSUIUWNLHQ-CYBMUJFWSA-N 344.419 1.210 10 10 EDCE COc1ccc(CNC(=O)c2c3c(nn2C)CCSC3)c(O)c1 879846866 PONYBWMQTIZXEI-UHFFFAOYSA-N 333.413 1.854 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)cc1 897912412 RMWKNAIYHYIMBE-WKULXVSPSA-N 345.443 1.949 10 10 EDCE Cn1ncc(Cl)c1S(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1 797431884 ANGAXYRQODLRKK-UHFFFAOYSA-N 332.725 1.488 10 10 EDCE COC(=O)COc1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 1142314867 XDMZGUNVEDMJQG-UHFFFAOYSA-N 331.324 1.831 10 10 EDCE O=C1CCCC[C@H]1[C@@H]1COCCN1C(=O)Cc1ccc(O)c(O)c1 1151960791 PPRWHVWPNDGXGM-KBPBESRZSA-N 333.384 1.627 10 10 EDCE COC(=O)[C@H](C[C@H]1CCCO1)NC(=O)/C=C\c1ccc(O)c(O)c1 1177476391 RBVOSQFHEFRPEO-XHSUHYBKSA-N 335.356 1.338 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)[C@H](O)C2(C)C)c(Br)c1 2124803108 UIPCYXPXAVEGMT-CKLFPEKLSA-N 330.222 1.823 10 10 EDCE C[C@]1(C(F)F)CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCO1 1332057376 URMYPFIXKRLEDT-MRXNPFEDSA-N 340.326 1.117 10 10 EDCE CC[C@H](C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1347655396 OHHZWLLUTBJFHK-GJZGRUSLSA-N 347.459 1.943 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cc3cc[nH]c3cn2)c1 1452642185 HUDZXOMLVOGGPS-UHFFFAOYSA-N 346.368 1.892 10 10 EDCE C[C@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)c1nncn1C 1296585482 OWFNOFABDRZVLC-MRVPVSSYSA-N 332.385 1.975 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cc3n(n2)CCC[C@H]3O)c1 1545684059 ISFLQGYFOZHREZ-MGPLVRAMSA-N 331.372 1.916 10 10 EDCE CNC(=O)CN(Cc1ccccc1)C(=O)Cc1ccc(O)c(O)c1 1558015536 LDTGFVOMWQGQQT-UHFFFAOYSA-N 328.368 1.415 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)C2=C(C)OCCS2(=O)=O)c1 1622779891 XVEBVUFSVCZEKE-VIFPVBQESA-N 341.385 1.255 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC2(CNC(=O)C3CC3)CC2)cc1 1722051835 CORVIZCZIFLDBH-UHFFFAOYSA-N 329.360 1.638 10 10 EDCE Cc1nonc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1644863166 AAAIKKSJHGBPBE-UHFFFAOYSA-N 343.387 1.010 10 10 EDCE Cc1ccc(C(=O)NC(c2nccn2C)c2nccn2C)c(O)c1O 1645694714 LLYCQCZHAMMQSS-UHFFFAOYSA-N 341.371 1.393 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)CC2CCCC2)cc(OC)n1 1737547708 BCIRVNQVACABNH-LBPRGKRZSA-N 349.431 1.914 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2[nH]cnc2C)cc1C 1734534044 NTGFRPVRGDPQHO-OAHLLOKOSA-N 346.431 1.258 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@@H]2CCC(=O)N2)C(C)C)cc1C 1698978925 DEOAFXBMWQPRMU-HOTGVXAUSA-N 347.459 1.513 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCCCN3C(C)=O)CC2)cc1 164794060 GMWIMXSBHVAPEI-SFHVURJKSA-N 345.443 1.745 10 10 EDCE CNCc1ccc(N2CCN3C(=O)CC[C@H]3C2)c(Br)c1 234429690 KXIIITJOCRQKIR-LBPRGKRZSA-N 338.249 1.980 10 10 EDCE COc1ccc(Br)c(CNCc2nncn2C)c1O 1964024814 ZCWKYSUVAWJEGN-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE CN(C)c1ccc([C@H](O)[C@H](N)c2c(Br)cnn2C)cc1 2148331179 NVQUHUBLSJYYSM-OCCSQVGLSA-N 339.237 1.982 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ccc(N)cc1 1977887938 JTCBVXCKZMOONR-UHFFFAOYSA-N 343.449 1.555 10 10 EDCE CC(C)(C)OC(=O)N(O)CC(=O)NCCc1ccc(O)c(O)c1 1984975539 NAIADBGDRNBZBR-UHFFFAOYSA-N 326.349 1.383 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985103986 CWEGMUIPQJBVIW-VHSXEESVSA-N 327.385 1.467 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)C1(O)CCC1 1987677700 AYOFTAITISKTEM-JTQLQIEISA-N 325.369 1.316 10 10 EDCE O=S(=O)(CC1CN(c2ccc(CO)c(Cl)c2)C1)C(F)F 2173170403 JQBFNVIVJNCMMY-UHFFFAOYSA-N 325.764 1.906 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)cc1Br 2173357565 NRYWULHGYCXGKD-IWMZPUPSSA-N 342.233 1.823 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H](OCC4CC4)C3)c2n1 2063424955 BCOQZEUKCVFYOI-CYBMUJFWSA-N 330.388 1.775 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](C(CO)CO)C2)cc1Br 2170641580 DJTSTFFUOLZAIX-WDEREUQCSA-N 344.249 1.930 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NC(=O)CCc1ccc(N)cc1 2044227576 YVGXSHWKGFKWQG-HUUCEWRRSA-N 349.431 1.610 10 10 EDCE C[P@]1(=O)C[C@@H](O)[C@@H](NCc2cc(Br)ccc2O)C1 2057722121 YLWLLKUFYMSLGT-GLUANWCPSA-N 334.150 1.980 10 10 EDCE O=S1(=O)C[C@@H]2[C@@H](CCN2Cc2c(O)cccc2Br)C1 2094882872 NXODYBBJXPAGBC-JOYOIKCWSA-N 346.246 1.774 10 10 EDCE NCc1ccc(N2CCc3c(O)ncnc3C2)cc1Br 2206106347 MKBLFULHVVRGQG-UHFFFAOYSA-N 335.205 1.966 10 10 EDCE C[C@@]1(CO)C=CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2237170899 MLPNCEHXFJMXTI-JSGCOSHPSA-N 339.189 1.562 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@H]2[C@@H](O)CO)c(Br)c1 2270703105 WCOWOHMRHQAQKO-IIMNLJJBSA-N 329.238 1.661 10 10 EDCE CSc1ncc(CNc2cc(S(N)(=O)=O)ccc2N)s1 2284699993 QSYVVDXAKNAYTK-UHFFFAOYSA-N 330.460 1.707 10 10 EDCE CNCc1ccc(N2C[C@H]3OCC[C@]3(CO)C2)c(Br)c1 2296428186 OIBZJIMVJSVKDD-HUUCEWRRSA-N 341.249 1.756 10 10 EDCE Cc1ccc(CN[C@@H]2CCO[C@H]2C(N)=O)c(O)c1Br 2352673704 YKGSBVWMXBKEKP-BXKDBHETSA-N 329.194 1.196 10 10 EDCE Cc1ccc(CN[C@@H]2CCO[C@@H]2C(N)=O)c(O)c1Br 2352673709 YKGSBVWMXBKEKP-SKDRFNHKSA-N 329.194 1.196 10 10 EDCE Cc1ccc(CN(C)[C@H]2CC(=O)NC2=O)c(O)c1Br 2352932576 OSMHXJVFHNDNOJ-VIFPVBQESA-N 327.178 1.310 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)Cn2c(=O)[nH]c3ccccc32)c1 103529607 JLDUJHSVAHNLER-NSHDSACASA-N 341.367 1.921 10 10 EDCE C[C@H](NC[C@@H](C)N1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 127304815 DOCGLPAHHLRYMM-MSOLQXFVSA-N 346.519 1.810 10 10 EDCE COC(=O)COc1ccc(N(C)Cc2nsc(N(C)C)n2)cc1 183796924 FDZQEECCRNXCFM-UHFFFAOYSA-N 336.417 1.792 10 10 EDCE CCOCCN1CCN(C(=O)c2ccc(C)c(O)c2O)C[C@@H]1CC 182460216 ZXXPWFWSPCUACR-AWEZNQCLSA-N 336.432 1.979 10 10 EDCE O=C(N[C@H]1CC[C@H](Oc2ncccn2)CC1)c1cc(O)nc(O)c1 238828077 FFTUMFYKGFOBDU-HAQNSBGRSA-N 330.344 1.403 10 10 EDCE Cc1nccc(N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)n1 278369912 MHWSGZGNIWMSNP-UHFFFAOYSA-N 332.335 1.298 10 10 EDCE C[C@H](CN(C)C)N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2379882477 LQHUWWPJJHJJHA-OQPBUACISA-N 341.253 1.787 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)NCc3cscn3)ccc21 803689251 NTZDCAHUPAEPPD-UHFFFAOYSA-N 344.440 1.458 10 10 EDCE CN1CC[C@@H](C(=O)NCc2cc(Br)ccc2O)C1=O 804739649 NNDVKVFLQIGKOG-JTQLQIEISA-N 327.178 1.249 10 10 EDCE COc1ccc(N2CCN(Cc3cc4c(cc3O)OCO4)CC2)nc1 825305494 LKWNQLKIKPUMBK-UHFFFAOYSA-N 343.383 1.847 10 10 EDCE Cn1ccc([C@@H]2CCCN(Cc3cc4c(cc3O)OC[C@H]4O)C2)n1 905716795 WXMSAOYJIGCDHT-SJKOYZFVSA-N 329.400 1.931 10 10 EDCE COc1cccc(CNC[C@H]2CS(=O)(=O)c3ccccc3O2)c1O 842721959 NCOACALKKQAIDZ-ZDUSSCGKSA-N 349.408 1.725 10 10 EDCE CCNC(=O)c1ccc(NCc2ccc(N3CCOCC3)cc2)nn1 756766093 IVLXEMOFGKWJPL-UHFFFAOYSA-N 341.415 1.675 10 10 EDCE COc1ccc(CNCC[C@@H]2CNC(=O)C2)cc1Cn1cccn1 922779870 BSAXZXAYDPIDBL-HNNXBMFYSA-N 328.416 1.556 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](C)O[C@@H](C)C3)nc12 852586873 OCZLRKGHHUTKES-NEPJUHHUSA-N 348.403 1.611 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccnc4[nH]cnc34)C2)cc1 855227969 SJLKSRAPUROSFJ-GFCCVEGCSA-N 337.383 1.975 10 10 EDCE C[C@@H](O)CN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 769326153 BRJZTVMNICLARC-OAHLLOKOSA-N 337.439 1.161 10 10 EDCE CNCCOCCN(C)C(=O)NCc1ccc2c(c1)CCCN2C 861568033 NNELJUBNFNNGRZ-UHFFFAOYSA-N 334.464 1.446 10 10 EDCE CN(C)C(=O)CCN1CCN(Cc2cc(Cl)ccc2O)CC1 769505845 JCWJSKUDOUCZIR-UHFFFAOYSA-N 325.840 1.642 10 10 EDCE CNCCOCCN(C)Cc1ccc(N2CCOCC2)c(F)c1 863647942 XTVRUEMYSCLWON-UHFFFAOYSA-N 325.428 1.330 10 10 EDCE CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccc(C)o2)ccc1O 790406014 AAYNGHXWBMZPRJ-UHFFFAOYSA-N 346.386 1.003 10 10 EDCE COc1ccc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cn1 795348545 OGLGAUBWTCRDEF-UHFFFAOYSA-N 325.302 1.505 10 10 EDCE NS(=O)(=O)Cc1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 1142810162 DKLRJAWDCTXUJP-UHFFFAOYSA-N 336.369 1.068 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)C[C@@]2(C)CO)cc1Br 698159108 WUBIMIPSVXEAHH-UDZFHETQSA-N 330.222 1.824 10 10 EDCE COCCCNC(=O)CN(C)c1cc(OC)c(OC)cc1[N+](=O)[O-] 1162061679 FHRIBQYIODAJGM-UHFFFAOYSA-N 341.364 1.201 10 10 EDCE C[C@@H](C(N)=O)N(C)CCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1327300574 XDWROZDHYQCKAQ-NSHDSACASA-N 348.407 1.117 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CC[C@@H](C)C3)C2)cc1 1332163275 BZXLIZZGOXXNHZ-ILXRZTDVSA-N 345.443 1.695 10 10 EDCE O=C1N[C@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CO1 1350629268 USNRQDSNENVMKH-AWEZNQCLSA-N 336.303 1.509 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CC[C@H]1CC[C@@H](C(N)=O)O1 1360075710 PMFCVRITRJIOMI-CVEARBPZSA-N 333.432 1.490 10 10 EDCE C[C@H]1C[C@@H]1C(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1295611736 LOAZGWQGNNLZAA-CWSCBRNRSA-N 331.376 1.740 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1ccc(-n2ccnc2)nn1 1469874814 PUVCDJBZTOJDHJ-UHFFFAOYSA-N 329.747 1.951 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CN(C(=O)Cc3ccc(O)c(O)c3)C2)C1 1472407699 LWYXWMQVSLFIFP-UHFFFAOYSA-N 348.399 1.720 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2ccoc2C)cc(OC)n1 1704006961 NLQQPCJNKZWLOU-SNVBAGLBSA-N 347.371 1.549 10 10 EDCE CC(C)(C)OC(=O)NOCCCNC(=O)c1c(F)ccc(O)c1O 1611671162 MLBPLCCNMDPQBB-UHFFFAOYSA-N 344.339 1.813 10 10 EDCE CCOCCN1CC[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1493265932 AINMVMOKXQBRBL-ZDUSSCGKSA-N 347.419 1.937 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H]1CCN(CC(F)(F)F)C1 1630755420 HZMNVZVZPBHOSI-NSHDSACASA-N 332.322 1.641 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc2c(nc1O)CCC[C@H]2O 1644753765 JCXIKLIECTXJAW-OAHLLOKOSA-N 330.340 1.498 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H]2CCNC(=O)C2)cc1C 1731903643 SWIQZJZCSGDHNF-OAHLLOKOSA-N 333.432 1.078 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@H]1CC(=O)N(Cc2ccccn2)C1 1643809688 ROILTRGKLXVIFS-ZDUSSCGKSA-N 341.367 1.158 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC([C@@H]3COC(=O)N3)CC2)cc1 1653003130 XMZOPGBSYCOWQA-ZDUSSCGKSA-N 345.359 1.810 10 10 EDCE CC[C@@H](F)C(=O)NC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1744722399 GVTPWFIFESSICU-MWLCHTKSSA-N 327.356 1.081 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1cnsn1 1662429154 DFXIFDCQNKDNOA-SECBINFHSA-N 347.404 1.609 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H]2CCC(=O)NC2=O)c1C 153497159 YSLIDDODJJUMJF-HNNXBMFYSA-N 339.395 1.938 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NCc2cccc(F)c2O)C1 1985826526 AMOCBKLPHULGLT-STQMWFEESA-N 326.368 1.601 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(O)cc2O)[C@@H](O)C1 2005085519 PKHXCFHLRJKHLC-HIFRSBDPSA-N 338.404 1.558 10 10 EDCE CCONC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2009802564 PLTMGBRWLRNWIL-NSHDSACASA-N 340.376 1.601 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@@H](O)CNC(=O)OC(C)(C)C)c1 2011423457 SGHCEUJPNAIHOU-NWDGAFQWSA-N 340.420 1.937 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2025611064 JOFHTOUFGKUAPL-UWVGGRQHSA-N 340.384 1.056 10 10 EDCE O[C@H]1C[C@H](O)CN(c2ccc(CNC3CC3)c(Br)c2)C1 2161357929 UZOZTVZQKMLTOK-KBPBESRZSA-N 341.249 1.633 10 10 EDCE C[C@H](N)c1ccc(N(C)C[C@H](O)CN(C)C)c(Br)c1 690171667 MYVRGSZWCPCGDD-CMPLNLGQSA-N 330.270 1.828 10 10 EDCE C[C@H]1OCCN(Cc2cc(Br)cc(F)c2O)[C@H]1C(=O)O 715771218 UKEJHAXCLJGUSE-RDDDGLTNSA-N 348.168 1.968 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC4(CCCC4)OC[C@@H]3C)c2n1 2064118933 DDXVXFAJECKVMA-LBPRGKRZSA-N 330.388 1.917 10 10 EDCE CN[C@H](c1ccc2c(c1)CCN2C)C1(O)CN(C(=O)OC(C)(C)C)C1 2044748052 LRVHGVYLHNZSHE-MRXNPFEDSA-N 347.459 1.921 10 10 EDCE CC(C)(O)[C@H]1CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2191157680 SZTYBUJAYVPPGE-VXGBXAGGSA-N 340.221 1.751 10 10 EDCE CCCN1CCN(c2ccc(CN)c(Br)c2)CC1=O 2102559627 WXLPOWUOOCAVSY-UHFFFAOYSA-N 326.238 1.966 10 10 EDCE CN(c1ccc(CN)c(Br)c1)[C@H]1CS(=O)(=O)C1(C)C 2097548727 KGMDBJNIUVTORX-LBPRGKRZSA-N 347.278 1.920 10 10 EDCE COc1ccc(Br)c(CN2CCOC[C@@H](N)C2)c1O 2227740717 FUTATCSISKXABO-VIFPVBQESA-N 331.210 1.323 10 10 EDCE CC(C)NC(=O)COC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297507146 DHWZEUZSXYRHKD-UHFFFAOYSA-N 332.400 1.604 10 10 EDCE O=C(O)[C@H]1CCCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2309144756 IAWURJBAYNLQLL-INIZCTEOSA-N 344.411 1.860 10 10 EDCE C[C@H](O)[C@@H](C(=O)O)N1C(=O)C(=Cc2ccccc2F)SC1=S 2323823874 VBKZOPISJXSHJH-CPCISQLKSA-N 341.385 1.861 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2333237781 RHQVGWUBMMLDSR-KQXJFYCDSA-N 333.201 1.349 10 10 EDCE Cc1ccc(CN2C[C@H](O)[C@H]3COC[C@H]32)c(O)c1Br 2352691866 XCFZEPHZBWAITI-TUAOUCFPSA-N 328.206 1.655 10 10 EDCE Cc1ccc(CNC[C@@H]2COCCN2C)c(O)c1Br 2352942910 MKIWUOKMCVKXQB-GFCCVEGCSA-N 329.238 1.883 10 10 EDCE CC(C)C[C@H](NC(N)=O)C(=O)NCc1ccc2c(c1)CCCN2C 57558800 DWFGKNLKKQNBGO-HNNXBMFYSA-N 332.448 1.768 10 10 EDCE NC(=O)CCN(Cc1ccccc1)C(=O)COc1ccc(N)cc1 301182167 LRHXBSAJXKZLFY-UHFFFAOYSA-N 327.384 1.552 10 10 EDCE COC(=O)[C@@H]1C[C@@H](OC)CN1Cc1ccc(N2CCOCC2)cc1 125782071 CUOSWAOLTHAGBW-SJORKVTESA-N 334.416 1.286 10 10 EDCE COC[C@H](O)CN1CCC(N[C@@H](C)c2ccc(F)cc2O)CC1 186194538 DROMRCHUDFEXTO-SWLSCSKDSA-N 326.412 1.654 10 10 EDCE Cc1ccc(C)c(OCC(=O)NCCN2C(=O)CSC2=S)c1 49756056 MNDCDRBUORYJDH-UHFFFAOYSA-N 338.454 1.659 10 10 EDCE CCCN(CC(N)=O)c1cc2c(cc1Br)[C@H](N)C(=O)N2 723169870 UTLXRYJGQYHCPX-LBPRGKRZSA-N 341.209 1.103 10 10 EDCE CN(C/C=C/c1ccc(N(C)C)cc1)C[C@@H](O)CN1CCOCC1 835026409 TUBCSVWIBGUFHW-VZSQWMKGSA-N 333.476 1.391 10 10 EDCE CCOC[C@H]1CCCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)C1 737876535 HMENPVAUJWQVQP-NSHDSACASA-N 334.376 1.382 10 10 EDCE CC(C)N(CC(=O)NCc1ccc(N(C)C)cc1)C[C@@H]1CCC(=O)N1 839669363 OXTRYVCPTFELSV-INIZCTEOSA-N 346.475 1.358 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CC2(C1)CS(=O)(=O)C2 910709584 DQEZARUQYHSZIS-UHFFFAOYSA-N 339.394 1.183 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(C2(O)CC2)CC1 844363145 IGWDIFLXFHBXND-UHFFFAOYSA-N 345.487 1.948 10 10 EDCE CSC[C@@H]1NC(=O)N(Cc2ccc(N3CCN(C)CC3)cc2)C1=O 925078984 BYXDBHKTGKZXNM-HNNXBMFYSA-N 348.472 1.222 10 10 EDCE O=C1C[C@H](CCNCc2cc(Br)cc(F)c2O)CN1 922783205 ZXCLZPZYUXSEHE-QMMMGPOBSA-N 331.185 1.910 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@@](C)(C(F)F)C2)cc1 852784975 VRUMDAKNYNRXOL-QGZVFWFLSA-N 341.402 1.725 10 10 EDCE C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)NCCCN=[N+]=[N-] 1895876443 VFWBUDCFYLJWKC-WDEREUQCSA-N 327.385 1.827 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@H]3CCCC(=O)N3)C2)cc1 855227445 WQXBBSYSVWFKDH-KGLIPLIRSA-N 331.416 1.449 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1cn([C@@H]2CCCNCC2)nn1 852817502 YFEKTKFUZPMHTD-CQSZACIVSA-N 329.404 1.571 10 10 EDCE CCOc1ccc(N2CCN(c3nnnn3[C@@H](C)COC)CC2)cc1 1340251865 IBLSKSFBPVCEKA-AWEZNQCLSA-N 346.435 1.606 10 10 EDCE Cc1cc(N(C)C)ccc1CNCc1cn(C[C@@H]2CCOC2)nn1 865466536 XNDLCUKKJAQAOR-HNNXBMFYSA-N 329.448 1.979 10 10 EDCE O[C@H](CNCc1ccc(N2CC=CC2)cc1)CC1(O)CCOCC1 872203960 GWGYLPRJCFNYQL-SFHVURJKSA-N 332.444 1.445 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4COC[C@H]4C3)c(Br)cc2[C@@H]1O 718354340 OYIGTMSWCGXKHZ-RBDZCENOSA-N 339.189 1.517 10 10 EDCE Cn1nc(-c2cccnc2)cc1C(=O)NCCc1ccc(O)c(O)c1 1137464635 JABDFYKTXDWLTD-UHFFFAOYSA-N 338.367 1.866 10 10 EDCE NC[C@H]1CN(Cc2cc(Br)cc(F)c2O)CCCO1 715790597 BNROLVCDCLSAPW-NSHDSACASA-N 333.201 1.843 10 10 EDCE CNC(=O)[C@@H](C)NCC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1320651790 FRFCAERXRKAUFO-WDEREUQCSA-N 348.407 1.082 10 10 EDCE COC(=O)C[C@@H](CNC(=O)C(=O)N(C)Cc1ccccc1O)C1CC1 1331089247 JXVCIJUMTVRTPF-AWEZNQCLSA-N 348.399 1.056 10 10 EDCE CO[C@@]1(CNCc2ccc(N3CCCC3)cc2)CCS(=O)(=O)C1 1332351067 BFVWRIPKTOFZPN-QGZVFWFLSA-N 338.473 1.580 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCC[C@H]3C)C2)cc1 1261694534 SMUBCFSEYYMHFN-KEYYUXOJSA-N 345.443 1.695 10 10 EDCE Oc1c(Br)cccc1CNCC1(F)COCCOC1 2130652917 TWQWULRZTZXHBA-UHFFFAOYSA-N 334.185 1.999 10 10 EDCE CO[C@@H]1C[C@@H](NCc2cc(Br)cc(F)c2O)C[C@H]1O 2130803955 FGHAUIAETLCTLK-MVWJERBFSA-N 334.185 1.922 10 10 EDCE COc1ccc(-n2nnnc2CN[C@H](C)CNC(=O)CC2CC2)cc1 1266918175 STIJHRMWPAUBIE-GFCCVEGCSA-N 344.419 1.065 10 10 EDCE O=S1(=O)CC(CCNCc2c(O)cccc2Br)C1 1351331306 SKMARPHRJVTKCE-UHFFFAOYSA-N 334.235 1.679 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1sccc1-n1ccnn1 1294909048 MUFYCKMDYFWQCB-UHFFFAOYSA-N 330.369 1.713 10 10 EDCE CCOC(=O)c1cn(CCNC(=O)/C=C/c2ccc(O)c(O)c2)cn1 1297287708 HQEVDGBFSHJSAS-GQCTYLIASA-N 345.355 1.301 10 10 EDCE O=C(C[C@@H]1Oc2ccccc2NC1=O)NCc1ccc(O)cc1O 1299570987 OLANQURRYQULMQ-HNNXBMFYSA-N 328.324 1.504 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cn2cncc2C)cc1C 1497640232 OUVBDOBHNKKICU-PLNGDYQASA-N 342.443 1.971 10 10 EDCE CC(C)OCCN[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1731638094 FWUCUUPJLWYDNQ-GFCCVEGCSA-N 335.408 1.982 10 10 EDCE COC(=O)N1CC[C@@H](C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 1858383821 VQTSEJUKBFKJMK-CQSZACIVSA-N 347.415 1.432 10 10 EDCE COc1ccc(C(N)=O)cc1S(=O)(=O)Nc1cccc(N(C)C)c1 1871340607 DTLJFJKDIAIPNR-UHFFFAOYSA-N 349.412 1.661 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](F)[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 1895515324 FZXSHENYAIPTRA-DDHJBXDOSA-N 328.384 1.457 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)C(=O)NCCN=[N+]=[N-])C1 1985093493 AJKXUMPERVXLLN-UHFFFAOYSA-N 335.311 1.030 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(O)C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 1985099693 APVQGZGHGFPVRH-KMHCFJFGSA-N 325.369 1.173 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010403367 CRHCRXLUUVAPBA-VHSXEESVSA-N 340.384 1.056 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(F)cc2O)[C@@H](O)C1 2024899386 ZWUAHDDYMLYSRH-HIFRSBDPSA-N 340.395 1.991 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2025611068 JOFHTOUFGKUAPL-ZJUUUORDSA-N 340.384 1.056 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@@]2(C)CO)cc1Br 698114420 KUYHWEAOGQCRNJ-ZFWWWQNUSA-N 343.265 1.881 10 10 EDCE O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)c1ccc(O)c(O)c1 385557241 YQCFUDCNPYWUEE-INIZCTEOSA-N 342.395 1.729 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCN(C4CC4)C[C@H](C)C3)c2n1 2064279877 FGQRNYBDFHBKNB-NSHDSACASA-N 329.404 1.300 10 10 EDCE Oc1ccccc1CNC1CCN(c2nccn3c(O)nnc23)CC1 2065383528 JQWPILWQDABHNU-UHFFFAOYSA-N 340.387 1.294 10 10 EDCE C[C@H](N)c1ccc(N2CC(N3CCOCC3)C2)cc1Br 2169499636 FAQBLXRHOGBEKO-NSHDSACASA-N 340.265 1.990 10 10 EDCE O=S1(=O)C[C@H]2CCN(Cc3ccc(Br)cc3O)[C@@H]2C1 2094882769 MWYSPFPPXMCHQJ-ZYHUDNBSSA-N 346.246 1.774 10 10 EDCE CN(CCN1CCOCC1)c1ccc(CO)cc1Br 2113756460 JBNARNYZZYKRLZ-UHFFFAOYSA-N 329.238 1.710 10 10 EDCE CC(C)(CCCOc1nnc(=N)[nH]n1)CNC(=O)OC(C)(C)C 2210652075 QTHUDRWHBALTSA-UHFFFAOYSA-N 326.401 1.389 10 10 EDCE CN(c1ccc(CO)c(Br)c1)[C@H]1COC2(COC2)C1 2270765060 ADLFVYWEBFASOT-GFCCVEGCSA-N 328.206 1.936 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cc(CO)ccn2)s1 2284541780 OVVKXEDYAYLIKG-UHFFFAOYSA-N 331.444 1.231 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@@H]2O 2355455540 ZSDARITZVXUPPP-OQMGSFEQSA-N 342.233 1.622 10 10 EDCE COc1cccc(/C=C2/SC(N3CCN(C)CC3)=NC2=O)c1OC 33285879 CXUFGPOVUYHDJP-SDNWHVSQSA-N 347.440 1.922 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3C[C@H](C)[C@@H](O)C3)c(Br)cc21 2367017985 SXZBFVOQDGQIKF-WCDAPOTHSA-N 340.221 1.479 10 10 EDCE Nc1ccc(CC(=O)N[C@H]2CCS(=O)(=O)c3ccccc32)cc1 195141499 MNCNPCYFWBFMHG-HNNXBMFYSA-N 330.409 1.846 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@H](Cc1ccc(O)cc1)C(=O)O 90635945 JRXLVUMFJASLDR-SMGNDMQFSA-N 343.335 1.629 10 10 EDCE C[C@@H](CN(C)C)NC(=O)NCc1cc(Br)ccc1O 807575983 KZFWOCCZOPIJIB-VIFPVBQESA-N 330.226 1.904 10 10 EDCE Cc1ncc(C(=O)NCc2cc(Br)ccc2O)c(N)n1 807736772 GWNHUVBTZDYNKT-UHFFFAOYSA-N 337.177 1.765 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@]23[C@H]4C(=O)[C@H]5[C@H]6C[C@@H]([C@@H]52)[C@H]3[C@H]64)cc1F 800471134 PGLCMPBFRMYYQX-WRGCWICPSA-N 340.398 1.835 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CSCN1C(=O)CC 808094847 GRYJANKHEXJOHM-NSHDSACASA-N 343.445 1.806 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=O)NCCc1ccc(N)cc1)C2 818654258 AKGBMGHPFFAIQV-IMJJTQAJSA-N 346.431 1.730 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CN3CC(C4CC4)C3)CC2)cc1 812312753 FTUMBKXAFMPYIU-LJQANCHMSA-N 345.487 1.520 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)N3CCOC[C@H]3CO)c2C)cc1 824695105 FSKKUJXYROIOHA-MRXNPFEDSA-N 344.411 1.936 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(C[C@H]2CCOC2)CC1 588406910 ONDVRUAUQBVLIN-NSRYLSIASA-N 332.400 1.292 10 10 EDCE O=C(/C=C\Cn1cncn1)N(Cc1ccccc1O)C[C@H]1CCCO1 901174723 HMCGHOOOHQFSRS-HQOGMNCSSA-N 342.399 1.748 10 10 EDCE O=C(NC[C@]1(O)[C@H]2[C@H]3C[C@@H]4[C@H]5[C@@H](C[C@H]42)[C@@H]1[C@@H]53)c1c(F)ccc(O)c1O 830689807 BTIJOYILVISPOP-YIRXJFJRSA-N 345.370 1.476 10 10 EDCE CCO[C@@H]1C[C@H](NC(=O)NCc2ccccc2O)[C@H]1n1cccn1 836495940 OZRJRZXFZXJPIJ-NUEKZKHPSA-N 330.388 1.807 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@@H](C(=O)N(C)C)C2)c([N+](=O)[O-])c1 840365615 XFRQUEPCWLCLMO-SCXUMTSISA-N 347.371 1.696 10 10 EDCE O=C(NCC[C@H]1CCCS1(=O)=O)NCc1c(O)cccc1F 924011437 GRMIRPNYTPLLNZ-SNVBAGLBSA-N 330.381 1.298 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)C(=O)N(C)C)C2)cc1 851985255 UCFGGRGSCPLZFG-QWHCGFSZSA-N 334.420 1.050 10 10 EDCE Cn1cc(/C=C\C(=O)N2CC(C)(C)c3ccccc32)c(=O)n(C)c1=O 758178642 MYSNHZMTZSTWHR-KTKRTIGZSA-N 339.395 1.422 10 10 EDCE O=C1CC[C@](C(=O)NCc2c(O)cccc2F)(c2ccccc2)CN1 928705988 NDVFEFWJDMPFAL-LJQANCHMSA-N 342.370 1.996 10 10 EDCE Cc1cc(C(=O)CN2C[C@@H](O)C[C@@H](O)C2)c(C)n1-c1cccc(F)c1 752309830 NAVXLQRKODUBCY-CALCHBBNSA-N 346.402 1.843 10 10 EDCE CC(C)OC[C@H](N)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 851630353 KDCRWHIWARTZIF-HNNXBMFYSA-N 339.411 1.031 10 10 EDCE C[C@@]1(Br)C[C@@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 860116267 MWMNERAEOIMFNZ-AMIZOPFISA-N 329.146 1.997 10 10 EDCE O=S(=O)(NCc1ccc(N2CCCC2)cc1)c1cnc(O)s1 866484999 CEVQLWSFWBWRFB-UHFFFAOYSA-N 339.442 1.927 10 10 EDCE CCOC(=O)C1(S(=O)(=O)N2Cc3cccc(O)c3C2)CCC1 867690584 JKBOPZMVWJUZAK-UHFFFAOYSA-N 325.386 1.523 10 10 EDCE CO[C@@H](CS(=O)(=O)N[C@H](C)c1ccccc1O)[C@@H]1CCOC1 867834435 IHYLKCMJYOUTPC-JMSVASOKSA-N 329.418 1.424 10 10 EDCE CC1(C)CN(Cc2ccc(N3CCOCC3)cc2)CCN1CCO 783715762 VKTLZJJDPCNTDU-UHFFFAOYSA-N 333.476 1.412 10 10 EDCE CC(C)(O)CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 792291060 GOCHABUMYOXDLP-UHFFFAOYSA-N 345.487 1.996 10 10 EDCE CN[C@H](C)c1ccc(N2CC(=O)NC(=O)[C@H]2C)c(Br)c1 97292473 RLSCJFMHRDEJTN-RKDXNWHRSA-N 340.221 1.581 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)C2(C(N)=O)CC2)cc1C 1319232680 KQOSNYAREOEELL-GFCCVEGCSA-N 333.432 1.111 10 10 EDCE O=C(O)C[C@@H]1CN(Cc2c(O)cccc2Br)C[C@H]1O 2117727175 GATWIGAFOBAZKA-PRHODGIISA-N 330.178 1.422 10 10 EDCE COC1(c2nccn2C)CCN(C(=O)c2ccc(C)c(O)c2O)CC1 1347605784 PETUMLYBCRQULC-UHFFFAOYSA-N 345.399 1.918 10 10 EDCE C[C@@H]1CN(c2ccc(C=CC(=O)O)c(Br)c2)CC(=O)N1 1912126912 CLUBVLZOIMQFKE-SECBINFHSA-N 339.189 1.872 10 10 EDCE CNC(=O)NCC(=O)N(C)C1CC(NCc2ccc(OC)c(C)c2)C1 1279242800 YWLWOPCONMBUQS-UHFFFAOYSA-N 348.447 1.012 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCCN(C(N)=O)C1 1297563077 VQPPZUFELLWYFU-NSHDSACASA-N 326.393 1.285 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CN(C)[C@@H]3CCC[C@H]3O)C2)cc1 1453219011 RDUYBKUDSXCCLQ-ZTFGCOKTSA-N 347.459 1.235 10 10 EDCE CCOCCN(C)[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1700487600 MEBMOGFHOIFYTO-GFCCVEGCSA-N 335.408 1.936 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CN2CCCC2=O)cc1C 1713571614 WLJUCYVFXVMIED-UHFFFAOYSA-N 333.432 1.174 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cnccn2)cc1C 1717044144 PSSNPCOJXWWQJY-UHFFFAOYSA-N 344.415 1.018 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccnc2[nH]c(O)nc12 1633818266 GMEKCOKXELZSFG-MRVPVSSYSA-N 328.328 1.436 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(C(N)=O)c(Cl)n1 1567468085 ZBWQTWKPFOJDEQ-QMMMGPOBSA-N 349.774 1.606 10 10 EDCE C[C@H]1CS(=O)(=O)CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1652411454 CABAIFIPOVAPIC-JTQLQIEISA-N 338.389 1.498 10 10 EDCE CCc1c(C(=O)NCc2ccc(N(C)C)cc2)[nH]c(C)c1C(N)=O 159777016 ZWUPQMVUJOZUHA-UHFFFAOYSA-N 328.416 1.980 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)[C@@H]2CCCN2)c2nccn2C)cc1 1866099421 GZVBJEAZBARDND-JKSUJKDBSA-N 327.432 1.444 10 10 EDCE CNCc1ccc(N2CCOC[C@@H]2C(=O)NC)c(Br)c1 234451258 RDONSKWCROFPNJ-CYBMUJFWSA-N 342.237 1.120 10 10 EDCE C[C@@H]1CN(C(=O)c2cccc(O)c2O)CC[C@@H]1NC(=O)C(F)(F)F 1963846576 YUPFARRWPCDKQN-SCZZXKLOSA-N 346.305 1.627 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010405226 GREGAVBSZIITIY-ZYHUDNBSSA-N 341.412 1.809 10 10 EDCE C[C@@H](N)c1ccc(N(C)C2CS(=O)(=O)C2)cc1Br 2034770817 XPRBMYYQTNAZJQ-MRVPVSSYSA-N 333.251 1.702 10 10 EDCE CNC(=O)CN(Cc1ccccc1)C(=O)[C@H]1CNc2ccccc2N1 2034789887 HLOMDGCHCWUCKZ-QGZVFWFLSA-N 338.411 1.667 10 10 EDCE C[C@@H]1C[C@H](CO)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2156547918 HPSFIRMHQXIUHM-BFHDXFOESA-N 340.221 1.608 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(C)[C@@H](CO)C2)c(Br)c1 687589018 FUOIOMAXVIHGNU-ZYHUDNBSSA-N 329.238 1.615 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3c4ccccc4CC[C@H]3O)c2n1 2064988140 PKBGTXXMSLGLSQ-ZBFHGGJFSA-N 338.367 1.522 10 10 EDCE CN(c1ccc(CN)cc1)[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C[C@H]1O 1906403912 QEBUPQYMDIYCSS-NUEKZKHPSA-N 335.448 1.998 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@H](O)CN1C(=O)Cc1ccc(N)cc1 2067382219 AYACGMHIOZCGTP-CABCVRRESA-N 349.431 1.298 10 10 EDCE CN(C)C[C@H]1COCCN1c1ccc(CO)cc1Br 2096926026 ONPMOXFIPLQBMC-LBPRGKRZSA-N 329.238 1.708 10 10 EDCE Oc1cc(Br)ccc1CN[C@H]1CCN(C2COC2)C1 2113267590 AQVBAHAJGNEFBY-LBPRGKRZSA-N 327.222 1.717 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3OC(=O)N[C@@H]3C2)cc1Br 2120402306 GHUOBSUOHQBVJB-BPTDKIDVSA-N 326.194 1.766 10 10 EDCE OCc1ccc(N2CCc3ncnc(O)c3C2)cc1Br 2206106053 HSXYOCOBHQSAHM-UHFFFAOYSA-N 336.189 2.000 10 10 EDCE COC[C@@H]1[C@@H](O)[C@H](O)CN1c1ccc([C@H](C)N)c(Br)c1 2234068680 PVLJDVFDKLTYOB-OKVQYTGBSA-N 345.237 1.026 10 10 EDCE C[C@H](NCc1nn(C)nc1Br)c1c(O)cccc1O 2226970949 XLZSFIKZXCTNOP-ZETCQYMHSA-N 327.182 1.840 10 10 EDCE CSc1ncc(CNc2ccc(S(N)(=O)=O)c(N)c2)s1 2284697923 HNKCFILUXQXDHX-UHFFFAOYSA-N 330.460 1.707 10 10 EDCE C[C@@H](NCC(CO)(CO)NC(=O)OC(C)(C)C)c1ccccc1O 2249538095 OVDWGQMBHUEMRS-GFCCVEGCSA-N 340.420 1.291 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@@H]2OCCN(C(=O)OC(C)(C)C)[C@@H]21 2300530501 RHKADHANRHOXTA-TUAOUCFPSA-N 339.396 1.780 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N=c1ccn(Cc2ccncc2)[nH]1 2307996533 NMAIVUDRYVRJBM-UHFFFAOYSA-N 336.351 1.811 10 10 EDCE Cc1ccc(CNC(=O)[C@@]23C[C@@H]2[C@H](N)C3)c(O)c1Br 2352933429 YZTOZCHOGGGBEJ-GPCCPHFNSA-N 325.206 1.817 10 10 EDCE O=C(O)[C@]12CO[C@H](C1)[C@H](NCc1ccc(Br)cc1O)C2 2359171499 HKFZQDOGRWEDAQ-QKCSRTOESA-N 342.189 1.877 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)C[C@H](C)OC)CC2)cc1 195041573 FDUKHVOXUOMMAP-ZDUSSCGKSA-N 328.434 1.182 10 10 EDCE CCn1nc(C)c(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c1C 274768698 IDXGBFUKRSQCKO-UHFFFAOYSA-N 340.361 1.934 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC[C@@H](c3nc(=O)[nH][nH]3)C2)c1O 289525638 VYNOLECXLSPONS-SNVBAGLBSA-N 334.351 1.525 10 10 EDCE CC(=O)N[C@@H](C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380775553 WGXPRFYVBLCVIA-VIFPVBQESA-N 343.221 1.946 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@H](n4ccnn4)C3)cc2N1 819947292 YDITWLKPWOVEQA-JTQLQIEISA-N 344.331 1.359 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CCCN(C)C3)C2)cc1 823248737 USVDAVWHUXMYCS-CVEARBPZSA-N 346.475 1.915 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@H]2C(N)=O)cc1Br 723202469 VLOUENOLVKKJDM-PELKAZGASA-N 328.210 1.159 10 10 EDCE CCN(OC)C(=O)CNC(=O)c1cc(C)n(-c2ccccn2)c1C 844070093 QCCFHCHZPSPYQD-UHFFFAOYSA-N 330.388 1.629 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCC1(C2(O)CCOCC2)CC1 928672200 MQCQTQQIZLOZTI-DUXPYHPUSA-N 333.384 1.549 10 10 EDCE CCN1C[C@@H](CN(C)Cc2ccc(N3CCOCC3)cc2)OC1=O 846766987 ZLIRMFIZAZNSHD-QGZVFWFLSA-N 333.432 1.796 10 10 EDCE CC1=C(C(=O)NCc2c(O)cccc2F)[C@@H](C)n2nnnc2N1C 928706010 NMCGRMJLRMPEBK-SECBINFHSA-N 332.339 1.119 10 10 EDCE COC(=O)[C@@H]1C[C@H]1[C@@H]1NC(=O)N([C@H](C)c2ccc(N(C)C)cc2)C1=O 924717277 LYUNOELNXFADIW-QZKOUSHUSA-N 345.399 1.543 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CS(=O)(=O)C[C@H]1Oc1ccc(N)cc1 1897336179 IWNPANFEWJNOEZ-CHWSQXEVSA-N 342.417 1.338 10 10 EDCE CC[S@@](C)(=O)=NS(=O)(=O)NCc1cc(Cl)ccc1O 867463144 HGCCSXJGMHYLMD-GOSISDBHSA-N 326.827 1.498 10 10 EDCE Cc1nccnc1NC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1345956680 BNUBSWSAFWEBNQ-UHFFFAOYSA-N 340.431 1.859 10 10 EDCE O=C1N[C@@]2(C(=O)NCc3ccc4cccnc4c3O)C[C@H]3C[C@@H]1[C@H]2C3 862025496 WOUKKLFRRFYLQO-GHFQWVAPSA-N 337.379 1.471 10 10 EDCE COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(F)ccc1O 779033427 MVZBQFRFZQUBEE-QHSBEEBCSA-N 337.347 1.456 10 10 EDCE COC(=O)CC1(NCc2cc(C)ccc2O)CCS(=O)(=O)CC1 784669982 HEMXWHHUVMFGDG-UHFFFAOYSA-N 341.429 1.301 10 10 EDCE C[C@H](CS(C)(=O)=O)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1136025415 JPMCGXOVPBAYHL-CQSZACIVSA-N 338.473 1.926 10 10 EDCE C[C@@H]1C[C@@H]1[C@H]1C[C@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 897581482 RLIJKMFOGGBJNS-UNQGMJICSA-N 347.434 1.916 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@]2(CCOC2)C1 897415643 DFTUXJPKXNIHDA-MRXNPFEDSA-N 335.381 1.944 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)C[C@H]2CO)c(Br)c1 698198347 LKGAJHWLJOYHLX-STQMWFEESA-N 343.265 1.879 10 10 EDCE CN(CCN(C)C1COC1)c1ccc(CO)c(Br)c1 2116483314 ZFCMJAGNGNHQPF-UHFFFAOYSA-N 329.238 1.708 10 10 EDCE CC(C)[C@@H]1CNC(=O)CN1c1ccc(CO)cc1Br 2124760276 XPFBLNYWADMAQJ-ZDUSSCGKSA-N 327.222 1.902 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1C[C@@H]2C[C@@H]2C1 1332028629 YRJCSRYWBOMRIT-MUJYYYPQSA-N 327.428 1.818 10 10 EDCE CO[C@H]1CC[C@H]1N(C)C(=O)C(=O)NCCCSc1nccs1 1335598482 NNOOVNRORMGDDN-MNOVXSKESA-N 343.474 1.377 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1 1261856598 JOIKSLVFQICWPV-KBPBESRZSA-N 334.441 1.562 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)Cc2cnc(C)o2)cc1C 1278094532 WOCVYNFFDWMETR-OAHLLOKOSA-N 347.415 1.109 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cccc(-c2nc(=O)o[nH]2)c1 1455355894 VNDAMWUFKYWNIX-UHFFFAOYSA-N 327.296 1.371 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CC(=O)N(CC3CC3)C2)cc1 1558115550 UCNUUZZVFYOTPJ-ZDUSSCGKSA-N 329.360 1.590 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)CN2CCCC2=O)cc1C 1480746598 BVOBYERXCXSFFZ-OAHLLOKOSA-N 347.459 1.610 10 10 EDCE COc1ccc(CNC(=O)c2cnc3c(c2)NC(=O)CN3C)c(O)c1 1635041716 BSYLZDJDGHJAHJ-UHFFFAOYSA-N 342.355 1.114 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C[C@H]2COC(=O)C2)cc1C 1567010628 XQAPUNLQWFBKDR-UKRRQHHQSA-N 334.416 1.551 10 10 EDCE CN1C(=O)COc2cc(NC(=O)Cc3ccc(O)c(O)c3)ccc21 1568149782 YIGBMYVGMJSHHN-UHFFFAOYSA-N 328.324 1.634 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2ccoc2)cc1C 1733609455 GIYDIEMWIBRSPF-UHFFFAOYSA-N 332.400 1.821 10 10 EDCE CC(C)[C@@H](C(=O)NCc1cc(O)ccc1O)N1C[C@@H](C)O[C@H](C)C1 1643881700 BPYKILJHRKAJHO-XNJGSVPQSA-N 336.432 1.848 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCO[C@@]3(CCOC3)C2)cc1 1597917838 QZAXVKMHDYDYGO-BBRMVZONSA-N 332.360 1.917 10 10 EDCE CCOCCN[C@H]1C[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1691757424 HWCQLQNDCFHBNB-JNSHFYNHSA-N 347.419 1.984 10 10 EDCE CNCc1ccc(N(C)CC(=O)NC2CC2)c(Br)c1 234399240 XPNZLABOSQAXPV-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 1985102932 NVQMLTYYRUELOD-MWLCHTKSSA-N 325.369 1.125 10 10 EDCE CS(=O)(=O)CS(=O)(=O)Nc1ccc(O)c(C(F)(F)F)c1 2152906680 JGLWPZIQYPWIKF-UHFFFAOYSA-N 333.309 1.155 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NCc2ccc(F)c(F)c2O)C1 2011486488 BETFKGNVFOFVKO-NEPJUHHUSA-N 344.358 1.740 10 10 EDCE C[C@H](O)c1ccc(N2CCN(CC(N)=O)CC2)cc1Br 700786144 ONSNRGPJXZCPGF-JTQLQIEISA-N 342.237 1.110 10 10 EDCE Cc1cccc(CNC(=O)COCCNC(=O)OC(C)(C)C)c1O 2024813656 XEVUHMRYTNINRN-UHFFFAOYSA-N 338.404 1.858 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CNCc2ccc(O)cc2O)C1 702786706 GDEPAVWCCYRAKP-DOMZBBRYSA-N 338.404 1.415 10 10 EDCE OC[C@]1(NCc2cc(Br)ccc2O)C[C@@H](O)C12CCC2 2193970449 ZDYWKUUDNYBVDY-UKRRQHHQSA-N 342.233 1.910 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NCc2cc(F)ccc2O)C1 1908633632 JMNQEGPBOMPPIE-UKRRQHHQSA-N 340.395 1.991 10 10 EDCE CN(C[C@H]1CCN1C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2186456659 DKHZEPFYENFAMO-OQPBUACISA-N 339.237 1.541 10 10 EDCE CN(C)C(=O)[C@@H]1CCN(c2ccc(CN)cc2Br)C1 2087394883 BQRFJANIFZTILO-LLVKDONJSA-N 326.238 1.822 10 10 EDCE C[C@@H](N)c1ccc(N2CC(C(=O)N(C)C)C2)c(Br)c1 2121047099 TWHIGEXPCTUIRR-SECBINFHSA-N 326.238 1.993 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213593218 VZYSBULYVRQLCD-IVZWLZJFSA-N 340.384 1.103 10 10 EDCE CC(C)n1[nH]c(Br)nc1=NCc1cc(N)ccc1O 2353711872 YFEYKWUWSFEFGL-UHFFFAOYSA-N 326.198 1.943 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2354478847 SPKAAABURTUJKT-HMUFECAUSA-N 341.249 1.660 10 10 EDCE Cc1cc(C(=O)CN2C[C@@H](O)C[C@@H]2CO)c(C)n1-c1cccc(F)c1 184733859 CIHDPQGVNINGBC-SJORKVTESA-N 346.402 1.843 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3C[C@@H]3C(=O)NC3CC3)CC2)cc1 242806401 FGWFXTNTPNHKCN-IRXDYDNUSA-N 343.427 1.259 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N[C@H]1C[C@H]2CC[C@H]1O2 255764823 AFSMSRGTAMNKIZ-NANQHQFXSA-N 328.412 1.973 10 10 EDCE Cc1ccc(CN2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)c(O)c1Br 2380815526 QHZJQJXHSUVLAV-HGSJOUDDSA-N 342.233 1.637 10 10 EDCE CCCCN(C)S(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 298262465 AESFKHBLYKBIES-UHFFFAOYSA-N 341.477 1.794 10 10 EDCE Cn1c(=O)n(C)c2cc(NC(=O)c3cccc(O)c3O)c(O)cc21 812384584 SEICUBRDYAXBJE-UHFFFAOYSA-N 329.312 1.246 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@@H]2C(N)=O)c(Br)c1 723202872 XQYSNJRQMMFUDY-PRHODGIISA-N 328.210 1.159 10 10 EDCE C[C@H](NC(=O)CC1(O)CCOCC1)c1ccc(N2CCOCC2)cc1 906418888 CZGMZGFRFRXERS-HNNXBMFYSA-N 348.443 1.632 10 10 EDCE C[C@H](O)c1cn(C2CN(C/C=C\c3ccc(N(C)C)cc3)C2)nn1 835045043 RKEOABIRBAJZJH-WSNITJDQSA-N 327.432 1.968 10 10 EDCE COc1ccc(CNC(=O)NCC2(CF)CCOCC2)c(O)c1 836600238 RLILRKRFGFYFPC-UHFFFAOYSA-N 326.368 1.966 10 10 EDCE COC(=O)/C(C)=C\CNC(=O)NCc1ccc(N2CC=CC2)cc1 919909357 QQCPUGGGFFWDJC-ZROIWOOFSA-N 329.400 1.981 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@](C)(O)[C@@H](O)C2)c(Br)c1 1893326910 YQXUXHJLRJIKDM-IIMNLJJBSA-N 329.238 1.791 10 10 EDCE C[C@@H](NC(=O)C(=O)NCC[C@H]1CCCNC1)c1ccc(N(C)C)cc1 842203852 XWXFYMNZJDYOIV-HUUCEWRRSA-N 346.475 1.436 10 10 EDCE O=C(NCC[C@@]1(O)CCOC1)NCc1ccc(N2CC=CC2)cc1 845002798 OAMLTKOTSFLZKY-GOSISDBHSA-N 331.416 1.404 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCC[C@@H](N)C3)C2)cc1 851664080 QODDCRDMKFHQCJ-ILXRZTDVSA-N 332.448 1.843 10 10 EDCE C[C@H](NC(=O)N[C@H]1CCc2nnn(C)c2C1)c1ccc(N(C)C)cc1 922054851 MGERIEPQCONPCX-JSGCOSHPSA-N 342.447 1.799 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](CC(C)C)NC(C)=O)C2)cc1 855225562 KXZRSBKOYNNXOC-YJBOKZPZSA-N 347.459 1.941 10 10 EDCE CS(=O)(=O)N1CCCC[C@@H]1CNCc1ccc2c(c1)CCCO2 922122577 AQBTYAIRLWJMSR-MRXNPFEDSA-N 338.473 1.915 10 10 EDCE COCc1n[nH]c(CNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 854002738 DFJAZGTVVOTBOT-LLVKDONJSA-N 332.408 1.578 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CCCOC3)C2)cc1 851996423 PYNOAOQUBPLMRD-GJZGRUSLSA-N 333.432 2.000 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccn4nnnc4c3)C2)cc1 855223491 AUHLTOMSLHNKBZ-ZDUSSCGKSA-N 338.371 1.142 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC2(COC2)C1 853452568 JNLDNEFZCXBKFV-UHFFFAOYSA-N 349.406 1.594 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCNC12CCC2 861792361 SVYGYFKWEIHLMX-INIZCTEOSA-N 344.459 1.112 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccn(C2CCOCC2)n1 860235788 ZDKGALJPXPCZSI-UHFFFAOYSA-N 331.372 1.618 10 10 EDCE C[C@](O)(C[C@H](O)CNCc1ccc(N2CCC(O)CC2)cc1)C1CC1 872215913 LFPOZTRTJJWWEX-PMACEKPBSA-N 348.487 1.649 10 10 EDCE C[C@@H](Nc1ccc(C(=O)NCCO)nn1)c1ccc(N(C)C)cc1 772299126 BOQDWMAWERMQAQ-GFCCVEGCSA-N 329.404 1.438 10 10 EDCE CN[C@@H](C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)c1cnn(C)c1 1118569366 FYBVCUYQSGRLMJ-WMLDXEAASA-N 343.431 1.084 10 10 EDCE Cc1ccc(C(=O)NC[C@@H](O)[C@@H](C)O)cc1-n1c(C)cc(C=O)c1C 871144080 UPYBBOWQUSYTFE-RDTXWAMCSA-N 344.411 1.687 10 10 EDCE C[C@@H](NC(=O)NCCCN1CCOC1=O)c1ccc(N(C)C)cc1 773306326 KNTBAFIRMMBKOV-CYBMUJFWSA-N 334.420 1.955 10 10 EDCE COc1cccc(CNC[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@@H]6[C@H]4[C@H]2[C@@H]6C[C@H]53)c1O 785543670 HQJCPTJEPDXTGN-RNCWDVHFSA-N 327.424 1.999 10 10 EDCE C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 897361981 XPJKQTUGJFQRMM-NQZOLGFYSA-N 329.444 1.777 10 10 EDCE C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 897581480 RLIJKMFOGGBJNS-REBRKWNGSA-N 347.434 1.916 10 10 EDCE CCN(Cc1cc(Br)ccc1O)[C@@H]1CCC(=O)NC1=O 799124948 CHYJYJMODZPLMG-LLVKDONJSA-N 341.205 1.782 10 10 EDCE C[C@H](NC(=O)C(=O)N1CC[C@@H]2COC[C@@H]2C1)c1ccc(N(C)C)cc1 1330968554 KQIDSERADVLVPP-IMJJTQAJSA-N 345.443 1.425 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)c2[nH]nnc2C)C2CC2)cc1C 1269099947 ULBYVOWVXIVBEI-HNNXBMFYSA-N 343.431 1.728 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2COC(=O)N2)cc1C 1277810182 MEYMIGMHUXPHSV-TZMCWYRMSA-N 335.404 1.049 10 10 EDCE COc1ccc(CNCC[C@@H]2CCN(C(=O)c3nc[nH]n3)C2)cc1C 1501628568 FPYSAUISGLEDOV-CQSZACIVSA-N 343.431 1.764 10 10 EDCE CC(C)(C)C(=O)Cn1cc(C(=O)NCc2cc(O)ccc2O)nn1 1471661102 IISQHQNVCZYPOJ-UHFFFAOYSA-N 332.360 1.235 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2ccc(O)nn2)cc1C 1480422739 XARHSGIFVOEGFK-GFCCVEGCSA-N 330.388 1.407 10 10 EDCE CO[C@@H](C)CN[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1480122820 ZGCPKQQOYWDJBJ-FZMZJTMJSA-N 333.392 1.688 10 10 EDCE COC(=O)c1cccc2c1CCN2C(=O)/C=C/c1cnc(OC)nc1 1626755314 ZGHFEORTPOSFBK-VOTSOKGWSA-N 339.351 1.874 10 10 EDCE C[C@@H](O)CNC[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1485707337 XCWJDWCPAPFFJV-JTNHKYCSSA-N 333.392 1.328 10 10 EDCE O=C(NCc1nnnn1C1CC1)c1cc2cc(O)c(O)cc2s1 1634794364 XYHXXBMTKXQODQ-UHFFFAOYSA-N 331.357 1.564 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nnn(C)c1C(F)(F)F 1633819507 QQLPYZLYPRXRSA-SSDOTTSWSA-N 344.293 1.606 10 10 EDCE CN(C)[C@@H]1COC[C@H]1CNCc1cccc(Br)c1O 1924667622 AYAJSBKJYCQMIQ-DGCLKSJQSA-N 329.238 1.821 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@H]2CN(C)C(=O)N2)cc1C 1497241942 SWGLLQBSVXMVET-DZGCQCFKSA-N 348.447 1.012 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2nnn3cc(C)nc(O)c23)c1 1636061021 BTEFJJDOBGPOPJ-SECBINFHSA-N 343.343 1.344 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@@H](C)NC(C)=O)C(C)C)cc1C 1732554896 ODAQOZYCDCQHMS-PBHICJAKSA-N 349.475 1.759 10 10 EDCE CN(CCCC(=O)NCc1ccc(O)cc1O)C(=O)c1ccncc1 1570463984 YPWRHVMSNQNRKL-UHFFFAOYSA-N 343.383 1.661 10 10 EDCE CS(=O)(=O)Cc1ccc(C(=O)NCc2ccc(O)cc2O)cc1 1643100661 GEADTFLILWOLAR-UHFFFAOYSA-N 335.381 1.572 10 10 EDCE CCC(=O)N[C@@H](CCSC)C(=O)NCc1cc(O)ccc1O 1593872898 FTNJXBSCXXSTLD-LBPRGKRZSA-N 326.418 1.362 10 10 EDCE COc1ccc(CNC2(CNC(=O)CO[C@H]3CCOC3)CC2)cc1C 1670781988 SBRPYXKLOIRPTN-INIZCTEOSA-N 348.443 1.548 10 10 EDCE CNCc1ccc(N2CC[C@](C)(C(N)=O)C2)cc1Br 234377090 BMKZWDBFTUXJMZ-AWEZNQCLSA-N 326.238 1.870 10 10 EDCE CCCNC(=O)CNCc1c(Br)ccc(OC)c1O 1964022012 NPOFAYYXYUNUMB-UHFFFAOYSA-N 331.210 1.779 10 10 EDCE COc1ccc(Br)c(CN(C)[C@@H]2CCNC2=O)c1O 1964604510 BORCOPZKLGRUQU-SNVBAGLBSA-N 329.194 1.484 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C1(NC(=O)OC(C)(C)C)CC(O)C1 1990022873 MXKZQAGFWZZUEV-UHFFFAOYSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC(N=[N+]=[N-])C1 2010389461 QHQBJJLUWZUSPW-LLVKDONJSA-N 335.368 1.367 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)NCC1(CN=[N+]=[N-])CC1 2010404413 AEXJZBNNBHYXGJ-JTQLQIEISA-N 341.412 1.857 10 10 EDCE CC(=O)N1C[C@@H]2C[C@H]1CN2c1cc(Br)c(CN)cc1F 2192282296 LQKSHPTVHXYQEZ-QWRGUYRKSA-N 342.212 1.856 10 10 EDCE COc1ccc(N2CCN[C@@H]3COC[C@H]32)c(OC)c1Br 2189095066 QTINCJXIAOGFOR-MWLCHTKSSA-N 343.221 1.643 10 10 EDCE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(C(=O)c2cccc(O)c2O)C1 2054419363 CKPUCZLILVOSIO-IUCAKERBSA-N 346.305 1.627 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)C1(CO)CN(C(=O)OC(C)(C)C)C1 2080809416 GSGCSSLVCVBHIE-UHFFFAOYSA-N 349.431 1.457 10 10 EDCE CO[C@H]1C[C@@H](O)CN(c2ccc(CN)c(Br)c2F)C1 2109020938 TYLLWSZCVGNMHK-ZJUUUORDSA-N 333.201 1.633 10 10 EDCE NCc1ccc(N2C[C@H]3CCO[C@]3(CO)C2)cc1Br 2231367625 BIHJBGGWQXGSNU-RISCZKNCSA-N 327.222 1.495 10 10 EDCE O=C(O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccncc2)SC1=S 2293031245 TUUIBVDOMQVQRI-QMMMGPOBSA-N 338.366 1.211 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1 2300530674 UUOLSHHZCBUVNI-VXGBXAGGSA-N 339.396 1.730 10 10 EDCE C[C@@H]1NCCC[C@@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2312036082 PZZPXJPLXZVXFN-YJBOKZPZSA-N 329.444 1.793 10 10 EDCE O=C1C[C@H](c2ccccc2)N(C(=O)c2cccc(O)c2O)CCN1 188216670 HRYZFWCSGGCPLY-CQSZACIVSA-N 326.352 1.801 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H](NC(N)=O)C(C)C)CC2)cc1 193665713 FFDKEIGUIPJNRU-INIZCTEOSA-N 348.447 1.427 10 10 EDCE O=C1NC[C@@H]2CN(Cc3cc(Br)ccc3O)CC[C@H]12 365661704 RGHPFWYWVIRLMJ-PWSUYJOCSA-N 325.206 1.723 10 10 EDCE CN1CCN(c2ccc(CN3CCO[C@@H](C(F)F)C3)cc2)CC1 802653777 SLYOBCWGFFJDBD-MRXNPFEDSA-N 325.403 1.904 10 10 EDCE CC[C@@H](C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1)C(=O)OC 819586770 BWMLDDVSWDZNST-BBRMVZONSA-N 334.416 1.837 10 10 EDCE CN[C@H](C)c1ccc(N2CCOC[C@H]2C(N)=O)cc1Br 723150707 LHKBFYVORDERER-RNCFNFMXSA-N 342.237 1.420 10 10 EDCE COC(=O)c1cn(C2CN(C/C=C\c3ccc(N(C)C)cc3)C2)nn1 835044536 LPZSCLQXCFUVLJ-PLNGDYQASA-N 341.415 1.701 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C1CN(C)CCN(C)C1 906344210 CWCOEGCQSWOIBU-UHFFFAOYSA-N 346.519 1.983 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCC[C@@]3(C2)NC(=O)NC3=O)cc1 835051501 GTTCJYAZSRRBMF-YZTRRJNXSA-N 328.416 1.440 10 10 EDCE CCO[C@H](C(=O)N(CC(=O)O)Cc1ccccc1O)[C@H]1CCOC1 911492587 IGCKHNJULICKIE-BBRMVZONSA-N 337.372 1.247 10 10 EDCE CC(C)NC(=O)[C@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 856240712 UBALBJHAUFJERY-OWNNVSBGSA-N 332.400 1.874 10 10 EDCE C[C@](Cc1cc(O)nc(O)c1)(NC(=O)OCc1ccccc1)C(=O)O 1952374851 UOKJXZOIPNYHHQ-QGZVFWFLSA-N 346.339 1.805 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)/C=C/c3cnn(C)c3)C2)cc1 855230761 XRAZYRVNFCQTJD-GZTQLTBSSA-N 326.400 1.837 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1C[C@H](O)C12CCC2 853474643 JYFROAFIWKTBFT-SJORKVTESA-N 345.443 1.626 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC4CC3(C)C4)CC2)cc1 852785971 SAFAPUTWGZIFMZ-UHFFFAOYSA-N 329.444 1.828 10 10 EDCE Cc1cncn1CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 858784906 BEBCCQJULZIYIX-OAHLLOKOSA-N 328.416 1.906 10 10 EDCE NC(=O)C[C@@H]1CN(Cc2ccc(Br)cc2O)CCO1 862535385 KYYPLXYMWJSFMD-LLVKDONJSA-N 329.194 1.231 10 10 EDCE Cc1ncc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)o1 862279337 OMBDUWWFCXYZQW-UHFFFAOYSA-N 335.429 1.508 10 10 EDCE CN(C)c1ccc(/C=C\CN[C@@H]2C(=O)NCC23CCOCC3)cc1 895769111 MUKAACUQCRNYPS-CWIOURORSA-N 329.444 1.651 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3C[C@H]3C3CC3)C2)cc1 1328179623 XGRPFUCQZVYFLM-RRQGHBQHSA-N 343.427 1.305 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H](CN(C)C)NC(=O)OC(C)(C)C 1900612188 FCRQVRNCYINZFL-LLVKDONJSA-N 328.417 1.600 10 10 EDCE CCOCCN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 211558344 FQYPAZGDAMOFRU-LBPRGKRZSA-N 328.210 1.874 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2cn(C)cn2)cc1C 1275954996 PSISZCSVRIMRPV-UHFFFAOYSA-N 330.432 1.989 10 10 EDCE C[C@@H](CN(C)C(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C1CC1 1287646824 ODJIQDUCMMVHOM-JTQLQIEISA-N 331.376 1.836 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)CCCCCO)CC2)cc1 1542431639 BIUQDHDWRIMJNZ-UHFFFAOYSA-N 349.475 1.486 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H]2CCCCO2)cc1C 1482722281 LAIIODXMWSAZSN-DOTOQJQBSA-N 336.432 1.139 10 10 EDCE COCCCN1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1483707142 QPEHIAOGHJBNAZ-AWEZNQCLSA-N 333.392 1.690 10 10 EDCE C[C@]1(CC(=O)NCc2ccc3cccnc3c2O)CCS(=O)(=O)N1 1557124304 ZOBKVYOVXVOCBR-MRXNPFEDSA-N 349.412 1.029 10 10 EDCE C[C@H]1CN(CC(C)(C)O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1633092324 PUWMADPHROGOAK-LBPRGKRZSA-N 347.419 1.766 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)Cc2nnc(C)o2)cc1C 1567014249 YSJIJMYSVUIKHK-LBPRGKRZSA-N 332.404 1.532 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@@H]2COC(=O)C2)cc1C 1731903504 QWSOEZLYMFXWAI-HNNXBMFYSA-N 334.416 1.505 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@]2(C)CCC(=O)N2)cc1C 1669027346 PTMDAYKLXNFZMU-HMECNJMJSA-N 345.443 1.434 10 10 EDCE CCc1nnc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)o1 1858105492 HZKBXTBIHNPCJC-UHFFFAOYSA-N 330.388 1.532 10 10 EDCE CCn1cc(/C=C/c2nc3c(c(=O)n(CC)c(=O)n3CC)n2C)cn1 1857514671 FSCFWYAAOQFYDJ-CMDGGOBGSA-N 342.403 1.323 10 10 EDCE CCC(=O)Nc1nc(N2CCN(c3ccc(OC)cc3)CC2)nn1C 1869969838 UTHCOJFAIIMGHU-UHFFFAOYSA-N 344.419 1.499 10 10 EDCE CC(C)C[C@@]1(C(=O)O)N[C@@H](c2ccccc2O)[C@H]2C(=O)N(C)C(=O)[C@@H]21 19858350 FWXFFGWGMHQQTN-MOROJQBDSA-N 346.383 1.137 10 10 EDCE Nc1cccc(Br)c1N[C@H]1CCNCC[C@@H]1C(=O)O 1876304238 KZZKYYAFDHHCAX-KWQFWETISA-N 328.210 1.896 10 10 EDCE Oc1ccccc1CN=c1[nH]ccnc1I 1982378794 AQALUXYRKFSGDG-UHFFFAOYSA-N 327.125 1.821 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985102202 CWEGMUIPQJBVIW-NXEZZACHSA-N 327.385 1.467 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010393517 TVIYHSYECQLZRS-GRYCIOLGSA-N 339.396 1.780 10 10 EDCE CO[C@]1(C(=O)O)CCN(Cc2c(O)cccc2Br)C1 706627936 HCYOZKSQSRLWTE-CYBMUJFWSA-N 330.178 1.830 10 10 EDCE CN1CC[C@@H](N(C)c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 380692165 FLYCFVITKGDNSF-OQPBUACISA-N 339.237 1.541 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@@H]2O 2174411404 DJPSSSOQCIFMJE-IPHMSRQVSA-N 342.233 1.622 10 10 EDCE COc1ccc(Br)c(CN2CCN(C(C)=O)CC2)c1O 1231549462 AQGQKEPDZBWYMY-UHFFFAOYSA-N 343.221 1.827 10 10 EDCE CNCc1ccc(N2CCN(C[C@@H](C)O)CC2)c(Br)c1 2170219012 RGNJRBKJIKFOIV-GFCCVEGCSA-N 342.281 1.671 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2CN3C(N)=O)cc1Br 2192279376 PITKGXRZTHNNNT-LSJOCFKGSA-N 340.221 1.844 10 10 EDCE CCC[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1COc1nnc(=N)[nH]n1 2213779853 YCXRYHZROCFPRV-GHMZBOCLSA-N 338.412 1.341 10 10 EDCE COc1ccc(Br)c(CN[C@H](C)c2nn[nH]n2)c1O 2208786065 HGMHSJHJDMZHCB-ZCFIWIBFSA-N 328.170 1.527 10 10 EDCE CSc1ncc(CNC(=O)[C@H]2CNC[C@H]2C(F)(F)F)s1 2284638145 FTYMNIUGTOXDTQ-JGVFFNPUSA-N 325.381 1.879 10 10 EDCE O=C(O)[C@@]12CCO[C@@H]1CN(Cc1ccc(Br)cc1O)C2 2296424746 IRDLFTWAJVRLTK-TZMCWYRMSA-N 342.189 1.830 10 10 EDCE CNC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)C(C)C 178706785 IKFNLSUURYRGQD-MRXNPFEDSA-N 328.416 1.990 10 10 EDCE CN(C)c1ccc(CNC(=O)CNc2ccc(C(N)=O)cc2)cc1F 172703290 DBCWBXRFEHOKTB-UHFFFAOYSA-N 344.390 1.719 10 10 EDCE CN(CCn1cc(Br)cn1)C(=O)c1ccc(O)c(O)c1 2361506917 SWEVBKDNWNUPHO-UHFFFAOYSA-N 340.177 1.829 10 10 EDCE Cc1ccc(/C=C2\C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)cc1 96459582 RHPMLZGTJACOTA-QMWDNBGHSA-N 348.409 1.616 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)/C=C\c1ccnn1C 255376112 ZLMQXUJESQEXJQ-FPLPWBNLSA-N 340.427 1.929 10 10 EDCE Cc1cc(O)c(CN2CCN(C(=O)N3CCNCC3)CC2)cc1C 530243596 TVFUXGZBOGNPSX-UHFFFAOYSA-N 332.448 1.152 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN(CCO)C[C@@H]2C)c1 825337201 DUADVXVGPMQCQW-LBPRGKRZSA-N 343.265 1.962 10 10 EDCE CCO[C@@H](CNC(=O)NCc1cc(OC)ccc1O)CN(C)C 918745854 SKKFFOXPPGZWQW-AWEZNQCLSA-N 325.409 1.167 10 10 EDCE CCOc1cccc(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1O 843426533 YSOZQVJSPCFKEG-INIZCTEOSA-N 341.429 1.180 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)c(Br)c1 1893331924 NMWMJINUJYEULT-BIGNPOOSSA-N 330.222 1.824 10 10 EDCE COC[C@H]1CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 849416397 QSZANZPCXKVIHA-GJZGRUSLSA-N 333.432 1.952 10 10 EDCE CSC[C@@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1893865467 YCJGJGRUBZDEJB-GMTAPVOTSA-N 330.450 1.508 10 10 EDCE C[C@H]1CC[C@H](NC(=O)NCc2c(O)cccc2F)CS1(=O)=O 923270357 RKZAPSQEWWDPTF-UWVGGRQHSA-N 330.381 1.296 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCC[S@@](=O)CC(F)(F)F 855275807 LTOXDZINMBDPAM-YYMZATOTSA-N 337.319 1.538 10 10 EDCE Cc1cc(C)c([C@@H](C)NC2CN(S(=O)(=O)N(C)C)C2)c(O)c1 858572262 RIAQCQYHIXQTPE-GFCCVEGCSA-N 327.450 1.150 10 10 EDCE O=S(=O)(C[C@@H]1CCCCO1)NNc1nc2cccnc2s1 857225016 DDIQKJROVNPGSL-VIFPVBQESA-N 328.419 1.507 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCc3cnn(C)n3)C2)cc1 855225035 NJGMJTIUYGJCKK-AWEZNQCLSA-N 329.404 1.151 10 10 EDCE C[C@@]12CN(Cc3cc(O)n4ncc(C(=O)O)c4n3)C[C@@H]1[C@@H]1C=C[C@H]2C1 851709479 ZKTLCOIRHYMIJB-GRINDBAHSA-N 340.383 1.777 10 10 EDCE COC(=O)c1nccc(N2CCN(c3ccc(OC)cc3)CC2)n1 853085125 GUBIKEADZMMNNG-UHFFFAOYSA-N 328.372 1.598 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3nc4ncccn4n3)C2)cc1 855224479 KULJJUYLWBGMKR-GFCCVEGCSA-N 338.371 1.142 10 10 EDCE CN(C)c1ccc(CNC(=O)CN[C@@H]2C[C@H]3C[C@H]2[C@H](CO)C3)cc1 934143600 QUADRADNJKDGOP-MXSMSXNCSA-N 331.460 1.365 10 10 EDCE Cc1cnn(C)c1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 850345278 REBRZIWOFSQPQU-UHFFFAOYSA-N 329.404 1.392 10 10 EDCE COC(=O)[C@@]1(OC)CCN(Cc2c(O)cccc2Br)C1 862475245 DZSIYPMHJRMPES-CQSZACIVSA-N 344.205 1.919 10 10 EDCE C/C=C/CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 863120873 UQDYLVJGHTVWOA-YKNGABIKSA-N 343.427 1.592 10 10 EDCE CN1CCN(c2cc(C(=O)NCc3ccccc3O)ccn2)CC1 769362818 KIZQOKPNPWAKJD-UHFFFAOYSA-N 326.400 1.469 10 10 EDCE CO[C@](C)(CO)CNCc1ccc(N2CCN(C)CC2)c(F)c1 1118387245 OJSKKHMDMVEFPJ-KRWDZBQOSA-N 325.428 1.065 10 10 EDCE O=C(CC[C@H]1CC[C@H](C2OCCO2)O1)N1Cc2cccc(O)c2C1 899173120 JTJRPQGGSUTGBF-CZUORRHYSA-N 333.384 1.935 10 10 EDCE COC(=O)c1cc(S(=O)(=O)Nc2ccc(O)c(OC)c2)c(C)o1 797820113 HFLBMJXECAKDKK-UHFFFAOYSA-N 341.341 1.890 10 10 EDCE CC(C)c1nc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n[nH]1 1328575428 JLJQGLSSRMDOGK-UHFFFAOYSA-N 339.377 1.258 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC(c3nnnn3C)CC2)c1O 1262019755 BYLFJZYMIKYQRJ-UHFFFAOYSA-N 333.367 1.637 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@@H](CO)[C@@H](CCO)C1 1348569805 FUDXZTWZIOOFAE-IRXDYDNUSA-N 345.443 1.195 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H](O)COc1ccc(F)cc1 1445779130 GYVKPIHZEURJHN-CYBMUJFWSA-N 335.331 1.336 10 10 EDCE CCOC(=O)[C@H](F)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1450261045 VLQVPXWTZKWVFG-GFCCVEGCSA-N 336.323 1.822 10 10 EDCE CC1CC(CNC[C@H](O)CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1482802165 QDYOVGKRQFGZPE-QOZQQMKHSA-N 347.419 1.575 10 10 EDCE CC1(C)OC[C@H](/C=C/C(=O)NCc2ccc(N3CCOCC3)cc2)O1 1626698965 SPPKDKPZSWETDJ-OZSKJFCKSA-N 346.427 1.847 10 10 EDCE COc1nscc1CN(C)CC(=O)NCc1ccc(N(C)C)cc1 1560173962 RVZVPNAQPUKOPV-UHFFFAOYSA-N 348.472 1.966 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3ncc[nH]3)cc2)CC1 1634974331 OWNATFPXMDIJHR-UHFFFAOYSA-N 327.388 1.041 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cnc(O)n2C)cc1C 1568898433 MESYBSMAMDHDFX-PLNGDYQASA-N 344.415 1.519 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cc2n[nH]c(C)n2)cc1C 1567491553 FFHUGKITKPJHGH-UHFFFAOYSA-N 331.420 1.221 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)C[C@@H]2CCC(=O)N2)cc1C 1732913158 VSPNESBOYSTFIZ-QGZUEGPWSA-N 345.443 1.434 10 10 EDCE CC[C@@H]1C(=O)NCCN1c1ccc(CNC)c(Br)c1 234127523 HDYWSWIZXGBLIZ-CYBMUJFWSA-N 326.238 1.883 10 10 EDCE NC(=O)N1C[C@@H]2C[C@H]1CN2Cc1c(O)cccc1Br 1877016454 MFQAWOZJACEZNA-IUCAKERBSA-N 326.194 1.492 10 10 EDCE NC1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CCN(Cc2ccccc2)CC1 2003167966 QGISPVUITKJXPJ-WKILWMFISA-N 329.444 1.246 10 10 EDCE CC1(O)CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)CC1 160498353 QUCVXCWULTXLNG-GFCCVEGCSA-N 340.221 1.752 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1C(=O)NCc1ccccc1O 2010044321 CRHKVCLERODXJJ-TZMCWYRMSA-N 336.388 1.691 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@]1(CO)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010389929 WEXAKWNJBNVAKR-XHDPSFHLSA-N 339.396 1.660 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010405205 XONIKSJIUWWPSP-CMPLNLGQSA-N 341.412 1.809 10 10 EDCE COc1ccc([C@H](C)NC[C@@H](CO)NC(=O)OC(C)(C)C)c(O)c1 2011516529 IYWSKLFPETXPDC-RYUDHWBXSA-N 340.420 1.937 10 10 EDCE CCN(CCNC(=O)c1cc(O)c(O)c(O)c1)C(=O)OC(C)(C)C 2015121498 DITQLVWYERYBOQ-UHFFFAOYSA-N 340.376 1.790 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)NCc2ccc(N)cc2)C1 2022906356 YSHFAGVAZILWSS-UHFFFAOYSA-N 335.404 1.303 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)C(C)(C)CCO 688356275 VRPCQQWZHPDMJW-LBPRGKRZSA-N 342.237 1.998 10 10 EDCE COc1ccc([C@@H](C)n2nc(C3(C)CC3)c(C(N)=O)c2N)c(O)c1 2080042356 HCAGYMJGIMLCSE-SECBINFHSA-N 330.388 1.939 10 10 EDCE Nc1ccc(CCC(=O)NCCn2ncc(Br)n2)cc1 2179693514 WDXNGMXYTPESJO-UHFFFAOYSA-N 338.209 1.372 10 10 EDCE O=S1(=O)C[C@@H]2[C@H](NCc3c(O)cccc3Br)[C@@H]2C1 2054267855 PGJMBELZYXBIPH-BZBKMWRSSA-N 332.219 1.287 10 10 EDCE CC(C)(C)OC(=O)N1CCN(Cc2cc(N)ccc2O)[C@@H]2COC[C@H]21 2068826772 OTAOLUBKUZBGCN-HUUCEWRRSA-N 349.431 1.795 10 10 EDCE COc1cc(Br)ccc1[C@@H](NCCN=[N+]=[N-])C(N)=O 2109266559 IRWFMJWUPLWRIX-SNVBAGLBSA-N 328.170 1.884 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2205614830 SGKFDEFGWYDMJV-RDBSUJKOSA-N 347.228 1.439 10 10 EDCE COc1ccc(Br)c(CN2CC(CO)(C(=O)O)C2)c1O 2236036647 FLWOWJOUWKRGSM-UHFFFAOYSA-N 346.177 1.042 10 10 EDCE CC1(CCNC(=O)C=Cc2ccc(N3CCOCC3)cc2)OCCO1 2308822003 RSEPFUFHBXLINP-UHFFFAOYSA-N 346.427 1.806 10 10 EDCE C[C@H](O)[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(O)cc2)SC1=S 2323823725 IDDYOOIRZARJAI-WRWORJQWSA-N 339.394 1.427 10 10 EDCE Cc1ccc(CNC(=O)CSCCN)c(O)c1Br 2327798677 KSMQINGSFNHVHV-UHFFFAOYSA-N 333.251 1.771 10 10 EDCE CN/C=C1\C(=O)NC(=O)N(c2ccc(Br)c(C)c2)C1=O 108741786 ZUKWPSLHTZNAJQ-RMKNXTFCSA-N 338.161 1.444 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)N[C@H]3C[C@@H]3C)CC2)cc1 170806283 HEYGEZGQIHGOAX-YJBOKZPZSA-N 346.475 1.915 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H]3[C@@H]4CO)c(Br)cc2[C@H]1O 2358061752 VKVFVBGIRNGYLT-MHBMLLMWSA-N 339.189 1.252 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)CC(C)(C)S(C)(=O)=O 121314477 ZEYHQTOURCLUKD-UHFFFAOYSA-N 340.489 1.778 10 10 EDCE Cc1ccc(/C=C\C(=O)NCc2ccc(N3CCNC(=O)C3)cc2)o1 222085255 CUELWJCKJBWRKQ-HJWRWDBZSA-N 339.395 1.854 10 10 EDCE CC(=O)O[C@@H]1[C@@H](N=[N+]=[N-])C[C@@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@@H]1OC(C)=O 256171837 SQKWPVVWVBKSIG-ROHXPCBUSA-N 340.296 1.543 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccn([C@H]2CCCNC2)n1 262855934 VUSISWGUEFXXMG-ZDUSSCGKSA-N 330.388 1.191 10 10 EDCE Cc1ccc(CN(C)C(=O)CN2CC(N)C2)c(O)c1Br 2380765540 NJJKSJZSSCJYHY-UHFFFAOYSA-N 342.237 1.064 10 10 EDCE Cc1ccc(CN2C[C@@H](C(=O)O)C[C@@H](O)C2)c(O)c1Br 2380812241 SVNBAQDREWYVGD-WDEREUQCSA-N 344.205 1.731 10 10 EDCE Cc1ccc(CN2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(O)c1Br 2381140488 LBNQUONOGCUAFL-YZENIEGJSA-N 342.233 1.779 10 10 EDCE CC(=O)C(=O)COC(=O)c1csc(-c2ccc3c(c2)OCO3)n1 808512371 IZSZHKSJCBGHMF-UHFFFAOYSA-N 333.321 1.854 10 10 EDCE O=C(O)CN1CCC[C@H](NCc2cc(Br)ccc2O)C1 2169312922 KLGMGAPOTCOMTN-LBPRGKRZSA-N 343.221 1.793 10 10 EDCE C[C@H](NC(=O)[C@@H]1CCNC(=O)CC1)c1ccc(N2CCOCC2)cc1 815114223 KUUFSAMPYFKVLH-HOCLYGCPSA-N 345.443 1.617 10 10 EDCE CN1CCCc2cc(/C=C3\SC(=S)N(CC(N)=O)C3=O)ccc21 727176271 OJSWCKKCFPMNFR-JYRVWZFOSA-N 347.465 1.756 10 10 EDCE Cc1ccc([C@@H](C)NCCS(=O)(=O)N=S(C)(C)=O)c(O)c1 903227476 RSCXXZQTOIECER-LLVKDONJSA-N 334.463 1.409 10 10 EDCE COc1ccc(N2CC[C@@H](CN3C(=O)N[C@H](CCF)C3=O)C2)cc1 844725277 KFNDVXKDQYBZCX-IUODEOHRSA-N 335.379 1.802 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCC2(CO)CCC2)c1 846566632 LMARPSKUSNDUOO-UHFFFAOYSA-N 342.417 1.046 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CNCCC3(F)F)C2)cc1 851639118 BHYFMKBPNIJLTB-IUODEOHRSA-N 339.386 1.635 10 10 EDCE COC[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)C(C)C 929238087 VSRYVTGEJMMKLU-HNNXBMFYSA-N 335.448 1.404 10 10 EDCE COCc1nc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)co1 775771999 IBKYFFYHAMYGCE-UHFFFAOYSA-N 345.399 1.930 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1CN([C@H]2CCOC2)C1 895526893 TXPBBSSNTMQUJR-SFHVURJKSA-N 331.460 1.822 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC2CCC3(CC2)COC3)cc1 897361477 IWAJYNXWUDINGN-UHFFFAOYSA-N 345.443 1.444 10 10 EDCE Cc1ccnc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 792187384 DZMBEIURQWDKFZ-UHFFFAOYSA-N 340.427 1.924 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CN(C3CC3)C(=O)O2)cc1 1143420905 VBYHLNJLGXPJER-LBPRGKRZSA-N 331.332 1.562 10 10 EDCE CS(=O)(=O)CS(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 213423649 YBSZBTAYPXNTIV-UHFFFAOYSA-N 334.202 1.443 10 10 EDCE O=C(C(=O)N1CCC[C@H]1[C@H]1CCCOC1)N1Cc2cccc(O)c2C1 1329866064 OTVZPJRTKMMNNQ-HOCLYGCPSA-N 344.411 1.652 10 10 EDCE O=C(C(=O)N1CCC[C@@H]1c1ccccn1)N1Cc2cccc(O)c2C1 1331998629 BJKPHZVKDNCNPN-MRXNPFEDSA-N 337.379 1.993 10 10 EDCE COCC1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 1916847973 NYASKZCEWQHGCU-GFCCVEGCSA-N 327.178 1.517 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NCC2(C)CCC2)cc1 1261536356 OGJSGTBVIMZEOI-UHFFFAOYSA-N 347.459 1.896 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2nc(CO)[nH]c2c1 1466791012 ONHFKLHJNIDRDR-SNVBAGLBSA-N 341.367 1.827 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3NC(=O)O[C@@H]3C2)c(Br)c1 2120416771 QHVCXUDHCYGXNG-NYRNMGCKSA-N 327.178 1.799 10 10 EDCE Cc1ccc2c(c1)c(C)c(C(=O)N(C)C[C@@H]1COC[C@H](O)[C@@H]1O)n2C 1615149422 QPGUFCPQZNQIJQ-RPVQJOFSSA-N 346.427 1.235 10 10 EDCE COC(=O)[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)[C@@H]1CCOC1 1472399015 GMSLWJWRORUKSZ-DGCLKSJQSA-N 348.359 1.405 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1cc[n+]([O-])cc1 1715718225 RPNYIFMPRRKHKS-UHFFFAOYSA-N 343.427 1.889 10 10 EDCE CC[C@@H](CNC(=O)Cc1nnc(C)o1)NCc1ccc(OC)c(C)c1 1715059556 WYYNNTJCFXMSSZ-HNNXBMFYSA-N 346.431 1.922 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)C(C)(C)C(N)=O)C2)cc1C 1480143976 RXMONLCLMPJZDP-HDJSIYSDSA-N 333.432 1.252 10 10 EDCE CCN1CCOC[C@H]1C(=O)NC[C@@H](C)NCc1ccc(OC)c(C)c1 1714248755 KPQZRZMUOOEHEM-WBVHZDCISA-N 349.475 1.319 10 10 EDCE CN1CCC2(CCN(C(=O)c3ccc(N=NC(N)=O)cc3)CC2)C1=O 1639624533 YZTHPDGUZFTSAA-UHFFFAOYSA-N 343.387 1.934 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc(-c2cnccn2)no1 1633818303 HHLOMKUWBFYWQQ-VIFPVBQESA-N 341.327 1.299 10 10 EDCE CCN[C@H](C)c1ccc(N2CC(CO)(CO)C2)c(Br)c1 1914979097 UKHWYQUYZUODAU-LLVKDONJSA-N 343.265 1.911 10 10 EDCE CN(C)[C@@H]1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 221247373 VCIIWGMVHFXVQD-AMIZOPFISA-N 339.237 1.541 10 10 EDCE C[C@H](N)[C@H](O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952207700 FFDLYCBGXJYHGW-CHIMOYNISA-N 326.393 1.242 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)N1CCC(N=[N+]=[N-])CC1 1987702668 VILUGSYWNUOVTQ-SNVBAGLBSA-N 327.385 1.421 10 10 EDCE CCCNCc1ccc(N2CC[C@@](O)(CO)C2)c(Br)c1 313684076 QZWKLAGFGHGMOV-HNNXBMFYSA-N 343.265 1.882 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2160717524 SPKAAABURTUJKT-RMROANFSSA-N 341.249 1.660 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](CO)C2)cc1Br 316445477 RPVCKBRZGCELBD-HFAKWTLXSA-N 343.265 1.909 10 10 EDCE C[C@@H](O)CN1CCCN(c2ccc(CO)c(Br)c2)CC1 2176853558 JAERHGKPKSSAGG-GFCCVEGCSA-N 343.265 1.834 10 10 EDCE C[C@@H](CO)CN(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 688701408 VRQNAXBIFNJAHE-KRTXAFLBSA-N 329.194 1.499 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCC=C[C@@H]3CO)c(Br)cc21 2182332296 ODTPDROURCNVTG-AMIZOPFISA-N 338.205 1.528 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(NC(=O)CCc2ccc(N)cc2)C1 2044233991 YMVJRKDOKLQUNX-UHFFFAOYSA-N 349.431 1.299 10 10 EDCE CN(C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N)cc1 2076781040 IZHWAHPBGZLZBH-UHFFFAOYSA-N 349.431 1.994 10 10 EDCE CC(C)(C)C[C@@H](CNC(=O)OC(C)(C)C)COc1nnc(=N)[nH]n1 2213790004 OUGFNZHTRPVXCA-JTQLQIEISA-N 340.428 1.635 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(NC(=O)Cc2ccc(N)cc2)C1 2216758668 XJDFCOMDRDBJQD-FZKQIMNGSA-N 331.416 1.937 10 10 EDCE COc1ccc(Br)c(CNCCOC(=O)N(C)C)c1O 2236055256 OWSVOWJJDFBCNK-UHFFFAOYSA-N 347.209 1.951 10 10 EDCE CNC(=O)[C@H](C)N(C)Cc1c(Br)ccc(OC)c1O 2227780266 QNXKGAXNNFRAMA-QMMMGPOBSA-N 331.210 1.730 10 10 EDCE COc1ccc(NC=C2C(=O)NC(=O)N(C[C@H]3CCCO3)C2=O)cc1 2297317926 KRFQNBVPPAIKLX-CYBMUJFWSA-N 345.355 1.248 10 10 EDCE O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2CCNCCO 6117825 LRHPCRBOMKRVOA-UHFFFAOYSA-N 334.375 1.795 10 10 EDCE CCCNC(=O)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 41428785 RQECPURJQVOGOG-UHFFFAOYSA-N 334.420 1.053 10 10 EDCE COC(=O)c1cc(C(=O)N2CCOc3cc(N(C)C)ccc32)no1 343735941 GWESSOWZFGIZSN-UHFFFAOYSA-N 331.328 1.566 10 10 EDCE CNC(=O)[C@@H](C)CN(C)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 255710171 HHQFZLMLFZSRPC-JYKYSHPRSA-N 335.360 1.599 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(CNC(=O)C2CCCC2)cc1 808514199 VQDOADXZIUNTAN-UHFFFAOYSA-N 331.368 1.808 10 10 EDCE CC(=O)C(=O)COC(=O)c1nnn(Cc2ccc(F)cc2F)c1C 808540512 DBBPTEPHCOJMNE-UHFFFAOYSA-N 337.282 1.228 10 10 EDCE COc1cc(Cl)cc(CN(C)[C@@H]2CCN3CCO[C@H]2C3)c1O 295030363 DCQCXRUWZZDTKP-HIFRSBDPSA-N 326.824 1.959 10 10 EDCE COc1ccc(N2CCCN(C(=O)NCc3cnn(C)n3)CC2)cc1 805994140 LORQVXMMNILBPP-UHFFFAOYSA-N 344.419 1.246 10 10 EDCE C[C@H]1Cc2ccccc2N(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)C1 729424212 OASHIMUBPNHGEI-XEHSLEBBSA-N 339.395 1.323 10 10 EDCE COC(=O)[C@]12C[C@H](N)C[C@H]1CN(Cc1cc(Cl)cc(F)c1O)C2 903977581 VPOQSPVKXYRTLJ-IETSOEAISA-N 342.798 1.897 10 10 EDCE CN1CCCc2cc(CNC(=O)c3c(C(=O)O)cnn3C)ccc21 901754363 MAEMSFFJTFSHIN-UHFFFAOYSA-N 328.372 1.431 10 10 EDCE O=C(NCc1ccccc1O)[C@H](C[C@H]1COCCO1)C(F)(F)F 830527355 ZMGVVRQCSQDIIR-RYUDHWBXSA-N 333.306 1.992 10 10 EDCE COC(=O)[C@@H]1CSCCN(Cc2cc3c(cc2O)OCO3)C1 840185503 FWEOIFODHDNRJC-NSHDSACASA-N 325.386 1.459 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCC[C@@H](C(=O)NCCN)C2)cc1 843048090 MNFWZCQXBBWWSR-NJELEJDNSA-N 330.476 1.553 10 10 EDCE CC[C@H](CS(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)OC 849416478 AQMLIHZLAGLFIB-UKRRQHHQSA-N 342.461 1.618 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCNC[C@H]1C 842264915 FMMJPORTWZGIDJ-ZBFHGGJFSA-N 347.459 1.635 10 10 EDCE COc1ccc(N2CCN(CCCN[C@H]3CN(C)C[C@@H]3C)CC2)cc1 756103296 BHRDLRHOYWPAPT-PXNSSMCTSA-N 346.519 1.747 10 10 EDCE CNC(=O)CCOC1CCN(Cc2cc3c(cc2O)CCC3)CC1 751951893 OAKJHXJZPVICRS-UHFFFAOYSA-N 332.444 1.998 10 10 EDCE O=C(O)c1ccc(NS(=O)(=O)c2cc(F)cc(F)c2O)cc1O 753018139 SYOCLCUNUXZQJH-UHFFFAOYSA-N 345.279 1.875 10 10 EDCE CCS(=O)(=O)N1CCC(C(=O)NCc2c(O)cccc2F)CC1 928711002 ZBFHJIIBJSFOKO-UHFFFAOYSA-N 344.408 1.209 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC2(COC2)C1 853474689 LNTZIGNXTMFAIY-UHFFFAOYSA-N 331.416 1.455 10 10 EDCE COC(=O)[C@H](C)NC(=O)[C@H](C)NC/C=C/c1ccc(N(C)C)cc1 865684781 JRWCOFGYONCMKQ-AGKLADILSA-N 333.432 1.422 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc(O)cs2)[C@H](O)C1 871181304 PANOLDXOFCSCGL-GHMZBOCLSA-N 342.417 1.554 10 10 EDCE O=C(c1ccccc1)N1CC(S(=O)(=O)NCc2ccccc2O)C1 779628832 YBKYFLXOPMSWNR-UHFFFAOYSA-N 346.408 1.336 10 10 EDCE Cn1cc([C@@H]2C[S@](=O)CCN2Cc2ccc(F)c(F)c2O)cn1 895379603 MSYKAIWVMROEBF-ZAMGYDSWSA-N 341.383 1.710 10 10 EDCE CCN(Cc1cn(C)nn1)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 781684370 OOXIUGAJTITJLB-VURMDHGXSA-N 345.359 1.936 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CC[C@H](C(N)=O)C3)CC2)cc1F 896898354 IMVXQIWAZIVXIZ-QWHCGFSZSA-N 349.406 1.385 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ocnc2C)cc1C 1320202148 NEESEMFNVURHDE-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@@H]4CN(C)C[C@H]43)cc2F)CC1 1324821601 DNKWDDVTYZZMDA-VQIMIIECSA-N 332.467 1.713 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)NC[C@@H]3C[C@H]3C)CC2)cc1F 1321886464 VFGUOSWZNASCEH-OLZOCXBDSA-N 349.406 1.255 10 10 EDCE N[C@]1(C(=O)NCc2ccccc2O)CCN(Cc2ccccc2)C1 693874447 ZRZGOQKZYFHAJL-LJQANCHMSA-N 325.412 1.612 10 10 EDCE COC(=O)CN(C)CCNC(=O)c1cc2cc(O)c(O)cc2s1 1334429998 WXADNRONUPEUNW-UHFFFAOYSA-N 338.385 1.147 10 10 EDCE CCOCCN1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1267735242 PWEIISDOWVAGFD-AWEZNQCLSA-N 333.392 1.690 10 10 EDCE CO[C@@H](C)C(=O)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1294707482 GSPIZRPTAXJIEZ-GWCFXTLKSA-N 347.375 1.215 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CC[C@H](C(F)(F)F)[C@H](CO)C1 1472559597 HKRGTFFJZUWPLV-YUMQZZPRSA-N 337.269 1.870 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)cc1 1626346405 VPGNNTZGYSERPC-GJZGRUSLSA-N 345.403 1.520 10 10 EDCE CCCCC(=O)N(C)C[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1487710283 FYYTUBXLGOMDSC-LBPRGKRZSA-N 337.420 1.866 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CN2CCCNC2=O)cc1C 1480494408 YVMIOGXDXZFZOF-AWEZNQCLSA-N 348.447 1.013 10 10 EDCE COc1cc(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)on1 1714228283 HZFWVYXQXRSINP-LBPRGKRZSA-N 333.388 1.908 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1cnn(C)c1 1568723462 MEPKCEQVUAJASL-UHFFFAOYSA-N 330.432 1.989 10 10 EDCE O=C(CNC(=O)c1cc(F)cc(F)c1)NCc1cccc(O)c1O 1633515738 NTHDSLWHKUGWDW-UHFFFAOYSA-N 336.294 1.422 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)Cc2cnn(C)c2)cc1C 1568259011 FDMJUJLAQIJFSW-HNNXBMFYSA-N 344.459 1.916 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cccc(-n3cncn3)n2)c1 1566374301 CGOSLWLWSMTDLB-LLVKDONJSA-N 339.355 1.868 10 10 EDCE Cc1cccc([C@@H]2C(=O)NCCN2C(=O)c2cccc(O)c2O)c1 1633766875 MBXYLLKKVUVTKW-OAHLLOKOSA-N 326.352 1.720 10 10 EDCE CC(C)(O)[C@@H](Oc1ccccc1)C(=O)NCc1cc(O)ccc1O 1644754043 OVWUXLUGYMEPLN-INIZCTEOSA-N 331.368 1.933 10 10 EDCE Cc1nc[nH]c1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1597001024 CXLMXIXTLNBZKU-CQSZACIVSA-N 341.415 1.350 10 10 EDCE CN1CCN(Cc2cc(CN(C)C[C@@H]3CCN(C)C3)ccc2O)CC1 19590059 BNQFXPIHLHDQDD-GOSISDBHSA-N 346.519 1.523 10 10 EDCE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@H]3C[C@@H](O)CN3)cccc21 1866040634 SWSHWCUIASIVJC-MEBBXXQBSA-N 336.347 1.123 10 10 EDCE Nc1ccc(OCCCN2CCC(NC(=O)[C@@H]3CCCO3)CC2)cc1 586044599 HKEYWQGYKUVRHR-SFHVURJKSA-N 347.459 1.797 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C[C@H]1CCCO1)C(=O)N1CC(N=[N+]=[N-])C1 2010406769 YTGQUBZWNMHJTR-VXGBXAGGSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(F)cc2O)[C@@H](O)C1 2024899387 ZWUAHDDYMLYSRH-ZFWWWQNUSA-N 340.395 1.991 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 1908252747 DXGPYQDXKYVLGB-RYUDHWBXSA-N 339.396 1.658 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2199528278 YFKFCLWSRRRWMZ-RELHGNMBSA-N 341.249 1.789 10 10 EDCE CS(=O)(=O)C[C@H]1CCN(c2ccc(CO)cc2Br)C1 2087364477 LATZYTJUZZDBCS-NSHDSACASA-N 348.262 1.812 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2C[C@H](O)C[C@H]2O)c1O 2227748444 AJNOJWXDUWJFJE-WHGOUJPWSA-N 332.194 1.137 10 10 EDCE CCCN=c1[nH]nc(C(=O)NCc2cnc(SC)s2)s1 2284708846 CEHHOHOHHCJCPE-UHFFFAOYSA-N 329.476 1.890 10 10 EDCE NCc1cc(F)c(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)cc1Br 2336551610 ANQGACYVPZEIQE-QPUJVOFHSA-N 349.225 1.280 10 10 EDCE COc1cc([C@H](NCCN=[N+]=[N-])C(=O)O)c(Br)cn1 2336990236 GBVFZOKKFPJKJW-VIFPVBQESA-N 330.142 1.878 10 10 EDCE COC1CN(CCNCc2ccc(C)c(Br)c2O)C1 2352682547 ZCGQUWWCEZRNNP-UHFFFAOYSA-N 329.238 1.883 10 10 EDCE Cc1ccc(CN2CC[C@H](N)[C@@H](CO)C2)c(O)c1Br 2352945126 REDTXRHTVOIEJR-NEPJUHHUSA-N 329.238 1.605 10 10 EDCE COCCn1nc(Br)nc1[C@@H](N)c1ccccc1O 2353783696 LEHJPPKNDREGTB-JTQLQIEISA-N 327.182 1.441 10 10 EDCE CN(CC(=O)NC(C)(C)C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 7243775 XIDRRBPNVDJYHN-UHFFFAOYSA-N 348.491 1.558 10 10 EDCE CCN(C)CCNC(=O)NC1CCN(c2ccc(OC)cc2)CC1 102562671 GGDZUFOTMRAOID-UHFFFAOYSA-N 334.464 1.915 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CCN(c3ccccc3)C2=O)c(O)c1O 179489890 GVTOORYSKWZIGB-CQSZACIVSA-N 326.352 1.942 10 10 EDCE COc1ccc(N2CCN(Cn3nc(CO)n(C)c3=S)CC2)cc1 120337596 UPPYGSWKMGGKDT-UHFFFAOYSA-N 349.460 1.232 10 10 EDCE C[C@@H](NCCCn1ccnn1)c1ccc(N2CCC(O)CC2)cc1 184269411 QSUAFGNZAONAMI-OAHLLOKOSA-N 329.448 1.980 10 10 EDCE CN(C)CCCNC(=O)CN(Cc1ccccc1O)C[C@H]1CCCO1 193425967 LZLDHNDJKGRSPH-QGZVFWFLSA-N 349.475 1.441 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCN3CCOC[C@@H]3C2)cc1 368293999 MXPPBFFLBYGZJW-SFHVURJKSA-N 346.475 1.759 10 10 EDCE Cc1ccc(CN2CC[C@@](O)(CN(C)C)C2)c(O)c1Br 2381135019 LDEWIWHKDKFUEL-OAHLLOKOSA-N 343.265 1.962 10 10 EDCE CCN1CCN(CC(=O)NCc2cc(Cl)cc(Cl)c2O)CC1 807838231 LNDZFXBNAZPGCZ-UHFFFAOYSA-N 346.258 1.953 10 10 EDCE COc1cc(Cl)cc(CN2CCN(S(C)(=O)=O)[C@H](C)C2)c1O 827271617 SONOSNMZNMDFBH-SNVBAGLBSA-N 348.852 1.520 10 10 EDCE CN(C1CC1)S(=O)(=O)NCc1ccc(N2CCOCC2)c(F)c1 736329078 CXPUQGBMAYTRHU-UHFFFAOYSA-N 343.424 1.091 10 10 EDCE COc1c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1C 839549722 MFJGTXWSRHIOPL-UHFFFAOYSA-N 348.378 1.334 10 10 EDCE CC[C@H](NC/C=C/c1ccc(N(C)C)cc1)C(=O)N1CCOCC1 835044406 ZREYEVAOYIYVIO-QWNKOJSDSA-N 331.460 1.993 10 10 EDCE CC(=O)N1CCN(CCNCc2c(O)cc(C)cc2Cl)CC1 840876929 UERNIPFCHDUXRU-UHFFFAOYSA-N 325.840 1.608 10 10 EDCE Cn1nccc1[C@H]1COCCN1C(=O)/C=C\c1ccc(O)c(O)c1 846611724 KCCZAGUZKNVTKK-PKXJPQMGSA-N 329.356 1.445 10 10 EDCE CC1=C(C(=O)NCc2c(O)cccc2F)[C@@H](C)n2ncnc2N1C 928707197 BYRKPRSJSOSSBK-SNVBAGLBSA-N 331.351 1.724 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnn4cccnc34)C2)cc1 855230844 FHCBUJZBXBWHNX-ZDUSSCGKSA-N 337.383 1.747 10 10 EDCE Cn1nccc1CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851948317 ALDZSTZNNGEMSW-UHFFFAOYSA-N 343.431 1.381 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)[C@H]3CCN(C)C3=O)C2)cc1 854296389 CDDWZQNADFMFDZ-BBRMVZONSA-N 346.431 1.146 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3C[C@H](O)C34CCC4)C2)cc1 854297159 NTHSFVKMVZYOQX-XKQJLSEDSA-N 345.443 1.877 10 10 EDCE CO[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCOC1 856208208 AJGPYJFXOYQLHD-CRAIPNDOSA-N 348.443 1.315 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@H](C(F)(F)F)C3)cc2N1 761907954 RHNKJLXIJLLVRV-NSHDSACASA-N 347.249 1.693 10 10 EDCE C[C@H](NC(=O)[C@H](O)c1cnc[nH]1)c1ccc(N2CCOCC2)cc1 865019178 NNYDFKWYLZEUFK-BLLLJJGKSA-N 330.388 1.157 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CCNC12CCC2 861564043 DWIBPRNUYMMLQV-KRWDZBQOSA-N 344.459 1.607 10 10 EDCE C[C@H]1CC[C@@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CN1 861685313 NKAOUNVJJHPZKQ-DOTOQJQBSA-N 346.475 1.805 10 10 EDCE O=C(NC1CCCCC1)N1CCN(C(=O)c2cccc(O)c2O)CC1 776627859 LXZGZKVNJZMNNF-UHFFFAOYSA-N 347.415 1.898 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN(CCO)CC2)c1 781901445 SULJCLRYQIDPRD-UHFFFAOYSA-N 329.238 1.573 10 10 EDCE COC(=O)c1c(CNCC(=O)NC(C)C)c2cc(F)ccc2n1C 894139077 AQFDBGMPSOCRNP-UHFFFAOYSA-N 335.379 1.718 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2nnc(N)o2)c1 1138697791 ASNDYXBODWEPSP-UHFFFAOYSA-N 339.355 1.802 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](CO)[C@@H](CO)C2)cc1Br 704792543 AIMUGLQIYVAPMM-HBNTYKKESA-N 329.238 1.506 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CONC(=O)OC(C)(C)C 1154025461 HJLWMYLSLKQBMN-JTQLQIEISA-N 340.376 1.601 10 10 EDCE COc1cc(CC(=O)NCc2c(O)cccc2O)cc(OC)c1O 1304053289 GWCBOESGQGBMPI-UHFFFAOYSA-N 333.340 1.680 10 10 EDCE N=c1nn[nH]n1-c1cccc(C(=O)NCc2cc(Cl)ccc2O)c1 1165508432 OKIUNHKBZRITQN-UHFFFAOYSA-N 344.762 1.364 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@H]2C(=O)NC3)cc1Br 2115749659 VCLWJKUZZKMUQL-FWDPORAESA-N 325.206 1.970 10 10 EDCE CN1CCN(c2ccc(CN[C@H]3CCNC34CCC4)cc2F)CC1 1329135002 MFMGPTRMSKZQPS-SFHVURJKSA-N 332.467 1.952 10 10 EDCE CO[C@@H]1CC[C@H](NC(=O)C(=O)NCCCSc2nccs2)C1 1324636782 KUCLTTBIQGEODB-WDEREUQCSA-N 343.474 1.425 10 10 EDCE COc1ccc(CNC(=O)NCc2ccc3nonc3c2)c(O)c1 1251485375 VLKDVVRODGZGTJ-UHFFFAOYSA-N 328.328 1.936 10 10 EDCE C[C@@H](N)c1ccc(N2CC3(CNC(=O)N3)C2)c(Br)c1 2121208348 GRWSPXOGOLRJBB-MRVPVSSYSA-N 325.210 1.340 10 10 EDCE CCN1CCO[C@@H](C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)C1 1266995759 FMELSRHCQDRZCN-CRAIPNDOSA-N 349.475 1.319 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@@]23CCC[C@@H]2C3)cc1 1283078829 QDNOZYWEJYMBEW-SJKOYZFVSA-N 343.387 1.885 10 10 EDCE CS(=O)(=O)C[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1298396348 QDFDALNRTZEWQS-JTQLQIEISA-N 338.389 1.356 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(CO)(CO)C2)c(Br)c1 1914971060 NJBMOWZYJNDTRI-JTQLQIEISA-N 329.238 1.521 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN(C(=O)c2ccco2)CC1 1539781627 HRFSFPWTRCCTPP-UHFFFAOYSA-N 344.367 1.654 10 10 EDCE CS(=O)(=O)c1ccc(F)c(C(=O)NCc2c(O)cccc2O)c1 1472064154 UIPRRIGJLLOUFP-UHFFFAOYSA-N 339.344 1.570 10 10 EDCE COCCCN(CCO)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1612265681 LWPLYWWTUWFVPS-ALCCZGGFSA-N 338.360 1.616 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H]2CCCCO2)cc1C 1717763743 CMJRQWOVAGHISW-WBVHZDCISA-N 336.432 1.139 10 10 EDCE CCC(=O)N(C)CCOCCNC(=O)c1ccc(N=NC(N)=O)cc1 1487585610 XZKLXZOEJSJVGP-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cc2ccn(C)n2)cc1C 1483007168 GKSIGBSWVIGSGL-SNAWJCMRSA-N 342.443 1.742 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CC[C@@H](C(F)(F)F)NC1=O 1635842985 DOUTVBJUTXBKLB-HQJQHLMTSA-N 332.278 1.171 10 10 EDCE COC(=O)c1ccc2nc(CNC(=O)c3cccc(O)c3O)[nH]c2c1 1569973406 QJSPFNPAJFEBRI-UHFFFAOYSA-N 341.323 1.691 10 10 EDCE COc1ccc(CNC2CCC(N(C)C(=O)CC(N)=O)CC2)cc1C 1570659028 VNCJYRFAXNAUKT-UHFFFAOYSA-N 347.459 1.738 10 10 EDCE CC/C(C)=C/C(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1578823459 VFFSBIZQGCIYBZ-JKCCJBJRSA-N 347.415 1.832 10 10 EDCE CC[C@@H](F)C(=O)NC/C=C/CNC(=O)c1ccc(N=NC(N)=O)cc1 1689370589 WWUZXKALEILHTJ-BZEOHAMZSA-N 349.366 1.999 10 10 EDCE CCS(=O)(=O)N1CCN(Cc2cc(C)cc(OC)c2O)CC1 164237145 OUGRIQMQTHSKDC-UHFFFAOYSA-N 328.434 1.177 10 10 EDCE CC1(C)O[C@H]2[C@H](O1)[C@H](CN=[N+]=[N-])O[C@H]2n1cnc2c(N)ncnc21 105228988 QWAPXRJZRIFMTR-UKHPNBTGSA-N 332.324 1.136 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C(C)(C)CO 126548590 GLGIUQQWVCEMJF-LLVKDONJSA-N 328.210 1.608 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@@]4(CO)C3)c(Br)cc2[C@H]1O 2146304873 ALWAGYHDFYHEBU-DSBAHLMNSA-N 339.189 1.253 10 10 EDCE NCc1cc(F)c(N2[C@H](CO)C[C@H]3OCC[C@H]32)cc1Br 2146706377 ZQGPIAXELRMYNU-MRCXROJRSA-N 345.212 1.775 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NCc1ccc(F)cc1O 1994510838 JIEWDBPCDVOKMV-OLZOCXBDSA-N 326.368 1.913 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)([C@H](F)C(=O)NCCCCN=[N+]=[N-])C1 2010399025 XVGOQXNJWLYKOY-SNVBAGLBSA-N 345.375 1.513 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)C[C@@H]1C(=O)NCCCCN=[N+]=[N-] 2010406733 YHTMQFSIEIJGRR-NWDGAFQWSA-N 341.412 1.954 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)c2cc(O)c(O)c(O)c2)C1 2015124771 FTTJDUSOCYTARI-SNVBAGLBSA-N 338.360 1.543 10 10 EDCE C[C@@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)[C@@H](C)O)c1ccccc1O 2017514748 KCBLFBFNMZHQBF-JTNHKYCSSA-N 338.404 1.844 10 10 EDCE CN(c1ccc(CN)c(Br)c1F)C1CS(=O)(=O)C1 2034770222 SFRGTLXCLNKHGM-UHFFFAOYSA-N 337.214 1.280 10 10 EDCE CCCN(c1ccc(CO)cc1Br)[C@@H]1CC(=O)NC1=O 2171202680 JTAIPIBXEHKXRH-GFCCVEGCSA-N 341.205 1.573 10 10 EDCE O=C(N[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1cc(O)c(O)c(O)c1 1148589953 RSUQQHHYHJBORL-HALDLXJZSA-N 340.379 1.664 10 10 EDCE NCc1ccc(N2CC[C@@H](N3CCOC3=O)C2)c(Br)c1 2171696438 LKJGMVYCHMJZJA-LLVKDONJSA-N 340.221 1.939 10 10 EDCE C[C@@H](O)[C@@H]1CCCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2193587783 ZOCAZPYTPVTWIA-BITCUVMXSA-N 340.221 1.751 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@@H](CO)C[C@@H]32)c(Br)c1 2199785562 ICKCRPOLYJJSLZ-TUKIKUTGSA-N 341.249 1.884 10 10 EDCE O=c1cc[nH]c(CNCc2ccc(Br)cc2O)c1O 2230952826 RDNBQMQQRMQTBN-UHFFFAOYSA-N 325.162 1.838 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H](O)C[C@@H](F)C3)c(Br)cc21 2234659205 DVEBTMDLUKSWRU-LTMDPNIMSA-N 344.184 1.310 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2225801031 RUCJHSXAUSDPHU-RQJHMYQMSA-N 349.214 1.692 10 10 EDCE CSc1ncc(CNC(=O)c2nc(NN)ncc2Cl)s1 2284722891 FQHOCCKCOUPTFR-UHFFFAOYSA-N 330.826 1.524 10 10 EDCE COCCNCC(=O)NCc1ccc(C)c(Br)c1O 2352619129 AVVDYLUVAOCVDA-UHFFFAOYSA-N 331.210 1.315 10 10 EDCE Cc1ccc(CN2CC[C@@](N)(C(=O)O)C2)c(O)c1Br 2352941521 RNVISXSWKKRNLH-ZDUSSCGKSA-N 329.194 1.451 10 10 EDCE CCN(CC)[C@H](C)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 68079919 VRUJNKWASMRXSB-LLVKDONJSA-N 343.449 1.224 10 10 EDCE CN1C(=O)C(=CNCCCN(C)c2ccccc2)C(=O)N(C)C1=O 60865469 HWOJTVHWGNBONL-UHFFFAOYSA-N 330.388 1.037 10 10 EDCE CN(C)c1ccc([C@H](N)[C@H](O)c2c(Br)ncn2C)cc1 2362530240 XYFAUHGVUYMQJV-AAEUAGOBSA-N 339.237 1.982 10 10 EDCE CNC(=O)C[C@H]1CNCCN1Cc1c(O)cccc1Br 2369317447 XACWAMUIKTZAMB-JTQLQIEISA-N 342.237 1.065 10 10 EDCE COc1ccc(CN(N=Nc2nonc2N)c2nonc2N)cc1 252609040 HPTOLGHISSBXEF-UHFFFAOYSA-N 331.296 1.331 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN[C@@H]2CC(=O)N([C@H]3C[C@H]3C)C2)c1O 376055050 PILZCQZVBZNCEX-XWIASGKRSA-N 335.360 1.408 10 10 EDCE Cc1ccc(CN2CC[C@@H](OCC(N)=O)C2)c(O)c1Br 2380760941 BQRRVWQDFKWZTD-LLVKDONJSA-N 343.221 1.539 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc(Br)c2c(c1)OCO2 808507921 KHCAZINVIAYGHZ-UHFFFAOYSA-N 329.102 1.493 10 10 EDCE C[C@@H]1C[C@H]1N1C[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CC1=O 819170972 QZRWGMJGTSAFQR-MRVWCRGKSA-N 343.383 1.166 10 10 EDCE N[C@@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)C[C@H]1C(F)(F)F 903982421 OHJGITKNAPJJEQ-TZMCWYRMSA-N 347.356 1.984 10 10 EDCE NC(=O)c1cccc2c1CCN(C(=O)NCCc1ccc(N)cc1)C2 851664913 LPBUOAWBBIFCKW-UHFFFAOYSA-N 338.411 1.678 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)C[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1895875421 JIMNGCKXQKZALH-GHMZBOCLSA-N 325.369 1.268 10 10 EDCE C[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[S@]1=O 758161736 WKYQZTLMCSJYJE-XQHREBAHSA-N 339.373 1.273 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CC[C@H](O)C(F)(F)C1 853775765 BDWHRZKBGFMHGR-HNNXBMFYSA-N 337.370 1.974 10 10 EDCE CN1CC(=O)N(CCN(Cc2ccccc2O)C[C@H]2CCCO2)C1=O 851840342 DBHYCRWRSCANLW-OAHLLOKOSA-N 347.415 1.267 10 10 EDCE Cc1nnc2n1C[C@H](C(=O)NCc1ccc3cccnc3c1O)CC2 862027195 LXAZPSBKCDPTOM-CQSZACIVSA-N 337.383 1.719 10 10 EDCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)NCc1ccc(N(CC)CC)cc1 861765616 DVPWBKLVAGCJRR-DLBZAZTESA-N 346.475 1.406 10 10 EDCE COC[C@]1(C)CN(CC(=O)NCc2ccc(N(C)C)cc2)CCO1 860202938 SSIPCYHNHUTEDI-SFHVURJKSA-N 335.448 1.106 10 10 EDCE CC(C)(C)[C@@H](NC(N)=O)C(=O)NCc1ccc2cccnc2c1O 862026481 PZHFSZIFXHNUBR-AWEZNQCLSA-N 330.388 1.640 10 10 EDCE CNC(=O)CCOC1CCN(C(=O)c2ccc(C)c(O)c2O)CC1 780960979 UEDGFLMRWYCFKW-UHFFFAOYSA-N 336.388 1.164 10 10 EDCE Cc1ccc(C(=O)NC[C@@]2(O)[C@H]3[C@@H]4C[C@@H]5[C@@H]6C[C@@H]([C@@H]3[C@@H]64)[C@@H]52)c(O)c1O 787668369 FNTJMYKIXQORJT-SCYLYBFASA-N 341.407 1.645 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(O)CCO[C@@H]1C 1306079652 CUCUEPAWXGNJCN-FZKQIMNGSA-N 346.431 1.722 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@@](O)(C(F)F)C3)cc2F)CC1 1327953843 ZRDVAGKGGUXJSV-KRWDZBQOSA-N 343.393 1.779 10 10 EDCE N[C@H]1CN(Cc2cc(Cl)cc(Br)c2O)CC[C@@H]1CO 2122343790 CQRSRTIUIRKHHN-PELKAZGASA-N 349.656 1.950 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)CCO1 1331792969 AFNDUTGDPVKMIK-QGZVFWFLSA-N 332.448 1.417 10 10 EDCE COc1ccc(N(C)[C@H]2COC[C@H]2O)c(OC)c1Br 2226539047 RMRVUULRYOBLAA-VHSXEESVSA-N 332.194 1.662 10 10 EDCE CN1CCN(c2ccc(CNC(=O)c3ncc(Cl)cn3)cc2)CC1 1438905812 XJVYXSVZAJXICA-UHFFFAOYSA-N 345.834 1.812 10 10 EDCE COc1ccc(CNC(=O)c2ccc3c(c2)C(=O)NCCO3)c(O)c1 1467469954 DOKHYJLHGKCSKP-UHFFFAOYSA-N 342.351 1.453 10 10 EDCE CS(=O)(=O)Nc1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 1538370852 GRVWSZDXGCDFMV-UHFFFAOYSA-N 336.369 1.651 10 10 EDCE O=C(CCCNC(=O)c1cccnc1)NCc1c(O)cccc1O 1472063502 LJDKSIWVWDFWRQ-UHFFFAOYSA-N 329.356 1.319 10 10 EDCE CCNC(=O)CC(=O)N1CC[C@@H](NCc2ccc(OC)c(C)c2)[C@H]1C 1717790704 LWQGKDDWSRMEQB-GDBMZVCRSA-N 347.459 1.609 10 10 EDCE CN(C(=O)Cc1ccc(O)c(O)c1)[C@H]1CCCC[C@H]1S(C)(=O)=O 1565975178 GAXFNDONKKVARV-SWLSCSKDSA-N 341.429 1.455 10 10 EDCE O=C(Cn1c(=O)cnc2ccccc21)NCc1ccc(O)cc1O 1570462237 KUCHOZQVDCLZQW-UHFFFAOYSA-N 325.324 1.124 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 1643812735 NTDCWXJLLHBUIY-LBPRGKRZSA-N 344.342 1.906 10 10 EDCE COCCn1cc(C(=O)NCc2cccc(O)c2O)c(=O)cc1C 1644710889 NDJWTOHFYGXOTP-UHFFFAOYSA-N 332.356 1.144 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1C[C@]2(CO)CCCC[C@]2(CO)C1 1653189709 PLKGJOFFVYJLDO-HDICACEKSA-N 335.400 1.014 10 10 EDCE CCC[C@H](C)C(=O)NC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1744638018 LZXFAMCRGFKYMX-NWDGAFQWSA-N 337.420 1.770 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)cc1 1583994134 KZWTWJJVRZPHEM-ZIAGYGMSSA-N 331.376 1.442 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N(C)[C@@H](C)CO)c(Br)cc21 122543763 VUOQSXIQSJSUAH-ISVAXAHUSA-N 342.237 1.869 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@@H](CNC(=O)C(C)(C)C)C2)cc(OC)n1 1684296456 SGULEQNOBLVHQD-BJHJDKERSA-N 349.431 1.770 10 10 EDCE CC1CCN(c2nnnn2Cc2ccc(N3CCOCC3)cc2)CC1 1119561113 BQBVSUZCOUGXNQ-UHFFFAOYSA-N 342.447 1.794 10 10 EDCE CCN(CCC(=O)O)C(=O)CNCc1ccc(N(CC)CC)cc1 1857866507 NPFSHSXKGKKIPH-UHFFFAOYSA-N 335.448 1.946 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCC(=O)NC2)c1O 1964561076 LDKZSCQKRWNNGQ-MRVPVSSYSA-N 329.194 1.532 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1985103218 RUIGQSQNWUYREO-MNOVXSKESA-N 327.385 1.421 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985103110 QLCPSCAVMMLIJQ-HBNTYKKESA-N 327.385 1.419 10 10 EDCE CO[C@H]1C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)C1 1985101334 QVPMXJACJWLEJY-WDEREUQCSA-N 325.369 1.532 10 10 EDCE C[C@@H](NC[C@@H](CO)NC(=O)OC(C)(C)C)c1c(O)cccc1O 1985857657 DWEBLAZWBZGUPH-MNOVXSKESA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1CC(CCO)(NCc2c(O)cccc2F)C1 1997950737 KLNOZISFVDTAMS-UHFFFAOYSA-N 340.395 1.993 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]([C@@H](O)[C@@H](N)c2ccccc2O)C1 2022716858 JIPIMLVEHCYVOG-QLFBSQMISA-N 338.404 1.389 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@@]2(C)CO)c(Br)c1 698117182 UHCMZXJYOHKRQL-WFASDCNBSA-N 343.265 1.881 10 10 EDCE CCN(C[C@@H](O)C(F)(F)F)C(=O)c1cnn2c(O)cc(C)nc12 2064159304 LPYLGWAASUWBFO-SECBINFHSA-N 332.282 1.129 10 10 EDCE CNCc1ccc(N2C[C@H](CO)OCC23CC3)cc1Br 2183982093 ZJRWLWZMDLPKEH-CYBMUJFWSA-N 341.249 1.899 10 10 EDCE CC(C)(C)OC(=O)N1CC(c2nc(=NCc3ccc(N)cc3)[nH][nH]2)C1 2064226115 VJJVQGRNOGGWHC-UHFFFAOYSA-N 344.419 1.755 10 10 EDCE O=C1Nc2cc(N3CC[C@@H]4COC[C@@H]43)c(Br)cc2[C@@H]1O 2198557225 QSXFVUAAMUHXHH-RDZIJCNDSA-N 339.189 1.660 10 10 EDCE CC(C)C[C@@H](CNC(=O)OC(C)(C)C)COc1nnc(=N)[nH]n1 2210645731 WQFPYTPXDZDDTB-JTQLQIEISA-N 326.401 1.245 10 10 EDCE O=C1C[C@H]2CCN(c3ccc(CO)c(Br)c3)C[C@H]2N1 2088803495 JAKGKTKORZYMCW-NOZJJQNGSA-N 325.206 1.656 10 10 EDCE O=C(O)[C@H]1[C@H]2[C@@H]1OCCN2Cc1ccc(Br)cc1O 2092844067 JOXBQCYYLPLHSK-SDDRHHMPSA-N 328.162 1.439 10 10 EDCE OCc1ccc(N2CC(N3CCOCC3)C2)c(Br)c1 2113193999 RTNOSEPFLFUVGK-UHFFFAOYSA-N 327.222 1.462 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(NC(=O)COc2ccc(N)cc2)C1 2222966111 ITHXJXCJIROYAN-KZULUSFZSA-N 347.415 1.773 10 10 EDCE COc1ccc(Br)c(CN2CC[C@H](CO)[C@H](N)C2)c1O 2236039754 DHITXGCJCGFTKF-BXKDBHETSA-N 345.237 1.305 10 10 EDCE O=C(O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccccc2)SC1=S 2293091938 ZTDKNVSCNHFUTP-VIFPVBQESA-N 337.378 1.816 10 10 EDCE CCCNCc1ccc(N2CC[C@@H]2[C@@H](O)CO)cc1Br 2286228771 QCWWWEOYOSQDOF-CABCVRRESA-N 343.265 1.881 10 10 EDCE C[C@H]1CCNC(=O)[C@@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2312521847 YVOGZCLSYUOYKV-KBXCAEBGSA-N 343.427 1.177 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)cc1Br 2354369984 UAJDQIMRZUDMIT-QBXIECCESA-N 341.249 1.925 10 10 EDCE CN(C)C(=O)CN(C)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 108767759 LJTQCQZIEZVKKX-RMKNXTFCSA-N 331.416 1.083 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H](n3cncn3)C2)cc1 105898416 XUVHDOODOHTATK-KRWDZBQOSA-N 342.447 1.297 10 10 EDCE O=C(NC[C@H](C(=O)O)c1ccc(O)c(O)c1O)OCc1ccccc1 1951595070 OXCSECYYUYNYQN-LBPRGKRZSA-N 347.323 1.898 10 10 EDCE COc1ccc(Br)c([C@@H]2N[C@@H](C(=O)O)CS2)c1O 83236612 GUDWTIROFAQFIK-LHLIQPBNSA-N 334.191 1.952 10 10 EDCE C[C@@H]1COCC[C@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 194076227 YERHINZRPVGZFO-UKRRQHHQSA-N 336.407 1.951 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cn(C[C@@H]3CCOC3)nn2)c1 528860827 MWNDRIFGNJUHDN-NEPJUHHUSA-N 346.387 1.520 10 10 EDCE Cc1ccc(CN2C(=O)[C@H]3COC[C@@H]3C2=O)c(O)c1Br 2381148435 ZCHJMUARUUYCDF-UWVGGRQHSA-N 340.173 1.595 10 10 EDCE O=c1cc(/C=C/c2ccc(N3CCOCC3)c(F)c2)nc2nc[nH]n12 806571202 QXIAYCHDAAAZMA-HNQUOIGGSA-N 341.346 1.564 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccccc1S(=O)(=O)CC(F)F 808516181 DBILBFVLEDRKEW-UHFFFAOYSA-N 334.296 1.040 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@H](OC)C2)c(Br)c1 396004358 FZIYFBZGTKMTAV-OWYVNGRQSA-N 329.238 1.925 10 10 EDCE C[C@@H](NC1(C(N)=O)CN(C(=O)OC(C)(C)C)C1)c1ccccc1O 715576204 SLMWRKQSPWAHKI-LLVKDONJSA-N 335.404 1.518 10 10 EDCE O=C1Cc2c(C(=O)NCCCSc3nccs3)ccnc2N1 827474715 KLWRNKUREQWOCF-UHFFFAOYSA-N 334.426 1.945 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H](N)C(F)(F)F)CC2)cc1 827458460 CWEWFAUNSGRUEX-CYBMUJFWSA-N 331.338 1.624 10 10 EDCE CN(C)c1ccc(/C=C/CNC2CCN(S(C)(=O)=O)CC2)cc1 835035104 FNLRSHUNEOGDQF-SNAWJCMRSA-N 337.489 1.779 10 10 EDCE Nc1ccc(CCNC(=O)N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1 841955581 HIZALXHXJRRIBA-DGCLKSJQSA-N 331.338 1.766 10 10 EDCE COC(=O)N1CCC[C@H]([C@H](C)NC(=O)NCCc2ccc(N)cc2)C1 841881024 MQZFFEORBSRIDQ-ZFWWWQNUSA-N 348.447 1.977 10 10 EDCE COCC[C@H]1NC(=O)N([C@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849357155 KQEBXURGUYYDSP-DZGCQCFKSA-N 333.388 1.231 10 10 EDCE Cc1cc(N(C)C)ccc1CN1CCN([C@H]2CCNC(=O)CC2)CC1 840951627 CQSJZQKGPARYFV-GOSISDBHSA-N 344.503 1.847 10 10 EDCE C[C@H]1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H]1C(=O)O 842938290 QEGGMMYQJKZQSL-YOEHRIQHSA-N 347.459 1.754 10 10 EDCE O=C(NCc1cc(NC(=O)[C@@H]2CCOC2)ccc1O)[C@H]1CCOC1 923124210 VEIZJGPVVWDNKT-NWDGAFQWSA-N 334.372 1.020 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)NCC(=O)N=S(C)(C)=O 923597212 LSQWZMATULHQIL-UHFFFAOYSA-N 341.433 1.568 10 10 EDCE Oc1ccccc1CN(C[C@@H]1CCCO1)C[C@@H]1CCC2(CNC2)O1 852742534 JPSLKCRYZWWRJZ-IRXDYDNUSA-N 332.444 1.894 10 10 EDCE CCn1nnc(C)c1C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855224285 DZNUGWUHJJVWOH-ZDUSSCGKSA-N 329.404 1.624 10 10 EDCE CCOC(=O)[C@@H]1NCC[C@H]1N[C@H]1CCN(c2ccc(OC)cc2)C1 854218604 ZEAKAFWWNUFQNP-IAOVAPTHSA-N 333.432 1.157 10 10 EDCE CC[C@@H](NCC[C@@H]1CNCCS1(=O)=O)c1ccc(C)cc1O 925787959 DNTRBFRFXOHJMJ-UKRRQHHQSA-N 326.462 1.518 10 10 EDCE C[C@H]1[C@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCN1C 925321066 OGLBSQBTBCFMDL-MAUKXSAKSA-N 346.475 1.757 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)C[S@](C)=O)C2)cc1 852250354 GZVJVNMJTONUAY-PSVOKBTDSA-N 339.461 1.340 10 10 EDCE O=C(NCc1ccccc1O)c1cn(CCO)nc1C1CCOCC1 856666595 KWHAQFMVMKXJDA-UHFFFAOYSA-N 345.399 1.405 10 10 EDCE C[C@H](NC[C@@H](O)[C@H]1CCCO1)c1ccc(N2CCOCC2)c(F)c1 858469670 XXALTDHPLAGWHO-MORSLUCNSA-N 338.423 1.853 10 10 EDCE Cc1cc(C(=O)NC[C@@H](O)[C@@H]2CCCO2)c(C)n1-c1ccccn1 862652369 XRFVCRALZZBOPM-CVEARBPZSA-N 329.400 1.759 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H](N4CCCCC4)C3)cc2N1 761894316 IJZCIVQPBVHZPJ-LBPRGKRZSA-N 346.387 1.990 10 10 EDCE COc1cc(N2CCN(Cc3cc4c(cc3O)OCO4)CC2)ncn1 763384443 QVPQISQFHCRAAC-UHFFFAOYSA-N 344.371 1.242 10 10 EDCE CCOC(=O)c1ccc(NC(=S)NNc2nnc(C)n2C)cc1 863205801 LYIHYIXYBMKDMH-UHFFFAOYSA-N 334.405 1.614 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)COC3CC3)cc2)CC1 879688504 ZMVFOMDFRCZGMQ-UHFFFAOYSA-N 331.416 1.150 10 10 EDCE CCOC(=O)[C@@H](F)[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C1 898548969 UJOGKJCYWYTRSH-PELKAZGASA-N 329.299 1.600 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCOCC2(CC2)C1 782714677 AVSWRCATZJCTLL-UHFFFAOYSA-N 345.443 1.845 10 10 EDCE C[C@@H](NCc1cc(Br)cc(F)c1O)c1nnc(O)n1C 895172681 WRLYPEITFJUDJO-ZCFIWIBFSA-N 345.172 1.979 10 10 EDCE CCN(CCC(=O)NC)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1164276489 RYKBHAMXEVPLSX-VURMDHGXSA-N 335.360 1.743 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCCC34OCCO4)CC2)cc1 1445740472 PCMREWUOBTVMAI-QGZVFWFLSA-N 346.427 1.887 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)Cn2cccn2)cc1C 1700319177 KTAZBNNGONPSBY-HNNXBMFYSA-N 330.432 1.885 10 10 EDCE C[C@H](O)CCCN1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1479972068 MFIYRGNFKMSUBU-SWLSCSKDSA-N 347.419 1.814 10 10 EDCE O=C(Cn1ncn2nccc2c1=O)NCc1c(O)ccc2ccccc12 1472085434 SRYQSAQGKAMJOB-UHFFFAOYSA-N 349.350 1.066 10 10 EDCE COc1ccc(CNC[C@]2(C)CCN(C(=O)CC(N)=O)C2)cc1C 1716860734 QIDAFMFXKGWTRA-SFHVURJKSA-N 333.432 1.207 10 10 EDCE CC[C@@H](CO)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1636648518 QADDKEQOCNVXDT-AWEZNQCLSA-N 333.392 1.378 10 10 EDCE CS(=O)(=O)c1ccc(/C=C/C(=O)NCc2c(O)cccc2O)o1 1639292805 RHNCZJMMPWUXFS-FNORWQNLSA-N 337.353 1.424 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](OCC)[C@H]1CCOC1 1634944245 PRLABOOLUFUZNQ-LRDDRELGSA-N 328.405 1.936 10 10 EDCE COc1cccc([S@@](=O)CC(=O)NCc2ccc(OC)cc2O)c1 1633926299 AHVNOPHMJXADBA-DEOSSOPVSA-N 349.408 1.833 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)C(C)(C)C(N)=O)cc1C 1495684270 ODPKZEFIOCKUAC-GFCCVEGCSA-N 335.448 1.357 10 10 EDCE CCN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)[C@@H](C)OC 1496802710 QFCCOZNZQMJQPL-LLVKDONJSA-N 349.391 1.462 10 10 EDCE C[C@]1(CNCCO)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1733444224 OSQFFXNYSAAXMD-MRXNPFEDSA-N 333.392 1.283 10 10 EDCE Cc1ccn2c(=O)c(C(=O)NCc3c(O)cccc3O)cnc2c1 1645360923 PBNJRXNPSQBAQU-UHFFFAOYSA-N 325.324 1.344 10 10 EDCE C[C@@]1(CNCCO)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1733444223 OSQFFXNYSAAXMD-INIZCTEOSA-N 333.392 1.283 10 10 EDCE NC(=O)c1cc(NCc2ccc(N3CCC(O)CC3)cc2)ncn1 1655703413 KYOMNECFEKBFQQ-UHFFFAOYSA-N 327.388 1.149 10 10 EDCE CS(=O)(=O)Nc1cccc(C(=O)NCc2c(O)cccc2F)c1 1596907118 OBBRDSHLXYYXQE-UHFFFAOYSA-N 338.360 1.833 10 10 EDCE Cn1cnc(CNC(=O)NCc2cccc(Br)c2O)c1 1676723297 QCKDLTLTCHOUTK-UHFFFAOYSA-N 339.193 1.888 10 10 EDCE [N-]=[N+]=NCCCNS(=O)(=O)N1CC(OCc2ccccc2)C1 1959207651 JNAZRRNTJVSOCV-UHFFFAOYSA-N 325.394 1.422 10 10 EDCE Oc1cc(Br)ccc1CN[C@H]1COC2(CCC2)[C@@H]1O 2141555830 KPGJTPCBXMLBSZ-WCQYABFASA-N 328.206 1.927 10 10 EDCE Cn1cc(Br)c(COC(=O)COc2ccc(N)cc2)n1 2143621882 YNZLVJWXZTVTRQ-UHFFFAOYSA-N 340.177 1.887 10 10 EDCE Cn1ncc(Br)c1COC(=O)COc1ccc(N)cc1 2143621254 OCJPUQLWALXPQB-UHFFFAOYSA-N 340.177 1.887 10 10 EDCE NCc1ccc(N2C[C@]3(CO)CC[C@@]3(CO)C2)cc1Br 2145749289 QEUVPDUSDXTTAT-GJZGRUSLSA-N 341.249 1.479 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4[C@H](O)C[C@H]4C3)c(Br)cc21 2151397121 MWWIPUFKYWVNDV-RWSBNGFJSA-N 338.205 1.218 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C1(CNC(=O)OC(C)(C)C)CC(O)C1 2014483149 PLEVUVWLJCYUDM-UHFFFAOYSA-N 341.412 1.811 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](N=[N+]=[N-])C1)C1COC1 2010401218 BNIRGXFFQJMACZ-NWDGAFQWSA-N 339.396 1.827 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)cc1Br 2173317245 KCBSCCLWQDNUQP-NIQAVCIQSA-N 341.249 1.789 10 10 EDCE O=C(NCc1c(O)cc(O)cc1O)[C@H]1CCCN(CC(F)(F)F)C1 2064881450 DQEMONKBYAOASP-VIFPVBQESA-N 348.321 1.694 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2CN3C(N)=O)cc1Br 2192286188 OZGUASQQWOOMJO-MIMYLULJSA-N 339.237 1.810 10 10 EDCE CCN(C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1cccnn1 2080942196 IKFICYKEHWFWAV-QWHCGFSZSA-N 348.403 1.414 10 10 EDCE COc1ccc(N2CCOC[C@H](N)C2)c(OC)c1Br 2106378055 SRWSAMCAJKTUEL-SECBINFHSA-N 331.210 1.630 10 10 EDCE Cn1cccc1C=C1C(=O)NC(=S)N(c2ccccc2F)C1=O 2293760688 MFMARZZDMBQGTG-UHFFFAOYSA-N 329.356 1.996 10 10 EDCE O=C(CN1C(=O)C(=Cc2ccccc2)SC1=S)NCCCO 2294871998 LBIRFVNBNPLYKF-UHFFFAOYSA-N 336.438 1.386 10 10 EDCE COc1ccc(N2CCN(C(=O)CCCCc3c[nH]nn3)CC2)cc1 137992242 GIXRXTMNVPGXND-UHFFFAOYSA-N 343.431 1.875 10 10 EDCE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H]2CNC(=O)C2)cc1 194698142 QHFZIWVRLBFKBF-WBVHZDCISA-N 345.443 1.396 10 10 EDCE CN1CCN(c2ccc(/C=C/C(=O)O)c(Br)c2)CC1=O 234367171 CMLKFIIBMIPZMF-HWKANZROSA-N 339.189 1.825 10 10 EDCE CC(=O)N(C(=O)c1ccc(NS(C)(=O)=O)cc1)c1ccc(N)cc1 242448459 BNYFTWZZAFAPLC-UHFFFAOYSA-N 347.396 1.834 10 10 EDCE O=C(CCN1CCOC1=O)NCc1cc(Br)ccc1O 804737479 SBLSOIZVGRQJDD-UHFFFAOYSA-N 343.177 1.613 10 10 EDCE CN(CCC(N)=O)c1ccc(/C=C/C(=O)O)cc1Br 381927752 SQOFKAAWPJCHAS-HWKANZROSA-N 327.178 1.859 10 10 EDCE Cn1nccc1CNC(=O)NCc1cc(Br)ccc1O 804903527 BVSZXNYJBAJXQD-UHFFFAOYSA-N 339.193 1.888 10 10 EDCE COC[C@@H](C(N)=O)N(C)C(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 817941021 UAZKYNPRABKVGG-INIZCTEOSA-N 347.390 1.806 10 10 EDCE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@H]1CCCNC1=O 726097968 ROTVSWILOPOSJE-HNNXBMFYSA-N 348.472 1.318 10 10 EDCE CNC(=O)[C@H]1COCCN1c1ccc([C@@H](C)N)cc1Br 723184060 YQKAIYNPLHCIKM-NOZJJQNGSA-N 342.237 1.420 10 10 EDCE CC(=O)N1CCO[C@H](C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C1 822832132 JZPVMLGQBWTZMA-KSSFIOAISA-N 347.459 1.356 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C1C[C@H]2COC[C@@H](C1)C2=O 739577330 UMMANLJQZBUCCX-MQVJKMGUSA-N 330.428 1.919 10 10 EDCE CCc1cccc(CN2CCN([C@@H]3CCNC(=O)CC3)CC2)c1O 848915544 XIYFYLCRIJMRHX-KRWDZBQOSA-N 331.460 1.741 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C[C@H]1CN(CC)C(=O)O1 847001501 JMBMTUPIGXLZIT-AWEZNQCLSA-N 336.388 1.598 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cc(C(=O)O)on3)CC2)cc1F 911582367 ONRPZJIVYFLQIR-UHFFFAOYSA-N 349.318 1.483 10 10 EDCE C[C@H]1CN([C@@H](C)CNC(=O)/C=C/c2ccc(O)c(O)c2)C[C@@H](C)O1 848295257 MDFSIYAKGZXLCS-BVGADEKGSA-N 334.416 1.725 10 10 EDCE Cc1cc(CC(=O)N2CCC[C@@](O)(CO)C2)c(C)n1-c1ccccc1 854907114 HEQQPOONJAIKDB-FQEVSTJZSA-N 342.439 1.982 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H]2COC[C@@]2(C)C1 852533462 ZCONSTKOOSJPIY-VQIMIIECSA-N 331.460 1.679 10 10 EDCE C[C@@H](NC(=O)NCc1ncc2c(n1)CCOC2)c1ccccc1O 868740702 RACDVSSHJAIJFL-LLVKDONJSA-N 328.372 1.815 10 10 EDCE COc1ccc(N2CCN(C(=O)Nc3nncs3)CC2)c(OC)c1 866128004 RQWMRXMWTGORPP-UHFFFAOYSA-N 349.416 1.909 10 10 EDCE COC(=O)C1(CS(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 866418558 LIAJZHIYWQROJX-UHFFFAOYSA-N 340.445 1.467 10 10 EDCE O=[N+]([O-])c1cc(Cl)cc(CNC2(CCO)CCOCC2)c1O 761992672 OUTIWJKXDFWVRT-UHFFFAOYSA-N 330.768 1.975 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)c1ccc2c(c1)COB2O 863875764 FQMAQYFBNRWSDV-UHFFFAOYSA-N 337.184 1.419 10 10 EDCE COC(=O)[C@@]1(N2CCN(Cc3cc(C)ccc3O)CC2)CCOC1 1118884392 WTJCKJLGWNFTSH-GOSISDBHSA-N 334.416 1.150 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCCC1CCS(=O)(=O)CC1 779546053 BALNWIUMXGZLLM-RQOWECAXSA-N 339.413 1.442 10 10 EDCE C[C@]1(C(F)(F)F)CCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)C1 872166991 ZFOHARIOFYRXQT-ZDUSSCGKSA-N 344.293 1.907 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1 870914347 PKQFTWXTBRCNAQ-CUYVQJCZSA-N 329.444 1.765 10 10 EDCE COc1ccc(CNCC[C@@H]2CCCCN2C(=O)C(N)=O)cc1C 1319774325 JQYLTTFDHPKTPZ-HNNXBMFYSA-N 333.432 1.350 10 10 EDCE CCn1nnc(CN(C)c2ccc(CN)c(Br)c2)n1 1892991588 IECQAAUYLRAANG-UHFFFAOYSA-N 325.214 1.551 10 10 EDCE CN(C)c1ccc(CN(C(=O)C(=O)N[C@@H]2[C@H]3COC[C@H]32)C2CC2)cc1 1322982461 XNPKSCGIOXEEKU-FVQHAEBGSA-N 343.427 1.005 10 10 EDCE CNCc1ccc(N2CCC(CO)(CO)C2)c(Br)c1 694684204 TVIHQGCJYUADDT-UHFFFAOYSA-N 329.238 1.350 10 10 EDCE C[C@H]1C[C@H]1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1257235053 XYZRNWJSPFJBPV-HOCLYGCPSA-N 345.443 1.254 10 10 EDCE O=C(C(=O)N1CC[C@H]2OCCC[C@H]2C1)N1Cc2cccc(O)c2C1 1331981457 PWVVTRXFVCSJDG-XJKSGUPXSA-N 330.384 1.262 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC(CC(F)(F)F)C1 1331231168 CNYKDUWWKHXNQM-UHFFFAOYSA-N 330.306 1.761 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H]2CCCC(=O)N2C)cc1C 1267019947 MEFPVAKRXNPASO-INIZCTEOSA-N 347.459 1.563 10 10 EDCE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@]12COCCN1C(=O)COC2 1351794312 MIEHLNCZQKQKKC-BIENJYKASA-N 346.427 1.466 10 10 EDCE COc1cccc(CNC(=O)[C@]2(C)Oc3ccccc3NC2=O)c1O 1445966735 IZQDWCXGJDXAKP-SFHVURJKSA-N 342.351 1.807 10 10 EDCE CN(C(=O)Cc1ccc(O)c(O)c1)[C@H](CC(N)=O)c1ccccc1 1297409971 NTOCCZXPLARLCY-CQSZACIVSA-N 328.368 1.715 10 10 EDCE C[C@H](O)c1ccc(N2CCC[C@@H]2[C@H](O)CO)cc1Br 2123170514 IGICYNSRGZVRFS-CUOATXAZSA-N 330.222 1.824 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 1636262576 NKIDVENUALLPPC-IGOJGBNBSA-N 338.407 1.887 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2cnn(C)n2)c1 1636083764 MUHSGPBISIJPCC-UHFFFAOYSA-N 337.383 1.965 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc[n+]([O-])cc1 1570514509 DPALWWJBBLSVOW-UHFFFAOYSA-N 330.340 1.231 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cccc(Nc2nn[nH]n2)c1 1593882074 QEGZIYWALIYRNM-UHFFFAOYSA-N 326.316 1.285 10 10 EDCE COCCN1C(=O)/C(=C/c2cccc(OC)c2O)C(C(=O)OC)=C1C 5701150 MXWCYRFNKMQVLC-JLHYYAGUSA-N 347.367 1.720 10 10 EDCE COc1ccc(N2N=C(C)/C(=C(/C)NN3CCN(C)CC3)C2=O)cc1 17071685 ZFFPVVZHVHTYGF-GHRIWEEISA-N 343.431 1.444 10 10 EDCE C[C@H](N)c1ccc(N2CC(CNC(N)=O)C2)cc1Br 2130744155 OPAPVFGARNOHMJ-QMMMGPOBSA-N 327.226 1.573 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CC(=O)O)c1ccc(O)c(O)c1O 1951478593 UURDNVPUDPYODO-MRVPVSSYSA-N 327.333 1.886 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1990031665 BTAYESPMJYXWFA-MNOVXSKESA-N 327.385 1.421 10 10 EDCE C[C@@H](CC(N)=O)N(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2151341163 WAKUEUKXOKEDSA-PWCHPLFNSA-N 342.193 1.135 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](O)CN(Cc2cc(N)ccc2O)C1 2002701035 LGGZODDQHFAUFD-ZIAGYGMSSA-N 337.420 1.434 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NCc2ccc(F)c(F)c2O)C1 2011486490 BETFKGNVFOFVKO-RYUDHWBXSA-N 344.358 1.740 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@](O)(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2011938701 CKMVOPYWVPJEBY-XHDPSFHLSA-N 339.396 1.660 10 10 EDCE C[C@H](C(=O)O)N1CCN(Cc2c(O)cccc2Br)CC1 706655619 SGIJPQDBOKOAHW-SNVBAGLBSA-N 343.221 1.745 10 10 EDCE CN1CCO[C@H](CN(C)c2ccc(CN)c(Br)c2)C1 707814312 AULRNZFOPLAXNJ-ZDUSSCGKSA-N 328.254 1.675 10 10 EDCE NCc1ccc(N2C[C@@H](CO)[C@@H](CCO)C2)c(Br)c1 2093495606 KNTKNHMTYAKXHG-RYUDHWBXSA-N 329.238 1.335 10 10 EDCE OCC1(O)CN(c2ccc(CNC3CC3)cc2Br)C1 2115304548 YTIYUSHTSPTJQF-UHFFFAOYSA-N 327.222 1.245 10 10 EDCE OCc1ccc(N2C[C@H]3CCO[C@@]3(CO)C2)c(Br)c1 2231313527 KRXLTYOYJZFWHW-BXUZGUMPSA-N 328.206 1.529 10 10 EDCE NCc1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(F)c1Br 2236627110 FXGBAQSMKAYTJG-AOOOYVTPSA-N 347.228 1.474 10 10 EDCE NCc1cc(F)c(N2CC[C@H](O)[C@H](O)CC2)cc1Br 2269149392 BPZFETSEUJONKQ-BETUJISGSA-N 333.201 1.369 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4COC[C@H]3C4)c(Br)cc21 2286951013 SFXAPXWPXMRKMB-DAROEXNTSA-N 338.205 1.626 10 10 EDCE O=C1CN(c2ccc(OCc3ccccc3)cc2)CCN1CCO 2299516004 WTLGEWODNAOXOG-UHFFFAOYSA-N 326.396 1.907 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@H](O)CCN1C(=O)OC(C)(C)C 2300526391 RXMGSIDPHAWXPD-NEPJUHHUSA-N 341.412 1.906 10 10 EDCE Cc1nc(CN2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)no1 114465346 ONWJMNHIADMDNV-UHFFFAOYSA-N 333.348 1.310 10 10 EDCE COC(=O)[C@H]1C[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 170760634 FMEMIINIBGOMIJ-STQMWFEESA-N 336.363 1.088 10 10 EDCE CCO[C@H]1C[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 1347558426 FCDFICRPLRSSCT-NOLJZWGESA-N 333.432 1.614 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)c(Br)c1 2357053460 WBKOJJOQHYHSTD-CDAHBRHOSA-N 342.233 1.965 10 10 EDCE C[C@@H](NCCCNS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 121121570 PGDGULBFAVBTPQ-CQSZACIVSA-N 341.477 1.113 10 10 EDCE CNC(=O)CC1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 93588032 ARCPQJWNLPLICO-UHFFFAOYSA-N 331.460 1.871 10 10 EDCE COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1C(=O)/C=C/c1ccc(O)c(O)c1 276238038 LQYKDEREGPUPQZ-JHPGTTKTSA-N 331.368 1.911 10 10 EDCE Cc1cc(CO)oc1C(=O)NCc1ccc(N2CCOCC2)cc1 282964756 IDXMOMHLYYETJZ-UHFFFAOYSA-N 330.384 1.847 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1[C@H]2CC[C@H]1[C@H](CO)C2 290880910 CWVQJBFKBAROAB-SZMVWBNQSA-N 345.443 1.578 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CCc2nnc(C3CC3)n2C1 815834146 VBDFRWIRVHYIDT-CYBMUJFWSA-N 342.399 1.488 10 10 EDCE Nc1ccc(OCCCOn2c(=O)c(=O)oc3ccc(O)cc32)cc1 821296836 IVBRCGBDFYHSKB-UHFFFAOYSA-N 344.323 1.140 10 10 EDCE COc1ccc(N2CCC(NC(=O)CC3(O)CCOCC3)CC2)cc1 906511395 JHHZEUAXPCDHNE-UHFFFAOYSA-N 348.443 1.712 10 10 EDCE C[C@H]1[C@H](C)CN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 837769914 RZVJOEOKRCUAEI-YCPHGPKFSA-N 344.459 1.938 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C1=O 839953388 PRBQQXBDIBWFDF-VQHPVUNQSA-N 341.411 1.080 10 10 EDCE CC(C)C(=O)N1CCC[C@@H]1C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 843296666 CZSXOFOCKOWJQA-DLBZAZTESA-N 346.475 1.516 10 10 EDCE N=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@H]1CCCO1 849014339 GQJYKPFFLKSGBW-CQSZACIVSA-N 336.411 1.455 10 10 EDCE C[C@H](O)[C@H]1CN(C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 840274330 DRAXFHZQOVIIFU-SUMWQHHRSA-N 333.432 1.360 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)NCCc2cn(C)cn2)cc1 845253862 SAXCBUJVFKWYKK-UHFFFAOYSA-N 345.447 1.749 10 10 EDCE CO[C@H](CS(=O)(=O)N(C)Cc1ccccc1O)[C@@H]1CCOC1 849376150 LZMLMWUTORNZEK-UKRRQHHQSA-N 329.418 1.205 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCCN(C(N)=O)C3)C2)cc1 855229274 LZABGCUNEYFIQE-KGLIPLIRSA-N 346.431 1.181 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCCN3C(C)=O)C2)cc1 857634589 JSJQODZDSQHRRG-PBHICJAKSA-N 331.416 1.401 10 10 EDCE C[C@@H]1OC[C@H](NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)[C@@H]1C 924728566 JKDLNNRZVLSLAP-KKBFJZEXSA-N 331.460 1.901 10 10 EDCE CN(C)C(=O)N(C)[C@H]1CCN(C(=O)NCCc2ccc(N)cc2)C1 851663163 UZHRGKYQNCOAJT-HNNXBMFYSA-N 333.436 1.209 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cnnn2C2CCNCC2)c1 852802530 PGUHYXAYYMOSJM-LLVKDONJSA-N 345.403 1.408 10 10 EDCE Cc1cc(CS(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)no1 850586756 FKHVKJNSSZMODE-HNNXBMFYSA-N 338.433 1.168 10 10 EDCE COC(=O)CSCCC(=O)NCc1ccc2cccnc2c1O 862028096 PPQCZZFPGJOSRW-UHFFFAOYSA-N 334.397 1.853 10 10 EDCE CCCC[C@H](NC(N)=O)C(=O)NCc1ccc2cccnc2c1O 862028031 NPMRBRTZYIPXOX-ZDUSSCGKSA-N 330.388 1.784 10 10 EDCE NC(=O)CCCCC(=O)NCc1ccc(N2CCSCC2)cc1 779607301 QJFVFOFZDHZWQM-UHFFFAOYSA-N 335.473 1.902 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](O)Cc1cnn(C)c1 786838214 NVVYSAPJBOIKMO-QGZVFWFLSA-N 330.432 1.438 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2C(=O)CC[C@H]2C1 897272767 KFEUUXALKMSYID-JTQLQIEISA-N 332.381 1.759 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC3(CC2)CNC(=O)C3)cc1 1137108563 GCWIKAFIHYRQHW-UHFFFAOYSA-N 329.360 1.591 10 10 EDCE C[C@H](NC(=O)c1ccc(S(N)(=O)=O)cc1F)c1ccccc1O 1302538497 SMDFWSFHHOAFKV-VIFPVBQESA-N 338.360 1.670 10 10 EDCE O=C1CN(C(=O)Cc2ccc(O)c(O)c2)CN1CCC(F)(F)F 1158377671 YBXWETXDSLVJBO-UHFFFAOYSA-N 332.278 1.221 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C)[C@@H](CO)C2)cc1 1151358955 KRLNYVZAJFFURM-GOSISDBHSA-N 327.428 1.843 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(C(=O)NCCCN=[N+]=[N-])CCCO1 1964885383 ZWQKVATWRHZZBH-AWEZNQCLSA-N 327.385 1.877 10 10 EDCE CCn1cnc(C(=O)NC[C@H](O)CNCc2ccc(OC)c(C)c2)c1 1320295138 IGGJFRRLRHXGTK-OAHLLOKOSA-N 346.431 1.101 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCC[C@@]2(C1)CC2(F)F 1326546542 CMZCFYFWNOXEKA-INIZCTEOSA-N 338.354 1.998 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@H](C)NC(C)=O)cc1C 1277750888 DGWQNJKBAUJBLF-ZIAGYGMSSA-N 335.448 1.465 10 10 EDCE COc1cc(C)cc(CNCc2nc(O)c3c(n2)CCOC3)c1O 1353604412 BOKKJZBKYYXBGS-UHFFFAOYSA-N 331.372 1.567 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@]2(C)CCC(=O)N2)cc1C 1507121674 GHPFORFNZCBLGU-LIRRHRJNSA-N 347.459 1.609 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1nc(-c2ccncc2)no1 1543764039 YAKHNPRDZKBCBG-UHFFFAOYSA-N 326.312 1.402 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@H](C)N1CCOCC1 1543149222 ZPEXIIGVTLVWQO-AWEZNQCLSA-N 345.447 1.649 10 10 EDCE NC(=O)c1ccn(-c2ccccc2NC(=O)c2cc(O)cs2)n1 1628006400 DFSKLGIVWZUNES-UHFFFAOYSA-N 328.353 1.991 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(c2ccccn2)=NO1 1556157740 IWWHCNOVUYNOHL-APPDUMDISA-N 341.367 1.733 10 10 EDCE NC(=O)CCOc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1630024379 YOWZTHSBEWXGIL-UHFFFAOYSA-N 330.340 1.533 10 10 EDCE COc1ccc(N2CCN(C(=O)CCCCCO)CC2)c(OC)c1 1642103519 CDXCEFNVGYWQCF-UHFFFAOYSA-N 336.432 1.905 10 10 EDCE O=C(CNC(=O)NCc1ccco1)NCc1cc(Cl)ccc1O 1583816398 IJHQQTRIZZFMPV-UHFFFAOYSA-N 337.763 1.754 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)NCc1cn(C)c(=O)nc1O 1676914511 KJQQDFWNUHOKCH-UHFFFAOYSA-N 346.387 1.313 10 10 EDCE CCOC(=O)N1CCN(/N=N/c2ccc3c(c2)OCC(=O)N3C)CC1 1860487693 JSTDZFHOWIZGCJ-ISLYRVAYSA-N 347.375 1.815 10 10 EDCE C[C@@]1(O)CC[C@H](O)c2c1ccc1c2C(=O)C(=O)c2c(CO)coc2-1 102474703 GSUXVWUEFDCUBE-BBATYDOGSA-N 328.320 1.853 10 10 EDCE biogenic Cc1cc(=O)c(OCC(=O)c2ccc(O)c(O)c2)cn1CCCCN 1857914063 MPKWEMHJJSJSRD-UHFFFAOYSA-N 346.383 1.569 10 10 EDCE NCc1ccc(N2C[C@@H]3[C@H](C(N)=O)[C@@H]3C2)c(F)c1Br 2136612720 IBISIQYRDQTUCA-DIYOJNKTSA-N 328.185 1.214 10 10 EDCE CC(C)(C)OC(=O)N1CCSC[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980379031 ZRUGKJRCXRPRCV-IJLUTSLNSA-N 342.461 1.605 10 10 EDCE CO[C@]1(C(=O)NCCCN=[N+]=[N-])CCN(C(=O)OC(C)(C)C)C1 1985094324 NHCULTQWZWIURM-CQSZACIVSA-N 327.385 1.829 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985101817 YGBYZFDUQHUHBX-SNVBAGLBSA-N 327.385 1.733 10 10 EDCE CN1CCc2cc([C@H](N)[C@](C)(O)CNC(=O)OC(C)(C)C)ccc21 1999526575 BRMXLPXATZRLGT-MAUKXSAKSA-N 335.448 1.954 10 10 EDCE COCC1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CN(C(=O)OC(C)(C)C)C1 2003421856 QCDORFNCXASWQZ-HAQNSBGRSA-N 340.420 1.136 10 10 EDCE CNCc1ccc(N2CCN(CCOC)CC2)cc1Br 2154742909 SPDJQWRWPIVZQN-UHFFFAOYSA-N 342.281 1.937 10 10 EDCE O=C(O)[C@@H]1CCCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2053821496 DNYGMUALMMAMFW-INIZCTEOSA-N 330.384 1.612 10 10 EDCE CCN(C[C@H](C)O)c1cc2c(cc1Br)[C@H](NC)C(=O)N2 691437298 WYVNUCNNVKNWIT-SDBXPKJASA-N 342.237 1.869 10 10 EDCE CCN(CC)C(=O)[C@@H]1CCCN1C(=O)c1cnn2c(O)cc(C)nc12 2062102599 LFRGPUDOUMDYGF-ZDUSSCGKSA-N 345.403 1.216 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)c(Br)c1 2201288396 JXOAAXQTCRPTSK-HJUHTLPRSA-N 338.249 1.897 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213589363 VZYSBULYVRQLCD-OPRDCNLKSA-N 340.384 1.103 10 10 EDCE COCCS(=O)(=O)CCNCc1cc(Cl)cc(Cl)c1O 2204671082 QZDISNOCQNMNMA-UHFFFAOYSA-N 342.244 1.850 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@H]1C(=O)NCc1ccc(N)cc1 2253581544 KPZXQDCMECHCPV-CABCVRRESA-N 349.431 1.645 10 10 EDCE Cc1ccc(C=C2C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)cc1 2297345108 RHPMLZGTJACOTA-UHFFFAOYSA-N 348.409 1.616 10 10 EDCE Cc1nc(CN(C)C(=O)C=Cc2ccc(N3CCOCC3)cc2)no1 2307539689 RHSMBQPGYUNCOC-UHFFFAOYSA-N 342.399 1.886 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)C(=Cc2ccc(F)c(F)c2)SC1=S 2323832115 MIRACACIIDDGMM-VIFPVBQESA-N 345.348 1.612 10 10 EDCE Cc1ccc(CNC2CC(NC(N)=O)C2)c(O)c1Br 2352683973 MXDWBKIIDGECHN-UHFFFAOYSA-N 328.210 1.752 10 10 EDCE COC(=O)CCC(=O)Nc1cc(N2CCN(C)CC2)ccc1OC 74586786 ZPUJTKOGEOMVDM-UHFFFAOYSA-N 335.404 1.339 10 10 EDCE COc1cc(Br)c(Br)c([C@@H](N)CO)c1O 72199926 SDZVASBUSQDVHQ-YFKPBYRVSA-N 340.999 1.918 10 10 EDCE CN(c1ccc(CN)cc1Br)[C@@H]1CCS(=O)(=O)C1 212968928 HPCQOQBLHPULHL-SNVBAGLBSA-N 333.251 1.531 10 10 EDCE C[C@H](NC[C@@H]1CN(C)CCO1)c1ccc(N2CCOCC2)c(F)c1 180500127 OIBRNDOXIJZJKV-GOEBONIOSA-N 337.439 1.644 10 10 EDCE COc1ccc(CCN2C(=O)CN(Cc3ccccc3O)C2=O)cn1 530215126 XHXHTMFGZKGVQO-UHFFFAOYSA-N 341.367 1.803 10 10 EDCE CCOC(=O)c1cn(C)nc1NC(=O)NCCc1ccc(O)c(O)c1 273211379 JUFHJQCZERPZKX-UHFFFAOYSA-N 348.359 1.372 10 10 EDCE Oc1cc2c(cc1CNC[C@@H]1CCC3(CCOCC3)[C@H]1O)OCO2 282843846 OZDUOVJQHWXDRV-SJCJKPOMSA-N 335.400 1.778 10 10 EDCE CN1CCN(C(=O)CCNCc2cc(Cl)c(F)cc2O)CC1 293668853 QGLMBSWJRKVQPQ-UHFFFAOYSA-N 329.803 1.438 10 10 EDCE COCCOCCNC(=O)NCc1cc(Br)ccc1O 804986246 IMRNRNJKKCDYEP-UHFFFAOYSA-N 347.209 1.617 10 10 EDCE CN1CCN(c2ccc(/C=C\C(=O)O)c(Br)c2)CC1=O 394360290 CMLKFIIBMIPZMF-HYXAFXHYSA-N 339.189 1.825 10 10 EDCE Cc1cc(CC(=O)N2CC[C@](O)(C(N)=O)C2)c(C)n1-c1ccccc1 832806154 IJAFNIIJXNVHJN-LJQANCHMSA-N 341.411 1.085 10 10 EDCE O=C(/C=C\Cn1cncn1)NCc1ccc(N2CCSCC2)cc1 900254242 DAOFDWFOILAABP-UPHRSURJSA-N 343.456 1.704 10 10 EDCE C[C@@H](NC(=O)CC(F)(F)CN)c1ccc(N2CCOCC2)cc1 846673145 OFPIZRFECMEBER-GFCCVEGCSA-N 327.375 1.685 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@H]2CN(C3CC3)C(=O)O2)cc1 847276224 FNJCXRGUBNDAOI-HNNXBMFYSA-N 332.404 1.535 10 10 EDCE COc1cc(O)c(CNCC(C)(C)[C@@]2(O)CCOC2)cc1OC 843428664 LOZTUALTKIUAHD-QGZVFWFLSA-N 325.405 1.677 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc([N+](=O)[O-])[nH]3)C2)cc1 855230877 FXISMGBGCGETFR-LLVKDONJSA-N 330.344 1.940 10 10 EDCE CCn1ncn(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1=O 854627116 FJAKVEUQDUMWLZ-UHFFFAOYSA-N 339.399 1.785 10 10 EDCE Nc1ccc(CC(=O)NCC2CCN(C3CCOCC3)CC2)cc1 852844000 MLYFSARARFPYEG-UHFFFAOYSA-N 331.460 1.819 10 10 EDCE CO[C@@H](CS(=O)(=O)NNc1nc2cccnc2s1)C(C)C 857225863 VIKPKKRVYKCKNM-JTQLQIEISA-N 330.435 1.609 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CN)CC(C)C)C2)cc1 851664577 FWLLBEJFAFLAQL-GJZGRUSLSA-N 334.464 1.947 10 10 EDCE CN1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)Cc1ccc(N(C)C)cc1 931395818 DEBWDDXYUKHUCB-HDICACEKSA-N 330.476 1.489 10 10 EDCE COc1ccc(N2CCN(CCNc3nc(C)nc(N)n3)CC2)cc1 865475982 HZUPTMRPAVOPDL-UHFFFAOYSA-N 343.435 1.005 10 10 EDCE COCCn1ncc(C(=O)N2CCOc3cc(N(C)C)ccc32)c1C 866203874 SJUTUYYGJRYXCN-UHFFFAOYSA-N 344.415 1.943 10 10 EDCE COCCN(CC1CCN(C)CC1)C(=O)c1ccc(C)c(O)c1O 869763216 ZAMJRYBFZCFKOZ-UHFFFAOYSA-N 336.432 1.837 10 10 EDCE COC(=O)c1cc(OCC2CCS(=O)(=O)CC2)ccc1N(C)C 865396107 KAPJBZHXSIMBAG-UHFFFAOYSA-N 341.429 1.743 10 10 EDCE Cc1cc(NS(=O)(=O)c2nn(C)cc2[N+](=O)[O-])c(C)c(C)c1O 863407179 OVDVXSJZPXELSC-UHFFFAOYSA-N 340.361 1.760 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C[C@H]1C 867504450 VUWGQHPXFJRNLB-CZPYZCIJSA-N 334.416 1.896 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)CCO1 1119768895 JPCBMYVCIFMXLK-NSHDSACASA-N 343.474 1.379 10 10 EDCE CO[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1C 785424855 VZKWSEHUCZAIAC-BBRMVZONSA-N 333.432 1.252 10 10 EDCE COC(=O)c1c(CN2CC[C@H](NC(C)=O)C2)c2cc(F)ccc2n1C 895035089 WVDOFGBUDXWUBU-ZDUSSCGKSA-N 347.390 1.814 10 10 EDCE COc1cc(O)c(CNCCN2C[C@@H]3CCCCN3C2=O)cc1OC 895345136 XVUCFCOBMFFNHD-AWEZNQCLSA-N 349.431 1.789 10 10 EDCE C[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)[C@H]1CN(C)CCO1 897077989 RERMOLWXHPKUFC-TVQRCGJNSA-N 336.413 1.761 10 10 EDCE O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1cc2cc(O)c(O)cc2s1 895989342 ADNJRFXLTUIECM-NWDGAFQWSA-N 348.424 1.906 10 10 EDCE CC(C)OC(=O)N1CCC(NC(=O)Cc2ccc(O)c(O)c2)CC1 1146765165 IQRRTMITSVNFAT-UHFFFAOYSA-N 336.388 1.766 10 10 EDCE O=C1C[C@](C(=O)NCc2c(O)cccc2O)(c2ccccc2)CN1 1156885749 NBTJHOFEIQGNLI-GOSISDBHSA-N 326.352 1.172 10 10 EDCE CNCc1ccc(N2CCO[C@@H](CCO)C2)c(Br)c1 2116230279 QSPYXMKDNWMRCV-LBPRGKRZSA-N 329.238 1.756 10 10 EDCE CNCc1ccc(N2CC(CNC(N)=O)C2)c(Br)c1 2130745247 ALQPJHWPWYCXBY-UHFFFAOYSA-N 327.226 1.273 10 10 EDCE CC[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@@H](CC)O1 1348651537 IDBKUFRWUBOTAT-ZIAGYGMSSA-N 332.400 1.650 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)C2(C(N)=O)CC2)cc1C 1274325209 KXINQJPXWNIGDF-ARJAWSKDSA-N 331.416 1.031 10 10 EDCE COc1cc(C(=O)N[C@@H](C)C[C@@H](C)NC(=O)C(F)F)cc(OC)n1 1288499893 AOYNPZCPWOAWQU-DTWKUNHWSA-N 345.346 1.377 10 10 EDCE C[C@H](NCCCO)[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1716975279 KZZMVNXOSDERSB-JSGCOSHPSA-N 347.419 1.672 10 10 EDCE CO[C@@H](C)C(=O)N(C)[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1718173527 VFSYLMMQFKFFQP-MNOVXSKESA-N 349.391 1.461 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CCC(=O)NC2)cc1C 1482302264 DVTMRQCBAKGKDB-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE COc1cc(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)on1 1714228277 HZFWVYXQXRSINP-GFCCVEGCSA-N 333.388 1.908 10 10 EDCE Cn1cnc(-c2noc(-c3nnsc3N)n2)c1Br 1923224590 KSEKZFMZGGVRPU-UHFFFAOYSA-N 328.155 1.333 10 10 EDCE CNS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccccc2O)cn1 1642831160 ROMJUYNDWCCBMH-JTQLQIEISA-N 335.385 1.186 10 10 EDCE Cc1csc2ncc(C(=O)NCc3ccc(O)cc3O)c(=O)n12 1570462146 FVHHTKYHJFMSTN-UHFFFAOYSA-N 331.353 1.406 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccc(N2CCOCC2)cn1 1587855545 IXRMQVNSYGHEGD-UHFFFAOYSA-N 329.356 1.511 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2n[nH]c(C)c2O)cc1C 1774112231 JTGUQTGZTZMXLU-LBPRGKRZSA-N 346.431 1.991 10 10 EDCE CO[C@@H](C(=O)O)C1CN(Cc2ccc(Br)cc2O)C1 1875982615 VJJIBRJTWLXHCC-GFCCVEGCSA-N 330.178 1.686 10 10 EDCE C[C@@H](COCC(=O)C(=O)C[C@H]1C[C@H](N)C1)NC(=O)OC(C)(C)C 1982091425 NUZAWFGDQCXNSA-SRVKXCTJSA-N 328.409 1.182 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)CNCc1ccc(F)c(F)c1O 1985856892 LHJNCRNZZIMATC-JTQLQIEISA-N 332.347 1.646 10 10 EDCE CO[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 2014405446 UNGOQANPNUEUNE-NWDGAFQWSA-N 339.396 1.922 10 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C[C@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2199533020 SVGVGHINUXPFQT-PDRAWDMGSA-N 342.233 1.823 10 10 EDCE O=C(O)[C@H]1CN(Cc2ccc(Br)cc2O)C2(CC2)CO1 2183985175 XCURDQRCMLLBSA-GFCCVEGCSA-N 342.189 1.973 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NC(=O)Nc2ccc(N)cc2)C1 1908508271 YPQIRDKZSFDZMY-CHWSQXEVSA-N 336.392 1.371 10 10 EDCE CC(C)(C)OC(=O)N=c1[nH][nH]cc1CNC(=O)c1ccc(O)c(O)c1 2054416307 VZGFFVDUGJZACT-UHFFFAOYSA-N 348.359 1.520 10 10 EDCE O=C1C[C@]2(CCN(c3ccc(CO)c(Br)c3)C2)CN1 2107033019 SPPHAFLSMXSYDJ-CQSZACIVSA-N 325.206 1.658 10 10 EDCE CN[C@@H](c1ccccc1O)[C@H](O)c1nn(C)nc1Br 2111421693 BOFSXPPHWGMTBW-ONGXEEELSA-N 327.182 1.277 10 10 EDCE O=S1(=O)C[C@@H]2CCN(c3ccc(CO)c(Br)c3)[C@H]2C1 2094927050 MGVNUPHIHPUDPB-GWCFXTLKSA-N 346.246 1.565 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CC(=O)N(C)C2=O)c1O 2236048828 ISHAPFWZNRVZBN-VIFPVBQESA-N 343.177 1.010 10 10 EDCE CSc1ncc(CNC(=O)N[C@H](C(=O)O)[C@@H](C)SC)s1 2284494725 QRJUIEBHFBKCMT-SVRRBLITSA-N 335.476 1.869 10 10 EDCE CSc1ncc(CNS(=O)(=O)N2CCCC[C@@H]2CO)s1 2284500681 TVALOTFCRCNVMM-SECBINFHSA-N 337.492 1.046 10 10 EDCE OCc1ccc(N2C[C@@H]3CC[C@H](CO)O[C@H]3C2)c(Br)c1 2289341576 WHJSCZCFHJPOAT-ZOWXZIJZSA-N 342.233 1.918 10 10 EDCE CNC(=O)[C@@H]1CN(C(=O)/C=C/c2ccc(C)nc2)c2ccccc2O1 493645880 HPUWWOOWQKEHQV-FVNWOWOISA-N 337.379 1.943 10 10 EDCE CC(C)(C)OC(=O)NOCC(=O)N1CCc2cc(O)c(O)cc2C1 2302401098 FKYGFIOWLVGTHT-UHFFFAOYSA-N 338.360 1.439 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NC[C@H]1CC[C@@H](O)C1 2311487613 QCVWPAYWELRDNA-FUHWJXTLSA-N 330.428 1.814 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)c(Br)c1 2336465849 MLNBMXFAPSKOJP-PLMOITTCSA-N 346.246 1.736 10 10 EDCE Oc1cc(Br)ccc1CNC[C@@H]1C[C@@H]2C[C@H]1[C@H](O)[C@@H]2O 2355453031 PLZSZCKUIKHJMQ-CFEZUGBKSA-N 342.233 1.622 10 10 EDCE Cc1cc(O)cc(=O)n1[C@@H](C)C(=O)NCc1ccc(N(C)C)c(F)c1 176211764 OWTVDJOZKZIEQD-LBPRGKRZSA-N 347.390 1.945 10 10 EDCE COCC(=O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951833641 PPSHSJHPBMVGIS-LLVKDONJSA-N 325.361 1.749 10 10 EDCE CN1CCCc2cc(/C=C\C(=O)Nc3cnn(CC(N)=O)c3)ccc21 96291714 LTXXISZTJVJFHW-ALCCZGGFSA-N 339.399 1.403 10 10 EDCE CCN(CC(=O)OC)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 264657081 RYIRRGCHTGOLMG-RMKNXTFCSA-N 332.400 1.558 10 10 EDCE Cc1ccc(CN2C[C@]3(CO)C[C@@]3(CO)C2)c(O)c1Br 2381134435 CGQPJWHGJNKYCN-GJZGRUSLSA-N 342.233 1.640 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CO[C@H](C)CN2)c(O)c1Br 2380746832 QIIPLRVWXVGSBF-KOLCDFICSA-N 343.221 1.456 10 10 EDCE CC(=O)C(=O)COC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O 808499314 SIWCLQOTVPWEBT-GFCCVEGCSA-N 341.772 1.844 10 10 EDCE CS[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@@H]1N1CCCC1 294885670 GKKLDNGILPPYAZ-AAEUAGOBSA-N 340.420 1.889 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@H]1CCNC1=O 824311056 PBMPAAJSKMMTIL-INIZCTEOSA-N 330.432 1.707 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)c([N+](=O)[O-])c1 828988269 VAQJVHLCVIQLNB-KUVDPZLZSA-N 331.372 1.921 10 10 EDCE Cc1cc(O)c(CN2CCN(S(C)(=O)=O)[C@H](C)C2)c(Cl)c1 827265655 LUQZXOHINUSCPX-LLVKDONJSA-N 332.853 1.820 10 10 EDCE Cn1ccc(N2CCC[C@@H](N3CCCc4cc(CN)ccc43)C2=O)n1 844218940 GBQAYTXUHHUTBE-QGZVFWFLSA-N 339.443 1.827 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)[C@@H](CN)C(F)(F)F 852762364 KYLMETLGOSQBNH-AWEZNQCLSA-N 346.397 1.532 10 10 EDCE COc1ccc(N2CC[C@H](NCc3nnn(C(C)(C)C)n3)C2)cc1 850347581 UDLZZLFRWRTWPL-ZDUSSCGKSA-N 330.436 1.805 10 10 EDCE CC(C)(C)OC(=O)N1CC(=O)C[C@@H]1[C@@H](N)Cc1ccc(O)c(O)c1 1952924953 KFAGTVFYJDMEIT-QWHCGFSZSA-N 336.388 1.546 10 10 EDCE C[C@@](O)(C[C@H](O)CNCc1ccc(N2CCC(O)CC2)cc1)C1CC1 872215915 LFPOZTRTJJWWEX-VQTJNVASSA-N 348.487 1.649 10 10 EDCE CN1CCCc2cc(CNS(=O)(=O)c3cnc4n3CCC4)ccc21 772561505 OPEVEVDCUDBRAS-UHFFFAOYSA-N 346.456 1.690 10 10 EDCE COC[C@@H](C)CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 783627501 VXUQEWXKOFZPIX-AWEZNQCLSA-N 326.462 1.294 10 10 EDCE COc1ccc2c(c1)CCN2Cc1nccn1S(=O)(=O)N(C)C 788843341 OABCZDDEQHZROI-UHFFFAOYSA-N 336.417 1.109 10 10 EDCE C[C@@H]1O[C@H](C)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H]1C 783814057 NQMWKAFQMIWCCK-VWYCJHECSA-N 342.417 1.402 10 10 EDCE COc1cc(O)c(CNCCN2C[C@H]3CCCCN3C2=O)cc1OC 895345139 XVUCFCOBMFFNHD-CQSZACIVSA-N 349.431 1.789 10 10 EDCE CO[C@H]1CC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1335546075 FUKWRICWNRKRKX-GJZGRUSLSA-N 337.395 1.144 10 10 EDCE CC[C@@H](CNC(=O)c1cnn(C)c1N)NCc1ccc(OC)c(C)c1 1267800695 VHFOZIQYNGEEBT-AWEZNQCLSA-N 345.447 1.618 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)C[C@@H]2CCNC2=O)cc1C 1268797406 MJBUPYGWVOCDMQ-INIZCTEOSA-N 347.459 1.468 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)Cn2cc(C)cn2)cc1C 1274694709 WENZZDWCRGVRAJ-OAHLLOKOSA-N 330.432 1.803 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N1CCN2C(=O)NC[C@@H]2C1 211554912 NKJIYOANCUTPPY-MWLCHTKSSA-N 340.221 1.925 10 10 EDCE C[C@H](NCCO)[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1501091660 POCNBZVAXCMBLF-AAEUAGOBSA-N 333.392 1.282 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)Cc2cnoc2)cc1C 1284436231 QWVJTSKGZBXVSN-INIZCTEOSA-N 347.415 1.143 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCc2nc[nH]n2)c1 1298359571 OVCNLEKELYJHPK-UHFFFAOYSA-N 337.383 1.997 10 10 EDCE CO[C@H](C)C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1703326798 XOEDZHBDUMJKQN-SNVBAGLBSA-N 335.364 1.120 10 10 EDCE CCOC1CC(O)(Cn2c(C)nnc2N(C)Cc2ccccc2O)C1 1548036676 QSPPKRMTXBCXOB-UHFFFAOYSA-N 346.431 1.859 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCc2ccc(O)c(O)c2)s1 1545637155 OBDOFIFLPMKCRJ-UHFFFAOYSA-N 327.383 1.493 10 10 EDCE Cc1nsc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)n1 1627930622 VBJROYMVOYDLOG-UHFFFAOYSA-N 334.401 1.149 10 10 EDCE CO[C@@H](C)CNC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1483606736 FCDLDOMQACUSMV-NHYWBVRUSA-N 347.419 1.982 10 10 EDCE CC(C)(O)[C@@H](Oc1ccccc1)C(=O)NCc1c(O)cccc1O 1558536170 VJJXBSSGFUNHPN-INIZCTEOSA-N 331.368 1.933 10 10 EDCE Cn1cc(Br)c(C(=O)NCc2ccc(O)cc2O)n1 1626837859 HHDSXGVSAJROAG-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)Cc2ccn(C)n2)cc1C 1567214573 ATFPYHKRORTGCT-HNNXBMFYSA-N 344.459 1.964 10 10 EDCE C[C@@H]1C[C@H]1C(=O)NCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1496380850 NXWBOZSPFGHAEO-ZWNOBZJWSA-N 331.376 1.693 10 10 EDCE CCOCCN(C)CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1568506445 JSNCJYCFRQOGDL-UHFFFAOYSA-N 335.408 1.889 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1ccc(-n2cncn2)nc1 1639621488 HCAGTYGSHGTVAB-UHFFFAOYSA-N 346.350 1.846 10 10 EDCE COc1ccc(CNC[C@H]2CCCN(C(=O)CNC(C)=O)C2)cc1C 1566882745 UZHIJAGVHNSERN-QGZVFWFLSA-N 347.459 1.468 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2ccoc2)cc1C 1571575517 YMNDMWLHZBMGQA-MRXNPFEDSA-N 332.400 1.819 10 10 EDCE C[C@H](CNC[C@@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1732985509 PLTDYHHENQCIRO-NEPJUHHUSA-N 333.392 1.593 10 10 EDCE Cc1ccc(C(=O)NCc2c(O)cccc2F)cc1S(N)(=O)=O 1596913457 ZBLOUJFSMLYRPO-UHFFFAOYSA-N 338.360 1.417 10 10 EDCE CC(=O)NC[C@](C)(NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1688812257 DBTBFINNPRFCIV-INIZCTEOSA-N 331.376 1.884 10 10 EDCE COc1ccc(CNC2(CNC(=O)CCc3nc[nH]n3)CC2)cc1C 1699649664 ULIHHLIZDDCCKO-UHFFFAOYSA-N 343.431 1.493 10 10 EDCE COc1ccc(CN[C@@H]2CCC[C@@H](NC(=O)CC(N)=O)C2)cc1C 1690764746 DWAAUTKRXKAULM-HUUCEWRRSA-N 333.432 1.396 10 10 EDCE NC(=O)N1CCC(NCc2ccc(N3CCSCC3)cc2)CC1 163581855 PSFMYDPAMPGCND-UHFFFAOYSA-N 334.489 1.873 10 10 EDCE Cn1ncc([C@@H](N)c2ccccc2O)c1I 1936977343 UICVHTKMHNPGRQ-JTQLQIEISA-N 329.141 1.778 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC[C@]12C[C@@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 2004881386 MCHAGWWWFNTFCE-BDIZYMIYSA-N 336.432 1.945 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CCCOC1 2003639305 ZAUCBZLTPAZOHD-PRXAMGSTSA-N 340.420 1.326 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC(N=[N+]=[N-])CC1)C(C)(C)O 2014483203 QBWDXWZDTKKRGP-LLVKDONJSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)NC(=O)CCc1ccc(N)cc1 2011423494 SNLRVIMJMRLWQC-AWEZNQCLSA-N 337.420 1.203 10 10 EDCE C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)c1cc(O)c(O)c(O)c1 2015119350 ITQFNHGQPAGWGL-VIFPVBQESA-N 340.376 1.837 10 10 EDCE CN(C)c1ccc([C@@H](CN)N2CC(NC(=O)C(F)(F)F)C2)cc1 2018846559 QLRDUZOOGRECRW-CYBMUJFWSA-N 330.354 1.115 10 10 EDCE NCc1cn(C2CN(Cc3c(O)cccc3Br)C2)nn1 713307359 QJUUODPOJXGJAY-UHFFFAOYSA-N 338.209 1.262 10 10 EDCE CN(C)CC1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 382346844 NOKCTFXYHDWCME-ZDUSSCGKSA-N 339.237 1.399 10 10 EDCE O=C1NC[C@]2(CCCN(c3ccc(CO)c(Br)c3)C2)N1 2177668536 MLJDXMLFETWCNN-AWEZNQCLSA-N 340.221 1.593 10 10 EDCE O=S1(=O)CCC2(CC1)OCC[C@@H]2NCc1ccc2c(c1)CCO2 2063085404 QSRKIYSQRVWTJG-INIZCTEOSA-N 337.441 1.447 10 10 EDCE NCc1ccc(N2CC[C@H]3OCC(=O)N[C@H]3C2)c(Br)c1 2185522192 NVSUUQWZJRPHLW-WCQYABFASA-N 340.221 1.002 10 10 EDCE NCc1ccc(N2C[C@@H]3OCCO[C@@H]3C2)c(F)c1Br 2093347456 VHQADYNHTBKSCJ-PHIMTYICSA-N 331.185 1.651 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)cc1Br 2205616970 WQZLPOAJSJDEMI-RDBSUJKOSA-N 347.228 1.439 10 10 EDCE CN(C)c1ccc(OC[C@](N)(C(=O)O)C2(Br)CC2)cc1 2237685357 SLGGWGRJIRWCFQ-AWEZNQCLSA-N 343.221 1.841 10 10 EDCE CC[C@@H](C)NCc1ccc(N2C[C@H](O)[C@H](O)C2)cc1Br 2240082079 RKIGJHNMKBUZPG-KMUNFCNLSA-N 343.265 1.879 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cc(CN)n(C)c2)s1 2284687847 IHCJJBSMFWJXNF-UHFFFAOYSA-N 332.476 1.141 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NC[C@@]1(O)CCSC1 2297772924 ZHHHASUQRNCQAY-SFHVURJKSA-N 348.468 1.521 10 10 EDCE O=S1(=O)C[C@H]2CN(Cc3cc(Br)ccc3O)C[C@H]21 2314965710 VMXANXHPEARWGE-BXKDBHETSA-N 332.219 1.384 10 10 EDCE Cn1cc(Br)nc1CNCCc1ccc(O)c(O)c1 2353802440 BRMBDDCBUCBOIG-UHFFFAOYSA-N 326.194 1.926 10 10 EDCE COCCNC(=O)c1ccc(NC(=O)Cc2ccc(N)cc2)cc1 66153955 BZOGVCZYZCFUQR-UHFFFAOYSA-N 327.384 1.826 10 10 EDCE Cc1noc(COCC(=O)NCc2c(O)ccc3c2CCCC3)n1 174521686 UZEQBTBWCHSNCR-UHFFFAOYSA-N 331.372 1.795 10 10 EDCE COc1ccc(OCC(=O)NC2=NN(c3ccccc3)C(=O)C2)cc1 21024420 FNKHPYBJWIPMRT-UHFFFAOYSA-N 339.351 1.941 10 10 EDCE CN1C[C@H](NC(=O)NCc2c(O)ccc3c2CCCC3)CCC1=O 173246814 BPVYJTVNKWAVIR-CYBMUJFWSA-N 331.416 1.691 10 10 EDCE CC[C@@H]1C(=O)NCCN1c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 267301303 UUNLLPXDQHJAGH-HOSRBBHYSA-N 333.344 1.496 10 10 EDCE CN(C[C@@H]1CCCO1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 264035702 UEAOPPKGARMEMR-NSHDSACASA-N 328.390 1.015 10 10 EDCE Cc1cc(C[C@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2)n[nH]1 283677054 ZKDIHQSXRAQCQX-LBPRGKRZSA-N 343.431 1.148 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@H](O)CCN2)c(O)c1Br 2380751081 HLSBBEHNHHZAHB-MNOVXSKESA-N 343.221 1.192 10 10 EDCE C[C@H]1CN(CCO)CCN1Cc1cc(Br)ccc1O 825338591 QTOWICIZKDBQFN-NSHDSACASA-N 329.238 1.653 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1[C@H]2COC[C@H]21 829262135 AEOSTEIQUJCDCJ-HALDLXJZSA-N 334.391 1.295 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H](OC)[C@H]3CCOC3)CC2)cc1 822918953 GFHRYUHKLFHJIH-YJBOKZPZSA-N 348.443 1.785 10 10 EDCE CCON(C)C(=O)CNCc1cc(Br)cc(OC)c1O 846062534 GNHKBBTVEMTZAE-UHFFFAOYSA-N 347.209 1.663 10 10 EDCE CC1(C)CN(CC(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 856216083 RUBYKQKXINYTDZ-UHFFFAOYSA-N 331.460 1.606 10 10 EDCE COCCN1CCC[C@@H]1CN[C@@H](C)c1cc(C(=O)OC)ccc1O 756535645 NVTDMVFJNAEVAY-DZGCQCFKSA-N 336.432 1.940 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)COC3CCC(N)CC3)C2)cc1 851639691 JTTFPZKMTKUJOA-SWKXRBFHSA-N 347.459 1.677 10 10 EDCE CCOC[C@H](C(=O)OC)N(C)Cc1cc(F)cc(C(C)=O)c1O 764345734 DDTXLZUUYPVXOV-CQSZACIVSA-N 327.352 1.744 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cc(Cl)[nH]n2)c1 763233269 PDHBOWDOIKKUDX-UHFFFAOYSA-N 330.753 1.393 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCO[C@H](C2CC2)C1 776856258 LNMUXGDEGZPREY-SFHVURJKSA-N 345.443 1.844 10 10 EDCE CC[C@]1(C(=O)O)CCCN(C(=O)C(=O)N(C)Cc2ccccc2O)C1 1119703226 MMPGLMVOUWEPQF-SFHVURJKSA-N 348.399 1.454 10 10 EDCE CN1CCN(c2cccc(C(=O)NCc3ccc(O)c(O)c3)n2)CC1 778917100 WNCVUDHGHHMOFB-UHFFFAOYSA-N 342.399 1.175 10 10 EDCE CC[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)C[C@]2(CCOC2)O1 794305324 WCVKVTWSTQLXCR-JRGNEYMUSA-N 333.384 1.908 10 10 EDCE NS(=O)(=O)c1cc(C(=O)NCc2c(O)cccc2F)ccc1F 1303879353 ZDLGHTONLJCSDV-UHFFFAOYSA-N 342.323 1.248 10 10 EDCE O=C(NCc1c(O)cccc1O)C1=NN(c2ccccc2)C(=O)CC1 1156880828 CROJVIDAVBTVHR-UHFFFAOYSA-N 339.351 1.897 10 10 EDCE CC(=O)N1C[C@@H](C(=O)NCc2c(O)cccc2F)Oc2ccccc21 1156164191 RCRCFOSIVTUXER-KRWDZBQOSA-N 344.342 1.962 10 10 EDCE Cc1nc([C@H]2CCN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)n[nH]1 1162028746 IFWGCJZXRIMFRE-NSHDSACASA-N 327.348 1.905 10 10 EDCE Cn1c(Br)nnc1CCNCc1c(O)cccc1F 2128771857 MNOJABGFPBQHQL-UHFFFAOYSA-N 329.173 1.755 10 10 EDCE CNCc1ccc(N(C)[C@H]2CC(=O)N(C)C2)c(Br)c1 2131960671 MXSVZRXGKZBDOH-NSHDSACASA-N 326.238 1.835 10 10 EDCE COC(=O)C[C@@H]1COCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1298839155 JJOPIDOZFRZZKV-GFCCVEGCSA-N 334.332 1.253 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1sccc1S(N)(=O)=O 1545501193 LFVSAYRZWVJTJQ-UHFFFAOYSA-N 326.399 1.373 10 10 EDCE O=C1CC(c2ccc(NC(=O)c3cccc(O)c3O)cc2)CC(=O)N1 1625322210 VVIDIRBBQWGDGA-UHFFFAOYSA-N 340.335 1.870 10 10 EDCE CC1(C)CN(c2ccc(CN)c(Br)c2)C[C@@H](CO)O1 228156693 SJVGCWXOHDYDSC-LBPRGKRZSA-N 329.238 1.884 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1CC(=O)C1 1637247334 NSWVENGJAXXSCD-UHFFFAOYSA-N 325.748 1.526 10 10 EDCE O=C(CCCc1nn[nH]n1)N(Cc1ccccc1O)C[C@H]1CCCO1 1632399329 QWDLFXTXBLYVQK-CQSZACIVSA-N 345.403 1.436 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2coc(C(N)=O)c2)cc1C 1569009494 KFHOUQSPCYUVQJ-GFCCVEGCSA-N 345.399 1.604 10 10 EDCE O=C(CNC(=O)c1ccc(F)cc1F)NCc1cccc(O)c1O 1637045878 LTHUGVOSJOIMSL-UHFFFAOYSA-N 336.294 1.422 10 10 EDCE C[C@H](NC(=O)c1cnc2c(c1)c(O)nc(=O)n2C)c1ccccc1O 1587447480 SIQSRXLJUCGLCZ-VIFPVBQESA-N 340.339 1.231 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H](C)SC)cc1C 1667790555 YFCCQHJQPSRQHE-GXTWGEPZSA-N 326.462 1.322 10 10 EDCE CN1CCN(C(=O)OC(C)(C)C)[C@@H](CNCc2ccc(N)cc2)C1 1948861093 AHLHQGPQXIBULG-INIZCTEOSA-N 334.464 1.910 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@]2(CC(C(=O)NCCN=[N+]=[N-])=NO2)C1 1963815834 BXYAYFHUKDOANK-CQSZACIVSA-N 338.368 1.569 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985100425 GWOBUTDCLOMAJQ-GHMZBOCLSA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NCc2c(O)cccc2F)C1 1985827618 NKYRPSGXSJPTRN-JSGCOSHPSA-N 326.368 1.601 10 10 EDCE CNCc1ccc(N2CCSC[C@H]2S(C)(=O)=O)c(Cl)c1 164140837 FNMJILRFZFTEQP-CYBMUJFWSA-N 334.894 1.983 10 10 EDCE CN1CCc2cc(CN[C@@H](CO)CNC(=O)OC(C)(C)C)ccc21 2011425396 XRROTSQUMSBUDS-OAHLLOKOSA-N 335.448 1.654 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2015120629 VIRRGTGBRSBMDK-MGCOHNPYSA-N 338.360 1.589 10 10 EDCE CCn1nnc(Br)c1CNC(=O)Nc1ccc(N)cc1 2156479788 ILPHLQNLFBBSJZ-UHFFFAOYSA-N 339.197 1.964 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@](O)(CO)C2)c(Br)c1 313787824 DFIGGDWIBBJOHU-IINYFYTJSA-N 329.238 1.792 10 10 EDCE NCc1cc(F)c(N2CCn3cnnc3C2)cc1Br 388064040 IZWCJPXZHZWHPJ-UHFFFAOYSA-N 326.173 1.659 10 10 EDCE O=C1Nc2cc(N3CC(O)(C(F)F)C3)c(Br)cc2[C@@H]1O 2172113268 CKVLRDMEQMCCKO-VIFPVBQESA-N 349.131 1.251 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@H](C(=O)N3CC(N=[N+]=[N-])C3)[C@@H]2C1 1908254993 YVSFOTANBBSFIA-SRVKXCTJSA-N 337.380 1.389 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)C[C@H](O)C2)c(Br)c1 2105075441 RCNWLOYXEMVBBB-USWWRNFRSA-N 329.238 1.661 10 10 EDCE CNC(=O)[C@H]1[C@H](C)CCN1c1ccc(CN)c(Br)c1 2090258869 LVUMLAOHOPDOBI-NOZJJQNGSA-N 326.238 1.869 10 10 EDCE NCc1cc(F)c(N2CC(n3ccnn3)C2)cc1Br 2113833243 XPMXLHHEVRNYPF-UHFFFAOYSA-N 326.173 1.700 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3NC(=O)O[C@@H]3C2)c1O 2236092052 JDGQVDWIHUQKQU-GXSJLCMTSA-N 343.177 1.456 10 10 EDCE CC(=O)N1CC[C@@H](OC(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2297815673 OENSXSYDMPWMPH-GOSISDBHSA-N 344.411 1.700 10 10 EDCE CNC(=O)c1cncc(C=CC(=O)N(C)Cc2ccccc2O)c1 2301491089 HZBCUOTYXSJIPN-UHFFFAOYSA-N 325.368 1.819 10 10 EDCE CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(CC)CCN=[N+]=[N-] 2300526240 QCTDVSXIHHVYRQ-JTQLQIEISA-N 343.384 1.602 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)CN(CCN(C)C)C(=O)OC(C)(C)C 2300526207 PQXHUDXIKLNMAP-UHFFFAOYSA-N 342.444 1.944 10 10 EDCE O=S1(=O)C[C@H]2CN(c3ccc(CO)cc3Br)C[C@H]21 2314776762 ZQDPSNIYAWGEEL-BXKDBHETSA-N 332.219 1.175 10 10 EDCE Cc1ccc(CNC(=N)N2CCOCC2)c(O)c1Br 2352636904 HQKXSGTVEMWVKC-UHFFFAOYSA-N 328.210 1.820 10 10 EDCE Cc1ccc(CNS(=O)(=O)c2cn[nH]c2)c(O)c1Br 2352645017 FNVGNNCPWVQLKN-UHFFFAOYSA-N 346.206 1.665 10 10 EDCE Cc1ccc(CNC(=O)C2(C(=O)O)CC2)c(O)c1Br 2352950619 WDAQGNCFVIXTCC-UHFFFAOYSA-N 328.162 1.944 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2355336015 KCBSCCLWQDNUQP-UDQBKAKJSA-N 341.249 1.789 10 10 EDCE COc1cccc(N2C(=O)/C(=C/N3CCCCC3)C(=O)NC2=S)c1 104928338 WMDIBQJLNZWJCF-SDNWHVSQSA-N 345.424 1.813 10 10 EDCE CN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1ccc2ccccc2c1 54190776 YTSYZRSVFUEPTP-PKNBQFBNSA-N 349.390 1.913 10 10 EDCE CN1CCN(CCC(C)(C)NCc2cc3c(cc2O)OCO3)CC1 185892552 BDPPIEMTBUVJPH-UHFFFAOYSA-N 335.448 1.627 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccc(Cc2nnn[nH]2)cc1 180864433 IPMRZMDMHGANID-XBXARRHUSA-N 337.339 1.854 10 10 EDCE O=C(COc1ccccn1)NCc1ccc(N2CCOCC2)c(F)c1 182852450 PEWGTMRIJKVSOX-UHFFFAOYSA-N 345.374 1.753 10 10 EDCE O=C(Cc1ccc(Cl)cc1)NCCN1C(=O)CSC1=S 49755690 IZSZMUKHUIOCQU-UHFFFAOYSA-N 328.846 1.859 10 10 EDCE CCOCCCN1CC[C@H](NC(=O)c2cccc(O)c2O)[C@@H](C)C1 249122491 HVZDHMGMWABUSW-ZFWWWQNUSA-N 336.432 1.965 10 10 EDCE Cn1cc([N+](=O)[O-])c(C(=O)NCc2ccc(N3CCOCC3)cc2)n1 270774905 RGUPJOYXLNJDJO-UHFFFAOYSA-N 345.359 1.095 10 10 EDCE Cc1ccc(CNC(=O)c2nnn(C)c2C)c(O)c1Br 2381133687 RVJQQRXDIAELFV-UHFFFAOYSA-N 339.193 1.830 10 10 EDCE COc1cc(Br)cc(CN2CCOC[C@H](O)C2)c1O 824625268 IJBYNMZBJUPEFE-LLVKDONJSA-N 332.194 1.356 10 10 EDCE Oc1c(F)cc(Br)cc1CN1C[C@H](O)CC12CNC2 2130052296 ALNQBYQZBYFBRE-SNVBAGLBSA-N 331.185 1.202 10 10 EDCE CCS(=O)(=O)N(C)CCCNC(=O)NCc1c(O)cccc1F 914174400 SFBDFAIQWBLXPM-UHFFFAOYSA-N 347.412 1.002 10 10 EDCE C[C@@H]1CN(C(=N)NCc2ccc(N3CCSCC3)cc2)CCO1 849095847 PRCZNEWBWMHQIQ-CQSZACIVSA-N 334.489 1.985 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)N[C@H]2CNCCC2(F)F)c1 842003657 ODLLYNHBTWCSGO-RNCFNFMXSA-N 329.347 1.758 10 10 EDCE C[C@H](NC(=O)N[C@@H]1CCNC[C@@H]1C)c1ccc(N2CCOCC2)cc1 841739973 CUIYTEZNUCYYOI-RLFYNMQTSA-N 346.475 1.881 10 10 EDCE O=S(=O)(NCc1c(O)cccc1F)c1cnn(C2CCC2)c1 921451708 VBJMAVGBRUEJKP-UHFFFAOYSA-N 325.365 1.931 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnc4[nH]nnc4c3)C2)cc1 855228163 WUDKCJXQWHDAOL-GFCCVEGCSA-N 338.371 1.370 10 10 EDCE CO[C@@](C)(CNC(=O)OC(C)(C)C)[C@H](N)Cc1ccc(O)c(O)c1 1952913263 XTQNXSWSQYLKSI-PBHICJAKSA-N 340.420 1.897 10 10 EDCE C[C@@H]1O[C@H](C)[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H]1C 863001294 FXIHVIDLANEYJT-LFNDISMMSA-N 342.417 1.305 10 10 EDCE Cc1ccc(C(=O)N2CCN(Cc3nccn3C)CC2)c(O)c1O 780930460 COCLNYQGSDKFSM-UHFFFAOYSA-N 330.388 1.098 10 10 EDCE COC(=O)[C@@H]1[C@H](CN[C@H]2CCN(c3ccc(OC)cc3)C2)C1(F)F 895229445 VQHKMJIGLLHXEQ-CQDKDKBSSA-N 340.370 1.918 10 10 EDCE O=C(NOCCN1CCCC1=O)c1cc2cc(O)c(O)cc2s1 898938892 CFQYQGRAHDLELD-UHFFFAOYSA-N 336.369 1.596 10 10 EDCE COC(=O)c1c(CN2CN(C)C(=O)[C@H]2C)c2cc(F)ccc2n1C 895083956 NKDDITDZTIQTDT-SNVBAGLBSA-N 333.363 1.724 10 10 EDCE CCC[C@H](CCCS(C)(=O)=O)C(=O)NCc1cccc(O)c1O 1153798696 WMUNRMJHMPHHEB-GFCCVEGCSA-N 343.445 1.955 10 10 EDCE CCN1CC[C@@H]1C(=O)N1CCN(c2ccc(OC)cc2OC)CC1 1169991473 XPMUMARXQKQOKK-MRXNPFEDSA-N 333.432 1.447 10 10 EDCE CN1C(=O)O[C@@H]2CN(c3ccc(CN)c(Br)c3)C[C@@H]21 2120409963 MQVRRJICYJZJAP-NWDGAFQWSA-N 326.194 1.547 10 10 EDCE O=S1(=O)C[C@H]2[C@H](CNCc3ccc(Br)cc3O)[C@H]2C1 2117990198 OUCRAHXGNHJAJA-CNDDSTCGSA-N 346.246 1.535 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@@H](O)C2)cc1Br 2132134725 QFAAJCBYVKKLBI-KBPBESRZSA-N 329.238 1.491 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(O)nc1 1299699204 HPDLKLCDAKTNSK-UHFFFAOYSA-N 330.340 1.698 10 10 EDCE CCOC[C@H](C(=O)OC)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1295064299 JEDHIQSRIXVAOT-GFCCVEGCSA-N 336.348 1.499 10 10 EDCE C[C@H](CCN(C)C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1544677326 RSCVXFFHDVUJJV-CQSZACIVSA-N 337.439 1.866 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@]12COC[C@@H]1C2 1482927854 YRLWPEFRAXMYQN-LPHOPBHVSA-N 332.444 1.978 10 10 EDCE COC(=O)c1cccc2c1CCN2C(=O)/C=C\c1cnc(OC)nc1 1626755313 ZGHFEORTPOSFBK-SREVYHEPSA-N 339.351 1.874 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H](C)CC(N)=O)cc1C 1482316644 JTPATYUVYJABQB-KGLIPLIRSA-N 335.448 1.452 10 10 EDCE COc1ccc(C(=O)NC[C@H](O)CNCc2ccc(OC)c(C)c2)o1 1715608070 LMOXWLDLCLCEJH-CQSZACIVSA-N 348.399 1.486 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](CO)NCC2CCCC2)cc1 1725551160 GUFKUWZFORASFA-HNNXBMFYSA-N 347.419 1.720 10 10 EDCE Cn1cc([C@@H]2C[C@H](NC(=O)Cc3ccc(O)c(O)c3)CCO2)cn1 1636573414 JRXXNNUKVZUMFR-CJNGLKHVSA-N 331.372 1.410 10 10 EDCE Cc1nnc(Cn2nnc(C(=O)N[C@H](C)c3ccccc3O)c2C)o1 1635793697 DHNHRTSKFQKDQY-SECBINFHSA-N 342.359 1.523 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](CN3CCOCC3)C2)cc1 1630150962 XVNJLJURZOHDRO-ZDUSSCGKSA-N 345.403 1.643 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)c2ccoc2)cc1 1720015662 NAPYZCCVNPMNCU-UHFFFAOYSA-N 329.316 1.602 10 10 EDCE C[C@@H](NC(=O)NCc1cc(Cl)ccc1O)c1nnc(O)n1C 1565377338 OXQKJXUAMPLKIJ-SSDOTTSWSA-N 325.756 1.440 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2[nH]c(C)cc2C)cc1C 1568568132 SXNYNPRBLXHCQI-INIZCTEOSA-N 345.443 1.829 10 10 EDCE COC(=O)c1c(NC(=O)/C=C\c2ccc(O)c(O)c2)nc2n1CCC2 1641420814 ADEWVMXQKNZYHS-ALCCZGGFSA-N 343.339 1.679 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)/C=C(\C)C2CC2)cc1C 1734361378 LBCLOZMATJYRIO-VEMDQMBVSA-N 332.444 1.927 10 10 EDCE O=C(CCc1nc(O)c2ccccc2n1)NCc1c(O)cccc1O 1652622922 JSINFNDPEKLZJB-UHFFFAOYSA-N 339.351 1.996 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccon3)cc2)CC1 1652068332 LZUHLDMDDYKSTO-UHFFFAOYSA-N 328.372 1.306 10 10 EDCE C[C@H](NC(=O)NCc1nc([C@H]2CCCO2)n[nH]1)c1ccccc1O 1683441079 KEFDWHDYMPNNMD-GXFFZTMASA-N 331.376 1.922 10 10 EDCE COc1ccc(CN[C@H]2CCC[C@H](NC(=O)CC(N)=O)C2)cc1C 1690764745 DWAAUTKRXKAULM-GJZGRUSLSA-N 333.432 1.396 10 10 EDCE C[C@]1(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCOC1=O 1123864711 ATDFMIJYCVJOQN-KDOFPFPSSA-N 348.399 1.788 10 10 EDCE Cc1c(OCCOc2ccc(N)cc2)c(=O)ccn1[C@H](C)C(=O)O 1857910773 AANAVRLKEYVFMP-GFCCVEGCSA-N 332.356 1.842 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]1(C)CN(C(=O)OC(C)(C)C)CCO1 1985093716 DISKQNMVOAKZDN-CQSZACIVSA-N 327.385 1.781 10 10 EDCE COCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985101664 WBWMAKQSGPTZNC-MNOVXSKESA-N 327.385 1.827 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC[C@]3(C)CO)c(Br)cc21 2153560266 KRUVLSQUNWNWNV-TZMCWYRMSA-N 340.221 1.623 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC[C@H]1CN=[N+]=[N-])C(C)(C)O 2014482264 HXPYTMSPPQGFBV-WDEREUQCSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](N[C@@H]2CCc3cccc(O)c32)C1 2011486780 DZIUMTFOOJTKBX-IPYPFGDCSA-N 334.416 1.949 10 10 EDCE C[C@H](NC(=O)[C@H](O)CCNC(=O)OC(C)(C)C)c1ccccc1O 2017518541 IOSNIFOELJBMQU-SMDDNHRTSA-N 338.404 1.845 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)C[C@@]2(C)CO)cc1Br 698136299 FZGPXVUUTRIXQZ-PUYPPJJSSA-N 329.238 1.791 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H](O)[C@H](C)C3)c(Br)cc21 388158542 SXZBFVOQDGQIKF-BLBGDKDGSA-N 340.221 1.479 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCCc3nnn(C)c32)c1 2062455463 HYLVKTHLLWVQQI-PWSUYJOCSA-N 330.388 1.827 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](O)[C@@H](O)C[C@H]3C2)cc1Br 2236980682 RNUAVDCAECKPJW-GVARAGBVSA-N 341.249 1.476 10 10 EDCE O=C1C(=Cc2cccnc2)SC(=S)N1CCS(=O)(=O)O 2293223790 OYCMUJQWJQDGFT-UHFFFAOYSA-N 330.412 1.171 10 10 EDCE COC(=O)[C@H](O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951701032 VKIYAILWRSSUJE-GXFFZTMASA-N 341.360 1.068 10 10 EDCE COc1ccc(N2CCN(c3ncnc(N(C)C)c3N)CC2)cc1 40723401 QFOBVYPVIQUKBU-UHFFFAOYSA-N 328.420 1.460 10 10 EDCE COc1cc(N2CCN(Cc3ncccn3)CC2)cc(OC)c1OC 192187257 BVTXWPGEJZOYAA-UHFFFAOYSA-N 344.415 1.825 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2C[C@H](C)Oc3ncccc32)c1 255777122 VWKBHVJXTHHYKX-FJOGCWAESA-N 338.367 1.664 10 10 EDCE CO[C@@H](C(=O)NCc1ccc(C)c(Br)c1O)C1CNC1 2381130054 STWNMLFIPWSPAT-CYBMUJFWSA-N 343.221 1.314 10 10 EDCE Cc1ccc(CNC(=O)c2cc(CN)[nH]n2)c(O)c1Br 2380748114 ZJTVPQWWBSVRQK-UHFFFAOYSA-N 339.193 1.575 10 10 EDCE Cc1ccc(CN2CCN(CC(=O)O)CC2)c(O)c1Br 2380809654 CMETVPOGSYBXBM-UHFFFAOYSA-N 343.221 1.665 10 10 EDCE CC(=O)C(=O)COC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1 808498959 CLTMEBGHSMCRIR-UHFFFAOYSA-N 344.772 1.348 10 10 EDCE COc1cc(Cl)cc(CN(C)[C@H]2CCN3CCO[C@H]2C3)c1O 295030364 DCQCXRUWZZDTKP-ZFWWWQNUSA-N 326.824 1.959 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)C3(C(=O)N(C)C)CC3)C2)cc1 819588480 MYJWHJUWRGJDJV-AWEZNQCLSA-N 345.443 1.506 10 10 EDCE COC(=O)[C@](C)(CCF)NCc1ccc([N+](=O)[O-])c(OC)c1O 827352721 OBVMCTMUTNRSTG-AWEZNQCLSA-N 330.312 1.690 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CC34CC4)CC2)cc1 822855529 IIPHMFNQRBATOI-QGZVFWFLSA-N 344.459 1.669 10 10 EDCE CNC(=O)N1CCN(c2cc(Br)c(CN)cc2F)CC1 721789859 UAFNFCNZFMUVDJ-UHFFFAOYSA-N 345.216 1.508 10 10 EDCE COCC(COC)NC(=O)NCc1cc(Br)ccc1O 836611169 NMHZIIHTRZKHNL-UHFFFAOYSA-N 347.209 1.615 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N[C@H]1CCC[C@@H](C(N)=O)C1 739018652 DUNPBUDOHBZVIF-HIFRSBDPSA-N 332.448 1.904 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1[nH]cnc1CC 911304565 UEIXZUYKAJAYLP-UHFFFAOYSA-N 331.372 1.883 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1CN(C)CCN(C)C1 910558318 OPVOLMPBOKSGQY-INIZCTEOSA-N 346.519 1.602 10 10 EDCE C[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1C)c1ccc(N2CCOCC2)cc1 914400715 RWLCZMHGQKZSLK-HDMKZQKVSA-N 346.475 1.976 10 10 EDCE C[C@@]1(C(=O)NCc2ccc3cccnc3c2O)CCCS1(=O)=O 911263327 YNRGJJUVJHQDDU-INIZCTEOSA-N 334.397 1.524 10 10 EDCE CC(C)(CNC(=O)NCc1c(O)cccc1F)N1CCOCC1 913877095 WGDFKNUAIAGAEU-UHFFFAOYSA-N 325.384 1.441 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)COCC(=O)OC(C)(C)C)c1 843830485 HEPCPIMJQYEIMR-LLVKDONJSA-N 339.388 1.936 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]12C[C@H]3C[C@@H](C(=O)N1)[C@H]2C3 845929320 AEMAJNBXAQYGBS-RQMFYDEFSA-N 330.384 1.060 10 10 EDCE NC(=O)[C@H]1C[C@@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)C1 844736279 XFAJDPHMOHFMPB-DKTWLAJQSA-N 337.763 1.074 10 10 EDCE O=C(CCS(=O)(=O)C1CCCC1)NCc1c(O)cccc1F 928712670 VUGNYGPGWHAVOY-UHFFFAOYSA-N 329.393 1.895 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCO[C@H]3CCOC3)C2)cc1 923185304 FFQJEBQWXXAMKT-PBHICJAKSA-N 349.431 1.379 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCN(C3CC3)C(=O)C2)cc1F 748626388 WUQMRQBYTPZTHL-UHFFFAOYSA-N 334.395 1.408 10 10 EDCE Cc1ccc(C(=O)N2CCC([C@]3(C)COC(=O)N3)CC2)c(O)c1O 928162465 IIHAUHWAQKOYMX-KRWDZBQOSA-N 334.372 1.757 10 10 EDCE Nc1ccc(Cc2nc(C(=O)N3CC[C@@H](F)[C@H](N)C3)cs2)cc1 851648817 OULTZWGLCHVULW-CHWSQXEVSA-N 334.420 1.827 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCC[C@H](C(N)=O)C3)C2)cc1 855228035 UIYMIWQXJBMCNJ-KKUMJFAQSA-N 345.443 1.682 10 10 EDCE COC(=O)[C@@H]1CCN[C@H]1c1cc(I)ccc1O 1952825555 LSZIHRXXICGJEP-LDYMZIIASA-N 347.152 1.820 10 10 EDCE COC(=O)[C@@H]1C[C@H]1[C@@H](C)NCc1ccc(N2CCOCC2)c(F)c1 850034286 KKIZXAYRBRHBPR-VHDGCEQUSA-N 336.407 1.950 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2c(O)cccc2OC)C1 862552353 WXFYIYFGQMPTLS-LBPRGKRZSA-N 328.434 1.162 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 869631616 VZJZMWWTDZXAGT-HAQNSBGRSA-N 327.377 1.771 10 10 EDCE Cc1cc(S(N)(=O)=O)sc1C(=O)NCc1ccccc1O 769362803 KICOEYIQIDXKQX-UHFFFAOYSA-N 326.399 1.340 10 10 EDCE O=C(O)CC[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 868343143 MSYHREYUFLTJGE-GFCCVEGCSA-N 346.383 1.338 10 10 EDCE COc1cc(C)cc(CNCC2(S(=O)(=O)N(C)C)CC2)c1O 895810337 MZZBCRZVWQMQJJ-UHFFFAOYSA-N 328.434 1.223 10 10 EDCE NC(=O)CN1CCC(NCc2c(O)cccc2Br)CC1 706842420 IPBZBBHFQUKCAB-UHFFFAOYSA-N 342.237 1.194 10 10 EDCE CCCN(CCO)c1cc2c(cc1Br)[C@@H](NC)C(=O)N2 92775429 YHKOHDWNGIVSLS-CYBMUJFWSA-N 342.237 1.870 10 10 EDCE Cc1nccn1CCCN(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329412929 NUDUEXWRBCYGBE-UHFFFAOYSA-N 342.399 1.288 10 10 EDCE NC[C@@]12CN(Cc3c(O)cccc3Br)C[C@@H]1CCO2 2118554300 DGRFCVXSWVUSIP-IINYFYTJSA-N 327.222 1.704 10 10 EDCE COc1ccc(CN[C@@H]2CC[C@H](CNC(=O)CC(N)=O)C2)cc1C 1264456221 JLOYUBVGCLOTBY-LSDHHAIUSA-N 333.432 1.254 10 10 EDCE CCOCC(=O)NC[C@@H](CC)NC(=O)c1ccc(N=NC(N)=O)cc1 1297349229 HSENORQKIHPYAK-GFCCVEGCSA-N 349.391 1.510 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCNC(=O)c1ccc(Cl)cc1 1542602848 NIQCGMMNRSXXRH-UHFFFAOYSA-N 348.786 1.840 10 10 EDCE COC(=O)[C@@H](O)C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1545993679 APVKXJVSOYFHNM-ZDUSSCGKSA-N 348.359 1.235 10 10 EDCE COC[C@@H](C)N[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1480069640 QVXCEZVKJGYTKO-ABAIWWIYSA-N 347.419 1.982 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)c2cnn(C)c2N)cc1C 1714466864 VDNJWKZVVSILMC-CYBMUJFWSA-N 345.447 1.618 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)[C@@](C)(O)C2)cc1Br 2136877649 JAUWKGOJWOUQNP-HERUPUMHSA-N 330.222 1.824 10 10 EDCE Cc1n[nH]c(C)c1[C@@H]1COCCN1C(=O)Cc1ccc(O)c(O)c1 1636545483 OYHCITXYXOYVDN-ZDUSSCGKSA-N 331.372 1.580 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCc3nnc(O)cc3C2)cc1 1633396832 DUAIICHHSDNVQS-UHFFFAOYSA-N 326.316 1.543 10 10 EDCE Cc1nc2cc(O)nn2c(C)c1CC(=O)NCc1c(O)cccc1O 1635847401 NLBGAJVDHNZXNC-UHFFFAOYSA-N 342.355 1.322 10 10 EDCE C[C@H](C(=O)NCc1cccc(O)c1O)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 1633509305 SSIWRYXPBOQLHI-RAIGVLPGSA-N 346.383 1.278 10 10 EDCE Cc1nc2ncnn2c(C)c1CCC(=O)NCc1c(O)cccc1O 1647178607 RNFREYCMGHUKQL-UHFFFAOYSA-N 341.371 1.401 10 10 EDCE NC(=O)CCOc1ccc(NC(=O)c2c(F)ccc(O)c2O)cc1 1641159684 BSGBGQQZBRICLE-UHFFFAOYSA-N 334.303 1.743 10 10 EDCE CCOC(=O)[C@H](C[C@@H]1CCCO1)NC(=O)/C=C\c1ccc(O)c(O)c1 1644419739 BRHXEDACPYUNHR-KQYOJSHESA-N 349.383 1.728 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)Cc2nnc(O)o2)c([N+](=O)[O-])c1 1651959524 VAYBNPHDUPNTJM-GQCTYLIASA-N 334.288 1.506 10 10 EDCE Nc1ccc(Oc2nc[nH]c(=O)c2I)cc1 164172288 LWBAMCXLZLVMPA-UHFFFAOYSA-N 329.097 1.749 10 10 EDCE NCCCOCCCCOCCCNC(=O)Cc1ccc(N)cc1 1865956746 GXWYPVAOLUZCEV-UHFFFAOYSA-N 337.464 1.480 10 10 EDCE CNCc1ccc(N2CCC[C@@H]3C(=O)NC[C@@H]32)c(Br)c1 234421654 ZNEMUNKOTYOKGN-FZMZJTMJSA-N 338.249 1.883 10 10 EDCE CNC(=O)COc1cn(CCCOc2ccc(N)cc2)c(C)cc1=O 1857916619 DQMZAFWGBGXCCN-UHFFFAOYSA-N 345.399 1.333 10 10 EDCE Oc1c(F)cc(F)cc1CNCCn1cc(Br)nn1 1878216481 GPIHRQREKWQVEO-UHFFFAOYSA-N 333.136 1.814 10 10 EDCE CC(C)(C)OC(=O)NC12COC(C(=O)NCc3ccccc3O)(C1)C2 1964889341 LFZZDFKGROTQOP-UHFFFAOYSA-N 348.399 1.835 10 10 EDCE C[C@@]12C[C@@H](CO1)N(c1cc3c(cc1Br)[C@@H](O)C(=O)N3)C2 2144574052 RAIRZMNOIAQVGX-DSBAHLMNSA-N 339.189 1.802 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCC(=O)N[C@H]2C)c1O 1971868805 IRFVSEBITXRWKW-GZMMTYOYSA-N 343.221 1.920 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)NCCCCN=[N+]=[N-] 1985093883 GXDRKRYLOHHIMU-JTQLQIEISA-N 331.373 1.664 10 10 EDCE C[C@H](O)c1ccc(N2CCOC[C@H]2[C@H](O)CO)c(Br)c1 2146324184 SPLWICDAIJUXLB-QCZZGDTMSA-N 346.221 1.061 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOCC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010405812 MDMCPKXRUWJQRB-NWDGAFQWSA-N 339.396 1.827 10 10 EDCE CN(C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1cccnc1 2022926049 HXWZGEIZVRLOFL-ZIAGYGMSSA-N 333.388 1.629 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)[C@H](CO)C2)c(Br)c1 704774373 BVLWDCJHUZRXNB-RYUDHWBXSA-N 329.238 1.206 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H]3c3nccn3C)c2n1 2063949687 VZXZENJCIGKXCD-LBPRGKRZSA-N 326.360 1.454 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)c(Br)c1 2182554621 SENBRMLAJNFQGC-GMBDUWKCSA-N 341.249 1.647 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@H]4COC[C@@H]43)c(Br)cc21 2198566472 XDCYMMBYZNJXOH-PAWXDDDFSA-N 338.205 1.626 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(CNC(N)=O)C2)cc1Br 2187295184 SQXUZMGXTAPQPM-VIFPVBQESA-N 341.253 1.834 10 10 EDCE O=S(=O)(C1CN(c2ccc(CO)c(Cl)c2)C1)C(F)(F)F 2237657794 LLUJDBAZYKMXDI-UHFFFAOYSA-N 329.727 1.956 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3C[C@H](C2)C3N)c1O 2227731039 YIIWNRHFWVKZAE-PHXKMMTBSA-N 327.222 1.942 10 10 EDCE CN(C)C(=O)[C@H]1C=CCN1c1ccc(CO)cc1Br 2265498660 LOHPNFKZXJNVIH-CYBMUJFWSA-N 325.206 1.774 10 10 EDCE COc1cc(OC)c(OC)cc1C=C1SC(=S)N(N)C1=O 2295491492 HSNGHYFPLNOIRS-UHFFFAOYSA-N 326.399 1.787 10 10 EDCE C[C@@H](O)[C@@H](C(=O)O)N1C(=O)C(=Cc2cccc(F)c2)SC1=S 2323823487 MCNIRAFVAUGWKE-HQJQHLMTSA-N 341.385 1.861 10 10 EDCE Cc1ccc(CN(C)CC[C@H](N)C(=O)O)c(O)c1Br 2352642313 DDHZMCUKSQKDTR-JTQLQIEISA-N 331.210 1.697 10 10 EDCE Cc1ccc(CNC2[C@H]3CS(=O)(=O)C[C@H]23)c(O)c1Br 2352670069 GUHWONWCLBIHLH-UWVGGRQHSA-N 346.246 1.596 10 10 EDCE COc1ccc(N(CC(=O)NCCNC(C)=O)[C@H](C)C2CC2)cc1 171927161 DHUSMYUMTUSSBA-CYBMUJFWSA-N 333.432 1.552 10 10 EDCE Cc1cc([N+](=O)[O-])cn(CC(=O)NCc2ccc(N(C)C)cc2)c1=O 127321101 IXWBOKSVSPSYAT-UHFFFAOYSA-N 344.371 1.447 10 10 EDCE CCOc1ccc(O)c(CN2CCN(S(=O)(=O)CC)CC2)c1 127266866 GOHBJPAGBFFGBF-UHFFFAOYSA-N 328.434 1.258 10 10 EDCE Cc1ccc(CN[C@@H]2CCC(=O)N(C)C2=O)c(O)c1Br 2380794860 FSBVUNFKTYHIHO-SNVBAGLBSA-N 341.205 1.700 10 10 EDCE O=C(NCCO)c1ccc(NCc2c(O)ccc3c2CCCC3)nn1 811808470 JZTLMZBTXHPUDI-UHFFFAOYSA-N 342.399 1.395 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1COCCOC1 813817788 HDQAOCOGMDVRSL-UHFFFAOYSA-N 349.431 1.080 10 10 EDCE COc1cc(Cl)cc(CNC[C@@H]2CCCCN2CCO)c1O 824584272 ZWWBOMIWOWVVQU-AWEZNQCLSA-N 328.840 1.991 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)N[C@@H]2C[C@H]2[C@@H]2C[C@H]2C)cc1 905128130 HDVLSSSVIGWOCU-BQDHKBFISA-N 332.400 1.747 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC(N)(CO)CC2)c([N+](=O)[O-])c1 733895469 FLXXOCGSWWUBMY-HYXAFXHYSA-N 335.360 1.071 10 10 EDCE COc1ccc(O)c(CNC(=O)C(=O)c2cnn(C(C)(C)C)c2)c1 734016907 NEIBHIHHCVLBHI-UHFFFAOYSA-N 331.372 1.851 10 10 EDCE Cc1ccccc1C(=O)NCC(=O)OCC(=O)c1ccc(O)c(O)c1 916610602 LMWNBNDFTKYLHS-UHFFFAOYSA-N 343.335 1.562 10 10 EDCE CCN1CCN(CC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 915217396 RWIUCKPJADCXRN-UHFFFAOYSA-N 344.503 1.881 10 10 EDCE COC(=O)[C@@H]1CN(C)CCN(Cc2c(O)cc(C)cc2Cl)C1 840957072 IJLBRMJWFRDHBD-GFCCVEGCSA-N 326.824 1.891 10 10 EDCE CCc1cccc(CNC[C@H]2CCCCN2S(C)(=O)=O)c1O 848910940 OOBMEKPXAOAKJF-OAHLLOKOSA-N 326.462 1.858 10 10 EDCE Cc1cc(CCNC(=O)NC(CO)CO)c(C)n1-c1ccccc1 745391719 PXDUNOGMAOYDEX-UHFFFAOYSA-N 331.416 1.289 10 10 EDCE Nc1ccc(NC(=O)C(=O)NC[C@H]2CCC[C@H](C(F)(F)F)O2)cc1 927867778 PELTXZNZKKSFHB-VXGBXAGGSA-N 345.321 1.824 10 10 EDCE COC(OC)[C@H](C)NC(=O)NCc1cccc(Br)c1O 923659497 VBCFFOIKKOGEQZ-QMMMGPOBSA-N 347.209 1.961 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN1Cc1cc(C)cc(OC)c1O 754740514 UNLPQFAFYHFYLO-ZDUSSCGKSA-N 328.434 1.223 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)c1cn2c(n1)COCC2 858453203 SWOPGPQKNUIIFK-UHFFFAOYSA-N 326.400 1.944 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCc4c[nH]nc4C3)C2)cc1 855232494 UWUHTJAZXJAIKN-HIFRSBDPSA-N 340.427 1.918 10 10 EDCE COC1(OC)CCN(Cc2ccc(N3CCOCC3)cc2)C[C@H]1O 931632370 ZEQQVXPUMHAICZ-QGZVFWFLSA-N 336.432 1.079 10 10 EDCE CN(C)C[C@]1(O)CCCN(Cc2ccc(N3CCOCC3)cc2)C1 930905072 YWPFIMVBTPUILD-LJQANCHMSA-N 333.476 1.412 10 10 EDCE CO[C@@H](CS(=O)(=O)N[C@@H](C)c1ccccc1O)[C@H]1CCOC1 867836167 IHYLKCMJYOUTPC-HUBLWGQQSA-N 329.418 1.424 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCC[C@H]2NCC[C@H]21 868420402 VXOYSRZGAXOIAP-IAGOWNOFSA-N 344.459 1.064 10 10 EDCE C[C@H]1C[C@@H](C)CN(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)C1 775289283 UDZXYMSXRYYCIN-AOOOYVTPSA-N 329.378 1.935 10 10 EDCE Cc1cc(C(=O)COC(=O)CC(N)=O)c(C)n1-c1cccc(F)c1 787940679 CBCOHGIWGBYKSV-UHFFFAOYSA-N 332.331 1.835 10 10 EDCE COC(=O)CCc1csc(NC(=O)Cc2ccc(O)c(O)c2)n1 1137452850 QATTWJOKVUOFAQ-UHFFFAOYSA-N 336.369 1.841 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(O)(C(=O)OC)C2)cc1Br 714438605 GRYYNKSHLLSVGY-VIFPVBQESA-N 343.221 1.454 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCO[C@H]2CNC[C@@H]21 715788288 JWFLRXVUCIMFLO-RYUDHWBXSA-N 331.185 1.466 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H](C)C(F)(F)F)cc1C 1320256398 HIFLHIWMVSWAFC-YPMHNXCESA-N 348.365 1.769 10 10 EDCE CC1(C)C[C@H](O)[C@@H](O)CN1c1ccc(CO)c(Br)c1 2132172313 JFGJIYGVVAEOLG-STQMWFEESA-N 330.222 1.652 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CNC(=O)C2CC2)cc1C 1268678461 IMHITBFPJNIWPF-ZDUSSCGKSA-N 333.432 1.124 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(C(=O)NCc2cccc(O)c2O)C1 1263896053 NEDOSCNJUVELGD-KPZWWZAWSA-N 348.399 1.971 10 10 EDCE O=C(O)/C=C\c1ccc(N2CCC(NCCO)CC2)c([N+](=O)[O-])c1 1349486389 IEBSDBCBPYEOLP-RQOWECAXSA-N 335.360 1.243 10 10 EDCE C[C@@](CNCCO)(NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1267865692 YJXGVCQXHDKDGZ-INIZCTEOSA-N 333.392 1.329 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@]34CCOC4)c(Br)cc21 1915825813 JCAMNLXWUSFXBH-GXTWGEPZSA-N 338.205 1.770 10 10 EDCE C[C@H](C(=O)NCc1ccc(O)c(O)c1)N1C(=O)c2ccccc2C1=O 1622642820 BJIIRIWPTGVMMO-SNVBAGLBSA-N 340.335 1.399 10 10 EDCE C[C@@H](NC(=O)c1cnc2nc(O)nc(O)c2c1)c1ccccc1O 1557967002 TWPLRQYGQALKAZ-MRVPVSSYSA-N 326.312 1.633 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CC[C@H](C(F)(F)F)NC1=O 1635842986 DOUTVBJUTXBKLB-RDDDGLTNSA-N 332.278 1.171 10 10 EDCE CC[C@H](CN(C)CCNC(=O)c1ccc(N=NC(N)=O)cc1)OC 1492887281 HRQMWXMNDNHVHZ-CQSZACIVSA-N 335.408 1.936 10 10 EDCE O=C(c1cccc(O)c1O)N1CCO[C@@H](c2noc(C3CC3)n2)C1 1644882715 XAWWJYGNIBTWQZ-GFCCVEGCSA-N 331.328 1.572 10 10 EDCE CCCNCC1(O)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1733889800 TYWYEBGXGJJEJA-UHFFFAOYSA-N 347.419 1.816 10 10 EDCE CC(C)(C)OC(=O)c1cnc(C(=O)NCc2cc(O)ccc2O)cn1 1643881694 BPEQIKLABGMYCP-UHFFFAOYSA-N 345.355 1.773 10 10 EDCE CCC[C@@H](C)C(=O)NC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1744638017 LZXFAMCRGFKYMX-NEPJUHHUSA-N 337.420 1.770 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC(Cn3ccnn3)CC2)cc1 1596409120 IPQXSHKVRMWLJM-UHFFFAOYSA-N 341.375 1.993 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2n[nH]cc2C)cc1C 1677075425 ZDJZCCAXYYHOQJ-HNNXBMFYSA-N 346.431 1.258 10 10 EDCE CN(CC(=O)NC1CC1)c1ccc(CN)c(Br)c1F 231839043 FYPTYBUYILRNSE-UHFFFAOYSA-N 330.201 1.762 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2COCCO2)cc1C 1698819332 XBXOPRSRERJRHV-RHSMWYFYSA-N 336.432 1.356 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@H](O)CN(C(=O)OC(C)(C)C)C1 1985102768 LPTYCLGVOAONSG-QWRGUYRKSA-N 327.385 1.373 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NCc2cccc(F)c2O)C1 1985826523 AMOCBKLPHULGLT-CHWSQXEVSA-N 326.368 1.601 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1990033892 ZEINHSVUGIVLKJ-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE CC(C)NCc1ccc(N(C)CC(CO)CO)c(Br)c1 2150418089 GQVKEIHVZSFCSO-UHFFFAOYSA-N 345.281 1.984 10 10 EDCE CC(C)(C)OC(=O)N1CC(NCc2ccc(F)cc2O)(C(=O)O)C1 2024898004 JLVZMQUXVRYLQS-UHFFFAOYSA-N 340.351 1.695 10 10 EDCE CN[C@H](C)c1ccc(N2CCOC[C@@H]2CO)cc1Br 300514632 JIIMYEVLTJISAU-PWSUYJOCSA-N 329.238 1.927 10 10 EDCE CC(C)N(C[C@@H](C)O)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 691418551 UTUZXDRTMFDDBR-AMIZOPFISA-N 342.237 1.997 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H](C)CN3C[C@@H](C)C[C@H](C)C3)c2n1 2062005998 JBWDDTKXYPRILR-SGMGOOAPSA-N 345.447 1.840 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCN(CC(C)(F)F)CC3)c2n1 2065014517 ZKQJRJAVTPJFKF-UHFFFAOYSA-N 339.346 1.156 10 10 EDCE Cc1nn(C)c(NC(=O)c2cc(O)c(O)c(O)c2)c1Br 2188874657 JPJINDFTWHSJBY-UHFFFAOYSA-N 342.149 1.860 10 10 EDCE 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[N-]=[N+]=N[C@H]1CCC[C@@H]1NC(=O)Cn1cc(Br)ccc1=O 2234175283 BAVFICTWZYNKRB-UWVGGRQHSA-N 340.181 1.958 10 10 EDCE NCc1ccc(N2CC(N3CCOC3=O)C2)c(Br)c1 2227412750 ZRSVBLBIFNOVDP-UHFFFAOYSA-N 326.194 1.549 10 10 EDCE CC[C@](C)(NCc1c(Br)ccc(OC)c1O)C(N)=O 2227748925 QWPSISDDHILODE-ZDUSSCGKSA-N 331.210 1.907 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](O)[C@H](O)CC2)c(Br)c1 2269120106 BGTCLYPJXVNJFF-OWYVNGRQSA-N 330.222 1.824 10 10 EDCE NCc1ccc(N2C[C@H]3OCC[C@]3(CO)C2)c(F)c1Br 2296384057 KNCXKZOZCQTIAT-BXUZGUMPSA-N 345.212 1.635 10 10 EDCE Cc1c(C=CC(=O)N(CC(=O)N(C)C)c2ccccc2)cnn1C 2304261503 QMMQTDPDSKLKCY-UHFFFAOYSA-N 326.400 1.863 10 10 EDCE Cc1ccc(CN(C)c2nnc(CO)o2)c(O)c1Br 2352942082 ZIFNSDZKUNXONN-UHFFFAOYSA-N 328.166 1.975 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCn4ccnc4C3)c(Br)cc21 118712390 OVVSOSYUKMDQED-ZDUSSCGKSA-N 348.204 1.618 10 10 EDCE O=C(O)CCNC(=O)CN1C(=O)/C(=C\c2ccco2)SC1=S 210682249 VCHKLIYEJPWSGC-RMKNXTFCSA-N 340.382 1.072 10 10 EDCE Cc1nc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)no1 74610843 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URACKWSKBHTQAL-HNNXBMFYSA-N 334.464 1.961 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)C3(O)CCCC3)CC2)cc1F 929820692 GFUSBBQFIBAESU-KRWDZBQOSA-N 338.423 1.622 10 10 EDCE COC[C@@H]1CC[C@@H]([C@@H]2COCCN2C(=O)Nc2ccc(N)cc2)O1 926141484 DNNRUOLPUZFSEH-JYJNAYRXSA-N 335.404 1.696 10 10 EDCE Cc1nc(O)c2c(n1)CN(Cc1ccc(N3CCOCC3)cc1)C2 931311749 MLTWCGXFOOQPOZ-UHFFFAOYSA-N 326.400 1.843 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H](C[C@H]3CCCOC3)C2=O)cc1 863500220 QJAWWBZRCCZWEG-ZBFHGGJFSA-N 331.416 1.990 10 10 EDCE CC[S@](C)(=O)=NS(=O)(=O)NCc1cc(Cl)ccc1O 867463145 HGCCSXJGMHYLMD-SFHVURJKSA-N 326.827 1.498 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)NCc2ccc(OC)cc2O)c1 794381115 LCPMUBPDUZUMQQ-ZZXKWVIFSA-N 341.367 1.485 10 10 EDCE C[C@@H](O)c1ccc(N(C)CCN(C)CCO)cc1Br 691271910 MIUUOXAODDDULB-LLVKDONJSA-N 331.254 1.863 10 10 EDCE CNS(=O)(=O)c1cc(NC(=O)c2cc(O)cs2)ccc1F 1157606657 WOISNGZOGTVBEN-UHFFFAOYSA-N 330.362 1.753 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2C[C@H](O)[C@H](O)C2)c1 1178290939 LDKPLGOPJSSYRV-VBUUOAMHSA-N 342.395 1.521 10 10 EDCE C[C@@H](NC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2[nH]1)c1ccccc1O 1171722990 IMAHOMKRQWIFEH-VFVAKGGASA-N 341.367 1.540 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H](C)S(C)(=O)=O)cc1C 1268693215 TUEAJKQFBGLXLN-QWHCGFSZSA-N 342.461 1.031 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)c2cnc(O)n2C)cc1C 1266166453 AYXUJXGMKSVZOZ-ZDUSSCGKSA-N 346.431 1.741 10 10 EDCE COCC1(C2CC2)CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1351942333 SSZXCEGDYOBNHT-UHFFFAOYSA-N 330.384 1.119 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCc2cnn[nH]2)cc1C 1480537411 DHAMBJRZHKLKAD-ZDUSSCGKSA-N 331.420 1.349 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@H]2CCCN2C(N)=O)cc1C 1483200671 DGLASHFQYCJEMM-HIFRSBDPSA-N 348.447 1.141 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2[nH]nnc2C)C2CC2)cc1C 1713114201 FSTPNEGMBTXTDJ-HNNXBMFYSA-N 343.431 1.728 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H]2CCC(=O)NC2)cc1C 1715237698 BJOLRYMGISQJQM-XJKSGUPXSA-N 347.459 1.372 10 10 EDCE CCCNC(=O)CN(C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1567322306 ZTWJUSTZDXEXEJ-UHFFFAOYSA-N 348.407 1.037 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@@H]2CCC(=O)N2)cc1C 1498134493 SLGPVYMFRHMQCJ-ZFWWWQNUSA-N 333.432 1.267 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@H](C)NC(N)=O)C2CC2)cc1C 1569300887 CSYLUYCQAUROFK-SWLSCSKDSA-N 348.447 1.045 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN[C@@H](c2ccc(O)cc2)C1 1631045212 CMMOXRLEEDAUEV-FQCWITJCSA-N 340.379 1.990 10 10 EDCE CC[C@H](CNC(=O)[C@]1(C)CCNC1=O)NCc1ccc(OC)c(C)c1 1698612239 ICIUWNAHGXLQBA-DNVCBOLYSA-N 347.459 1.514 10 10 EDCE Cc1cccc2c1NC(=O)/C2=C1/SC(=S)N(CCC(=O)O)C1=O 12463015 FKRYUVDLKGRGDP-ZRDIBKRKSA-N 348.405 1.993 10 10 EDCE CC(=O)N1C[C@H]2C[C@H]1CN2Cc1cccc(Br)c1O 1877021182 OBBUYIWVJBBOMP-NEPJUHHUSA-N 325.206 1.960 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@@H]2C1 897617856 FMHNLHCDWDFLGW-PHIMTYICSA-N 346.246 1.631 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H](C(=O)NCCCN=[N+]=[N-])C1 1964882789 GYQWDAXPUSXUNI-GHMZBOCLSA-N 327.385 1.875 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1[C@@H](O)[C@@H](N)c1ccccc1O 2005036037 MVJXJZJHDRLRIJ-VHDGCEQUSA-N 338.404 1.389 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)CN1CC(CNC(=O)OC(C)(C)C)C1 2010389106 LKHWFXIJFPWZJO-UHFFFAOYSA-N 340.428 1.602 10 10 EDCE OCc1ccc(N2CCC[C@H](CO)[C@H]2CO)c(Br)c1 710090436 KFGIDIDBRKRUAV-BXUZGUMPSA-N 330.222 1.511 10 10 EDCE CS(=O)(=O)c1cnn(Cc2cccc(C(F)(F)F)c2O)c1N 2070220403 TXUUKOZVLMMIBR-UHFFFAOYSA-N 335.307 1.642 10 10 EDCE CC(C)(C)OC(=O)N1CC(NC(=O)Cc2ccc(N)cc2)(C(=O)O)C1 2044228052 FIXSMMSKNPBHCE-UHFFFAOYSA-N 349.387 1.002 10 10 EDCE CNCc1ccc(N2CC(C[S@](C)=O)C2)cc1Br 2047850047 KAYIJKNDHQLVGW-SFHVURJKSA-N 331.279 1.983 10 10 EDCE COC[C@]1(O)CCCN(c2ccc(CN)c(Br)c2)C1 2095480463 OJZIPSRYOSQSQC-AWEZNQCLSA-N 329.238 1.886 10 10 EDCE CO[C@H]1[C@H](CO)N(c2ccc(CN)c(Br)c2)C[C@H]1OC 2233356685 QNJQBTHAPJKZMO-MJBXVCDLSA-N 345.237 1.119 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CC[C@H](C(N)=O)C2)c1O 2236031066 ITNZKJGRSOYMEU-DTWKUNHWSA-N 343.221 1.907 10 10 EDCE CNC[C@H]1CN(Cc2c(Br)ccc(OC)c2O)CCO1 2236033466 PCQUICFDGIHVBQ-JTQLQIEISA-N 345.237 1.584 10 10 EDCE CC1(C)OCCN(c2ccc(CO)c(Br)c2)[C@@H]1CO 2267737543 LMAHZKVVHTWOCD-CYBMUJFWSA-N 330.222 1.918 10 10 EDCE COC(=O)CC1=NN(c2ccccc2)C(=O)C1=C(C)N=c1cc[nH][nH]1 2293027766 FZSJDMNSAMVCCI-UHFFFAOYSA-N 339.355 1.483 10 10 EDCE COCCCN/C(C)=C1/C(=O)N(c2ccccc2)N=C1CC(=O)OC 101834109 XFSPMQBEOHVPPJ-GHRIWEEISA-N 345.399 1.852 10 10 EDCE CCc1nc2n(n1)C[C@H](NC(=O)NCc1cccc(OC)c1O)CC2 174971054 WARONPYTYFXXTK-GFCCVEGCSA-N 345.403 1.369 10 10 EDCE CC[C@@H](C(=O)N1CCN(c2ccc(OC)cc2)CC1)N1CCCC1=O 174941366 GOZNHGWOHGHDKT-KRWDZBQOSA-N 345.443 1.745 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccncc3O)CC2)cc1F 177362674 RVAUQJOLGSNKDZ-UHFFFAOYSA-N 331.347 1.897 10 10 EDCE O=C([C@@H]1CCCCN1Cc1cc([N+](=O)[O-])ccc1O)N1CCOCC1 173299621 AXJWUMIQVXIPIU-HNNXBMFYSA-N 349.387 1.514 10 10 EDCE COc1ccc(O)c(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)c1 121515425 YQYNOLCDDXGTBZ-LLVKDONJSA-N 336.413 1.899 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@H](C)C[S@](C)=O)CC2)cc1 183632873 OKUGXQONFYCVHQ-ZLOXQWCVSA-N 339.461 1.294 10 10 EDCE COc1ccc(N2CCN(C(=O)NC3CCN(C)CC3)CC2)cc1 43180462 ADYFKLKCFLBLDF-UHFFFAOYSA-N 332.448 1.621 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H](CO)C[C@H](O)C(C)(C)C)cc1 284693388 HCCNOOLUYOSYEI-ZBFHGGJFSA-N 337.464 1.710 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@@H](C)C2(S(C)(=O)=O)CC2)c1 806809953 FBWITHQAXOLOKP-JTQLQIEISA-N 342.417 1.166 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@H]1CCNC12CCC2 903469756 BTGRGFFTKVHCMC-KRWDZBQOSA-N 330.476 1.585 10 10 EDCE COCCCN1CCC(NC(=O)NCc2c(O)cccc2F)CC1 916323512 KARDTYTUJLMLBE-UHFFFAOYSA-N 339.411 1.831 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCNC[C@@H]1C 842264668 BKNBZRFKBXXPLT-DZGCQCFKSA-N 333.432 1.245 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)CCCCF)C2)cc1 849417438 QZPKLLBKSPLJLH-ZDUSSCGKSA-N 330.425 1.943 10 10 EDCE C[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)[C@H](C)CN1CCO 841892355 XVZOBZYYENFCCB-GHMZBOCLSA-N 343.811 1.841 10 10 EDCE COc1ncncc1CN(C)Cc1ccc(N2CCOCC2)cc1 843391564 YRMWMSWAVDJNIR-UHFFFAOYSA-N 328.416 1.954 10 10 EDCE COc1ccc(N2CC[C@H](Nc3ncccc3S(N)(=O)=O)C2)cc1 853759603 XUZWQDLAKQXRDN-LBPRGKRZSA-N 348.428 1.428 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NCC34CC(CN3)C4)C2)cc1 851667557 QGROFVUDLVYBPU-TZGCNFNXSA-N 344.459 1.573 10 10 EDCE C[C@@H]1C[C@]2(CC[C@@H](CNC(=O)/C=C\c3ccc(O)c(O)c3)O2)CO1 924272149 LEDFIQONEUGFDN-UMGDGCMASA-N 333.384 1.954 10 10 EDCE C[C@H](N[C@@H](CO)c1ccnn1C)c1ccc(N2CCOCC2)c(F)c1 858434617 LGILIRGYPSEXME-BBRMVZONSA-N 348.422 1.780 10 10 EDCE CC(C)(C)OC(=O)Nc1ccc(O)c([C@@H]2CS(=O)(=O)CCN2)c1 1952984934 YBMKKHJKMONKRY-LBPRGKRZSA-N 342.417 1.798 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@@H]2COCC[C@@H]21 888786003 VCNZGEHTIVWEMN-GXFFZTMASA-N 335.381 1.942 10 10 EDCE C[C@@H]1CC[C@@H](O)CN1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 899098409 NKZLWUNTZGVWIQ-ZTFGCOKTSA-N 348.491 1.910 10 10 EDCE O=C1N(CCNCc2cc3c(cc2O)OCO3)C[C@@H]2CCCCN12 895345125 XTBQLQASWQYQIG-ZDUSSCGKSA-N 333.388 1.501 10 10 EDCE CN1C(=O)O[C@@H]2CN(c3ccc(CO)cc3Br)C[C@@H]21 2120405292 YLZWIABOKAEISP-NWDGAFQWSA-N 327.178 1.581 10 10 EDCE C[C@@H](O)CCCN[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1265508429 DIAXFWQLFNTILP-KCPJHIHWSA-N 347.419 1.860 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@H]2CCN(C)C(=O)C2)cc1C 1274810616 OZFIVRPVAZMYPP-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE CC[C@@H](CNC(=O)COC)NC(=O)c1ccc(N=NC(N)=O)cc1 1285023149 DPWYFUCEBBUTBM-NSHDSACASA-N 335.364 1.120 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)CCn2cncn2)cc1C 1714548549 HAIKDXJWOOAHSW-HNNXBMFYSA-N 345.447 1.622 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H]1CCC2(CCOCC2)[C@@H]1O 1634026857 HFFBIXFJHVVKNJ-SUMWQHHRSA-N 335.400 1.324 10 10 EDCE CC(C)c1ccc(N(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)cc1 155761018 FRJADRGUHCWQNB-DHZHZOJOSA-N 341.411 1.884 10 10 EDCE CNCc1ccc(N(C)[C@@H]2CCS(=O)(=O)C2)c(Br)c1 234413785 VYPNWSBCZRLGFF-LLVKDONJSA-N 347.278 1.792 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1ccc2c(c1)NC(=O)[C@H]2O 1946869505 WAAOEBUFAXCKSK-KRWDZBQOSA-N 325.368 1.425 10 10 EDCE COc1ccc(Br)c(CN(C)[C@@H]2CCN(C)C2=O)c1O 1964580490 YLKZPGPFVLRTMJ-LLVKDONJSA-N 343.221 1.826 10 10 EDCE Cn1nc(C(=O)NCCOc2ccc(N)cc2)cc1Br 2150482817 VPYSBEMFUPLMFE-UHFFFAOYSA-N 339.193 1.574 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)NCCCN=[N+]=[N-])CCCOC1 1985094113 KELHLBNYELGVOX-AWEZNQCLSA-N 327.385 1.877 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)NCC1(CN=[N+]=[N-])CC1 1985101826 YHRLDOLCEVYUOP-UHFFFAOYSA-N 327.385 1.734 10 10 EDCE CC(C)(C)OC(=O)N=c1cc(C(=O)NCC2(CN=[N+]=[N-])CC2)[nH][nH]1 2010392433 ZOFHULHGDILBKU-UHFFFAOYSA-N 335.368 1.999 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CC(N=[N+]=[N-])C3)CO[C@H]2C1 2010403008 YVSFOTANBBSFIA-UTUOFQBUSA-N 337.380 1.389 10 10 EDCE CC(C)(C)OC(=O)NCC1CN(C(=O)c2cc(O)c(O)c(O)c2)C1 2015119667 LOLUTKSFLKHATI-UHFFFAOYSA-N 338.360 1.400 10 10 EDCE C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)[C@@H](C)O)c1ccccc1O 2017514749 KCBLFBFNMZHQBF-MISXGVKJSA-N 338.404 1.844 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCC(N)=O)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2025611066 JOFHTOUFGKUAPL-VHSXEESVSA-N 340.384 1.056 10 10 EDCE CNCc1ccc(N2CCNC(=O)C[C@@H]2C)cc1Br 707625354 HVWVUJNOFWNBCD-JTQLQIEISA-N 326.238 1.883 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4COC[C@H]4C3)c(Br)cc21 718191918 MFPKHUTYMNGLLA-DAROEXNTSA-N 338.205 1.484 10 10 EDCE CC1(C)CO[C@@H](CO)CN1c1ccc(CN)c(Br)c1 2111238646 KBTKWVGIMKSHDC-GFCCVEGCSA-N 329.238 1.884 10 10 EDCE CN(Cc1cc(Cl)cc(Br)c1O)[C@H]1CC(=O)NC1=O 2114731192 AMMQYXGSBIKKER-VIFPVBQESA-N 347.596 1.655 10 10 EDCE CCN(c1ccc(CN)cc1Br)[C@@H]1CC(=O)NC1=O 2114736291 YVLHTXAJBVFCSI-LLVKDONJSA-N 326.194 1.149 10 10 EDCE CO[C@@H]1CN(c2ccc(CO)c(Br)c2)[C@@H](CO)[C@H]1OC 2233354193 OHGKSYGLWAQJKW-BFHYXJOUSA-N 346.221 1.152 10 10 EDCE COC[C@@H]1[C@@H](O)[C@@H](O)CN1c1ccc([C@@H](C)O)cc1Br 2233867577 ZSKXPSZEDBDLNX-ULTHFGNCSA-N 346.221 1.059 10 10 EDCE COc1ccc(Br)c(CNCCn2cnnc2C)c1O 2236035588 FUZLTPKFAHDNTL-UHFFFAOYSA-N 341.209 1.853 10 10 EDCE CN[C@@H](C)c1ccc(N2CC([C@@H](O)CO)C2)cc1Br 2336782488 GNSHPAORBFGBFL-XPTSAGLGSA-N 329.238 1.519 10 10 EDCE O=C1NC(=S)N(c2ccccc2F)C(=O)/C1=C\NC1CCCC1 136678393 GSXIKHWDNPENNC-LUAWRHEFSA-N 333.388 1.990 10 10 EDCE CCOC(=O)[C@@H]1C[C@H](O)[C@H](N=[N+]=[N-])C[C@@H]1NC(=O)OC(C)(C)C 381071205 PETGZSIPWBXEIZ-YTWAJWBKSA-N 328.369 1.893 10 10 EDCE Cc1ccc(CN2CC[C@@H](C(=O)O)[C@@H](O)C2)c(O)c1Br 2381141728 DIHMZWVSEPHPEO-MNOVXSKESA-N 344.205 1.731 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCCN(C)C3=O)CC2)cc1F 294782873 ASDJOAGDVFQQQS-CQSZACIVSA-N 349.406 1.351 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H](C)O[C@@H](C)[C@@H]1C 807102446 ZMYSAAWBYBFKER-KKUMJFAQSA-N 347.459 1.702 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C[C@H](C)O)C(C)C 807098115 TXXNUZUGUBIHNW-AWEZNQCLSA-N 335.448 1.295 10 10 EDCE O=C1CC[C@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCN1 815860650 VIENHDAPQDXKMM-HOCLYGCPSA-N 346.427 1.816 10 10 EDCE Oc1ccccc1CN(C[C@@H](O)CN1CCOCC1)C1CCCC1 733613749 JVYPVCFUYYOEOF-SFHVURJKSA-N 334.460 1.830 10 10 EDCE C[C@@H]1CN(CCO)CCN1C(=O)NCc1ccc(N2CC=CC2)cc1 838486825 SWEVFIZOKNFKRE-MRXNPFEDSA-N 344.459 1.271 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@](C)(O)[C@H](O)C2)cc1Br 1893330954 GOTYXHNCWZRQDJ-CUOATXAZSA-N 329.238 1.791 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)N[C@H](CC4CC4)C3=O)C2)cc1 849356968 IWMIHADVSMSLIU-GOEBONIOSA-N 329.400 1.994 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)Nc2ccc(=O)n(C)c2)cc1 844516407 GOCIBNLCYZVNRF-UHFFFAOYSA-N 344.415 1.994 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3CCC3(OC)OC)CC2)cc1 924830468 APVZUTNMAPINRP-SFHVURJKSA-N 349.475 1.558 10 10 EDCE CC[C@@H](CCO)CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 854300662 XRUIWDKWMVUCSQ-LSDHHAIUSA-N 335.448 1.982 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(c2c(O)cc(O)cc2O)C[C@H]1C(=O)O 1952775797 QPCSPBKJOCGEED-AYVTZFPOSA-N 325.317 1.628 10 10 EDCE COC(=O)[C@@H]1C[C@H]1[C@@H]1NC(=O)N(Cc2ccc(N(C)C)c(F)c2)C1=O 924540058 BMSPPNJZEDOHTB-GYSYKLTISA-N 349.362 1.121 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCSC4(CCC4)CC3)nc12 851708222 AXSMMWCGYYRDBJ-UHFFFAOYSA-N 348.428 1.995 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)NCc1c(O)cccc1F 928705331 JPNCVCJXFWQPIE-UHFFFAOYSA-N 342.367 1.689 10 10 EDCE COc1ccc(O)c(CNC(=O)c2ccn(C3CCOCC3)n2)c1 860241644 LYKZNYPIPXMOHC-UHFFFAOYSA-N 331.372 1.879 10 10 EDCE CN(C)c1ccc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1 872254419 COPOGBCUAHNQJK-BBWFWOEESA-N 330.432 1.120 10 10 EDCE O=C(OCC(=O)N1CCO[C@H]2CCCC[C@H]21)c1cccc(O)c1O 776282126 PGIAANDXHPONKX-OCCSQVGLSA-N 335.356 1.425 10 10 EDCE O=C(NCC[C@H]1CCOC1)NCc1ccc(N2CCOCC2)cc1 784240320 GHEVHVFDJKSAAL-INIZCTEOSA-N 333.432 1.749 10 10 EDCE Cn1ccnc1[C@H]1C[C@@H](NC(=O)Cc2ccc(O)c(O)c2)CCO1 1142058853 WDVHCWZZCQYGGF-SWLSCSKDSA-N 331.372 1.410 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CC(=O)N(C2CCCCC2)C1 1304050000 GIADGOQFJXVFAA-GFCCVEGCSA-N 332.400 1.895 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)Nc2ccc(O)cc2N)n1 2121908058 NFBQPAAVTISBSG-UHFFFAOYSA-N 347.194 1.271 10 10 EDCE CCC(=O)NCC(=O)N1C[C@@H](C)[C@@H](NCc2ccc(OC)c(C)c2)C1 1327850481 WDIMCGXFOVHSRV-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE CN(CCCNC[C@@H]1CCOC1)C(=O)c1ccc(N=NC(N)=O)cc1 1322854109 KNBKYAPFLTVSQH-ZDUSSCGKSA-N 347.419 1.937 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1 1900608310 YUKSUNYQQDZMBV-LLVKDONJSA-N 327.385 1.781 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3C[C@@H]4CCC[C@@H]43)ccc21 1340602636 IMEKYHPYMYMQLN-BHYGNILZSA-N 341.455 1.990 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn2c1NC[C@@H](C)C2 1346737290 YFUNFKPUKHKWLT-MNOVXSKESA-N 330.388 1.717 10 10 EDCE CC[C@@H](C)CNC[C@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1278838190 HECGRCJSLSJRJB-DOMZBBRYSA-N 349.435 1.918 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)C[C@H]2CCNC2=O)cc1C 1270420650 VUEOVAVCWHIDCN-CZUORRHYSA-N 347.459 1.372 10 10 EDCE C[C@H](CNC(=O)CCN(C)C)NC(=O)c1ccc(N=NC(N)=O)cc1 1284323808 FQIZTFKYFVYZDE-LLVKDONJSA-N 348.407 1.035 10 10 EDCE CCn1ncc(C(=O)N[C@@H](C)[C@@H](C)NCc2ccc(OC)c(C)c2)n1 1282124787 QGNDSJMABFYYPG-KGLIPLIRSA-N 345.447 1.912 10 10 EDCE CCO[C@@H](CCN(C)C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1446012319 KDPSXDMSONOGRO-AWEZNQCLSA-N 335.408 1.936 10 10 EDCE O=C1CC[C@@H](CC(=O)NCc2cccc(Br)c2O)CN1 1448954595 AOANDJYRBKLYOV-VIFPVBQESA-N 341.205 1.687 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc2c(nc1O)CCCC2=O 1455350729 UKEBGWYUHVLNIC-UHFFFAOYSA-N 328.324 1.647 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1715977952 HCKBMBYJHJJALI-DZGCQCFKSA-N 333.432 1.076 10 10 EDCE CC[C@H](CNC(=O)Cc1cc[nH]n1)NCc1ccc(OC)c(C)c1 1714068394 WXODUOFHTVZXCV-OAHLLOKOSA-N 330.432 1.954 10 10 EDCE COc1ccc(CNC(=O)[C@@H]2CCN(c3ccncc3)C2)c(O)c1 1638622921 DBYKPFGOROVCJT-CQSZACIVSA-N 327.384 1.939 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2nnnn2C)c1 1567859892 QVWZJZGQRGJCIL-UHFFFAOYSA-N 338.371 1.360 10 10 EDCE COc1cc(CC(=O)NCc2ccc(O)cc2O)cc(OC)c1O 1639444357 ISSFVOZUTKCQBL-UHFFFAOYSA-N 333.340 1.680 10 10 EDCE C[C@@H](CNCC[C@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1699434076 UDGQKGFAJQJVNM-STQMWFEESA-N 347.419 1.984 10 10 EDCE CN1NC(=O)[C@H](CC(=O)N(Cc2ccccc2)c2ccccc2)C1=O 169996217 BENUKRHXNSWUOE-INIZCTEOSA-N 337.379 1.729 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)Nc1ccc(C(N)=O)nc1 163916777 AWVYXMZJNBRVFB-UHFFFAOYSA-N 327.388 1.877 10 10 EDCE CC[C@@H](c1cc(Br)ccc1O)N1CCNC[C@H]1C(=O)O 251116710 VKJPNGROEUBSDH-RYUDHWBXSA-N 343.221 1.964 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985100180 VNZAHWUIAHQCKR-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE CO[C@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)C1CN(C(=O)OC(C)(C)C)C1 2010396295 MXYUAPDULVCRDH-RYUDHWBXSA-N 339.396 1.780 10 10 EDCE CN(C(=O)C1(O)CC(NC(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2022907041 ZRWHDZRENPYTAL-UHFFFAOYSA-N 335.404 1.650 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@@H](O)[C@@H](CO)C2)c(Br)c1 316500848 YYWFUGZHCMJEIO-IXPVHAAZSA-N 343.265 1.909 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)CCCCO)c(Br)cc21 385032947 CREPFORKNLBVBK-ZDUSSCGKSA-N 342.237 1.870 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC4(COC4)C3)c(Br)cc21 697109554 CMYGLAZYENWTLE-GFCCVEGCSA-N 338.205 1.498 10 10 EDCE C[P@]1(=O)C[C@@H](O)[C@H](NCc2ccc(Br)cc2O)C1 2057717503 FSAZETFEEOTBFP-AJLCLMPTSA-N 334.150 1.980 10 10 EDCE N[C@@H]1CC(C(=O)N2CCCc3cc(Br)ccc32)=C[C@@H]1O 2188028361 YSCROLZMRIGBTP-OCCSQVGLSA-N 337.217 1.747 10 10 EDCE OCc1nnc(CNCc2c(O)cccc2Br)s1 2072469891 DEGDICIESAGMMC-UHFFFAOYSA-N 330.207 1.788 10 10 EDCE NC(=O)[C@H]1CCN1c1ccc(C=CC(=O)O)cc1Br 2089361084 CSNAIINLJKIXHE-LLVKDONJSA-N 325.162 1.611 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](CO)C[C@H]2CO)cc1Br 2089864584 VKONHADHOSVJKS-FOGDFJRCSA-N 330.222 1.682 10 10 EDCE O=C1Nc2cc(N3C[C@H](O)C34CCC4)c(Br)cc2[C@@H]1O 2201417317 UJZZNLRBRZTSET-RYUDHWBXSA-N 339.189 1.538 10 10 EDCE OC[C@@H]1NC[C@H]2CN(Cc3cc(Br)ccc3O)C[C@H]21 2227311131 AIUODBZGLWQQJH-UHTWSYAYSA-N 327.222 1.167 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]12CCO[C@@H]1CN(C(=O)OC(C)(C)C)C2 2253350770 LFTXIWBPDFUZGO-ABAIWWIYSA-N 339.396 1.781 10 10 EDCE O=C1NC(=S)N(C2CC2)C(=O)C1=CNc1ccccc1C(=O)O 2296109998 CEDFWNIZYOBMCL-UHFFFAOYSA-N 331.353 1.086 10 10 EDCE CSc1ncc(CNC[C@@H]2CCCN(S(C)(=O)=O)C2)s1 2284636662 LGFROXKVXUTAMK-JTQLQIEISA-N 335.520 1.626 10 10 EDCE CC1(C)OC(=O)C(=CN=c2ccnc(-c3ccccn3)[nH]2)C(=O)O1 2295063834 QUVHDXJRNRWSHJ-UHFFFAOYSA-N 326.312 1.092 10 10 EDCE COc1ccc(C=C2SC(=S)N(CC(=O)O)C2=O)cc1O 2297552991 PQRRLGSTFNAABF-UHFFFAOYSA-N 325.367 1.687 10 10 EDCE Oc1ccccc1CN1CCN(C[C@H](O)COc2ccccc2)CC1 179572627 QFKNLWWHEGEKIL-SFHVURJKSA-N 342.439 1.950 10 10 EDCE COCCNC(=O)c1cccc(NC(=O)Cc2ccc(N)cc2)c1 66153957 KCJMCBOZIJJJTH-UHFFFAOYSA-N 327.384 1.826 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@H]4OCCC[C@H]4C3)cc2N1 301694624 ALSDWARYGBMAIH-HZMBPMFUSA-N 333.344 1.931 10 10 EDCE CC[C@]1(CO)CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 302380335 GOZVUBLJBYQNLB-INIZCTEOSA-N 335.360 1.915 10 10 EDCE CN1C(=O)C(=C/C=C\c2ccc(N(C)C)cc2)C(=O)N(C)C1=S 33328983 LHXNFDGSZVTQAW-WAYWQWQTSA-N 329.425 1.908 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H](C)C(=O)N(C)C)CC2)cc1 46970082 RSZGIFLDVWZUGE-ZDUSSCGKSA-N 334.420 1.004 10 10 EDCE COCCN1CCCN(Cc2ccc(N3CCOCC3)cc2)CC1=O 191695720 WZHJKLGZKZSENO-UHFFFAOYSA-N 347.459 1.204 10 10 EDCE CO[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@H]1C 276260347 MQOOCBUECGYMHO-YGRLFVJLSA-N 342.417 1.261 10 10 EDCE O=C(CN1CCCNC1=O)NCc1cc(Br)ccc1O 804735133 MFUIKXJRCBXZTA-UHFFFAOYSA-N 342.193 1.186 10 10 EDCE CO[C@H]1C=CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2165073156 HZOVOPFDEQBSFO-SDBXPKJASA-N 338.205 1.792 10 10 EDCE CN(C)c1ccc(/C=C/CNc2cnn(CC(=O)NCCO)c2)cc1 835043944 CVFHHXVSKOQCIJ-ONEGZZNKSA-N 343.431 1.183 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)CN2CCN(C3CC3)C2=O)c1 830541528 ZJRPHVRGTIPFKF-LLVKDONJSA-N 333.388 1.478 10 10 EDCE CCc1nc[nH]c1C(=O)N1CCN(c2ccc(OC)cc2OC)CC1 913482571 QYSMTMROYGPVHM-UHFFFAOYSA-N 344.415 1.952 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCNC[C@H]2C)cc1 842208522 WIWPXCLYDJEAIL-RHSMWYFYSA-N 346.475 1.263 10 10 EDCE C[C@H](N)CNC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 841866686 NJJNLZXLIJKGFH-HNNXBMFYSA-N 345.491 1.365 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H](CN)C(F)(F)F)CC2)cc1 848596654 ZRGZPZOJYGTBOG-ZDUSSCGKSA-N 346.353 1.416 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1CCNC[C@H]1C)c1ccc(N(C)C)cc1 842201777 BZKYJOXPRKIRJU-DVOMOZLQSA-N 332.448 1.044 10 10 EDCE CCN(CC)c1ccc(CNC(=O)Cc2ccc(C(N)=O)nc2)cc1 858605726 XTRAUVZXOZPGRY-UHFFFAOYSA-N 340.427 1.886 10 10 EDCE COc1cccc(CNS(=O)(=O)c2ccc3c(c2)N(C)CC3)c1O 751309202 ITCLIPOMOXJXNP-UHFFFAOYSA-N 348.424 1.872 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O[C@@H](N)Cc2ccc(O)c(O)c2)C1 1952762024 SWHNTCCQQRPIGH-SWLSCSKDSA-N 338.404 1.951 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C[C@H]3CCC(=O)N3C)C2)cc1 855227729 ZLYPJDSCGAMWOJ-UKRRQHHQSA-N 331.416 1.401 10 10 EDCE NC(=O)C1CCN(c2ccc(CN[C@@H]3C[C@@H](N)C34CCC4)cc2)CC1 925775818 AQSYDGRIKOZMMU-QZTJIDSGSA-N 342.487 1.748 10 10 EDCE CCOC(=O)C(C)(C)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855233781 MSTOANIXCBAOAR-ZDUSSCGKSA-N 334.416 1.979 10 10 EDCE Cn1[nH]c([C@@H]2CCCN2Cc2ccc(N3CCOCC3)cc2)nc1=N 930318104 ZUCDGOHOMBYJPI-INIZCTEOSA-N 342.447 1.401 10 10 EDCE CCN(CC)c1ccc(CN2CCO[C@H](CNC(=O)NC)C2)cc1 862461791 ROZHXEZTURBDLC-QGZVFWFLSA-N 334.464 1.663 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@H](CS(=O)(=O)NC)C2)c1 862552286 VIFHZLBEWPYOJI-ZDUSSCGKSA-N 342.461 1.552 10 10 EDCE O=C(C[C@@H]1CCNC1=O)NCc1ccc(N2CCC(CO)CC2)cc1 878302454 NNANIDCJEKQLFZ-INIZCTEOSA-N 345.443 1.038 10 10 EDCE CN(Cc1ccns1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 897361994 XZEPGMWQDUHCMD-UHFFFAOYSA-N 332.429 1.484 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@H](O)CC(F)(F)C3)ccc21 786731882 GTWUBLCJNIZIRU-CQSZACIVSA-N 339.386 1.981 10 10 EDCE CC(=O)N[C@@H]1CCc2cc(O)c(O)c(O)c2-c2ccc(O)c(=O)cc21 197496979 AQAJIZGCFLTZFB-GFCCVEGCSA-N 343.335 1.660 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)c1cn(C(F)(F)CO)nn1 1157050467 HFGISKQWJWRREE-UHFFFAOYSA-N 348.309 1.609 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2126152067 CSZXIXDJKICSJB-DHPDLVEQSA-N 327.222 1.086 10 10 EDCE COc1ccc(NC(=O)c2c(F)ccc(O)c2O)cc1NC(N)=O 1183333948 OVPAHXKLJROJDM-UHFFFAOYSA-N 335.291 1.988 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2ccc(C(N)=O)[nH]2)cc1C 1265827158 NEZXFZPGLXYXBF-LBPRGKRZSA-N 344.415 1.339 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@@H](C[C@@H]1COCCO1)C(F)(F)F 1350935416 IJEZQBHPMUVQJT-GHMZBOCLSA-N 349.305 1.698 10 10 EDCE COCCCC(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1285627309 NAASBEDPCXGBRR-LLVKDONJSA-N 349.391 1.510 10 10 EDCE C[C@H](CNC(=O)C(C)(C)F)NC(=O)c1ccc(N=NC(N)=O)cc1 1526332550 LRIAVSYKIJGVFI-SECBINFHSA-N 337.355 1.832 10 10 EDCE CCN(CC)CC[C@@H](CO)NC(=O)c1ccc(N=NC(N)=O)cc1 1618205095 OCNFWTYGICPKAT-AWEZNQCLSA-N 335.408 1.672 10 10 EDCE CC(C)=CCNC[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1700976721 CCMXRRGNWCJYRN-OAHLLOKOSA-N 347.419 1.838 10 10 EDCE O=C(O)[C@@]1(CO)CCCN1Cc1ccc(Br)cc1O 2136360229 QPHWGGAVGBQYKR-ZDUSSCGKSA-N 330.178 1.566 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@@]2(C)CCNC2=O)cc1C 1482870712 GIBVPKICZIYION-KUHUBIRLSA-N 347.459 1.514 10 10 EDCE CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1cccc(O)c1O 1558159828 MWPGZYPTRPJCDP-WFASDCNBSA-N 349.431 1.934 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)CCn1cccn1 1567321817 GUKNVGYKTZMDSD-UHFFFAOYSA-N 343.391 1.407 10 10 EDCE O=C(CCn1cnc2sccc2c1=O)NCc1cccc(O)c1O 1633506911 CNHHXADTZPTHMD-UHFFFAOYSA-N 345.380 1.576 10 10 EDCE COC(=O)[C@]1(O)CCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 1636664721 QSKHHCHULOKDSX-HNNXBMFYSA-N 337.353 1.063 10 10 EDCE CC[C@@H](CNC(=O)C(C)C)NCc1nnnn1-c1ccc(OC)cc1 1665759843 LIABZYBGNAOODS-ZDUSSCGKSA-N 346.435 1.311 10 10 EDCE C[C@H](O)CCCNC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1670906978 LGQYFKKIANOGAD-LBPRGKRZSA-N 347.419 1.862 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1C[C@H]1C)NC(=O)c1cc(OC)nc(OC)c1 1688765526 IFULWDALYNETCA-RAIGVLPGSA-N 335.404 1.379 10 10 EDCE O=C(c1cc(O)c(O)c(O)c1)N1CCCN(C(=O)C(F)(F)F)CC1 169843878 CLZDESCSNZVYBM-UHFFFAOYSA-N 348.277 1.040 10 10 EDCE CNC(=O)C(C)(C)CNC(=O)c1c(C)oc(-n2cccc2)c1C#N 154374366 PHSBAIXVWDYJOC-UHFFFAOYSA-N 328.372 1.752 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1990023616 BTAYESPMJYXWFA-MNOVXSKESA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)[C@H]1CCCO1 2004956449 DWADSJIEVKIBBV-HBJVGIJOSA-N 340.420 1.324 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2010404475 ASTLQIHDGAZASU-GHMZBOCLSA-N 341.412 1.809 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2COC[C@]2(C(=O)NCCCN=[N+]=[N-])C1 2010403247 BIALTXYSMQKIJU-XHDPSFHLSA-N 339.396 1.687 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C1CSC1 2028430230 PAUCFUVRPBKWML-LLVKDONJSA-N 329.219 1.986 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](C(CO)CO)C2)c(Br)c1 2170674545 STHDDFPRRDDOLP-PWSUYJOCSA-N 343.265 1.896 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCC[C@]45OCC[C@@H]4C[C@@H]35)c2n1 2064564381 ACFKINQQOZXYRW-KEIZMWOVSA-N 342.399 1.821 10 10 EDCE NCc1ccc(N2C[C@H](O)C3(CCOCC3)C2)cc1Br 2174365524 SZUHOZNLHBGHBC-AWEZNQCLSA-N 341.249 1.886 10 10 EDCE O=C1C[C@@H]2CCN(Cc3c(O)cccc3Br)C[C@@H]2N1 2088806651 RWEGELXWMQQNDB-CABZTGNLSA-N 325.206 1.865 10 10 EDCE O=C1C[C@H]2CC[C@@H](CN1)N2c1ccc(CO)cc1Br 2114121645 OGXXDTVFPLWDRV-MNOVXSKESA-N 325.206 1.799 10 10 EDCE Nc1ccc(OCC(=O)NCc2conc2Br)cc1 2230534795 DJDDJXODONHQRG-UHFFFAOYSA-N 326.150 1.715 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCC(=O)NC2=O)c1O 2236050010 ZEURFWQQDRMEHB-SECBINFHSA-N 343.177 1.058 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3C[C@H]3[C@@H]2CN)c1O 2227742870 KVANISKKKKWZRU-SBMIAAHKSA-N 327.222 1.942 10 10 EDCE OCc1ccc(N2C[C@H]3OCCC[C@@]3(CO)C2)c(Br)c1 2238831450 XVWUCFWOTDZYBN-CABCVRRESA-N 342.233 1.919 10 10 EDCE CC(C)(C)OC(=O)NCC1(Oc2ccc(N)cc2)CS(=O)(=O)C1 2243486304 MSVIZOILRDTOGB-UHFFFAOYSA-N 342.417 1.340 10 10 EDCE CC[C@@H](C)N1C(=O)C(=CNc2cccc3nonc23)C(=O)NC1=S 2296555056 NASGDXJYSRVWFW-MRVPVSSYSA-N 345.384 1.560 10 10 EDCE C[C@@H](NC(=O)C=Cc1ccc(O)c(O)c1)C(=O)NCc1ccccc1 2307986571 JTOGBAVVOBHFJF-CYBMUJFWSA-N 340.379 1.932 10 10 EDCE Cc1ccc(CN[C@@H]2CCC[C@@H](O)[C@H]2O)c(O)c1Br 2352669251 CBLMQUWASXWXBA-GYSYKLTISA-N 330.222 1.827 10 10 EDCE Cc1ccc(CNC(=O)c2cc(=N)[nH][nH]2)c(O)c1Br 2352692243 IRXGALZBBHPXTK-UHFFFAOYSA-N 325.166 1.529 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)N(C)CC(C)(CO)CO 305819244 NXKNAIOAYGDWKT-UHFFFAOYSA-N 331.372 1.313 10 10 EDCE Cc1cccc(CN2CCN(S(=O)(=O)c3cccnc3)CC2)c1O 179720419 STUKPBKSJXSJAC-UHFFFAOYSA-N 347.440 1.602 10 10 EDCE NCc1ccc(-c2csc(NS(=O)(=O)c3cn[nH]c3)n2)s1 37745162 NGZCUJZPZIGGCL-UHFFFAOYSA-N 341.443 1.854 10 10 EDCE Cn1ncnc1CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 74912767 DIQJLWACBLJHIH-AWEZNQCLSA-N 345.403 1.412 10 10 EDCE O=C(CNC(=O)c1ccccn1)NCc1c(O)ccc2c1CCCC2 75159394 MEJJACIVZWAIOV-UHFFFAOYSA-N 339.395 1.712 10 10 EDCE CO[C@@H]1C[C@@H](c2nc(C)no2)N(Cc2cc([N+](=O)[O-])ccc2O)C1 190101883 VICHFCUAWKGBBA-OLZOCXBDSA-N 334.332 1.954 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@H]2CNC[C@@H]2O)c1C 262382356 XDYBWDKWOADTJS-QAPCUYQASA-N 327.428 1.713 10 10 EDCE CN(C)[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 365226599 DVOLYBWQXSHQNI-LLVKDONJSA-N 334.376 1.846 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CCOCC[C@H]3C)CC2)cc1 374977952 IZEQBVYOWDEUHU-MRXNPFEDSA-N 347.459 1.455 10 10 EDCE Cc1ccc(CN(CCN(C)C)CC(=O)O)c(O)c1Br 2380811366 KGLOFESEKOLLNO-UHFFFAOYSA-N 345.237 1.911 10 10 EDCE COC(=O)NC(=O)CN(C)Cc1ccc(C)c(Br)c1O 2381129015 CXZAYXVKCQAIRR-UHFFFAOYSA-N 345.193 1.778 10 10 EDCE COc1cccc(CNC(=O)[C@@H]2CCc3nnc(C4CC4)n3C2)c1O 815834373 GSNLFQLKOQEWKW-CYBMUJFWSA-N 342.399 1.749 10 10 EDCE C[C@@H](NC(=O)NCCCc1ncn(C)n1)c1ccc(N(C)C)cc1 826532303 UBAMTSHWSYIYGY-CYBMUJFWSA-N 330.436 1.874 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3cc(Cl)cc(F)c3O)C[C@@H]12 827390049 SGPMTNVCZZGPIV-UHTWSYAYSA-N 349.811 1.429 10 10 EDCE CNS(=O)(=O)C1CCN(C/C=C\c2ccc(N(C)C)cc2)CC1 835028145 JXJVKUXXYRXHHZ-PLNGDYQASA-N 337.489 1.779 10 10 EDCE COC[C@]1(C(=O)NCc2cc(Br)ccc2O)CCOC1 831936820 GXTNNMFKVVUNMV-CQSZACIVSA-N 344.205 1.824 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@@H]2CCCCN2CCO)cc1 836223481 BKOLAAOYZNKGFY-KRWDZBQOSA-N 334.464 1.399 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)/C=C/Cn3cncn3)C2)cc1 912291866 FFBTZHXNUGXHFF-HSWBROFVSA-N 327.388 1.238 10 10 EDCE Cc1c(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)nnn1C 741543698 DXFLCSCKRUVDRB-GFCCVEGCSA-N 329.404 1.451 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cncc(C=O)c3)CC2)cc1 929249542 IYINETVDWANRKM-UHFFFAOYSA-N 325.368 1.865 10 10 EDCE CN(C)c1ccc(CNC(=O)NCc2nnc(O)n2C2CC2)cc1F 923866116 CHSXWWWNHIMCFD-UHFFFAOYSA-N 348.382 1.523 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@H]3CC[C@@H](C2)[S@@]3=O)cc1 859885963 PMSGFZPKRLICQR-XVTZWQNCSA-N 349.500 1.354 10 10 EDCE C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@@H](CCC2OCCO2)C1=O 924714926 DOVXPASGBILDCM-WFASDCNBSA-N 347.415 1.887 10 10 EDCE COc1ccc(CN[C@@H]2CCN(c3ccc4nncn4n3)C2)cc1C 858245495 RYXQTYICRBPRMZ-OAHLLOKOSA-N 338.415 1.810 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCc3cncnc3)C2)cc1 855226654 PKNQFPPIXQPOOA-HNNXBMFYSA-N 326.400 1.813 10 10 EDCE COCc1nc(C(=O)NCc2c(O)ccc3c2CCCC3)n(C)n1 853802785 GRBUNVQFWPCBLY-UHFFFAOYSA-N 330.388 1.476 10 10 EDCE Oc1ccccc1CN1CCC[C@@H](c2cc(N3CCNCC3)n[nH]2)C1 853248534 HGVCUXFEJQUJFQ-OAHLLOKOSA-N 341.459 1.905 10 10 EDCE COc1ccc(N2CCN(CCO[C@@H]3CCOC3)CC2)c(OC)c1 931530822 QIXOPLPKQPQQMO-MRXNPFEDSA-N 336.432 1.631 10 10 EDCE COCCN1CCCN(Cc2cc(F)c(N(C)C)cc2F)CC1=O 862338989 JEYIOWKEVJHMCX-UHFFFAOYSA-N 341.402 1.712 10 10 EDCE CCOC(=O)[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1118934896 BPQCLHGFBSCKJG-CYBMUJFWSA-N 346.383 1.036 10 10 EDCE COCCC1CN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 1118692644 RCAUAFRIOASEPG-ZDUSSCGKSA-N 333.432 1.425 10 10 EDCE O=C(NCc1ncn(Cc2cccc(F)c2)n1)c1cccc(O)c1O 781815448 VLVOZIDQJUUOJJ-UHFFFAOYSA-N 342.330 1.807 10 10 EDCE CN1CCN(c2ccncc2NC(=O)Cc2ccc(O)c(O)c2)CC1 1136352662 HYKQLTPAVJQGTG-UHFFFAOYSA-N 342.399 1.426 10 10 EDCE COCCNCc1ccc(N(C)[C@@H](C)C(N)=O)c(Br)c1 711090081 KXMUHBPFGLZMFH-JTQLQIEISA-N 344.253 1.495 10 10 EDCE Cc1nc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n[nH]1 1313383754 YGJZQBPJXSDICJ-CQSZACIVSA-N 345.403 1.710 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H]2CNCCCO)cc1 1324285613 KXQDCUICQYTKEY-CQSZACIVSA-N 333.392 1.426 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC3(CC2)CC(=O)N3)c([N+](=O)[O-])c1 1320935107 QBABQZDGPXMCID-HWKANZROSA-N 345.355 1.640 10 10 EDCE CO[C@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1335546074 FUKWRICWNRKRKX-CABCVRRESA-N 337.395 1.144 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCC[C@@H]2CNCCO)cc1 1268293429 BVZSODLNBXKPJE-TZMCWYRMSA-N 333.392 1.329 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NC2C[C@H]3C[C@@H]3C2)cc1 1332820739 YDMLQVSXRDFPLT-ZIAGYGMSSA-N 345.443 1.505 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCOC[C@H]2C)cc1 1345139774 NRIQEDARFRQQAZ-PBHICJAKSA-N 347.459 1.690 10 10 EDCE C[C@@H]1CC[C@@H](C(N)=O)CN1c1ccc(CN)cc1Br 212868109 BBLRJEAJCLZCCY-MWLCHTKSSA-N 326.238 1.998 10 10 EDCE CCNC(=O)CN[C@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1278025371 MLSWXJRSDRJISX-LLVKDONJSA-N 348.407 1.035 10 10 EDCE CCN(CC(N)=O)c1ccc(C=CC(=O)O)c(Br)c1 1912076048 AFIPTZPPMBFLQQ-UHFFFAOYSA-N 327.178 1.859 10 10 EDCE COC(=O)C1(NCc2ccccc2O)CN(C(=O)OC(C)(C)C)C1 1913939699 HFTCILQYKPRZGY-UHFFFAOYSA-N 336.388 1.644 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)C[C@@H]2CO)c(Br)c1 2136084260 ZVGPQEIQFOHTKU-WCQGTBRESA-N 330.222 1.824 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccnc2[nH]c(O)nc12 1629931319 GQHTYTZNRIMMNG-UHFFFAOYSA-N 339.355 1.769 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC1CCN(CC(F)F)CC1 1569919210 BVPRAHDOIUHIAI-UHFFFAOYSA-N 328.359 1.734 10 10 EDCE CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(O)c(O)c1 1643415699 LJYLBACKKRKEAD-HNNXBMFYSA-N 340.379 1.340 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@H](NC(=O)CC(C)C)C2)cc(OC)n1 1737440220 ISPCOMUVGCFZNZ-JOCQHMNTSA-N 335.404 1.522 10 10 EDCE CCOCC(=O)NC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1738437920 HMIGXCMRDCZTJS-XWQBDTFCSA-N 347.375 1.288 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCC[C@H]2CNCCCO)cc1 1667778466 MDUPNQFPAJWNRH-ZFWWWQNUSA-N 347.419 1.720 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2CC[C@H]2C(N)=O)cc1C 1670205344 WZUKIZHGIBCHRI-HZPDHXFCSA-N 347.459 1.453 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)N[C@H]1CS(=O)(=O)C[C@H]1C 1685295981 ZXJYGNIQGGWCLF-OCCSQVGLSA-N 340.445 1.747 10 10 EDCE C[C@H](O)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 1858592162 IDDYOOIRZARJAI-OMOYZJFYSA-N 339.394 1.427 10 10 EDCE CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCCCN=[N+]=[N-] 1963699269 OODOUAPDJJSBAX-NSHDSACASA-N 326.401 1.354 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985094088 JYAWFRUWVOZJCN-QWRGUYRKSA-N 326.401 1.353 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]1(N(C)C(=O)OC(C)(C)C)CCOC1 1985101958 ZWNLPOFTNHMECB-AWEZNQCLSA-N 327.385 1.781 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@]2(C1)C(=O)NCCN2CCN=[N+]=[N-] 2018432652 JGXYAYKDPZMLIG-OAHLLOKOSA-N 338.412 1.498 10 10 EDCE CN(C)C[C@@H]1C[C@H](O)CN1c1cc(Br)c(CN)cc1F 380293330 DVNIODDBYBPCKB-QWRGUYRKSA-N 346.244 1.548 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCCOCc1ccccc1 390067666 DFTDKAUZYYAADN-HNNXBMFYSA-N 330.384 1.301 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCC3CCN(C4CC4)CC3)c2n1 2063208163 FUDABHBRBJZCKO-UHFFFAOYSA-N 329.404 1.348 10 10 EDCE CCCN(C)C[C@H]1CCN(C(=O)c2cnn3c(O)cc(C)nc23)C1 2063772800 XQQBNBIPOHMHLI-CYBMUJFWSA-N 331.420 1.547 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CNCc2ccc(F)c(F)c2O)C1 895206304 JFEJQPDZLZCGBZ-UHFFFAOYSA-N 344.358 1.742 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC=CC[C@@H]3CO)c(Br)cc21 2176342982 NBNVZVHHUHQAOA-OQPBUACISA-N 338.205 1.528 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](C(CO)CO)C2)cc1Br 2170641579 DJTSTFFUOLZAIX-QWRGUYRKSA-N 344.249 1.930 10 10 EDCE CCNCc1ccc(N(C)Cc2nnn(C)n2)cc1Br 2197843962 AVYDJNVNSJPDIM-UHFFFAOYSA-N 339.241 1.719 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1NC(=O)Cc1ccc(N)cc1 2044229787 ACXRFGVFZXLONX-LSDHHAIUSA-N 349.431 1.610 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@H](CCCOc2nnc(=N)[nH]n2)C1 2213781048 NKXFCIAKFJRRQU-LLVKDONJSA-N 338.412 1.485 10 10 EDCE CNCc1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2336474340 WLVRSOLZMSSVOJ-MFKMUULPSA-N 345.262 1.402 10 10 EDCE CC1=NN(c2nc3ccccc3[nH]2)C(=O)/C1=C/NCCc1c[nH]cn1 101771980 AIMAJZRTBMINHV-UKTHLTGXSA-N 335.371 1.725 10 10 EDCE CC(=O)N1CC[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 175267642 ZZSKMBOPEALJPF-DLBZAZTESA-N 346.427 1.768 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2357592856 OMMZMMCTXLEQQK-FSJWZZSZSA-N 341.249 1.789 10 10 EDCE CC(=O)NCCCOC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255640897 OPKZPESVHAVZIE-YVMONPNESA-N 332.400 1.606 10 10 EDCE Cc1ccc([C@H](C)NC[C@@]2(CO)COCC3(CCC3)N2C)c(O)c1 527956549 PYNDAXCJJSGAOS-HNAYVOBHSA-N 334.460 1.967 10 10 EDCE CN1CCCc2cc(CNC(=O)COCc3nncn3C)ccc21 292912406 FLZMTMXKYNYCDR-UHFFFAOYSA-N 329.404 1.031 10 10 EDCE COC[C@H](O)CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 819199954 IGJWNKCPCZQBGS-LJQANCHMSA-N 333.476 1.316 10 10 EDCE C[C@H](NC(=O)[C@H]1CCN=C2C1=NNN2C)c1ccc(N(C)C)cc1 832431231 LWGAYKVLEYHZKD-FZMZJTMJSA-N 328.420 1.154 10 10 EDCE CN(C)c1ccc(CNC(=O)CS(=O)(=O)NC(C)(C)C)cc1 919687092 SQQZXMGPMYQJHK-UHFFFAOYSA-N 327.450 1.087 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@@H]2C[C@@H]3COC[C@@H]3O2)c1 926648564 ASHBSCFGNFSHBI-BQNAKDMGSA-N 336.388 1.565 10 10 EDCE CC[C@H](NCC[C@H]1CNCCS1(=O)=O)c1cc(Cl)ccc1O 925787797 CMZWPIKNISSCLT-JSGCOSHPSA-N 346.880 1.863 10 10 EDCE C[C@H](NCC[C@H]1CNCCS1(=O)=O)c1cc(F)cc(F)c1O 925800601 VTYSOOAQPGJSKT-ONGXEEELSA-N 334.388 1.098 10 10 EDCE C[C@@H]1CC2(CO1)CC(NC(=O)C(=O)NCc1ccc(N(C)C)cc1)C2 929238642 QXFKFWAKZOIIPI-VZDIAYEVSA-N 345.443 1.443 10 10 EDCE COC[C@]1(C(=O)OC)CCCN1C(=O)/C=C/c1ccc(O)c(O)c1 855375402 OMDDZCTVHHJYCK-UABRLCRWSA-N 335.356 1.292 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCO[C@@H]([C@@H](C)O)C3)C2)cc1 854296623 FJOBQHPVOMKSOA-JKIFEVAISA-N 349.431 1.065 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC[C@@H]3C(F)F)CC2)cc1 931416055 FUEHKDSTBHGYDJ-OAHLLOKOSA-N 339.386 1.683 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)C[C@@]2(C)CO)cc1Br 698158828 WUBIMIPSVXEAHH-CHIMOYNISA-N 330.222 1.824 10 10 EDCE Cc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(OC(C)C)nn2)c1 862024988 KGZJOILLWPZPIF-UHFFFAOYSA-N 344.371 1.533 10 10 EDCE C[C@]1(Br)C[C@@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 860116269 MWMNERAEOIMFNZ-OQPBUACISA-N 329.146 1.997 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(C(=O)N2CCCC2)CC1 779493786 OZZKNXAONWBYGK-GQCTYLIASA-N 344.411 1.972 10 10 EDCE C[C@@H](NC(=O)c1ccc(-n2cnnn2)cn1)c1ccc(N(C)C)cc1 1128135475 DLQRKZZAJUFQBY-GFCCVEGCSA-N 337.387 1.614 10 10 EDCE C[C@H](NC(=O)[C@@H]1CC[C@H](C(N)=O)C1)c1ccc(N2CCOCC2)cc1 888455048 JPDCMKLFSICPJP-CWRNSKLLSA-N 345.443 1.602 10 10 EDCE Nc1ccc(Cn2c(=O)c(-c3ccccc3N)nn3cnnc23)cc1 82719394 MJMPWRMUTQHXSE-UHFFFAOYSA-N 333.355 1.166 10 10 EDCE COC(=O)[C@H](CNC(=O)c1cccc(O)c1O)Cc1cccc(F)c1 790657429 GJMOCNMMPMFKIQ-LBPRGKRZSA-N 347.342 1.999 10 10 EDCE C[C@H](O)c1ccc(N2CCN(C)C[C@H]2CO)c(Br)c1 699431919 HGYGEWDMFONQJD-JQWIXIFHSA-N 329.238 1.615 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCCc1cnn(C)n1 1304794865 QUWAIDLZPKQFOE-UHFFFAOYSA-N 341.419 1.690 10 10 EDCE COC(C)(C)[C@H](C)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1332903063 QVKUPKFRTCPDHR-AWEZNQCLSA-N 345.443 1.609 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)CC1CC1 1358414361 SYQOWAIIIUBILC-JTQLQIEISA-N 331.376 1.884 10 10 EDCE COc1cc(OC)c(OC)cc1CNC(=O)Cc1ccc(O)c(O)c1 1442986393 LXZDGUMTSUIDOT-UHFFFAOYSA-N 347.367 1.983 10 10 EDCE Cc1ccc(C(=O)N2CCc3c(cccc3C(N)=O)C2)c(O)c1O 1470481327 CQKPCJRKEFOZCT-UHFFFAOYSA-N 326.352 1.704 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3C(C(N)=O)[C@H]3C2)cc1Br 2136607113 NJFBNZMMPTVOBA-YUMQZZPRSA-N 328.185 1.214 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCc2nc3ncccn3n2)c1 1478840224 RJYMURVWCIYOQF-JTQLQIEISA-N 342.359 1.399 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc2c(nc1O)CCOC2 1556515928 SGMTXBCVENWHNG-UHFFFAOYSA-N 349.383 1.981 10 10 EDCE CO[C@@H](C)C(=O)NC/C=C/CNC(=O)c1ccc(N=NC(N)=O)cc1 1721805121 DAJGGPWZZPKAEW-XPCNCWMISA-N 347.375 1.286 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1C[C@H]1C(N)=O 1568775746 JKGMMKBNZOYFTD-CABCVRRESA-N 333.432 1.063 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cc(C)n(NC(N)=O)c2C)c1 1566374864 WNQGIRFEGALHTB-SNVBAGLBSA-N 346.387 1.932 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ncccc2F)cc1C 1732663881 QBJFKHMMZWUMKA-CQSZACIVSA-N 347.390 1.418 10 10 EDCE NC(=O)c1cccc(CN(C(=O)Cc2ccc(O)c(O)c2)C2CC2)c1 1640927919 GWEFMOPYLJVCJW-UHFFFAOYSA-N 340.379 1.930 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2cccnc2)cc1C 1571422346 YENGONAFLLCCKM-MRXNPFEDSA-N 329.400 1.279 10 10 EDCE CC(C)(F)C(=O)NCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1759872931 JANGNXAWOLCXLA-UHFFFAOYSA-N 349.366 1.976 10 10 EDCE NCc1ccc(N2CCCC[C@@H]2C(N)=O)c(F)c1Br 231839476 KCLQHUYICIYBLX-SNVBAGLBSA-N 330.201 1.891 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2nc([C@H]3CCCO3)n[nH]2)c1 1683440660 FSSXHLYZZXZMDQ-CYBMUJFWSA-N 331.376 1.670 10 10 EDCE C[C@@H](O)CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1691238663 BIDIZGLBQXNGBT-LLVKDONJSA-N 333.392 1.424 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H](CC(=O)NCCN=[N+]=[N-])C1 1965101637 GCNYESHBGVPADV-GHMZBOCLSA-N 327.385 1.875 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](CO)[C@@H](NCc2ccc(N)cc2)C1 2005088542 JYSACSHFAFOBLY-ZBFHGGJFSA-N 335.448 1.976 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1C(=O)NCCCCN=[N+]=[N-] 1985103234 RYOIVZNLHKFQLF-QWRGUYRKSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CCC(=O)NCc1ccc(N)cc1 2022941668 DRWRDKJRSVALIO-CQSZACIVSA-N 337.420 1.551 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(CCC(N)=O)Cc3ccccc3)ccc21 2034754819 SEUKJQYIHJWKRO-GOSISDBHSA-N 338.411 1.781 10 10 EDCE CO[C@@H]1CN(c2cc(Br)c(CN)cc2F)[C@@H]2COC[C@H]12 2158361209 HGGKNXOFUMJRGF-CUOATXAZSA-N 345.212 1.897 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)c(Br)c1 2178085181 CXGPSLOCZFIQAO-NYMYIZQJSA-N 341.249 1.912 10 10 EDCE CO[C@@H]1C[C@@H](N(C)C(=O)c2cnn3c(O)cc(C)nc23)C12CCC2 2062331858 QXVMWXFOCMKUIA-CHWSQXEVSA-N 330.388 1.773 10 10 EDCE CN1C[C@@H](O)[C@H](N(C)c2ccc(CNC(=O)OC(C)(C)C)cc2)C1 1906125935 DXVARNJKCVSACQ-HZPDHXFCSA-N 335.448 1.822 10 10 EDCE CN1CCc2cc(CN[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)ccc21 2062449520 AHNFHSCIAQNMIH-DOTOQJQBSA-N 347.459 1.749 10 10 EDCE C[C@@]1(NC(=O)C(F)(F)F)CCN(C(=O)c2cc(O)c(O)c(O)c2)C1 2068627238 FSYOPFJTWFEHAD-CYBMUJFWSA-N 348.277 1.087 10 10 EDCE CC(=O)N[C@H]1CCCN(C(=O)NCc2ccc(N(C)C)c(F)c2)C1 57647297 JCQNDXDEWCUAQP-AWEZNQCLSA-N 336.411 1.702 10 10 EDCE C[C@@H](O)CCCN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2361180310 CZEDYARJICROEL-OQPBUACISA-N 342.237 1.998 10 10 EDCE C[C@@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)cc1Br 2357052506 KNLOKVZNYDKAAK-MAMIUBEXSA-N 341.249 1.932 10 10 EDCE N[C@]1(C(=O)O)CCCc2cc(I)cc(O)c21 309568379 VALLVPVMSGUAOF-LLVKDONJSA-N 333.125 1.572 10 10 EDCE C[C@@H](NC[C@@H](C)N1CCOCC1)c1ccc(N2CCOCC2)cc1 123213970 FKJGYCQFAMDKLV-IAGOWNOFSA-N 333.476 1.895 10 10 EDCE C[C@]1(O)CCCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255615939 OZSXTQHRSVLEIJ-ZXYDQQDNSA-N 330.428 1.910 10 10 EDCE CN(CCCCO)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 284290726 UGTYXXDTWPJOOX-UHFFFAOYSA-N 333.432 1.134 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](NC(=O)c1c(F)cccc1F)C(C)C 808483224 HAWKOPMVTRVORM-AWEZNQCLSA-N 341.310 1.421 10 10 EDCE C[C@H]1CN(c2ccc(/C=C\C(=O)O)c(Br)c2)CC(=O)N1 395672681 CLUBVLZOIMQFKE-LVCFMKKZSA-N 339.189 1.872 10 10 EDCE CC[C@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 817637805 BZCSNVNUNATSOR-JQWIXIFHSA-N 342.417 1.451 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3C[C@H]4C[C@]4(CO)C3)C2)cc1 824685508 FTAOJUSVDJEYGV-SPYBWZPUSA-N 345.443 1.545 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)c3cnccc3C)CC2)cc1 829656930 KLWMTABQJGFYPM-UHFFFAOYSA-N 347.440 1.910 10 10 EDCE CC[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@]2(CCOC2)O1 831020335 QOLQNELDFSWPKZ-QFYYESIMSA-N 325.336 1.647 10 10 EDCE CC1CCN(c2ccc(CNC(=O)[C@]34CNC[C@H]3COC4)cc2)CC1 846672304 GHWJISBYKGJPEM-PXNSSMCTSA-N 343.471 1.775 10 10 EDCE COc1ccc(N(C)CC(=O)NC[C@@H]2CN(CC(C)C)CCO2)cc1 844353505 QJAHYHQVEJFFPJ-GOSISDBHSA-N 349.475 1.604 10 10 EDCE Cn1cc([C@@H](NC(=O)c2cccc(O)c2O)C2(CO)CCC2)cn1 846203941 OODHXUYWSCXVBM-OAHLLOKOSA-N 331.372 1.465 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H]4C[C@H]43)CC2)cc1 754082806 PPXUPERGTCYAJW-VDZJLULYSA-N 331.460 1.272 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)NCc2ccc3c(c2)CCCN3C)C[C@H]1C 865054042 ODQSAICSYXSFSA-CSMYWGQOSA-N 346.427 1.652 10 10 EDCE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCc1cc(C)ccc1O 862753097 BHRVWBYXNHBKDI-UHFFFAOYSA-N 349.431 1.126 10 10 EDCE COc1cccc(CNC(=O)[C@@H](C)Oc2cccc(CO)c2)c1O 764100598 JOCVFCHYILWFQK-GFCCVEGCSA-N 331.368 1.977 10 10 EDCE COC1(CS(=O)(=O)N2Cc3cccc(O)c3C2)CCOCC1 867690186 CCOFNPNOIZALMW-UHFFFAOYSA-N 327.402 1.233 10 10 EDCE C[C@@H]1COCCN1C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1141597766 FVGIKKMVPBELRD-CYBMUJFWSA-N 334.416 1.352 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CS(=O)(=O)Cc2ccccc21 1148523306 RFIHHBVFRBZVTI-AWEZNQCLSA-N 347.392 1.426 10 10 EDCE COc1ccc(Br)c(CN2CC[C@@](C)(C(N)=O)C2)c1O 1964583745 ZKJAKISBWNWLGM-CQSZACIVSA-N 343.221 1.861 10 10 EDCE O=C(CC1(Cn2cnnn2)CCCCC1)NCc1c(O)cccc1O 1304053093 CEMBCRNSNDXWBW-UHFFFAOYSA-N 345.403 1.741 10 10 EDCE CNC(=O)C1(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)CCC1 1317279852 NOWUVGUFHWVFAQ-CQSZACIVSA-N 347.459 1.514 10 10 EDCE COc1cccc(CNCc2nnc(Br)n2C)c1O 2121515687 XRRCVIDFCUKSGJ-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE CNCc1ccc(N2CCO[C@@H]([C@H](C)O)C2)cc1Br 2117532797 VFGDMQNURXZBEP-IINYFYTJSA-N 329.238 1.755 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccc(C)nc2)cc1C 1331684071 NKAPFYSWHPXFRD-KRWDZBQOSA-N 343.427 1.588 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1CCC(=O)NC1 1268462436 PRIFNWYGZWRDGG-MRXNPFEDSA-N 347.459 1.468 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)c2cnc(O)n2C)cc1C 1266166452 AYXUJXGMKSVZOZ-CYBMUJFWSA-N 346.431 1.741 10 10 EDCE CCN1CCN(C2CN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)CC1 1347916615 ZSOLGKVFISQHDD-UHFFFAOYSA-N 344.419 1.311 10 10 EDCE CO[C@H]1C[C@H](CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1262125323 FQEFCOIWJQFRIF-XJKCOSOUSA-N 333.432 1.471 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NC2CC(C)(C)C2)cc1 1350960552 QAWYILITOBEJFT-UHFFFAOYSA-N 347.459 1.895 10 10 EDCE C[C@H](CNC(=O)[C@H]1CCCO1)NC(=O)c1ccc(N=NC(N)=O)cc1 1526372213 GSHPSYLRXDBUBC-ZWNOBZJWSA-N 347.375 1.263 10 10 EDCE CN(CC(=O)NCc1cccs1)C(=O)Cc1ccc(O)c(O)c1 1465033929 YJGNMEORINZIOX-UHFFFAOYSA-N 334.397 1.477 10 10 EDCE COc1cc(C(=O)N[C@H](C)CCNC(=O)c2ccc[nH]2)cc(OC)n1 1704124618 MYVAPKUIHHMEKP-LLVKDONJSA-N 346.387 1.365 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2[nH]c(O)nc2C)cc1C 1714720055 DNFLWOICKOIIRW-UHFFFAOYSA-N 332.404 1.603 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)C(C)(C)NC(C)=O 1482956223 IMNLWGGGZWKBMG-UHFFFAOYSA-N 349.475 1.856 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C[C@H]2C=CCC2)cc1C 1496938457 LJVJUAVJNXARMX-DOTOQJQBSA-N 332.444 1.927 10 10 EDCE Cn1cc(CN(CCn2ccnc2)C(=O)c2cccc(O)c2O)cn1 1568829969 JZDXGTNLEJXJEK-UHFFFAOYSA-N 341.371 1.370 10 10 EDCE CCCC(=O)N(C)C1CN(Cc2nnnn2-c2ccc(OC)cc2)C1 1733299055 SVFAIXPNRSRTTN-UHFFFAOYSA-N 344.419 1.114 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)[C@@H]2[C@H]3CCC[C@H]32)cc1C 1733612344 VUYVULKDFNIZHE-DZFIZOCASA-N 346.471 1.960 10 10 EDCE C[C@@H](NC(=O)CCc1nc(-c2nc[nH]n2)no1)c1ccccc1O 1648889725 JEMDBOLNTIHIKO-SECBINFHSA-N 328.332 1.370 10 10 EDCE CCNCc1ccc(N2CC(=O)NC(=O)[C@H]2C)cc1Br 233516527 XIMMTPRJOYXNFT-SECBINFHSA-N 340.221 1.410 10 10 EDCE NC(=O)N1C[C@H]2C[C@H]1CN2c1ccc(CO)c(Br)c1 1877067684 KOHCTYNZMLEFIY-MNOVXSKESA-N 326.194 1.283 10 10 EDCE CNC(=O)C[C@H](C)NCc1c(Br)ccc(OC)c1O 1964047381 CRBCJHNMOFPRSZ-QMMMGPOBSA-N 331.210 1.778 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985103646 YNENYFXJKFRURK-GXSJLCMTSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1986369480 SYFNTEWRNJINBC-WDEREUQCSA-N 327.385 1.421 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)[C@H](N)c1ccc2c(c1)CCN2C 2000228274 CJGYENMQGHAEOC-IUIKQTSFSA-N 335.448 1.953 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC[C@@H](CN=[N+]=[N-])C1)C(C)(C)O 2014484144 ZAJXFOPLKFQQTA-QWRGUYRKSA-N 341.412 1.809 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NCc2ccc(F)c(F)c2O)C1 2011486491 BETFKGNVFOFVKO-VXGBXAGGSA-N 344.358 1.740 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](CC(=O)NCCN=[N+]=[N-])OCC12CC2 2012859503 ISYQZEDWPIGACW-LLVKDONJSA-N 339.396 1.972 10 10 EDCE C[C@H](CNC(=O)c1cc(O)c(O)c(O)c1)N(C)C(=O)OC(C)(C)C 2015121804 GQEIVIPTJVNTHN-SECBINFHSA-N 340.376 1.789 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCC[C@H](O)CC3)c(Br)cc21 393232700 XUXDGNOFTZYKHV-SDBXPKJASA-N 340.221 1.752 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)c(Br)c1 2182554625 SENBRMLAJNFQGC-OZNWZFTHSA-N 341.249 1.647 10 10 EDCE COC1(C(N)=O)CN(c2ccc([C@H](C)O)c(Br)c2)C1 2104898741 QDWHPTKMVZUKKT-QMMMGPOBSA-N 329.194 1.193 10 10 EDCE CCCCN1C(=O)NC(=O)C(=CNCc2ccc3c(c2)OCO3)C1=O 2296133107 ZGAXVDALPCOIDD-UHFFFAOYSA-N 345.355 1.267 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H](C)N1CC(NC(=O)OC(C)(C)C)C1 2300530177 MYSYCOCDBRGMDW-LLVKDONJSA-N 340.428 1.743 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N[C@H]1CCCC[C@@H]1O 2310377044 MPPRGBCZGHAVBZ-ROUUACIJSA-N 330.428 1.956 10 10 EDCE CC(=O)N(C)CCN(C)c1ccc(CN)c(Br)c1F 2339468746 WOWVFFKUSMCNLJ-UHFFFAOYSA-N 332.217 1.961 10 10 EDCE Cc1cc(C(=O)NC[C@@H]2CN3CCN2CC3)c(C)n1-c1ccccc1 178729497 OBKAUZIMXWTJJM-GOSISDBHSA-N 338.455 1.824 10 10 EDCE COc1ccccc1CNC(=O)C(=O)N(C(C)=O)c1ccc(N)cc1 170318960 SUKQZPMPRJGQNK-UHFFFAOYSA-N 341.367 1.473 10 10 EDCE CCOC(=O)C(C)(C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 134470976 AZJBILHGYYIGKC-UHFFFAOYSA-N 334.416 1.933 10 10 EDCE CCN1C(=O)/C(=C/c2ccc(OCC(N)=O)cc2)C(C(=O)OC)=C1C 83259631 BNFPTBRADJXOBB-NTEUORMPSA-N 344.367 1.243 10 10 EDCE CN(Cc1c(O)ccc2ccccc12)C[C@H](O)CN1CCOCC1 93583268 IGTUJVPCVZRVPK-INIZCTEOSA-N 330.428 1.670 10 10 EDCE Cc1ccc(CN(C)[C@](CN)(CF)C(=O)O)c(O)c1Br 2380764915 IMNRAXWNOPAQQD-ZDUSSCGKSA-N 349.200 1.647 10 10 EDCE Cc1ccc(CN(C)C(=O)CCOCCN)c(O)c1Br 2380766618 DCMLFYSJWYNQRJ-UHFFFAOYSA-N 345.237 1.787 10 10 EDCE CC(=O)C(=O)COC(=O)c1n[nH]c2ccc(Br)cc12 808516527 GXMKMCHTLNZLKN-UHFFFAOYSA-N 325.118 1.640 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N(C)CCCCO)C2)cc1 824685327 DHLGGZOKTWYQQP-HNNXBMFYSA-N 335.448 1.935 10 10 EDCE CO[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)[C@](C)(C(=O)O)C1 908758483 LWVGBSOOAHMKEC-YOEHRIQHSA-N 335.404 1.526 10 10 EDCE CN(c1ccc(CNC(=O)CCNC(=O)CO)cc1)C1CCCCC1 906431090 QOSZPHWMGQTGDF-UHFFFAOYSA-N 347.459 1.570 10 10 EDCE C[C@H]1CN(C)C[C@H]1NCc1cc(F)c(N2CCOCC2)c(F)c1 839146873 YPEPNWDWLUPAES-BLLLJJGKSA-N 325.403 1.841 10 10 EDCE CCNC(=O)C1CN(Cc2cc(Br)cc(OC)c2O)C1 839137669 DQLDYBKSRDVLPR-UHFFFAOYSA-N 343.221 1.731 10 10 EDCE Cc1cc(O)c(CNCCCCn2cc(C(N)=O)nn2)c(Cl)c1 840978449 RQEHSPRUPQIDRU-UHFFFAOYSA-N 337.811 1.614 10 10 EDCE Cc1cc(C(=O)CN(C)CCO)c(C)n1-c1ccc2c(c1)OCO2 916645032 NJKVYMYVLRTFNE-UHFFFAOYSA-N 330.384 1.930 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3CCC[C@@H](N)C3)CC2)cc1 848716361 BZWWNNPQMSJIOI-SJORKVTESA-N 332.492 1.677 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cn2c(n1)CCCC2 845929369 BYDPGRIUDRYEHB-GFCCVEGCSA-N 329.400 1.921 10 10 EDCE C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(C)(C)CO 925054462 GMPCXCQQQYNAKJ-CQSZACIVSA-N 340.489 1.418 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](C(=O)O)C(C)C)C2)cc1 851651526 LZCHFFCOYKHSGY-CZUORRHYSA-N 349.431 1.930 10 10 EDCE Cn1nccc1[C@H]1C[C@H](NC(=O)NCc2c(O)cccc2F)CCO1 922749505 QCEUORWSSXARDW-BDJLRTHQSA-N 348.378 1.984 10 10 EDCE Cc1cc(CNC(=O)[C@@H]2CN(C)C(=O)N2)c(C)n1-c1ccccc1 863163380 AHDWIMJOMXZXMB-INIZCTEOSA-N 326.400 1.734 10 10 EDCE CCOC(=O)[C@H](Cc1ccccn1)NCc1cc2c(cc1O)OCO2 763482189 WHNLNLXIGCNQGU-AWEZNQCLSA-N 344.367 1.780 10 10 EDCE CCN1C[C@@H](S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 866418663 PXHDOJYLQYWUIE-HNNXBMFYSA-N 339.461 1.135 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](O)[C@H](C)O)c2C)cc1 871125416 NGZNJQAXCDPFCB-GUYCJALGSA-N 332.400 1.574 10 10 EDCE Cc1ccc(C(=O)NCCNC(=O)Cc2ccc(O)c(O)c2)cc1F 1136141822 LIYXJLWHKAJRPO-UHFFFAOYSA-N 346.358 1.634 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H](N3CCNC3=O)C2)cc1 1136505870 WJESBHPGMDAADN-ZDUSSCGKSA-N 344.375 1.479 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@H]1COc2ccc(O)cc2O1 1137464465 AUZKXNVHBCOPJT-MRXNPFEDSA-N 331.324 1.302 10 10 EDCE CC(C)NCc1ccc(N2C[C@H](O)C[C@H]2CO)c(Br)c1 698198344 LKGAJHWLJOYHLX-QWHCGFSZSA-N 343.265 1.879 10 10 EDCE Cc1ccc(CNC(=O)NCC(=O)NCc2cccc(O)c2O)cc1 1303193798 SXJKBYVTCJXOHU-UHFFFAOYSA-N 343.383 1.522 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H]2COC[C@@]2(C)C1 1327330232 PRYRADNBABQQMQ-DNVCBOLYSA-N 346.427 1.626 10 10 EDCE C[C@@H](O)c1ccc(N2CCC[C@H]2[C@H](O)CO)c(Br)c1 2123168617 BPJNJGQJIPALFV-BIGNPOOSSA-N 330.222 1.824 10 10 EDCE O=S1(=O)C[C@H]2[C@H](CNCc3ccc(Br)cc3O)[C@H]2C1 2117982283 OUCRAHXGNHJAJA-CNDDSTCGSA-N 346.246 1.535 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccc(C)nc2)cc1C 1331684075 NKAPFYSWHPXFRD-QGZVFWFLSA-N 343.427 1.588 10 10 EDCE COCC(=O)N[C@@H](C)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1335814536 IJNJOJWFXMGODA-NSHDSACASA-N 349.391 1.510 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@@H]2CN)c(OC)c1Br 2131036055 RZGIJHBASZDZTI-BDAKNGLRSA-N 331.210 1.365 10 10 EDCE CC(C)C[C@]1(CO)CCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1261865658 JBUKEEXGSDVPLK-IBGZPJMESA-N 346.427 1.634 10 10 EDCE CC[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@@H](CC)O1 1348651535 IDBKUFRWUBOTAT-OKILXGFUSA-N 332.400 1.650 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2nc(C)oc2C)cc1C 1278171702 KQSNXSRKXLFLFZ-OAHLLOKOSA-N 347.415 1.489 10 10 EDCE CNC(=O)C1CN(c2ccc(C=CC(=O)O)c(Br)c2)C1 1911789305 CVAMYYCSQJKZDT-UHFFFAOYSA-N 339.189 1.729 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1CC12CC2)NC(=O)c1cc(OC)nc(OC)c1 1297496427 OSFDBIXIOXVHBH-OLZOCXBDSA-N 347.415 1.524 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3c[nH]nc3C)nc12 1460596479 UCFIIYWHXIIMTG-UHFFFAOYSA-N 344.375 1.275 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2ccc(C(N)=O)o2)cc1C 1715986502 JPGIWKRMEOSZHD-LBPRGKRZSA-N 345.399 1.604 10 10 EDCE O=C(NCc1c(O)cccc1F)c1cncc(N2CCCC2=O)c1 1558455105 OOLSUFPJYDOJPH-UHFFFAOYSA-N 329.331 1.983 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1coc(C=O)c1 1638030369 KIFZDMSZIWFHEB-ZDUSSCGKSA-N 347.323 1.408 10 10 EDCE C[C@@H](O)c1cn(C2CN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)nn1 1567353459 VHJGFLCWQDVROS-SECBINFHSA-N 343.347 1.191 10 10 EDCE CNS(=O)(=O)c1ccc(C(=O)NCc2cc(Cl)ccc2O)o1 1640920963 YFMDRTDYHKMTEG-UHFFFAOYSA-N 344.776 1.477 10 10 EDCE CS(=O)(=O)Nc1cccc(C(=O)NCc2cccc(O)c2O)c1 1651173237 VGBJLCULGVWZON-UHFFFAOYSA-N 336.369 1.399 10 10 EDCE Cc1ccc(-n2[nH]c(C(=O)NCc3cc(O)ccc3O)cc2=O)cc1 1593873256 MZCDDDDBCVCKBZ-UHFFFAOYSA-N 339.351 1.815 10 10 EDCE CC(C)(C)OC(=O)N1Cc2nccn2C[C@@H](C(=O)NCCN=[N+]=[N-])C1 1965101986 KFLMLDWLCAUTFJ-LLVKDONJSA-N 349.395 1.677 10 10 EDCE Cn1ncc(C2OCCO2)c1S(=O)(=O)Nc1ccc(O)c(F)c1 2144009071 AIAAQUMDIPRRAW-UHFFFAOYSA-N 343.336 1.111 10 10 EDCE CCNCc1ccc(N2CCCC2(CO)CO)c(Br)c1 2146077995 FJIUTOWKEOIIKV-UHFFFAOYSA-N 343.265 1.882 10 10 EDCE CN1CCc2cc([C@H](N)[C@@](C)(O)CNC(=O)OC(C)(C)C)ccc21 1999526577 BRMXLPXATZRLGT-YJBOKZPZSA-N 335.448 1.954 10 10 EDCE Cn1cc(C=CC(=O)N2CCCc3ccccc32)c(=O)n(C)c1=O 2041505239 RKEQEPFPDTXBPV-UHFFFAOYSA-N 325.368 1.077 10 10 EDCE O=C(C=Cc1cscn1)NCc1ccc(N2CCNC(=O)C2)cc1 2041531306 FHBSEXJYXDSDGM-UHFFFAOYSA-N 342.424 1.409 10 10 EDCE CS(=O)(=O)N[C@H]1CCN(c2ccc(CO)c(Br)c2)C1 702985976 WSFUAQBEXHBBTN-JTQLQIEISA-N 349.250 1.069 10 10 EDCE CS(=O)(=O)C1CCN(c2ccc(CN)c(Br)c2)CC1 389060430 IWINZGIYQNDCSH-UHFFFAOYSA-N 347.278 1.921 10 10 EDCE Oc1ccc(Br)cc1CN1CCC(C2(O)CNC2)CC1 2176940036 DWFMBGIDHCHCLB-UHFFFAOYSA-N 341.249 1.701 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H]2[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1906904874 POOZYEDNFSQPEK-CXOVXGEYSA-N 336.432 1.898 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](N2CCCc3cc(CN)ccc32)[C@H](O)C1 2044595798 MYQDHXVHSVIEEN-DLBZAZTESA-N 347.459 1.878 10 10 EDCE CN(CCN1CCOCC1)c1ccc(CN)c(Br)c1 2113750243 AUNUFOJCWIMZII-UHFFFAOYSA-N 328.254 1.676 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210543069 XRAUJAYBOYOABF-GMTAPVOTSA-N 327.385 1.874 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213586264 ABSHRHKSYDFOGK-BJDJZHNGSA-N 339.396 1.704 10 10 EDCE COc1ccc(N2CCOC[C@H]2CO)c(OC)c1Br 2226540744 LMENXIKJOULUCN-SECBINFHSA-N 332.194 1.664 10 10 EDCE CN(CC(=O)N1CCc2cc(O)c(O)cc2C1)C(=O)OC(C)(C)C 2302402277 UXXRSKYMKYNIME-UHFFFAOYSA-N 336.388 1.849 10 10 EDCE NCc1ccc(N2CC3(CC[C@H](CO)O3)C2)cc1Br 2336705014 QOYQZYQSPBSNNC-GFCCVEGCSA-N 327.222 1.638 10 10 EDCE COc1cccc(CNC(=O)NCc2c(C)cc(C)[nH]c2=O)c1O 73548377 YCCGWQZRZOWXOG-UHFFFAOYSA-N 331.372 1.705 10 10 EDCE CN(C)[C@@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)c1cnn(C)c1 181097905 HVVGLWPZUFJFKQ-DYLGSBMWSA-N 330.388 1.264 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CCOC[C@@H]2C(N)=O)cc1 180270645 IVOSFSICKRCEGP-MRXNPFEDSA-N 327.384 1.420 10 10 EDCE NC(=O)N[C@@H](CC(=O)NCCc1ccc(N)cc1)c1cccs1 262583312 RTKYJQKUYLIILH-ZDUSSCGKSA-N 332.429 1.789 10 10 EDCE CCN(Cc1ccc(C)c(Br)c1O)[C@H]1CC(=O)NC1=O 2380734277 SJORAIWMZIPNFA-JTQLQIEISA-N 341.205 1.700 10 10 EDCE CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)OCC(=O)C(C)=O 808502657 NUIHIJBABVJNML-CQSZACIVSA-N 347.367 1.391 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1cccc(OCc2cccnc2)c1 808532556 BESPNWZLZMTHSE-UHFFFAOYSA-N 327.336 1.904 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)Nc1cn(C)nc1C1CC1 291581683 XPYSVNPCTPUEKA-UHFFFAOYSA-N 328.372 1.600 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N(C)CCCCO)C2)cc1 824685328 DHLGGZOKTWYQQP-OAHLLOKOSA-N 335.448 1.935 10 10 EDCE CNC(=O)N1CCN(c2ccc([C@@H](C)O)c(Br)c2)CC1 721694721 DDUMTDNTXXJYTF-SNVBAGLBSA-N 342.237 1.964 10 10 EDCE NCc1nc2c(s1)CCN(Cc1ccc(N3CCOCC3)cc1)C2 903941268 VIDXVAVZBFBSMT-UHFFFAOYSA-N 344.484 1.997 10 10 EDCE C/C(=C/C(=O)N1CCOc2cc(N(C)C)ccc21)CN1CCOCC1 900894839 IFNPSKNEIMCSGS-QINSGFPZSA-N 345.443 1.757 10 10 EDCE CCN(OC)C(=O)CNC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 828147814 KMEUTOPPTUBRDU-UHFFFAOYSA-N 348.447 1.837 10 10 EDCE C[C@]1(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CCCO1 837709078 ZOHHTUKQHXBKQR-QGZVFWFLSA-N 340.370 1.987 10 10 EDCE COc1cc2c(c(OC)c1)N(CC(=O)N=c1cc[nH]cc1)CCC2 839656133 IBUYTNJKAOMZNZ-UHFFFAOYSA-N 327.384 1.912 10 10 EDCE O=C(O)CN(Cc1ccccc1O)C(=O)[C@H]1CC[C@@H]2CCCCN21 911489669 VVHGWWDCOHYRIW-LSDHHAIUSA-N 332.400 1.822 10 10 EDCE COc1ccc(N2CC[C@H](NC(=S)NCCCN(C)C)C2)cc1 849270856 RBKGRQIXWZHCNQ-AWEZNQCLSA-N 336.505 1.690 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCNC[C@](C)(F)C2)cc1F 841762272 VMNSSJNMKVPSLW-INIZCTEOSA-N 326.391 1.735 10 10 EDCE COCCN(C(=O)C(=O)Nc1ccc(N)cc1)[C@@H]1C[C@H]2CC[C@H]1C2 841120848 LDXGSFNFBLEOGE-HEHGZKQESA-N 331.416 1.871 10 10 EDCE Cn1nccc1[C@H](O)CNCc1ccc(N2CCOCC2)c(F)c1 922974814 ZIQGWGIZMCZWSV-QGZVFWFLSA-N 334.395 1.219 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H](CCF)C2)c1 855826481 DFXNLDSMKCEMMH-LLVKDONJSA-N 344.408 1.976 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@@H]2CC[C@H]1N2C(=O)OC(C)(C)C 924460903 LPVLVXNEXWGYCH-QJPTWQEYSA-N 325.361 1.476 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N3CCC[C@H](C)C3)C2)cc1 855228240 YCVJFFUFHGOFQM-GJZGRUSLSA-N 345.443 1.649 10 10 EDCE CCN(CCC(N)=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 923189555 XUIDBOSMXIOCKF-ZDUSSCGKSA-N 334.420 1.181 10 10 EDCE C[C@H](NC(=O)NCCCN(C)S(C)(=O)=O)c1ccccc1O 868110995 AQQMWEGEOLNFRG-NSHDSACASA-N 329.422 1.034 10 10 EDCE COc1cc(Br)cc(CN2C[C@H]3C(=O)OC[C@H]3C2)c1O 862545238 LNWQCQLJCJFYEY-MWLCHTKSSA-N 342.189 1.768 10 10 EDCE CN(C)c1ccc(CN2CCN(C(=O)N3CCNCC3)CC2)cc1F 863641858 DJFVAWUFCRXMDK-UHFFFAOYSA-N 349.454 1.035 10 10 EDCE CN(C)C(=O)CCN1CCN(Cc2cc3c(cc2O)CCCC3)CC1 768462153 KDFFIQICBPWSCV-UHFFFAOYSA-N 345.487 1.867 10 10 EDCE Cc1cc(C(=O)N2C[C@H]3C(=O)OC[C@H]3C2)c(C)n1-c1ccccn1 863763484 AVKCZGGDYJLZKG-UKRRQHHQSA-N 325.368 1.734 10 10 EDCE Cc1nc(NCc2ccc(N3CCOCC3)c(F)c2)nc(N(C)C)n1 768523312 RNBRWEKXBXULQC-UHFFFAOYSA-N 346.410 1.834 10 10 EDCE CO[C@@H]1CC[C@@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 870714841 ANASXUAEAZHGLC-ZYHUDNBSSA-N 342.417 1.403 10 10 EDCE CN(C)c1ccc(CNC(=O)NCCC2CS(=O)(=O)C2)cc1F 786732080 LJCKTEWZIJLSBR-UHFFFAOYSA-N 343.424 1.126 10 10 EDCE CCN1CC[C@H]1CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 897866167 SCLVZIYWOOAMFI-BBRMVZONSA-N 332.448 1.140 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](N3CC[C@H](O)C3)C2)cc1 1140117110 QDXITKCXJHUWRJ-KGLIPLIRSA-N 331.376 1.130 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)C[C@]2(C)CO)c(Br)c1 698159134 XDQLDBRQFQNASB-GLXFQSAKSA-N 330.222 1.824 10 10 EDCE Nc1ccc(Cc2noc([C@@H]3[C@H]4CC[C@]5(COC(=O)[C@H]35)O4)n2)cc1 1329237883 XCOZSXUSEYNMSO-MBMVNNNZSA-N 327.340 1.431 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H]2CCN(C)C(=O)C2)cc1C 1266948946 RUWNZJFWQXHPMP-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE Oc1cccc(Br)c1CN1CCO[C@@H]2CCNC[C@H]21 2129072081 OSHLIBQQBTVQFS-TZMCWYRMSA-N 327.222 1.717 10 10 EDCE CN1CCCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)CC1 221237057 OFICFZZFKBRUKU-CYBMUJFWSA-N 339.237 1.543 10 10 EDCE COc1ccc(N(C)CC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 1473613555 VSLAOEUVLKLXAQ-UHFFFAOYSA-N 349.412 1.418 10 10 EDCE O=C(COCc1ccnc(O)c1)NCc1ccc2cccnc2c1O 1639624958 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2053477901 UBVBLRHBLCKTGA-UHFFFAOYSA-N 334.378 1.685 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)C[C@]2(C)CO)c(Br)c1 698134500 AZNGAFFHKAIKCR-OLUVUFQESA-N 329.238 1.791 10 10 EDCE CN[C@H](C)c1ccc(N2CC(O)(COC)C2)cc1Br 384188088 YIELVGRUQPWDFN-SNVBAGLBSA-N 329.238 1.927 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@H](O)C[C@@H]3C)c(Br)cc21 385109359 SBHLYSCPQZJTGP-DAROEXNTSA-N 340.221 1.621 10 10 EDCE COCCOCCOCCNCc1cc(Br)ccc1O 2187127422 CRNBAAJERQCUTG-UHFFFAOYSA-N 348.237 1.924 10 10 EDCE Nc1ccc(OCC(=O)N2C[C@H]3C[C@H]2CN3C(=O)C(F)(F)F)cc1 2044621516 RFNDQKWMANROKH-WDEREUQCSA-N 343.305 1.022 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)COc2ccc(N)cc2)[C@H]2C[C@H]21 2044625533 WECUJTYIHUBVQR-LSDHHAIUSA-N 347.415 1.868 10 10 EDCE O=S1(=O)C[C@H]2CN(c3ccc(CO)cc3Br)C[C@@H]2C1 2087855579 DJMYWTKJKUGCDC-GHMZBOCLSA-N 346.246 1.422 10 10 EDCE Oc1c(F)cc(Br)cc1CNC[C@@H]1C[C@@H](O)CCO1 2097944342 CKXHAYIZWQHHTN-QWRGUYRKSA-N 334.185 1.923 10 10 EDCE Cn1nc(Br)c(C(=O)N2CCC[C@@H](CN=[N+]=[N-])C2)n1 2226977398 DVTVIMRJQHVCJB-ZETCQYMHSA-N 328.174 1.740 10 10 EDCE Cc1ccc(CN2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(O)c1Br 2352946154 GRAFMKXBAITUOD-QOBDMFJFSA-N 328.206 1.389 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2354368964 OZVKCKBBPCNRCU-BYCMXARLSA-N 341.249 1.755 10 10 EDCE Nc1ccc(O)c2c1C(=O)c1c(N)cc(Br)c(O)c1C2=O 34064984 OEOBNTWIEVRPDW-UHFFFAOYSA-N 349.140 1.800 10 10 EDCE O=C(Nc1cc(O)c(O)c(O)c1)Nc1ncc(Br)cn1 217278999 RVPVJOJNXIAMQR-UHFFFAOYSA-N 341.121 2.000 10 10 EDCE CNC(=O)CCCN(C)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255020598 RETBXBSFNCPJEV-YFHOEESVSA-N 345.443 1.521 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@H](OC)[C@H]3CCOC3)CC2)cc1 825425902 OGVWMKHZHXZGSV-KBXCAEBGSA-N 348.443 1.832 10 10 EDCE CN1CCN(c2ccc(CN3C[C@H]4CC[C@H]3[C@H]3CNC[C@@H]43)cc2)CC1 903962027 HKUICRHUHWLGMU-HZEGPAAWSA-N 340.515 1.868 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@@H]3C3CC3)CC2)cc1 834383516 UJXIZSOZTHGFFL-UYAOXDASSA-N 345.487 1.662 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@]2(OC)CCS(=O)(=O)C2)c1 903364976 GCGXISXBEKBXQS-XHDPSFHLSA-N 329.418 1.255 10 10 EDCE C[C@H]1CCNC[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 841731172 ZVPBKWUXMIGSFN-WMLDXEAASA-N 332.448 1.320 10 10 EDCE CCOC(=O)[C@@H]1CCCN(CC(=O)N2Cc3cccc(O)c3C2)C1 913725977 FNIKKAUCUFXHQZ-CQSZACIVSA-N 332.400 1.510 10 10 EDCE C[C@H]1[C@@H](N)CCN1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 841739781 CBRKBEBTUYMWLP-KEYYUXOJSA-N 332.448 1.715 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)c3ccccc3O)C2)cc1 849417462 RLIUWZHRZJJUSS-CYBMUJFWSA-N 348.424 1.958 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CCOC[C@H]3CCO)ccc21 758431434 OLLQFQJMMDJRCU-MRXNPFEDSA-N 333.432 1.362 10 10 EDCE C[C@H](NC(=O)NCc1nnc(O)n1C1CC1)c1ccc(N(C)C)cc1 923868240 DLGJQBMTTGRCDD-NSHDSACASA-N 344.419 1.945 10 10 EDCE Cc1cc(CC(=O)N2CC(=O)N[C@@H](C)C2)c(C)n1-c1ccccc1 854825497 GXBFIDMFAVOEGK-ZDUSSCGKSA-N 325.412 1.984 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCc3cnccn3)C2)cc1 852237910 SZDMYKKKTXTHAX-HNNXBMFYSA-N 341.415 1.606 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NC[C@@]2(C)CC2(F)F)cc1 853011735 ZWCSJCPCOFGNFE-OAHLLOKOSA-N 342.342 1.748 10 10 EDCE Cc1cc(Cl)cc(CNCCCN2CCC[C@H]2C(N)=O)c1O 862464875 KVDZJFAUENHQTQ-AWEZNQCLSA-N 325.840 1.783 10 10 EDCE CON1CCC(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 864635073 RDLGVJKXNHXXCC-UHFFFAOYSA-N 347.459 1.755 10 10 EDCE c1noc([C@H]2COCCN2Cc2ccc(N3CCOCC3)cc2)n1 930443124 UEKCCYHDRZGHFU-MRXNPFEDSA-N 330.388 1.480 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCN([S@@](C)(=N)=O)CC2)c1O 879944502 TXOKIBGKRFAWIT-JOCHJYFZSA-N 329.397 1.443 10 10 EDCE COc1cc(C)cc(CNC[C@H]2CCCCN2S(C)(=O)=O)c1O 894752077 HAHYJPGIWHFGPN-CQSZACIVSA-N 342.461 1.613 10 10 EDCE COc1ccc(N2CCN(C(=O)C[C@@]3(O)CCCN(C)C3)CC2)cc1 899940498 PFTLYSATNHAQIA-IBGZPJMESA-N 347.459 1.191 10 10 EDCE O=C(COC(=O)C1(N2CCOCC2)CCC1)c1ccc(O)c(O)c1 784488310 JBHUFKFLMLFBLS-UHFFFAOYSA-N 335.356 1.079 10 10 EDCE COC(=O)[C@@]1(CNCc2cc(C)c(C)cc2O)C[C@@H]1S(C)(=O)=O 895508192 BPJSEMRRAPLLST-GOEBONIOSA-N 341.429 1.075 10 10 EDCE Cc1n[nH]cc1CN(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1142913685 GUJLZOUZNVANEV-UHFFFAOYSA-N 338.389 1.067 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@@H]1CC(=O)N(c2ccccc2F)C1 1162277900 CYMIORCFEVWPKX-GFCCVEGCSA-N 344.342 1.906 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NC[C@H]1CCOC1 1258221992 UMELWCBUNXQPAW-SECBINFHSA-N 329.194 1.990 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@H](O)C2(C)C)c(Br)c1 2124796468 PFTLCGFQHOSKFM-STQMWFEESA-N 329.238 1.489 10 10 EDCE CC[C@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@H]1CCCOC1 1333947548 KBIVXGXXDRIWSL-GJZGRUSLSA-N 334.416 1.672 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccsc2)cc1C 1268301993 UGVQFLUBTHYIFY-HNNXBMFYSA-N 334.441 1.946 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(O)CCOC1 1292841349 RHSWZKDHMGEVOA-QGZVFWFLSA-N 332.404 1.334 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CNC(=O)C1 1470514965 MBPUYEBLDCZIOT-OAHLLOKOSA-N 332.448 1.809 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2conc2C)cc1C 1700950841 ZFPDNZXWWDYLTO-OAHLLOKOSA-N 347.415 1.523 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)[C@](C)(O)C2)c(Br)c1 2136877661 JBGVXQPVNFMDBS-QCZZGDTMSA-N 330.222 1.824 10 10 EDCE CC[C@H](CNC(=O)C1CN(C(C)=O)C1)NCc1ccc(OC)c(C)c1 1567960330 ZKJNMGLORZSHMO-QGZVFWFLSA-N 347.459 1.466 10 10 EDCE COC(=O)[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)c1cccnc1 1637050660 NDGIGQUNUYDBRV-ZDUSSCGKSA-N 341.327 1.888 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cccc(N2CCOC2=O)c1 1633506825 AZKFMOYKOXENGW-UHFFFAOYSA-N 328.324 1.984 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCO[C@H](c2noc(C3CC3)n2)C1 1654798599 HJTAHAUIKHIJEM-NSHDSACASA-N 349.318 1.711 10 10 EDCE CN1CCN(c2ccc(CO)cc2Br)[C@H](CCO)C1 2138067135 QBCLWDIXBBVKHI-GFCCVEGCSA-N 329.238 1.444 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@]23COC[C@@H]2C3)cc1C 1666903883 ZHQIZJVUUBVSFP-ALKREAHSSA-N 332.444 1.977 10 10 EDCE CC(C)(C)OC(=O)NOCCCNC(=O)Cc1ccc(O)c(O)c1 1598142305 ONROFDVOCWMKPI-UHFFFAOYSA-N 340.376 1.603 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H](C)n2cncn2)cc1C 1690566745 OAKITTFRHQTYAQ-ZIAGYGMSSA-N 331.420 1.451 10 10 EDCE CCS(=O)(=O)CCN[C@@H](C)c1ccc(N2CCC(O)CC2)cc1 163464834 BXVKHINJRGNGRT-AWEZNQCLSA-N 340.489 1.733 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)CCCCO)c2nccn2C)cc1 1866066811 PXBOBVZBJGYJAO-QGZVFWFLSA-N 330.432 1.854 10 10 EDCE Cn1cncc1[C@@H]1NC(=O)CC[C@H]1NCc1ccc2c(c1)CCO2 848568502 KRVYYXCLQOCCTL-RDTXWAMCSA-N 326.400 1.465 10 10 EDCE C[C@@H](CNC(=O)OC(C)(C)C)[C@@H](F)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980369243 IWRVZOJCOMVVNC-MRBYEJRBSA-N 330.400 1.751 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)NCCN=[N+]=[N-])CCOCC1 1985093882 GWKYIJXQOSHWHP-UHFFFAOYSA-N 327.385 1.734 10 10 EDCE CNCc1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)c(Br)c1 2146317478 BNSFXKLDBVKOSY-GASCZTMLSA-N 341.249 1.350 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1987702162 PEKAHJIQAQUPGN-MNOVXSKESA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]1NC(=O)COc1ccc(N)cc1 2009325715 CGLLMQVFLMSRGD-RISCZKNCSA-N 335.404 1.677 10 10 EDCE CNCc1ccc(N2C[C@H]3OCCN(C)[C@@H]3C2)cc1Br 2153999097 YRQYAUJFUQEWFW-HUUCEWRRSA-N 340.265 1.688 10 10 EDCE CN1CCO[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]21 93641346 PGMBJQDQLKRBLI-GXTWGEPZSA-N 327.222 1.670 10 10 EDCE CN[C@H](C)c1ccc(N(C)[C@H]2COC[C@@H]2O)cc1Br 709221733 KDAMODCYRJJQDX-IIMNLJJBSA-N 329.238 1.925 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)[C@@H](CO)C2)c(Br)c1 396818445 XJUWDUQXOKNMMY-DRCTWCGVSA-N 329.238 1.648 10 10 EDCE CCN(Cc1cc(Br)cc(F)c1O)[C@@H]1CC(=O)NC1=O 2171207594 QZSHMBGLSPVUHQ-SNVBAGLBSA-N 345.168 1.531 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NC(=O)CCc2ccc(N)cc2)C1 2062452477 WOMRBYIMEHESSW-HUUCEWRRSA-N 349.431 1.298 10 10 EDCE CN(C(=O)C1CC(O)(CNC(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2080848391 GMAYKXBRNRSTBB-UHFFFAOYSA-N 349.431 1.897 10 10 EDCE NCc1cc(F)c(N2C[C@@H](CO)C[C@@H]2CO)cc1Br 2089907893 ONESDYNXGPFXLB-WCBMZHEXSA-N 333.201 1.226 10 10 EDCE C[C@@H](O)c1ccc(N2CC(=O)N[C@H]3CC[C@@H]32)c(Br)c1 2112061628 MKSBVZIASRNGMW-WLTAIBSBSA-N 325.206 1.970 10 10 EDCE CCNCc1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)c(Br)c1 2201287705 FQIROOSATCSOAG-YABSGUDNSA-N 338.249 1.726 10 10 EDCE OCc1ccc(N2CCc3c(O)ncnc3C2)cc1Br 2206105174 YICQTKSUJLINKU-UHFFFAOYSA-N 336.189 2.000 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1CC[C@@H](O)CN1C(=O)OC(C)(C)C 2242655889 HVRKZDAXIAMOGX-GHMZBOCLSA-N 327.385 1.516 10 10 EDCE O=C(O)C[C@H](C(=O)O)N1C(=O)C(=Cc2ccc[nH]2)SC1=S 2293438626 FPTNLNSNSQCOCA-SSDOTTSWSA-N 326.355 1.144 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(C)C=CCN2)c(O)c1Br 2352642129 BAGHNRQLIBAPQJ-CQSZACIVSA-N 325.206 1.997 10 10 EDCE C[C@@H](NC(=O)c1ccco1)C(=O)N1CCOc2cc(N(C)C)ccc21 173197816 UNXOOWKGOWORGM-GFCCVEGCSA-N 343.383 1.890 10 10 EDCE COCCCCS(=O)(=O)N1CCOc2cc(N(C)C)ccc21 184994692 BHTRDPYFGRGWPG-UHFFFAOYSA-N 328.434 1.708 10 10 EDCE COCCNC(=O)CCNCc1cccc(Br)c1O 134492503 UPJHROITGNQPDN-UHFFFAOYSA-N 331.210 1.397 10 10 EDCE O=C(NC[C@H]1C[C@H](O)CN1Cc1ccccc1)c1cccc(O)c1O 193149455 RLOLTVJLLXPBOI-CABCVRRESA-N 342.395 1.463 10 10 EDCE CCN(CC)c1ccc(CN2CC[C@H](NS(C)(=O)=O)C2)cc1 93531473 RSGQBLOQWAGVFB-HNNXBMFYSA-N 325.478 1.656 10 10 EDCE Cc1nc(COC(=O)/C=C\c2ccc(N3CCOCC3)cc2)no1 255178659 MTXKSSCHOABSRU-DAXSKMNVSA-N 329.356 1.971 10 10 EDCE Cc1ccc(CN2C[C@H](N)CC[C@H]2C(=O)O)c(O)c1Br 2380800790 LNBJZMMENKSXDE-MNOVXSKESA-N 343.221 1.839 10 10 EDCE COC[C@]1(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)CCOC1 819587942 QWZAXSSIWKIYRC-HNAYVOBHSA-N 348.443 1.691 10 10 EDCE Cc1cc(C)c([C@H](C)NCCS(=O)(=O)N=S(C)(C)=O)c(O)c1 903227961 WLOVVRNAMABPOL-LBPRGKRZSA-N 348.490 1.717 10 10 EDCE O=C(CC1(O)CCOCC1)N(Cc1ccccc1O)C[C@H]1CCCO1 907106117 ZYBOHBHQMPGQCO-MRXNPFEDSA-N 349.427 1.831 10 10 EDCE C[C@@H](NC[C@@]1(CO)COCCN1C)c1cccc(C(F)(F)F)c1O 903281551 YHNXCJAGMUIVAQ-IAQYHMDHSA-N 348.365 1.755 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Cc1c(O)ncnc1O 900293144 WNXQVGDRKFRXQB-UHFFFAOYSA-N 344.415 1.934 10 10 EDCE Cn1nc(C(=O)O)cc1C(=O)NCc1ccc(N2CCCC2)cc1 901933736 DSOCYNBIUYMFPK-UHFFFAOYSA-N 328.372 1.649 10 10 EDCE CC[C@H](C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(O)cc1O 910956438 WEPHPWHGINWHQY-GWCFXTLKSA-N 338.429 1.662 10 10 EDCE COc1ccc(N2CCCN(C(=O)C[C@@H](C)NC(N)=O)CC2)cc1 847366716 WWEZVINUFULMLX-CYBMUJFWSA-N 334.420 1.181 10 10 EDCE CNC(=O)CC(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 912108690 BPJUSAMHSSPROQ-UHFFFAOYSA-N 331.338 1.780 10 10 EDCE Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)nc(N(C)C)n1 853955022 BACGFQZZJBQIRJ-UHFFFAOYSA-N 342.447 1.819 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCN(C)C(=O)[C@H]3C)C2)cc1 852451323 HXCGKUYLBPYWAK-KGLIPLIRSA-N 346.431 1.146 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3C)C2)c1 750657069 LVXCCSOUDZANPR-ZAZJYDDPSA-N 347.415 1.770 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)C3CCN(OC)CC3)C2)cc1 868954702 BDGHYFDDIDVFPH-HNNXBMFYSA-N 347.459 1.911 10 10 EDCE COC(=O)c1cc(OCCc2nnn(C(C)(C)C)n2)ccc1N(C)C 865395564 WGFCYUAUUWPOQW-UHFFFAOYSA-N 347.419 1.902 10 10 EDCE C[C@H](NC(=O)CNC(=O)c1ccccn1)c1ccc(N(C)C)cc1 773993519 HDDSVIUBLTWTPS-ZDUSSCGKSA-N 326.400 1.755 10 10 EDCE COC(=O)COc1ccc(N(C)C[C@H](C)CS(C)(=O)=O)cc1 784563091 IUOCCCZJFQFCBJ-LBPRGKRZSA-N 329.418 1.355 10 10 EDCE O=C1C[C@]2(CCN(C(=O)NCCCSc3nccs3)C2)CN1 789090791 MNYZIAKVJHHYDA-CQSZACIVSA-N 340.474 1.547 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@@H]2CC(C)(C)CO2)cc1 897361221 BSXAQVGWOKSBQL-MRXNPFEDSA-N 347.459 1.690 10 10 EDCE CN(C[C@@H]1CCCS1(=O)=O)c1ccc(CO)cc1Br 694134306 UUSLUQVHUVPTAY-NSHDSACASA-N 348.262 1.955 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@@H](NC(N)=O)C(C)C)CC2)cc1 1151503452 VUCPNOFUMDPVKH-INIZCTEOSA-N 348.447 1.427 10 10 EDCE NS(=O)(=O)c1ccc(CCC(=O)N2Cc3cccc(O)c3C2)cc1 1175031446 UTBQISUALXOQNO-UHFFFAOYSA-N 346.408 1.515 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCC(C)(C)CO2)cc1 1334441075 PORPWYNJDHUIFZ-INIZCTEOSA-N 347.459 1.690 10 10 EDCE CO[C@@H](CCNC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1902054565 SZMPVZFFJBNWFI-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2cnn(C)c2N)cc1C 1275968476 YJAHINDXLRSCGN-UHFFFAOYSA-N 345.447 1.571 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)NCCCCN=[N+]=[N-] 1912145025 CGLWFVBVCORRFK-UHFFFAOYSA-N 337.203 1.551 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCC[C@@H]3CO)c(Br)cc21 221241921 NXGPAWIUDCIVBP-KRTXAFLBSA-N 326.194 1.362 10 10 EDCE Cc1ncccc1NC(=O)[C@H](C)NC(=O)Cc1ccc(O)c(O)c1 1468738773 OSORAGQYILODRW-NSHDSACASA-N 329.356 1.487 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@H](O)[C@@H]3C)C2)cc1 1470773095 NRTULGPJHUASOH-VBQJREDUSA-N 333.432 1.829 10 10 EDCE CCNC(=O)c1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1 1630017426 CKJUDSGJLUBJBE-UHFFFAOYSA-N 328.368 1.706 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1=COCCO1 1637243797 JPXZPPKQPWKKTQ-UHFFFAOYSA-N 341.747 1.435 10 10 EDCE CN(CCNC[C@H]1CCCOC1)C(=O)c1ccc(N=NC(N)=O)cc1 1567615513 XJDTWZOHQDGPSF-CYBMUJFWSA-N 347.419 1.937 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cscn2)cc1C 1672594938 DPJNFCZIPMGJBH-UHFFFAOYSA-N 349.456 1.684 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)c2c[nH]c(=O)cn2)cc1C 1674224544 SXSKYVDYUBCJQS-ZDUSSCGKSA-N 344.415 1.385 10 10 EDCE CC(C)CNCc1ccc(N2C[C@H](O)[C@@H](O)C2)c(Br)c1 232638233 PUWPAAURZNADTE-GJZGRUSLSA-N 343.265 1.737 10 10 EDCE CCON(CC)C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 879797072 GEKXJJSVUUTYFX-QGZVFWFLSA-N 337.464 1.452 10 10 EDCE CN1CCc2cc([C@H](N)[C@@H](O)CCNC(=O)OC(C)(C)C)ccc21 1999527061 IRHXMQLWAVHOCB-HOTGVXAUSA-N 335.448 1.954 10 10 EDCE C[C@H]1CC[C@@H](C2OCCO2)N(S(=O)(=O)Cc2ccc(N)cc2)C1 2152088376 NVLOVZOUMJGBJL-WFASDCNBSA-N 340.445 1.572 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2CCO[C@]2(C(=O)NCCCN=[N+]=[N-])C1 2010392643 HWYJFVOAYOJVPA-IAQYHMDHSA-N 339.396 1.829 10 10 EDCE O=C(O)[C@@]12COC[C@@H]1CN(Cc1cc(Br)ccc1O)C2 2160991325 MTVAZYXPDIZIPF-HZMBPMFUSA-N 342.189 1.688 10 10 EDCE CCNCc1ccc(N2C[C@@H]3NC(=O)O[C@H]3C2)cc1Br 2176921562 SBMYLGSOVSFWNX-STQMWFEESA-N 340.221 1.856 10 10 EDCE CCOC(=O)c1c(-c2ccccc2)nn2c(O)cc(CC(=O)O)nc12 2080929452 BAUYACMPHUGLMP-UHFFFAOYSA-N 341.323 1.906 10 10 EDCE CNCc1ccc(N2CC[C@H](C)[C@H]2C(N)=O)cc1Br 2090267057 YSRGGKWOTQJSKV-ZANVPECISA-N 326.238 1.869 10 10 EDCE O=S1(=O)C[C@@H]2CCN(Cc3c(O)cccc3Br)[C@H]2C1 2094882871 NXODYBBJXPAGBC-CABZTGNLSA-N 346.246 1.774 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)C[C@H]3C2)c(Br)c1 2236999667 ZMHNFNCUPGYZSH-LWWSYDQCSA-N 342.233 1.509 10 10 EDCE CC(C)(C)OC(=O)NC12COC(C(=O)N3CC[C@@H](N=[N+]=[N-])C3)(C1)C2 2247299950 INNZOSNFTXAMQS-SFNBMPIDSA-N 337.380 1.724 10 10 EDCE CN(c1ccc(CN)cc1Br)[C@H]1COC2(COC2)C1 2270771239 RGTVPVXNABNWCY-LLVKDONJSA-N 327.222 1.902 10 10 EDCE O=C1C(=Cc2ccoc2)SC(=S)N1[C@@H]1CCS(=O)(=O)C1 2293438612 CSGVLYSFTHEWDE-SECBINFHSA-N 329.424 1.668 10 10 EDCE COc1n[nH]c(NC(=O)C=Cc2ccc(N3CCOCC3)cc2)n1 2306230660 QQLVAQBQUAKTNR-UHFFFAOYSA-N 329.360 1.302 10 10 EDCE O=S(=O)(CCO)CCNCc1cc(Cl)cc(Cl)c1O 2335759270 JYIJQJGKYMOURD-UHFFFAOYSA-N 328.217 1.196 10 10 EDCE C[C@@H]1CN(C(=O)c2cc(O)c(O)c(O)c2)C[C@@H](C(F)(F)F)N1C 170190636 XEEYSRJJDMBQFF-HQJQHLMTSA-N 334.294 1.510 10 10 EDCE O=C1N[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CS1 266844520 PLXVVQSVHSRZEA-LBPRGKRZSA-N 339.392 1.104 10 10 EDCE C[C@@H]1CCOCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 375003618 HHDQCHHASNRZPL-SNVBAGLBSA-N 328.390 1.015 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCCN(C(C)=O)CC2)c([N+](=O)[O-])c1 298196088 QMVZULDTXGYDQW-FNORWQNLSA-N 347.371 1.840 10 10 EDCE CN1CCC[C@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1=O 294257909 DEOQPYRXRFBWQL-KRWDZBQOSA-N 345.443 1.350 10 10 EDCE COC(=O)N(C)CCN(C)Cc1ccc(N2CCOCC2)c(F)c1 827341132 ZTYKWJOIVFQCKZ-UHFFFAOYSA-N 339.411 1.792 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3C[C@H](N)C(C)(C)C3)CC2)cc1 903555871 FHYBUPSPEADKTM-KRWDZBQOSA-N 346.475 1.013 10 10 EDCE O=C1N[C@]2(C(=O)NCc3ccc(N4CCCC4)cc3)C[C@H]3C[C@@H]1[C@H]2C3 845192736 QCUAQZCNCHEVBH-CNVJLJKISA-N 339.439 1.818 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 1895876721 YAEMEJBPBZCPIM-QWRGUYRKSA-N 327.385 1.516 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCC(=O)N(C)C1 840306169 QOOJIKFODFJHDG-GOEBONIOSA-N 346.475 1.912 10 10 EDCE O=C(NCCCSc1nccs1)N[C@@H]1CNCCC1(F)F 841857189 NRWOJBXNFMJSRX-SECBINFHSA-N 336.433 1.922 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(=O)[C@@H](C)C3)C2)cc1 923187451 YHHWQMQFMCLVIR-UONOGXRCSA-N 331.416 1.894 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@@H]2COC[C@H]2C1 852004549 HWCNLDYPKFPXLF-IAGOWNOFSA-N 345.443 1.701 10 10 EDCE CO[C@H](Cc1ccc(O)c(O)c1)[C@H](NC(=O)OC(C)(C)C)C(=O)O 1952305735 CQBRYLWQKJHLLI-OLZOCXBDSA-N 341.360 1.633 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1c[nH]nc1[C@@H]1CCNC1 852775407 SZSYMNZQLSXZFN-CQSZACIVSA-N 327.432 1.825 10 10 EDCE COC[C@@](C)(NC(=O)OC(C)(C)C)[C@H](N)Cc1ccc(O)c(O)c1 1952848579 NIUGCPFMGBSBJG-RHSMWYFYSA-N 340.420 1.897 10 10 EDCE CC[S@](C)(=O)=NS(=O)(=O)NCc1ccc(N2CCCC2)cc1 866485053 KSRCZGYEXCGFPJ-NRFANRHFSA-N 345.490 1.739 10 10 EDCE COC(=O)[C@@H]1CC(F)(F)CN1Cc1ccc(N2CCOCC2)cc1 931691447 LTNYLHUSMXNGMO-HNNXBMFYSA-N 340.370 1.906 10 10 EDCE CNc1cnc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cn1 862226264 XXWCTSWJWKUPCF-UHFFFAOYSA-N 341.415 1.409 10 10 EDCE O=C1O[C@H]2CNC[C@H]2N1[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1 872255565 ZFWJLHLGRAJNKF-NFAWXSAZSA-N 337.807 1.413 10 10 EDCE C[C@@H](NC(=O)C(=O)N[C@H]1CSC1(C)C)c1ccc(N(C)C)cc1 1117729559 OYPGMVPWYJHETA-RISCZKNCSA-N 335.473 1.940 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)C1=CS(=O)(=O)CCC1 1137445118 WCXWRGLRCTUQAT-UHFFFAOYSA-N 335.425 1.980 10 10 EDCE CS(=O)(=O)c1ccccc1Cc1n[nH]c(Cc2ccc(N)cc2)n1 82752290 CPUAQUULOFKVNF-UHFFFAOYSA-N 342.424 1.972 10 10 EDCE CCN(CCN(C)C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 688295376 QZYOGVJSARDURW-CYBMUJFWSA-N 341.253 1.789 10 10 EDCE O=C(O)[C@@H]1CO[C@H](CNCc2cc(Br)ccc2O)C1 714008405 MESUWEREXUHOBV-ONGXEEELSA-N 330.178 1.734 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCN2CCOCC2)cc1C 1317274506 BRGBSEFJZZBKKT-INIZCTEOSA-N 349.475 1.320 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@]3(C)CCOC3=O)C2)cc1 1263794156 NPDMHNRSSSJPMI-SJKOYZFVSA-N 333.388 1.279 10 10 EDCE NC(=O)C1CN(c2ccc(C=CC(=O)O)c(Br)c2)C1 1911910294 SCNXCMHHRSEBDN-UHFFFAOYSA-N 325.162 1.468 10 10 EDCE O=C(CCS(=O)(=O)C1CCCC1)NCc1c(O)cccc1O 1472063691 NPMUXNLTZNFDHE-UHFFFAOYSA-N 327.402 1.462 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)Cc2cncn2C)cc1C 1716578953 IAAIKGDCPUGHBF-UHFFFAOYSA-N 344.459 1.918 10 10 EDCE CS(=O)(=O)c1sccc1-c1noc(-c2nnsc2N)n1 1923225169 UQEHSMZAKWXVOG-UHFFFAOYSA-N 329.388 1.302 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)CN1CCOCC1 1715729958 ZNYMYRIRFMUVQZ-UHFFFAOYSA-N 349.475 1.274 10 10 EDCE CNC(=O)COc1cccc(CC(=O)NCc2c(O)cccc2F)c1 1596911687 JACFFZKMWMULFS-UHFFFAOYSA-N 346.358 1.515 10 10 EDCE CC1(C)CN(S(=O)(=O)CCOc2ccc(N)cc2)CCS1 158548150 CJNOGPHNEFVIMM-UHFFFAOYSA-N 330.475 1.805 10 10 EDCE NCc1ccc(N2CC[C@@H](OCCCO)C2)c(Br)c1 2142090729 ZTKQNOIHAPCYGE-GFCCVEGCSA-N 329.238 1.886 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCOC[C@H]2O)c1O 1964581581 PHPNEOSQYATWRT-WDEREUQCSA-N 332.194 1.403 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)NCC1(CN=[N+]=[N-])CC1 1985093595 BPIQUIPUVFZLKK-SNVBAGLBSA-N 327.385 1.469 10 10 EDCE C[C@H](COCC(=O)N1CC[C@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1985101478 SWIFBINEJURDLN-MNOVXSKESA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 1986143068 LXOZNAQNFYUKQN-HZMBPMFUSA-N 325.369 1.270 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@](C)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010388607 DXMZNWAUKOSDQT-IAQYHMDHSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(CO)CNC(=O)Cc1ccc(N)cc1 2010527297 CLDQIGIFJPURCU-KRWDZBQOSA-N 337.420 1.203 10 10 EDCE Nc1ccc(CCC(=O)N[C@H](COCc2ccccc2)C(=O)O)cc1 2034488531 RAKWKYGEPAMYPF-QGZVFWFLSA-N 342.395 1.988 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NCC=C(Cl)Cl)cc1 407257281 DXCKLLAAILMOST-UHFFFAOYSA-N 325.217 1.886 10 10 EDCE Cn1nnc2c1CCN(c1ccc(CN)c(Br)c1F)C2 2170404965 FSFZWOXOPIQGCY-UHFFFAOYSA-N 340.200 1.738 10 10 EDCE C[C@H](O)c1ccc(N2CCN(CCO)C(=O)C2)cc1Br 2171074159 JHCNUHOTGFJQHL-JTQLQIEISA-N 343.221 1.143 10 10 EDCE C[C@H]1CS(=O)(=O)C[C@@H]1NCc1c(O)cccc1Br 711773104 DVSAMEXJULXEDY-KWQFWETISA-N 334.235 1.677 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)CCCO)c(Br)cc21 388634156 IQOLHGIYQRQJMF-LBPRGKRZSA-N 328.210 1.480 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCO[C@H](C(F)(F)F)[C@@H]3C)c2n1 2064779591 NZOLPNFBZQBHTG-KWQFWETISA-N 344.293 1.535 10 10 EDCE CCOCC1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2165851916 VKBFCSHFFFQIHH-CYBMUJFWSA-N 341.205 1.907 10 10 EDCE NCc1ccc(N2C[C@H](O)[C@H](O)CC23CCC3)c(Br)c1 2169893492 CSJKKWXZWIFMKS-KGLIPLIRSA-N 341.249 1.762 10 10 EDCE CNCc1ccc(N2CC[C@@H](C)[C@@H]2C(N)=O)cc1Br 2090267054 YSRGGKWOTQJSKV-NOZJJQNGSA-N 326.238 1.869 10 10 EDCE O=C(O)[C@]1(CO)CCN(Cc2cc(Br)cc(F)c2O)C1 2201082851 TYJCBXLYMGFVDY-CYBMUJFWSA-N 348.168 1.563 10 10 EDCE O=C(O)CN1CC[C@@H](NCc2ccc(Br)cc2O)C1 2113025229 BLSKLMNQEDAHLN-LLVKDONJSA-N 329.194 1.403 10 10 EDCE NCc1cc(F)c(N2CC[C@]3(C[C@@H](O)CO3)C2)cc1Br 2201772204 NXZRLXSETMLGOI-YGRLFVJLSA-N 345.212 1.777 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)C[C@H]3C2)c(Br)c1 2236979101 MBYJIUARNAPVMJ-BAESOJJISA-N 341.249 1.476 10 10 EDCE O=C1OCCN1C1CN(c2ccc(CO)c(Br)c2)C1 2227417499 CLMUWLLRIVYOLN-UHFFFAOYSA-N 327.178 1.582 10 10 EDCE COCCN1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)C(C(=O)OC)=C1C 2293500067 QLPPWOLWVBFCPN-UHFFFAOYSA-N 346.339 1.914 10 10 EDCE CCOC(=O)[C@H]1CCCN(C=C2SC(=S)N(CC)C2=O)C1 2293863914 UDCZKMFPYCKGFS-JTQLQIEISA-N 328.459 1.983 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)c(Br)c1 2330368907 DSCYSXCWTJEJDB-HYNSBDGHSA-N 327.222 1.228 10 10 EDCE CN1CCC[C@H](CNC(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 108816945 XFKJYHPRGXZIRW-AHKGRUIUSA-N 343.471 1.994 10 10 EDCE O=C(COCc1ccccc1)N[C@H](Cc1ccc(O)c(O)c1)C(=O)O 310209479 PJRPZKCBYOIDQF-CQSZACIVSA-N 345.351 1.427 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@H](N3CCOCC3)C2)cc1 173789422 WQIYYZFNAXUUTM-KRWDZBQOSA-N 332.448 1.369 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C[C@H](O)C(=O)O 1951546581 UVTILTCOGOWCNB-MFKMUULPSA-N 341.360 1.369 10 10 EDCE COC[C@]1(C(=O)O)C=CCN1Cc1c(O)cccc1Br 2361558896 TVHUSZMIKVKRKT-AWEZNQCLSA-N 342.189 1.996 10 10 EDCE COCc1n[nH]c(CNC(=O)NCc2ccc(N(C)C)c(F)c2)n1 1261654917 HFVRLSSRMYQSPM-UHFFFAOYSA-N 336.371 1.156 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC[C@H](CC(N)=O)C2)c([N+](=O)[O-])c1 80682784 JASNWRZYACXLON-VUDGCMKMSA-N 347.371 1.873 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ncccc3C(=O)O)CC2)cc1 83238168 DWXUGGLHJRLWFB-UHFFFAOYSA-N 341.367 1.751 10 10 EDCE O=C1NC(=S)NC(=O)C1=CNc1nc2ccc(Cl)cc2s1 40476895 BVNMJISGKYHRCB-UHFFFAOYSA-N 338.801 1.776 10 10 EDCE COc1cc([C@H]2c3cc(O)c(O)cc3C[C@@H](CO)[C@@H]2CO)ccc1O 95936377 PGDXMXMJDYPCRB-PJFSTRORSA-N 346.379 1.717 10 10 EDCE biogenic,in-vitro CC1(C)CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCS1(=O)=O 93735378 DLZNWJYJQMPKLK-UHFFFAOYSA-N 348.808 1.963 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2c(O)ccc3ccccc23)CCO1 529644135 SLDCNROVXRVDGC-CQSZACIVSA-N 329.400 1.675 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCCc1ncc[nH]1 255500311 IMDTVNLOWUYJOK-UTCJRWHESA-N 326.400 1.618 10 10 EDCE CN(Cc1cnccn1)C(=O)NCc1ccc(N2CCOCC2)cc1 265430356 ZDTQNKGMIMRIBL-UHFFFAOYSA-N 341.415 1.655 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CCOCC[C@@H]3C)CC2)cc1 374977948 IZEQBVYOWDEUHU-INIZCTEOSA-N 347.459 1.455 10 10 EDCE CCO[C@H]1C[C@@H]1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 299307444 DTWIVFJUDXSHBW-ROUUACIJSA-N 347.459 1.358 10 10 EDCE Cc1ccc(CNC(=O)c2c[nH]c(=O)cn2)c(O)c1Br 2380753963 LLOURAXEDZRZOJ-UHFFFAOYSA-N 338.161 1.476 10 10 EDCE CS[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@H]1N1CCCC1 294885686 GKKLDNGILPPYAZ-YPMHNXCESA-N 340.420 1.889 10 10 EDCE CCC(=O)N1CSC[C@H]1C(=O)N[C@H](C)c1cc(OC)ccc1O 728978385 FLWCWBXMHPLIAU-MFKMUULPSA-N 338.429 1.890 10 10 EDCE COCCN1CCC[C@H]1CNC(=O)NCc1cc(OC)ccc1O 734069467 MALHMUGKMZIFBA-AWEZNQCLSA-N 337.420 1.311 10 10 EDCE CC(C)[C@@H](NC(=O)c1ccccn1)C(=O)NCCc1ccc(N)cc1 844164387 DPNNDSAFVRSUCX-QGZVFWFLSA-N 340.427 1.777 10 10 EDCE CN1CCCc2cc(CNC(=O)N[C@H](CN)C(F)(F)F)ccc21 848595569 LZFOKRJCZKDCFD-CYBMUJFWSA-N 330.354 1.758 10 10 EDCE CC[C@H](C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@H](C)O 842230819 AGXDXLULYXCMHF-YJBOKZPZSA-N 349.475 1.340 10 10 EDCE COC(=O)[C@H]1CSCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 840185943 JIHOWJVRXCOPSP-BXUZGUMPSA-N 339.413 1.156 10 10 EDCE C[C@H](NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H]1[C@H]2CN[C@H]1C2 925689902 DFJIEANSCMLLMA-LPOXYFBYSA-N 337.414 1.887 10 10 EDCE CCOC1(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCOCC1 855224356 FRWAYPPOBTYFNW-HNNXBMFYSA-N 348.443 1.976 10 10 EDCE Fc1cc(CN[C@H]2CN3CCC[C@H]2C3)cc(F)c1N1CCOCC1 926558794 IKPIJYOBUMESLV-YOEHRIQHSA-N 337.414 1.985 10 10 EDCE COc1ccc(O)c([C@@H](C)NCCCN2CCCS2(=O)=O)c1 756686626 JHVSFAFBPKUFJF-GFCCVEGCSA-N 328.434 1.477 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCc4n[nH]cc4C3)C2)cc1 855231496 ARRRHNXJQVZYFK-HIFRSBDPSA-N 340.427 1.918 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(-n2cnnn2)cn1 857433445 BOZXWRJQCLOQHH-UHFFFAOYSA-N 337.387 1.396 10 10 EDCE CNC(=O)[C@H]1CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 852449388 RUAAETORBSQKCN-KBPBESRZSA-N 346.431 1.051 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](CO)CC3CC3)C2)cc1 854296593 KKQBVJRCMNPWSR-HOTGVXAUSA-N 347.459 1.982 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC[C@H](C)N(C)C)C2)cc1 854295935 FCALXDSJXUMYKE-GJZGRUSLSA-N 334.464 1.913 10 10 EDCE CC(=O)N1CC[C@](C)(C(=O)NCc2ccc3cccnc3c2O)C1 862027348 OHJPVQFTXIMKAP-SFHVURJKSA-N 327.384 1.815 10 10 EDCE CN1CCCc2cc(CN3C(=O)N[C@@]4(CCSC4)C3=O)ccc21 761182750 ZSUNWEQFTDTDRA-QGZVFWFLSA-N 331.441 1.997 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CC(C)(F)C3)C2)cc1 1118178820 VLZXDINQHBZTMR-CYBMUJFWSA-N 349.406 1.208 10 10 EDCE CCN1C[C@@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)CC1=O 898277836 VNRCVEYCMRFMFV-SECBINFHSA-N 334.397 1.911 10 10 EDCE C[C@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)CCN1CCO 897454905 IANJIUINQHLZNF-JTQLQIEISA-N 336.413 1.451 10 10 EDCE O=C(O)[C@@H]1COCCN(Cc2cc(Br)ccc2O)C1 700452516 UFQGODKDUNKBKY-JTQLQIEISA-N 330.178 1.688 10 10 EDCE COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1cc2cc(O)c(O)cc2s1 1137874880 VVOUXXXYRIDIBM-BDAKNGLRSA-N 337.353 1.061 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 1142532986 BKWDJSVYXKDIRM-LBPRGKRZSA-N 344.342 1.906 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CS1(=O)=O 1146271712 UNJPGIMCWYCHGF-SKDRFNHKSA-N 338.389 1.545 10 10 EDCE C[C@H](NC(=O)CCNS(=O)(=O)c1ccccc1)c1ccccc1O 1302532917 USLRQRYTCOBNJL-ZDUSSCGKSA-N 348.424 1.938 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(c2ccon2)CC1 1329509460 SJPZSLDJSXQTFY-UHFFFAOYSA-N 341.367 1.629 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)Cc2cnc[nH]2)C2CC2)cc1C 1276664920 JTEAFIVNAOFCOH-QGZVFWFLSA-N 342.443 1.954 10 10 EDCE CCn1cc(C(=O)N[C@@H](C)CNCc2ccc(OC)c(C)c2)nn1 1275391637 KGYUKFDTPHLQJY-ZDUSSCGKSA-N 331.420 1.523 10 10 EDCE COCCNCC1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1282084210 NVYDCGRZZZSPNX-UHFFFAOYSA-N 333.392 1.593 10 10 EDCE CC(C)[C@H](F)C(=O)NC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1530589861 BHGACDKHOPMHLJ-ZDUSSCGKSA-N 349.366 1.784 10 10 EDCE COc1ccc(CNC(=O)c2coc3c2C(=O)NCCC3)c(O)c1 1617761620 CNYJAOPCSMPBRQ-UHFFFAOYSA-N 330.340 1.600 10 10 EDCE CCc1nc[nH]c1C(=O)NC[C@H](CO)NCc1ccc(OC)c(C)c1 1700804643 FBBGCFXUISDDOC-CQSZACIVSA-N 346.431 1.170 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2ccc(O)nn2)cc1C 1714538066 MLQRUHPYSVWXOI-ZDUSSCGKSA-N 344.415 1.750 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1COCCO1)NCc1ccc(OC)c(C)c1 1714061301 VTWYJDGRGUVGKP-RDJZCZTQSA-N 336.432 1.403 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1COC(=O)N1)NCc1ccc(OC)c(C)c1 1481808565 WSQRNZSEGDJPJZ-KGLIPLIRSA-N 335.404 1.096 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N(CCO)C3CCC3)c(Br)cc21 228395576 SFGIKJHVHRARES-ZDUSSCGKSA-N 340.221 1.752 10 10 EDCE Cc1cn2c(=O)c(C(=O)NCc3ccc(O)cc3O)cnc2s1 1638352449 OHTWAGFAXGEDNZ-UHFFFAOYSA-N 331.353 1.406 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCCC[C@@H]2CO)c1 1631407249 JIMAFQJCLXOCLZ-GFCCVEGCSA-N 342.417 1.141 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2nnn(C)c2C)cc1C 1568265077 SFBZUWBCSZTVNS-CYBMUJFWSA-N 345.447 1.691 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)CCC(C)C)cc(OC)n1 1737548713 KVPCTEGINFKLTD-GFCCVEGCSA-N 337.420 1.770 10 10 EDCE C[C@@H](C(=O)NCc1cc(O)ccc1O)c1ccc(S(C)(=O)=O)cc1 1644753566 DUPXZODOHSBSKS-LLVKDONJSA-N 349.408 1.921 10 10 EDCE C[C@@H](NC(=O)CN1C(=O)COc2ccccc21)c1ccccc1O 1587444332 DGBANDWKAZFFGU-GFCCVEGCSA-N 326.352 1.995 10 10 EDCE COc1ccc(N2CCN(CN3C(=O)[C@H]4CC[C@H]4C3=O)CC2)cc1 1119324288 CYPNRTJGGVSPLR-IYBDPMFKSA-N 329.400 1.170 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 2010392257 YNJDVLJQEZUCLO-GFCCVEGCSA-N 340.428 1.743 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010404185 PLLKYVTUSHSSDL-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)c(Br)c1 2178085182 CXGPSLOCZFIQAO-OXUWNYNTSA-N 341.249 1.912 10 10 EDCE NCc1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)c(F)c1Br 2178086806 NQIHTPWGYXDVFC-SCVCMEIPSA-N 345.212 1.490 10 10 EDCE CS(=O)(=O)c1cnn(Cc2cc(Br)ccc2O)c1 2070206462 QPYCZGUZFQGZAL-UHFFFAOYSA-N 331.191 1.803 10 10 EDCE CNCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)cc1Br 2189069850 XKWDBGYNGZRELZ-JYAVWHMHSA-N 341.249 1.612 10 10 EDCE O=S1(=O)C[C@H]2[C@@H](C1)[C@@H]2NCc1cccc(Br)c1O 2054271823 ZSDBAXPPXQENGK-JZYVYDRUSA-N 332.219 1.287 10 10 EDCE O=C(N[C@]12C[C@H]1CN(Cc1ccccc1)C2)c1cc(O)c(O)c(O)c1 2068618315 PISYNUICUQHCIX-LIRRHRJNSA-N 340.379 1.808 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@@]4(CO)C3)c(Br)cc2[C@@H]1O 2200842539 ALWAGYHDFYHEBU-UEXBWHTRSA-N 339.189 1.253 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@H](N(C)C)C2)cc1Br 2089922012 FRWUMZXKVMXWMG-KGLIPLIRSA-N 328.254 1.280 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)C[C@H](CO)C2)cc1Br 2236635950 LISXGMPLLIRXTB-SRVKXCTJSA-N 344.249 1.930 10 10 EDCE OCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2332589691 ATUZWXHLQBEMMT-IGJVIKARSA-N 328.206 1.262 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCO1 54787270 CULXOGZGCKHTSX-YOEHRIQHSA-N 333.432 1.890 10 10 EDCE Cc1ccccc1N1C(=O)/C(=C/NC[C@H]2CCCO2)C(=O)NC1=S 103844068 UHMOUURKNMAILV-GMCKNXKJSA-N 345.424 1.395 10 10 EDCE CCOC(=O)[C@@H]1C[C@H](N=[N+]=[N-])[C@@H](O)C[C@@H]1NC(=O)OC(C)(C)C 309772729 BKORQFRBLKLSCW-RCWTZXSCSA-N 328.369 1.893 10 10 EDCE COC[C@H]1[C@@H](O)[C@@H](O)CN1c1ccc([C@@H](C)N)c(Br)c1 2358565925 PVLJDVFDKLTYOB-DGJRKYIQSA-N 345.237 1.026 10 10 EDCE O=C(O)CCN1C(=O)/C(=C\c2ccc(O)cc2O)SC1=S 35624560 ZVKXIPSGDRSVSV-BJMVGYQFSA-N 325.367 1.774 10 10 EDCE Cn1c(O)ncc(C(=O)NCc2c(O)ccc3c2CCCC3)c1=O 267966972 MBCNAVVZVUUVOP-UHFFFAOYSA-N 329.356 1.000 10 10 EDCE Cc1cc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)no1 283049545 DHHNWRQMESTQAZ-UHFFFAOYSA-N 330.388 1.324 10 10 EDCE Cc1ccc(CN2C[C@H](CO)[C@@H](CCO)C2)c(O)c1Br 2381134491 CVUXTIIBRYTEOK-WCQYABFASA-N 344.249 1.886 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)C[C@H]1CCCO1 807096142 APVZJGQRXDZBJL-MRXNPFEDSA-N 333.432 1.315 10 10 EDCE COc1ccc(CN[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)cc1C 800309025 BMQRZONZTZPNNF-HUUCEWRRSA-N 326.462 1.811 10 10 EDCE C[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccnn1C 817428210 FFKOVNZCDFHHNF-ZDUSSCGKSA-N 346.406 1.816 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CCCN(C)C1=O 839922378 SJQQXJOYJUHOIG-RHSMWYFYSA-N 331.460 1.977 10 10 EDCE CCOC[C@@H]1C(=O)N([C@H]2CCN(c3ccc(OC)cc3)C2)C(=O)N1C 849358451 WFSIMDGVXCNMBX-GOEBONIOSA-N 347.415 1.573 10 10 EDCE Cn1[nH]c([C@H]2CCCN2C(=O)/C=C/c2ccc(O)c(O)c2)nc1=N 846067886 LKHDNCIMDFXHGK-OKPNEXGHSA-N 329.360 1.016 10 10 EDCE COc1cnc(F)c(C(=O)NCc2ccc(N3CCOCC3)cc2)c1 847381802 RXCBZAIZQSGAOZ-UHFFFAOYSA-N 345.374 1.996 10 10 EDCE COc1ccc(N2CC[C@@H](NC[C@H]3CCCN(C(=O)CN)C3)C2)cc1 849350827 XPYYKQRBXJBTNN-HZPDHXFCSA-N 346.475 1.061 10 10 EDCE CC(=O)[C@H](C[C@@H](N)Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952894733 ZBDLOSSHFLQUCF-STQMWFEESA-N 338.404 1.840 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ncc(OC)cn3)C2)cc1 855225311 JUZISKJQQLQWEY-GFCCVEGCSA-N 328.372 1.503 10 10 EDCE COC(=O)CCNC(=O)CCNCc1c(O)cc(C)cc1Cl 858292620 BYJWZHOFKOHCEQ-UHFFFAOYSA-N 328.796 1.513 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCCCCNC(N)=O)C2)cc1 857302594 WEKDLXFUCUEANL-CQSZACIVSA-N 348.447 1.619 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CC(=O)N(C4CC4)C3)C2)cc1 855231736 LQUWAQAZDSVDRF-KBPBESRZSA-N 343.427 1.401 10 10 EDCE CCc1noc(C[C@]2(O)CCCN(Cc3c(O)cccc3OC)C2)n1 856595641 GVXURRXGASCELL-GOSISDBHSA-N 347.415 1.916 10 10 EDCE CC(=O)N1CCCC[C@@H]1C(=O)NCc1ccc2cccnc2c1O 862028258 VUYKHCDBYSIWAD-OAHLLOKOSA-N 327.384 1.958 10 10 EDCE CCN(C)c1ccc(CN2CCC[C@H](CS(=O)(=O)NC)C2)cc1 860194820 YGABQXFJTVRYOJ-INIZCTEOSA-N 339.505 1.904 10 10 EDCE Cc1cc(CNC(=O)C[C@@H]2NC(=O)NC2=O)c(C)n1-c1ccccc1 863165664 JYRFBPILSJVWPW-HNNXBMFYSA-N 340.383 1.308 10 10 EDCE COC(=O)c1cn([C@@H]2CCN(Cc3cc4c(cc3O)CCC4)C2)nn1 760543129 YBTGHYGMXLUHII-OAHLLOKOSA-N 342.399 1.706 10 10 EDCE COc1ccc(O)c([C@@H](C)NCC(=O)N2CCOC[C@H]2C2CC2)c1 775377518 GPQPQIUUJQUMTG-WBMJQRKESA-N 334.416 1.689 10 10 EDCE CCOc1ccc(CN2CCOC[C@@H]2c2noc(COC)n2)c(O)c1 779615708 IFJYAYDIOHIXNA-CQSZACIVSA-N 349.387 1.894 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@]34COC[C@@H]3C4)C2)cc1 889265150 SNBIUASKQZEZCT-DEYYWGMASA-N 331.416 1.610 10 10 EDCE COC(=O)[C@@H]1[C@@H](CN[C@@H]2CCN(c3ccc(OC)cc3)C2)C1(F)F 895229447 VQHKMJIGLLHXEQ-DFBGVHRSSA-N 340.370 1.918 10 10 EDCE CC(=O)N/C(=C/c1cccs1)C(=O)NCCc1ccc(O)c(O)c1 1137464445 AFUAHKLEFXFTOJ-GXDHUFHOSA-N 346.408 1.995 10 10 EDCE OCCN1CCC[C@H](NCc2cc(Br)cc(F)c2O)C1 715804075 LWULXQIOQYUUHR-LBPRGKRZSA-N 347.228 1.840 10 10 EDCE C[C@@](NCCCN=[N+]=[N-])(C(N)=O)c1ccc(Br)cn1 695239155 VULHGFOSJMXFDY-NSHDSACASA-N 327.186 1.835 10 10 EDCE C[C@]1(CO)C[C@@H](O)CN1c1ccc(CN)c(Br)c1F 698201864 NBUHOMVKISCOPP-NOZJJQNGSA-N 333.201 1.369 10 10 EDCE CN(C)[C@@H]1CC[C@@H]2[C@@H](C1)OCCN2C(=O)Cc1ccc(O)c(O)c1 1151552980 ZJPLQRQICDAFFP-CKEIUWERSA-N 334.416 1.350 10 10 EDCE OCc1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)c(Br)c1 2121593419 QACIMTBRRUHZEC-GYSYKLTISA-N 328.206 1.385 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H](c2ccccn2)C1 1324809021 OPSYTLTZDGUTCL-CQSZACIVSA-N 339.395 1.762 10 10 EDCE COC(=O)c1cc(C(=O)NCc2ccc3cccnc3c2O)c[nH]1 1451954078 GFIQZIXKFWGNIP-UHFFFAOYSA-N 325.324 1.985 10 10 EDCE CO[C@H](C)C(=O)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1294707484 GSPIZRPTAXJIEZ-MFKMUULPSA-N 347.375 1.215 10 10 EDCE Cn1c(=O)n(CC(=O)NCc2ccc(O)cc2O)c2ccccc21 1451773640 YXVDSWRTVHFIEB-UHFFFAOYSA-N 327.340 1.068 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CSC(c2ccccc2O)=N1 1455357500 RTHQNOYBZBSADL-CYBMUJFWSA-N 344.392 1.982 10 10 EDCE COC(=O)C[C@](C)(NC(=O)c1cccc(O)c1O)c1ccncc1 1467369855 WWNKFLJAVCFIFY-KRWDZBQOSA-N 330.340 1.701 10 10 EDCE Cn1c(S)nnc1CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1468445268 DXUZRNASFTYMMT-UHFFFAOYSA-N 347.404 1.629 10 10 EDCE CNC(=O)C1(C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)CC1 1483175333 GXEPZSKJHOOBCC-CYBMUJFWSA-N 333.432 1.124 10 10 EDCE CCCCOCC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCC 1624658290 DDRKWBNHBKTNPA-ZDUSSCGKSA-N 339.388 1.505 10 10 EDCE COC(=O)c1c(C)nn(C)c1NC(=O)c1ccc(C2=S=CC=C2)o1 1623457480 BJSFFOJRYKZCSQ-UHFFFAOYSA-N 345.380 1.986 10 10 EDCE NC(=O)N1CC[C@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)C1 1623614625 CIVWQHOIKQWNEF-MRVPVSSYSA-N 335.385 1.443 10 10 EDCE COc1ccc(CNC[C@@H]2CCCN2C(=O)[C@@H](C)CC(N)=O)cc1C 1499915983 KVYKENGLAFVCSA-HOCLYGCPSA-N 347.459 1.596 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cc(=O)n(C)cn2)cc1C 1491486215 CNLDVQJXFWZYRB-ZDUSSCGKSA-N 344.415 1.005 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2c[nH]cc2C)cc1C 1667934387 RRLILEWLXMKRDV-HNNXBMFYSA-N 331.416 1.521 10 10 EDCE COc1ccc(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)nn1 1774043310 NGQVCDKGEZVCSR-CYBMUJFWSA-N 344.415 1.710 10 10 EDCE COc1cccc(CN[C@H]2COC[C@@H]2NC(=O)OC(C)(C)C)c1O 1944917714 OWONDVKBGWVAKY-STQMWFEESA-N 338.404 1.783 10 10 EDCE CN(C(=O)CN(CC(N)=O)Cc1ccccc1)c1ccc(N)cc1 1946835332 YDASIMFCTQCZPZ-UHFFFAOYSA-N 326.400 1.219 10 10 EDCE NC(=O)COC1CCN(c2ccc(CO)cc2Br)CC1 2145372961 XHXSZBSCUVHGBX-UHFFFAOYSA-N 343.221 1.412 10 10 EDCE Cn1cc(I)c([C@@H](N)c2ccccc2O)n1 1983829898 SGMBFTWKRJUUSY-JTQLQIEISA-N 329.141 1.778 10 10 EDCE NCc1ccc(N2CC[C@@H](N3CC(O)C3)C2)c(F)c1Br 2158751931 TXJUHGZSHRTCSK-SNVBAGLBSA-N 344.228 1.302 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)COC1 2014496007 XOYQJPAYNROKFY-LLVKDONJSA-N 339.396 1.829 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 2010390913 JZMYHZCLIAGTAX-NSHDSACASA-N 340.428 1.648 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCCN(C(=O)C(C)C)CC3)c2n1 2064235399 IZEJBTLWMCFWFC-UHFFFAOYSA-N 345.403 1.074 10 10 EDCE Cn1cc(C(=O)N2CC[C@H](N=[N+]=[N-])C2)c(CNC(=O)OC(C)(C)C)n1 2060640135 QCTDBDXAIGQPSU-JTQLQIEISA-N 349.395 1.970 10 10 EDCE CNCc1ccc(N2C[C@H](N(C)C)[C@H](O)C2)c(Br)c1 2089918698 JFJBQVQHWGCFIG-UONOGXRCSA-N 328.254 1.280 10 10 EDCE CN(C)C[C@@H]1COCCN1Cc1cccc(Br)c1O 2096920833 GRTUDTZCTRQGKK-GFCCVEGCSA-N 329.238 1.917 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CN(c3ccc(N)cc3)C[C@H]2[C@H]1CO 2214630009 DBQGIOMROXLQGA-APHBMKBZSA-N 333.432 1.933 10 10 EDCE OC[C@@H]1NC[C@@H]2CN(Cc3c(O)cccc3Br)C[C@H]21 2227311442 DHQIZOQSQCJFNA-BREBYQMCSA-N 327.222 1.167 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H](N)[C@@H](C)O)c(O)c1Br 2352648744 BANKYBXKJOJRQB-LDYMZIIASA-N 331.210 1.130 10 10 EDCE CC(C)c1nnnn1CC(=O)NCc1c(O)ccc2c1CCCC2 175375622 LZSKRAWNORMTIY-UHFFFAOYSA-N 329.404 1.697 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCC(=O)NC(C)C)CC2)cc1 45576301 MUEPYWOEDIEOBE-UHFFFAOYSA-N 348.447 1.442 10 10 EDCE CCS(=O)(=O)C[C@](C)(NCc1cnc(SC)s1)C(=O)O 2371363821 CULLOURRYPIYOP-NSHDSACASA-N 338.476 1.233 10 10 EDCE C[C@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1ccc(N2CCOCC2)cc1 93420620 QWVPUWMUMMMXEN-HUUCEWRRSA-N 340.489 1.777 10 10 EDCE Cc1ccc(CN2C[C@H](O)C[C@@H](C(=O)O)C2)c(O)c1Br 2380812238 SVNBAQDREWYVGD-GHMZBOCLSA-N 344.205 1.731 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC34CC4)cc2)CC1 817448661 WPWVNLJYDNDLSJ-QGZVFWFLSA-N 327.428 1.771 10 10 EDCE CC[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CCO1 817828642 KVGYQTYIQGCJQH-RDJZCZTQSA-N 347.459 1.751 10 10 EDCE Nc1ccc(OCCOn2c(=O)c(=O)oc3ccc(Cl)cc32)cc1 821297139 ODSVSDCIAFHBRZ-UHFFFAOYSA-N 348.742 1.698 10 10 EDCE O=[N+]([O-])c1cc(CN2CCC[C@@](O)(CO)C2)ccc1N1CCCCC1 839156198 YKRMEGHYLZFCHW-SFHVURJKSA-N 349.431 1.904 10 10 EDCE CO[C@@H]1COC[C@@H]1NC(=O)NCc1cc(Br)ccc1O 838777967 IEYKHDWUIFTLLJ-CMPLNLGQSA-N 345.193 1.368 10 10 EDCE C[C@H](NC(=O)N[C@H](CO)c1ccnn1C)c1ccc(N(C)C)cc1 838560491 XTMZMLWDDXYLKJ-SWLSCSKDSA-N 331.420 1.580 10 10 EDCE COC(=O)C[C@@H]1C(=O)NCCN1C/C=C\c1ccc(N(C)C)cc1 835026497 YFAPCOHQBHNZPS-YIEVGGLXSA-N 331.416 1.129 10 10 EDCE CN(Cc1nnn(C)n1)c1cc(Br)c(CN)cc1F 1893028829 DQEYZFAPKKHILR-UHFFFAOYSA-N 329.177 1.207 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@]23C[C@H]4C[C@H](C(=O)N2)[C@H]3C4)cc1F 844357700 OWCGICRBWCSPPI-JWXAPSBJSA-N 331.391 1.423 10 10 EDCE COCC1(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 848933504 CUYYAJAWEJNIAE-UHFFFAOYSA-N 343.427 1.222 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)c3nccn3C)cc2F)CC1 741261811 QTTFRSGFBXQRCM-UHFFFAOYSA-N 345.422 1.631 10 10 EDCE COc1ccc(N2CC[C@@H](CN3C(=O)N[C@H](CSC)C3=O)C2)cc1 924951083 QSWZBFSTAWWHAJ-IUODEOHRSA-N 349.456 1.805 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCc4cncn4C3)C2)cc1 855224459 GMCOSBRNAZWOIC-CABCVRRESA-N 340.427 1.849 10 10 EDCE CCc1cccc(CN2CCC[C@H](CS(=O)(=O)NC)C2)c1O 862550379 DUEMOQRDJAWJQD-ZDUSSCGKSA-N 326.462 1.716 10 10 EDCE COC(=O)C1=CC[C@H](NCc2ccc(N3CCN(C)CC3)cc2)C1 862465021 CMFWWKDTAZIDNZ-KRWDZBQOSA-N 329.444 1.790 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC(C)(C(N)=O)C2)c1 862092136 RQJMOPUIMOEKQW-UHFFFAOYSA-N 339.395 1.854 10 10 EDCE CCn1nc2c(cc1=O)CN(C(=O)/C=C\c1ccc(O)c(O)c1)CC2 779527588 HGLLXCWGKDPIAA-XQRVVYSFSA-N 341.367 1.273 10 10 EDCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(N(C)C)cc1 770374971 PCCGLNVSUQAYTA-NCOADZHNSA-N 346.427 1.678 10 10 EDCE Cc1cc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)ncn1 795352487 KJCDOHAMHGBBDQ-UHFFFAOYSA-N 337.357 1.219 10 10 EDCE COCCc1cc(NC(=O)NCc2ccc(OC)cc2O)n(C)n1 797635760 HZGNHBOVTHXMFK-UHFFFAOYSA-N 334.376 1.645 10 10 EDCE C[C@@H](N[C@H](C)C1(S(C)(=O)=O)CC1)c1cc([N+](=O)[O-])ccc1O 797070878 NJVVTUWKROOLKY-NXEZZACHSA-N 328.390 1.917 10 10 EDCE COCC(=O)N[C@H](C)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1335814533 IJNJOJWFXMGODA-LLVKDONJSA-N 349.391 1.510 10 10 EDCE CN1C(=O)O[C@@H]2CN(Cc3c(O)cccc3Br)C[C@H]21 2120402669 OTZFPERTAVHVFD-ZYHUDNBSSA-N 327.178 1.790 10 10 EDCE CO[C@@]1(CO)CCCN(C(=O)NCc2ccc3c(c2)CCCN3C)C1 1330045376 IQUIVWPBIGDGIF-IBGZPJMESA-N 347.459 1.752 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCc1ccns1 1332133741 QHEGAVQHORXIDV-UHFFFAOYSA-N 346.456 1.493 10 10 EDCE CO[C@H](CCNC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1902037570 SZMPVZFFJBNWFI-WDEREUQCSA-N 327.385 1.827 10 10 EDCE CC1(C)C[C@H](O)[C@H](O)CN1c1ccc(CO)cc1Br 2132174008 MULJJOHTWPZBCQ-QWHCGFSZSA-N 330.222 1.652 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)c2cnnc(O)c2)cc1C 1274735728 HWDDHJBXAMOYAO-ZDUSSCGKSA-N 344.415 1.797 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc([C@@H]2CCCN2C)[nH]n1 1447560058 FHZRVSUVCGEZKK-NHYWBVRUSA-N 344.415 1.949 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCCc1nnc2n1CCCC2 1466577997 CFZYRVZMLMQCLK-UHFFFAOYSA-N 330.388 1.317 10 10 EDCE CC[C@@H](C)C(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1524876402 GEUYUXXRAJJKHV-RAIGVLPGSA-N 335.404 1.522 10 10 EDCE COc1ccc([C@@H](CCO)NC(=O)Cc2ccc(O)c(O)c2)cc1 1623092447 SXTYYGOHNTXNQA-OAHLLOKOSA-N 331.368 1.889 10 10 EDCE COc1ccc(CN[C@@H]2C[C@@H](C)N(C(=O)CCNC(N)=O)C2)cc1C 1717828235 PLJXMUJMCRFNBN-UKRRQHHQSA-N 348.447 1.141 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CS(=O)(=O)NC(C)(C)C 1556515961 TXZJDPRMEIMMTR-UHFFFAOYSA-N 349.449 1.212 10 10 EDCE C[C@H](C(=O)NCCc1ccc(O)c(O)c1)N1CSCCSC1 1622753227 MSHUNZJFCZDMLQ-LLVKDONJSA-N 342.486 1.842 10 10 EDCE CC[C@@H](CNC(=O)[C@H](C)C1CC1)NC(=O)c1cc(OC)nc(OC)c1 1721458730 SMLNFLGGEOAOBI-RISCZKNCSA-N 349.431 1.770 10 10 EDCE COc1ccc(N2CCN(C(=O)CCN3CC[C@H](F)C3)CC2)cc1 1631277163 LUBISPYVZIFBFN-HNNXBMFYSA-N 335.423 1.778 10 10 EDCE O=C1NCCN(C(=O)Cc2ccc(O)c(O)c2)[C@H]1CC1CCCCC1 1638273916 OTLWATPVWFNDSQ-HNNXBMFYSA-N 346.427 1.938 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)C2=C[S@](=O)CCC2)N(C)C)cc1 1640231778 BRMSJAPWAOTRTC-BXKMTCNYSA-N 349.500 1.898 10 10 EDCE CCn1cc(C(=O)NCC[C@H](C)NCc2ccc(OC)c(C)c2)nn1 1674245532 HULKPYVRAPMPIC-AWEZNQCLSA-N 345.447 1.913 10 10 EDCE CC1(C)C(=O)NCCN1c1ccc(CN)c(Br)c1F 231839998 KLHDAOQZORLWIA-UHFFFAOYSA-N 330.201 1.762 10 10 EDCE CC[C@@H]1C(=O)NC(=O)CN1c1ccc([C@@H](C)N)c(Br)c1 234072279 CJTZNWGKOIHQJE-PRHODGIISA-N 340.221 1.710 10 10 EDCE C[C@]1(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCOC1=O 1123864712 ATDFMIJYCVJOQN-KSSFIOAISA-N 348.399 1.788 10 10 EDCE CC(C)(C)OC(=O)N[C@]12C[C@H]1CN(C(=O)c1cccc(O)c1O)C2 1965253613 RGJVSWAWMHDOKQ-BTDLBPIBSA-N 334.372 1.837 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985100564 HQACDKHLXRGAAT-OUAUKWLOSA-N 327.385 1.562 10 10 EDCE COC1CC(NC(=O)OC(C)(C)C)(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003172695 PBMBLTXYAJEPIT-YPHDCTBHSA-N 340.420 1.324 10 10 EDCE CC[C@]1(O)CCN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2150760195 LCZQZHRGISRNSM-JSGCOSHPSA-N 341.205 1.786 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2010404347 RFOMMQJUPPMXDA-LBPRGKRZSA-N 339.396 1.924 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCN(C)[C@H](C(C)(C)C)C3)c2n1 2062887394 ISBUNTAKJAVXTP-ZDUSSCGKSA-N 331.420 1.546 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@H](O)C2)cc1Br 2105075577 UDDOZJZUTQXTER-STQMWFEESA-N 329.238 1.491 10 10 EDCE CN(C)c1ccc(OC[C@@](N)(C(=O)O)C2(Br)CC2)cc1 2237685358 SLGGWGRJIRWCFQ-CQSZACIVSA-N 343.221 1.841 10 10 EDCE CC[C@H](C)NCc1ccc(N2CC(O)(CO)C2)cc1Br 2240030455 DXNDXKYMSDVQOA-NSHDSACASA-N 343.265 1.881 10 10 EDCE CC1(C)[C@@H](NC(=O)C=Cc2ccc(N3CCOCC3)cc2)C[C@H]1O 2310366433 GURKMGYFCDKGPN-DLBZAZTESA-N 330.428 1.812 10 10 EDCE CC(C)S(=O)(=O)N(C)Nc1nc(Cl)c(C(N)=S)s1 2317439313 UDMSESIGRHQXME-UHFFFAOYSA-N 328.872 1.428 10 10 EDCE COc1ccc(N2C(=O)[C@H](CN3CCOCC3)SC2=S)cc1 20248933 CCDXRTRLVLMHLO-ZDUSSCGKSA-N 338.454 1.761 10 10 EDCE OC[C@H](O)C1CN(c2ccc(CNC3CC3)c(Br)c2)C1 2361909420 WFTZURGHRACYRJ-HNNXBMFYSA-N 341.249 1.491 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCCC[C@H]1CN1CCOCC1 180769527 IHXPSHXRDYOZTD-YERXGYGTSA-N 346.427 1.824 10 10 EDCE CCCn1nnnc1CN(Cc1ccccc1O)C[C@H]1CCCO1 70976541 XMJXKESZFOLSHW-OAHLLOKOSA-N 331.420 1.970 10 10 EDCE O=S(=O)([C@@H]1CCN(Cc2cc(F)ccc2O)C1)N1CCCC1 180281379 XTEGFMVPGBBQLW-CQSZACIVSA-N 328.409 1.531 10 10 EDCE CO[C@@H](CO)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951699250 QWRIWCJCAWTDDG-FZMZJTMJSA-N 327.377 1.541 10 10 EDCE COc1cc(N(C)C(=O)c2ccoc2CC(N)=O)cc(OC)c1OC 353305791 DYNYVNWIYXQCLJ-UHFFFAOYSA-N 348.355 1.610 10 10 EDCE Cc1ccc(CN2CCC[C@@]2(CO)C(=O)O)c(O)c1Br 2380804187 KWNQODCKJIRDGP-CQSZACIVSA-N 344.205 1.875 10 10 EDCE C[C@H]1CCCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1C(=O)O 818331682 XMVZAJFRRXQFPB-KSSFIOAISA-N 347.459 1.896 10 10 EDCE COc1cccc(CNS(=O)(=O)CCC[C@H]2CCOC2)c1O 827194342 KFDDGXRAMXCCQU-LBPRGKRZSA-N 329.418 1.637 10 10 EDCE NS(=O)(=O)C1(CNCc2cc(Cl)cc(Cl)c2O)CCC1 721587601 QXGVPFZPBAVKLI-UHFFFAOYSA-N 339.244 2.000 10 10 EDCE COC(=O)COc1ccc(N(C)Cc2cn(CC3CC3)nn2)cc1 828790412 DXTFFNWDTKUYJP-UHFFFAOYSA-N 330.388 1.876 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3ccc(N(C)C)cc3C)C[C@@H]12 827390140 UMMSRLRCKURVBA-BBWFWOEESA-N 338.473 1.305 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3c(O)ccc(Cl)c3F)C[C@@H]12 827390581 XRGIUYYUSZFWRN-BIMULSAOSA-N 349.811 1.429 10 10 EDCE C[C@@H]1CS(=O)(=O)CCCN1C(=O)NCc1ccc(N(C)C)cc1 913927017 SEBDLDYWQALLBJ-CYBMUJFWSA-N 339.461 1.471 10 10 EDCE CC[C@@H](CNC(=O)C(=O)N(CC)Cc1ccc(N(C)C)cc1)C(=O)O 927955512 GDHSIDWXAQHOIK-AWEZNQCLSA-N 349.431 1.328 10 10 EDCE Cn1cnnc1N1CCN(Cc2c(O)ccc(Cl)c2F)CC1 848925287 RPYMPMASQKBFLO-UHFFFAOYSA-N 325.775 1.635 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)c3cnn(C)c3)C2)cc1 853817273 CBLQCQFKLSJKNH-CYBMUJFWSA-N 328.372 1.007 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@](O)(C2CC2)C1 852503323 SNHOUELWAWUSBJ-HXUWFJFHSA-N 345.487 1.948 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H](C)C(C)(C)CO)CC2)cc1 924830987 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CC(C)(C)OC(=O)NC[C@@H]1CCN1C(=O)c1cc(O)c(O)c(O)c1 2015123624 UQPXCYUPVUVDQK-JTQLQIEISA-N 338.360 1.543 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H](CC(=O)N2CC(N=[N+]=[N-])C2)C1 2022659482 KSVQITRQRLSHLA-NSHDSACASA-N 339.396 1.781 10 10 EDCE CN(c1ccc(CN)c(Br)c1)C1CCS(=O)(=O)CC1 694192442 OQNYKZIYCCSJOQ-UHFFFAOYSA-N 347.278 1.921 10 10 EDCE CC[C@@H](N[C@H](COC)C(N)=O)c1cc(Br)ccc1O 2096073600 RVBKAXPKJPPCRC-GHMZBOCLSA-N 331.210 1.696 10 10 EDCE Oc1cccc(Br)c1CN[C@H]1CCN(C2COC2)C1 2113272101 XDQCMVLQHYEXCQ-JTQLQIEISA-N 327.222 1.717 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2205600296 PKWAXLVCYODCSR-NGSVMEPUSA-N 347.228 1.609 10 10 EDCE OCc1ccc(N2CCc3ncnc(O)c3C2)c(Br)c1 2206106789 UOTKBTAMTDBOGG-UHFFFAOYSA-N 336.189 2.000 10 10 EDCE CCN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1ccccc1OC 491290962 KFNNUYNVJJTEAB-ZHACJKMWSA-N 343.383 1.159 10 10 EDCE C[C@H](CNC(=O)C=Cc1ccc(O)c(O)c1)CN1CCN(C)CC1 2308001112 AEMMZAQOLXBHPK-CQSZACIVSA-N 333.432 1.111 10 10 EDCE Cc1ccc(CNS(=O)(=O)[C@@H](C)CN)c(O)c1Br 2327594406 MXWPFFOIFKBZAB-QMMMGPOBSA-N 337.239 1.230 10 10 EDCE Cc1ccc(CNC(=O)COCC(=O)O)c(O)c1Br 2352619070 ADVHAFJUFFGEOP-UHFFFAOYSA-N 332.150 1.181 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H](O)C(C)(C)N 1951507021 LGPKJMBPMLNOCZ-SMDDNHRTSA-N 340.420 1.632 10 10 EDCE CN(C)CCOc1ccc(N2CCN(c3ncccn3)CC2)cc1 71702488 IEPJBRBKLGEWRV-UHFFFAOYSA-N 327.432 1.744 10 10 EDCE Cc1cc(C(=O)N2CC(=O)N(C)[C@H](C)C2)c(C)n1-c1ccccn1 282493822 WNTUZVYWXRXVFL-CYBMUJFWSA-N 326.400 1.792 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)[C@@H](O)Cc1cnn(C)c1 801545863 FIYUZSCHTQYJLN-KRWDZBQOSA-N 331.416 1.858 10 10 EDCE C[C@@H](NC(=O)C(=O)NCCOC(C)(C)C)c1ccc(N(C)C)cc1 807673784 ZBMKIKFOBNDCJW-CYBMUJFWSA-N 335.448 1.861 10 10 EDCE CO[C@@]1(CO)CCCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 826952866 VLWCDVCXXKMVRG-AWEZNQCLSA-N 330.768 1.927 10 10 EDCE CN[C@@H](C)c1ccc(N2CCOC[C@H]2C(N)=O)c(Br)c1 723151365 XRJDYOJFEIDIBD-ZANVPECISA-N 342.237 1.420 10 10 EDCE C[C@H](C[S@@](C)=O)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588432054 MGMHKIWUGILBMZ-BWEWRYSISA-N 336.457 1.420 10 10 EDCE CCOc1ccncc1S(=O)(=O)NCc1ccc(OC)cc1O 831348269 YLWQQHWLCYJYNQ-UHFFFAOYSA-N 338.385 1.673 10 10 EDCE Nc1ccc(CCNC(=O)N2CCn3c(CC4CC4)nnc3C2)cc1 846171290 FPSVKEMWBQHOAD-UHFFFAOYSA-N 340.431 1.581 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CNCCC2(F)F)c1 842003660 ODLLYNHBTWCSGO-TVQRCGJNSA-N 329.347 1.758 10 10 EDCE CCn1nnc(CN(C)c2ccc(CO)cc2Br)n1 1893002450 FLLLBYQBMALMRJ-UHFFFAOYSA-N 326.198 1.584 10 10 EDCE COC1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 843534474 LRNHBZVMPZIJNO-CQSZACIVSA-N 331.416 1.184 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)c3nncn3C)C2)cc1 849224940 MJKZWRJYKYTWTC-STQMWFEESA-N 344.419 1.463 10 10 EDCE NC(=O)[C@H]1C[C@@H](NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 846046986 RGOBJAMSABBPJP-OKILXGFUSA-N 332.404 1.939 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC2C[C@@H]3C[C@H]3C2)c1 853893056 HJNIKDRNZCAMEM-GHMZBOCLSA-N 325.386 1.967 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C3CCN(C(C)=O)CC3)C2)cc1 855230373 VUMGMWWSMAGKPO-INIZCTEOSA-N 345.443 1.649 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N(C)CC3CN(C)C3)C2)cc1 852386263 AKQDLJYQRKWJGS-OAHLLOKOSA-N 346.475 1.725 10 10 EDCE Cc1cc(CC(=O)N2CC(=O)N(C)C(=O)C2)c(C)n1-c1ccccc1 854382253 VZADVCWVDGPCLJ-UHFFFAOYSA-N 339.395 1.464 10 10 EDCE CN1C[C@@H](CCNCc2ccc(N3CCC(O)CC3)cc2)CC1=O 922483827 BLYYQZOGWFWKHG-INIZCTEOSA-N 331.460 1.606 10 10 EDCE C[C@H]1[C@H](NC(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCN1C 924009667 YFPOLBQASUQTCP-MAUKXSAKSA-N 345.491 1.330 10 10 EDCE Cn1nnc2c1C[C@H](NCc1c(O)cccc1Br)CC2 922991058 DVMAUIBCRQZZGY-SECBINFHSA-N 337.221 1.930 10 10 EDCE Cc1cc(O)c(CN[C@@H]2CCN(c3ccc4nncn4n3)C2)cc1C 858243897 QBFOZHFROYYFFR-OAHLLOKOSA-N 338.415 1.815 10 10 EDCE C[C@@]1(C(F)F)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 853997478 LBQQIBKCJQVWHL-AWEZNQCLSA-N 343.286 1.786 10 10 EDCE COc1ccc(O)c(CNC(=O)C(=O)Nc2c(C)nn(C)c2C)c1 754489295 QPKZJHALFDEBPP-UHFFFAOYSA-N 332.360 1.006 10 10 EDCE CC(C)[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 856124221 FMBYCDQASFYFJO-CQSZACIVSA-N 326.418 1.928 10 10 EDCE COC(=O)[C@H](C)NC(=O)[C@H](C)NC/C=C\c1ccc(N(C)C)cc1 865684782 JRWCOFGYONCMKQ-KFBXHMBNSA-N 333.432 1.422 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3C[C@@H]4COC[C@H]4O3)CC2)c(OC)c1 931531070 WSYJOYGVQIJTFQ-SIXWZSSISA-N 348.443 1.630 10 10 EDCE CN(C)c1ccc(CNC(=O)NCc2nnc(O)n2C2CC2)cc1 866060585 AGFINRSMMMCKOO-UHFFFAOYSA-N 330.392 1.384 10 10 EDCE O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CCCn1ccnn1 761353958 WDKVDYYYZNOMMN-UHFFFAOYSA-N 349.778 1.492 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCCC(N)=O)C1 774159772 YDXQMWIGGSEMQN-UHFFFAOYSA-N 343.427 1.826 10 10 EDCE C[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H]1F 778468274 LWPRSRRVXPAJAH-SKDRFNHKSA-N 330.381 1.584 10 10 EDCE O=S(=O)(Cc1ccon1)NCc1cc(Br)ccc1O 796191639 YRQJHKLJCQTBBF-UHFFFAOYSA-N 347.190 1.762 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1C[C@@H](C)CO1 1153664231 RRWCAGBHKUYPFA-IFUGULHKSA-N 337.372 1.113 10 10 EDCE CCCCN1CC[C@@](O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1325161816 QHVCPFISOQQWPA-QGZVFWFLSA-N 347.419 1.816 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCCC[C@@H]2CNCCO)cc1 1275816956 OHSKDNHXUFHAKM-HIFRSBDPSA-N 347.419 1.720 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)CCc2nc[nH]n2)cc1C 1282112698 MVQBPTFFGACIDM-KBPBESRZSA-N 345.447 1.737 10 10 EDCE O=C(NCc1nnc2n1CCOC2)c1cc2cc(O)c(O)cc2s1 1448798268 RADPOZVSWKFLIC-UHFFFAOYSA-N 346.368 1.364 10 10 EDCE O=C(Cn1ncc2ccccc2c1=O)NCc1c(O)cccc1F 1471974823 LFJIUFWUKXFDQE-UHFFFAOYSA-N 327.315 1.558 10 10 EDCE OC[C@@H]1[C@H](O)[C@@H](O)[C@@H](Cc2ccccc2)N1Cc1cccc(F)c1O 1615122253 XSTAAKMGAKPZQP-FPAYPSAMSA-N 347.386 1.041 10 10 EDCE COc1ccc(-n2nnnc2CN(C)CCNC(=O)CC(C)C)cc1 1714530740 KSWVHICTPIQNTG-UHFFFAOYSA-N 346.435 1.265 10 10 EDCE O=C(O)[C@H]1C[C@H](O)CN1Cc1cc(Br)cc(F)c1O 2136131635 ZOEAPSTTXULBJW-WCBMZHEXSA-N 334.141 1.314 10 10 EDCE CN1C(=O)c2ccc(C(=O)NCc3cccc(O)c3O)cc2C1=O 1633506844 BNTRMHZPCVSIBC-UHFFFAOYSA-N 326.308 1.254 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccc(-n2cncn2)n1 1556515882 QJEDHLNIPMCLAK-UHFFFAOYSA-N 344.371 1.784 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(CCO)C3CC3)c(Br)cc21 118712112 SYLXNCYCRAAOLP-CYBMUJFWSA-N 340.221 1.623 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)Cn1cccn1 1568725636 YYIWFPMXWDPESA-UHFFFAOYSA-N 330.432 1.838 10 10 EDCE CN(C)C(=O)[C@@H]1CCCN1c1ccc(CN)c(Br)c1 228148265 JNZKSJUMIPHJBJ-ZDUSSCGKSA-N 326.238 1.965 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)CN2CCCC2=O)cc1C 1725086532 ZWXQGMQOCGSCSH-LSDHHAIUSA-N 347.459 1.609 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cncn3C)CC2)cc1C 1499279016 QRLRPAFGLKQTCZ-UHFFFAOYSA-N 328.416 1.789 10 10 EDCE CC(C)(C)NC(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1633281023 BQKNOZRKVNYTNG-UHFFFAOYSA-N 335.404 1.293 10 10 EDCE Cc1cn(C2CCOCC2)nc1C(=O)NCc1c(O)cccc1O 1597573745 FHRWGUKDNNQBGA-UHFFFAOYSA-N 331.372 1.884 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H]2CCN(C)C2=O)cc1C 1691437890 UPIOCCUXMJRRID-HNNXBMFYSA-N 333.432 1.030 10 10 EDCE COCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)C(C(=O)OC)=C1C 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2010390912 JZMYHZCLIAGTAX-LLVKDONJSA-N 340.428 1.648 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)NCC2(CN=[N+]=[N-])CC2)C1 2010391459 QZRIYZWRSZZAEK-UHFFFAOYSA-N 339.396 1.565 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@H]2OCC[C@H]2N1C(=O)OC(C)(C)C 2010389789 UZGBZLKKBLXWIH-GRYCIOLGSA-N 339.396 1.922 10 10 EDCE C[C@@H]1CN(C)C[C@H](CNCc2ccc(Br)cc2O)O1 691446760 TVXMTENNLQCIFI-MFKMUULPSA-N 329.238 1.963 10 10 EDCE CN[C@@H](C)c1ccc(N2CC3(CNC(=O)N3)C2)c(Br)c1 2177691222 HOYWSLRNQIOMGW-VIFPVBQESA-N 339.237 1.601 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@]3(CNC(=O)N3)C2)cc1Br 2177695658 ITZZJVXUYAJKEU-XPTSAGLGSA-N 339.237 1.731 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@]2(C)C[C@@]2(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 1906905617 DHZQSCRNAJDHRA-RHMWETHNSA-N 336.432 1.899 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3CCOC[C@H]3C2)c(Br)c1 2185896130 LIEOMHVDZLMSQC-DGCLKSJQSA-N 340.265 1.990 10 10 EDCE O=C(O)[C@H]1CCC2(CN(Cc3c(O)cccc3Br)C2)O1 2205354589 FLEPKBRSFGTSST-GFCCVEGCSA-N 342.189 1.973 10 10 EDCE CSc1ncc(CNCCOC2CCS(=O)(=O)CC2)s1 2208804991 OQFQZTUMYLFJKL-UHFFFAOYSA-N 336.504 1.548 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cncc(CN)c2)s1 2284690343 QITYXRGVUTYCIS-UHFFFAOYSA-N 330.460 1.197 10 10 EDCE CCn1cc(C=Cc2nc3c(c(=O)n(CC)c(=O)n3CC)n2C)cn1 2297719130 FSCFWYAAOQFYDJ-UHFFFAOYSA-N 342.403 1.323 10 10 EDCE OCc1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2332590013 GCMYFCKATAJJFG-XAGKMFGPSA-N 328.206 1.262 10 10 EDCE O=C1Nc2cc(N3CCOC[C@@H](F)C3)c(Br)cc2[C@H]1O 2361814276 FQXGJJYELLICBP-JVXZTZIISA-N 345.168 1.609 10 10 EDCE CC(=O)N1CSC[C@H]1C(=O)NCc1c(O)ccc2c1CCCC2 174513117 XIHPZNGKBKVOEI-HNNXBMFYSA-N 334.441 1.809 10 10 EDCE Cc1ccn2ncc(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)c2n1 186387321 UBDVQTMBJJLVRZ-NSHDSACASA-N 326.356 1.810 10 10 EDCE N[C@@H](c1ccc(I)cc1O)C(F)(F)CO 95782909 PKNYDMYPUBUXEF-QMMMGPOBSA-N 329.084 1.624 10 10 EDCE Cn1cc(/C=C\C(=O)N2CC3(CC3)c3ccccc32)c(=O)n(C)c1=O 255166353 WXYZPAOSOMVXCL-FPLPWBNLSA-N 337.379 1.176 10 10 EDCE CS(=O)(=O)N1CCC[C@@H]1CNCc1cc(Cl)c(F)cc1O 293583251 JWDJNNWVSPEWFQ-SNVBAGLBSA-N 336.816 1.698 10 10 EDCE CN(C[C@H]1C[C@@H](O)C1)c1cc2c(cc1Br)[C@H](O)C(=O)N2 703793088 BINBDGPTCDVRPC-DAROEXNTSA-N 341.205 1.642 10 10 EDCE CSc1cccc(N2C[C@@H](C(=O)OCC(=O)C(C)=O)CC2=O)c1 808494391 NNWUZCIWDGNYNS-NSHDSACASA-N 335.381 1.463 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4COC[C@@H]43)c(Br)cc2[C@@H]1O 2129728735 YAFQWYLZJLKUJW-LNCSFIOASA-N 325.162 1.270 10 10 EDCE C[C@@H](NC(=O)c1cn([C@@H]2CC[C@H]2O)nn1)c1ccc(N(C)C)cc1 907494228 WPBMROLRGUOAJJ-HFBAOOFYSA-N 329.404 1.531 10 10 EDCE Nc1ccc(CCNC(=O)N2CCC[C@@H](C(=O)N3CCCC3)C2)cc1 841953653 BDWCNTMKNFTTDX-MRXNPFEDSA-N 344.459 1.855 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCO[C@@H]([C@@H](C)O)C2)cc1 840263421 QLIBOAOXJKWKRS-RHSMWYFYSA-N 335.448 1.824 10 10 EDCE CCO[C@@H](CN(C)C)CN1C(=O)CN(Cc2ccccc2O)C1=O 925236616 QLPLFUDNVQRNDO-AWEZNQCLSA-N 335.404 1.123 10 10 EDCE CCOc1ccc(O)c(CN[C@@H]2CCCC[C@H]2NS(C)(=O)=O)c1 858252445 HYXVQJAYOKDEEL-HUUCEWRRSA-N 342.461 1.741 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@H]3C[C@@H](O)C34CCC4)nc12 852584962 VMHMULZEADIWFO-QWHCGFSZSA-N 346.387 1.005 10 10 EDCE CCN1CCN(Cc2c(O)c(C(=O)OC)cc3ccccc23)CC1=O 758278793 WTNHDGQOQSICRN-UHFFFAOYSA-N 342.395 1.996 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NOC3CCOCC3)C2)cc1 852257517 SMMOVPBILONOSU-ZDUSSCGKSA-N 335.404 1.684 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc(N)cc3O)C2)cc1 852843539 AMMRSKMXQUAERJ-ZDUSSCGKSA-N 327.384 1.992 10 10 EDCE COCn1nc(C)c(S(=O)(=O)N2Cc3cccc(O)c3C2)c1C 867690741 LPEYBUSMTBKEKB-UHFFFAOYSA-N 337.401 1.514 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc(O)cs2)[C@H](O)C1 871181307 PANOLDXOFCSCGL-WDEREUQCSA-N 342.417 1.554 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCC34CC(CN3)C4)C2)cc1 870952716 WRGHBCSBGAKGTL-XAUUPUKJSA-N 329.444 1.922 10 10 EDCE C[C@H](NC(=O)CN1C(=O)NC(C)(C)C1=O)c1ccc(N(C)C)cc1 773016166 RDUYDGJAZGPYSD-NSHDSACASA-N 332.404 1.260 10 10 EDCE COC(=O)/C=C\c1ccc(N(CC(N)=O)CC(C)C)c([N+](=O)[O-])c1 771234311 IMHBJPVANZXRDG-ALCCZGGFSA-N 335.360 1.729 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H](C)NC(C)=O)cc1C 1317385359 GCYPSNGUOCKECA-ZIAGYGMSSA-N 335.448 1.513 10 10 EDCE Cn1nc(Br)cc1C(=O)NCc1cc(O)ccc1O 1176755043 LEKAJWNGFAJKEK-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE CN(c1ccc(CN)c(Br)c1F)C1COCCOC1 2131497516 CIWYNYBKCXHIJZ-UHFFFAOYSA-N 333.201 1.899 10 10 EDCE CN(C)c1ccc(CNC(=O)/C=C/c2ccc(C(N)=O)o2)cc1F 1434915210 PAVAUYCDFFVIOD-VMPITWQZSA-N 331.347 1.913 10 10 EDCE NC(=O)CCNC(=O)c1ccc(NC(=O)c2cc(O)cs2)cc1 1468507544 RROZIXVFZLWIFD-UHFFFAOYSA-N 333.369 1.311 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Cn1c(O)nnc1O 1544884619 MCPKTMIEMORWCT-UHFFFAOYSA-N 333.392 1.193 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(O)(Cc2ccncc2)CC1 1556443702 LBMFWIWYJFMFKD-UHFFFAOYSA-N 342.395 1.632 10 10 EDCE Cc1nc(SCC(=O)NCc2ccc3cccnc3c2O)n[nH]1 1630533012 QWQZWVCMJKZVTK-UHFFFAOYSA-N 329.385 1.775 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(N[C@@H]3CCOC3)C2)c([N+](=O)[O-])c1 1640465323 SXDXBCMVQXHOPA-MASHWEEQSA-N 347.371 1.348 10 10 EDCE O=C(C[C@H]1C(=O)Nc2c(F)cccc21)NCc1cccc(O)c1O 1644710421 ACWHZAOMRHDLRK-LLVKDONJSA-N 330.315 1.979 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CCN(Cc2ccccc2)C1=O 1644757132 VIFZNAGUVUPOGR-INIZCTEOSA-N 340.379 1.763 10 10 EDCE CC[C@H](F)C(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1584302593 XUQYBFBIZQBADD-CABZTGNLSA-N 337.355 1.832 10 10 EDCE COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1597633838 BTFVHHDFVLNWGN-CHWSQXEVSA-N 348.359 1.642 10 10 EDCE NC(=O)CC[C@@H](N)C(=O)Nc1ccc(Oc2ccc(N)cc2)cc1 1866105417 IXBIEPDURKJABN-OAHLLOKOSA-N 328.372 1.592 10 10 EDCE Nc1ccc(-n2nnc(C(=O)Nc3ccc(F)c(F)c3F)n2)cc1 1857878577 IKILHZCIQCBJHJ-UHFFFAOYSA-N 334.261 1.914 10 10 EDCE CN(C)c1ccc(CNCC(=O)N(CCO)Cc2ccccc2)cc1 1857865401 KPILUINTKHKRLK-UHFFFAOYSA-N 341.455 1.863 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@@H](F)C1 2003169252 ZKSAWULPGCREOK-LPWJVIDDSA-N 342.411 1.847 10 10 EDCE C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)NCCCN=[N+]=[N-] 1985101618 VFWBUDCFYLJWKC-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@]1(C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010398873 WVAYHOOGPUIJKO-UEKVPHQBSA-N 339.396 1.827 10 10 EDCE CNC(=O)CN(Cc1ccccc1)C(=O)[C@@H]1CNc2ccccc2N1 2034789886 HLOMDGCHCWUCKZ-KRWDZBQOSA-N 338.411 1.667 10 10 EDCE NCc1cc(F)c(N2CCN3C(=O)NC[C@@H]3C2)cc1Br 312250910 JABUWROVGYMGSN-SECBINFHSA-N 343.200 1.261 10 10 EDCE CN1CCO[C@H](CN(C)c2ccc(CN)cc2Br)C1 707817296 QHZCUBRVSPKBJL-LBPRGKRZSA-N 328.254 1.675 10 10 EDCE COc1ccc(Br)c(CNCCc2cc(O)n[nH]2)c1O 2236049332 PHYVBZFTDXWUHG-UHFFFAOYSA-N 342.193 1.924 10 10 EDCE CSCC[C@@H](NC(=O)NCc1cnc(SC)s1)C(=O)O 2284505841 ZNAHFFAYHOJURM-MRVPVSSYSA-N 335.476 1.871 10 10 EDCE O=C(O)CN(Cc1ccc(Br)cc1O)[C@@H]1CCOC1 2272419894 YEZUSKQNVOYXFB-LLVKDONJSA-N 330.178 1.830 10 10 EDCE Cc1ccc(C=C2C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)cc1 2297345892 LCXBOSVGVRPBKX-UHFFFAOYSA-N 348.409 1.616 10 10 EDCE CCOC(=O)c1ccccc1NC=C1C(=O)NC(=S)N(CC)C1=O 2297365916 IJBUSXYXWPHECU-UHFFFAOYSA-N 347.396 1.422 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 2300531662 JXUIITXOIOPAKX-RYUDHWBXSA-N 341.412 1.763 10 10 EDCE CN(C)CCNC(=O)CN1C(=O)/C(=C\c2ccco2)SC1=S 102428429 MGKHCBUFLKYIDD-DHZHZOJOSA-N 339.442 1.159 10 10 EDCE CN(CC(=O)NC1CCN(C2CC2)CC1)c1ccc2c(c1)OCO2 121274523 QKNDRJNTCGHUMY-UHFFFAOYSA-N 331.416 1.595 10 10 EDCE CCCn1nnnc1CN(Cc1ccccc1O)C[C@@H]1CCCO1 70976540 XMJXKESZFOLSHW-HNNXBMFYSA-N 331.420 1.970 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1F 191709912 LNBUQLYDVQCGQP-UKPHBRMFSA-N 349.406 1.986 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C[C@@H]2CCOC2)nn1 528995924 JORSXBPXMURKFF-YPMHNXCESA-N 346.387 1.087 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@]2(N)CCOC2)c(O)c1Br 2381129211 GWGPQHDKRXEHNX-CQSZACIVSA-N 343.221 1.539 10 10 EDCE Cc1ccccc1-n1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)nn1 806568886 DFGNJVGEEOZQGJ-UHFFFAOYSA-N 325.328 1.010 10 10 EDCE C[C@@H](Cn1cncn1)NC(=O)NCc1ccc(N2CCCC2)cc1 299622586 JRWOQZJHGWWROD-AWEZNQCLSA-N 328.420 1.766 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1cnc(O)s1 649613107 DUTXZWWVDKMHGP-UHFFFAOYSA-N 341.414 1.502 10 10 EDCE CO[C@@]1(CN[C@@H](C)c2cc(Cl)ccc2O)CCS(=O)(=O)C1 903365809 QLFKMZPFWFQJTF-IINYFYTJSA-N 333.837 1.900 10 10 EDCE O=C(C[C@@H](O)C(Cl)(Cl)Cl)NCc1ccc(O)c(O)c1 907061997 ZPLWQKMPSSSFDF-SECBINFHSA-N 328.579 1.835 10 10 EDCE C[C@H](NC(=O)NCc1c(O)cccc1F)[C@@H](C)N1CCOCC1 917015210 FYLXOUIZISTZSY-NWDGAFQWSA-N 325.384 1.440 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCC[C@H]1CCCN1 842240533 QZZSSPFWUSZLDV-OAHLLOKOSA-N 333.432 1.389 10 10 EDCE COC(=O)[C@@H](NCc1c(O)ccc(Cl)c1F)c1ccnn1C 843430291 SOFHSKRPGVPBDE-ZDUSSCGKSA-N 327.743 1.922 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](OC)[C@@H]3CCOC3)C2)cc1 855227267 WWHUQKVFOCAYTO-JKIFEVAISA-N 334.416 1.442 10 10 EDCE CC(C)(C)OC(=O)[C@]12COC[C@H]1CN(C(=O)c1cccc(O)c1O)C2 855632126 HUQCPIMSWSUZQY-ADLMAVQZSA-N 349.383 1.528 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1OCC[C@@H]1NC(=O)OC(C)(C)C 1895875493 KCGGINABBAAJLT-WDEREUQCSA-N 327.385 1.827 10 10 EDCE CNC(=O)C(C)(C)CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852221278 ULUMPGDHWGAWSM-CYBMUJFWSA-N 348.447 1.345 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)N[C@@H]2CCc3nnn(C)c3C2)c1 927145928 MCQRCPBOIPXKBL-ZYHUDNBSSA-N 330.388 1.515 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCCNCC3)C2)cc1 851663776 IPFAHHOTUMGCSN-LSDHHAIUSA-N 332.448 1.715 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](C)CCCO)C2)cc1 854297022 IITZUKVZGVMGLJ-LSDHHAIUSA-N 335.448 1.982 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CN3CCSC3=O)C2)cc1 855229290 MDLMAGKWVKKZER-LBPRGKRZSA-N 335.429 1.559 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc(C(N)=O)o3)C2)cc1 855233903 OVARSVGCALJXFB-NSHDSACASA-N 329.356 1.396 10 10 EDCE C[C@@H](CF)NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 852355709 YQJGYKMMJUJEIH-LBPRGKRZSA-N 343.424 1.079 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2nn(C)cc2C)c1 850366391 XMQKJCJORXSIGX-JTQLQIEISA-N 332.360 1.259 10 10 EDCE O[C@@H](CNCc1ccc(N2CC=CC2)cc1)CC1(O)CCOCC1 872203959 GWGYLPRJCFNYQL-GOSISDBHSA-N 332.444 1.445 10 10 EDCE Cc1nn(C)c(C)c1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773849295 YLBAFYHXKAPZQO-NSHDSACASA-N 343.431 1.919 10 10 EDCE COC(=O)c1c(CN2CC[C@@H](NC(C)=O)C2)c2cc(F)ccc2n1C 895035087 WVDOFGBUDXWUBU-CYBMUJFWSA-N 347.390 1.814 10 10 EDCE CCOCc1cc(CNC2(C(=O)NC)CCOCC2)ccc1OC 895883784 IAQFYKLUWOWEHJ-UHFFFAOYSA-N 336.432 1.617 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C2CN([C@@H]3CCOC3)C2)cc1 895779967 XKBPZDANBDOFBK-GOSISDBHSA-N 331.460 1.870 10 10 EDCE O=S1(=O)C=C[C@@H](NCc2cc(Br)cc(F)c2O)C1 715757164 DSMSSMYFFFVGOR-SECBINFHSA-N 336.182 1.694 10 10 EDCE C[C@@H](O)c1ccc(N2CCC(CO)(CO)C2)c(Br)c1 694630823 WOWKMGXGHDEJAZ-SNVBAGLBSA-N 330.222 1.684 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccn(CCn2cccn2)n1 1304053593 OXLMOVQSBRQKQK-UHFFFAOYSA-N 327.344 1.121 10 10 EDCE CCCC(=O)N[C@H]1C[C@H](NCc2nnnn2-c2ccc(OC)cc2)C1 1317071556 HKRIXRWJWFNYCK-JOCQHMNTSA-N 344.419 1.208 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@H]2CCNC2=O)C2CC2)cc1C 1317023757 CALGNDWSVIJJAV-JKSUJKDBSA-N 345.443 1.124 10 10 EDCE O=C(O)C[C@@H]1CN(Cc2ccc(Br)cc2O)C[C@@H]1O 2117729042 UDBJVQJDYGTALO-SKDRFNHKSA-N 330.178 1.422 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc(Cl)ccc1-n1cnnn1 1176748052 INWQGSAVUCFUPO-UHFFFAOYSA-N 345.746 1.657 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3NC(=O)O[C@@H]3C2)cc1Br 2120414226 ZOGPUTWRBWEXIK-GXSJLCMTSA-N 330.157 1.344 10 10 EDCE COC(C)(C)[C@@H](C)NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1334617444 SIQUNBYSZRXPNT-LLVKDONJSA-N 339.411 1.438 10 10 EDCE O=C(C(=O)N1CCC[C@@H]1c1ccc[nH]1)N1Cc2cccc(O)c2C1 1332001971 XHZZRPAEZPHYEU-OAHLLOKOSA-N 325.368 1.926 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CNC(=O)c1ccc(Br)o1 1912157573 ROZZEARCSPVYIF-UHFFFAOYSA-N 330.142 1.541 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CN[C@@H]2CCc3cccc(O)c32)C1 1918657238 GZWAFUNJQYXJPE-CYBMUJFWSA-N 334.416 1.951 10 10 EDCE C[C@H]1CN(C(=O)CN2CCOc3cc(N(C)C)ccc32)CC(C)(C)O1 1616891484 DPVFSGNRAATKHU-AWEZNQCLSA-N 347.459 1.977 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1Cc1nncn1C 1709039088 VQWBBHZHFLVKCC-UHFFFAOYSA-N 327.392 1.359 10 10 EDCE C[C@@H](C(=O)NCc1c(O)cccc1O)n1nnc(-c2ccccc2)n1 1635846784 BFFCGGKYBHZARK-NSHDSACASA-N 339.355 1.629 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cncnc2O)cc1C 1569062952 FUJFBGOLVTUYFJ-LBPRGKRZSA-N 330.388 1.407 10 10 EDCE Cn1ccnc1[C@@H](O)C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1566629389 AMHUORXGDJPRTA-KRWDZBQOSA-N 345.399 1.346 10 10 EDCE CS(=O)(=O)C1CCC(C(=O)NCc2ccc(O)cc2O)CC1 1643103951 JYJLMBOUCYIZAN-UHFFFAOYSA-N 327.402 1.317 10 10 EDCE COCCC(=O)N(C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1738787520 PWJOCSDXMDTHRR-NSHDSACASA-N 349.391 1.462 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2c[nH]cc2C)cc1C 1571446545 HFSSRWHUOXENIU-HNNXBMFYSA-N 331.416 1.521 10 10 EDCE COc1ccc(CNCCC[C@H](C)NC(=O)c2ncn(C)n2)cc1C 1571249526 BEDSKJZGVDCNRT-AWEZNQCLSA-N 345.447 1.820 10 10 EDCE O=C1Cc2c(C(=O)NCc3ccc4cccnc4c3O)ccnc2N1 1570533711 NNSNWERYSDDRRQ-UHFFFAOYSA-N 334.335 1.760 10 10 EDCE Cc1ccccc1[C@@H](CC(=O)NCc1cc(O)ccc1O)NC(N)=O 1651222554 JQFYLVSRCMNRHL-OAHLLOKOSA-N 343.383 1.822 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2C[C@H](O)CC3(CCOCC3)C2)cc1 1650841239 SZKUUJXRAQSVFX-CQSZACIVSA-N 346.387 1.853 10 10 EDCE C[C@@H]1C[C@H]1C(=O)NCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1689603989 ORVLKUVYTPLFMA-ZWNOBZJWSA-N 343.387 1.884 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2140663741 PIEOMJKLILKFAE-VFFVRTRHSA-N 334.185 1.382 10 10 EDCE O=C(NCCCSc1nccs1)N[C@H]1CCc2ncnn2C1 153769258 GHKFYJRJZAVHIB-JTQLQIEISA-N 338.462 1.531 10 10 EDCE CCOC(=O)c1c(NC(=O)C[C@H](N)C(=O)O)sc2c1CCC2 1865999359 LLFWHJIFDLSHCD-QMMMGPOBSA-N 326.374 1.154 10 10 EDCE CNCc1ccc(N2CCC[C@H]2C(=O)NC)cc1Br 234444656 YUVZUIGFFBIUPI-ZDUSSCGKSA-N 326.238 1.883 10 10 EDCE COc1ccc(CNCC2(NC(=O)OC(C)(C)C)COC2)c(O)c1 1946134821 DCTLNYTXLONFBM-UHFFFAOYSA-N 338.404 1.784 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 2010390081 YNJDVLJQEZUCLO-LBPRGKRZSA-N 340.428 1.743 10 10 EDCE CNCc1ccc(N2C[C@H](OC)C[C@H]2CO)c(Br)c1 311562621 SIZMUZWGFVLLKQ-NWDGAFQWSA-N 329.238 1.755 10 10 EDCE NCc1ccc(N2CC[C@H](O)[C@@H](CO)C2)c(F)c1Br 396912546 DPGUAWPFHGETLW-KOLCDFICSA-N 333.201 1.226 10 10 EDCE CN1CCc2cc([C@H](NN)c3cn(C)nc3Br)ccc21 2173188902 IGCAJDDXXIUCCH-ZDUSSCGKSA-N 336.237 1.728 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H](C(F)F)n3cccn3)c2n1 2062433925 BQVVLLRHBMWLIE-SNVBAGLBSA-N 336.302 1.176 10 10 EDCE COC[C@@H]1C=CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2182373218 VLOKENVYGGASQC-ISVAXAHUSA-N 338.205 1.792 10 10 EDCE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CCN1C(=O)Cc1ccc(N)cc1 2044626471 IAFOGSREPLOJQL-GXFFZTMASA-N 343.349 1.869 10 10 EDCE NCc1ccc(N2CC[C@@H]3CS(=O)(=O)C[C@H]32)c(Br)c1 2094931694 VAWVXERABSFYFM-ZWNOBZJWSA-N 345.262 1.531 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H](O)C[C@H]2C(=O)O)c1O 2236037598 KGZILEOEGMVBFG-XVKPBYJWSA-N 346.177 1.183 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2COCC[C@@H]2O)c1O 2227749935 HSFXWSGFNVELHY-MNOVXSKESA-N 332.194 1.403 10 10 EDCE CNCc1coc(S(=O)(=O)NCc2cnc(SC)s2)c1 2284691981 UPODAYHTRBDULC-UHFFFAOYSA-N 333.460 1.656 10 10 EDCE CC(C)(C)OC(=O)N[C@]12CO[C@](C(=O)N3CC[C@@H](N=[N+]=[N-])C3)(C1)C2 2247299951 INNZOSNFTXAMQS-VCTAVGKDSA-N 337.380 1.724 10 10 EDCE C[C@@H]1OC2(C(=O)N3CC(N=[N+]=[N-])C3)CC1(NC(=O)OC(C)(C)C)C2 2247287145 NDESMWLGXVEBAX-RAXBXGLRSA-N 337.380 1.722 10 10 EDCE NC(=O)COc1ccc(C=C2C(=O)NN(c3ccccc3)C2=O)cc1 2293894408 JXJOZZMFSOASLO-UHFFFAOYSA-N 337.335 1.012 10 10 EDCE C[C@H]1CCNC(=O)[C@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2312521849 YVOGZCLSYUOYKV-KSSFIOAISA-N 343.427 1.177 10 10 EDCE CONCc1cn(Cc2ccc(C)c(Br)c2O)nn1 2352948734 TVRCNCMTJCXGJS-UHFFFAOYSA-N 327.182 1.754 10 10 EDCE COc1cccc(CNC(=O)NCc2ccnc(N(C)C)c2)c1O 73656163 NBPJPRCKVAKKLX-UHFFFAOYSA-N 330.388 1.861 10 10 EDCE COc1cc(/C=C2/SC(=S)N(CCO)C2=O)cc(OC)c1O 210386606 PUHHTUSEHMWIOZ-YRNVUSSQSA-N 341.410 1.603 10 10 EDCE CC[C@H](C(=O)OC)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 276751947 HTMIUYOBHARKMS-ZDUSSCGKSA-N 338.379 1.682 10 10 EDCE CN1C[C@H](NC(=O)NCc2cc(Br)ccc2O)CC1=O 805184958 YCYIIHYORMDKSJ-SNVBAGLBSA-N 342.193 1.185 10 10 EDCE O=C(NCc1cc(Br)ccc1O)[C@H](O)c1ccccn1 804739167 SXOQEUPOVGJFDC-CYBMUJFWSA-N 337.173 1.900 10 10 EDCE CN1C[C@H](C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)NC1=O 819978776 GRALFAINOUJZSR-MRXNPFEDSA-N 330.432 1.659 10 10 EDCE COc1ccc2c(c1)oc(=O)c(=O)n2OCCOc1ccc(N)cc1 821297815 XKEOWRHEYXUVAT-UHFFFAOYSA-N 344.323 1.053 10 10 EDCE CC[C@@H](NC[C@]1(OC)CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 903368285 MPQZFIYPJDGHSZ-IAGOWNOFSA-N 340.489 1.997 10 10 EDCE CC(C)N1CCC([C@@H]2C[C@@H]2CNC(=O)c2cc(O)nc(O)c2)CC1 585509668 ZPBATAGAJOBQTO-CABCVRRESA-N 333.432 1.979 10 10 EDCE Cc1cc(C(=O)CN2CCOC[C@@H](O)C2)c(C)n1-c1ccccc1 830623449 RGWJFQLLNLQYLE-KRWDZBQOSA-N 328.412 1.970 10 10 EDCE O=C(O)[C@@]12CCOC[C@@H]1CN(Cc1ccc(N3CCOCC3)cc1)C2 901951551 HVRRVSKXLIMPPL-QFBILLFUSA-N 346.427 1.446 10 10 EDCE CCC[C@H](CC)S(=O)(=O)Nc1ccc(NS(=O)(=O)NC)cc1 844660849 CTAPWBZKXVKOQE-ZDUSSCGKSA-N 349.478 1.883 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H]3CC[C@@H]3C(=O)O)CC2)cc1 911250792 ILYMWOKOQGQPQK-CVEARBPZSA-N 332.400 1.845 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2)cc1 841846694 SKSHLRJAGSVMCW-BGTYHANMSA-N 330.476 1.789 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)NC[C@@H]2CN(C3CC3)C(=O)O2)c1 848573039 XGYCVVHGHMNFJB-ZWNOBZJWSA-N 334.372 1.813 10 10 EDCE CC1CCN(c2ccc(CNC(=O)C[C@H](C)NC(N)=O)cc2)CC1 847473867 CLIAUKFBJYZFBZ-AWEZNQCLSA-N 332.448 1.986 10 10 EDCE C[C@@]1(CCNC(=O)C(=O)NCCc2ccc(N)cc2)C[C@]1(F)Cl 846345526 YHTDQRQIIANYQW-HZPDHXFCSA-N 341.814 1.748 10 10 EDCE C[C@]1(NCc2cccc(Br)c2O)CCS(=O)(=O)C1 44381306 SNPIEHDGOSPDQU-LBPRGKRZSA-N 334.235 1.822 10 10 EDCE Cc1cc(CC(=O)O[C@@H]2CCC(=O)NC2=O)c(C)n1-c1ccccc1 853935486 ZNUMWNPRKMEDGZ-MRXNPFEDSA-N 340.379 1.985 10 10 EDCE CN(C)c1ccc([C@H](N)CNS(=O)(=O)C[C@H]2CCC2(F)F)cc1 866756965 FAZVLEQJDTWKCE-TZMCWYRMSA-N 347.431 1.717 10 10 EDCE CC(C)(O)C[C@@H](O)CNCc1ccc(N2CCC(CO)CC2)cc1 872213505 QKYHEVHTVGHHDM-GOSISDBHSA-N 336.476 1.507 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(C(N)=O)nc3)C2)cc1 1118778257 SQTSKHVGWRXFAD-CYBMUJFWSA-N 340.383 1.198 10 10 EDCE CCN(C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)[C@H]1CCN(C)C1 1118690858 AWOLBRBIPSXRHW-PBHICJAKSA-N 346.475 1.482 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)NC(=O)c1ccccc1 773755559 DFPNQJSPNYSPEK-QWHCGFSZSA-N 342.395 1.964 10 10 EDCE O=C1Cc2cc(S(=O)(=O)Nc3ccc(O)c([N+](=O)[O-])c3)ccc2N1 775288129 KZDKUGHFBVMRTE-UHFFFAOYSA-N 349.324 1.596 10 10 EDCE C[C@@H](NC(=S)NCCN1CCOCC1)c1ccc(N(C)C)cc1 774250466 NKLKAMMCFQQHJL-CQSZACIVSA-N 336.505 1.610 10 10 EDCE O=C(/C=C/c1cncc(O)c1)NCc1ccc(N2CCOCC2)cc1 770487498 SVYDIKAOVDEEOM-ZZXKWVIFSA-N 339.395 1.953 10 10 EDCE C[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)[C@H]1CN(C)CCO1 897077987 RERMOLWXHPKUFC-NOZJJQNGSA-N 336.413 1.761 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC[C@]23CCCO3)cc1 897362012 YKISEJBOXAQFOY-APWZRJJASA-N 345.443 1.587 10 10 EDCE COC(=O)[C@H](CCF)NC(=O)c1cc2cc(O)c(O)cc2s1 898273477 ZDBMKCCQUJKGLV-QMMMGPOBSA-N 327.333 1.944 10 10 EDCE Cn1nc(C2CCOCC2)cc1C(=O)NCc1ccc(O)cc1O 1263842738 DFOJQVBYWGVZTB-UHFFFAOYSA-N 331.372 1.655 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1cn(CC)nn1 1268487567 FFHORBIKIKRGFT-UHFFFAOYSA-N 345.447 1.867 10 10 EDCE C[C@@H](CCNCC(=O)N(C)C)NC(=O)c1ccc(N=NC(N)=O)cc1 1273212453 LSEGQTSWOCUHRY-NSHDSACASA-N 348.407 1.035 10 10 EDCE O=C(O)c1cc(O)ccc1NC(=O)c1c[nH]nc1Br 2134188569 FXWGFEULWYDTLG-UHFFFAOYSA-N 326.106 1.828 10 10 EDCE CC(=O)N1C[C@@H](C(=O)NCc2c(O)cccc2O)Oc2ccccc21 1456233841 GDGJZQDHOQCOEA-KRWDZBQOSA-N 342.351 1.528 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCCN2CCOCC2)cc1 1540950143 QYIYHZOIGCXFFW-UHFFFAOYSA-N 333.392 1.691 10 10 EDCE COC(=O)[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CCOC1 1472399014 GMSLWJWRORUKSZ-AAEUAGOBSA-N 348.359 1.405 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@H]3CC[C@@H](O)C[C@H]3C2)cc1 1473641523 SGTFOGWRHKHUIU-SOLBZPMBSA-N 331.460 1.462 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)C2=COCCO2)C2CC2)cc1C 1483542374 FDQCBHCXCCLAEX-INIZCTEOSA-N 346.427 1.876 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CCNC2=O)cc1C 1715356782 QZBUBHGRDSMPJZ-ZFWWWQNUSA-N 333.432 1.076 10 10 EDCE CC(C)(C)OC(=O)[C@@]12COC[C@@H]1CN(C(=O)c1cccc(O)c1O)C2 1628939576 HUQCPIMSWSUZQY-VOJFVSQTSA-N 349.383 1.528 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H]2CCNC2=O)cc1C 1715356780 QZBUBHGRDSMPJZ-UKRRQHHQSA-N 333.432 1.076 10 10 EDCE CN1CCCc2cc(CNC(=O)[C@@H]3CCCn4ncnc43)ccc21 1631322309 HXRCMOPSJZBVHY-OAHLLOKOSA-N 325.416 1.854 10 10 EDCE CC(=O)c1ccc(S(=O)(=O)NCc2ccc(O)cc2O)cc1F 1561670612 MZXSINYBPSKWRU-UHFFFAOYSA-N 339.344 1.918 10 10 EDCE C[C@H](O)[C@@H](NC(=O)C1CCCC1)C(=O)N[C@H](C)c1ccccc1O 1643738624 JVHGYUFJHDHRKR-BFQNTYOBSA-N 334.416 1.625 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2cc[n+]([O-])cc2)cc1C 1676300931 ZZKRAUWVNGIDHA-HNNXBMFYSA-N 343.427 1.887 10 10 EDCE CC(C)C(=O)NC/C=C/CNC(=O)c1ccc(N=NC(N)=O)cc1 1689231048 NHUJXLRAPFWHEI-XZFMURBMSA-N 331.376 1.907 10 10 EDCE CC(C)NCc1ccc(N2C[C@H](O)[C@H](O)C2)c(Br)c1 232652335 CMCAXCALWJFNAS-OKILXGFUSA-N 329.238 1.489 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cc2nnc(C)o2)cc1C 1699253781 XOWKZEDSYAPJJX-PLNGDYQASA-N 344.415 1.700 10 10 EDCE CCOCCN[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1690302018 SQDFZZSGJZZHIQ-HDJSIYSDSA-N 333.392 1.736 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)[C@@H]2CCCCN2)c2nccn2C)cc1 1866038882 GQJVTTYHKTWZBM-IRXDYDNUSA-N 341.459 1.834 10 10 EDCE C[C@]1(O)CCN(c2ccc(CN)c(Br)c2)C[C@@]1(C)O 1880698323 NJCWJGFKECSFJB-UONOGXRCSA-N 329.238 1.620 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NCc1ccc(F)cc1O 1994510840 JIEWDBPCDVOKMV-STQMWFEESA-N 326.368 1.913 10 10 EDCE Oc1ccc(F)cc1CN=c1[nH]ccnc1I 2008700067 SXMWVEFZIWMQAC-UHFFFAOYSA-N 345.115 1.960 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2010401204 BLFWICGNYLPVSO-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE NCc1ccc(N2CCC(CO)(CO)C2)c(F)c1Br 694688334 INNYYSJDRZWIDY-UHFFFAOYSA-N 333.201 1.228 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H](C)N(C)c3ccccc3)c2n1 2062165141 QAFVFERIVZDYGC-ZDUSSCGKSA-N 339.399 1.998 10 10 EDCE CCOC(=O)Cc1cc(O)n2nc(C3CCCC3)c(C(=O)OC)c2n1 2080924359 RPJRXQJBBCUJBU-UHFFFAOYSA-N 347.371 1.985 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)c(Br)c1 2190454891 WBKOJJOQHYHSTD-PFKCXJIQSA-N 342.233 1.965 10 10 EDCE CN(C)C[C@H]1COCCN1c1ccc(CO)c(Br)c1 2096926624 VLBRVCKPKJHFBP-ZDUSSCGKSA-N 329.238 1.708 10 10 EDCE COC[C@H]1CNCCN1Cc1c(Br)ccc(OC)c1O 2236052770 LOOZNXQZJHWCBR-SNVBAGLBSA-N 345.237 1.584 10 10 EDCE CC[C@@H](C)N1C(=O)C(=CNc2ccc(C(=O)O)cc2)C(=O)NC1=S 2296103135 QUAQHVLEEDCGSB-SECBINFHSA-N 347.396 1.722 10 10 EDCE CCOC(=O)CCCS(=O)(=O)NCc1cnc(SC)s1 2284543674 IILGEDXFOYKPFX-UHFFFAOYSA-N 338.476 1.628 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCCn1cccn1 2297575766 HKHSVBGLFKITIW-UHFFFAOYSA-N 326.400 1.549 10 10 EDCE COC[C@H](C(=O)O)N(C)Cc1ccc(C)c(Br)c1O 2352946716 BQLDEBUBWBCDAR-SNVBAGLBSA-N 332.194 1.995 10 10 EDCE CN[C@@H](c1ccccc1O)[C@H](O)c1nc(Br)cn1C 2353756843 LVYKZUCHJGXHAT-RYUDHWBXSA-N 326.194 1.882 10 10 EDCE CCOc1ccc(O)c(CN2CCN(C(=O)CN(CC)CC)CC2)c1 93046152 ALZTXMHQEAMZEB-UHFFFAOYSA-N 349.475 1.777 10 10 EDCE CN(CCn1cccn1)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255119564 UJNJTRQSULOSRG-YVMONPNESA-N 340.427 1.892 10 10 EDCE Cc1ccc(CN2CC[C@H](OCC(N)=O)C2)c(O)c1Br 2380760942 BQRRVWQDFKWZTD-NSHDSACASA-N 343.221 1.539 10 10 EDCE Cc1ccc(CNCCN2C[C@@H](C)NC2=O)c(O)c1Br 2380800302 HHQKKPMILWAHJG-SNVBAGLBSA-N 342.237 1.966 10 10 EDCE COC(=O)c1c(C)oc(C)c1S(=O)(=O)NCc1ccccc1O 290732453 LKCKHOCLIQMAJB-UHFFFAOYSA-N 339.369 1.867 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 808484358 BOVUEFHCPDACGM-MJBXVCDLSA-N 349.383 1.054 10 10 EDCE CC(C)(C)[N+](=O)/C=C1\C=CC(=S(=O)(O)O)C=C1S(=O)(=O)O 585662104 DRHPEMDVOOORBG-BQYQJAHWSA-O 338.383 1.192 10 10 EDCE CCCn1nccc1NC(=O)C(=O)N[C@H](C)c1cc(OC)ccc1O 746395687 MVYCXSPBXKEYKK-LLVKDONJSA-N 346.387 1.823 10 10 EDCE COc1ccc(N(C)CCN(C)C[C@@H](C)CS(C)(=O)=O)cc1 844402045 SJEQUAALBQZKCH-CQSZACIVSA-N 328.478 1.744 10 10 EDCE CN1CCCN=C1NCc1ccc(N2CCN(CC3CC3)CC2)cc1 849112592 XCUFLWTUJGOJTF-UHFFFAOYSA-N 341.503 2.000 10 10 EDCE COC(=O)[C@@H]1C[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)[C@H]2C[C@H]21 925435050 GYHHCVBIIOHNGH-RQJABVFESA-N 344.367 1.354 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@@H]3CCC(=O)NC3)C2)cc1 855222860 BMKURBYQXDSNKH-KBPBESRZSA-N 331.416 1.306 10 10 EDCE CCCNC(=O)CCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 851996930 FMSJEFQWLIUVGG-CQSZACIVSA-N 348.447 1.489 10 10 EDCE Cn1nc(I)cc1[C@@H](N)c1ccccc1O 1899677737 ZOZRUAPCOOYQTL-NSHDSACASA-N 329.141 1.778 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CS1(=O)=O 855699961 DLLRFQNTWXHNLL-STBQQDIQSA-N 325.386 1.193 10 10 EDCE COC[C@@]1(C)CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CCO1 858865671 LSTLJUYVRHKQRL-OAHLLOKOSA-N 326.349 1.854 10 10 EDCE CCc1nc(CNC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)n[nH]1 854094780 DZXVLLIOGDREAU-LBPRGKRZSA-N 344.419 1.454 10 10 EDCE C[C@H](NC(=O)c1cc(C=O)n(C)n1)c1ccc(N2CCOCC2)cc1 930745299 UYJXDHMJMNKSOR-ZDUSSCGKSA-N 342.399 1.560 10 10 EDCE C[C@@H](NS(=O)(=O)C[C@H]1CN(C)CCO1)c1ccc(N(C)C)cc1 867126302 XACKATUTNXCVJR-CZUORRHYSA-N 341.477 1.064 10 10 EDCE COc1ccc(N2CCN(C(=O)NCc3ccn(C)n3)CC2)cc1F 765767524 RIRRPHSTYRGPBE-UHFFFAOYSA-N 347.394 1.600 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)Cn3cncc3C)C2)cc1 862034983 FQRANOWNLJOTNV-OAHLLOKOSA-N 328.416 1.843 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc(C(N)=O)nc3)C2)cc1 1118778258 SQTSKHVGWRXFAD-ZDUSSCGKSA-N 340.383 1.198 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CC[C@@H](N3CCN(C)CC3)CC2)c(O)c1O 1138625786 MTCDRKQDDIOTLH-GASCZTMLSA-N 347.459 1.695 10 10 EDCE NC(=O)[C@@H](CNC(=O)c1cccc(O)c1O)Cc1ccc(F)cc1 790574435 ASLWFFPFMKIDRV-LLVKDONJSA-N 332.331 1.311 10 10 EDCE COC(=O)[C@@H](CNC(=O)c1cccc(O)c1O)Cc1cccc(F)c1 790657428 GJMOCNMMPMFKIQ-GFCCVEGCSA-N 347.342 1.999 10 10 EDCE CO[C@@]1(C(=O)O)CCN(Cc2cc(Br)ccc2O)C1 703783247 NIULQZFHWWLMIN-ZDUSSCGKSA-N 330.178 1.830 10 10 EDCE CO[C@]1(C(=O)O)CCN(Cc2cc(Br)cc(F)c2O)C1 715793548 WNOLQGYIXSOBQM-CYBMUJFWSA-N 348.168 1.969 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1CCc2nnc(O)n2C1 1150385790 FLRWTINEGYZEKY-LBPRGKRZSA-N 342.399 1.447 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2ccnc3c2CC(=O)N3)c1 1150542514 BAFZTOCHICAQBD-VIFPVBQESA-N 327.340 1.781 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@H](O)C2(C)C)cc1Br 2124803261 UQYPIBXBGAZKHV-HJIKLVIJSA-N 330.222 1.823 10 10 EDCE NC(=O)[C@@H]1OCC[C@@H]1NCc1cc(Cl)cc(Br)c1O 2117460406 PTDBBSJRLXFHKN-GXSJLCMTSA-N 349.612 1.541 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@H](O)[C@@H](O)C2)c(Br)c1 2132138105 RCLJLIRMSQFASH-IIMNLJJBSA-N 329.238 1.661 10 10 EDCE O=C(CN1CCCCS1(=O)=O)Nc1c(Cl)ccc2nonc12 1271355756 FORXUHLHAJXVMQ-UHFFFAOYSA-N 344.780 1.240 10 10 EDCE COc1ccc(CNC2CC(N(C)C(=O)[C@@H](C)NC(C)=O)C2)cc1C 1486454563 VVXBIDRWZMZBML-NVPAJSRCSA-N 347.459 1.607 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C(C)(C)C(F)F)cc1C 1717777054 XEYCCONYVRURKD-CYBMUJFWSA-N 344.402 1.862 10 10 EDCE Cc1cc(C(=O)N[C@H]2C[C@H](O)[C@H](O)C2)c(C)n1-c1ccc(F)cc1 1558433703 CTKLIBYSYGIQAZ-FFGGFLGDSA-N 332.375 1.847 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CC(=O)N(Cc2ccccn2)C1 1558534150 OGTHIBGOJKLGPZ-LBPRGKRZSA-N 341.367 1.158 10 10 EDCE COC[C@H](C)N(C)[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1725199353 BMCBRBQCQWUWGM-NEPJUHHUSA-N 335.408 1.934 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCCOC 1632356481 PSOYBQJVEWYABP-ZDUSSCGKSA-N 339.388 1.505 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CN2CCCC2=O)cc1C 1566996377 MEMUOBRVXMLUIF-CQSZACIVSA-N 333.432 1.220 10 10 EDCE Cc1cccc(-n2c(C)cc(CNC(=O)Cn3nnc(N)n3)c2C)c1 1635326462 HPFYMNYYZPJSPY-UHFFFAOYSA-N 339.403 1.288 10 10 EDCE COc1cccc(CNC(=O)c2ccccc2Cn2ccnn2)c1O 1630366227 MNQXOIFVNFORBA-UHFFFAOYSA-N 338.367 1.971 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccns2)cc1C 1734368102 HREAUPCKBKWMSL-ZDUSSCGKSA-N 335.429 1.341 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@@H](NC(N)=O)C(C)C)cc1 1644438470 QLCPUZJTZJBAJB-HNNXBMFYSA-N 336.436 1.283 10 10 EDCE Cc1ccc(C(=O)NCCC(=O)NCc2ccc(O)cc2O)c(O)c1 1643104314 ULLZKRMHLSBLKN-UHFFFAOYSA-N 344.367 1.548 10 10 EDCE COc1ncc(/C=C/C(=O)N(C)c2ccc(C(F)(F)F)nn2)cn1 1586358811 TXTJGPCISAQFSN-ZZXKWVIFSA-N 339.277 1.970 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)CCc2cnn[nH]2)cc1C 1674729992 YMMCTXALCCQCNK-UONOGXRCSA-N 345.447 1.737 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3nnc(C4CC4)o3)CC2)cc1 1858105834 QCAKKCSPPQDUIC-UHFFFAOYSA-N 342.399 1.847 10 10 EDCE COc1cccc(/C=C2/SC(=S)N(CCOCCO)C2=O)c1 1858589217 KZFBNJSVSMHWIK-JLHYYAGUSA-N 339.438 1.905 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)cc1Br 2140663735 PIEOMJKLILKFAE-FFAVSVRISA-N 334.185 1.382 10 10 EDCE NCc1ccc(N2CC[C@H](OCCCO)C2)cc1Br 2142089584 OCKBLDYYFFIHLJ-ZDUSSCGKSA-N 329.238 1.886 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985099721 AWFFHYWPECTCTE-VWYCJHECSA-N 327.385 1.419 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N(C)CCN=[N+]=[N-] 1985095751 IXPVTFFKDAJOOV-MNOVXSKESA-N 327.385 1.637 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 1990359369 ZIBUOZVGOUSHLZ-KOLCDFICSA-N 325.369 1.580 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCN(CC(=O)Nc2ccc(N)cc2)C1 1999444511 ZMQGGNDVWANOOE-AWEZNQCLSA-N 334.420 1.806 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])CCOC1 2010405016 FAJOLXGOKIZGLI-IAQYHMDHSA-N 339.396 1.972 10 10 EDCE CC[C@H](CNC(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 2015121162 ARHQBMAAQXBDSQ-SNVBAGLBSA-N 340.376 1.837 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2018047560 QZRLADPADSZLBB-NEPJUHHUSA-N 341.412 1.954 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@H](O)CCNC(=O)OC(C)(C)C 2022899342 DOHRXDOGJGXXJQ-CQSZACIVSA-N 337.420 1.503 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@]1(C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2023001634 AQZBYZBNGLKYJL-XHDPSFHLSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)CNCc2ccc(N)cc2)CC1 2031662357 HHNLFENYBVCMNR-UHFFFAOYSA-N 348.447 1.438 10 10 EDCE Nc1ccc(CNC(=O)Cn2cc(Br)ccc2=O)cc1 701021998 HBHGDZRREXELMH-UHFFFAOYSA-N 336.189 1.509 10 10 EDCE C[C@@H]1CS(=O)(=O)C[C@H]1NCc1c(O)cccc1Br 711773107 DVSAMEXJULXEDY-LDYMZIIASA-N 334.235 1.677 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H]4C[C@]4(O)C3)c(Br)cc21 2171028047 NVBXZVQKHTYPSI-UEXBWHTRSA-N 338.205 1.362 10 10 EDCE COc1cccc(Cn2ncnc2I)c1O 2070051727 MBRLXYBPRMUDPI-UHFFFAOYSA-N 331.113 1.645 10 10 EDCE OCc1ccc(N2C[C@H](O)C3(CCOCC3)C2)c(Br)c1 2174374001 NFEQSEGQJWCTCS-AWEZNQCLSA-N 342.233 1.919 10 10 EDCE CCOC(=O)Cc1cc(O)n2nc(-c3ccccc3)c(C(=O)O)c2n1 2080924036 NXKZWSAQZHDXSO-UHFFFAOYSA-N 341.323 1.906 10 10 EDCE NCc1cc(F)c(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)cc1Br 2190458161 LVWQLBSDVLKOBE-LDZXTUBUSA-N 345.212 1.510 10 10 EDCE CN(Cc1nc(=NCc2cccc(O)c2O)[nH][nH]1)C(=O)OC(C)(C)C 2065556758 CWJRICWPUPDMIH-UHFFFAOYSA-N 349.391 1.617 10 10 EDCE O=C1Nc2cc(N3C[C@@H](O)C[C@@H](F)C3)c(Br)cc2[C@@H]1O 2234661196 VCWCNUUFELRVTG-LTMDPNIMSA-N 345.168 1.344 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CN(C)C[C@H]2OC)c1O 2236049221 NRZAESHJKVURRV-WCQYABFASA-N 345.237 1.582 10 10 EDCE OCc1ccc(N2C[C@@H]3OCCC[C@@]3(CO)C2)c(Br)c1 2238831451 XVWUCFWOTDZYBN-GJZGRUSLSA-N 342.233 1.919 10 10 EDCE CCCO[C@@H]1CS(=O)(=O)C[C@H]1NCc1cnc(SC)s1 2284638833 SCIDNCMKWMSRMM-GHMZBOCLSA-N 336.504 1.547 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](O)[C@H](O)CC2)cc1Br 2269122750 XQBVURCKCOKYLS-FZQKWOKYSA-N 330.222 1.824 10 10 EDCE CNC(=O)c1cccc(CCNC(=O)C=Cc2ccc(O)c(O)c2)c1 2307988006 XKTVNABUXXNCFM-UHFFFAOYSA-N 340.379 1.830 10 10 EDCE CNCc1ccc(N2CC3(COC(=O)N3)C2)c(Br)c1 2351872207 SGXRUPSNCJMEDV-UHFFFAOYSA-N 326.194 1.467 10 10 EDCE COc1ccc(N2C(=O)[C@@H](CN3CCOCC3)SC2=S)cc1 20248931 CCDXRTRLVLMHLO-CYBMUJFWSA-N 338.454 1.761 10 10 EDCE C[C@@H](NC[C@@H]1CN(C)CCO1)c1ccc(N2CCOCC2)c(F)c1 180500148 OIBRNDOXIJZJKV-GDBMZVCRSA-N 337.439 1.644 10 10 EDCE Cn1cnc(S(=O)(=O)Nc2ccc(O)cc2[N+](=O)[O-])c1Cl 38106170 VEUBVWVKMAQESD-UHFFFAOYSA-N 332.725 1.488 10 10 EDCE OCCOc1cncc(NCc2ccc(N3CCOCC3)cc2)n1 133225985 FYJJJKNMIMOSQW-UHFFFAOYSA-N 330.388 1.296 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CC2)cc1 220521839 LCIHVULWYPMCSE-CQSZACIVSA-N 340.427 1.872 10 10 EDCE CC1(OCC(=O)O)CN(Cc2cc(Br)ccc2O)C1 232809826 YONCBUHMOSVEHF-UHFFFAOYSA-N 330.178 1.830 10 10 EDCE Cc1cc(C(=O)N2CCN3CCOC[C@@H]3C2)c(C)n1-c1ccccn1 368322904 DTSRAUUBFNAQFK-INIZCTEOSA-N 340.427 1.646 10 10 EDCE CCO[C@H](CN)CC(=O)NCc1ccc(C)c(Br)c1O 2381136186 BQLHZJLUJMPZRI-NSHDSACASA-N 345.237 1.833 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC[C@@H](O)C(F)(F)F)cc2)C1 818967877 DMMKQLATHYASTF-GXTWGEPZSA-N 345.365 1.401 10 10 EDCE CC(=O)C(=O)COC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C 909829371 NHOYHHAYFFWAJZ-ZYHUDNBSSA-N 327.377 1.581 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1CN(C)CCN(C)C1 906428769 UQWZHIAPKFKCTQ-UHFFFAOYSA-N 332.492 1.595 10 10 EDCE CC(C)[C@H](NC(=O)c1ccccn1)C(=O)NCc1ccc(N)cc1 837302791 HFFJZYJJUJALEJ-INIZCTEOSA-N 326.400 1.735 10 10 EDCE O=C1Cc2c(C(=O)N3C[C@H](CO)Cc4cccc(F)c43)ccnc2N1 911684487 RFFGTLWACHQZKP-SNVBAGLBSA-N 341.342 1.527 10 10 EDCE COc1cc(C)cc(CN2CCS(=O)(=O)[C@@H]3CCC[C@@H]32)c1O 840144978 KXZDASKOEIHKTM-DZGCQCFKSA-N 325.430 1.861 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)OC[C@H]3CCCO3)C2)cc1 855231041 SNKOYVUIALMXJH-RVKKMQEKSA-N 348.443 1.974 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CC3(O)CCC3)CC2)cc1F 859161274 MHYNHPUMAJXWKA-HNNXBMFYSA-N 338.423 1.622 10 10 EDCE CCO[C@@H](CNC(=O)NCc1cccc(OC)c1O)CN(C)C 926836938 JYBAHZGGYSXWTJ-ZDUSSCGKSA-N 325.409 1.167 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3c[nH]c(C(N)=O)c3)C2)cc1 855232507 RHZHXXJJNXOHFM-GFCCVEGCSA-N 328.372 1.131 10 10 EDCE CN(C)C(=O)N(C)[C@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 853585217 WNVVNCWWHVKZAP-SWLSCSKDSA-N 335.404 1.006 10 10 EDCE COc1ccc(N2CCN(C(=O)COCC(F)F)CC2)cc1F 859965856 IYUHRJGTUXZGSX-UHFFFAOYSA-N 332.322 1.765 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc4ncccn4n3)C2)cc1 857635375 SRZWTWYPLXSTGV-CYBMUJFWSA-N 337.383 1.747 10 10 EDCE COC(=O)CC1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761883434 FXOKATOFSXJNMD-UHFFFAOYSA-N 349.343 1.705 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCO[C@H](COc2ccccc2)C1 1138207255 ZNZYKNJGLOHKPN-INIZCTEOSA-N 343.379 1.947 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3n[nH]cc3C)CC2)cc1 799412677 BSFYGWQNYRDQPE-UHFFFAOYSA-N 343.431 1.279 10 10 EDCE CCN(C[C@@H](C)O)c1cc2c(cc1Br)[C@H](O)C(=O)N2 691520468 IZJKKHZGBHNIRK-KRTXAFLBSA-N 329.194 1.642 10 10 EDCE Cc1cc(CN2CC[C@H](CNS(C)(=O)=O)C2)ccc1N(C)C 1308059841 PCMRNQDFDZOJTJ-OAHLLOKOSA-N 325.478 1.432 10 10 EDCE CCn1cccc1C(=O)NC[C@@H](CO)NCc1ccc(OC)c(C)c1 1331835147 LEOYLTRNYOHHBW-INIZCTEOSA-N 345.443 1.706 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C1(CO)CC1 2128186619 XTHKSLDLNYLZSU-LLVKDONJSA-N 326.194 1.362 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@H]3CC[C@H]2OC3)cc1 1332583576 ZDXDOYDMCRECIM-USXIJHARSA-N 345.443 1.443 10 10 EDCE CN1CCN(c2ccc(CN)cc2Br)C(C)(C)C1=O 212997228 DVXZPSYYRUYHMV-UHFFFAOYSA-N 326.238 1.965 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)cc1Br 2133921661 YCGLKCYBBGONCR-PYJNHQTQSA-N 327.222 1.371 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@@H]2CC[C@H]3C[C@@H]23)cc1 1351089779 GJLZDCNFJMSUDX-ZOBUZTSGSA-N 329.444 1.921 10 10 EDCE C[C@H](O)CCN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 219786808 FRMRSMWEURLYNP-JVXZTZIISA-N 328.210 1.608 10 10 EDCE C[C@@H](O)[C@H](NC(=O)C1CCCC1)C(=O)NCc1ccc(N(C)C)cc1 1463728549 WABDACBRAQMHLQ-DYVFJYSZSA-N 347.459 1.425 10 10 EDCE COc1cc(N2C[C@@H]3CCC[C@]3(C(N)=O)C2)c([N+](=O)[O-])cc1OC 1472888218 BIKIBISHDJDZIR-QFYYESIMSA-N 335.360 1.704 10 10 EDCE C[C@@](NC(=O)Cc1ccc(O)c(O)c1)(C(N)=O)c1cccc(Cl)c1 1544940495 NGJOXMKNWKKDFP-KRWDZBQOSA-N 348.786 1.811 10 10 EDCE CNC(=O)[C@@H]1CCCN(c2ccc(CN)c(Br)c2)C1 228157189 WRJIAMQCLRYVPP-LLVKDONJSA-N 326.238 1.870 10 10 EDCE CCOC(=O)c1c[nH]nc1[C@@H]1CCN(C(=O)c2cccc(O)c2O)C1 1641514842 PSSQSPGGYRIZFB-SNVBAGLBSA-N 345.355 1.627 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cc(O)ccc1O)C2 1644753732 HIFZTSRZXVEMGM-BPNCWPANSA-N 334.372 1.581 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cn(C[C@H](O)CC)nn1 1640259748 CBUUGWSEWMLKOW-LLVKDONJSA-N 339.392 1.170 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCc2nc[nH]n2)cc1C 1669268788 DINJFBNSUAZTFE-CYBMUJFWSA-N 331.420 1.349 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2cn(C)cn2)cc1C 1666881454 CIYVUGVVKGKRQL-CQSZACIVSA-N 330.432 1.987 10 10 EDCE CCN(CC(N)=O)c1ccc(CNCCOC)cc1Br 233445010 CBMUFGQMHAGSGL-UHFFFAOYSA-N 344.253 1.497 10 10 EDCE CCNCc1ccc(N2CC[C@H](C(N)=O)C2)c(Br)c1 233540194 JYWKAHZBHPMCCK-NSHDSACASA-N 326.238 1.870 10 10 EDCE COC[C@@H](O)CCNCc1c(Br)ccc(OC)c1O 1964054591 XSPBUMULSOENKL-VIFPVBQESA-N 334.210 1.650 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 1985094896 VQIGNVRLERQHMD-SNVBAGLBSA-N 325.369 1.534 10 10 EDCE CO[C@H]1C[C@H](C(=O)N(C)CCN=[N+]=[N-])N(C(=O)OC(C)(C)C)C1 1985100093 CXKMCOLAQNRLGN-WDEREUQCSA-N 327.385 1.780 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCOC1 1985101536 UIVXYJIPTOYAFP-AWEZNQCLSA-N 325.369 1.534 10 10 EDCE C[C@@H](N[C@H](CO)CNC(=O)OC(C)(C)C)c1c(O)cccc1O 1985777080 HBVMGGKLPIUABL-MNOVXSKESA-N 326.393 1.634 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H](CC(=O)N2CC(N=[N+]=[N-])C2)O1 2010405350 YJGRPEGERKEIOA-CMPLNLGQSA-N 339.396 1.922 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010404960 WBAWYSUINSHBQC-GRYCIOLGSA-N 341.412 1.809 10 10 EDCE C[C@@H]1CC[C@H]([C@@H](NC(=O)OC(C)(C)C)C(=O)N2CC(N=[N+]=[N-])C2)O1 2010401066 ANEWESQPEGINJH-YUSALJHKSA-N 339.396 1.968 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCC(N)=O)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2025611062 JOFHTOUFGKUAPL-NXEZZACHSA-N 340.384 1.056 10 10 EDCE CN[C@H](C)c1ccc(N2CCOC[C@H]2CO)cc1Br 300514634 JIIMYEVLTJISAU-ZYHUDNBSSA-N 329.238 1.927 10 10 EDCE O=C1Nc2cc(N(CCO)CC3CC3)c(Br)cc2[C@@H]1O 688394252 CWBYPJSIEONHBO-ZDUSSCGKSA-N 341.205 1.643 10 10 EDCE Nc1ccc(N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c(Br)c1 378994292 OMAIVJDKEOGUBP-KKOKHZNYSA-N 337.173 1.698 10 10 EDCE COC(OC)C(=O)N1CCN(Cc2c(O)cccc2Cl)CC1 2063621236 KQZXMRXHMZIRFN-UHFFFAOYSA-N 328.796 1.309 10 10 EDCE CCNCc1ccc(N2CC3(CNC(=O)N3)C2)c(Br)c1 2177696861 WPMIKPFKMNAUOT-UHFFFAOYSA-N 339.237 1.430 10 10 EDCE OC[C@@]1(NCc2cccc(Br)c2O)C[C@H](O)C12CCC2 2193964899 CWJFCYJUMDUXLD-WFASDCNBSA-N 342.233 1.910 10 10 EDCE C[C@@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2190457643 KNLOKVZNYDKAAK-MOLYSANOSA-N 341.249 1.932 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@H](O)C3)cc1Br 2190452452 DWQRSCAAJRNHQH-HMUFECAUSA-N 342.233 1.965 10 10 EDCE NCc1ccc(N2CC[C@H]3OCC(=O)N[C@@H]3C2)c(Br)c1 2185522191 NVSUUQWZJRPHLW-DGCLKSJQSA-N 340.221 1.002 10 10 EDCE CN(C[C@@H]1CCN1C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2186456660 DKHZEPFYENFAMO-SDBXPKJASA-N 339.237 1.541 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H]3C(C(N)=O)[C@@H]3C2)cc1Br 2201294193 PBNQKVUUUXNRMZ-GGZOMVNGSA-N 338.249 1.897 10 10 EDCE O=C(NC[C@H]1CNCCN1Cc1ccccc1)c1ccc(O)c(O)c1 2084716724 FOPAVTCJCBKCII-MRXNPFEDSA-N 341.411 1.302 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(NC(=O)Cc2ccc(N)cc2)C1 2216757256 XJDFCOMDRDBJQD-SCLBCKFNSA-N 331.416 1.937 10 10 EDCE OCc1ccc(N2C[C@@H]3COC[C@@]3(CO)C2)c(Br)c1 2226174106 ISXLVEZAAKMJPF-RISCZKNCSA-N 328.206 1.387 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)C[C@H]3C2)cc1Br 2236991417 XADPFTOVUYOBOF-BAESOJJISA-N 342.233 1.509 10 10 EDCE CN(C)[C@H](CNC(=O)C=Cc1ccc(O)c(O)c1)c1cnn(C)c1 2308001424 HVVGLWPZUFJFKQ-CQSZACIVSA-N 330.388 1.264 10 10 EDCE Cc1ccc(CN2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(O)c1Br 2381140486 LBNQUONOGCUAFL-NDMCHQMPSA-N 342.233 1.779 10 10 EDCE CN(C)c1ccc(CN2CCC(CNS(C)(=O)=O)CC2)cc1F 289616591 WBHWWTMEMNKOBI-UHFFFAOYSA-N 343.468 1.653 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2COCCO2)c(O)c1Br 2380772800 OEYDDACKERCKMI-NSHDSACASA-N 344.205 1.837 10 10 EDCE CN1CCCc2cc(CNC(=O)COCc3nccn3C)ccc21 816910278 AROHFAKVWUBIJY-UHFFFAOYSA-N 328.416 1.636 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](C)O[C@@H](C)C1 828438219 USCSCNDQAVRRPH-CABCVRRESA-N 347.459 1.703 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCN=C2C1=NNN2C 824234346 JHQOSSRXJLEKQA-HNNXBMFYSA-N 342.447 1.326 10 10 EDCE COCc1n[nH]c(CNCc2ccc(Br)cc2O)n1 827005348 FHZFSTJKTXKEPJ-UHFFFAOYSA-N 327.182 1.709 10 10 EDCE Cc1ccc([C@H](C)NCCS(=O)(=O)N=S(C)(C)=O)c(O)c1 903227477 RSCXXZQTOIECER-NSHDSACASA-N 334.463 1.409 10 10 EDCE C[C@@]1(C2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)COC(=O)N1 905710278 HTIQHEVAYRNKIF-YJBOKZPZSA-N 348.399 1.529 10 10 EDCE C[C@H](NC(=O)N[C@H]1CCN(C)[C@@H]1C)c1ccc(N2CCOCC2)cc1 914400714 RWLCZMHGQKZSLK-DAYGRLMNSA-N 346.475 1.976 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](O)c3ccccn3)C2)cc1 855227668 ZYYHMKSGXBCMPP-CXAGYDPISA-N 327.384 1.519 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)c3ncn(C)n3)C2)cc1 852268131 GVSLBPXWYFQBCF-CHWSQXEVSA-N 344.419 1.463 10 10 EDCE CNC(=O)C[C@@H](C)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852374740 XQCGHVSPQHERSQ-CHWSQXEVSA-N 334.420 1.098 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCOC[C@@H]2CCO)cc1 758385952 ZDGQYVKAHUCDHS-KRWDZBQOSA-N 335.448 1.826 10 10 EDCE CCS(=O)(=O)C1(CNC(=O)NCc2cc(Cl)ccc2O)CC1 852649325 HIYTYTXECQXEFP-UHFFFAOYSA-N 346.836 1.812 10 10 EDCE CCO[C@H](CS(=O)(=O)NCc1cccc(OC)c1O)C1CC1 859006662 RMKGUXOWRGKWOY-CQSZACIVSA-N 329.418 1.635 10 10 EDCE Nc1nnc([C@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)o1 931004684 AVDDRNXMNQEITB-HNNXBMFYSA-N 343.431 1.868 10 10 EDCE C[C@H]1[C@H](C(N)=O)CC[C@@H](C)N1Cc1ccc(N2CCOCC2)cc1 930906930 HQNBHJAZZJKGIA-RVKKMQEKSA-N 331.460 1.998 10 10 EDCE COC[C@@H](O)C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 766147890 QRCVXKBGCWTLFC-QGZVFWFLSA-N 349.358 1.966 10 10 EDCE CN(CCCCCCN)C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 872185112 HCJDVGMEBGGRAR-UHFFFAOYSA-N 348.491 1.689 10 10 EDCE NC(=O)CN1C(=O)/C(=C/c2cncc3ccccc23)SC1=S 772802121 QKRSNIYARFVMJV-XGICHPGQSA-N 329.406 1.921 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)[C@](C)(O)Cn1ccccc1=O 790724280 CFBUKVOVQGEXKK-LJQANCHMSA-N 343.427 1.290 10 10 EDCE COCCNC(=O)[C@H](C)NCc1c(O)cccc1Br 706829108 JZAPEKKSRZFAFH-VIFPVBQESA-N 331.210 1.395 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3C[C@H](O)[C@H](O)C3)ccc21 1155983628 FTVDZWZNYQVNAN-GBEXYDAJSA-N 346.427 1.519 10 10 EDCE CC1(C)C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CCS1(=O)=O 1157724589 DRQRCKPWOSDBJZ-FVOPLDGLSA-N 339.413 1.583 10 10 EDCE CC[C@@H](CNC(=O)c1cncnc1O)NCc1ccc(OC)c(C)c1 1267809057 DHXUJOUZHVTDSU-AWEZNQCLSA-N 344.415 1.797 10 10 EDCE O=S1(=O)CCN(c2ccc(CN[C@H]3C[C@H]4CC[C@H]3O4)cc2)CC1 1262202364 SJNKLXMEVSGEQM-IXDOHACOSA-N 336.457 1.331 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CCOC1(C)C 1347534808 OTWIDTKXZLQHKL-HNNXBMFYSA-N 347.459 1.609 10 10 EDCE C[C@H](NC(=O)CCCn1c(O)nnc1O)c1ccc(N(C)C)cc1 1616835136 RNRUILCLLIXKME-NSHDSACASA-N 333.392 1.413 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H](CO)C3)c(Br)cc21 226455279 JEBHLMKFYQNXHH-KRTXAFLBSA-N 326.194 1.220 10 10 EDCE CCC[C@@H]1C[C@H]1C(=O)NC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1704060117 FBWGXRGWBHCDDS-OUCADQQQSA-N 349.431 1.770 10 10 EDCE CC1=NNC(=O)[C@@H]1CCNC(=O)c1cc2cc(O)c(O)cc2s1 1628274159 DQUZZKQGRLJUIR-SECBINFHSA-N 333.369 1.554 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2cnnn2C)c1 1629003403 QFCZOVZIJVYFRC-UHFFFAOYSA-N 337.383 1.965 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCc2ncc3c(n2)CCOC3)cc1 1557367362 ROTGMIPNYNAOTA-UHFFFAOYSA-N 340.343 1.642 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)/C=C\c2ccc[nH]2)cc1C 1725531819 ZXOWENRHCZLQLT-BQLWYNFJSA-N 343.427 1.612 10 10 EDCE O=C(NCC(F)F)[C@@H]1CCCCN1C(=O)Cc1ccc(O)c(O)c1 1569200498 PCYXIBZUKVFMSJ-NSHDSACASA-N 342.342 1.403 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1C[C@H]1C(=O)OC 1568727780 ABKQWTPFOWOUPR-HZPDHXFCSA-N 348.443 1.751 10 10 EDCE NC(=O)c1nc2cc(NC(=O)/C=C/c3ccc(O)c(O)c3)ccc2o1 1642405682 BZIYFMNLRVRRDU-QHHAFSJGSA-N 339.307 1.990 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCCc1ccc(O)c(CO)c1 1651178136 PLQLZYPSDBBJKZ-UTCJRWHESA-N 329.352 1.668 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)Cc2ccoc2)cc(OC)n1 1688135284 AHXKCVUBSWQPQK-NSHDSACASA-N 347.371 1.169 10 10 EDCE C[C@H](O)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccsc2)SC1=S 1858595981 KZNJOTIHVBKYSP-GUZTYWLKSA-N 329.424 1.783 10 10 EDCE CCNCc1ccc(N2CCC2(CO)CO)cc1Br 1879987085 PNKZBOOKPQRWBJ-UHFFFAOYSA-N 329.238 1.492 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)C(C)(C)F 1982063058 DRBCBXZFHKQMIQ-KWBADKCTSA-N 330.400 1.893 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@H]1CCCO1 1985102574 IRURBPKTBBMRJK-MNOVXSKESA-N 325.369 1.580 10 10 EDCE C[C@H]1CN(C)C[C@H](CNCc2c(O)cccc2Br)O1 706835099 QHOZVSANCHOCJD-QWRGUYRKSA-N 329.238 1.963 10 10 EDCE COc1ccc([C@H](C)n2nc(C(F)F)c(C(N)=O)c2N)c(O)c1 2079855194 LDNVJRKIVPKLPM-LURJTMIESA-N 326.303 1.825 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1908252894 IDGYWYZDTWLQLK-SDDRHHMPSA-N 339.396 1.658 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1[C@H]2C[C@@H](CN(CCN=[N+]=[N-])C2)[C@H]1CO 2212449658 CQCQLUUESIHBQU-WUHRBBMRSA-N 325.413 1.750 10 10 EDCE C[C@H]1CCCN(C(=O)OC(C)(C)C)[C@H]1CCOc1nnc(=N)[nH]n1 2213790059 PORGITSALKGDLZ-QWRGUYRKSA-N 338.412 1.484 10 10 EDCE COc1ccc(N2CCC[C@@](O)(CO)C2)c(OC)c1Br 2234904552 XWLORRIAJLZXMD-AWEZNQCLSA-N 346.221 1.790 10 10 EDCE COc1ccc(Br)c(CN[C@H]2COC(C)(C)[C@H]2O)c1O 2236055487 QGIPWVWXQQQHKA-GWCFXTLKSA-N 346.221 1.791 10 10 EDCE OCc1ccc(N2C[C@@H]3COC[C@]3(CO)C2)c(Br)c1 2226174104 ISXLVEZAAKMJPF-BXUZGUMPSA-N 328.206 1.387 10 10 EDCE CC(C)(C)OC(=O)NC12COC(C(=O)C(=O)C[C@H]3C[C@H](N)C3)(C1)C2 2247290190 KQMGGLCWTGKKBR-PJHAICGXSA-N 338.404 1.078 10 10 EDCE CNCc1ccc(N2CC[C@H](O)[C@@H](O)CC2)cc1Br 2269119501 SIOLSKQPVNWPBH-KBPBESRZSA-N 329.238 1.491 10 10 EDCE CC[C@@H](C)CNC=C1C(=O)NC(=O)N(c2ccc(OC)cc2)C1=O 2296166949 IIRKPHFESYEFHR-LLVKDONJSA-N 331.372 1.798 10 10 EDCE CC(=O)NCCCOC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297507187 OPKZPESVHAVZIE-UHFFFAOYSA-N 332.400 1.606 10 10 EDCE CCOc1ccc(CC(=O)NCCN2C(=O)CSC2=S)cc1 49755714 VXYWRXARMNHFSH-UHFFFAOYSA-N 338.454 1.604 10 10 EDCE CN1CCC[C@@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1=O 294257924 DEOQPYRXRFBWQL-QGZVFWFLSA-N 345.443 1.350 10 10 EDCE CC[C@@H](C(=O)NCc1cc(Br)ccc1O)C(=O)OC 804737563 SZNCAZNFZGJJCU-JTQLQIEISA-N 330.178 1.970 10 10 EDCE COCC(COC)C(=O)NCc1ccc(C)c(Br)c1O 2380752130 RVGDNWLXYSZSBK-UHFFFAOYSA-N 346.221 1.988 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(C(=O)C3CC3)C2)c([N+](=O)[O-])c1 817131460 ASORWPNLINSLGC-CLTKARDFSA-N 345.355 1.797 10 10 EDCE OCCO[C@@]1(CNCc2ccc(Br)cc2O)CCOC1 826943294 WISWIQBZVLULAU-CQSZACIVSA-N 346.221 1.412 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@@H](Cn4ccnn4)C3)cc2)CC1 826845270 IEXQUGPOYILDQB-GOSISDBHSA-N 340.475 1.552 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCN(C[C@H]2CCCO2)CC1 732576859 UFPJRHNYQPZZBC-HXUWFJFHSA-N 345.487 1.820 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@@]2(C)CCCS2(=O)=O)c1 907060503 MSWNAXVDAIJSSQ-MEBBXXQBSA-N 327.402 1.545 10 10 EDCE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@@H](CF)C(=O)O 908853063 XZIIKNDOIKWEQV-ZDUSSCGKSA-N 341.408 1.462 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCc4n[nH]cc4C3)C2)cc1 855231498 ARRRHNXJQVZYFK-ZFWWWQNUSA-N 340.427 1.918 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CO)CC(F)F)C2)cc1 854299329 OEYVOIXQHUCRJE-NWDGAFQWSA-N 343.374 1.589 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@](C)(C(F)F)C2)cc1 852784974 VRUMDAKNYNRXOL-KRWDZBQOSA-N 341.402 1.725 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCNC12CCC2 861750300 HUCUVMRWIJPKSB-INIZCTEOSA-N 344.459 1.078 10 10 EDCE COC[C@H](NCc1cc(OC)c(OC)cc1O)[C@@H]1CCCOC1 895854952 OGIWWSYJWKDWIY-OCCSQVGLSA-N 325.405 1.941 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@H](C)O[C@H](CO)C2)c([N+](=O)[O-])c1 786809971 BAQGPPRMUHRMOW-RKLVJPFCSA-N 336.344 1.367 10 10 EDCE COC(=O)[C@@]1(CNCc2ccc(OC)c(C)c2)C[C@@H]1S(C)(=O)=O 895509361 RQGACBJKFMXOHL-GOEBONIOSA-N 341.429 1.070 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@H](O)Cc2cnn(C)c2)cc1 786793338 LKCAHYCWKRVSKO-QGZVFWFLSA-N 330.432 1.486 10 10 EDCE COC(=O)[C@]1(O)CCN(Cc2cccc(Br)c2O)C1 895708182 QHOQVUOQBSPJOO-ZDUSSCGKSA-N 330.178 1.265 10 10 EDCE Cn1cc(C[C@H](CO)CNC(=O)c2ccc(N=NC(N)=O)cc2)cn1 1157612012 CSLIYZBBVXVOGA-LBPRGKRZSA-N 344.375 1.164 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@]12CCOC2 1326308422 JRSOEZZRHVGRQJ-GOSISDBHSA-N 331.416 1.069 10 10 EDCE COC[C@H](C)N(C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1322304948 AXROQZPMKOLXPB-RYUDHWBXSA-N 335.408 1.934 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H]2CCN(C)C2=O)cc1C 1265812967 HWZCERSNZQSSOI-HIFRSBDPSA-N 333.432 1.076 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CCC(=O)N2C)cc1C 1268700377 PAVKDLJAZWBQOU-ZFWWWQNUSA-N 333.432 1.219 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCC(O)(C(F)(F)F)CC1 1445865343 PZZJRATYVAMPEP-UHFFFAOYSA-N 333.306 1.993 10 10 EDCE CN(c1ccc(C=CC(=O)O)c(Br)c1)[C@H]1CCNC1=O 1916232598 OMYYNWMNRSCUGE-LBPRGKRZSA-N 339.189 1.872 10 10 EDCE CCOCC(=O)N[C@@H](C)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1725913565 ZPAZOIUFFPEOMQ-WDEREUQCSA-N 349.391 1.509 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)CCc2cnn[nH]2)cc1C 1496172367 UYTMTOQKOBULMT-AWEZNQCLSA-N 345.447 1.691 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](C)CN3CCOCC3)CC2)cc1 1631277248 NGCDMVJRWUWFHW-INIZCTEOSA-N 347.459 1.312 10 10 EDCE CCC(=O)N(C)CCCNCc1nnnn1-c1ccc(OC)cc1 1498501677 CPGZYRGHMLEOGT-UHFFFAOYSA-N 332.408 1.019 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@]2(C)CCNC2=O)cc1C 1732359705 FMYYLFXLGQXNBO-DJJJIMSYSA-N 347.459 1.372 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CN3CCC[C@H]3CO2)cc1 1583994131 KZWTWJJVRZPHEM-KBPBESRZSA-N 331.376 1.442 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H]2CCCNC2=O)cc1C 1669320489 LNTITHNOVTUOIH-HIFRSBDPSA-N 333.432 1.124 10 10 EDCE COC(=O)COCCNC(=O)NCCCSc1nccs1 1675024672 HVVVIDVNLXYABI-UHFFFAOYSA-N 333.435 1.114 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H]2CCCC(=O)N2C)cc1C 1690642656 ACSHXPFWLWQIFL-GOEBONIOSA-N 347.459 1.609 10 10 EDCE COc1cc(CN2CCC[C@H](NS(C)(=O)=O)C2)c(O)cc1C 159811975 CCTZZHHXUZZXNF-ZDUSSCGKSA-N 328.434 1.223 10 10 EDCE CCCNCc1ccc(N2CCNC(=O)C2)c(Br)c1 233109627 TXRZKYQHTIMRPJ-UHFFFAOYSA-N 326.238 1.885 10 10 EDCE CNCc1ccc(N(C)CCS(C)(=O)=O)cc1Br 234403862 QNFNLWXFKVZHSD-UHFFFAOYSA-N 335.267 1.649 10 10 EDCE NCc1ccc(N2C[C@H]3CCC[C@]3(C(N)=O)C2)cc1Br 2144089990 FETBOVVBLJYUOT-ABAIWWIYSA-N 338.249 2.000 10 10 EDCE CNCc1ccc(N2CC[C@@H](OCC(N)=O)C2)c(Br)c1 2145374642 FNNKQXUTKYVXIE-LLVKDONJSA-N 342.237 1.249 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCCCN=[N+]=[N-] 1985096716 VUFGHAPQUYXEPS-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CC[C@]1(O)CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2150756275 BOFWXCMLGJRZPX-JSGCOSHPSA-N 340.221 1.752 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010406434 UTRUTKKPSHIVST-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](Nc2c(N)cccc2C(=O)O)C1 2011486837 FUTRYCWPNUUDNJ-RYUDHWBXSA-N 337.376 1.359 10 10 EDCE C[C@H](NC(=O)CN(CCO)C(=O)OC(C)(C)C)c1ccccc1O 2017519597 VDERYTIZDVEIBP-LBPRGKRZSA-N 338.404 1.799 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N(C)[C@@H](CO)c3ccccc3C)c2n1 2062318740 XWKYNOAJMVCRSL-HNNXBMFYSA-N 340.383 1.857 10 10 EDCE O=C1NC[C@]2(CCCN(Cc3cc(Br)ccc3O)C2)N1 2177676328 LCJNFQHRQQMECM-AWEZNQCLSA-N 340.221 1.802 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NC(=O)Cc1ccc(N)cc1 2044235992 WFLVOYRRBFOUHO-UKRRQHHQSA-N 349.431 1.467 10 10 EDCE C[C@H](O)c1ccc(N2CCCC2(CO)CO)cc1Br 2089867403 DBUCYVQPSOWZCJ-JTQLQIEISA-N 330.222 1.826 10 10 EDCE CCNCc1ccc(N(C)C2CS(=O)(=O)C2)c(Br)c1 2095906206 JQXXFACVSQTIGK-UHFFFAOYSA-N 347.278 1.792 10 10 EDCE O=C(O)[C@H]1C[C@H](O)CN(Cc2cc(Br)cc(F)c2O)C1 2201044924 OETCTADGXDJRAJ-WPRPVWTQSA-N 348.168 1.561 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213593566 SKEPTMALXFFJTF-SDDRHHMPSA-N 339.396 1.970 10 10 EDCE O=C(O)C1CN(C2CN(Cc3ccc(Br)cc3O)C2)C1 2284225011 QRALVPOITXYZKH-UHFFFAOYSA-N 341.205 1.355 10 10 EDCE COc1ccc(N2CC[C@H](O)[C@H](O)CC2)c(OC)c1Br 2284573514 JFTOTCPWVXAEEH-PHIMTYICSA-N 346.221 1.788 10 10 EDCE CN1CC2(CCC1=O)CN(c1ccc(CN)c(Br)c1)C2 2289726313 GAVHYALYTNAVOH-UHFFFAOYSA-N 338.249 1.966 10 10 EDCE O=C(O)CN1C(=O)C(=Cc2cnc3ccccc3n2)SC1=S 2296836377 BEGKFKDSQOKFBA-UHFFFAOYSA-N 331.378 1.916 10 10 EDCE CCOC(=O)CN1C(=O)C(=C2SC(=S)NC2=O)c2ccccc21 2314717372 JQEOOUQMORNYIB-UHFFFAOYSA-N 348.405 1.455 10 10 EDCE O=C1Nc2cc(N3C[C@@H](F)[C@H](F)C3)c(Br)cc2[C@@H]1O 2330041189 ASXBZMDKAACEMM-XLDPMVHQSA-N 333.132 1.931 10 10 EDCE Cc1ccc(CN2CCN(C(N)=O)CC2)c(O)c1Br 2352609184 VLGQQHVREMFZQH-UHFFFAOYSA-N 328.210 1.659 10 10 EDCE Cc1ccc(CNC(=O)c2cnn(C)n2)c(O)c1Br 2352627516 QEMXLMMXIAYWHR-UHFFFAOYSA-N 325.166 1.522 10 10 EDCE CN1CCN(C2=NC(=O)/C(=C/c3cccc4c3OCO4)S2)CC1 33294918 LOOJIFKBUPBHAB-LCYFTJDESA-N 331.397 1.633 10 10 EDCE Cc1ccc2c(c1)/C(=C1/SC(=S)N(CCC(=O)O)C1=O)C(=O)N2 34240676 ICRKWVZEUUZIQU-QXMHVHEDSA-N 348.405 1.993 10 10 EDCE C[S@@](=O)CCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 136792443 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CC(C)CCO[C@@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1335637314 WFHFGXCMFLOGMZ-OAHLLOKOSA-N 346.427 1.898 10 10 EDCE O=C(O)C=Cc1ccc(N2CCNC(=O)C2)cc1Br 1911946913 WZCUQRDLBSYJTN-UHFFFAOYSA-N 325.162 1.483 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1C[C@@H]2CCC[C@@H]21 1354610952 AAMFFAFOWLKHAV-RYQLBKOJSA-N 339.439 1.984 10 10 EDCE CCCN1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1=O 1296464251 WUGQZARPJRSFCO-UHFFFAOYSA-N 331.376 1.934 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CC(=O)N(Cc2ccccc2)C1 1471661129 RKKKBZFJJRRNCV-HNNXBMFYSA-N 340.379 1.763 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)C[C@@H]2CCC(=O)N2)cc1C 1714795468 MRVIYXVCTIXJSU-HOCLYGCPSA-N 347.459 1.609 10 10 EDCE COC(=O)c1nc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cs1 1624955057 QDLOWVFKHYTYHR-MRVPVSSYSA-N 336.369 1.702 10 10 EDCE CNC(=O)COc1cccc(CNC(=O)Cc2ccc(O)c(O)c2)c1 1556510900 BJTITSNYDMZOIH-UHFFFAOYSA-N 344.367 1.082 10 10 EDCE Cn1ccnc1[C@@H]1C[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)CCO1 1638948035 GTDRPSOENLRSOF-FYQXYTAUSA-N 343.383 1.881 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2occc2C)cc1C 1725533676 UHHIRHHLPOPXRJ-OAHLLOKOSA-N 332.400 1.786 10 10 EDCE O=C(C[C@H](O)C(Cl)(Cl)Cl)NCc1c(O)cccc1O 1652629051 UPPBFKQPSFQQML-VIFPVBQESA-N 328.579 1.835 10 10 EDCE COc1nccc(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)n1 1662278193 RLIAGJRXNUJTGP-ZDUSSCGKSA-N 344.415 1.710 10 10 EDCE CNC(=O)C[C@@H](C)NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1672798486 DLUKHVZXHPUUPR-CQSZACIVSA-N 348.447 1.189 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)N[C@H]1CCc2ncnn2C1 161251312 QPFUIDXCWJGCJX-AWEZNQCLSA-N 329.404 1.920 10 10 EDCE CC[C@H](NCCNS(=O)(=O)c1cccnc1)c1ccccc1O 156812534 CANXWEYQIPFTLH-HNNXBMFYSA-N 335.429 1.806 10 10 EDCE COC(=O)C[C@H](N)C(=O)Nc1ccc(Oc2ccc(N)cc2)cc1 1865968571 ZJYJGZFIFZMPTD-HNNXBMFYSA-N 329.356 1.890 10 10 EDCE COCCNC(=O)[C@@H](C)NCc1cc(Br)ccc1O 234640536 HQXLHHLOZXUBKF-SECBINFHSA-N 331.210 1.395 10 10 EDCE O[C@H]1CN(c2ccc(CNC3CC3)c(Br)c2)C[C@@H]1O 236555697 KTPGGHCPTQZVPA-KBPBESRZSA-N 327.222 1.243 10 10 EDCE Nc1ccc(CS(=O)(=O)N[C@H]2CCCCC23OCCO3)cc1 1876528682 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CN1CCC[C@H]1CNC(=O)NCc1ccc(N2CCOCC2)cc1 263696018 HNWAJOQMURMBLZ-KRWDZBQOSA-N 332.448 1.417 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@@H]2CO)c(Br)c1 704709942 TWYPPGXCJIIKKJ-NEPJUHHUSA-N 329.238 1.491 10 10 EDCE Cc1cccnc1CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 296341704 DBMNPJJHDNZKBR-UHFFFAOYSA-N 349.412 1.440 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@H](CO)c2cccnc2)cc1F 806634509 LJURNNIWFWNPDS-OAHLLOKOSA-N 346.406 1.862 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNCC(C)(C)[C@]2(O)CCOC2)c1O 843428968 RHXQLSOQZCYFQS-INIZCTEOSA-N 340.376 1.576 10 10 EDCE CCON(C)C(=O)CNC(=O)NCc1ccc(N(C)C)c(F)c1 844935201 SIYOAGOHAPHGKL-UHFFFAOYSA-N 326.372 1.101 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1C[C@@H](C)N(CCO)C[C@@H]1C 842181466 YGRVRCXWTWYBGS-CVEARBPZSA-N 348.491 1.658 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@@H]2CC3(CCNCC3)C(=O)O2)c1 925854913 KAMTYORVIDRMRT-OCCSQVGLSA-N 334.416 1.737 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(=O)O)c1cc(CCO)ccc1O 687752741 NBIYLRGXEGVXEK-GFCCVEGCSA-N 325.361 1.968 10 10 EDCE CN(Cc1ccccc1O)[C@H]1CCN(CC(=O)OC(C)(C)C)C1=O 851841319 PBCJOQHHAXNCRI-AWEZNQCLSA-N 334.416 1.767 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCC[C@H]1CNC(=O)C1 922916472 UURUNOZURNGMBU-HUUCEWRRSA-N 346.475 1.817 10 10 EDCE Nc1ccc(NC(=O)C(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1 850846516 PCAGJTWCFFXADK-RISCZKNCSA-N 325.315 1.138 10 10 EDCE COc1ccc(N2CCCN(C(=O)N[C@H]3C[C@H](C(N)=O)C3)CC2)cc1 858773665 YXVQYRQZGUNNDS-HDJSIYSDSA-N 346.431 1.181 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CNC(=O)CC(C)(C)C)C2)cc1 855231176 TXRRXAOUNFXTQT-CQSZACIVSA-N 347.459 1.943 10 10 EDCE COC(=O)CCNC(=O)CCNCc1ccc(N2CCCCC2)cc1 858292754 MNFTUGHPMLZVCR-UHFFFAOYSA-N 347.459 1.836 10 10 EDCE COC(=O)CC1(NCc2ccc(N3CCOCC3)cc2)CCOCC1 751886793 GITYDGCHWVLOEC-UHFFFAOYSA-N 348.443 1.725 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCc4c[nH]nc4C3)C2)cc1 855232495 UWUHTJAZXJAIKN-UKRRQHHQSA-N 340.427 1.918 10 10 EDCE C[C@@H](C(=O)NCc1cc(Br)ccc1O)[C@H]1CCC(=O)N1 861687347 MKDCXTBBHINZBF-LDYMZIIASA-N 341.205 1.686 10 10 EDCE CC(C)(C)n1cc(C(=O)C(=O)NCCc2ccc(O)c(O)c2)cn1 762274815 KHJXPFSTUQXAHU-UHFFFAOYSA-N 331.372 1.591 10 10 EDCE CCN1C[C@H](S(=O)(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1=O 867126349 XOAMNIDZCKLNQA-SWLSCSKDSA-N 339.461 1.354 10 10 EDCE COc1ccc(O)c(CNC(=O)COCc2ccc(OC)nc2)c1 860242481 TXVILSMWJZFTLS-UHFFFAOYSA-N 332.356 1.637 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN3C(=O)CC[C@@H]3C2)c([N+](=O)[O-])c1 765658535 WQULHPDOINLPMW-LPZVBRGNSA-N 345.355 1.592 10 10 EDCE CCCc1nnc(SCC(=O)N2Cc3cccc(O)c3C2)n1N 871204302 CHMGLEZJSYDEGH-UHFFFAOYSA-N 333.417 1.285 10 10 EDCE Cc1cccc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)n1 788153325 LKMXGSOVDJCIEE-UHFFFAOYSA-N 340.427 1.731 10 10 EDCE O=S1(=O)CC(C2CN(Cc3ccc(Br)cc3O)C2)C1 895423646 AGBBFOCFQQTPMG-UHFFFAOYSA-N 346.246 1.631 10 10 EDCE CO[C@@H](C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)C(=O)OC(C)(C)C 1138152997 VJYPVNYFGLAGHR-HZMBPMFUSA-N 339.388 1.502 10 10 EDCE CN(c1ccc(CNC2CC2)cc1Br)[C@H]1COC[C@H]1O 708112417 GVILKXFDFVTENS-LSDHHAIUSA-N 341.249 1.897 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c1 1147956305 BWVAEULWSDLYGM-UHFFFAOYSA-N 325.324 1.160 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCC[C@@H](O)C3)c(Br)cc21 92775479 FCMQBIWDWGKJOC-JMCQJSRRSA-N 326.194 1.362 10 10 EDCE CN1CCc2cc([C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)O)ccc21 1917191329 RIOXYDSDQOVKDL-ZIAGYGMSSA-N 336.388 1.690 10 10 EDCE COC(=O)CC(C)(C)CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 1333259186 HJSJFLZJGBVKHZ-UHFFFAOYSA-N 349.431 1.074 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@]3(C)C[C@H](O)CN3C)CC2)cc1 1333111327 OWDCDZFJYVFVFR-LPHOPBHVSA-N 347.459 1.189 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)C[C@@H]2CCNC2=O)cc1C 1283619664 BAAKHQGJUYNTCH-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)C2[C@H]3CCC[C@H]23)cc1 1522577370 OQZJWJUOHDUGCR-STQMWFEESA-N 343.387 1.741 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@@H](O)c1cccc([N+](=O)[O-])c1 1465981342 KJYUARVVRYPZHW-HNNXBMFYSA-N 332.312 1.398 10 10 EDCE CC(C)[C@H](NS(C)(=O)=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1539180101 GNAWJOXKXIHXIK-HNNXBMFYSA-N 341.477 1.285 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)Cc2cnn(C)c2)cc1C 1716431550 WCDXDKWTMFHDGB-AWEZNQCLSA-N 330.432 1.574 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC(=O)N1CCc2ccccc2C1 1627705992 SZPOOKSUPDOAQX-UHFFFAOYSA-N 340.379 1.341 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2ccc(=O)n(C)c2)cc1C 1714728022 RLCTWDGUCNJIPU-UHFFFAOYSA-N 343.427 1.564 10 10 EDCE COCCNc1nc(CC(=O)NCc2c(O)cccc2F)cs1 1558457843 VUVDXMSVQRXARR-UHFFFAOYSA-N 339.392 1.905 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](NC(N)=O)C(C)C)C2)cc1 1638649224 DYBPRHCLTBQUQS-CJNGLKHVSA-N 348.447 1.331 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@H]2CCN(C)C2)C2CC2)cc1C 1566732540 DGLCTDMKSLQWFV-ZWKOTPCHSA-N 345.487 1.940 10 10 EDCE COc1ccc(CNC[C@@H]2CCCN(C(=O)CNC(C)=O)C2)cc1C 1566882742 UZHIJAGVHNSERN-KRWDZBQOSA-N 347.459 1.468 10 10 EDCE Cc1nccc(N[C@@H]2COCC[C@@H]2NC(=O)c2cccc(O)c2O)n1 1648069418 ONTUPCFKCJZRQS-QWHCGFSZSA-N 344.371 1.196 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)c2ncccc2O)N(C)C)cc1 1653420570 BHNRNOROPFPTIK-OAHLLOKOSA-N 328.416 1.886 10 10 EDCE CC(C)CN1CC(O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1699925378 FUBFOKOADYYIRX-UHFFFAOYSA-N 333.392 1.282 10 10 EDCE CC1(C)CC(NC(=O)CCN2C(=O)CSC2=S)CC(C)(C)N1 1865764774 AEDGHYXCVGUMFZ-UHFFFAOYSA-N 343.518 1.662 10 10 EDCE CCOC(=O)CCN(CC)C(=O)CNCc1ccc(N(C)C)cc1 1857865496 PJSFDOOFQPYSQZ-UHFFFAOYSA-N 335.448 1.644 10 10 EDCE CC1(C2CCN(S(=O)(=O)Cc3ccc(N)cc3)CC2)OCCO1 2145810937 CNBVTTMLCZYTFD-UHFFFAOYSA-N 340.445 1.574 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)NCCCN=[N+]=[N-])C1 1985095330 CIJNTKXPKIFSES-LLVKDONJSA-N 327.385 1.687 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@H]1C(=O)NCCCCN=[N+]=[N-] 1985096260 OTQIOPDFDYVSIA-WDEREUQCSA-N 327.385 1.875 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC(N=[N+]=[N-])C1)C1(O)CCC1 1987677701 AYOFTAITISKTEM-SNVBAGLBSA-N 325.369 1.316 10 10 EDCE CC(C)(C)OC(=O)N[C@]12C[C@@H]1CN(C(=O)Cc1ccc(N)cc1)C2 1999440509 GUNCKVLJVVBNNA-ACJLOTCBSA-N 331.416 1.937 10 10 EDCE CN[C@H](c1ccc2c(c1)CCN2C)[C@@H](O)CNC(=O)OC(C)(C)C 1999527435 NOULVKCSNPXGHR-JKSUJKDBSA-N 335.448 1.825 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]12CN(C(=O)OC(C)(C)C)C[C@@H]1CCO2 2010392921 LDPMXROUJHHEPG-NHYWBVRUSA-N 339.396 1.781 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@H](O)CNC(=O)OC(C)(C)C)c1 2011423456 SGHCEUJPNAIHOU-NEPJUHHUSA-N 340.420 1.937 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]1NC(=O)c1cc(O)c(O)c(O)c1 2015121141 AOVSQLBJDHYNFB-VHSXEESVSA-N 338.360 1.589 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)C[C@@H](O)C2)cc1Br 2161358128 WWJBQOAPOZGXKN-OKILXGFUSA-N 343.265 1.881 10 10 EDCE CCOC(=O)[C@@H]1CNCCN1Cc1ccc(Br)cc1O 691390676 ZFJJCADNAYHNNK-LBPRGKRZSA-N 343.221 1.492 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](CO)C[C@H]2CO)cc1Br 2089864590 VKONHADHOSVJKS-UMNHJUIQSA-N 330.222 1.682 10 10 EDCE CNCc1ccc(N2C[C@@H]3CCO[C@@]3(CO)C2)c(Br)c1 2239802237 XPVRXJHQOMFYFH-SWLSCSKDSA-N 341.249 1.756 10 10 EDCE CCNCc1ccc(N2CC(O)(CCO)C2)c(Br)c1 2270665094 NAAZEYLYPMCCJH-UHFFFAOYSA-N 329.238 1.492 10 10 EDCE CN(C[C@H]1CCCO1)C(=O)NCc1ccc(N2CCOCC2)cc1 102904710 IGIKDAMDBOTJSU-QGZVFWFLSA-N 333.432 1.844 10 10 EDCE COC[C@@H](NC(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CC1 178740895 FEXMDXTWDSUCPX-QGZVFWFLSA-N 333.432 1.952 10 10 EDCE CCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 76140484 NETOZZUWFZHLAO-AWEZNQCLSA-N 339.436 1.819 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NC[C@@]1(O)CCSC1 255620177 ZHHHASUQRNCQAY-CJISVDGZSA-N 348.468 1.521 10 10 EDCE COc1cc(NS(=O)(=O)c2ccc3c(c2)C(=O)NCC3)ccc1O 366830609 RGWKEARLLMKPDO-UHFFFAOYSA-N 348.380 1.488 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H](OC)C3CC3)CC2)cc1 279392379 ARPXCGIVTNTMSP-SFHVURJKSA-N 347.459 1.358 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CC[C@H](O)CN2)c(O)c1Br 2380753040 BNMLIMZJVGLYHZ-QWRGUYRKSA-N 343.221 1.192 10 10 EDCE C[C@@H](N[C@H]1CCC(=O)N(C)C1=O)c1cc(Br)ccc1O 818362245 SMYORFKEAOMTOZ-KCJUWKMLSA-N 341.205 1.953 10 10 EDCE COc1cc(O)c(CN2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)cc1OC 824654367 NPCJFGAWTIIPLM-BPLDGKMQSA-N 337.416 1.771 10 10 EDCE CO[C@@]1(CN[C@H](C)c2ccc(Cl)cc2O)CCS(=O)(=O)C1 903362308 DFWGUEPGWKESOR-QMTHXVAHSA-N 333.837 1.900 10 10 EDCE COC(=O)CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 907192910 POGMAUJRWHSTKV-UHFFFAOYSA-N 345.443 1.398 10 10 EDCE O=C(Cn1ccnc1)NCc1ccc(N2CCC(CO)CC2)cc1 746279945 KUVNHFYGKMBORI-UHFFFAOYSA-N 328.416 1.408 10 10 EDCE Cn1ccnc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 840932798 WWLHPXMQLZRRMC-UHFFFAOYSA-N 336.342 1.465 10 10 EDCE CS(=O)(=O)c1ccnc(NCc2ccc(N3CCOCC3)cc2)n1 911750358 ICKOHUPOFWRWIW-UHFFFAOYSA-N 348.428 1.329 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CNCC3(CCOCC3)C2)c1 925793840 SHWDVZJSYLJOII-DZGCQCFKSA-N 348.443 1.988 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC(=O)N(C)C[C@H]3C)C2)cc1 852451163 FFGIMQNVMQXMNY-ZIAGYGMSSA-N 346.431 1.146 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C3(C(=O)NC4CC4)CC3)C2)cc1 855231043 SNUAYPNGZHRUDJ-AWEZNQCLSA-N 343.427 1.449 10 10 EDCE CCO[C@H](CNC(=O)N(C)Cc1ccc(N(C)C)cc1)CN(C)C 926823911 VJCVLQCJQIMIPC-QGZVFWFLSA-N 336.480 1.861 10 10 EDCE CS(=O)(=O)c1ccccc1S(=O)(=O)NCc1ccccc1O 751150326 BVQMPUWVKFGIQA-UHFFFAOYSA-N 341.410 1.274 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](O)c3ccco3)C2)cc1 854301189 KMQFGOYSKYXRNH-BBRMVZONSA-N 345.399 1.900 10 10 EDCE CN(C)c1cc(F)c(CNC[C@]2(OCCO)CCOC2)cc1F 858188491 UNVSHQOPEUNKPF-MRXNPFEDSA-N 330.375 1.288 10 10 EDCE CCN1C[C@H](S(=O)(=O)NCCCSc2nccs2)CC1=O 866781453 KIEGCACDPHIFFW-SNVBAGLBSA-N 349.503 1.166 10 10 EDCE O=C(Nc1cccc2c1CCNC2)C(=O)N1Cc2cccc(O)c2C1 868300122 SBZYLYWPZJMULO-UHFFFAOYSA-N 337.379 1.519 10 10 EDCE COc1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)nn1C 773221023 YYCPJIYKFKQHHF-UHFFFAOYSA-N 345.403 1.092 10 10 EDCE O=C(CCCS(=O)(=O)N1CCCC1)N1Cc2cccc(O)c2C1 871200792 IZUFFASHOQRTAS-UHFFFAOYSA-N 338.429 1.440 10 10 EDCE CCOC(=O)[C@@]1(C)CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCO1 871224280 HAFNUJJEQCLNKQ-QQOXCAACSA-N 335.356 1.292 10 10 EDCE C[C@@H](O)c1ccc(N(C)C[C@@H](O)CN(C)C)c(Br)c1 690318634 WGRLLXLNSYNQHS-PWSUYJOCSA-N 331.254 1.861 10 10 EDCE CCc1noc(C)c1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774363037 HKYYWBJUBKNSDQ-UHFFFAOYSA-N 333.344 1.254 10 10 EDCE O=C(NC[C@@H](CO)[C@H]1CCOC1)c1cc2cc(O)c(O)cc2s1 897633128 ZLHDIVQKMICHPX-ONGXEEELSA-N 337.397 1.687 10 10 EDCE CN(C(=O)c1cc2cc(O)c(O)cc2s1)[C@H]1CCS(=O)(=O)C1 895483032 MYPMLWSTUWQINZ-VIFPVBQESA-N 341.410 1.572 10 10 EDCE C[C@@H](N)c1ccc(N2CCC(CO)(CO)C2)cc1Br 694722583 JDLDEDFTJRHMJU-SNVBAGLBSA-N 329.238 1.650 10 10 EDCE CC[C@H](NC(C)=O)C(=O)N[C@H]1C[C@H](NCc2ccc(OC)c(C)c2)C1 1317087766 LRGVNEOGENQSGB-ULQDDVLXSA-N 347.459 1.655 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1C[C@H]1C1CC1 1327621321 QMXPMORIPAZIOE-DLBZAZTESA-N 327.428 1.818 10 10 EDCE C[C@@H](O)[C@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CCO1 1326050963 OSFQLUSMUCGTHD-RDTXWAMCSA-N 337.439 1.159 10 10 EDCE Oc1ccc(Br)cc1CN[C@@]12CC[C@@H](C1)[C@@H](O)[C@H]2O 2120389883 XGGWOFUYXCWYJK-IYMWITQMSA-N 328.206 1.519 10 10 EDCE CC1(C)C[C@H](O)[C@H](O)CN1c1ccc(CO)c(Br)c1 2132172312 JFGJIYGVVAEOLG-QWHCGFSZSA-N 330.222 1.652 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3cc4c(cc3O)CCC4)C[C@@H]12 1261655991 MCUUVLIVAYLITQ-UAGQMJEPSA-N 337.441 1.125 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)CN2CCOCC2)cc1C 1272728844 JRLMEBDEVROBKG-MRXNPFEDSA-N 349.475 1.320 10 10 EDCE CCOC(=O)c1csc(CNC(=O)Cc2ccc(O)c(O)c2)n1 1443447996 RESWSRGZMHAKSF-UHFFFAOYSA-N 336.369 1.590 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)C(C)(C)F)cc1C 1284377211 YFAYUKSJAHNFHY-CQSZACIVSA-N 326.412 1.661 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2nc(O)[nH]c2n1 1296247646 WHJVTPQKBWXBMF-MRVPVSSYSA-N 328.328 1.436 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(NCc2cc(F)ccc2O)C1 1918436033 ZOIVBPAXAIUGEN-UHFFFAOYSA-N 326.368 1.603 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)Cc2cnc[nH]2)cc1C 1700768954 SSAZHDZIQXAUNO-AWEZNQCLSA-N 330.432 1.906 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CC1([S@@](C)=O)CC1 1707861602 OTLFBBRZLSHDHW-HSZRJFAPSA-N 334.445 1.840 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CC(=O)NCC(F)(F)F 1627026333 DFQKWVGCHPJUDP-UHFFFAOYSA-N 339.310 1.563 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CCOCC3)c(Br)cc21 118589727 KYKOXVZZDCKYMG-GFCCVEGCSA-N 326.194 1.498 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CCN(C)CC3)c(Br)cc21 118711170 HAPMQZBVIHODEV-CYBMUJFWSA-N 339.237 1.414 10 10 EDCE CC[C@@H](C)C(=O)NCCN(C)Cc1nnnn1-c1ccc(OC)cc1 1492194143 IGTTVLGWQIODNP-CYBMUJFWSA-N 346.435 1.265 10 10 EDCE Cc1c(C(=O)NCc2cccc(O)c2O)cnn1-c1ccc(O)nn1 1637035972 YBIBILDKHSIPTL-UHFFFAOYSA-N 341.327 1.018 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H](n1cncn1)C(F)(F)F 1632049097 XHDYODABSVMNIQ-KMOQFTEPSA-N 342.277 1.622 10 10 EDCE CN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CCN2CCO[C@H]1C2 1641313984 NLBNYINPKAVPIG-KBPBESRZSA-N 331.376 1.394 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NCc2cc(O)ccc2O)C1 1643881801 GDYUQNCLRQBMRK-ZDUSSCGKSA-N 348.399 1.971 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)c2cnc(O)n2C)cc1C 1649457593 XKNQGFBAYVNWSX-ZDUSSCGKSA-N 346.431 1.741 10 10 EDCE COC(=O)c1cnc(CNC(=O)NCc2c(O)cccc2F)s1 1685311960 JLKIPNUWKHOYHI-UHFFFAOYSA-N 339.348 1.774 10 10 EDCE CC[C@@H](CNC(=O)[C@]1(C)CCNC1=O)NCc1ccc(OC)c(C)c1 1698612240 ICIUWNAHGXLQBA-HNAYVOBHSA-N 347.459 1.514 10 10 EDCE COc1cc(/C=C2/SC(=S)N(C[C@@H](C)O)C2=O)ccc1O 1858587191 WPCWGGFCMFPCHE-OPYOOOJUSA-N 325.411 1.983 10 10 EDCE CCOc1cccc(CNCCC(=O)NCCCn2ccnc2)c1O 1857859747 DPUVJGBTDULLOI-UHFFFAOYSA-N 346.431 1.674 10 10 EDCE O=C(N[C@H](COCc1ccccc1)C(=O)O)c1ccc(O)c(O)c1 1946562567 WZRQGRWYCQKYBA-CYBMUJFWSA-N 331.324 1.498 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N(C)[C@H](C)CO)c(Br)cc21 252815865 VUOQSXIQSJSUAH-OQPBUACISA-N 342.237 1.869 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CC(F)(F)C1 2003171797 BAELQDVNQXLHJH-MGCOHNPYSA-N 346.374 1.945 10 10 EDCE CCCNCc1ccc(N(C)CC(CO)CO)cc1Br 2150414551 GKYHKEAHRYBXLG-UHFFFAOYSA-N 345.281 1.986 10 10 EDCE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)C(=O)Cc1ccc(N)cc1 1999492767 UIYCXHWCFOEHNH-AWEZNQCLSA-N 337.420 1.155 10 10 EDCE CNCCOCCN(C)Cc1cc(Br)cc(F)c1O 715795103 HKJQBHQFADKSEM-UHFFFAOYSA-N 335.217 1.962 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(CO)(OC)C2)c(Br)c1 2101062644 WBOYDMHLQCFVPN-JTQLQIEISA-N 329.238 1.927 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)C[C@@H]1C(=O)NCc1ccc(N)cc1 2080905611 XBXDKHCJUUOUHC-HUUCEWRRSA-N 349.431 1.645 10 10 EDCE CN[C@H](C)c1ccc(N2CC(NC(N)=O)C2)c(Br)c1 2106928096 PXKMDSKXXUWBER-MRVPVSSYSA-N 327.226 1.586 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@H](N(C)C)C2)cc1Br 2089926826 NJKURMXCQGZJMC-FZZIBODNSA-N 329.238 1.614 10 10 EDCE COCCN(Cc1c(Br)ccc(OC)c1O)C1CNC1 2236053140 PWJGPIFXBZZNDE-UHFFFAOYSA-N 345.237 1.584 10 10 EDCE O=C(O)CCN1C(=O)C(=Cc2ccc(O)cc2O)SC1=S 2296880271 ZVKXIPSGDRSVSV-UHFFFAOYSA-N 325.367 1.774 10 10 EDCE CCCCNC=C1C(=O)NC(=O)N(c2ccc(OCC)cc2)C1=O 2297316028 UELVVGGZXGFUHN-UHFFFAOYSA-N 331.372 1.942 10 10 EDCE CCN1C(=O)C(=CNCCc2c[nH]c3ccccc23)C(=O)NC1=S 2297366120 NKGDWKMDZMLXPK-UHFFFAOYSA-N 342.424 1.447 10 10 EDCE CCN1C(=O)NC(=O)C(=Cc2ccc(N3CCOCC3)cc2)C1=O 2313631595 SHZKKRZMDWXRSU-UHFFFAOYSA-N 329.356 1.005 10 10 EDCE CN(NCc1ccc(Br)cc1O)S(=O)(=O)C1CC1 2317453573 XHGAGMGCEOSKCL-UHFFFAOYSA-N 335.223 1.583 10 10 EDCE NCc1ccc(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)c(F)c1Br 2336544886 AIJPDDRWCRHIJC-WCBMZHEXSA-N 349.225 1.280 10 10 EDCE COc1ccc(N2CC([C@@H](O)CO)C2)c(OC)c1Br 2336875650 ZYECSDWMVVROGA-JTQLQIEISA-N 332.194 1.256 10 10 EDCE C[C@@H](N)c1ccc(N2CC3(COC(=O)N3)C2)cc1Br 2351870683 GQKAYDRATACHQJ-MRVPVSSYSA-N 326.194 1.767 10 10 EDCE CN(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCOC1 106537622 YLXXBFRLYLJBRF-AWEZNQCLSA-N 337.395 1.593 10 10 EDCE CN1CCCc2cc(CNC(=O)CSc3nncn3C)ccc21 171030026 QKMMNOVEEVMXGS-UHFFFAOYSA-N 331.445 1.606 10 10 EDCE C[C@H]1CN(C(=O)c2cc(O)c(O)c(O)c2)C[C@@H](C(F)(F)F)N1C 170190638 XEEYSRJJDMBQFF-CPCISQLKSA-N 334.294 1.510 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)cc1Br 2357051978 DWQRSCAAJRNHQH-CNSIFVFBSA-N 342.233 1.965 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)[C@@H]3CCO[C@@H]3C)CC2)cc1 189939999 VEDOVQDPLDNMBP-CZUORRHYSA-N 340.445 1.324 10 10 EDCE CNCc1ccc(N2CC[C@H]3C[C@H]2C(=O)N3C)cc1Br 2360844377 ULCHXQMILITAIG-FZMZJTMJSA-N 338.249 1.978 10 10 EDCE Cn1cnc(Br)c1C(=O)NCCOc1ccc(N)cc1 2362451359 KKQREIIQABCWET-UHFFFAOYSA-N 339.193 1.574 10 10 EDCE CN(C)C(=O)c1cccc(S(=O)(=O)NCCc2ccc(N)cc2)c1 193338375 IFCIUQZSEHDIOM-UHFFFAOYSA-N 347.440 1.492 10 10 EDCE CO[C@H](CN)C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951993724 QSKCJQYPMXKCNN-OLZOCXBDSA-N 340.420 1.897 10 10 EDCE CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NCc1ccccc1O 263646538 BTWIKOBXQFEFIX-OAHLLOKOSA-N 348.447 1.134 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@@H](C(=O)N3CCOCC3)C2)c(O)c1O 370219849 OGBLWSRQCNXOTN-CYBMUJFWSA-N 348.399 1.117 10 10 EDCE Cc1ccc(CN2C[C@H]3C[C@H]2CN3C(N)=O)c(O)c1Br 2380711635 KMIXLKHPLKSAJR-WDEREUQCSA-N 340.221 1.800 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(C)COC[C@@H]2N)c(O)c1Br 2380725245 JDCFXBPXAROPDO-HZMBPMFUSA-N 343.221 1.443 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CCOCCN2)c(O)c1Br 2380755400 APTPGZKGEYENCA-LLVKDONJSA-N 343.221 1.458 10 10 EDCE Cc1ccc(CN2CCC[C@](O)(C(N)=O)C2)c(O)c1Br 2380804333 LESHCHRRBYZEDG-CQSZACIVSA-N 343.221 1.275 10 10 EDCE NCc1cc(F)c(N2CC[C@]3(CNC(=O)C3)C2)cc1Br 2163345242 XNHJEJGZYSGOIS-AWEZNQCLSA-N 342.212 1.763 10 10 EDCE CC(=O)C(=O)COC(=O)c1cccnc1I 808536345 PJRVSQSMXZHZBZ-UHFFFAOYSA-N 333.081 1.001 10 10 EDCE COc1cccc(CNS(=O)(=O)CCOCC2CCC2)c1O 827195291 YHCNACRAIMGWGN-UHFFFAOYSA-N 329.418 1.637 10 10 EDCE CN1CCc2ccc(S(=O)(=O)NCCc3ccc(N)cc3)cc21 842822265 BKPIVYIXWIUPGG-UHFFFAOYSA-N 331.441 1.782 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)NCC[C@@H]1CCNC1 842232089 DKFFHDDACZURPS-HNNXBMFYSA-N 347.459 1.637 10 10 EDCE CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)NCCc1ccc(N)cc1 841960117 VHDOOGQRAXHYQK-HZPDHXFCSA-N 349.431 1.563 10 10 EDCE COCc1n[nH]c(CN[C@@H](C)c2ccc(N3CCOCC3)c(F)c2)n1 850515409 XPJHRLWBSAPAOU-LBPRGKRZSA-N 349.410 1.778 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CN(C(C)=O)CCO2)cc1 929537972 WAYZKHUCOIMNGK-GOSISDBHSA-N 347.459 1.739 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](O)CC(C)C)C2)cc1 854299784 LOFOUEQUTFFQSG-GOEBONIOSA-N 335.448 1.980 10 10 EDCE O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(N2CCC(O)CC2)cc1 856209523 RCUJHZGDZZJZKQ-ZEVQVBBLSA-N 330.428 1.999 10 10 EDCE C[C@H](O)c1ccc(N(C)C[C@@H](O)CN(C)C)c(Br)c1 690318631 WGRLLXLNSYNQHS-JQWIXIFHSA-N 331.254 1.861 10 10 EDCE CCCNC(=O)CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 851921730 ZKYKEVNCVXQAFX-CYBMUJFWSA-N 334.420 1.099 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCCn3cncn3)C2)cc1 851971335 BEUNMIZSURRYIH-AWEZNQCLSA-N 344.419 1.255 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cn(C[C@H]2CCOC2)nn1 858199761 QPNHUFODQLOEMS-OAHLLOKOSA-N 343.431 1.653 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3nocc3C)C2)cc1 850536943 LETWURQDDXETSO-GFCCVEGCSA-N 344.371 1.325 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC[C@]3(O)CCOC3)C2)cc1 852396685 BWLGWPWEQCIEHE-KSSFIOAISA-N 349.431 1.115 10 10 EDCE CCO[C@H](C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCOC1 864470992 UVTXHAAGYPUKSR-QAPCUYQASA-N 348.443 1.785 10 10 EDCE CCN(CC)c1ccc(CNC[C@@]23COCCN2C(=O)OC3)cc1 865768282 ZEKBFAQBWRXCHF-SFHVURJKSA-N 333.432 1.844 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C/Cn3cncn3)CC2)cc1 899940842 XXTAPPMXWBATKU-NSCUHMNNSA-N 327.388 1.192 10 10 EDCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2c(Cl)cnn2C)c1 797448346 PNENTHONSGIZTO-MRVPVSSYSA-N 345.808 1.827 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](CO)[C@@H](CO)C2)c(Br)c1 704451148 JDQAIDOBBRKCLH-YUSALJHKSA-N 330.222 1.539 10 10 EDCE CN(C)c1ccc(CN(C(=O)NCc2nc(N)n[nH]2)C2CC2)cc1 1313161781 BKBFQBPOMJGYLB-UHFFFAOYSA-N 329.408 1.327 10 10 EDCE CC[C@H](CNC(=O)[C@H]1CC(=O)N(C)C1)NCc1ccc(OC)c(C)c1 1318531603 VSWJLUFONDDNCH-JKSUJKDBSA-N 347.459 1.466 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)C(C)(C)C(N)=O)cc1C 1321109771 WSFXTZRHLMSUDW-WAYWQWQTSA-N 333.432 1.277 10 10 EDCE CCCC(=O)N[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1352729586 HRUOWYFTICOKDR-CYBMUJFWSA-N 331.376 1.980 10 10 EDCE CCOCC(=O)N[C@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1287646527 MAMMFRKEHHOAPL-LLVKDONJSA-N 349.391 1.462 10 10 EDCE C[C@@H](CS(C)(=O)=O)N(C(=O)Cc1ccc(O)c(O)c1)C1CC1 1443946399 NMUFXYVNEJTFGY-JTQLQIEISA-N 327.402 1.064 10 10 EDCE O=C(CN1C(=O)COc2ccccc21)NCc1ccc(O)cc1O 1299571026 OWAWNGYFYZTRQS-UHFFFAOYSA-N 328.324 1.140 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2nc(O)[nH]c2n1 1296247678 WHJVTPQKBWXBMF-QMMMGPOBSA-N 328.328 1.436 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@@](C)(O)C2)c(Br)c1 2136835875 ZSOHQAGAQZGDCM-HERUPUMHSA-N 329.238 1.791 10 10 EDCE Cc1ccc(S(N)(=O)=O)c(C(=O)N[C@@H](C)c2ccccc2O)c1 1557968236 VIBCYYVTEDYEDZ-NSHDSACASA-N 334.397 1.839 10 10 EDCE Cc1cccc([C@H](CC(=O)NCc2ccc(O)cc2O)NC(N)=O)c1 1557084636 ICEJFLJSYJTCEW-HNNXBMFYSA-N 343.383 1.822 10 10 EDCE CC[C@@H](O)Cn1cc(C(=O)N[C@@H](C)c2cc(OC)ccc2O)nn1 1631541854 BIPMSECINYYIDR-WDEREUQCSA-N 334.376 1.254 10 10 EDCE CC(C)C(=O)N(C)C[C@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1739025176 BRPNWRVQJLZSRP-CYBMUJFWSA-N 349.391 1.054 10 10 EDCE Cc1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1S(N)(=O)=O 1644088423 UKRCOEIMLDRIHP-UHFFFAOYSA-N 332.381 1.504 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2cnc(O)n2C)cc1C 1649457592 XKNQGFBAYVNWSX-CYBMUJFWSA-N 346.431 1.741 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cnc(-c2ncccn2)s1 1651173376 ZBJFJSGVTPUHOO-UHFFFAOYSA-N 328.353 1.941 10 10 EDCE O=C(NCc1cnn(CC(F)(F)F)c1)c1c(F)ccc(O)c1O 1654406160 NYCRWQWXOVIZSP-UHFFFAOYSA-N 333.241 1.926 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2cnn(C)n2)cc1C 1668245022 YBCDKRIIUGPLCP-CYBMUJFWSA-N 331.420 1.430 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)N1CC[C@H](N=[N+]=[N-])C1 1985100259 DKDRHQDTKOOTKQ-WDEREUQCSA-N 327.385 1.827 10 10 EDCE CNCc1ccc(N2CC[C@@H](N3CC(O)C3)C2)cc1Br 2158750029 AGAHVKKAVWYHOZ-CYBMUJFWSA-N 340.265 1.424 10 10 EDCE CN(C)CCN(CC(=O)N1CC[C@H](N=[N+]=[N-])C1)C(=O)OC(C)(C)C 2010393405 RWNVUSPYPREVRS-LBPRGKRZSA-N 340.428 1.696 10 10 EDCE C[C@@H]1CNCCN1S(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 2162244012 GGZKEBNYTZKEPH-SSDOTTSWSA-N 340.232 1.649 10 10 EDCE CCN(CCN(C)C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 708427898 TZIACTZUUPNKSH-ZDUSSCGKSA-N 342.237 1.823 10 10 EDCE Nc1ccc(N2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1Br 379102628 PHLPXCSTTIBHMQ-DDHJBXDOSA-N 337.173 1.698 10 10 EDCE C[C@@]1(CO)CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 381807991 VBBGOCZQKIGGMY-GXTWGEPZSA-N 340.221 1.610 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N3C[C@@H](O)[C@H]3C)c(Br)cc21 2182523002 JMUPSLVPABZBNA-BLBGDKDGSA-N 340.221 1.621 10 10 EDCE [N-]=[N+]=NCCNC1(C(=O)O)[C@H]2COC[C@H]1CN(Cc1ccccc1)C2 2048815001 HINVFHBRQWMOKH-HUUCEWRRSA-N 345.403 1.488 10 10 EDCE N[C@@H](Cc1ccccc1Br)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2237432056 QMLVKZUIIWCDDB-GAFUQQFSSA-N 339.233 1.585 10 10 EDCE CNCc1ccc(N2C[C@H]3CCO[C@@]3(CO)C2)cc1Br 2239802438 YMBKIDYUELADCP-IUODEOHRSA-N 341.249 1.756 10 10 EDCE NCc1cc(F)c(N2CCC[C@H]3CNC(=O)[C@@H]32)cc1Br 2279274695 ILYGOOXBKCCPRZ-ISVAXAHUSA-N 342.212 1.762 10 10 EDCE O=C(O)C1CN(C2CN(Cc3cc(Br)ccc3O)C2)C1 2284239263 VNJBXFHVCSSMSF-UHFFFAOYSA-N 341.205 1.355 10 10 EDCE CC(C)(C)[C@@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)C(N)=O 2297526564 CFMGYKXUWMSPHQ-KRWDZBQOSA-N 345.443 1.553 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CC[C@H](CN2CCOCC2)C1 2307987884 ROBVHDHJPWZURK-OAHLLOKOSA-N 332.400 1.292 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)NCCCCN1CCC[C@H]1CO 2308001986 KNFJRPALKSWPRZ-HNNXBMFYSA-N 334.416 1.464 10 10 EDCE Cc1ccc(CNC(=O)[C@]23CNC[C@H]2C3)c(O)c1Br 2352642094 ASVTTZXUTIHSLQ-QMTHXVAHSA-N 325.206 1.689 10 10 EDCE Cc1ccc(CN2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(O)c1Br 2352685765 GRAFMKXBAITUOD-ZNIXKSQXSA-N 328.206 1.389 10 10 EDCE CC(C)NC(=O)CSc1nc(-c2ccco2)nc2cc(=O)[nH]n12 21537500 YHZSTBIQHKCZNR-UHFFFAOYSA-N 333.373 1.294 10 10 EDCE CCN(C)C[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 301636500 XABBPZOQVJWHPC-LLVKDONJSA-N 334.376 1.704 10 10 EDCE Cc1cc(C(=O)N2CC(NC(=O)C3CC3)C2)c(C)n1-c1ccccn1 189500331 LWYRDQITNNZZPI-UHFFFAOYSA-N 338.411 1.840 10 10 EDCE CNC(=O)CN(C)c1ccc(/C=C\C(=O)O)c(Br)c1 311267904 JVULBXCEOYLULM-XQRVVYSFSA-N 327.178 1.729 10 10 EDCE COC(=O)[C@@H]1C[C@@H](O)CN1Cc1cc(Br)cc(C)c1O 187570145 GCCQTWGJIAPRJZ-NEPJUHHUSA-N 344.205 1.571 10 10 EDCE O=C(O)[C@H]1CCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 606441089 DNYGMUALMMAMFW-KQQSKNTNSA-N 330.384 1.612 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CC[C@@](O)(C(F)(F)F)C2)c1O 278305030 WGZQWYPITDSFGT-LBPRGKRZSA-N 336.266 1.808 10 10 EDCE Cc1ccc(CN(C)C(=O)CC[C@@H](O)CN)c(O)c1Br 2380761718 IRVYCXKKLDHPAM-LLVKDONJSA-N 345.237 1.521 10 10 EDCE CCCNCc1ccc(N2CC(NC(N)=O)C2)cc1Br 2163217110 QROWZKHLQBWGDO-UHFFFAOYSA-N 341.253 1.806 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1COc2ccc(Br)cc21 808530996 HZIALOLBCJJQNK-JTQLQIEISA-N 327.130 1.626 10 10 EDCE COC(=O)c1cnc(SCC(=O)N2CCOC[C@@H]2C2CC2)s1 829681193 PXMVZTOXWJXEJK-SNVBAGLBSA-N 342.442 1.659 10 10 EDCE COC(=O)/C(C)=C\CNC(=O)NCc1ccc(N2CCOCC2)cc1 914335460 HFFGZJDRGQOJKE-AUWJEWJLSA-N 347.415 1.442 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1CCCCNC1)c1ccc(N(C)C)cc1 842203913 YNRWVCGSNNMESE-DZGCQCFKSA-N 332.448 1.188 10 10 EDCE C[C@H]1C(=O)N(CCN(C)C)CN1C/C=C/c1ccc(N(C)C)cc1 843429428 VNGAXGLKUBJMED-MOEXGYKKSA-N 330.476 1.818 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CCc3nnn(C)c3C2)c1 927145919 MCQRCPBOIPXKBL-CMPLNLGQSA-N 330.388 1.515 10 10 EDCE CC[C@@H](OC)C(=O)NCc1cc(NC(=O)[C@@H](CC)OC)ccc1O 923124147 TWPRPHKIMUIUTF-HUUCEWRRSA-N 338.404 1.797 10 10 EDCE NCC(F)(F)CC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852869086 UIDNSRSRVQHYQF-UHFFFAOYSA-N 327.375 1.248 10 10 EDCE CCC1(CNC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)COC1 852372489 CFBFAMNFMBLLTB-CQSZACIVSA-N 333.432 2.000 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCCNC3CC3)C2)cc1 851662026 RWVQHGREBCTVBW-HNNXBMFYSA-N 332.448 1.715 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)CCCN(C)C)C2)cc1 854299183 MPTRBZHNTMHZCI-HNNXBMFYSA-N 334.464 1.867 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCc3nccc(N)c3C2)cc1 931511644 CTNUTWSBDTWTLR-UHFFFAOYSA-N 339.443 1.404 10 10 EDCE O=C(CCCCO)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 867152279 AATXUZUACFYCHN-UHFFFAOYSA-N 345.487 1.997 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@H](C4OCCO4)C3)cc2N1 761888741 GEBCRXMAIHKCOR-JTQLQIEISA-N 349.343 1.515 10 10 EDCE NCCN(Cc1ccccc1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1119037218 QBZANSQWJZOLOI-UHFFFAOYSA-N 339.395 1.222 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H](Cc3cncs3)C2=O)cc1 871893608 CRDQCNAEMWIHPX-AWEZNQCLSA-N 330.413 1.872 10 10 EDCE CCn1nc(C)cc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 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1.882 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 2080576710 BKSJBDLMFPHOLJ-CABCVRRESA-N 349.431 1.598 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)cc1Br 2102176377 BUMZANOQOZZGSP-DVXMNORISA-N 328.206 1.698 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@@]2(CO)CO3)cc1Br 2094647815 ZGMYVJXVHCXYDL-DRCTWCGVSA-N 327.222 1.809 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2210541434 QISIQDSDWPIREE-AXFHLTTASA-N 327.385 1.874 10 10 EDCE CC(C)(C)OC(=O)N[C@H](COc1nnc(=N)[nH]n1)CC1CCCC1 2213786046 SYBGPXQEUUVWMN-NSHDSACASA-N 338.412 1.532 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H](N)C[C@H](O)C2)c1O 2227749528 DFXGZCWTPBFWLM-IUCAKERBSA-N 331.210 1.057 10 10 EDCE COc1ccc(Br)c(CNC[C@@]2(C)CC(=O)N2)c1O 2227750175 IOYVMFVWGWNDQO-CYBMUJFWSA-N 329.194 1.532 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)c(F)c1Br 2355335294 ZACMVFHHEMOBKY-XVVMBKRBSA-N 345.212 1.367 10 10 EDCE CN1CCN(C(=O)c2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 175370694 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UVJFHMGPAUAFCN-HIFRSBDPSA-N 347.415 1.937 10 10 EDCE COc1cc(Br)ccc1[C@H](NCCN=[N+]=[N-])C(N)=O 2109266558 IRWFMJWUPLWRIX-JTQLQIEISA-N 328.170 1.884 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2225798910 IJCLBQVGKAQAQM-HTQZYQBOSA-N 349.214 1.692 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2C[C@H](O)[C@H](OC)C2)c1O 2236052420 HFYBABHAEWEUQM-YDEJPDAXSA-N 346.221 1.791 10 10 EDCE C[C@H](C(=O)O)N1C(=O)C(=C2C(=O)Nc3ccccc32)SC1=S 2293188539 SQTWVYNREXHISB-ZCFIWIBFSA-N 334.378 1.683 10 10 EDCE CN(Cc1ccccc1)C(=O)CNC(=O)C=Cc1ccc(O)c(O)c1 2307996685 IIDGMNGVMMKKAR-UHFFFAOYSA-N 340.379 1.886 10 10 EDCE COC[C@H](N)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2352670362 INKUVQMKMFKHMN-JTQLQIEISA-N 331.210 1.395 10 10 EDCE COC(=O)[C@H]1C[C@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 171383636 JYHYAEHJWXJITF-CABCVRRESA-N 334.441 1.665 10 10 EDCE CC(C)(C)OC(=O)N(CCN)C(=O)Nc1cc(O)c(O)c(O)c1 217279014 DVZOYEYNFFICKV-UHFFFAOYSA-N 327.337 1.531 10 10 EDCE CCc1c(C(=O)NCc2cc(OC)ccc2O)[nH]c(C)c1C(N)=O 133598322 VHSJPWIMSRPUOR-UHFFFAOYSA-N 331.372 1.629 10 10 EDCE Nc1ccc(CCNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])cc1 193338550 UOQQCHTUHYGXCD-UHFFFAOYSA-N 339.348 1.837 10 10 EDCE CCCN(C)S(=O)(=O)Nc1ccc(NS(=O)(=O)CC)c(C)c1 268744704 AADZDAUTNPUDCR-UHFFFAOYSA-N 349.478 1.755 10 10 EDCE CNC(=O)[C@@]1(C)CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])C1 281987287 NDOLYSJKZAKFOE-UABRLCRWSA-N 347.371 1.743 10 10 EDCE CC(=O)C(=O)COC(=O)c1csc(I)c1 808515123 AYIWTWYYNDIXIQ-UHFFFAOYSA-N 338.122 1.668 10 10 EDCE CN(C)CCN(CCN(C)C)Cc1ccc(N2CCOCC2)cc1 809740888 FAHYGLOLHFEICI-UHFFFAOYSA-N 334.508 1.448 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CCC[C@H](CO)C1 298249533 MVAPPRRDDLQYKS-IRXDYDNUSA-N 347.459 1.874 10 10 EDCE CO[C@H](COC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 820301546 IVGQNTXDSOCLPO-CYBMUJFWSA-N 329.374 1.346 10 10 EDCE CC(C)(C(=O)NCc1ccc(N2CCOCC2)cc1)n1cccn1 823291307 FFRNPJHWFJHGOW-UHFFFAOYSA-N 328.416 1.771 10 10 EDCE CN1CCC2(CC1)CN(C(=O)NCc1ccc(N(C)C)cc1)CCO2 825602612 LGEBSWFGLDYSCI-UHFFFAOYSA-N 346.475 1.759 10 10 EDCE COc1cccc(CNC(=O)Nc2cnn(CCN(C)C)c2)c1O 747558794 YASICXXQFWGZEH-UHFFFAOYSA-N 333.392 1.481 10 10 EDCE CCN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1ccc(C)cc1 914761322 RNVZERNQADGYCC-DHZHZOJOSA-N 327.384 1.459 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cc3cncc(O)c3)C2)cc1 855226950 REJAKUBJRSWRER-AWEZNQCLSA-N 327.384 1.733 10 10 EDCE Cc1cn(C)nc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 850415690 PFEXZJVZHFUAGY-LBPRGKRZSA-N 329.404 1.610 10 10 EDCE COC(=O)c1cc(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)c(C)o1 852792052 PRIQWGMFZMHHFX-OAHLLOKOSA-N 345.399 1.870 10 10 EDCE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@@H]1c1cc(N)ccc1O 1953067066 XNJNHZWNHYCWEW-GFCCVEGCSA-N 342.417 1.681 10 10 EDCE CCN(CC)c1ccc(CNC(=O)c2cnn3c(=O)cc[nH]c23)cc1 857001972 ADBPBWRRCHDATR-UHFFFAOYSA-N 339.399 1.799 10 10 EDCE NC(=O)[C@@H](F)C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 931218616 DWHMNPWMTBIAGM-KRWDZBQOSA-N 335.423 1.559 10 10 EDCE O=S(=O)(c1ccc2c(c1)OCCO2)N1Cc2cccc(O)c2C1 867688878 GJOXMHVQIOIJLN-UHFFFAOYSA-N 333.365 1.868 10 10 EDCE Cc1cc(Br)cc(CN2CCn3c(O)nnc3C2)c1O 776520913 IFHONGLKGWUMDB-UHFFFAOYSA-N 339.193 1.776 10 10 EDCE COc1ccc(COCCNC(=O)Cc2ccc(O)c(O)c2)cc1 1137890465 JGPDIJSSNPZIMQ-UHFFFAOYSA-N 331.368 1.982 10 10 EDCE O=C(NC1CC(N2CCOCC2)C1)c1cc2cc(O)c(O)cc2s1 898094743 SMASTHRMEDNGDI-UHFFFAOYSA-N 348.424 1.906 10 10 EDCE Cc1cc(CN2CC[C@@H](CNS(C)(=O)=O)C2)ccc1N(C)C 1308059840 PCMRNQDFDZOJTJ-HNNXBMFYSA-N 325.478 1.432 10 10 EDCE CC1=C(C(=O)NCc2cccc(O)c2O)[C@@H](C)n2ncnc2N1C 1303195046 OULMOSXICFXNLU-SNVBAGLBSA-N 329.360 1.291 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C[C@H](C)NC(N)=O)cc1C 1317240802 IPMRDCGJLALBDG-QWHCGFSZSA-N 336.436 1.045 10 10 EDCE CCOC(=O)[C@H](c1cccnc1)N(C)C(=O)Cc1ccc(O)c(O)c1 1177685025 DNJHAHAUVRVCFZ-KRWDZBQOSA-N 344.367 1.798 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cc(C(N)=O)c[nH]2)cc1C 1317281924 RCNMUVWFYZOARP-GFCCVEGCSA-N 344.415 1.339 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N[C@@H]2CC[C@@H]3[C@H](C2)C3(F)F)cc1 1333544591 WVFSJMRFHHQBBV-MCIONIFRSA-N 337.370 1.478 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)C(N)=O)C2CCCCC2)cc1C 1268120148 NBCXLNDUYWZUGR-INIZCTEOSA-N 347.459 1.644 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@H]3CC[C@@H](C(N)=O)C3)CC2)cc1 1455934912 VYUYMRBMTOIADL-KGLIPLIRSA-N 345.443 1.682 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](O)C[C@H]2CO)cc1Br 2136081169 BBTBFOBAGBKRHJ-ZMLRMANQSA-N 330.222 1.824 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CC(=O)N(C2CCCCC2)C1 1622936047 MZDQFYCIYKQBRD-CYBMUJFWSA-N 332.400 1.690 10 10 EDCE COc1cc(N(C)CC(=O)NCc2ccco2)c([N+](=O)[O-])cc1OC 1559146422 DIHVAQCDGQNKKP-UHFFFAOYSA-N 349.343 1.958 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)[C@@H](O)CC 1632356655 TVIQWLPIJCXICV-DRZSPHRISA-N 339.388 1.095 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cc2n(n1)CCC[C@@H]2O 1639625098 XICGXCVGSLQIDT-HNNXBMFYSA-N 338.367 1.894 10 10 EDCE Cc1nc2nc(N)nn2c(C)c1CC(=O)NCc1c(O)cccc1F 1649076244 RBTGHXINBDOATD-UHFFFAOYSA-N 344.350 1.027 10 10 EDCE NC(=O)[C@]1(c2ccccc2)CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1642832444 YKHDVGYQFCDLHV-LJQANCHMSA-N 340.379 1.296 10 10 EDCE C[C@@](O)(CO)[C@@H]1CCN(c2ccc(CO)cc2Br)C1 2138090710 BHKUSXUXRXAGLM-BXUZGUMPSA-N 330.222 1.511 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccsc2)cc1C 1676499311 LCFALBLLZCQFGI-OAHLLOKOSA-N 334.441 1.946 10 10 EDCE CCCn1c([C@H]2CCC(=O)N2)nnc1N(C)Cc1ccccc1O 1766054504 OOKJPYRWUWHMSW-CYBMUJFWSA-N 329.404 1.981 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)/C(=C\c2ccc(Cl)cc2)SC1=S 1858596557 WEPWHLZSRMKRFC-UMYFRRCYSA-N 343.813 1.987 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1NCc1cccc(O)c1O 1943955758 UFBKMNZGEBSXME-OLZOCXBDSA-N 338.404 1.870 10 10 EDCE CC(=O)C(=O)[C@]1(O)COC2(CCN(C(=O)OC(C)(C)C)CC2)C1 1981626220 IOPUHVYOSZBVNE-MRXNPFEDSA-N 327.377 1.066 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]1(O)CCCN(C(=O)OC(C)(C)C)C1 1986144736 RDRDGWRKWWFYRS-AWEZNQCLSA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1986368355 FLHQPYROJDYEOF-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)Cc2ccc(N)cc2)CCO1 1999142750 FJISYCVXJCURIB-AWEZNQCLSA-N 335.404 1.869 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@]2(COCCN2CCN=[N+]=[N-])C1 2006177592 SJYOWIWRRPUYLD-HNNXBMFYSA-N 341.412 1.635 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNCc2ccc(O)c(O)c2)C1 702793881 ZCPNIDQESIXHMN-IUODEOHRSA-N 338.404 1.415 10 10 EDCE COCCOC1CN(c2ccc(CN)c(Br)c2F)C1 707662551 LHBKDOMPWAYCEG-UHFFFAOYSA-N 333.201 1.899 10 10 EDCE CN(c1ccc(CN)cc1Br)C1CC(S(C)(=O)=O)C1 716151749 GFUJPLWMZREMQJ-UHFFFAOYSA-N 347.278 1.920 10 10 EDCE CNC(=O)[C@H]1[C@@H](C)CCN1c1ccc(CN)c(Br)c1 2090258871 LVUMLAOHOPDOBI-TVQRCGJNSA-N 326.238 1.869 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)C(=O)C1(Br)CC1 2111900423 KQCDXBBRXXIKNQ-UHFFFAOYSA-N 326.194 1.010 10 10 EDCE CC(C)N1CCN(c2ccc(CO)c(Br)c2)CC1=O 2114173194 QBGABPFMIKWEMO-UHFFFAOYSA-N 327.222 1.998 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3COC[C@@]3(CO)C2)cc1Br 2234550367 CCSYKJBMRJVFOC-PGUXBMHVSA-N 341.249 1.914 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2C[C@@H](O)C[C@@H]2O)c1O 2227748443 AJNOJWXDUWJFJE-ONOSFVFSSA-N 332.194 1.137 10 10 EDCE COc1cc(N)c(N2CCC(NC(=O)C(F)(F)F)CC2)cc1OC 2258233992 SUKLOYLLRBUECX-UHFFFAOYSA-N 347.337 1.933 10 10 EDCE O=C1CCC2(CN1)CN(c1ccc(CO)c(Br)c1)C2 2265525654 IWBUFQDNAAXQDG-UHFFFAOYSA-N 325.206 1.658 10 10 EDCE Cc1ccccc1N1C(=O)NC(=O)C(=CNN2CCCCC2)C1=O 2296932788 MIPUSYWMDXBNBY-UHFFFAOYSA-N 328.372 1.452 10 10 EDCE COC(CNC(=O)C(=O)N(c1ccccc1)c1ccc(N)cc1)OC 170388849 RAAVYGGNPFGOPY-UHFFFAOYSA-N 343.383 1.669 10 10 EDCE COC(=O)C[C@H](N)c1ccc(I)c(N)c1O 309274065 FUDIAOQDSWPBGY-ZETCQYMHSA-N 336.129 1.142 10 10 EDCE COc1ccc(N2CCN(C(=O)CC(=O)NC(C)(C)C)CC2)cc1 244261440 WMUXDRQALDASHI-UHFFFAOYSA-N 333.432 1.649 10 10 EDCE Cc1ccc(CN(C)C(=O)Cn2cnnn2)c(O)c1Br 2380773732 QPLBZDDBRHRQRZ-UHFFFAOYSA-N 340.181 1.108 10 10 EDCE Cc1ccc(CN2CCO[C@@H]3[C@@H](C(=O)O)[C@@H]32)c(O)c1Br 2380809858 CXYGGCFEOVPORZ-XHVZSJERSA-N 342.189 1.747 10 10 EDCE COc1ccc([C@H]2[C@H](C(=O)OCC(=O)C(C)=O)CCC(=O)N2C)cc1 808518258 FESMHEDZODCCTP-PBHICJAKSA-N 347.367 1.306 10 10 EDCE Nc1ccc(Br)c([C@H](C(F)F)N2CCNCC2)c1O 575274029 ANKNNFDLBVWINJ-SNVBAGLBSA-N 336.180 1.948 10 10 EDCE CC[C@@H](NC/C=C\c1ccc(N(C)C)cc1)C(=O)N1CCOCC1 835044404 ZREYEVAOYIYVIO-OOFWQKGWSA-N 331.460 1.993 10 10 EDCE C[C@@]1(C(=O)NCc2c(O)ccc3c2CCCC3)CCCS1(=O)=O 907059585 JNRKUDSXBWTBCU-KRWDZBQOSA-N 337.441 1.855 10 10 EDCE CC(C)[C@@H](N)CNC(=O)NCc1cc(Br)ccc1O 841942737 AICRTFKUUNBHHS-NSHDSACASA-N 330.226 1.937 10 10 EDCE CC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCCCO1 848930533 UWFKATTVLBIHGB-IRXDYDNUSA-N 347.459 1.833 10 10 EDCE CCOC1(CS(=O)(=O)N(C)Cc2ccccc2O)CCOCC1 859004119 HAZRLOLQQGGHTD-UHFFFAOYSA-N 343.445 1.740 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC(CN3CCNC3=O)CC2)c1O 933590007 USOFTDKBPVSXLY-UHFFFAOYSA-N 349.406 1.971 10 10 EDCE Cc1nc(N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)n[nH]1 931631043 FDELLHIWGMAZTI-UHFFFAOYSA-N 342.447 1.272 10 10 EDCE COc1ccc(N2CCN(C(=O)Cn3cncc3C)CC2)c(OC)c1 870166826 VQJXZMNRXZGJFD-UHFFFAOYSA-N 344.415 1.558 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)NCc1ccc(N(CC)CC)c(F)c1 773960947 YWDRYEDFPBSULE-OAHLLOKOSA-N 340.395 1.602 10 10 EDCE CN(C)c1ccc(CN2CC(S(=O)(=O)NC3CCCC3)C2)cc1 781921693 UXPCSLARUSCFOG-UHFFFAOYSA-N 337.489 1.799 10 10 EDCE CN(Cc1ncnn1C)c1ccc(CN)c(Br)c1F 707603372 DLWWRUKRXWMMLO-UHFFFAOYSA-N 328.189 1.812 10 10 EDCE Cn1cnc(S(=O)(=O)NCc2cc(Br)ccc2O)c1 796191153 PBELVRHKQPNGLG-UHFFFAOYSA-N 346.206 1.367 10 10 EDCE COc1nsc([C@@H](NCCCN=[N+]=[N-])C(N)=O)c1Br 690071159 ZEUSHDZUIHHULL-ZCFIWIBFSA-N 349.214 1.731 10 10 EDCE COc1ccc(CN[C@@H]2CCO[C@@H]2C(=O)O)cc1Cn1cccn1 1353915775 MREINECPPUKGAK-ZBFHGGJFSA-N 331.372 1.272 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](O)C[C@H]2CO)c(Br)c1 2136084255 ZVGPQEIQFOHTKU-ADEWGFFLSA-N 330.222 1.824 10 10 EDCE NC(=O)c1cccc(OCCC(=O)NCc2c(O)cccc2F)c1 1456029483 NYNHNTAEIPINSH-UHFFFAOYSA-N 332.331 1.716 10 10 EDCE CS(=O)(=O)c1cccnc1C(=O)NCc1cccc(Cl)c1O 1457037405 QXTDPRAUHIDBIX-UHFFFAOYSA-N 340.788 1.774 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2cn(CC(=O)OC(C)(C)C)nn2)c1 1470258428 UINPNVVIPHCZLU-UHFFFAOYSA-N 346.387 1.564 10 10 EDCE C[C@H](N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1)C(F)(F)F 1620689184 IYANQSOKCGWJQJ-JTQLQIEISA-N 332.322 1.735 10 10 EDCE C[C@H](NC(=O)c1ccc(CO)nc1)c1ccc(N2CCOCC2)cc1 1626978194 LWESBLNJAXNYEJ-AWEZNQCLSA-N 341.411 1.902 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2ncn(C)n2)cc1C 1716137452 LLAADZSJKVTMLA-CYBMUJFWSA-N 331.420 1.430 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cn(-c2cccnc2)nn1 1639625136 ZDHAIZBQYLPMRI-UHFFFAOYSA-N 346.350 1.846 10 10 EDCE COc1coc(C(=O)NCc2ccc3cccnc3c2O)cc1=O 1638573419 WEUZNSAXLNGYNG-UHFFFAOYSA-N 326.308 1.832 10 10 EDCE COC[C@H](C)CC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1736803004 XZFHYBGCXDWLGQ-LLVKDONJSA-N 349.391 1.368 10 10 EDCE COC(=O)c1cc(C2CN(C(=O)c3ccc(C)c(O)c3O)C2)[nH]n1 1647742593 IRYZUEQXFAGSDB-UHFFFAOYSA-N 331.328 1.156 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C2(C)CC=CC2)cc1C 1667880462 CBKQXCYHEJHILG-MRXNPFEDSA-N 332.444 1.927 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C2(C)CCC2)cc(OC)n1 1758786508 QLFMBNTVWSAFLD-LLVKDONJSA-N 335.404 1.524 10 10 EDCE O=C(NCc1ccccc1O)N[C@@H]1CCO[C@H]1c1ccc(O)nc1 1684638298 LMCBOYSEKQMOSJ-CJNGLKHVSA-N 329.356 1.822 10 10 EDCE CCCn1nccc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 153111646 NXMCGYCHCZOWJH-UHFFFAOYSA-N 343.431 1.922 10 10 EDCE Cc1cc(=O)c(OCC(=O)c2ccc(O)c(O)c2)cn1CCC(=O)O 1857914686 OPZLYXMSJUFOPI-UHFFFAOYSA-N 347.323 1.304 10 10 EDCE Oc1c(Br)cccc1CN[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@H]2O 1974158980 WFTXMCCOTOYPFO-VPQRTEOYSA-N 328.206 1.375 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CC(C(=O)C(=O)C[C@H]3C[C@H](N)C3)C2)C1 2003173113 UJQFJNAHZVRCBK-AULYBMBSSA-N 336.432 1.899 10 10 EDCE C[C@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003168959 YENLLBFTHDLUPE-HKUMRIAESA-N 340.420 1.276 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)Nc2ccc(N)cc2)C[C@@H](O)C1 2022857836 NFOKXZXRBWCLBH-SMDDNHRTSA-N 335.404 1.825 10 10 EDCE O=C(O)[C@]12COC[C@@H]1CN(Cc1cc(Br)ccc1O)C2 2160991328 MTVAZYXPDIZIPF-IINYFYTJSA-N 342.189 1.688 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@@H]2O 2174415107 XSTITNZOLDXURF-ABNINFQISA-N 342.233 1.622 10 10 EDCE Cc1cc(O)c(CN(C)Cc2nnc3c(=O)n(C)ccn23)cc1C 2063360455 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MDNMCEHPEREWNM-FIXISWKDSA-N 342.233 1.948 10 10 EDCE Cc1cccc(O)c1CNCC(CO)(CO)NC(=O)OC(C)(C)C 2249531326 NCALSTSQLVRFKQ-UHFFFAOYSA-N 340.420 1.038 10 10 EDCE CCN(CC)CCNC=C1C(=O)NC(=S)N(c2ccccc2)C1=O 2296082471 FYGXGBIBTRLTIQ-UHFFFAOYSA-N 346.456 1.250 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)CN1CC(CNC(=O)OC(C)(C)C)C1 2300530300 OGJABUUJSPCWMY-UHFFFAOYSA-N 340.428 1.602 10 10 EDCE Cc1ccc(CN2CCOC[C@H]2C(N)=O)c(O)c1Br 2352950600 VVAZLVXIKOHYFX-JTQLQIEISA-N 329.194 1.149 10 10 EDCE CC(=O)N(C)C1CN(c2cc(Br)c(CN)cc2F)C1 2353349171 OYLZDSOOKWEZAB-UHFFFAOYSA-N 330.201 1.714 10 10 EDCE O=C(O)c1ccc2c(c1)C(=O)c1cc(C(=O)O)c(C(=O)O)cc1C2=O 4314871 VMNYDODLIFMAMS-UHFFFAOYSA-N 340.243 1.557 10 10 EDCE COCCN(Cc1nc(N(C)C)no1)c1ccc(OC)c(OC)c1 192760520 ZGWLDCUROWLXGH-UHFFFAOYSA-N 336.392 1.806 10 10 EDCE CN1C(=O)C(=Cc2c(C3CC3)nc3sccn23)C(=O)N(C)C1=O 91538874 NRFNGYFPZAQNIB-UHFFFAOYSA-N 330.369 1.707 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(CC(F)(F)F)C(=O)C1 286454556 NJHVOWIUXYVATK-DUXPYHPUSA-N 344.289 1.344 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CC[C@@H](O)CN2)c(O)c1Br 2380753039 BNMLIMZJVGLYHZ-MNOVXSKESA-N 343.221 1.192 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@@H](CC(N)=O)C2)c([N+](=O)[O-])c1 808122480 UUBKYAWJXWSZGQ-FHMRSRPSSA-N 333.344 1.483 10 10 EDCE O=C(NCC[C@@H]1CCOC1)C(=O)NCc1ccc(N2CC=CC2)cc1 807292009 RSIVMDNCNGHBQF-MRXNPFEDSA-N 343.427 1.222 10 10 EDCE Cn1cc(N2CC[C@H](NCc3cc(Cl)c(F)cc3O)C2=O)cn1 293499328 BILYMOBRBKWMRO-ZDUSSCGKSA-N 338.770 1.813 10 10 EDCE O=C(COC(=O)[C@@H]1CCCN1CC(F)(F)F)c1ccc(O)c(O)c1 812683963 GTLDDAOISUIEJV-JTQLQIEISA-N 347.289 1.850 10 10 EDCE COC[C@@]1(C(=O)OC)CCCN1Cc1cc(OC)c(OC)cc1O 827488451 HLSXCXVZRGPFKG-QGZVFWFLSA-N 339.388 1.563 10 10 EDCE C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cscn1 826706094 FXVCSWXJLKOFFX-LLVKDONJSA-N 332.429 1.703 10 10 EDCE Cc1cc(C(=O)NCCCc2ncn(C)n2)c(C)n1-c1ccccn1 843975120 NYBCBGFXVUHNIE-UHFFFAOYSA-N 338.415 1.980 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@]1(C)C[C@@H](O)CN1C 910557510 DAVMFXNHABKDOP-POZUXBRTSA-N 333.476 1.563 10 10 EDCE COC[C@H](C[C@@H](N)Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952893597 LPLJOOVKSNVHOW-STQMWFEESA-N 340.420 1.897 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)[C@@H](N)Cc1ccc(O)c(O)c1 1952755767 VQBMVFDTPHXLCN-NWDGAFQWSA-N 326.393 1.507 10 10 EDCE CO[C@@H](CNCc1ccc(N2CCN(C)CC2)cc1)[C@@H]1CCOC1 850341453 AGIWCSOFEGMUKP-MJGOQNOKSA-N 333.476 1.580 10 10 EDCE C[C@H](C(=O)NCc1c(O)cccc1F)N1C(=O)[C@H]2CCCC[C@H]2C1=O 928708224 DYJFUGFZPCKDBB-UTUOFQBUSA-N 348.374 1.711 10 10 EDCE Cc1cc(CNC(=O)CN2CC(=O)NC2=O)c(C)n1-c1ccccc1 863165399 XRSIGTJTRSTUIR-UHFFFAOYSA-N 340.383 1.262 10 10 EDCE COc1ccc(F)c(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1 774362656 BXQBOZNJGLRHBN-UHFFFAOYSA-N 348.330 1.543 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C)O[C@H](C)[C@H]3C)nc12 782628933 OXJLANMWPLBJDX-QJPTWQEYSA-N 348.403 1.609 10 10 EDCE C[C@@H](NC(=O)N(C)CCCCO)c1ccc(N2CCOCC2)cc1 788313510 LPUBFCJHBDRSTR-OAHLLOKOSA-N 335.448 1.998 10 10 EDCE COCCN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CCOC1 786188408 FJAQGFYAYNMVDY-GOSISDBHSA-N 349.475 1.448 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C[C@H](C)O)C(C)C)cc1 788955540 XCRMHLLLFLHNNO-HNNXBMFYSA-N 349.475 1.767 10 10 EDCE COc1ccc2c(c1)C[C@@H](C(=O)NCc1cc(O)ccc1O)CO2 1303223189 DVSYNWLIKVEQCI-CYBMUJFWSA-N 329.352 1.974 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cnc(C)cn2)cc1C 1317563229 BEPHQCPLWGZCDM-UHFFFAOYSA-N 328.416 1.964 10 10 EDCE COc1ccc(CNC[C@H]2C[C@H](NC(=O)CCNC(N)=O)C2)cc1C 1506904980 AGFXOVYYDGDCJD-SHTZXODSSA-N 348.447 1.046 10 10 EDCE CC(C)(C)[C@H](O)C[C@@H](CO)NC(=O)c1ccc(N=NC(N)=O)cc1 1467973222 VHZKDEPYAOJULN-QWHCGFSZSA-N 336.392 1.737 10 10 EDCE COc1ccc(-n2nnnc2CN[C@@H](C)[C@@H](C)NC(=O)C(C)C)cc1 1700385281 COGXOABNVJQTRX-QWHCGFSZSA-N 346.435 1.310 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)[C@H](C)NC(C)=O)C2)cc1C 1707055186 CMYZLAILFCFHNK-RRQGHBQHSA-N 347.459 1.513 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)Cc2ccn(C)n2)cc1C 1715227060 GUVNYSCXWYJEBN-CQSZACIVSA-N 344.459 1.822 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)[C@@H]2CCNC2=O)cc1C 1485732740 NVFVSJJUVNERHC-GDBMZVCRSA-N 347.459 1.514 10 10 EDCE COc1ccc(CNCCC[C@H](C)NC(=O)[C@@H]2CCNC2=O)cc1C 1485732741 NVFVSJJUVNERHC-GOEBONIOSA-N 347.459 1.514 10 10 EDCE COC(=O)[C@@H]1c2ccccc2OCCN1C(=O)c1cccc(O)c1O 1558656853 BUVNWZLMKWFNOD-HNNXBMFYSA-N 343.335 1.847 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)Cn2ccnc2)cc1C 1734007111 RZMVTFMEISSFBQ-HUUCEWRRSA-N 330.432 1.883 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)CCn2cncn2)cc1C 1733962374 JXASBTBFIBJXNU-CABCVRRESA-N 345.447 1.668 10 10 EDCE O=C(CNC(=O)c1cc(F)cc(F)c1)NCc1ccc(O)cc1O 1643103882 IPSUCQRWSNUBRT-UHFFFAOYSA-N 336.294 1.422 10 10 EDCE COC(=O)c1cc(CNC(=O)c2ccc(C)c(O)c2O)n(C)c1C 1644491887 CZCFHIHOZSBRPP-UHFFFAOYSA-N 332.356 1.770 10 10 EDCE CC[C@@H](CNC(=O)CC1CCC1)NC(=O)c1cc(OC)nc(OC)c1 1759307912 KSVXXAROOXCBNO-AWEZNQCLSA-N 349.431 1.914 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2CCc3ncnn3C2)c1 161149946 UVHMNRBNWMHXAV-QWRGUYRKSA-N 331.376 1.368 10 10 EDCE CNCc1ccc(N(C)[C@H]2CCS(=O)(=O)C2)cc1Br 234416112 WUAXGIBSKXFAJK-LBPRGKRZSA-N 347.278 1.792 10 10 EDCE CN(C)c1ccc(CNCCC(=O)N2CCCC[C@H]2CCO)cc1 1857863250 UCZIUISZWFSEMM-SFHVURJKSA-N 333.476 1.996 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 1985100893 KLRBOOTXIOJGEA-GHMZBOCLSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)C(C)(F)F 1986643699 ZWBUOMQJMGJXDA-KBVBSXBZSA-N 334.363 1.801 10 10 EDCE CN1C[C@H](O)[C@@H](NCc2cc(Cl)cc(Br)c2O)C1 2029868886 AWIGBZYTEYUYIE-QWRGUYRKSA-N 335.629 1.573 10 10 EDCE NCc1ccc(N2CCC[C@H](NC(N)=O)C2)c(Br)c1 702150512 PZXQWDLZUVOCTH-JTQLQIEISA-N 327.226 1.545 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)c(Br)c1 2173356258 BVUPWACLWUUMEU-LFNVJSRFSA-N 342.233 1.823 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H](C)Cn3ccnc3C)c2n1 2064124056 RSDFZTJTFUTIGR-SNVBAGLBSA-N 328.376 1.314 10 10 EDCE COCCNCc1ccc(N2CC=C[C@H]2CO)c(Br)c1 2176342875 IYVSTEUBDLSZSJ-ZDUSSCGKSA-N 341.249 1.922 10 10 EDCE Nc1ccc(OCC(=O)N(Cc2ccccc2)CC2(O)CNC2)cc1 2071682575 LDCMXCGGBBGXRL-UHFFFAOYSA-N 341.411 1.011 10 10 EDCE Oc1cc(Br)ccc1CNC[C@@H]1CO[C@H]2COC[C@H]12 2101846496 IQKATOWNLYJHJI-QKCSRTOESA-N 328.206 1.906 10 10 EDCE CC(=O)C(=O)[C@H](O)c1cc(Br)c2c(c1)OCCCO2 2090947221 GWLPOQBOBQSGDP-GFCCVEGCSA-N 329.146 1.802 10 10 EDCE NCc1ccc(N2CC(=O)N[C@H]3CC[C@@H]32)c(F)c1Br 2112067709 WFWYMDGTVYIYJV-IUCAKERBSA-N 328.185 1.514 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@H]3CNC[C@H]32)c1O 2236053599 XCPFAUSIDIXTMU-YPMHNXCESA-N 343.221 1.336 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CC(=O)O)c1cc(O)c(O)c(O)c1 1951421996 REMNVAGMPWRFCR-SECBINFHSA-N 327.333 1.886 10 10 EDCE CCN[C@@H](C)c1ccc(N2CC([C@H](O)CO)C2)c(Br)c1 2361914052 QREWNLDQFISJGC-ZUZCIYMTSA-N 343.265 1.909 10 10 EDCE CC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(O)c(F)c2)s1 228651487 VHGGYELGYNUGDC-UHFFFAOYSA-N 332.338 1.142 10 10 EDCE COc1ccc(CN2CCN(C(=O)[C@@H]3CCCN3C)CC2)c(O)c1 93821406 BJRWCBHVVDMAFW-INIZCTEOSA-N 333.432 1.139 10 10 EDCE O=C(O)/C=C/c1ccc(N2CCNC(=O)CC2)c(Br)c1 236466988 OCLTXCYFJYIDFT-DUXPYHPUSA-N 339.189 1.873 10 10 EDCE CN(C)c1ccc(C23NC(=O)NC2(c2ccccc2)NC(=O)N3)cc1 248056903 OSSMRQUNNHOVOJ-UHFFFAOYSA-N 337.383 1.384 10 10 EDCE CCN1C(=O)[C@@H]2CN(Cc3ccc(N(C)C)c(F)c3)CCN2C1=O 378367960 FOBJDMHNVXEPSF-HNNXBMFYSA-N 334.395 1.360 10 10 EDCE Cc1ccc(CN(C)[C@@H]2CC(=O)N(C)C2=O)c(O)c1Br 2381129763 OSMQSZVCNNKYCO-SNVBAGLBSA-N 341.205 1.652 10 10 EDCE COc1ccc(N2CCN(CCCNC[C@H](O)C3CC3)CC2)cc1 818943436 TZWHHIRTTHMRJT-IBGZPJMESA-N 333.476 1.568 10 10 EDCE Cn1cc(C(=O)N2CCOc3ccc(N4CCOCC4)cc3C2)cn1 575542114 PBEXZFMRZMFETE-UHFFFAOYSA-N 342.399 1.292 10 10 EDCE Cn1ncc(CCC(=O)NCc2ccc(N3CCSCC3)cc2)n1 822585751 AXBCRPFYYYGJDE-UHFFFAOYSA-N 345.472 1.617 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CCCOC3)C2)cc1 823093678 GERWBOFWYFNIQM-CABCVRRESA-N 333.432 2.000 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCC[C@@H](CS(N)(=O)=O)C2)cc1 835029776 SFHWNXRZRJZJNZ-LLCTXKFZSA-N 337.489 1.766 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@]2(C)CCCS2(=O)=O)cc1F 906453572 ILHLSNLXZQNVKI-HNNXBMFYSA-N 328.409 1.475 10 10 EDCE CCN1CCN(CC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC1 839919592 RXWKWIIGLOOCGS-KRWDZBQOSA-N 346.519 1.746 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C[C@@]1(O)CCCN(C)C1 910557446 ASLYGUKPBAAHKI-JXFKEZNVSA-N 347.503 1.955 10 10 EDCE COC(=O)[C@H]1CSCCN(Cc2cc3c(cc2O)OCO3)C1 840185501 FWEOIFODHDNRJC-LLVKDONJSA-N 325.386 1.459 10 10 EDCE C[C@H](NC(=O)[C@H](O)C1CCOCC1)c1ccc(N2CCOCC2)cc1 746169281 XTFKIJRXIBELTB-KBXCAEBGSA-N 348.443 1.488 10 10 EDCE C[C@@H](NC[C@H](O)CS(C)(=O)=O)c1ccc(N2CCCCC2)cc1 927032985 NUTVBSZAUYADRZ-PBHICJAKSA-N 340.489 1.733 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)c3cnn(C)c3)C2)cc1 855232413 TTWLMGSHHNMLIO-DZGCQCFKSA-N 328.416 1.927 10 10 EDCE COc1cccc(CNC(=O)N[C@H]2C[C@@H]3OC(C)(C)O[C@@H]3C2)c1O 927363847 JBEJEJVTAMVGDE-DEZZGGKRSA-N 336.388 1.883 10 10 EDCE CCn1ncc(CNC(=O)N(C)CCN(C)c2ccc(OC)cc2)n1 858660068 PPYHAODLDSQWJH-UHFFFAOYSA-N 346.435 1.584 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCn4cncc4C3)C2)cc1 855224641 GRTZOCFWXKNBMD-HUUCEWRRSA-N 340.427 1.849 10 10 EDCE C[C@@H](O)c1ccc(N(C)C[C@@H](O)CN(C)C)cc1Br 690314604 DBTPKOUFCZBXAN-PWSUYJOCSA-N 331.254 1.861 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)CCCN(C)C)C2)cc1 867497095 MQSWVRJCBXYNGW-CQSZACIVSA-N 341.477 1.145 10 10 EDCE CCOC(=O)C1(O)CCN(Cc2cc(OC)c(OC)cc2O)CC1 775712950 DRPZMOJCGMOJOP-UHFFFAOYSA-N 339.388 1.299 10 10 EDCE Cc1nc([C@@H]2COCCN2C(=O)/C=C\c2ccc(O)c(O)c2)no1 779692433 HUMNUISJJDUNCW-FHMRSRPSSA-N 331.328 1.403 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccc(N2CCNC2=O)cc1 1136125897 BWSDQZYQFCZDDA-UHFFFAOYSA-N 327.340 1.809 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@H]2CCN(C)C2)cc1C 1319284812 XCICGDYPXYFVPE-PBHICJAKSA-N 333.476 1.797 10 10 EDCE CCCC(=O)N[C@H](C)[C@H](C)NCc1nnnn1-c1ccc(OC)cc1 1328967462 DQHDWECXRNILPJ-QWHCGFSZSA-N 346.435 1.454 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCO[C@H](C(=O)C3CC3)C2)cc1 1297345297 CXTCIUZAKKZHOX-ZDUSSCGKSA-N 330.344 1.669 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2nccnc2N)cc1C 1700393069 QJLJDWQZJRWCTD-QWHCGFSZSA-N 343.431 1.672 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)Cc1ncccn1 1713478741 IDPCAGBSBKGTGL-UHFFFAOYSA-N 341.375 1.501 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@H]2CN3CCC2CC3)cc1C 1715930012 PJBYFHCYXQLICP-CRAIPNDOSA-N 345.487 1.940 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cc2cc[nH]n2)cc1C 1715800084 QFZFQWFTCYAHLF-ONEGZZNKSA-N 328.416 1.731 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](O)[C@](C)(O)C2)c(Br)c1 2136877654 JBGVXQPVNFMDBS-BIGNPOOSSA-N 330.222 1.824 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2C[C@H]2[C@@H]2CCCO2)c1 1631493514 PCFINLCMDGRESC-QKCSRTOESA-N 340.401 1.061 10 10 EDCE CCOC(=O)[C@@H]1CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CCO1 1640506291 QHMCYDDKGIAVCY-AWEZNQCLSA-N 340.332 1.380 10 10 EDCE C[C@H](NCC(=O)N(C)C)[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1734006620 QMWHNXNSNKTKHR-QWRGUYRKSA-N 348.407 1.034 10 10 EDCE C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1noc(C(F)(F)F)n1 1570581614 BZGVKIAFTKFAEP-ZCFIWIBFSA-N 331.250 1.920 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccncc2F)cc1C 1571426299 URIIGZNXSGWTNH-AWEZNQCLSA-N 347.390 1.418 10 10 EDCE O=C(CC[C@@H]1NC(=O)NC1=O)NCc1c(O)ccc2ccccc12 1652705773 NQGKSLVAJZTJKL-ZDUSSCGKSA-N 327.340 1.150 10 10 EDCE CC(C)N(C)CC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1742513397 FDEXLDSLDUEUOR-UHFFFAOYSA-N 348.407 1.035 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccsc2S(N)(=O)=O)c1 1584983081 BVJMLRZCFSFTCR-UHFFFAOYSA-N 326.399 1.340 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cn(C)c(O)n3)CC2)cc1C 1670850343 GBOTWRODJPEIFN-UHFFFAOYSA-N 344.415 1.495 10 10 EDCE CS(=O)(=O)c1ccccc1CNC(=O)NCc1ccccc1O 1683187863 USSQADZTTXRXMW-UHFFFAOYSA-N 334.397 1.795 10 10 EDCE Nc1ccc(NC(=O)c2ccc(N3C(=O)CCS3(=O)=O)cc2)cc1 1865943320 MPLVSDHUBMOITD-UHFFFAOYSA-N 345.380 1.588 10 10 EDCE O[C@H]1CN(c2ccc(CNC3CC3)cc2Br)C[C@H]1O 236555777 VCMCIDRLEKRHSU-OKILXGFUSA-N 327.222 1.243 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCCCN=[N+]=[N-])[C@@H]1CCOC1 1964880588 RNOCTMHDFHFNLR-MNOVXSKESA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C(F)(F)C1 2003172254 IHJLYZASYNNCAW-DCAQKATOSA-N 346.374 1.754 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1987702161 PEKAHJIQAQUPGN-GHMZBOCLSA-N 327.385 1.421 10 10 EDCE CN(C)c1ccc([C@H](N)CN2CC(NC(=O)OC(C)(C)C)C2)cc1 2003462731 CZUWPHLENKLPAT-MRXNPFEDSA-N 334.464 1.961 10 10 EDCE CN(Cc1cc(N)ccc1O)C[C@H](O)CN(C)C(=O)OC(C)(C)C 1999444338 YAQKDXPKTHXKEI-AWEZNQCLSA-N 339.436 1.634 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(N)cc1 2022850275 QMSHNJBVXPFZDI-FZMZJTMJSA-N 337.420 1.202 10 10 EDCE CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C=Cc1cccnc1)CC2 2042435382 YHEMTGSVSQRQJJ-UHFFFAOYSA-N 343.408 1.592 10 10 EDCE COC1(CO)CN(c2ccc(CNC3CC3)cc2Br)C1 2157295702 KTJMAOVVRINYTQ-UHFFFAOYSA-N 341.249 1.899 10 10 EDCE C[C@@H]1CN(Cc2c(O)cccc2Br)CCS1(=O)=O 707144769 TZUJWGAHMPOXME-SECBINFHSA-N 334.235 1.774 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1CCO[C@@H]2CNC[C@H]21 708134200 PCVHHBFTFWQPJC-VXGBXAGGSA-N 347.640 1.981 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H]3C[C@H]4O)c(Br)cc21 2172091727 GLEUEKWBELRFIF-NDHFTHCPSA-N 338.205 1.361 10 10 EDCE CC[C@]1(NCc2ccc(Br)cc2O)CCC(=O)NC1=O 2182525385 BRUXGQGZPONFBR-AWEZNQCLSA-N 341.205 1.830 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)c(Br)c1 2102190062 RDRXOLSOWGROBM-BQAVTBIBSA-N 327.222 1.665 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)c(Br)c1 2102178887 XJSYVIIMEXTKMQ-WNIABHAQSA-N 328.206 1.698 10 10 EDCE O=C1Nc2cc(N3CC4(CSC4)C3)c(Br)cc2[C@H]1O 2090180006 LUXBHRPCQOOUHJ-LLVKDONJSA-N 341.230 1.988 10 10 EDCE O=C(O)[C@H]1C[C@@H](O)CCN1Cc1cc(Br)cc(F)c1O 2201087809 BUTSGOKUDCAONI-GXSJLCMTSA-N 348.168 1.704 10 10 EDCE O=C(O)CN1CC[C@@H](NCc2c(O)cccc2Br)C1 2113032163 XWBQPYYZKKULDY-SECBINFHSA-N 329.194 1.403 10 10 EDCE COc1ccc(Br)c(CNCc2nnc(O)n2C)c1O 2236051165 OZRFXHZTFXQFDS-UHFFFAOYSA-N 343.181 1.287 10 10 EDCE CSCC[C@H](NC(=O)NCc1cnc(SC)s1)C(=O)O 2284505842 ZNAHFFAYHOJURM-QMMMGPOBSA-N 335.476 1.871 10 10 EDCE NCc1cc(F)c(N2C[C@H]3OCC[C@@]3(CO)C2)cc1Br 2296392925 RTIGDBDSPKBUNW-KGLIPLIRSA-N 345.212 1.635 10 10 EDCE CC(C)NCc1ccc(N2CC[C@H]2[C@H](O)CO)c(Br)c1 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348.491 1.275 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2C[C@H]3CC[C@H]2C3)c1 245204035 VAQLHWNNRZGXGS-SDDRHHMPSA-N 338.429 1.930 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C\c3ccnn3C)CC2)cc1F 255680875 IXZMKHPPCIFRHK-XQRVVYSFSA-N 344.390 1.930 10 10 EDCE O=S(=O)(C1CC1)N1CCN(Cc2cc3c(cc2O)CCC3)CC1 530101632 KYMCUWRFUJGBSJ-UHFFFAOYSA-N 336.457 1.491 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]3C3CC3)nc12 377542220 FODITWQYFZSQFF-AWEZNQCLSA-N 330.388 1.986 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@](O)(C(N)=O)C2)cc1 276518830 SMONHEKBFQGGMH-GOSISDBHSA-N 327.384 1.156 10 10 EDCE Cc1ccc(CNC(=O)COC2(C)CNC2)c(O)c1Br 2380737744 QYKVUZXPJSERGW-UHFFFAOYSA-N 343.221 1.458 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C[C@H](O)CCN2)c(O)c1Br 2380751080 HLSBBEHNHHZAHB-GHMZBOCLSA-N 343.221 1.192 10 10 EDCE Cc1ccc(CN2C[C@H](O)C[C@@H]2CN(C)C)c(O)c1Br 2380813363 FXXKLYLCGBVMRS-CHWSQXEVSA-N 343.265 1.960 10 10 EDCE C[C@@H]1CN(c2ccc(/C=C/C(=O)O)cc2Br)CC(=O)N1 387340823 TZWYOIOFUMLFMZ-HYYFJVDXSA-N 339.189 1.872 10 10 EDCE Cc1ccc(CN(C)C(=O)Cn2ccnn2)c(O)c1Br 2381142807 MWZFVWORJLVNOK-UHFFFAOYSA-N 339.193 1.713 10 10 EDCE C[C@H]1CN(C(=O)NCCCSc2nccs2)CC(=O)N1C 800711190 DLTCDOJAEDLRCI-JTQLQIEISA-N 328.463 1.497 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccnc(S(C)(=O)=O)n1 816822729 UXOLCGXVNYBUJU-UHFFFAOYSA-N 348.428 1.218 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C3=COCCC3)cc2)C1 727767639 IJNWBIDTYVBGLQ-OAHLLOKOSA-N 343.427 1.699 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN(CCO)[C@H]2CCO[C@@H]2C)c1O 825129822 FZWVDNJXBAXBHO-PWSUYJOCSA-N 326.349 1.281 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@H](O)C[C@H]2[C@H]2CCCOC2)cc1 836226388 DTLUORLUXHNPDI-JQHSSLGASA-N 347.459 1.824 10 10 EDCE CO[C@@]1(CN[C@H](C)c2ccc(C)c(C)c2O)CCS(=O)(=O)C1 903364780 BSLVCEIWHMDIDE-CZUORRHYSA-N 327.446 1.863 10 10 EDCE CC1CCN(c2ccc(CNC(=O)COC3(C)CNC3)cc2)CC1 844183619 IFIZEKSPSGRHCX-UHFFFAOYSA-N 331.460 1.918 10 10 EDCE Cn1nccc1[C@@H]1NC(=O)N(Cc2ccc(N3CCCC3)cc2)C1=O 843307506 QOZJLEANZDCFEU-INIZCTEOSA-N 339.399 1.813 10 10 EDCE CC[C@](C)(CO)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 847860840 XMVOQSWMTNUKEV-LJQANCHMSA-N 347.459 1.380 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H]4C[C@H]3C[S@]4=O)C2)cc1 852448618 KXWLPHLIXIXYLO-KMCPTZPMSA-N 349.456 1.189 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3c[nH]c(C)cc3=O)C2)cc1 855231063 IYGJZOSINFWEEU-CYBMUJFWSA-N 327.384 1.701 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CN(C)C(=O)[C@H]3C)C2)cc1 852449232 RLBAVJSYSUVUQH-OLZOCXBDSA-N 332.404 1.104 10 10 EDCE Cc1cnn(C)c1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 850383070 IFKBOMKWBFGURM-UHFFFAOYSA-N 342.399 1.568 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnn4ncccc34)C2)cc1 855225541 KLZAOCLOSDCQLZ-CYBMUJFWSA-N 337.383 1.747 10 10 EDCE C[C@@H](NC[C@]1(OCCO)CCOC1)c1cc([N+](=O)[O-])ccc1O 850508013 LMENYLZHCPZKPM-IAQYHMDHSA-N 326.349 1.119 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc4nncn4c3)C2)cc1 855228538 BUPNAZNFVXPSHP-CQSZACIVSA-N 337.383 1.747 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CCO)C(C)C)C2)cc1 854300031 ORYOTBUWIDHKTI-YOEHRIQHSA-N 335.448 1.980 10 10 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10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)Cc2nc[nH]n2)cc1C 1676461669 PCSFDIYRGZXOPJ-CYBMUJFWSA-N 331.420 1.301 10 10 EDCE CCc1oncc1C(=O)NC[C@@H](O)CNCc1ccc(OC)c(C)c1 1699059754 KLHGZACYHMZHDA-AWEZNQCLSA-N 347.415 1.435 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCOC[C@@H]2c2nc(C)no2)c1O 161206317 TZAFNOSPYKBCOW-CQSZACIVSA-N 335.335 1.999 10 10 EDCE COc1cc(C)cc(CN2CCC[C@@H](NS(C)(=O)=O)C2)c1O 164011404 NOQWOMUPGYQFRW-CYBMUJFWSA-N 328.434 1.223 10 10 EDCE CC(C)(C)OC(=O)NCc1cn(C[C@H](N)c2ccccc2O)nn1 1942393422 ZQMLXXHYRBYPSM-ZDUSSCGKSA-N 333.392 1.708 10 10 EDCE C[C@]1(O)CN(c2ccc(CO)cc2Br)CC[C@@]1(C)O 1880700562 DEXRIJLRAHPZEC-KGLIPLIRSA-N 330.222 1.654 10 10 EDCE COc1ccc(O)c(CNC[C@@H](O)CNC(=O)OC(C)(C)C)c1 1985772267 UCQRZGDHUQLDFA-GFCCVEGCSA-N 326.393 1.376 10 10 EDCE CN(C[C@H](O)CNC(=O)OC(C)(C)C)C(=O)Cc1ccc(N)cc1 1999492768 UIYCXHWCFOEHNH-CQSZACIVSA-N 337.420 1.155 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CCC(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010402337 PQNPCEUYAJGCQJ-NWDGAFQWSA-N 341.412 1.954 10 10 EDCE 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1.566 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)C2=COCCO2)cc1C 1714537921 KMXFRQPQUOQNSY-AWEZNQCLSA-N 334.416 1.828 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2scnc2C)cc1C 1568550425 WOWWAHFHDHLYKJ-CQSZACIVSA-N 349.456 1.649 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)c2nsnc2O)N(C)C)cc1 1637004721 MVSRFWIUWCDFHE-GFCCVEGCSA-N 335.433 1.342 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)c(O)c1O 1640271647 QKQDCCPXSIZJAE-CYBMUJFWSA-N 326.352 1.724 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@H](F)C(C)C)cc1C 1571438775 SZSSYQRBGRRPQV-GDBMZVCRSA-N 326.412 1.564 10 10 EDCE C[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)c1cc2cc(O)c(O)cc2s1 1596586308 XAUWDZLOTQUMOB-APPZFPTMSA-N 341.410 1.475 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CC1(O)CCOCC1 1762870718 DLUCJWKOQXZEKK-UHFFFAOYSA-N 346.431 1.724 10 10 EDCE CN(C)C[C@H]1CN(C(=O)NCCCSc2nccs2)CCO1 154596270 FPCOELRHHGRBCB-LBPRGKRZSA-N 344.506 1.597 10 10 EDCE CCCN(CC(N)=O)Cc1c(Br)ccc(OC)c1O 1964575034 VVBANPOURPAFGB-UHFFFAOYSA-N 331.210 1.861 10 10 EDCE O=C(O)CC1(O)CCN(Cc2cc(Br)ccc2O)CC1 1968189487 WHZMZWYQAPZUQR-UHFFFAOYSA-N 344.205 1.956 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](C(CO)CO)C2)c(Br)c1 2170674546 STHDDFPRRDDOLP-ZYHUDNBSSA-N 343.265 1.896 10 10 EDCE NCc1ccc(N2CCN3C(=O)OC[C@@H]3C2)c(F)c1Br 2170715912 CICURHVBJWMNQH-VIFPVBQESA-N 344.184 1.688 10 10 EDCE COC1(CNC(=O)Cc2ccc(N)cc2)CN(C(=O)OC(C)(C)C)C1 2044231619 RNEQRVRDLNJRCS-UHFFFAOYSA-N 349.431 1.563 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CN(Cc2cc(N)ccc2O)[C@H]2COC[C@H]12 2044665471 IPPODTUWGHNYNV-KFWWJZLASA-N 349.431 1.698 10 10 EDCE C[C@]1(C(=O)O)COCCN1Cc1cc(Br)cc(F)c1O 2201207768 XGCLPESGVDLOGX-CYBMUJFWSA-N 348.168 1.969 10 10 EDCE COc1ccc(Br)c(CNC2(c3nn[nH]n3)CC2)c1O 2236032862 PJBLMUBBEJYDQN-UHFFFAOYSA-N 340.181 1.455 10 10 EDCE CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=CNCC1CCNCC1 2297316456 BFOFNKVTXKBZOE-UHFFFAOYSA-N 343.387 1.790 10 10 EDCE CC(C)C[C@@H](CNC(=O)C=Cc1ccc(O)c(O)c1)N1CCOCC1 2307982244 VNQDIIYAGZXBEM-INIZCTEOSA-N 348.443 1.974 10 10 EDCE 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EDCE COc1ccc(CN[C@H](CNC(=O)[C@@H]2COCCO2)C2CC2)cc1C 1713861949 NMLACXBMVHGYQU-AEFFLSMTSA-N 348.443 1.403 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cc[n+]([O-])cc2)cc1C 1566997563 XSWOAEVMBGBFHT-AWEZNQCLSA-N 329.400 1.545 10 10 EDCE COc1ccc(CNCC2CC(NC(=O)CCNC(N)=O)C2)cc1C 1570579515 AGFXOVYYDGDCJD-UHFFFAOYSA-N 348.447 1.046 10 10 EDCE Cc1ccc(S(=O)(=O)NCC(=O)NCc2cc(C)ccc2O)cc1 1645800547 JDLKNUPBCSQTMM-UHFFFAOYSA-N 348.424 1.604 10 10 EDCE COCc1nnc(NC(=O)CCNCc2cc(C)ccc2O)s1 1857875361 XAGBMTRWHGGNOG-UHFFFAOYSA-N 336.417 1.817 10 10 EDCE CNC(=O)CN(Cc1ccccc1)C(=O)COc1ccc(N)cc1 1946869156 JMVAPPMEHAOWSK-UHFFFAOYSA-N 327.384 1.422 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(=O)NC(=O)[C@H]2C)c(Br)c1 252674488 RLSCJFMHRDEJTN-DTWKUNHWSA-N 340.221 1.581 10 10 EDCE C[C@H](CNC(=O)OC(C)(C)C)[C@@H](F)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980369244 IWRVZOJCOMVVNC-PRULPYPASA-N 330.400 1.751 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](F)[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 1983546036 FZXSHENYAIPTRA-FIQHERPVSA-N 328.384 1.457 10 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10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2236645430 RCHZCWDGGKWHCR-SDDRHHMPSA-N 343.265 1.896 10 10 EDCE COC(=O)c1cccc2c1OCCN2C(=O)/C=C\c1cnccn1 492299882 ACERYIADAXOTFV-WAYWQWQTSA-N 325.324 1.702 10 10 EDCE COC(=O)C=Cc1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@@H]4O)c([N+](=O)[O-])c1 2312513734 PTCIAUKHTGWFFV-YOCBEXAOSA-N 344.367 1.987 10 10 EDCE CN(C)c1nnc(SC[C@H](O)COc2ccc(N)cc2)s1 111315358 WLTZTXLQJHXEKK-SNVBAGLBSA-N 326.447 1.718 10 10 EDCE CO[C@H]1C[C@@H](CO)N(c2cc(Br)c(CN)cc2F)C1 311647017 LUUDXKZSLONXEU-UWVGGRQHSA-N 333.201 1.633 10 10 EDCE COC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)/C=C\c1ccc(N(C)C)cc1 221753995 KROJOKOTJBECFK-SELBCVKXSA-N 332.400 1.555 10 10 EDCE COC(=O)[C@H]1CN(Cc2cccc(Br)c2O)C[C@@H](C)O1 92013734 MLXRBYUJNOMXDG-BXKDBHETSA-N 344.205 1.917 10 10 EDCE CCCCN(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)=O 243243354 KNWSGOZQIUMTBJ-UHFFFAOYSA-N 347.459 1.992 10 10 EDCE COc1ccc(N2CCN(C(=O)C3(C(=O)NC(C)C)CC3)CC2)cc1 242752119 DHKPDUJOAAIXCL-UHFFFAOYSA-N 345.443 1.649 10 10 EDCE O=S(=O)(C1CN(Cc2ccccc2O)C1)N1CCc2ccccc21 369378681 HTBVANOSNHKRED-UHFFFAOYSA-N 344.436 1.969 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@@H](c3ccnc(N)n3)C2)c(O)c1O 370579063 GNZXPZUVDQEDMO-LLVKDONJSA-N 328.372 1.798 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CC(=O)N(c2cc(F)cc(F)c2)C1 808508093 RLTDWFJMLMEBSQ-SECBINFHSA-N 325.267 1.019 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](O)C3CCC3)cc2)C1 825373114 CTURETQQBAQMKG-WBVHZDCISA-N 345.443 1.166 10 10 EDCE CCN1CCN(CCCCNC(=O)/C=C\c2ccc(O)c(O)c2)CC1 588404469 DKLRMPVTZNOUDM-VURMDHGXSA-N 347.459 1.645 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@]1(C)CC(=O)N1 1952208957 PBCSRURWBNWKRI-CXAGYDPISA-N 336.388 1.812 10 10 EDCE O=S(=O)(CC1(F)CC1)NCc1ccc(N2CCC(O)CC2)cc1 917704607 KJBPVNWJMUIJRO-UHFFFAOYSA-N 342.436 1.569 10 10 EDCE CO[C@H](c1ccc(O)c(O)c1O)[C@H](NC(=O)OC(C)(C)C)C(=O)O 1952365806 VQKVINZGQOTUCU-JOYOIKCWSA-N 343.332 1.469 10 10 EDCE NC[C@H](NC(=O)NCCCSc1nccs1)C(F)(F)F 848598351 YNZKBWBAMJWXSQ-ZETCQYMHSA-N 328.385 1.814 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCOC[C@H]2c2ccnn2C)cc1 844781042 BVZMWSHDEJNZOL-KRWDZBQOSA-N 343.431 1.769 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)N[C@@](C)(C4CC4)C3=O)C2)cc1 849357160 KRHWCESDCNNLER-KDOFPFPSSA-N 329.400 1.994 10 10 EDCE CC(=O)OC1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 753817880 CWASTZGXXAMJGC-UHFFFAOYSA-N 335.316 1.458 10 10 EDCE O=C1Nc2cc(N3[C@@H]4COC[C@H]3C4)c(Br)cc2[C@@H]1O 1899633967 AWJRMWQJOPNSAR-KJNMHVQDSA-N 325.162 1.412 10 10 EDCE CC(C)n1cnc(S(=O)(=O)NNc2nc3cccnc3s2)c1 857225261 JUXWKZPDPOSQBX-UHFFFAOYSA-N 338.418 1.774 10 10 EDCE COC(=O)C[C@@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)C[C@H]1C 932107518 SKESSQLTZLGMCD-GDBMZVCRSA-N 347.459 1.500 10 10 EDCE CN(C)c1ccc(/C=C/CNC[C@@]23COCCN2C(=O)OC3)cc1 865770368 KOMDLFHQDKGDDS-WHLIDYPQSA-N 331.416 1.577 10 10 EDCE CN1CCN(c2ccc(CN3CCO[C@]4(CCOC4)C3)cc2)CC1 769555881 JXUVLHRGFJZKLS-LJQANCHMSA-N 331.460 1.430 10 10 EDCE CC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 881854303 AKXLKPJUCFYACH-GOSISDBHSA-N 344.459 1.066 10 10 EDCE CCc1noc(C)c1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 785295138 SDWHIZYPEFODDW-SECBINFHSA-N 347.371 1.643 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@@](C)(O)Cn2ccccc2=O)c1 790649568 HKGFUIVOKZTYAD-XIKOKIGWSA-N 346.383 1.191 10 10 EDCE CS(=O)(=O)N[C@H]1CCN(Cc2cccc(Br)c2O)C1 93531197 VBLYAWJTHIFOFJ-JTQLQIEISA-N 349.250 1.278 10 10 EDCE CC[C@@H](CNC(=O)C(C)(C)C(N)=O)NCc1ccc(OC)c(C)c1 1318537847 MTMYAFIZUURTCH-AWEZNQCLSA-N 335.448 1.500 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@]23CCC[C@@H]2C3)cc1C 1320251056 WDVPLOJWKKFGLI-JTDSTZFVSA-N 332.444 1.761 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCc2cccc(Cl)c2O)o1 1180409603 DYXRBHMBUZUTPB-UHFFFAOYSA-N 329.761 1.972 10 10 EDCE COCCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@H]1CC[C@H](C)C1 1332023603 RBPWHMRZCYCEIB-ZFWWWQNUSA-N 346.427 1.898 10 10 EDCE CN(C/C=C\c1ccc(N(C)C)cc1)Cc1nnc2c(=O)[nH]ccn12 1262113112 BZTWJPAHKLVFDX-PLNGDYQASA-N 338.415 1.629 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CC[C@@H](C(N)=O)C1 1451907148 ACFVDUZXVBVTMT-OLZOCXBDSA-N 348.399 1.186 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H]2CC23CCC3)cc1C 1700807891 IETGNKAPSMAVRU-CVEARBPZSA-N 332.444 1.761 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2CCC(=O)NC2)cc1C 1482302262 DVTMRQCBAKGKDB-GOEBONIOSA-N 347.459 1.466 10 10 EDCE Cc1nc2n(n1)C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)CC2 1626752656 ULWOJXJUKYBPHC-GFCCVEGCSA-N 327.348 1.494 10 10 EDCE COc1ccc(C(=O)NC[C@@H](O)CNCc2ccc(OC)c(C)c2)o1 1715608069 LMOXWLDLCLCEJH-AWEZNQCLSA-N 348.399 1.486 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CCN(C)C2=O)cc1C 1714724267 LJTGFEFKXVMRQV-HOCLYGCPSA-N 347.459 1.418 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc([N+](=O)[O-])cc1N 1632680636 ARONGKSBGUVEOC-VIFPVBQESA-N 331.328 1.949 10 10 EDCE O=S(=O)(Nc1cccc(-c2nnc[nH]2)c1)c1cccc2nonc12 163585317 FLVXYBPICWGFNC-UHFFFAOYSA-N 342.340 1.809 10 10 EDCE COc1cc(NC(=O)c2nnn(-c3ccc(N)cc3)n2)cc(OC)c1 1857878927 OQEQQBKFQZNZRI-UHFFFAOYSA-N 340.343 1.514 10 10 EDCE CC(C)(C)OC(=O)N1CCCN1C[C@H](O)COc1ccc(N)cc1 1999441978 ODWJWXDODHPQJQ-AWEZNQCLSA-N 337.420 1.866 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2Nc1c(N)cccc1C(N)=O 2000888731 OYIVPENKQLGNBZ-ICCXJUOJSA-N 332.404 1.787 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](CO)(NCc2ccc(O)c(O)c2)C1 2016028152 CXVOQYPSLDCCCX-QGZVFWFLSA-N 338.404 1.559 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(CNCc2cc(F)ccc2O)C1 2023459213 AUBBBYODYDXFFH-UHFFFAOYSA-N 340.395 1.850 10 10 EDCE CC(C)(C)OC(=O)N1Cc2nncn2C[C@H]1[C@H](N)c1ccccc1O 2029556690 VBYJIMIGSYRQGM-SWLSCSKDSA-N 345.403 1.803 10 10 EDCE COC(=O)C(=CN(C)C)C1=NN(c2ccccc2)C(=O)C1=CN(C)C 2040861763 LZFSEKQTFSZXIA-UHFFFAOYSA-N 342.399 1.453 10 10 EDCE NCc1cnn(Cc2cc(F)ccc2O)c1I 2070409303 OLUHRKGEGMNALA-UHFFFAOYSA-N 347.131 1.839 10 10 EDCE CC(C)[C@H](O)CN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2167604816 ULXCVCWCWZMHDL-OLZOCXBDSA-N 342.237 1.854 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@@H](O)c2nn(C)nc2Br)cc1 2167724642 SSDFOCZNIJLVRS-ZYHUDNBSSA-N 340.225 1.377 10 10 EDCE O=C1NC[C@@]2(CCCN(Cc3ccc(Br)cc3O)C2)N1 2177680179 KPXCCVMOHFFPTA-CQSZACIVSA-N 340.221 1.802 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@]3(CNC(=O)N3)C2)c(Br)c1 2177696947 XMGZJPXXWNPNAM-YMTOWFKASA-N 339.237 1.731 10 10 EDCE Nc1nonc1/N=N/N(Cc1ccccc1Cl)c1nonc1N 12375489 MLRSTMIVLIGNNG-HMMYKYKNSA-N 335.715 1.976 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CCC(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213593365 RMPOPYYWHSEJKM-GRYCIOLGSA-N 341.412 2.000 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213582287 GKJQBRQODIZHEN-GRYCIOLGSA-N 339.396 1.970 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(COc2nnc(=N)[nH]n2)CCCCC1 2213790764 XUYVCALBIDZBSU-UHFFFAOYSA-N 338.412 1.628 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(NC(=O)Cc2ccc(N)cc2)C1 2216758667 XJDFCOMDRDBJQD-ACJLOTCBSA-N 331.416 1.937 10 10 EDCE Oc1cc(Br)ccc1CN1CC(CN2CCNCC2)C1 2236845652 KXNBXCYLPOVRIZ-UHFFFAOYSA-N 340.265 1.492 10 10 EDCE OCc1ccc(N2C[C@H](CO)C[C@@H](CO)C2)cc1Br 2228399932 NRZDRZSFAZBRKE-GHMZBOCLSA-N 330.222 1.369 10 10 EDCE O=C1N=C(N2CCOCC2)SC1=Cc1cc([N+](=O)[O-])ccc1O 2293175927 OQHWEIDRXNFABU-UHFFFAOYSA-N 335.341 1.603 10 10 EDCE CCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1cccc(C)c1C 491237233 PLGLKFKFVHWQEG-KHPPLWFESA-N 341.411 1.767 10 10 EDCE Cc1ccc(CN[C@@H]2CCC[C@@H](O)[C@@H]2O)c(O)c1Br 2352945851 CBLMQUWASXWXBA-JTNHKYCSSA-N 330.222 1.827 10 10 EDCE CCn1[nH]c(Br)nc1=NCCOc1ccc(N)cc1 2353602985 UQEURQDVGBZWKP-UHFFFAOYSA-N 326.198 1.556 10 10 EDCE CCNC(=O)CN(CC)c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 177505595 KRGJCXFWGDRZKQ-VQHVLOKHSA-N 335.360 1.743 10 10 EDCE COc1cc(NC(=S)NC(C)=O)c(N2CCOCC2)cc1OC 20496590 USCHEPDGKCVJII-UHFFFAOYSA-N 339.417 1.373 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@](O)(C(F)(F)F)C3)cc2N1 301679468 IXJVGQRNBSMDMU-LBPRGKRZSA-N 347.249 1.429 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NCCc2cccs2)cc1 70490507 LHROFHMNNTYLNG-UHFFFAOYSA-N 326.443 1.871 10 10 EDCE COc1ncc(Br)c(C)c1[C@@H](NCCN=[N+]=[N-])C(N)=O 2368189353 KUEPVEQKXNKINA-SECBINFHSA-N 343.185 1.587 10 10 EDCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cc[nH]n1 92126277 WENRSHVCRANNRN-UHFFFAOYSA-N 339.443 1.872 10 10 EDCE CN[C@@H](C)c1ccc(N2CCN(C(N)=O)CC2)cc1Br 722195759 FIKRSXZLHCILEY-JTQLQIEISA-N 341.253 1.930 10 10 EDCE CCOc1ccc(CN2CCS(=O)(=O)[C@@H]3CCC[C@@H]32)c(O)c1 825201364 JYQQRQGPSARCHO-GOEBONIOSA-N 325.430 1.942 10 10 EDCE Cn1cc(CNCc2ccc(O)c(O)c2O)c(Br)n1 720626654 YUWSSNJFCXDHHT-UHFFFAOYSA-N 328.166 1.589 10 10 EDCE CN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCOC1 823553666 MIHLEQJMEIAMRX-INIZCTEOSA-N 333.432 1.578 10 10 EDCE COC[C@@](C)(O)CCNC(=O)NCc1ccc(N2CCCC2)cc1 836243539 BWRURBAPYKPDNV-SFHVURJKSA-N 335.448 1.874 10 10 EDCE C[C@@H](c1ccc(N2CCOCC2)cc1)N1C(=O)N[C@H](CCF)C1=O 844723272 WFXTWTPWNYWXGG-SWLSCSKDSA-N 335.379 1.864 10 10 EDCE Cc1cc(O)c(CN2CCS(=O)(=O)[C@@H]3COCC[C@@H]32)c(Cl)c1 840952531 DFFVMJBCMJJRIL-DZGCQCFKSA-N 345.848 1.742 10 10 EDCE O=S1(=O)CC[C@@]2(CN(Cc3cc(Cl)c(F)cc3O)CCO2)C1 843425734 HGDAGACQALTWRD-CQSZACIVSA-N 349.811 1.574 10 10 EDCE Cc1cc(O)c(CNC[C@H]2CCCN2S(C)(=O)=O)c(Cl)c1 840908416 WWQGNKPHXRFXKS-LLVKDONJSA-N 332.853 1.868 10 10 EDCE COc1ccc(CNC(=O)NCC(C)(C)C(=O)N2CCCC2)c(O)c1 858901717 JCKYKLHDDPKZIN-UHFFFAOYSA-N 349.431 1.849 10 10 EDCE CNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nn1 853758914 MTZGJBVQHVTZLS-LBPRGKRZSA-N 327.388 1.536 10 10 EDCE NC(=O)c1ccccc1NS(=O)(=O)c1cc(F)cc(F)c1O 753022959 ZOOKWELMOYHFNY-UHFFFAOYSA-N 328.296 1.570 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(CCO)C3CCC3)C2)cc1 854298638 HMJIMNPFDXMDQE-AWEZNQCLSA-N 333.432 1.830 10 10 EDCE COC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)O1 862001962 IAWGUWGARDADLY-XKQJLSEDSA-N 348.443 1.829 10 10 EDCE COC(=O)[C@]1(OC)CCN(Cc2cc(F)c(N(C)C)cc2F)C1 862475227 DCNMRWDMMMDMCN-INIZCTEOSA-N 328.359 1.795 10 10 EDCE COC(=O)CCNC(=O)CCNCc1cc(Cl)c(F)cc1O 862528088 PLESORFXPFXXHO-UHFFFAOYSA-N 332.759 1.344 10 10 EDCE C[C@H]1COCC[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 763192478 FJTQSWYILMAIRZ-WMLDXEAASA-N 333.432 1.747 10 10 EDCE CCNCc1ccccc1NC(=O)C(=O)N1Cc2cccc(O)c2C1 868299926 PNGHMXXSZWLBNI-UHFFFAOYSA-N 339.395 1.983 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CC=CCC3)C2)cc1 1118621076 SYSKJEZYGASYFZ-CABCVRRESA-N 343.427 1.615 10 10 EDCE Cc1ccncc1CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 792977777 NWRCBTUXXWDROU-UHFFFAOYSA-N 345.468 1.915 10 10 EDCE CS(=O)(=O)C1(CNC(=O)Cc2ccc(O)c(O)c2)CCCCC1 1147541723 MBPYKQSYTGMTNJ-UHFFFAOYSA-N 341.429 1.504 10 10 EDCE O=C(Cn1ncc(=O)c2ccccc21)NCc1cc(O)ccc1O 1153879466 PKTAXVRGPLHMMR-UHFFFAOYSA-N 325.324 1.124 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3COCCO3)CCC2)cc1C 1326787351 ZLFRXWQUZOODHA-KRWDZBQOSA-N 348.443 1.548 10 10 EDCE CCOCCNC[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1267069815 DXAFHFUIZUHDTK-ZDUSSCGKSA-N 347.419 1.937 10 10 EDCE COc1ccc(N2CCC(NC(=O)C(=O)NC[C@@H]3C[C@H]3C)CC2)cc1 1345185552 GTRQUQCYWHNQQB-KGLIPLIRSA-N 345.443 1.552 10 10 EDCE COC(=O)[C@H]1CN(C(=O)/C=C\c2cn(C)cn2)c2ccccc2O1 1352671121 MUCUELVPJIHKMX-ZPIQOJFGSA-N 327.340 1.401 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](NC(=O)OC)C(C)C 1297563160 YRNCLDKUNHRUNK-ZDUSSCGKSA-N 329.393 1.875 10 10 EDCE C[C@@H]1C[C@H]1C(=O)NC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1533354805 PACUKZYJJURHFK-VEQQVYERSA-N 343.387 1.907 10 10 EDCE C[C@@H]1CN(C(=O)CN2CCOc3cc(N(C)C)ccc32)CC(C)(C)O1 1616891485 DPVFSGNRAATKHU-CQSZACIVSA-N 347.459 1.977 10 10 EDCE Cc1nc2cc(O)nn2c(C)c1CC(=O)NCc1c(O)cccc1F 1558454675 JAURXJKOPONPBI-UHFFFAOYSA-N 344.346 1.755 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1cccnc1N1CCCC1 1629075685 LQXUSXMEHJBKSQ-UHFFFAOYSA-N 327.384 1.952 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC[C@H](N2CCCC2=O)CC1 1558995162 CXVMOBTZFRBMCW-NSHDSACASA-N 336.363 1.854 10 10 EDCE CO[C@H](C)CNCCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1723206006 RBUGMUJJVPEDBM-GFCCVEGCSA-N 335.408 1.936 10 10 EDCE O=C(CN1C(=O)CCOc2ccccc21)NCc1ccc(O)cc1O 1639441205 MNMMYEQHGQWGDP-UHFFFAOYSA-N 342.351 1.530 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)C2=COCCO2)cc1C 1733960878 RPLUYTPQGVFKPB-ZIAGYGMSSA-N 334.416 1.875 10 10 EDCE Cc1ccc(-c2nnn(CC(=O)NCc3cccc(O)c3O)n2)cc1 1643810132 WFXABDHJUZGERM-UHFFFAOYSA-N 339.355 1.376 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCCn3nncc3C2)c([N+](=O)[O-])c1 1651423914 MIMFOIDEEVTONR-XQRVVYSFSA-N 343.343 1.783 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)Cc2nnc(C)o2)cc1C 1666541302 ZTMQCTBIEAETTE-LBPRGKRZSA-N 346.431 1.780 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCN1CCOC[C@H]1C 1693459213 QFOJVVRAKXZXHL-CQSZACIVSA-N 345.447 1.649 10 10 EDCE CCNCc1ccc(N2CCN(CCO)CC2)cc1Br 233529802 WKMHRJKYAIZHNQ-UHFFFAOYSA-N 342.281 1.673 10 10 EDCE C[C@H](NC(=O)c1nnn(-c2ccc(N)cc2)n1)[C@H]1C[C@H]2CC[C@H]1C2 1857878761 LKQHCUVCWSDPLW-JUFZMCDQSA-N 326.404 1.799 10 10 EDCE C[C@@H](NCc1c(O)cccc1Br)C1CS(=O)(=O)C1 1966009616 GITCHSNBEWTPRY-MRVPVSSYSA-N 334.235 1.677 10 10 EDCE Cn1nccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC(N=[N+]=[N-])C1 2010392208 XVFYGAAHYSVVDT-LLVKDONJSA-N 335.368 1.507 10 10 EDCE CC(C)(C)OC(=O)N=c1cc(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)[nH][nH]1 2010390737 HXCSZPNHUAPZJM-VIFPVBQESA-N 335.368 1.951 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]1(NC(=O)OC(C)(C)C)C[C@H](O)C1(C)C 2018046494 AQDNSZXWYNTHFX-BONVTDFDSA-N 341.412 1.809 10 10 EDCE CC(=O)N[C@@H]1CCN(c2cc(Br)c(CN)cc2F)C1 311528520 VPNIUCGSTCXTAZ-SNVBAGLBSA-N 330.201 1.762 10 10 EDCE O=C(NCc1c(O)cc(O)cc1O)[C@@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F 2062056692 PYNYXHXAXWPFGD-LPWJVIDDSA-N 347.289 1.776 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC4(C=CCO4)C3)c(Br)cc21 2183724278 HPCUYMDYZYBCEU-GFCCVEGCSA-N 336.189 1.546 10 10 EDCE CNCc1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2199528418 ZKFWKZDXCATQAE-ISGRIPCHSA-N 341.249 1.489 10 10 EDCE CCNCc1ccc(N2CC(NC(N)=O)C2)cc1Br 2106927848 NFIWSJLDBWMLQL-UHFFFAOYSA-N 327.226 1.416 10 10 EDCE NC(=O)c1cnc(CNCc2cccc(Br)c2O)s1 2112200066 OWKBVHAZSCEBRJ-UHFFFAOYSA-N 342.218 2.000 10 10 EDCE NCc1ccc(N2C[C@@H]3CCO[C@@]3(CO)C2)c(Br)c1 2231371529 MFHPKCKCEIJGSN-SMDDNHRTSA-N 327.222 1.495 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(NC(=O)COc2ccc(N)cc2)C1 2223011650 ITHXJXCJIROYAN-XIKOKIGWSA-N 347.415 1.773 10 10 EDCE CN1C(=O)NC(=O)C(=Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1=O 2294619914 LOJOCZYRBYKQHR-UHFFFAOYSA-N 341.279 1.946 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2329326242 NDGLWLGBOQPOSX-KEHYKAFYSA-N 327.222 1.399 10 10 EDCE OCc1ccc(N2C[C@H]3OC[C@H](CO)[C@H]3C2)cc1Br 2330879532 GILHLYUUMSISSF-ZKYQVNSYSA-N 328.206 1.385 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cccn(C)c3=O)CC2)cc1 74706095 ZTOPCWHYNHNSHY-UHFFFAOYSA-N 327.384 1.356 10 10 EDCE CNC[C@@H](O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951829430 JCLDBPJQRFAJIV-BXUZGUMPSA-N 326.393 1.114 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCOCC(F)F)CC2)cc1 191597009 WBFOORRLHHGMTN-UHFFFAOYSA-N 343.374 1.809 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3cc(C)nn3C)CC2)cc1 82320281 GDMOWPZFSFARIT-UHFFFAOYSA-N 328.416 1.628 10 10 EDCE COC(=O)/C(=C/N(C)C)C1=NN(c2ccccc2)C(=O)/C1=C/N(C)C 97526997 LZFSEKQTFSZXIA-LCPPQYOVSA-N 342.399 1.453 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2c(O)ccc(Cl)c2F)CCO1 529640158 BOIORGZDPPDXIL-VIFPVBQESA-N 331.775 1.315 10 10 EDCE CN(CCCCO)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 276459536 MTZIFZGKVVMIPO-UHFFFAOYSA-N 339.411 1.576 10 10 EDCE CC(C)[C@]1(CO)CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 377980887 BLLPJDIZHUFHTB-MRXNPFEDSA-N 335.360 1.771 10 10 EDCE Cc1ccc(CN[C@@H]2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(O)c1Br 2380794203 YFSHXHTXGJVCAG-XBIAIPMCSA-N 342.233 1.683 10 10 EDCE C[C@H](NC(=O)C(=O)N1CCOCC2(CC2)C1)c1ccc(N(C)C)cc1 807674411 KMKFLEYIMKGMOF-AWEZNQCLSA-N 345.443 1.569 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC(c3ccccn3)C2)c1 913377931 FZRUHLJRWBETNE-UHFFFAOYSA-N 347.396 1.398 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCCC2CC(F)(F)C2)cc1 1325893777 AQXTVXABTQVEBC-UHFFFAOYSA-N 339.386 1.920 10 10 EDCE C[C@H](O)c1ccc(N(C)Cc2nnn(C)n2)c(Br)c1 1892993462 VDSSSXITNBZXIA-QMMMGPOBSA-N 326.198 1.662 10 10 EDCE Cc1cc(O)c(CN2CCN(CC(=O)N(C)C)CC2)c(Cl)c1 840910978 ZDTNOIZPEWQPPB-UHFFFAOYSA-N 325.840 1.560 10 10 EDCE COc1cc(O)c(CN2CCNC[C@H]2c2cccnc2)cc1OC 843116164 MLYLQZTYBNRWAY-HNNXBMFYSA-N 329.400 1.951 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCC[C@H]1CC(=O)N(C)C1 919068641 ACMBWIGIFPUYKO-AWEZNQCLSA-N 332.448 1.729 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3coc(C(N)=O)c3)C2)cc1 855226474 PJWCMYFJGGNQQG-GFCCVEGCSA-N 329.356 1.396 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H]2C(F)(F)F)c1 854519404 BTJBFTUKKOZACF-JTQLQIEISA-N 338.307 1.541 10 10 EDCE N[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)C(F)(F)F 852869083 UFGPWSANSMUZRD-ZDUSSCGKSA-N 331.338 1.154 10 10 EDCE CCn1c(S)nnc1CCNC(=O)NCc1c(O)cccc1F 922863579 IVJNVNXMMORUGR-UHFFFAOYSA-N 339.396 1.473 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H](CCC3OCCO3)C2=O)cc1 924444240 FSAPMTAXCBOXTE-CQSZACIVSA-N 333.388 1.326 10 10 EDCE CS(=O)(=O)NC[C@@H]1CCC[C@H]1NCc1ccc2c(c1)CCCO2 922106536 QQCBHUIYOQNIMX-JKSUJKDBSA-N 338.473 1.819 10 10 EDCE CCn1cc(CC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)cn1 855224513 FPGMBRZQMHRRPC-OAHLLOKOSA-N 328.416 1.849 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@](C)(O)C3)C2)cc1 854298582 FZOSNXYENVNUSE-KDOFPFPSSA-N 333.432 1.830 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)[C@H]2C[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1 858815036 IZFDZKKGVITXTE-STNZKUDTSA-N 333.344 1.481 10 10 EDCE C[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccnn1C 856209582 TUHLFIZWWQBKHM-AWEZNQCLSA-N 342.443 1.801 10 10 EDCE C[C@H](NCCc1nnnn1C)c1ccc(Br)cc1O 756678777 YHPLQRITAXKMGP-QMMMGPOBSA-N 326.198 1.572 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@@H](n4ccnc4)C3)cc2N1 761891299 HQNGAGLKZPCTDB-LLVKDONJSA-N 343.343 1.964 10 10 EDCE OCCOc1cncc(NCc2cccc(Br)c2O)n1 764934077 ISFFYRCKZIPSIX-UHFFFAOYSA-N 340.177 1.928 10 10 EDCE O=C1C[C@@H](C(=O)N2Cc3cccc(O)c3C2)CN1Cc1ccccn1 871197969 BTGQSOFCXZTQGU-CQSZACIVSA-N 337.379 1.678 10 10 EDCE CCCCN(CCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 92775520 RSKQIIDJRDSEAB-CYBMUJFWSA-N 342.237 2.000 10 10 EDCE O=C(NCc1cc(O)ccc1O)C1CCN([C@H]2CCSC2)CC1 1303225704 NUPSFMWUQIGZNF-AWEZNQCLSA-N 336.457 1.932 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)CCCC(N)=O)C2)cc1C 1317127773 HGJIPOFELQEMLG-GASCZTMLSA-N 333.432 1.396 10 10 EDCE COc1cc(C=O)ccc1OCC(=O)NCc1c(O)cccc1O 1178905437 NQLLLHJOXCWXBT-UHFFFAOYSA-N 331.324 1.614 10 10 EDCE CCCCN1CC[C@](O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1325161815 QHVCPFISOQQWPA-KRWDZBQOSA-N 347.419 1.816 10 10 EDCE Cc1cc(O)c(CN2CN(CCN(C)C)C(=O)[C@@H]2C)cc1Cl 1261677826 DHRNXQSZNBUOIT-LBPRGKRZSA-N 325.840 1.906 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)Nc3ccc[n+]([O-])c3)C2)cc1 1346593098 CZDPIJKJSKMSBX-AWEZNQCLSA-N 342.399 1.977 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@H](C)N(C)C(=O)C2CC2)cc1 1270870661 NPVMRVWNHGFMEN-LBPRGKRZSA-N 344.419 1.017 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@]23COC[C@@H]2C3)cc1C 1283613304 WPAPYOOQHOMIMA-ALKREAHSSA-N 332.444 1.977 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2COCCN2CC(F)F)c1 1294937369 ODTBNAAZMQWXMX-GWCFXTLKSA-N 344.358 1.544 10 10 EDCE O=C(N[C@H]1CCN(c2ccc(F)cc2)C1=O)c1c(F)ccc(O)c1O 1457866132 RDRHPGACIAFBEF-LBPRGKRZSA-N 348.305 1.911 10 10 EDCE CCS(=O)(=O)c1ccccc1CC(=O)NCc1ccc(O)c(O)c1 1465953276 DLHMRKGFILYGCP-UHFFFAOYSA-N 349.408 1.750 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1ncnc(O)c1Br 1545639583 VEJCCUBOTVCQTI-UHFFFAOYSA-N 340.133 1.286 10 10 EDCE CC[C@H](F)C(=O)NC[C@@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1705230778 PBVOFDCSGSGLJD-STQMWFEESA-N 349.366 1.928 10 10 EDCE CC(=O)N/C(=C\c1cccs1)C(=O)NCc1c(O)cccc1O 1635847679 RLXXMCCZOBARFD-JYRVWZFOSA-N 332.381 1.953 10 10 EDCE Cn1cc(Br)c(CNC(=O)NCc2ccccc2O)n1 1564785911 RDJUUJLGAAOFHM-UHFFFAOYSA-N 339.193 1.888 10 10 EDCE O=C(CN1C(=O)/C(=C\c2ccccc2)SC1=S)N1CCOCC1 1009675 QHAPIBUCXUSWOC-JLHYYAGUSA-N 348.449 1.747 10 10 EDCE COCCN(C)CCn1c(C)nnc1N(C)Cc1ccccc1O 1769782755 BXIKKFKPAKGEII-UHFFFAOYSA-N 333.436 1.507 10 10 EDCE Cc1nc2ccccn2c1/C=C1/SC(=S)N(CC(=O)O)C1=O 1858588350 AAQSUGBWLCONHO-UXBLZVDNSA-N 333.394 1.929 10 10 EDCE Nc1ccc(OCCN2CCC(NC(=O)[C@@H]3CCCO3)CC2)cc1 586044785 MKRNIYRQVFFINU-KRWDZBQOSA-N 333.432 1.407 10 10 EDCE Oc1ccc(Br)cc1CN[C@H]1COC2(CCC2)[C@H]1O 2141559866 WLZVTUCOLDBBMT-AAEUAGOBSA-N 328.206 1.927 10 10 EDCE COc1cc([N+](=O)[O-])ccc1-n1nnnc1Cc1ccc(N)cc1 1857926782 ACMCEGQMWRIJSK-UHFFFAOYSA-N 326.316 1.752 10 10 EDCE CN1[C@H](CNCc2cc(Br)ccc2O)CCS1(=O)=O 1967749133 UHUSDOWHUVPIBB-NSHDSACASA-N 349.250 1.278 10 10 EDCE NCc1ccc(N2CCC[C@@H](OCC(N)=O)C2)c(Br)c1 2145380654 BJSPPJNCBXFSSS-LLVKDONJSA-N 342.237 1.379 10 10 EDCE CO[C@@H](C(=O)NCCCN=[N+]=[N-])C1CN(C(=O)OC(C)(C)C)C1 1985101913 ZORFTRJXUSBMMP-LLVKDONJSA-N 327.385 1.685 10 10 EDCE CS(=O)(=O)c1cnn(Cc2cccc(C(F)(F)F)c2O)c1O 2070261372 WJRTVJOYHHYSDB-UHFFFAOYSA-N 336.291 1.765 10 10 EDCE C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)O)c1ccccc1O 1632255024 KCBLFBFNMZHQBF-WDMOLILDSA-N 338.404 1.844 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)C[C@H]1C(=O)NCCCCN=[N+]=[N-] 1908254957 YHTMQFSIEIJGRR-NEPJUHHUSA-N 341.412 1.954 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCC[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1908254796 VQQPJQASLYDLBQ-SDDRHHMPSA-N 339.396 1.827 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C)C[C@@H]2CCO)cc1Br 2202830161 JUUXCCZEIOEEGY-YPMHNXCESA-N 342.281 1.972 10 10 EDCE COc1ccc(Br)c(CNCC(C)(C)C(N)=O)c1O 2227749632 UWHKXXCWSVAMGL-UHFFFAOYSA-N 331.210 1.764 10 10 EDCE CC[C@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2288906486 WYDSHDYKWIDMMP-UHTWSYAYSA-N 341.205 1.784 10 10 EDCE Cc1ccc(CN2CCNC[C@]2(C)CO)c(O)c1Br 2352684803 TXOJXTSHIIWDCN-CQSZACIVSA-N 329.238 1.619 10 10 EDCE CN1CCCc2cc(CNC(=O)CN3C(=O)NC(C)(C)C3=O)ccc21 58768705 OZOWRBUOYDTCKP-UHFFFAOYSA-N 344.415 1.016 10 10 EDCE Cc1n[nH]c([C@@H]2CN(C(=O)NCc3ccc(N(C)C)cc3)CCO2)n1 175323282 YHCAMOIRLJFEET-HNNXBMFYSA-N 344.419 1.462 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CN2CCCN(c3cccnn3)CC2)c1 171548488 ILPAVGXFVDGILX-UHFFFAOYSA-N 329.360 1.803 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CCN(c3ccccc3)C2=O)c(O)c1O 179489904 GVTOORYSKWZIGB-AWEZNQCLSA-N 326.352 1.942 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2357585981 SVGVGHINUXPFQT-CNSIFVFBSA-N 342.233 1.823 10 10 EDCE CCOC(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCCCC1 36100092 CAWBFIGWQIKOAZ-QGZVFWFLSA-N 347.459 1.959 10 10 EDCE C[C@]1(CNS(=O)(=O)CCOc2ccc(N)cc2)CCCS1 121990002 QHHUAYDECXDCOT-CQSZACIVSA-N 330.475 1.853 10 10 EDCE COc1cc([N+](=O)[O-])cc([C@H]2N[C@@H](C(=O)O)C(C)(C)S2)c1O 83236940 ZLUBVFJCYFVRGW-QWRGUYRKSA-N 328.346 1.876 10 10 EDCE O=C(O)c1cc(O)ccc1NS(=O)(=O)c1cn2c(n1)CCCC2 364415841 FGICOJRHERBCEA-UHFFFAOYSA-N 337.357 1.424 10 10 EDCE CC(C)CN1CCO[C@H](CNC(=O)COc2ccc(N(C)C)cc2)C1 277694379 DRMPEBKVJMKYFZ-GOSISDBHSA-N 349.475 1.604 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCCSCC3)nc12 270700272 XDTPIWJAFVMEFF-UHFFFAOYSA-N 336.417 1.551 10 10 EDCE Cc1ccc(CN(C)c2ncc(N)c(=N)[nH]2)c(O)c1Br 2380784103 YVIRXIRWCFMJSS-UHFFFAOYSA-N 338.209 1.884 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N3C[C@@H](C)[C@H]3C)CC2)cc1 297163818 JMTAHRXJFJNGJM-HZPDHXFCSA-N 346.475 1.867 10 10 EDCE Cc1cc(CN2CCN(c3nccn(C)c3=O)CC2)ccc1N(C)C 815055635 HNNDRKUBHPRMSJ-UHFFFAOYSA-N 341.459 1.477 10 10 EDCE C[C@@H]1CCCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1C(=O)O 818331685 XMVZAJFRRXQFPB-RDTXWAMCSA-N 347.459 1.896 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H]1CN1CCOCC1 588405748 OQMZYTLUNBHIHV-ZDTYVGOBSA-N 332.400 1.434 10 10 EDCE C[C@H]1CN(CCO)CCN1C(=O)c1cc2cc(O)c(O)cc2s1 909436445 NKEMACJLLIEMIU-JTQLQIEISA-N 336.413 1.451 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@@H](O)C[C@@H](O)C3)ccc21 674808960 QEYKEHNYXOFIAL-IYBDPMFKSA-N 346.427 1.472 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)C[C@H]3CCCO3)C2)cc1 849416413 QWLWFMWQBNCXAL-XJKSGUPXSA-N 340.445 1.372 10 10 EDCE C[C@@H](NC[C@@H](O)CS(C)(=O)=O)c1cc2c(cc1O)CCCC2 927023857 JDQFVUVJFPCFKH-BXUZGUMPSA-N 327.446 1.327 10 10 EDCE C[C@H](NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1[C@H]2CN[C@H]1C2 925501334 IFOVSNXVYJJRBA-KTGNWYGMSA-N 329.488 1.981 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@@H]3CCOC3)C2)cc1 852250828 FDQRZOAAAWYTGP-HUUCEWRRSA-N 333.432 2.000 10 10 EDCE O=C(NCCCSc1nccs1)N1CCn2c(O)nnc2C1 853854527 BJRJFIGZMBIFEG-UHFFFAOYSA-N 340.434 1.148 10 10 EDCE Cc1nc(CC(=O)NCc2cc(Br)ccc2O)n[nH]1 854442360 PLOCHXXAYJIYQK-UHFFFAOYSA-N 325.166 1.440 10 10 EDCE COc1ccc(N2CC[C@H](Nc3cncc(-n4cncn4)n3)C2)cc1 853758910 MNEDKAYXLDLMRT-ZDUSSCGKSA-N 337.387 1.757 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CSCN3C(C)=O)C2)cc1 855228962 GMAIWBOKKTUPJH-CJNGLKHVSA-N 349.456 1.312 10 10 EDCE C[C@H]1CCCN(C(=O)C(=O)NCc2ccc3cccnc3c2O)C1 862027086 IUOWKKSRZYRBBN-LBPRGKRZSA-N 327.384 1.815 10 10 EDCE Cn1cc(CNC(=O)NCc2cccc(Br)c2O)nn1 764807866 WPINGSKLLOBRSA-UHFFFAOYSA-N 340.181 1.283 10 10 EDCE CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 875253632 XCWYHQJRXMATAH-UHFFFAOYSA-N 345.443 1.505 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2C(=O)OCC[C@H]2C1 897262549 OSKSHZIUPMRCOE-JTQLQIEISA-N 348.380 1.979 10 10 EDCE C[C@H](NC(=O)C(=O)N1C[C@H]2CSC[C@H]2C1)c1ccc(N(C)C)cc1 897866068 QRHKWXSPPPZKHS-AEGPPILISA-N 347.484 1.751 10 10 EDCE COC(=O)CC1(NCc2cccc(C)c2O)CCS(=O)(=O)CC1 784669568 BZTAEJZEZICHFX-UHFFFAOYSA-N 341.429 1.301 10 10 EDCE CC1(C)CC(=O)NCCN1Cc1ccc(N2CCC(O)CC2)cc1 895400584 TWVWKQCQNWTYEJ-UHFFFAOYSA-N 331.460 1.748 10 10 EDCE COC(=O)c1c(CN2C[C@@H]3CNC[C@H]3C2)c2cc(F)ccc2n1C 894097156 DAOGEGIXGYNFJX-RYUDHWBXSA-N 331.391 1.755 10 10 EDCE COCCc1cc(NC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n(C)n1 797635747 HIUCUTDCFRYICX-NSHDSACASA-N 348.403 1.773 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(C)[C@@H](CO)C2)c(Br)c1 687613169 YTPDUXCQGOLYDW-DGCLKSJQSA-N 342.281 1.842 10 10 EDCE COC(=O)c1cc(S(=O)(=O)Nc2ccc(O)c(OC)c2)cn1C 797819384 HQEDTIXVYRQXTA-UHFFFAOYSA-N 340.357 1.327 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)C[C@]2(C)CO)c(Br)c1 698159136 XDQLDBRQFQNASB-OLUVUFQESA-N 330.222 1.824 10 10 EDCE CN(C)[C@@H]1CC[C@H]2[C@H](C1)OCCN2C(=O)Cc1ccc(O)c(O)c1 1151552985 ZJPLQRQICDAFFP-KEYYUXOJSA-N 334.416 1.350 10 10 EDCE COc1c(C(=O)NCc2ccc(N3CCOCC3)cc2)cnn1C 1327318874 DNPCXEMCBLPOQH-UHFFFAOYSA-N 330.388 1.195 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@]4(CNC(=O)C4)C3)cc2F)CC1 1320962092 BEGWSIRAULQZBH-IBGZPJMESA-N 346.450 1.290 10 10 EDCE CN(C)c1ccc([C@@H](CNc2ncc([N+](=O)[O-])c(N)n2)N(C)C)cc1 1187834011 YYMVXHHLOMUGRJ-CYBMUJFWSA-N 345.407 1.748 10 10 EDCE C[C@@H](NC(=O)C(=O)N1CC[C@@]12CCOC2)c1ccc(N(C)C)cc1 1331649508 MWOSXYIEGMHQGZ-ACJLOTCBSA-N 331.416 1.321 10 10 EDCE NCc1ccc(N2CCN3CCOC[C@@H]3C2)cc1Br 2129377245 CFXGFPJTZAKWFJ-ZDUSSCGKSA-N 326.238 1.429 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)Cn2ccnc2)cc1C 1274841182 PMSFUTMRJCISGU-HNNXBMFYSA-N 330.432 1.885 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1C[C@@H]2CCC[C@H]21 1351287413 JYGNOENEPBMTAV-IAOVAPTHSA-N 329.444 1.982 10 10 EDCE CCOCC(=O)N1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1299369119 ILIZECKQXBDYIB-UHFFFAOYSA-N 347.375 1.168 10 10 EDCE C[C@@H](NCc1cc(F)ccc1O)C1(O)CN(C(=O)OC(C)(C)C)C1 1918695541 YIAHULAATTWFRB-LLVKDONJSA-N 340.395 1.991 10 10 EDCE O=C(NCc1cc(O)nc(O)n1)c1cc2cc(O)c(O)cc2s1 1469439427 YCJRWCAYBREONA-UHFFFAOYSA-N 333.325 1.444 10 10 EDCE Cc1nc2ncnn2c(C)c1CCC(=O)NCc1cc(O)ccc1O 1471660924 NLVVWAAEBVOQSG-UHFFFAOYSA-N 341.371 1.401 10 10 EDCE COc1c(C)[nH]cc(CN(C)C(=O)/C=C\c2ccc(O)c(O)c2)c1=O 1470681637 NWTAPONIJWAICV-ALCCZGGFSA-N 344.367 1.775 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CC[C@@H](CNCCO)C2)cc1 1700914058 VGYQJKCBJPIBJJ-RISCZKNCSA-N 333.392 1.329 10 10 EDCE CCc1n[nH]cc1C(=O)NC[C@H](CO)NCc1ccc(OC)c(C)c1 1717769513 NYIPGLHBOWBCDF-CQSZACIVSA-N 346.431 1.170 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)c2[nH]nnc2C)cc1C 1725138047 XHRZJAQJZQEEDB-RYUDHWBXSA-N 331.420 1.727 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccn1CC 1632355885 GGHJYXUDLVLKRT-ZDUSSCGKSA-N 346.383 1.823 10 10 EDCE C[C@@H](CNC[C@H]1CCOC1)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1732461941 YJHMNLWYIGNYMO-QWHCGFSZSA-N 347.419 1.936 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)CCCC(N)=O)C2)cc1C 1690301287 HGJIPOFELQEMLG-SHTZXODSSA-N 333.432 1.396 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc2ccccc2c(=O)[nH]1 152979071 HMCKLHGJCFXFPA-JTQLQIEISA-N 339.351 1.695 10 10 EDCE CC[C@H](O)CN1CCN(C(=O)NCc2ccc(N(C)C)cc2)CC1 155532351 DVBSJWQWMCBYAH-KRWDZBQOSA-N 334.464 1.351 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CC=C(Br)CC1 2148816948 XABLMUSJBXFAIL-NSHDSACASA-N 341.205 1.479 10 10 EDCE CC(C)(C)OC(=O)NCc1nc(C(=O)C(=O)C[C@H]2C[C@H](N)C2)co1 2003171557 YAOSJZHABREPCS-MGCOHNPYSA-N 337.376 1.579 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N(C)Cc1ccc(N)cc1 2022867257 IOEHACZMVMJVGV-SMDDNHRTSA-N 337.420 1.501 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC[C@H](OC)C3)c(Br)cc21 300181202 UDVLNHKTLKJOPE-ISVAXAHUSA-N 340.221 1.887 10 10 EDCE CC(=O)N1CCN(C(=O)C=Cc2ccc3c(c2)CCCN3C)CC1 2041595267 MTJAZHWRGUZDTO-UHFFFAOYSA-N 327.428 1.773 10 10 EDCE C[C@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)CCO1 92774828 JUVUEZDCKRLCBM-MADCSZMMSA-N 326.194 1.626 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H]3CCCN(CC4CC4)C3)c2n1 2063554436 POIVZDSOPLKIDR-CQSZACIVSA-N 343.431 1.595 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NCc2ccc(F)cc2O)C1 1911381007 BICTYMIGNIWUDC-ZIAGYGMSSA-N 340.395 1.991 10 10 EDCE O=C1NC(=O)N(C2CCCC2)C(=O)/C1=C\c1ccc(C(=O)O)cc1 15013934 KSHWKZWBUFFCAD-LCYFTJDESA-N 328.324 1.789 10 10 EDCE CO[C@H]1C[C@H](O)CN(c2ccc(CN)c(Br)c2F)C1 2109020936 TYLLWSZCVGNMHK-UWVGGRQHSA-N 333.201 1.633 10 10 EDCE CC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 55523197 FDNIDITVUGGAMK-QGZVFWFLSA-N 349.406 1.289 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)c2[nH]nnc2C)cc1C 1266167198 PYETVZCQZHZJCK-GFCCVEGCSA-N 331.420 1.728 10 10 EDCE Cc1cc(N(C)C)ccc1CNS(=O)(=O)N1C[C@@H](C)O[C@H](C)C1 115592846 WMSSZPMEFAJULH-ZIAGYGMSSA-N 341.477 1.505 10 10 EDCE [N-]=[N+]=NCCCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21 252487107 HSSTWUOLSWCKKL-NTZNESFSSA-N 340.453 1.919 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)CNC(=O)c1ccc(Br)o1 2362994434 VAKFQKCHJIWTRW-UHFFFAOYSA-N 344.169 1.931 10 10 EDCE Oc1ccc(Br)cc1CN1CCN2CCOC[C@H]2C1 368814476 SHXQLVGYXLYVNL-CYBMUJFWSA-N 327.222 1.671 10 10 EDCE N[C@@H]1CCCC[C@H]1NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255076298 LYLIOVGNDUYQSF-HJPCAMOWSA-N 329.444 1.923 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@H](CO)C[C@H](O)C(C)(C)C)c1 284543168 XOKGPLJEWJTKQP-RBOXIYTFSA-N 339.432 1.987 10 10 EDCE CN=c1nc(C)[nH]c(=NCc2ccc(C)c(Br)c2O)[nH]1 2380743694 FQVQPUSGXHIOFY-UHFFFAOYSA-N 338.209 1.454 10 10 EDCE Cc1ccc(CN2CCN([C@H](C)CO)CC2)c(O)c1Br 2380813157 DCJDREKAIRPPCA-GFCCVEGCSA-N 343.265 1.962 10 10 EDCE O=C(O)c1cccc(COn2c(=O)c(=O)oc3ccc(Cl)cc32)c1 821300346 VGMLFFJUJIVOBS-UHFFFAOYSA-N 347.710 1.935 10 10 EDCE COC(=O)[C@]12C[C@H](N)C[C@H]1CN(Cc1ccc(N(C)C)cc1C)C2 903977686 WAQPSMMMTPEOLC-FCEWJHQRSA-N 331.460 1.773 10 10 EDCE CN(Cc1ccccc1O)C[C@@H](O)COc1ccc2c(c1)OCO2 731843026 NRZXUIKEJUHKJS-CQSZACIVSA-N 331.368 1.993 10 10 EDCE CC[C@H](CNS(C)(=O)=O)NC/C=C/c1ccc(N(C)C)cc1 835053566 DHYSEDGFEGUPRQ-LQYUOIDQSA-N 325.478 1.683 10 10 EDCE COc1ccccc1[C@H](O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 907272194 FUCCMCCVCNACTL-GTNSWQLSSA-N 331.368 1.887 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NC[C@H](C)C(C)C)cc1 846734569 VOIJYWOAKBPQGK-HNNXBMFYSA-N 349.475 1.998 10 10 EDCE Nc1ccc(CCNC(=O)N2CC[C@H](CN3CCOC3=O)C2)cc1 841955697 KFYGKYVLWYCJAJ-AWEZNQCLSA-N 332.404 1.295 10 10 EDCE COC1(CS(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)CCOCC1 844656173 GIFVRSFKKPMEDH-UHFFFAOYSA-N 345.373 1.028 10 10 EDCE CCC1CCN(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)CC1 849218320 UKSBUCBEKRIUNQ-UHFFFAOYSA-N 328.390 1.869 10 10 EDCE C[C@@H]1[C@@H](NC(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCN1C 924009669 YFPOLBQASUQTCP-QAPCUYQASA-N 345.491 1.330 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H](C)[C@@H]3[C@H]4CN[C@H]3C4)CC2)cc1 925508530 QRAPVUNQHQDSRI-ACZWYYKOSA-N 344.503 1.403 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H]3CCC[C@H]3O)C2)cc1 854296029 AHCJPKAMBTYXBI-JJRVBVJISA-N 333.432 1.734 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)COCC(F)F 858200796 CFSMZUNIIQPBFY-UHFFFAOYSA-N 328.359 1.763 10 10 EDCE C[C@@H]1[C@H](C(F)(F)F)OCCN1Cc1cc2c(cc1O)OC[C@@H]2O 853571471 CFCMUTKPXGHFPN-CWONEXCFSA-N 333.306 1.970 10 10 EDCE CCOC1(CS(=O)(=O)N2Cc3cccc(O)c3C2)CCOCC1 867690927 NYOZPLXFHOWVTP-UHFFFAOYSA-N 341.429 1.623 10 10 EDCE CCN(CC)c1ccc(CNC(=O)c2ccc3c(c2)B(O)OC3)cc1 863871316 IVEJKNJQOXMAGC-UHFFFAOYSA-N 338.216 1.681 10 10 EDCE O=C1OCC[C@H]2CN(Cc3ccc(N4CCOCC4)c(F)c3)CCN12 770391031 JPFWNYWVIVLCML-HNNXBMFYSA-N 349.406 1.689 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@@H](C)CO3)CC2)cc1 896330990 QETQOUGTQOITEQ-QAPCUYQASA-N 347.459 1.358 10 10 EDCE Cc1oc2ncn(C)c(=O)c2c1C(=O)NCc1cccc(O)c1O 1176564737 DGUOKIXYDREZLV-UHFFFAOYSA-N 329.312 1.176 10 10 EDCE CN1CCC(CN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329360718 KZKQGIGDWCZRJS-UHFFFAOYSA-N 331.416 1.035 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)C[C@@H]1CCOC1 1276010672 ISGWXGCBCCURNW-STQMWFEESA-N 347.419 1.936 10 10 EDCE CS(=O)(=O)C1CCC(C(=O)NCc2c(O)cccc2O)CC1 1456319034 NKDKYIGYMPSCGX-UHFFFAOYSA-N 327.402 1.317 10 10 EDCE NC(=O)c1cn(CC(=O)NCc2ccc(O)cc2O)c2ccccc12 1299570590 KENSOOWFNBVNST-UHFFFAOYSA-N 339.351 1.468 10 10 EDCE CO[C@@H](C)CN[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1713885638 NOAGQEVARPRGAJ-XHDPSFHLSA-N 347.419 1.982 10 10 EDCE OCc1ccc(N2CC[C@]3(C[C@H](O)CO3)C2)c(Br)c1 2137134468 QBGLLFDWTPOQOB-FZMZJTMJSA-N 328.206 1.672 10 10 EDCE CCC[C@]1(C)C(=O)NCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1625425082 NNQZIKNCKSUBQK-MRXNPFEDSA-N 331.376 1.980 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1485184520 ULXIAYUGIVSASL-PDFKHUOFSA-N 332.444 1.879 10 10 EDCE CC[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H](C)OC 1714124935 KMTYNYPNERBNGV-YPMHNXCESA-N 335.408 1.982 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cn(Cc2cccs2)nn1 1638353034 ZUNSNVHYJQOOGQ-UHFFFAOYSA-N 330.369 1.729 10 10 EDCE Cc1ccc(O)c(CNC(=O)CNC(=O)c2cc(Cl)ccn2)c1 1641758535 DWAXBZRNSWRCIX-UHFFFAOYSA-N 333.775 1.795 10 10 EDCE C[C@@H](NC(=O)c1c2c(nn1C)CCS(=O)(=O)C2)c1ccccc1O 1643741997 JECXPYJGSOGJNI-SNVBAGLBSA-N 349.412 1.088 10 10 EDCE CCn1nccc1C(=O)NC[C@@H](CO)NCc1ccc(OC)c(C)c1 1734366131 RGYWSUMHWBZQKC-HNNXBMFYSA-N 346.431 1.101 10 10 EDCE CC(C)CNC(=O)N1CCC[C@H](C(=O)NCc2ccc(O)cc2O)C1 1570462397 RQGFJNYDAWSNRH-AWEZNQCLSA-N 349.431 1.792 10 10 EDCE COCCNC[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1C 1733557994 GIVDGFFBSATXAI-GXTWGEPZSA-N 347.419 1.793 10 10 EDCE COCCC(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1747490517 RVNXGQFFTVLKNE-JTQLQIEISA-N 335.364 1.120 10 10 EDCE CC[C@@H](CNC(=O)Cc1cncn1C)NCc1ccc(OC)c(C)c1 1665871208 DZJGTKMFTFGARW-INIZCTEOSA-N 344.459 1.964 10 10 EDCE O=C1CC[C@](C(=O)NCc2c(O)cccc2O)(c2ccccc2)CN1 1597574812 TUJMAROEAGDZKG-LJQANCHMSA-N 340.379 1.562 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCN2C(=O)CSC2=O)cc1 1596887670 USILOOINLXXVOJ-UHFFFAOYSA-N 335.345 1.274 10 10 EDCE CCN1CCO[C@H](C(=O)N[C@@H](C)CNCc2ccc(OC)c(C)c2)C1 1699433301 ZCGJLUHBCASZNN-YJBOKZPZSA-N 349.475 1.319 10 10 EDCE COC(=O)c1ccccc1NC(=O)CCN1C(=O)CSC1=S 1865768042 HQOGBCKWROHYFD-UHFFFAOYSA-N 338.410 1.662 10 10 EDCE CC(C)(C)OC(=O)N1CC(F)(CNC(=O)c2cccc(O)c2O)C1 1962815386 RDEDCTUFJYZVGH-UHFFFAOYSA-N 340.351 1.787 10 10 EDCE O=C1OCCN1CCNCc1cc(Br)cc(F)c1O 1963612506 LGTFMQNALLWGGZ-UHFFFAOYSA-N 333.157 1.836 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CN1CCC[C@@H](NC(=O)OC(C)(C)C)C1 2010388721 GEJRAVMOQOHFGX-GFCCVEGCSA-N 340.428 1.744 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)c1cn(CCNC(=O)OC(C)(C)C)nn1 2010405896 NJHMXMMFFMJPIK-UHFFFAOYSA-N 338.372 1.185 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010405598 JNSWKSVBEANJED-MNOVXSKESA-N 341.412 1.952 10 10 EDCE C[C@H]1CN(c2ccc(CN)c(Br)c2F)C[C@H](CO)O1 300427268 GOPNBXQDQRSNMA-WCBMZHEXSA-N 333.201 1.633 10 10 EDCE CNCc1ccc(N2CC3(C2)OCCC[C@H]3O)c(Br)c1 2159651255 TYDILPNMHUTJNT-CQSZACIVSA-N 341.249 1.899 10 10 EDCE CC(C)(C)NCc1ccc(N2CC(O)(CO)C2)cc1Br 2171948905 QOVPYERUNONNPG-UHFFFAOYSA-N 343.265 1.881 10 10 EDCE C[C@H](O)[C@@H]1CCCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2193587784 ZOCAZPYTPVTWIA-LCHGKGQCSA-N 340.221 1.751 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)C[C@@H]1C(=O)NCCCCN=[N+]=[N-] 1908254958 YHTMQFSIEIJGRR-VXGBXAGGSA-N 341.412 1.954 10 10 EDCE CN(C[C@@H](N)COCc1ccccc1)C(=O)c1cc(O)c(O)c(O)c1 2068615796 TUEGCZHFUBGUGW-CQSZACIVSA-N 346.383 1.420 10 10 EDCE CNCc1ccc(N2C[C@@H](O)C[C@@H](OC)C2)cc1Br 2109023084 WKNRAGGLSZWFDC-QWHCGFSZSA-N 329.238 1.755 10 10 EDCE CS(=O)(=O)[C@H]1COC[C@H]1Nc1c(N)cccc1Br 2086312733 NARRILZEDFIQSP-ZJUUUORDSA-N 335.223 1.255 10 10 EDCE CNCc1ccc(N2C[C@H]3OCCO[C@@H]3C2)cc1Br 2093348415 FYFRWVKXULNSDM-ZIAGYGMSSA-N 327.222 1.773 10 10 EDCE CN1CCO[C@H]2CN(c3ccc(CO)cc3Br)C[C@H]21 2097691765 CGAJYRMMTGZIFG-KGLIPLIRSA-N 327.222 1.461 10 10 EDCE CCN(c1ccc(CNC)c(Br)c1)[C@@H]1CCNC1=O 2114773603 XJNKZQRTBPJFCF-CYBMUJFWSA-N 326.238 1.883 10 10 EDCE C[C@H](O)c1ccc(N(C)[C@H]2CC(=O)NC2=O)c(Br)c1 2114727465 PRVNBIXZDAVZGN-CPCISQLKSA-N 327.178 1.354 10 10 EDCE CN(C)C[C@H]1COC[C@H]1NCc1cc(Br)cc(F)c1O 2206389155 AXRHHYWNIJREEK-GXFFZTMASA-N 347.228 1.960 10 10 EDCE OC[C@@H]1NC[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@H]21 2227311130 AIUODBZGLWQQJH-RTXFEEFZSA-N 327.222 1.167 10 10 EDCE CC(C)NCc1ccc(N2CC[C@H]2[C@H](O)CO)cc1Br 2286209018 MXDXLEWONIUADT-LSDHHAIUSA-N 343.265 1.879 10 10 EDCE CN1C(=O)NC(=O)C(=Cc2ccc(-c3ccc(C(=O)O)cc3)o2)C1=O 2297301768 WRQALGRJWYGHCO-UHFFFAOYSA-N 340.291 1.736 10 10 EDCE Cc1c(CNC(=O)C=Cc2ccc(N3CCOCC3)cc2)cnn1C 2304507289 FWPREZNNBZMHHY-UHFFFAOYSA-N 340.427 1.895 10 10 EDCE CCN(C)S(=O)(=O)NCc1ccc(C)c(Br)c1O 2327792934 PMXWYFZPRUEFSC-UHFFFAOYSA-N 337.239 1.749 10 10 EDCE C[C@H](NC(=O)N[C@@H](C)[C@@H](C)CO)c1ccc(N2CCOCC2)cc1 77796536 YZKGIOKPWSWXSI-KKUMJFAQSA-N 335.448 1.900 10 10 EDCE C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCN1C[C@@H](C)O 120600587 OETNQIVJTMWVJP-WDEREUQCSA-N 343.811 1.841 10 10 EDCE O=C(Nc1ccc(S(=O)(=O)O)cc1)Nc1cc(O)c(O)c(O)c1 217278617 WKRUDTAYQLMFJK-UHFFFAOYSA-N 340.313 1.694 10 10 EDCE COCCCCS(=O)(=O)NCc1ccc2c(c1)CCCN2C 133984724 CDJMNUAQXJXLAZ-UHFFFAOYSA-N 326.462 1.915 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H]3CCCCC(=O)N3)CC2)cc1 193873349 FMWRMVXWXIMTSD-KRWDZBQOSA-N 345.443 1.793 10 10 EDCE COc1ccc(-n2cc(CNC(=O)c3cccc(O)c3O)nn2)cc1 365945295 LDTJLAROTLDHQY-UHFFFAOYSA-N 340.339 1.617 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@H](OC)C2)cc1Br 396076767 YCQTXWLGIZIGPS-OWYVNGRQSA-N 329.238 1.925 10 10 EDCE C[C@@H](NC(=O)C(=O)N1CCOCC2(CC2)C1)c1ccc(N(C)C)cc1 807674412 KMKFLEYIMKGMOF-CQSZACIVSA-N 345.443 1.569 10 10 EDCE Cn1ncc(C(=O)NCc2cc(N)ccc2O)c1Br 393680143 NTVXZRYNNBBQIO-UHFFFAOYSA-N 325.166 1.400 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](C)c3ccnn3C)CC2)cc1 817421952 PCUFHKUSHRNUSX-CQSZACIVSA-N 328.416 1.881 10 10 EDCE C[C@@H](c1cc(Br)ccc1O)N1CCN(C(N)=O)CC1 722180968 LIIOEWFVGFBHGI-VIFPVBQESA-N 328.210 1.912 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3CO[C@@H](C4CC4)C3)CC2)cc1 825155932 LZUYRSWNJBBDOT-FXAWDEMLSA-N 345.487 1.974 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H]2COC[C@H]2C1 828436686 DAGXKKSTWUZZBW-JKSUJKDBSA-N 345.443 1.172 10 10 EDCE C[C@@H](NC(=O)[C@H]1CCCN(C)C1=O)c1ccc(N2CCOCC2)cc1 822786421 QQQXMXGPCRIZOT-RHSMWYFYSA-N 345.443 1.569 10 10 EDCE O=S1(=O)CC(CCNCc2ccc(Br)cc2O)C1 825650904 AQOUTUXUXJGAGK-UHFFFAOYSA-N 334.235 1.679 10 10 EDCE CC[C@@H](NCCS(=O)(=O)N=S(C)(C)=O)c1ccc(C)cc1O 903224683 AEGWIFKUNJKGHP-CYBMUJFWSA-N 348.490 1.799 10 10 EDCE COc1cnc(F)c(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)c1 848393021 MSFREJAYBJFSFF-HNNXBMFYSA-N 332.379 1.725 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)CCNC3CC3)CC2)cc1 848414651 AYMZPTLNLFNWJF-UHFFFAOYSA-N 346.475 1.076 10 10 EDCE CC1(C)COc2c(S(=O)(=O)NCc3ccccc3O)cnn2C1 914140871 RDFGEVQLZHUCSK-UHFFFAOYSA-N 337.401 1.486 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@@H]3C[C@H]2C[S@]3=O)c([N+](=O)[O-])c1 845735577 YBPNPXNUIDDWJB-KDYBBVTHSA-N 336.369 1.491 10 10 EDCE O=C(NCC[C@H]1CCCNC1)NCc1ccc(N2CCOCC2)cc1 841729151 CKDLRCXNMNCHTB-MRXNPFEDSA-N 346.475 1.712 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)C(C)(C)C(=O)O)CC2)cc1 844244723 WOPDTJKUTQCRQF-UHFFFAOYSA-N 349.431 1.044 10 10 EDCE Cc1cc(O)nc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1 856215398 LNURUFHGTWRMTR-UHFFFAOYSA-N 341.411 1.987 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@@](C)(O)C3)C2)cc1 854298584 FZOSNXYENVNUSE-RDTXWAMCSA-N 333.432 1.830 10 10 EDCE COc1ccc(CNC(=O)c2cn([C@H]3CCCNCC3)nn2)c(O)c1 852890737 LSBMZGTXDBMVBO-ZDUSSCGKSA-N 345.403 1.237 10 10 EDCE Cn1ccnc1CN1CCC[C@@H](NC(=O)c2cc(O)cs2)C1=O 753469177 ZZBPACFUJSXCSU-LLVKDONJSA-N 334.401 1.108 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC1(C(=O)O)CCC1 851680374 HHLYFAWIJPXXGT-UHFFFAOYSA-N 347.415 1.048 10 10 EDCE CN(C)CCC[C@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCO1 856430164 SGSMEIHYIJNCHV-LYASGUKUSA-N 334.416 1.680 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCCN(C)C3)C2)cc1 852186759 HZEYBYGOOIJLJS-CABCVRRESA-N 332.448 1.667 10 10 EDCE COc1ccc(N2CCC(NC3CN(c4ccncn4)C3)CC2)cc1 865747095 OFTWOGQXLJPMSU-UHFFFAOYSA-N 339.443 1.932 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 875508157 VDMUVYUYINLDAU-JGGQBBKZSA-N 349.431 1.691 10 10 EDCE COc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)nn1C 773325366 GGASXJKZKPRHDU-UHFFFAOYSA-N 345.403 1.058 10 10 EDCE OCC[C@@H]1CSCCN1Cc1ccc(N2CCOCC2)c(F)c1 770305734 KDHAATLLNRVFFR-OAHLLOKOSA-N 340.464 1.962 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@@H](O)Cc2cnn(C)c2)cc1 786793337 LKCAHYCWKRVSKO-KRWDZBQOSA-N 330.432 1.486 10 10 EDCE O=C(CC[C@H]1CC[C@@H](C2OCCO2)O1)N1Cc2cccc(O)c2C1 899173033 JTJRPQGGSUTGBF-CJNGLKHVSA-N 333.384 1.935 10 10 EDCE O=C1CC[C@H](N2CCN(Cc3cc(F)cc(F)c3O)CC2)CCN1 894927827 GZVIEFBCIWPFKV-AWEZNQCLSA-N 339.386 1.457 10 10 EDCE COCCCS(=O)(=O)NCc1cc(Br)ccc1O 796190282 FYDWMPMTVTXPKW-UHFFFAOYSA-N 338.223 1.611 10 10 EDCE CN(CCCN1CCCC1)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 798403523 ACASBHANCFAVQL-UHFFFAOYSA-N 334.376 1.848 10 10 EDCE COc1cncc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c1 799124522 SSSHGZLIUWTEMT-UHFFFAOYSA-N 325.302 1.505 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@]23CCC[C@@H]2C3)cc1C 1320251055 WDVPLOJWKKFGLI-GPMSIDNRSA-N 332.444 1.761 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(Cc2nn[nH]n2)CC1 1176780305 MRNFICQXLFIBOD-DUXPYHPUSA-N 329.360 1.105 10 10 EDCE C=C/C=C/CCNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1338861295 LAQIHCARKJLUAY-RGDDUWESSA-N 343.427 1.639 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3C[C@@H]4CC[C@H]3O4)C2)cc1 1353843416 GWCYPBSPJRGYJT-KKBVYLPWSA-N 331.416 1.893 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C(C)=C2CCC2)cc(OC)n1 1284229638 BDOBCIUSVHLNRX-NSHDSACASA-N 347.415 1.834 10 10 EDCE Nc1ccc(CS(=O)(=O)N(Cc2ccccc2)C2COC2)cc1 1915722379 SPTSQASHSUHJTQ-UHFFFAOYSA-N 332.425 2.000 10 10 EDCE CN(C)C[C@@]1(O)CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1297346165 SDSQMRZKVWXWAX-INIZCTEOSA-N 333.392 1.378 10 10 EDCE C[C@@](NC(=O)c1ccc(N=NC(N)=O)cc1)(C(N)=O)c1ccccc1 1465852874 QHQKNBFKOWLGNV-KRWDZBQOSA-N 339.355 1.980 10 10 EDCE C/C=C(/C)C(=O)NC[C@@H](C)NCc1nnnn1-c1ccc(OC)cc1 1480442475 SKNNUDHEEQXRBR-QWGHSUKYSA-N 344.419 1.231 10 10 EDCE CC(C)[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)c1cccc(O)c1O 1628785627 VYUHBQZEHVZOMX-ZYHUDNBSSA-N 338.429 1.774 10 10 EDCE CCn1nncc1C(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 1716680188 OTUSYHCAIUWYIQ-UHFFFAOYSA-N 343.431 1.667 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CCN1CCN(CC)CC1 1556515524 BLUDBIQZECMILF-UHFFFAOYSA-N 340.464 1.522 10 10 EDCE COCCCNC(=O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1631250671 ITTCUPRIQKJTTG-UHFFFAOYSA-N 335.364 1.074 10 10 EDCE CN(CC(=O)NCc1ccccc1)C(=O)c1c(F)ccc(O)c1O 1651083180 XEUNRVADYGTREE-UHFFFAOYSA-N 332.331 1.625 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)CC3(C)CC3)C2)cc(OC)n1 1758707136 AMWAGWRQTCOLME-BETUJISGSA-N 347.415 1.666 10 10 EDCE CN(Cc1ccccc1O)c1nnc([C@H]2CCC(=O)N2)n1CC1CC1 1696699969 NZPYTUZIWYKCOG-CQSZACIVSA-N 341.415 1.981 10 10 EDCE CCc1nnc(NC(=O)CN2C(=O)[C@H](CC)SC2=S)s1 11635630 VUNQDLXPYPCJAS-LURJTMIESA-N 330.460 1.678 10 10 EDCE O=C1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)c2ccccc2N1 156577975 LBHRAGRXGQHXBF-ZDUSSCGKSA-N 326.352 1.883 10 10 EDCE O=C1C[C@@H](C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)CCN1 1889600735 PANJTDLNEBMKDM-ZOBUZTSGSA-N 327.428 1.818 10 10 EDCE C[C@H]1C(=O)NC(=O)CN1c1ccc([C@@H](C)N)c(Br)c1 235211164 OWEPYTCBFNIBEV-SFYZADRCSA-N 326.194 1.320 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(=O)NCCCN=[N+]=[N-])CO1 1964885304 YVQHXCAIPBNANT-MNOVXSKESA-N 327.385 1.733 10 10 EDCE C[C@H]1COC[C@@H](C(=O)NCCCN=[N+]=[N-])N1C(=O)OC(C)(C)C 1985096877 XNABPGSWVIFAOF-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CO[C@@H]1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C[C@@H]1F 2146474416 VDLSYLRFRIZWPJ-AXTRIDKLSA-N 345.168 1.608 10 10 EDCE O=c1c2c(ccn1CCc1ccc(Br)cn1)CCNC2 2150798158 QZGVAXSWAYQABJ-UHFFFAOYSA-N 334.217 1.894 10 10 EDCE NC[C@@H]1COCCN1Cc1cc(Cl)cc(Br)c1O 2035630349 STEPHKGKHLEUKX-SNVBAGLBSA-N 335.629 1.968 10 10 EDCE Oc1n[nH]c(CNCc2cc(Cl)cc(Br)c2O)n1 708176723 GUZAPXKUSNFSPE-UHFFFAOYSA-N 333.573 1.922 10 10 EDCE COCCn1nnnc1CNCc1cccc(Br)c1O 2169374060 BYVZUECDARWIGE-UHFFFAOYSA-N 342.197 1.077 10 10 EDCE NCc1cc(F)c(N2CCO[C@@H]3C[C@H](O)C[C@H]32)cc1Br 2185306879 JLEYZMGOIHQVOH-OWYVNGRQSA-N 345.212 1.775 10 10 EDCE O=S1(=O)C[C@H]2CCN(c3ccc(CO)c(Br)c3)[C@H]2C1 2094927052 MGVNUPHIHPUDPB-MFKMUULPSA-N 346.246 1.565 10 10 EDCE NCc1cc(F)c(N2CCOC[C@@H](CO)C2)cc1Br 2098217495 IDQDZQDWUGZQBU-SECBINFHSA-N 333.201 1.492 10 10 EDCE C[C@H]1CCNC[C@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2310309935 ZBAINZNGSGOFLY-MAUKXSAKSA-N 329.444 1.651 10 10 EDCE COc1ccc(Br)cc1C=C1C(=O)NC(=O)N(C)C1=O 2313507706 NCYZAULKCAIUJO-UHFFFAOYSA-N 339.145 1.549 10 10 EDCE COC(=O)CCN1C(=O)C(=C2C(=O)Nc3ccccc32)SC1=S 2314769417 QCGJFLPJNDJBLG-UHFFFAOYSA-N 348.405 1.773 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@H]21 2314955703 JVZXQUJABNTFIM-JOYOIKCWSA-N 332.219 1.384 10 10 EDCE Cc1ccc(CN[C@H](C)c2nc(=O)o[nH]2)c(O)c1Br 2352676829 UHPLQRAFVSVSJF-SSDOTTSWSA-N 328.166 1.990 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)Nc3nccs3)ccc21 57738528 WXSITBKNHDLQOM-UHFFFAOYSA-N 330.413 1.780 10 10 EDCE NS(=O)(=O)c1ccc2c(c1)CCN2Cc1cc([N+](=O)[O-])ccc1O 175515584 GJPOXILUEVAFBP-UHFFFAOYSA-N 349.368 1.511 10 10 EDCE CC(=O)N[C@H]1C(=O)c2ccccc2C(=O)[C@@H]1N1CCc2ccccc2C1 20309849 RGZYRNVATCVQPV-RTBURBONSA-N 348.402 1.997 10 10 EDCE Cc1nc(N2CCN(Cc3ccccc3O)CC2)c2cnn(C)c2n1 179574416 GATYQGLEWBNJOF-UHFFFAOYSA-N 338.415 1.700 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)COC[C@H]1CCOC1 117747393 XVNCDELTRVAKHK-KRWDZBQOSA-N 348.443 1.535 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C(NCc3ccc(O)c(O)c3O)[C@H]2C1 302104970 GOPXKJJBAJXOFA-QWRGUYRKSA-N 336.388 1.758 10 10 EDCE COC[C@H](O)CN(C)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 178076845 QKISMPHCALXDAF-ZGRWHYIRSA-N 334.416 1.002 10 10 EDCE NCc1ccc(N2CC3(CC[C@H](CO)O3)C2)c(F)c1Br 2361871444 IDXHHBIHOYCQLM-SNVBAGLBSA-N 345.212 1.777 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@H](C4CC4)C3)nc12 363777930 XFSLIDCXRHABRQ-AWEZNQCLSA-N 346.387 1.222 10 10 EDCE CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)c1ccc(C)c(O)c1O 370419253 UFYDRKUZGLZIQX-NWDGAFQWSA-N 337.372 1.589 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](C)N1CCN(c2ccc(F)cc2)CC1 808519539 WIQYARZBZAKGOY-GFCCVEGCSA-N 336.363 1.038 10 10 EDCE COc1cccc(CN[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)c1O 800309532 KNHZBCRLLZFUMH-DGCLKSJQSA-N 328.434 1.208 10 10 EDCE CC(=O)[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)C 828782720 XZMRJGVHNPCBRT-CYBMUJFWSA-N 329.374 1.534 10 10 EDCE CCn1c(-c2nnn(C)c2C)nnc1N(C)Cc1ccccc1O 834932343 AZTLBZXQDMNQRB-UHFFFAOYSA-N 327.392 1.744 10 10 EDCE CN(C)c1ccc(/C=C\CNCCCN2CCCS2(=O)=O)cc1 835037656 JVZGVZDSJYJKEB-UTCJRWHESA-N 337.489 1.781 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCCC[C@@H]2C2(O)CC2)cc1 839618517 LAYRIBFNKNGLCS-QGZVFWFLSA-N 331.460 1.748 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N[C@@H](C)c1nnc(O)n1C 919072901 UAVYOEVTRRGIBG-NSHDSACASA-N 332.408 1.456 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)NCC[C@H]1CCNC1 842232091 DKFFHDDACZURPS-OAHLLOKOSA-N 347.459 1.637 10 10 EDCE CN(C)CCC[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCO1 856430163 SGSMEIHYIJNCHV-DDJMYBDESA-N 334.416 1.680 10 10 EDCE Cc1cc(C)nc(NNS(=O)(=O)c2cc(F)cc(F)c2O)n1 753016223 IXVZGGOEOQSALC-UHFFFAOYSA-N 330.316 1.383 10 10 EDCE C[C@@]1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1(F)F 855799495 WAZZAQXNCQLFHM-LBPRGKRZSA-N 334.344 1.539 10 10 EDCE COC(=O)c1cnc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1 853759871 CIXJTGCDGQWLLO-CYBMUJFWSA-N 328.372 1.963 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)CC2(OC)CCCC2)c1 866848548 ITKYHWKWBRYFIK-UHFFFAOYSA-N 329.418 1.779 10 10 EDCE COC(=O)c1cc(OCc2oncc2C(=O)OC)ccc1N(C)C 865395460 QMBDZKPALKGFTC-UHFFFAOYSA-N 334.328 1.893 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)c2c(Cl)cnn2C)c1 797448347 PNENTHONSGIZTO-QMMMGPOBSA-N 345.808 1.827 10 10 EDCE O=C(CNC(=O)N1CCCC1)NCc1c(O)ccc2ccccc12 1304090869 RXSHCBNKDMHDGO-UHFFFAOYSA-N 327.384 1.967 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)[C@@H](C)C2CC2)cc(OC)n1 1337099052 CKYCEGQRVKXFRM-RYUDHWBXSA-N 349.431 1.722 10 10 EDCE COC(=O)/C=C/c1ccc(C(=O)NCCc2ccc(O)c(O)c2)o1 1445939294 QXWTZGOCAAFGOB-QPJJXVBHSA-N 331.324 1.850 10 10 EDCE C[C@]1(O)CCCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 222418320 YKLGQHSLUZVDGB-OCCSQVGLSA-N 340.221 1.752 10 10 EDCE O=C(O)[C@H]1C[C@H](O)CN1Cc1cc(Br)cc(F)c1O 2136111005 ZOEAPSTTXULBJW-WCBMZHEXSA-N 334.141 1.314 10 10 EDCE NC(=O)[C@H]1CC[C@@H](NC(=O)NCc2c(O)ccc3c2CCCC3)C1 1478801901 LFIQZGTZTHUCTN-QWHCGFSZSA-N 331.416 1.724 10 10 EDCE C[C@@H](CNC[C@@H]1CCOC1)CNC(=O)c1ccc(N=NC(N)=O)cc1 1715271125 GZRSVQHBJBPUSD-STQMWFEESA-N 347.419 1.841 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cc2c(nc1O)CCC[C@H]2O 1558162343 ZSHAGDWYACBDOT-CYBMUJFWSA-N 330.340 1.498 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cn(-c3cccnc3)nn2)c1 1622779513 QGLXWTUCQTTXFO-NSHDSACASA-N 339.355 1.868 10 10 EDCE CN(C)[C@@H]1COC[C@H]1CNCc1cc(Br)ccc1O 1924671223 MPPVHZICYVFINS-DGCLKSJQSA-N 329.238 1.821 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)Cn2cncn2)cc1C 1567237773 DGKANYIIROZYHF-CQSZACIVSA-N 331.420 1.280 10 10 EDCE Cc1ccc(-n2[nH]c(C(=O)NCc3c(O)cccc3O)cc2=O)cc1 1635847302 LQWUFHZMPZWPQV-UHFFFAOYSA-N 339.351 1.815 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2[nH]c(O)nc2C)cc1C 1666926619 BKCDKSWCXGILDM-LBPRGKRZSA-N 346.431 1.991 10 10 EDCE CC[C@H](CNC(=O)C1(C)CC1)NC(=O)c1cc(OC)nc(OC)c1 1759325264 KWKVZYIDFMHGNF-GFCCVEGCSA-N 335.404 1.524 10 10 EDCE COc1ccc(N2CCC(NC(=O)NC[C@@H](O)C(C)C)CC2)cc1 154529028 TZQMUACNLNKXSZ-QGZVFWFLSA-N 335.448 1.980 10 10 EDCE CN1CCc2cc(CNC[C@H](O)CNC(=O)OC(C)(C)C)ccc21 2011421356 ITUOZASVUSKCSK-HNNXBMFYSA-N 335.448 1.654 10 10 EDCE Nc1ccc(COc2ncnc(I)c2N)cc1 2012552233 ASIUBKJZMCAHKO-UHFFFAOYSA-N 342.140 1.825 10 10 EDCE Oc1c(Br)cc(Cl)cc1CNC[C@@H]1COC[C@@H]1O 2036575493 FIDLNJNBJDZIFK-KCJUWKMLSA-N 336.613 1.905 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)C[C@@H](O)COCc1ccccc1 2038118981 HBGXGSYIZUCCEQ-GOSISDBHSA-N 343.427 1.134 10 10 EDCE NCc1ccc(N2CCN3C[C@@H](O)C[C@@H]3C2)cc1Br 405256308 KQGTYTIVYFVNKM-OLZOCXBDSA-N 326.238 1.163 10 10 EDCE Cc1nc2n(n1)CCN(c1ccc(CN)c(Br)c1F)C2 2170405715 DTZYEVNRGZKHJU-UHFFFAOYSA-N 340.200 1.967 10 10 EDCE Oc1ccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)c(O)c1O 702566575 JTDNBGMHUDVBHE-LJQANCHMSA-N 344.411 1.530 10 10 EDCE C[C@H](O)c1ccc(N2CC(NS(C)(=O)=O)C2)cc1Br 703017040 YNWOOHTUWSTSEO-QMMMGPOBSA-N 349.250 1.240 10 10 EDCE CN(Cc1c(O)cccc1Cl)Cc1nnc2c(=O)n(C)ccn12 2062163851 RTGRYCRXHVGTBW-UHFFFAOYSA-N 333.779 1.419 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCCc4c3cnn4C)c2n1 2064477155 QTFCYPFDIXHEHI-GFCCVEGCSA-N 326.360 1.284 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)C[C@H]3C2)c(Br)c1 2236999666 ZMHNFNCUPGYZSH-JLUCKKNBSA-N 342.233 1.509 10 10 EDCE CN(c1ccc(CNC2CCC2)cc1Br)C(CO)CO 2240087087 CIUJVORPKBYBGA-UHFFFAOYSA-N 343.265 1.881 10 10 EDCE NCc1cc(F)c(N2CC3(CCC(=O)NC3)C2)cc1Br 2280275975 PWFAEGKQVJDATK-UHFFFAOYSA-N 342.212 1.763 10 10 EDCE O=C1NC(=O)C(=CC=Cc2coc3ccc(F)cc3c2=O)C(=O)N1 2296203754 GNAKXAHMUAXHBV-UHFFFAOYSA-N 328.255 1.238 10 10 EDCE COC(CNC(C)=C1C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1C)OC 2313682227 YCJLDZQRWMDOFJ-UHFFFAOYSA-N 348.359 1.800 10 10 EDCE Cc1nn(C)cc1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 179122738 GVCPKMJJRDOGBH-UHFFFAOYSA-N 341.415 1.366 10 10 EDCE C[C@@H](NC(=O)NCc1ccnn1C)c1ccc(N2CCOCC2)cc1 68549324 JWUIGDWLIKRTDA-CQSZACIVSA-N 343.431 1.817 10 10 EDCE CCCCNC(=O)NC(=O)[C@@H](C)N1CCOc2cc(N(C)C)ccc21 181126447 KBFUJPIPQPJCSF-CYBMUJFWSA-N 348.447 1.966 10 10 EDCE C[C@@H]1CN(c2ccc(/C=C/C(=O)O)c(Br)c2)CC(=O)N1 395672680 CLUBVLZOIMQFKE-HYYFJVDXSA-N 339.189 1.872 10 10 EDCE CC(=O)C(=O)COC(=O)CCOc1ccccc1Br 808506896 UDDCSKXFRWYOPC-UHFFFAOYSA-N 329.146 1.919 10 10 EDCE CO[C@H]1COCC[C@@H]1CC(=O)NCc1ccc(N2CCOCC2)cc1 294438282 GVAQQETWZHJQOQ-AEFFLSMTSA-N 348.443 1.581 10 10 EDCE CC(C)OC[C@H](O)CNCc1ccc(N2CCC(O)CC2)c(F)c1 819122123 QYWXDQFCRQFFIT-MRXNPFEDSA-N 340.439 1.662 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 823271530 WVAOUPNLCLTACT-DBMJBKLQSA-N 345.395 1.707 10 10 EDCE COCCN(Cc1cc(O)n2ncc(C(=O)O)c2n1)C1CCCC1 846244558 WRNDUKCFAXNTMM-UHFFFAOYSA-N 334.376 1.524 10 10 EDCE COCCN1CCC[C@@H]1CNC(=O)NCc1cccc(OC)c1O 745813267 ZXRZPEBAEBTHNL-CQSZACIVSA-N 337.420 1.311 10 10 EDCE O=C(NCc1cc(Br)ccc1O)N[C@@H]1CCCNC1 841941023 JWTLVEHLPSUGMG-LLVKDONJSA-N 328.210 1.706 10 10 EDCE COc1cc(Br)cc([C@H](C)N[C@@H]2CCOC[C@H]2O)c1O 858552265 RFHPDUYYOSWAOI-XXILOJSOSA-N 346.221 1.964 10 10 EDCE CS(=O)(=O)CC1(CCNCc2cc([N+](=O)[O-])ccc2O)CC1 850343694 VLRBTRNLHJQMAJ-UHFFFAOYSA-N 328.390 1.605 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3C[C@H]4CC[C@@H](O)C[C@H]4C3)cc2N1 853771031 JUFPUWNUBMIDLA-OUAUKWLOSA-N 333.344 1.523 10 10 EDCE COCCO[C@H]1COCC[C@@H]1NC(=O)NCc1c(O)cccc1F 922070657 KRLCNTALYVIBOK-ZFWWWQNUSA-N 342.367 1.151 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@H]1C[C@@H]2CC[C@H](C1)S2(=O)=O 928709965 JOWKVMOAYCSGPK-RTCCRHLQSA-N 327.377 1.503 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC(=O)NC(C)C)C2)cc1 851924905 PXHBLMHNZSGAND-CYBMUJFWSA-N 334.420 1.098 10 10 EDCE COc1ccc(N2CCN(C(=O)C=C3CCNCC3)CC2)cc1F 852872168 IZLDXVSEUMKQFF-UHFFFAOYSA-N 333.407 1.793 10 10 EDCE Cn1nc2c(c1/C=C1/SC(=S)N(CC(=O)O)C1=O)CCCC2 864362435 FCILFIRZBICMQP-IZZDOVSWSA-N 337.426 1.585 10 10 EDCE C[C@@H]1O[C@H](C)C[C@@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 868131105 YQYUABUQVAJXRZ-KEYYUXOJSA-N 333.432 1.888 10 10 EDCE COc1ccc(N2CCN(CCNC[C@@]3(OC)CCOC3)CC2)cc1 876979855 BCXWACFBIIGWRA-IBGZPJMESA-N 349.475 1.212 10 10 EDCE CC(C)(C(=O)NCc1ccc(N2CCOCC2)cc1)c1cnc[nH]1 788290350 MDUQEOHGMYDMHN-UHFFFAOYSA-N 328.416 1.840 10 10 EDCE NC(=O)[C@@H]1OCC[C@H]1NCc1cc(Br)cc(F)c1O 2117459077 ISHVUMAPESULCG-MWLCHTKSSA-N 333.157 1.026 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1C[C@H]2CC[C@H]1C2 1323004384 LCIGMYYJVAINRG-BQFCYCMXSA-N 339.439 1.984 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@@H]1CCCN(CC(F)(F)F)C1=O 1347235897 ZUXLGUNWFHKBOM-JTQLQIEISA-N 346.305 1.515 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@]1(NC(=O)OC(C)(C)C)CCOC1 1900613022 RHWYJFRZUYVQFE-CQSZACIVSA-N 327.385 1.829 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)Cc1cncn1C 1273709868 ASYYMYQXYPIKAS-UHFFFAOYSA-N 344.459 1.918 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](O)C[C@@H]2CO)cc1Br 2136089150 XFYQCWKKMLWROW-YUSALJHKSA-N 329.238 1.791 10 10 EDCE COc1cc(N2CCN(c3n[nH]c(C)n3)CC2)c([N+](=O)[O-])cc1OC 1612561531 WFRYFEVEQYXQAR-UHFFFAOYSA-N 348.363 1.365 10 10 EDCE CCOCCN[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1480240200 SQDFZZSGJZZHIQ-OKILXGFUSA-N 333.392 1.736 10 10 EDCE CCN1CCC(CO)(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1717354149 PYUJRLSXXRYDCB-UHFFFAOYSA-N 333.392 1.426 10 10 EDCE C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)c1cc(O)cs1 1623387147 RHUSSZZANNQHQN-SECBINFHSA-N 340.426 1.934 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 1558174201 HFIWZIIBTGTIEL-CYBMUJFWSA-N 341.367 1.158 10 10 EDCE O=C(O)[C@H]1C[C@H](O)CCN1Cc1cc(Br)ccc1O 2136384927 VSTKHGAEXZEDHQ-GHMZBOCLSA-N 330.178 1.565 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)[C@H]2CCNC2=O)cc1C 1485732743 NVFVSJJUVNERHC-ZBFHGGJFSA-N 347.459 1.514 10 10 EDCE O=C1C[C@](C(=O)NCc2cc(O)ccc2O)(c2ccccc2)CN1 1633598788 ALVPLQHZQNCKMT-GOSISDBHSA-N 326.352 1.172 10 10 EDCE CC(C)OCC(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1720899604 GTPVFTQUYADKNE-LLVKDONJSA-N 349.391 1.509 10 10 EDCE CC[C@H](C(N)=O)N(C)CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1568507085 USJSAOJIUGNDPY-CYBMUJFWSA-N 348.407 1.117 10 10 EDCE O=C(CCN1C(=O)c2ccccc2C1=O)NCc1c(O)cccc1O 1645360905 OFJFRHPLMGVGQW-UHFFFAOYSA-N 340.335 1.400 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)c2cnn(C)n2)cc1C 1668245023 YBCDKRIIUGPLCP-ZDUSSCGKSA-N 331.420 1.430 10 10 EDCE Nc1ccc(OCCCN2CCC[C@H](NC(=O)[C@H]3CCCO3)C2)cc1 586064818 LYIDKBXTDHKUKB-FUHWJXTLSA-N 347.459 1.797 10 10 EDCE CO[C@@H]1C[C@@H](C(=O)O)N(Cc2cc(Br)cc(F)c2O)C1 1964721552 WKFGGBFBFXJPAM-KOLCDFICSA-N 348.168 1.968 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)C(=O)C[C@H]1C[C@H](N)C1 1980369743 NGWPSKCMRWSYDD-IJLUTSLNSA-N 328.409 1.182 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@]1(C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003169472 KZYVBKNHQHHBHV-NDBFUVGKSA-N 340.420 1.182 10 10 EDCE CC(C)(C)OC(=O)NC1(CC(=O)NCCN=[N+]=[N-])CCOCC1 1985094072 JRLMBAUDDSFXJO-UHFFFAOYSA-N 327.385 1.877 10 10 EDCE CC(C)(C)OC(=O)NC[C@@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCCO1 1985101637 VOTLPEBEDWWAHK-CQSZACIVSA-N 325.369 1.581 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1990033886 ZEINHSVUGIVLKJ-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE Cn1cc(Br)c(CNCc2cc3c(cc2O)OCO3)n1 393315042 KRNZMUQQSCJHDP-UHFFFAOYSA-N 340.177 1.907 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(C2(O)COC2)cc1 2064863020 BPZXAWQPEACYEW-LBPRGKRZSA-N 343.379 1.677 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@]3(CNC(=O)N3)C2)cc1Br 2177668790 PBDXCWMVYPPYGD-XPTSAGLGSA-N 340.221 1.764 10 10 EDCE COc1cnn(Cc2ccc(O)cc2O)c1I 2070311607 HBIDXSUTSZKNMF-UHFFFAOYSA-N 346.124 1.956 10 10 EDCE CN(C[C@@H]1CCN1C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2186467995 AYBUXJTXNIEOCF-ISVAXAHUSA-N 340.221 1.575 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)C[C@@H](O)C2)cc1Br 2105074463 PZUQMMLRWHDLEL-ZMLRMANQSA-N 329.238 1.661 10 10 EDCE OC[C@@H]1NC[C@H]2CN(Cc3c(O)cccc3Br)C[C@@H]21 2227311447 DHQIZOQSQCJFNA-KWBADKCTSA-N 327.222 1.167 10 10 EDCE Oc1cc(O)c(CNCCN2CCOCC2)cc1Br 2267811133 XGTQKQNUHALFQA-UHFFFAOYSA-N 331.210 1.282 10 10 EDCE CC[C@@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2288894658 ALSGIMXMXGZAMM-KGYLQXTDSA-N 340.221 1.751 10 10 EDCE C[C@H](CN(C)C(=O)C=Cc1ccc(N2CCOCC2)cc1)C(=O)O 2311973822 TYPGZEZUNJUSEV-CQSZACIVSA-N 332.400 1.716 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H]2CCC[C@H](C(N)=O)C2)cc1F 172571739 KARQASKNHLLCGB-QWHCGFSZSA-N 336.411 1.735 10 10 EDCE C[C@H]1CN(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)[C@H](C)CO1 173078844 UZAOPGSWWAYMOB-NEPJUHHUSA-N 345.440 1.335 10 10 EDCE Cn1cnc(Br)c1C(=O)Nc1ccc(O)cc1C(=O)O 2362329491 VRADKHYATAQYDT-UHFFFAOYSA-N 340.133 1.839 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CC[C@H]3OCC(=O)N[C@@H]3C2)c1O 366758119 OGJCDOPSQLGPDE-ZIAGYGMSSA-N 338.791 1.338 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@H]3CCOC[C@@H]3C)CC2)cc1 277282376 BFUFOEQUZBRLCK-YJBOKZPZSA-N 347.459 1.358 10 10 EDCE COc1ccc(N2CCN(C(=O)Nc3nnc(OC)s3)CC2)cc1 282817886 NAIPHKXLDNKISC-UHFFFAOYSA-N 349.416 1.909 10 10 EDCE CCNS(=O)(=O)[C@@H]1CCN(Cc2cc(Cl)c(F)cc2O)C1 293684745 RSAGQLPKKIZPRW-SNVBAGLBSA-N 336.816 1.698 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)[C@H](C)[C@@H](C)O1 807677066 LAZXAPVNJIFTTE-KBUPBQIOSA-N 347.459 1.954 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)c2cnn3c2CCCC3)cc1 832267404 RPCNDFQLSQZNTF-MRXNPFEDSA-N 327.432 1.715 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@@H]1C 837769911 RZVJOEOKRCUAEI-FMKPAKJESA-N 344.459 1.938 10 10 EDCE COC(=O)N1CCC[C@@H](NC(=O)NCc2c(O)cccc2F)C1 916186425 GKMWIHQNYRTTQD-SNVBAGLBSA-N 325.340 1.561 10 10 EDCE C[C@@H]1C[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)c2ncnn21 849360249 ZWQNGWXOUZEGNV-ZYHUDNBSSA-N 327.344 1.454 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)NCc1ccc(N2CCCCC2)cc1 848227077 XEONXPBCODIQCJ-MRXNPFEDSA-N 334.416 1.607 10 10 EDCE Cc1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)nc(C)n1 754141975 QRGZOPJFORGZAB-UHFFFAOYSA-N 344.390 1.999 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](CO)C3CCC3)C2)cc1 852386943 NPEWBELQAGOOKV-RDTXWAMCSA-N 347.459 1.982 10 10 EDCE CC(=O)N1CCN(C(=O)NCc2ccc(N(C)C)cc2C)[C@H](C)C1 764358087 CHFQANHHXDGDSZ-CQSZACIVSA-N 332.448 1.823 10 10 EDCE O=C(CCC12CC(CN1)C2)NCc1ccc(N2CCOCC2)cc1 870873115 ZLPBZQHBVLPBGK-UHFFFAOYSA-N 329.444 1.672 10 10 EDCE O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N1Cc2cccc(O)c2C1 871200056 YMUYBFKTAGRRLV-NXKWAJLKSA-N 338.363 1.042 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cc(N2CCOCC2)ccn1 1558534533 TYUQLAAPIHJPLV-UHFFFAOYSA-N 329.356 1.259 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCC[C@H](O)C3)c(Br)cc21 92775473 BWVNFYWRDCMUGZ-SDBXPKJASA-N 340.221 1.623 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cn3cc(C4CC4)nn3)C2)cc1 1328372321 FHKVCKCNTZDBKW-AWEZNQCLSA-N 341.415 1.559 10 10 EDCE CCOC1(CS(=O)(=O)NCc2cc(C)ccc2O)CCOCC1 1331364389 NRADAWIVSZTNED-UHFFFAOYSA-N 343.445 1.706 10 10 EDCE CC[C@@H](F)C(=O)N(C)C[C@@H](O)CNCc1ccc(OC)c(C)c1 1332552853 RDPLYQCPVWLQAB-LSDHHAIUSA-N 326.412 1.661 10 10 EDCE COCc1cc(N2C(=O)CN(Cc3ccccc3O)C2=O)ncn1 1261435995 MEWXZNAPXOUKJP-UHFFFAOYSA-N 328.328 1.297 10 10 EDCE C[C@@H]1CN(c2ccc(CO)c(Br)c2)C2(CC2)C(=O)N1 2132026795 YUQLEDXAVRBXIP-SECBINFHSA-N 325.206 1.799 10 10 EDCE CC[C@@H]1C(=O)NC(=O)CN1c1ccc(CN)cc1Br 212928056 SUHLSWNOBHRLMX-SNVBAGLBSA-N 326.194 1.149 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@H](NS(C)(=O)=O)C(C)C)c1 1445967047 JPVLRABMWWMSBZ-HZMBPMFUSA-N 344.433 1.152 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)C2CN(C(C)=O)C2)cc1C 1282124845 QSIQRHFZSCYFCC-ZIAGYGMSSA-N 347.459 1.465 10 10 EDCE O=C(c1cc(O)nc(O)c1)N(Cc1ccccc1)[C@H](CO)C1CC1 1915262885 QCRMBTYNPCRVPO-OAHLLOKOSA-N 328.368 1.906 10 10 EDCE Cc1nnc(N(C)[C@H](C)CC(N)=O)n1Cc1ccc(N(C)C)c(F)c1 1290704011 ANRMAEFEZFRTEF-LLVKDONJSA-N 348.426 1.540 10 10 EDCE COC(=O)[C@H]1CN(C(=O)/C=C/c2cn(C)cn2)c2ccc(F)cc2O1 1530902163 SUWXTXFCBIOQIR-CSPWOOARSA-N 345.330 1.540 10 10 EDCE CC(C)(C)OC(=O)N1CC(C)(C(=O)NCc2cc(O)ccc2O)C1 1471661832 DSZKHZUQABORPQ-UHFFFAOYSA-N 336.388 1.971 10 10 EDCE CO[C@H](C)CN(C)[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1485391536 VOMAJRABCAVVOC-VXGBXAGGSA-N 335.408 1.934 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cccn(CC(F)(F)F)c1=O 1558175651 ZLJLGJDYBABOGT-UHFFFAOYSA-N 342.273 1.752 10 10 EDCE CN(C)[C@@H]1COC[C@@H]1CNCc1ccc(Br)cc1O 1924718930 NYYNICPWFJHJAF-WCQYABFASA-N 329.238 1.821 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1c[nH]c(C(N)=O)c1 1570514946 VNERANTTXOWNPZ-UHFFFAOYSA-N 345.355 1.025 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCNC(=O)[C@@H]2CC23CC3)cc1 1742929282 CANIGAJINSJRLV-ZDUSSCGKSA-N 343.387 1.885 10 10 EDCE CNC(=O)N[C@@H]1CCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 1654085778 RETUCTFBHYXOOV-GFCCVEGCSA-N 325.796 1.752 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)NCc2cc(O)ccc2O)c1 1593872951 HQRSIVKXGCASCK-GORDUTHDSA-N 327.340 1.182 10 10 EDCE Cc1cc2n(n1)CCC(=O)N2CC(=O)NCc1ccc(N(C)C)cc1 15728807 LDWNWMAZXFQPPL-UHFFFAOYSA-N 341.415 1.311 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H]2CS3(=O)=O)c(Br)c1 320764739 KBLGZYKAQXSNOD-VHSXEESVSA-N 331.235 1.284 10 10 EDCE CC(C)[C@H](O)CN(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2167641598 DTDWAROOGGKHCR-OLZOCXBDSA-N 343.221 1.888 10 10 EDCE NCc1ccc(N2CCn3ncc(O)c3C2)c(F)c1Br 2168345133 OKKAUWAKBGSUAE-UHFFFAOYSA-N 341.184 1.969 10 10 EDCE OCc1ccc(N2C[C@H](O)[C@H](O)CC23CCC3)c(Br)c1 2169919755 DCILVHYTMCFHTD-KGLIPLIRSA-N 342.233 1.796 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2190457645 KNLOKVZNYDKAAK-PFKCXJIQSA-N 341.249 1.932 10 10 EDCE CCCNC(=O)C1CN(c2ccc(CO)cc2Br)C1 2111746759 WOXWMMIIASWUFP-UHFFFAOYSA-N 327.222 1.904 10 10 EDCE COc1ccc(Br)c(CN2CCN[C@H]3COC[C@H]32)c1O 2236043478 LJEAHKRTTJVKOV-NWDGAFQWSA-N 343.221 1.336 10 10 EDCE Oc1ccc(Br)cc1CN1CC(CN2CCNCC2)C1 2236850260 NMFALBGJRFMHRU-UHFFFAOYSA-N 340.265 1.492 10 10 EDCE O=C1OCCN1C1CN(c2ccc(CO)cc2Br)C1 2227418724 KRZXGOBVOGIKMS-UHFFFAOYSA-N 327.178 1.582 10 10 EDCE CCc1nc2n(n1)CCC[C@H]2NC(=O)C=Cc1ccc(O)c(O)c1 2308002244 MDJXHGOHBWKVBW-GFCCVEGCSA-N 328.372 1.916 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@@]23C[C@@H]3N)c(O)c1Br 2352642519 GDPJTQKQMOOKKT-PKFCDNJMSA-N 325.206 1.817 10 10 EDCE COc1ccc(N2CCCN(C(=O)NCc3ccnn3C)CC2)cc1 56387538 BQFDMUWHVGOQSN-UHFFFAOYSA-N 343.431 1.851 10 10 EDCE NC1=NC(=O)/C(=C/c2cc(I)ccc2O)S1 33679114 LOBOYYJSUPQRBP-YWEYNIOJSA-N 346.149 1.926 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1nnc2ccccc21 186418487 FRYFZSHKQNMQJL-NSHDSACASA-N 326.356 1.590 10 10 EDCE C[S@](=O)CCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 136792481 HASIXTWRGQCBAA-JOCHJYFZSA-N 328.409 1.047 10 10 EDCE COC(=O)[C@@H]1CC[C@@H]1C(=O)N1CCCN(c2ccc(OC)cc2)CC1 375611443 KUADZBAQIOMRJR-DLBZAZTESA-N 346.427 1.933 10 10 EDCE CN1CCC[C@](O)(CC(=O)NCc2ccc3c(c2)CCCN3C)C1 900432792 HPCZBZUCRQQVRD-IBGZPJMESA-N 331.460 1.532 10 10 EDCE COc1ccc(O)c(CNC(=O)NCC2(CF)CCOCC2)c1 838474204 GZHOGVVWOLBTTQ-UHFFFAOYSA-N 326.368 1.966 10 10 EDCE COc1ccc(N2CC[C@H](CNS(=O)(=O)CC3(F)CC3)C2)cc1 916482377 FTYIPKNIUUAVHX-CYBMUJFWSA-N 342.436 1.943 10 10 EDCE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CNC(N)=O)cc1 912106926 PFKCVEIVRUMBOO-UHFFFAOYSA-N 332.326 1.312 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(C)CCCN3)cc2)CC1 843498946 AIVOAIWILZFLIE-LJQANCHMSA-N 344.459 1.113 10 10 EDCE CC(C)[C@H](N)CCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851677532 SEMVIUDHEJBOHY-GOSISDBHSA-N 348.491 1.820 10 10 EDCE CO[C@H](CCNC(=O)OC(C)(C)C)[C@H](N)Cc1ccc(O)c(O)c1 1952754356 DOVLWYYDJOOOJK-IUODEOHRSA-N 340.420 1.897 10 10 EDCE COC[C@H](CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)OC 853974388 XFCGZNAKHSICCW-CJNGLKHVSA-N 337.420 1.235 10 10 EDCE O=C(N[C@@H]1C[C@]1(C(=O)O)c1cc(O)nc(O)c1)OCc1ccccc1 1952931417 QKZQPNJPNGOEGK-PXAZEXFGSA-N 344.323 1.514 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCc3ccncn3)C2)cc1 855226908 UJUOSVKHDYRNPA-OAHLLOKOSA-N 326.400 1.813 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CN(C)CC3CC3)CC2)cc1 754009156 YQAQFLSPUCVSBV-SFHVURJKSA-N 333.476 1.520 10 10 EDCE CC(C)[C@H](C(=O)NCc1c(O)cccc1F)N1CCCS1(=O)=O 928706553 WWZIRAJPMSKKJF-CQSZACIVSA-N 344.408 1.208 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@@H]3CCO)C2)cc1 854297879 SPILEUDIQTXDKT-GDBMZVCRSA-N 333.432 1.830 10 10 EDCE COc1cccc(CNC[C@@H]2CN(Cc3ccncc3)CCO2)c1O 858306965 XFGIGRIKXROMRR-QGZVFWFLSA-N 343.427 1.786 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2CC(=O)N1CCOC(C)(C)C1 930125933 GWMRYNVKNAMDAW-UHFFFAOYSA-N 333.432 1.589 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cn(CC4CC4)nn3)C2)cc1 855224599 MSUTYHKKHVSEKD-AWEZNQCLSA-N 341.415 1.705 10 10 EDCE CO[C@H](CS(=O)(=O)N[C@@H](C)c1ccccc1O)C1CCOCC1 867836237 KSHUSFGSRMEDIS-BLLLJJGKSA-N 343.445 1.814 10 10 EDCE COC(=O)[C@H]1CCCC[C@@H]1S(=O)(=O)N1Cc2cccc(O)c2C1 867691394 VEXFJWJWAXBHCK-WFASDCNBSA-N 339.413 1.769 10 10 EDCE C[C@@H](NC(=O)c1cc(O)nc(N(C)C)n1)c1ccc(N(C)C)cc1 765515764 NVGINEBZWYDODK-LLVKDONJSA-N 329.404 1.805 10 10 EDCE CN(Cc1cc(F)c(N(C)C)cc1F)C[C@H]1CCS(=O)(=O)C1 862247656 KTRSBLXOAFTNEB-LLVKDONJSA-N 332.416 1.897 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1C[C@@H](O)C[C@@H](O)C1 894086689 ZIPKSIYTHVWODB-AOOOYVTPSA-N 336.613 1.736 10 10 EDCE CS(=O)(=O)C1CC(NCc2cc(Br)ccc2O)C1 715187276 OYSZIYUWEQXBRQ-UHFFFAOYSA-N 334.235 1.820 10 10 EDCE C[C@@H](NCc1cc(Br)cc(F)c1O)c1nc(O)n[nH]1 715719628 TTXSBOPRQGUABQ-RXMQYKEDSA-N 331.145 1.968 10 10 EDCE C[C@@H](N)[C@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 715768896 GJPZNSRXVGOSQV-PRHODGIISA-N 333.201 1.842 10 10 EDCE C[C@@H]1CN(c2ccc(CN)c(Br)c2)C[C@@H](CCO)O1 2122799877 NVXRMKPLTSDKOK-ZWNOBZJWSA-N 329.238 1.884 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 1333090735 WUEJPXUKZFGENR-OAHLLOKOSA-N 345.443 1.540 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CC[C@@H](C)C3)C2)cc1 1332163277 BZXLIZZGOXXNHZ-KFWWJZLASA-N 345.443 1.695 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@@H]2CC[C@H](C1)O2 1348537014 WVGHWSZBEXDAEI-CALCHBBNSA-N 345.443 1.491 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2cnnc(O)c2)cc1C 1270428259 XOFSCMZTNAUWOI-GFCCVEGCSA-N 344.415 1.655 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)NCc2c(O)cccc2F)c1 1456031019 WATZHJAQVCZFJJ-AATRIKPKSA-N 329.331 1.616 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cc(C)c(C(N)=O)cn2)c1 1545684160 LWJZMHJBSPKVQO-SNVBAGLBSA-N 329.356 1.694 10 10 EDCE COc1ccc(CNC[C@H]2CCN(C(=O)CCN(C)C)C2)cc1C 1714364622 XQRRCSQRBPKKJU-QGZVFWFLSA-N 333.476 1.893 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C23CCN(CC2)C3)cc1C 1716368609 VMZWHJOXYCKWRQ-ONEGZZNKSA-N 343.471 1.861 10 10 EDCE COC(=O)NCC(=O)N[C@@H](C)[C@@H](C)NCc1ccc(OC)c(C)c1 1717401204 OQRBBSYESSSUJE-OLZOCXBDSA-N 337.420 1.342 10 10 EDCE Cn1cnn(-c2ccc(NC(=O)Cc3ccc(O)c(O)c3)cc2)c1=O 1637499672 YJDTYUDCGMQAMS-UHFFFAOYSA-N 340.339 1.163 10 10 EDCE CCn1cc(-c2nn(C)cc2C(=O)NCc2c(O)cccc2O)cn1 1639292752 PDJMUYYXMQQEJS-UHFFFAOYSA-N 341.371 1.645 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCCC[C@H]2CO)c1 1631407250 JIMAFQJCLXOCLZ-LBPRGKRZSA-N 342.417 1.141 10 10 EDCE COc1cc(C(=O)N[C@@H](C)C[C@H](C)NC(=O)C2CC2)cc(OC)n1 1572628323 MOBHUNUEBYGVHL-QWRGUYRKSA-N 335.404 1.522 10 10 EDCE Cc1c[nH]c(CC(N)=O)c1C(=O)NCc1ccc2cccnc2c1O 1643285332 WFGQUKOJFMRXMS-UHFFFAOYSA-N 338.367 1.535 10 10 EDCE COCC(=O)N(C)C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1735163779 MGNOXTAPEOYSGN-SNVBAGLBSA-N 335.364 1.072 10 10 EDCE O=C(CCN1CCCS1(=O)=O)NCc1c(O)ccc2ccccc12 1597736320 COKPSVYJWUBAAK-UHFFFAOYSA-N 348.424 1.587 10 10 EDCE CCCn1cc(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)nn1 1662373203 QKAQDLCUSWRCEG-CQSZACIVSA-N 345.447 1.913 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccoc1C1(O)CCOCC1 1593872949 HOXWNXWNCNYYLW-UHFFFAOYSA-N 333.340 1.619 10 10 EDCE O=C(O)Cc1ccc(/N=N/N2CCN(c3ncccn3)CC2)cc1 1860481377 WELUATRLGMSQOJ-FMQUCBEESA-N 326.360 1.925 10 10 EDCE Cc1c(OCCOc2ccc(N)cc2)c(=O)ccn1[C@@H](C)C(=O)O 1857910774 AANAVRLKEYVFMP-LBPRGKRZSA-N 332.356 1.842 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1nn(C)nc1Br 1964873775 KWRNQEYWFNYLON-UHFFFAOYSA-N 325.166 1.555 10 10 EDCE COC(=O)[C@@H](CNC(=O)OC(C)(C)C)N(C)c1ccc(CN)cc1 1999243327 HSCVDBDNVMNLRU-CQSZACIVSA-N 337.420 1.648 10 10 EDCE CN(C(=O)OC(C)(C)C)C1CN(C(=O)COc2ccc(N)cc2)C1 1999442358 QVMIDTSTGWRWIQ-UHFFFAOYSA-N 335.404 1.725 10 10 EDCE CCN1CCc2cc([C@H](N)[C@@H](O)CNC(=O)OC(C)(C)C)ccc21 1999537372 XXTZDLQFCRAEQS-HOTGVXAUSA-N 335.448 1.954 10 10 EDCE CCNCc1ccc(N2CC(O)(C(=O)OC)C2)c(Br)c1 714463529 DQERTQTYCABGGP-UHFFFAOYSA-N 343.221 1.283 10 10 EDCE CCS(=O)(=O)Nc1ccc(NS(=O)(=O)CCSC)cc1 2174048461 UFRLKHDAHAIKBI-UHFFFAOYSA-N 338.476 1.553 10 10 EDCE COc1cccc(O)c1CN=c1nc(CNC(=O)OC(C)(C)C)[nH][nH]1 2063196565 VBKPXGIHKXSKGG-UHFFFAOYSA-N 349.391 1.578 10 10 EDCE CCNCc1ccc(N2C[C@@H]3[C@H](C(N)=O)[C@@H]3C2)c(Br)c1 2201283466 FQIROOSATCSOAG-GNXNZQSNSA-N 338.249 1.726 10 10 EDCE N[C@@H](Cc1cccc(Br)c1)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2237415775 DOBMTJIZAPVAJW-DRZSPHRISA-N 339.233 1.585 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C[C@@H]2C(N)=O)c(O)c1Br 2352646702 XFNAUVJFVUASMH-IUCAKERBSA-N 327.178 1.201 10 10 EDCE COc1cccc(CNC(=O)CCCNC(=O)c2ccco2)c1O 68488528 NINDLDXNMAZZCD-UHFFFAOYSA-N 332.356 1.820 10 10 EDCE O=C(N[C@H](Cc1cc(O)c(O)c(O)c1)C(=O)O)OCc1ccccc1 1951401412 FPNBLBZVFOHOFB-GFCCVEGCSA-N 347.323 1.726 10 10 EDCE C[C@H](CCS(C)(=O)=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 127102912 ZDSGBBJEEMMNBX-HUUCEWRRSA-N 340.489 1.997 10 10 EDCE C[C@H](N[C@@H]1CCc2ncnn2C1)c1ccc(N2CCOCC2)c(F)c1 180605697 MTPZMFFPUSTZKR-DZGCQCFKSA-N 345.422 1.919 10 10 EDCE CNC(=O)c1ccc(/C=C\C(=O)NCc2ccc(O)c(O)c2)cc1 255508267 FMMXGXQYIWCESK-UITAMQMPSA-N 326.352 1.787 10 10 EDCE Cc1nn(CC(=O)N(C)Cc2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 273141302 TWQGZBVYHXMPOZ-UHFFFAOYSA-N 331.376 1.824 10 10 EDCE Cc1ccc(CN2CC(O)([C@H](F)C(=O)O)C2)c(O)c1Br 2380803734 IVHNULMNUYHCLG-LLVKDONJSA-N 348.168 1.433 10 10 EDCE CC[C@@H]1[C@H](C(=O)OCC(=O)C(C)=O)CCN1C(=O)OC(C)(C)C 811298735 SOKCJXKZBRAWFT-VXGBXAGGSA-N 327.377 1.723 10 10 EDCE O=C(O)c1cncnc1NCc1ccc(N2CCOCC2)c(F)c1 844208587 SHFORCPYBKESOD-UHFFFAOYSA-N 332.335 1.763 10 10 EDCE C[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@H]1C(=O)O 843035190 HMKZMKDLZQVTBQ-IUCAKERBSA-N 335.316 1.473 10 10 EDCE COc1cc(C)cc(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)c1O 842634389 VAMBYDLLHUGFCU-MRXNPFEDSA-N 341.429 1.099 10 10 EDCE COc1ccc(N2CCC(NCCN3CCC(N)CC3)CC2)cc1 925812634 XNEQWLMHRKDWCR-UHFFFAOYSA-N 332.492 1.677 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cc(C=O)n(C)c3)CC2)cc1 929249530 ITLQTIIWXJTKSN-UHFFFAOYSA-N 327.384 1.809 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](NCCO)C2)c1O 923402347 IRFLNLOIJXHBTP-CQSZACIVSA-N 326.824 1.795 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOCC[C@H]1C(=O)NCCN=[N+]=[N-] 1895876600 WNZDLWOTUWZIQI-GHMZBOCLSA-N 327.385 1.733 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H]2CC[C@H]1[C@@H](N)C2 852767499 UUYIGECVSSJQEV-SZMVWBNQSA-N 330.476 1.523 10 10 EDCE CO[C@H]1C[C@@](CO)(NCc2cc(Br)cc(F)c2O)C1 1899825201 MLKWOUBQZNFWGD-GSJFWJNXSA-N 334.185 1.923 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(-c2nc(Cn3cccn3)no2)c1 758291978 XLEVSONTYVFBTD-UHFFFAOYSA-N 335.345 1.059 10 10 EDCE Cc1cc(CCNS(=O)(=O)C2COC2)c(C)n1-c1ccccc1 755070101 CJCAQDVQYFXDQL-UHFFFAOYSA-N 334.441 1.955 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H](C)S(N)(=O)=O)c2C)c1 768597260 WFMHLPBKUKQCKO-CYBMUJFWSA-N 349.456 1.809 10 10 EDCE CCCOc1cncc(NC(=O)C(=O)NCCc2ccc(N)cc2)c1 861503698 MBXJCUZUSRAVEV-UHFFFAOYSA-N 342.399 1.750 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@H](CC(N)=O)C2)cc1 863487899 YAZDDTYKBONQCX-QGZVFWFLSA-N 341.411 1.811 10 10 EDCE Cn1cc(C[C@H](O)C(=O)NCc2c(O)ccc3c2CCCC3)cn1 787134405 XNOFOUODCXVDDX-KRWDZBQOSA-N 329.400 1.224 10 10 EDCE CN1C(=O)[C@@H](N)c2ccc(N3CC4(CN(Cc5ccccc5)C4)C3)cc21 706642935 IXIBIRUGSVAXSI-IBGZPJMESA-N 348.450 1.985 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccns2)c1 1147632462 JFHBORTYDBVEML-UHFFFAOYSA-N 327.387 1.150 10 10 EDCE CN(CCNCc1cc(Br)ccc1O)S(C)(=O)=O 692450658 ONHNWNPMVUCUAF-UHFFFAOYSA-N 337.239 1.136 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H](O)C3)c(Br)cc21 92775788 XTQUEDDFUGHJLU-MADCSZMMSA-N 326.194 1.233 10 10 EDCE NC(=O)Cc1occc1C(=O)NCc1ccc2cccnc2c1O 1162613157 XRDPJUUDUDDLEJ-UHFFFAOYSA-N 325.324 1.491 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)cc1Br 2126159279 QBLXSVLPFQEYGK-DJBIQUGXSA-N 328.206 1.119 10 10 EDCE C[C@H]1COCC[C@@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1323983603 KJLSLSGPSOPMQE-BBRMVZONSA-N 333.432 1.252 10 10 EDCE N[C@H]1CCN(Cc2cc(Cl)cc(Br)c2O)C[C@H]1CO 2122380264 YVBGCUNRPORSEE-CABZTGNLSA-N 349.656 1.950 10 10 EDCE COc1cc(N2CCN(c3cccnn3)CC2)c([N+](=O)[O-])cc1OC 1185158032 JNMPPQGDLCCKAO-UHFFFAOYSA-N 345.359 1.729 10 10 EDCE O=C(O)CN(Cc1ccccc1O)C(=O)[C@@H]1Cc2cccnc2C1 1349953659 FBMSHWVNTANLKR-CQSZACIVSA-N 326.352 1.615 10 10 EDCE [N-]=[N+]=N[C@H]1CCN(Cc2ncc(I)cn2)C1 1905229910 QFTVTPKKMWCQCZ-QMMMGPOBSA-N 330.133 1.966 10 10 EDCE COc1cccc(CN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)c1 1351809299 IADTYNNVLMJRME-UHFFFAOYSA-N 340.379 1.902 10 10 EDCE CS(=O)(=O)c1ccc(N)c(C(=O)N2Cc3cccc(O)c3C2)c1 1455037770 VASFNIIIMCCOSU-UHFFFAOYSA-N 332.381 1.534 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@@H](O)c2cnn(C)c2)cc1 1540459530 LGSMGRUXZXPTCW-KRWDZBQOSA-N 330.432 1.958 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H]2CCN(C)C2=O)cc1C 1700767103 XXRJZKAQNQGANO-GOEBONIOSA-N 347.459 1.418 10 10 EDCE CNC(=O)[C@H](C)NC[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1482370976 HLIUJKDMLPRSGO-MNOVXSKESA-N 348.407 1.034 10 10 EDCE O=C(NCCc1cnc2c(Cl)cnn2c1)c1cccc(O)c1O 1636768363 KBPKUMQMTNFCKE-UHFFFAOYSA-N 332.747 1.766 10 10 EDCE O=C1C[C@@H](C(=O)NCc2cccc(O)c2O)c2ccc(F)cc2N1 1637036019 ZSUNIOZGJQVFHD-GFCCVEGCSA-N 330.315 1.979 10 10 EDCE CC(C)(CNC(=O)c1ccc(N=NC(N)=O)cc1)[C@]1(O)CCOC1 1638824965 YARCTEBJZWTKNH-INIZCTEOSA-N 334.376 1.756 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)C(=O)NCc1cccc(Cl)c1O 1640405409 TZKPEBFMGRLVCE-NSHDSACASA-N 344.795 1.547 10 10 EDCE COc1cc(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)on1 1731904826 UHFVGOBTYDCDGV-UHFFFAOYSA-N 333.388 1.862 10 10 EDCE CCS(=O)(=O)CC(=O)NC[C@H](C)NCc1ccc(OC)c(C)c1 1774048841 PSNSQYKCFAAVTH-ZDUSSCGKSA-N 342.461 1.033 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@]2(O)CCN(CC3CC3)C2)cc1 1699907445 RIJIUTRNKKSHTA-QGZVFWFLSA-N 345.403 1.426 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H]2CCCN2C(N)=O)cc1C 1691635482 IBHZXIHDFYTFEZ-HNNXBMFYSA-N 348.447 1.095 10 10 EDCE O=C(O)[C@H](Cc1cnc[nH]1)N1C(=O)/C(=C\c2ccc[nH]2)SC1=S 1858586619 DFNBQOGLVLVLSQ-XXNJBDPSSA-N 348.409 1.635 10 10 EDCE CCNCc1ccc(N2CCNC(=O)CC2)c(Br)c1 233530260 CKOBFXUSNHTXEN-UHFFFAOYSA-N 326.238 1.885 10 10 EDCE CCOc1cccc(CNCCC(=O)N2CCC[C@@H]2C(=O)O)c1O 1857864057 UJCUUHNYVNMOQZ-CYBMUJFWSA-N 336.388 1.346 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H](C(=O)NCCCN=[N+]=[N-])C1 1964882790 GYQWDAXPUSXUNI-MNOVXSKESA-N 327.385 1.875 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985094610 RGFLLUVIFYJHMH-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1CCOC[C@@H]1NC(=O)OC(C)(C)C 1985100854 JVUKRTNLIMRBKC-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE Cn1cc([C@H](NC(=O)OC(C)(C)C)C(=O)N2CC(N=[N+]=[N-])C2)cn1 2010401252 BWKRFVUQAZGALF-NSHDSACASA-N 335.368 1.507 10 10 EDCE COC(=O)[C@H](CC(=O)N1CC[C@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 2010401052 AJRALRPZNLBLGY-UWVGGRQHSA-N 341.368 1.354 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(NCc2c(O)cccc2F)C1 2016033849 SGBRIGOSMIPYAN-KRWDZBQOSA-N 340.395 1.993 10 10 EDCE C[C@](NCCCN=[N+]=[N-])(C(N)=O)c1cnn(Cc2ccccc2)c1 2024706866 KAGSCLISMHJYSA-MRXNPFEDSA-N 327.392 1.922 10 10 EDCE OC[C@H]1CN(c2ccc(CNC3CC3)cc2Br)C[C@@H]1O 316251370 DTSKJBORWQHJER-ABAIWWIYSA-N 341.249 1.491 10 10 EDCE O=C1Nc2cc(N3CCO[C@@H](CF)C3)c(Br)cc2[C@H]1O 2172042473 WDSVRTCTZYLMKW-JVXZTZIISA-N 345.168 1.609 10 10 EDCE CCCNCc1ccc(N2C[C@H](O)C[C@H]2CO)cc1Br 698194818 BBDOYBFISDNRMS-UONOGXRCSA-N 343.265 1.881 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCc3ccc(N(C)C)nc3)c2n1 2062671011 VOWZKOCXOCONBX-UHFFFAOYSA-N 326.360 1.134 10 10 EDCE CCOC1CC2(CCN(C(=O)c3cnn4c(O)cc(C)nc34)C2)C1 2064815080 NISLWCRCLHYCOH-UHFFFAOYSA-N 330.388 1.775 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC([C@@H](F)CO)C3)c(Br)cc21 2166899667 MNJAWNLUWJUAKA-CABZTGNLSA-N 344.184 1.168 10 10 EDCE COc1ccc(N(C)[C@H](CN)c2nn(C)nc2Br)cc1 2167734493 KOUSCWXJJRXGJF-LLVKDONJSA-N 340.225 1.722 10 10 EDCE CC(C)(O)[C@@H]1CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2191157890 VGPJHDNPMCDNIX-NWDGAFQWSA-N 341.205 1.784 10 10 EDCE Cc1ccc(O)c(CN=c2nc(CCNC(=O)OC(C)(C)C)[nH][nH]2)c1 2063192778 NOSBXFPBUFQOSJ-UHFFFAOYSA-N 347.419 1.920 10 10 EDCE NCc1ccc(N2CC3(C2)OCCC[C@@H]3O)cc1Br 2103408214 IFERIXBSKVCMJZ-ZDUSSCGKSA-N 327.222 1.638 10 10 EDCE O=C(NC1CC1)C1CN(c2ccc(CO)c(Br)c2)C1 2111746401 RPSUDMRTJOQTRY-UHFFFAOYSA-N 325.206 1.656 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213589358 VZYSBULYVRQLCD-IVZWLZJFSA-N 340.384 1.103 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2C[C@H](O)[C@H]2OC)c1O 2271171430 UTKRBABTXXSVDX-NRUUGDAUSA-N 332.194 1.401 10 10 EDCE COc1ccc(N2CC[C@@H](O)C[C@@H]2CO)c(OC)c1Br 2234903266 PZDPCHMTPZWQSO-NXEZZACHSA-N 346.221 1.788 10 10 EDCE Cc1ccc(C=C2SC(N3CCN(CCO)CC3)=NC2=O)cc1 2293320786 JGRUKOWDZFHORB-UHFFFAOYSA-N 331.441 1.575 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@@H](O)CC2)c(Br)c1 2284535244 CBWMSINTUHBMFQ-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@H](O)CC2)c(Br)c1 2284535245 CBWMSINTUHBMFQ-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE CN1CCN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)[C@@H]2C[C@@H]21 2355080237 VBPZWWVWZYXLED-YNEHKIRRSA-N 338.205 1.327 10 10 EDCE Cn1ccnc1-c1noc(NCc2ccc(N3CCOCC3)cc2)n1 181532561 DKLIFQHSWIZLID-UHFFFAOYSA-N 340.387 1.919 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)CCN1CCCC1 189679237 KMTJMOIQDYXAHE-UHFFFAOYSA-N 339.461 1.377 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1F 287619603 HYASHPGJJHYLBD-AWEZNQCLSA-N 345.365 1.474 10 10 EDCE CN1CC[C@@H](NC(=O)NCc2cc(Br)ccc2O)C1=O 805144044 SNWJNYGYOIIQDA-SNVBAGLBSA-N 342.193 1.185 10 10 EDCE CS(=O)(=O)NC[C@H]1CCC[C@@H]1NCc1cccc(Cl)c1O 800541574 NBNHSXYQARQHDW-MFKMUULPSA-N 332.853 1.853 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN(C)[C@H]2CCN3CCO[C@H]2C3)c1O 295181661 VTUBTWOWVWXRRG-JSGCOSHPSA-N 337.376 1.214 10 10 EDCE CC[C@@H](O)CN(CC)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2162893632 OFVBVXHLBITVOY-AMIZOPFISA-N 342.237 1.998 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccccc1SCc1nc(C)no1 808499742 KZIVUSKHTZDGFS-UHFFFAOYSA-N 334.353 1.985 10 10 EDCE C[C@@H](Cn1cncn1)NC(=O)c1csc(Cc2ccc(N)cc2)n1 817920221 FFELEBYPYAXJNN-NSHDSACASA-N 342.428 1.726 10 10 EDCE OC1CCN(c2ccc(CNC[C@@H](O)C(F)(F)F)cc2F)CC1 819122405 WMVNBGSYYLHGBG-CQSZACIVSA-N 336.329 1.800 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)/C=C(\C)CN2CCOCC2)c1 901127794 MVPIREWJJBYGOA-JWAFFJSPSA-N 334.416 1.857 10 10 EDCE Cc1cc(C(=O)N2CCC[C@@](O)(CO)C2)c(C)n1-c1ccccn1 837780304 IIIKDIVULFYDFT-SFHVURJKSA-N 329.400 1.449 10 10 EDCE CC(C)C[C@H](N)c1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 842586770 PNOLBKCPMIANSK-NSHDSACASA-N 340.405 1.860 10 10 EDCE NCCCNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 841843402 HHSAXRJVBTZURK-LBPRGKRZSA-N 342.390 1.905 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCn2c(CC3CC3)nnc2C1 846362020 CROZIEUSAAHLQK-GQCTYLIASA-N 340.383 1.697 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NC[C@H]2C[C@@H]3COC[C@@H]3O2)c1 926648566 ASHBSCFGNFSHBI-IQDSPRDJSA-N 336.388 1.565 10 10 EDCE CO[C@]1(CNCc2ccc3c(c2)CCCO3)CCS(=O)(=O)C1 922619562 VJYGQEQQEURLII-INIZCTEOSA-N 325.430 1.305 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc(OC)nn3)C2)cc1 855229630 BKTBRUWRDSYYSO-LBPRGKRZSA-N 328.372 1.503 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](CO)C(C)C)C2)cc1 854297103 KCEMIEINTNPBQD-CABCVRRESA-N 335.448 1.838 10 10 EDCE COCc1n[nH]c(CNC(=O)NCCCSc2nccs2)n1 853856225 UYJZCUCSEPEWGY-UHFFFAOYSA-N 342.450 1.389 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CC[C@H](C)NC2)cc1 861767588 SXMDXMXNQSHEPB-HOCLYGCPSA-N 346.475 1.406 10 10 EDCE CO[C@H]1CCn2cc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)nc2C1 867302551 RHGAGQHLJOWDGW-YPMHNXCESA-N 345.399 1.617 10 10 EDCE NC1(CNC(=O)NCc2ccc(N3CCCC3)cc2)CCOCC1 861556433 AHYUURMMJNTDFP-UHFFFAOYSA-N 332.448 1.594 10 10 EDCE COc1ccc(O)c([C@@H](C)NCC(=O)N2CCOC[C@@H]2C2CC2)c1 775377516 GPQPQIUUJQUMTG-MLGOLLRUSA-N 334.416 1.689 10 10 EDCE Cc1cc(C(=O)NCCc2nnnn2C)c(C)n1-c1ccc(F)cc1 771777386 TXPIKXAJBNVAEP-UHFFFAOYSA-N 342.378 1.729 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc2nc(CO)[nH]c12 1138152963 ULHXWSHHTUVALW-JTQLQIEISA-N 341.367 1.827 10 10 EDCE CN1CCCc2cc(CNC(=O)[C@H](O)Cc3cnn(C)c3)ccc21 786848714 OPZXDCIAWGBDOH-QGZVFWFLSA-N 328.416 1.022 10 10 EDCE COc1ccc(CNC(=O)CNC(=O)c2ccccc2C)c(O)c1 794389881 RKFCXXKBTKYQLH-UHFFFAOYSA-N 328.368 1.755 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](CO)[C@@H](CO)C2)c(Br)c1 704817267 WQTBFEHYTRQKDG-RTXFEEFZSA-N 343.265 1.767 10 10 EDCE O=C1CCCC(=O)N1CCNCc1c(O)cccc1Br 706841894 CXMWFROCLUFXLS-UHFFFAOYSA-N 341.205 1.783 10 10 EDCE Cn1nc(C(F)(F)F)cc1CNC(=O)c1c(F)ccc(O)c1O 1306894703 WHUDQJCYZLAEJS-UHFFFAOYSA-N 333.241 1.919 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@H](O)C2(C)C)c(Br)c1 2124796466 PFTLCGFQHOSKFM-OLZOCXBDSA-N 329.238 1.489 10 10 EDCE CCN1CCO[C@H](C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)C1 1266995763 FMELSRHCQDRZCN-YJBOKZPZSA-N 349.475 1.319 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)c2nccnc2N)cc1C 1503127249 SAKLPUYGQUQPQE-ZDUSSCGKSA-N 343.431 1.674 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@@H](CNC(=O)C(C)C)C2)cc(OC)n1 1514777427 VEHAUPGOVCXHED-BJHJDKERSA-N 335.404 1.379 10 10 EDCE Cc1ccc(S(=O)(=O)CCC(=O)NCc2cc(O)ccc2O)cc1 1455351926 ZUVQDAZDQVVUOV-UHFFFAOYSA-N 349.408 1.886 10 10 EDCE CC[C@@H](CNC(=O)C(F)F)NC(=O)c1ccc(N=NC(N)=O)cc1 1531038279 VZOXZQLMXZLVEI-VIFPVBQESA-N 341.318 1.739 10 10 EDCE C=CCCC(=O)N1CCC[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1704495074 JEUKCCCQORZZOR-AWEZNQCLSA-N 347.415 1.786 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)CNC(=O)C2CC2)cc1C 1700394769 WHCBGXQESDLWHP-KBPBESRZSA-N 347.459 1.513 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H]2CC23CCC3)cc1C 1482772158 DATCIBSCRXHFPE-HOTGVXAUSA-N 332.444 1.761 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)c2cn(C)nn2)C2CC2)cc1C 1483559181 ZISQLLRLGTYKGK-OAHLLOKOSA-N 343.431 1.430 10 10 EDCE COCCCNC[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1714877160 JZNJXENMOACDHD-GFCCVEGCSA-N 335.408 1.936 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@]2(C)CCNC2=O)cc1C 1715359507 HRDDEERXSFFGSU-AUUYWEPGSA-N 347.459 1.466 10 10 EDCE CCOC(=O)Cn1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)n1 1557274445 AZGIAJWYHYTQMD-GQCTYLIASA-N 331.328 1.509 10 10 EDCE CS(=O)(=O)c1cccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)c1 1636665206 INNIITPXXLNNQR-VURMDHGXSA-N 347.392 1.831 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)C(C)(C)C(N)=O)C2CC2)cc1C 1723307867 NZZMQWWNXZLEMS-OAHLLOKOSA-N 347.459 1.500 10 10 EDCE C[C@@H](O)c1cn(CC(=O)NCc2c(O)ccc3ccccc23)nn1 1635965241 RYIQVHXWOWCORL-LLVKDONJSA-N 326.356 1.507 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1=CS(=O)(=O)CCC1 1632680936 IYUPDSAHLXEDKT-SNVBAGLBSA-N 325.386 1.238 10 10 EDCE O=C(Cn1nnnc1-c1ccsc1)NCc1ccc(O)cc1O 1630307439 VWNDCAJCGKZHBY-UHFFFAOYSA-N 331.357 1.129 10 10 EDCE CNC(=O)NCC(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)[C@H]1C 1734393122 FUXDLBXETNIXFG-HIFRSBDPSA-N 348.447 1.012 10 10 EDCE C[C@@H](NC(=O)c1cc(S(=O)(=O)N(C)C)c[nH]1)c1ccccc1O 1642824397 SQRXAQVWPLCRLT-SNVBAGLBSA-N 337.401 1.462 10 10 EDCE CCOCCN[C@H](C)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1570655955 VBYLGMVFJPFINL-VXGBXAGGSA-N 335.408 1.982 10 10 EDCE CS(=O)(=O)c1ccc(CCC(=O)NCc2cccc(O)c2O)cc1 1651175831 PCWTYIMOTIEILZ-UHFFFAOYSA-N 349.408 1.750 10 10 EDCE O=C(NCCn1c(O)nc2ccccc21)c1c(F)ccc(O)c1O 1650857178 WPFXGDFSMODCRK-UHFFFAOYSA-N 331.303 1.722 10 10 EDCE CCOC(=O)[C@@H](NC(=O)c1cc(O)cs1)[C@@H](O)c1cccnc1 1587187490 WVIMLLPOWWFQRF-STQMWFEESA-N 336.369 1.244 10 10 EDCE CN1CCn2nc(NC(=O)c3ccc(N=NC(N)=O)cc3)cc2C1 1587864856 PMYQPNDVXFKJFY-UHFFFAOYSA-N 327.348 1.743 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@H]2CCCC(=O)N2)cc1C 1669610367 BGQCGJIMXMIBNF-GOEBONIOSA-N 347.459 1.657 10 10 EDCE O=C(O)CCNC(=O)CN1C(=O)/C(=C/c2ccco2)SC1=S 15036534 VCHKLIYEJPWSGC-TWGQIWQCSA-N 340.382 1.072 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](C)Cn1cncn1 158148462 IDEYOROIYGQRKK-CQSZACIVSA-N 330.436 1.964 10 10 EDCE Nc1ccc(OCC(=O)Nc2cc(C(=O)O)cc(C(=O)O)c2)cc1 1860078892 RSXPNUCRLNKIQZ-UHFFFAOYSA-N 330.296 1.683 10 10 EDCE CCCNCc1ccc(N2C[C@H](O)[C@H](O)C2)cc1Br 233113967 YSMAWUCRSOSVMS-OKILXGFUSA-N 329.238 1.491 10 10 EDCE O=C(O)[C@H]1C[C@H](NCc2ccc(Br)cc2O)CCO1 1880020121 IXPMYYNSZBXQCS-ZYHUDNBSSA-N 330.178 1.877 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@]1(C(=O)NCCCN=[N+]=[N-])CCOC1 1985100640 IJELIXRZNQPRHH-CQSZACIVSA-N 327.385 1.829 10 10 EDCE COC1(CNCc2ccc(O)c(O)c2)CN(C(=O)OC(C)(C)C)C1 1996224297 YWJZYGBOSXGMSV-UHFFFAOYSA-N 338.404 1.823 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCC[C@H]2CN=[N+]=[N-])CCOC1 2010405018 FAJOLXGOKIZGLI-XHDPSFHLSA-N 339.396 1.972 10 10 EDCE N[C@@]1(C(=O)O)CCN(Cc2cc(Cl)cc(Br)c2O)C1 708110841 IMYRXWUVGPELCK-LBPRGKRZSA-N 349.612 1.796 10 10 EDCE CC[C@H](O)CN(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2106613048 HSYGZUUWNJKYAB-MADCSZMMSA-N 329.194 1.642 10 10 EDCE NC(=O)CO[C@@H]1CCN(c2ccc(CO)cc2Br)C1 2089140074 UAKGMQYQOUAMRG-SNVBAGLBSA-N 329.194 1.022 10 10 EDCE C[C@@H](CO)N1CCN(c2ccc(CN)c(Br)c2)CC1 2113061940 MNOOWPCKKDWDQF-NSHDSACASA-N 328.254 1.411 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-])C(C)(C)O 2213584035 YOECZYHCHIUEJZ-GMTAPVOTSA-N 341.412 1.998 10 10 EDCE C[C@@H]1CN(CCNCc2c(O)cccc2Br)C(=O)N1 2230838660 CBQGBDKCRVECQO-SECBINFHSA-N 328.210 1.658 10 10 EDCE COc1ccc(Br)c(CN[C@H]2COC[C@@H]2OC)c1O 2227736783 LACQEIKUYHMTNM-JQWIXIFHSA-N 332.194 1.667 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N[C@H]1C[C@H]2CC[C@H]1O2 2298958904 AFSMSRGTAMNKIZ-FGTMMUONSA-N 328.412 1.973 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2CCN(C)c3ncccc32)c1 492091576 SIBYVQGRAURCIL-AATRIKPKSA-N 337.383 1.332 10 10 EDCE CC1(C)OC(=O)C(=CNC2CCN(Cc3ccccc3)CC2)C(=O)O1 100280095 XFGNULWGXZOHFZ-UHFFFAOYSA-N 344.411 1.961 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)c(Br)c1 2357056178 GBLSXPWNIMXTCR-KJEVXHAQSA-N 341.249 1.631 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCCNC(=O)[C@@H]2C)c([N+](=O)[O-])c1 302793224 ZQPNZGBNHHZPJY-ZRQQLDRUSA-N 333.344 1.496 10 10 EDCE N[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1346103535 IWMHRYAYKPZAIC-NVXWUHKLSA-N 349.450 1.921 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCOC[C@@H](F)C3)c(Br)cc21 2361809514 XFFIKBNJEOEOAR-MADCSZMMSA-N 344.184 1.576 10 10 EDCE Cc1ccc(C(=O)Nc2ccc(Cc3nnn[nH]3)cc2)c(O)c1O 182611486 MUHAPYIOACDIGW-UHFFFAOYSA-N 325.328 1.762 10 10 EDCE N#Cc1cc(F)c(S(=O)(=O)NCCc2ccc(N)cc2)c(F)c1 193339015 WCYOXGNMNQSQDW-UHFFFAOYSA-N 337.351 1.940 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1cn[nH]c1 270394542 IORSTAIZQVRDMG-ZDUSSCGKSA-N 329.404 1.807 10 10 EDCE COC(=O)c1cncnc1N1CCCN(c2ccc(OC)cc2)CC1 376119590 WPMBCEDULWGWEB-UHFFFAOYSA-N 342.399 1.989 10 10 EDCE COc1ccc(N2CCN(C[C@H]3CCCS(=O)(=O)C3)CC2)cc1 284024851 IAEIGZIFNWWFLP-OAHLLOKOSA-N 338.473 1.642 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](N)C(C)(C)O)c(O)c1Br 2380765074 JMSSYDBHPIYHKK-GFCCVEGCSA-N 345.237 1.520 10 10 EDCE Cc1ccc(CN2CCN(C)C[C@@H]2CCO)c(O)c1Br 2380805008 OLWIFHFEFPDMOU-ZDUSSCGKSA-N 343.265 1.962 10 10 EDCE COCCN(CC(=N)NO)Cc1ccc(C)c(Br)c1O 2381147047 ONTGBWWDKZBPRA-UHFFFAOYSA-N 346.225 1.868 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccn(C)n1 805705204 XCKYHFPRTFIHMT-UHFFFAOYSA-N 344.415 1.571 10 10 EDCE COc1ccc(N2CCC[C@@](N)(CO)C2)c(OC)c1Br 2162645732 BYRCBKFJWGLHED-AWEZNQCLSA-N 345.237 1.756 10 10 EDCE C/C=C/[C@H](O)C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 901327616 QSLDPFBGUBUJFH-OOPCZODUSA-N 327.764 1.484 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccnn1C1CCOCC1 830531522 JFYGALNOQDSNDR-UHFFFAOYSA-N 331.372 1.618 10 10 EDCE O=C(NC[C@@H]1C[C@@H]2COC[C@@H]2O1)c1cc2cc(O)c(O)cc2s1 831227413 ROHVBCUBHVJQDW-NRUUGDAUSA-N 335.381 1.846 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N[C@H]3CC3(C)C)CC2)cc1 840274316 BBYHCXHLFHRAHR-KRWDZBQOSA-N 346.475 1.915 10 10 EDCE C[C@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@@H](c2ccnn2C)C1=O 843308963 VTJLKWAPRIIHHK-ABAIWWIYSA-N 327.388 1.840 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCCCNC3=O)C2)cc1 849225659 YMUDIVJMMNHIIQ-XJKSGUPXSA-N 346.431 1.242 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)OCCn1nc2ccccn2c1=O 759595370 QVILVHIVCSLJST-ALCCZGGFSA-N 341.323 1.164 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3csc(CCN)n3)C2)cc1 852899990 FSIFBVMWRSQYIU-GFCCVEGCSA-N 346.456 1.662 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3(O)CCOCC3)C2)cc1 854298365 BNQFRJDVFATYSE-CQSZACIVSA-N 349.431 1.115 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cc3ccc(N)cn3)C2)cc1 851639924 NDCFGSXVSRJXJV-OAHLLOKOSA-N 326.400 1.610 10 10 EDCE CC(=O)C(=O)COC(=O)c1cncc2nc(C(F)(F)F)n(C)c12 850181439 IWGHVLPIGJLAET-UHFFFAOYSA-N 329.234 1.302 10 10 EDCE COC(=O)c1cc2ccccc2c(CN(C)[C@H]2CCNC2=O)c1O 758395430 ANTUUBCSEQBYKJ-HNNXBMFYSA-N 328.368 1.652 10 10 EDCE COC(=O)[C@@]1(OC)CCN(Cc2cccc(Br)c2O)C1 862473951 IWPIGOPPBDQZCG-CQSZACIVSA-N 344.205 1.919 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2ccc3ccccc3c2O)CCO1 862459563 VVDSWPYSYBPCKQ-HNNXBMFYSA-N 329.400 1.675 10 10 EDCE CC(=O)N1CCC(C(=O)NCc2ccc3cccnc3c2O)CC1 862028554 CVCHPCJXRSIHDC-UHFFFAOYSA-N 327.384 1.815 10 10 EDCE CCN(Cc1cn(C)nn1)C(=O)NCCCSc1nccs1 781939674 RKDJMPMICSPFMO-UHFFFAOYSA-N 340.478 1.986 10 10 EDCE Cc1cc(Br)c(O)c(CNC[C@H]2CC(C(N)=O)=NO2)c1 789560319 IOXJCPUISZVICZ-SECBINFHSA-N 342.193 1.183 10 10 EDCE CS(=O)(=O)c1cccnc1CNC(=O)NCc1ccccc1O 787128402 GPQXWFOMTFVHPM-UHFFFAOYSA-N 335.385 1.190 10 10 EDCE CN[C@H](C)c1ccc(N(C)[C@@H]2COC[C@H]2O)c(Br)c1 709229265 XIPFXBLPKDBZRI-OWYVNGRQSA-N 329.238 1.925 10 10 EDCE Cc1ccncc1N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 799153530 DIXIMTPGONHXMO-SFHVURJKSA-N 341.411 1.844 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)C[C@@H]2CN(C)C)c(Br)c1 97246493 VGEPKWLCWXHWJI-CYZMBNFOSA-N 342.281 1.970 10 10 EDCE CNC(=O)CC1(CNC(=O)Cc2ccc(O)c(O)c2)CCCCC1 1167645919 SDMWKNNUYJJZMW-UHFFFAOYSA-N 334.416 1.843 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1CCCNC1=O 1320758982 UCSOSVAAUHRVRD-INIZCTEOSA-N 347.459 1.468 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC2(CCC2)O1 1329497844 UYETUWOCHPTWSH-GFCCVEGCSA-N 330.384 1.404 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NC[C@H]2COCCN2C)cc1 1261788293 QYNGKIIHTGTXCG-KRWDZBQOSA-N 334.464 1.663 10 10 EDCE O=C(C(=O)N(C[C@H]1CCOC1)C1CC1)N1Cc2cccc(O)c2C1 1348587407 SAVJELOPNCSOGW-GFCCVEGCSA-N 330.384 1.262 10 10 EDCE C[C@@H](O)CNCC[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1272651247 CEJYZFOGYFMFKZ-OLZOCXBDSA-N 347.419 1.672 10 10 EDCE COc1ccc(CN[C@@H]2CCN(C(=O)CCCC(N)=O)[C@H]2C)cc1C 1507303291 WUOHYILIIVIJMR-GOEBONIOSA-N 347.459 1.738 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3ccnnc3)CC2)cc1C 1277182795 CBZKGDLBKPWWAM-UHFFFAOYSA-N 326.400 1.846 10 10 EDCE COc1ccc(N2CCCN(C(=O)/C=C/C(=O)N(C)C)CC2)cc1 1441926447 BRQVTZPGGGLUDY-MDZDMXLPSA-N 331.416 1.378 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)C[C@H]2COC(=O)C2)cc1C 1281707583 NLKQOZJPOVGAKX-GOEBONIOSA-N 348.443 1.941 10 10 EDCE CC(C)C(=O)NC[C@@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1464679072 GYPDGKJUBKTRLL-AWEZNQCLSA-N 334.416 1.651 10 10 EDCE CCCOc1ccnc(CC(=O)NCc2ccc(OC)cc2O)n1 1617753514 PVAQEVGYWDFKCB-UHFFFAOYSA-N 331.372 1.839 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CN2CCN1C[C@@H]2C 1542169775 ASZGRXQYNNCVMX-QFBILLFUSA-N 344.503 1.878 10 10 EDCE COc1ccc(CN[C@@H]2CCN(C(=O)CNC(C)=O)C[C@@H]2C)cc1C 1715408698 YEWDIGRXJLLMAZ-WMLDXEAASA-N 347.459 1.466 10 10 EDCE COC(=O)[C@@](C)(CNC(=O)Cc1ccc(O)c(O)c1)c1ccccc1 1638768577 JBXMHLHGHNZGSV-IBGZPJMESA-N 343.379 1.887 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1cn(CCc2ccccc2)nn1 1566359195 VWGMGZNZEHYIBQ-UHFFFAOYSA-N 338.367 1.862 10 10 EDCE CC(C)(C)OC(=O)[C@]1(NC(=O)Cc2ccc(O)c(O)c2)CCOC1 1640947599 OLORVYLHWHXHLK-KRWDZBQOSA-N 337.372 1.257 10 10 EDCE O=C1CSc2ncc(C(=O)NCc3c(O)cccc3F)cc2N1 1646034570 NCGVCIJZDMYQNK-UHFFFAOYSA-N 333.344 1.901 10 10 EDCE COc1ccc(CNC[C@]2(NC(=O)C(N)=O)CCCC[C@@H]2C)cc1C 1732259027 SCUVMHSGTYGLND-IFXJQAMLSA-N 347.459 1.644 10 10 EDCE Cc1c(F)cc(S(N)(=O)=O)cc1C(=O)NCc1ccccc1O 1595792085 DJOGGRWSHQDHMP-UHFFFAOYSA-N 338.360 1.417 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2(NC(=O)CCCF)CC2)cc1 1689593057 PGODWVPRXCZNLO-UHFFFAOYSA-N 349.366 1.977 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NC[C@@H]1CCCS1(=O)=O 153521329 VPHMEDXDWUSYJJ-LBPRGKRZSA-N 347.396 1.557 10 10 EDCE Oc1c(F)cc(Br)cc1CNC[C@@]1(O)CCCOC1 1971053364 ISJRDPCSJLHKIM-ZDUSSCGKSA-N 334.185 1.925 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(NCc2c(O)cccc2F)C1 1976861132 ROTIZXRQDACWAC-UHFFFAOYSA-N 326.368 1.603 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1C[C@H](O)CN(C(=O)OC(C)(C)C)C1 2010406276 RVMZEINCLMPNMX-NEPJUHHUSA-N 341.412 1.763 10 10 EDCE OC[C@@H]1COC[C@@H]1NCc1cc(Cl)cc(Br)c1O 2029843437 FNATXXWQWHPRNZ-KCJUWKMLSA-N 336.613 1.905 10 10 EDCE C[C@@H](N)c1ccc(N(C)Cc2nnnn2C)c(Br)c1 707668905 QQQBCKOZKCZBNQ-MRVPVSSYSA-N 325.214 1.629 10 10 EDCE C[C@@H]1C[C@H]1N(CCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2167109744 PXNOVCFZDICTDK-TWPQKTAQSA-N 340.221 1.608 10 10 EDCE C[C@@H](N)c1ccc(N2CCN([C@H](C)CO)CC2)cc1Br 2169364690 RYUUBWWTHVDDFI-VXGBXAGGSA-N 342.281 1.972 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3cccc(Br)c3O)C[C@H]2C1 2087858511 NEURGTVLFQQCPO-QWRGUYRKSA-N 346.246 1.631 10 10 EDCE CN(C)C[C@@H]1COCCN1c1ccc(CO)c(Br)c1 2096926623 VLBRVCKPKJHFBP-CYBMUJFWSA-N 329.238 1.708 10 10 EDCE N[C@@H]1CN(Cc2c(O)cccc2Br)[C@]2(CCOC2)C1 2098287779 RTRVFKUIMCUZJN-IINYFYTJSA-N 327.222 1.847 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-])C1COC1 2213585023 JSXUUJBZPKBXRE-SRVKXCTJSA-N 339.396 1.874 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCNC(=O)CC2)c1O 2236055841 RXDQNDGROSCINU-SECBINFHSA-N 343.221 1.922 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)C[C@H]3C2)c(Br)c1 2236999665 ZMHNFNCUPGYZSH-HGSJOUDDSA-N 342.233 1.509 10 10 EDCE C[C@@]1(CO)C=CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2237169747 HZYKHJWZFGFIKS-OCCSQVGLSA-N 338.205 1.528 10 10 EDCE COC[C@]1(C(=O)N2CC(N=[N+]=[N-])C2)C=CCN1C(=O)OC(C)(C)C 2299700764 SJSCIRAFQHNKTB-HNNXBMFYSA-N 337.380 1.700 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N(C)c2ccc([N+](=O)[O-])nc2)c1 493863878 XSMIYXPRVIRYEX-UTCJRWHESA-N 341.327 1.421 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)c(Br)c1 2336349908 NNANWOXQXLYXCX-ZDSQKVDBSA-N 345.262 1.702 10 10 EDCE C[C@]1(c2cccc(CNCc3ccccc3O)c2)NC(=O)NC1=O 171130138 PGXSBRLRCVMJOC-GOSISDBHSA-N 325.368 1.737 10 10 EDCE CCN(CC)C(=O)N1CCN(c2ccc3c(c2)CC(=O)N3C)CC1 62093807 WDUYNJNEGISRDR-UHFFFAOYSA-N 330.432 1.789 10 10 EDCE Cc1ccc([C@H](C)NCCNS(=O)(=O)c2cccnc2)c(O)c1 186142262 SIPPNQCKYKVWMW-ZDUSSCGKSA-N 335.429 1.725 10 10 EDCE CN(Cc1ccccc1O)C(=O)N[C@@H]1CCCN(c2cnn(C)c2)C1 74613736 BTCNPOFZWNEOCB-OAHLLOKOSA-N 343.431 1.936 10 10 EDCE COc1ccc(N2CCN(CC(=O)N3C[C@H](C)O[C@@H](C)C3)CC2)cc1 97653834 CJAGYZYTENYLGH-HOTGVXAUSA-N 347.459 1.453 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3C[C@H]3C(=O)NC(C)C)CC2)cc1 242945506 HEACIZGQMRHHCI-SJORKVTESA-N 345.443 1.505 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N(C)C(C)C)CC2)cc1 267914804 GGCRQHNNXDXTMW-UHFFFAOYSA-N 334.464 1.867 10 10 EDCE Cc1ccc(CN(C)C(=O)COC2CNC2)c(O)c1Br 2381132731 FIPHZHNEXVBIHM-UHFFFAOYSA-N 343.221 1.410 10 10 EDCE Cc1ccc(CN2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(O)c1Br 2381140487 LBNQUONOGCUAFL-YIVQXAGMSA-N 342.233 1.779 10 10 EDCE O=C1C[C@@H](C(=O)NCc2cc(Br)ccc2O)CCN1 804739767 RTKQFEWUISIDAJ-QMMMGPOBSA-N 327.178 1.297 10 10 EDCE N[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(F)(F)F 827364311 HLHSPTDQUDQSOM-ZDUSSCGKSA-N 349.328 1.293 10 10 EDCE CN1C[C@@H](O)C[C@]1(C)C(=O)NCc1cc(Br)ccc1O 908171460 YJTSELPVTVEHFF-SMDDNHRTSA-N 343.221 1.226 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCO[C@H](C2CC2)C1 839219821 UDMRDEZCUDAWRN-KRWDZBQOSA-N 345.443 1.348 10 10 EDCE Cc1cc(C(=O)N2CCN(C)[C@@H](CO)C2)c(C)n1-c1ccccn1 913553145 BXCGXSKJTDYRTJ-OAHLLOKOSA-N 328.416 1.238 10 10 EDCE C[C@H]1CNCC[C@@H]1NC(=O)NCc1cccc(Br)c1O 841988880 NMAIREVCDBHZMI-CABZTGNLSA-N 342.237 1.952 10 10 EDCE CN(Cc1cc(O)n2ncc(C(=O)O)c2n1)C1Cc2ccccc2C1 846238205 AMJTYROISKPXCS-UHFFFAOYSA-N 338.367 1.732 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1c(O)cccc1F)[C@H]1CCOC1 921450606 BNZSXYZDNRZEOK-IINYFYTJSA-N 333.381 1.002 10 10 EDCE COC[C@@H]([C@H]1CCCOC1)N1C(=O)CN(Cc2ccccc2O)C1=O 925142504 OGAJNIALJQAJQF-GJZGRUSLSA-N 348.399 1.598 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@H]2CC[C@@H](C2)C1 850602068 MWGYXDWVUFFXLP-HOTGVXAUSA-N 329.444 1.970 10 10 EDCE NCC12CC(CN1C(=O)NCc1ccc(N3CCC(O)CC3)cc1)C2 851682991 ZHILILWMFYQLTP-UHFFFAOYSA-N 344.459 1.280 10 10 EDCE CCn1cc(CC(=O)NC2CCN(c3ccc(OC)cc3)CC2)nn1 931576315 JSEBDJHHIPUTFJ-UHFFFAOYSA-N 343.431 1.634 10 10 EDCE O=S(=O)(c1cnn([C@H]2CCOC2)c1)N1Cc2cccc(O)c2C1 867690738 LOEWFHFAXWIAQC-LBPRGKRZSA-N 335.385 1.255 10 10 EDCE CC(=O)N1CCN(Cc2ccc(N3CCOCC3)c(F)c2)[C@H](C)C1 769448498 SQKCVQHAYDHAHM-CQSZACIVSA-N 335.423 1.715 10 10 EDCE CCN(OC)C(=O)CNCc1ccc(N2CCN(C)CC2)c(F)c1 1118175867 DONYKTNPVXUZSD-UHFFFAOYSA-N 338.427 1.077 10 10 EDCE N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 870869276 JYEHIWPDFXRSOS-PMUMKWKESA-N 333.407 1.406 10 10 EDCE CC(=O)N1CC[C@@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)C1 897779883 UCZHWGUDRBVMRM-JTQLQIEISA-N 334.397 1.911 10 10 EDCE C[C@@H](NC(=O)N[C@@H]1[C@H]2COC[C@H]21)c1ccc(N2CCOCC2)cc1 792920931 GMIJUIZSSWGTMM-VZEFYGNVSA-N 331.416 1.528 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NC[C@@H](C)S(N)(=O)=O)cc1 799885290 DGGNHFDFZLMBAI-GFCCVEGCSA-N 342.465 1.009 10 10 EDCE CN1CCO[C@H](CN(C)c2ccc(CO)cc2Br)C1 707869936 UWRBCUFCCWNKSY-LBPRGKRZSA-N 329.238 1.708 10 10 EDCE COCCNC(=O)[C@@H](C)NCc1cc(Br)cc(F)c1O 715711165 DKKYRZNOGMQANV-MRVPVSSYSA-N 349.200 1.535 10 10 EDCE Cc1oc(S(C)(=O)=O)cc1C(=O)NCc1c(O)cccc1O 1304053319 IHAHUWPMEKOSHQ-UHFFFAOYSA-N 325.342 1.333 10 10 EDCE COCC1(CCNC(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 1326094756 ZLWRWXCMBRQTGS-UHFFFAOYSA-N 333.432 1.302 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)C[C@@H]2CCNC2=O)cc1C 1320448177 UCKMLHGPWRMGOV-ZBFHGGJFSA-N 347.459 1.514 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3NC(=O)O[C@H]3C2)c(Br)c1 2120416769 QHVCXUDHCYGXNG-JWYUURKGSA-N 327.178 1.799 10 10 EDCE CN(C)c1ccc(/C=C/CNCCN2C[C@H](C(=O)O)CC2=O)cc1 1339240543 KDKZSUQUPDWZKP-NHZBNJEXSA-N 331.416 1.289 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C[C@H]2COC(=O)C2)cc1C 1268642898 SAPMGYXOWDOURF-UKRRQHHQSA-N 334.416 1.551 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](C)N(C(=O)CCCC(N)=O)C2)cc1C 1278430036 DBRUPIWCUJRCJK-HOCLYGCPSA-N 347.459 1.738 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@H](C)NC(C)=O)C2CC2)cc1C 1480001785 QHXCBUFBMFANEQ-SUMWQHHRSA-N 347.459 1.513 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1=C2CCCN=C2NN1 1630180659 PLFCXRWGKYUYJJ-CYBMUJFWSA-N 341.459 1.662 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2nnn(C)c2C)cc1C 1568616684 LTOKCKPGTZSACC-CYBMUJFWSA-N 345.447 1.739 10 10 EDCE CN(C)CCCC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1736802987 XEQXSOACTCONIE-UHFFFAOYSA-N 348.407 1.037 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)c2ncn(C)n2)cc1C 1571249527 BEDSKJZGVDCNRT-CQSZACIVSA-N 345.447 1.820 10 10 EDCE COc1ccc(CNC[C@@H]2CC[C@H](NC(=O)CNC(C)=O)C2)cc1C 1571527789 DZQOWQOPYIJLIV-SJORKVTESA-N 347.459 1.514 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CNC(=O)C(C)(C)C)cc1C 1664364988 XBYBSMRAKQBWIH-UHFFFAOYSA-N 349.475 1.714 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CCC(=O)N3C)CC2)cc1C 1670842456 FUZGSCZWLRGFJX-OAHLLOKOSA-N 345.443 1.363 10 10 EDCE COc1ccccc1[C@H](CNC(=O)Cc1ccc(N)cc1)C(=O)O 1865957045 QXAKXYNPSVOIGT-HNNXBMFYSA-N 328.368 1.805 10 10 EDCE CN(C)C[C@H]1COC[C@@H]1NCc1cccc(Br)c1O 2141466760 UGMPFDJDDLNYMP-AAEUAGOBSA-N 329.238 1.821 10 10 EDCE Oc1cccc(Br)c1CN[C@@H]1COC2(CCC2)[C@H]1O 2141560651 ZMMOJXLQWNKDDT-YPMHNXCESA-N 328.206 1.927 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)NCCCN=[N+]=[N-])C1 1985095331 CIJNTKXPKIFSES-NSHDSACASA-N 327.385 1.687 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC(CN=[N+]=[N-])CC1 1985099084 GTCQWXCJYOWXRD-NSHDSACASA-N 327.385 1.421 10 10 EDCE C[C@@H](NC[C@H](CO)NC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985852802 HBXCMEOQRKHBEC-GHMZBOCLSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](C(=O)NCCN=[N+]=[N-])C1CCOCC1 2010389048 KRSLKLLQVPZYDG-LBPRGKRZSA-N 341.412 1.980 10 10 EDCE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010404635 BIHLCZSOQJPLIE-VHSXEESVSA-N 341.368 1.354 10 10 EDCE CN1CCO[C@H]2CN(c3ccc(CN)c(Br)c3F)C[C@@H]21 2153987973 BDVMRQCNEHAQBZ-RYUDHWBXSA-N 344.228 1.566 10 10 EDCE CNCc1ccc(N2CC[C@@H]3C(=O)NC[C@@H]3C2)cc1Br 2157170493 BCXWVEUCQYKJJC-YPMHNXCESA-N 338.249 1.741 10 10 EDCE NCc1cc(F)c(N2CCN3C(=O)NC[C@H]3C2)cc1Br 312250911 JABUWROVGYMGSN-VIFPVBQESA-N 343.200 1.261 10 10 EDCE CNCc1ccc(N2C[C@H]3COC[C@@H](C2)C3O)c(Br)c1 2167789721 NBOOZFCUFFMPPN-ODOQXGPZSA-N 341.249 1.612 10 10 EDCE COc1ccc(N(C)[C@@H]2COC[C@@H]2O)c(OC)c1Br 2226539048 RMRVUULRYOBLAA-ZJUUUORDSA-N 332.194 1.662 10 10 EDCE CCCNC1CC(S(=O)(=O)NCc2cnc(SC)s2)C1 2284724443 PKBPOUSHMJESCT-UHFFFAOYSA-N 335.520 1.815 10 10 EDCE Cc1ccc(CN2CC(O)(CN(C)C)C2)c(O)c1Br 2352953393 UVSUTRKSGZJRFX-UHFFFAOYSA-N 329.238 1.571 10 10 EDCE COc1cccc(N2C(=O)[C@@H](CN3CCOCC3)SC2=S)c1 59397395 RCFOFWTWEZFQSC-CYBMUJFWSA-N 338.454 1.761 10 10 EDCE CN(C)CCNC(=O)C(=O)N(c1ccccc1)c1ccc(N)cc1 170388820 UYIIAPWTSMZTJR-UHFFFAOYSA-N 326.400 1.611 10 10 EDCE C[C@](O)(CNCc1cc(Cl)cc(Cl)c1O)CN1CCOCC1 174489071 VNEIXLKIPXYGFS-HNNXBMFYSA-N 349.258 1.872 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3CCC(=O)NC3)CC2)cc1C 1269442439 FUYFFGGOLZPRMC-OAHLLOKOSA-N 345.443 1.268 10 10 EDCE O=C1c2ccccc2C(=O)c2c1cccc2C(=O)N1CC[C@@H](CO)C1 128834228 TWUAPEAJFFLTGQ-GFCCVEGCSA-N 335.359 1.916 10 10 EDCE COc1cccc(/C=C2/SC(N3CCN(C)CC3)=NC2=O)c1O 35198463 MOOFOXMGUIYONL-JLHYYAGUSA-N 333.413 1.619 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)Nc1ccc2c(c1)OCCNC2 528716687 BZFFCNPCWPBBNM-UHFFFAOYSA-N 343.383 1.944 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(C)C[C@@H]3CCCO3)nc12 263910745 LYXNXQJDMWLPHS-LBPRGKRZSA-N 334.376 1.222 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC(=O)N1C 282284530 VXTBAYYAESDCPF-AWEZNQCLSA-N 328.416 1.435 10 10 EDCE CNC(=O)NCCC(=O)NCc1cc(Br)ccc1O 816653645 BYJLTMNKKVVCMK-UHFFFAOYSA-N 330.182 1.090 10 10 EDCE CCn1ncc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)n1 815425525 ASQZKWSOPOSKTL-UHFFFAOYSA-N 345.403 1.179 10 10 EDCE COC[C@@]1(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCOC1 823771073 QNQGPHBBPASAJW-IBGZPJMESA-N 348.443 1.535 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cn([C@@H]3CC[C@H]3O)nn2)cc1F 828865960 KDJMJQSCRYEGQO-HUUCEWRRSA-N 333.367 1.109 10 10 EDCE C/C=C/[C@@H](O)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 909855619 IHYSWHGBFPQMCQ-BAABZTOOSA-N 326.343 1.355 10 10 EDCE CN1C(=O)CO[C@H](C(=O)NCc2ccccc2O)[C@H]1c1cccnc1 830527139 VDZLPKFIBDEPMB-SJORKVTESA-N 341.367 1.002 10 10 EDCE O=S1(=O)CC[C@@]2(CN(Cc3cc(Cl)cc(F)c3O)CCO2)C1 843425742 HNXRGMCUAPECRG-CQSZACIVSA-N 349.811 1.574 10 10 EDCE O=C1N[C@H](CCF)C(=O)N1Cc1ccc(N2CCOCC2)c(F)c1 844719737 RGOLLYLAHAQHQE-CYBMUJFWSA-N 339.342 1.442 10 10 EDCE CN1CCN(c2cccc(C(=O)NCc3c(O)cccc3F)n2)CC1 928705591 LQJQIRHJIMCXRZ-UHFFFAOYSA-N 344.390 1.608 10 10 EDCE CC[C@H](NCCC(=O)NCCC(=O)OC)c1ccc(F)cc1O 858542879 YUOWZTDARVSSQQ-ZDUSSCGKSA-N 326.368 1.641 10 10 EDCE Cc1cc(CC(=O)N[C@H](CO)CN(C)C)c(C)n1-c1ccccc1 854466954 OLZPOMAKCHDIJJ-KRWDZBQOSA-N 329.444 1.675 10 10 EDCE COc1ccc(N2CC[C@@H](NCc3c4c(nn3C)CCOC4)C2)cc1 922237426 KKNFEJFTWJBHIO-CQSZACIVSA-N 342.443 1.870 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCN3CCOCC3)C2)cc1 855229355 JGTGZLXKWYCARR-HNNXBMFYSA-N 333.432 1.112 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3COCC3(C)C)C2)cc1 852372740 GJUNUXPKCMBWCI-XJKSGUPXSA-N 333.432 1.998 10 10 EDCE COC(=O)c1cc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)no1 855223174 CDPCTOUFBLHVPO-NSHDSACASA-N 345.355 1.479 10 10 EDCE CCO[C@@H](C(=O)NCc1ccc2cccnc2c1O)[C@@H]1CCOC1 868937979 PQQUFYLGDTVVLK-RHSMWYFYSA-N 330.384 1.998 10 10 EDCE CC[C@]1(C(=O)NCc2cc(Br)ccc2O)CCNC1=O 868307350 YZUHGCYYQGMPTI-AWEZNQCLSA-N 341.205 1.687 10 10 EDCE C[C@@H](NC(=O)[C@H]1CC[C@@H](C(N)=O)C1)c1ccc(N2CCOCC2)cc1 1125518663 JPDCMKLFSICPJP-BMFZPTHFSA-N 345.443 1.602 10 10 EDCE Cn1cc(N2CCC[C@@H](NC(=O)c3c(F)ccc(O)c3O)C2)cn1 790070562 DDNSZQPLMDXQEN-SNVBAGLBSA-N 334.351 1.369 10 10 EDCE COc1cc(O)c(CN[C@H](Cc2ccncc2)C(=O)O)cc1OC 1329973282 NIXLURQXJADBEW-CYBMUJFWSA-N 332.356 1.590 10 10 EDCE CO[C@@H](C)CN[C@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1267155005 BDPDUYVAQPVMBP-NEPJUHHUSA-N 335.408 1.982 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1C[C@@H](CO)[C@@H](CCO)C1 1346297752 ZGMJXFCHPLQECV-HOTGVXAUSA-N 335.448 1.193 10 10 EDCE COCCNC[C@@]1(C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1500406219 IRFBZAHYYLAHSX-QGZVFWFLSA-N 347.419 1.937 10 10 EDCE COc1cccc([S@@](=O)CC(=O)NCc2cccc(OC)c2O)c1 1294925940 VJJITHNHASVVMR-DEOSSOPVSA-N 349.408 1.833 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(N)ccn1 1299699054 MNXCVJLKZHREOK-UHFFFAOYSA-N 329.356 1.575 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2COCCN2CC(F)F)c1 1294937372 ODTBNAAZMQWXMX-ZWNOBZJWSA-N 344.358 1.544 10 10 EDCE COC(=O)[C@@H]1CC[C@H](C(=O)Nc2c(Cl)ccc3nonc23)O1 1459788766 NWNLBKIIFGXSSC-BDAKNGLRSA-N 325.708 1.535 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc(-n3[nH]c(O)nc3=O)cc2)c1 1470254792 KLOHMQPUKHFBSZ-UHFFFAOYSA-N 340.339 1.210 10 10 EDCE O=C(O)[C@]1(CO)CCCN1Cc1c(O)cccc1Br 2136360880 ZFDAHMDLFLRECF-CYBMUJFWSA-N 330.178 1.566 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H]2[C@H]3CCC[C@H]32)cc1C 1700788239 SFEADYGYBAJSBP-LISAXSMJSA-N 332.444 1.616 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)CN(C)C(C)=O)C2)cc1C 1713153720 AIOCNSNHQIKYGQ-WKILWMFISA-N 333.432 1.219 10 10 EDCE Cc1c(NC(=O)Cc2ccc(O)c(O)c2)nnn1Cc1ccncc1 1556753719 PZEBYFCHWUXJAU-UHFFFAOYSA-N 339.355 1.622 10 10 EDCE COc1cccc(CNC(=O)c2cnc3c(c2)NC(=O)CN3C)c1O 1631540244 QHNHAELSKAOWKK-UHFFFAOYSA-N 342.355 1.114 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H](C)CC(N)=O)CCC2)cc1C 1570113485 WLXLAIBBIYXOKM-CQSZACIVSA-N 347.459 1.644 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H](C)NC(C)=O)cc1C 1699227896 QZFNLVBHQOWQFW-VBROQKIQSA-N 333.432 1.290 10 10 EDCE COC(=O)C1=C(C)NC(=O)/C1=C/c1cc(OC)c(OC)c(OC)c1 6241484 WJFSGQWGAKNJPQ-IZZDOVSWSA-N 333.340 1.673 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 1985100894 KLRBOOTXIOJGEA-MNOVXSKESA-N 325.369 1.534 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)CCO1 1990349011 XSRMXWZMFSYTQT-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)NCCN=[N+]=[N-])O2)C1 1994655136 MDVKREBNNJYQDI-SNVBAGLBSA-N 325.369 1.581 10 10 EDCE CNCc1ccc(N2CCOC[C@H]2CN(C)C)c(Br)c1 2153246837 KAKIAGMDCHAIKW-CYBMUJFWSA-N 342.281 1.935 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@@H]1CCOC1 2010389093 LGFUUQOQZDWMOI-ZYHUDNBSSA-N 339.396 1.685 10 10 EDCE C[C@H](NCC1(C(N)=O)CN(C(=O)OC(C)(C)C)C1)c1ccccc1O 2041265041 HTGXXQPUALNTSY-LBPRGKRZSA-N 349.431 1.765 10 10 EDCE CCNCc1ccc(N2CCC(O)(CO)CC2)cc1Br 314240986 UUVSRPRRPVRUQF-UHFFFAOYSA-N 343.265 1.882 10 10 EDCE C[C@@H](O)c1ccc(N2CC(NS(C)(=O)=O)C2)cc1Br 703009093 YNWOOHTUWSTSEO-MRVPVSSYSA-N 349.250 1.240 10 10 EDCE C[C@H](O)c1ccc(N(C)CC(C)(CO)CO)c(Br)c1 689299315 WJMJVYLDYHTCNU-JTQLQIEISA-N 332.238 1.930 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@@H](CO)C2)cc1Br 396816662 UERQJWLPKASNPL-RBZYPMLTSA-N 329.238 1.648 10 10 EDCE CNCc1ccc(N2CC[C@@H](O)[C@H](CO)C2)cc1Br 396821049 KEUWTKOIZALAJA-SMDDNHRTSA-N 329.238 1.348 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC4(CCOCC4)C[C@H]3C)c2n1 2063790123 BKFOPKCDSYFHQP-GFCCVEGCSA-N 330.388 1.775 10 10 EDCE CS(=O)(=O)[C@@H]1CSCCN1c1cc(Cl)c(CN)cc1F 2177381494 NWOXTKYGNGFZBM-GFCCVEGCSA-N 338.857 1.862 10 10 EDCE C[C@@H](N=c1nc(CNC(=O)OC(C)(C)C)[nH][nH]1)c1cc(O)ccc1O 2063196783 XYWYDBRPTJUHAZ-SECBINFHSA-N 349.391 1.836 10 10 EDCE COC(=O)CN(C(=O)C=Cc1ccc(N2CCOCC2)cc1)C(C)C 2297505234 BZJINVCCUMJZCU-UHFFFAOYSA-N 346.427 1.946 10 10 EDCE CNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1CCCN=[N+]=[N-] 2303498425 INKTZVXJYNVTJI-GFCCVEGCSA-N 340.428 1.744 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2329332181 JJRCKHCJHBKQSZ-NZPIUUIZSA-N 327.222 1.099 10 10 EDCE CN(C[C@H]1CCO1)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2341208018 BPCFBVSVTKDBKN-JMCQJSRRSA-N 327.178 1.660 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1C[C@@H]2C[C@H]1[C@H](O)[C@@H]2O 2355461063 DJPSSSOQCIFMJE-OSAYJDNMSA-N 342.233 1.622 10 10 EDCE O=C1NC(=O)C(=C/C=C\c2coc3ccc(F)cc3c2=O)C(=O)N1 102578976 GNAKXAHMUAXHBV-UPHRSURJSA-N 328.255 1.238 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCO[C@H](c3nc(C)n[nH]3)C2)c1O 175742987 KUOFGHFZVPMVRM-AWEZNQCLSA-N 334.351 1.734 10 10 EDCE CC(=O)NCCNC(=O)C(=O)N(c1ccccc1)c1ccc(N)cc1 170388938 MTFRIBZTBZORKG-UHFFFAOYSA-N 340.383 1.186 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@@H]1CCCN(S(C)(=O)=O)C1 125291621 BJZSCPTXFPBGMQ-CYBMUJFWSA-N 326.418 1.022 10 10 EDCE CO[C@@H]1CN[C@@H](C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 187949871 COGWPBNCJJANRZ-ZWKOTPCHSA-N 331.460 1.916 10 10 EDCE CC[C@H]1CN(Cc2ccc(N3CCOCC3)cc2)CCN1C[C@@H](C)O 120714097 GHSMJZACNAKIOD-MJGOQNOKSA-N 347.503 1.800 10 10 EDCE COc1ccc(CN2CCC(C(=O)NCCN(C)C)CC2)c(O)c1 92615878 YUIUIWBYGQZHCB-UHFFFAOYSA-N 335.448 1.291 10 10 EDCE CN(C)c1ccc(CN2CCC[C@@H](CS(N)(=O)=O)C2)cc1F 271177826 LBVBVLKJNSKMMC-CYBMUJFWSA-N 329.441 1.392 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCCc1nnc2n1CCCC2 373689804 LGXGXUYLJBFOFQ-FNORWQNLSA-N 328.372 1.398 10 10 EDCE COC[C@@H](CNC(=O)NCc1cc(Br)ccc1O)OC 807092626 DVLWOVJQRTUJQE-LLVKDONJSA-N 347.209 1.615 10 10 EDCE Cc1ccc(CN2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)c(O)c1Br 2380805573 QZHIPWGCUSGWRM-OHTBPHCPSA-N 342.233 1.922 10 10 EDCE Cc1ccc(CN2CC[C@@H](O)C[C@@H]2C(=O)O)c(O)c1Br 2380812961 BGDMLDQZFUCOKR-GHMZBOCLSA-N 344.205 1.873 10 10 EDCE C[C@H]1[C@H](C)CN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 293553375 ZIIYVABBUKTFCM-KGLIPLIRSA-N 335.423 1.619 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)N3CC[C@@H](O)[C@@H](O)C3)c2C)c1 827628264 CWYDNANJABEWSZ-MSOLQXFVSA-N 328.412 1.970 10 10 EDCE COc1cccc(CNC(=O)Nc2cc(C)nnc2N(C)C)c1O 824535941 ZJGSELFXWMSHOR-UHFFFAOYSA-N 331.376 1.887 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CC[C@H](Cn3ccnn3)C2)c1O 826846469 VETGHOHOFABFFQ-NSHDSACASA-N 333.348 1.423 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1[C@H]2COC[C@H]21 828148834 BELSUKOKYDIFSO-PIIMJCKOSA-N 330.428 1.404 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)[C@H]2CCO[C@H](C)C2)c1 830623335 KSBMZXWJPFUCRX-MDZLAQPJSA-N 329.418 1.949 10 10 EDCE CC[C@H](NC[C@]1(OC)CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 903368284 MPQZFIYPJDGHSZ-DLBZAZTESA-N 340.489 1.997 10 10 EDCE COCCCn1nc(C(=O)N(C)Cc2ccccc2O)ccc1=O 830140387 BHLNUBRVQABXQO-UHFFFAOYSA-N 331.372 1.258 10 10 EDCE COCCO[C@H]1CCN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])C1 844214410 PXNYSHYBHKLECP-LQPUYASZSA-N 336.344 1.934 10 10 EDCE C[C@]1(Br)C[C@H]1C(=O)N(CC(=O)O)Cc1ccccc1O 911488736 NOGHAMUVHGEDRI-HZMBPMFUSA-N 342.189 1.979 10 10 EDCE Cn1nccc1[C@H]1COCCN1Cc1cc2c(cc1O)OC[C@H]2O 844754949 HVYFUGOUXMNGCD-GDBMZVCRSA-N 331.372 1.125 10 10 EDCE O=C(NCc1c(O)cccc1F)N[C@@H]1CCCN2CCSC[C@H]12 925169822 LILQISKUWKTDQW-ZIAGYGMSSA-N 339.436 1.910 10 10 EDCE COC[C@@H]1CC[C@H]([C@@H]2COCCN2C(=O)Nc2ccc(N)cc2)O1 926141483 DNNRUOLPUZFSEH-HRCADAONSA-N 335.404 1.696 10 10 EDCE COCCN(C[C@@H](C)CS(C)(=O)=O)c1ccc(OC)c(OC)c1 757838280 BAIZABGHUIFOPI-CYBMUJFWSA-N 345.461 1.837 10 10 EDCE COCC1(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCOCC1 855227515 XGBGLMVKMHSOCR-HNNXBMFYSA-N 348.443 1.833 10 10 EDCE COC(=O)c1cncc(NC(=O)NCc2cc(OC)ccc2O)c1 776476905 PGYKNPDTAIDILY-UHFFFAOYSA-N 331.328 1.904 10 10 EDCE C[C@@H](NC(=O)CN1C(=O)NC(C)(C)C1=O)c1ccc(N(C)C)cc1 773016165 RDUYDGJAZGPYSD-LLVKDONJSA-N 332.404 1.260 10 10 EDCE NS(=O)(=O)c1cc(Br)cc(Br)c1O 958530394 JOPCLRWKDGFANF-UHFFFAOYSA-N 330.985 1.565 10 10 EDCE CN1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788932099 LPSJYMRTEZYHPQ-INIZCTEOSA-N 344.459 1.113 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cnn(CC(F)(F)F)c1 787131636 RFSHTSOMNPPPMS-UHFFFAOYSA-N 329.278 1.829 10 10 EDCE CN(C)CC1(O)CCN(c2ccc(CN)cc2Br)CC1 710588981 PCNWERCFCDOFFP-UHFFFAOYSA-N 342.281 1.801 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@H]1Cc2cc(F)ccc2NC1=O 1303194680 JBDNGCSRLOFGRC-GFCCVEGCSA-N 330.315 1.664 10 10 EDCE Cc1csc2ncc(C(=O)NCc3cc(O)ccc3O)c(=O)n12 1303226131 XNHIPLGCRZYUSN-UHFFFAOYSA-N 331.353 1.406 10 10 EDCE C[C@@H](NCc1nnc(Br)n1C)c1cc(O)ccc1O 2121513305 IURXLWIYFRMLHN-SSDOTTSWSA-N 327.182 1.840 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CCN(C(=O)c2ccccc2)C1 1176755425 OYZNDTDBIQKPIA-CQSZACIVSA-N 340.379 1.876 10 10 EDCE O=C(O)C[C@H]1CN(Cc2c(O)cccc2Br)C[C@@H]1O 2117727177 GATWIGAFOBAZKA-UFBFGSQYSA-N 330.178 1.422 10 10 EDCE C[C@H]1C[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1321705451 CPCBGDBLQZISFU-GXTWGEPZSA-N 349.406 1.051 10 10 EDCE CC(C)NC1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1330488710 YKUGVOHVYQNJAA-UHFFFAOYSA-N 331.416 1.223 10 10 EDCE COC(=O)CC(C)(C)CNC(=O)C(=O)N(C)Cc1ccccc1O 1333210871 TWUHAWLZLRFWAG-UHFFFAOYSA-N 336.388 1.056 10 10 EDCE O=S1(=O)CCN(c2ccc(CNCc3cncnc3)cc2)CC1 1333847516 SPRHXRZEHVEVSO-UHFFFAOYSA-N 332.429 1.001 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)N1CC[C@H](N=[N+]=[N-])C1 1912169455 KSXMOSXPWMFMCI-LURJTMIESA-N 335.187 1.256 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cncnc3O)CC2)cc1C 1277088299 YBICAXRFTFGLLI-UHFFFAOYSA-N 342.399 1.551 10 10 EDCE CCOC(=O)[C@@]1(CNC(=O)/C=C/c2ccc(O)c(O)c2)CCCOC1 1454294938 HORCLRUHLUHWPL-SUQGKYDKSA-N 349.383 1.587 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cscn2)cc1C 1700934639 JLSFFKSIAGWCQV-CQSZACIVSA-N 349.456 1.683 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2CCCNC2=O)cc1C 1700752869 APXPZXCMIGCXJF-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cn([C@@H]2CC[C@H]2O)nn1 1630533182 WZQXEUJAYQQRHZ-ZIAGYGMSSA-N 339.355 1.158 10 10 EDCE O=C(CC1(C(=O)NCc2ccccc2O)CCCC1)N1CCOCC1 1630363471 QYRLQRUCOWMAAQ-UHFFFAOYSA-N 346.427 1.818 10 10 EDCE C[C@@]1(CC(=O)NCc2c(O)ccc3ccccc23)CCS(=O)(=O)N1 1639388199 XZFLAOKYTFGVGT-KRWDZBQOSA-N 348.424 1.634 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](NC(N)=O)C(C)C 1639340675 BIFMAHUZFMNBMG-CJNGLKHVSA-N 334.464 1.801 10 10 EDCE O=C(NCc1cccc(Cl)c1O)c1ccc(-n2cncn2)nc1 1640402311 PIGQYEIVPPXJTC-UHFFFAOYSA-N 329.747 1.951 10 10 EDCE COc1ccc(CNC[C@@H](C2CC2)N(C)C(=O)c2nc[nH]n2)cc1C 1734315523 QKSZHISMBJYVJY-HNNXBMFYSA-N 343.431 1.762 10 10 EDCE COCCN1C(=O)/C(=C\c2ccc(N3CCCC3)cc2)NC1=S 5795743 JNJWYNYRQUMNPS-NTCAYCPXSA-N 331.441 1.991 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(C(=O)Cc3ccc(N)cc3)C[C@@H]21 2000279510 HZOHNLLBBMZQPI-FOLVSLTJSA-N 331.416 1.793 10 10 EDCE CN1C(=O)[C@@H](O)c2ccc(N(CCC(N)=O)Cc3ccccc3)cc21 2034745161 AMNATLIMWJFCCJ-SFHVURJKSA-N 339.395 1.578 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)C[C@@H](O)C2)c(Br)c1 2161355300 UHMLBZZUXTWSRZ-BETUJISGSA-N 343.265 1.879 10 10 EDCE CC(C)n1cnnc1CC(=O)NCc1ccc2cccnc2c1O 2062037699 PMYUEAGWJYGIIP-UHFFFAOYSA-N 325.372 1.972 10 10 EDCE C[C@H]1CNC(=O)CN1c1ccc(C=CC(=O)O)cc1Br 2181180024 ZYSJWWLVCIMRNI-VIFPVBQESA-N 339.189 1.872 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)c(Br)c1 2182562655 WSPDHYHJRLKELL-ZKOAOSJTSA-N 342.233 1.680 10 10 EDCE CCn1nnnc1CN(C)c1ccc(CNC)c(Br)c1 2196299937 FLBNWOZKXPDALW-UHFFFAOYSA-N 339.241 1.811 10 10 EDCE N[C@@H]1CN(Cc2cc(Cl)cc(Br)c2O)[C@H]2COC[C@@H]12 2102138293 USOFSYFSAXYAHR-WCQGTBRESA-N 347.640 1.966 10 10 EDCE CC(C)(C)OC(=O)N1CCC(O)(C(=O)NCc2ccc(N)cc2)CC1 2076777177 BEQYEVPZQIYEQL-UHFFFAOYSA-N 349.431 1.647 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCOc1nnc(=N)[nH]n1)C1CCCC1 2213786735 BRZVPWWEBPCALA-LLVKDONJSA-N 338.412 1.532 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@@H]2CO)c(OC)c1Br 2226538479 NPCONWQAUCPDLS-BDAKNGLRSA-N 332.194 1.398 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](C(=O)N2CC(N=[N+]=[N-])C2)CO1 2246585110 LXKLRJLCZOVCNV-CMPLNLGQSA-N 339.396 1.827 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cc(CO)n(C)c2)s1 2284499756 PQQABRKIQBHAHZ-UHFFFAOYSA-N 333.460 1.174 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cnc(O)cc2C)s1 2284700776 WLWWDTQHPCZGGQ-UHFFFAOYSA-N 331.444 1.753 10 10 EDCE O=C(O)CN1C(=O)C(=Cc2cccc3nccnc23)SC1=S 2296509330 OQAUJSHMBYTJQC-UHFFFAOYSA-N 331.378 1.916 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2329329376 UEWXVWRUKHUVPS-UNVYILGJSA-N 328.206 1.433 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2COCCN2)c(O)c1Br 2352635914 JAGYIJTZWWZSFU-JTQLQIEISA-N 329.194 1.068 10 10 EDCE CNCc1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2357591992 CSOFFIANRGFREZ-KAOXEZKKSA-N 341.249 1.489 10 10 EDCE COC[C@@H]1CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CCO1 255005073 QROTTWCSIKVLMM-GINYUPMKSA-N 346.427 1.410 10 10 EDCE CCN1CCCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])CC1=O 276329518 RDCBSNRSDOZTAI-SOFGYWHQSA-N 347.371 1.840 10 10 EDCE Oc1cc2c(cc1CNC[C@@H]1CCC3(CCOCC3)[C@@H]1O)OCO2 282843849 OZDUOVJQHWXDRV-YVEFUNNKSA-N 335.400 1.778 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1cccc(I)c1 808526371 PUOKHGIDLXJWKD-UHFFFAOYSA-N 346.120 1.535 10 10 EDCE CCOc1ccncc1S(=O)(=O)NCc1cccc(OC)c1O 295692217 SQYXYQWPFMDXRH-UHFFFAOYSA-N 338.385 1.673 10 10 EDCE COC(=O)c1cncnc1N1CCN(c2ccc(OC)c(F)c2)CC1 804539222 CTRARLPCHLWUPB-UHFFFAOYSA-N 346.362 1.738 10 10 EDCE Cc1cc(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)ccc1N(C)C 830006817 ORZWPYVICNUEMS-KRWDZBQOSA-N 338.473 1.451 10 10 EDCE COC(=O)[C@H]1[C@H]2C=C[C@@H](CC2)[C@H]1C(=O)NCc1ccc(O)cc1O 910958381 RHLPDZBSQDVSDL-QMMBQJITSA-N 331.368 1.715 10 10 EDCE Cc1ccc(-n2cnnn2)cc1NC(=O)NCc1ccc(O)c(O)c1 749020935 BMTKNWGJGGAPHV-UHFFFAOYSA-N 340.343 1.704 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1C[C@H](O)CC2(CCOCC2)C1 922897655 BEMMXXUTKLIVLG-CTGSTSKSSA-N 333.384 1.501 10 10 EDCE C[C@@H](NC(=O)NCc1nnc(O)n1C1CC1)c1ccc(N(C)C)cc1 923868238 DLGJQBMTTGRCDD-LLVKDONJSA-N 344.419 1.945 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN1Cc1cc(C)cc(OC)c1O 754740512 UNLPQFAFYHFYLO-CYBMUJFWSA-N 328.434 1.223 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1cn(C[C@@H]2CCOC2)nn1 859421000 HEQHRCNZFBSZAX-AWEZNQCLSA-N 343.431 1.619 10 10 EDCE CO[C@@](C)(CNC(=O)OC(C)(C)C)[C@@H](N)Cc1ccc(O)c(O)c1 1952913266 XTQNXSWSQYLKSI-YOEHRIQHSA-N 340.420 1.897 10 10 EDCE C[C@@H](NC[C@@]12COCCN1C(=O)COC2)c1ccc(N(C)C)cc1 866555838 OONJFDGOMPXYKB-KDOFPFPSSA-N 333.432 1.031 10 10 EDCE CN1CCCc2cc(CN3C(=O)N[C@H](c4ccn(C)n4)C3=O)ccc21 761175210 AQWLQUQROWEUIJ-MRXNPFEDSA-N 339.399 1.596 10 10 EDCE CN1CCO[C@H](CNCc2cc(Br)cc(F)c2O)C1 715803206 GONVNVMLUQOLGA-LLVKDONJSA-N 333.201 1.714 10 10 EDCE CS(=O)(=O)C[C@H](C(=O)NCc1cc(O)ccc1O)c1ccccc1 1153884302 BIZAEOZQSQSGAO-HNNXBMFYSA-N 349.408 1.542 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccc(CN2CCOCC2)o1 1156885434 DPEYFLKTQVNUQU-UHFFFAOYSA-N 332.356 1.453 10 10 EDCE Nc1ccc(OCCNC(=O)c2nnc(Br)s2)cc1 2126296447 XOQDSVLUUDXVPD-UHFFFAOYSA-N 343.206 1.692 10 10 EDCE CN1C(=O)O[C@H]2CN(c3ccc(CO)c(Br)c3)C[C@@H]21 2120405492 ZFFHGXHWGHYGDB-RYUDHWBXSA-N 327.178 1.581 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 1333834135 GJKDOPWKSZYUKO-AWEZNQCLSA-N 345.443 1.323 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2ccnnc2)cc1C 1332574699 HDLFQOVKYHDNLA-MRXNPFEDSA-N 344.415 1.016 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CN(C)CCO2)cc1C 1268057235 LQKBVSVCNTXAAA-MAUKXSAKSA-N 349.475 1.271 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H](CNCCCO)C2)cc1 1265636626 MBRHCYLCDABLLI-ZDUSSCGKSA-N 347.419 1.673 10 10 EDCE Cc1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)ncc1C(N)=O 1434916054 YVMXIVBGGJOZOY-UHFFFAOYSA-N 330.363 1.624 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC2(CNCCO)CCCCC2)cc1 1282637078 XJHRNOUYTMDPTH-UHFFFAOYSA-N 347.419 1.864 10 10 EDCE COc1ccc(CNC(=O)C[C@@H]2NC(=O)c3ccccc32)c(O)c1 1448371524 JCCHXEBHISKMJI-HNNXBMFYSA-N 326.352 1.892 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H](C1CCOCC1)C1(CO)CCC1 1299978343 XQVGBSOGEQTNAA-GOSISDBHSA-N 349.427 1.714 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cc(C)[nH]n2)cc1C 1700933055 ROCNPUDWFZOWSA-OAHLLOKOSA-N 346.431 1.258 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cnc(C)[nH]2)cc1C 1486264008 BFCNWJLMRIMEQI-HNNXBMFYSA-N 346.431 1.258 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cc2c(cc1[N+](=O)[O-])OCCO2 1558534970 ZUHLCAIIUPARBR-UHFFFAOYSA-N 346.295 1.707 10 10 EDCE O=C(CSc1n[nH]c(O)n1)NCc1ccc2cccnc2c1O 1627073472 PBUXHQMXVWTTJC-UHFFFAOYSA-N 331.357 1.173 10 10 EDCE Nc1c(C(=O)NCc2c(O)cccc2O)cnn1-c1ccccn1 1639292757 PLTDCUSEKRTUNA-UHFFFAOYSA-N 325.328 1.191 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2CCC(=O)NC2)cc1C 1568877125 GPJYHFJLFGEZFU-MJSXRHKHSA-N 345.443 1.292 10 10 EDCE CCC[C@H](O)[C@@H](CO)NC(=O)c1cc2cc(O)c(O)cc2s1 1642392618 ORBRVWUSWMOJTN-ZJUUUORDSA-N 325.386 1.564 10 10 EDCE Cc1noc(CN(C)CCNC(=O)c2ccc(N=NC(N)=O)cc2)n1 1731796911 CYIGCBONSMYDGU-UHFFFAOYSA-N 345.363 1.402 10 10 EDCE CSCc1n[nH]c(CNC(=O)c2ccc(N=NC(N)=O)cc2)n1 1652087294 OYXPFNLVOQHEIO-UHFFFAOYSA-N 333.377 1.760 10 10 EDCE C[C@](O)(CO)[C@@H]1CCN(c2ccc(CO)c(Br)c2)C1 2138092578 YWWXSKBGNUCGKC-RISCZKNCSA-N 330.222 1.511 10 10 EDCE CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NCc2c(O)cccc2O)C1 1597574141 IKYCSPAIYICILG-STQMWFEESA-N 334.416 1.999 10 10 EDCE O=C(CCn1c2c(c3ccccc31)CCCC2)N[C@H]1CONC1=O 1850194296 UIGPDECHTYSONH-AWEZNQCLSA-N 327.384 1.456 10 10 EDCE CC(C)[C@@H](N)C(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1865916662 NMKUBTAKZPOBIE-CVEARBPZSA-N 329.448 1.675 10 10 EDCE CCOc1cccc(CNCCC(=O)NCc2cccnc2)c1O 1857859942 OLQLRJKNBTVZIK-UHFFFAOYSA-N 329.400 1.982 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@H](N)COCc2ccccc2)cc1 1946505410 YNNJKKRADNWIDG-SFHVURJKSA-N 327.428 1.913 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CC(=O)NCCCN=[N+]=[N-])CC1 1963699294 PDIXIXHVSIXBPB-UHFFFAOYSA-N 326.401 1.356 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3OCCO[C@@H]3C2)c1O 1964602028 DYASCCJHLMAOGU-BETUJISGSA-N 344.205 1.763 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1COC[C@H]1NC(=O)OC(C)(C)C 1985102034 AWIGCYJLCGIWCS-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010392132 XMSYJXZRUNUNID-RYUDHWBXSA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010392952 LTWNBSXRMXPRTJ-QJPTWQEYSA-N 339.396 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342.399 1.189 10 10 EDCE CN(C)c1ccc(CNC(=O)CSCCSCCO)cc1 783596587 RRXIFWSNVVESFT-UHFFFAOYSA-N 328.503 1.828 10 10 EDCE CCOC(=O)[C@@H]1C[C@@H](N=[N+]=[N-])[C@H](O)C[C@@H]1NC(=O)OC(C)(C)C 96007555 BKORQFRBLKLSCW-LMLFDSFASA-N 328.369 1.893 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN(CC(N)=O)CC2)c1 781894823 MSWHHNYWYZUNHF-UHFFFAOYSA-N 342.237 1.066 10 10 EDCE CN(C)c1ccc(CNC(=O)Cn2ccc3occc3c2=O)cc1 1307303168 QZIFJRNZCJEYRO-UHFFFAOYSA-N 325.368 1.977 10 10 EDCE CCOC(=O)c1ccc(NCCNC(=O)c2cc(O)cs2)nc1 1180813875 SHNSLASDPXXPGH-UHFFFAOYSA-N 335.385 1.867 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccccc2O)cc1C 1331685035 RGPHASDJKUAYTD-OAHLLOKOSA-N 344.411 1.590 10 10 EDCE CC(=O)C(=O)[C@]1(O)C[C@H]2CC[C@H]1C[C@@]2(C)NC(=O)OC(C)(C)C 1905174216 CSQVACWLDWHMGC-AWBCAMRRSA-N 325.405 1.979 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C[C@@H]2CCCO2)cc1C 1283733694 JJLJGAOMWBYSRV-CVEARBPZSA-N 336.432 1.139 10 10 EDCE O=C(O)[C@]1(CO)CCN(Cc2ccc(Br)cc2O)C1 2136396745 FYXZYEWQHAQKRA-CYBMUJFWSA-N 330.178 1.424 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cnnc(O)c2)cc1C 1567025309 JRUYGXKJDVYJOD-LBPRGKRZSA-N 330.388 1.407 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2ccnc3[nH]c(O)nc23)c1 1630366624 SJHXJRNENWVZAC-QMMMGPOBSA-N 328.328 1.869 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)Cc2cscn2)cc1C 1568582692 DJXSTRKUDNIELJ-HNNXBMFYSA-N 349.456 1.270 10 10 EDCE O=C(Cn1cc(Br)cn1)NCc1c(O)cccc1F 1646028370 HCSARQBCVHISBF-UHFFFAOYSA-N 328.141 1.807 10 10 EDCE COC(=O)c1cnc(CCNC(=O)Cc2ccc(O)c(O)c2)s1 1653082273 GLKKFOBICDQXMU-UHFFFAOYSA-N 336.369 1.242 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)Cc2cnn(C)c2C)cc1C 1669313244 RFQVPCHYFVRTDI-CQSZACIVSA-N 344.459 1.883 10 10 EDCE Cc1nnc(N2CCN(C)C(=O)C2)n1Cc1ccc(N(C)C)c(F)c1 1762607568 SSDWLGAXBFONGP-UHFFFAOYSA-N 346.410 1.118 10 10 EDCE CO[C@@H](C)C(=O)NC[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1688860326 WFTWYWDUONBVHC-QWRGUYRKSA-N 349.391 1.366 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)Cc3ncc[nH]3)C2)cc1C 1691821435 KLFWPUJNBXMYDS-WKILWMFISA-N 342.443 1.954 10 10 EDCE 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CC(C)(C)OC(=O)NC[C@H](O)CNC(=O)CCc1ccc(N)cc1 2011420798 ZZCANUWOYGDXSG-CQSZACIVSA-N 337.420 1.203 10 10 EDCE CN(C(=O)[C@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2022783962 FQWIRIWYQFWSCX-UONOGXRCSA-N 335.404 1.602 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@@H](O)[C@H](CO)C2)c(Br)c1 396790443 AEXZNCVNIGAEGZ-IFUGULHKSA-N 343.265 1.909 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCN(C)C[C@H]3CC(C)C)c2n1 2065223727 NVDSQLUANPKJAG-CYBMUJFWSA-N 331.420 1.546 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1908253233 ORSQHFXWZPUFRQ-GRYCIOLGSA-N 339.396 1.827 10 10 EDCE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CCN1C(=O)Cc1ccc(N)cc1 2044626473 IAFOGSREPLOJQL-ZWNOBZJWSA-N 343.349 1.869 10 10 EDCE O=C(NC[C@@H]1CCCN(C(=O)C(F)(F)F)C1)c1ccc(O)c(O)c1 2054399813 WJPHMDSJNPSFSX-VIFPVBQESA-N 346.305 1.629 10 10 EDCE COC[C@]1(O)CCN(c2cc(Br)c(CN)cc2F)C1 2095540350 JJXLAAHYJCGVDZ-ZDUSSCGKSA-N 333.201 1.635 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(NC(=O)Cc2ccc(N)cc2)C1 2216760551 XJDFCOMDRDBJQD-UGSOOPFHSA-N 331.416 1.937 10 10 EDCE NCc1ccc(N2C[C@@H](CO)C[C@H](CO)C2)c(F)c1Br 2236641807 FXGBAQSMKAYTJG-UWVGGRQHSA-N 347.228 1.474 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](N)[C@H](OC)C2)c1O 2227741990 YHCHTMOBOQYSRO-CMPLNLGQSA-N 331.210 1.321 10 10 EDCE O=C(O)CC[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc[nH]2)SC1=S 2293202076 MDPVHJGWDFPVIO-QMMMGPOBSA-N 340.382 1.534 10 10 EDCE COc1ccc(C=C2SC(=S)N(CCO)C2=O)c(OC)c1 2294874741 RZDKSBQMTZEQKW-UHFFFAOYSA-N 325.411 1.897 10 10 EDCE COc1ccc(Br)c(CN2CCOC3(CNC3)C2)c1O 2288475240 QXUGHKIFRVRJPX-UHFFFAOYSA-N 343.221 1.338 10 10 EDCE COC1(CN(C)Cc2ccc(C)c(Br)c2O)CNC1 2352951207 DGHASTDQAUNNIR-UHFFFAOYSA-N 329.238 1.883 10 10 EDCE NC(=O)c1cc(NC(=O)/C=C/c2ccc(N3CCOCC3)cc2)c[nH]1 176714383 RSNXWQZFDDZODZ-ZZXKWVIFSA-N 340.383 1.602 10 10 EDCE C[C@]1(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCCO1 121569204 OOYNZYWLLNNOQB-GOSISDBHSA-N 336.407 1.972 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@H](O)C(F)(F)F 121594146 KPFXELKDEFRANN-NSHDSACASA-N 341.713 1.944 10 10 EDCE 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EDCE CC[C@@H](C)C(=O)N(C)C[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1738792428 LOUNUJURQFKNFL-NEPJUHHUSA-N 337.420 1.722 10 10 EDCE O=C(CC[C@H]1NC(=O)NC1=O)NCc1c(O)ccc2ccccc12 1652705771 NQGKSLVAJZTJKL-CYBMUJFWSA-N 327.340 1.150 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@@H]2CC=CCC2)cc(OC)n1 1744620266 XIWMPCKNJJQIGA-QWHCGFSZSA-N 347.415 1.690 10 10 EDCE CC(=O)NCC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCCCC1 1865948864 WCNHGUUXQWQUKY-SFHVURJKSA-N 346.475 1.532 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1986368354 FLHQPYROJDYEOF-MNOVXSKESA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010392954 LTWNBSXRMXPRTJ-UTUOFQBUSA-N 339.396 1.658 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](C(=O)NCCN=[N+]=[N-])C1CCOCC1 2010389047 KRSLKLLQVPZYDG-GFCCVEGCSA-N 341.412 1.980 10 10 EDCE CN1CCc2cc(CNC[C@@H](CO)NC(=O)OC(C)(C)C)ccc21 2011516767 NJVGIRGVIFQREN-HNNXBMFYSA-N 335.448 1.654 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@@H](O)C(C)(C)C 2017669840 RFQUDDAVKMWWQZ-GHMZBOCLSA-N 341.412 1.808 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C(=O)NC(=O)[C@H]3C2)c(Br)c1 387451096 QQUVZTCLKZKVQV-UJNFCWOMSA-N 338.205 1.178 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC(C)(C)[C@@H](O)C(F)(F)F)c2n1 2065128205 TVPIBODCTGFJNE-LLVKDONJSA-N 332.282 1.175 10 10 EDCE Oc1c(F)cc(Br)cc1CNC1CN([C@@H]2CCOC2)C1 2169351241 BUWGJRCOPJGBCH-GFCCVEGCSA-N 345.212 1.857 10 10 EDCE CNCc1ccc(N2CCN3C(=O)OC[C@H]3C2)cc1Br 2170718012 TZTXZWIGTSBSDE-GFCCVEGCSA-N 340.221 1.809 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CC(=O)Nc2ccc(N)cc2)C1 1910945084 LFZVJIMXAUUWOK-BXUZGUMPSA-N 335.404 1.825 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@]1(CO)C(=O)NCc1ccc(N)cc1 2080666014 JHXYFTPKYSTYLF-SFHVURJKSA-N 349.431 1.647 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(COc2nnc(=N)[nH]n2)CCCC1(C)C 2213780494 GOSXEPRNDFPWBC-OAHLLOKOSA-N 338.412 1.532 10 10 EDCE CN(CCn1cnc(C(=O)N2CC(N=[N+]=[N-])C2)c1)C(=O)OC(C)(C)C 2218301337 LZGWFSUZZSILOX-UHFFFAOYSA-N 349.395 1.885 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3COC[C@]3(CO)C2)c(Br)c1 2234565796 ILQNWDVJPSZQPC-IFUGULHKSA-N 342.233 1.948 10 10 EDCE O=C(CCN1C(=O)C(=Cc2ccccc2)SC1=S)NCCO 2297297560 KASLOOWPEAMXLK-UHFFFAOYSA-N 336.438 1.386 10 10 EDCE Cc1cc(Br)cc(CN2C[C@@H]3[C@H](C2)CS3(=O)=O)c1O 2336548182 HDMLLKRRUMBHTO-ZYHUDNBSSA-N 346.246 1.692 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CNC(=O)C2)c(O)c1Br 2352635832 AZDPTZLVMHYAHD-SECBINFHSA-N 327.178 1.215 10 10 EDCE CC(=O)O[C@H]1[C@H](OC(C)=O)[C@H](N=[N+]=[N-])CO[C@]12COC(C)(C)O2 77271969 YWEMWEKIXSKBDT-DCQANWLSSA-N 329.309 1.038 10 10 EDCE in-vitro C[C@H]1C(=O)NCCCN1C(=O)/C=C/c1ccc(N2CCOCC2)cc1 188102682 LSGOPWIMPIWSIN-PXTSUWAFSA-N 343.427 1.273 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)[C@H]3CCO[C@H]3C)CC2)cc1 189940058 VEDOVQDPLDNMBP-BBRMVZONSA-N 340.445 1.324 10 10 EDCE COc1ccc(N2CCN(CC(=O)N(C)CC3CC3)CC2)cc1F 84866706 ZILPISOICOWUSW-UHFFFAOYSA-N 335.423 1.825 10 10 EDCE COCCN(CC(=O)N(C)C)Cc1ccc(N2CCOCC2)cc1 91774015 QDJPBLGCSIYNBC-UHFFFAOYSA-N 335.448 1.060 10 10 EDCE Cc1cc(C(=O)NCCN2CCNCC2)c(C)n1-c1ccccc1 237725815 RZVZLIAMOQUNAT-UHFFFAOYSA-N 326.444 1.729 10 10 EDCE COC[C@H](ON)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381130930 GUMDMFXBCDBQNG-JTQLQIEISA-N 347.209 1.327 10 10 EDCE CN(C)c1ccc(CN[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)cc1 808424550 LBDROMOMMLCDMY-OAHLLOKOSA-N 340.493 1.113 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(C(=O)c2cccc(O)c2)cc1 808538699 BXFVLICIFKTHLC-UHFFFAOYSA-N 326.304 1.938 10 10 EDCE CN(CC(=O)NCc1cc(Br)ccc1O)C(=O)C1CC1 804739409 FOIHJIAHECUTKH-UHFFFAOYSA-N 341.205 1.639 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1 808500529 PLKGDOAMYLGYDO-UHFFFAOYSA-N 338.259 1.295 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cccn(C)c1=O 819695978 GTNSZODDEGYSIR-UHFFFAOYSA-N 344.367 1.296 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NCc1cc3c(cc1O)OCO3)C2 818234669 PZGWOCYBKXTITL-DRZSPHRISA-N 334.372 1.830 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1CC1(CF)CCOCC1 819170114 VIUCPNYJLAGNKD-UHFFFAOYSA-N 336.363 1.923 10 10 EDCE CC[C@H]1C[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 817877805 DTPIBKFLRWALKS-RDJZCZTQSA-N 347.459 1.785 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCC2(CCN2)CC1 817995832 BBEBPPJCMRZIQQ-UHFFFAOYSA-N 344.459 1.066 10 10 EDCE C[C@]1(CO)CCCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 723042394 IXXJBKPUKNCMFJ-TZMCWYRMSA-N 341.205 1.786 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N1CCN(C(N)=O)CC1 722180967 LIIOEWFVGFBHGI-SECBINFHSA-N 328.210 1.912 10 10 EDCE CCNC(=O)N1CCN(c2ccc(CO)c(Br)c2)CC1 721630814 HSDBXJGFTDAXPL-UHFFFAOYSA-N 342.237 1.793 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)C[C@H](OC)C2CC2)c1 827195303 YPUJATFBDWUBCR-BONVTDFDSA-N 329.418 1.806 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)N[C@H](C)C(C)(C)OC)cc1 905130187 BVTYKCIVRXXZRZ-GFCCVEGCSA-N 338.404 1.516 10 10 EDCE CC(C)C(=O)N1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 588408185 CEAVSCGHCULAGP-ALCCZGGFSA-N 332.400 1.828 10 10 EDCE COCC[C@@H]1CCCCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)C1 846259671 SSJLXOYDPZYXCW-LBPRGKRZSA-N 348.403 1.772 10 10 EDCE COC(=O)CCN1CCC[C@H](OC(=O)c2cc(O)cs2)C1=O 849728914 ZRIBYEUOAYQHAL-JTQLQIEISA-N 327.358 1.165 10 10 EDCE O=C(N[C@@H]1C[C@@]1(C(=O)O)c1cc(O)nc(O)c1)OCc1ccccc1 1952931419 QKZQPNJPNGOEGK-SJKOYZFVSA-N 344.323 1.514 10 10 EDCE CC[C@H]1NC(=O)N(Cc2ccc(N3CCC(C(N)=O)CC3)cc2)C1=O 925131790 DJUYKKCJRCPFTD-OAHLLOKOSA-N 344.415 1.219 10 10 EDCE C[C@]12CCN(Cc3cc(O)n4ncc(C(=O)O)c4n3)C[C@@H]1C2(F)F 851708301 CUXYIWOHAKZXTM-HZMBPMFUSA-N 338.314 1.610 10 10 EDCE CCN(CCC(N)=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 923336842 MBPIXTMFSKEEJN-UHFFFAOYSA-N 348.447 1.055 10 10 EDCE CCOC(=O)[C@@]1(F)CN(C(=O)c2cccc(O)c2O)CC12CCC2 855240234 ADTICUFMNBBMLK-KRWDZBQOSA-N 337.347 1.995 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)c2nnn(C(C)(C)C)n2)cc1 855020675 UYLLVHSPXRISPD-UHFFFAOYSA-N 346.435 1.645 10 10 EDCE CCN(C)C(=O)[C@@H](C)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852273929 AGCVLEMLPREPAI-KGLIPLIRSA-N 348.447 1.440 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCNC12CCC2 861792362 SVYGYFKWEIHLMX-MRXNPFEDSA-N 344.459 1.112 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)cc1Br 2116694058 IXPJZKOPCGBOAU-HKSFMPNISA-N 327.222 1.228 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)Cc2cnc(C)o2)cc1C 1320236157 VHEHOEFFXTYCMP-HNNXBMFYSA-N 347.415 1.109 10 10 EDCE CCS(=O)(=O)[C@H]1CCN(c2ccc(CN)cc2Br)C1 2123307223 YIOHMCYHYBRYGM-NSHDSACASA-N 347.278 1.921 10 10 EDCE Cc1cc(CNC(=O)C(=O)N2CC(CO)C2)c(C)n1-c1ccccc1 1328804443 WFDSHTZURTZJHE-UHFFFAOYSA-N 341.411 1.161 10 10 EDCE CN1CCN(c2ccc(CN3CCNC[C@@H]3C(F)F)cc2F)CC1 1345955332 FKWQFIGYVOBWMQ-MRXNPFEDSA-N 342.409 1.616 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1ccc(S(N)(=O)=O)cc1F 1445648871 WGAONRUWZPVOON-UHFFFAOYSA-N 338.360 1.451 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cccnc1OCCO 1540440876 XBSOFWQGIRXXKR-UHFFFAOYSA-N 329.400 1.791 10 10 EDCE Cc1cc(C(=O)N[C@H](C)c2ccccc2O)nc2nc(O)nc(O)c12 1471196299 XQIIDWNZLUQDDC-SECBINFHSA-N 340.339 1.941 10 10 EDCE CO[C@@H]1C[C@H](C(=O)O)N(Cc2c(O)cccc2Br)C1 2136353075 OIIJXTKDLHQKSU-LDYMZIIASA-N 330.178 1.829 10 10 EDCE COC(=O)c1cc(NC(=O)Cc2ccc(O)c(O)c2)c(O)c(OC)c1 1472229584 GWOUJKBMPYFWQQ-UHFFFAOYSA-N 347.323 1.780 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(c2cnn(C)c2)=NO1 1624955094 RLAVZYSGRIRQBJ-MGPLVRAMSA-N 344.371 1.072 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccc(F)nc2)cc1C 1485982273 KBAPVNBXARABAS-HNNXBMFYSA-N 347.390 1.418 10 10 EDCE C[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CCS1(=O)=O 1556184412 RBGNWAQZDCAZEQ-JTQLQIEISA-N 338.389 1.498 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(c2ccccn2)=NO1 1556157743 IWWHCNOVUYNOHL-PIGZYNQJSA-N 341.367 1.733 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccnc2c1CC(=O)N2 1568737994 WHKIPNCTWNVRDN-UHFFFAOYSA-N 332.356 1.698 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cc(C)ncn2)cc1C 1567483953 IJGFHIAGOVVQJI-UHFFFAOYSA-N 328.416 1.964 10 10 EDCE Cn1ncc(CCCNC(=O)c2cc3cc(O)c(O)cc3s2)n1 1637778436 YYZYBVMYTNEYJL-UHFFFAOYSA-N 332.385 1.804 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)C2=C[S@@](=O)CCC2)N(C)C)cc1 1640231780 BRMSJAPWAOTRTC-OSPHWJPCSA-N 349.500 1.898 10 10 EDCE CC(C)CNC(=O)N1CCC[C@@H](C(=O)NCc2ccc(O)cc2O)C1 1570462398 RQGFJNYDAWSNRH-CQSZACIVSA-N 349.431 1.792 10 10 EDCE CCN(c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-])[C@H]1CCNC1=O 1773050563 WLXVWYYYKBLMEB-IYNGYCSASA-N 333.344 1.496 10 10 EDCE CO[C@@H]1COC[C@H]1NC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1683596167 FYLOFIDWXGEHBX-IAGOWNOFSA-N 333.432 1.842 10 10 EDCE O=C1CN(c2ccc(CNC3CC3)c(Br)c2)CC(=O)N1 232452975 BJHSPPDYBPNMQB-UHFFFAOYSA-N 338.205 1.164 10 10 EDCE Nc1ccc(NC(=O)[C@H]2COCC(=O)N2Cc2ccccc2)cc1 160387786 UOBHAPWNCDZPQV-MRXNPFEDSA-N 325.368 1.635 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H]3CCC(=O)NC3=O)c2C)c1 153268977 OEPVPDWOJKOZRM-MRXNPFEDSA-N 339.395 1.938 10 10 EDCE NC(=O)CCN(Cc1ccccc1)c1ccc2c(c1)NC(=O)[C@H]2O 1946834216 MLZMFGLOQJEZQE-KRWDZBQOSA-N 325.368 1.554 10 10 EDCE CN1[C@@H](CNCc2cc(Br)ccc2O)CCS1(=O)=O 1967749132 UHUSDOWHUVPIBB-LLVKDONJSA-N 349.250 1.278 10 10 EDCE CN(C)c1ccc([C@@H](O)[C@H](N)c2cc(Br)nn2C)cc1 2148508654 IBKAWYGLBUTSDK-ZIAGYGMSSA-N 339.237 1.982 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC4(CC(O)C4)C3)c(Br)cc21 2146334884 RHQWAJDJKGYIPP-GFCCVEGCSA-N 338.205 1.362 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@H]2[C@H](O)CO)cc1Br 2146330646 ZNSWPFXGXQAXPV-BIGNPOOSSA-N 345.237 1.027 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985102530 IEHNHYAWPMRTHO-HBNTYKKESA-N 327.385 1.562 10 10 EDCE C[C@H](CNC(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 1988131987 YNRYXNDOPSGIDP-MRVPVSSYSA-N 326.349 1.446 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)[C@H](CO)C2)cc1Br 316620526 XMSQLCRCFLXXBY-SWLSCSKDSA-N 343.265 1.737 10 10 EDCE Cc1cnn([C@H]2CCN(C(=O)c3cnn4c(O)cc(C)nc34)C2)c1 2062576731 RJBZJMMHNSBUQF-LBPRGKRZSA-N 326.360 1.335 10 10 EDCE NCc1ccc(N2C[C@H](O)[C@H](O)CC23CCC3)cc1Br 2169893402 CMELYWANJBTPMQ-KGLIPLIRSA-N 341.249 1.762 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N3C[C@H](O)[C@@H]3C)c(Br)cc21 2182523003 JMUPSLVPABZBNA-PAWXDDDFSA-N 340.221 1.621 10 10 EDCE CCn1nnc(CN(C)c2ccc(CN)c(Br)c2F)n1 2197848071 VIAFZQIKDAILEV-UHFFFAOYSA-N 343.204 1.690 10 10 EDCE CC[C@@H](O)CN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2106620250 IBSKDLYJBCLDIM-JMCQJSRRSA-N 328.210 1.608 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)[C@H]1C[C@@H](O)C1 2224218024 KDJGBEPLZJXOND-KJNMHVQDSA-N 326.194 1.361 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OCC[C@@]2(C(=O)NCCN=[N+]=[N-])C1 2246329572 AASFTGCTWVIRHR-IINYFYTJSA-N 325.369 1.439 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2sc(=N)[nH]c2C)s1 2269089148 ZTPJHDREITZWAN-UHFFFAOYSA-N 336.489 1.521 10 10 EDCE Cc1ccc(CNCCCS(N)(=O)=O)c(O)c1Br 2327623261 FTCKBVGJFFLIRV-UHFFFAOYSA-N 337.239 1.231 10 10 EDCE Cc1ccc(CN[C@@H]2CO[C@H]3COC[C@@H]23)c(O)c1Br 2352670501 JFJCETUDRSAWDD-TUAOUCFPSA-N 328.206 1.967 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2355463329 DJPSSSOQCIFMJE-OEHKJAOLSA-N 342.233 1.622 10 10 EDCE CC(C)C(=O)N1CCN(C(=O)NCc2ccc(N(C)C)cc2)CC1 53984886 FLKUKKPPLIDNGC-UHFFFAOYSA-N 332.448 1.762 10 10 EDCE Cn1c(=O)c(C2=NNC(=O)/C2=C/c2ccccn2)c(O)c2ccccc21 100261011 ZXUJNHKQHBDACB-JLHYYAGUSA-N 346.346 1.557 10 10 EDCE NC(=O)c1cncc(NCc2ccc(N3CCSCC3)cc2)n1 301445305 PLLHJJSGJZHXSP-UHFFFAOYSA-N 329.429 1.741 10 10 EDCE CCCCN1C(=O)N=C(O)/C(=C/NNCCN(CC)CC)C1=O 38166107 OSRINXXLJALAMX-QXMHVHEDSA-N 325.413 1.025 10 10 EDCE CC(=O)N1CC[C@@H](CN(C)Cc2ccc(N3CCOCC3)cc2)C1 92100851 OZSKUFZMBRYOBL-SFHVURJKSA-N 331.460 1.823 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1C[C@H]2CC[C@H]1O2 247700388 UOBHIFFIGWRLKC-KZNAEPCWSA-N 345.443 1.985 10 10 EDCE Cc1ccc(CN(C)C(=O)N(O)CC(=O)O)c(O)c1Br 2380766295 REGJDICNXRGBKG-UHFFFAOYSA-N 347.165 1.791 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](CC(C)C)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O 808484355 BOVUEFHCPDACGM-MCIONIFRSA-N 349.383 1.054 10 10 EDCE O=C1N[C@@H](CF)C(=O)N1Cc1ccc(N2CCOCC2)c(F)c1 806672262 WJRBLBSWZOMARY-LBPRGKRZSA-N 325.315 1.052 10 10 EDCE O=C(Cc1ccc(O)nc1)NCc1ccc(N2CCOCC2)c(F)c1 822688784 USCODPWEXBIIDD-UHFFFAOYSA-N 345.374 1.622 10 10 EDCE Cc1cc(CN2CCN([C@@H]3CCNC(=O)CC3)CC2)ccc1N(C)C 832368816 FTZBMMAQCAZOBY-SFHVURJKSA-N 344.503 1.847 10 10 EDCE CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)n1 832285126 OHQXEVNIZBWGFE-CYBMUJFWSA-N 346.391 1.307 10 10 EDCE Cc1ccc(=O)n([C@H]2COC[C@@H]2NCc2ccc3c(c2)CCO3)n1 585626443 PQJDLWDQDDNMNN-HOTGVXAUSA-N 327.384 1.216 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3CO[C@H](C)[C@@H]3C)CC2)cc1 924832177 PRBAVQIBMOFJMP-FRQCXROJSA-N 333.476 1.830 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@H]3C[C@@H](N)C34CCC4)cc2)C1 925484225 CSQUFGDPRMLPBR-NXHRZFHOSA-N 342.487 1.748 10 10 EDCE CCON(CC)C(=O)CNC(=O)NCc1c(O)ccc2c1CCCC2 858712671 JZWXZCDRZCXCAQ-UHFFFAOYSA-N 349.431 1.870 10 10 EDCE CCN1C[C@@H](C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 855230498 DPNDFXOCYWHSTF-UONOGXRCSA-N 331.416 1.259 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCNC3=O)c2C)cc1 855146996 YLHPOLBKFSEQMK-INIZCTEOSA-N 327.384 1.721 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](C)C[C@@H](O)C3)C2)cc1 854297430 NLVHDVIGRGWXGH-OFQRWUPVSA-N 333.432 1.686 10 10 EDCE CC(C)(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1cnc[nH]1 856213452 MUNBBUYIRNECNL-UHFFFAOYSA-N 342.443 1.965 10 10 EDCE C[C@H](NC1CN(S(=O)(=O)N(C)C)C1)c1cc(Cl)ccc1O 858570177 UOFDHUSKGTWTJS-VIFPVBQESA-N 333.841 1.187 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1C[C@H]2[C@H]3CC[C@@H](CN3)[C@H]2C1 863653018 XYHUCTXNILCZOS-MTFMMBMASA-N 327.472 1.953 10 10 EDCE C[C@@H](NC(=O)Cc1ccc(C(N)=O)nc1)c1ccc(N(C)C)cc1 860949906 DWLMVRZAVXQAOB-GFCCVEGCSA-N 326.400 1.666 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@@H](O)Cc2cnn(C)c2)cc1 786708436 OXCISIDJIBHBMY-SFHVURJKSA-N 344.459 1.828 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cscn2)cc1 788951168 IQIBIOKSZMZUHD-UHFFFAOYSA-N 346.456 1.922 10 10 EDCE CN(Cc1nc(Br)nn1C)c1ccc2c(c1)OCO2 894429275 BILPZEDMVPQJSD-UHFFFAOYSA-N 325.166 1.943 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1[nH]c(C)nc1C 1138055128 OAJWTCGHPQNJQK-LBPRGKRZSA-N 347.371 1.342 10 10 EDCE C[C@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)N1CCN(C)CC1 896427870 MKEJYGMGQBZJJC-LLVKDONJSA-N 349.456 1.678 10 10 EDCE Cc1ccnc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 791526672 LRGSBZXDWAVYTC-UHFFFAOYSA-N 330.363 1.691 10 10 EDCE Cc1cc(C(=O)N[C@H](CO)c2cncn2C)c(C)n1-c1ccccn1 898884676 RYKRZRGCVIUWQE-OAHLLOKOSA-N 339.399 1.686 10 10 EDCE Cc1ccc(O)c(CNS(=O)(=O)c2c(C)nn(C)c2Cl)c1 1348156473 GMFXSAMXIJTMBE-UHFFFAOYSA-N 329.809 1.874 10 10 EDCE O=C(Nc1cn[nH]c1)[C@H]1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 1449968746 HMXMWISCAVSGOX-QQHVMHFCSA-N 342.355 1.321 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)CCc2nc[nH]n2)cc1C 1282112699 MVQBPTFFGACIDM-KGLIPLIRSA-N 345.447 1.737 10 10 EDCE CCN[C@@H](C)c1ccc(N2CC(O)(C(N)=O)C2)c(Br)c1 1915248675 KGPYTPWGYFZHJK-VIFPVBQESA-N 342.237 1.156 10 10 EDCE COc1ccc(CNC(=O)CONC(=O)OC(C)(C)C)c(O)c1 1626079856 NHDKFFQLFOVIBF-UHFFFAOYSA-N 326.349 1.473 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2ccncn2)cc1C 1716356633 WJXVLTCJZTVRST-ONEGZZNKSA-N 326.400 1.869 10 10 EDCE O=C(Cn1nc2ccccn2c1=O)NCc1ccc2cccnc2c1O 1630526065 CNECNVWLJVMFRG-UHFFFAOYSA-N 349.350 1.066 10 10 EDCE O=C(Cn1cc(C(F)(F)F)ccc1=O)NCc1cccc(O)c1O 1633508790 RINXRGUARICRQJ-UHFFFAOYSA-N 342.273 1.595 10 10 EDCE CC[C@H](CNC(=O)C(C)(F)F)NC(=O)c1cc(OC)nc(OC)c1 1738099427 CFSYEGRPRNKPMI-SNVBAGLBSA-N 345.346 1.379 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@H]2CCCC(=O)N2C)cc1C 1690642655 ACSHXPFWLWQIFL-GDBMZVCRSA-N 347.459 1.609 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)Cc2n[nH]c(C)n2)cc1C 1699101171 UTZJSOCJKBQHPA-CYBMUJFWSA-N 345.447 1.657 10 10 EDCE CS(=O)(=O)Cc1cccc(C(=O)NCCc2ccc(N)cc2)c1 152493527 ULGQDYYMEBWJGV-UHFFFAOYSA-N 332.425 1.786 10 10 EDCE CN1CCO[C@@H](CNC(=O)NCCCSc2nccs2)C1 153284295 ZIESLOZHKNGRQJ-NSHDSACASA-N 330.479 1.255 10 10 EDCE NCC1CCC(NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 1119698598 BTKJEYJDMYQHGJ-UHFFFAOYSA-N 344.503 1.995 10 10 EDCE CN(C)c1ccc(CNC(=O)c2nn(C)nc2Br)cc1 1964843311 VWRMANFMRQLTCL-UHFFFAOYSA-N 338.209 1.574 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)CO1 1985094891 VPHCGZAYQFLDIA-GXSJLCMTSA-N 325.369 1.437 10 10 EDCE Nc1ccc(CS(=O)(=O)NCCNOCc2ccccc2)cc1 1989365293 OYYATPOTRNZXFU-UHFFFAOYSA-N 335.429 1.410 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1990024745 UWFUHWHPCTXYGR-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1[C@H]2OCCN(C(=O)OC(C)(C)C)[C@H]12 2010391965 CJHIBHUNIGAZIJ-QJPTWQEYSA-N 339.396 1.780 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010406783 YYDFXDYANVZDQY-NXEZZACHSA-N 340.384 1.056 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)NCCCN=[N+]=[N-])OCC12CC2 2012212889 VBCNIVPBEDVZFK-NSHDSACASA-N 339.396 1.972 10 10 EDCE CN(C(=O)OC(C)(C)C)C1CN(C(=O)c2cc(O)c(O)c(O)c2)C1 2015124639 DSSHTFHTNCDTPG-UHFFFAOYSA-N 338.360 1.495 10 10 EDCE Oc1cc(F)ccc1CN=c1[nH]ccnc1I 2024889018 YOEWYSLEMMNLQJ-UHFFFAOYSA-N 345.115 1.960 10 10 EDCE O=C(O)C[C@@H](COCc1ccccc1)NC(=O)c1cccc(O)c1O 2035482086 UHTZMRNAINKJDG-ZDUSSCGKSA-N 345.351 1.888 10 10 EDCE C[C@@H]1CN(c2ccc(CN)c(Br)c2)CCS1(=O)=O 706923469 RYCIPXLOEPOVOJ-SECBINFHSA-N 333.251 1.531 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H]3C[C@@H]4O)c(Br)cc21 2172091728 GLEUEKWBELRFIF-NFECNHKBSA-N 338.205 1.361 10 10 EDCE Nc1ccc(N2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)c(Br)c1 380907353 OMAIVJDKEOGUBP-DDHJBXDOSA-N 337.173 1.698 10 10 EDCE C[C@@H]1C[C@@H]2CN(c3ccc(CN)c(Br)c3)CCN2C1=O 2181290295 UNGHWFCIRRLOBD-ZWNOBZJWSA-N 338.249 1.965 10 10 EDCE O=C1NC[C@H]2CN(c3ccc(CO)c(Br)c3)CC[C@@H]12 2100940830 NFWKWRFGRJPURU-CMPLNLGQSA-N 325.206 1.514 10 10 EDCE O=C1Nc2cc(N3C[C@@H](O)C[C@H](F)C3)c(Br)cc2[C@H]1O 2234673715 VCWCNUUFELRVTG-DJOAAKCGSA-N 345.168 1.344 10 10 EDCE C[C@]1(C(=O)O)CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2311974157 YHQBLHNVUWKBDC-IBGZPJMESA-N 344.411 1.860 10 10 EDCE CO[C@H]1CN(c2ccc(CN)cc2Br)[C@@H]2COC[C@@H]21 2329182341 FDRRRGJLBXDYCB-GDLCADMTSA-N 327.222 1.758 10 10 EDCE CC(=O)N[C@@H]1CCCN(C(=O)NCc2ccc3c(c2)CCCN3C)C1 57661519 KYASFOWZZIMHJN-QGZVFWFLSA-N 344.459 1.879 10 10 EDCE CCOc1ccc(O)c(CN2CCN(CC(=O)N3CCCC3)CC2)c1 119651072 CACJEUAAIQFKSW-UHFFFAOYSA-N 347.459 1.531 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)CN1C(=O)[C@H]2CC[C@H]1C2 176876253 SOJWCRGBHNZOER-WMZOPIPTSA-N 329.444 1.923 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C[C@@H](N)C(=O)O 1951536935 UOXZSXPDHZARCU-GHMZBOCLSA-N 340.376 1.336 10 10 EDCE CCN(c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-])[C@H]1CCNC1=O 281735036 WLXVWYYYKBLMEB-VGVVRCBHSA-N 333.344 1.496 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1CC(NC)(C(N)=O)C1 2165755071 BZQNQIQAKIXODH-LLVKDONJSA-N 342.237 1.365 10 10 EDCE COCCN1CC[C@H](NC[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 818220622 HQZMNAQWPCEADP-IRXDYDNUSA-N 333.476 1.832 10 10 EDCE COCC[C@@H](COC)NC(=O)NCc1ccc2c(c1)CCCN2C 811958579 UYBMKRXEXKBISA-INIZCTEOSA-N 335.448 1.920 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CN(C)C(=O)[C@@H]1C 826979249 KKSXVMHUDUYFGM-KBPBESRZSA-N 332.448 1.822 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@H](C2CC2)C1 839270921 HBYANSBBGLZDPN-KRWDZBQOSA-N 346.427 1.768 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@H]1CCNC[C@@H]1C)c1ccc(N(C)C)cc1 842201780 BZKYJOXPRKIRJU-XEZPLFJOSA-N 332.448 1.044 10 10 EDCE CCON(C)C(=O)CNC(=O)NCc1ccc(N2CCCC2)cc1 844888563 VCXXUPJPQOTDID-UHFFFAOYSA-N 334.420 1.496 10 10 EDCE COc1ccc(CN2CC[C@H]2C(=O)NCc2ccc(O)cc2O)cc1 910944869 XWGDXEPGNQCRRT-KRWDZBQOSA-N 342.395 1.997 10 10 EDCE COC(=O)[C@H]1CN(C)CCN(C/C=C\c2ccc(N(C)C)cc2)C1 840958659 QZJQBFMDZDLWGJ-OSJSJHBBSA-N 331.460 1.802 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)c2ccc([N+](=O)[O-])s2)c1 751415222 NEPRPSCRPSDDRM-UHFFFAOYSA-N 344.370 1.849 10 10 EDCE CN(C)c1ccc(CNC(=O)CN[C@]23C[C@H]2COC32CCC2)cc1 933390196 GYAGELAUJBQXNT-HNAYVOBHSA-N 329.444 1.670 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(N)cc3O)C2)cc1 852843538 AMMRSKMXQUAERJ-CYBMUJFWSA-N 327.384 1.992 10 10 EDCE C[C@H]1C(=O)N(CCN(C)C)CN1Cc1cc(F)c(N(C)C)cc1F 862400045 LCCAZUKENKYYHF-LBPRGKRZSA-N 340.418 1.583 10 10 EDCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2cc(C)cnc2N)c1 766816973 IHDICCKOBCQWNC-SNVBAGLBSA-N 337.401 1.726 10 10 EDCE CCOC(=O)[C@H](Cc1ccccn1)NC(=O)c1cccc(O)c1O 760629838 WPBZTQYGWFTZPU-ZDUSSCGKSA-N 330.340 1.397 10 10 EDCE C[C@@H](NCCn1nc2ccccn2c1=O)c1ccc(N(C)C)cc1 765399121 AVUGHFZAHLVXRZ-CQSZACIVSA-N 325.416 1.913 10 10 EDCE Cc1cn2nnc(C(=O)NCc3ccc(N(C)C)c(F)c3)c2c(O)n1 1136454185 ODDFWCXZTUMJBB-UHFFFAOYSA-N 344.350 1.273 10 10 EDCE C[C@@H]1OCCN(Cc2c(O)cccc2Br)[C@H]1C(=O)O 706647158 DDYAEZWPFVCMAR-QPUJVOFHSA-N 330.178 1.829 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)[C@H]1CCC[C@H]1O 708603209 YEIWPZUYMJUHNN-UHTWSYAYSA-N 341.205 1.784 10 10 EDCE Cn1ncc(Br)c1CNC(=O)c1cccc(O)c1O 710501772 IOKIKTVMIAINCB-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE COC(=O)[C@@H]1[C@H]2CN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)C[C@H]21 794950985 FFYSXHSMGNIADM-VQFNDLOPSA-N 345.443 1.062 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(C)[C@H](CO)C2)cc1Br 687588634 JIJCCYIVTFJFMP-PWSUYJOCSA-N 329.238 1.615 10 10 EDCE Cc1ccc(C(=O)Nc2ccccc2-c2nnnn2C)c(O)c1O 1304531858 WKKQHRXOGZVBJB-UHFFFAOYSA-N 325.328 1.849 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@H](O)[C@@H]3C)c(Br)cc21 2126120036 QDDZFTNNQKFSCS-QNRPFLCFSA-N 326.194 1.231 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2occc2C)cc1C 1320204734 ZAXQSFFYSJFREX-HNNXBMFYSA-N 332.400 1.786 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@@H](O)C2(C)C)cc1Br 2124803259 UQYPIBXBGAZKHV-BZHVJNSISA-N 330.222 1.823 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC3CC(C)C3)C2)cc1 1261700799 QEUJGRHWVARKBL-ROKHWSDSSA-N 331.416 1.305 10 10 EDCE C[C@H](CNCC1CCOCC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1275045417 HGESAEWPGVBAJO-GFCCVEGCSA-N 347.419 1.984 10 10 EDCE CNCc1ccc(N2CC[C@H](O)C[C@@H]2CO)cc1Br 2136084171 YRLCCAVJZRIPCW-OLZOCXBDSA-N 329.238 1.491 10 10 EDCE C[C@@H](NCc1cc(Br)ccc1O)C(=O)N1CCOCC1 225814063 HCPYTDARVMZVRX-SNVBAGLBSA-N 343.221 1.492 10 10 EDCE O=C(O)[C@@]1(CO)CCN(Cc2c(O)cccc2Br)C1 2136386290 HWFBDTZYLYMBDZ-ZDUSSCGKSA-N 330.178 1.424 10 10 EDCE C[C@@H](NCCCO)[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1716975280 KZZMVNXOSDERSB-OCCSQVGLSA-N 347.419 1.672 10 10 EDCE CCOC(=O)Cc1cccc(N(C)C(=O)c2ccoc2CC(N)=O)c1 1558778895 LFQRYFUFZXJAFD-UHFFFAOYSA-N 344.367 1.690 10 10 EDCE CO[C@@H](C)C(=O)N(C)[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1718173528 VFSYLMMQFKFFQP-QWRGUYRKSA-N 349.391 1.461 10 10 EDCE COc1ccc(-n2nnnc2CNCC[C@@H](C)NC(=O)C2CC2)cc1 1715617791 XWYOEBIOJVYKDY-GFCCVEGCSA-N 344.419 1.065 10 10 EDCE Cc1nn(CC(=O)NCCc2ccc(O)c(O)c2)c2ncccc12 1631517100 WSQJLPZVHATQBU-UHFFFAOYSA-N 326.356 1.510 10 10 EDCE NS(=O)(=O)c1ccc(F)c(C(=O)NCc2c(O)cccc2F)c1 1635360662 PKNLJHOMVOYCSI-UHFFFAOYSA-N 342.323 1.248 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](c1cncn1C)N(C)C 1567465666 XBLKTCMBTFNCRQ-ZBEGNZNMSA-N 332.404 1.181 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cnn(C)c2OC)cc1C 1567074286 MJENCTXATUAQRV-CYBMUJFWSA-N 346.431 1.654 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)C2=COCCO2)cc1C 1733960877 RPLUYTPQGVFKPB-UONOGXRCSA-N 334.416 1.875 10 10 EDCE COC[C@@H](C)NC[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1567155451 PXTOXIMLFQXZIV-CHWSQXEVSA-N 347.419 1.936 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)C(=O)NCC2CC2)cc1C 1571412263 VZFNMJQANPQSNM-AWEZNQCLSA-N 347.459 1.466 10 10 EDCE COC(=O)C1=NO[C@]2(CCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)C1 1649042568 SRRBMSXENJMZHG-MAVJXHJTSA-N 346.339 1.031 10 10 EDCE COCc1ccc([C@H]2COCCN2C(=O)Cc2ccc(O)c(O)c2)o1 1645044008 RMQWTWJXSVYEQU-CQSZACIVSA-N 347.367 1.980 10 10 EDCE Cc1[nH]c2ccnn2c(=O)c1CC(=O)N[C@H](C)c1ccccc1O 1643738793 QVGXAVPOCXLABA-SNVBAGLBSA-N 326.356 1.457 10 10 EDCE CN(C)c1ccc(CNC(=O)Cn2cnc(-c3ccccn3)n2)cc1 1652760579 WKRCIGKIVFJKJA-UHFFFAOYSA-N 336.399 1.723 10 10 EDCE O=C(N[C@H]1CS(=O)(=O)c2ccccc21)c1c(F)ccc(O)c1O 1654435923 QTOLJSAFSHPVTH-JTQLQIEISA-N 337.328 1.495 10 10 EDCE NC(=O)NCCNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1655614895 NQPVWONWWVIPLF-UHFFFAOYSA-N 328.328 1.906 10 10 EDCE O=C(Cc1cc(F)cc2c1OCOC2)NCc1cc(O)ccc1O 1593873583 SHAIWWZDLGHMRO-UHFFFAOYSA-N 333.315 1.962 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)C(=O)NCC2CC2)cc1C 1667023730 PLLIQVHHZCCHCO-AWEZNQCLSA-N 347.459 1.466 10 10 EDCE CCC(=O)NCC1CC(NCc2nnnn2-c2ccc(OC)cc2)C1 1750973173 BECBFVPQLAQIFY-UHFFFAOYSA-N 344.419 1.065 10 10 EDCE CN(C)C(=O)CN(Cc1ccccc1)c1ccc2c(c1)NC(=O)[C@@H]2O 2034786989 JEXSOKJNAPKPPW-GOSISDBHSA-N 339.395 1.767 10 10 EDCE Oc1ccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)cc1O 702604118 QJFQHOMIOPCVHT-LJQANCHMSA-N 328.412 1.824 10 10 EDCE CS(=O)(=O)N[C@H]1CCN(c2ccc(CN)cc2Br)C1 703006734 PYSMGBZEWVVSLW-JTQLQIEISA-N 348.266 1.036 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@@H](O)C[C@H]3c3ccccc3)c2n1 2065007379 RVGPGPUIXVOMKI-ZFWWWQNUSA-N 338.367 1.691 10 10 EDCE C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1906905520 YENLLBFTHDLUPE-ZJQBRPOHSA-N 340.420 1.276 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)c(Br)c1 2102190065 RDRXOLSOWGROBM-LMVZTGKYSA-N 327.222 1.665 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(NC(N)=O)C2)c(Br)c1 2106928097 PXKMDSKXXUWBER-QMMMGPOBSA-N 327.226 1.586 10 10 EDCE NCc1cc(F)c(N2CC[C@H](OCCO)C2)cc1Br 2109129625 CAJNVGJRYNHPGQ-JTQLQIEISA-N 333.201 1.635 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC[C@H]3CO)c(Br)cc21 2092555537 OBJFFBLIRYTWJT-JVXZTZIISA-N 326.194 1.233 10 10 EDCE CNCc1ccc(N2CCN(C)C[C@H]2CCO)c(Br)c1 2202831225 UTHQQKFCFNEZOS-CYBMUJFWSA-N 342.281 1.671 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](COc2nnc(=N)[nH]n2)C[C@H]2CCC[C@@H]21 2213778085 BWDYUGSXVAJOQN-VWYCJHECSA-N 336.396 1.236 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCC[C@H]2C(N)=O)c1O 2236054475 IOFNPZQZGJXYCD-LDYMZIIASA-N 343.221 1.907 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)C[C@H]3C2)cc1Br 2236980684 RNUAVDCAECKPJW-JLUCKKNBSA-N 341.249 1.476 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)N1CC(N=[N+]=[N-])C1)C1CCOCC1 2250666742 MBQBLFHCQDOHDT-UHFFFAOYSA-N 339.396 1.924 10 10 EDCE N[C@@H]1CCCC[C@@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2308911521 LYLIOVGNDUYQSF-MSOLQXFVSA-N 329.444 1.923 10 10 EDCE OCc1ccc(N2CC3(CC[C@@H](CO)O3)C2)cc1Br 2336719418 SOSBWMNBKOLNFP-LBPRGKRZSA-N 328.206 1.672 10 10 EDCE Cc1ccc(CNC(=O)C2(CN)COC2)c(O)c1Br 2352940889 JRPQJTJJWNVFQG-UHFFFAOYSA-N 329.194 1.055 10 10 EDCE Cc1ccccc1N1C(=O)NC(=O)/C(=C/N[C@H]2NC=CS2)C1=O 100104001 VJSRECGPQIYZJG-QQBNSCQMSA-N 330.369 1.143 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCc1ccc(O)c(O)c1O)C(=O)O 1951421135 PHPJHLSBTGLROD-SECBINFHSA-N 327.333 1.714 10 10 EDCE CN(C(=O)c1cccc(O)c1O)[C@H]1CCCN(c2cccnn2)C1 193078426 YVYKYYVTAOHYLI-LBPRGKRZSA-N 328.372 1.629 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C(C)=O)C3CC3)CC2)cc1 243263122 KUGAQNARKLINNK-UHFFFAOYSA-N 331.416 1.355 10 10 EDCE CCn1cnc(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c1 360030747 IMHICCIJCSIEIV-UHFFFAOYSA-N 336.417 1.557 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCN3CCOC[C@@H]3C2)cc1F 376893757 DYAFTMGOKDBOGT-AWEZNQCLSA-N 336.411 1.118 10 10 EDCE Cc1ccc(C(=O)NC[C@H]2CCC3(CCOCC3)[C@@H]2O)c(O)c1O 283754559 ZONCXTWBVORDFH-MLGOLLRUSA-N 335.400 1.704 10 10 EDCE CN1CCO[C@@H](C(=O)NCc2cc(Br)ccc2O)C1 804738580 VOXDSNGIEMHAEE-GFCCVEGCSA-N 329.194 1.102 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1 808504904 NVMZBHQHBCNOMP-HNNXBMFYSA-N 347.367 1.879 10 10 EDCE C[C@H](N[C@H]1CCC(=O)N(C)C1=O)c1ccc(N2CCOCC2)c(F)c1 818360721 BRWHZSARQNIGLG-WFASDCNBSA-N 349.406 1.460 10 10 EDCE COc1ccc(CNC(=O)Nc2ccc3c(n2)OCCO3)c(O)c1 825008004 QBECDYNAVJOBNC-UHFFFAOYSA-N 331.328 1.889 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2COC(C)(C)C2)cc1F 827575165 MUSUEBQRQCIQHH-GFCCVEGCSA-N 337.395 1.192 10 10 EDCE CN(C)C(=O)[C@@H]1CC[C@@H](CNC/C=C\c2ccc(N(C)C)cc2)O1 835043740 YLVRPBILUJBGBI-SLXDBMQSSA-N 331.460 1.991 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCc1cnn(C)n1 839922176 PIFATELOZAMZTR-CQSZACIVSA-N 329.448 1.870 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)[C@H](N)Cc1ccc(O)c(O)c1 1952755769 VQBMVFDTPHXLCN-VXGBXAGGSA-N 326.393 1.507 10 10 EDCE C[C@@H](C(=O)NCc1c(O)cccc1F)N1C(=O)[C@H]2CCCC[C@H]2C1=O 928708220 DYJFUGFZPCKDBB-SDDRHHMPSA-N 348.374 1.711 10 10 EDCE CC(C)(CNCc1ccc(N2CCOCC2)cc1)CS(C)(=O)=O 922738690 WHLWAVJKQOEOGN-UHFFFAOYSA-N 340.489 1.684 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)CCN(C)C)C2)cc1 852188084 WGBHZUGRPUYOHC-GJZGRUSLSA-N 334.464 1.913 10 10 EDCE COC(=O)c1ccc2c(n1)CCCN2C(=O)/C=C\c1cnn(C)c1 857661466 GTWNBFVWGRLLPW-YVMONPNESA-N 326.356 1.594 10 10 EDCE COC[C@@]1(C(=O)OC)CCCN1C(=O)/C=C/c1ccc(O)c(O)c1 855375400 OMDDZCTVHHJYCK-QQOXCAACSA-N 335.356 1.292 10 10 EDCE CC[C@@H](NCC[C@@H]1CNCCS1(=O)=O)c1cccc(Cl)c1O 925788320 HNOVUACXWIQDEO-BXUZGUMPSA-N 346.880 1.863 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CCC[C@H]3O)C2)cc1 854296028 AHCJPKAMBTYXBI-GRDNDAEWSA-N 333.432 1.734 10 10 EDCE NC(=O)c1cccc2c1CCN(Cc1cc3c(cc1O)OC[C@H]3O)C2 853621733 GSNDCSYHNMHSTR-QGZVFWFLSA-N 340.379 1.475 10 10 EDCE Cc1ccc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)nn1 866673580 DIYRPXQJBYVLQF-UHFFFAOYSA-N 332.429 1.646 10 10 EDCE COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(OC)cc3O)C[C@@H]1C2 876130610 AGPXPJXBKTXTND-PEBVRCNWSA-N 334.372 1.542 10 10 EDCE O=C(CCN1C(=O)COc2ccccc21)NCc1ccc(O)cc1O 1142531199 XVWHKIUHPFMGAA-UHFFFAOYSA-N 342.351 1.530 10 10 EDCE C[C@@H](c1nc(-c2nc[nH]n2)no1)N1CCOc2cc(N(C)C)ccc21 1307648494 PHDRPUAZIQIWFS-JTQLQIEISA-N 341.375 1.881 10 10 EDCE CNCc1ccc(N2CC(C(=O)N(C)C)C2)cc1Br 2121041722 HPMPEFWHPKQZLZ-UHFFFAOYSA-N 326.238 1.693 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@H](NC3CCOCC3)C2)c(O)c1O 1176467133 NMSHEPLKQKTLMA-AWEZNQCLSA-N 334.416 1.779 10 10 EDCE CCC[C@H](C)NC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1333946950 KYFCRGSHEUJXJK-UONOGXRCSA-N 333.432 1.695 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2ccc(=O)n(C)c2)cc1C 1268652106 ZRJBAXKRQYTJLT-CQSZACIVSA-N 343.427 1.610 10 10 EDCE COc1ccc(CNCC2(NC(=O)C(N)=O)CCCCC2)cc1C 1282618746 CGQQRMSJNSOYJX-UHFFFAOYSA-N 333.432 1.398 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)C(=O)NCc1cc(Cl)ccc1O 1469876124 BEHVRTQKOOFMHX-LBPRGKRZSA-N 344.795 1.547 10 10 EDCE Oc1ccccc1CN[C@@H]1CO[C@H](CN2CCC(F)(F)CC2)[C@@H]1O 1615259239 CVPMMTGUTIEZQH-FVQBIDKESA-N 342.386 1.341 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@H](C)C(C)(F)F)cc1C 1717777892 OVVXEWSDJJUZBY-GXTWGEPZSA-N 344.402 1.862 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc2c(nc1O)CCC[C@H]2O 1557085520 OHLYTZXIIWNLQD-CQSZACIVSA-N 330.340 1.498 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2cn(C)nn2)C2CC2)cc1C 1713109769 WSMSSOSMFGOBLH-HNNXBMFYSA-N 343.431 1.430 10 10 EDCE COCCN1C(=O)/C(=C2\C(=O)N(C)c3ccccc32)SC1=S 2280138 QZPAEVMNFZLJCA-VAWYXSNFSA-N 334.422 1.881 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCc3nnc(O)n3C2)c1 1631542339 HUBARQCLUMAHSQ-ZJUUUORDSA-N 332.360 1.138 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2ccnn2C)cc1C 1493568991 WMSNCGDIQDTNTM-UHFFFAOYSA-N 344.459 1.918 10 10 EDCE CCOC(=O)C1=S=C(NC(=O)c2ccn3nccc3n2)C=C1C 1642546608 BUQUMZLLCHNKAY-UHFFFAOYSA-N 330.369 1.018 10 10 EDCE CCC(=O)NC[C@H]1CCN(Cc2nnnn2-c2ccc(OC)cc2)C1 1731840512 DPBQTDNTFKOWPG-CYBMUJFWSA-N 344.419 1.019 10 10 EDCE CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1c(O)cccc1O 1647269841 MHLPJJDUIUCVKR-HNNXBMFYSA-N 326.352 1.692 10 10 EDCE O=C(NCc1c(O)cccc1F)c1cnc2nc(O)nc(O)c2c1 1646028296 DFSNZENGCKKPBQ-UHFFFAOYSA-N 330.275 1.211 10 10 EDCE COC1CCN(c2ccc(CN3CCCN(C(N)=O)CC3)cc2)CC1 1641663463 UCQWIXJQDKFBDI-UHFFFAOYSA-N 346.475 1.888 10 10 EDCE CCOC(=O)[C@H](C[C@@H]1CCCO1)NC(=O)Cc1ccc(O)c(O)c1 1651634230 KCTHRSUCCNXCKD-STQMWFEESA-N 337.372 1.257 10 10 EDCE CO[C@@H](C)c1noc(CN(C)C(=O)/C=C\c2ccc(O)c(O)c2)n1 1772911369 RMCMIQICBQERPV-BXKUYDPTSA-N 333.344 1.860 10 10 EDCE CN(C)C[C@H]1COC[C@H]1NCc1ccc(Br)cc1O 2141464580 KJZIDJMWKUUOMI-WCQYABFASA-N 329.238 1.821 10 10 EDCE CN(C)c1ccc(CNCCC(=O)N2CCCC[C@@H]2CCO)cc1 1857863249 UCZIUISZWFSEMM-GOSISDBHSA-N 333.476 1.996 10 10 EDCE CN1[C@@H](CNCc2cccc(Br)c2O)CCS1(=O)=O 1967746293 DVQVYOLFLNOHSV-SNVBAGLBSA-N 349.250 1.278 10 10 EDCE O=S1(=O)CC2(CC(NCc3c(O)cccc3Br)C2)C1 1967801160 DPRQYIOQQFWQIW-UHFFFAOYSA-N 346.246 1.822 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H](O)C4(CC4)C3)c(Br)cc21 2149753918 JBYUNMXEFXVKDT-NWDGAFQWSA-N 338.205 1.362 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@@]1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CCOC1 2010395165 HHSTWRMNVWUYCO-NHYWBVRUSA-N 339.396 1.924 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010406360 TWOHWZWQRJHXAT-LBPRGKRZSA-N 340.428 1.602 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010406621 WVNSWYDSFMBNEL-TUAOUCFPSA-N 339.396 1.827 10 10 EDCE CN(Cc1c(Br)nnn1C)C(=O)Nc1ccc(N)cc1 2156469586 PZCMREXCEKXCGK-UHFFFAOYSA-N 339.197 1.824 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H]3CN3CCCCC3)c2n1 2063351630 MVSSDGPTANCNEQ-CQSZACIVSA-N 343.431 1.834 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1C(=O)Cc1ccc(N)cc1 2060805238 AYACGMHIOZCGTP-LSDHHAIUSA-N 349.431 1.298 10 10 EDCE C[C@@H]1CN(Cc2c(O)cccc2Br)[C@@H](C(=O)O)CO1 2109527061 USVPXJIMVPEDIP-LDYMZIIASA-N 330.178 1.829 10 10 EDCE COCC1(O)CCN(c2ccc(CO)cc2Br)CC1 2095406954 ANWRMWSXOLSZON-UHFFFAOYSA-N 330.222 1.919 10 10 EDCE CNC(=O)NCCNCc1c(Br)ccc(OC)c1O 2227749226 FFMGYGWYOJALTD-UHFFFAOYSA-N 332.198 1.182 10 10 EDCE CC[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2288890923 ALSGIMXMXGZAMM-RTXFEEFZSA-N 340.221 1.751 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)c(Br)c1 2357053464 WBKOJJOQHYHSTD-IKRVOCLZSA-N 342.233 1.965 10 10 EDCE Oc1cc2c(cc1CN1CCCC[C@@H]1CN1CCOCC1)OCO2 93012174 KNZCUSZUEWAXOR-OAHLLOKOSA-N 334.416 1.808 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3[C@H]4CC[C@H]3CC(O)C4)nc12 264687878 CVYYLSPBQZFWGA-RYUDHWBXSA-N 346.387 1.099 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2CNCCO2)c(O)c1Br 2381129966 RYDCNZLLNXIIDU-NSHDSACASA-N 343.221 1.410 10 10 EDCE Cc1ccc(CN(C)[C@]2(C(=O)O)CC[C@@H]2N)c(O)c1Br 2381130499 ZXHUGGGSDSFGJR-IINYFYTJSA-N 343.221 1.839 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)N1CC[C@](O)(C(N)=O)C1 286591889 WCZMHYHOIRPVJV-MRXNPFEDSA-N 333.413 1.218 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(C)C3)CC2)cc1 801253376 YFHBLLJIDBQGOY-BQYQJAHWSA-N 343.427 1.378 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1cc([N+](=O)[O-])cn1 808093036 FGUJYBPBSZEUQF-UHFFFAOYSA-N 325.321 1.299 10 10 EDCE Oc1cc(Br)ccc1CN1CC[C@@]2(CNCCO2)C1 719956298 NWTPDXZFVCLYDW-CQSZACIVSA-N 327.222 1.719 10 10 EDCE c1cc(N2CCOCC2)ccc1CN[C@@H]1CNCC2(CCOCC2)C1 903974252 NGGCSKCPFHMHCF-SFHVURJKSA-N 345.487 1.772 10 10 EDCE Oc1cc2c(cc1CN1CCC(N3[C@H]4CC[C@H]3CNC4)CC1)OCO2 903978391 NYIGVBMLYJETBX-HOTGVXAUSA-N 345.443 1.522 10 10 EDCE CNC[C@@H]1CCCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 903528221 FGSOKCSUJVDRGF-SFHVURJKSA-N 332.492 1.785 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CC1(C(=O)O)CCOCC1 911118382 LWXNLILTMQDPMP-UHFFFAOYSA-N 334.416 1.983 10 10 EDCE CCNC(=O)CN1CCN(Cc2c(O)cc(C)cc2Cl)CC1 840911048 VFCWAWDNZLYMIE-UHFFFAOYSA-N 325.840 1.608 10 10 EDCE COc1cc(Cl)cc(CN2CCN(c3nncn3C)CC2)c1O 848925039 LNGJMNJAUKGRHA-UHFFFAOYSA-N 337.811 1.505 10 10 EDCE CC[C@H](OC)C(=O)Nc1ccc(O)c(CNC(=O)[C@@H](CC)OC)c1 923124145 TWPRPHKIMUIUTF-CABCVRRESA-N 338.404 1.797 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@]3(C)CO)C2)cc1 854300042 TYMMFYBAGZVSNN-KSSFIOAISA-N 333.432 1.830 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)CCN(C)C)C2)cc1 852188086 WGBHZUGRPUYOHC-LSDHHAIUSA-N 334.464 1.913 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(C2CC2)C1=O 854324063 FXNNWOKORYGVEQ-UHFFFAOYSA-N 330.432 1.611 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CNC1(CCO)CCCC1 852117784 RZVXVNRLHCNIEL-UHFFFAOYSA-N 333.476 1.996 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)N(C)C3CC3)CC2)cc1F 754040645 WEZXCWXHKSTQML-UHFFFAOYSA-N 343.424 1.295 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCN2C(=O)OCC[C@H]2C1 764408747 WNXQDRPWPQAURW-INIZCTEOSA-N 346.431 1.797 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)[C@@H]3CCC(=O)N3)C2)cc1 862158613 IWSDKRLVBPSCPN-WWGRRREGSA-N 331.416 1.305 10 10 EDCE Cn1cc(S(=O)(=O)N2Cc3cccc(O)c3C2)c(C(F)(F)F)n1 867691016 PVLRPJQZMNQOPI-UHFFFAOYSA-N 347.318 1.849 10 10 EDCE CN1CCN(c2ccc(CN3CCCC[C@H]3CC(N)=O)cc2)CC1 775664597 NGOACFVFHAIKBT-SFHVURJKSA-N 330.476 1.668 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CC(CN2CCOCC2)C1 897820448 BBQNDMWYSNFWSY-UHFFFAOYSA-N 348.424 1.717 10 10 EDCE COc1ccc(CNC(=O)c2cnc3c(cnn3C)c2OC)c(O)c1 794388492 WNUALGKIHXCZDO-UHFFFAOYSA-N 342.355 1.621 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cncc2ncn(C)c12 1154027632 XOSVWAMUIDWMCH-JTQLQIEISA-N 326.356 1.741 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccc(N2C(=O)CCC2=O)cc1 1162271496 HPMSWCINLQEIMA-UHFFFAOYSA-N 340.335 1.681 10 10 EDCE Cn1cc(NC(=O)Cc2ccc(O)c(O)c2)c(Br)n1 1637113268 JAHLOEVVRRHIMQ-UHFFFAOYSA-N 326.150 1.775 10 10 EDCE CC1(C)CNC(=O)CN1c1ccc(CN)c(Br)c1F 2119118449 YKKVPXLGOXYCFX-UHFFFAOYSA-N 330.201 1.762 10 10 EDCE Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NC1CN(S(=O)(=O)N(C)C)C1 1329192888 URYRMHTVHBCNJA-WCQYABFASA-N 339.461 1.329 10 10 EDCE COc1ccc(N2C[C@H](O)C[C@H]2CN)c(OC)c1Br 2124714372 RZGIJHBASZDZTI-DTWKUNHWSA-N 331.210 1.365 10 10 EDCE CN1C(=O)O[C@H]2CN(c3ccc(CN)cc3Br)C[C@H]21 2120412828 UNFRELKEFQWGKI-NEPJUHHUSA-N 326.194 1.547 10 10 EDCE CN1CCN(c2ccc(CN[C@@H]3CC[C@H](C(=O)O)C3)cc2F)CC1 1332339942 TULQRCJQOSFNIK-LSDHHAIUSA-N 335.423 1.920 10 10 EDCE Cn1nnnc1CCCNC(=O)c1cc2cc(O)c(O)cc2s1 1180376773 VAAFGVOQHHJZAZ-UHFFFAOYSA-N 333.373 1.199 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCCC[C@H]2CNCCO)cc1 1275816954 OHSKDNHXUFHAKM-DZGCQCFKSA-N 347.419 1.720 10 10 EDCE C[C@H](NC(=O)CCc1cnn(C)n1)c1ccc(N2CCOCC2)cc1 1357929917 ZWAPRJZTJZDWPK-AWEZNQCLSA-N 343.431 1.462 10 10 EDCE [N-]=[N+]=NC1CCN(C(=O)Cn2cc(Br)ccc2=O)CC1 1912201227 RICQFVGBHFRFAH-UHFFFAOYSA-N 340.181 1.912 10 10 EDCE NC(=O)[C@H]1CC[C@@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)O1 1445981036 DANBSPWCYFDGBY-GZMMTYOYSA-N 336.369 1.075 10 10 EDCE C[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 1914310012 ASSUMBKPPAWWOY-JPWUCKPDSA-N 326.194 1.361 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)C2=CS(=O)(=O)CCC2)c1 1445966901 JKBPSGYPPQMREX-JTQLQIEISA-N 325.386 1.671 10 10 EDCE CN(C)C(=O)CCn1c(C2CC2)nnc1N(C)Cc1ccccc1O 1297984366 VRLANWSEBUTJCZ-UHFFFAOYSA-N 343.431 1.976 10 10 EDCE CS(=O)(=O)c1ccc(NCC(=O)NCc2ccccc2O)cc1 1545681848 GDODJDJNMNYXBV-UHFFFAOYSA-N 334.397 1.524 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2ccon2)cc1C 1700930567 FMJJDSBWZLLYOP-CQSZACIVSA-N 333.388 1.214 10 10 EDCE CCNC(=O)CC(=O)N(C)C[C@H](C)NCc1ccc(OC)c(C)c1 1485866172 QQQPLECYSZLQNA-AWEZNQCLSA-N 335.448 1.466 10 10 EDCE COc1ccc(CNC2(C)CCN(C(=O)CNC(C)=O)CC2)cc1C 1484911184 CLGBWBHEBADLHA-UHFFFAOYSA-N 347.459 1.610 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1cnc2n(c1=O)CCS2 1628667463 WAZQMLDHOONCRD-UHFFFAOYSA-N 337.788 1.638 10 10 EDCE CC[C@H](C)CN1CC(O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1569791884 UJXGASBYHYAIGM-LBPRGKRZSA-N 347.419 1.672 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1c(C)c[nH]c1CC(N)=O 1636058636 KYLSXAJINOGUTD-UHFFFAOYSA-N 336.388 1.472 10 10 EDCE Cc1noc([C@@H]2OCC[C@@H]2NC(=O)N2Cc3cccc(O)c3C2)n1 1565160746 ZLUKYFUNUQGYLU-GXTWGEPZSA-N 330.344 1.639 10 10 EDCE CN(CCF)C[C@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1734547683 VMXOVKRRAGOMIE-ZDUSSCGKSA-N 339.371 1.183 10 10 EDCE O=C(Cc1csc(N2CCCC2=O)n1)NCc1c(O)cccc1O 1647177543 DIBFWSDSNJCLJT-UHFFFAOYSA-N 347.396 1.540 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCN2CCCC2=O)cc1C 1731641708 VCYBKQKHJMJHHR-OAHLLOKOSA-N 347.459 1.610 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccc(N2CCNC2=O)cc1 1644752335 BDAXZTDVNCHUBO-UHFFFAOYSA-N 327.340 1.557 10 10 EDCE CCC[C@@H](O)[C@@H](CO)NC(=O)c1cc2cc(O)c(O)cc2s1 1642392610 ORBRVWUSWMOJTN-NXEZZACHSA-N 325.386 1.564 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCC[C@H]2CNCCCO)cc1 1667778463 MDUPNQFPAJWNRH-DZGCQCFKSA-N 347.419 1.720 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H]2CN3CCC2CC3)cc1C 1690575733 ZMMPQJQMWZJIJU-CRAIPNDOSA-N 345.487 1.940 10 10 EDCE CC[C@H](Nc1cnn(CC(=O)NCCOC)c1)c1ccccc1O 157870196 RMJMFWXNGOMMCI-HNNXBMFYSA-N 332.404 1.915 10 10 EDCE Cc1nnnn1-c1cccc(C(=O)NCCc2ccc(O)c(O)c2)c1 1860167909 HFJLCOVPDLQLBO-UHFFFAOYSA-N 339.355 1.354 10 10 EDCE Cn1nnnc1C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1860769146 RMZKMYWSKGSGSL-UHFFFAOYSA-N 333.307 1.238 10 10 EDCE NCc1ccc(N2CC[C@@H](OCC(N)=O)C2)c(F)c1Br 2145372718 VLVWPFHAVWUJKN-SECBINFHSA-N 346.200 1.128 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)NCC1(CN=[N+]=[N-])CC1 1985103200 RMNBIFQNZYBGMS-ZJUUUORDSA-N 327.385 1.467 10 10 EDCE CN[C@@H](C)c1ccc(N2CC[C@@](O)(C(N)=O)C2)cc1Br 380495111 NDMSEMFZWBISDS-XPTSAGLGSA-N 342.237 1.156 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C(=O)NC(=O)[C@H]3C2)cc1Br 387428268 NWWLKOWTNCOWDH-GGVZMXCHSA-N 338.205 1.178 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCN(c4nccs4)CC3)c2n1 2063469673 HXSLVITYHUOYAJ-UHFFFAOYSA-N 344.400 1.162 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213593611 XRLISTYTHFYEHZ-WHOHXGKFSA-N 339.396 1.874 10 10 EDCE CC(C)(C)OC(=O)N1Cc2ccc(COc3nnc(=N)[nH]n3)cc2C1 2219018627 UGXSHTYHHQXXHI-UHFFFAOYSA-N 344.375 1.509 10 10 EDCE CC[C@@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2288917891 WYDSHDYKWIDMMP-KGYLQXTDSA-N 341.205 1.784 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)cc1Br 2331965943 YCGLKCYBBGONCR-SAXRGWBVSA-N 327.222 1.371 10 10 EDCE Cc1ccc(CN2CC[C@H](CO)[C@@H](N)C2)c(O)c1Br 2352680595 RIQZPQSELPNGNZ-NEPJUHHUSA-N 329.238 1.605 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN([C@@H](C)CO)CC2)c([N+](=O)[O-])c1 103925564 AFWLLKFXOQPFOU-AGLBCWCQSA-N 349.387 1.284 10 10 EDCE N[C@H]1[C@H]2C[C@H](CN(Cc3ccc(Br)cc3O)C2)[C@H]1CO 2358896725 WXWAGVNTQIDWEG-OICBVUGWSA-N 341.249 1.542 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCCN1C(=O)CSC1=O 170245512 FPTRLNXCPJPABO-VIFPVBQESA-N 338.385 1.088 10 10 EDCE CCS(=O)(=O)CCN(C)C(=O)c1c(C)oc(-n2cccc2)c1C#N 89374133 IONGTESFCVMSSQ-UHFFFAOYSA-N 349.412 1.757 10 10 EDCE CCOc1ccccc1[C@@H](CC(=O)OCC(=O)C(C)=O)NC(C)=O 808514159 UHYYLCCCZVLJNE-CQSZACIVSA-N 335.356 1.354 10 10 EDCE O=C(C1CC1)[C@@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)CCO1 811501893 BUZNATFYYWQSFC-SFHVURJKSA-N 348.418 1.842 10 10 EDCE CC(C)[C@@](C)(CO)NC(=O)NCc1ccc(N2CCOCC2)cc1 812012147 PJJMTZKULIVROX-GOSISDBHSA-N 335.448 1.729 10 10 EDCE O=C1CC[C@H](C(=O)NCc2ccc(N3CCOCC3)cc2)CCN1 815097311 XXEWFTCNBUXHCX-HNNXBMFYSA-N 331.416 1.056 10 10 EDCE O[C@@]1(C(F)F)CCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 824726860 XKRSCXGTJHIBNL-INIZCTEOSA-N 330.350 1.864 10 10 EDCE O=C1NCC[C@@H]1NC(=O)N(Cc1ccco1)Cc1ccccc1O 824305306 HLEXJNUPHCZVOT-AWEZNQCLSA-N 329.356 1.586 10 10 EDCE COCCC1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 827158082 NGBVIYVBJKTILT-UHFFFAOYSA-N 345.443 1.398 10 10 EDCE C[C@@H](CN(C)C(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(=O)O 588592525 TYPGZEZUNJUSEV-PODYEWJSSA-N 332.400 1.716 10 10 EDCE CCO[C@@H]1CN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C[C@H]1CN 846159280 FQMVGQBNKFLLPC-YSVLISHTSA-N 334.464 1.819 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CC[C@H](C2CC2)N1 846673780 WUUINZVWAHMTCT-QZTJIDSGSA-N 329.444 1.670 10 10 EDCE CCO[C@H]1[C@@H](C(=O)NCc2ccc(N3CCN(C)CC3)cc2)[C@H]1C 918904810 BNQFQIXNHBHXKD-FHLIZLRMSA-N 331.460 1.726 10 10 EDCE CCSC[C@@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1895031282 DDSYXJIFRIPBRN-IJLUTSLNSA-N 344.477 1.898 10 10 EDCE CO[C@H](CNCc1ccc(N2CCN(C)CC2)cc1)[C@@H]1CCOC1 850341452 AGIWCSOFEGMUKP-IEBWSBKVSA-N 333.476 1.580 10 10 EDCE CC[C@@H](NCC[C@H]1CNCCS1(=O)=O)c1ccc(F)cc1O 925789242 RFAJFPSGRCUEOO-GXTWGEPZSA-N 330.425 1.349 10 10 EDCE Cn1nccc1[C@@H](O)CNCc1cc(Br)cc(F)c1O 922975343 SOYKFWUQRXTINX-LBPRGKRZSA-N 344.184 1.851 10 10 EDCE COCc1nc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)co1 856212788 SBOKZFHBWHQYDS-UHFFFAOYSA-N 345.399 1.712 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCCS(=O)(=O)C1 935945582 CTFGSKJOZWEZFN-NSHDSACASA-N 332.418 1.319 10 10 EDCE COC(=O)[C@@]1(OC)CCN(Cc2cc(Cl)cc(OC)c2O)C1 862475720 VEHSXXODQXBKNT-OAHLLOKOSA-N 329.780 1.818 10 10 EDCE Cc1ccc(/C=C2/SC(=S)N(CCN3CCOCC3)C2=O)nc1 761787243 VRVLKTBJTLBONG-GXDHUFHOSA-N 349.481 1.923 10 10 EDCE Oc1ccc(F)cc1CN[C@H]1CCN(c2ccc3nncn3n2)C1 862482519 UWLIUGAPOQWVCB-ZDUSSCGKSA-N 328.351 1.338 10 10 EDCE CC(C)(C)CC(=O)N1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768440093 DBMYHBNFLBPERP-INIZCTEOSA-N 348.443 1.898 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](C)[C@H](F)C3)nc12 778237465 PRRDZEDMPBIBLC-ZWNOBZJWSA-N 336.367 1.792 10 10 EDCE COC(=O)CCN(CC(=O)OC(C)(C)C)C(=O)c1cc(O)cs1 882884738 VJGQAOYUKKKOJZ-UHFFFAOYSA-N 343.401 1.801 10 10 EDCE CC(C)S(=O)(=O)CCNC(=O)c1cc2cc(O)c(O)cc2s1 1141754784 YMNXIEAYDDXJBH-UHFFFAOYSA-N 343.426 1.866 10 10 EDCE CCN1CCO[C@H](CNCc2ccc(Br)cc2O)C1 691500225 DVDLMBRYUICKGU-CYBMUJFWSA-N 329.238 1.965 10 10 EDCE CN(CC(=O)c1ccc(O)c(O)c1)C[C@H](O)COCc1ccccc1 1916357164 HEJAGIHOBPKFRA-INIZCTEOSA-N 345.395 1.790 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@H]2CC2(F)F)cc1 1328589484 AUVUILYOMQYRHE-LBPRGKRZSA-N 325.359 1.530 10 10 EDCE C[C@]1(c2cccc(CNC(=O)c3cc(O)cs3)c2)NC(=O)NC1=O 1333804881 KTMPPYVKOJTTJF-MRXNPFEDSA-N 345.380 1.438 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H](C)CO3)CC2)c(OC)c1 1332170134 GKWCDOJUYCTMQX-GUYCJALGSA-N 334.416 1.777 10 10 EDCE O=C(C[C@@H](O)C(Cl)(Cl)Cl)NCc1cccc(O)c1O 1348048415 SXLGBMMOMWTZHR-MRVPVSSYSA-N 328.579 1.835 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C[C@H]1CCCOC1 1266365248 SZJLQFJWJFZIMT-CYBMUJFWSA-N 347.419 1.937 10 10 EDCE C[C@H](CN(C)C(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H]1CCOC1 1283724351 SCGCDYSIVGQTND-OLZOCXBDSA-N 347.419 1.936 10 10 EDCE Cn1ccnc1-c1cc(NC(=O)/C=C\c2ccc(O)c(O)c2)n[nH]1 1452414280 OJWAKYQDSVZNRX-HYXAFXHYSA-N 325.328 1.873 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N(Cc1ccccc1)CC1(O)CNC1 1915455694 XDNOACCJFQNJQY-UHFFFAOYSA-N 342.395 1.003 10 10 EDCE Cn1cc(-c2nn(C)cc2NC(=O)Cc2ccc(O)c(O)c2)cn1 1467796077 CJSHXHOAHVXXSA-UHFFFAOYSA-N 327.344 1.413 10 10 EDCE CC[C@@H](F)C(=O)NC[C@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1705230775 PBVOFDCSGSGLJD-CHWSQXEVSA-N 349.366 1.928 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cc2c(nc1O)CCC[C@@H]2O 1558162345 ZSHAGDWYACBDOT-ZDUSSCGKSA-N 330.340 1.498 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)Cc2cnn(C)c2)cc1C 1497154115 JUXCYBHGKZUIOH-HNNXBMFYSA-N 344.459 1.964 10 10 EDCE Cc1cnc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c(O)c1 1633251980 DABVNXQVYBTBSO-UHFFFAOYSA-N 340.427 1.777 10 10 EDCE O=C(C[C@@H]1C(=O)Nc2c(F)cccc21)NCc1cccc(O)c1O 1644710423 ACWHZAOMRHDLRK-NSHDSACASA-N 330.315 1.979 10 10 EDCE O=C(CCc1nc(-c2ccncc2)no1)NCc1cccc(O)c1O 1643809494 OUUJNDSHCMUGGL-UHFFFAOYSA-N 340.339 1.792 10 10 EDCE CCC(=O)N[C@H](C)C(=O)N(C)[C@H](C)CNCc1ccc(OC)c(C)c1 1732421565 VSBQYYXJBZCKFX-HUUCEWRRSA-N 349.475 1.855 10 10 EDCE NS(=O)(=O)CCNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1654985785 RCPAKECCJFJQDF-UHFFFAOYSA-N 349.368 1.526 10 10 EDCE CCC(=O)NCC(=O)N[C@H](C)[C@@H](C)NCc1ccc(OC)c(C)c1 1674639772 ITBZQGPUMCKJSZ-ZIAGYGMSSA-N 335.448 1.513 10 10 EDCE COCCN(CC(=O)C(=O)C[C@H]1C[C@H](N)C1)C(=O)OC(C)(C)C 1980376075 DAIOYCQKNDEDGA-HAQNSBGRSA-N 328.409 1.136 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC(CN=[N+]=[N-])CC1 1985102060 BDWADJSNERLEAU-LLVKDONJSA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCN(Cc2ccc(N)cc2)C[C@@H]1CO 2009100634 YELHYEBNCAZYQO-GDBMZVCRSA-N 335.448 1.976 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@]1(O)CCCN(C(=O)OC(C)(C)C)C1 2011938789 DEBNXFDEBDSSMH-HNNXBMFYSA-N 341.412 1.907 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CC(CO)C1 2018277817 GYHZRVWEGHRHDX-LOIXOFCESA-N 339.396 1.563 10 10 EDCE NCc1ccc(N2CC[C@@H]3C(=O)NC(=O)[C@@H]3C2)c(Br)c1 2158786476 WJYWOSQEAKLWNP-VHSXEESVSA-N 338.205 1.007 10 10 EDCE C[C@H](O)CN1CCCN(c2ccc(CN)cc2Br)CC1 2176856065 OHWRBXAKCGWUIH-LBPRGKRZSA-N 342.281 1.801 10 10 EDCE CO[C@@H]1CCN(Cc2cn(C)nc2C(=O)Nc2ccc(O)c(O)c2)C1 2062393726 JNRPJMZQRBPGBW-CYBMUJFWSA-N 346.387 1.304 10 10 EDCE CC[C@@]1(NCc2cccc(Br)c2O)CCC(=O)NC1=O 2182521435 WTYBYTHDYFPXNF-CQSZACIVSA-N 341.205 1.830 10 10 EDCE O=C1Nc2cc(N3CC4(C=CCO4)C3)c(Br)cc2[C@H]1O 2183724810 LVXGJTZOLZIXDD-GFCCVEGCSA-N 337.173 1.580 10 10 EDCE Nc1ccc(CC(=O)N2CCC(CNC(=O)C(F)(F)F)CC2)cc1 2044620482 KSQGGDKSAAXHQU-UHFFFAOYSA-N 343.349 1.728 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)Cc1ccc(N)cc1 2058673110 QLUHEKDBAGMHEQ-GJZGRUSLSA-N 349.431 1.562 10 10 EDCE Oc1c(F)cc(Br)cc1CNCC[C@@H]1COC[C@@H]1O 2111325789 LUQKGVCMAAOKPQ-PELKAZGASA-N 334.185 1.781 10 10 EDCE CN(c1ccc(CN)cc1Br)[C@@H]1CS(=O)(=O)C1(C)C 2097550075 VLAFINWNWSXMOX-GFCCVEGCSA-N 347.278 1.920 10 10 EDCE CN(CCn1cc(C(=O)NCCN=[N+]=[N-])cn1)C(=O)OC(C)(C)C 2213271496 SCENBHWNVCWBRE-UHFFFAOYSA-N 337.384 1.790 10 10 EDCE CC(C)(C)OC(=O)N1CCC(C)(C)[C@@H](COc2nnc(=N)[nH]n2)C1 2213792232 LUAAGTNLCQFXEE-SNVBAGLBSA-N 338.412 1.341 10 10 EDCE COC[C@@H]1[C@@H](O)[C@H](O)CN1c1ccc([C@@H](C)O)c(Br)c1 2233867094 VVDZOTJRIPQUNQ-HKSFMPNISA-N 346.221 1.059 10 10 EDCE Cc1ccc(N2C(=O)NC(=O)C(=CNCCCC(=O)O)C2=O)cc1C 2297533626 YRZAVHGKLHMOPC-UHFFFAOYSA-N 345.355 1.225 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(c2ncccn2)CC1 2307978563 KALGFLULRJFPDC-UHFFFAOYSA-N 326.356 1.250 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CSC(=O)N2)c(O)c1Br 2352932374 MAQNGHAJHLSQLI-MRVPVSSYSA-N 345.218 1.904 10 10 EDCE C[C@H](NC=C1C(=O)NC(=S)NC1=O)c1ccc2c(c1)CCCC2 52529068 ZCVFQHDNUYHUAU-JTQLQIEISA-N 329.425 1.631 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCC[C@@H]1CN1CCOCC1 92218102 ITYZSQZCMUKRTA-HXUWFJFHSA-N 345.487 1.820 10 10 EDCE CN1C(=O)C[C@H](C(=O)NCc2ccc(O)c(O)c2)[C@@H]1c1cccnc1 272303095 JCHLURTXUQNBHA-GUYCJALGSA-N 341.367 1.329 10 10 EDCE Cc1ccc(CN2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)c(O)c1Br 2380805572 QZHIPWGCUSGWRM-JUFZMCDQSA-N 342.233 1.922 10 10 EDCE CN1CCC[C@@H](C(=O)NCc2ccc(N3CCOCC3)cc2)C1=O 294331688 ABBPNWHTHRQKCV-INIZCTEOSA-N 331.416 1.008 10 10 EDCE CC[C@H](O)CC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 823161150 AMICNDRJIGGQQZ-HNNXBMFYSA-N 337.439 1.745 10 10 EDCE COC[C@H]1CCN1C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 823733860 ULHMSLMFYFZOIR-GOEBONIOSA-N 333.432 1.952 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCC[C@@H]3C[C@H]23)cc1 826706398 JKGJANRJKLLATG-VYDXJSESSA-N 329.444 1.921 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1C[C@@H](C)CO1 901326009 CZKANEFKHBMUAI-QMTHXVAHSA-N 341.791 1.972 10 10 EDCE CC1(C)COC[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 836248750 JJZHMIGEZDGXCE-MRXNPFEDSA-N 333.432 1.747 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1CCO[C@@H]1CC1(F)F 849359963 HNZRPAYVEMZAAC-GFCCVEGCSA-N 326.299 1.581 10 10 EDCE Nc1ccc(NC(=O)NC[C@@]2(O)[C@H]3[C@@H]4C[C@@H]5[C@@H]6C[C@@H]([C@@H]3[C@@H]64)[C@@H]52)cc1 841297337 OVZZSWKCNIASLI-JGXYAXPUSA-N 325.412 1.899 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1(C(=O)O)CCC1 851687445 UTWGMDIXILXDQU-UHFFFAOYSA-N 347.415 1.082 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCC[C@@H](C3CCOCC3)C2)cc1 927935217 YAVXCGIYMQKDSV-CQSZACIVSA-N 331.416 1.873 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@@H](O)C(F)(F)C2)c([N+](=O)[O-])c1 853802794 GUNIYOJFUPFCPF-MASHWEEQSA-N 342.298 1.987 10 10 EDCE O=C(NCCCSc1nccs1)N1CCOC[C@@H]1CCO 758581028 AVQSEGBVBWRRHS-NSHDSACASA-N 331.463 1.418 10 10 EDCE CCOC(=O)CC1(S(=O)(=O)NCc2c(O)cccc2F)CC1 921452171 GLUJYCMDGLBKEY-UHFFFAOYSA-N 331.365 1.437 10 10 EDCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NCC1COC1 858530497 GOTXNDDSQSJMNW-UHFFFAOYSA-N 341.358 1.247 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1c[nH]nc1[C@@H]1CCNC1 852805999 BERZJOODZHDGAY-CQSZACIVSA-N 327.432 1.791 10 10 EDCE Cn1ncc(C(F)(F)F)c1S(=O)(=O)NCCc1ccc(N)cc1 866761701 VJNWAFUNJGJCOI-UHFFFAOYSA-N 348.350 1.542 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@@H](C(F)F)CC3)cc2N1 866064495 RQJNVLGFCCOGAA-LLVKDONJSA-N 343.286 1.786 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)NCCc2ccc(O)c(O)c2)c1 767784652 FBWRPSLAJSIXCS-HYXAFXHYSA-N 341.367 1.225 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H](O)[C@@H](C)O)ccc21 871131539 XWIXYMFTGAUFRN-CXAGYDPISA-N 334.416 1.376 10 10 EDCE CC[C@H](CO)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 779827341 GPOILSNPUUNQFC-GOSISDBHSA-N 345.487 1.853 10 10 EDCE CC(F)(F)CN1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 1157352700 JQUNCEIEQJEVKJ-HWKANZROSA-N 326.343 1.910 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 1150771309 SKRJBIRBUTVYFR-CVEARBPZSA-N 348.443 1.524 10 10 EDCE CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)NCc1c(O)cccc1O 1304051132 VAMDWCZVSWLXLM-LLVKDONJSA-N 338.429 1.662 10 10 EDCE Cc1ccnc(NC(=O)CN(C)C(=O)c2c(F)ccc(O)c2O)c1 1183977619 OHEFBFSWKSWFPP-UHFFFAOYSA-N 333.319 1.651 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@@H](O)C2)cc1Br 2132134726 QFAAJCBYVKKLBI-KGLIPLIRSA-N 329.238 1.491 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CN2CCCNC2=O)cc1C 1268694285 KJUQKLMYTAIAGM-AWEZNQCLSA-N 348.447 1.013 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C2=COCCO2)cc1C 1273821711 BUGTWSIXIKIZFD-ONEGZZNKSA-N 332.400 1.654 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2cnnn2C)cc1C 1275394282 JXEHQWDBZJYHQY-QWHCGFSZSA-N 331.420 1.429 10 10 EDCE COc1cccc(CNC(=O)c2cccc3c2NC(=O)CO3)c1O 1445963947 BSVMACAVPGBWED-UHFFFAOYSA-N 328.324 1.662 10 10 EDCE Cc1ccc(CNC(=O)NCC(=O)NCc2c(O)cccc2F)cc1 1456109548 ZIGHDUJZFRLJFN-UHFFFAOYSA-N 345.374 1.955 10 10 EDCE Cn1cc([N+](=O)[O-])c(C(=O)NCc2ccc3cccnc3c2O)n1 1299721825 RUYNSMKFHLRKEM-UHFFFAOYSA-N 327.300 1.512 10 10 EDCE Cc1nc2ccccc2c(=O)n1CC(=O)NCc1cccc(O)c1O 1471641957 CWCVGOLKXPUCNS-UHFFFAOYSA-N 339.351 1.433 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)C2CC(C)C2)cc1C 1700937720 LTVMNBMYTXMSJC-IMRCBTMISA-N 334.460 1.959 10 10 EDCE CN(C[C@@H]1COc2ccccc2O1)C(=O)Cc1ccc(O)c(O)c1 1628489426 BHGCDGNVLMXFHA-CYBMUJFWSA-N 329.352 1.939 10 10 EDCE O=C(NCCCSc1nccs1)c1cn(C(F)(F)CO)nn1 1565620518 VBQWKMNHXSBNMX-UHFFFAOYSA-N 349.388 1.188 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccc(C)nc2)cc1C 1568550715 OCVUVFRKTHJPQF-KRWDZBQOSA-N 343.427 1.588 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)[C@@H](C)NC(C)=O)C2CC2)cc1C 1569293951 KYQZMSLCAGFRSP-DYVFJYSZSA-N 347.459 1.513 10 10 EDCE C[C@H]1C[C@@H]1C(=O)NC[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1738252146 CXCRCJOLPMNEFQ-MJVIPROJSA-N 345.403 1.987 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C2CC3(CC3)C2)cc(OC)n1 1737584725 HVIHJXMSIRTWDU-NSHDSACASA-N 347.415 1.524 10 10 EDCE Cc1ccc(O)c(CNC(=O)CNC(=O)c2ccc3c(c2)OCO3)c1 1584978885 ZZCLHYHJBCLBBE-UHFFFAOYSA-N 342.351 1.476 10 10 EDCE O=C(C[C@H](O)C(Cl)(Cl)Cl)NCc1cc(O)ccc1O 1593880977 AWDOVTLWMDBFPC-VIFPVBQESA-N 328.579 1.835 10 10 EDCE C[C@]1(O)CC[C@H](O)c2c1ccc1c2C(=O)C(=O)c2c(CO)coc2-1 102474699 GSUXVWUEFDCUBE-VOJFVSQTSA-N 328.320 1.853 10 10 EDCE biogenic CC[C@H]1C(=O)NCCN1c1ccc(CNC)cc1Br 233945809 RPDNNGJUPNXDFE-LBPRGKRZSA-N 326.238 1.883 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCCN=[N+]=[N-])[C@@H](CC(N)=O)C1 1902749370 WZNCDGJPFMHLOA-NSHDSACASA-N 326.401 1.484 10 10 EDCE CC(C)(C)OC(=O)NC1(CNC(=O)c2cccc(O)c2O)COC1 1962852541 MAUPAIKTPLATGN-UHFFFAOYSA-N 338.360 1.121 10 10 EDCE CNCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@H]32)c(Br)c1 2146685193 MHDPLCOPJKMRKK-NILFDRSVSA-N 341.249 1.897 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)COc2ccc(N)cc2)C1 1999132474 VSXWYFLRQMLEKH-ZDUSSCGKSA-N 335.404 1.773 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010391510 RVHJCONHXLISLW-NWDGAFQWSA-N 340.428 1.743 10 10 EDCE C[C@H](N[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)c1c(O)cccc1O 2011488581 XTNWTPYVXANWHR-COPLHBTASA-N 338.404 1.729 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]12C[C@](CNC(=O)OC(C)(C)C)(CO1)C2 2026198021 PSXLYFGNQCNWDU-GASCZTMLSA-N 339.396 1.829 10 10 EDCE NCc1cc(F)c(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)cc1Br 2173316894 HDXPFVQBJUVOMP-IIIJUWHMSA-N 345.212 1.367 10 10 EDCE CS(=O)(=O)c1cnn(Cc2c(O)cccc2Br)c1 2070217152 LRFQNPNWBCOXGL-UHFFFAOYSA-N 331.191 1.803 10 10 EDCE CNCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)cc1Br 2189069849 XKWDBGYNGZRELZ-JJLQDPRZSA-N 341.249 1.612 10 10 EDCE CN1CCO[C@H]2CN(c3ccc(CN)c(Br)c3)C[C@H]21 2097702561 IJESCCFZHJSEOU-KGLIPLIRSA-N 326.238 1.427 10 10 EDCE CSC[C@@H](N)C(=O)NCc1ccc(C)c(Br)c1O 2327591577 KLXSKHCFBVPHSK-SECBINFHSA-N 333.251 1.770 10 10 EDCE Cc1ccc(CN2CC3(CNC(=O)N3)C2)c(O)c1Br 2352650319 HTTRMDNPYIQIHW-UHFFFAOYSA-N 326.194 1.330 10 10 EDCE CCNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2354485797 RKJIWZVBRAZGGQ-FBUXBERBSA-N 341.249 1.489 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCO[C@H](Cn3cccn3)C2)c1O 175652055 XSMUCPAUPWHPNO-HNNXBMFYSA-N 333.363 1.831 10 10 EDCE Cc1ccnc(-n2c(C)cc(CN3CC[C@](N)(C(=O)O)C3)c2C)c1 67894671 KDTKQVGNCDFORW-GOSISDBHSA-N 328.416 1.785 10 10 EDCE CN1CCCc2cc(CNC(=O)N[C@@H]3CCC[C@H](C(N)=O)C3)ccc21 172572040 OONQVEIWKPAHDG-JKSUJKDBSA-N 344.459 1.912 10 10 EDCE Cc1ccc2c(c1)/C(=C1\SC(=S)N([C@@H](C)C(=O)O)C1=O)C(=O)N2 38185649 VWBAEVPDXVDJPP-QYQSLSSCSA-N 348.405 1.992 10 10 EDCE CCN[C@H](C)c1ccc(N2CC([C@@H](O)CO)C2)cc1Br 2361913565 OOVUPFVOULJLDP-BMIGLBTASA-N 343.265 1.909 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)/C=C/c1ccnn1C 32455151 ZLMQXUJESQEXJQ-BQYQJAHWSA-N 340.427 1.929 10 10 EDCE NC(=O)C[C@@H]1CCCCN1Cc1ccc(N2CCOCC2)c(F)c1 92588667 FJSSSQSVVPLVTJ-HNNXBMFYSA-N 335.423 1.892 10 10 EDCE CCS(=O)(=O)NCCN(C)c1cc(OC)c(OC)c(OC)c1 265980461 DXWPDAAUXFFACP-UHFFFAOYSA-N 332.422 1.088 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCOCC[C@H]3C)nc12 367667570 XGUPDEUFDUSYNB-LLVKDONJSA-N 334.376 1.222 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCCSCC1 284054054 MIWUJDRQIFUUDB-UHFFFAOYSA-N 347.484 1.869 10 10 EDCE COC[C@@H](C(N)=O)N(C)C(=O)c1sccc1-n1c(C)ccc1C 817940186 KOANEJNYWRTLIG-ZDUSSCGKSA-N 335.429 1.728 10 10 EDCE Cc1cc(CC(=O)N[C@H]2CCN(C)C2=O)c(C)n1-c1ccccc1 828382015 XOIIMUANHCOHRH-KRWDZBQOSA-N 325.412 1.984 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H]3CCCOC3)C2)cc1 823093679 GERWBOFWYFNIQM-GJZGRUSLSA-N 333.432 2.000 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)C3CCC3)C2)cc1 828309571 LEUCQCXDTYWRRN-UKRRQHHQSA-N 345.443 1.695 10 10 EDCE O=S1(=O)CCN(Cc2cc3c(cc2O)OCO3)[C@H]2CCC[C@H]21 825200353 DEUCZCRSHDLZNW-XHDPSFHLSA-N 325.386 1.272 10 10 EDCE COc1ccc(N2CCN(C(=O)CCc3cnn(C)n3)CC2)cc1 822196891 ADGKBNIXPLXQEM-UHFFFAOYSA-N 329.404 1.105 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1ccnc(S(C)(=O)=O)n1 839286163 MEVZFHFVLIPIPB-UHFFFAOYSA-N 348.428 1.185 10 10 EDCE CCCNC(=S)NCCN1CCN(c2ccc(OC)cc2)CC1 742910245 CQZOBKLNWIMFRJ-UHFFFAOYSA-N 336.505 1.691 10 10 EDCE CCO[C@@H](C(=O)N(CC(=O)O)Cc1ccccc1O)[C@H]1CCOC1 911492592 IGCKHNJULICKIE-XJKSGUPXSA-N 337.372 1.247 10 10 EDCE 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339.396 1.827 10 10 EDCE COCC1(O)CCN(c2ccc(CO)c(Br)c2)CC1 2095407746 GPLDTGKNGNOPJH-UHFFFAOYSA-N 330.222 1.919 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(NC(=O)c2ccc(O)c(O)c2)C1 2216764446 SFWPYCNVAVIUDI-PIGZYNQJSA-N 334.372 1.837 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2C[C@H](O)[C@@H]2OC)c1O 2271171428 UTKRBABTXXSVDX-GBIKHYSHSA-N 332.194 1.401 10 10 EDCE CN(Cc1nn(C)nc1Br)c1c(F)cc(CO)cc1F 2235266583 LXSVLUCEIQTATD-UHFFFAOYSA-N 347.163 1.985 10 10 EDCE COc1ccc(Br)c(CNCCn2cnnc2)c1O 2227745705 AJRBTSDXMYCTLB-UHFFFAOYSA-N 327.182 1.545 10 10 EDCE COc1ccc(Br)c(CNCc2nc(O)n[nH]2)c1O 2227747714 FGAHYEOCUMQWAY-UHFFFAOYSA-N 329.154 1.277 10 10 EDCE OCC1(O)CN(c2ccc(CNC3CCC3)cc2Br)C1 2240026291 MFBOKTCHURJBBK-UHFFFAOYSA-N 341.249 1.635 10 10 EDCE COc1ccc(N2CCN(C(=O)NCC(=O)NC(C)C)CC2)cc1 54399416 XBJADFQLKLYVLT-UHFFFAOYSA-N 334.420 1.051 10 10 EDCE CCN(CC)c1ccc(CN2CCC[C@]3(C2)NC(=O)NC3=O)cc1F 193472661 QSZPUUBQNWLYPH-GOSISDBHSA-N 348.422 1.846 10 10 EDCE Cc1cc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cnn1 276113327 UZLWWBJZSKNWIK-UHFFFAOYSA-N 326.400 1.894 10 10 EDCE Cc1ccc(CN2CCN([C@@H](C)CO)CC2)c(O)c1Br 2380813158 DCJDREKAIRPPCA-LBPRGKRZSA-N 343.265 1.962 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CN[C@H]3C[C@@H]4C[C@@H]4C3)CC2)cc1 819383866 SPXXOGASJBBUDU-ZMMAXQRCSA-N 345.487 1.566 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2C)CCO1 734687408 ZCWVGFJATJCVAL-HNNXBMFYSA-N 335.404 1.144 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)C1C[C@H]2CNC[C@@H](C1)C2=O 830597865 URLWTSNHLNJKBK-GOOCMWNKSA-N 342.439 1.702 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@H]3C[C@@H]3C2)cc1F 834678286 UCKLALRBBPSSKY-BFHYXJOUSA-N 333.407 1.813 10 10 EDCE COC(C)(C)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 730747374 PCJBLYWBPVYFFP-CQSZACIVSA-N 333.432 1.430 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CCn4nncc4C3)ccc21 847302425 IPXXANTUJAOALZ-UHFFFAOYSA-N 326.404 1.386 10 10 EDCE Cn1nccc1[C@H]1COCCN1Cc1ccc(N2CCOCC2)cc1 846116636 WACVGQYKJUKOLG-LJQANCHMSA-N 342.443 1.830 10 10 EDCE C[C@@]1(Br)C[C@H]1C(=O)N(CC(=O)O)Cc1ccccc1O 911488743 NOGHAMUVHGEDRI-IINYFYTJSA-N 342.189 1.979 10 10 EDCE Oc1ccccc1CN(C[C@H]1CCCO1)C[C@H]1CC2(CNC2)CO1 923298826 KWVVWUPTTQMYGD-IAGOWNOFSA-N 332.444 1.752 10 10 EDCE CO[C@@H](CS(=O)(=O)N(C)Cc1ccccc1O)[C@@H]1CCOC1 849376149 LZMLMWUTORNZEK-HIFRSBDPSA-N 329.418 1.205 10 10 EDCE CCN(C)C(=O)[C@H](C)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852273931 AGCVLEMLPREPAI-UONOGXRCSA-N 348.447 1.440 10 10 EDCE CNC(=O)CCOC1CCN(Cc2cc3c(cc2O)OCO3)CC1 751953167 STAYURATAUYOBF-UHFFFAOYSA-N 336.388 1.238 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3c(C)nc(N)nc3C)C2)cc1 855228308 ZFNVCMHSSHTODI-ZDUSSCGKSA-N 341.415 1.693 10 10 EDCE CC[C@H](NC1CN(S(=O)(=O)N(C)C)C1)c1ccc(F)cc1O 858572224 QHNXQCKKBBAPQS-ZDUSSCGKSA-N 331.413 1.063 10 10 EDCE Oc1ccc(Cl)cc1CN[C@@H]1CCN(c2ccc3nncn3n2)C1 858243630 MELQOZCUNFVLBL-CYBMUJFWSA-N 344.806 1.852 10 10 EDCE CO[C@@H](C(=O)NCc1ccc(N(C)C)c(F)c1)C(=O)OC(C)(C)C 865050996 GRDBLWLBFOUTJQ-AWEZNQCLSA-N 340.395 1.865 10 10 EDCE CCN1C[C@@H](S(=O)(=O)NCCCSc2nccs2)CC1=O 866781451 KIEGCACDPHIFFW-JTQLQIEISA-N 349.503 1.166 10 10 EDCE CC(=O)NCC1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761887836 PXTKMLNCXRKQRY-UHFFFAOYSA-N 348.359 1.278 10 10 EDCE CO[C@H](C(=O)NCc1ccc2cccnc2c1O)C(=O)OC(C)(C)C 868937469 JTOZBLLGBUVYRX-OAHLLOKOSA-N 346.383 1.913 10 10 EDCE C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@@H](c2ccn(C)n2)C1=O 761576490 NHCHIRSQQRYQCK-NHYWBVRUSA-N 327.388 1.840 10 10 EDCE CCNC(=O)C[C@H]1CCCCN1Cc1cc2c(cc1O)OC[C@H]2O 789521903 UVDJHVKCFOPFSF-CZUORRHYSA-N 334.416 1.699 10 10 EDCE COCCN(Cc1cc(OC)c(OC)cc1O)Cc1ccnn1C 787332634 SOTNJOKAJWSKIX-UHFFFAOYSA-N 335.404 1.792 10 10 EDCE CNC(=O)c1ccc(S(=O)(=O)Nc2ccc(O)c(OC)c2)cc1 797819983 ZVSCULQJHAMQEF-UHFFFAOYSA-N 336.369 1.561 10 10 EDCE CO[C@H]1CC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1326205409 WRVPNAGNRLFYPL-ONGXEEELSA-N 328.390 1.061 10 10 EDCE COc1cc(COCC(=O)NCc2ccc(N(C)C)cc2)ccn1 1329626363 NVXUEOZIYBNWLQ-UHFFFAOYSA-N 329.400 1.989 10 10 EDCE C[C@@H]1COCC[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1323983607 KJLSLSGPSOPMQE-CZUORRHYSA-N 333.432 1.252 10 10 EDCE CNC(=O)NCCC(=O)N[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1265536950 GDDVIGYBRFWMPO-GASCZTMLSA-N 348.447 1.060 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)CN2CCOCC2)cc1C 1275960930 CVPYPOGPKPERGV-UHFFFAOYSA-N 349.475 1.274 10 10 EDCE CC(C)(O)[C@H](Oc1ccccc1)C(=O)NCc1cccc(O)c1O 1350299772 ISSHJEGAMJLPDC-MRXNPFEDSA-N 331.368 1.933 10 10 EDCE COc1ccc(O)c([C@@H](C)N[C@H](C)c2nc(-c3nc[nH]n3)no2)c1 1459848877 HUOJJGQZXACDRW-RKDXNWHRSA-N 330.348 1.981 10 10 EDCE CCNCc1ccc(N2CC(CO)(CO)C2)c(Br)c1 1914987624 YTLIYTIAMDEVKT-UHFFFAOYSA-N 329.238 1.350 10 10 EDCE CC(=O)N1CC[C@@](C)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1536925689 POIWLVDYUIBENG-INIZCTEOSA-N 331.376 1.837 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)C2CC(C)C2)cc1C 1700025683 LYMKZKLRBNHJDN-UHFFFAOYSA-N 334.460 1.960 10 10 EDCE CCN(CC)[C@@H]1[C@H]2OC[C@@H](O2)[C@@H](NCc2ccc(N(C)C)cc2)[C@@H]1O 1616153591 XOVRJOQYGFQUEF-GFEQUFNTSA-N 349.475 1.037 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2COC(=O)N2)cc1C 1480761606 HVGOCJGMWUKROQ-JSGCOSHPSA-N 335.404 1.096 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)CNC(C)=O)C2CC2)cc1C 1566701919 KFPILLLLBVVUML-INIZCTEOSA-N 333.432 1.124 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cc2n(n1)CCC[C@H]2O 1639625099 XICGXCVGSLQIDT-OAHLLOKOSA-N 338.367 1.894 10 10 EDCE O=C(COCCNC(=O)c1ccccc1)NCc1c(O)cccc1O 1635847860 UONFIJCGMGAHJN-UHFFFAOYSA-N 344.367 1.161 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1C[C@H](c2ccccc2)[C@](F)(CO)C1 1641673923 UYLQXDYREMTWDW-DNVCBOLYSA-N 345.370 1.967 10 10 EDCE CC(=O)Nc1cccc(NC(=O)CCN2C(=O)CSC2=S)c1 1865768079 ITMJNYGFOMGZHM-UHFFFAOYSA-N 337.426 1.834 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)cc1Br 2140664547 RHQVGWUBMMLDSR-FFAVSVRISA-N 333.201 1.349 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)C1(F)F 1985095617 GZCBUAWOIPSZDQ-BDAKNGLRSA-N 331.323 1.914 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1986369479 SYFNTEWRNJINBC-QWRGUYRKSA-N 327.385 1.421 10 10 EDCE CNCc1ccc(N2CC[C@@](CO)(CCO)C2)c(Br)c1 2153355883 MSCPWBAAFVGPSZ-OAHLLOKOSA-N 343.265 1.740 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)c1cn(C)[nH]c1=NC(=O)OC(C)(C)C 2010391837 VRONZZSHXDEIRS-UHFFFAOYSA-N 337.384 1.961 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC(N=[N+]=[N-])CC1)C(C)(C)O 2014483204 QBWDXWZDTKKRGP-NSHDSACASA-N 341.412 1.952 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)c(Br)c1 2158406578 ARVXRDCFODMUEU-QFEPDWEUSA-N 341.249 1.925 10 10 EDCE Nc1ccc(CS(=O)(=O)N=c2nc(Br)[nH]s2)cc1 2047599333 XDUOWFPLJPFBQG-UHFFFAOYSA-N 349.235 1.247 10 10 EDCE O=C1NC[C@@H]2CN(Cc3cccc(Br)c3O)CC[C@H]12 2100946534 YYIGGAKBTYVCQT-MNOVXSKESA-N 325.206 1.723 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)NCCc2ccc(N)cc2)C1 2080826237 FCDOTVJKCLPMPJ-UHFFFAOYSA-N 349.431 1.157 10 10 EDCE CN[C@@H](C)c1ccc(N(C)CC(CO)CO)cc1Br 2094031196 SPYUUCBWIGJHKN-JTQLQIEISA-N 331.254 1.767 10 10 EDCE CS(=O)(=O)CCN(c1ccc(CO)cc1Br)C1CC1 2113813862 LTEIITWTWZWVTE-UHFFFAOYSA-N 348.262 1.955 10 10 EDCE COc1ccc(Br)c(CN2CC[C@@](O)(C(=O)O)C2)c1O 2236035742 AKQPTVJJNFCLMH-ZDUSSCGKSA-N 346.177 1.185 10 10 EDCE COC[C@H]1C[C@@H](CN)N(Cc2ccc(Br)cc2O)C1 2273821731 CVMDCJGTIVZSRT-GWCFXTLKSA-N 329.238 1.950 10 10 EDCE NCc1ccc(N2C[C@@H]3OCC[C@]3(CO)C2)c(Br)c1 2278920990 GXZKSNWJTHTHMU-UONOGXRCSA-N 327.222 1.495 10 10 EDCE CC[C@@]1(NCc2c(Br)ccc(OC)c2O)CCNC1=O 2288919889 YATQOAZYXLUNDV-CQSZACIVSA-N 343.221 1.922 10 10 EDCE CCN1C(=O)C(=Cc2cc(C)n(CCOC)c2C)C(=O)NC1=S 2313656539 BHXNITIOKANZDS-UHFFFAOYSA-N 335.429 1.398 10 10 EDCE Cc1ccc(CN(C)CC(=O)NCCO)c(O)c1Br 2352633020 DWEVXADAMXGDNO-UHFFFAOYSA-N 331.210 1.003 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC/C=C/CNC[C@H]2CCOC2)cc1 1268631991 GJXKBZVIMVSFND-ZKRLOSADSA-N 345.403 1.761 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCCN(CCO)CC2)c([N+](=O)[O-])c1 171681890 QUAFSSUCQAWJFU-GQCTYLIASA-N 349.387 1.285 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC([C@@H]2CCCN2)CC1 1261875792 RBGIZCPGENLVKM-INIZCTEOSA-N 343.427 1.225 10 10 EDCE COc1cc(O)c(CN2CCC(N3CCNC3=O)CC2)cc1OC 271073302 FXXJNEXPTSPMFJ-UHFFFAOYSA-N 335.404 1.399 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3CCOC[C@@H]3C)CC2)cc1 279801977 DWUANLRHCJYBHL-QFBILLFUSA-N 333.476 1.832 10 10 EDCE CCn1c(O)nnc1C1CCN(C(=O)c2cccc(O)c2O)CC1 377046805 NERDCMDLUZAHNQ-UHFFFAOYSA-N 332.360 1.435 10 10 EDCE CC[C@@H](NC(C)=O)C(=O)NCc1ccc(C)c(Br)c1O 2380723654 WEYAFYCKOHPUHV-LLVKDONJSA-N 343.221 1.994 10 10 EDCE O=C1CC[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)CCN1 815046145 JPIRDGIYOICZTQ-HNNXBMFYSA-N 347.484 1.772 10 10 EDCE Cc1ccc(O)c([C@@H](C)NC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c1 715549526 LSKPVTGLAPIKFW-GFCCVEGCSA-N 349.431 1.826 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H]2CC[C@@H](C2)C1 828437894 ROBDSABXIMXGCX-GJZGRUSLSA-N 329.444 1.936 10 10 EDCE C/C=C\[C@@H](O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 901288640 YOKZUAYWHKFVNT-FFPCURRISA-N 343.471 1.772 10 10 EDCE C[C@@H]1CCNC[C@H]1NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 841975444 GEXHUYZWTFZIFX-CRAIPNDOSA-N 346.475 1.663 10 10 EDCE CO[C@H](CN1C(=O)CN(Cc2ccccc2O)C1=O)[C@@H]1CCOC1 849357478 MPCAPMXHWHIKLL-UKRRQHHQSA-N 334.372 1.208 10 10 EDCE COC(=O)c1cc(/C=C2/SC(N3CCOCC3)=NC2=O)c(C)o1 848638851 MPIVKOWTNVRWNU-XYOKQWHBSA-N 336.369 1.677 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)Cn3cccn3)C2)cc1 851978623 NSGRILKFCFJBQS-LSDHHAIUSA-N 343.431 1.858 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)NCc2ccc(N(C)C)cc2)CS1(=O)=O 853245459 ZQIGCBWNQFIASX-OCCSQVGLSA-N 339.461 1.518 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3C[C@@H](N)C34CCC4)CC2)cc1 925508622 RRRINKCZRCNAKR-MOPGFXCFSA-N 344.503 1.677 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCN[C@H]2C)cc1 861767524 QUXCDSSTADRNJV-XJKSGUPXSA-N 332.448 1.016 10 10 EDCE O=C1N=C(N2CCCCC2)S/C1=C\c1cn(C[C@H]2CCOC2)nn1 865219263 XMXSOYBAJFHQCU-UGMNDJHYSA-N 347.444 1.771 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)/C=C/CN3CCOCC3)C2)cc1 869228042 FNGCEFOFFBYHGW-KZSQQDEKSA-N 345.443 1.279 10 10 EDCE CCN1C[C@H](S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)CC1=O 866842166 SKOHPRBONOQZJN-ZYHUDNBSSA-N 342.417 1.002 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](O)C3CCC3)CC2)c(OC)c1 870166078 UAOCODQNYQGGDW-KRWDZBQOSA-N 334.416 1.513 10 10 EDCE CS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccc(O)cc1F 780837321 GBIIITAWIQYCSF-UHFFFAOYSA-N 345.373 1.736 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)c2cccc(O)c2O)c2ccc(F)cc2O1 1144519045 ANRJNQMTCLNGNS-AWEZNQCLSA-N 347.298 1.818 10 10 EDCE C[C@H]1COCC[C@H]1NC(=O)C(=O)NCCCSc1nccs1 1323025996 LASDRLQAVNJJSO-WDEREUQCSA-N 343.474 1.283 10 10 EDCE CC[C@@H](CNC(=O)Cn1ccnc1)NCc1ccc(OC)c(C)c1 1267831755 TXBXQVRESDWYBB-INIZCTEOSA-N 330.432 1.885 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)NC3C[C@H]4C[C@@H]4C3)ccc21 1349022251 BIBZAYDHIALYKT-HUUCEWRRSA-N 327.428 1.600 10 10 EDCE COCCn1cc(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)nn1 1351671970 BTSJMGVEFUFWJJ-UHFFFAOYSA-N 343.431 1.797 10 10 EDCE Nc1ccc(OCCNC(=O)c2c[nH]nc2Br)cc1 2134188890 IDPBOXDNWKXOQI-UHFFFAOYSA-N 325.166 1.563 10 10 EDCE COc1cccc(-c2nnn(CC(=O)c3ccc(O)c(O)c3)n2)c1 1458826092 JIUZIILYMHXQDV-UHFFFAOYSA-N 326.312 1.643 10 10 EDCE O=C(NCc1c(O)cccc1O)C1CCC(NC(=O)C2CC2)CC1 1456315731 KLOMNSWLSYJNKW-UHFFFAOYSA-N 332.400 1.799 10 10 EDCE CCO[C@@H](C)c1noc(CN(C)C(=O)Cc2ccc(O)c(O)c2)n1 1465407644 PYVREZPARYAVGQ-JTQLQIEISA-N 335.360 1.779 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2ccncn2)cc1C 1486305784 MYSIBTBUMOUSDA-HNNXBMFYSA-N 344.415 1.016 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@]2(C)CCC(=O)NC2)cc1C 1714748300 KBTYHWOPUBZAHT-LJQANCHMSA-N 347.459 1.468 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@H](C)NC(C)=O)C2CC2)cc1C 1480001784 QHXCBUFBMFANEQ-GUYCJALGSA-N 347.459 1.513 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)Cc2nonc2C)cc1C 1485210083 NEAVBSMLCZFWSX-OLZOCXBDSA-N 346.431 1.921 10 10 EDCE Cn1cc(-c2nc(C(=O)NCc3ccc(O)cc3O)cs2)cn1 1639444782 ZISMQYCPUDTBAL-UHFFFAOYSA-N 330.369 1.885 10 10 EDCE C[C@@H](C(=O)NCc1cccc(O)c1O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1633509307 SSIWRYXPBOQLHI-WCFLWFBJSA-N 346.383 1.278 10 10 EDCE CC(C)(C)C(=O)NCC(=O)OCCC(=O)NCc1ccccc1O 1630363672 XMZLHTVPXKBFHX-UHFFFAOYSA-N 336.388 1.104 10 10 EDCE COc1cc(CCNC(=O)NCc2cccc(OC)c2O)ccn1 1565177234 KPFOODBJYRVUPN-UHFFFAOYSA-N 331.372 1.846 10 10 EDCE COCCNC[C@@](C)(NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1732251767 BKXAXXIPIPNQRW-QGZVFWFLSA-N 347.419 1.984 10 10 EDCE CN1C[C@H](C(=O)NCc2cc(O)ccc2O)c2ccccc2C1=O 1644754460 XWELBEWOTNRYPW-HNNXBMFYSA-N 326.352 1.583 10 10 EDCE O=C(CN1CCc2ccccc2C1=O)NCc1c(O)cccc1O 1652625287 ABAMGLLZDYEAGK-UHFFFAOYSA-N 326.352 1.413 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)CN(C)C(C)=O)cc1C 1666516157 YZIMCLFRHMWWQX-CYBMUJFWSA-N 335.448 1.324 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cn(C)c(O)n2)cc1C 1662329861 NUHQLFJFKJTTAF-GFCCVEGCSA-N 332.404 1.351 10 10 EDCE CCCn1nccc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 151462164 LPFIAUNJLSKUGP-UHFFFAOYSA-N 343.431 1.956 10 10 EDCE C[C@@H](N[C@@H]1CCC(=O)N(C)C1)c1ccc(N2CCOCC2)c(F)c1 152491836 XRSLZWLELCGJON-UKRRQHHQSA-N 335.423 1.934 10 10 EDCE CC(C)(C)OC(=O)NCCOCCNCc1ccc(O)cc1O 1939421781 SPDQJIXAZRGDTH-UHFFFAOYSA-N 326.393 1.729 10 10 EDCE CN(CCN=[N+]=[N-])CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1 1982240452 CFXPAAQOZDWQFM-UHFFFAOYSA-N 326.401 1.308 10 10 EDCE 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EDCE CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1440745784 ILUNBYAVHXRTIC-JQWIXIFHSA-N 338.429 1.457 10 10 EDCE COc1cc(C(=O)N[C@H](C)CCNC(=O)c2cnco2)cc(OC)n1 1704143838 LTCCUDOAVTXNSK-SNVBAGLBSA-N 348.359 1.025 10 10 EDCE C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1544115753 UIQSJFGSFHNTJK-NXEZZACHSA-N 338.389 1.497 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2[nH]nnc2C)cc1C 1714420400 SJWLQQQUEVZQAW-NSHDSACASA-N 331.420 1.586 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C23CCN(CC2)C3)cc1C 1715955943 SRSRWRDFXLNNQX-OAHLLOKOSA-N 331.460 1.694 10 10 EDCE O=C(CNC(=O)c1ccc(F)c(F)c1)NCc1c(O)cccc1O 1558534894 YZLICMZXWZVIIY-UHFFFAOYSA-N 336.294 1.422 10 10 EDCE CCN(CCCNC(C)=O)Cc1nnnn1-c1ccc(OC)cc1 1566537536 UTLPTSUUBNHHCK-UHFFFAOYSA-N 332.408 1.019 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1cccnc1OCC(F)F 1567204346 KTDQKUPLSGOSBC-UHFFFAOYSA-N 338.310 1.996 10 10 EDCE Cc1cc(C(=O)NCc2cc(O)ccc2O)c2c(C)nn(C)c2n1 1637122631 KSJQAJNQIXKSTP-UHFFFAOYSA-N 326.356 1.926 10 10 EDCE CN(C)[C@]1(C(=O)NCc2c(O)cccc2O)COc2ccccc2C1 1635847432 NWQVIBXHJXJCRU-IBGZPJMESA-N 342.395 1.650 10 10 EDCE NC(=O)CCNC(=O)c1cccc(NC(=O)c2cc(O)cs2)c1 1632548101 MZTITVAKURKBTC-UHFFFAOYSA-N 333.369 1.311 10 10 EDCE COCCNC[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1C 1733557999 GIVDGFFBSATXAI-OCCSQVGLSA-N 347.419 1.793 10 10 EDCE CNC(=O)c1ccccc1N(C)C(=O)/C=C\c1cnc(OC)nc1 1584257702 WFRSPDMZTDOGME-HJWRWDBZSA-N 326.356 1.521 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C[C@@H](C)C2CC2)cc(OC)n1 1758780480 JMAFJBBLVSCWNB-NEPJUHHUSA-N 349.431 1.770 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2cncn2C)cc1C 1774120705 BKMBSADYPFACDN-AWEZNQCLSA-N 330.432 1.987 10 10 EDCE O=C1c2cccc(NCCO)c2C(=O)c2cccc(NCCO)c21 5933616 NHCOLOILTUTOLA-UHFFFAOYSA-N 326.352 1.270 10 10 EDCE O=C(NCCNC(=O)c1cc(O)c(O)c(O)c1)c1cccc(F)c1 169839071 JKWYIMGHDNIDED-UHFFFAOYSA-N 334.303 1.102 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cc(C)nnc3O)CC2)cc1 1858181945 WTAPDRUTXQRCCF-UHFFFAOYSA-N 328.372 1.462 10 10 EDCE COCCN(C)C1CN(c2ccc(CN)cc2Br)C1 1877449550 AIUMFOOPRBFIFA-UHFFFAOYSA-N 328.254 1.675 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](NCc2ccc(O)c(O)c2O)CCO1 1949591038 KBMSRUNXSLQXGC-NSHDSACASA-N 340.376 1.834 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@@H]1C(=O)NCCCCN=[N+]=[N-] 1985096259 OTQIOPDFDYVSIA-QWRGUYRKSA-N 327.385 1.875 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](C(CO)CO)C2)c(Br)c1 2170642225 ISGMMKQRCCQPCP-ZYHUDNBSSA-N 344.249 1.930 10 10 EDCE CN(CCOCc1ccccc1)C(=O)[C@@H](N)Cc1ccc(O)c(O)c1 383999512 DAPSFEFIYNWOIW-INIZCTEOSA-N 344.411 1.643 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CNC(=O)Cc2ccc(N)cc2)C1 2044229246 SYGZMXIEUMDKJB-GOSISDBHSA-N 349.431 1.299 10 10 EDCE C[C@@H](N)c1ccc(N(CCO)CCN(C)C)cc1Br 2099357783 RZQLNAALIHIWLY-LLVKDONJSA-N 330.270 1.829 10 10 EDCE COc1ccc(Br)c(CN2CC=C[C@H]2C(=O)O)c1O 2227745422 WSJSNMKSOHRORC-JTQLQIEISA-N 328.162 1.988 10 10 EDCE CSc1ncc(CNS(=O)(=O)C[C@@H]2N[C@H]3CC[C@H]2C3)s1 2284499507 PFWQEXBIMKZOMA-QXEWZRGKSA-N 333.504 1.425 10 10 EDCE CC(C)c1cccc(N(C)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c1 491197885 AHIAZYYOYQVEGN-KTKRTIGZSA-N 341.411 1.884 10 10 EDCE CCOc1ccccc1N(C)C(=O)C=Cc1cn(C)c(=O)n(C)c1=O 2303931714 HCGHETBYJDJWAB-UHFFFAOYSA-N 343.383 1.159 10 10 EDCE O=C(C=Cc1ccncn1)NCc1ccc(N2CCOCC2)c(F)c1 2308511023 SLNGOEKTKBQNMY-UHFFFAOYSA-N 342.374 1.782 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)c(Br)c1 2331966001 YQTNHBUFHIPRRS-GJQVQUKXSA-N 327.222 1.371 10 10 EDCE C[C@@H](N)c1ccc(N2CC(O)(CN(C)C)C2)cc1Br 2343637080 YHWQENFGPUSPNU-SNVBAGLBSA-N 328.254 1.582 10 10 EDCE COC(=O)c1cn(CN2CCCN(c3ccc(OC)cc3)CC2)nn1 54570519 CKIWWHDPVKBPRN-UHFFFAOYSA-N 345.403 1.243 10 10 EDCE C[C@@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)cc1Br 2357056514 KNLOKVZNYDKAAK-CNSIFVFBSA-N 341.249 1.932 10 10 EDCE CCc1noc([C@H](C)N2CCN(C(=O)c3cccc(O)c3O)CC2)n1 193065085 NUZULZJHLMBPEU-NSHDSACASA-N 346.387 1.562 10 10 EDCE Cc1cc(C(=O)NC[C@@H](C)O)c(C)n1-c1ccc2c(c1)OCCO2 97177892 MCKPGDNRNPXKSP-GFCCVEGCSA-N 330.384 1.976 10 10 EDCE COC[C@]1(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)CCOC1 819587940 QWZAXSSIWKIYRC-DNVCBOLYSA-N 348.443 1.691 10 10 EDCE COCCCOc1ccccc1NC[C@@H](O)CN1CCN(C)CC1 819422222 SPGFUVNPZWLCQW-MRXNPFEDSA-N 337.464 1.122 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=O)c1c(F)ccc(O)c1O)C2 822485227 IPDSOSWBNGGQDV-GDPRMGEGSA-N 338.335 1.586 10 10 EDCE O=C1OCCN1C[C@@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 824451209 ORTXLHONWHPEAC-QGZVFWFLSA-N 345.443 1.797 10 10 EDCE Cc1nnc(NC(=O)Cn2ccc(-c3cccnc3)cc2=O)s1 821184834 BKDWXOQPHZLEAI-UHFFFAOYSA-N 327.369 1.709 10 10 EDCE CN1CCCc2cc(CNC(=O)NCC[C@H]3CNC(=O)C3)ccc21 915390853 SLAMIKPNKDCZSE-CQSZACIVSA-N 330.432 1.394 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@]3(CCCNC3)C2)cc1 844224633 RYFBTTYWYFSNPE-LJQANCHMSA-N 330.476 1.444 10 10 EDCE COCCNC1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 844903103 RXJVAOCJZKXLSE-UHFFFAOYSA-N 333.476 1.724 10 10 EDCE Cn1cc(N2CCC[C@H](N3CCCc4cc(CN)ccc43)C2=O)cn1 844218528 BSHWJCAPVBGIKR-SFHVURJKSA-N 339.443 1.827 10 10 EDCE CNC1CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 844218558 COFOJCJMGCWGHS-UHFFFAOYSA-N 346.475 1.028 10 10 EDCE C[C@@H](NC(=O)NCC(C)(C)CS(C)(=O)=O)c1ccccc1O 926750369 ZXQUZWFFOMSXFC-LLVKDONJSA-N 328.434 1.823 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@@H]1C[C@@H](O)C12CCC2 852584453 NNEYNXTXJBEVHX-IAGOWNOFSA-N 331.460 1.604 10 10 EDCE COc1ccc(N2CCCN(C(=O)N[C@@H]3CCN[C@H]3C)CC2)cc1 861701704 VWQKRJPBGRSZNG-WMLDXEAASA-N 332.448 1.667 10 10 EDCE Cc1cn2c(n1)C[C@@H](C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)CC2 860697433 WKQCHAMGJUQAEH-FZMZJTMJSA-N 329.400 1.913 10 10 EDCE COc1cc(Br)cc([C@@H](C)N[C@@H]2CCOC[C@H]2O)c1O 872140573 RFHPDUYYOSWAOI-GGZOMVNGSA-N 346.221 1.964 10 10 EDCE C[C@H](NC(=O)N1CCN(C2CC2)C(=O)C1)c1ccc(N(C)C)cc1 773622929 ISHSQYPFNVTGPW-ZDUSSCGKSA-N 330.432 1.830 10 10 EDCE Cc1ccc(C(=O)NCc2ncccc2S(C)(=O)=O)c(O)c1O 787713876 SHHUKPBHGUWIJV-UHFFFAOYSA-N 336.369 1.135 10 10 EDCE COC(=O)[C@H](NC(=O)c1ccc(C)c(O)c1O)c1cccc(O)c1 780999969 RRFJUPMSGGECSC-CYBMUJFWSA-N 331.324 1.756 10 10 EDCE COC(=O)[C@H]1CN(C(=O)/C=C\c2cnn(C)c2)c2ccc(F)cc2O1 1130592204 DUADEZHGVUBERA-OMVNSRBRSA-N 345.330 1.540 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1CN2CCCN1CC2 706881760 ZYVRGXQPQWZZKR-GFCCVEGCSA-N 340.265 1.634 10 10 EDCE COc1cc(NS(=O)(=O)c2cccc(-n3cnnn3)c2)ccc1O 797820213 LSQHEASBGJVLKH-UHFFFAOYSA-N 347.356 1.177 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)c2ccc(CO)nc2)N(C)C)cc1 1158716864 HZEMFGDOGOCXGM-SFHVURJKSA-N 342.443 1.673 10 10 EDCE O=C(CCc1nc(-c2ccco2)no1)NCc1cc(O)ccc1O 1176748369 QLNXXGLGTDHAOF-UHFFFAOYSA-N 329.312 1.990 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccccn2)cc1C 1331662194 GENXLHNOEPNUMH-HNNXBMFYSA-N 329.400 1.279 10 10 EDCE Cc1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ncc1C(N)=O 1611430874 HULYDDUVVKSOMV-JTQLQIEISA-N 329.356 1.261 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CC[C@@H](C(F)(F)F)[C@H](CO)C1 1472559593 HKRGTFFJZUWPLV-JGVFFNPUSA-N 337.269 1.870 10 10 EDCE COC(=O)c1ccc2c(c1)NC(=O)CN2C(=O)/C=C\c1cnn(C)c1 1544608977 BPCMSDHHBRKIPY-UTCJRWHESA-N 340.339 1.205 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cccc(Nc3nn[nH]n3)c2)cc1 1623316492 VVHAHJLOSJYAQK-UHFFFAOYSA-N 337.387 1.939 10 10 EDCE Cn1c(CC(=O)NCc2c(O)cccc2O)nnc1-c1ccccc1 1558535809 OWUPVPDAUIZBAY-UHFFFAOYSA-N 338.367 1.752 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1ccn(CCn2cccn2)n1 1631155321 UGUVLUXCPCDLJR-UHFFFAOYSA-N 325.372 1.758 10 10 EDCE CC(C)(C)OC(=O)[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CCO1 1566239679 OCZGPBMFFSUPFM-AWEZNQCLSA-N 337.372 1.209 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CCCN1C(=O)C(F)(F)F 1639292961 XIBIXRINCHOFLU-VIFPVBQESA-N 332.278 1.267 10 10 EDCE Cc1nc2ccnn2cc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 1567467233 FFQSFWNLJQNWLX-JTQLQIEISA-N 326.356 1.810 10 10 EDCE COc1c[nH]c(C(=O)NCc2ccc3cccnc3c2O)cc1=O 1570533930 XDHTYZGXPQBRSE-UHFFFAOYSA-N 325.324 1.567 10 10 EDCE O=C(Cn1cccc(C(F)(F)F)c1=O)NCc1cc(O)ccc1O 1644752704 QLRZIPOXTYRJIM-UHFFFAOYSA-N 342.273 1.595 10 10 EDCE COC(=O)[C@H]1C[C@@H]1C(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 1699646891 GMHMMVHJANERMA-GJZGRUSLSA-N 346.427 1.551 10 10 EDCE CC(=O)N1C[C@H]2C[C@H]1CN2c1ccc(CO)c(Br)c1 1877062293 ACPSMTXJJOWUAB-QWHCGFSZSA-N 325.206 1.751 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC(N=[N+]=[N-])CC1 1990033729 YHZIWFYWXMHQAH-NSHDSACASA-N 327.385 1.563 10 10 EDCE CNCc1ccc(N2CC[C@@](CO)(CCO)C2)cc1Br 2153356535 SBYJOEADCSEOEN-OAHLLOKOSA-N 343.265 1.740 10 10 EDCE CN(C)c1ccc(CN=c2[nH]c(NN)ncc2Br)cc1 2160472424 NMHCQFXHRQFTCY-UHFFFAOYSA-N 337.225 1.625 10 10 EDCE O=C(O)C[C@H]1COCCN1Cc1cc(Br)cc(F)c1O 715770288 OZDBMGQWVXFCGK-JTQLQIEISA-N 348.168 1.969 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@H]2C3)c(Br)c1 2173316625 DFDFXLNKVFYRGG-REYDYLPWSA-N 341.249 1.789 10 10 EDCE Nc1ccc(OCCC(=O)N(OCc2ccccc2)C2CNC2)cc1 2071704035 SDYNDPMHDQWOCE-UHFFFAOYSA-N 341.411 1.970 10 10 EDCE CN(C)c1ccc([C@H](N)[C@@](O)(CF)CNC(=O)OC(C)(C)C)cc1 2246678723 AMHSJAAOIXYTMI-WMLDXEAASA-N 341.427 1.978 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)C[C@H]21 2249687444 YHOGZDKBORMZJN-XGFWRYKXSA-N 336.432 1.898 10 10 EDCE CCOc1cc2c(cc1C=C1C(=O)NC(=S)N(C)C1=O)OCO2 2294216496 OMSYOVUUYGZUKI-UHFFFAOYSA-N 334.353 1.071 10 10 EDCE CCS(=O)(=O)C1=NSC2=NC(=O)/C(=C\c3ccco3)C(=N)N21 20206596 XOEXUIIWIFLIEQ-IOAGGNQZSA-N 338.370 1.291 10 10 EDCE N[C@@]1(C(=O)O)CCCc2cc(I)cc(O)c21 309568383 VALLVPVMSGUAOF-NSHDSACASA-N 333.125 1.572 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CCCN(c3ncccn3)C2)c(O)c1O 182119964 HFTGZBATSMALRU-LBPRGKRZSA-N 328.372 1.595 10 10 EDCE CN(Cc1ccccc1O)C(=O)C1CCN(Cc2nccn2C)CC1 193947218 MCWYYCLJBVNZHT-UHFFFAOYSA-N 342.443 1.996 10 10 EDCE CCCNC(=O)C1(C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 244076303 UCJNSVKDZLDWCS-UHFFFAOYSA-N 345.443 1.650 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3[nH]ccc3C)CC2)cc1 280516766 DMOSEKRYUFLEIL-UHFFFAOYSA-N 342.443 1.884 10 10 EDCE Cc1ccc(CN=c2nc([N+](=O)[O-])[nH]n2C)c(O)c1Br 2380741321 GBEFAFPWKNQEDV-UHFFFAOYSA-N 342.153 1.534 10 10 EDCE CN1CCc2cc([C@H](NN)c3ncc(Br)cn3)ccc21 2163161746 ZPPPMJSEYXDFOS-ZDUSSCGKSA-N 334.221 1.784 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NC2COCCOC2)cc1F 813634932 XAEUPMSIJAYJCB-UHFFFAOYSA-N 339.411 1.887 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCC[C@](CO)(OC)C2)c1O 826952781 STQLNXWLALVATO-HNNXBMFYSA-N 326.349 1.282 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)[C@H](O)C3CCC3)cc2F)CC1 825756360 QCRKBKWNYYXWCG-GOSISDBHSA-N 349.450 1.745 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H](N)C(F)(F)F 826030987 ZTHBPLMMDDHBKL-CYBMUJFWSA-N 331.338 1.371 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C/c1ccc(O)c(F)c1F 901441628 CBFZCANPTGNSOX-JXMROGBWSA-N 326.324 1.973 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@H]2CCN2C2CCOCC2)cc1 913927037 SKIPTQKNGGIWPH-GOSISDBHSA-N 346.475 1.805 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2CC[C@@H]2C(N)=O)cc1C 1268572611 MNHCVESOJDGSEH-MYIWKSEUSA-N 345.443 1.277 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]([C@@H]3CCCN3)C2)cc1 844221881 XLKIOOPEIYQGHY-MJGOQNOKSA-N 344.503 1.833 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1CNC(=O)O1 1951992696 IZKLRBXUBXIRFW-ZWNOBZJWSA-N 338.360 1.642 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCCNC2=O)c1 858926541 FBBPBTMKPDPZGJ-KRWDZBQOSA-N 339.395 1.915 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3ccnc(C)n3)C2)cc1 851966117 YIWNNPMLUBYFNL-HNNXBMFYSA-N 341.415 1.872 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3cnc[nH]3)C2)cc1 852447715 DBZMPNHXRKPQGX-ZDUSSCGKSA-N 329.404 1.839 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NC[C@@H](OC)[C@@H]2CCOC2)c1 852440838 VMHSPQMTTBRUJJ-HWWQOWPSSA-N 338.404 1.813 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@](C)(O)C3)C2)cc1 854298583 FZOSNXYENVNUSE-KSSFIOAISA-N 333.432 1.830 10 10 EDCE CN1CCCc2cc(CNC(=O)c3c[nH]nc3[C@@H]3CCNC3)ccc21 852798765 NIEUCIPPBOJMDG-OAHLLOKOSA-N 339.443 1.799 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CO[C@@H]([C@@H](N)Cc2ccc(O)c(O)c2)C1 1952997541 NTVLCUUTRJMJME-SLEUVZQESA-N 338.404 1.650 10 10 EDCE CCN(CC)CCN(C(=O)OC(C)(C)C)[C@@H](CN=[N+]=[N-])C(N)=O 698451866 LUPVLZDUIUMRRB-NSHDSACASA-N 328.417 1.730 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NCC[C@H]2CCOC2)cc1 853006492 HADZZGZTBKMKTL-ZDUSSCGKSA-N 336.388 1.129 10 10 EDCE Cc1nn(C)c(C)c1OCC(=O)NCc1ccc2cccnc2c1O 862026890 BSRWAOOOZWFTGJ-UHFFFAOYSA-N 340.383 1.986 10 10 EDCE Nc1cccnc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 866212850 WWIUSXWNBUVCKV-UHFFFAOYSA-N 344.390 1.694 10 10 EDCE COC(=O)COc1ccc(N(C)C[C@@H]2[C@@H](C(=O)OC)C2(F)F)cc1 894445991 SKEJYQYETRBQGN-OCCSQVGLSA-N 343.326 1.729 10 10 EDCE COc1ccc(O)c(CNC(=O)C(=O)Nc2cn(C)nc2C(C)C)c1 796822541 DANYTMSWQGKNRE-UHFFFAOYSA-N 346.387 1.513 10 10 EDCE CS(=O)(=O)c1cccc(C(=O)COC(=O)c2cc(O)cs2)c1 791884944 GGOMUQSDDLEJLR-UHFFFAOYSA-N 340.378 1.897 10 10 EDCE O=C(NC[C@]1(O)CCSC1)c1cc2cc(O)c(O)cc2s1 896828830 USSZJFOPGPDLJI-CQSZACIVSA-N 325.411 1.910 10 10 EDCE C[C@H](O)c1ccc(N(C)CCN(C)CCO)cc1Br 691271912 MIUUOXAODDDULB-NSHDSACASA-N 331.254 1.863 10 10 EDCE O=S1(=O)C=C[C@H](NCc2cc(Br)cc(F)c2O)C1 715757174 DSMSSMYFFFVGOR-VIFPVBQESA-N 336.182 1.694 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(c3n[nH]c(C)n3)C2)c([N+](=O)[O-])c1 1307210058 YCHPAWVMZDZUTQ-GQCTYLIASA-N 343.343 1.811 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CCS(=O)(=O)C(C)(C)C2)c(O)c1O 1179551632 HJIBNQSRJJPAHE-SNVBAGLBSA-N 327.402 1.492 10 10 EDCE NC(=O)COc1ccccc1C(=O)NCc1cccc(Cl)c1O 1180410930 VPQSXNMPAHEMFN-UHFFFAOYSA-N 334.759 1.840 10 10 EDCE CCN(CCCN1CCCC1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1335602399 MLYPZTKVCZOXSV-UHFFFAOYSA-N 345.443 1.569 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@H]3C[C@@H]3C)C2)cc1 1347444177 GJRINGLFPDWUIZ-MJBXVCDLSA-N 331.416 1.162 10 10 EDCE C[C@@H](CO)[C@@H]1CCCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1351929031 FPQLCHBJQSPTTN-WFASDCNBSA-N 332.400 1.244 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2cnnn2C)C(C)C)cc1C 1271830690 XBSMHXXOXNWWRT-HNNXBMFYSA-N 345.447 1.676 10 10 EDCE C[C@@H](O)CN(Cc1ccccc1)S(=O)(=O)Cc1ccc(N)cc1 1914629766 KKFGKURCGWEAEM-CQSZACIVSA-N 334.441 1.982 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@H]2CC23CC3)cc(OC)n1 1284344556 QSKREVOLBJUULS-CMPLNLGQSA-N 333.388 1.133 10 10 EDCE O=C([C@@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1)N1CCCC1 1540502716 IGFZBOYDICMOIS-LBPRGKRZSA-N 336.413 1.164 10 10 EDCE CC(C)C[C@H](NC(=O)NCc1ccccc1O)C(=O)N1CCOCC1 1470613008 JQURKZNKOVUTHR-HNNXBMFYSA-N 349.431 1.465 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCCN1CCOC1=O 1707861916 ZIVXZLQSGHOXIG-UHFFFAOYSA-N 345.403 1.771 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CN2CCCCC2=O)cc1C 1483143363 ATSKNGBZLJCOHX-OAHLLOKOSA-N 347.459 1.610 10 10 EDCE CCOC(=O)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)[C@@H]1CCCOC1 1633782070 KENJQMBUVVEAAW-WBMJQRKESA-N 337.372 1.115 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1(c2ncccn2)CCOCC1 1635576437 ZPOCSHYQCSOCIV-UHFFFAOYSA-N 329.356 1.252 10 10 EDCE O=C1CC(c2cccc(NC(=O)c3cccc(O)c3O)c2)CC(=O)N1 1637263561 CAQZVGFTPSPTBC-UHFFFAOYSA-N 340.335 1.870 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@@H](C)C(C)C)cc(OC)n1 1495101992 YAHJPBKGJHIVIN-RYUDHWBXSA-N 337.420 1.625 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)C(C)(C)F)cc(OC)n1 1738786455 JHWLZNXRTSBPDA-SNVBAGLBSA-N 341.383 1.424 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C(C(N)=O)[C@H]3C2)c(Br)c1 2136583841 AOSRFMMIINKKGW-JEZHCXPESA-N 325.206 1.670 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@]3(C)CCC(=O)N3)CC2)cc1C 1733260013 SHFQRBRBPLWJDT-SFHVURJKSA-N 345.443 1.411 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2cnccc2C)cc1C 1571425443 CZXRJPBJTXBLPZ-INIZCTEOSA-N 343.427 1.588 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@H]2C[C@@H](C(=O)OC)C2)cc1 1586649619 PJCPURDIMKUAIV-OKILXGFUSA-N 334.416 1.789 10 10 EDCE CCNCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCOCC1 1673756541 RTQHRCUQUQTTJS-UHFFFAOYSA-N 333.392 1.738 10 10 EDCE CC(=O)Nc1ccc(NC(=O)CCN2C(=O)CSC2=S)cc1 1865767695 BJYGXOYMSKJCIA-UHFFFAOYSA-N 337.426 1.834 10 10 EDCE CNCc1ccc(N2CCOC[C@H]2C(=O)NC)cc1Br 234452504 NCNPROFAQUNRCP-ZDUSSCGKSA-N 342.237 1.120 10 10 EDCE C[C@H](NCCn1cc(Br)nn1)c1c(O)cccc1O 1878208541 SJIWDVLHDIJPPX-QMMMGPOBSA-N 327.182 1.803 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2C[C@@H](CO)CO2)c1O 1966088616 REROSKCTSOBJPF-UWVGGRQHSA-N 346.221 1.650 10 10 EDCE CN(C)C(=O)OC1CN(c2ccc(CN)c(Br)c2F)C1 2146486765 ICYUHVOTAUBFQP-UHFFFAOYSA-N 346.200 1.934 10 10 EDCE C[C@H](N)c1ccc(N2CCN3C[C@@H](O)C[C@H]3C2)c(Br)c1 405535592 ZPVVOVKNQDMIKG-DRZSPHRISA-N 340.265 1.724 10 10 EDCE CN(Cc1c(Br)nnn1C)c1c(F)cc(CN)cc1F 2156469928 RPBYAPZJHMYMMD-UHFFFAOYSA-N 346.179 1.951 10 10 EDCE CNCc1ccc(N2CC[C@@H](CC(N)=O)C2)c(Br)c1 690762712 QGKWPDGGHDLLCF-NSHDSACASA-N 326.238 1.870 10 10 EDCE COc1ccc(Cn2ncc(I)c2O)c(O)c1 2070494992 XTCOLMAEAAERPX-UHFFFAOYSA-N 346.124 1.956 10 10 EDCE CC(C)[C@@H](O)CN(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2167641599 DTDWAROOGGKHCR-QWHCGFSZSA-N 343.221 1.888 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](C(CO)CO)C2)c(Br)c1 2170674543 STHDDFPRRDDOLP-CMPLNLGQSA-N 343.265 1.896 10 10 EDCE O=C(O)[C@H]1CN(Cc2c(O)cccc2Br)C2(CC2)CO1 2183983871 GOSOZASZVNSLLW-GFCCVEGCSA-N 342.189 1.973 10 10 EDCE Cn1c(Br)nnc1CCNCc1ccc(F)c(F)c1O 2185197137 BMUQDKNQGGCSFK-UHFFFAOYSA-N 347.163 1.894 10 10 EDCE Cn1nnc(Br)c1CNCCc1ccc(O)c(O)c1 2091754155 KKZYGACVOYMACA-UHFFFAOYSA-N 327.182 1.321 10 10 EDCE CNCc1ccc(N2C[C@@H]3OCCO[C@@H]3C2)c(Br)c1 2093346665 XHZZSVWPPHZINP-OKILXGFUSA-N 327.222 1.773 10 10 EDCE CS(=O)(=O)C[C@H]1CCCN1c1ccc(CO)c(Br)c1 2094923383 KJABZEXIFQLDCY-GFCCVEGCSA-N 348.262 1.955 10 10 EDCE CC[C@H](N[C@H](COC)C(N)=O)c1cc(Br)ccc1O 2096073603 RVBKAXPKJPPCRC-WDEREUQCSA-N 331.210 1.696 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2199527171 OMMZMMCTXLEQQK-PFKCXJIQSA-N 341.249 1.789 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCc1conc1Br 2238844849 MBSJOKSKCAOXTR-UHFFFAOYSA-N 341.161 1.750 10 10 EDCE O=C1NC[C@@H]2CCCN(c3ccc(CO)c(Br)c3)[C@@H]12 2264603238 UMOUDPJUZRDEMD-TVQRCGJNSA-N 325.206 1.656 10 10 EDCE Cc1cccc(NC=C2C(=O)NC(=O)N(C[C@@H]3CCCO3)C2=O)c1 2297317883 CZVNEPWJWPUOTD-ZDUSSCGKSA-N 329.356 1.548 10 10 EDCE Cc1ccc(CN(C)[C@@H]2CC(=O)NC2=O)c(O)c1Br 2352932575 OSMHXJVFHNDNOJ-SECBINFHSA-N 327.178 1.310 10 10 EDCE COC(=O)CN(CC(=O)NC(C)(C)C)Cc1cc(Cl)ccc1O 111238268 OMJTWWPTUXBYHH-UHFFFAOYSA-N 342.823 1.935 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)[C@@H]3CCO[C@H]3C)CC2)cc1 189940018 VEDOVQDPLDNMBP-XJKSGUPXSA-N 340.445 1.324 10 10 EDCE CN(C)c1ccc(CNC(=O)NCCCCN2CCOCC2)cc1 48141181 OXOPIACWSRTTBY-UHFFFAOYSA-N 334.464 1.664 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](N)CCO 1951703830 VXDSXZFEEJSJHL-NWDGAFQWSA-N 326.393 1.243 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)C(C)(C)OC)CC2)cc1 264477008 HFAINOFKJKWLKU-UHFFFAOYSA-N 335.448 1.358 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)C3=COCCC3)CC2)cc1 264506593 KYRMLBSJSSHTQH-UHFFFAOYSA-N 345.443 1.628 10 10 EDCE CO[C@H](CN)CC(=O)N(C)Cc1ccc(C)c(Br)c1O 2380791483 ZUJOQBWDCKSIMB-NSHDSACASA-N 345.237 1.785 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F 808550984 YCXYOLBMMRHSEE-CQSZACIVSA-N 339.338 1.845 10 10 EDCE CCc1nc[nH]c1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 823552557 CVJYHTSHMKZUKX-UHFFFAOYSA-N 332.379 1.878 10 10 EDCE CCOCCN1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)C[C@H]1C 588407994 NBRDCUJDRJDXKL-BRLPQQTGSA-N 334.416 1.680 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(C4(O)CC4)CC3)cc2N1 845606771 VCMVCPZHURIKGD-UHFFFAOYSA-N 333.344 1.667 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)OC1(C)CNC1 1952206653 NNGNHNKODRFQRB-AWEZNQCLSA-N 338.404 1.870 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)COc3cccnc3)C2)cc1 855228488 BENIIOKZNVPNLR-CQSZACIVSA-N 327.384 1.864 10 10 EDCE C[C@@]1(NCc2cccc(Br)c2O)CCS(=O)(=O)C1 44381311 SNPIEHDGOSPDQU-GFCCVEGCSA-N 334.235 1.822 10 10 EDCE CS(=O)(=O)CC1(CCNC(=O)/C=C/c2ccc(O)c(O)c2)CC1 855215725 YRKOOMGJBPCHHC-HWKANZROSA-N 339.413 1.442 10 10 EDCE CO[C@@H](CS(=O)(=O)NCc1c(O)cccc1F)[C@@H]1CCOC1 921450608 BNZSXYZDNRZEOK-YGRLFVJLSA-N 333.381 1.002 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)NC[C@H]1C[C@@H]2COC[C@@H]2O1 926655837 CGUVTNPEIAMURQ-LBTNJELSSA-N 346.427 1.874 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3C[C@H](O)C34CCC4)nc12 852584961 VMHMULZEADIWFO-OLZOCXBDSA-N 346.387 1.005 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H]2COC[C@@H]2C1 850626133 MYHOAXIADBAYBS-HOTGVXAUSA-N 346.427 1.626 10 10 EDCE CNCCOCCNC(=O)NCc1cc(Br)ccc1O 861677060 WXFHNFLICFQIQG-UHFFFAOYSA-N 346.225 1.190 10 10 EDCE NC(=O)C[C@H]1CN(Cc2cc(Br)ccc2O)CCO1 862534492 CWBWNYGXLQEKJG-NSHDSACASA-N 329.194 1.231 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/COC1CCOCC1 867301980 IHUCPCVUDQYKKP-YWVDXFKGSA-N 335.400 1.897 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)C34CC(C3)C4)nc12 860270168 ZPGXBCQFNNUIBW-UHFFFAOYSA-N 331.328 1.455 10 10 EDCE COC(=O)c1cn(C2CN(Cc3cc(Cl)cc(C)c3O)C2)nn1 779613159 HBHLUFFVXNLCLK-UHFFFAOYSA-N 336.779 1.789 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(C)CCCO1 1116669253 LMKUMPXUXHVOMQ-YVEFUNNKSA-N 337.372 1.257 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N(C)C)cc1)C1(S(C)(=O)=O)CC1 796621539 WFDVATGLNQDSLL-GFCCVEGCSA-N 339.461 1.518 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CCCN1Cc1ccccn1 1153885490 PFWCLHCDWVVOIW-MRXNPFEDSA-N 327.384 1.774 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)N(C)C)cc1 1304766987 CBAGXVWLBNFFFT-AWEZNQCLSA-N 346.391 1.417 10 10 EDCE O=C1NC[C@@]2(CCN(c3ccc(CO)cc3Br)C2)N1 2121183800 NEJFCDMRFPLCRR-CYBMUJFWSA-N 326.194 1.203 10 10 EDCE N[C@@H]1CCN(Cc2cc(Br)cc(F)c2O)C[C@H]1CO 2122373847 GDZZIZRMBAQUON-JOYOIKCWSA-N 333.201 1.435 10 10 EDCE Cn1nc(C2CCOCC2)cc1C(=O)NCc1ccc(O)c(O)c1 1263769221 UGVZIGIJUGQMHE-UHFFFAOYSA-N 331.372 1.655 10 10 EDCE C[C@@H](O)CN(Cc1ccccc1)c1cc2c(cc1N)OCC(=O)N2 1914656518 IGWSHNODTDEVKU-GFCCVEGCSA-N 327.384 1.987 10 10 EDCE C[C@H](O)[C@H](O)CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1612667015 JLRRZNCTGGIKPQ-MEDUHNTESA-N 330.340 1.979 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@](C)(O)C2)c(Br)c1 2136835880 ZSOHQAGAQZGDCM-OWYVNGRQSA-N 329.238 1.791 10 10 EDCE Cc1ccc(C(=O)NCCNC(=O)Cc2ccc(O)c(O)c2)cc1 1628074333 CEAGQGCURUFHMO-UHFFFAOYSA-N 328.368 1.495 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H]2CN(C)C(=O)N2)cc1C 1497241950 SWGLLQBSVXMVET-UKRRQHHQSA-N 348.447 1.012 10 10 EDCE COc1cccc(CNC(=O)CCc2ccc(C(N)=O)cc2)c1O 1630365893 HMJDFSYBKAFLEP-UHFFFAOYSA-N 328.368 1.749 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC(CNC(=O)CC3CC3)C2)cc1 1721379962 XWXSOKRRZBTMGY-UHFFFAOYSA-N 343.387 1.837 10 10 EDCE COCC(=O)N[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1687954887 ZRMDXNUCBFMQAC-CYBMUJFWSA-N 347.375 1.120 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)c(Br)c1 2146310431 JTBBXLIYQYTPDU-KMUNFCNLSA-N 342.233 1.684 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985095836 JYAWFRUWVOZJCN-GHMZBOCLSA-N 326.401 1.353 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985095839 JYAWFRUWVOZJCN-WDEREUQCSA-N 326.401 1.353 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(C(=O)c3ccc(O)c(O)c3)C[C@@H]21 2006293898 QIMCQTSELODLMK-YABSGUDNSA-N 334.372 1.693 10 10 EDCE CC(C)(C)OC(=O)NCCOCCNC(=O)Nc1ccc(N)cc1 1999155617 PNGQFHZFKQKFEB-UHFFFAOYSA-N 338.408 1.932 10 10 EDCE N[C@@H]1CN(Cc2cc(Br)cc(F)c2O)[C@@]2(CCOC2)C1 2154540284 IPZXHIUCCKUHTP-FZMZJTMJSA-N 345.212 1.986 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@@](C)(C(=O)N2CC(N=[N+]=[N-])C2)C1 2010393541 UCFNOLJQNSOQEF-ZUZCIYMTSA-N 339.396 1.970 10 10 EDCE CN(Cc1c(Br)cnn1C)C(=O)c1cccc(O)c1O 2156476717 QJWDXIPJUMOYKZ-UHFFFAOYSA-N 340.177 1.866 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H]4C[C@@]4(O)C3)c(Br)cc21 2171028045 NVBXZVQKHTYPSI-FDHQVAJDSA-N 338.205 1.362 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(O)(C(=O)OC)C2)c(Br)c1 714438011 ADIIEMAYWWOEEI-VIFPVBQESA-N 343.221 1.454 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(O)(COC)C2)cc1Br 384188084 YIELVGRUQPWDFN-JTQLQIEISA-N 329.238 1.927 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H]3c3ccnn3C)c2n1 2065177304 PKHLGVCTFYNYPT-CYBMUJFWSA-N 326.360 1.454 10 10 EDCE COc1ccc([C@H](C2CCC2)n2nc(C)c(C(N)=O)c2N)c(O)c1 2079969476 DFLZSTBCIGPJLH-HNNXBMFYSA-N 330.388 1.976 10 10 EDCE N[C@H]1CC(C(=O)N2CCCc3cccc(Br)c32)=C[C@@H]1O 2188025612 GVFKYPJVPLQXOQ-STQMWFEESA-N 337.217 1.747 10 10 EDCE Cn1c(Br)nnc1CCNCc1ccc2c(c1)CCO2 2185200113 DSTHHLKYMKLGQG-UHFFFAOYSA-N 337.221 1.845 10 10 EDCE CO[C@@H]1C[C@@H](O)CN(c2ccc(CN)c(Br)c2F)C1 2109020935 TYLLWSZCVGNMHK-NXEZZACHSA-N 333.201 1.633 10 10 EDCE N=c1[nH]c(Br)cc(=NCCc2ccc(O)c(O)c2)[nH]1 2091749991 BLSUWIISTXUQEH-UHFFFAOYSA-N 325.166 1.139 10 10 EDCE CNCc1ccc(N2CC[C@](O)(COC)C2)cc1Br 2095539172 WRKUNPTWQSPJNR-CQSZACIVSA-N 329.238 1.756 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)c1c[nH]nc1CCNC(=O)OC(C)(C)C 2214421750 WELOGJFOCIUGGW-UHFFFAOYSA-N 337.384 1.859 10 10 EDCE NCc1cc(F)c(N2CCC3(CC2)CC(=O)N3)cc1Br 2207923532 NXNIAIACVAYPHD-UHFFFAOYSA-N 342.212 1.906 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NC[C@@H]1CC[C@H](O)C1 2311487612 QCVWPAYWELRDNA-AEFFLSMTSA-N 330.428 1.814 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)C(=Cc2c[nH]c3ccccc23)SC1=S 2323831545 AXXUOPSVBBGMEC-NSHDSACASA-N 348.405 1.815 10 10 EDCE CCc1n[nH]c([C@@H]2CN(Cc3cc([N+](=O)[O-])ccc3O)CCO2)n1 173686459 PNSZUVUUWMEOPB-ZDUSSCGKSA-N 333.348 1.554 10 10 EDCE CCc1nc2n(n1)C[C@H](NC(=O)NCc1cc(OC)ccc1O)CC2 114969709 NECBPKRPPWRPDJ-GFCCVEGCSA-N 345.403 1.369 10 10 EDCE C/C=C(\C)C(=O)N(C)CCNCc1nnnn1-c1ccc(OC)cc1 1267360664 LRIFZBVKSXJDOO-WLRTZDKTSA-N 344.419 1.185 10 10 EDCE COCCNC(=O)Cn1cc(N[C@H](C)c2ccc(F)cc2O)cn1 186498199 CCSDSHDBKKXEFG-LLVKDONJSA-N 336.367 1.664 10 10 EDCE O=C(NCCCSc1nccs1)N(CCO)CC(F)F 192761352 SDYLXPPFZINUHK-UHFFFAOYSA-N 325.406 1.894 10 10 EDCE CN1C2(CCC2)COC[C@@]1(CO)CN[C@H]1CCc2cccc(O)c21 527949497 LMGWHXMKDIBXKV-KXBFYZLASA-N 332.444 1.585 10 10 EDCE CCO[C@H]1C[C@H]1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 299307438 DTWIVFJUDXSHBW-MSOLQXFVSA-N 347.459 1.358 10 10 EDCE O=C(O)c1ccc(COn2c(=O)c(=O)oc3ccc(Cl)cc32)cc1 821297634 WWZZWHAFMWUUDJ-UHFFFAOYSA-N 347.710 1.935 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@@](O)(C(F)F)C3)cc2)CC1 824726379 KTSAETXJWWZBRP-KRWDZBQOSA-N 325.403 1.640 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@](O)(CO)C1 838485163 DAOFQWCMFVCDRY-GOSISDBHSA-N 331.416 1.092 10 10 EDCE CCc1ncc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)o1 836993148 UFEIAMOKNVMHTE-UHFFFAOYSA-N 339.373 1.244 10 10 EDCE Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832293313 UVTQODNSASVAOR-MRXNPFEDSA-N 343.387 1.794 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1CCCN(c2cccnn2)C1 588404816 SUZAJMNXGYNYMT-QPBFKRLHSA-N 340.383 1.686 10 10 EDCE C[C@H](NCC[C@]1(O)CCOC1)c1ccc(N2CCOCC2)c(F)c1 846194167 LVOULKPCIBMESV-KSSFIOAISA-N 338.423 1.854 10 10 EDCE Oc1ccc(Br)cc1CN1CCN2C[C@H](O)C[C@H]2C1 848925944 INGXLBHIXFNEFE-QWHCGFSZSA-N 327.222 1.406 10 10 EDCE COc1cc(CN2CCS(=O)(=O)[C@H]3CCC[C@@H]32)c(O)cc1C 840146512 PXZPYNUEPDAOOD-BBRMVZONSA-N 325.430 1.861 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)C(OC)OC)C2)cc1 923186846 KDKGETKNSABNMH-STQMWFEESA-N 337.420 1.581 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3nc[nH]n3)C2)cc1 852449849 XJSIWXCYHKFSMD-LBPRGKRZSA-N 330.392 1.234 10 10 EDCE COC(=O)c1cnc(SCc2nc(O)c3c(n2)CCOC3)s1 865369299 QLOHMPYLKUYNEG-UHFFFAOYSA-N 339.398 1.790 10 10 EDCE COc1nn(C)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 789568061 VWUYWOCOIAKZRR-UHFFFAOYSA-N 345.403 1.058 10 10 EDCE CS(=O)(=O)[C@H]1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 897670743 HVKKXKQBWGAQFX-VIFPVBQESA-N 341.410 1.572 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1[C@H]2OCCC[C@@H]21 780384370 HJIVGFMAIQTMCL-QRVBRYPASA-N 344.455 1.937 10 10 EDCE Cn1cc(CNCc2cc3c(cc2O)OCO3)c(Br)n1 720640662 UEPRIUDOAAYLLE-UHFFFAOYSA-N 340.177 1.907 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCC[C@H]1N1CCC(O)CC1 1302835093 NYNIRVWJWXGMKV-HUUCEWRRSA-N 334.416 1.134 10 10 EDCE CO[C@H]1CC[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 1325972302 UTEJHBMVEWSMRB-HOTGVXAUSA-N 345.443 1.369 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1(CNC(=O)OC(C)(C)C)COC1 1900612889 PMNVPGGPRITWEC-UHFFFAOYSA-N 327.385 1.687 10 10 EDCE C[C@]1(CNCc2cc(Br)cc(F)c2O)CCNC1=O 2136063316 WBAPVVGPAVIJDN-CYBMUJFWSA-N 331.185 1.910 10 10 EDCE COCc1nn(C)cc1C(=O)NCc1ccc2cccnc2c1O 1299723952 ALIINRNXZGAGFQ-UHFFFAOYSA-N 326.356 1.750 10 10 EDCE COc1cc([C@@](C)(CN)CNC(=O)OC(C)(C)C)cc(O)c1O 1535974819 KJERJVYOSHAXCH-INIZCTEOSA-N 326.393 1.848 10 10 EDCE O=C(c1ccccn1)N1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 1472494325 FPODDZQIFHYRFO-UHFFFAOYSA-N 345.330 1.230 10 10 EDCE CNC(=O)c1cccc(CCNC(=O)Cc2ccc(O)c(O)c2)c1 1544329263 OWHJYAAVLMOAAW-UHFFFAOYSA-N 328.368 1.359 10 10 EDCE CCC[C@@H](C(=O)NCc1c(O)ccc2ccccc12)S(N)(=O)=O 1472085604 XCBVMDGONCXRRD-HNNXBMFYSA-N 336.413 1.619 10 10 EDCE COC[C@@](O)(CNC(=O)OC(C)(C)C)[C@@H](N)c1ccccc1O 1921822906 HCKVWEXNVZZBFV-BBRMVZONSA-N 326.393 1.294 10 10 EDCE CNC(=O)C1(C(=O)N(C)C[C@@H](C)NCc2ccc(OC)c(C)c2)CC1 1734346769 RVKNMYSBGHGJDS-CQSZACIVSA-N 347.459 1.466 10 10 EDCE Cn1cc(Br)c(C(=O)NCc2ccccc2O)cc1=O 1595800127 PAICMMZKWWKTOD-UHFFFAOYSA-N 337.173 1.783 10 10 EDCE CC[C@H](OC)C(=O)NC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1688597497 IZZPOIIFYAXHED-ZDUSSCGKSA-N 347.375 1.215 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@H](C)NC(N)=O)cc1C 1699403295 RJMHGVXPEVYFHU-STQMWFEESA-N 336.436 1.045 10 10 EDCE CC(=O)N[C@H](CC(=O)NCc1ccc(O)c(O)c1)c1ccccc1 159092862 YKSWUTPHTUXXEQ-OAHLLOKOSA-N 328.368 1.982 10 10 EDCE CNCc1ccc(N(C)C[C@H](C)C(=O)NC)cc1Br 234405520 QAYOKLXYWMPRRO-JTQLQIEISA-N 328.254 1.987 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@H]1CCOC1 1985097022 ZRUABHNLVHZXFG-GXSJLCMTSA-N 325.369 1.437 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985101635 VNZAHWUIAHQCKR-WDEREUQCSA-N 327.385 1.827 10 10 EDCE C[C@@H]1CC[C@@H](C2OCCO2)N(S(=O)(=O)Cc2ccc(N)cc2)C1 2152088373 NVLOVZOUMJGBJL-DOMZBBRYSA-N 340.445 1.572 10 10 EDCE CC(C)(O)C1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2152268325 KJOBQNPMPVODCO-GFCCVEGCSA-N 341.205 1.642 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@H]4C[C@H]3CO4)c(Br)cc21 2153088448 AQNQGMWCIGZKCX-UPFKWVMWSA-N 338.205 1.769 10 10 EDCE COC(=O)[C@H](CC(=O)NCCCCN=[N+]=[N-])NC(=O)OC(C)(C)C 2010397809 ULXGUFBPVSYGJW-JTQLQIEISA-N 343.384 1.650 10 10 EDCE O=C(O)C1CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CC1 2053821451 HATDIXOQEJPUAO-UHFFFAOYSA-N 344.411 1.860 10 10 EDCE C[C@H]1[C@H](NCc2cccc(Br)c2O)CCS1(=O)=O 380992432 FKKKDWYUKZFYCH-GZMMTYOYSA-N 334.235 1.820 10 10 EDCE CN(C[C@H]1CCCS1(=O)=O)c1ccc(CN)c(Br)c1 694093208 CHBFPWLJZXLEDD-GFCCVEGCSA-N 347.278 1.921 10 10 EDCE CCn1nnc(CN(C)c2ccc(CNC)cc2Br)n1 2197859894 UWBOWIOCKDVVEA-UHFFFAOYSA-N 339.241 1.811 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N2CC[C@H](N=[N+]=[N-])C2)n1 2058158142 HCMFIZYIFGTMKT-LURJTMIESA-N 335.187 1.256 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2CN3C(C)=O)c(Br)c1 2192286936 UDHPBVLRYKLEAB-STQMWFEESA-N 338.249 1.978 10 10 EDCE OCc1ccc(N2[C@H](CO)C[C@@H]3OCC[C@@H]32)c(Br)c1 2090533810 IBAIITOHLWSTID-BPNCWPANSA-N 328.206 1.670 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](O)[C@H](O)CC2)cc1Br 2269122753 XQBVURCKCOKYLS-OWYVNGRQSA-N 330.222 1.824 10 10 EDCE COc1ccc(N(C)Cc2nn(C)nc2Br)c(N)c1 2226982450 CGHHIXKWZXAQJW-UHFFFAOYSA-N 326.198 1.805 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](C(=O)NCCN=[N+]=[N-])O[C@H]2C1 2251289922 KNBUNTIRBZMYNT-SRVKXCTJSA-N 339.396 1.827 10 10 EDCE CSc1ncc(CNC(=O)N2[C@H](C)SC[C@H]2C(=O)O)s1 2284542770 BFQJBCSIMJHESS-XPUUQOCRSA-N 333.460 1.923 10 10 EDCE O=C(O)[C@@]12CO[C@@H](C1)[C@@H](NCc1cc(Br)ccc1O)C2 2280799430 RAWCWVXHCZJKIP-VHRBIJSZSA-N 342.189 1.877 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCCN1CCCC1 2297575638 LKXDXGUGEVZVRZ-UHFFFAOYSA-N 329.444 1.748 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(C(=O)N3CC(N=[N+]=[N-])C3)CO[C@@H]1C2 2298342492 ZPPJFHARKLOYFL-HFAKWTLXSA-N 337.380 1.580 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)C1(O)CCC1 2300530292 ODNIAQWKWMMTJK-NSHDSACASA-N 341.412 1.954 10 10 EDCE Cc1nn(CC(C)C)c(Cl)c1C=C1C(=O)N(C)C(=O)N(C)C1=O 7718397 URZSBCHPPQWYGZ-UHFFFAOYSA-N 338.795 1.935 10 10 EDCE O=C(N[C@H]1CC[C@H](Oc2cnccn2)CC1)c1cc(O)nc(O)c1 238848294 IVUIASKYOBOQGU-HAQNSBGRSA-N 330.344 1.403 10 10 EDCE C[C@@H]1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)C[C@H]1N(C)C 266141739 FSBQAFQXLCPNQB-CSZITXDSSA-N 343.471 1.945 10 10 EDCE CCOc1ccc(O)c(CN2CCc3nn(CC)c(=O)cc3C2)c1 371327874 PPBKAKUKFVOXLA-UHFFFAOYSA-N 329.400 1.926 10 10 EDCE CN(C)c1ccc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)cc1F 374316606 INAWNLDAJKPKBZ-MRXNPFEDSA-N 349.450 1.963 10 10 EDCE Cc1ccc(CN2C[C@@]3(CO)C[C@]3(CO)C2)c(O)c1Br 2381134436 CGQPJWHGJNKYCN-HUUCEWRRSA-N 342.233 1.640 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cnc(OCC2CC2)cn1 286800578 QSVGNXPSDUNERE-UHFFFAOYSA-N 329.356 1.649 10 10 EDCE Cc1ccc(CN(C)C(=O)c2cnn(C)n2)c(O)c1Br 2380774623 SZNGGRODVJBKJN-UHFFFAOYSA-N 339.193 1.864 10 10 EDCE O=C(NCc1cc(Br)ccc1O)[C@@H]1CCS(=O)(=O)C1 804738369 NPXSCDMYAQFDAH-MRVPVSSYSA-N 348.218 1.206 10 10 EDCE COCCN1CCC[C@H]1CN1C(=O)CN(Cc2ccccc2O)C1=O 819169157 YUVQRJBPEHDNMF-HNNXBMFYSA-N 347.415 1.267 10 10 EDCE C[C@H](NC(=O)Cc1cnnn1C)c1ccc(N2CCOCC2)cc1 823834891 PUIBNGDZFJDPLC-ZDUSSCGKSA-N 329.404 1.072 10 10 EDCE CN1CCC[C@@H](C(=O)NCc2cc(Br)ccc2O)C1=O 831932826 JPBUCVSIEFXVES-NSHDSACASA-N 341.205 1.639 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCCNC1 842238868 AGWZPYNFKBEPKT-INIZCTEOSA-N 347.459 1.779 10 10 EDCE C[C@@H]1C(=O)N(CCN(C)C)CN1Cc1c(O)ccc(Cl)c1F 843428023 FLOXFCWFHHOCAC-SNVBAGLBSA-N 329.803 1.737 10 10 EDCE CCOC(=O)CN1C(=O)/C(=C/c2cnnn2CC)c2ccccc21 841484743 BIWGKJBAPGMBNO-NTEUORMPSA-N 326.356 1.748 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3ccnn3C)C2)cc1 851948989 MZTIUDNKJOXBKU-ZDUSSCGKSA-N 329.404 1.507 10 10 EDCE CCOC(=O)C[C@H](O)CN1CCCN(c2ccc(OC)cc2)CC1 859085705 BOWYLCZXUANEFL-INIZCTEOSA-N 336.432 1.521 10 10 EDCE C[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cncnc1 764384550 ZWEHLCZBVZDKHC-ZDUSSCGKSA-N 344.390 1.872 10 10 EDCE Cn1cccc1[C@H]1CCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1118998212 ACCVGMLDQPJSCY-MRXNPFEDSA-N 339.395 1.937 10 10 EDCE CNS(=O)(=O)c1ccc2c(c1)CCN2Cc1c(O)cccc1OC 792177013 PZLFIKXTBXXWLE-UHFFFAOYSA-N 348.424 1.872 10 10 EDCE COc1cc(Br)cc(CNCCOCCCO)c1O 1323698273 BDKUGSYRCVSATE-UHFFFAOYSA-N 334.210 1.652 10 10 EDCE CO[C@@H]1CC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)C1 1321778362 TZLFEEQKRYBBEL-NVXWUHKLSA-N 333.432 1.890 10 10 EDCE CO[C@]1(C)C[C@@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1(C)C 1332024002 XCSYXQYHJMFFOB-DNVCBOLYSA-N 346.427 1.896 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@@H]1C(=O)NCc1cccc(O)c1O 1263896181 QWSRWCZPZIEFFR-SGMGOOAPSA-N 348.399 1.969 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@@H](CO)[C@@H](CCO)C1 1348463999 YEUWSFWEBCTQJS-IRXDYDNUSA-N 347.459 1.419 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)CNC(=O)C2CC2)cc1C 1700394770 WHCBGXQESDLWHP-KGLIPLIRSA-N 347.459 1.513 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)c2cnn(C)c2N)cc1C 1485139856 XCVUMHQBYFTELL-OLZOCXBDSA-N 345.447 1.616 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1csnn1 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GEOUUGSXDFOLFC-NSHDSACASA-N 344.433 1.649 10 10 EDCE C[C@@H]1NC(=O)N(Cc2ccc(N3CCN(CC4CC4)CC3)cc2)C1=O 777674218 XEJIVHQOACZYSR-AWEZNQCLSA-N 342.443 1.659 10 10 EDCE CCO[C@H]1C[C@H](NC(=O)C(=O)N(CC)Cc2ccc(N(C)C)cc2)C1 1118665032 MSZGNLRUKSIXDJ-JCNLHEQBSA-N 347.459 1.785 10 10 EDCE CCOc1cccc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c1O 872255424 WQSPETCBHMDVCG-LZWOXQAQSA-N 347.415 1.158 10 10 EDCE O=C(N1Cc2cccc(O)c2C1)[C@@]1(O)CCN(Cc2ccccc2)C1 871202211 AHIKJSQOTDFVQG-HXUWFJFHSA-N 338.407 1.871 10 10 EDCE CC(=O)C(=O)COC(=O)COCCc1ccc(Br)cc1 885514392 ZKOUKYDREGYRLJ-UHFFFAOYSA-N 343.173 1.710 10 10 EDCE O=C1NCC2(CCOCC2)[C@@H]1NCc1c(O)ccc(Cl)c1F 895768914 KUVZXLOAZFBSGR-CYBMUJFWSA-N 328.771 1.570 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C)O[C@@H](C)[C@@H]3C)nc12 782628935 OXJLANMWPLBJDX-SRVKXCTJSA-N 348.403 1.609 10 10 EDCE COC(=O)[C@@]1(CNCc2c(O)cccc2Cl)C[C@@H]1S(C)(=O)=O 895508788 LESMKXXBAHYJOM-GXTWGEPZSA-N 347.820 1.112 10 10 EDCE COc1cc(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3C)ccc1O 797820333 RXYODCSAUZJXSL-UHFFFAOYSA-N 348.380 1.721 10 10 EDCE CNCc1ccc(N2CC[C@](O)(CN(C)C)C2)cc1Br 713717781 FMCOVXVAKWBZSL-HNNXBMFYSA-N 342.281 1.671 10 10 EDCE OCCNC1CCN(Cc2c(O)cccc2Br)CC1 686283696 YWAAJYBXUNBZRB-UHFFFAOYSA-N 329.238 1.701 10 10 EDCE CCN1CC[C@@H]1C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1152407575 RQMUXWNRFRKNFE-CYBMUJFWSA-N 340.807 1.641 10 10 EDCE C[C@@H](NC(=O)CCc1ccccc1)C(=O)NCc1cc(O)ccc1O 1176748340 PJEZCBIGRJATIB-CYBMUJFWSA-N 342.395 1.852 10 10 EDCE CC(C)N1CC[C@@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1329430260 ZXIKPYMBVYUJNC-CQSZACIVSA-N 331.416 1.176 10 10 EDCE CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 1328069927 ODEUUSCOGIYPAC-KOMQPUFPSA-N 333.432 1.361 10 10 EDCE CN1C(=O)O[C@H]2CN(c3ccc(CN)cc3Br)C[C@@H]21 2120412833 UNFRELKEFQWGKI-RYUDHWBXSA-N 326.194 1.547 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCc1ccns1 1338836696 DFYADFGIXXVRDP-UHFFFAOYSA-N 346.456 1.526 10 10 EDCE O=S(=O)(Nc1cc(Cl)c(O)c(Cl)c1)N1CCC[C@H](O)C1 1914131562 FJRQPRYAJMIMHN-QMMMGPOBSA-N 341.216 1.812 10 10 EDCE C[C@@H](CNC(=O)[C@H]1C[C@@H]1C)NC(=O)c1ccc(N=NC(N)=O)cc1 1295611738 LOAZGWQGNNLZAA-KWBADKCTSA-N 331.376 1.740 10 10 EDCE CS(=O)(=O)Cc1ccccc1CNC(=O)Cc1ccc(O)c(O)c1 1295042083 ANBLLVGKBAQMFG-UHFFFAOYSA-N 349.408 1.501 10 10 EDCE CN(C(=O)Cc1ccc(O)c(O)c1)[C@@H]1CCN(CC(F)(F)F)C1=O 1543305934 HZKDYSRIKFWOCI-SNVBAGLBSA-N 346.305 1.262 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](O)[C@](C)(O)C2)c(Br)c1 2136877655 JBGVXQPVNFMDBS-CUOATXAZSA-N 330.222 1.824 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@]23COC[C@@H]2C3)cc1C 1495668974 PLQFJQDOTZJEPV-AZOIQLNYSA-N 332.444 1.882 10 10 EDCE Cn1ncc(C(=O)NCc2ccc3cccnc3c2O)c1-n1cnnc1 1639621828 VRISVMQTSPPSIB-UHFFFAOYSA-N 349.354 1.185 10 10 EDCE CCOC(=O)c1ccc(C(=O)NCc2ccc(O)cc2O)nc1C 1630301467 BFQBKMOGPJTHQU-UHFFFAOYSA-N 330.340 1.908 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)C(=O)NCC2CC2)cc1C 1733998421 OYDZSNKJINNFRC-KBPBESRZSA-N 347.459 1.513 10 10 EDCE CCOC(=O)C1=C(COC)Nc2ncnn2[C@H]1c1ccccc1O 17067659 JYZQFSZODVUBGX-AWEZNQCLSA-N 330.344 1.462 10 10 EDCE NCc1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)c(F)c1Br 2146317380 AQBQWSWTECTUDX-KBPBESRZSA-N 345.212 1.228 10 10 EDCE COc1ccc(O)c(CNC[C@H](CO)NC(=O)OC(C)(C)C)c1 1985852624 FYDXWNOANVASNU-GFCCVEGCSA-N 326.393 1.376 10 10 EDCE O=C(O)CO[C@H]1CCN(Cc2cc(Br)cc(F)c2O)C1 2153158461 BQDPKCMXBIOJTQ-JTQLQIEISA-N 348.168 1.969 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3OCCN(C)[C@@H]3C2)c(Br)c1 2153997497 YQNSBPDMBZRLGV-KMUNFCNLSA-N 340.265 1.988 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](O)CN1Cc1cc(N)ccc1O 2014240719 XQKNTWJCRSYAFQ-KBPBESRZSA-N 337.420 1.434 10 10 EDCE CNCc1ccc(N2CCC[C@@](O)(CO)C2)cc1Br 313754764 RTCYJFKURWLEGY-AWEZNQCLSA-N 329.238 1.492 10 10 EDCE OCCN(Cc1cc(Br)cc(F)c1O)C[C@@H]1CCCN1 715778852 NBXQEOXAIZPILW-LBPRGKRZSA-N 347.228 1.840 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NCc2cc3c(cc2O)OCO3)CO1 722491276 VHGPPUWMZXQHHO-NSHDSACASA-N 338.360 1.761 10 10 EDCE Cc1cc(O)n2ncc(C(=O)Nc3cc(C4CCC4)nn3C)c2n1 2062901012 JSDMMBLWQPWGJH-UHFFFAOYSA-N 326.360 1.997 10 10 EDCE CC1(C)[C@@H](O)C[C@@]1(CO)NCc1cc(Br)cc(F)c1O 2193972287 ZTOVILSTUJPRRD-FZMZJTMJSA-N 348.212 1.905 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](CO)C[C@H]2CO)cc1Br 2089863700 MKNWCVXJVTXWFA-FOGDFJRCSA-N 329.238 1.648 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@@H](N)C2)c(OC)c1Br 2111801273 PPPNBTROLYLMLV-BDAKNGLRSA-N 331.210 1.365 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1CCC[C@H](O)[C@@H]1O 2224348774 NMHJCHQDVOAEBY-NTZNESFSSA-N 334.185 1.658 10 10 EDCE CC(=O)N1CCN(C2=NC(=O)C(=Cc3ccc(O)cc3)S2)CC1 2296672256 DZZAJJSJHZRDMQ-UHFFFAOYSA-N 331.397 1.527 10 10 EDCE C[C@H]1CN(C2CCN(C(=O)C=Cc3ccc(O)c(O)c3)CC2)CCO1 2307987307 ROEQAOOJNSNYLJ-AWEZNQCLSA-N 346.427 1.823 10 10 EDCE Cc1ccc(CN(C)S(=O)(=O)C2CNC2)c(O)c1Br 2352641359 SIRGSGIAIDLBKU-UHFFFAOYSA-N 349.250 1.197 10 10 EDCE O=C1CN(C(=O)c2cccc3c2C(=O)c2ccccc2C3=O)CCN1 175279447 DMWXTBWNOIXLLV-UHFFFAOYSA-N 334.331 1.034 10 10 EDCE C[C@@H](O)CCCN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2361180308 CZEDYARJICROEL-AMIZOPFISA-N 342.237 1.998 10 10 EDCE CCN1C(=O)CN(CN2CCN(c3ccc(OC)cc3)CC2)C1=O 172405938 HCUOZIRQTOTEGQ-UHFFFAOYSA-N 332.404 1.059 10 10 EDCE CCOc1ccc(O)c(CN2CCN([C@H](C)C(=O)NC3CC3)CC2)c1 123357349 IBHQKNUEXBKXFG-CQSZACIVSA-N 347.459 1.576 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cncnc1N 185401952 BYLVCYOBMPWROF-UHFFFAOYSA-N 327.388 1.168 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)CC3(O)CC3)c(Br)cc21 2365712897 VJJKDZBQHXUXEM-GFCCVEGCSA-N 340.221 1.623 10 10 EDCE CSc1ncc(CN[C@@](C)(C(=O)O)[C@@H](C)S(C)(=O)=O)s1 2372948214 LHPQGXBYXXWLSO-RDDDGLTNSA-N 338.476 1.231 10 10 EDCE C[C@H](CN1CCOCC1)C(=O)NCc1ccc(N2CCCC2)cc1 273082873 MRBSYIZFFCMBJD-MRXNPFEDSA-N 331.460 1.871 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)c1 289595792 UWJJXMILXQYMBK-OAHLLOKOSA-N 342.461 1.647 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C 808486749 XPQJUZPCENZXJV-HNNXBMFYSA-N 335.356 1.639 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(NCCc3ccc(O)c(O)c3)cc2N1 811811530 WXBPKLWWGXIKMD-UHFFFAOYSA-N 345.311 1.992 10 10 EDCE COc1cc(N(C)CC(=O)N2CCO[C@@H](C)C2)cc(OC)c1OC 741798391 BBUPRFZDGWFUTI-LBPRGKRZSA-N 338.404 1.396 10 10 EDCE CN1CCN(C(C)(C)CNC(=O)NCc2c(O)cccc2F)CC1 913997626 UWNBLDSDWWVGRP-UHFFFAOYSA-N 338.427 1.357 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(=O)O)c1cc(CCO)ccc1O 687810637 NBIYLRGXEGVXEK-LBPRGKRZSA-N 325.361 1.968 10 10 EDCE CSC[C@@H]1NC(=O)N([C@H](C)c2ccc(N3CCOCC3)cc2)C1=O 924533865 NKEBLTKOORBOOQ-DOMZBBRYSA-N 349.456 1.868 10 10 EDCE COC(=O)C(C)(C)CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852200584 YGZCVJTULAXFLA-ZDUSSCGKSA-N 349.431 1.772 10 10 EDCE O=C1C[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CN1CC1CC1 925114929 SZMVMXDYRXNTSP-AWEZNQCLSA-N 343.383 1.167 10 10 EDCE O=C1N[C@@H](CCF)C(=O)N1Cc1ccc(N2CCC(O)CC2)cc1 853089894 VJFBEHABVSKZLP-HNNXBMFYSA-N 335.379 1.428 10 10 EDCE Cc1cc(Br)c(O)c(CNC[C@@H]2COCCN2C)c1 858276423 OKOHGQKBQBOHNF-GFCCVEGCSA-N 329.238 1.883 10 10 EDCE CCN(CC)C(=O)CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852011599 PJYZFAKTBDMIFA-AWEZNQCLSA-N 348.447 1.442 10 10 EDCE C[C@@H]1CCN(CC(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 856216282 TXPPBJKCOLZSFO-OAHLLOKOSA-N 331.460 1.606 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)N3CCSCC3)C2)cc1 855233665 KHKYBNSNWRDEJE-GJZGRUSLSA-N 349.500 1.827 10 10 EDCE CCNCc1ccc(N2C[C@H](O)C[C@H]2CO)cc1Br 698180112 KCUGCGHFYBNHFJ-QWHCGFSZSA-N 329.238 1.491 10 10 EDCE COC(=O)C1CCN(S(=O)(=O)N[C@@H](C)c2ccccc2O)CC1 867834598 RIFGOTDSLNFADO-NSHDSACASA-N 342.417 1.173 10 10 EDCE Nc1ccc(CCNC(=O)N2CCC(CO[C@@H]3CCNC3)CC2)cc1 861640466 LYHYNANMTPAIHP-GOSISDBHSA-N 346.475 1.611 10 10 EDCE COc1cc(Br)cc([C@@H](C)N[C@@H]2COC[C@@H]2O)c1O 866421229 YBOMPXIOUUXJOL-ONOSFVFSSA-N 332.194 1.574 10 10 EDCE NS(=O)(=O)C[C@H]1CCCN1Cc1cc(Cl)cc(Cl)c1O 769428711 RRJNNPQGVFLYGK-SNVBAGLBSA-N 339.244 1.952 10 10 EDCE O=C(CSCC(=O)N1Cc2cccc(O)c2C1)N1CCCCC1 871198508 IRDGKEBGBXRVSJ-UHFFFAOYSA-N 334.441 1.980 10 10 EDCE C[C@@H]1CO[C@H](C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 891515529 OBWLLMDQLXJGIV-NHYWBVRUSA-N 340.370 1.843 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3C[C@H](C)CO3)cc2)CC1 890129157 CVWFLLJLVPUWJR-KBXCAEBGSA-N 345.443 1.396 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@H](C)CO3)CC2)cc1 896330989 QETQOUGTQOITEQ-MAUKXSAKSA-N 347.459 1.358 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@H](CO)C2)cc1Br 396880388 OQALCXTUYCLPFZ-WFASDCNBSA-N 343.265 1.738 10 10 EDCE CC(=O)N1C[C@H](C(=O)NCc2c(O)cccc2F)Oc2ccccc21 1156164192 RCRCFOSIVTUXER-QGZVFWFLSA-N 344.342 1.962 10 10 EDCE COC(=O)[C@@H](Cc1ccccc1O)NC(=O)Cc1ccc(O)c(O)c1 1167470591 VUNFNQRTBWVHKH-CYBMUJFWSA-N 345.351 1.246 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@H]1CCN(CC(F)F)C1 1175685652 HYAJOUZXTXHHKR-DTRQGZQOSA-N 326.343 1.814 10 10 EDCE CN1CCN(c2ccc(CNCC[C@]3(O)CCOC3)cc2F)CC1 1329658620 GCWQCXVPPNWOFJ-SFHVURJKSA-N 337.439 1.209 10 10 EDCE O=C(O)[C@H](NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCO1 1331846222 RCCZPPZVDHXQFJ-JKSUJKDBSA-N 338.379 1.384 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)N1CC[C@@H](N=[N+]=[N-])C1 1912169456 KSXMOSXPWMFMCI-ZCFIWIBFSA-N 335.187 1.256 10 10 EDCE Cn1c(S)nnc1[C@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1443703658 RPQLCWPTASKJMQ-NSHDSACASA-N 348.428 1.464 10 10 EDCE CN(CC1(O)CCC1)c1cc2c(cc1Br)[C@H](O)C(=O)N2 1914603203 ZDCCURLHSFFETH-LBPRGKRZSA-N 341.205 1.786 10 10 EDCE COC(=O)[C@H](CNC(=O)c1c(F)ccc(O)c1O)c1ccccc1 1457663817 KFVNGAOGTCTXKB-LLVKDONJSA-N 333.315 1.924 10 10 EDCE COc1cc(/C=C2/NC(=S)N(C)C2=O)cc(Br)c1O 456267 PCSFHLHHPWUJQS-XBXARRHUSA-N 343.202 1.851 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC(c2cnn(C)c2)=NO1 1624955096 RLAVZYSGRIRQBJ-QLJPJBMISA-N 344.371 1.072 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H]2CCCNC2=O)cc1C 1713602522 PHENWPRDKPJRSM-HNNXBMFYSA-N 333.432 1.078 10 10 EDCE Cc1cc(C(=O)NCc2ccc(O)cc2O)c2c(O)nn(C)c2n1 1630302174 RYOCPMOAUICIDX-UHFFFAOYSA-N 328.328 1.324 10 10 EDCE Cn1nccc1[C@@H](O)CNC(=O)c1cc2cc(O)c(O)cc2s1 1639198628 FATIFJANCZZQTG-LBPRGKRZSA-N 333.369 1.509 10 10 EDCE COc1ccc(CN[C@H]2CCC[C@H](NC(=O)CNC(C)=O)C2)cc1C 1567157126 JBNMUHGFHRKWCP-IRXDYDNUSA-N 347.459 1.657 10 10 EDCE COC(=O)NCC(=O)N(C)[C@H](C)CNCc1ccc(OC)c(C)c1 1732411927 XPMINULHNFCKEK-CYBMUJFWSA-N 337.420 1.296 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)Cn2ccnc2)C2CC2)cc1C 1733192048 ZRWBSKJVQWAQHV-KRWDZBQOSA-N 342.443 1.885 10 10 EDCE O=C(CCc1nc2ccccc2oc1=O)NCc1ccc(O)cc1O 1570462208 JAQXUNAXUFQCAL-UHFFFAOYSA-N 340.335 1.848 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@H]2CC23CCC3)cc1 1757998098 REXQYSYJJVYIBX-CYBMUJFWSA-N 343.387 1.885 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCO[C@@]3(CCOC3)C2)cc1 1597917839 QZAXVKMHDYDYGO-CJNGLKHVSA-N 332.360 1.917 10 10 EDCE CC1=NN(c2ccccc2)C(=O)/C1=C(\C)NCCN1CCOCC1 13519819 PLLQJUCORDUOPM-SAPNQHFASA-N 328.416 1.605 10 10 EDCE CCNCc1ccc(N2CC(=O)NC(=O)C2)c(Br)c1 233516241 PUUCBSZHUDAQOJ-UHFFFAOYSA-N 326.194 1.021 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H]2[C@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)[C@@H]2C1 2003168224 FQSUNUIMLAUIQQ-HVNMYJMUSA-N 336.432 1.755 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C 1985101052 NFHMJYFKAQKXQH-LLVKDONJSA-N 327.385 1.781 10 10 EDCE NCc1cc(F)c(N2[C@H](CO)C[C@@H]3OCC[C@@H]32)cc1Br 2146706382 ZQGPIAXELRMYNU-WFBYXXMGSA-N 345.212 1.775 10 10 EDCE COc1ccc(O)c(CNC[C@@](C)(CO)NC(=O)OC(C)(C)C)c1 2010530167 OBFGDCJDJLWTJW-KRWDZBQOSA-N 340.420 1.766 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NC(=O)Nc2ccc(N)cc2)C1 2011488670 YPQIRDKZSFDZMY-OLZOCXBDSA-N 336.392 1.371 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)C[C@H](O)CNC(=O)OC(C)(C)C 2022869831 DHRRUSFDMZAXPY-AWEZNQCLSA-N 337.420 1.503 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)c(Br)c1 2158406580 ARVXRDCFODMUEU-VGKMCQHDSA-N 341.249 1.925 10 10 EDCE COc1ccc(N2CCNC[C@H]2CO)c(OC)c1Br 2106377725 QUZRDJDUPVGHBE-VIFPVBQESA-N 331.210 1.237 10 10 EDCE NCc1ccc(N2CC[C@@H](OCCO)C2)c(F)c1Br 2109130741 OGCRIMCGZUYIOY-SNVBAGLBSA-N 333.201 1.635 10 10 EDCE CNCc1ccc(N(C)[C@H]2CCCNC2=O)c(Br)c1 2114631790 MJJSRDXORZPAOF-ZDUSSCGKSA-N 326.238 1.883 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CN(CCCN=[N+]=[N-])C[C@@H]2[C@@H]1CO 2211158654 QFOKUOLAESNMIS-AVGNSLFASA-N 325.413 1.846 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@H]3[C@@H]4CO)c(Br)cc2[C@H]1O 2203022440 VKVFVBGIRNGYLT-HGAATKPUSA-N 339.189 1.252 10 10 EDCE Cc1c(C=CC(=O)N(C)c2cccc(S(C)(=O)=O)c2)cnn1C 2305472677 VSQVHWZXDXGKKD-UHFFFAOYSA-N 333.413 1.808 10 10 EDCE C[C@H]1CN=C(N2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)S1 175789016 HNPYQDHKJVXFKY-NSHDSACASA-N 336.417 1.909 10 10 EDCE COc1ccc(N2CCN(C(=O)NCc3cnn(C)c3C)CC2)cc1 179219036 XJGFAVNPMFEWSZ-UHFFFAOYSA-N 343.431 1.769 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2358209398 PKWAXLVCYODCSR-IYMWITQMSA-N 347.228 1.609 10 10 EDCE C[C@@H](N[C@H]1CCc2ncnn2C1)c1ccc(N2CCOCC2)cc1 180578999 MXEKWOJJHAVMQB-ZBFHGGJFSA-N 327.432 1.780 10 10 EDCE CN1CCN(c2ccc(/C=C\C(=O)O)cc2Br)CC1=O 312195454 SWPZVSPYWNXXEM-HYXAFXHYSA-N 339.189 1.825 10 10 EDCE CN(C)c1noc([C@@H]2CCCN(C(=O)c3cccc(O)c3O)C2)n1 194482953 DMFGIIBJMUYINC-SNVBAGLBSA-N 332.360 1.567 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)CCO1 529644735 WPSLSWKTOIVGBR-LLVKDONJSA-N 331.775 1.315 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)C(N)=O)C1 435534288 ZQFHZOICRLFHIG-CYBMUJFWSA-N 342.443 1.398 10 10 EDCE Cc1ccc(CNc2cnn(CC(N)=O)c2)c(O)c1Br 2381133332 MYCMDHLSYYCCJH-UHFFFAOYSA-N 339.193 1.757 10 10 EDCE CN1CCO[C@H]2CN(Cc3c(O)cccc3Br)C[C@@H]21 1275944269 CIFQHFMRLBEFQS-JSGCOSHPSA-N 327.222 1.670 10 10 EDCE COc1ccc(N2CCN(CCNCc3cn(C)cn3)CC2)cc1 808383444 DWJBNAZZZGWMSH-UHFFFAOYSA-N 329.448 1.341 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C[C@H](C)CS(C)(=O)=O 823581367 HNJXJVWXPZAXAN-ZDUSSCGKSA-N 343.445 1.438 10 10 EDCE COC[C@]1(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCOC1 825421010 ASHNNPCSKWNDOD-DNVCBOLYSA-N 348.443 1.754 10 10 EDCE Cc1cc(CC(=O)N[C@]2(CO)CCOC2)c(C)n1-c1ccccc1 832149155 SWBSBPWGNVAZRL-IBGZPJMESA-N 328.412 1.904 10 10 EDCE COc1ccc(N2CC[C@H](NC(=S)NC[C@H]3CCCO3)C2)cc1 849271103 AEOYAHRVTMDPPE-XJKSGUPXSA-N 335.473 1.917 10 10 EDCE CN(C)CCN1CCN(Cc2cc(C(C)(C)C)cc(O)c2O)CC1=O 844714753 QBRIMUPMPROVBF-UHFFFAOYSA-N 349.475 1.601 10 10 EDCE CC(C)Oc1ccc(N(C)Cc2cc(=O)n3nc(N)[nH]c3n2)cc1 856738987 UGNJOIQDLNQVRO-UHFFFAOYSA-N 328.376 1.423 10 10 EDCE CCO[C@H]1C[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)C1 852004821 KWJIWXKFAAIZTG-JCNLHEQBSA-N 333.432 1.890 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)N[C@H](CC(F)F)C3=O)C2)cc1 924977292 HPOJSICOSLRCKZ-WCQYABFASA-N 339.342 1.850 10 10 EDCE COC[C@@H](NC(=O)NCc1ccc(OC)cc1O)C1CCOCC1 852470164 MRIZUENFALBCNM-OAHLLOKOSA-N 338.404 1.642 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCc3cncn3C)C2)cc1 855225422 IUNKFEQSOYBAMV-AWEZNQCLSA-N 328.416 1.756 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)c1cn2c(n1)COCC2 860243460 NTUATJBKPHRHFD-UHFFFAOYSA-N 327.384 1.928 10 10 EDCE CC(=O)N1CCC[C@@H](C(=O)NCc2ccc3cccnc3c2O)C1 862029520 XYIYGQTZIGKIPM-OAHLLOKOSA-N 327.384 1.815 10 10 EDCE O=C1NC(=O)[C@]2(CCCN(Cc3cc(Cl)cc(F)c3O)C2)N1 789767444 BWHCBLHXJLIRIA-CQSZACIVSA-N 327.743 1.359 10 10 EDCE CC1(C)COC[C@H]1NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 894384093 CWUPUUXAGPQBAH-NVXWUHKLSA-N 331.460 1.903 10 10 EDCE Cn1ncnc1C1(O)CN(Cc2ccc(N3CCCCC3)cc2)C1 895620543 IBJPRQNCEQAJIA-UHFFFAOYSA-N 327.432 1.509 10 10 EDCE CN(Cc1ccccc1)C[C@@H](NC(=O)Cc1ccc(N)cc1)C(=O)O 702220489 GIZGWVKZIMXBRI-QGZVFWFLSA-N 341.411 1.513 10 10 EDCE CCN1CCC[C@H]1CN(CCN(C)C)C(=O)c1cccc(O)c1O 1143139683 AGVDHRAFZSBWNW-AWEZNQCLSA-N 335.448 1.586 10 10 EDCE CNCc1ccc(N2CCN(C)[C@H](CO)C2)cc1Br 687616842 USITYWWLQRLNBS-ZDUSSCGKSA-N 328.254 1.281 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@H](O)Cc1ccccc1F 1177982227 VELKQYNVGHNTIG-IQCBXXCUSA-N 331.343 1.970 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C[C@H]2CCN(C)C2)cc1C 1265850316 CRYFHBBUIAJJOX-NVXWUHKLSA-N 333.476 1.940 10 10 EDCE COC(=O)c1cnc([C@H](C)NC(=O)Cc2ccc(O)c(O)c2)s1 1469215856 BSBNTSABVRSQKP-QMMMGPOBSA-N 336.369 1.761 10 10 EDCE C[C@H](CNCc1ccn(C)n1)NC(=O)c1ccc(N=NC(N)=O)cc1 1483200518 YPABWWXSVURWRU-LLVKDONJSA-N 343.391 1.491 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@H](O)c3cnn(C)c3)CC2)cc1 1626479338 GVTHFRJCEUCPLO-KRWDZBQOSA-N 344.415 1.247 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2cnn(C)n2)cc1C 1482149943 PJRSWTMLXMIVLH-GFCCVEGCSA-N 331.420 1.288 10 10 EDCE NC(=O)N1CCc2ccc(NC(=O)c3c(F)ccc(O)c3O)cc21 1638647191 DVMKWDWWRINWIZ-UHFFFAOYSA-N 331.303 1.930 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1ccc2c(c1)COB2O 1643285005 PVRHZGRQIBSDHN-UHFFFAOYSA-N 334.140 1.088 10 10 EDCE C[C@@H]1CCN(CC(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1589179344 MHIXIDXRBSQBOI-MRXNPFEDSA-N 330.476 1.396 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@]1(Br)CC1(F)F 2137804987 SIDRDPRCWISOKS-LLVKDONJSA-N 336.132 1.929 10 10 EDCE CC[C@@H](CNC(=O)Cc1cnn(C)c1)NCc1ccc(OC)c(C)c1 1665764783 FACLXWFVMKTRRS-KRWDZBQOSA-N 344.459 1.964 10 10 EDCE CN1C[C@H](C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)CC1=O 1889615136 LCGXMZGWASEWFL-UXLLHSPISA-N 327.428 1.770 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCN1C[C@H]2CCCCN2C1=O 1301313242 OTPRFLGFUULKPG-CYBMUJFWSA-N 333.388 1.047 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](C(=O)NCCN=[N+]=[N-])[C@H]1CCOC1 1965103319 ZYBUDOOYISAJQH-QWRGUYRKSA-N 327.385 1.590 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2COC[C@@]2(C(=O)NCCN=[N+]=[N-])C1 1985102706 KURBPOJXKUXPOM-YGRLFVJLSA-N 325.369 1.296 10 10 EDCE C[C@H](NC[C@@H](O)CNC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985775918 OQGUUNUGNQEPRU-CMPLNLGQSA-N 326.393 1.634 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3OCCN(C)[C@@H]3C2)cc1Br 2153995288 QEKPOECYLYAJLZ-COLVAYQJSA-N 340.265 1.988 10 10 EDCE CO[C@@H]1[C@@H]2C[C@@H]3[C@@H]1N(C(=O)c1cnn4c(O)cc(C)nc14)C[C@@H]3C2 2063047561 STTCVLRBCDZESQ-UQXKVLDMSA-N 328.372 1.239 10 10 EDCE CNCc1ccc(N2CCN([C@@H](C)CO)CC2)c(Br)c1 2169366866 RLCDIUNVWPECQP-LBPRGKRZSA-N 342.281 1.671 10 10 EDCE Oc1cc(Br)ccc1CNC[C@@H]1CO[C@@H]2COC[C@H]21 2101846497 IQKATOWNLYJHJI-SCDSUCTJSA-N 328.206 1.906 10 10 EDCE O=C(NC1CC1)C1CN(c2ccc(CO)cc2Br)C1 2111746590 UUISYCTXQJTGSA-UHFFFAOYSA-N 325.206 1.656 10 10 EDCE COc1ccc(Br)c(CN(C)C[C@H]2CNCCO2)c1O 2236031907 JIURIQFKWBWHKO-SNVBAGLBSA-N 345.237 1.584 10 10 EDCE NCc1ccc(N2C[C@@H](CO)C[C@H](CO)C2)c(Br)c1 2228401353 CTRCFHRSNPACPL-RYUDHWBXSA-N 329.238 1.335 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2c[nH]c(C(=O)O)c2)s1 2284544277 NYAXHYZTHVRIKU-UHFFFAOYSA-N 333.416 1.370 10 10 EDCE CSc1ncc(CNCc2nc(CS(C)(=O)=O)no2)s1 2284632301 ZPPNGBYDJCSUST-UHFFFAOYSA-N 334.448 1.082 10 10 EDCE NCc1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2332599609 SHACYTULFLPQGC-HYNSBDGHSA-N 327.222 1.228 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)c(Br)c1 2353966528 UKZNVLWHGAKBEX-COLVAYQJSA-N 342.281 1.841 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)NCc3ccco3)CC2)cc1 9859366 DMGYNUQNJHCPLI-UHFFFAOYSA-N 343.383 1.253 10 10 EDCE O=C(CNC(=O)c1cccc2c1C(=O)c1ccccc1C2=O)NC1CC1 175279050 ASHAHQRHSZDGOZ-UHFFFAOYSA-N 348.358 1.470 10 10 EDCE COc1ccc(N2CCN(C(=O)c3c(C)n(C)oc3=O)CC2)cc1 74660735 BJSCZEURQYISAK-UHFFFAOYSA-N 331.372 1.258 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cn(C)nc1C 190481372 NUIFJIRZGXIURZ-UHFFFAOYSA-N 330.388 1.811 10 10 EDCE N[C@H]1CCC[C@H](C(=O)NCc2ccc(N3CCNCC3)c(F)c2)C1 238044121 COJBLAXISRVTII-GJZGRUSLSA-N 334.439 1.369 10 10 EDCE C[C@@H](NCCNS(=O)(=O)c1cccnc1)c1ccc(N(C)C)cc1 90584042 WQMVLUJMLFJZHE-CQSZACIVSA-N 348.472 1.777 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2cc(Cl)c(F)cc2O)CCO1 529640068 BCOBCWMZNSTYIO-SNVBAGLBSA-N 331.775 1.315 10 10 EDCE O=C(O)C1CCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1 255883811 HATDIXOQEJPUAO-UTCJRWHESA-N 344.411 1.860 10 10 EDCE COc1cc(O)c(CN2CCC[C@H](c3ccnc(N)n3)C2)cc1OC 377702702 UNUXUFNXJIIIOR-LBPRGKRZSA-N 344.415 2.161 10 10 EDCE CNC(=O)C1(C(=O)NCc2cc(Br)ccc2O)CC1 804736012 JZYIBVXYCRPJDP-UHFFFAOYSA-N 327.178 1.297 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCN(c2ccc(F)c(F)c2)C1=O 808507979 NCWBDGMCNNMAHB-SNVBAGLBSA-N 325.267 1.019 10 10 EDCE CCOC(=O)C(=O)[C@H](N)c1cc(Br)cc([N+](=O)[O-])c1O 725396861 BBPCNRLVNXJZML-MRVPVSSYSA-N 347.121 1.195 10 10 EDCE COc1ccccc1N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 586741131 VSSIKCVFCHQNCE-UHFFFAOYSA-N 344.367 1.774 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CC[C@@H](N2CC[C@H](O)C2)C1 908200555 JEDFMPDZURSVOB-NEPJUHHUSA-N 348.424 1.594 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CCC[C@@](O)(CO)C3)ccc21 838031710 NCOAGJQQHMBKJK-SFHVURJKSA-N 333.432 1.098 10 10 EDCE COC(=O)/C(C)=C/CNC(=O)NCc1ccc(N2CCOCC2)cc1 914335461 HFFGZJDRGQOJKE-VGOFMYFVSA-N 347.415 1.442 10 10 EDCE O=C(/C=C\c1cnccn1)NCc1ccc(N2CCOCC2)c(F)c1 918161354 DJCHJGXPSVTLQS-RQOWECAXSA-N 342.374 1.782 10 10 EDCE C[C@H]1CCNC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 842214342 PJGYSCFVRDYDKM-WMLDXEAASA-N 344.459 1.017 10 10 EDCE Cc1cc(Cl)cc(CN2CCC[C@H](N3CCNCC3=O)C2)c1O 843065898 RBNASCJFOIMNSU-HNNXBMFYSA-N 337.851 1.750 10 10 EDCE COc1ccc(CNS(=O)(=O)C[C@@]23CCCN(CC2)C3)c(O)c1 915165061 RFVSWKNDABYJAJ-INIZCTEOSA-N 340.445 1.306 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)/C=C/Cn3cncn3)C2)cc1 911275408 DXECTRQMMBOWKO-XYBNCVKDSA-N 341.415 1.486 10 10 EDCE CCO[C@@H]1[C@@H](C)[C@@H]1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 918904817 BNQFQIXNHBHXKD-JCGIZDLHSA-N 331.460 1.726 10 10 EDCE COCCN1CC(=O)N([C@@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849357299 LENAVJQXNRWOCR-CQSZACIVSA-N 333.388 1.185 10 10 EDCE CC1(C)CN(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 847508057 UKVGJSRVADEMBV-UHFFFAOYSA-N 345.487 1.853 10 10 EDCE Cc1cc(O)c(CNCCNS(=O)(=O)NC(C)C)c(Cl)c1 840942076 RNGNFWLUZWISNQ-UHFFFAOYSA-N 335.857 1.276 10 10 EDCE O=C(O)C1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 857096846 HEFDEXIALSNGDJ-UHFFFAOYSA-N 335.429 1.466 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NCc1cc(Cl)cc(C(C)=O)c1O 852414889 AQIZEMNOCGABDO-GXTWGEPZSA-N 327.764 1.668 10 10 EDCE CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)NCc1c(O)cccc1F 928704975 BPCIYTUGDHQMAR-CQSZACIVSA-N 344.408 1.254 10 10 EDCE COc1ccc(CNC(=O)NC[C@@]2(OC)CCSC2)c(O)c1 925376948 HKLCYSBAXZYZRX-HNNXBMFYSA-N 326.418 1.722 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)CCCN(C)C)C2)cc1 854299186 MPTRBZHNTMHZCI-OAHLLOKOSA-N 334.464 1.867 10 10 EDCE CCOC(=O)C[C@@H](O)CN(Cc1ccccc1O)C[C@H]1CCCO1 859190411 JXULWYOIPXFTBA-HZPDHXFCSA-N 337.416 1.687 10 10 EDCE CCOC(=O)[C@@H]1c2ccoc2CCN1C(=O)c1cccc(O)c1O 862685913 YITLIEHVBNQWKO-AWEZNQCLSA-N 331.324 1.994 10 10 EDCE O=C(CN1CC[C@@H]2C[C@@H]21)NCc1ccc(N2CCOCC2)c(F)c1 761096792 RCABTVMDHNEIHF-PBHICJAKSA-N 333.407 1.373 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@]2(C)CC2(F)F)cc1F 1118667937 GMSYDAVORJEMIA-HNNXBMFYSA-N 343.349 1.669 10 10 EDCE Cc1ccncc1COC(=O)c1cc(NS(C)(=O)=O)ccc1O 771343010 AJRHZFJUTBCTPI-UHFFFAOYSA-N 336.369 1.824 10 10 EDCE COC(=O)[C@@]1(O)CCN(Cc2ccc(N(C)C)cc2C(F)(F)F)C1 895702683 DYEHVFWVAPDCAX-OAHLLOKOSA-N 346.349 1.881 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1CN([C@@H]2CCOC2)C1 897984315 VJVQEBDZLFCHKC-HNAYVOBHSA-N 345.487 1.829 10 10 EDCE CNC(=O)N[C@@H]1CCCN(c2ccc(CN)c(Br)c2)C1 702151863 HADILWURXJWADM-LLVKDONJSA-N 341.253 1.806 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@H]2CCCCN2S(C)(=O)=O)c1 797097846 YVIDHWGIDHNLLB-CHWSQXEVSA-N 342.461 1.866 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@@H](O)Cc1ccc(F)cc1 1155514797 YRBLCPHILFJJKW-UVCVVPOWSA-N 331.343 1.970 10 10 EDCE NCc1ccc(N2CCC[C@@H]2[C@@H](O)CO)c(F)c1Br 2123233407 CYKDBDHZVQTQIO-KOLCDFICSA-N 333.201 1.369 10 10 EDCE C[C@@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1322198273 VIIOOMREIHXTAO-PBHICJAKSA-N 345.443 1.444 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3NC(=O)O[C@@H]3C2)cc1Br 2120414656 CJQGGSAWZONQOH-NZXMKCKXSA-N 327.178 1.799 10 10 EDCE COCCN(CCF)C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1261704908 GSIDTQRCKDIYMQ-CYBMUJFWSA-N 339.411 1.374 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C(C)(F)F 1285617462 LTQLQCVRFWLJAC-MRVPVSSYSA-N 341.318 1.739 10 10 EDCE COC[C@@H]1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 221250313 BVVPXWQKSNLDDM-AMIZOPFISA-N 340.221 1.874 10 10 EDCE COc1cc(OC)nc(C(=O)NCc2ccc3cccnc3c2O)n1 1299726999 XBOXBKHXPNQAGH-UHFFFAOYSA-N 340.339 1.678 10 10 EDCE NC(=O)[C@@H]1CC[C@H](CCC(=O)NCc2cc(Cl)ccc2O)O1 1469876168 CZVGMIZSRQIWPO-YPMHNXCESA-N 326.780 1.475 10 10 EDCE CC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)N1CCOCC1 1465635743 QKLVCUPLZMWAOT-CYBMUJFWSA-N 347.375 1.216 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CCCN1C(=O)C(F)(F)F 1471661374 PQHOGLHNEVRGEL-SNVBAGLBSA-N 332.278 1.267 10 10 EDCE CCCN1CCC(CO)(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1485027628 UVRGGQOYXAEZPF-UHFFFAOYSA-N 347.419 1.816 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(C)co1 1624659357 SPLUPMXIPAIZKF-LBPRGKRZSA-N 333.340 1.903 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@@H](C)OC 1582482869 OTODUISASOJEBA-ZYHUDNBSSA-N 349.391 1.509 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ncncc1Br 2148022406 UPKBBBUEAWAQFC-UHFFFAOYSA-N 338.161 1.623 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(C2CCN(CCN=[N+]=[N-])CC2)C1 1983442801 NLRDUANUEPAGHL-UHFFFAOYSA-N 325.413 1.991 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1987702163 PEKAHJIQAQUPGN-QWRGUYRKSA-N 327.385 1.421 10 10 EDCE Cn1cc(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)c(=NC(=O)OC(C)(C)C)[nH]1 2010391081 MIOYVNQJGUGLBF-SECBINFHSA-N 335.368 1.714 10 10 EDCE O=C1CN(Cc2ccccc2)CC(=O)N1CCc1ccc(O)c(O)c1 2031072180 AFFSGVWPCSQYPP-UHFFFAOYSA-N 340.379 1.511 10 10 EDCE C[C@H]1C[C@@H]2CN(c3ccc(CO)c(Br)c3)CCN2C1=O 2181182198 KYPJXLZGPJTVKR-GXFFZTMASA-N 339.233 1.998 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4[C@H](CO)[C@@H]4C3)c(Br)cc21 2182050597 QGDQTQZLUVAAEI-LOKDSWTASA-N 338.205 1.076 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)cc1Br 2102181153 NLBQEDUDWLPGEV-YUTCNCBUSA-N 327.222 1.364 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2210538021 QISIQDSDWPIREE-GARJFASQSA-N 327.385 1.874 10 10 EDCE NCc1nnc2n1CCN(Cc1cc(Br)ccc1O)C2 2203331277 VVKGGHNGLSGTCF-UHFFFAOYSA-N 338.209 1.221 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(NC(=O)c2cccc(O)c2O)C1 2216762689 KVLXQFLRULWPFF-DYZYQPBXSA-N 334.372 1.837 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(NC(=O)COc2ccc(N)cc2)C1 2223011649 ITHXJXCJIROYAN-SGTLLEGYSA-N 347.415 1.773 10 10 EDCE C[C@H](O)c1ccc(N(C)Cc2nn(C)nc2Br)cc1O 2235267999 WEDBZIMKPOSMIV-QMMMGPOBSA-N 341.209 1.973 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](N)[C@H]3COC[C@@H]32)c1O 2236039756 DHSSPVURODITIR-USWWRNFRSA-N 343.221 1.321 10 10 EDCE Cc1ccc(O)c(CNC(CO)(CO)CNC(=O)OC(C)(C)C)c1 2247109030 ZWBJHEDHTKKAOV-UHFFFAOYSA-N 340.420 1.038 10 10 EDCE COc1ccc(N(CCO)CCCNC(=O)OC(C)(C)C)c(N)c1 2247479795 VWRVIVAJKCZDOV-UHFFFAOYSA-N 339.436 1.991 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2C[C@@H](O)Cc3ccccc32)c1 493237951 JQFNWQKLCPEDSW-WLMCBFPDSA-N 337.379 1.405 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)cc1Br 2330385738 KFELOEAIUPNAGD-DSMZTOPNSA-N 328.206 1.262 10 10 EDCE CNCc1ccc(N2CC(N(C)C(C)=O)C2)c(Br)c1 2353536941 PTPNGWRCXQTYIM-UHFFFAOYSA-N 326.238 1.835 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2358209399 PKWAXLVCYODCSR-OJICRYGUSA-N 347.228 1.609 10 10 EDCE COc1cc(N2CCN(Cc3cncnc3)CC2)cc(OC)c1OC 184751954 UHHLTOADUXBHRA-UHFFFAOYSA-N 344.415 1.825 10 10 EDCE O=C(c1cccc(O)c1O)N1CCN(C[C@@H](O)c2ccccc2)CC1 188428363 OJQGEVHQNKZWDX-QGZVFWFLSA-N 342.395 1.589 10 10 EDCE N[C@@H]1CCC[C@@H](C(=O)NCc2ccc(N3CCNCC3)c(F)c2)C1 237872245 COJBLAXISRVTII-HUUCEWRRSA-N 334.439 1.369 10 10 EDCE CC1(CNC(=O)NCc2cc(Br)ccc2O)COC1 805110285 SBIMYFUPWWWGMV-UHFFFAOYSA-N 329.194 1.990 10 10 EDCE CN1CCN(C)CC(C(=O)NCCCSc2nccs2)C1 906670540 KSUPYLCTDYGPFS-UHFFFAOYSA-N 328.507 1.235 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C12CCN(CC1)C2 900899054 FVRSRPUORSMYMI-UHFFFAOYSA-N 347.434 1.499 10 10 EDCE COc1ccc(N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)nc1 839792826 OPPSRSRCEIXYFP-UHFFFAOYSA-N 347.346 1.603 10 10 EDCE Nc1ccc(CCNC(=O)N2CCCC[C@H]2CN2CCOCC2)cc1 841953699 BJPFZQMJLPZUBN-SFHVURJKSA-N 346.475 1.708 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)C[C@H]3CCOC3)C2)cc1 849415545 BRULXENUYZGCCP-KBPBESRZSA-N 340.445 1.230 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCC[C@H](C(=O)NCCN)C2)cc1 843048091 MNFWZCQXBBWWSR-RCFWFJCLSA-N 330.476 1.553 10 10 EDCE O=C(O)[C@@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CC1 849364480 KXOOQHVKBAANMF-OAHLLOKOSA-N 336.363 1.389 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)N[C@@](C)(CCF)C3=O)C2)cc1 849356089 CCDKOLPGDYCBPY-GUYCJALGSA-N 335.379 1.944 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(C(N)=O)cc3)C2)cc1 855229480 NXPGDKJYBIBLJR-OAHLLOKOSA-N 339.395 1.803 10 10 EDCE COC(=O)c1cnc(CN2CCOc3cc(N(C)C)ccc32)cn1 859217618 NXDSRKUDPJFFFQ-UHFFFAOYSA-N 328.372 1.728 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC3(CO)CCCC3)C2)cc1 854299018 DVGULPAGESHBBH-CQSZACIVSA-N 333.432 1.878 10 10 EDCE C[C@H]1[C@H](C(N)=O)CC[C@@H](C)N1CC(=O)NCc1ccc(N(C)C)cc1 930918429 YTTIQGZREOVTFR-JKIFEVAISA-N 346.475 1.343 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3=CCNCC3)C2)cc1 851664231 URUBZKQWDTYNMU-OAHLLOKOSA-N 330.432 1.493 10 10 EDCE C[C@H](NC[C@@H]1C[C@@H]2COC[C@H]2O1)c1ccc(N2CCOCC2)cc1 930211784 WNJYYTJCVMVMQE-QNDJGXFYSA-N 332.444 1.978 10 10 EDCE Cn1ncc(C(F)(F)F)c1S(=O)(=O)N1Cc2cccc(O)c2C1 867690742 LPOAALFOHMAUIZ-UHFFFAOYSA-N 347.318 1.849 10 10 EDCE CN(C[C@@H](O)CN(C)C(=O)c1cc(O)cs1)C(=O)OC(C)(C)C 869568784 HPNAREYNLDFQMR-NSHDSACASA-N 344.433 1.754 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCN3C(=O)OCC[C@H]3C2)c1O 774914950 ORJRZTDEMUIANF-NSHDSACASA-N 337.332 1.336 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H](O)CC(F)(F)C1 787361233 QJLYNHYDJJXATO-OAHLLOKOSA-N 341.402 1.413 10 10 EDCE COC(=O)c1c(CN(C)[C@H]2CCNC2=O)c2cc(F)ccc2n1C 894093468 DTDWCJRBAIZQCZ-AWEZNQCLSA-N 333.363 1.424 10 10 EDCE C[C@@H](OCc1ccccc1)[C@@H](NC(=O)c1ccc(O)c(O)c1)C(=O)O 706114683 PMZZHQIMUNOWMR-BDJLRTHQSA-N 345.351 1.886 10 10 EDCE Oc1cc(Br)ccc1CN1CCO[C@@]2(CCNC2)C1 717405193 IIYKQCNUVDRFNM-CQSZACIVSA-N 327.222 1.719 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CONC(=O)OC(C)(C)C 1154025463 HJLWMYLSLKQBMN-SNVBAGLBSA-N 340.376 1.601 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccnc2c1CC(=O)N2 1154027399 ULHZHOHLKQNGIU-VIFPVBQESA-N 327.340 1.348 10 10 EDCE Cn1ncc2c(O)nc(CCC(=O)N3Cc4cccc(O)c4C3)nc21 1175031718 VIZZYTYBDCCNEE-UHFFFAOYSA-N 339.355 1.250 10 10 EDCE CC(C)(C)C(=O)N1CCO[C@H](C(=O)N2Cc3cccc(O)c3C2)C1 1175029924 MTZJRWVIXHDCDL-HNNXBMFYSA-N 332.400 1.508 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)Cc1nnc2c(=O)n(C)ccn12 1176070918 TXPARTHJIACDMC-UHFFFAOYSA-N 326.404 1.126 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H](O)C2(C)C)c(Br)c1 2124803111 UIPCYXPXAVEGMT-OXHMUOHRSA-N 330.222 1.823 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2conc2C)cc1C 1272250793 FWKJUNCEYGGWCW-UHFFFAOYSA-N 347.415 1.524 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1csc(-c2ncc[nH]2)n1 1445937024 IJYNECJWRXCFST-UHFFFAOYSA-N 330.369 1.917 10 10 EDCE C[C@@]1(CO)COCCN(c2ccc(CO)c(Br)c2)C1 2135075454 APOYBNDUZSGXLV-CQSZACIVSA-N 330.222 1.777 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)c2cc[nH]c2)cc(OC)n1 1701627159 FQMKCNGHDMQHIS-LLVKDONJSA-N 346.387 1.317 10 10 EDCE COc1ccc(CN[C@@H]2CCN(C(=O)CCNC(N)=O)[C@@H]2C)cc1C 1700826649 RHHFWNUTWYCGOJ-UKRRQHHQSA-N 348.447 1.141 10 10 EDCE C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@@H](C)NC(=O)C(F)F 1486627199 KCXXDGJQPFUGHF-HTQZYQBOSA-N 341.318 1.737 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCS(=O)(=O)C1 1625184919 HKMDTFQGLNSGSI-JTQLQIEISA-N 338.389 1.356 10 10 EDCE O=C(NCc1cccc(O)c1O)c1ncnc(O)c1Br 1633515848 SQSYSHHMLWNICA-UHFFFAOYSA-N 340.133 1.286 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H]1CC(=O)c2ccccc2O1 1642867210 WRHBPPJXNTWUTP-LBPRGKRZSA-N 327.336 1.791 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cnn(C)n3)CCC2)cc1C 1733724406 NYNGLNTVYBJKOX-UHFFFAOYSA-N 343.431 1.574 10 10 EDCE Cc1sc(S(N)(=O)=O)cc1C(=O)N[C@@H](C)c1ccccc1O 1643742202 SUDPAFNQHDXSRO-QMMMGPOBSA-N 340.426 1.901 10 10 EDCE C[C@@]1(CCCC(=O)NCc2cccc(Cl)c2O)NC(=O)NC1=O 1640404456 AXNLGEKCBWUZJT-HNNXBMFYSA-N 339.779 1.430 10 10 EDCE C[C@@]1(C(=O)NCc2c(O)cccc2O)Oc2ccccc2NC1=O 1652626255 UQVPLOQVQLWCNT-KRWDZBQOSA-N 328.324 1.504 10 10 EDCE Cc1ccc(C(=O)N2CCC(O)(CN3CCCCC3)CC2)c(O)c1O 1653601764 TZFJAWCTASEKLA-UHFFFAOYSA-N 348.443 1.859 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](CO)[C@H]1CCOC1 1683421402 OAXAXIIZOXJQKT-QILLFSRXSA-N 349.475 1.689 10 10 EDCE COc1cc(CN2CCC[C@@H](NS(C)(=O)=O)C2)c(O)cc1C 159812125 CCTZZHHXUZZXNF-CYBMUJFWSA-N 328.434 1.223 10 10 EDCE CCOc1cccc(CNCCC(=O)N2C[C@H](C)O[C@@H](C)C2)c1O 1857863904 MOIVEGKNTWWEAR-KBPBESRZSA-N 336.432 1.906 10 10 EDCE COc1cccc(O)c1CNCCn1cc(Br)nn1 1878226421 YHFSBZCVVLWZIJ-UHFFFAOYSA-N 327.182 1.545 10 10 EDCE CC(C)(C)OC(=O)N1CCS(=O)(=O)CCN1CCCCN=[N+]=[N-] 1982246701 YOCXZUQDGTZNGB-UHFFFAOYSA-N 347.441 1.959 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)NCCN=[N+]=[N-])C[C@H](O)C1(C)C 1990023056 PWBYYHNZEWPAKW-LKFCYVNXSA-N 327.385 1.467 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1Nc1c(N)cccc1C(N)=O 2000872664 WXBDCCTUTGJEGW-VXGBXAGGSA-N 336.392 1.072 10 10 EDCE CCOc1cccc(CNC[C@@H](CO)NC(=O)OC(C)(C)C)c1O 2011517130 UDGKFBRDKXXPHW-ZDUSSCGKSA-N 340.420 1.766 10 10 EDCE C[C@H](NC(=O)c1cc(O)c(O)c(O)c1)[C@@H](C)NC(=O)OC(C)(C)C 2015126793 YRPKYQKYWLPIIE-DTWKUNHWSA-N 340.376 1.835 10 10 EDCE Nc1ccc(NC(=O)N(Cc2ccccc2)CC2(O)CNC2)cc1 2016887607 MZUICRSGILXUTQ-UHFFFAOYSA-N 326.400 1.637 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CCCN(c2ncccn2)C1 2062057869 XQAVGPKMIJDNNF-GFCCVEGCSA-N 328.372 1.421 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H](F)[C@@H](CO)C3)c(Br)cc21 2177144358 RGRIKHMFQZPONH-JSTDYGSISA-N 344.184 1.168 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(O)c(O)c1 1907373711 LOFYMYCGFKAYOF-RYUDHWBXSA-N 334.372 1.932 10 10 EDCE Cn1[nH]c(CNC(=O)OC(C)(C)C)nc1=NCc1ccc(O)c(O)c1 2063130081 FSWFNUKWHZGBFS-UHFFFAOYSA-N 349.391 1.285 10 10 EDCE NCc1cc(F)c(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2199532603 QPUVPPHNKUMKCM-DRGUQFHNSA-N 345.212 1.367 10 10 EDCE CC(C)(C)OC(=O)Nc1ccc(F)c(COc2nnc(=N)[nH]n2)c1 2213786830 CPKNPIRZMZABGM-UHFFFAOYSA-N 336.327 1.744 10 10 EDCE CN(CCc1ccc(Nc2nnc(=N)[nH]n2)cc1)C(=O)OC(C)(C)C 2219019213 DKFQGBVKKUGZII-UHFFFAOYSA-N 345.407 1.832 10 10 EDCE COc1cc(N(C)Cc2nn(C)nc2Br)ccc1CO 2235263548 WPQWRNJRVXQPGT-UHFFFAOYSA-N 341.209 1.715 10 10 EDCE C[C@@H]1CN(Cc2cc(Br)ccc2O)CC2(CNC2)O1 2272928014 ZXAUDHBNLSIMEO-SNVBAGLBSA-N 327.222 1.717 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@H]2C[C@H]21 2303769550 CEYYKDZSNFNSEL-QSLWVIQJSA-N 336.432 1.898 10 10 EDCE CN1CCC(CO)(NCc2cccc(Br)c2O)CC1 2352522630 OTWWJXCJSGNWKQ-UHFFFAOYSA-N 329.238 1.701 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@H](F)CN2)c(O)c1Br 2352628122 SNCNPMHSMUWCGJ-UWVGGRQHSA-N 331.185 1.779 10 10 EDCE COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2cc(O)nc(O)c2)c1 170223324 HHPBUYFEDBYIJP-UHFFFAOYSA-N 346.295 1.318 10 10 EDCE CN(C)c1ccc(CNC(=O)NCc2cc(C(N)=O)co2)cc1F 186644543 NUXASGKDKQJJQS-UHFFFAOYSA-N 334.351 1.583 10 10 EDCE C[C@H]1COCCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 221238766 RYHQAIRGCLNEHZ-JVXZTZIISA-N 326.194 1.626 10 10 EDCE CN1CCCc2cc(CNS(=O)(=O)CCN3CCCC3)ccc21 192570276 QIFNPTYFNKYPKQ-UHFFFAOYSA-N 337.489 1.584 10 10 EDCE COc1c(Br)cc([C@H](N)CO)c(O)c1Br 238336843 FPRYUNSPRWWVFP-ZCFIWIBFSA-N 340.999 1.918 10 10 EDCE O=C(O)/C=C\c1ccc(N2CCNC(=O)C2)c(Br)c1 387623546 RZICAWCFIGIPQU-RQOWECAXSA-N 325.162 1.483 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](N)[C@@H]2CCOC2)c(O)c1Br 2380743001 XYSJMFDVOTWGMR-PWSUYJOCSA-N 343.221 1.443 10 10 EDCE Cc1ccc(CNC(=O)[C@@](C)(N)C(C)(C)O)c(O)c1Br 2380752638 XSGDETOUAKFXBH-CQSZACIVSA-N 345.237 1.568 10 10 EDCE COc1ccc(N2CCN(C(=O)c3n[nH]c(C)c3[N+](=O)[O-])CC2)cc1 299514327 HEZDDSPJNFMKFX-UHFFFAOYSA-N 345.359 1.597 10 10 EDCE COc1cc(CN2CCn3c(CO)nnc3C2)c(O)c(C(C)(C)C)c1 824894220 CEWGRYCFRYPYDH-UHFFFAOYSA-N 346.431 1.798 10 10 EDCE Cc1cc(CC(=O)N2CCC(CO)(CO)C2)c(C)n1-c1ccccc1 912554647 SOJYGWSUWVOLBM-UHFFFAOYSA-N 342.439 1.840 10 10 EDCE CC(C)(C)CC(=O)N1CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 841014664 HRNCNYAGKITMSB-UHFFFAOYSA-N 346.431 1.314 10 10 EDCE CC1(C)NC(=O)N(CCCC(=O)NCc2c(O)cccc2F)C1=O 928709618 KBSPGBJINAMVDH-UHFFFAOYSA-N 337.351 1.258 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](NC(C)=O)C(C)C)C2)cc1 855228941 HWCRIAXEWUQFSJ-RHSMWYFYSA-N 333.432 1.551 10 10 EDCE C[C@H](NC[C@@]12COCCN1C(=O)COC2)c1cc(Cl)ccc1O 866551978 FAGXLXAVMZHQAG-ZBEGNZNMSA-N 340.807 1.324 10 10 EDCE Cn1nccc1CC(=O)NCc1ccc(N2CCSCC2)cc1 767654826 BRCQNAIWMBQDNE-UHFFFAOYSA-N 330.457 1.832 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCC[C@@H](OCCO)C1 1119465583 UKNGTFZSNNYEOI-LLVKDONJSA-N 337.397 1.926 10 10 EDCE C[C@@H](Sc1nnnn1C1CC1)C(=O)N1Cc2cccc(O)c2C1 871200568 GRDMRWRFQXAWQY-SECBINFHSA-N 331.401 1.737 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@H](C)[C@@H](C)O1 785427591 DDWUGPVNNGXBMW-MGPQQGTHSA-N 333.432 1.393 10 10 EDCE NS(=O)(=O)C[C@@H]1CCCN(Cc2c(O)ccc(Cl)c2F)C1 792167144 BFFMHVPLCRCPHY-SECBINFHSA-N 336.816 1.685 10 10 EDCE O=C(NC[C@@H](O)COCC1CC1)c1cc2cc(O)c(O)cc2s1 896818386 JWVUUZFBWONYID-LLVKDONJSA-N 337.397 1.830 10 10 EDCE Cn1cc([C@]2(CNC(=O)Cc3ccc(O)c(O)c3)CCCO2)cn1 1636839614 HFZRZZOYGHSBKX-QGZVFWFLSA-N 331.372 1.196 10 10 EDCE CNCc1ccc(N2CCC[C@@H]2[C@@H](O)CO)c(Br)c1 2123223998 XDAQRSNZIVMWQC-KGLIPLIRSA-N 329.238 1.491 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1coc(OC)n1 1329498719 YNJGKRLUCMRXAZ-UHFFFAOYSA-N 334.328 1.594 10 10 EDCE Cc1cc(CC(=O)N[C@@]2(C(=O)O)CCOC2)c(C)n1-c1ccccc1 1328210792 ZTJHDCPHYJDGCF-IBGZPJMESA-N 342.395 1.997 10 10 EDCE COC(=O)[C@H]1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 1337001522 UKMOGUGXIJPAKG-HNNXBMFYSA-N 335.423 1.572 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)c(Br)c1 2132547629 MANIBLBTMMRITB-GNXNZQSNSA-N 327.222 1.351 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1CCC(=O)N1C 1268472665 ZGBXFIGPGWRDJK-INIZCTEOSA-N 347.459 1.563 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)Cc2nonc2C)cc1C 1270559476 OYALIZFAHAPDBA-GFCCVEGCSA-N 346.431 1.780 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)N1CCC[C@H]1CN=[N+]=[N-] 1912189476 WGRPLIFPYXQATC-ZETCQYMHSA-N 349.214 1.646 10 10 EDCE COC(=O)C[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(O)c(O)c1 1603305369 IVCZBVGJZZAZKI-OAHLLOKOSA-N 343.379 1.931 10 10 EDCE Cc1nc2cc(O)nn2c(C)c1CNC(=O)Cc1ccc(O)c(O)c1 1617136332 CKXKEOPXYLBJGO-UHFFFAOYSA-N 342.355 1.322 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cnccc2C)cc1C 1715584544 WLXCCQXRLDOYJW-MRXNPFEDSA-N 343.427 1.588 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)/C=C\C(=O)N(C)C)C2)cc1 1557133495 MRFICSYPIFSVCT-QIAWRQBBSA-N 331.416 1.282 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CO[C@@H]2CCOC2)cc1C 1714236521 PTCNQRMPEMACTF-GDBMZVCRSA-N 336.432 1.403 10 10 EDCE CCOc1ccc(C(=O)NCC(=O)NCc2cc(O)ccc2O)cc1 1637123104 WDNXICRLHLHRGT-UHFFFAOYSA-N 344.367 1.543 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)CNC(=O)C2CC2)cc1C 1568261132 STGFHFJMNLVWDF-CQSZACIVSA-N 347.459 1.466 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H]2CCN(C)C(=O)C2)cc1C 1733002296 OZFIVRPVAZMYPP-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cncnc2O)cc1C 1731600369 RXLWAVVJZHZEIZ-GFCCVEGCSA-N 330.388 1.407 10 10 EDCE CCNC(=O)N1CC[C@H](NC(=O)NCc2ccc(N(C)C)cc2)C1 151933652 FVMRJSBWVGMGFH-AWEZNQCLSA-N 333.436 1.356 10 10 EDCE O=C(CN1C[C@H]2C=C[C@H]1C2)NCc1ccc(N2CCOCC2)c(F)c1 880447543 HEDOYWXLDRHEHX-HOTGVXAUSA-N 345.418 1.539 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)C[C@H]2CN(C)C)c(Br)c1 250911718 VGEPKWLCWXHWJI-WXHSDQCUSA-N 342.281 1.970 10 10 EDCE CNCc1ccc(N2CC[C@H](OCC(N)=O)C2)c(Br)c1 2145374643 FNNKQXUTKYVXIE-NSHDSACASA-N 342.237 1.249 10 10 EDCE COCC1(C(=O)O)CN(Cc2c(O)cccc2Br)C1 1973654996 SYIARIAZPFCHPX-UHFFFAOYSA-N 330.178 1.688 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)CC1(O)CN(C(=O)OC(C)(C)C)C1 1985096462 RMMYPJMPPKVOQC-UHFFFAOYSA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985094204 LGWWJLVKOBCCQK-LLVKDONJSA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)NCc1cc(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)n[nH]1 2010401639 GLCLSKOXBIBPFV-SECBINFHSA-N 335.368 1.959 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc(C(=O)C(=O)C[C@H]2C[C@H](N)C2)cn1 2049781288 SXJOXAPQNRRZRD-AULYBMBSSA-N 347.415 1.986 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCc3ccc4c(c3)C[C@H](C)O4)c2n1 2062446275 SYQDBQPIZQWENT-NSHDSACASA-N 338.367 1.997 10 10 EDCE CC(C)[C@@H](O)CN(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2167641700 DTDWAROOGGKHCR-STQMWFEESA-N 343.221 1.888 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@H]4C[C@]4(O)C3)c(Br)cc21 2171028046 NVBXZVQKHTYPSI-FMCKTDMXSA-N 338.205 1.362 10 10 EDCE NCc1cc(F)c(N2CC(N3CCCC3=O)C2)cc1Br 2182223111 PQFFYGMYDBZHDJ-UHFFFAOYSA-N 342.212 1.858 10 10 EDCE CCC(CC)N(CCOc1nnc(=N)[nH]n1)C(=O)OC(C)(C)C 2210646765 LZLKNAFTVANYDC-UHFFFAOYSA-N 326.401 1.484 10 10 EDCE CCNCc1ccc(N2CC[C@H]2[C@H](O)CO)c(Br)c1 2270719161 TXAXHLMUWDIDJQ-UONOGXRCSA-N 329.238 1.491 10 10 EDCE COc1ccc(N2CC[C@@H](O)[C@@H](O)C2)c(OC)c1Br 2226549672 RKZJGPNAWMRDEE-ZJUUUORDSA-N 332.194 1.398 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(CCC(=O)N3)C2)cc1Br 2229684837 SADLSDAZOMKBEF-SECBINFHSA-N 325.206 1.971 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)N1CC(N=[N+]=[N-])C1)C[C@H]1CCCO1 2250599122 LDQNVRNKTPRGOW-GFCCVEGCSA-N 339.396 1.924 10 10 EDCE CC[C@@H](N[C@@H]1CN(C)C[C@H]1O)c1cc(Br)ccc1O 2296973348 YJIRJOGQHVIYIM-YRGRVCCFSA-N 329.238 1.870 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCC[C@H](Cn2cncn2)C1 2308001492 NBSLKHBQESKUOU-AWEZNQCLSA-N 328.372 1.641 10 10 EDCE O=C1Nc2cc(N3CCOC[C@H](F)C3)c(Br)cc2[C@H]1O 2361814273 FQXGJJYELLICBP-JMCQJSRRSA-N 345.168 1.609 10 10 EDCE CN(C)C[C@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 172123023 AMJMGVNVMXOCAU-SFHVURJKSA-N 346.475 1.759 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)CC3(O)CC3)c(Br)cc21 2365712899 VJJKDZBQHXUXEM-LBPRGKRZSA-N 340.221 1.623 10 10 EDCE CN(C)c1ccc(CNC(=O)CCCCCCS(N)(=O)=O)cc1 298037019 GGFVUHLTQKENSY-UHFFFAOYSA-N 341.477 1.608 10 10 EDCE CNCc1ccc(N(C)[C@H]2C[C@@H](C(N)=O)C2)c(Br)c1 703485971 OIWXNFNHIYCVHD-PHIMTYICSA-N 326.238 1.869 10 10 EDCE C[C@H](NC(=O)N(C)Cc1ccccc1O)C1(S(C)(=O)=O)CC1 807481816 NIDAEMDOVIRLCG-NSHDSACASA-N 326.418 1.499 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CSC(=O)N3)C2)cc1 819582598 JRJDFHDFGAHMSX-RISCZKNCSA-N 335.429 1.463 10 10 EDCE NCCCCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 827468862 FFXQCMJIQMJPTI-OAHLLOKOSA-N 332.448 1.134 10 10 EDCE CCOc1ccc(CN2CCN(S(C)(=O)=O)[C@H](C)C2)c(O)c1 827271899 WNTVNFGGOPOYSA-GFCCVEGCSA-N 328.434 1.257 10 10 EDCE CC1(C)OC[C@H]2C[C@@]21C(=O)NCc1ccc(N2CCOCC2)cc1 823291270 DWPWRNJGBVDEDM-BEFAXECRSA-N 330.428 1.955 10 10 EDCE Cc1nsc(N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)n1 588405673 HRBSMPMHZACWGC-HYXAFXHYSA-N 346.412 1.620 10 10 EDCE Cn1c2c(ccc1=O)[C@@H](NCc1cc3c(cc1O)OCO3)CCC2 846106086 AXAFWHWSSOMZRL-ZDUSSCGKSA-N 328.368 1.987 10 10 EDCE Oc1c(Br)cccc1CN1CCN2C[C@H](O)C[C@H]2C1 848926042 JXTYDGVYRKCUAL-NWDGAFQWSA-N 327.222 1.406 10 10 EDCE CO[C@H](CS(=O)(=O)N(C)Cc1ccccc1O)[C@H]1CCOC1 849376148 LZMLMWUTORNZEK-DZGCQCFKSA-N 329.418 1.205 10 10 EDCE O=S1(=O)CC[C@]2(CN(Cc3cc(Cl)c(F)cc3O)CCO2)C1 843425733 HGDAGACQALTWRD-AWEZNQCLSA-N 349.811 1.574 10 10 EDCE CCN(CCC(F)(F)F)Cc1cc(O)n2ncc(C(=O)O)c2n1 846243155 BZPWOJMSSUARBN-UHFFFAOYSA-N 332.282 1.907 10 10 EDCE C[C@@]1(CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1(F)F 855807086 QOEKDSJQYKNYMW-CYBMUJFWSA-N 348.371 1.929 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN(C)C(=O)[C@H]3C)C2)cc1 852451325 HXCGKUYLBPYWAK-ZIAGYGMSSA-N 346.431 1.146 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)[C@H]3CCOC3)C2)cc1 852146823 IWZWBGMGAUYUHV-KKUMJFAQSA-N 333.432 1.998 10 10 EDCE Cc1cc(CCNC(=O)C2(NC(N)=O)CC2)c(C)n1-c1ccccc1 767207106 VEIYEKOOYSPCEG-UHFFFAOYSA-N 340.427 1.954 10 10 EDCE CC(C)C(=O)N1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761875900 YYCDUWVCDXINQU-UHFFFAOYSA-N 348.359 1.230 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@]1(C)CCCCO1 1119809519 BJDTYPDTTJKYNG-IBGZPJMESA-N 347.459 1.753 10 10 EDCE NC(=O)C[C@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 1118800836 DZNUSTTYTHHZIY-INIZCTEOSA-N 346.431 1.073 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)Nc1ncn(C(C)(C)C)n1 784670715 MUFCEWOLEDXSBU-UHFFFAOYSA-N 331.376 1.336 10 10 EDCE COC(=O)c1c(CN2CCC[C@H](C(N)=O)C2)c2cc(F)ccc2n1C 893864201 SVNIYJORVJJLTE-NSHDSACASA-N 347.390 1.801 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@H](C)O[C@@H](CO)C2)c([N+](=O)[O-])c1 786809969 BAQGPPRMUHRMOW-OWQIOCHFSA-N 336.344 1.367 10 10 EDCE CS(=O)(=O)[C@H]1C[C@H](NCc2ccc(Br)cc2O)C1 714248872 GLVSASDXDPGZCC-XYPYZODXSA-N 334.235 1.820 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@H](C)[C@H](O)C3)C2)cc1 1312901765 HSOCGZFTFJGXSL-HDMKZQKVSA-N 347.459 1.934 10 10 EDCE CCCNCc1ccc(N2CC(O)(CO)C2)cc1Br 2115307456 XDIQGQMPLJKOHZ-UHFFFAOYSA-N 329.238 1.492 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CCc2ccnn2C)cc1C 1268688189 XTWJTPJOQKDIPS-HNNXBMFYSA-N 344.459 1.964 10 10 EDCE COC(=O)[C@H](NC(=O)c1cccc(O)c1O)c1ccc2c(c1)CCO2 1296806905 UDNSDVKXZCTHHZ-OAHLLOKOSA-N 343.335 1.677 10 10 EDCE CS(=O)(=O)C[C@@H](C(=O)NCc1c(O)cccc1O)c1ccccc1 1456323463 SFIBRYVZXPMTRE-CQSZACIVSA-N 349.408 1.542 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)Cc2nnc(C)o2)cc1C 1700390966 CWNCDDCTLOUALG-STQMWFEESA-N 346.431 1.921 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CC[C@@H](C(F)(F)F)NC1=O 1471661627 VQMVWSRDEQNSAY-ONGXEEELSA-N 332.278 1.171 10 10 EDCE CNC(=O)c1cccc(C(=O)NCc2ccc3cccnc3c2O)n1 1627072608 CBENZCONZNCXBM-UHFFFAOYSA-N 336.351 1.625 10 10 EDCE CCc1cc(C(=O)NC[C@H](O)CNCc2ccc(OC)c(C)c2)n[nH]1 1715584096 ZHJCQFGJKPXJBE-OAHLLOKOSA-N 346.431 1.170 10 10 EDCE CC[C@H](CNC(=O)Cn1cccn1)NCc1ccc(OC)c(C)c1 1715048072 LMZQHKUDVZGARB-MRXNPFEDSA-N 330.432 1.885 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cncnc2O)cc1C 1495686053 AXXHLLBGYADJFE-LBPRGKRZSA-N 344.415 1.655 10 10 EDCE CCOc1ccc(N2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)cc1 1630992800 XERJHJPFQNXOOV-UHFFFAOYSA-N 345.359 1.679 10 10 EDCE Cn1cc(C(N)=O)c(NC(=O)c2cc3cc(O)c(O)cc3s2)n1 1631865425 UKCWJNIVSPDZPL-UHFFFAOYSA-N 332.341 1.397 10 10 EDCE Cn1ncc2c1CC(C)(C)CN(C(=O)Cc1ccc(O)c(O)c1)C2 1630701195 NGEGDRDWHLUQIP-UHFFFAOYSA-N 329.400 1.985 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)C(=O)NCC2CC2)cc1C 1723162937 IGHXOYHBGBCLCP-UHFFFAOYSA-N 347.459 1.468 10 10 EDCE C[C@H](O)CNC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(C)(C)C 1649473756 QLYSBHANNKBLIL-FZMZJTMJSA-N 349.435 1.964 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cnn3cc[nH]c23)cc1C 1662398370 BJXTWGAYNQWVCX-ZDUSSCGKSA-N 341.415 1.888 10 10 EDCE Cn1ccnc1[C@@H]1C[C@H](NC(=O)NCc2ccccc2O)CCO1 1683084194 OGUSTULVIZPIOE-HIFRSBDPSA-N 330.388 1.845 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1nccn1C 1774050392 WWXQJEWEWOWAQV-LLVKDONJSA-N 343.391 1.491 10 10 EDCE CS(=O)(=O)Cc1cccc(CNC(=O)Cc2ccc(N)cc2)c1 153726735 VRQQSLWQAJDTFB-UHFFFAOYSA-N 332.425 1.672 10 10 EDCE COc1ccc(N(C)C[C@@](N)(CO)C2(Br)CC2)cc1 2141692667 GMKCDJLMOAHHLH-CQSZACIVSA-N 329.238 1.749 10 10 EDCE OCc1ccc(N2C[C@]3(CO)CC[C@]3(CO)C2)c(Br)c1 2145745216 GADHGLKBDMFYQT-GASCZTMLSA-N 342.233 1.513 10 10 EDCE C[C@@H](O)c1ccc(N2CCOC[C@H]2[C@@H](O)CO)c(Br)c1 2146324182 SPLWICDAIJUXLB-IIMNLJJBSA-N 346.221 1.061 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)O1 1985099161 IKDLDXURCZWXCN-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H](CC(=O)NCCN=[N+]=[N-])O1 1985103166 RDXRWDDDJJLNCA-WDEREUQCSA-N 327.385 1.827 10 10 EDCE CNCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@@H]32)c(Br)c1 2146685194 MHDPLCOPJKMRKK-TUKIKUTGSA-N 341.249 1.897 10 10 EDCE CN1CCN(c2ccc(CN)c(Br)c2F)CCC1=O 688930693 JPMROSVRLKEUNQ-UHFFFAOYSA-N 330.201 1.715 10 10 EDCE CN1CCN(Cc2cc(Br)cc(F)c2O)[C@H](CN)C1 715769523 LSOPBHFIXOMHMU-LLVKDONJSA-N 332.217 1.369 10 10 EDCE Cc1cc(NS(=O)(=O)CC(F)F)ccc1NS(C)(=O)=O 695093878 UNSFMNJEIKZNQV-UHFFFAOYSA-N 328.362 1.373 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@@H](O)[C@H](CO)C2)cc1Br 396819002 WBFANLLYDNUCAX-JRPNMDOOSA-N 343.265 1.909 10 10 EDCE O=C(NCc1ccn(Cc2ccccc2)n1)c1cc(O)c(O)c(O)c1 1148590457 KSJBIILGMYADSO-UHFFFAOYSA-N 339.351 1.978 10 10 EDCE C[C@H](O)[C@@H]1CCCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2193595474 HXJSSPGGYPJXCA-XDYOCTJHSA-N 341.205 1.784 10 10 EDCE C[C@@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)c(Br)c1 2190462176 VSHVOIBIAJWZBJ-AISOMTMTSA-N 341.249 1.932 10 10 EDCE Cn1nccc1[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2060621775 RJGKAETYGGRYGS-JQWIXIFHSA-N 349.395 1.897 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)NCCc1ccc(N)cc1 2080604381 JDSWEHSPPIYTPL-GJZGRUSLSA-N 349.431 1.298 10 10 EDCE CCNCc1ccc(N(C)CC(CO)CO)cc1Br 2094028613 HEOGZXOSLXRJRP-UHFFFAOYSA-N 331.254 1.596 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])C1 2213588199 OYCLXYNCLXYUPA-GHMZBOCLSA-N 339.396 1.706 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2333237008 JFTCJQKUGNUTEL-XQQFMLRXSA-N 333.201 1.048 10 10 EDCE CO[C@H](CCN)C(=O)NCc1ccc(C)c(Br)c1O 2352626205 LOSPWILIYXCFGH-SNVBAGLBSA-N 331.210 1.443 10 10 EDCE Cc1ccc(CN[C@@H]2CCC[C@H](O)[C@@H]2O)c(O)c1Br 2352945853 CBLMQUWASXWXBA-UHIISALHSA-N 330.222 1.827 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)c(Br)c1 2355335596 DFDFXLNKVFYRGG-PTPDJHTLSA-N 341.249 1.789 10 10 EDCE C[C@H](CNC(=O)NCc1c(O)ccc2c1CCCC2)N1CCOCC1 175010108 WQATYRRTBDTCQE-CQSZACIVSA-N 347.459 1.791 10 10 EDCE CCCC(=O)NCC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 65599363 WVSQPCZUTQKQEN-CQSZACIVSA-N 333.432 1.617 10 10 EDCE COC[C@@H](O)CN1CCC(N[C@@H](C)c2cc(F)ccc2O)CC1 186195155 WQFBLPOTXCVACO-WFASDCNBSA-N 326.412 1.654 10 10 EDCE Cc1nc(CN2CCCN(Cc3cc4c(cc3O)OCO4)CC2)no1 127970061 VQAOZBPLHPLDTL-UHFFFAOYSA-N 346.387 1.520 10 10 EDCE C[C@@H]1CC[C@@H](C(N)=O)CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 78490035 NWVMQPXKMVCEHJ-GDBMZVCRSA-N 346.475 1.297 10 10 EDCE CN1CCCc2cc(/C=C\C(=O)OCC(=O)N3CCCC3=O)ccc21 96291715 BTGXMMDKQRXXMS-CLFYSBASSA-N 342.395 1.774 10 10 EDCE Cc1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1 276096008 QOHLAKGKYREBLR-UHFFFAOYSA-N 330.363 1.691 10 10 EDCE Cc1ccc(CNCC2(O)CC(C(=O)O)C2)c(O)c1Br 2381140404 KAEODMZCRBUKBN-UHFFFAOYSA-N 344.205 1.778 10 10 EDCE O=c1n(CN2CCCc3cc(OC(F)F)ccc32)nnn1C1CC1 808175635 XVVRAMOEWPJOAP-UHFFFAOYSA-N 337.330 1.786 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC(C)(CO)C3)C2)cc1 824681222 GTLAKDBMQGNHDS-CQSZACIVSA-N 333.432 1.545 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(Cc2ccon2)CC1 588406580 HJLQKTLAEWSIIM-RQOWECAXSA-N 329.356 1.443 10 10 EDCE Cc1cc(CC(=O)N2C[C@@H](O)C[C@H]2CO)c(C)n1-c1ccccc1 832440661 QUQFRVWWHZGVFS-ROUUACIJSA-N 328.412 1.591 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)/C=C\Cn3cncn3)C2)cc1 911275405 DXECTRQMMBOWKO-GWQWAINWSA-N 341.415 1.486 10 10 EDCE C[C@H](CC(=O)N(Cc1ccco1)Cc1ccccc1O)NC(N)=O 847570511 QIBCUIWNNOOLIG-GFCCVEGCSA-N 331.372 1.961 10 10 EDCE COc1ccc(N(C)C[C@H]2CCCN(C(=O)CN)C2)cc1Cl 841011082 CCMZXHKSKLZBPB-GFCCVEGCSA-N 325.840 1.982 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@@H](O)C1(O)CCC1 929973061 VWULROXJLSGUJB-CQSZACIVSA-N 343.807 1.297 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1CNCC[C@H]1C)c1ccc(N(C)C)cc1 842203173 QCFKPRXYLSBLKX-DVOMOZLQSA-N 332.448 1.044 10 10 EDCE CCN(CC(=O)N(C)C)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 747621547 WIOHPRUXKJDXHV-CLFYSBASSA-N 335.360 1.696 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCC1=O 924008581 UDHOSLSQCFKFIN-HNNXBMFYSA-N 344.459 1.559 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)CC3(CO)CC3)C2)cc1 854300176 VWSNKMMKMDOJHA-CQSZACIVSA-N 333.432 1.688 10 10 EDCE COC[C@@H](CCNC(=O)N[C@@H](C)c1cc(OC)ccc1O)OC 852448697 NBXQKWIABMYLCE-WCQYABFASA-N 326.393 1.813 10 10 EDCE C[C@@H]1CN(Cc2c(O)ccc3ccncc23)CCN1S(C)(=O)=O 853563975 HDUOVJWWNIBRAP-GFCCVEGCSA-N 335.429 1.406 10 10 EDCE Cc1cn(CC(=O)NCc2ccc(O)c(O)c2)nc1C(F)(F)F 860243517 ORATZSVBIZHKOK-UHFFFAOYSA-N 329.278 1.938 10 10 EDCE CN1CCCc2cc(CNS(=O)(=O)c3cnc(O)s3)ccc21 866673881 KTJSUJRKTGMBLQ-UHFFFAOYSA-N 339.442 1.710 10 10 EDCE Cn1cncc1Cc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 762413008 ZQRNZIJPAJBRQW-UHFFFAOYSA-N 349.372 1.138 10 10 EDCE O=C(COC(=O)c1cnn(CC(F)(F)F)c1)c1ccc(O)c(O)c1 784894399 UCVHVXFNDWZAQP-UHFFFAOYSA-N 344.245 1.896 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H]2CSC[C@H]2C1 897791685 TZTCXWRITZZNBT-GASCZTMLSA-N 347.484 1.499 10 10 EDCE Cc1cc(Br)c(O)c(CN(C)CCS(C)(=O)=O)c1 781896113 HYECBMYCWYALDA-UHFFFAOYSA-N 336.251 1.940 10 10 EDCE Nc1ccc(Cc2nn3c(=O)c(Cc4ccco4)nnc3s2)cc1 82719665 RNTJTRJVVMDBEA-UHFFFAOYSA-N 339.380 1.903 10 10 EDCE OCCNC1CCN(Cc2cc(Br)cc(F)c2O)CC1 715789927 TZDUOMWLOOZENW-UHFFFAOYSA-N 347.228 1.840 10 10 EDCE C[C@@H](CN1CCN(C)CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1144612914 KCCAFTCNDUCNOL-LBPRGKRZSA-N 332.408 1.215 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC2CN(c3ccncn3)C2)cc1 1302712309 ATAAPJZMDLRPMG-UHFFFAOYSA-N 325.332 1.258 10 10 EDCE O=C(c1ns[nH]c1=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1151903907 XTNLUJZEGXBMPH-LLVKDONJSA-N 335.385 1.358 10 10 EDCE CCCCS(=O)(=O)CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1154024405 BSEXSRDBBWZFIK-LLVKDONJSA-N 329.418 1.360 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC2(CCC2)S(=O)(=O)CC1 1161953195 LWADSLVEQNCZKF-UHFFFAOYSA-N 339.413 1.210 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3CSC3(C)C)ccc21 1324419349 XIMWAIJCPPZXNR-HNNXBMFYSA-N 347.484 1.695 10 10 EDCE COC(=O)[C@@]1(N2CCN(Cc3ccc(N(C)C)cc3)CC2)CCOC1 1261801864 WXRPWEONLKEWDO-LJQANCHMSA-N 347.459 1.202 10 10 EDCE CN(C)c1ccc(CNC(=O)Cn2ncc3cccnc32)cc1F 1264827181 QMZNAPMRIWZRQM-UHFFFAOYSA-N 327.363 1.953 10 10 EDCE O=C(C(=O)N1CCC[C@@]2(CCSC2)C1)N1Cc2cccc(O)c2C1 1351920497 REHJEEREHCRXJM-GOSISDBHSA-N 346.452 1.980 10 10 EDCE COc1ccc(CNC(=O)[C@@H]2Cc3cc(F)ccc3NC2=O)c(O)c1 1296968763 QLOLEJDQFRDQPV-AWEZNQCLSA-N 344.342 1.967 10 10 EDCE Cc1nccnc1N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1296849586 QXVWPRYDZKLJNR-UHFFFAOYSA-N 328.372 1.088 10 10 EDCE COC(=O)[C@@H](CNC(=O)c1c(F)ccc(O)c1O)c1ccccc1 1457663818 KFVNGAOGTCTXKB-NSHDSACASA-N 333.315 1.924 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@@](C)(O)C2)cc1Br 2136828209 ICLIFKPBUMNJJJ-IIMNLJJBSA-N 329.238 1.791 10 10 EDCE CC(C)OCCNCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1481321838 GOLCCGGAHILQOK-UHFFFAOYSA-N 335.408 1.936 10 10 EDCE COCCOCCCn1c(C)nnc1N(C)Cc1ccccc1O 1555715685 YRQIAXSSBWNRPQ-UHFFFAOYSA-N 334.420 1.982 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CCCC(=O)N2)cc1C 1496093677 WCSHCGIWPJCGMY-GDBMZVCRSA-N 347.459 1.609 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@H]2CC[C@H](F)C2)cc1 1720146617 WBPIDRFKKBDMDI-RYUDHWBXSA-N 349.366 1.833 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H](C)[C@H]2CCC(=O)N2)cc1C 1493701771 KKXHGMZWLSSYGI-GOEBONIOSA-N 347.459 1.466 10 10 EDCE Cc1ccoc1C(=O)NCCCNC(=O)Cc1ccc(O)c(O)c1 1634292982 MNNDDKDPDJQNTN-UHFFFAOYSA-N 332.356 1.478 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@@H]2CC[C@H](F)C2)cc1 1720146615 WBPIDRFKKBDMDI-NEPJUHHUSA-N 349.366 1.833 10 10 EDCE Cn1cc([C@@H]2C[C@@H](NC(=O)Cc3ccc(O)c(O)c3)CCO2)cn1 1636573413 JRXXNNUKVZUMFR-BBRMVZONSA-N 331.372 1.410 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2c[nH]c3nccc-3c2)c1 1634308832 YAUJASHBUMUIJD-UHFFFAOYSA-N 346.368 1.844 10 10 EDCE O=C(Cc1csc(N2CCOCC2)n1)NCc1c(O)cccc1O 1647289680 HFVIKHURXCPHPY-UHFFFAOYSA-N 349.412 1.250 10 10 EDCE O=C(CCc1nc(-c2ccco2)no1)NCc1c(O)cccc1O 1647269726 KMWVJYLGQUGVHL-UHFFFAOYSA-N 329.312 1.990 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(O)cc1O 1643104284 SOMDAGOQRGEJSN-LBPRGKRZSA-N 340.376 1.254 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCNC(=O)C1CC1 1742753748 CGVRHSPIYMKDLT-UHFFFAOYSA-N 329.404 1.455 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)c2ncccc2O)N(C)C)cc1 1653420568 BHNRNOROPFPTIK-HNNXBMFYSA-N 328.416 1.886 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H]2CCC2(F)F)cc1C 1667843940 YTSQPWJMOYVEJB-KGLIPLIRSA-N 342.386 1.616 10 10 EDCE O=S(=O)(NCCc1ccc(O)c(O)c1)c1cnc(Cl)s1 2148011070 JBLJPVJGOQDHEY-UHFFFAOYSA-N 334.806 1.729 10 10 EDCE CC(C)(C)OC(=O)NOCCCNC(=O)c1ccc(O)c(O)c1 1982313699 LHLCEQALTTXCII-UHFFFAOYSA-N 326.349 1.674 10 10 EDCE NCCCN(Cc1ccccc1)S(=O)(=O)Cc1ccc(N)cc1 1989315950 QMBMYLWVBVLUQP-UHFFFAOYSA-N 333.457 1.950 10 10 EDCE CC(C)(C)OC(=O)N1CCN(NC(=O)c2ccc(O)c(O)c2)CC1 2006279452 BPLPLOLKBCVYTK-UHFFFAOYSA-N 337.376 1.295 10 10 EDCE CN1C[C@H](O)[C@H](N(C)c2ccc(CNC(=O)OC(C)(C)C)cc2)C1 1999491394 DXVARNJKCVSACQ-CVEARBPZSA-N 335.448 1.822 10 10 EDCE CNCc1ccc(N2CC[C@]3(CNC(=O)N3)C2)c(Br)c1 2177699865 XQNQVGMPPABJAU-AWEZNQCLSA-N 339.237 1.430 10 10 EDCE Cc1nn(C)c(CNC(=O)c2cccc(O)c2O)c1Br 2192442161 XDVMSLGMYLNZGB-UHFFFAOYSA-N 340.177 1.832 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)cc1Br 2102176381 BUMZANOQOZZGSP-LDZXTUBUSA-N 328.206 1.698 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2C[C@@H](O)[C@@H]2OC)c1O 2271171429 UTKRBABTXXSVDX-GIPNMCIBSA-N 332.194 1.401 10 10 EDCE Cc1cccc(CNC(=O)c2nn(C)nc2Br)c1O 2226979233 ONOGWWPPVWDIGF-UHFFFAOYSA-N 325.166 1.522 10 10 EDCE CCNCc1ccc(N2CC[C@H]2[C@@H](O)CO)cc1Br 2270717899 IOTVJSMNRPYJHN-KBPBESRZSA-N 329.238 1.491 10 10 EDCE C[C@@H]1CCN(C(=O)C=Cc2cn(C)c(=O)n(C)c2=O)c2ccccc21 2297372930 VKQXOPODMWPTEQ-CYBMUJFWSA-N 339.395 1.638 10 10 EDCE CNCc1ccc(N2C[C@H]3CS(=O)(=O)[C@H]3C2)c(Br)c1 2336475234 GCBCEMNRSWWIAH-GWCFXTLKSA-N 345.262 1.402 10 10 EDCE CCn1nc(Br)nc1[C@H](O)[C@H](N)c1ccccc1O 2353740255 PRFAWIOAUZUMLH-NXEZZACHSA-N 327.182 1.500 10 10 EDCE C[C@H](OCCCNC=C1C(=O)N(C)C(=O)N(C)C1=O)c1ccccc1 52536835 ATHNUEZBKXBOJJ-ZDUSSCGKSA-N 345.399 1.678 10 10 EDCE CC[C@H](C)NC(=O)Nc1cc(N2CCN(C=O)CC2)ccc1OC 62275227 USYNUGPKZWLDQQ-ZDUSSCGKSA-N 334.420 1.894 10 10 EDCE CN(C[C@H]1CCCC[C@H]1O)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 302044341 MKKPDOJMMQFLJH-QMTHXVAHSA-N 335.360 1.913 10 10 EDCE C[C@H](NCCN1CCN(c2ncccn2)CC1)c1ccccc1O 183429915 PKBXKJIVFJHCDN-HNNXBMFYSA-N 327.432 1.655 10 10 EDCE N[C@@H]1CCCC[C@@H]1NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 185432393 LYLIOVGNDUYQSF-WGDYAQENSA-N 329.444 1.923 10 10 EDCE COCCNC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 132294628 KTVMOMPHWYGXBW-UHFFFAOYSA-N 346.475 1.664 10 10 EDCE CS(=O)(=O)C[C@H](N)c1cccc(I)c1O 95769564 UUZYCDVCBJTMNI-QMMMGPOBSA-N 341.170 1.041 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCCO3)CC2)cc1 269404328 FZULQUYUHGBQOB-SFHVURJKSA-N 347.459 1.503 10 10 EDCE O=C1C[C@H]([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2)CN1 368049649 XFWLQIQUEOBDQR-CXSYMGSUSA-N 330.384 1.628 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCNC(=O)[C@@H]2C(C)C)c([N+](=O)[O-])c1 270957473 YIMTWBSHQUKVNC-YERXGYGTSA-N 347.371 1.742 10 10 EDCE Cc1ccc(CN(C)[C@H](C)C(=O)NC(N)=O)c(O)c1Br 2380770144 YYOWGEQPDYJBFP-MRVPVSSYSA-N 344.209 1.478 10 10 EDCE CCO[C@@H]1[C@H](C)[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 912709655 RNHSAHXYSFKGLF-FSPWUOQZSA-N 332.444 1.935 10 10 EDCE CC1(C)CCCN[C@@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 844171806 XTBQBOSSDLIUFS-QGZVFWFLSA-N 331.460 1.918 10 10 EDCE COC(=O)N1C[C@H]2C=C[C@H]1[C@H](C(=O)NCc1c(O)cccc1F)C2 928706351 QZNREGLIXIKNST-WDMOLILDSA-N 334.347 1.790 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC[C@H](C)CCO)C2)cc1 854296643 FMQOFOBZCINLOU-GJZGRUSLSA-N 335.448 1.982 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3C[C@H]4CC[C@H]3NC4)C2)cc1 851639601 HXHKIFNEBLBVLY-IDCJVQTKSA-N 329.444 1.778 10 10 EDCE C[C@@H](NC(=O)NCCN(C)CCCN(C)C)c1ccc(N(C)C)cc1 854003268 GXYAMYKHAXCQNJ-MRXNPFEDSA-N 349.523 1.996 10 10 EDCE C[C@H](CO)COC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O 766659445 CGANESHMITXSQM-SNVBAGLBSA-N 339.347 1.829 10 10 EDCE CNC(=O)C(C)(C)CNCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894359988 WQSPHMQWHFHUKK-UHFFFAOYSA-N 349.406 1.966 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cn(C)nc2OC)cc1C 1317253539 CYNRRXVHMPFLHI-CYBMUJFWSA-N 346.431 1.654 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@@H]2[C@H](O)CO)cc1Br 2123209836 JUVDWNYYPMTEGR-OWYVNGRQSA-N 329.238 1.791 10 10 EDCE CNCc1ccc(N2CCO[C@@H]([C@@H](C)O)C2)c(Br)c1 2117532582 UKWQGBXCTBMCLC-QMTHXVAHSA-N 329.238 1.755 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2[C@H]3CCC[C@H]32)cc1 1326674056 GNDCXCMHMODUBM-BJWYYQGGSA-N 345.443 1.505 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@@H](O)C2(C)C)c(Br)c1 2124799971 JGHGNYOVVNNBEM-BZHVJNSISA-N 329.238 1.789 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC(C)(C)CNC(N)=O)C2)cc1 1252922256 FVJZUXGNNRKTDJ-LBPRGKRZSA-N 349.435 1.020 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC[C@@H](O)[C@H]1C 1334502786 ISQGXQXTGAGJDI-CZUORRHYSA-N 333.432 1.049 10 10 EDCE O=C1CC2(CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)N1 1262114535 ZEWFGOGJCNTOOX-UHFFFAOYSA-N 332.381 1.807 10 10 EDCE O=C(C(=O)N1CC[C@@H]2CSC[C@@H]2C1)N1Cc2cccc(O)c2C1 1351961302 RCDCYHLIQOHAJO-OLZOCXBDSA-N 332.425 1.446 10 10 EDCE COc1ccc(CNC(=O)[C@H]2CNC(=O)c3ccccc32)c(O)c1 1296968166 LAXSUGPZYKJIFT-HNNXBMFYSA-N 326.352 1.544 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)C1=NN(CCO)C(=O)CC1 1456310196 OZDYBXZNWXBMGS-UHFFFAOYSA-N 341.367 1.132 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H]2COCCO2)cc1C 1700738323 MNRYHNYYMNFUFH-YOEHRIQHSA-N 336.432 1.356 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@H](C)NC(=O)C=C(C)C)cc1 1715964005 AOQFCKFCZHNFCD-ZDUSSCGKSA-N 344.419 1.231 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)C=C(C)C)cc(OC)n1 1718523776 XQGKMXUYCJRWJP-LBPRGKRZSA-N 335.404 1.642 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)Cc2cnn(C)c2)cc1C 1497154116 JUXCYBHGKZUIOH-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C(=O)C(C)(C)C)cc1C 1496954554 IERXKSARUUIRLY-AWEZNQCLSA-N 336.432 1.186 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cccnc2)cc1C 1725678688 FNRMTBNINIDYTP-KRWDZBQOSA-N 343.427 1.621 10 10 EDCE Cc1ccc(C(=O)NCCc2ccccc2S(C)(=O)=O)c(O)c1O 1634162244 KVERWBFDQREISK-UHFFFAOYSA-N 349.408 1.782 10 10 EDCE NS(=O)(=O)c1cc(C(=O)NCc2c(O)cccc2F)c(Cl)o1 1646034500 KEWPGOCSTLWCEH-UHFFFAOYSA-N 348.739 1.355 10 10 EDCE CN(C(=O)c1ccc(N=NC(N)=O)cc1)C1CC(NCCCO)C1 1571666287 DLAGSXUVZJXZQN-UHFFFAOYSA-N 333.392 1.424 10 10 EDCE Nc1nc(C2CC2)nc(N2CCN(C(=O)c3cc(O)cs3)CC2)n1 1647983196 XBMLHQVDBWGNQE-UHFFFAOYSA-N 346.416 1.061 10 10 EDCE COCC(=O)NC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1758597721 YZAKADOUJAGVQE-CYBMUJFWSA-N 347.375 1.120 10 10 EDCE CCOC(=O)[C@H]1CCCN(C(=O)CNCc2ccc(N(C)C)cc2)C1 1857865575 UDVXYCZNSKJBHN-INIZCTEOSA-N 347.459 1.644 10 10 EDCE COc1ccc(Br)c(CNCC2(C(N)=O)CC2)c1O 1972478637 OJGZYLUVAUHQRT-UHFFFAOYSA-N 329.194 1.518 10 10 EDCE C[C@H]1COC[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)N1C(=O)OC(C)(C)C 2003170550 QZCMRPSISRCRQM-CYDGBPFRSA-N 340.420 1.276 10 10 EDCE Cn1[nH]c(=NC(=O)OC(C)(C)C)cc1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003170783 SCDNBOFCQMGPKB-MGCOHNPYSA-N 336.392 1.068 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1990024973 ZEINHSVUGIVLKJ-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE O=C(c1ccc(O)c(O)c1)N1C[C@H]2C[C@H]1CN2C(=O)C(F)(F)F 2006284537 RKZLNWYOTKRCEN-DTWKUNHWSA-N 330.262 1.085 10 10 EDCE CN1CC2(C1)CN(c1cc3c(cc1Br)[C@H](N)C(=O)N3)C2 2152270447 ONAQNKGEFJJSLQ-LBPRGKRZSA-N 337.221 1.153 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)O1 2010398009 UWZKBIBNBGNWHX-SRVKXCTJSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNC(=O)Nc1ccc(N)cc1 2010536780 ICTMRKLPEOXZKI-MRXNPFEDSA-N 338.408 1.666 10 10 EDCE C[C@@H](O)c1ccc(N2CC(S(C)(=O)=O)C2)c(Br)c1 2034834689 YHSNOBYGZOMJPF-MRVPVSSYSA-N 334.235 1.736 10 10 EDCE C[C@H](N)c1ccc(N2CC(N(C)C3COC3)C2)c(Br)c1 2173101413 OJMJAATUHQYNIC-JTQLQIEISA-N 340.265 1.988 10 10 EDCE O=C1NC[C@]2(CCCN(Cc3c(O)cccc3Br)C2)N1 2177679732 GVBRUCRDJCQQBB-AWEZNQCLSA-N 340.221 1.802 10 10 EDCE O=C1Nc2cc(N3CCC=C[C@@H]3CO)c(Br)cc2[C@H]1O 2182333821 VUSNREJNFUSGCQ-AMIZOPFISA-N 339.189 1.562 10 10 EDCE C[C@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1C(=O)c1cccc(O)c1O 2054401437 RWSIRSPPHADTGH-DTWKUNHWSA-N 346.305 1.769 10 10 EDCE Cc1cnccc1N(C)C(=O)C1=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C1 2080952145 UVJFHMGPAUAFCN-ZFWWWQNUSA-N 347.415 1.937 10 10 EDCE CC(C)(C)OC(=O)N[C@H](COc1nnc(=N)[nH]n1)c1ccsc1 2210644958 RTLZEAVRMLHNPP-SECBINFHSA-N 338.393 1.385 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])C1 2213585989 SYWAUIFSUFOQRP-NWDGAFQWSA-N 339.396 1.970 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)C[C@H](CO)C2)cc1Br 2236635952 LISXGMPLLIRXTB-WOPDTQHZSA-N 344.249 1.930 10 10 EDCE CC(C)(C)OC(=O)N1CCOCC[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2249053895 DAENMVZUBMHHJS-NWDGAFQWSA-N 339.396 1.924 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@@H](O)CC2)cc1Br 2269120763 HALXVVGKTXCJIX-HERUPUMHSA-N 329.238 1.791 10 10 EDCE Cc1ccc(CNC2[C@@H]3CS(=O)(=O)C[C@@H]23)c(O)c1Br 2352670068 GUHWONWCLBIHLH-NXEZZACHSA-N 346.246 1.596 10 10 EDCE CC(=O)N(CCN)C(=O)C(=O)N(c1ccccc1)c1ccc(N)cc1 170388936 UCTWRPQNHVGOHE-UHFFFAOYSA-N 340.383 1.267 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCc1ccc(O)c(O)c1O)C(=O)O 1951421137 PHPJHLSBTGLROD-VIFPVBQESA-N 327.333 1.714 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@@]2(CCO)CCOC2)cc1F 129002653 NAVNIPUURVDFMR-QGZVFWFLSA-N 339.411 1.480 10 10 EDCE CC[C@H](C)[C@H](NC(N)=O)C(=O)NCc1ccc(N2CCCC2)cc1 41365554 KSEASRGZPPBDEI-BBRMVZONSA-N 332.448 1.986 10 10 EDCE C[C@@H](NC[C@@H]1CCN(S(C)(=O)=O)C1)c1ccc(N(C)C)cc1 90796985 UYCPSUJSPGEJPK-KGLIPLIRSA-N 325.478 1.685 10 10 EDCE CN1C(=O)C[C@H](C(=O)NCc2ccccc2O)[C@H]1c1cccnc1 265393091 DUOTUBVOJPBFCI-WMLDXEAASA-N 325.368 1.623 10 10 EDCE C[C@H](NC[C@@H]1CCC[C@@]12NC(=O)N(C)C2=O)c1ccc(F)cc1O 363846400 CITSMKJHSDIOBM-PSVSLLHZSA-N 335.379 1.902 10 10 EDCE Cc1ccc(CNC(=O)CCn2cnnn2)c(O)c1Br 2381133661 RMWRYBUZZABWRU-UHFFFAOYSA-N 340.181 1.156 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@H]2C(N)=O)c(Br)c1 723202871 XQYSNJRQMMFUDY-PELKAZGASA-N 328.210 1.159 10 10 EDCE C[C@H](O)C[C@@H]1COCCN1C(=O)c1cc2cc(O)c(O)cc2s1 907416057 GAKZXTPUVDJZMR-GXSJLCMTSA-N 337.397 1.924 10 10 EDCE Cc1ccc(C(=O)N2CCS(=O)(=O)[C@H]3CCC[C@@H]32)c(O)c1O 837095370 CIOJSVZZPJZRHV-RYUDHWBXSA-N 325.386 1.198 10 10 EDCE C[C@@H](NC(=O)N(C)[C@H]1CCN2CCO[C@H]1C2)c1ccc(N(C)C)cc1 836407437 ZFMWBFDZUVPZKV-JLSDUUJJSA-N 346.475 1.928 10 10 EDCE COc1cc(Br)cc([C@@H](C)NC[C@H]2CNC(=O)C2)c1O 848553446 SVHGCFGBLCPKIZ-BDAKNGLRSA-N 343.221 1.950 10 10 EDCE CCC/C=C/[C@@H](O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 918914099 QSMMAFNRAUGWDZ-DUMMIQTOSA-N 331.460 1.772 10 10 EDCE O=C(/C=C\C1CC1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 742561633 WQECRZITECTFQV-YVMONPNESA-N 334.441 1.504 10 10 EDCE COC(=O)c1cc2ccccc2c(CN2CCn3nncc3C2)c1O 848490728 BLXPSOKMJQSPBP-UHFFFAOYSA-N 338.367 1.939 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3C[C@@H]4COC[C@@H]4O3)CC2)cc1F 929823106 RXMKHHLZWKNCPG-XUWXXGDYSA-N 336.407 1.760 10 10 EDCE O=C(NCc1cc(NC(=O)[C@H]2CCCO2)ccc1O)[C@H]1CCCO1 923121797 LBHPKORSFBVWFA-HUUCEWRRSA-N 334.372 1.305 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC(=O)[C@H](C)C3)C2)cc1 923187448 YHHWQMQFMCLVIR-KGLIPLIRSA-N 331.416 1.894 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)C[C@]2(C)CO)cc1Br 698158838 WUBIMIPSVXEAHH-NURSFMCSSA-N 330.222 1.824 10 10 EDCE CN(C)CCC[C@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCO1 856430166 SGSMEIHYIJNCHV-VFADXPBXSA-N 334.416 1.680 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](CN)CC(C)C)C2)cc1 851664578 FWLLBEJFAFLAQL-HUUCEWRRSA-N 334.464 1.947 10 10 EDCE O=C([C@@H](O)C1CCOCC1)N(Cc1ccccc1O)C[C@H]1CCCO1 752152030 SJJSPBXKOMAYQD-AEFFLSMTSA-N 349.427 1.687 10 10 EDCE C[C@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@H](c2ccn(C)n2)C1=O 761576488 NHCHIRSQQRYQCK-IAQYHMDHSA-N 327.388 1.840 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](O)C3CCC3)CC2)c(OC)c1 870166080 UAOCODQNYQGGDW-QGZVFWFLSA-N 334.416 1.513 10 10 EDCE CCN(C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)[C@H]1CCN(C)C1 1118690861 AWOLBRBIPSXRHW-YOEHRIQHSA-N 346.475 1.482 10 10 EDCE CC1(C)COC[C@@H]1NCc1ccc(N2CCC(C(N)=O)CC2)cc1 895813990 OUPCDCYHKQWTPB-KRWDZBQOSA-N 331.460 1.903 10 10 EDCE CN(Cc1cc(Br)cc(F)c1O)C[C@@H]1CNCCO1 715771098 SAGHDAOSLMMRNE-NSHDSACASA-N 333.201 1.714 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N(CC(=O)O)Cc1ccccc1 692464056 MXDXRWXIMDGFBF-AWEZNQCLSA-N 344.367 1.081 10 10 EDCE Cc1nn(Cc2ccccc2)c(C)c1/C=C1/C(=O)NC(=O)N(C)C1=O 1084034588 XZWMJOQWTZGBFR-DHDCSXOGSA-N 338.367 1.640 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cc3nc(C4CC4)n[nH]3)C2)cc1 1300634545 YHIBYZJZHUUXFN-CYBMUJFWSA-N 341.415 1.628 10 10 EDCE CC(C)[C@H]1C(=O)NCCN1C(=O)c1cc2cc(O)c(O)cc2s1 1350344776 SDVNUACEXXIORG-AWEZNQCLSA-N 334.397 1.909 10 10 EDCE CO[C@H](C)C(=O)NC[C@@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1505632113 FEQLPKSLRVRNJL-MFKMUULPSA-N 347.375 1.215 10 10 EDCE C[C@@H](NC(=O)c1cn(C)c2c(cnn2C)c1=O)c1ccccc1O 1454805545 LPVALYDUUFUXOS-SNVBAGLBSA-N 326.356 1.469 10 10 EDCE COC(=O)c1ccc(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cn1 1296247341 TXOZCKXPWFLTNS-NSHDSACASA-N 344.367 1.569 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)C[C@H]2CO)c(Br)c1 2136084256 ZVGPQEIQFOHTKU-DLOVCJGASA-N 330.222 1.824 10 10 EDCE O=C(O)[C@@H]1C[C@@H](O)CCN1Cc1cc(Br)ccc1O 2136384929 VSTKHGAEXZEDHQ-QWRGUYRKSA-N 330.178 1.565 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2[nH]c(O)nc2C)cc1C 1713317196 HIMTZZSUFJALNF-NSHDSACASA-N 332.404 1.649 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H]2CCNC(=O)C2)cc1C 1485868094 RNOCTHRNZAEQLJ-GOEBONIOSA-N 347.459 1.466 10 10 EDCE O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NCc1cc(O)ccc1O 1633595100 IGWMJWKLPBSDEB-OKILXGFUSA-N 346.383 1.279 10 10 EDCE CC(=O)NCCN(Cc1ccsc1)C(=O)Cc1ccc(O)c(O)c1 1634801208 PQJHVYNEHCDGSC-UHFFFAOYSA-N 348.424 1.867 10 10 EDCE CC(C)(CO)[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1cccnc1 1639152633 QBPTWOWFUMWYIX-QGZVFWFLSA-N 330.384 1.911 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN[C@@H](c2ccc(O)cc2)C1 1631045213 CMMOXRLEEDAUEV-NGKAXPBTSA-N 340.379 1.990 10 10 EDCE COC(=O)[C@@](C)(Cn1cccn1)NC(=O)/C=C\c1ccc(O)c(O)c1 1637024453 AMEBCHWQZQGUNS-XTKXOIQPSA-N 345.355 1.056 10 10 EDCE COC[C@H](C)C(=O)NCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1745078051 XIFPMTKFKCXDNF-NSHDSACASA-N 349.391 1.320 10 10 EDCE CC(=O)C(=O)[C@H](O)c1c(Br)cncc1Br 1929255245 ZDPKOQNLUMJHNI-SECBINFHSA-N 336.967 1.798 10 10 EDCE Cc1cc(C(=O)N2Cc3cccc(O)c3C2)cc(S(N)(=O)=O)c1C 1587929442 ZVIBYDCMYZVXHN-UHFFFAOYSA-N 346.408 1.812 10 10 EDCE O=C(Cc1nc(C2CCOCC2)n[nH]1)NCCc1ccc(O)c(O)c1 1595753026 WOAKKFZZKQWBII-UHFFFAOYSA-N 346.387 1.011 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@H]2CCCNC2=O)cc1C 1669320490 LNTITHNOVTUOIH-UKRRQHHQSA-N 333.432 1.124 10 10 EDCE CC[C@@H](C)CNC[C@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1699072471 KNWCEWZXYHZVRO-RISCZKNCSA-N 335.408 1.575 10 10 EDCE COc1ccc([N+](=O)[O-])cc1-n1nnnc1Cc1ccc(N)cc1 1857927053 RHPVZENJDUEMGX-UHFFFAOYSA-N 326.316 1.752 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H](O)[C@H](F)C3)c(Br)cc21 2144574205 SSJYQINCARAMCG-FXAINCCUSA-N 344.184 1.310 10 10 EDCE CC(C)(C)OC(=O)N1CC([C@H](F)C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 1980370381 QKFKREVRQLCCBG-GAFUQQFSSA-N 328.384 1.457 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)COC1(C)CN(C(=O)OC(C)(C)C)C1 1985100112 DCQFSYDAGCULSY-UHFFFAOYSA-N 327.385 1.781 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@]4(CCO4)C3)c(Br)cc21 2153334933 RFHSKVZSPRQSKU-OCCSQVGLSA-N 338.205 1.770 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@@H](CO)C2)cc1Br 316654204 DTHIXAUFKJWBSS-RISCZKNCSA-N 329.238 1.348 10 10 EDCE CCNCc1ccc(N2CC[C@](C)(O)[C@@H](O)C2)c(Br)c1 2197965412 JAABAUTUMGEIQU-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2182543942 VIZPGOOEQALJKI-LPQAMYBRSA-N 345.212 1.225 10 10 EDCE CN(C[C@H]1CCN1C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2186467996 AYBUXJTXNIEOCF-OQPBUACISA-N 340.221 1.575 10 10 EDCE Cn1nnc(Br)c1C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2099335661 BHFGOCPZMVXUPP-ZETCQYMHSA-N 328.174 1.883 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213589355 VZYSBULYVRQLCD-AEJSXWLSSA-N 340.384 1.103 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213589359 VZYSBULYVRQLCD-KXUCPTDWSA-N 340.384 1.103 10 10 EDCE CNCCOCCN(C)Cc1c(Br)ccc(OC)c1O 2236052877 MUFQYVVAHPRPDU-UHFFFAOYSA-N 347.253 1.831 10 10 EDCE COc1ccc(Br)c(CN2CCOC[C@@H]2CN)c1O 2227741969 XZJYWGGZCMFKLQ-VIFPVBQESA-N 331.210 1.323 10 10 EDCE O=C1NC(=S)NC1=Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 2297456460 SZZCWZLDIDIZPB-UHFFFAOYSA-N 332.385 1.930 10 10 EDCE O=C1NC(=O)N(C2CCCCC2)C(=O)C1=Cc1ccc(O)c(O)c1 2297534444 FBIBVERQBBHAKA-UHFFFAOYSA-N 330.340 1.892 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCC(=O)NCC1CC1 2307596452 RYFWPZPLLIQHLQ-UHFFFAOYSA-N 343.427 1.179 10 10 EDCE Cc1ccc(CN2CCC[C@](O)(CN)C2)c(O)c1Br 2352676540 QIBGWDNBXMHVQC-AWEZNQCLSA-N 329.238 1.749 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](ON)C2CC2)c(O)c1Br 2352950005 MBKWGFGWJOXEAG-LBPRGKRZSA-N 329.194 1.748 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)Nc1nccs1 172658647 HYQANYNWVFMSMJ-UHFFFAOYSA-N 328.397 1.774 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](O)CCN 1951473223 WQLDPCLDDMMFRE-VXGBXAGGSA-N 326.393 1.243 10 10 EDCE COc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(OC)c1Br 2358637175 SGSHODTWALLFBL-OBRLSWLKSA-N 344.205 1.397 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCCCC(=O)N3)CC2)cc1F 194291228 HNDUBOUYUALEBE-OAHLLOKOSA-N 349.406 1.542 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CC(F)(F)C[C@H]3CO)ccc21 368704722 UDQWHNDWEAWZJX-AWEZNQCLSA-N 339.386 1.981 10 10 EDCE CCOc1cccc(CNC[C@H]2CCC[C@]23NC(=O)N(C)C3=O)c1O 360017444 DABYZDYYWMGQAP-ACJLOTCBSA-N 347.415 1.601 10 10 EDCE COc1ccc(CNS(=O)(=O)CCC[C@@H]2CCOC2)c(O)c1 827539399 CECJELUMSSTBLB-GFCCVEGCSA-N 329.418 1.637 10 10 EDCE C[C@@H]1CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C[C@@H](CO)O1 588561478 UPGZNNYRGPUYQI-DYKRAQSHSA-N 346.427 1.145 10 10 EDCE C/C=C\[C@H](O)C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 901327617 QSLDPFBGUBUJFH-SCOBNMCVSA-N 327.764 1.484 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC(C3(O)CC3)CC2)cc1 844362898 LZNZEPQDMNDSMD-UHFFFAOYSA-N 331.460 1.606 10 10 EDCE Cc1cc(O)c(CN2CCS(=O)(=O)[C@@H]3COCC[C@H]32)c(Cl)c1 840952533 DFFVMJBCMJJRIL-UKRRQHHQSA-N 345.848 1.742 10 10 EDCE CO[C@H](CS(=O)(=O)Nc1ccc(O)cc1F)C1CCOCC1 842587758 HRUJMEQXRMVKAQ-CQSZACIVSA-N 333.381 1.715 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)c3ccc(C)nc3)C2)cc1 849416272 NNEBJQIJSLFZRC-AWEZNQCLSA-N 347.440 1.956 10 10 EDCE CCOC[C@H]1C(=O)N([C@H]2CCN(c3ccc(OC)cc3)C2)C(=O)N1C 849358452 WFSIMDGVXCNMBX-HOCLYGCPSA-N 347.415 1.573 10 10 EDCE COC(=O)c1cnc(CNC(=O)N2Cc3cccc(O)c3C2)s1 924974191 JOIXETIKQPTKIJ-UHFFFAOYSA-N 333.369 1.861 10 10 EDCE CCOc1ccc(CN(C)CCN2CCCS2(=O)=O)c(O)c1 769559766 YDFOEIHZUQKOAH-UHFFFAOYSA-N 328.434 1.258 10 10 EDCE CCNC(=O)N1CC[C@@H](NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 773385890 FCFIXOFPUMZRDB-DZGCQCFKSA-N 347.463 1.917 10 10 EDCE CCc1nc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)no1 775377388 JJENOCIZMDEWEE-UHFFFAOYSA-N 334.351 1.538 10 10 EDCE COC(=O)[C@H]1C[C@@H]2C[C@H](NC(=O)/C=C\c3ccc(O)c(O)c3)[C@@H]2C1 888465256 FLBSLHCNTCARQM-MAVSDYAVSA-N 331.368 1.815 10 10 EDCE Cc1cc(O)c(CN2CCC(O)(COCCO)CC2)cc1Cl 895829067 NIKCIBFFGBWDIJ-UHFFFAOYSA-N 329.824 1.690 10 10 EDCE C[C@@H](NC(=O)C(=O)NCC[C@H]1CCCO1)c1ccc(N(C)C)cc1 786595279 CDHQJCCPLYUFHX-CZUORRHYSA-N 333.432 1.615 10 10 EDCE CCNCc1ccc(N2C[C@@H](CO)[C@@H](CO)C2)cc1Br 704763324 DPLXKWMOLWIDMP-BETUJISGSA-N 343.265 1.596 10 10 EDCE CCNCc1ccc(N(C)C[C@@H](O)CN(C)C)c(Br)c1 690256233 MDQLKRRFQHNUNP-ZDUSSCGKSA-N 344.297 1.917 10 10 EDCE CC(C)N[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1329864257 AIPGGYAFKQRBNL-AWEZNQCLSA-N 331.416 1.223 10 10 EDCE CC(C)(CNC(=O)C(=O)NCCc1ccc(N)cc1)C(F)(F)F 1326148539 WUUXLZQMKPSRNT-UHFFFAOYSA-N 331.338 1.632 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCC(F)F 1321206431 CNUXYLMUTJXIQW-JTQLQIEISA-N 331.315 1.734 10 10 EDCE C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1ccc(N2CCN(C)CC2)c(F)c1 1337001605 XSAKRVFYTOVRAG-GDBMZVCRSA-N 348.466 1.663 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2CN(C)CCO2)cc1C 1268057237 LQKBVSVCNTXAAA-YJBOKZPZSA-N 349.475 1.271 10 10 EDCE COC[C@H](C)N[C@H]1C[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1263851635 QRFZOXZBKUNTQX-SLEUVZQESA-N 347.419 1.982 10 10 EDCE CN1C(=O)c2ccc(C(=O)NCc3cc(O)ccc3O)cc2C1=O 1558174245 IEMQAZUEWUTWDS-UHFFFAOYSA-N 326.308 1.254 10 10 EDCE Cc1nn(CCC(=O)NCc2cccc(O)c2O)c(C)c1[N+](=O)[O-] 1637045852 KNYOBBIWEZTFSY-UHFFFAOYSA-N 334.332 1.526 10 10 EDCE CC1=C(C(=O)NCCCSc2nccs2)S(=O)(=O)CCO1 1565620610 XLOKCBYXQQXZLT-UHFFFAOYSA-N 348.471 1.418 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@@H]2CN(C)C(=O)N2)cc1C 1497241952 SWGLLQBSVXMVET-ZFWWWQNUSA-N 348.447 1.012 10 10 EDCE CC[C@H](CNC(=O)c1nccnc1N)NCc1ccc(OC)c(C)c1 1494954536 XBJNELXPKRIXKZ-CQSZACIVSA-N 343.431 1.674 10 10 EDCE NCc1ccc(N2CC[C@@]3(C[C@@H](O)CO3)C2)cc1Br 2137138901 UNBGOJXXVTZSNL-TZMCWYRMSA-N 327.222 1.638 10 10 EDCE Cc1cc(CC(=O)N2[C@H](CO)CC[C@H]2CO)c(C)n1-c1ccccc1 1570795393 CEMKNKBTUQLMES-OALUTQOASA-N 342.439 1.981 10 10 EDCE COc1cc(O)c(CN2CCO[C@H](Cn3cccn3)C2)cc1OC 160260784 NWTUAHJDDIPNHK-AWEZNQCLSA-N 333.388 1.507 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCCO1 1985101636 VOTLPEBEDWWAHK-AWEZNQCLSA-N 325.369 1.581 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCOC1 1985101537 UIVXYJIPTOYAFP-CQSZACIVSA-N 325.369 1.534 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985104405 IEHNHYAWPMRTHO-VWYCJHECSA-N 327.385 1.562 10 10 EDCE CN(C)c1ccc([C@H](O)C(=O)c2c(Br)nnn2C)cc1 2146998462 XLHVLMBYSFJRHJ-NSHDSACASA-N 339.193 1.560 10 10 EDCE CCOc1cccc(CN[C@H](CO)CNC(=O)OC(C)(C)C)c1O 2011425225 VLDOIWPCKGTNDS-ZDUSSCGKSA-N 340.420 1.766 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCC2(CN=[N+]=[N-])CC2)C1 2011939037 HDTRJBGEJDBFIW-HNNXBMFYSA-N 339.396 1.565 10 10 EDCE C[C@H](NC(=O)[C@@H](O)[C@@H](C)NC(=O)OC(C)(C)C)c1ccccc1O 2017514405 GNODLFYZMJMUPN-WDMOLILDSA-N 338.404 1.844 10 10 EDCE C[C@@H](OCc1ccccc1)C(=O)N(CC(N)=O)Cc1ccc(N)cc1 404476103 OMQYITPCLZEUNP-CQSZACIVSA-N 341.411 1.688 10 10 EDCE CN(C)C[C@]1(O)CCN(c2cc(Br)c(CN)cc2F)C1 713662937 QDOUTLGYNZRYSR-CQSZACIVSA-N 346.244 1.550 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4CCO[C@H]4C3)c(Br)cc2[C@H]1O 2172075448 ZXMMFEHJEXIZJA-WCDAPOTHSA-N 339.189 1.660 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CCC(=CBr)C1 2172363380 PHKISLSUXQTABW-NSHDSACASA-N 341.205 1.479 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCC(C)(C)C3(O)CCCC3)c2n1 2062571862 JYLDHDGQGPFKEL-UHFFFAOYSA-N 332.404 1.804 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CCCN(c2cnccn2)C1 2064018564 HVRIUAORYRPCCX-LBPRGKRZSA-N 328.372 1.421 10 10 EDCE C[C@@H](CO)N1CCN(c2ccc([C@@H](C)N)c(Br)c2)CC1 2169364686 RYUUBWWTHVDDFI-NWDGAFQWSA-N 342.281 1.972 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CN(c3ccc(N)cc3)CCN2C1=O 2053193878 GQHPMQWANAVQFN-HUUCEWRRSA-N 346.431 1.583 10 10 EDCE COC12CC(C1)N(c1cc3c(cc1Br)[C@H](O)C(=O)N3)C2 2185462642 YTTONRIKXLMTCG-XUTOFBKGSA-N 339.189 1.802 10 10 EDCE NCc1ccc(N2CCc3c(cnnc3O)C2)c(Br)c1 2206098606 DMZAVFXGTWZYTC-UHFFFAOYSA-N 335.205 1.966 10 10 EDCE CO[C@H]1[C@H](CO)N(c2ccc(CN)cc2Br)C[C@H]1OC 2233354842 KOOHWDXALDNCDN-MJBXVCDLSA-N 345.237 1.119 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2C[C@H](O)CCO2)c1O 2236056822 XSHBUOBMAOPQCP-ZJUUUORDSA-N 346.221 1.793 10 10 EDCE C[C@@H](NCc1nn(C)nc1Br)c1c(O)cccc1O 2226970948 XLZSFIKZXCTNOP-SSDOTTSWSA-N 327.182 1.840 10 10 EDCE CN1CCN(C2=NC(=O)C(=Cc3ccc4c(c3)OCO4)S2)CC1 2297327713 DINBYPRHMZUBNP-UHFFFAOYSA-N 331.397 1.633 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)cc1Br 2329194024 YCRCVZPOACPPDE-WDGYITBISA-N 327.222 1.665 10 10 EDCE C[C@@H](C(=O)NC(=O)NCC(F)(F)F)N(C)Cc1ccccc1O 111235666 ADGOZNBFVNWGFV-VIFPVBQESA-N 333.310 1.601 10 10 EDCE Nc1c(OCCCCO)cc(O)c2c1C(=O)c1ccccc1C2=O 196952681 MXDMAZZFLAVZMJ-UHFFFAOYSA-N 327.336 1.901 10 10 EDCE Cc1ccc(CN2CCOC[C@@H]2C(=N)NO)c(O)c1Br 2380680783 SCSBTHKQPUUMEL-SNVBAGLBSA-N 344.209 1.620 10 10 EDCE CC[C@H](O)CN(C)c1cc2c(cc1Br)[C@@H](NC)C(=O)N2 2162893108 GQCQKFVEYHLFSY-ISVAXAHUSA-N 342.237 1.869 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN(C(=O)c2ccc(C)cc2)C1 808502559 LRZGNOWTYIABLE-OAHLLOKOSA-N 331.368 1.549 10 10 EDCE CC(=O)C(=O)COC(=O)C(C)(C)S(=O)(=O)c1ccc(Cl)cc1 808551153 QCLSYDNTVMWNBP-UHFFFAOYSA-N 346.788 1.594 10 10 EDCE Cc1cc(CN2CCN(CCC(=O)N(C)C)CC2)ccc1N(C)C 292906102 WLBWRHONWJVNBI-UHFFFAOYSA-N 332.492 1.657 10 10 EDCE COc1ccc(N2CCN(C)C[C@H]2CN)c(OC)c1Br 2162633131 VIHSGRWIRSJWOC-SNVBAGLBSA-N 344.253 1.545 10 10 EDCE COc1ccc(N2CCC(NC[C@H](O)Cn3cccn3)CC2)cc1 819002678 NEXWTBSUWXKVKR-KRWDZBQOSA-N 330.432 1.511 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3CC[C@@H](C3)C2)cc1F 827574910 IVFOTJNWYFOQFI-KBPBESRZSA-N 333.407 1.766 10 10 EDCE O=C(O)[C@@H]1CC[C@H](C(=O)NCc2cc(Br)ccc2O)O1 911555522 LCWJXOJTOUOESR-MNOVXSKESA-N 344.161 1.403 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN2C[C@H](O)C[C@H]2C1 847323171 CLCAQVVKQUZEDB-ZWKOTPCHSA-N 342.443 1.023 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)NCc2noc(C)n2)cc1 845014143 HFMWUDAAXUNZGO-UHFFFAOYSA-N 333.392 1.664 10 10 EDCE O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1cccc(O)c1O 855402009 COSBYBDKHRPFKJ-OAHLLOKOSA-N 342.395 1.594 10 10 EDCE N[C@H]1C[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C12CCC2 925489619 ZRZBFCXFJXBEQZ-IRXDYDNUSA-N 349.500 1.281 10 10 EDCE CN(C)c1ccc([C@@H](N)CNS(=O)(=O)c2cccc(N)c2)cc1 850586649 BCTZLNUUIGOPIS-INIZCTEOSA-N 334.445 1.313 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CCc1cn(C)nn1 854949345 UPDRIZSQIZUIGJ-AWEZNQCLSA-N 329.448 1.870 10 10 EDCE COC(=O)c1cc(OCC(=O)N2CCO[C@H](C)C2)ccc1N(C)C 865396618 WKUJGFRLNROPSJ-GFCCVEGCSA-N 336.388 1.165 10 10 EDCE CCc1cccc(CNC[C@]2(CO)COCC3(CCC3)N2C)c1O 862463945 PEYJJHUMRMYWSD-IBGZPJMESA-N 334.460 1.660 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCNC34CCC4)C2)cc1 861658809 OBVICVMZKDRMRW-RHSMWYFYSA-N 344.459 1.858 10 10 EDCE C[C@@H](NC(=O)C(=O)N1CCC2(COC2)C1)c1ccc(N(C)C)cc1 1118691810 JATTUQSHBHEYJB-CYBMUJFWSA-N 331.416 1.179 10 10 EDCE C[C@@H](C(=O)N1Cc2cccc(O)c2C1)N1C(=O)NC2(CCCC2)C1=O 871200558 GHIGWUGGYYVUBQ-NSHDSACASA-N 343.383 1.488 10 10 EDCE CS(=O)(=O)N1CCCC[C@@H]1CNCc1cc([N+](=O)[O-])ccc1O 796513057 JDIIOQOQCRPSCK-CYBMUJFWSA-N 343.405 1.204 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCCC[C@H]1N1CCOCC1 1149533147 FRXNSNZQWCXVQO-HUUCEWRRSA-N 334.416 1.400 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CCN(C)C1 1152401110 KOCCKGUOLMFHBM-LLVKDONJSA-N 340.807 1.499 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ncnc(O)c1Br 1304053356 IZGHUOQWAWOTOS-UHFFFAOYSA-N 340.133 1.286 10 10 EDCE NCc1ccc(N2CCC(OCCO)CC2)c(Br)c1 212983341 SXFYAXSFFFVRNZ-UHFFFAOYSA-N 329.238 1.886 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12 1351821826 BKUFZKCMCYIHCU-ARKGTOAJSA-N 328.412 1.759 10 10 EDCE CCN(c1cc2c(cc1Br)[C@H](NC)C(=O)N2)C1COC1 1915657648 SOZGSIJLOUYTFS-ZDUSSCGKSA-N 340.221 1.887 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnn(CCOC)c1C 1467841513 YHELIFASTTVJLD-UHFFFAOYSA-N 338.404 1.959 10 10 EDCE C[C@H](NC(=O)c1cc(S(=O)(=O)N(C)C)c[nH]1)c1ccccc1O 1471195038 SQRXAQVWPLCRLT-JTQLQIEISA-N 337.401 1.462 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1COC(=O)N1)NCc1ccc(OC)c(C)c1 1481808566 WSQRNZSEGDJPJZ-UONOGXRCSA-N 335.404 1.096 10 10 EDCE OCc1ccc(N2CC[C@@]3(C[C@H](O)CO3)C2)cc1Br 2137136434 VMJRWUGVVQYQTI-GXTWGEPZSA-N 328.206 1.672 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)CN2CCOCC2)cc1C 1725477759 CZQKWGYJFRTVDC-INIZCTEOSA-N 349.475 1.272 10 10 EDCE COc1ccc(CNC[C@H]2CCCN2C(=O)CCCC(N)=O)cc1C 1699766866 XAZOFVGKTJOPSU-MRXNPFEDSA-N 347.459 1.740 10 10 EDCE C[C@H]1SC(=S)N(CCCCCC(=O)N2CCOCC2)C1=O 11636613 LRDNKLDJFWDYEZ-LLVKDONJSA-N 330.475 1.654 10 10 EDCE O=C(O)COc1ccccc1/C=C1\SC(=S)N(CCO)C1=O 16904934 LAGDFFNSMVMFFO-XFFZJAGNSA-N 339.394 1.344 10 10 EDCE CCNCc1ccc(N2CCNC(=O)[C@@H]2C)cc1Br 233530433 HTQUSRUGDBSHJW-JTQLQIEISA-N 326.238 1.883 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NCCc1ccc(O)c(O)c1 1944566916 RKDZUFZXAKEJRA-STQMWFEESA-N 338.404 1.522 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCCN=[N+]=[N-])CCCOC1 1985094114 KELHLBNYELGVOX-CQSZACIVSA-N 327.385 1.877 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]1(C)COC[C@@H]1NC(=O)OC(C)(C)C 1985101441 SIVKZHQATFIYKK-IINYFYTJSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC[C@@H](N=[N+]=[N-])C1)C1COC1 2010401216 BNIRGXFFQJMACZ-NEPJUHHUSA-N 339.396 1.827 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1C[C@@H](O)CCN1C(=O)OC(C)(C)C 2010405833 MKPVYZLZPNMOJS-NWDGAFQWSA-N 341.412 1.906 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)C[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010404703 BYVWXZCVHHCTBW-SDDRHHMPSA-N 339.396 1.658 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C1 2012305730 KINYEXUMNQFOBS-NLTNOIMHSA-N 339.396 1.563 10 10 EDCE CCCN[C@H]1C(=O)Nc2cc(N3CC(O)C3)c(Br)cc21 384059181 PLBFQANPTVHDFW-CYBMUJFWSA-N 340.221 1.623 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCOC34CCCCC4)c2n1 2062738016 FLHJGABXIFWYBL-CYBMUJFWSA-N 330.388 1.965 10 10 EDCE O=C(O)CN1CCC[C@H](NCc2ccc(Br)cc2O)C1 2169328185 VYNJWEQHYNSERZ-LBPRGKRZSA-N 343.221 1.793 10 10 EDCE CN1CCO[C@@H]2CCN(c3ccc(CN)c(Br)c3)C[C@H]21 2185493218 PFIVLHBDLHTUBI-HUUCEWRRSA-N 340.265 1.817 10 10 EDCE CCN1CCN(c2ccc(CN)c(Br)c2F)CC1=O 2102564156 PSONQTSNNVILSQ-UHFFFAOYSA-N 330.201 1.715 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)C[C@H]3C2)c(Br)c1 2236991984 ZMHNFNCUPGYZSH-HGSJOUDDSA-N 342.233 1.509 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cccnc2NN)s1 2284700585 VGIQCXQMVHFOGO-UHFFFAOYSA-N 331.448 1.024 10 10 EDCE CCN1C(=O)C(=Cc2ccc(N3CCCC3)cc2)C(=O)NC1=S 2297327124 DWSLSKFMQSTDCG-UHFFFAOYSA-N 329.425 1.933 10 10 EDCE Cc1ccc(CNC[C@@]2(C)COCCN2)c(O)c1Br 2352952258 MRCAMFVKMDPTEY-AWEZNQCLSA-N 329.238 1.931 10 10 EDCE COc1ccc(N2CCN(C(=O)COc3cc(C)n(C)n3)CC2)cc1 128417824 RCSBSCDZIQYGGW-UHFFFAOYSA-N 344.415 1.465 10 10 EDCE Cc1ccc(O)c([C@@H](C)NCCNS(=O)(=O)c2cccnc2)c1 186142097 ZRACLZSXXZHLHG-CYBMUJFWSA-N 335.429 1.725 10 10 EDCE COc1c(N)nc[nH]c1=NCc1ccc(C)c(Br)c1O 2381131279 LMMAHTXRXXAISR-UHFFFAOYSA-N 339.193 1.878 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc(S(=O)(=O)C(C)C)ccc1F 808516633 IZPYPUGRCQOMEM-UHFFFAOYSA-N 330.333 1.323 10 10 EDCE CNC(=O)[C@@H]1CCN(C(=O)NCCCSc2nccs2)C1 817776390 ISVNQDHQRYPZTK-SNVBAGLBSA-N 328.463 1.403 10 10 EDCE CCN(CC)CCS(=O)(=O)NCc1ccc(N(C)C)c(F)c1 810044710 MGAIAUODBUCNKK-UHFFFAOYSA-N 331.457 1.653 10 10 EDCE CCOc1ccc(O)c(CNCCCN2CCCS2(=O)=O)c1 729684048 GVOLNULSSZOVCI-UHFFFAOYSA-N 328.434 1.306 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC[C@@H]1CCC[C@H]1O 823524692 WTDLTZCRNVTHCP-MAUKXSAKSA-N 347.459 1.608 10 10 EDCE CC(C)(C)n1nnc(C(=O)NCc2ccc(N3CCCC3)cc2)n1 821843549 TWVQMHGTLNCNQN-UHFFFAOYSA-N 328.420 1.958 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CCC3(O)CCC3)CC2)cc1 905875495 PNERHBRHYVQUQN-QGZVFWFLSA-N 334.460 1.873 10 10 EDCE CN1CCN(c2ccc(CNC(=O)[C@@H]3CC[C@H](C(=O)O)C3)cc2)CC1 902693120 OWAPFYUSBNYQSX-CVEARBPZSA-N 345.443 1.556 10 10 EDCE C[C@H](NC(=O)N1CCN2C[C@H](O)C[C@H]2C1)c1ccc(N(C)C)cc1 847357526 ZCCJDXFMYNZWQJ-RRQGHBQHSA-N 332.448 1.274 10 10 EDCE COC1(CS(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)CCOCC1 844660182 HXQYYTHHBCFGPY-UHFFFAOYSA-N 346.361 1.238 10 10 EDCE O=C(NCc1c(O)cccc1F)NC[C@H]1COC2(CCOCC2)O1 921826519 SMXYFNQFLUHGBL-NSHDSACASA-N 340.351 1.253 10 10 EDCE Nc1ccc(CCNS(=O)(=O)Cc2noc3c2CCCC3)cc1 923637440 ZQXWPQSQZGOUCD-UHFFFAOYSA-N 335.429 1.798 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C2)cc1 855226251 OTIOXPJRFABJJF-RHSMWYFYSA-N 347.459 1.941 10 10 EDCE CN(C)CCC[C@H]1CN(C(=O)NCCc2ccc(N)cc2)CCO1 851664777 KOAGJRHHJBBYLV-KRWDZBQOSA-N 334.464 1.564 10 10 EDCE O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)NCc1c(O)cccc1F 928706812 VLOCYTOJUXQMIW-PHIMTYICSA-N 332.331 1.099 10 10 EDCE Cc1nsc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 763256932 KVAWTUPULWGXSI-UHFFFAOYSA-N 336.392 1.752 10 10 EDCE CCNC(=O)N1CC[C@@H](NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 773385897 FCFIXOFPUMZRDB-UKRRQHHQSA-N 347.463 1.917 10 10 EDCE COC(=O)[C@@]12CCOC[C@@H]1CN(Cc1cc(F)cc(F)c1O)C2 894626778 BWNHISJLZGNKRR-MEDUHNTESA-N 327.327 1.682 10 10 EDCE CN(c1ccc(CNC2CC2)c(Br)c1)[C@@H]1COC[C@H]1O 708104521 FYCNYZBOQYRVGG-HUUCEWRRSA-N 341.249 1.897 10 10 EDCE O=C(O)[C@@H]1OCC[C@H]1CNCc1cc(Br)cc(F)c1O 715786493 GBOAMRTVJLRRMT-JVXZTZIISA-N 348.168 1.873 10 10 EDCE CCCNCc1ccc(N2C[C@H](O)C[C@@H]2CO)c(Br)c1 698194796 AVVFPZQAHOBIPO-CHWSQXEVSA-N 343.265 1.881 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CCO[C@@H](c3nccn3C)C2)c(O)c1O 1161536423 VLQWMQLIMKKEFB-DGCLKSJQSA-N 331.372 1.790 10 10 EDCE CCOc1ccc(N2CCN(C(=O)CCCCC(N)=O)CC2)cc1 1320493694 DPVCXIIXTHQMES-UHFFFAOYSA-N 333.432 1.780 10 10 EDCE C[C@H]1CCOCCN1C(=O)C(=O)NCCCSc1nccs1 1332569212 SRIFSARZOLAMRE-NSHDSACASA-N 343.474 1.379 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ncoc2C)cc1C 1272372336 PLTRZUNQLIODKQ-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3CCC(=O)N3C)CC2)cc1C 1277139964 FUZGSCZWLRGFJX-HNNXBMFYSA-N 345.443 1.363 10 10 EDCE Cc1cc(C(N)=O)c(NC(=O)CCN2C(=O)CSC2=S)s1 1865768252 OJHSSOMZSKEGEM-UHFFFAOYSA-N 343.455 1.344 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C1CC(O)C1 1914574378 NANMZSJHCWDPIJ-FOEZSWGGSA-N 327.178 1.394 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](C)CCN(C)C 1299700111 YHQOINDGTORKLN-CQSZACIVSA-N 336.432 1.872 10 10 EDCE Cc1cc(CC(=O)N2CC(CO)(CO)C2)c(C)n1-c1ccccc1 1455619405 ABNZONSAGGBZGJ-UHFFFAOYSA-N 328.412 1.450 10 10 EDCE CSc1ccccc1C(=O)N1CCS(=O)(=O)[C@@H]2COCC[C@H]21 1451145194 RYTTWNMFMXFIOV-TZMCWYRMSA-N 341.454 1.437 10 10 EDCE C[C@H](CCO)N(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 1917089916 DZVDZOFLPQNMKY-KRTXAFLBSA-N 329.194 1.642 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1ccc(-n2ccnc2O)cc1 1465954120 MZCONFTUAPKIDZ-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE C[C@@H](CCCNC[C@@H](C)O)NC(=O)c1ccc(N=NC(N)=O)cc1 1485752458 WKBVSLVFZDVRLN-NWDGAFQWSA-N 335.408 1.718 10 10 EDCE CCS(=O)(=O)c1cccc(C(=O)NCc2c(O)cccc2O)c1 1558533375 DSWGJZJNBJDASY-UHFFFAOYSA-N 335.381 1.821 10 10 EDCE CCOCC(=O)N(C)C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1718523731 XFNAJLUACNSERX-LLVKDONJSA-N 349.391 1.462 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@H](NS(C)(=O)=O)C(C)C)c1 1631542618 JPVLRABMWWMSBZ-IINYFYTJSA-N 344.433 1.152 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)Cc2nnc(C)o2)cc1C 1498541287 FULXOCQFZJAHNW-UHFFFAOYSA-N 346.431 1.876 10 10 EDCE CN(CCNCc1csnn1)C(=O)c1ccc(N=NC(N)=O)cc1 1567615320 QAFYGTRFFNHNEU-UHFFFAOYSA-N 347.404 1.562 10 10 EDCE COc1ccc(CNC[C@](C)(NC(=O)CNC(C)=O)C2CC2)cc1C 1568012384 FPFBEFIKWLARLK-IBGZPJMESA-N 347.459 1.514 10 10 EDCE CNC(=O)[C@@H](C)N[C@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1734357109 OCCPSFHKBYSWDE-GHMZBOCLSA-N 348.407 1.034 10 10 EDCE O=C(C[C@@H]1C(=O)Nc2c(F)cccc21)NCc1c(O)cccc1O 1645363147 NOXCJNYMMGGCBH-JTQLQIEISA-N 330.315 1.979 10 10 EDCE COC(=O)NCC(=O)N(C)CCCNCc1ccc(OC)c(C)c1 1733089584 OWSAYHKPFBXQCU-UHFFFAOYSA-N 337.420 1.298 10 10 EDCE O=C(NC[C@@H]1CCCS1(=O)=O)c1cc2cc(O)c(O)cc2s1 1640762576 UWELHVFJXPIRJV-VIFPVBQESA-N 341.410 1.620 10 10 EDCE CN(C)S(=O)(=O)c1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1 1587928082 JBUJISOYPKNDJR-UHFFFAOYSA-N 346.408 1.799 10 10 EDCE O=C1NC(=S)NC(=O)C1=Cc1ccc(N2CCC(Cl)=N2)cc1 5673293 RRALUSMHBVKWDC-UHFFFAOYSA-N 334.788 1.363 10 10 EDCE C[C@@]1(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCOC1=O 1123864710 ATDFMIJYCVJOQN-KBXCAEBGSA-N 348.399 1.788 10 10 EDCE CCNCc1ccc(N2C[C@H](CO)C[C@@H]2CO)c(Br)c1 2146080178 URQOUAMIGAAPLE-CHWSQXEVSA-N 343.265 1.738 10 10 EDCE COC1(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 2010405339 YBZNYMGLDZLIBP-NSHDSACASA-N 339.396 1.924 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@H](O)CCNC(=O)OC(C)(C)C 2012310951 JDGDPJGTABZCKW-CQSZACIVSA-N 338.404 1.626 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C 2022869833 DHRRUSFDMZAXPY-CQSZACIVSA-N 337.420 1.503 10 10 EDCE CN[C@H](c1cn(CCNC(=O)OC(C)(C)C)nn1)c1ccccc1O 2029559944 RHQDBJWUABKCMB-HNNXBMFYSA-N 347.419 1.817 10 10 EDCE CN1CCCc2cc(C=CC(=O)NC3CCN(C(N)=O)CC3)ccc21 2041682759 SYRRQRSQKGDPGW-UHFFFAOYSA-N 342.443 1.742 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](CO)[C@@H](CO)C2)cc1Br 704814801 LAFMLTALUOKZEH-SDDRHHMPSA-N 343.265 1.767 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCC[C@]45OCC[C@@H]4C[C@H]35)c2n1 2064564383 ACFKINQQOZXYRW-OPWYMKIUSA-N 342.399 1.821 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3CCc4ccccc4OC3)c2n1 2065151157 VDJSSWGZMPHBCT-ZDUSSCGKSA-N 338.367 1.867 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)c(Br)c1 2189047231 AAZJOKLLIZPUBA-APAOZMKASA-N 341.249 1.912 10 10 EDCE O=C(c1cc(O)c(O)c(O)c1)N1C[C@H]2C[C@H]1CN2Cc1ccccc1 2068577459 NNBWBABNNCCLBZ-CABCVRRESA-N 340.379 1.902 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(CNC(=O)Cc2ccc(N)cc2)C1 2081958665 FPSZDCBQNNRWDP-UHFFFAOYSA-N 349.431 1.157 10 10 EDCE CCCNC(=O)C1CN(c2ccc(CO)c(Br)c2)C1 2111744555 GGYYTTPVWKPPFS-UHFFFAOYSA-N 327.222 1.904 10 10 EDCE C[C@H](O)c1ccc(N2CC(=O)N[C@H]3CC[C@@H]32)c(Br)c1 2112061626 MKSBVZIASRNGMW-QWRKXWFKSA-N 325.206 1.970 10 10 EDCE NCc1ccc(N2CCC[C@H](OCCO)C2)cc1Br 2113853576 HLGOMGOQTOSYIV-ZDUSSCGKSA-N 329.238 1.886 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3COC[C@@]3(CO)C2)cc1Br 2234550368 CCSYKJBMRJVFOC-RWSFTLGLSA-N 341.249 1.914 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@H](COc1nnc(=N)[nH]n1)c1ccccc1 2264208770 GNOJMTUPDKXWON-GFCCVEGCSA-N 346.391 1.666 10 10 EDCE O=C(O)[C@@]12CCO[C@H]1CN(Cc1ccc(Br)cc1O)C2 2296424743 IRDLFTWAJVRLTK-GXTWGEPZSA-N 342.189 1.830 10 10 EDCE CCNCc1ccc(N2CC([C@@H](O)CO)C2)c(Br)c1 2336768117 AZMLHUAPHALFET-AWEZNQCLSA-N 329.238 1.348 10 10 EDCE CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C/c1c(O)[nH]c(=O)[nH]c1=O 106414937 IBRPJXOMSRNZKB-KPKJPENVSA-N 340.339 1.192 10 10 EDCE C[C@H](NC(=O)NCc1ccnn1C)c1ccc(N2CCOCC2)cc1 68549322 JWUIGDWLIKRTDA-AWEZNQCLSA-N 343.431 1.817 10 10 EDCE COc1ccc(N2CCCN(c3cncc(C(N)=O)n3)CC2)cc1 301537363 UKXONFVFCWWBII-UHFFFAOYSA-N 327.388 1.301 10 10 EDCE COc1cccc(OCC(=O)NCCN2C(=O)CSC2=S)c1 49755997 JYUWQJXWRIAUPP-UHFFFAOYSA-N 340.426 1.051 10 10 EDCE CO[C@H](c1cccc(O)c1O)[C@@H](NC(=O)OC(C)(C)C)C(=O)O 1952308273 JSZLPQXQSIFKCU-ZYHUDNBSSA-N 327.333 1.763 10 10 EDCE CN(C)c1ccncc1C(=O)NCc1ccc(N2CCOCC2)cc1 273518845 PBJZSGHTFRCHKW-UHFFFAOYSA-N 340.427 1.914 10 10 EDCE Cc1ccc(CN=c2nc(C(=O)O)n(C)[nH]2)c(O)c1Br 2381141665 CJJNIRWCZRJWAG-UHFFFAOYSA-N 341.165 1.324 10 10 EDCE CCn1ncc(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)n1 819590644 LWQPFNRJSYDACN-CYBMUJFWSA-N 329.404 1.563 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H](OC)[C@@H]3CCOC3)CC2)cc1 822918949 GFHRYUHKLFHJIH-QAPCUYQASA-N 348.443 1.785 10 10 EDCE COc1ccc(OC)c(/C=C2\SC(=S)N(CC(N)=O)C2=O)c1 727177066 VUZUYSNFDNIHIH-WDZFZDKYSA-N 338.410 1.390 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC(CCOC)C2)cc1 827164031 BJIMZOUUKHMOHK-UHFFFAOYSA-N 347.459 1.644 10 10 EDCE COc1cc(O)ccc1NS(=O)(=O)C[C@H](OC)C1CCOCC1 901703452 FSKOKWRLVCFUMB-HNNXBMFYSA-N 345.417 1.584 10 10 EDCE Cc1cc(O)c(CN2CCC[C@H](CS(N)(=O)=O)C2)c(Cl)c1 840916695 BHKZJQJIUXAHDS-NSHDSACASA-N 332.853 1.855 10 10 EDCE Nc1ccc(CCNC(=O)N2CC[C@@H]([C@H](O)C(F)(F)F)C2)cc1 841955583 HIZALXHXJRRIBA-YPMHNXCESA-N 331.338 1.766 10 10 EDCE O=C(c1cccn1CCN1CCOCC1)N1Cc2cccc(O)c2C1 913726279 LNSYRXZBWQDORM-UHFFFAOYSA-N 341.411 1.682 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)N1C(=O)[C@H]2[C@H](O)CCCN2C1=O 842264545 KFGNNPRRUAIAMR-IAOVAPTHSA-N 345.443 1.780 10 10 EDCE CCN1CCN(CC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 855232067 QGWGSDMQWFQJPO-MRXNPFEDSA-N 346.475 1.028 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C[C@@H]3CSCCN3)C2)cc1 851640559 YBKUIHYKFYMKLH-ZIAGYGMSSA-N 335.473 1.485 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)N3CCN(C)CC3)C2)cc1 855230293 FVKGPUOLQLJOJL-CVEARBPZSA-N 346.475 1.026 10 10 EDCE CC[C@H](NC[C@]12COCCN1C(=O)COC2)c1ccc(C)cc1O 866553809 OAMRKPQUUOKMFH-MAUKXSAKSA-N 334.416 1.369 10 10 EDCE O=C(NCCCSc1nccs1)C1(N2CCOCC2)CC1 865783332 NWJQIIOJLAALEE-UHFFFAOYSA-N 327.475 1.606 10 10 EDCE CC1(C)CC[C@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)O1 779330808 DHOFMVQQEMWPHN-LLVKDONJSA-N 342.417 1.451 10 10 EDCE COc1cc(C)cc(CN[C@@H]2CCC[C@H]2CNS(C)(=O)=O)c1O 894671766 CJZKDIMGIDZGSV-GXTWGEPZSA-N 342.461 1.517 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(C)[C@H](CO)C2)c(Br)c1 687613171 YTPDUXCQGOLYDW-YPMHNXCESA-N 342.281 1.842 10 10 EDCE CN[C@H](C)c1ccc(N2CCC(CO)(CO)C2)c(Br)c1 694726912 INIPERZXTPULSH-LLVKDONJSA-N 343.265 1.911 10 10 EDCE Cc1nnc2n1CCN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@H]2C 1306033937 NBBRCAWVBYCLPA-VIFPVBQESA-N 327.348 1.966 10 10 EDCE C[S@@](=O)C1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2115310634 ONWOPKAJEXLJNM-NSPYISDASA-N 345.218 1.002 10 10 EDCE CN1CCN(c2ccc(CN[C@H](CN)C(F)(F)F)cc2F)CC1 1327711860 UXNMMMUICMGOLK-CQSZACIVSA-N 334.361 1.557 10 10 EDCE Cc1cc(C(=O)NCc2c(O)cccc2O)ccc1N1CCNC1=O 1178905040 DZWFQSBDZUFWBQ-UHFFFAOYSA-N 341.367 1.866 10 10 EDCE CC(C)(C)N1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1331950881 PTHDLGYHFCAHCQ-UHFFFAOYSA-N 345.443 1.567 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cn(C)c(O)n2)cc1C 1268660131 GSUYAVOGNQZOFV-GFCCVEGCSA-N 332.404 1.351 10 10 EDCE COCCNC(=O)CN(C)c1ccc(CN)cc1Br 212890865 XQTWUYQNDMVGRF-UHFFFAOYSA-N 330.226 1.107 10 10 EDCE COc1ccc(C=O)c(OCC(=O)NCc2cc(O)ccc2O)c1 1455355523 BJYVJSVXZRZCOD-UHFFFAOYSA-N 331.324 1.614 10 10 EDCE CN1CCN(c2ccc(CNC(=O)CCN3CC[C@@H](F)C3)cc2)CC1 1455224201 IZKIGQMAVLQIOX-QGZVFWFLSA-N 348.466 1.489 10 10 EDCE COc1cccc(CNC(=O)c2cc(-c3ccn(C)n3)on2)c1O 1465991312 ATVKZZMRZUWBTM-UHFFFAOYSA-N 328.328 1.719 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3nnn(C)c3C)CC2)cc1C 1483724580 PSFVHBWYMVSXRH-UHFFFAOYSA-N 343.431 1.493 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2coc(C)n2)cc1C 1716085874 LPCZEGNJKLCXMN-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)Cn2ccnc2)cc1C 1482906436 XZFRJYWSNBYYJZ-HNNXBMFYSA-N 330.432 1.885 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CCN2CCOCC2)cc1C 1715998009 OOIPEWYFHWLYNB-INIZCTEOSA-N 349.475 1.320 10 10 EDCE CCN(C)C(=O)CNC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1497994934 QTKDCCCVUZNKSC-LLVKDONJSA-N 348.407 1.035 10 10 EDCE CC[C@H](F)C(=O)NCC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1495646200 GETCKIJNJBRRHV-PWSUYJOCSA-N 341.383 1.472 10 10 EDCE COC(=O)[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccc(OC)cc1 1636365328 ZPLGFXNOZBSNTH-QGZVFWFLSA-N 345.351 1.679 10 10 EDCE COC(=O)C(C)(C)n1ccc(NC(=O)Cc2ccc(O)c(O)c2)n1 1641729423 RGHWIYLTLZOUKY-UHFFFAOYSA-N 333.344 1.384 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CCCC[C@@H]1N1CCCC1=O 1645362995 ICTAIMUOGGKQNP-OCCSQVGLSA-N 332.400 1.895 10 10 EDCE CO[C@@H](C)C(=O)NCC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1745952729 OPLJRAARHUAQII-JTQLQIEISA-N 347.375 1.072 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cn(C)c(O)n2)cc1C 1662329862 NUHQLFJFKJTTAF-LBPRGKRZSA-N 332.404 1.351 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)Cc2ccon2)cc1C 1677066696 WQBGRWONHIKBPY-INIZCTEOSA-N 347.415 1.143 10 10 EDCE CC[C@H]1CN(S(=O)(=O)CCOc2ccc(N)cc2)CCS1 157241681 RAMYBCZYHMVPHO-AWEZNQCLSA-N 330.475 1.805 10 10 EDCE NC(=O)CCN(CC(=O)c1ccc(O)c(O)c1)Cc1ccccc1 1946832745 KHOZBKURYXVQKP-UHFFFAOYSA-N 328.368 1.658 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)NCCCCN=[N+]=[N-] 1963732030 FOHCVQOZQRYTCH-LLVKDONJSA-N 327.385 1.829 10 10 EDCE COC(C)(C)[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2004243309 NLWAKHLCWRNTIR-JTNHKYCSSA-N 342.436 1.570 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2CCN(C)C2=O)c1O 1973451570 MTKKPOLSQHTUCA-VIFPVBQESA-N 343.221 1.731 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1990024972 ZEINHSVUGIVLKJ-MNOVXSKESA-N 327.385 1.563 10 10 EDCE Nc1c(I)nc[nH]c1=NCc1ccccc1O 2008301919 NVYUTJRUAOFTFP-UHFFFAOYSA-N 342.140 1.403 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H](CC(=O)N2CC(N=[N+]=[N-])C2)O1 2010405351 YJGRPEGERKEIOA-JQWIXIFHSA-N 339.396 1.922 10 10 EDCE Oc1c(Br)cc(Cl)cc1CNC[C@H]1COC[C@@H]1O 2036575494 FIDLNJNBJDZIFK-KWQFWETISA-N 336.613 1.905 10 10 EDCE NCc1ccc(N2CCS[C@@H](CO)C2)c(F)c1Br 720067527 LLGQFRFPYZZVPH-SECBINFHSA-N 335.242 1.961 10 10 EDCE CS(=O)(=O)c1cnn(Cc2ccc(O)cc2O)c1Br 2070219566 CARWSSPYFNDGAI-UHFFFAOYSA-N 347.190 1.509 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)OCC23CC3)c(Br)c1 2183972096 PBHGRXMIJGGRFO-LBPRGKRZSA-N 341.249 1.899 10 10 EDCE [N-]=[N+]=NCCCCN1CC(O)(C2CCN(C(=O)C(F)(F)F)CC2)C1 2056827756 KFMBXGIVUQPEMM-UHFFFAOYSA-N 349.357 1.925 10 10 EDCE CC1(C)CC(CNC(=O)OC(C)(C)C)(COc2nnc(=N)[nH]n2)C1 2213783123 MJVVFKULLYFBDT-UHFFFAOYSA-N 338.412 1.389 10 10 EDCE CC[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2288908400 WYDSHDYKWIDMMP-WCFLWFBJSA-N 341.205 1.784 10 10 EDCE O=C1C(=Cc2ccncc2)SC(=S)N1[C@H]1CCS(=O)(=O)C1 2297299513 PHPRQMHXHIMMIV-JTQLQIEISA-N 340.451 1.470 10 10 EDCE C[C@@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)c1ncon1 2305556549 RCQOKQGIMYUWSC-CYBMUJFWSA-N 328.372 1.797 10 10 EDCE C[C@@H](O)[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(F)cc2)SC1=S 2323823838 RIFIHEFTUCZHRO-RDDDGLTNSA-N 341.385 1.861 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@@H]4C[C@]4(O)C3)c(Br)cc21 2355179617 NVBXZVQKHTYPSI-PYSYBHHASA-N 338.205 1.362 10 10 EDCE O=C(COCc1ccccc1)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O 304723991 PJRPZKCBYOIDQF-AWEZNQCLSA-N 345.351 1.427 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@]1(C)CC1(F)F 1261672038 HHSDXCHZQKECAN-MRXNPFEDSA-N 339.386 1.873 10 10 EDCE Cc1ccnc(-n2c(C)cc(CN3CC[C@@](N)(C(=O)O)C3)c2C)c1 67894673 KDTKQVGNCDFORW-SFHVURJKSA-N 328.416 1.785 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)N1C[C@H](CO)OC[C@H]1C 305135649 KTSYJUOGDAEDKV-DGCLKSJQSA-N 329.356 1.472 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)NCCCN1CCOC1=O 77526379 CMYKDOFTBBXRHV-UHFFFAOYSA-N 334.420 1.736 10 10 EDCE COc1ccc(N2CCC(NC(=O)N3CC(NC(C)=O)C3)CC2)cc1 190019159 XIPZNGMOVRJOIJ-UHFFFAOYSA-N 346.431 1.194 10 10 EDCE Cc1ccc(CN2C[C@H](N)CC[C@@H]2C(=O)O)c(O)c1Br 2380800789 LNBJZMMENKSXDE-GHMZBOCLSA-N 343.221 1.839 10 10 EDCE Cc1ccc(CN2CC(O)([C@@H](F)C(=O)O)C2)c(O)c1Br 2380803735 IVHNULMNUYHCLG-NSHDSACASA-N 348.168 1.433 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F 808528373 YZDLURRDXSEJMV-UHFFFAOYSA-N 344.245 1.619 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@](C)(CO)C(C)C)CC2)cc1 810074830 ALMUVODLPYYNFZ-LJQANCHMSA-N 349.475 1.340 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)C3(C(=O)N(C)C)CC3)C2)cc1 819588481 MYJWHJUWRGJDJV-CQSZACIVSA-N 345.443 1.506 10 10 EDCE C[C@H]1CN(c2ccc(CNC(=O)[C@@H]3[C@H]4COC[C@H]43)cc2F)C[C@@H](C)O1 822688060 KACRQDPAYLWNJZ-XVTHAXPKSA-N 348.418 1.948 10 10 EDCE CC(C)N1CCC([C@H]2C[C@H]2CNC(=O)c2cc(O)nc(O)c2)CC1 585509681 ZPBATAGAJOBQTO-LSDHHAIUSA-N 333.432 1.979 10 10 EDCE CCS(=O)(=O)C1(CNCc2ccc([N+](=O)[O-])c(OC)c2O)CC1 827579679 GUMYKKNSWBVIOD-UHFFFAOYSA-N 344.389 1.366 10 10 EDCE CN1C(=O)C(=Cc2ccc(Br)s2)C(=O)NC1=S 2293662189 DHXHBTASCMMTSD-UHFFFAOYSA-N 331.216 1.767 10 10 EDCE O=S(=O)(CC1CC1)NCc1cc(F)c(N2CCOCC2)c(F)c1 841536980 IWWWRYCXAXLUKG-UHFFFAOYSA-N 346.399 1.631 10 10 EDCE C[C@@H]1OC[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[C@H]1C 925055389 MACNYJNSLGFFDI-ZQIUZPCESA-N 338.473 1.434 10 10 EDCE CCn1nc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)ccc1=O 855230720 IPMNMPDMTZRMPP-ZDUSSCGKSA-N 342.399 1.281 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@@](C)(C(=O)OCC(=O)C(C)=O)C1 859989680 YJXMPSHAANJEMX-MEDUHNTESA-N 343.376 1.102 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)Nc1cnn(C)c1C(F)F 758969643 PFIWDZFEAZGHSB-UHFFFAOYSA-N 338.314 1.660 10 10 EDCE Cc1cc(Cl)cc([C@H](C)NC2CN(S(=O)(=O)N(C)C)C2)c1O 858571682 JDWWEBMYADPDNJ-JTQLQIEISA-N 347.868 1.495 10 10 EDCE COCc1nn(C)cc1C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855222905 CIQOTHAIPIHUAQ-ZDUSSCGKSA-N 344.415 1.584 10 10 EDCE COC[C@@]1(C(=O)NCCN=[N+]=[N-])C=CCN1C(=O)OC(C)(C)C 1900002653 MCVZDVNKHZRJBM-CQSZACIVSA-N 325.369 1.605 10 10 EDCE COC(=O)c1cnc(CSc2ncc(C(=O)OC)s2)cn1 863340714 MRLMNDOTYQTXCS-UHFFFAOYSA-N 325.371 1.799 10 10 EDCE C[C@H](NS(=O)(=O)CCCN1CCN(C)CC1)c1ccccc1O 867836268 LYXWWHIWYYCYAW-AWEZNQCLSA-N 341.477 1.010 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@@H](C)[C@H](CN)C1 868356634 BRLMUCXHIAJPBV-GDBMZVCRSA-N 346.475 1.154 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](O)[C@@H](C)O)c2C)cc1 871125415 NGZNJQAXCDPFCB-DYVFJYSZSA-N 332.400 1.574 10 10 EDCE C[C@H](N)[C@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 715768899 GJPZNSRXVGOSQV-QPUJVOFHSA-N 333.201 1.842 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3OC(=O)N[C@@H]3C2)cc1Br 2120414654 CJQGGSAWZONQOH-HFKOZYHYSA-N 327.178 1.799 10 10 EDCE Cc1ccc(-n2c(C)cc(C(=O)Cn3nnn(C)c3=O)c2C)cc1 1189770208 OJMBBBYQAIVPSV-UHFFFAOYSA-N 325.372 1.576 10 10 EDCE C[C@H](O)C[C@H]1COCCN1c1ccc(CN)cc1Br 2128868266 VMGQKCRRPSCIGJ-JQWIXIFHSA-N 329.238 1.884 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)N[C@H]1[C@H]2CCC[C@H]21 1346327817 UECQKBHSVJQUMY-JGPRNRPPSA-N 325.459 1.656 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@H](C[C@@H]1COCCO1)C(F)(F)F 1350935422 IJEZQBHPMUVQJT-MNOVXSKESA-N 349.305 1.698 10 10 EDCE CN(C)c1ccc(CNC(=O)/C=C\c2ccc(C(N)=O)o2)cc1F 1434915212 PAVAUYCDFFVIOD-YVMONPNESA-N 331.347 1.913 10 10 EDCE CN(CC1(O)CCC1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 1914583692 QSXXNFCEWHDMJF-LBPRGKRZSA-N 340.221 1.752 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2CCCc3ccnc(O)c32)c1 1461572212 NCRMRAPOLAPCRR-SNAWJCMRSA-N 338.367 1.534 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)c2cc[nH]c2)cc(OC)n1 1701627160 FQMKCNGHDMQHIS-NSHDSACASA-N 346.387 1.317 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)Cc2ccccc2)cc1C 1716094308 VCEQBYMWTVVWAJ-GOSISDBHSA-N 342.439 1.813 10 10 EDCE Cc1cccnc1NC(=O)CCNC(=O)Cc1ccc(O)c(O)c1 1637434594 UENYWGYJODLFOK-UHFFFAOYSA-N 329.356 1.489 10 10 EDCE Cc1nnnn1-c1ccc(C(=O)NCc2cc(O)ccc2O)cc1 1637125910 GVKRDRMIRQGMDS-UHFFFAOYSA-N 325.328 1.312 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1coc2c1C(=O)NCCC2 1567467260 FPPLXIIPKDNLIO-JTQLQIEISA-N 344.367 1.728 10 10 EDCE COc1ccc(-n2nnnc2CNCCN(C)C(=O)CC(C)C)cc1 1493462881 KMYTZUBHHMPFAU-UHFFFAOYSA-N 346.435 1.265 10 10 EDCE COC(=O)CCSCCNC(=O)c1ccc(N=NC(N)=O)cc1 1633997162 GJWCEWWDDSWLPX-UHFFFAOYSA-N 338.389 1.875 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2ccns2)cc1C 1734519504 SAANYNYVFPNLKD-AWEZNQCLSA-N 349.456 1.683 10 10 EDCE C[C@H](NC(=O)Cc1ccc(O)c(O)c1)C(=O)OCc1ccccc1 1640437954 VFZFSBZHNXELCC-LBPRGKRZSA-N 329.352 1.888 10 10 EDCE Cn1cc([C@H](O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cn1 1588145589 KJAAVEHRUSWPEJ-KRWDZBQOSA-N 341.367 1.981 10 10 EDCE CCOc1ccc(N2CCN(C(=O)Cc3cn(CC)nn3)CC2)cc1 1596732494 BPGDXDMCLMJXJF-UHFFFAOYSA-N 343.431 1.588 10 10 EDCE CC(C)(C)OC(=O)NCCSCC(=O)C(=O)C[C@H]1C[C@H](N)C1 1961042801 FZTZMNMUTBEHRT-XYPYZODXSA-N 330.450 1.510 10 10 EDCE NCc1ccc(N2CCC(OCC(N)=O)CC2)cc1Br 2145378757 BZKQZEAEHCNQIH-UHFFFAOYSA-N 342.237 1.379 10 10 EDCE CN(C)c1ccc([C@@H](O)[C@@H](N)c2cc(Br)nn2C)cc1 2148508653 IBKAWYGLBUTSDK-UONOGXRCSA-N 339.237 1.982 10 10 EDCE Cn1cc(C(=O)N2CC[C@H](N=[N+]=[N-])C2)c(=NC(=O)OC(C)(C)C)[nH]1 2010391082 MIOYVNQJGUGLBF-VIFPVBQESA-N 335.368 1.714 10 10 EDCE NCc1ccc(N2CC[C@@H]3C(=O)NC[C@H]3C2)c(F)c1Br 2157192971 ZIOCAAXONRWLCW-UWVGGRQHSA-N 342.212 1.619 10 10 EDCE O=C1Nc2cc(N(C3CC3)C3COC3)c(Br)cc2[C@H]1O 2161291734 QTMWIUVSHUDHEK-CYBMUJFWSA-N 339.189 1.802 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)c(Br)c1 2173316626 DFDFXLNKVFYRGG-WBGBGRJVSA-N 341.249 1.789 10 10 EDCE CNCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2199525120 CSOFFIANRGFREZ-HPEDKQMDSA-N 341.249 1.489 10 10 EDCE Cc1cc(Br)cc(CN(C)[C@@H]2CC(=O)NC2=O)c1O 2114732226 LABZTWFMYSYCSZ-SNVBAGLBSA-N 327.178 1.310 10 10 EDCE O=C(O)[C@H]1CCC2(CN(Cc3cc(Br)ccc3O)C2)O1 2205376785 FNYYZXQZYDLOPJ-GFCCVEGCSA-N 342.189 1.973 10 10 EDCE O=C(c1cccc(O)c1O)N1CCC[C@H](NC(=O)C(F)(F)F)CC1 2258226272 OBLKSERSOYLKQQ-VIFPVBQESA-N 346.305 1.771 10 10 EDCE CSc1ncc(CNS(=O)(=O)[C@@H]2CC[C@@H](C(=O)O)C2)s1 2284499447 OXGKFTGVYHBWHN-VXNVDRBHSA-N 336.460 1.538 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1[C@H]2[C@@H]1OCCN2C(=O)OC(C)(C)C 2300530499 RHKADHANRHOXTA-SDDRHHMPSA-N 339.396 1.780 10 10 EDCE COC(=O)C1(NC(=O)C=Cc2ccc(N3CCOCC3)cc2)CC1 2305344489 LTAOKRRFFUWTFF-UHFFFAOYSA-N 330.384 1.358 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2336480720 RMAJIXSWFZUIQL-RWEMILLDSA-N 346.246 1.736 10 10 EDCE Cc1ccc(CN2CCN(C)[C@H](CN)C2)c(O)c1Br 2352932278 KTLQKEYVITWOEV-GFCCVEGCSA-N 328.254 1.538 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@@H](O)[C@H]3C4)c(Br)cc2[C@@H]1O 2355625328 FTYCVHZLBYNCJY-FTRPCTHQSA-N 339.189 1.394 10 10 EDCE CCN(OC)C(=O)CNC(=O)NCc1ccc(N2CC=CC2)cc1 1261457065 WHUZIRHDPDJXHV-UHFFFAOYSA-N 332.404 1.272 10 10 EDCE CNc1ncc(C(=O)NCc2ccc(N3CCOCC3)cc2)s1 138223479 COWJRNHKCXRUEE-UHFFFAOYSA-N 332.429 1.951 10 10 EDCE COc1ccc(N2CCNC[C@@H]2C(=O)O)c(OC)c1Br 2162632679 SHWBJXVCFLCDMJ-SECBINFHSA-N 345.193 1.329 10 10 EDCE Cc1nnc(CC(=O)NCc2cc(Br)ccc2O)o1 813611026 XZUQXHXXHJQAAY-UHFFFAOYSA-N 326.150 1.705 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C)[C@@H](C)CO)C2)cc1 824354787 RCKVPQJNQWHVTG-SOUVJXGZSA-N 335.448 1.838 10 10 EDCE O=C(NC1CCC(Oc2cnccn2)CC1)c1cc(O)nc(O)c1 585353751 IVUIASKYOBOQGU-UHFFFAOYSA-N 330.344 1.403 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1COC(C)(C)C1 828438227 UZISRNQKZUSHOJ-AWEZNQCLSA-N 333.432 1.361 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3C[C@@H](C(N)=O)C3)C2)cc1 845269814 WCWQPHUJKUJWPO-MCIONIFRSA-N 346.431 1.085 10 10 EDCE COc1cc(O)c(CN2CC[C@H](Nc3ncccn3)C2)cc1OC 842617804 WSEHMJKWSMBFDW-ZDUSSCGKSA-N 330.388 1.886 10 10 EDCE Cn1ncc(C(F)(F)F)c1/C=C1\SC(N2CCOCC2)=NC1=O 849243380 JCIIZQUJKGINRO-POHAHGRESA-N 346.334 1.741 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@H]3CSCCN3)C2)cc1 851640556 YBKUIHYKFYMKLH-KBPBESRZSA-N 335.473 1.485 10 10 EDCE COC1(OC)CC[C@H]1NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 924728546 JFXBOAAAVPCEFU-NVXWUHKLSA-N 347.459 1.629 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC(C(=O)O)C3)C2)cc1 857101388 VNZHNBUIFTXCMF-GFCCVEGCSA-N 333.388 1.248 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCCN(C(C)=O)C3)C2)cc1 855228422 CAJDRHYSNDRBNV-JKSUJKDBSA-N 345.443 1.649 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCOC[C@@H]3C)C2)cc1 852281208 RFPVZKYZIXIOOH-GRDNDAEWSA-N 333.432 1.998 10 10 EDCE CCN(CCO)CCNCc1cc(C)cc(Br)c1O 768945309 ICLDHQWNCFSIOF-UHFFFAOYSA-N 331.254 1.867 10 10 EDCE C[C@@H](NC(=O)C(=O)N1CC(C)(F)C1)c1ccc(N2CCOCC2)cc1 1117126709 SIQBDNCSJXSVGC-CYBMUJFWSA-N 349.406 1.271 10 10 EDCE CN(CCCO)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 799552432 BSGSTFDLGFZHDD-UHFFFAOYSA-N 339.411 1.311 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CCCS(=O)(=O)C2)cc1 1141687485 PAZLSYXSISQHEW-JTQLQIEISA-N 338.389 1.404 10 10 EDCE C[C@@H](O)[C@@H]1CN(c2ccc(CN)c(Br)c2F)CCO1 2117526653 AWXSJLCEZXDBFI-KCJUWKMLSA-N 333.201 1.633 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC[C@@]12CCOC2 1327863465 NZTIWVMANYFRNP-IBGZPJMESA-N 345.443 1.722 10 10 EDCE COC[C@H](C)NC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1276712480 VEZKNQMPJIDKKL-NHYWBVRUSA-N 347.419 1.982 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cc2ccon2)cc1C 1273920180 YWDPGHOBSLMMQO-ONEGZZNKSA-N 329.400 1.996 10 10 EDCE CN(C)C(=O)[C@H]1CCCN1c1ccc(CN)cc1Br 212939706 ULMASTOQGJTGEW-CYBMUJFWSA-N 326.238 1.965 10 10 EDCE C[C@@H](CNC(=O)[C@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1285742045 VQHFZJXYASHKRU-JQWIXIFHSA-N 347.375 1.120 10 10 EDCE CS(=O)(=O)C1CCC(C(=O)NCCc2ccc(O)c(O)c2)CC1 1445941452 YAUPCIAXNPOCTF-UHFFFAOYSA-N 341.429 1.360 10 10 EDCE CCc1nnc(N2CCNC(=O)C2)n1Cc1ccc(N(C)C)c(F)c1 1293140478 OLRHAVVOSTZOPF-UHFFFAOYSA-N 346.410 1.030 10 10 EDCE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1C[C@H]1C(N)=O 1465849122 PCXIRJFSGZJUNX-MNOVXSKESA-N 341.205 1.625 10 10 EDCE Cc1cn2nc(C(=O)NCc3cccc(Cl)c3O)cc2c(=O)[nH]1 1606868490 PUKWAJQWGARSLZ-UHFFFAOYSA-N 332.747 1.620 10 10 EDCE COC[C@](O)(CNC(=O)OC(C)(C)C)[C@H](N)c1ccccc1O 1921822908 HCKVWEXNVZZBFV-CZUORRHYSA-N 326.393 1.294 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H]2CCCN2C(C)=O)cc1C 1715964855 NBMHFGBKRPLFLY-RHSMWYFYSA-N 347.459 1.609 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2[nH]nnc2C)cc1C 1714420399 SJWLQQQUEVZQAW-LLVKDONJSA-N 331.420 1.586 10 10 EDCE COCCNc1nc(CC(=O)NCc2c(O)cccc2O)cs1 1558536083 SDEDKPDHTIFSCY-UHFFFAOYSA-N 337.401 1.472 10 10 EDCE CCOC(=O)COCCNC(=O)c1cc2cc(O)c(O)cc2s1 1635785780 ITIMUYBMHCDPNB-UHFFFAOYSA-N 339.369 1.622 10 10 EDCE CCS(=O)(=O)CCn1c(C)nnc1N(C)Cc1ccccc1O 1729201951 OLSKTVSEYAKIIZ-UHFFFAOYSA-N 338.433 1.363 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2nnn(C)n2)C(C)C)cc1C 1732567165 YGLBGJYPZJKPTB-AWEZNQCLSA-N 346.435 1.071 10 10 EDCE COc1ccc(CNC2CC(N(C)C(=O)[C@@H](C)CC(N)=O)C2)cc1C 1734598006 JSLJWZQMJOAALY-JEYLPNPQSA-N 347.459 1.594 10 10 EDCE CC/C(C)=C\C(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1758673442 VFFSBIZQGCIYBZ-ZCDQOCIJSA-N 347.415 1.832 10 10 EDCE COc1cccc(CNC(=O)Cc2nc(C)c(C(=O)O)s2)c1O 8016987 WCXHTFFDAQHATA-UHFFFAOYSA-N 336.369 1.723 10 10 EDCE O=C1C[C@H](C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)CCN1 1889600734 PANJTDLNEBMKDM-UXLLHSPISA-N 327.428 1.818 10 10 EDCE Cc1ccc(O)c(CNCC(=O)Nc2sc(C)cc2C(N)=O)c1 1857876593 IKJDPBNUYLZFQI-UHFFFAOYSA-N 333.413 1.898 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]1(CNC(=O)OC(C)(C)C)CCCO1 1985099663 AIXHBPSRJYJRHB-AWEZNQCLSA-N 327.385 1.829 10 10 EDCE CC(C)(C)OC(=O)N1CCOCCN1C(=O)c1ccc(O)c(O)c1 2006285274 UEBMKJPXVLFBNH-UHFFFAOYSA-N 338.360 1.722 10 10 EDCE C[C@H]1CCN(Cc2cc(N)ccc2O)C[C@@H]1NC(=O)C(F)(F)F 1999433472 AUKHTJQGYKSDIB-CABZTGNLSA-N 331.338 1.863 10 10 EDCE CC(C)(C)OC(=O)NCc1nc(=NCc2c(O)cccc2F)[nH][nH]1 2011842737 HYVMFOMSOWGJDG-UHFFFAOYSA-N 337.355 1.708 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCC2(CN=[N+]=[N-])CC2)C[C@H](O)C1 2018046485 ANLOEYYCHVAJTJ-AVCCJPFPSA-N 339.396 1.611 10 10 EDCE O=C(Nc1nc(O)nc(O)c1Br)c1cccc(O)c1O 2182325218 WZNWUMVYJFBPEN-UHFFFAOYSA-N 342.105 1.314 10 10 EDCE CO[C@H](C)[C@@H](CC(=O)C(=O)C[C@H]1C[C@H](N)C1)NC(=O)OC(C)(C)C 1906905901 HWSAESZGTFWGIQ-FDYHWXHSSA-N 342.436 1.570 10 10 EDCE NCc1cc(F)c(N2CCO[C@@H]3C[C@H](O)C[C@@H]32)cc1Br 2185306870 JLEYZMGOIHQVOH-BIGNPOOSSA-N 345.212 1.775 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCO[C@H]2CCNC[C@@H]21 2185534431 UVEDHHUMJXNIBU-STQMWFEESA-N 345.212 1.857 10 10 EDCE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CCN1C(=O)c1ccc(O)c(O)c1 2054417097 ITJRTKDRSBTUPB-PSASIEDQSA-N 346.305 1.769 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2104414311 JJRCKHCJHBKQSZ-GJQVQUKXSA-N 327.222 1.099 10 10 EDCE C[C@H]1[C@H](C)S(=O)(=O)CCN1c1ccc(CN)c(Br)c1 2113894932 QNXLLFZVBCUDST-UWVGGRQHSA-N 347.278 1.920 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCCC[C@H]1CCOc1nnc(=N)[nH]n1 2213780599 HYWSYOFVYLBBKJ-QWRGUYRKSA-N 338.412 1.532 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1CCC[C@@H](O)[C@H]1O 2224348775 NMHJCHQDVOAEBY-WZRBSPASSA-N 334.185 1.658 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)C[C@H]3C2)cc1Br 2236980685 RNUAVDCAECKPJW-LWWSYDQCSA-N 341.249 1.476 10 10 EDCE CN(C)c1ccc([C@@H](NN)c2nn(C)nc2Br)cc1 2226976243 GGFUNQWPYQHIPX-SNVBAGLBSA-N 325.214 1.196 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1CC[C@H](O)CN1C(=O)OC(C)(C)C 2246452972 ZKLWYNSXAKJOLM-NWDGAFQWSA-N 341.412 1.906 10 10 EDCE CN1CCN(/C=C2/SC(=S)N(C[C@H]3CCCO3)C2=O)CC1 102724106 OVXCRXWBNLBIRC-KPMWUXBGSA-N 327.475 1.115 10 10 EDCE CCCC[C@@H](NC(N)=O)C(=O)N1CCN(c2ccc(OC)cc2)CC1 68516521 AUBVUFPLDUVFMU-MRXNPFEDSA-N 348.447 1.571 10 10 EDCE CN1CCO[C@@H](CNC(=O)NCc2c(O)ccc3c2CCCC3)C1 176438524 QHDNAKYYLHELCE-AWEZNQCLSA-N 333.432 1.401 10 10 EDCE C[C@H](N[C@@H]1CCc2ncnn2C1)c1ccc(N2CCOCC2)cc1 180578946 MXEKWOJJHAVMQB-GOEBONIOSA-N 327.432 1.780 10 10 EDCE CCOC(=O)c1cn(C)nc1NC(=O)N(C)Cc1ccccc1O 272286463 AULSVGCJDNNICM-UHFFFAOYSA-N 332.360 1.966 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 808520590 TYSZDMGVLZOMKA-CQSZACIVSA-N 335.356 1.954 10 10 EDCE C[C@H](NC(=O)C(=O)N1CCN(C2CC2)CC1)c1ccc(N(C)C)cc1 807672975 KVOHKRYBPRDYNE-AWEZNQCLSA-N 344.459 1.236 10 10 EDCE CC(F)(F)CCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 295595836 OPEGVIUBHKJARB-UHFFFAOYSA-N 336.360 1.929 10 10 EDCE C[C@H](C(N)=O)N(C)c1ccc(/C=C\C(=O)O)cc1Br 711183625 FEVXLECESUSVPZ-RZAAKKIOSA-N 327.178 1.857 10 10 EDCE C[C@@H](NC(=O)[C@@H]1CCNC(=O)CC1)c1ccc(N2CCOCC2)cc1 815114224 KUUFSAMPYFKVLH-ZBFHGGJFSA-N 345.443 1.617 10 10 EDCE COc1cc(Br)cc(CN2CC3(CNC(=O)O3)C2)c1O 817417725 OFHMAFZZWGGWDS-UHFFFAOYSA-N 343.177 1.458 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H]3CCCNC3=O)C2)cc1 824284763 VYUTUKJJUOWXSO-BBRMVZONSA-N 346.431 1.099 10 10 EDCE C[C@H](N)CCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 827469500 ZQYLSENHRMIWKT-DZGCQCFKSA-N 332.448 1.132 10 10 EDCE COC[C@H](O)CN[C@H](C)c1cc(Br)cc(OC)c1O 848548987 NBFSUVMPKFCWMP-PSASIEDQSA-N 334.210 1.821 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CCC(=O)N(C)C1 840306170 QOOJIKFODFJHDG-HOCLYGCPSA-N 346.475 1.912 10 10 EDCE C[C@@H](NC(=O)C(=O)N1C[C@@H]2CCC[C@H](C1)N2)c1ccc(N(C)C)cc1 842201726 AJDWUFLZIZIZRO-BMFZPTHFSA-N 344.459 1.283 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCN3C[C@H](O)C[C@H]3C2)cc1 847292450 XGIGGEBCUMLJKV-ZWKOTPCHSA-N 346.475 1.493 10 10 EDCE COc1ccc(N2CC[C@@H](Nc3nc(O)c4cnn(C)c4n3)C2)cc1 853758833 LACFKKRDPHWWRT-LLVKDONJSA-N 340.387 1.768 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCc4nccn4C3)C2)cc1 855223891 CMQDFCHSWOIXSH-LSDHHAIUSA-N 340.427 1.849 10 10 EDCE C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCS1 929238036 VNHMGKKZVPDDPT-JSGCOSHPSA-N 335.473 1.769 10 10 EDCE COCCO[C@H]1COCC[C@H]1NC(=O)NCc1c(O)cccc1F 922070653 KRLCNTALYVIBOK-HIFRSBDPSA-N 342.367 1.151 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC(N3CC[C@@H](O)C3)CC2)c1O 852708590 FPZSLMUIMICWGN-MRXNPFEDSA-N 336.407 1.765 10 10 EDCE C[C@@H]1NCC[C@H]1NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 861699296 PZFHQPJILCBXHK-NUEKZKHPSA-N 333.432 1.833 10 10 EDCE Cc1ccc(O)c(CNC(=O)[C@@H]2CCN(C)C[C@@H]2c2cnn(C)c2)c1 862754313 XLABVOUEJIPQFT-IAGOWNOFSA-N 342.443 1.786 10 10 EDCE Cc1cc(CCNC(=O)C2CS(=O)(=O)C2)c(C)n1-c1ccccc1 864645238 WVWWVYMWICHWFE-UHFFFAOYSA-N 346.452 1.797 10 10 EDCE CN(C)c1ccc(/C=C\CNC[C@]23COCCN2C(=O)OC3)cc1 865770363 KOMDLFHQDKGDDS-DDKKJVIOSA-N 331.416 1.577 10 10 EDCE COCc1n[nH]c(CNCc2ccc(N3CCN(C)CC3)c(F)c2)n1 1118484835 NRBLQUZKUQZNEB-UHFFFAOYSA-N 348.426 1.132 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)NCCC1CS(=O)(=O)C1 786842987 UCDMULNAJGLGGT-UHFFFAOYSA-N 340.445 1.749 10 10 EDCE [N-]=[N+]=NC[C@H]1CCCN1C(=O)Cn1cc(Br)ccc1=O 701276094 XBXCSRAMCZLRGK-SNVBAGLBSA-N 340.181 1.912 10 10 EDCE CN(C)[C@H]1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 92775841 VCIIWGMVHFXVQD-SDBXPKJASA-N 339.237 1.541 10 10 EDCE O=C(CNC(=O)Cc1cccc(F)c1)NCc1c(O)cccc1F 1156163707 ARYCKHGZWZWRRF-UHFFFAOYSA-N 334.322 1.646 10 10 EDCE CC1CC(n2nnc3c2CN(C(=O)Cc2ccc(O)c(O)c2)CC3)C1 1642733836 VCGXIIPTZALPBU-UHFFFAOYSA-N 342.399 1.788 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NC[C@@H]1CCOC1 1258221993 UMELWCBUNXQPAW-VIFPVBQESA-N 329.194 1.990 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC(C)(C)CNC(N)=O)C2)cc1 1252922255 FVJZUXGNNRKTDJ-GFCCVEGCSA-N 349.435 1.020 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cn(C)cn2)cc1C 1268527631 KLRKKIQSOUBVEQ-SNAWJCMRSA-N 328.416 1.813 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2C[C@H](CNCCCO)C2)cc1 1283112000 YZTMJZIPBKPUPL-YEORSEQZSA-N 333.392 1.329 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)Cc2cncn2C)cc1C 1700799627 MVVYHFUWBHMKLH-HNNXBMFYSA-N 344.459 1.916 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cnon3)CCC2)cc1C 1700141349 HTLIHIQVNDPZNI-UHFFFAOYSA-N 330.388 1.829 10 10 EDCE O=C(Cc1c(O)ncnc1O)NCc1ccc2cccnc2c1O 1627073824 WMGOEMDHJPDSHZ-UHFFFAOYSA-N 326.312 1.001 10 10 EDCE COc1ccc(CNC(=O)c2c(Br)cnn2C)c(O)c1 1556354628 PCFJPSZWQFOERT-UHFFFAOYSA-N 340.177 1.827 10 10 EDCE CCOC(OCC)[C@@H](C)NC(=O)NCc1cccc(OC)c1O 1565495329 HSTQQTIYHVGWLY-LLVKDONJSA-N 326.393 1.988 10 10 EDCE O=C(NCc1cccc(Cl)c1O)c1cn(-c2cccnc2)nn1 1647830392 UZDCMMQDTYCAAT-UHFFFAOYSA-N 329.747 1.951 10 10 EDCE COC(=O)N[C@H]1CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 1651405881 GHLXNJBYVQOHRK-VIFPVBQESA-N 325.321 1.547 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1Cc2cc(F)ccc2NC1=O 1593880986 BDAQJTOMFNSWGO-ZDUSSCGKSA-N 330.315 1.664 10 10 EDCE CN(C)c1ccc(CNCC(=O)Nc2ccc(C(N)=O)cc2)cc1 1857854924 FPDALBAIUPKVBY-UHFFFAOYSA-N 326.400 1.580 10 10 EDCE COc1ccc(Br)c(CNC[C@@]2(O)CCOC2)c1O 1964061931 NJFAKDYIOLZMPL-ZDUSSCGKSA-N 332.194 1.404 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(OCC(N)=O)C2)c(Br)c1 2145377090 JQCBRXZMMNMWFM-VIFPVBQESA-N 342.237 1.420 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2010391779 UVZSODQXAQDLQV-GHMZBOCLSA-N 339.396 1.875 10 10 EDCE CO[C@@]1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CCN(C(=O)OC(C)(C)C)C1 2010391629 AGNUSWGUOOHUHF-NHYWBVRUSA-N 339.396 1.924 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 2010388993 JZMYHZCLIAGTAX-NSHDSACASA-N 340.428 1.648 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C1 2010404995 WIEOVMCDCRQURA-RYUDHWBXSA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOCC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010405811 MDMCPKXRUWJQRB-NEPJUHHUSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1CC(=O)N1CC[C@@H](N=[N+]=[N-])C1 2014442306 LSRPZKLPWOWFGT-IJLUTSLNSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3CC(CN)C3)ccc(N)c2C1 2016924005 BBERPLPRTAJVEU-UHFFFAOYSA-N 332.448 1.957 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)C[C@@H]2CO)cc1Br 698194816 BBDOYBFISDNRMS-KGLIPLIRSA-N 343.265 1.881 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@@H](CO)C2)c(Br)c1 396818454 XJUWDUQXOKNMMY-UDZFHETQSA-N 329.238 1.648 10 10 EDCE Cc1ccc(CN(C)S(=O)(=O)CCN)c(O)c1Br 2327800494 LVLMYYRYVJLQNX-UHFFFAOYSA-N 337.239 1.183 10 10 EDCE OC[C@@]1(NCc2cccc(Br)c2O)C[C@@H](O)C12CCC2 2193964896 CWJFCYJUMDUXLD-DOMZBBRYSA-N 342.233 1.910 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@]4(CO)C3)c(Br)cc21 2200841489 LFZDFPLYDGVCNQ-AAAAQAOESA-N 338.205 1.220 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)C[C@@H]2CO)cc1Br 2200832604 LKUKIXCLJGJZAA-KGLIPLIRSA-N 343.265 1.881 10 10 EDCE Oc1c(F)cc(Br)cc1CNCC[C@H]1COC[C@@H]1O 2111325792 LUQKGVCMAAOKPQ-UFBFGSQYSA-N 334.185 1.781 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@]2(COc2nnc(=N)[nH]n2)C1 2213783182 NADNMGCLMMLZCJ-ZUZCIYMTSA-N 336.396 1.095 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)CO1 2246585112 LXKLRJLCZOVCNV-PWSUYJOCSA-N 339.396 1.827 10 10 EDCE CCOC(=O)CC[C@@H](NC(=O)Cc1ccc(N)cc1)C(=O)OCC 1721461 KZNZDJFLHCYTFC-CQSZACIVSA-N 336.388 1.203 10 10 EDCE CN(CC1(O)CC1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2340178327 DCICQPGWWHNUCY-NSHDSACASA-N 326.194 1.362 10 10 EDCE Cc1ccc(Cn2cc([C@H](N)CO)nn2)c(O)c1Br 2352947763 KARDSMJGTUNWHB-SECBINFHSA-N 327.182 1.095 10 10 EDCE CN[C@H](c1ccccc1O)[C@@H](O)c1nc(Br)cn1C 2353756844 LVYKZUCHJGXHAT-VXGBXAGGSA-N 326.194 1.882 10 10 EDCE CCc1nc(CN2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)no1 174840542 RZOMHYIXEJRPKX-UHFFFAOYSA-N 347.375 1.564 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)c(Br)c1 2357057245 VSHVOIBIAJWZBJ-IDNCBAHPSA-N 341.249 1.932 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2357593604 YFKFCLWSRRRWMZ-PTPDJHTLSA-N 341.249 1.789 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)O[C@@H]1CCNC1 1951831631 AQEVLODWYSXSBP-DOMZBBRYSA-N 338.404 1.870 10 10 EDCE CC[C@@H](C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(O)c(O)c1 272269122 CWHVBVKEKSSHQA-ZYHUDNBSSA-N 338.429 1.662 10 10 EDCE Cc1ccc(CN[C@@H]2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(O)c1Br 2380794200 YFSHXHTXGJVCAG-KAILVDNBSA-N 342.233 1.683 10 10 EDCE CC1CCN(c2ccc(CNC[C@H](O)CN3CCOCC3)cc2)CC1 819039495 RDLZQHADUXLFRY-FQEVSTJZSA-N 347.503 1.706 10 10 EDCE CNC(=O)[C@@H]1CCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C1 817171209 RONUATGMDFKOCP-GDBMZVCRSA-N 346.475 1.770 10 10 EDCE CN1CC2(CN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)C2)OC1=O 817413957 NOKZVYDARMCHGV-UHFFFAOYSA-N 327.724 1.590 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](NC(=O)OC(C)(C)C)C(F)(F)F 811422724 SJIWPJQBVKISAX-MRVPVSSYSA-N 327.255 1.143 10 10 EDCE COC[C@@]1(C(=O)NCc2ccc(N3CCOCC3)cc2)CCOC1 825393380 DPGMZWWNMZKIPA-SFHVURJKSA-N 334.416 1.193 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1COC2(CCC2)C1 828438505 WXIKAJNVDUUKFR-OAHLLOKOSA-N 345.443 1.505 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCNC3)cc2)C1 827468613 BCYQMWROMWITDL-HZPDHXFCSA-N 344.459 1.004 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCN(CCO)C[C@H]2C)c1O 832783142 NWDQGBVOJMRQQM-LLVKDONJSA-N 326.824 1.747 10 10 EDCE CN1CCCc2cc(CNC(=O)N[C@@H]3CNCCC3(F)F)ccc21 841760654 XJBXQIRVVUWODI-OAHLLOKOSA-N 338.402 1.865 10 10 EDCE Cc1cc(O)c(CNC[C@@H]2CCN(S(C)(=O)=O)C2)c(Cl)c1 840905686 BJRKRJSRKYZSBM-NSHDSACASA-N 332.853 1.725 10 10 EDCE CO[C@@H](CS(=O)(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCOC1 849369580 YWXRBMVHIVCJFX-HOCLYGCPSA-N 342.461 1.224 10 10 EDCE NCc1ccc2c(c1)CCCN2S(=O)(=O)c1cccc2nonc12 842713105 ACHCWLBTEHLWCN-UHFFFAOYSA-N 344.396 1.823 10 10 EDCE O=C(Nc1ccc(O)c(CNC(=O)[C@H]2CCCO2)c1)[C@@H]1CCCO1 923125943 LBHPKORSFBVWFA-CABCVRRESA-N 334.372 1.305 10 10 EDCE COC(=O)[C@]1(C)CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 840388306 WLSREDAQMJAPNU-MRXNPFEDSA-N 349.343 1.705 10 10 EDCE O=C(NCc1cc(NC(=O)[C@@H]2CCCO2)ccc1O)[C@@H]1CCCO1 923121796 LBHPKORSFBVWFA-GJZGRUSLSA-N 334.372 1.305 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H]([C@H](O)c3ccncc3)C2=O)cc1 924444133 DSZIJFLDDRHPPW-HZPDHXFCSA-N 340.383 1.302 10 10 EDCE Cc1cncn1CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 858201582 QIDQGKOHPUISMN-UHFFFAOYSA-N 328.416 1.687 10 10 EDCE C[C@H](NC[C@@]1(OCCO)CCOC1)c1cc([N+](=O)[O-])ccc1O 850508017 LMENYLZHCPZKPM-NHYWBVRUSA-N 326.349 1.119 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](N)Cc3ccccc3)C2)cc1 851639894 MTFUHHNKAOZTAT-APWZRJJASA-N 339.439 1.960 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)Nc2cn(C)nn2)N(C)C)cc1 931510413 UZXKJVOQOVABNG-CQSZACIVSA-N 331.424 1.306 10 10 EDCE CCO[C@@H](CS(=O)(=O)NNc1nc2cccnc2s1)C1CC1 863410226 XPQDVRNHJYASBY-NSHDSACASA-N 342.446 1.753 10 10 EDCE C[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)C(=O)NCCF 897670853 LDLMXEUUXVXESW-ZETCQYMHSA-N 326.349 1.517 10 10 EDCE COC[C@](C)(CO)N(C)c1cc(Br)c(CN)cc1F 689783274 XHLKQMIYNJATLA-ZDUSSCGKSA-N 335.217 1.881 10 10 EDCE NCc1ccc(N2CCOC[C@@H]2CCO)c(F)c1Br 694919218 HSYRXNAWORNWTI-JTQLQIEISA-N 333.201 1.635 10 10 EDCE CN(CCc1ccncc1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329338517 HEAWOTPUTSEILW-UHFFFAOYSA-N 325.368 1.331 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2C[C@H]3C=C[C@H]2CC3)cc1 1334534135 BCKZPIDMAMIHSC-QRTARXTBSA-N 327.428 1.840 10 10 EDCE C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1332018392 GBBACTJVXDJTFD-IUODEOHRSA-N 331.416 1.033 10 10 EDCE NCc1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2134818005 WAZJBIYQYVWNLI-PWURMNTRSA-N 327.222 1.228 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H](C)NC(C)=O)cc1C 1274669584 GCYPSNGUOCKECA-UONOGXRCSA-N 335.448 1.513 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@]3(C)CCNC3=O)CC2)cc1C 1277170152 JGRFALOMLDWSGU-SFHVURJKSA-N 345.443 1.268 10 10 EDCE O=C(Cn1nc(-c2ccccc2)oc1=O)N1Cc2cccc(O)c2C1 1455037327 PIAAIDBKYFETSD-UHFFFAOYSA-N 337.335 1.751 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1nc(-c2cnccn2)no1 1452935630 IWZGWVRQZFWPPL-UHFFFAOYSA-N 331.719 1.816 10 10 EDCE CO[C@@H](C)C(=O)NCCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1293979945 XHQXXVMXZVZGMJ-NSHDSACASA-N 349.391 1.462 10 10 EDCE CC[C@H](C)CC(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1295112397 LAHLYRLIFSWMSE-UBHSHLNASA-N 349.431 1.912 10 10 EDCE O=C(NC[C@@H]1CS(=O)(=O)c2ccccc2O1)c1cc(O)cs1 1469310533 LHVOGTHEHAQYBT-SNVBAGLBSA-N 339.394 1.418 10 10 EDCE COC(=O)NCC(=O)N1C[C@@H](NCc2ccc(OC)c(C)c2)C[C@H]1C 1700830507 LRAISQAMYPGOAC-HIFRSBDPSA-N 349.431 1.439 10 10 EDCE COc1ccc(CC(=O)NCc2cc(O)ccc2O)cc1[N+](=O)[O-] 1558174057 CSNCSAZVELJBHF-UHFFFAOYSA-N 332.312 1.874 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@H]1CCCOC1 1567083507 MLLLXDDBLWTTBS-CHWSQXEVSA-N 347.419 1.984 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)Cc2nc[nH]n2)C2CC2)cc1C 1569323843 KUDUTFFDPIVBQQ-OAHLLOKOSA-N 343.431 1.349 10 10 EDCE C[C@H](NCC(=O)N(C)C)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1734006621 QMWHNXNSNKTKHR-WDEREUQCSA-N 348.407 1.034 10 10 EDCE CCn1nncc1C(=O)N(C)C[C@H](C)NCc1ccc(OC)c(C)c1 1734323009 BVYZRNFZCWICRA-AWEZNQCLSA-N 345.447 1.865 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)Nc1cccc(Cc2nn[nH]n2)c1 1570109299 QKWHZZOGRMTPFR-ALCCZGGFSA-N 337.339 1.854 10 10 EDCE CC1CCN(c2ccc(NC(=O)C[C@H]3C(=O)NN(C)C3=O)cc2)CC1 169996205 IJTQPSMTNPTLER-HNNXBMFYSA-N 344.415 1.371 10 10 EDCE Cc1ccc(C(=O)O)cc1NC(=O)CCN1C(=O)CSC1=S 1865769061 UQYIYXZZMITAOO-UHFFFAOYSA-N 338.410 1.882 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CNCc1ccc2c(c1)CCCO2 1962871207 WQSMUQRIFFZUPS-HNNXBMFYSA-N 336.432 1.987 10 10 EDCE CC(C)(C)OC(=O)NCCOCCNCc1ccc(O)c(O)c1O 1950154856 HXDNTLDIPYADMM-UHFFFAOYSA-N 342.392 1.434 10 10 EDCE CO[C@H]1C[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)C1 1985094585 QVPMXJACJWLEJY-QWRGUYRKSA-N 325.369 1.532 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2018048677 KWVWJQOLJOPCIK-RYUDHWBXSA-N 341.412 1.811 10 10 EDCE OC[C@H]1CN(c2ccc(CNC3CC3)cc2Br)C[C@H]1O 316251374 DTSKJBORWQHJER-IAQYHMDHSA-N 341.249 1.491 10 10 EDCE O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccc(O)c(O)c1 702600365 QSOWUOFYRZASAU-IBGZPJMESA-N 342.395 1.465 10 10 EDCE C[C@@H]1CN(C)C[C@H](CNCc2cc(Br)ccc2O)O1 697316941 NBTNSVBZQQTSKS-MFKMUULPSA-N 329.238 1.963 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCC[C@H](O)CC3)c(Br)cc21 393232694 XUXDGNOFTZYKHV-ISVAXAHUSA-N 340.221 1.752 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCCN3CCCC(C)(C)C3)c2n1 2065244856 DPCMHRZNCTULEY-UHFFFAOYSA-N 331.420 1.595 10 10 EDCE COC[C@@H]1C=CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2182334187 XCDSBHYDVINVQF-ISVAXAHUSA-N 339.189 1.826 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)CO1 1906905168 UOKCJIGZMYDDEB-CYDGBPFRSA-N 340.420 1.276 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)c(Br)c2)[C@H]2COC[C@H]12 2102140499 IQHBHXNSUXOSFW-FPMFFAJLSA-N 327.222 1.758 10 10 EDCE C[C@@]1(CCO)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2205512613 NEFJLKRUEPSUKX-OCCSQVGLSA-N 341.205 1.786 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)C[C@H]3C2)c(Br)c1 2236979104 MBYJIUARNAPVMJ-JLUCKKNBSA-N 341.249 1.476 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C1CN(C2CN(C(=O)OC(C)(C)C)C2)C1 2248528258 FQIIXTJSCZQTHP-UHFFFAOYSA-N 338.412 1.306 10 10 EDCE N[C@@H]1CCCC[C@H]1NC=C1C(=O)NC(=S)N(c2ccccc2)C1=O 2296116220 VMNVYGXDZFTPSS-ZIAGYGMSSA-N 344.440 1.178 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)NCCNC(=O)c1ccc(F)cc1 2307996722 OAAINWQFELKTDN-UHFFFAOYSA-N 344.342 1.796 10 10 EDCE CNCCN(C)C(=O)NCc1ccc(C)c(Br)c1O 2352931643 BHKQNYQGQGGZHL-UHFFFAOYSA-N 330.226 1.824 10 10 EDCE Cc1ccc(CN2C[C@@H](O)[C@@H](O)[C@@H]2CF)c(O)c1Br 2352949710 IKHMIOLVNCZKRZ-CWSCBRNRSA-N 334.185 1.339 10 10 EDCE O=C1Nc2cc(N3CC[C@H]4[C@@H](O)C[C@H]43)c(Br)cc2[C@H]1O 2355697856 ZTVNEUXDISRCRO-GDQJLZBOSA-N 339.189 1.394 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(CC(=O)NC(C)C)CC2)c1O 179600631 GKHJPHPHJFPKJR-UHFFFAOYSA-N 339.867 1.996 10 10 EDCE CCNC(=O)C1CN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 121620561 XIVIOTWRKSXBBK-UHFFFAOYSA-N 326.400 1.697 10 10 EDCE COC[C@@H](O)CN1CCC(N[C@H](C)c2ccc(F)cc2O)CC1 186194522 DROMRCHUDFEXTO-DOMZBBRYSA-N 326.412 1.654 10 10 EDCE Cn1nccc1/C=C/C(=O)NCc1ccc(N2CCOCC2)c(F)c1 194086656 WUBPBTAJZYHIEW-HWKANZROSA-N 344.390 1.725 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2cc(Cl)cc(OC)c2O)CCO1 529645114 POVVHUDTZIUXRL-LBPRGKRZSA-N 343.811 1.184 10 10 EDCE CO[C@H](C)c1noc(CN(C)C(=O)/C=C/c2ccc(O)c(O)c2)n1 272678468 RMCMIQICBQERPV-BREXMAIKSA-N 333.344 1.860 10 10 EDCE COc1cc(N2CCC[C@@H](c3nc(=O)[nH][nH]3)C2)c([N+](=O)[O-])cc1OC 285724817 SIWLIMWFEWHERY-SECBINFHSA-N 349.347 1.407 10 10 EDCE Cc1ccc(CNC(=O)[C@]2(CO)CCNC2)c(O)c1Br 2381126765 UTZDBQMQOZTBFR-CQSZACIVSA-N 343.221 1.051 10 10 EDCE CN(C)c1ccc([C@H](N)[C@H](O)c2cnn(C)c2Br)cc1 2163136893 XUAVDWQOSUHDRS-QWHCGFSZSA-N 339.237 1.982 10 10 EDCE COc1ccc(O)c(CNC[C@@H]2CCCCN2S(C)(=O)=O)c1 809710344 QLKYFRVRXIWKMM-ZDUSSCGKSA-N 328.434 1.305 10 10 EDCE COCC[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)C(N)=O 831727128 LYFJIMVKUGXQOV-KRWDZBQOSA-N 343.427 1.643 10 10 EDCE CS(=O)(=O)C1CCC(CNC(=O)NCc2ccccc2O)CC1 915517596 KSUMTSRDIYLXHY-UHFFFAOYSA-N 340.445 1.795 10 10 EDCE C[C@@H]1CCNC[C@@H]1NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 841975448 GEXHUYZWTFZIFX-QAPCUYQASA-N 346.475 1.663 10 10 EDCE C[C@@H]1C[C@@H](NC(=O)NCc2ccc(N(C)C)c(F)c2)c2ncnn21 852475968 JQJVCQLWZNHYTA-ZWNOBZJWSA-N 332.383 1.988 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCCC34OCCO4)C2)cc1 855224399 KISLXMYEEFVTSZ-YOEHRIQHSA-N 346.427 1.933 10 10 EDCE Cc1cc(C(=O)CN2C[C@H](O)C[C@H]2C(N)=O)c(C)n1-c1ccccc1 859515886 XKZWNSDVZDTBSE-WBVHZDCISA-N 341.411 1.197 10 10 EDCE COC[C@H](CCNC(=O)NCc1ccc2c(c1)CCCN2C)OC 852449736 XBVGSCRHGWGBKK-INIZCTEOSA-N 335.448 1.920 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN(C4CC4)CC3)C2)cc1 854302050 XHCLTQNNHPAFKC-OAHLLOKOSA-N 344.459 1.764 10 10 EDCE CCN(C(=O)NCc1ccc(N2CCOCC2)cc1)[C@H]1CCN(C)C1 853474486 JJEDALPGLLVLLU-SFHVURJKSA-N 346.475 1.759 10 10 EDCE COC(=O)C[C@@H](O)CNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 863012948 GIPMDOAVNLWVKE-QGZVFWFLSA-N 344.411 1.677 10 10 EDCE O=C([C@@H]1COCCN1CC(F)(F)F)N1Cc2cccc(O)c2C1 871204184 AISVLVXPQQWJRL-LBPRGKRZSA-N 330.306 1.498 10 10 EDCE CNC(=O)Cn1cc(NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cn1 775709157 PHUQYPSWMXPFAE-LBPRGKRZSA-N 344.419 1.578 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cccnc3C(N)=O)CC2)cc1 786633006 NWZZZQTXXORILW-UHFFFAOYSA-N 340.383 1.152 10 10 EDCE Cc1cc(Br)c(O)c(CN2CC[C@@H](NC(N)=O)C2)c1 781910263 NBTRTRWJZYTXSK-SNVBAGLBSA-N 328.210 1.706 10 10 EDCE O=C(N[C@H](CO)[C@@H]1CCCOC1)c1cc2cc(O)c(O)cc2s1 897975087 BADNPPPXRHVJTM-MWLCHTKSSA-N 337.397 1.830 10 10 EDCE C[C@@H](C(=O)NCc1cc(O)ccc1O)N1CSCCSC1 1153885029 JJBRQVMJRHUIFM-JTQLQIEISA-N 328.459 1.800 10 10 EDCE CCN(Cc1ccncc1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329393205 JLVWGBDUUFIXAI-UHFFFAOYSA-N 325.368 1.678 10 10 EDCE CC(C)=CCNCCN(CCO)C(=O)c1ccc(N=NC(N)=O)cc1 1326160366 UVVQADIETZCPME-UHFFFAOYSA-N 347.419 1.839 10 10 EDCE CC1(C)[C@@H](CNC(=O)C(=O)NCCc2ccc(N)cc2)C1(F)F 1329838556 RRGPNCOFTKDYEU-GFCCVEGCSA-N 325.359 1.335 10 10 EDCE CCS(=O)(=O)NCCNCc1cccc(Br)c1O 101595267 OKDGLBPVINJMFO-UHFFFAOYSA-N 337.239 1.184 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3c(O)ccc4ccccc34)C[C@@H]12 1330664521 IWEHSJKXVDAJEK-JQHSSLGASA-N 347.436 1.789 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H](C(C)(C)C)[C@H](O)C1 1261312798 DTYOQHNYSOODAU-GOEBONIOSA-N 348.443 1.606 10 10 EDCE CS(=O)(=O)C[C@H](C(=O)NCc1c(O)cccc1O)c1ccccc1 1456323461 SFIBRYVZXPMTRE-AWEZNQCLSA-N 349.408 1.542 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2cccnc2)cc(OC)n1 1295399513 BSQYJLQTOJKRCG-LLVKDONJSA-N 344.371 1.042 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2cn[nH]c2)cc1C 1481289083 CBAXQASKISWWRM-UHFFFAOYSA-N 330.432 1.908 10 10 EDCE CN1C(=O)COc2ccc(C(=O)NCCc3ccc(O)c(O)c3)cc21 1622753253 NYJUOEBANUDGLC-UHFFFAOYSA-N 342.351 1.426 10 10 EDCE COCC(=O)NC[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1718133696 MNKBFBGQSKJTEF-SNVBAGLBSA-N 335.364 1.072 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@H]2CCC(=O)N2C)cc1C 1714269936 ZWEMJBRACANBBL-UKRRQHHQSA-N 333.432 1.219 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1[C@@H](OCC)[C@@H]1C 1557114204 KSNJNRAHBMPASA-JLZZUVOBSA-N 335.400 1.955 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccc(N2C(=O)CCC2=O)cc1 1637123177 ZPVIUJGWQJVSPP-UHFFFAOYSA-N 340.335 1.681 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H]2COC(=O)[C@H]2C1 1636266777 IPMVXUOMRKRBPM-QRTARXTBSA-N 345.443 1.806 10 10 EDCE COCc1nnc2n1CCN(Cc1ccc(N3CCOCC3)cc1)C2 1643719279 ZANZBUNNUGICQO-UHFFFAOYSA-N 343.431 1.277 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccnc(F)c2)cc1C 1571425053 XEZBQJWPKRIQKT-HNNXBMFYSA-N 347.390 1.418 10 10 EDCE Cn1cc([N+](=O)[O-])c(NCc2ccc(N3CCC(O)CC3)cc2)n1 1655703962 YWZCYFDYBOTSLX-UHFFFAOYSA-N 331.376 1.902 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CO[C@@H]2CCOC2)cc1C 1663927553 DIQNPFHIDROJBL-MRXNPFEDSA-N 336.432 1.357 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CC(=O)NC3(C)C)CC2)cc1 1889845169 LWMMVGMHJLLRAW-OAHLLOKOSA-N 331.416 1.259 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C1(C)COC1 2143193369 IOICALSGNUWVLX-NSHDSACASA-N 327.178 1.660 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCO[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003172862 RAMVKXPDIPBGLV-BLTAXRJOSA-N 340.420 1.182 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCO[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985094832 UYTUTRCRSKAORI-KOLCDFICSA-N 325.369 1.437 10 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CN1C(=O)O[C@@H]2CN(c3ccc(CO)c(Br)c3)C[C@H]21 2120405493 ZFFHGXHWGHYGDB-VXGBXAGGSA-N 327.178 1.581 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)c(Br)c1 2330386769 QHNJPIXZZBHJMM-GJQVQUKXSA-N 328.206 1.262 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CN2CCC[C@H](CN3CCOCC3)C2)c1 69859048 ZIKABZBTTYMBDC-CQSZACIVSA-N 335.404 1.845 10 10 EDCE CCCS(=O)(=O)NC1CCN(Cc2ccc(OC)cc2O)CC1 180021384 CYFOWRZEGXBZOZ-UHFFFAOYSA-N 342.461 1.695 10 10 EDCE CN1CCN(c2cc(C(=O)NCCc3ccc(N)cc3)ccn2)CC1 237237044 IXAYRLRSVZOVBP-UHFFFAOYSA-N 339.443 1.388 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@@]3(CCCOC3)C2)cc1 285404081 UFMYEQPZNFASNL-IBGZPJMESA-N 347.459 1.250 10 10 EDCE CCNCc1ccc(N2CC(=O)N[C@@H](C)C2)cc1Br 386868049 DAPQBSRUBSUSJF-JTQLQIEISA-N 326.238 1.883 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCCC2(F)F)c1 807853617 NAMQCBQQMCUEGE-LLVKDONJSA-N 334.344 1.681 10 10 EDCE COCCC1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 828437216 LQEVECMAKATFGA-UHFFFAOYSA-N 333.432 1.172 10 10 EDCE Cc1ncccc1/C=C1/SC(=S)N(CCN2CCOCC2)C1=O 728982751 LYQXYRGMTKYJEI-SDNWHVSQSA-N 349.481 1.923 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCCNC(=O)c1ccccc1 588403591 PJVFIMJNHIUSRE-CLFYSBASSA-N 326.352 1.657 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H](C)[C@@H](C(=O)O)O3)CC2)cc1 911094264 NLEZMNGCWISHSH-RCBQFDQVSA-N 348.399 1.222 10 10 EDCE CN(C[C@@H]1CCS(=O)(=O)C1)C(=O)NCc1ccc(N(C)C)cc1 740902124 QNFJNPVFJQBRBA-AWEZNQCLSA-N 339.461 1.329 10 10 EDCE COC[C@@H](C)S(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849416668 UXBIRPZDYXHKGR-OLZOCXBDSA-N 328.434 1.228 10 10 EDCE CCO[C@@H]1CN(Cc2ccc([N+](=O)[O-])c(OC)c2O)C[C@H]1CN 844903477 CRNATSFOAYQSCK-DGCLKSJQSA-N 325.365 1.105 10 10 EDCE COc1cccc(CNC(=O)NC[C@@]2(OC)CCSC2)c1O 925365777 XJBLQMMMWVLTOW-HNNXBMFYSA-N 326.418 1.722 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCCN2CCSC[C@H]12 928088315 GGMYPXTVVGQTSG-IOKDEZFASA-N 334.441 1.807 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N1CCC2(COC2)C1 850654002 WDAZWJADFSTETC-UHFFFAOYSA-N 346.427 1.770 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCn3c(O)nnc3C2)c1 761510596 LCLWFXZKHDMKTI-UHFFFAOYSA-N 339.193 1.776 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1[C@@H]2CCCO[C@H]21 780388856 FBZRBDVPDFTUGZ-BMGDILEWSA-N 348.418 1.828 10 10 EDCE O=C1NC(=O)[C@@]2(CCCN(Cc3cc(Cl)cc(F)c3O)C2)N1 789767440 BWHCBLHXJLIRIA-AWEZNQCLSA-N 327.743 1.359 10 10 EDCE COc1ccc(CNC(=O)c2cccc(Cn3ccnn3)c2)c(O)c1 1139031662 DDDYICLGTFFDBB-UHFFFAOYSA-N 338.367 1.971 10 10 EDCE C[C@@H](NC(=O)[C@](C)(O)Cn1ccccc1=O)c1ccc(N(C)C)cc1 790940146 JEFXPSBJOXXWSQ-AUUYWEPGSA-N 343.427 1.543 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ncccc1O 792049819 ANUNSWDQDFYMRV-UHFFFAOYSA-N 342.399 1.623 10 10 EDCE C[C@@](NCCCN=[N+]=[N-])(C(N)=O)c1cncc(Br)c1 695176545 KGEDRYBUQWCFEH-NSHDSACASA-N 327.186 1.835 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cnc(O)c(Br)c1 1156881100 PBMQNLBCEPFYCD-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE CCS(=O)(=O)[C@H]1CCN(c2ccc(CN)c(Br)c2)C1 2123321235 QMGJWLPWYOXPBV-LBPRGKRZSA-N 347.278 1.921 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cnc(-c2ncccn2)s1 1178912397 SQDOUEYKBLSROT-UHFFFAOYSA-N 328.353 1.941 10 10 EDCE Cc1ncc(S(N)(=O)=O)cc1C(=O)N[C@@H](C)c1ccccc1O 1171729753 HJLAMZJUBYPHJB-JTQLQIEISA-N 335.385 1.234 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H]2C[C@H]2C2CC2)cc1C 1268329520 VIKOCQFTFHTQPA-YESZJQIVSA-N 332.444 1.616 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NC(=O)Nc1ccc(N)cc1 1906110515 YPHINZAYCPFBGK-QWHCGFSZSA-N 336.392 1.682 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2cnnn2C)C(C)C)cc1C 1271830691 XBSMHXXOXNWWRT-OAHLLOKOSA-N 345.447 1.676 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)[C@H]2COC(=O)N2)cc1C 1277177921 KRYJQBWDOFZPDZ-UKRRQHHQSA-N 349.431 1.487 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)c2cnnn2C)cc1C 1275394281 JXEHQWDBZJYHQY-OLZOCXBDSA-N 331.420 1.429 10 10 EDCE CN(c1ccc(C=CC(=O)O)cc1Br)[C@@H]1CCNC1=O 1916230989 GXVDQCYUMKFYGK-GFCCVEGCSA-N 339.189 1.872 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2nc(=O)o[nH]2)c1 1466304021 HAWXBQFNWITUQJ-UHFFFAOYSA-N 340.339 1.513 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CC(c2n[nH]c3c2COCC3)C1 1472386626 KYJXTEOZQXFZER-RQOWECAXSA-N 341.367 1.533 10 10 EDCE COc1ccc(-n2nnnc2CN2CC[C@H]2CNC(=O)C(C)C)cc1 1716644429 VUPVSNOYLIKCGZ-AWEZNQCLSA-N 344.419 1.017 10 10 EDCE Cn1ccnc1[C@@H]1C[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CCO1 1638948034 GTDRPSOENLRSOF-BRFWBLJHSA-N 343.383 1.881 10 10 EDCE CNC(=O)N[C@@H]1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 1632537377 KOYOHBARXRVOIO-SECBINFHSA-N 335.385 1.456 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2C[C@H]2C(N)=O)cc1C 1567230355 GFTZIOSCVDWYMR-CFVMTHIKSA-N 333.432 1.109 10 10 EDCE COc1cncc(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)n1 1567059140 HVBZOZLXIDFTMK-ZDUSSCGKSA-N 344.415 1.710 10 10 EDCE COC(=O)[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccc(O)cc1 1567354772 KCOAXPFZTWMQGB-MRXNPFEDSA-N 331.324 1.376 10 10 EDCE CNC(=O)NCC(=O)N1CC[C@@H](NCc2ccc(OC)c(C)c2)[C@@H]1C 1734393117 FUXDLBXETNIXFG-DZGCQCFKSA-N 348.447 1.012 10 10 EDCE C[C@H](NC(=O)c1cnc2c(c1)NC(=O)CN2C)c1ccccc1O 1587451111 IEUAOKVAQKXAHV-JTQLQIEISA-N 326.356 1.667 10 10 EDCE O=C(CCCNC(=O)c1ccsc1)NCc1cc(O)ccc1O 1651222953 UCPJGQURXTZURC-UHFFFAOYSA-N 334.397 1.986 10 10 EDCE COC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc(C)c(O)c1O 1583230829 MIENFWDMCWOGSI-CQSZACIVSA-N 329.352 1.920 10 10 EDCE COCCC(=O)NCC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1759229821 PQFKCTRYMGOHNE-UHFFFAOYSA-N 347.375 1.074 10 10 EDCE COCCN[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1C 1698899268 AYMMFQJZRNJZQF-DOMZBBRYSA-N 347.419 1.936 10 10 EDCE CC[C@@]1(O)CCN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2150760193 LCZQZHRGISRNSM-GXTWGEPZSA-N 341.205 1.786 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCCN=[N+]=[N-])[C@@H]1CCCO1 1985101991 AGDNARPEKSFCMY-WDEREUQCSA-N 327.385 1.875 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)COC1 2010402685 UPHLGRPZIAMVKR-LLVKDONJSA-N 339.396 1.781 10 10 EDCE COC(=O)[C@H](CC(=O)N(C)CCCN=[N+]=[N-])NC(=O)OC(C)(C)C 2010401337 DCLMGMULFCJVBK-JTQLQIEISA-N 343.384 1.602 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(CCO)CC2)cc1Br 300519961 VAEWAGLBMMBLBV-GFCCVEGCSA-N 342.281 1.844 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)c2n1 2064908316 WYXBKZLOWUAXRX-GLQYFDAESA-N 342.399 1.821 10 10 EDCE O=S1(=O)C[C@H]2C(NCc3cc(Br)ccc3O)[C@@H]2C1 2054278166 NHSHXWJGAXSQSC-NXEZZACHSA-N 332.219 1.287 10 10 EDCE CN(C[C@H]1CCS(=O)(=O)C1)c1ccc(CO)cc1Br 2092347456 YJJBWJVJRCOCTF-LLVKDONJSA-N 348.262 1.812 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213593570 SKEPTMALXFFJTF-WOPDTQHZSA-N 339.396 1.970 10 10 EDCE CSc1ncc(CN=c2nc(CO)c(Br)c[nH]2)s1 2256962034 ACMHFIZZVXSGBD-UHFFFAOYSA-N 347.263 1.944 10 10 EDCE CCN(C)C(=O)CNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2309977974 ZJEVVIVRGBZHTE-UHFFFAOYSA-N 331.416 1.131 10 10 EDCE C[C@H](N)c1ccc(N2CC3(COC(=O)N3)C2)cc1Br 2351870684 GQKAYDRATACHQJ-QMMMGPOBSA-N 326.194 1.767 10 10 EDCE COC(=O)NCC(=O)NC/C=C/CNCc1ccc(OC)c(C)c1 1268515609 DLCNAOCYXHCHTE-SNAWJCMRSA-N 335.404 1.122 10 10 EDCE CCN1CC[C@@H](CNC(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 108781546 ZHNZPHURDNWIOD-MOTZXUDYSA-N 343.471 1.994 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1CCC(=O)N1 1952208833 NQBHSHOAADZQJX-VXGBXAGGSA-N 336.388 1.812 10 10 EDCE CCc1nc2n(n1)CCC[C@@H]2NC(=O)NCc1cc(OC)ccc1O 88563506 ICXOQAXARRKGJO-ZDUSSCGKSA-N 345.403 1.889 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CC[C@@]4(CNC(=O)C4)C3)ccc21 279466054 LNWSFNNJKQRHON-LJQANCHMSA-N 342.443 1.491 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@H]3CCOC[C@@H]3C)nc12 277316380 DFHHHYQMIGGXLQ-GWCFXTLKSA-N 334.376 1.126 10 10 EDCE Cc1ccc(CN2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)c(O)c1Br 2381136434 GIMJKZWMNDJHLN-JDTTZNEISA-N 342.233 1.779 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CN(C)CCO2)c(O)c1Br 2380748525 FRJKEBVZNDTUPV-NSHDSACASA-N 343.221 1.410 10 10 EDCE Cc1ccc(CN2C[C@@H](O)C[C@@H](C(=O)O)C2)c(O)c1Br 2380812239 SVNBAQDREWYVGD-MNOVXSKESA-N 344.205 1.731 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](O)C3CCOCC3)C2)cc1 819584114 DIJIIKQSJNVXCO-KDOFPFPSSA-N 348.443 1.425 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@]1(c2ccccc2)C[C@H](O)C1 901121507 GLVWZLCUEMZAEH-GLRZTSSQSA-N 327.380 1.849 10 10 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COCC1(CNC(=O)CN(CC(=O)O)c2ccc(OC)cc2)CC1 853011718 ZGCXQZALUZTGJG-UHFFFAOYSA-N 336.388 1.129 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCOC[C@@H]3CCCO3)C2)cc1 855230388 CTUDGZWWPMNDBT-YJBOKZPZSA-N 348.443 1.976 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1C[C@@H]2CC[C@H]1N2 1340820507 GPYGYWKJPHJGKE-QXAKKESOSA-N 343.471 1.652 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2cc(C)cc(OC)c2O)C1 863340121 IDHRCDSKSJUPRU-ZDUSSCGKSA-N 342.461 1.470 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)CC2)cc1F 870903908 ZXTBMISACNDJHS-VBHSOAQHSA-N 333.407 1.610 10 10 EDCE C[C@H]1CCCN1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 770241282 MJAMITDHMRSSCU-AWEZNQCLSA-N 339.461 1.342 10 10 EDCE CCn1cc(S(=O)(=O)Nc2ccc(O)c(OC)c2)c([N+](=O)[O-])n1 797819304 FAOUBGCCUCEAGZ-UHFFFAOYSA-N 342.333 1.326 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCO[C@H]2CNC[C@H]21 715788285 JWFLRXVUCIMFLO-NEPJUHHUSA-N 331.185 1.466 10 10 EDCE NCc1ccc(N2CCOC[C@H]2CCO)c(F)c1Br 694919224 HSYRXNAWORNWTI-SNVBAGLBSA-N 333.201 1.635 10 10 EDCE COC[C@@H](C)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1317069449 MXBQBTZGKZUBFK-RISCZKNCSA-N 333.392 1.688 10 10 EDCE CN1CCN(c2ccc(CN3CCC(=O)N(C)CC3)cc2F)CC1 1327973678 NQZUGBJNRIYQTN-UHFFFAOYSA-N 334.439 1.242 10 10 EDCE O=C1NC[C@@]2(CCN(c3ccc(CO)c(Br)c3)C2)N1 2121183322 IGILKXWBAGYHHK-CYBMUJFWSA-N 326.194 1.203 10 10 EDCE O=Cc1cncc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 1334854725 JKKNOICLENJRGV-UHFFFAOYSA-N 343.358 1.800 10 10 EDCE Cc1nocc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1439327475 KPKDRTVNJFBFAK-UHFFFAOYSA-N 342.399 1.615 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CNC(=O)c1cccc(Br)c1 1912152634 WRESNCUCXDCBJD-UHFFFAOYSA-N 340.181 1.948 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)Cc2cnc[nH]2)C2CC2)cc1C 1276664919 JTEAFIVNAOFCOH-KRWDZBQOSA-N 342.443 1.954 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN(Cc3ccno3)CC2)cc1 1455129772 KBLBQPVVEVPUIM-UHFFFAOYSA-N 342.359 1.795 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@@H]1SC(=N)NC1=O 1467840845 RCVVICZMYRGOLG-JTQLQIEISA-N 328.390 1.051 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)CCC2CC2)cc(OC)n1 1704015980 PJHRGVNDQZBUQX-NSHDSACASA-N 335.404 1.524 10 10 EDCE O=C1C[C@@H](CNC(=O)N(Cc2ccco2)Cc2ccccc2O)CN1 1478821468 ZEBDXGWITDBNQY-CYBMUJFWSA-N 343.383 1.833 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CNC(=O)Cc1ccccc1 1623574693 XIBQVVCERAGFJE-UHFFFAOYSA-N 347.411 1.853 10 10 EDCE CN(C)CCCCN(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1633602296 GUNKBFDDXWMQPZ-UHFFFAOYSA-N 343.449 1.178 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)Cn2ccnc2)cc1C 1568210975 HUSHVFFMHUOBEK-AWEZNQCLSA-N 330.432 1.742 10 10 EDCE C[C@@H](NCC(=O)N(C)C)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1734006618 QMWHNXNSNKTKHR-GHMZBOCLSA-N 348.407 1.034 10 10 EDCE COC(=O)/C=C1/SC(CCN2C(=O)c3ccccc3C2=O)=NC1=O 209928965 UQXFSGXGMKETDD-DHZHZOJOSA-N 344.348 1.402 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)OC[C@@H]2C)cc1Br 234378945 YPXMNKRBKXONIR-GWCFXTLKSA-N 329.238 1.755 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnc([N+](=O)[O-])n3C)CC2)cc1 1889905401 IUKSQDFHYJFASQ-UHFFFAOYSA-N 345.359 1.299 10 10 EDCE COc1ccc(-n2nnnc2Cc2ccc(N)cc2)cc1[N+](=O)[O-] 1857927108 WRLVOOCXAXQMGV-UHFFFAOYSA-N 326.316 1.752 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1990033323 UWFUHWHPCTXYGR-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE OC1(CN(Cc2ccccc2)c2ccc3c(c2)OCCO3)CNC1 1999222513 HQGYPDXZUCXIJM-UHFFFAOYSA-N 326.396 1.799 10 10 EDCE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(Cc2cc(N)ccc2O)C1 1999475059 MPCRRHPUMMSVLX-CABZTGNLSA-N 331.338 1.863 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@](C)(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010388608 DXMZNWAUKOSDQT-NHYWBVRUSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@]1(C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010398868 WVAYHOOGPUIJKO-HFAKWTLXSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC[C@@H]1CN=[N+]=[N-])C1COC1 2010401389 DUXGQXGPAPWLIX-NEPJUHHUSA-N 339.396 1.827 10 10 EDCE O=C1C(=Cc2ccc(O)cc2)SC(=S)N1CN1CCOCC1 2053498115 IYJKAHPKBLWEKT-UHFFFAOYSA-N 336.438 1.883 10 10 EDCE CCNCc1ccc(N2CC[C@H](NC(N)=O)C2)cc1Br 690813151 KVAWEPVJXCLXPQ-NSHDSACASA-N 341.253 1.806 10 10 EDCE CNCc1ccc(N2CCN(C[C@H](C)O)CC2)c(Br)c1 2170219013 RGNJRBKJIKFOIV-LBPRGKRZSA-N 342.281 1.671 10 10 EDCE C[C@H](O)CN(C[C@@H](C)O)c1cc(Br)c(CN)cc1F 2103485410 VCJPEGHTWWKJGC-DTORHVGOSA-N 335.217 1.615 10 10 EDCE CN=c1nc(C(=O)NCc2cnc(SC)s2)c(Cl)c[nH]1 2284724491 PQSNCIXJPMMNQK-UHFFFAOYSA-N 329.838 1.702 10 10 EDCE CNC1CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CC1 2301709119 ZABSPVFEHHLOOZ-UHFFFAOYSA-N 329.444 1.747 10 10 EDCE CCOCCOCC(=O)NC1CCN(c2ccc(OC)cc2)CC1 102382254 OVQSYWYJAULZDA-UHFFFAOYSA-N 336.432 1.833 10 10 EDCE Cc1c(C(=O)NCc2ccc(N(C)C)cc2)cccc1S(N)(=O)=O 125244113 MCENFGZRKLAMRG-UHFFFAOYSA-N 347.440 1.638 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(NC(=O)C3CC3)C2)c([N+](=O)[O-])c1 189160307 KPNMFDWSRJYGBP-XVNBXDOJSA-N 345.355 1.496 10 10 EDCE CCOc1cnc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cn1 186058669 IATVYHSVEJIPSY-UHFFFAOYSA-N 342.399 1.846 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CC[C@H](C(=O)O)C3)CC2)cc1 326041700 ZFXVHQKLFITSFG-KGLIPLIRSA-N 332.400 1.845 10 10 EDCE COc1ccc(N2CCN(C(=O)Cn3nc(C)cc3C)CC2)cc1F 84814609 XAGDJTUGRVHKHF-UHFFFAOYSA-N 346.406 1.996 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1cccnc1NC(=O)OC(C)(C)C 808540895 JLDIFXUAFFLMQJ-UHFFFAOYSA-N 336.344 1.672 10 10 EDCE CCCNC(=O)CNC(=O)NCc1cc(Br)ccc1O 804871002 NYGSDBLKZMQQQA-UHFFFAOYSA-N 344.209 1.480 10 10 EDCE CNCc1ccc(N2CCN(C(N)=O)CC2)cc1Br 722174215 KLYMQHOUMITEEN-UHFFFAOYSA-N 327.226 1.369 10 10 EDCE C[C@H](N)c1ccc(N2CCN(CC(N)=O)CC2)cc1Br 723183233 SGEOCIFSUHPFGC-JTQLQIEISA-N 341.253 1.076 10 10 EDCE O=C(O)/C=C\c1ccc(N2CCO[C@@H](C(=O)C3CC3)C2)c([N+](=O)[O-])c1 844212792 BEADYTSNLUIJGC-ANPLFTBSSA-N 346.339 1.877 10 10 EDCE Cc1cc(C(=O)COC(=O)CC(N)=O)c(C)n1-c1ccc(F)cn1 840495994 KLRMROWSFRAHSG-UHFFFAOYSA-N 333.319 1.230 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCO[C@H]([C@H](C)O)C2)c([N+](=O)[O-])c1 840384882 BPBMTEMSYFPDBE-KMBMKTKISA-N 336.344 1.367 10 10 EDCE COc1cc(Br)cc([C@@H](C)NCc2nnn(C)n2)c1O 848549341 NSUQNFXOPJSUEM-SSDOTTSWSA-N 342.197 1.538 10 10 EDCE O=C(O)CN(Cc1ccccc1O)C(=O)CN1CCc2ccccc21 911485176 HBATZZDHDYSHTG-UHFFFAOYSA-N 340.379 1.868 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N(C)C)c(F)c1)c1nnc(O)n1C 915371387 AZYRYJGLXPVARA-VIFPVBQESA-N 336.371 1.286 10 10 EDCE COC(=O)[C@H]1CSCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 840567565 VOBFAIHCGUJLMR-KTLBGCOUSA-N 337.397 1.476 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3nc(C)no3)C2)cc1 852185040 UJFLSSBIWIJUIA-GFCCVEGCSA-N 331.376 1.465 10 10 EDCE O=S1(=O)CCN(c2ccc(CN[C@@H]3CCCSC3)cc2)CC1 850355889 MMLXUDZQIJZEKL-OAHLLOKOSA-N 340.514 1.907 10 10 EDCE COc1cc(Br)cc(CNC[C@@H]2COCCN2C)c1O 858275849 GCKKGVLTVOYNKE-GFCCVEGCSA-N 345.237 1.584 10 10 EDCE CCC1(Cn2cc(C(=O)NCc3c(O)cccc3F)nn2)COC1 928705960 MYSKQUUOVIAIHZ-UHFFFAOYSA-N 334.351 1.479 10 10 EDCE COCc1nc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)co1 855225044 IDQYGGVUNUJUOL-GFCCVEGCSA-N 331.372 1.838 10 10 EDCE CC(C)[C@H](N)CCNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 851687033 YDSHQUBZJFPUQN-XJKSGUPXSA-N 334.464 1.419 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCN2CCOC[C@@H]2C1 758495949 SEFHAZSAVQVPRG-KRWDZBQOSA-N 332.448 1.287 10 10 EDCE COCc1n[nH]c(CNCc2ccc(N3CCOCC3)c(F)c2)n1 850361362 YRDVKMIIZCXBTB-UHFFFAOYSA-N 335.383 1.217 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)C[C@@H]3CCOC3)C2)cc1 852456473 YIFANTQLZLZWQZ-LSDHHAIUSA-N 333.432 1.952 10 10 EDCE O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(N2CCC(O)CC2)cc1 856209520 RCUJHZGDZZJZKQ-DVBCCOPCSA-N 330.428 1.999 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)OCCF)CC2)cc1 858980474 COGDHKUCRZCVAA-UHFFFAOYSA-N 325.384 1.513 10 10 EDCE CNCCOCCN(C)C(=O)NCc1ccc(N(C)C)c(F)c1 861571212 XTFFYLLGWUSGRP-UHFFFAOYSA-N 326.416 1.269 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C)c1ccnn1C 867423596 JINIWXIHXIYJPU-ZDUSSCGKSA-N 344.415 1.742 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccnc4ccnn34)C2)cc1 862159354 RMUKFEWLZZVFPT-CYBMUJFWSA-N 337.383 1.747 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3ncc[nH]3)C2)cc1 868762625 RCGBYMDFYLFZKR-ZDUSSCGKSA-N 329.404 1.839 10 10 EDCE Cn1ccnc(N2CCN(Cc3cccc(Cl)c3O)CC2)c1=O 775712320 OWEOAALNOCGTEJ-UHFFFAOYSA-N 334.807 1.462 10 10 EDCE COc1ccc(CNC(=O)NC2CCN(C(=O)C(C)C)CC2)c(O)c1 792797194 UXBQHDYRNTUGFG-UHFFFAOYSA-N 349.431 1.847 10 10 EDCE CN(CCN1CCNCC1)Cc1c(O)cccc1Br 706830495 YTTRLRQJHHBSOB-UHFFFAOYSA-N 328.254 1.492 10 10 EDCE Oc1cccc(Br)c1CN[C@@]12CC[C@@H](C1)[C@H](O)[C@@H]2O 2120393811 HELKHUPRAWSIAM-GZBPVQSJSA-N 328.206 1.519 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)COc2cc(C)on2)cc1C 1266950621 PAFVONPEIHBOIF-ZDUSSCGKSA-N 347.415 1.973 10 10 EDCE C[C@H](NC(=O)[C@@H](NC(=O)C1CCCC1)[C@@H](C)O)c1ccccc1O 1454817311 JVHGYUFJHDHRKR-OZVIIMIRSA-N 334.416 1.625 10 10 EDCE Cc1nnc(N2CCNC(=O)CC2)n1Cc1ccc(N(C)C)c(F)c1 1612608700 KSPWMNZGFOVJOY-UHFFFAOYSA-N 346.410 1.166 10 10 EDCE COC(=O)c1cnc(CNC(=O)/C=C\c2ccc(O)c(O)c2)s1 1471902425 PEPWETFSQQNVOM-HYXAFXHYSA-N 334.353 1.671 10 10 EDCE O=C(NCc1nnnn1-c1ccccc1)c1c(F)ccc(O)c1O 1472598623 DMJNBCPCKHNBIR-UHFFFAOYSA-N 329.291 1.143 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@H](C)C(C)(F)F)cc1C 1717777893 OVVXEWSDJJUZBY-JSGCOSHPSA-N 344.402 1.862 10 10 EDCE COc1ccc(-n2nnnc2CN(C)C[C@@H](C)NC(=O)C(C)C)cc1 1498230282 ZWPYSUUJPWQTEL-CYBMUJFWSA-N 346.435 1.263 10 10 EDCE CC[C@H](C)C(=O)NC[C@@H](CC)NC(=O)c1cc(OC)nc(OC)c1 1746113433 JQHTVBIPBGJABV-WCQYABFASA-N 337.420 1.770 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN(c3cccnn3)CC2)cc1 1584229974 WTEUYODLPLDTKB-UHFFFAOYSA-N 339.359 1.601 10 10 EDCE O=C1Nc2cc(N3C[C@H](O)C(F)(F)C3)c(Br)cc2[C@@H]1O 2152094310 LWRWFHMPDZZOAO-UWVGGRQHSA-N 349.131 1.251 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010389043 KPDOXLBZDDJRET-QWRGUYRKSA-N 343.384 1.759 10 10 EDCE Cn1nc(CNC(=O)OC(C)(C)C)cc1C(=O)N1CC(N=[N+]=[N-])C1 2010388531 CRCWVAYQTDIPTK-UHFFFAOYSA-N 335.368 1.580 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010406742 YJJGWYFDYMQPAR-QJPTWQEYSA-N 339.396 1.685 10 10 EDCE CCOC(=O)[C@@H](CCC(=O)C=S(C)(C)=O)NC(=O)OC(C)(C)C 2037850414 PINWUJKIARKCEK-GFCCVEGCSA-N 349.449 1.138 10 10 EDCE Cn1[nH]c(=NC(=O)CCOc2ccc(N)cc2)cc1Br 2155765682 LETRHELIDOUYBW-UHFFFAOYSA-N 339.193 1.594 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4COC[C@H]4C3)c(Br)cc21 718257219 MFPKHUTYMNGLLA-RBDZCENOSA-N 338.205 1.484 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H](CO)c1nc[nH]n1 2062768137 LCXHAQYOWSZTBD-LLVKDONJSA-N 331.401 1.737 10 10 EDCE CCCN(C)C[C@@H]1CCN(C(=O)c2cnn3c(O)cc(C)nc23)C1 2063772801 XQQBNBIPOHMHLI-ZDUSSCGKSA-N 331.420 1.547 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)cc1Br 2182552161 AQYLSLHUOHQBAB-UZGCMYEVSA-N 342.233 1.680 10 10 EDCE CNCCN(C)S(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 2104034315 VTQBTZPEBYMHLP-UHFFFAOYSA-N 328.221 1.507 10 10 EDCE NCc1ccc(N2C[C@@H]3CCS(=O)(=O)[C@H]3C2)cc1Br 2088820378 WRILRQPCXKZREF-GWCFXTLKSA-N 345.262 1.531 10 10 EDCE COc1ccc(N2C[C@H](O)C[C@@]2(C)CO)c(OC)c1Br 2234881152 OOVBMCKOUKOVLY-OTYXRUKQSA-N 346.221 1.788 10 10 EDCE COc1ccc(O)c(CNC(=O)C=Cc2ccc(C(N)=O)cc2)c1 2301551367 TUEWRQBLAGDLQZ-UHFFFAOYSA-N 326.352 1.829 10 10 EDCE Cc1ccc(CN2CCN(C)C[C@@H]2CO)c(O)c1Br 2352678483 HEBIMEVDBZPGIQ-GFCCVEGCSA-N 329.238 1.571 10 10 EDCE Cc1cc(Br)cc(CN2CCN3CCOC[C@H]3C2)c1O 371887313 FKOUCMACVFDPFY-CQSZACIVSA-N 341.249 1.980 10 10 EDCE COC(=O)c1ncsc1S(=O)(=O)Nc1ccc(O)cc1C 134714946 HKGJBJDZWXEUQM-UHFFFAOYSA-N 328.371 1.745 10 10 EDCE COc1ccc(Br)c([C@H]2N[C@@H](C(=O)O)CS2)c1O 83236614 GUDWTIROFAQFIK-LDWIPMOCSA-N 334.191 1.952 10 10 EDCE COc1ccc(N2CCN(C(=O)CCNC[C@H]3CCCO3)CC2)cc1 243998199 SGSQYTSIBZFSND-GOSISDBHSA-N 347.459 1.503 10 10 EDCE CNC(=O)CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 369974057 NLZAPCLEFFYDAY-UHFFFAOYSA-N 341.358 1.509 10 10 EDCE O=C1N[C@H](CF)C(=O)N1Cc1ccc(N2CCC(O)CC2)c(F)c1 287626160 IKDWMJJVZUOLQZ-CYBMUJFWSA-N 339.342 1.177 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCCSCC2)cc1F 285653447 HCKBWZHJZRJMLK-UHFFFAOYSA-N 339.436 1.473 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCC[C@@]3(C2)NC(=O)NC3=O)cc1 835051496 GTTCJYAZSRRBMF-AJNOYIKESA-N 328.416 1.440 10 10 EDCE CS(=O)(=O)NC[C@H]1CCC[C@H]1NC(=O)Nc1ccc(N)cc1 841298347 APKRGJRRCQBPLT-ZWNOBZJWSA-N 326.422 1.108 10 10 EDCE O=C1N[C@]2(C(=O)NCc3c(O)ccc4c3CCCC4)C[C@H]3C[C@H]1[C@H]2C3 845833487 GSUDBFDLOHQNSY-UPMGUGHMSA-N 340.423 1.802 10 10 EDCE Cc1cc(CNC[C@H](O)CN2CCOCC2)c(C)n1-c1ccccc1 743759911 WMEPBGXOXDWEIQ-FQEVSTJZSA-N 343.471 1.877 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CN[C@H]3CCNC34CCC4)cc2)C1 925484974 JNZQWVNRXZEGPW-WMZOPIPTSA-N 342.487 1.763 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3nnc(C)s3)CC2)cc1 854198232 FTJCWWLCMFQQSN-UHFFFAOYSA-N 332.429 1.746 10 10 EDCE C[C@@H](NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1[C@H]2CN[C@H]1C2 925504536 PUINMSQUFPJGEU-AICUMBRKSA-N 333.451 1.873 10 10 EDCE CC1CCN(S(=O)(=O)NNc2nc3cccnc3s2)CC1 857225881 WAPBQKUSYVEMIY-UHFFFAOYSA-N 327.435 1.585 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)NCCC2SCCS2)cc1 851687526 FAHJCRARXWUYND-UHFFFAOYSA-N 339.486 1.240 10 10 EDCE CCO[C@@H]1[C@H](C)[C@H]1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 923443115 QUJOZSORZBLGSM-FSPWUOQZSA-N 348.443 1.925 10 10 EDCE Cc1cc(CC(=O)N[C@@H]2CC(=O)N(C)C2=O)c(C)n1-c1ccccc1 854381795 RBMPSNCEPXLPAQ-MRXNPFEDSA-N 339.395 1.510 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2C[C@H](O)C[C@H]2CO)c1 860948358 CSPRCGYCGGERPZ-ZWKOTPCHSA-N 342.395 1.474 10 10 EDCE CN1CCN(c2ccc(CNC(=O)c3nnc(C4CC4)o3)cc2)CC1 883146167 CSXIKYHUNCAHJI-UHFFFAOYSA-N 341.415 1.629 10 10 EDCE CC[C@H](NC(=O)Cc1ccc(O)c(O)c1)C(=O)NCc1cccs1 1143220698 NNWNPXSGZDVOTA-ZDUSSCGKSA-N 348.424 1.913 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCCNC(=O)c1cccc(O)c1 1150543275 JQYAOCBREOTMTB-UHFFFAOYSA-N 344.367 1.282 10 10 EDCE CSc1nc(O)cc(CNC(=O)/C=C/c2ccc(O)c(O)c2)n1 1163576442 CORFCRSGXMBLDP-HWKANZROSA-N 333.369 1.645 10 10 EDCE CN(C[C@@H]1CCCC[C@@H]1O)C(=O)C(=O)N1Cc2cccc(O)c2C1 1332019526 QTKZOPSIVKAHKT-ZFWWWQNUSA-N 332.400 1.244 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)C[C@@H]2COC(=O)C2)cc1C 1277793808 VUKVBMYLHNTIQX-HOCLYGCPSA-N 348.443 1.893 10 10 EDCE COc1cccc(CNC(=O)c2cccc3nc(CO)[nH]c23)c1O 1465993768 WKZYCRXTYKFFLA-UHFFFAOYSA-N 327.340 1.699 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CCCn2ncnc21 1618593935 SFDHCZKPHFRYKF-ZDUSSCGKSA-N 327.388 1.647 10 10 EDCE CCN1CCN([C@@H](C)CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1627184630 AUVAQUNQLOFMDJ-ZDUSSCGKSA-N 346.435 1.605 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@@H]2COC(=O)N2)C2CC2)cc1C 1713109402 UYJWDPGHVMBDEO-CABCVRRESA-N 347.415 1.096 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCc1cc(C)[nH]n1 1627014301 VCQLAHHCBLZPCP-UHFFFAOYSA-N 345.399 1.948 10 10 EDCE CCn1ccc(C(=O)NC[C@H](O)CNCc2ccc(OC)c(C)c2)n1 1715605791 QCQNXARZBKTJTR-OAHLLOKOSA-N 346.431 1.101 10 10 EDCE CN1C(=O)[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)Cc2ccccc21 1557449120 QHSMFYBQISYURH-LEJCZOIISA-N 338.363 1.815 10 10 EDCE COC(=O)[C@](C)(Cn1cccn1)NC(=O)/C=C/c1ccc(O)c(O)c1 1637024451 AMEBCHWQZQGUNS-UABRLCRWSA-N 345.355 1.056 10 10 EDCE Cc1ccc(C(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)c(O)c1O 1637397187 MWFYQJJKZNFRCL-GFCCVEGCSA-N 345.355 1.880 10 10 EDCE CS(=O)(=O)C[C@H](NC(=O)c1cc(O)cs1)c1ccccc1 1566181919 RWBWULMXNFCHAN-LBPRGKRZSA-N 325.411 1.969 10 10 EDCE CN(CC(C)(C)CN1CCOCC1)C(=O)Cc1ccc(O)c(O)c1 1632464165 NJPLLEHHRSPXCE-UHFFFAOYSA-N 336.432 1.457 10 10 EDCE CCC(=O)N[C@H](C)C(=O)N(C)C[C@H](C)NCc1ccc(OC)c(C)c1 1734326446 GKOVKQQWBUXEIB-LSDHHAIUSA-N 349.475 1.855 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C(F)F 1738134544 TUNCMAKNSIAFHK-SECBINFHSA-N 341.318 1.739 10 10 EDCE Cc1ccc(O)c(CNC(=O)Cc2ccc(S(N)(=O)=O)s2)c1 1584983879 UKNXHNLVAPLART-UHFFFAOYSA-N 340.426 1.268 10 10 EDCE CO[C@@H](C)C(=O)NC[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1678095790 IDVUMJUAIOACKH-MNOVXSKESA-N 349.391 1.461 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)c2ncn(C)n2)C2CC2)cc1C 1699582112 BRGXYQFWMXYAII-HNNXBMFYSA-N 343.431 1.430 10 10 EDCE CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NCc1ccc(N)cc1 1120588727 CVOFDSUMSMRKLH-INIZCTEOSA-N 347.463 1.011 10 10 EDCE CC1(C)[C@@H](O)C[C@]1(CO)NCc1c(O)cccc1Br 1879558123 GUUWDALJZQEYLS-GXTWGEPZSA-N 330.222 1.766 10 10 EDCE COc1ccc(Br)c(CNCCC(=O)NC2CC2)c1O 1968865378 LEZQIVMKCGYXQY-UHFFFAOYSA-N 343.221 1.922 10 10 EDCE CO[C@]1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CCN(C(=O)OC(C)(C)C)C1 2010391627 AGNUSWGUOOHUHF-IAQYHMDHSA-N 339.396 1.924 10 10 EDCE CCN(CC)C[C@@H]1CCN(C(=O)c2cnn3c(O)cc(C)nc23)C1 2064213720 TZSXOMCYSZMQSU-ZDUSSCGKSA-N 331.420 1.547 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@]3(CNC(=O)N3)C2)cc1Br 2177668788 PBDXCWMVYPPYGD-LKFCYVNXSA-N 340.221 1.764 10 10 EDCE C[C@H]1C[C@H]2CN(c3ccc(CN)cc3Br)CCN2C1=O 2181270494 WBPVJWZFDUEWRL-JQWIXIFHSA-N 338.249 1.965 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3CC(O)(CO)C3)ccc(N)c2C1 2051897176 LUANFHWJBVCWQR-UHFFFAOYSA-N 349.431 1.105 10 10 EDCE CN1CCc2cc([C@H](CN)N3CC(NC(=O)C(F)(F)F)C3)ccc21 2074456450 OFZNUDNTIIUAFH-AWEZNQCLSA-N 342.365 1.041 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](N(C)C)[C@H](O)C2)cc1Br 2089926830 NJKURMXCQGZJMC-QCZZGDTMSA-N 329.238 1.614 10 10 EDCE CCOc1ccc(NC(=O)CNC(=O)Cc2ccc(N)cc2)cc1 178458761 SHNLRENKEITDPZ-UHFFFAOYSA-N 327.384 1.965 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)C(=O)O 1951545746 PMIWVDPCCKQQAU-VIFPVBQESA-N 325.317 1.187 10 10 EDCE CCN(Cc1cc(Br)ccc1O)C(=O)C(C)(CO)CO 134497419 OQPIAVKDVKOBQP-UHFFFAOYSA-N 346.221 1.494 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1CCNC1=O 1952209583 VYZMGTJZIGHKSY-RYUDHWBXSA-N 336.388 1.670 10 10 EDCE COc1ccc(N2CCN(C(=O)C(C)(C)C(=O)NC3CC3)CC2)cc1 244054441 TVAXYIIKDOVDFZ-UHFFFAOYSA-N 345.443 1.649 10 10 EDCE Cc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)S3(=O)=O)c(O)c1O 530049350 FQYHVEKAWIYUSP-MNOVXSKESA-N 325.386 1.198 10 10 EDCE NC(=O)[C@H]1CCN(c2ccc(/C=C\C(=O)O)c(Br)c2)C1 379840966 XTXPMHXJVZSEJV-GQPNGRKGSA-N 339.189 1.859 10 10 EDCE CCN1CCN(Cc2ccc(C)c(Br)c2O)C(=O)C1=O 2381136692 IEYMOIXFEGWYIA-UHFFFAOYSA-N 341.205 1.654 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(C)CNC(=O)C2)c(O)c1Br 2381139486 XPMBVAKRGASJAE-CQSZACIVSA-N 341.205 1.606 10 10 EDCE COc1cc(O)c(CN[C@H](CO)C[C@@H](O)C(C)(C)C)cc1OC 284284019 ATHTUWDNLDYQLJ-BLLLJJGKSA-N 327.421 1.657 10 10 EDCE C[C@@H](NC(=O)C(=O)N(C)Cc1cc[nH]n1)c1ccc(N(C)C)cc1 807672107 WOZZSXDQHNZFQD-GFCCVEGCSA-N 329.404 1.312 10 10 EDCE COc1cc(NC(=O)C(=O)NCc2ccccc2O)c(C)c(OC)c1 800601656 ACSABGJXLHZVQR-UHFFFAOYSA-N 344.367 1.973 10 10 EDCE CC(C)[C@](C)(CO)NC(=O)NCc1ccc(N2CCOCC2)cc1 812012148 PJJMTZKULIVROX-SFHVURJKSA-N 335.448 1.729 10 10 EDCE CNC(=O)N1CCN(c2ccc(CN)c(Br)c2F)CC1 721787247 LDVWHNLBYDKQGV-UHFFFAOYSA-N 345.216 1.508 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CCNC(=O)CO 905460157 KCCSXSVTHPNDGT-UHFFFAOYSA-N 333.432 1.134 10 10 EDCE C[C@@]1([C@@H]2CCCN(Cc3cc4c(cc3O)OCO4)C2)COC(=O)N1 905708037 MPJWLMNYXUDCSE-PXAZEXFGSA-N 334.372 1.831 10 10 EDCE C[C@@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@@H]1CCCO1 918906556 PGRKCYJKDCAPCF-QAPCUYQASA-N 331.460 1.870 10 10 EDCE Cc1cc(CCNC(=O)[C@H](C)NC(N)=O)c(C)n1-c1ccccc1 746425808 JTTGWFYTZKMTDE-ZDUSSCGKSA-N 328.416 1.810 10 10 EDCE CC[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C(=O)O 927942395 IAZRECMRZNQDLP-NEPJUHHUSA-N 335.404 1.157 10 10 EDCE O=C(NCCCSc1nccs1)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 921447558 MNMJXIAOLSZNGD-WOPDTQHZSA-N 343.474 1.728 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3nccn3C)C2)cc1 854298320 AHEAMFUMGJGELC-AWEZNQCLSA-N 343.431 1.849 10 10 EDCE COc1cccc(CNC(c2ccnn2C)c2ccnn2C)c1O 858322371 XFOCCLJLJLIHGO-UHFFFAOYSA-N 327.388 1.747 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1[C@@H]2CCCO[C@@H]21 856212012 FEUOUFADSZHKMC-KSZLIROESA-N 330.428 1.689 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCc3cncn3C)C2)cc1 855225424 IUNKFEQSOYBAMV-CQSZACIVSA-N 328.416 1.756 10 10 EDCE N[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)C(F)(F)F 852869082 UFGPWSANSMUZRD-CYBMUJFWSA-N 331.338 1.154 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@](C)(O)CO 861485334 KAGNWXLEGJGQHE-GOSISDBHSA-N 330.384 1.380 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2c(O)ccc3ccncc23)CCO1 863287439 SIJUEUMBRZOMNQ-CYBMUJFWSA-N 330.388 1.070 10 10 EDCE CN1CCN(c2ccc(CNC(=O)[C@@]34CCCN(CC3)C4)cc2)CC1 899210680 CNSKSOTXOASGBW-FQEVSTJZSA-N 342.487 1.541 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN(C(=O)C2CC2)C1 898000199 NCXKWZPTHAYHQD-UHFFFAOYSA-N 332.381 1.964 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NC[C@H](C)S(N)(=O)=O)cc1 799885291 DGGNHFDFZLMBAI-LBPRGKRZSA-N 342.465 1.009 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc(CO)nc3)CC2)cc1F 1137423133 VXGACXQRBCBCOA-UHFFFAOYSA-N 345.374 1.684 10 10 EDCE Cn1cc(C(=O)N(Cc2ccco2)Cc2ccccc2O)n(C)c1=O 1137343488 RJDUDKKRCLZQQJ-UHFFFAOYSA-N 341.367 1.865 10 10 EDCE CC(C)(C)[C@H](O)C[C@@H](CO)NCc1ccc(N2CCOCC2)cc1 790618874 IUHDJOTUCLIQKG-FUHWJXTLSA-N 336.476 1.771 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N(CC)CCO)c(Br)cc21 92775323 BPWJJWNXCXYKOZ-ZDUSSCGKSA-N 342.237 1.870 10 10 EDCE O=C(NCc1c(O)cccc1F)c1ccc(-n2[nH]c(O)nc2=O)cc1 1303877401 CSQWZTDJSUJCDZ-UHFFFAOYSA-N 344.302 1.041 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N2CCC[C@@H](N=[N+]=[N-])C2)n1 2121909959 JOKRQDGVNHDCAR-SSDOTTSWSA-N 349.214 1.646 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@H](C)C2CC2)cc1C 1332487264 GBJVUDYYWJCRSX-PBHICJAKSA-N 334.460 1.959 10 10 EDCE C[C@H]1CSCCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 1332580998 DPHKEWDJQUGFTO-ZDUSSCGKSA-N 335.473 1.723 10 10 EDCE CC1(C)C[C@@H](O)[C@H](O)CN1c1ccc(CO)cc1Br 2132174006 MULJJOHTWPZBCQ-CHWSQXEVSA-N 330.222 1.652 10 10 EDCE 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COc1ccc(CNC[C@@H](O)CNC(=O)C2CC(F)(F)C2)cc1C 1732639034 XECNXGPWJHOBOZ-CQSZACIVSA-N 342.386 1.616 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)Nc1cccc(Cc2nn[nH]n2)c1 1570109300 QKWHZZOGRMTPFR-FNORWQNLSA-N 337.339 1.854 10 10 EDCE CCN(CCNC(=O)C(F)F)C(=O)c1ccc(N=NC(N)=O)cc1 1581031156 FYONGFYMPMXNBZ-UHFFFAOYSA-N 341.318 1.692 10 10 EDCE CO[C@@H](C)CN(C)CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1667669022 KHCCCCWTGAQMPW-LBPRGKRZSA-N 335.408 1.888 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCc1nc(N)n[nH]1 1683464744 LLHIXVFQFNROFG-UHFFFAOYSA-N 331.424 1.573 10 10 EDCE Cc1nnc(CNCCN(C)C(=O)c2ccc(N=NC(N)=O)cc2)o1 1691631018 NKXARCCNUXIHBO-UHFFFAOYSA-N 345.363 1.402 10 10 EDCE CC[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N[C@@H](C)C(=O)NC 1698623381 PRLFQYRBXHYLPL-JQWIXIFHSA-N 348.407 1.082 10 10 EDCE CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(\C)NN1CCOCC1 17071977 MSFOMOINXPQPRV-RVDMUPIBSA-N 345.359 1.428 10 10 EDCE CC1CCN(c2ccc(CNC(=O)Cn3cn[nH]c3=O)cc2)CC1 153124068 VGKFHJXONPSFLU-UHFFFAOYSA-N 329.404 1.124 10 10 EDCE 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CC(C)C[C@@H](CO)N(C)C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807679020 LZKOUIYCVRZNSS-PBHICJAKSA-N 349.475 1.795 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CC[C@@H](C(=O)O)O3)C2)cc1 819000933 CHPZAUCNQFJYIV-KCXAZCMYSA-N 348.399 1.270 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(CC(N)=O)CC2)cc1Br 723183234 SGEOCIFSUHPFGC-SNVBAGLBSA-N 341.253 1.076 10 10 EDCE C[C@@H](NC[C@]1(CO)COCCN1C)c1ccc2ccccc2c1O 903278376 FNVBMNQPBMRUCM-KUHUBIRLSA-N 330.428 1.889 10 10 EDCE Cc1ccn([C@H](C)CC(=O)N(CC(=O)O)Cc2ccccc2O)n1 911488674 MDVVJVUPGUBTEH-CYBMUJFWSA-N 331.372 1.962 10 10 EDCE Cc1cc(O)c(CN2CCN(C(C)(C)C(N)=O)CC2)c(Cl)c1 840917007 MWXHIKKZQXKTJR-UHFFFAOYSA-N 325.840 1.736 10 10 EDCE C[C@H](NC(=O)N[C@H]1CNCC[C@@H]1C)c1ccc(N2CCOCC2)cc1 841739758 BZVMJLQEWZPKTL-MPGHIAIKSA-N 346.475 1.881 10 10 EDCE Cn1[nH]c([C@H]2CCCN2C(=O)/C=C\c2ccc(O)c(O)c2)nc1=N 846067885 LKHDNCIMDFXHGK-JPVGGKMYSA-N 329.360 1.016 10 10 EDCE C[C@@H]1CCn2ncc(C(=O)NC[C@@H](N)c3ccc(N(C)C)cc3)c2C1 843296572 BEXHVAQWCUOOJM-CXAGYDPISA-N 341.459 1.961 10 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EDCE C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(O)c(O)c2)SC1=S 2293031149 UBUWBGLWQWRFHG-LURJTMIESA-N 325.367 1.772 10 10 EDCE CCCCCCN1C(=O)NC(=O)C(=CNCCCn2ccnc2)C1=O 2296931386 IRQOYHBHDTVKMN-UHFFFAOYSA-N 347.419 1.405 10 10 EDCE O=C(O)C[C@H](C(=O)O)N1C(=O)/C(=C\c2ccccc2)SC1=S 1908128 ZTDKNVSCNHFUTP-ZFZMKPAXSA-N 337.378 1.816 10 10 EDCE CCOc1ccccc1[C@@H]1CC(=O)NC(NC(=O)c2cccnc2)=N1 20924907 HRFMXZSHLJYSCJ-AWEZNQCLSA-N 338.367 1.827 10 10 EDCE O=C1Nc2cc(N3CC[C@@]4(O)C[C@H]4C3)c(Br)cc2[C@H]1O 2359026251 WNVXMKWXKKRIOM-AAAAQAOESA-N 339.189 1.396 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CC[C@@H](N2CCOCC2)C1 121005520 VFDTVRIDTIQBHA-LJQANCHMSA-N 331.460 1.430 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCCO2)N2CCOCC2)cc1 36100160 XQCZFMNQUWPEFR-MSOLQXFVSA-N 347.459 1.421 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H](O)C(C)C)cc2)CC1 190234193 WDENHRXVIYTBMP-GOSISDBHSA-N 347.459 1.378 10 10 EDCE COc1cccc(CNC[C@H]2CCC[C@]23NC(=O)N(C)C3=O)c1O 371083962 FJMAWXZVPNGIMT-PXAZEXFGSA-N 333.388 1.211 10 10 EDCE Cc1ccc(CN2CCO[C@H]3[C@@H]2[C@H]3C(=O)O)c(O)c1Br 2380809852 CXYGGCFEOVPORZ-SUZMYJTESA-N 342.189 1.747 10 10 EDCE Cc1ccc(CN2CCCN(CCO)CC2)c(O)c1Br 2381132832 GSRTXLLKNCUSCK-UHFFFAOYSA-N 343.265 1.963 10 10 EDCE COc1cc(N2CCN(C[C@@H](O)C(C)C)CC2)cc(OC)c1OC 293036859 WUUWSPMQONDUKI-OAHLLOKOSA-N 338.448 1.851 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@H]1CCCS(=O)(=O)C1 292660982 CYOOTOHZXLXVGX-OAHLLOKOSA-N 338.473 1.926 10 10 EDCE CC(=O)C(=O)COC(=O)c1csc(CNC(=O)OC(C)(C)C)n1 808516329 CDSQATOJDCTVPO-UHFFFAOYSA-N 342.373 1.483 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@H]2CCc3nnc(C4CC4)n3C2)c1 815835318 PHKIZFADAFAMBU-LBPRGKRZSA-N 342.399 1.749 10 10 EDCE CN(C)C1CCN(CCNC(=O)/C=C\c2ccc(O)c(O)c2)CC1 588406908 OIWHGIWSXQEJKA-XQRVVYSFSA-N 333.432 1.253 10 10 EDCE Cc1cc(C(=O)CN2CN(C)C(=O)[C@H]2C)c(C)n1-c1ccc(F)cn1 830796368 AYQOQQMUHZNZNC-CYBMUJFWSA-N 344.390 1.931 10 10 EDCE NC(=O)CN1C(=O)/C(=C/c2nccc3c2CCCC3)SC1=S 905002105 LNUHOPSJIUWYMZ-GHXNOFRVSA-N 333.438 1.647 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CC[C@H](N2CC[C@@H](O)C2)C1 908200556 JEDFMPDZURSVOB-NWDGAFQWSA-N 348.424 1.594 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cccc(O)c3O)CC2)nc1 837158383 RFGGQNIUUKCNDZ-UHFFFAOYSA-N 329.356 1.464 10 10 EDCE COc1cccc([C@@H](C)NC2CCN(CCC(=O)N(C)C)CC2)c1O 846143315 DTRHHOOYNXGUCK-CQSZACIVSA-N 349.475 1.994 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)NCC2(COC)CC2)cc1 848931233 IIHFBLQBJJOETM-UHFFFAOYSA-N 347.459 1.692 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NC1CCNCC1 841914228 AEZSCZJCIUNYCY-UHFFFAOYSA-N 328.210 1.706 10 10 EDCE COc1ccc(N2CCN(C(=O)C3(n4cccn4)CC3)CC2)cc1 929250762 VHIUERUZQISTIJ-UHFFFAOYSA-N 326.400 1.730 10 10 EDCE CCOC(=O)[C@H]1[C@H]2CN(C(=O)/C=C\c3ccc(O)c(O)c3)CC[C@H]21 928118728 JCNDOTKLERDTKH-LQROEWSXSA-N 331.368 1.769 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3C)C2)c1 750657066 LVXCCSOUDZANPR-OHTBPHCPSA-N 347.415 1.770 10 10 EDCE COC(=O)CN(CCO[C@H]1CCOC1)Cc1cc(Cl)ccc1O 929974798 AYLNPDMLWNDXEW-AWEZNQCLSA-N 343.807 1.826 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCC1(C2(O)CCOCC2)CC1 928672203 MQCQTQQIZLOZTI-RQOWECAXSA-N 333.384 1.549 10 10 EDCE Oc1ccccc1CN(C[C@@H]1CC2(CNC2)CO1)C[C@H]1CCCO1 923298832 KWVVWUPTTQMYGD-SJORKVTESA-N 332.444 1.752 10 10 EDCE CN(C)c1ccc(/C=C/CNCCCN2CCC[C@H]2C(N)=O)cc1 858228109 YTCRHWDOGILLLS-PXPSOEEZSA-N 330.476 1.695 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3=CCCOC3)C2)cc1 852338936 GPGCRPRKDSJDBV-OAHLLOKOSA-N 331.416 1.920 10 10 EDCE COC(=O)[C@]12C[C@H]1CCCN2CC(=O)NCc1ccc(N(C)C)cc1 933160687 WIKOQHVFTUBMDR-BEFAXECRSA-N 345.443 1.396 10 10 EDCE O=C1N[C@@]2(CCSC2)C(=O)N1Cc1ccc(N2CC=CC2)cc1 761362355 PDFRBZSVIOMTCB-QGZVFWFLSA-N 329.425 1.990 10 10 EDCE CN(C(=O)c1cc2cc(O)c(O)cc2s1)[C@H]1CCN2CCO[C@H]1C2 897870331 ODKLKWMSXXDRNT-FZMZJTMJSA-N 348.424 1.858 10 10 EDCE O=C1C[C@@]2(CCN(C(=O)NCCCSc3nccs3)C2)CN1 789090789 MNYZIAKVJHHYDA-AWEZNQCLSA-N 340.474 1.547 10 10 EDCE COc1cc(NS(=O)(=O)c2ccc(C)c(C(N)=O)c2)ccc1O 797820289 PDYSWCIXOKLCJU-UHFFFAOYSA-N 336.369 1.609 10 10 EDCE C[C@H](C(=O)NCc1cc(O)ccc1O)n1nnc(-c2ccccc2)n1 1153885901 RSGDGSCZNJUBGD-LLVKDONJSA-N 339.355 1.629 10 10 EDCE CCCN1C(=O)/C(=C/c2ccc(OC)c(OC)c2)C(=O)N(C)C1=O 1081105039 KKNLCFZSOTVRDD-FMIVXFBMSA-N 332.356 1.918 10 10 EDCE C[C@H](O)[C@H]1CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2125823336 OTTGYFZAIOQKCQ-ISROVCFRSA-N 326.194 1.361 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H]2CC[C@H](C1)O2 1331948043 ZORBZKGPLKYHDB-GASCZTMLSA-N 332.400 1.521 10 10 EDCE CCOC[C@@H]1CCCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1335623431 SYBWZEKKOKDPFJ-AWEZNQCLSA-N 332.400 1.652 10 10 EDCE Cc1nnc(CN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)s1 1348662615 PQORTXNLEOXDAC-UHFFFAOYSA-N 332.385 1.053 10 10 EDCE Cc1cc(C(=O)N2C[C@@H](CCO)[C@@H](CO)C2)c(C)n1-c1ccccn1 1350989288 BYLRBHYFOMVAFH-HZPDHXFCSA-N 343.427 1.552 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1C[C@H]2CCC[C@H]21 1351287414 JYGNOENEPBMTAV-KBRIMQKVSA-N 329.444 1.982 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCn2cccn2)cc1C 1274678619 LUIFAJLUBGGCFZ-OAHLLOKOSA-N 330.432 1.885 10 10 EDCE COCCC(=O)NCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1299106382 HLOJVMZZJGQCSS-UHFFFAOYSA-N 347.375 1.264 10 10 EDCE CCC(=O)NC[C@H]1C[C@H](NCc2nnnn2-c2ccc(OC)cc2)C1 1479346285 BECBFVPQLAQIFY-JOCQHMNTSA-N 344.419 1.065 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H]2CCC(=O)N2)cc1C 1715370940 DUWNNLDHVNLNJI-HIFRSBDPSA-N 333.432 1.219 10 10 EDCE CCC(=O)NCC(=O)N[C@H]1C[C@H](NCc2ccc(OC)c(C)c2)C1 1480130868 FOHKYIBAXICYAQ-SHTZXODSSA-N 333.432 1.267 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)C(=O)NCc1c(O)cccc1O 1639292460 DBYJZPIGIQZORP-ZDUSSCGKSA-N 340.376 1.254 10 10 EDCE C[C@@H](NC(=O)CNC(=O)Cc1ccc(O)cc1)c1ccccc1O 1635794103 WGKUDBMKELLHSV-GFCCVEGCSA-N 328.368 1.634 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)/C=C(\C)C2CC2)cc1C 1734361377 LBCLOZMATJYRIO-JZUUQJBKSA-N 332.444 1.927 10 10 EDCE COc1ccc(-n2nnnc2CNCCN(C)C(=O)C2CCC2)cc1 1731886665 NJLJKZITOBENCE-UHFFFAOYSA-N 344.419 1.019 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2ccncn2)cc1C 1666635982 RLNFPFQPXVIPNR-ZDUSSCGKSA-N 328.416 1.949 10 10 EDCE C[C@@H](NCC1CCN(CCO)CC1)c1ccc(N2CCOCC2)cc1 151784737 RTJXJQLEXOMWJC-QGZVFWFLSA-N 347.503 1.878 10 10 EDCE CC[C@](C)(N)C(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1866113330 PHYRKBBXKGYVTQ-YJBOKZPZSA-N 329.448 1.819 10 10 EDCE O=C(Nc1ccc(S(=O)(=O)O)cc1)c1cc(O)c(O)c(O)c1 1865876023 NFNNXDQXRNNYQG-UHFFFAOYSA-N 325.298 1.302 10 10 EDCE C[C@H](NC[C@@H](CO)NC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985852804 HBXCMEOQRKHBEC-QWRGUYRKSA-N 326.393 1.634 10 10 EDCE Nc1ccc(N2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1Br 379102633 PHLPXCSTTIBHMQ-WYUUTHIRSA-N 337.173 1.698 10 10 EDCE CNCc1ccc(N2C[C@H](OC)C[C@H]2CO)cc1Br 381695861 FLNVCGNWRXQUIW-QWHCGFSZSA-N 329.238 1.755 10 10 EDCE COC1(C)CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 382936107 PLBUACDRPSMLCP-LLVKDONJSA-N 326.194 1.626 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC34C[C@H]5C[C@@H](CC(O)(C5)C3)C4)c2n1 2062767506 RVLFZWGZADWWOU-SKLAPFLYSA-N 342.399 1.557 10 10 EDCE Cc1nc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nn1C 2065002339 BUUOZGDVHAJHCR-AWEZNQCLSA-N 330.388 1.651 10 10 EDCE COC(=O)c1cnn(Cc2ccc(Br)cc2O)c1O 2070456071 POSWARIGUMIBML-UHFFFAOYSA-N 327.134 1.892 10 10 EDCE C[C@H](NCCc1nnc(Br)n1C)c1cc(O)ccc1O 2185197917 LWPLRZMJZXWCRT-QMMMGPOBSA-N 341.209 1.882 10 10 EDCE Cc1ccc(N(C)C(=O)C2=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C2)cn1 2080944483 YNFMUKWJJCMZEO-LSDHHAIUSA-N 347.415 1.937 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])CC(O)C1 2213587632 JSVWLSSTQBRDNY-YJVGMPMCSA-N 339.396 1.752 10 10 EDCE COc1ccc(Br)c(CN2CC(OCC(=O)O)C2)c1O 2236040364 FJEYBZIIGJVMTF-UHFFFAOYSA-N 346.177 1.449 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CN(C)C[C@@H]2OC)c1O 2236049222 NRZAESHJKVURRV-YPMHNXCESA-N 345.237 1.582 10 10 EDCE COCCN(C[C@H](C)O)c1ccc(CN)c(Br)c1F 2272409459 SSIAYQVWZPJIJH-VIFPVBQESA-N 335.217 1.881 10 10 EDCE CNC(=O)c1ccc(C=CC(=O)NCCc2ccc(O)c(O)c2)cc1 2301396303 CALIHKZPMAVMMW-UHFFFAOYSA-N 340.379 1.830 10 10 EDCE Cc1ccc(CNC[C@@H](C)c2nn[nH]n2)c(O)c1Br 2352680486 QHXLWVYACAZQFW-MRVPVSSYSA-N 326.198 1.870 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(Br)c1 2355335600 DFDFXLNKVFYRGG-ZAJSEHCFSA-N 341.249 1.789 10 10 EDCE CCCN(CCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 118589997 AQJBFSCPFPPIGP-LBPRGKRZSA-N 328.210 1.610 10 10 EDCE COC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc(N(C)C)cc2)C1 171063441 DZUHZYDZCZWLBD-OAHLLOKOSA-N 333.432 1.254 10 10 EDCE C[C@@H](NC[C@H]1CN(C)CCO1)c1ccc(N2CCOCC2)c(F)c1 180500182 OIBRNDOXIJZJKV-ZBFHGGJFSA-N 337.439 1.644 10 10 EDCE COc1cccc(CN2CCN([C@H](C)c3nc(C)no3)CC2)c1O 121312847 ABFLWQYVKIYMHT-GFCCVEGCSA-N 332.404 1.971 10 10 EDCE C[C@@H](NCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1O 185065244 FFCYMJCCTSQERU-CQSZACIVSA-N 345.422 1.794 10 10 EDCE COc1ccc(N2CCN(C(=O)c3sc(=O)[nH]c3C)CC2)cc1 74751390 QPUSSNOANVVYSS-UHFFFAOYSA-N 333.413 1.716 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@H]3CCCOC3)CC2)cc1F 84890288 DSWWOXOENWUVMO-ZDUSSCGKSA-N 337.395 1.845 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2c(O)cc(C)cc2Cl)CCO1 529645679 ULQZMGOGFZUVER-NSHDSACASA-N 327.812 1.484 10 10 EDCE Cc1ccc(CN2CCO[C@H](C(=N)NO)C2)c(O)c1Br 2380678423 DYUCORJESAYICG-JTQLQIEISA-N 344.209 1.620 10 10 EDCE Cc1ccc(Cn2cc(C3(F)CNC3)nn2)c(O)c1Br 2380812158 SGBJNKYGORHUPP-UHFFFAOYSA-N 341.184 1.871 10 10 EDCE COc1ccc(CNC(=O)c2cnc(OCC3CC3)cn2)c(O)c1 803292869 YRBZDAWPCRBMBR-UHFFFAOYSA-N 329.356 1.910 10 10 EDCE CCn1ncc(C(=O)NCc2cccc(Br)c2O)n1 295220203 BQXOZSKBGLRIHS-UHFFFAOYSA-N 325.166 1.696 10 10 EDCE O=C(C1CC1)[C@H]1CN(Cc2ccc(N3CCOCC3)cc2)CCO1 811502254 OAEGPPWXEMVHPK-GOSISDBHSA-N 330.428 1.703 10 10 EDCE COCCNC(=O)c1ccc(NCc2cc(OC)ccc2O)nc1 811805975 GONWUNORUUUMGF-UHFFFAOYSA-N 331.372 1.784 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC(Oc2cnccn2)CC1 830663246 CIMRLPIVTQMADC-UHFFFAOYSA-N 333.319 1.711 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@@H]1CCCN1C(=O)C(F)(F)F 928707777 HXJGPRRPJLYEAG-JTQLQIEISA-N 334.269 1.701 10 10 EDCE C[C@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCO1 923337447 PLMALSIAVDQUIW-HNNXBMFYSA-N 347.459 1.968 10 10 EDCE COC(=O)NC(C)(C)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855229597 KJHTUZHZKVCEGU-LBPRGKRZSA-N 335.404 1.525 10 10 EDCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c1 751316790 BETQYKJZBQXUQH-GRYCIOLGSA-N 344.433 1.405 10 10 EDCE COc1cc(C)cc(CN2CCCC[C@H]2CNS(C)(=O)=O)c1O 754725721 AHJUNEQGJMTEIZ-AWEZNQCLSA-N 342.461 1.613 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](CO)C3CCC3)C2)cc1 852386941 NPEWBELQAGOOKV-KDOFPFPSSA-N 347.459 1.982 10 10 EDCE COC(=O)[C@]1(C)C[C@@H](OC)CN1Cc1ccc(N2CCOCC2)cc1 931382994 PIRTWEKJGVVQDI-MJGOQNOKSA-N 348.443 1.676 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CC[C@H](O)C(F)(F)C1 853748345 BZVCLIQMZGDEDO-AWEZNQCLSA-N 327.375 1.973 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H]3CCCNC3)C2)cc1 851660871 BCDLPVSFRLLDJE-HUUCEWRRSA-N 332.448 1.573 10 10 EDCE COC(=O)[C@]1(OC)CCN(Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 862475459 LKQLXBYUMRHGAS-HNNXBMFYSA-N 340.332 1.073 10 10 EDCE COc1ccc(CNC(=O)c2ccn(C3CCOCC3)n2)c(O)c1 861490646 YHTYHYQGRSWUIC-UHFFFAOYSA-N 331.372 1.879 10 10 EDCE C[C@H](NC(=O)NCC1CCS(=O)(=O)CC1)c1ccccc1O 868443120 ALYHNSSALDZPKD-NSHDSACASA-N 326.418 1.577 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1C[C@@H](CO)[C@H](C(F)(F)F)C1 870789189 VAJSZKLPZORFTK-OVXAFGJRSA-N 331.290 1.740 10 10 EDCE Cc1cc(C(=O)N[C@@H](C)c2nnc(O)n2C)c(C)n1-c1ccccn1 880605423 ZVKVYROXLMBICO-NSHDSACASA-N 340.387 1.814 10 10 EDCE C[C@@H](OCc1ccccc1)[C@H](NC(=O)c1ccc(O)c(O)c1)C(=O)O 706057511 PMZZHQIMUNOWMR-BZNIZROVSA-N 345.351 1.886 10 10 EDCE OCCN[C@@H]1CCCN(Cc2cc(Br)cc(F)c2O)C1 715789826 QXNQAAOVNYJSGS-GFCCVEGCSA-N 347.228 1.840 10 10 EDCE Nc1ccc(OCCC(=O)NCc2n[nH]cc2Br)cc1 718127692 AXIFQCGSRSALQX-UHFFFAOYSA-N 339.193 1.840 10 10 EDCE COCCN1C[C@@H](C(=O)NCc2c(O)ccc3ccccc23)CC1=O 1179029142 KKWLTDKSCBNLDY-AWEZNQCLSA-N 342.395 1.657 10 10 EDCE Cc1nnc(Cn2nnc(C(=O)N3Cc4cccc(O)c4C3)c2C)o1 1175039471 YUWZLDYOEIBXSQ-UHFFFAOYSA-N 340.343 1.188 10 10 EDCE Cn1cc([C@@]2(CNC(=O)Cc3ccc(O)c(O)c3)CCCO2)cn1 1636839613 HFZRZZOYGHSBKX-KRWDZBQOSA-N 331.372 1.196 10 10 EDCE C[C@H](O)c1ccc(N2CC(CNC(N)=O)C2)c(Br)c1 2130741700 FFDSZZQPYGOEJY-QMMMGPOBSA-N 328.210 1.607 10 10 EDCE CC(=O)C(=O)[C@@]1(O)C[C@H]2CC[C@H]1C[C@@]2(C)NC(=O)OC(C)(C)C 1905174217 CSQVACWLDWHMGC-CZAMWMTLSA-N 325.405 1.979 10 10 EDCE CCCNC(=O)[C@@H](C)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1346292111 YGMRMKLVLCVWHR-KGLIPLIRSA-N 348.447 1.488 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](CO)NCC2CCC2)cc1 1507266413 BPWGGMHXZGWHBT-AWEZNQCLSA-N 333.392 1.329 10 10 EDCE Cc1nc(CNC(=O)/C=C\c2ccc(O)c(O)c2)sc1C(N)=O 1452468201 ZEPWWWHVHKDZMT-HYXAFXHYSA-N 333.369 1.291 10 10 EDCE CN(C)c1ccc([C@@H](CN)N2CCN(c3ncccn3)CC2)cc1 32087401 GKDLMRWFXIFTOM-QGZVFWFLSA-N 326.448 1.365 10 10 EDCE O=C(CCc1nc(-c2ccoc2)no1)NCc1cc(O)ccc1O 1633594960 BWMGFVAFUFWNQE-UHFFFAOYSA-N 329.312 1.990 10 10 EDCE Nc1nnc([C@@H]2CCCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)o1 1641506941 KLHSUUMOGRUSCX-DUMNWFOQSA-N 330.344 1.482 10 10 EDCE NC(=O)c1nc2cc(NC(=O)/C=C\c3ccc(O)c(O)c3)ccc2o1 1642405681 BZIYFMNLRVRRDU-KXFIGUGUSA-N 339.307 1.990 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)CCC(C)C)cc(OC)n1 1737548714 KVPCTEGINFKLTD-LBPRGKRZSA-N 337.420 1.770 10 10 EDCE CC(=O)N1CCc2cc(C(=O)NCc3cc(O)ccc3O)ccc21 1644752702 QGJUDUGRPZJDST-UHFFFAOYSA-N 326.352 1.937 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(Cc2ccc(O)cc2)CC1 1587338526 ZXSWVAJJEUBBDD-UHFFFAOYSA-N 342.395 1.690 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@H]2CC=CCC2)cc(OC)n1 1744620267 XIWMPCKNJJQIGA-STQMWFEESA-N 347.415 1.690 10 10 EDCE COc1ccc(CNCC[C@@H]2CCCN(C(=O)C(N)=O)C2)cc1C 1698680120 VPJQLZGUFZWZAZ-AWEZNQCLSA-N 333.432 1.207 10 10 EDCE O=C(c1cc(O)c(O)c(O)c1)N1CCN(C(=O)C2CCCCC2)CC1 169822418 CJWLLYBZNCWYAI-UHFFFAOYSA-N 348.399 1.668 10 10 EDCE CCNC(=O)N1CC[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)C1 151933731 FVMRJSBWVGMGFH-CQSZACIVSA-N 333.436 1.356 10 10 EDCE CNC(=O)c1ccc(/C=C/C(=O)NCc2ccc(O)c(O)c2)cc1 159014962 FMMXGXQYIWCESK-WEVVVXLNSA-N 326.352 1.787 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2C[C@H](CO)CO2)c1O 1966088618 REROSKCTSOBJPF-ZJUUUORDSA-N 346.221 1.650 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)NCC1(CN=[N+]=[N-])CC1 1990022962 OGEXKLNXCKWTKR-SNVBAGLBSA-N 327.385 1.469 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 2010388605 DXFIFAHTGRTKBY-NSHDSACASA-N 339.396 1.924 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010406676 XONIKSJIUWWPSP-ZYHUDNBSSA-N 341.412 1.809 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@@H](CO)CNC(=O)OC(C)(C)C 2022916626 KDUAUENFEGJOQQ-CYBMUJFWSA-N 337.420 1.360 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3C[C@H](O)C[C@H]3C2)c(Br)c1 405535594 ZPVVOVKNQDMIKG-KGYLQXTDSA-N 340.265 1.724 10 10 EDCE [N-]=[N+]=NCCCNC(=O)CNC(=O)c1ccc(Br)o1 701323634 WAIVGJPQFXZIIP-UHFFFAOYSA-N 330.142 1.589 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)cc1Br 2178086648 MQSUGAIOWARCAZ-ACGQPVHCSA-N 341.249 1.912 10 10 EDCE C[C@@H]1[C@@H](CO)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 385832635 UICCHGUZWAQDGE-OTPXZMOZSA-N 340.221 1.608 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@@H]2O 2174415108 XSTITNZOLDXURF-LNNJMGJISA-N 342.233 1.622 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCO[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1908252778 FWFFGNTWTSNREQ-SRVKXCTJSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1COC[C@H]1NC(=O)Cc1ccc(N)cc1 2044235990 WFLVOYRRBFOUHO-DZGCQCFKSA-N 349.431 1.467 10 10 EDCE O=C(O)C[C@]1(O)CCN(Cc2c(O)cccc2Br)C1 2104561137 VLIJRWSUNAYIIX-CYBMUJFWSA-N 330.178 1.566 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](O)[C@H](O)CC2)cc1Br 2269122749 XQBVURCKCOKYLS-CUOATXAZSA-N 330.222 1.824 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])n1 2225792693 PGXFVKPGALBINY-YUMQZZPRSA-N 349.214 1.692 10 10 EDCE CC(C)(C)OC(=O)N1CC(N2CC(C(=O)NCCCN=[N+]=[N-])C2)C1 2248555543 LTWGBBYKRLPARV-UHFFFAOYSA-N 338.412 1.354 10 10 EDCE COCCCNC(C)=C1C(=O)N(c2ccccc2)N=C1CC(=O)OC 2294474449 XFSPMQBEOHVPPJ-UHFFFAOYSA-N 345.399 1.852 10 10 EDCE Cc1ccc(CN2CC(S(C)(=O)=O)C2)c(O)c1Br 2327797504 XNJLLKSSVVIRTM-UHFFFAOYSA-N 334.235 1.692 10 10 EDCE COC(=O)NC1CN(c2cc(Br)c(CN)cc2F)C1 2351820857 FOJCJMGYFMILLV-UHFFFAOYSA-N 332.173 1.592 10 10 EDCE Cc1ccc(Cn2nccc2NC=C2C(=O)NC(=S)NC2=O)cc1 52536877 OGIKNQBARBBPIM-UHFFFAOYSA-N 341.396 1.067 10 10 EDCE CC1=NN(c2ccc3nncn3n2)C(=O)/C1=C\Nc1ccccc1F 36356947 GOUNGSBPLPJPNR-FLIBITNWSA-N 337.318 1.982 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1C[C@H]2CC[C@H]1O2 191714508 UOBHIFFIGWRLKC-FGTMMUONSA-N 345.443 1.985 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCO[C@H]([C@@H]2CCCO2)C1 91927103 WSZKGECLNPNHJQ-OALUTQOASA-N 332.444 1.903 10 10 EDCE CCOC(=O)[C@@H](C)CNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255659918 JVKLQLQNOUAXBO-AJHXJQRKSA-N 346.427 1.852 10 10 EDCE Nc1nccc([C@@H]2CCCN(Cc3cc4c(cc3O)OCO4)C2)n1 368045810 WTHLRDULMHTTAF-LLVKDONJSA-N 328.372 1.873 10 10 EDCE CCOC1(C(=O)NCc2ccc(C)c(Br)c2O)CNC1 2381128952 BSPDQFASKLGWTK-UHFFFAOYSA-N 343.221 1.458 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@H](c3nc[nH]n3)C2)c([N+](=O)[O-])c1 819948470 FUYWEQNEHYYDRZ-FHMRSRPSSA-N 343.343 1.893 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1n[nH]c(C)c1C 819695847 AXSVAWBLPUIXHW-UHFFFAOYSA-N 331.372 1.938 10 10 EDCE C[C@H]1Oc2ccc(N)cc2N(OCCOc2ccc(N)cc2)C1=O 821298060 AIVWPVNHCDMXIS-LLVKDONJSA-N 329.356 1.976 10 10 EDCE CCO[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)cc2)C[C@H]1CN 844903510 DWZXYVDSYBFKMJ-IEBWSBKVSA-N 332.492 1.234 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(C=O)n(C)c1 929537850 VMPYIDCKSIDGLY-UHFFFAOYSA-N 341.411 1.946 10 10 EDCE O=C(N[C@H](C1CCOCC1)C1(CO)CCC1)c1cccc(O)c1O 855121986 VXYDORAVTRZDOC-MRXNPFEDSA-N 335.400 1.785 10 10 EDCE COc1ccc(CNC(=O)NCc2nc3c(s2)COCC3)c(O)c1 927692865 RYDFBTDDBLCGLI-UHFFFAOYSA-N 349.412 1.929 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H]3OCCO[C@@H]3C)CC2)cc1 930308905 BYMDPLWKKHVNLE-RHSMWYFYSA-N 334.416 1.538 10 10 EDCE CCN1CCN(c2ccc(CNc3nccnc3CN)cc2F)CC1 1515457441 BFGKQMJXWVVTQX-UHFFFAOYSA-N 344.438 1.828 10 10 EDCE CCN1C[C@@H](S(=O)(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1=O 867126352 XOAMNIDZCKLNQA-WFASDCNBSA-N 339.461 1.354 10 10 EDCE CN1CCN(c2ccc(CNCC[C@H]3CC(=O)N(C)C3)cc2F)CC1 1119678950 UZNIKOMLKDMTIO-INIZCTEOSA-N 348.466 1.536 10 10 EDCE COC(=O)C(C)(C)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 779191267 PKNKUGJLTAKISW-UHFFFAOYSA-N 336.388 1.190 10 10 EDCE O=C(NC[C@@]1(O)CCSC1)c1cc2cc(O)c(O)cc2s1 896828829 USSZJFOPGPDLJI-AWEZNQCLSA-N 325.411 1.910 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@]34CCCN(CC3)C4)CC2)cc1 895444763 PFCMMMYMSHWGJV-IBGZPJMESA-N 329.444 1.830 10 10 EDCE CN(C[C@H](O)C1CC1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 690293211 NKNGOPQKASNARE-QWHCGFSZSA-N 340.221 1.608 10 10 EDCE CC[C@@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)C[C@]2(CCOC2)O1 794700797 HTBVHFCEBMOPKZ-QBIMZIAESA-N 335.400 1.588 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CC[C@@H](NCCCO)C2)cc1 1316672521 YUYDCXGUJIFWSB-SWLSCSKDSA-N 347.419 1.720 10 10 EDCE CN(CC1(Br)CC1)c1cc2c(cc1N)OCC(=O)N2 1887880136 SMDHJVNJBQIMHS-UHFFFAOYSA-N 326.194 1.963 10 10 EDCE C[C@H](NC(=O)C(=O)NC[C@@H]1C[C@H]1C)c1ccc(N2CCOCC2)cc1 1321666404 WANYYPVNSKGGOT-YCPHGPKFSA-N 345.443 1.473 10 10 EDCE NCc1cc(F)c(N2C[C@H]3NC(=O)O[C@@H]3C2)cc1Br 2120414228 ZOGPUTWRBWEXIK-MWLCHTKSSA-N 330.157 1.344 10 10 EDCE CCOCC(=O)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1358671485 QGRSWTILDOWRSP-UHFFFAOYSA-N 347.375 1.264 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2ccccn2)cc1C 1507462293 OBHWICSUFXHGTE-INIZCTEOSA-N 343.427 1.621 10 10 EDCE OCCN(c1ccc(CNC2CC2)cc1Br)C1COC1 1915497311 BTMMFKZPESMCLZ-UHFFFAOYSA-N 341.249 1.899 10 10 EDCE Cc1sc2ncn(NC(=O)Cc3ccc(O)c(O)c3)c(=O)c2c1C 1539143152 VPWRCZUPLPWPKH-UHFFFAOYSA-N 345.380 1.799 10 10 EDCE CC1(C)[C@@H](O)CN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2136633400 YNLADXBBGUCLAB-WDEREUQCSA-N 327.178 1.394 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cccnc2OCCO)c1 1622778928 BIDZPOWXEKAZNU-LLVKDONJSA-N 332.356 1.658 10 10 EDCE COC[C@H](C)NCC1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1717394244 DDYXUIKEWDYMBE-BZUNDVKYSA-N 347.419 1.982 10 10 EDCE CCOCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N=NC(N)=O)cc1 1714992131 UGKQVIXCTFZTPR-GJZGRUSLSA-N 345.403 1.784 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N1CCCCC1=O 1556256776 AHQMDDOMIQBTGO-LLVKDONJSA-N 331.376 1.980 10 10 EDCE C[C@H](NC(=O)N[C@H]1CS(=O)(=O)C[C@H]1C)c1ccc(N(C)C)cc1 1634435581 PABHKJDQUGLJKE-XUJVJEKNSA-N 339.461 1.546 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)Cc2ccn(C)n2)cc1C 1567214575 ATFPYHKRORTGCT-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE Cc1ccc(O)c(CNC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1 1645800850 WKEHMJGZWGPZDI-UHFFFAOYSA-N 334.397 1.207 10 10 EDCE Cc1cc(Cn2nnc(C(=O)NCc3cc(O)ccc3O)c2C)no1 1643882377 UJBULYPVNFLPLJ-UHFFFAOYSA-N 343.343 1.272 10 10 EDCE CCOC(=O)CN1C(=O)CS/C1=C1/SC(=S)N(CC)C1=O 201823558 HSTGIAIKRAGWIE-PKNBQFBNSA-N 346.455 1.174 10 10 EDCE CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010388618 FAGYMNRJZUXASO-RYUDHWBXSA-N 338.412 1.449 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2010393693 WCCDEPMXNJLZOL-LLVKDONJSA-N 339.396 1.517 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)c2cc(O)c(O)c(O)c2)C1 2015118968 FTTJDUSOCYTARI-SNVBAGLBSA-N 338.360 1.543 10 10 EDCE C[C@H](NC(=O)[C@H](CO)CNC(=O)OC(C)(C)C)c1ccccc1O 2017519244 QMJQRVJAZHCYIK-RYUDHWBXSA-N 338.404 1.703 10 10 EDCE CN(Cc1cn(C)nc1Br)C(=O)c1ccc(O)c(O)c1 2173260414 ZAGANBSUYPBRIP-UHFFFAOYSA-N 340.177 1.866 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(NCc2ccc(O)c(O)c2O)C1 2216823520 QJLJEJWKBGNCTC-APPDUMDISA-N 336.388 1.902 10 10 EDCE CSc1ncc(Cn2ccc(=O)nc2SCC(=O)O)s1 2284502133 WDZQUMSYDBPWLX-UHFFFAOYSA-N 329.428 1.647 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cc(CN)ccn2)s1 2284688354 JYKSTJMMBNCOIQ-UHFFFAOYSA-N 330.460 1.197 10 10 EDCE O=[N+]([O-])c1c(O)nc(C=Cc2ccc(N3CCOCC3)cc2)nc1O 2297554356 ICKKKLRKKUNCMN-UHFFFAOYSA-N 344.327 1.803 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCc2cc(O)c(O)cc2C1 2302399376 LGEKFKJCQMTHSG-SNVBAGLBSA-N 336.388 1.896 10 10 EDCE COc1cc([C@@H](NCCN=[N+]=[N-])C(N)=O)c(Br)cn1 2336991110 SMFIHAMAQACIHP-SECBINFHSA-N 329.158 1.279 10 10 EDCE Cc1nc(Br)c([C@@H](O)[C@H](N)c2ccccc2O)n1C 2337358927 KYXGNRHXDARCEF-PWSUYJOCSA-N 326.194 1.930 10 10 EDCE Cc1cccc2c1NC(=O)/C2=C1/SC(=S)N([C@@H](C)C(=O)O)C1=O 102603770 HZBANZUPRUKHMU-MCTJWZARSA-N 348.405 1.992 10 10 EDCE COc1ccc(CN2CCN(C(=O)c3cccnc3)CC2)c(O)c1 179494199 KCZXCANOKQECQT-UHFFFAOYSA-N 327.384 1.754 10 10 EDCE CN[C@H](COC)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952207390 CZQZCJZVLYYSID-QWHCGFSZSA-N 340.420 1.768 10 10 EDCE Oc1cc2c(cc1CN1CCC(CO[C@H]3CCNC3)CC1)OCO2 530249823 ZASJYNQPGWZKOC-HNNXBMFYSA-N 334.416 1.711 10 10 EDCE CCn1nccc1S(=O)(=O)NCc1ccc2c(c1)CCCN2C 274438067 GDPNEHIJSYETPH-UHFFFAOYSA-N 334.445 1.764 10 10 EDCE Cc1cc(O)c(CNC[C@@H]2CCC[C@]23NC(=O)N(C)C3=O)cc1C 371083680 DDNYYJLYGIYHMF-KSSFIOAISA-N 331.416 1.819 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)NCc1ccc(C)c(Br)c1O 2380744674 LKUZTBOBLRMNEL-NXEZZACHSA-N 342.189 1.888 10 10 EDCE CCOc1cccc(CN[C@@H]2CCC[C@H]2CNS(C)(=O)=O)c1O 800309043 BVEPTMGIQIXFEB-GXTWGEPZSA-N 342.461 1.598 10 10 EDCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)[C@H](O)C1CC1 831560799 FNPSXQSAMKUCLE-LJQANCHMSA-N 343.471 1.606 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCC[C@]3(C2)NC(=O)NC3=O)cc1 835051499 GTTCJYAZSRRBMF-YWPBOTNQSA-N 328.416 1.440 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H](O)C1CCC1 838305313 KDOBMNUFDRQXNQ-KRWDZBQOSA-N 334.416 1.415 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)c2cnccc2N(C)C)cc1 843298684 PTMUCRIWMQZDIF-MRXNPFEDSA-N 327.432 1.643 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)c2cccnc2C(N)=O)cc1 846442517 RXIMIILIDYZTMU-UHFFFAOYSA-N 342.399 1.398 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C[C@]3(C(=O)O)CCOC3)C2)cc1 849183762 UHAINHJRTFYCBA-FZKQIMNGSA-N 348.399 1.272 10 10 EDCE COc1ccc(CNS(=O)(=O)CC2(OC)CCOCC2)c(O)c1 845926046 DAKKRMVFLYJWQB-UHFFFAOYSA-N 345.417 1.016 10 10 EDCE CN1CCCc2cc(CNC(=O)NCC[C@@]3(O)CCOC3)ccc21 844934586 PCJRGQMEKXTBOL-GOSISDBHSA-N 333.432 1.410 10 10 EDCE COc1ccc(N2CC[C@@H](NC[C@@H]3CCCN(C(=O)CN)C3)C2)cc1 849350828 XPYYKQRBXJBTNN-JKSUJKDBSA-N 346.475 1.061 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@@H]([C@]3(C)COC(=O)N3)C2)c(O)c1O 928030044 XAIGGJTWSWDTBT-DIFFPNOSSA-N 334.372 1.757 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)C34CC(C3)C4)CC2)cc1 858839480 GBCNGXYNRKVHTB-UHFFFAOYSA-N 329.444 1.734 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H]4C[C@H]43)CC2)cc1 754082464 PPXUPERGTCYAJW-HHXXYDBFSA-N 331.460 1.272 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)Cc2cn(C)nn2)c([N+](=O)[O-])c1 853860246 CYUUFQLSAVPARA-FNORWQNLSA-N 331.332 1.546 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@H](O)C(F)(F)C2)c([N+](=O)[O-])c1 853802790 GUNIYOJFUPFCPF-DXTPNHAXSA-N 342.298 1.987 10 10 EDCE COC[C@]1(C)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 858865681 LZTMRUGVALTYMR-HNNXBMFYSA-N 337.332 1.167 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](O)Cc3ccccc3)C2)cc1 855223374 GESIXOYKPABHIO-APWZRJJASA-N 340.423 1.994 10 10 EDCE CON1CCC(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 864984464 STYHGZADBBMEOI-UHFFFAOYSA-N 333.432 1.413 10 10 EDCE O=C1NCCC[C@H]1C(=O)NCc1cc(Br)ccc1O 868307178 RALDWGREBGOCDL-SNVBAGLBSA-N 327.178 1.297 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C3(N4CCOCC4)CC3)C2)cc1 869228523 KPNLYGFRGGEHOU-OAHLLOKOSA-N 345.443 1.255 10 10 EDCE CCC1(CC)NC(=O)N(CC(=O)N2Cc3cccc(O)c3C2)C1=O 871198037 FWWFTCDWKBYSNO-UHFFFAOYSA-N 331.372 1.345 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H](O)[C@H](C)O)ccc21 871131546 XWIXYMFTGAUFRN-GUYCJALGSA-N 334.416 1.376 10 10 EDCE Cc1ccc(C(=O)NC[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@@H]6[C@H]4[C@H]2[C@@H]6C[C@H]53)c(O)c1O 787668370 FNTJMYKIXQORJT-WIZVAUIUSA-N 341.407 1.645 10 10 EDCE COC(=O)[C@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CC1 781588868 ARZCDIJPLLPVLT-NVXWUHKLSA-N 345.443 1.430 10 10 EDCE O=C(NC[C@@H]1CS(=O)(=O)c2ccccc21)c1cccc(O)c1O 1141337759 QQGCGRKQIFWFBA-SNVBAGLBSA-N 333.365 1.399 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCCOCC3)c(Br)cc21 92775808 TWGUPLLVLUEFSD-ZDUSSCGKSA-N 340.221 1.888 10 10 EDCE CCN1CC[C@@H]1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 1154275912 LJBLHEROKKKVQY-GOSISDBHSA-N 344.459 1.066 10 10 EDCE C[C@@H](CCNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H]1CCOC1 1317418011 RTOMFAWXJNMZMN-STQMWFEESA-N 347.419 1.984 10 10 EDCE C[C@@H]1[C@@H](CO)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1313065882 ZAQJFZPWAFLVSS-GDBMZVCRSA-N 347.459 1.560 10 10 EDCE CNCc1ccc(N2CCC[C@@H]2[C@@H](O)CO)cc1Br 2123223620 SOIATJGCEKPVFB-KGLIPLIRSA-N 329.238 1.491 10 10 EDCE CCC1(N(C)C)CCN(C(=O)C(=O)N(C)Cc2ccccc2O)CC1 1329899107 KDIUBUUTDZYUTA-UHFFFAOYSA-N 347.459 1.683 10 10 EDCE CO[C@@H]1COC[C@H]1N(C)c1ccc(CN)c(Br)c1F 2120773111 CSYMUNRTQUUGDO-GHMZBOCLSA-N 333.201 1.897 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(C2CC2)CC1 1334140945 OWFKNEDMBHCTNV-ZDUSSCGKSA-N 333.384 1.878 10 10 EDCE Cc1ccc(O)c(CNCCc2nnc(Br)n2C)c1 2128774041 UKMOXKAAJDGLTP-UHFFFAOYSA-N 325.210 1.924 10 10 EDCE C[C@@H](CO)N(Cc1ccccc1)C(=O)[C@@H](N)Cc1ccc(O)c(O)c1 1914368309 RAEHXPWESXSHIY-BBRMVZONSA-N 344.411 1.377 10 10 EDCE O=C(CSc1n[nH]c(O)n1)NCCCSc1nccs1 1292997274 LXCNUHJTJGBTRE-UHFFFAOYSA-N 331.448 1.358 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)[C@@H]3CCN3CC)cc2F)CC1 1627360592 LZQJISNOJOUXRK-SFHVURJKSA-N 348.466 1.678 10 10 EDCE CCc1n[nH]cc1C(=O)NC[C@@H](CO)NCc1ccc(OC)c(C)c1 1717769512 NYIPGLHBOWBCDF-AWEZNQCLSA-N 346.431 1.170 10 10 EDCE CN(C)CCN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 118590074 UBOBNDBGAYECIN-LBPRGKRZSA-N 327.226 1.399 10 10 EDCE O=C(Nc1n[nH]cc1I)c1cccc(O)c1O 1557589144 AEBSMDNQMDFMCS-UHFFFAOYSA-N 345.096 1.678 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc(-n2ccnc2)ccc1O 1633599128 PMEQRSCTNNOLCD-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE CN1CC[C@@H](C(=O)NCc2cc(O)ccc2O)[C@H](c2cnn(C)c2)C1 1633599308 WYYZYLKJCMPAIZ-CVEARBPZSA-N 344.415 1.183 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H]2COC(=O)N2)cc1C 1568627119 MOLNPFCBDPGNHA-TZMCWYRMSA-N 335.404 1.096 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](C)N(C(=O)CNC(C)=O)C2)cc1C 1725573211 HMVNVTKLHVRAHS-BBRMVZONSA-N 333.432 1.219 10 10 EDCE COC1CCN(c2ccc(CN3CCS(=O)(=O)CC3)cc2)CC1 1641701408 FDIRXPGVJVBFMM-UHFFFAOYSA-N 338.473 1.532 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C[C@H]2C=CCC2)cc(OC)n1 1737548520 AIQYSMUXCZUFKR-STQMWFEESA-N 347.415 1.690 10 10 EDCE CC[C@H](CNC(=O)c1c[nH]c(=O)cn1)NCc1ccc(OC)c(C)c1 1665834772 QOLUXILLKNFCOG-CQSZACIVSA-N 344.415 1.385 10 10 EDCE O=C(O)CNCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866109974 HWKZCMRLQJVDBR-UHFFFAOYSA-N 338.319 1.075 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985102205 CWEGMUIPQJBVIW-ZJUUUORDSA-N 327.385 1.467 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@H]4C[C@H]3CO4)c(Br)cc21 2153088449 AQNQGMWCIGZKCX-UVPNAGLESA-N 338.205 1.769 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)NCCCCN=[N+]=[N-])=C[C@H]1O 2014507791 XRGBFCWAZZEEQC-VXGBXAGGSA-N 339.396 1.777 10 10 EDCE CO[C@H]1CN(Cc2ccc(Br)cc2O)C[C@H]1C(=O)O 691436445 IFIUFUULOXPTHS-PWSUYJOCSA-N 330.178 1.686 10 10 EDCE CCOC(=O)c1c(C(F)(F)F)nn2c(O)cc(CC(=O)OC)nc12 2080935551 RKTVNXMTYOIMCU-UHFFFAOYSA-N 347.249 1.346 10 10 EDCE NCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(F)c1Br 2199531735 LOLNESDBYYDTBP-ZXVPCKTCSA-N 345.212 1.367 10 10 EDCE CNCc1ccc(N2CC(=O)NC(C)(C)C2)c(Br)c1 2094062069 BVPZMEZRPFHAFD-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE CO[C@H]1CN(C)C[C@@H]1NCc1cc(Br)cc(F)c1O 2095433332 GLARTYRWSPTBTH-RYUDHWBXSA-N 333.201 1.712 10 10 EDCE OCc1ccc(N2CC[C@@H]3OCCO[C@H]3C2)cc1Br 2095427847 WWCBCSVHAYGOKK-KBPBESRZSA-N 328.206 1.936 10 10 EDCE CC(C)[C@@H]1C(=O)NCCN1c1ccc(CO)c(Br)c1 2113704100 UOLJSNCHZGZGOP-CYBMUJFWSA-N 327.222 1.902 10 10 EDCE OCc1ccc(N2CC[C@H](C(CO)CO)C2)cc1Br 2114244279 IUEHNAKSNSLNPR-JTQLQIEISA-N 330.222 1.369 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(NC(=O)c2ccc(O)c(O)c2)C1 2216768273 SFWPYCNVAVIUDI-PIGZYNQJSA-N 334.372 1.837 10 10 EDCE O=C1Nc2cc(N3C[C@@H](F)C[C@@H](O)C3)c(Br)cc2[C@H]1O 2234666344 VCWCNUUFELRVTG-QRPMWFLTSA-N 345.168 1.344 10 10 EDCE COc1ccc(Br)c(CN2CCN(CCN)CC2)c1O 2236045068 QBDHBDLAOJOXNQ-UHFFFAOYSA-N 344.253 1.240 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2COC[C@@H]2OC)c1O 2227736784 LACQEIKUYHMTNM-PWSUYJOCSA-N 332.194 1.667 10 10 EDCE CC(C)(C)OC(=O)N1CC(N2CCC[C@@H]2C(=O)NCCN=[N+]=[N-])C1 2250170703 PNPUCUGMWOSXTG-GFCCVEGCSA-N 338.412 1.497 10 10 EDCE C[C@@H](C(=O)O)N1C(=O)C(=C2C(=O)N(C)c3ccccc32)SC1=S 2293031023 FKALJXADTPROPL-ZETCQYMHSA-N 348.405 1.708 10 10 EDCE COc1ccc(C=C2SC(N3CCN(CCO)CC3)=NC2=O)cc1 2297471863 UYHNSFCLLMEROD-UHFFFAOYSA-N 347.440 1.275 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CNC[C@H]2C)c(O)c1Br 2352948558 QUARNNUQIDGABY-KOLCDFICSA-N 327.222 1.935 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(N)cc1 170316662 KJFDOBGKBHVYEB-UHFFFAOYSA-N 342.311 1.695 10 10 EDCE COC(=O)[C@H]1C[C@H]1C(=O)NC1CCN(c2ccc(OC)cc2)CC1 170763416 AIFAURZUKITEPO-CVEARBPZSA-N 332.400 1.589 10 10 EDCE COc1ccc(CN2CCN([C@@H](C)c3nc(C)no3)CC2)c(O)c1 121338125 IJBRSOVSOHCCQV-LBPRGKRZSA-N 332.404 1.971 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(CCCO)CC2)c([N+](=O)[O-])c1 215021753 XOSNYEDMTKGSLX-XQRVVYSFSA-N 349.387 1.285 10 10 EDCE COCc1noc(CN2CCN(Cc3ccc(OC)cc3O)CC2)n1 188800872 DSGKQCOWVNDQKM-UHFFFAOYSA-N 348.403 1.248 10 10 EDCE O=C(Cn1cc(-c2ccccc2)nn1)NCCc1ccc(O)c(O)c1 122914995 NHECFHUECNABSO-UHFFFAOYSA-N 338.367 1.715 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@H](C(F)F)C3)cc2N1 193576513 WBYJGVVYQGXVHX-NSHDSACASA-N 329.259 1.396 10 10 EDCE CCOC(CNC(=S)N(C(C)=O)c1ccc(N)cc1)OCC 242622996 CNEPEUSMNIHXRJ-UHFFFAOYSA-N 325.434 1.895 10 10 EDCE CC[C@@H](CO)N1CCN(Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 278305213 WIPXXWSMVGWQJN-ZDUSSCGKSA-N 339.392 1.198 10 10 EDCE CC(=O)C(=O)COC(=O)C1=NN(Cc2ccc(F)cc2)C(=O)CC1 808505512 CNBRHCYZZZAGHX-UHFFFAOYSA-N 334.303 1.005 10 10 EDCE CCO[C@@H]1C[C@H](NC(=O)c2ccc(C)c(O)c2O)[C@@H]1n1cccn1 819405113 JGLOATBZABPSPI-MJBXVCDLSA-N 331.372 1.751 10 10 EDCE O=C1OCCN1[C@@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 826995713 ZOLBHHIUAJCQBA-QGZVFWFLSA-N 331.416 1.550 10 10 EDCE Cc1c(C[C@H](CN)CN2CCCc3cc(CN)ccc32)cnn1C 903874271 WUMALDDKYJYFFL-MRXNPFEDSA-N 327.476 1.757 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)N[C@H](CC4CC4)C3=O)C2)cc1 849356967 IWMIHADVSMSLIU-GDBMZVCRSA-N 329.400 1.994 10 10 EDCE Nc1ccc(NC(=O)C(=O)NC[C@H]2CC[C@@H](C(F)(F)F)O2)cc1 927837798 PCNMGOACOLSMNY-MNOVXSKESA-N 331.294 1.433 10 10 EDCE COC(=O)/C(C)=C\CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 923183011 JXDNHWQKYIMUJZ-YLHGKKIISA-N 347.415 1.692 10 10 EDCE O=C(N[C@H]1CCCN2CCSC[C@H]12)N1Cc2cccc(O)c2C1 925173425 XTMCGRFIYJDNDU-LSDHHAIUSA-N 333.457 1.997 10 10 EDCE COc1nc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)co1 859734825 ZZVPQJCTMGUDRL-UHFFFAOYSA-N 349.362 1.713 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(F)(F)C3(O)CCC3)C2)cc1 855234359 YAWSPSUJQAFXCU-GFCCVEGCSA-N 340.370 1.940 10 10 EDCE Oc1cc2c(cc1CN1CCO[C@@H](CC(F)(F)F)C1)[C@H](O)CO2 853614251 SKSQXQZUSKPMPV-GXFFZTMASA-N 333.306 1.971 10 10 EDCE COCc1n[nH]c(CNC(=O)c2cc(C)n(-c3ccccn3)c2C)n1 855520123 CBEIMGYHAZPZRM-UHFFFAOYSA-N 340.387 1.684 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@@H]2CC[C@H](C)S(=O)(=O)C2)c1 853736637 ISMJKCZJXBKTBN-CMPLNLGQSA-N 342.417 1.166 10 10 EDCE COc1cc(COCC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccn1 860696687 CUIWXNNNYFKQPD-GFCCVEGCSA-N 346.383 1.765 10 10 EDCE COc1ccc(COCC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cn1 860697270 RJGJKCXVGSMRHY-GFCCVEGCSA-N 346.383 1.765 10 10 EDCE CN1CC[C@@H]2CN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC[C@H]21 866205419 LODBYCNPMYKYQV-ZYHUDNBSSA-N 332.360 1.456 10 10 EDCE O=C(OCC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1cccc(O)c1O 776282124 PGIAANDXHPONKX-GXTWGEPZSA-N 335.356 1.425 10 10 EDCE Cn1c(=O)n(CC(=O)NCc2c(O)cccc2O)c2ccccc21 1178905558 OXNVKICYZPMHBM-UHFFFAOYSA-N 327.340 1.068 10 10 EDCE C[C@H](CNCC[C@@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1321760619 UDGQKGFAJQJVNM-CHWSQXEVSA-N 347.419 1.984 10 10 EDCE C[C@H](O)c1ccc(N2CCC[C@@H]2[C@H](O)CO)c(Br)c1 2123168625 BPJNJGQJIPALFV-CUOATXAZSA-N 330.222 1.824 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cn2cncc2C)cc1C 1266776560 CDPJVDPEXBEMRK-UHFFFAOYSA-N 330.432 1.757 10 10 EDCE N[C@H]1CC[C@@H](C(=O)O)N(Cc2cc(Br)ccc2O)C1 2132271808 AFXNHDKEVHWSME-QWRGUYRKSA-N 329.194 1.531 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@H](O)C3)cc1Br 2133921662 YCGLKCYBBGONCR-SCUASFONSA-N 327.222 1.371 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3[C@H](C(N)=O)[C@@H]3C2)c(Br)c1 2136583844 AOSRFMMIINKKGW-SQFXPHBZSA-N 325.206 1.670 10 10 EDCE C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)NCC(F)(F)F 1625273642 NLMDDGSEESPLEN-SSDOTTSWSA-N 345.281 1.646 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2ccnc(C)n2)cc1C 1481317674 PYUQWWJQKGESMV-UHFFFAOYSA-N 328.416 1.964 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(c2cnn(C)c2)=NO1 1624955093 RLAVZYSGRIRQBJ-HWPZZCPQSA-N 344.371 1.072 10 10 EDCE CC(=O)C(=O)[C@@]1(O)[C@@H](CNC(=O)OC(C)(C)C)CCC12CCC2 1924872863 BIAVKVZBPTWODA-PXAZEXFGSA-N 325.405 1.981 10 10 EDCE CS(=O)(=O)[C@@H]1CCCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1635397841 REWLDFIIWHHSKQ-GFCCVEGCSA-N 327.402 1.066 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)C(C)(C)NC(C)=O)cc1C 1725010080 CPAZEGYDHLBXHS-AWEZNQCLSA-N 349.475 1.903 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1COCCN1CC(F)F 1633819744 UUINPZVBXKWGJF-ZYHUDNBSSA-N 344.358 1.111 10 10 EDCE Cn1cc([C@@H](O)C(=O)NCc2cccc(Br)c2O)cn1 1640083817 IQHRKRHZIPOROC-GFCCVEGCSA-N 340.177 1.238 10 10 EDCE C[C@H](NC(=O)c1cc(S(N)(=O)=O)ccc1F)c1ccccc1O 1587447409 REULHORMYAMIJQ-VIFPVBQESA-N 338.360 1.670 10 10 EDCE CCOC(=O)c1cc(CNC(=O)N(C)Cc2ccccc2O)on1 1675389931 YJBMYHZCQDKSDA-UHFFFAOYSA-N 333.344 1.899 10 10 EDCE COc1ccc(CNC2(CNC(=O)C[C@@H](C)NC(N)=O)CC2)cc1C 1670782264 YODYIDDDJWAJSN-CYBMUJFWSA-N 348.447 1.189 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N3CC[C@H](O)[C@@H]3C)C2)cc1 1682188432 QEZMANLPQHVLCJ-ZQIUZPCESA-N 333.432 1.686 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)Cc2cnn(C)c2)cc1C 1690557816 XKZFMQPCXJKAKX-AWEZNQCLSA-N 330.432 1.574 10 10 EDCE CC(C)NCc1ccc(N2CCNC(=O)C2)c(Br)c1 232711432 DZBFDBFFLQYITD-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE COc1cc(O)c(CN2CCN(c3cccnn3)CC2)cc1OC 160096515 JKBDLGIIVKCSPH-UHFFFAOYSA-N 330.388 1.522 10 10 EDCE CCOc1cccc(CNCC(=O)N2CCCC[C@H]2CCO)c1O 1857866880 IOUXBFPFFJCNHD-HNNXBMFYSA-N 336.432 1.644 10 10 EDCE CC(C)(C)OC(=O)NCC1(F)CC(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003171611 YRQNODLJPUAYKT-FFCJKCFQSA-N 342.411 1.895 10 10 EDCE CN1CCN(Cc2ccc(N)cc2)[C@@H](CNC(=O)OC(C)(C)C)C1 1999436075 CJEABQNLSCUNFD-INIZCTEOSA-N 334.464 1.910 10 10 EDCE COC(=O)CN(Cc1ccccc1)C(=O)c1cc(O)c(O)c(O)c1 170190546 QEZMWJSXYKXFEL-UHFFFAOYSA-N 331.324 1.619 10 10 EDCE Oc1ccc(Br)cc1CNC[C@H]1CN2CCCN1CC2 394817652 SKHFBCPDPXQRLR-AWEZNQCLSA-N 340.265 1.634 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)cc1Br 2182558065 AQYLSLHUOHQBAB-BVDPADPGSA-N 342.233 1.680 10 10 EDCE Cc1cnccc1N(C)C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1 2080952144 UVJFHMGPAUAFCN-UKRRQHHQSA-N 347.415 1.937 10 10 EDCE Cc1cccc(CNC(=O)CN2CC(NC(=O)OC(C)(C)C)C2)c1O 2084060146 DISJBGUAWZFLKH-UHFFFAOYSA-N 349.431 1.526 10 10 EDCE NCc1ccc(N2C[C@H]3CCS(=O)(=O)[C@H]3C2)c(Br)c1 2088819818 MTQLERJBDBUIKW-MFKMUULPSA-N 345.262 1.531 10 10 EDCE C[C@@H](N)c1ccc(N2CC(OCC(N)=O)C2)cc1Br 2089135140 JMWAYVJYMVXQDX-MRVPVSSYSA-N 328.210 1.159 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@H](N(C)C)C2)c(Br)c1 2089925700 FGOQVWKSNGFUFI-FZQKWOKYSA-N 329.238 1.614 10 10 EDCE CNCc1ccc(N2CCOC[C@]2(C)CO)c(Br)c1 2112713314 MEAFGYPXCKIRSL-AWEZNQCLSA-N 329.238 1.756 10 10 EDCE C[C@](O)(CO)[C@@H]1CCN(c2cc(Br)c(CN)cc2F)C1 2202841339 SUMAWKFOVTWPFG-YGRLFVJLSA-N 347.228 1.617 10 10 EDCE CNCc1ccc(N2C[C@H]3CCO[C@]3(CO)C2)cc1Br 2239802437 YMBKIDYUELADCP-DOMZBBRYSA-N 341.249 1.756 10 10 EDCE CC1CCN(c2ccc(CNC(=O)N3CCNC(=O)CC3)cc2)CC1 108583890 DOVLBDUJSHXWQK-UHFFFAOYSA-N 344.459 1.954 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCCN(c2cccnn2)C1 180789838 SUZAJMNXGYNYMT-IZPAUZPXSA-N 340.383 1.686 10 10 EDCE C[C@H](N[C@H]1CCc2ncnn2C1)c1ccc(N2CCC(O)CC2)cc1 180580430 LDOBWXYEKVNUOW-HOCLYGCPSA-N 341.459 1.905 10 10 EDCE Nc1ccc(NC(=S)NCc2ccc(S(N)(=O)=O)cc2)cc1 244300003 WXFVLAFFODNXTA-UHFFFAOYSA-N 336.442 1.403 10 10 EDCE CCNC(=O)N1CC[C@@H](N[C@@H](C)c2cc(C(=O)OC)ccc2O)C1 273536130 XKZNLPXBGWHSIF-WCQYABFASA-N 335.404 1.633 10 10 EDCE C[C@H]1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H]1C 293553372 ZIIYVABBUKTFCM-KBPBESRZSA-N 335.423 1.619 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCCS1(=O)=O 808094136 BVOLYXPHUDVARI-LBPRGKRZSA-N 332.418 1.461 10 10 EDCE Cn1ncc(C(=O)NCc2cc(Br)ccc2O)c1N 804735229 QKFPYQNYNLYPKX-UHFFFAOYSA-N 325.166 1.400 10 10 EDCE O=[N+]([O-])c1cc([C@H](C2CCOCC2)N2CCOCC2)cc(O)c1O 575277613 HOGHEGMGKGIQMH-HNNXBMFYSA-N 338.360 1.806 10 10 EDCE COC(=O)CC[C@@H](N)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 828988294 PPWMOOHONNNHTC-QGZVFWFLSA-N 347.459 1.820 10 10 EDCE CSCCCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 736688048 GSZSEBSDUQYGHL-UHFFFAOYSA-N 332.447 1.637 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N(C)C2CS(=O)(=O)C2)cc1 913146399 VBXFUIPWBLCMRD-UHFFFAOYSA-N 332.425 1.963 10 10 EDCE CN(C)c1ccc(CN(C(=O)NCC[C@@]2(O)CCOC2)C2CC2)cc1 845449311 LUEUYBXJLBRHSE-LJQANCHMSA-N 347.459 1.968 10 10 EDCE O=S1(=O)CC[C@@]2(CN(Cc3cc4c(cc3O)CCC4)CCO2)C1 842633019 NHPFSNWNPPHDPN-QGZVFWFLSA-N 337.441 1.270 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N2CCC[C@@]3(CCCOC3)C2)cc1 842241655 HGYQIIVRESNHLU-LJQANCHMSA-N 345.443 1.347 10 10 EDCE COC1CCN(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)CC1 849307645 AWOMJSBVUYMMSM-UHFFFAOYSA-N 331.350 1.068 10 10 EDCE CN(C)c1ccc(/C=C\CNCCCCn2cc(C(N)=O)nn2)cc1 840978790 WABFJAKAJZWJHE-WAYWQWQTSA-N 342.447 1.526 10 10 EDCE O=C(Cc1csc(N2CCCC2=O)n1)NCc1c(O)cccc1F 928711074 ZTCSUPVRXOPOAR-UHFFFAOYSA-N 349.387 1.974 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCn4ccnc4C3)C2)cc1 855223850 IOQRAZJPTCKOFU-CABCVRRESA-N 340.427 1.849 10 10 EDCE CC[C@H](NCC[C@@H]1CNCCS1(=O)=O)c1ccc(N(C)C)cc1 925796526 OVHBBBQSVXFAAM-SJORKVTESA-N 339.505 1.570 10 10 EDCE NC(=O)C1CCN(c2ccc(CN[C@@H]3CCNC34CCC4)cc2)CC1 925777657 PYWOFKQABNJBER-GOSISDBHSA-N 342.487 1.763 10 10 EDCE COc1cc(O)c(CN2CCO[C@@H](CCCN(C)C)C2)cc1OC 853623657 CQDYGDRGCKMJMQ-HNNXBMFYSA-N 338.448 1.952 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@@H]3CCNC3)C2)cc1 851664508 CQSNEOLSVKFOGD-LSDHHAIUSA-N 332.448 1.573 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H](C(=O)O)C1CC1 852950861 SFCYTTGKVMAPSP-INIZCTEOSA-N 332.400 1.592 10 10 EDCE C[C@@H]1NCC[C@H]1NC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 861565559 BMVZNRJHUVCVRJ-JKIFEVAISA-N 332.448 1.634 10 10 EDCE CCNC(=O)c1ccc(N2CCN(c3ccc(OC)cc3)CC2)nn1 764404846 NWYIGDGESGRJQU-UHFFFAOYSA-N 341.415 1.562 10 10 EDCE CCn1nc(C)cc1NC(=O)C(=O)NCc1ccc(OC)cc1O 861844408 LETWTSSEAJNSQX-UHFFFAOYSA-N 332.360 1.181 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C2CN([C@@H]3CCOC3)C2)cc1 898275484 UQTZAULGQLOPKJ-QGZVFWFLSA-N 347.459 1.311 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCNC(=O)CC1CCCCC1 1136538641 DKQCSOJZNHWODG-UHFFFAOYSA-N 334.416 1.843 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCN(c2ncccc2F)C1 1149776044 NIZFUJRIKZANEK-LBPRGKRZSA-N 331.347 1.570 10 10 EDCE O=C1CN(Cc2cc3c(cc2O)OC[C@H]3O)CCN1CC(F)(F)F 795732912 YMIKYUOMHXFBJM-GFCCVEGCSA-N 346.305 1.025 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)CCN(C)C)c(Br)cc21 92775907 UEBNKGRCQYUFBM-ZDUSSCGKSA-N 341.253 1.660 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@]2(C)CCC(=O)N2)cc1C 1317631183 CBALPJGNPZJZNU-SFHVURJKSA-N 333.432 1.220 10 10 EDCE O=C(C(=O)N1CC[C@H](C2CCOCC2)C1)N1Cc2cccc(O)c2C1 1329478624 NFMJZTCWBHUYEN-AWEZNQCLSA-N 344.411 1.510 10 10 EDCE C[C@H](N)c1ccc(N2CC3(CNC(=O)N3)C2)c(Br)c1 2121208349 GRWSPXOGOLRJBB-QMMMGPOBSA-N 325.210 1.340 10 10 EDCE CC[C@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@@H]1CCCCO1 1261565490 FINRJEZZQVVNJR-HOCLYGCPSA-N 334.416 1.815 10 10 EDCE CC[C@H](CNC(=O)Cn1ccnc1)NCc1ccc(OC)c(C)c1 1267831756 TXBXQVRESDWYBB-MRXNPFEDSA-N 330.432 1.885 10 10 EDCE CC1(C)C[C@@H](O)[C@@H](O)CN1c1ccc(CN)cc1Br 2132114636 FOFBRADIKFWSBI-OLZOCXBDSA-N 329.238 1.618 10 10 EDCE COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H]3C[C@@H]3C)CC2)cc1 1345185556 GTRQUQCYWHNQQB-UONOGXRCSA-N 345.443 1.552 10 10 EDCE CN1CCCc2cc(CNC(=O)c3cccnc3OCCO)ccc21 1464522348 WCEPJUNTFZBEPP-UHFFFAOYSA-N 341.411 1.765 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cccnn2)cc1C 1700039810 JOEQXSYEHUREDJ-UHFFFAOYSA-N 344.415 1.018 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)Cc2nnc(C)o2)cc1C 1700390951 CWNCDDCTLOUALG-CHWSQXEVSA-N 346.431 1.921 10 10 EDCE COC[C@H](C)NC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1715916976 WEMAPHZBMSFWOL-PXTZJAAESA-N 333.392 1.760 10 10 EDCE CN(C)[C@@H]1COC[C@H]1CNCc1ccc(Br)cc1O 1924715666 NYYNICPWFJHJAF-DGCLKSJQSA-N 329.238 1.821 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCCn4ncnc43)CC2)cc1 1635783633 DXEOMPCTQFSUHE-MRXNPFEDSA-N 341.415 1.513 10 10 EDCE COC(=O)c1ccn(CC(=O)N[C@H](C)c2cc(OC)ccc2O)n1 1631543278 SLGBZNBSTWQFSL-SNVBAGLBSA-N 333.344 1.261 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)Cn2cncn2)cc1C 1568705960 MOTWPZDONGWXTO-AWEZNQCLSA-N 331.420 1.280 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CCCN1Cc1ccccn1 1647270717 XUHZMVUWZUETRH-OAHLLOKOSA-N 327.384 1.774 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)NC/C=C\CNCc1ccc(OC)c(C)c1 1732829078 DFURRAXYVWJHTH-KSLSASGISA-N 346.427 1.575 10 10 EDCE CCOc1cccnc1NC(=O)CCN1C(=O)CSC1=S 1865768342 QCQVOFRVSQOLCF-UHFFFAOYSA-N 325.415 1.669 10 10 EDCE Oc1ccc(Br)cc1CN[C@@H]1COC2(CCC2)[C@@H]1O 2141559870 WLZVTUCOLDBBMT-DGCLKSJQSA-N 328.206 1.927 10 10 EDCE CCOc1cccc(CNCC(=O)N(CCOC)CCOC)c1O 1857867144 VSBSLIUOTFQPCW-UHFFFAOYSA-N 340.420 1.002 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@]1(C)C(=O)NCCCN=[N+]=[N-] 1985099700 ATKXOAFLBSXQDX-QMTHXVAHSA-N 327.385 1.733 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010405224 GREGAVBSZIITIY-JQWIXIFHSA-N 341.412 1.809 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@](O)(CC(=O)N2CC(N=[N+]=[N-])C2)C1 2010404028 NPFZEMQSYFWHGZ-OAHLLOKOSA-N 339.396 1.660 10 10 EDCE CO[C@@]1(CO)CCN(c2ccc(CN)c(Br)c2F)C1 402967209 YUQGYZYQXSKEAZ-ZDUSSCGKSA-N 333.201 1.635 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)[C@@H](CO)C2)c(Br)c1 316634564 ZUSFFKSPZMUIFT-IUODEOHRSA-N 343.265 1.737 10 10 EDCE NCc1ccc(N2CCC(NC(N)=O)CC2)cc1Br 702128115 JLEOTNJOTQPJJV-UHFFFAOYSA-N 327.226 1.545 10 10 EDCE C[C@H]1CN(C)C[C@@H](CNCc2cc(Br)ccc2O)O1 697316940 NBTNSVBZQQTSKS-GXFFZTMASA-N 329.238 1.963 10 10 EDCE O=C(NCc1c(O)cc(O)cc1O)[C@H]1CCCN(CC(F)F)C1 2062463192 ZOMWANAJZHLZPX-VIFPVBQESA-N 330.331 1.397 10 10 EDCE CNCc1ccc(N2CC[C@@](C)(O)[C@](C)(O)C2)c(Br)c1 2194607883 CGJLXTLUEASQDB-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE COc1ccc(Br)c(CN[C@H](C(=O)O)C2COC2)c1O 2236045957 SYEHLFYOVNVOET-NSHDSACASA-N 346.177 1.353 10 10 EDCE COc1ccc(Br)c(CNC[C@H](C)c2nn[nH]n2)c1O 2236048811 IJGIKYIHPJEGFE-ZETCQYMHSA-N 342.197 1.570 10 10 EDCE CC1=NN(c2ccccc2)C(=O)C1=C(C)NCCN1CCOCC1 2294474401 PLLQJUCORDUOPM-UHFFFAOYSA-N 328.416 1.605 10 10 EDCE Nc1ccc(CC(=O)N[C@@H](CCO)COCc2ccccc2)cc1 2303567568 AASRZTQICCLEGP-SFHVURJKSA-N 328.412 1.895 10 10 EDCE CC(C)(C)OC(=O)N1CCN[C@@H](CC(=O)NCc2ccccc2O)C1 2320302265 FAOUGMDPCNECDI-AWEZNQCLSA-N 349.431 1.607 10 10 EDCE C[C@@H](Cn1cncn1)NC(=O)NCc1ccc(N2CCOCC2)cc1 101991044 CBFQGRYGCXSSMN-AWEZNQCLSA-N 344.419 1.003 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)NC3CCCCC3)CC2)cc1 9856994 VKDNYXKZLIWBIW-UHFFFAOYSA-N 345.443 1.793 10 10 EDCE C[C@@H](CO)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 130463270 NFMOEPZKTCZWEZ-LBPRGKRZSA-N 339.411 1.309 10 10 EDCE O=C(O)/C=C/c1ccc(N2CCNC(=O)C2)cc1Br 236466949 WZCUQRDLBSYJTN-DUXPYHPUSA-N 325.162 1.483 10 10 EDCE C/C=C\C[S@@](=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 255365266 JODAQQYDPIKHAF-GYLQWBMOSA-N 336.457 1.669 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@H](C)c3cn[nH]c3)CC2)cc1 273979198 HONGGOMJXQEGRY-CQSZACIVSA-N 343.431 1.418 10 10 EDCE Cc1ccc(CN2C[C@@H](CO)C[C@H](CO)C2)c(O)c1Br 2380813057 BXPNNBUOJAMVHX-RYUDHWBXSA-N 344.249 1.886 10 10 EDCE COC[C@@H](O)CNC(=O)NCc1ccc(N2CCSCC2)cc1 801745827 WQUKLTWDSPEJPW-HNNXBMFYSA-N 339.461 1.046 10 10 EDCE COCCNC(=O)CNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 820004632 DEFXPDLHXORYCS-UHFFFAOYSA-N 343.427 1.515 10 10 EDCE CNC(=O)[C@H]1CN(Cc2cccc3c2CCNC3)c2ccccc2O1 662248806 JUTNDFCGLPBBJU-LJQANCHMSA-N 337.423 1.846 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CCCN(C)C1=O 839922380 SJQQXJOYJUHOIG-YOEHRIQHSA-N 331.460 1.977 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@@H]2CN(C3CC3)C(=O)O2)c1 847456971 RLKGKOHCCCMKRW-ZWNOBZJWSA-N 349.387 1.744 10 10 EDCE Cc1c(NC(=O)NCc2cc(Br)ccc2O)nnn1C 841791743 FFUMLTSEZODKSM-UHFFFAOYSA-N 340.181 1.913 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)/C=C/Cn1cncn1 910559966 YUORADLGJQXYHQ-NFAHFFEMSA-N 327.432 1.956 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@]12CCCN(CC1)C2 911303851 POQCFOWYFJDAIE-IBGZPJMESA-N 346.427 1.770 10 10 EDCE CCn1cnc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1 753070035 ZOSDOWSAYSWKQI-UHFFFAOYSA-N 344.418 1.075 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)c3nc[nH]n3)C2)cc1 854299844 SFMICEFTNXLCLC-VXGBXAGGSA-N 330.392 1.452 10 10 EDCE N[C@@H]1C[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C12CCC2 925489622 ZRZBFCXFJXBEQZ-SJORKVTESA-N 349.500 1.281 10 10 EDCE COCCN(C(=O)C=C1CCNCC1)c1ccc(OC)c(OC)c1 852846683 JQEIRWOEBXGHIQ-UHFFFAOYSA-N 334.416 1.993 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CCN(C3CCC3)C2=O)c1 858604013 YYTKXUSAMAHWID-XHDPSFHLSA-N 332.400 1.983 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C2(N3CCOCC3)CC2)cc1 869143047 VMOQURLIEZBGMK-UHFFFAOYSA-N 347.459 1.455 10 10 EDCE CN1CCC(OCC(=O)NCc2ccc3c(c2)CCCN3C)CC1 931152074 FSYNFEPEHZXJIB-UHFFFAOYSA-N 331.460 1.796 10 10 EDCE Cc1ccc(/C=C2\SC(=S)N(CCN3CCOCC3)C2=O)nc1 761787244 VRVLKTBJTLBONG-UVTDQMKNSA-N 349.481 1.923 10 10 EDCE Oc1cc2c(cc1CNC[C@@]1(O)[C@H]3[C@@H]4C[C@@H]5[C@@H]6C[C@@H]([C@@H]3[C@@H]64)[C@@H]51)OCO2 785546231 ROKNDWMNCXDXFW-XIZDMREUSA-N 341.407 1.719 10 10 EDCE CCNC(=O)C[C@@H]1CCCCN1Cc1cc2c(cc1O)OC[C@@H]2O 789521898 UVDJHVKCFOPFSF-BBRMVZONSA-N 334.416 1.699 10 10 EDCE COC(=O)c1c(CN2CC[C@H](C(N)=O)C2)c2cc(F)ccc2n1C 893872220 VZABQPCPDXNNCU-JTQLQIEISA-N 333.363 1.411 10 10 EDCE COC(=O)[C@H](C[C@H]1CCCO1)NCc1cc(OC)c(OC)cc1O 895865590 TTZYFCFKNSFWBY-OLZOCXBDSA-N 339.388 1.610 10 10 EDCE CO[C@](C)(C(=O)NCc1cc(O)ccc1O)C(=O)OC(C)(C)C 1153884276 BAQLCHCVNRCDNO-MRXNPFEDSA-N 325.361 1.461 10 10 EDCE CS(=O)(=O)Nc1ccc(C(=O)NCc2cccc(O)c2O)cc1 1153792948 WBQVMWLRYDCPHJ-UHFFFAOYSA-N 336.369 1.399 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccc(N2C(=O)CCC2=O)cc1 1181010079 HMYBCKRQADWVCR-UHFFFAOYSA-N 340.335 1.932 10 10 EDCE CO[C@H]1CC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1333344287 YRPZUSRZNRMCIU-IRXDYDNUSA-N 343.427 1.315 10 10 EDCE COc1ccc(CN[C@@H](CN(C)C)C(=O)O)cc1Cn1cccn1 1331998944 QTFFVRPUGAXJRN-HNNXBMFYSA-N 332.404 1.044 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1CCNC(=O)C1)NCc1ccc(OC)c(C)c1 1269390324 LHGAULDKLPELLQ-HZPDHXFCSA-N 347.459 1.514 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C[C@@H]2CCCO2)cc1C 1268302206 VYVXTDXIPVYSEM-CVEARBPZSA-N 336.432 1.139 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@H]2COC(=O)N2)cc1C 1277810181 MEYMIGMHUXPHSV-OCCSQVGLSA-N 335.404 1.049 10 10 EDCE COc1cc(OC)cc(N(C)C(=O)c2ccnc3c2CC(=O)N3)c1 1447744335 RWXIKMGCWZKTRD-UHFFFAOYSA-N 327.340 1.870 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@H]1SC(=N)NC1=O 1467840848 RCVVICZMYRGOLG-SNVBAGLBSA-N 328.390 1.051 10 10 EDCE COCC(=O)N[C@@H](C)C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1701980058 LZNWWWJXCODCFM-WDEREUQCSA-N 349.391 1.509 10 10 EDCE O=C(CCn1cnc2ccccc2c1=O)NCc1cc(O)ccc1O 1558174131 FNDDZECGMCMLLM-UHFFFAOYSA-N 339.351 1.514 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccoc1C1(O)CCOCC1 1639292914 VMFDMRKDEWTDKM-UHFFFAOYSA-N 333.340 1.619 10 10 EDCE Cc1nn(C)c(-n2ccnc2C)c1C(=O)NCc1ccc(O)cc1O 1638355928 BXZAKLJMBLRQML-UHFFFAOYSA-N 341.371 1.564 10 10 EDCE O=C(C[C@@H]1Oc2ccccc2NC1=O)NCc1cc(O)ccc1O 1637123114 WPMXKGNRUREFRU-HNNXBMFYSA-N 328.324 1.504 10 10 EDCE COC(=O)c1cc(C(=O)NCCCSc2nccs2)no1 1632807103 NQRBSEGHTRXOLZ-UHFFFAOYSA-N 327.387 1.830 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H]2CCC(=O)N2C)cc1C 1732356025 ITRJOJKNFCXCPO-XJKSGUPXSA-N 347.459 1.466 10 10 EDCE C[C@@H](NC(=O)[C@@H]1CN(C(=O)C(C)(C)C)CCO1)c1ccccc1O 1643741939 GLHUDAQOLOWEEO-DOMZBBRYSA-N 334.416 1.843 10 10 EDCE Cc1cc(C(=O)N[C@@H]2C[C@H](O)[C@H](O)C2)c(C)n1-c1ccc(F)cc1 1645877814 CTKLIBYSYGIQAZ-AYGBPOKTSA-N 332.375 1.847 10 10 EDCE Cc1cc(C)n(C[C@@H]2CN(Cc3cc4c(cc3O)OCO4)CCO2)n1 152879982 FBMQXSOXLSKKBK-HNNXBMFYSA-N 345.399 1.835 10 10 EDCE COc1cccc(CNN2CCN(C(=O)OC(C)(C)C)CC2)c1O 1941831790 MSIXZTGBZDCMAT-UHFFFAOYSA-N 337.420 1.958 10 10 EDCE CC(=O)N1C[C@H]2C[C@H]1CN2c1ccc(CO)cc1Br 1877064960 TWOSJCDJXJHDED-NWDGAFQWSA-N 325.206 1.751 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2005898492 NRRRWDTUBMABOZ-UCKQBZRPSA-N 336.432 1.801 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@@H]1CCOC1 1985097024 ZRUABHNLVHZXFG-MWLCHTKSSA-N 325.369 1.437 10 10 EDCE C[C@H](NC[C@H](O)CNC(=O)OC(C)(C)C)c1c(O)cccc1O 1985772573 YKQNICVUWGONOY-QWRGUYRKSA-N 326.393 1.634 10 10 EDCE C[C@H](CCNC(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 2015121822 GRVNTZVIWSUHCG-SECBINFHSA-N 340.376 1.837 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)OC[C@H]2C)c(Br)c1 300494034 BQBNBIHVHZPABB-PWSUYJOCSA-N 329.238 1.755 10 10 EDCE COCCN1CCN(c2ccc(CO)cc2Br)CC1=O 2158788896 GFDKWFPILATGIZ-UHFFFAOYSA-N 343.221 1.236 10 10 EDCE CN1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)[C@H]2C[C@@H]21 2168356339 WMUOWMHVTJYIDW-AVGNSLFASA-N 337.221 1.294 10 10 EDCE CNC(=O)c1nn(Cc2cccc(F)c2O)c(C(F)(F)F)c1N 2079261328 LUANPJQDTDQFEA-UHFFFAOYSA-N 332.257 1.737 10 10 EDCE Cn1nccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2060621774 RJGKAETYGGRYGS-CMPLNLGQSA-N 349.395 1.897 10 10 EDCE NC[C@@H]1C[C@@H](O)CN1Cc1cc(Cl)cc(Br)c1O 2060807844 RQWPUCQLWRJSCJ-VHSXEESVSA-N 335.629 1.702 10 10 EDCE O=C(O)C[C@@]1(O)CCN(Cc2ccc(Br)cc2O)C1 2104569711 ITAACIXHXXUZFH-ZDUSSCGKSA-N 330.178 1.566 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213582293 GKJQBRQODIZHEN-UTUOFQBUSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@H]1C(C)(C)COc1nnc(=N)[nH]n1 2213789379 HUGIDAIGAPJZMZ-JTQLQIEISA-N 338.412 1.484 10 10 EDCE N[C@@H]1[C@H]2C[C@@H](CN(Cc3cc(Br)ccc3O)C2)[C@H]1CO 2239326130 LRWXUTPAVGKTEB-SQWGHXPGSA-N 341.249 1.542 10 10 EDCE CNCc1ccc(N2C[C@H]3CCO[C@]3(CO)C2)c(Br)c1 2239802235 XPVRXJHQOMFYFH-DOMZBBRYSA-N 341.249 1.756 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(C(=O)N3CC(N=[N+]=[N-])C3)CO[C@H]1C2 2247350559 ZPPJFHARKLOYFL-ZETOZRRWSA-N 337.380 1.580 10 10 EDCE OC1CNc2ccccc2NCC(O)CNc2ccccc2NC1 59371428 MEZMHOMKWIKBLA-UHFFFAOYSA-N 328.416 1.770 10 10 EDCE CN(Cc1nnc[nH]1)C(=O)c1cccc2c1C(=O)c1ccccc1C2=O 175367834 IZZFZPJNGSRIOT-UHFFFAOYSA-N 346.346 1.852 10 10 EDCE O=C(c1ccc(O)c(O)c1)N1CC(n2cc(Br)cn2)C1 2361658498 KDIYIBFQYYSIFY-UHFFFAOYSA-N 338.161 1.754 10 10 EDCE COCc1cc(CC2(NCc3ccc(OC)cc3O)COC2)no1 72321921 YSXPYACPKDPQEZ-UHFFFAOYSA-N 334.372 1.637 10 10 EDCE COCCC(=O)N1C[C@H]2CN(Cc3ccc(N(C)C)cc3)C[C@@H]2C1 96080894 TUVHSYCHEXMQSS-IAGOWNOFSA-N 331.460 1.679 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@H]4O)c([N+](=O)[O-])c1 249595693 PTCIAUKHTGWFFV-ABLYJAJWSA-N 344.367 1.987 10 10 EDCE CC[C@@](C)(OC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 280160686 BXERRGLAYGIEBN-LJQANCHMSA-N 349.475 1.749 10 10 EDCE CC(C)[C@@]1(CO)CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 377980885 BLLPJDIZHUFHTB-INIZCTEOSA-N 335.360 1.771 10 10 EDCE CN1CCN(Cc2cc(Br)cc(C(=O)O)c2O)CC1 642880400 PVCNWEDRTWDFPU-UHFFFAOYSA-N 329.194 1.600 10 10 EDCE Nc1ccc(OCCON2C(=O)COc3cc(C(=O)O)ccc32)cc1 821300727 YBJJXNSMCMDDOJ-UHFFFAOYSA-N 344.323 1.703 10 10 EDCE O=C(/C=C/Cn1cncn1)N(Cc1ccccc1O)C[C@@H]1CCCO1 901174724 HMCGHOOOHQFSRS-ICFOYXHFSA-N 342.399 1.748 10 10 EDCE CCn1nnc(CN(C)c2ccc(CN)cc2Br)n1 1892990799 DDTMTLQOGDVWII-UHFFFAOYSA-N 325.214 1.551 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@H]2CCN(C)S2(=O)=O)cc1 843532287 XKJFSYCGFXDRCV-OAHLLOKOSA-N 339.461 1.183 10 10 EDCE Cn1ccnc1CN1CCC(C(=O)NCc2ccc(O)cc2O)CC1 910951548 SNWLDBGZETYBPU-UHFFFAOYSA-N 344.415 1.360 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(c2c(O)cc(O)cc2O)C[C@@H]1C(=O)O 1952775798 QPCSPBKJOCGEED-GLEZIHRCSA-N 325.317 1.628 10 10 EDCE CCOC(=O)[C@H]1NC(=O)N([C@@H](C)Cc2ccc(N(C)C)cc2C)C1=O 842263961 BPTZXHGYPRUDNG-WFASDCNBSA-N 347.415 1.476 10 10 EDCE CN(C)c1ccc([C@H](N)CNCc2nc3c(s2)CNCC3)cc1 853246447 KMXCZJBHFUNLGR-CQSZACIVSA-N 331.489 1.644 10 10 EDCE O=C(C=C1CCNCC1)NCc1ccc(N2CCOCC2)c(F)c1 852859793 AOSCDOONUXDZHE-UHFFFAOYSA-N 333.407 1.588 10 10 EDCE CNC(=O)CCCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852185748 SXRZREKJAOWZGO-ZDUSSCGKSA-N 334.420 1.099 10 10 EDCE CCOC(=O)[C@@H]1CCCN(CC(=O)NCc2c(O)cccc2F)C1 928710499 UANMZGNDBKKPRJ-GFCCVEGCSA-N 338.379 1.423 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)C[C@@H]2CO)cc1Br 698118143 XKMGELCTYAXRFF-JLLWLGSASA-N 329.238 1.661 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)Cn3cccn3)C2)cc1 851978622 NSGRILKFCFJBQS-HUUCEWRRSA-N 343.431 1.858 10 10 EDCE COc1cccc(CNS(=O)(=O)c2nc(C)c(C)s2)c1O 751309584 ONRZZTKBFXFQIU-UHFFFAOYSA-N 328.415 1.953 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H]([C@@H](C)O)C3)C2)cc1 854298557 FSQYGRKYYAKCAY-KFWWJZLASA-N 333.432 1.686 10 10 EDCE Cc1ccc(O)c(CNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2cccnc2)c1 862753885 KAOFOYSBUPVXSS-MAUKXSAKSA-N 339.395 1.931 10 10 EDCE COc1ccc(O)c(CN2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1 863641860 DLOXIIPXFMPYJM-WBVHZDCISA-N 347.415 1.158 10 10 EDCE COC(=O)c1cnc(SCc2cn(C[C@@H]3CCOC3)nn2)s1 871673206 GTKDKEOUJBZKMG-VIFPVBQESA-N 340.430 1.850 10 10 EDCE O=S1(=O)CC(CCNCc2cc(Br)ccc2O)C1 786823710 DJEKPQDSEYLJSM-UHFFFAOYSA-N 334.235 1.679 10 10 EDCE C[C@H](NCc1c(O)cccc1Br)c1nnc(O)n1C 895172134 RUJRIGYDKGPCTJ-ZETCQYMHSA-N 327.182 1.840 10 10 EDCE CC1(C)CN(C(=O)c2cc3cc(O)c(O)cc3s2)C[C@@H](CO)O1 897993434 RADCZFRGORJNGX-JTQLQIEISA-N 337.397 1.924 10 10 EDCE NS(=O)(=O)CCNCc1cc(Cl)cc(Br)c1O 708111500 SPWZNPCGTBLGGP-UHFFFAOYSA-N 343.630 1.186 10 10 EDCE COc1cccc(C(=O)NCC(=O)NCc2cc(O)ccc2O)c1 1176747947 GBZMUAWMDVVSTO-UHFFFAOYSA-N 330.340 1.153 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)[C@H]1C[C@H](O)C1 2122887836 NANMZSJHCWDPIJ-NQYJQULFSA-N 327.178 1.394 10 10 EDCE CCOC(=O)[C@@H](C[C@H]1CCCO1)NC(=O)c1ccc(C)c(O)c1O 1177476342 QFWNXTQOJUUTRD-DGCLKSJQSA-N 337.372 1.637 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC[C@H]1CC1(F)F 1328601685 PUCZFNJIGYAPRW-ZDUSSCGKSA-N 339.386 1.839 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC1C[C@@H]2C[C@H]2C1 1332028626 YRJCSRYWBOMRIT-GJZGRUSLSA-N 327.428 1.818 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3COCCO3)CC2)cc1C 1269380326 YXMYRSVPLQXPTR-MRXNPFEDSA-N 334.416 1.157 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)CN2CCOCC2)cc1C 1267979544 GCHSMOMWUCVGSD-HNNXBMFYSA-N 349.475 1.178 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cocc2C)cc1C 1268321723 VASNSGLVWMJPRQ-OAHLLOKOSA-N 332.400 1.786 10 10 EDCE CN(CCC(N)=O)c1ccc(C=CC(=O)O)cc1Br 1911809676 SQOFKAAWPJCHAS-UHFFFAOYSA-N 327.178 1.859 10 10 EDCE NCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2134821299 SHACYTULFLPQGC-WTDIUWLJSA-N 327.222 1.228 10 10 EDCE CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1cc(O)ccc1O 1455357878 WNYNVEKKHLINTC-WBMJQRKESA-N 349.431 1.934 10 10 EDCE C[C@H](NC(=O)[C@H](NC(=O)C1CCCC1)[C@H](C)O)c1ccccc1O 1454817309 JVHGYUFJHDHRKR-MQIPJXDCSA-N 334.416 1.625 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCOC[C@H]2c2ncon2)cc1 1295078449 PEKHHKPIQOHZMS-NSHDSACASA-N 330.304 1.446 10 10 EDCE Cc1ncccc1CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1472278987 JUMBOABFPDZLNF-UHFFFAOYSA-N 349.412 1.440 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CCCN(C(=O)N2CCCC2)C1 1472063494 LGLQTAQQJTUYCP-CYBMUJFWSA-N 347.415 1.642 10 10 EDCE CN1CCN(C(=O)c2ccnc3c2CC(=O)N3)c2ccc(F)cc21 1629125954 RAUGUUQPBLNITM-UHFFFAOYSA-N 326.331 1.812 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2C[C@H]2C(N)=O)cc1C 1717741903 WXSWRFLCRJWGEN-CFVMTHIKSA-N 333.432 1.062 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@H](C)S(C)(=O)=O)cc1C 1491499066 BKSZWXLXOHGPLZ-OLZOCXBDSA-N 342.461 1.031 10 10 EDCE Cc1cn2nc(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc2c(=O)[nH]1 1556157797 JWQVNNAPDRVCLF-VIFPVBQESA-N 342.355 1.103 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@@H]2CCC(=O)N2)C2CC2)cc1C 1723343012 MDXBXPFOPHOQSN-JKSUJKDBSA-N 345.443 1.267 10 10 EDCE COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccc(O)cc1 1567354771 KCOAXPFZTWMQGB-INIZCTEOSA-N 331.324 1.376 10 10 EDCE Cc1c(C(=O)NCc2ccc(O)cc2O)nnn1Cc1ccncc1 1630302025 PLYANXIMCAWLOI-UHFFFAOYSA-N 339.355 1.371 10 10 EDCE CCOc1ccc(N2CCN(CCN3CCOC[C@H]3C)CC2)cc1 1642354210 KEWCSBGNISKRAB-QGZVFWFLSA-N 333.476 1.928 10 10 EDCE C[C@@]1(C(=O)NCc2c(O)cccc2O)Cc2ccccc2C(=O)O1 1645361058 VHBCDTSJGLHNON-SFHVURJKSA-N 327.336 1.886 10 10 EDCE CC(=O)c1cc(F)cc(CN2CC[C@H](CNS(C)(=O)=O)C2)c1O 1660059815 XLCRUFKVGUTYDZ-LLVKDONJSA-N 344.408 1.105 10 10 EDCE O=C(C[C@@H](O)C(Cl)(Cl)Cl)NCc1cc(O)ccc1O 1593880976 AWDOVTLWMDBFPC-SECBINFHSA-N 328.579 1.835 10 10 EDCE O=C(NCCNC(=O)c1ccccc1F)c1cc(O)c(O)c(O)c1 169833531 TZWFDDXZIYWTTJ-UHFFFAOYSA-N 334.303 1.102 10 10 EDCE Nc1ccc(OCCCN2CCC[C@@H](NC(=O)[C@H]3CCCO3)C2)cc1 586064820 LYIDKBXTDHKUKB-SJLPKXTDSA-N 347.459 1.797 10 10 EDCE CC(=O)C(=O)[C@]1(O)CN(C(=O)OC(C)(C)C)[C@]2(CCCOC2)C1 1939683464 HESBWLBTXMFRIK-HZPDHXFCSA-N 327.377 1.066 10 10 EDCE C[C@]1(O)CCN(c2ccc(CO)c(Br)c2)C[C@@]1(C)O 1880703320 NUJPOFUMYOLTHB-UONOGXRCSA-N 330.222 1.654 10 10 EDCE Cn1ncc(C(=O)C(=O)C[C@H]2C[C@H](N)C2)c1NC(=O)OC(C)(C)C 2003166922 KHRKEQOGIYDYGP-MGCOHNPYSA-N 336.392 1.646 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1 1986142176 JSDWLMRJNBGPRF-UHFFFAOYSA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2010402125 MOPYNHVEXRZJLY-VXGBXAGGSA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NCc2ccc(O)cc2O)C1 2011918951 XAELTXNDPAEZRN-UONOGXRCSA-N 338.404 1.558 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCN1C(=O)c1cc(O)c(O)c(O)c1 2015123625 UQPXCYUPVUVDQK-SNVBAGLBSA-N 338.360 1.543 10 10 EDCE Cc1cccc(CNC(=O)[C@H](O)[C@@H](C)NC(=O)OC(C)(C)C)c1O 2024813375 YFCFHCMLGBSXRP-BXUZGUMPSA-N 338.404 1.591 10 10 EDCE CNCc1ccc(N2C[C@@H](O)C[C@H]2CN(C)C)c(Br)c1 300495805 JYOCMGPUVBNUMV-STQMWFEESA-N 342.281 1.670 10 10 EDCE CN(Cc1ccc(Br)cc1O)[C@@H]1COC[C@@H]1C(=O)O 691422898 LMXJRJIHFQHBKS-WDEREUQCSA-N 330.178 1.686 10 10 EDCE Cn1cc(C(=O)Nc2ccc(O)cc2C(=O)O)c(Br)n1 2173189493 PJPSHNUDLALKOO-UHFFFAOYSA-N 340.133 1.839 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)c(Br)c1 2178085177 CXGPSLOCZFIQAO-CGEWXTDFSA-N 341.249 1.912 10 10 EDCE CCCC(=O)N[C@@H]1CCCN(C(=O)c2cnn3c(O)cc(C)nc23)C1 2062512892 FVWHNHNXRBKKLW-GFCCVEGCSA-N 345.403 1.264 10 10 EDCE O=C1NCC2(CCN(Cc3cc(Br)ccc3O)CC2)N1 1203650204 NAQSWDJKFKSPOH-UHFFFAOYSA-N 340.221 1.802 10 10 EDCE COCCNCc1ccc(N2CC=C[C@@H]2CO)cc1Br 2176339735 RTCVXQSCNQHNQF-CQSZACIVSA-N 341.249 1.922 10 10 EDCE Oc1cc2c(cc1CNCCn1cc(Br)nn1)OCO2 2192990299 FQGUZINRMNIKBP-UHFFFAOYSA-N 341.165 1.265 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@H](O)CC2(C)C)c(Br)c1 2188630054 JJWYABRDQZCMML-KGLIPLIRSA-N 343.265 1.879 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CN2CC(=O)Nc1ccc(N)cc1 2044607269 YDJROMQRXIKEMF-CABCVRRESA-N 346.431 1.901 10 10 EDCE CC(C)(C)OC(=O)NC1[C@@H]2CN(CC(=O)Nc3ccc(N)cc3)C[C@@H]12 2045669027 YZCNSZPDSVHWMI-ZIAGYGMSSA-N 346.431 1.662 10 10 EDCE CN(Cc1cc(Br)cc(F)c1O)C[C@@H]1COCCN1 2104241692 MEUCMLHZLVVUID-LLVKDONJSA-N 333.201 1.714 10 10 EDCE COc1ccc(N2CCOC[C@@H](CO)C2)c(OC)c1Br 2234896508 CFEIPJNAXWEMAJ-SNVBAGLBSA-N 346.221 1.911 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-])C(C)(C)O 2250342706 YOECZYHCHIUEJZ-VWYCJHECSA-N 341.412 1.998 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(COc2nnc(=N)[nH]n2)C[C@H]2CC[C@H]1C2 2248372755 FPOSSOLKQVOZHJ-YHAQOWFVSA-N 336.396 1.141 10 10 EDCE CCOC(=O)C[C@@H](C)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2299585408 CKWLQCCHTUBQDG-OAHLLOKOSA-N 346.427 1.994 10 10 EDCE CC(=O)NC[C@@H](C)OC(=O)C=Cc1ccc(N2CCOCC2)cc1 2303807154 XEEBIGMFKBWJID-CQSZACIVSA-N 332.400 1.604 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)C2=COCCO2)C2CC2)cc1C 1266395488 OFSMCPUWRFGBSJ-INIZCTEOSA-N 346.427 1.876 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CC2OCCCO2)cc1C 1268642275 MRNQDVWIILSQPA-CQSZACIVSA-N 336.432 1.751 10 10 EDCE Cc1cc(C(=O)N2CCN(CCO)[C@@H](C)C2)c(C)n1-c1ccccn1 188718571 SBWPNHJKWYDKCR-HNNXBMFYSA-N 342.443 1.628 10 10 EDCE COC(=O)[C@@H]1CCCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 193190195 MXMRTNLLNFTPJB-KRWDZBQOSA-N 347.459 1.739 10 10 EDCE C[C@@H]1CN(Cc2cccc(Br)c2O)C[C@@H](C(N)=O)O1 92007255 BCKBGNOIAWDYMW-KCJUWKMLSA-N 329.194 1.229 10 10 EDCE COc1ccc(N(CC(=O)N[C@H](C)C(=O)N(C)C)[C@@H](C)C2CC2)cc1 252443247 PPDUCUYCHOUHMV-KGLIPLIRSA-N 347.459 1.893 10 10 EDCE NC[C@H]1CCCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255198213 VCRNJSOFBJMAOM-OTIVFRFGSA-N 329.444 1.876 10 10 EDCE CN1C(=O)C[C@H](C(=O)NCc2ccccc2O)[C@@H]1c1cccnc1 265393092 DUOTUBVOJPBFCI-YOEHRIQHSA-N 325.368 1.623 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3CCOC[C@H]3C)CC2)cc1 279801971 DWUANLRHCJYBHL-APWZRJJASA-N 333.476 1.832 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@H](NC(N)=O)C2)cc1 270769198 QJOILQXDWOGPOQ-OAHLLOKOSA-N 326.400 1.977 10 10 EDCE CNCc1ccc(N2CC=C[C@]2(CO)COC)cc1Br 2379882831 JFQDAHHNGMIJQF-HNNXBMFYSA-N 341.249 1.922 10 10 EDCE C[C@H](CN(C)C)N(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2379903757 RWJKXYZYBFGVOO-OQPBUACISA-N 342.237 1.821 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CCCC(=O)N2)c(O)c1Br 2380745874 KZMQRPLWNFEYAO-SNVBAGLBSA-N 341.205 1.748 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3C(=O)NC[C@@H]3C2)cc1Br 723182611 MWUJCQMUZCDPHQ-MWLCHTKSSA-N 339.237 1.683 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@]23[C@@H]4[C@H]5C(=O)[C@H]2[C@@H]2[C@@H]5C[C@@H]4[C@H]23)cc1F 800471133 PGLCMPBFRMYYQX-VUNJHSESSA-N 340.398 1.835 10 10 EDCE CC(=O)C(=O)COC(=O)c1csc(-c2ccc3c(c2)OCCO3)n1 808516303 HDDMOVLQWYSRBA-UHFFFAOYSA-N 347.348 1.896 10 10 EDCE Cc1cc(C(=O)CN2CCNC(=O)CC2)c(C)n1-c1ccc(F)cn1 827675318 RGZMAHLKRMDOMA-UHFFFAOYSA-N 344.390 1.633 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H]2COC[C@H]2C1 828436685 DAGXKKSTWUZZBW-HZPDHXFCSA-N 345.443 1.172 10 10 EDCE CCCn1[nH]ccc1=NC(=O)CN[C@H](C)c1cc(OC)ccc1O 588382565 GKZFWUZDMKVALX-GFCCVEGCSA-N 332.404 1.719 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NCc1cc(Br)cc(C)c1O 826967167 GMDSPHNYSCPYTJ-WCQYABFASA-N 344.205 1.883 10 10 EDCE CO[C@@H](CS(=O)(=O)NCc1ccccc1O)C1CCOCC1 827187947 PBFGYKGXSOGLSY-HNNXBMFYSA-N 329.418 1.253 10 10 EDCE COc1ccccc1[C@H](O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 907272193 FUCCMCCVCNACTL-DIFFPNOSSA-N 331.368 1.887 10 10 EDCE CN(C)c1ccc(CNC(=O)NCCc2nnc3n2CCC3)cc1 749301366 DSNZXBXVKAZXLQ-UHFFFAOYSA-N 328.420 1.332 10 10 EDCE CC(C)(C)OC(=O)N1CCC(=O)[C@H]1[C@@H](N)Cc1ccc(O)c(O)c1 1952911338 RIBVWZFVHPHNGM-XHDPSFHLSA-N 336.388 1.546 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCCCNC3=O)C2)cc1 849225656 YMUDIVJMMNHIIQ-BBRMVZONSA-N 346.431 1.242 10 10 EDCE CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)NCc2c(O)cccc2F)C1 922506629 LYSNHWCXUVLZME-JGGQBBKZSA-N 349.406 1.978 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3[C@H]4CC[C@H]3COC4)C2)cc1 852448650 LJEQXXPXCBFLKG-BPUTZDHNSA-N 331.416 1.847 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NC[C@@H](OC)[C@H]2CCOC2)c1 852440840 VMHSPQMTTBRUJJ-MQIPJXDCSA-N 338.404 1.813 10 10 EDCE COC(=O)CN(CCc1nnc(C)o1)Cc1cc(Cl)ccc1O 929975717 JAPLDLJENGVQSE-UHFFFAOYSA-N 339.779 1.955 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3nnc(C)o3)C2)cc1 852450498 NMKFRQMKTMEVTN-ZDUSSCGKSA-N 345.403 1.807 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)c3cncnc3)C2)cc1 855227079 WDQQBSLQYPGSNN-UKRRQHHQSA-N 326.400 1.984 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](OC)c3cnn(C)c3)C2)cc1 855225440 NHFYXQCONOVADP-PBHICJAKSA-N 344.415 1.511 10 10 EDCE CCc1cccc(CN[C@@H]2CCN(c3ccc4nncn4n3)C2)c1O 862481279 FCWHUTYRZQRKCV-OAHLLOKOSA-N 338.415 1.761 10 10 EDCE Cc1cccc(CN2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1O 863641714 AAKYKFQVZBQCGT-CVEARBPZSA-N 331.416 1.458 10 10 EDCE C[C@H]1COCC[C@H]1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 769259075 QSESOLVOISNKFM-WMLDXEAASA-N 348.443 1.927 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCSC[C@H]2CCO)c1O 774911962 JKFCNPLHQYZVJA-LLVKDONJSA-N 328.390 1.609 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/[C@H]1CCOC1 1138055450 YQWNWXQWPUKNGA-JRCXTIHVSA-N 349.383 1.281 10 10 EDCE NCc1ccc(N2CCC[C@H](NC(N)=O)C2)c(F)c1Br 702152077 WZCWNOGRJVLHLI-VIFPVBQESA-N 345.216 1.684 10 10 EDCE NC(=O)N1CCC(NCc2cc(Br)cc(F)c2O)CC1 715719917 GXRAMCIYTQRPBE-UHFFFAOYSA-N 346.200 1.927 10 10 EDCE COC(=O)[C@@H]1C[C@@H]2Cc3c(Cl)ccc(OC)c3C(=O)[C-]2C(=O)C1=O 1088680879 ANSNNXMNISCOJB-IONNQARKSA-N 349.746 1.609 10 10 EDCE Cn1c(O)nnc1CNC(=O)NCc1cc(Cl)cc(Cl)c1O 1313200871 WTXNCRHDPMRYLR-UHFFFAOYSA-N 346.174 1.533 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1320523337 MLGVHLWOIOFSEJ-KBEGMRNHSA-N 332.444 1.880 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cc3n[nH]c(C)n3)CC2)cc1C 1269411577 LYNZLWOBPYEUAD-UHFFFAOYSA-N 343.431 1.411 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)CNC(=O)C3CC3)C2)cc1C 1266578511 YGSGKKLFXYBJET-WKILWMFISA-N 345.443 1.267 10 10 EDCE COc1ccc(N2CCN(C(=O)Nc3ccc[n+]([O-])c3)CC2)cc1F 1346594393 LLKXTLHLZAEXKS-UHFFFAOYSA-N 346.362 1.822 10 10 EDCE CN1C[C@H](N(C)c2ccc(CN)cc2Br)CCC1=O 2131953559 WBJPTPSHNMWMEU-LLVKDONJSA-N 326.238 1.965 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cccn(C)c2=O)cc1C 1265851711 RBTGIWPYHFXGRZ-CQSZACIVSA-N 343.427 1.610 10 10 EDCE COc1ccc(CN[C@@H]2CCN(C(=O)CNC(C)=O)[C@@H]2C)cc1C 1507271418 OHNMEJVRVVOVDO-CZUORRHYSA-N 333.432 1.219 10 10 EDCE O=C(Cc1c(O)ncnc1O)NCc1c(O)ccc2c1CCCC2 1294869037 JKKHHXQULYSKKU-UHFFFAOYSA-N 329.356 1.331 10 10 EDCE O=C1C[C@H](CNC(=O)N(Cc2ccco2)Cc2ccccc2O)CN1 1478821469 ZEBDXGWITDBNQY-ZDUSSCGKSA-N 343.383 1.833 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)/C=C/c2ccco2)cc1C 1485970911 WPAFAQPSBXFOQB-BVBGJJFLSA-N 344.411 1.877 10 10 EDCE O=C(CCNC(=O)c1cc2cc(O)c(O)cc2s1)Nc1ncc[nH]1 1629379378 HIIWBDFQUBGKHZ-UHFFFAOYSA-N 346.368 1.794 10 10 EDCE CCC(=O)N[C@@H](C)C(=O)N[C@H]1C[C@H](NCc2ccc(OC)c(C)c2)C1 1490894043 YJFPCOVBUUMTTN-BPUTZDHNSA-N 347.459 1.655 10 10 EDCE Nc1ncn(CC(=O)Nc2c(-c3ccccn3)nc3ccccn23)n1 1637107917 JGIJFHIREVNNII-UHFFFAOYSA-N 334.343 1.209 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@H](C)n2cncn2)cc1C 1568988465 OOEDXPDDPXHFKM-ZIAGYGMSSA-N 331.420 1.451 10 10 EDCE COC(=O)C1CC2(C1)C[C@H](NC(=O)c1ccc(C)c(O)c1O)CCO2 1645183970 UCSATAYGKQBSPN-BJCXPLBRSA-N 349.383 1.637 10 10 EDCE NS(=O)(=O)c1cc(C(=O)NCc2ccc3cccnc3c2O)co1 1570533469 DAAYFUIDIXDBHE-UHFFFAOYSA-N 347.352 1.111 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@H]2CCC(=O)N2C)cc1C 1668995367 LUEVNROBTGXCFP-DWTRPJMMSA-N 345.443 1.386 10 10 EDCE CCn1ncc(C(=O)NCC2(NCc3ccc(OC)c(C)c3)CC2)n1 1670777447 YRIPKUMDWHWGKU-UHFFFAOYSA-N 343.431 1.667 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(C(C)=O)C[C@@H]2C)c([N+](=O)[O-])c1 1772897382 HZGQQACIZKEZER-HWPRWLFBSA-N 347.371 1.838 10 10 EDCE Cc1cc(C(=O)N[C@H]2CCC(=O)NC2=O)c(C)n1-c1ccc(F)cc1 153496504 TUDXGMCEHWRLQJ-HNNXBMFYSA-N 343.358 1.768 10 10 EDCE COc1ccc(N2CCN(CCNC[C@H]3COC(C)(C)O3)CC2)cc1 892702265 ADDIXXOYBYAFRT-SFHVURJKSA-N 349.475 1.558 10 10 EDCE COc1ccc(Br)c(CNCC(=O)NC2CC2)c1O 1964538342 QRCCIRCIUBCYFZ-UHFFFAOYSA-N 329.194 1.532 10 10 EDCE O=C(O)C[C@@H]1COCCN1Cc1cc(Br)cc(F)c1O 715770294 OZDBMGQWVXFCGK-SNVBAGLBSA-N 348.168 1.969 10 10 EDCE NCCC1(O)CCN(Cc2cc(Br)ccc2O)CC1 717921299 CQECXTSFELHSGP-UHFFFAOYSA-N 329.238 1.830 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCC(=O)N(C)C3CCCCC3)c2n1 2064584256 NMNQVINQCCYACS-UHFFFAOYSA-N 345.403 1.264 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc(C(=O)C(=O)C[C@H]2C[C@H](N)C2)nc1 2049784716 PIIKLVYVXYXVNG-JOCQHMNTSA-N 347.415 1.986 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H]2CN3C(N)=O)c(Br)c1 2192283633 PDCCHHDTYDDICJ-INTQDDNPSA-N 340.221 1.844 10 10 EDCE Cn1[nH]c(=NCc2cc3c(cc2O)OCO3)cc1Br 2099580291 SOMZHFWOZKRHGI-UHFFFAOYSA-N 326.150 1.651 10 10 EDCE COc1ccc(N2CC[C@@H]2C(=O)O)cc1I 2243014769 IOJJPTYVXSEPNH-SECBINFHSA-N 333.125 1.963 10 10 EDCE CC(=O)C(=O)[C@]1(O)[C@H]2CCC[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C2 2244178334 XHEJEFJABZUXHY-FBBPANFNSA-N 325.405 1.979 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1CC[C@@H](O)CN1C(=O)OC(C)(C)C 2246452974 ZKLWYNSXAKJOLM-VXGBXAGGSA-N 341.412 1.906 10 10 EDCE NCc1cc(F)c(N2C[C@H]3OCC[C@]3(CO)C2)cc1Br 2296392927 RTIGDBDSPKBUNW-ZIAGYGMSSA-N 345.212 1.635 10 10 EDCE Cc1nc(Br)c([C@H](O)[C@H](N)c2ccccc2O)n1C 2337358928 KYXGNRHXDARCEF-ZYHUDNBSSA-N 326.194 1.930 10 10 EDCE COC(=O)[C@@H](C)N1C(=O)/C(=C2\C(=O)Nc3ccccc32)SC1=S 1810212 GRMLJIMPQNOPSF-XQTQKYGKSA-N 348.405 1.772 10 10 EDCE CC(C)NS(=O)(=O)N1CCc2cc(N3CCOCC3)ccc21 62526688 NSHRCRPYJOIQJA-UHFFFAOYSA-N 325.434 1.129 10 10 EDCE CCOC(=O)CN(Cc1ccccc1)C(=O)c1cc(O)nc(O)c1 303437312 JAZHPMHZXMZABD-UHFFFAOYSA-N 330.340 1.698 10 10 EDCE CCOC[C@@H](N)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380761268 FALOGSMCULVJJA-LLVKDONJSA-N 345.237 1.785 10 10 EDCE CN=c1ncnc(N(C)Cc2ccc(C)c(Br)c2O)[nH]1 2381129507 LADMEWOVMGRKRS-UHFFFAOYSA-N 338.209 1.748 10 10 EDCE C[C@H](N)c1ccc(N2CCN3C(=O)NC[C@@H]3C2)cc1Br 723178362 MWUJCQMUZCDPHQ-GXSJLCMTSA-N 339.237 1.683 10 10 EDCE COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CC34CC4)CC2)cc1 817234486 AAGIYTJCXKFXEI-MRXNPFEDSA-N 344.411 1.687 10 10 EDCE CC(C)(C)C(=O)N1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 588404240 DGKMLKMJOKEQRU-ALCCZGGFSA-N 332.400 1.828 10 10 EDCE CC1CCN(c2ccc(CNC(=O)[C@@H]3CN(C)C(=O)N3)cc2)CC1 826861373 FJXAEOCDNNCVGC-INIZCTEOSA-N 330.432 1.563 10 10 EDCE O=C(OCC(=O)N1CCO[C@@H]2CCCC[C@H]21)c1cc(O)cs1 732355119 DGLVODGZOBPFGJ-VXGBXAGGSA-N 325.386 1.781 10 10 EDCE NC(=O)CN1CCN(Cc2cc(-c3ccccc3)ccc2O)CC1=O 839170534 OMFZPLLZDOVHDS-UHFFFAOYSA-N 339.395 1.189 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC(F)(F)C[C@@H]2CO)cc1 839574855 OYQKFHHRPLGHDZ-CQSZACIVSA-N 327.375 1.071 10 10 EDCE CCO[C@@H]1[C@H](C)[C@H]1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 918904823 BNQFQIXNHBHXKD-ZTFGCOKTSA-N 331.460 1.726 10 10 EDCE Cc1cc(N(C)C)ccc1CN[C@H]1CCC[C@@H]1CNS(C)(=O)=O 840942887 LBQIMUWAALUSTA-WBVHZDCISA-N 339.505 1.869 10 10 EDCE CC1(OCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CNC1 843483974 GISISSJMEFECKC-OAHLLOKOSA-N 334.416 1.278 10 10 EDCE C[C@@H](NC(=O)[C@@H](O)C1CCOCC1)c1ccc(N2CCOCC2)cc1 746169282 XTFKIJRXIBELTB-KDOFPFPSSA-N 348.443 1.488 10 10 EDCE Cc1cc(O)c(CNC2CCC3(CC2)NC(=O)NC3=O)c(Cl)c1 840946613 BWHZLELWKJLDAB-UHFFFAOYSA-N 337.807 1.964 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC(O)(CO)CC2)c([N+](=O)[O-])c1 853831472 CQBXVOXLLXRKFP-HWKANZROSA-N 336.344 1.105 10 10 EDCE CNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nn1 853758913 MTZGJBVQHVTZLS-GFCCVEGCSA-N 327.388 1.536 10 10 EDCE COc1cccc(CNCCS(=O)(=O)CC(F)(F)F)c1O 850364030 OZQFOABEFBEWLQ-UHFFFAOYSA-N 327.324 1.468 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H]3CCN[C@H]3C)CC2)cc1F 861703244 GUWVVVDJSPDCEB-SWLSCSKDSA-N 336.411 1.416 10 10 EDCE CO[C@@H]1COCC[C@@H]1CC(=O)NCc1ccc2cccnc2c1O 862026637 VTVRKNYUIASRAT-UKRRQHHQSA-N 330.384 1.998 10 10 EDCE NCCCOCCNC(=O)NCc1cc(Br)ccc1O 861693195 QVHOXZLFFHTSIW-UHFFFAOYSA-N 346.225 1.319 10 10 EDCE CC[C@@H](NC[C@@]12COCCN1C(=O)COC2)c1ccc(F)cc1O 866553796 NXKVEFHSEUIEET-PBHICJAKSA-N 338.379 1.200 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc2c(c1)COB2O 863871711 YNGJDUUPZVUSKT-UHFFFAOYSA-N 338.216 1.633 10 10 EDCE O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)N1Cc2cccc(O)c2C1 871199694 SNQSDQAWOKLSCU-BETUJISGSA-N 328.368 1.410 10 10 EDCE CN1CCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@H]3O)cc2)CC1 889663113 NCXYQJHFGDXKNR-IAGOWNOFSA-N 332.448 1.151 10 10 EDCE COC(OC)C(=O)N1CCN(Cc2c(O)cc(C)cc2Cl)CC1 1462606467 QRDMESGRHPLYEU-UHFFFAOYSA-N 342.823 1.617 10 10 EDCE C[C@H](NC(=O)N[C@@H]1[C@H]2COC[C@H]21)c1ccc(N2CCOCC2)cc1 792920929 GMIJUIZSSWGTMM-KKBVYLPWSA-N 331.416 1.528 10 10 EDCE CN(Cc1cc(Br)cc(F)c1O)[C@@H]1COC[C@H]1C(=O)O 715772064 YAFZDYDUEKGLOY-MWLCHTKSSA-N 348.168 1.825 10 10 EDCE CCN1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)CC1 92774953 CSUCAKDHDDVXKZ-CYBMUJFWSA-N 339.237 1.543 10 10 EDCE Cc1nc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n[nH]1 1313383753 YGJZQBPJXSDICJ-AWEZNQCLSA-N 345.403 1.710 10 10 EDCE CC1(C)CCCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1321547368 PHAXDUJPHFMPDH-UHFFFAOYSA-N 345.443 1.540 10 10 EDCE COc1c(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cnn1C 1325227858 YQCOQYNSOPPQSG-CQSZACIVSA-N 345.399 1.956 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@@H](O)[C@H](O)C2)cc1Br 2132139185 YJQXTPKPSMXJNJ-OWYVNGRQSA-N 329.238 1.661 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2c1nnnn1C[C@@H]1CCCO1 1332958457 PJOFSKITKJJZLG-ZDUSSCGKSA-N 330.392 1.449 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)cc1Br 2133919334 JVRZYXPEVZSIOV-DOERSZECSA-N 328.206 1.404 10 10 EDCE C[C@@H](O)CCN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 219786731 FRMRSMWEURLYNP-JMCQJSRRSA-N 328.210 1.608 10 10 EDCE Cc1conc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1517374515 ZDUPAGBSVRDBRO-AWEZNQCLSA-N 342.399 1.615 10 10 EDCE COC(=O)[C@@H](NC(=O)c1cccc(O)c1O)c1ccc2c(c1)CCO2 1296806904 UDNSDVKXZCTHHZ-HNNXBMFYSA-N 343.335 1.677 10 10 EDCE O=C(O)[C@@]1(CO)CCCN1Cc1c(O)cccc1Br 2136360881 ZFDAHMDLFLRECF-ZDUSSCGKSA-N 330.178 1.566 10 10 EDCE C[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CC[C@H]1N1CCN(C)CC1 1623046836 ZYSWTJIYBXQFTP-GDBMZVCRSA-N 347.459 1.125 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H]3[C@H]2CCCN3CCO)cc1 1558701798 GFPDEHJIUITJOC-HUUCEWRRSA-N 345.403 1.520 10 10 EDCE Cc1[nH]nc(C(=O)NCc2ccc3cccnc3c2O)c1[N+](=O)[O-] 1638573108 JHLAIIPGIRCEKB-UHFFFAOYSA-N 327.300 1.810 10 10 EDCE COCCS(=O)(=O)CC(=O)NCc1c(O)ccc2ccccc12 1639384739 SZDOBBUABPAHPQ-UHFFFAOYSA-N 337.397 1.223 10 10 EDCE O=C(NCc1cccc(Br)c1O)c1ccnc2[nH]nnc12 1634725360 VGMAYCMKFHNGBP-UHFFFAOYSA-N 348.160 1.751 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C1CC1 1721479590 WLCJSDFUCRUCMZ-GFCCVEGCSA-N 331.376 1.884 10 10 EDCE COc1ccc(CNC2CC(CNC(=O)[C@@H](C)NC(C)=O)C2)cc1C 1657169966 CMYZLAILFCFHNK-NVPAJSRCSA-N 347.459 1.513 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H]2CCNC(=O)CC2)cc1C 1662292933 LPXQVTGBDHEWMX-ZBFHGGJFSA-N 347.459 1.514 10 10 EDCE CC(C)OCCN(C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1663341887 ASDGXCVAOXCNJF-UHFFFAOYSA-N 335.408 1.936 10 10 EDCE Cc1nc2ccccc2c(=O)n1CC(=O)NCc1cc(O)ccc1O 1593873620 UGXAUCNOKFZMCU-UHFFFAOYSA-N 339.351 1.433 10 10 EDCE C[C@@H](NC(=O)NCCCn1ccc(O)nc1=O)c1ccccc1O 1684602257 XACIOYFTVKTZDW-LLVKDONJSA-N 332.360 1.105 10 10 EDCE Oc1c(CNCCn2cc(Br)nn2)ccc(F)c1F 1878212676 RBFPFMAMAWPNCX-UHFFFAOYSA-N 333.136 1.814 10 10 EDCE Cn1nnc(Br)c1CNCc1cc2c(cc1O)OCO2 1967834596 MNVAMWYWRQHAQT-UHFFFAOYSA-N 341.165 1.302 10 10 EDCE Cn1nc(C(=O)Nc2ccc(O)cc2C(=O)O)cc1Br 2150482813 VMYJDVQWHYESDM-UHFFFAOYSA-N 340.133 1.839 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2010405877 NDXMCIHYMPDDAJ-QWRGUYRKSA-N 339.396 1.733 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC(N=[N+]=[N-])C2)C[C@@H](O)C1(C)C 2018046545 BELJYXFSDQXNTM-MEBBXXQBSA-N 339.396 1.562 10 10 EDCE CC(C)(C)OC(=O)NC[C@]12CO[C@](C(=O)NCCCN=[N+]=[N-])(C1)C2 2026197586 KAMPIRWDUKEPAZ-GASCZTMLSA-N 339.396 1.877 10 10 EDCE CN(c1ccc(CO)cc1Br)C1CC(S(C)(=O)=O)C1 716096316 LSALUERHHJZNOK-UHFFFAOYSA-N 348.262 1.953 10 10 EDCE CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnn2c(O)cc(C)nc12 2062761881 CAUVTQRYRVZLLV-OLZOCXBDSA-N 329.404 1.442 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CCN2CC(=O)Nc2ccc(N)cc2)C1 2044681504 OAJDTEONTZDLBN-UHFFFAOYSA-N 346.431 1.903 10 10 EDCE C[C@H](O)CN(C[C@@H](C)O)c1ccc(CN)c(Br)c1F 2103484835 OYYSUSBAQGJOHP-DTORHVGOSA-N 335.217 1.615 10 10 EDCE O=C(O)CO[C@H]1CCN(Cc2c(O)cccc2Br)C1 2096820141 JIYGYZHKCYHMMI-VIFPVBQESA-N 330.178 1.830 10 10 EDCE COC[C@@H]1CNCCN1Cc1c(Br)ccc(OC)c1O 2236052769 LOOZNXQZJHWCBR-JTQLQIEISA-N 345.237 1.584 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(C(=O)NCCCN=[N+]=[N-])CO[C@H]1C2 2247348935 VFVVPAOXLPZYGH-ZETOZRRWSA-N 339.396 1.875 10 10 EDCE CN(CC1COC1)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2269769984 YAOXZJWGAPMTJD-LBPRGKRZSA-N 327.178 1.517 10 10 EDCE Cc1cc(=NC=C2C(=O)NC(=O)N(CCc3ccccc3)C2=O)[nH]o1 2296555945 BPDOBSHNRZYZTI-UHFFFAOYSA-N 340.339 1.022 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@]12C[C@](NC(=O)OC(C)(C)C)(CO1)C2 2300532921 CWTLDJVSSPUULK-SHTZXODSSA-N 339.396 1.972 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3[C@H]4CC[C@@H](C4)[C@@H]3N)CC2)cc1 172021442 OTGAQSDCESFFCE-USJZOSNVSA-N 329.444 1.717 10 10 EDCE CC(C)NC(=O)CN[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1266995960 LKOIWWUEACWYGN-NSHDSACASA-N 348.407 1.082 10 10 EDCE O=C(CN1C(=O)/C(=C\c2cccs2)SC1=S)NCCO 210393980 ASTRZBDJBSXOAC-RMKNXTFCSA-N 328.440 1.058 10 10 EDCE CN(C)C(=O)C1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 43784301 YKADALLFTUIRJB-UHFFFAOYSA-N 346.475 1.169 10 10 EDCE Cc1ccc(CN(N=Nc2nonc2N)c2nonc2N)c(C)c1 252597039 COCFXAMJVUWCAE-UHFFFAOYSA-N 329.324 1.939 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cn2cc(C)cn2)cc1C 1266652616 DNWUTFHEBGFXJD-UHFFFAOYSA-N 330.432 1.757 10 10 EDCE CO[C@@H]1CNC[C@@H]1C(=O)NCc1ccc(C)c(Br)c1O 2381139795 BBWFCMAXLJCESB-WDEREUQCSA-N 343.221 1.314 10 10 EDCE Cc1cc(O)c(CN(C)CCN2CCCS2(=O)=O)cc1Cl 824913329 OZVFKFGCSFPTNI-UHFFFAOYSA-N 332.853 1.821 10 10 EDCE Cc1cc(C)nc(O[C@@H]2CCCN(C(=O)c3cc(O)nc(O)c3)C2)n1 585339877 JCNBIVVPRDSHBG-CYBMUJFWSA-N 344.371 1.583 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@H]2CNCCC2(F)F)c1O 903957437 QVSKVMNIWSPONT-SNVBAGLBSA-N 331.319 1.643 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](N)C(F)(F)F)C2)cc1 831752805 FBBOAMCPQHDQBY-GXFFZTMASA-N 331.338 1.527 10 10 EDCE C[C@H](O)CN1CCC(CN(C)C(=O)/C=C\c2ccc(O)c(O)c2)CC1 588406823 RTMFRCSYOOOJGB-SDQPKGBYSA-N 348.443 1.662 10 10 EDCE COC(=O)[C@@H]1C[C@@H](O)CN1Cc1ccc(Br)cc1O 1327880351 FTOWAYNLEIBAIC-MNOVXSKESA-N 330.178 1.263 10 10 EDCE CO[C@H](c1cc(O)nc(O)c1)[C@@H](NC(=O)OC(C)(C)C)C(=O)O 1952776412 UMURSTAOPISXQJ-GHMZBOCLSA-N 328.321 1.158 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)[C@H]2CCCc3n[nH]cc32)cc1 843299534 XJVZYFJGJPVCJZ-HOCLYGCPSA-N 327.432 1.712 10 10 EDCE Cn1cnnc1N1CCN(Cc2cc(Cl)c(F)cc2O)CC1 848926522 RNVUERMGGBIICJ-UHFFFAOYSA-N 325.775 1.635 10 10 EDCE O=C(NCC12CC(CN1)C2)N(Cc1ccccc1O)C[C@@H]1CCCO1 851676902 KQUNQHJZWHMZQF-RCDNUKIMSA-N 345.443 1.835 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCn3c(CO)nnc3C2)c1O 750053045 JGIJNDNEPAJZHW-UHFFFAOYSA-N 336.779 1.348 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3[C@H](C)O[C@H](C)[C@@H]3C)nc12 859827995 VMKPJVUPPFZVBN-DDIVZENXSA-N 348.403 1.513 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccnc(OC)n3)CC2)cc1 929250911 RQJZMKGVWGCZHF-UHFFFAOYSA-N 328.372 1.456 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NOCCSC)C2)cc1 852294710 HIWFXRIKBZPHCD-LBPRGKRZSA-N 325.434 1.868 10 10 EDCE COc1cc(O)c(CN(C)C[C@@H]2CCS(=O)(=O)C2)cc1OC 768445169 GAURYVZLUMRCES-NSHDSACASA-N 329.418 1.276 10 10 EDCE COC(=O)c1cnc(SCc2cn(C[C@H]3CCOC3)nn2)s1 871673205 GTKDKEOUJBZKMG-SECBINFHSA-N 340.430 1.850 10 10 EDCE CN1C[C@H](NCc2cc(Cl)cc(Br)c2O)C(=O)N1 708196126 GHNZQIJHMWJORF-VIFPVBQESA-N 334.601 1.243 10 10 EDCE CN(CC(=O)c1ccc(O)c(O)c1)C[C@@H](O)COCc1ccccc1 1916357165 HEJAGIHOBPKFRA-MRXNPFEDSA-N 345.395 1.790 10 10 EDCE COc1cccc(C2=NO[C@@H](C(=O)NCc3cccc(O)c3O)C2)c1 1176566489 YJMNZKCBIZOPCI-MRXNPFEDSA-N 342.351 1.916 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC3=C(CCC(=O)N3)C2)cc1F 1327696784 CLNSLPDHQPAPOW-UHFFFAOYSA-N 346.406 1.971 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@@H]2CC2(F)F)cc1F 1347940209 GWPQPHDKWMDRGR-LLVKDONJSA-N 343.349 1.669 10 10 EDCE CN1CCCc2cc(CNC(=O)c3cn4c(n3)COCC4)ccc21 1351692688 HZSIQHSLIKUQSO-UHFFFAOYSA-N 326.400 1.726 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)CC(C)C)cc(OC)n1 1287553302 HSAVJRYPPPTUFN-LBPRGKRZSA-N 337.420 1.722 10 10 EDCE CN1CCN(c2ccc(CNC(=O)c3cc(F)cnc3O)cc2)CC1 1455226945 SWRRPXXUKYAJRA-UHFFFAOYSA-N 344.390 1.608 10 10 EDCE CC[C@@H](F)C(=O)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1535555498 KHUFNUFGCRGHKA-GFCCVEGCSA-N 349.366 1.976 10 10 EDCE CN(Cc1ncnn1CC(F)F)C(=O)c1c(F)ccc(O)c1O 1611237073 CVZJJLAWZWNQFB-UHFFFAOYSA-N 330.266 1.366 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)cc1Br 2136828195 ICLIFKPBUMNJJJ-FZQKWOKYSA-N 329.238 1.791 10 10 EDCE COc1cc(OC)c(C(=O)NCc2cccc(O)c2O)cc1C=O 1558160874 BMHAGLVAWYGXAA-UHFFFAOYSA-N 331.324 1.858 10 10 EDCE CCNC(=O)CC(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)[C@H]1C 1717790706 LWQGKDDWSRMEQB-ZBFHGGJFSA-N 347.459 1.609 10 10 EDCE NC(=O)N[C@@H](CC(=O)NCc1cccc(O)c1O)c1ccccc1 1633508175 LHDWZFDUDBOXBH-ZDUSSCGKSA-N 329.356 1.514 10 10 EDCE CC[C@H](NCC(=O)NCCOC)c1cc(Br)ccc1O 228694660 HRNYWKQRUSOFMX-LBPRGKRZSA-N 345.237 1.958 10 10 EDCE Cn1ncnc1CCCNC(=O)c1cc2cc(O)c(O)cc2s1 1640052383 UMMGNIWTUNYROP-UHFFFAOYSA-N 332.385 1.804 10 10 EDCE O=C(NC1(c2nn[nH]n2)CCC1)c1cc2cc(O)c(O)cc2s1 1644748587 PADSKSOJJFXWRA-UHFFFAOYSA-N 331.357 1.635 10 10 EDCE CCN[C@@H](C)c1ccc(N2C[C@H](O)[C@H](O)C2)c(Br)c1 233574826 PDEPYYSVCPJBBV-QCZZGDTMSA-N 329.238 1.661 10 10 EDCE CC[C@@H]1C(=O)NC(=O)CN1c1ccc([C@H](C)N)c(Br)c1 234072829 CJTZNWGKOIHQJE-QPUJVOFHSA-N 340.221 1.710 10 10 EDCE OC[C@@H]1COCCN1c1ccc(CNC2CC2)c(Br)c1 236494962 DFMZLPSEPKILMJ-CQSZACIVSA-N 341.249 1.899 10 10 EDCE CN1CCN(c2ccc(CNC(=O)NCC[C@@H]3CCNC3)cc2)CC1 891997902 AUUZMPMMKJCAOQ-KRWDZBQOSA-N 345.491 1.237 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](OCC(N)=O)C2)c(Br)c1 2145376097 XCSRYKLXFBYGKS-MWLCHTKSSA-N 342.237 1.549 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCO[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985094831 UYTUTRCRSKAORI-GXSJLCMTSA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)C1 2011940099 VGZYNYSTFVOYPH-ABAIWWIYSA-N 339.396 1.517 10 10 EDCE COC1(CO)CN(c2ccc(CNC3CC3)c(Br)c2)C1 2157297736 XKJKBRYUKOVHOM-UHFFFAOYSA-N 341.249 1.899 10 10 EDCE CN(C)C[C@H](CO)NCc1cc(Cl)cc(Br)c1O 708056830 PYTURUDWVFLKSZ-SNVBAGLBSA-N 337.645 1.820 10 10 EDCE O=C(C[C@]1(O)CCOC1)Nc1c(-c2ccccn2)nc2ccccn12 2064148847 MFVRZSFKZQBHLO-GOSISDBHSA-N 338.367 1.876 10 10 EDCE Cc1cnn(Cc2c(O)cc(O)cc2O)c1I 2070203469 LMQRYUZOAMEVCU-UHFFFAOYSA-N 346.124 1.961 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@H](O)CC2(C)C)cc1Br 2188639481 ZLEHZMRSVSMGPV-ZIAGYGMSSA-N 343.265 1.879 10 10 EDCE O=C1CO[C@H]2CCN(c3ccc(CO)cc3Br)C[C@@H]2N1 2185523848 ZFCXWJQMDHBEHP-AAEUAGOBSA-N 341.205 1.035 10 10 EDCE C[P@]1(=O)C[C@H](O)[C@@H](NCc2cccc(Br)c2O)C1 2057720681 PIDWYIJCCLHINO-LDLUMPKVSA-N 334.150 1.980 10 10 EDCE CC1(C)[C@H](CO)OCCN1c1ccc(CO)cc1Br 2103400530 KUNXAWVPFYPYEB-ZDUSSCGKSA-N 330.222 1.918 10 10 EDCE CN[C@H](c1ccccc1O)[C@H](O)c1c(Br)nnn1C 2091867680 NOGCCNHLYGYYIN-KOLCDFICSA-N 327.182 1.277 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C[C@H](O)C1 2213587628 JSVWLSSTQBRDNY-OZWUEAAUSA-N 339.396 1.752 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@@]1(COc1nnc(=N)[nH]n1)C2 2213784173 YWHCVVCOVMLLBL-FCHSOHFDSA-N 336.396 1.141 10 10 EDCE CN[C@H](c1ccccc1O)[C@@](O)(CF)CNC(=O)OC(C)(C)C 2242773599 WAJWZEAKTYPQIW-CZUORRHYSA-N 328.384 1.878 10 10 EDCE O=C(O)[C@H]1CC[C@H](O)CN1Cc1cc(Br)cc(F)c1O 2279185453 DQZWDVHJXTZVDO-GXSJLCMTSA-N 348.168 1.704 10 10 EDCE O=C1NC(=O)N(C2CCCC2)C(=O)C1=Cc1ccc(C(=O)O)cc1 2297620091 KSHWKZWBUFFCAD-UHFFFAOYSA-N 328.324 1.789 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(CC(F)(F)F)CC1 2307987621 ZCRSJSRMLFWNCL-UHFFFAOYSA-N 330.306 1.818 10 10 EDCE O=C(O)[C@@H](Cc1cnc[nH]1)N1C(=O)C(=Cc2ccc[nH]2)SC1=S 2323718574 DFNBQOGLVLVLSQ-SNVBAGLBSA-N 348.409 1.635 10 10 EDCE Cc1ccc(CN2CCO[C@H]3CNC[C@H]32)c(O)c1Br 2352940783 IFICGUJUXKUDNF-NEPJUHHUSA-N 327.222 1.636 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC2C[C@@H]3CC[C@H](C2)S3)cc1 1340445460 KPYXNAQWLFCXPM-VHRNVKJDSA-N 347.484 1.912 10 10 EDCE Cc1noc([C@@H](C)N2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)n1 171590832 XQYDKPPPRSPFAJ-LLVKDONJSA-N 347.375 1.871 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)CCN2CCCC2)c1 189649402 OTWUYKNUQGFQIJ-LBPRGKRZSA-N 328.434 1.477 10 10 EDCE C[C@@H](NC[C@@]1(CO)COCC2(CCC2)N1C)c1cc(F)ccc1O 527954921 NABOOSJHOHGGOK-FZKQIMNGSA-N 338.423 1.798 10 10 EDCE CC(=O)N1CC[C@@H](OC(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255058668 OENSXSYDMPWMPH-NCRRVARUSA-N 344.411 1.700 10 10 EDCE Cc1ccc(CN2CCN(C)C[C@@H]2C(=N)N)c(O)c1Br 2380807264 SLUVLQDNDLJMDU-LLVKDONJSA-N 341.253 1.515 10 10 EDCE CC[C@@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 817877804 DTPIBKFLRWALKS-NVXWUHKLSA-N 347.459 1.785 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)C(C)(C)C)C2)cc1 829763401 PBDCYLNYYWDUFV-KGLIPLIRSA-N 347.459 1.941 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C1C[C@H]2CNC[C@@H](C1)C2=O 825942920 PCCMVISVHJQMSN-MQVJKMGUSA-N 329.444 1.526 10 10 EDCE CN1CC[C@H](NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1=O 588563136 DZVHZYZOTLDIFR-OUOZUETKSA-N 343.427 1.273 10 10 EDCE C[C@@H](NC(=O)C(=O)N[C@@H]1CC[C@H](C(=O)O)C1)c1ccc(N(C)C)cc1 843256796 HYPWVWQBFKIJIC-KWCYVHTRSA-N 347.415 1.299 10 10 EDCE COC(=O)[C@@]1(OC)CCN(Cc2cc(F)cc(C(C)=O)c2O)C1 859558955 SWQHWHGCRRCIED-MRXNPFEDSA-N 325.336 1.498 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cn4c(n3)CCC4)C2)cc1 855222915 CYTOZSJQFDEUTC-CYBMUJFWSA-N 326.400 1.847 10 10 EDCE CN(C1CC1)S(=O)(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 751121521 XCNLQBVBTQAJFY-HNNXBMFYSA-N 340.445 1.712 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CC[C@H]3C[C@H]3C2)c1 862374717 PSZSRGKSVAGTIJ-GRYCIOLGSA-N 338.429 1.930 10 10 EDCE NC(=O)[C@@H]1CC[C@H](CCC(=O)NCc2ccc(N3CCCC3)cc2)O1 864863987 UPCNTVGNKNXQBA-SJORKVTESA-N 345.443 1.716 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1ccnn1C 767477785 ILOJRZHRSCAKSX-UHFFFAOYSA-N 328.416 1.458 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@H]3CC3(C)C)C2)cc1 1118683378 WOMCBLZEBZOGJE-ZIAGYGMSSA-N 345.443 1.552 10 10 EDCE Oc1c(F)cc(Br)cc1CNCC[C@]1(O)CCOC1 715771981 XBOAPWWFLYVMRK-ZDUSSCGKSA-N 334.185 1.925 10 10 EDCE C[C@@H](NC(=O)CCc1nc(O)c2cnn(C)c2n1)c1ccccc1O 1151886079 UGWMPARRBAQCNU-SNVBAGLBSA-N 341.371 1.585 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 1153879637 SIIHYLKIKPVPHJ-GFCCVEGCSA-N 344.342 1.906 10 10 EDCE CN(C)CC[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1cccnc1 1303874449 WOJNFECBIVXZGU-OAHLLOKOSA-N 329.400 1.845 10 10 EDCE CS(=O)(=O)N1CCC[C@@H]1C(=O)NCc1c(O)ccc2ccccc12 1304089760 KTCDAGQIOQOHQK-OAHLLOKOSA-N 348.424 1.586 10 10 EDCE CN(CCNCc1cncn1C)C(=O)c1ccc(N=NC(N)=O)cc1 1317664682 HMJSAKVCNXLZOF-UHFFFAOYSA-N 343.391 1.444 10 10 EDCE O=C(C[C@@H]1Oc2ccccc2NC1=O)NCc1c(O)cccc1O 1178905294 KRSRRWPHTRIHHZ-HNNXBMFYSA-N 328.324 1.504 10 10 EDCE COC(=O)[C@@]1(N2CCN(Cc3cc(C)c(C)cc3O)CC2)CCOC1 1329067769 PKSJEBZITNPMOD-LJQANCHMSA-N 348.443 1.459 10 10 EDCE COCc1nocc1C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1328439676 RQEIVYTWZORQBC-LBPRGKRZSA-N 331.372 1.838 10 10 EDCE NCc1ccc(N2CC[C@@]3(CNC(=O)N3)C2)c(Br)c1 2121212339 ZNFBLTJPHHVFQW-CYBMUJFWSA-N 325.210 1.170 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@H]2CCNC2=O)cc1C 1268691294 SNSNPIYKPVDYJI-DZGCQCFKSA-N 333.432 1.124 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1COC[C@H]1NC(=O)OC(C)(C)C 1900606979 ITJFQGXHRMSWMP-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE C[C@@H](O)CNC[C@@H]1CCCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1505412252 YTQNYJUPSFIJMZ-DOMZBBRYSA-N 347.419 1.814 10 10 EDCE COc1cc(OC)nc(C(=O)Nc2c(Cl)ccc3nonc23)n1 1436137935 METAMYMVWRCSMU-UHFFFAOYSA-N 335.707 1.936 10 10 EDCE CN(C)C(=O)/C=C/C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1456937212 VBNDHNVMPBAYRN-LPQFERQCSA-N 332.448 1.116 10 10 EDCE O=C(NCc1cccc(-n2cncn2)c1)c1c(F)ccc(O)c1O 1457662556 UVWDMQVTCUKTAH-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(NCc2ccc(F)c(F)c2O)C1 1918545826 JQMQGKJXYBYCPX-UHFFFAOYSA-N 344.358 1.742 10 10 EDCE CC[C@@H]1C[C@H]1C(=O)N(C)C[C@@H](O)CNCc1ccc(OC)c(C)c1 1700953000 BDZZRCNLULBUHU-IXDOHACOSA-N 334.460 1.959 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CN2CCCCC2=O)cc1C 1713320555 AXJHUYZOUFSZMW-OAHLLOKOSA-N 347.459 1.610 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccc(F)nc2)cc1C 1485982274 KBAPVNBXARABAS-OAHLLOKOSA-N 347.390 1.418 10 10 EDCE COc1ccc(-n2nnnc2CN[C@H](C)[C@@H](C)NC(=O)C2CC2)cc1 1717395585 NSIAINVXNFENHT-VXGBXAGGSA-N 344.419 1.064 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@H](CO)[C@@H]3C)C2)cc1 1564962839 PHOQHGQBWSBESX-ARFHVFGLSA-N 347.459 1.934 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCNC(N)=O)c1 1631253741 WQOBKCJBZQYWCU-UHFFFAOYSA-N 328.372 1.305 10 10 EDCE CN(Cc1ccccc1O)C(=O)Cn1nnnc1-c1ccsc1 1631151777 UVMFFAIIILXMGK-UHFFFAOYSA-N 329.385 1.766 10 10 EDCE Cn1cc(-c2ncccc2C(=O)NCCc2ccc(O)c(O)c2)cn1 1631509927 HJTSICQKRDLCNM-UHFFFAOYSA-N 338.367 1.866 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC(N2CCCCC2=O)CC1 1650864776 NSUSDOZHOAXZAL-UHFFFAOYSA-N 336.363 1.854 10 10 EDCE C[C@@H]1Cc2n[nH]cc2CN(CC(=O)NCc2ccc(N(C)C)cc2)C1 1654791980 YHHBJJBQWLNZJC-CQSZACIVSA-N 341.459 1.786 10 10 EDCE COC(=O)Cc1csc(NC(=O)CN[C@@H](C)c2ccccc2O)n1 1655349303 GPPKXYAQXCFTFK-JTQLQIEISA-N 349.412 1.854 10 10 EDCE CSCC(=O)N[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1687166682 AVJOMBMRUXFOEP-GFCCVEGCSA-N 349.416 1.543 10 10 EDCE CO[C@H](CNCc1ccc(O)c(O)c1)CNC(=O)OC(C)(C)C 1901545603 DFIUMZLVAQLBQY-GFCCVEGCSA-N 326.393 1.727 10 10 EDCE CN(C[C@@H](O)COc1ccc(N)cc1)CC1(Br)CC1 1887873202 JTRVIOXAJISQSU-GFCCVEGCSA-N 329.238 1.868 10 10 EDCE O=C(O)[C@@]1(O)CCCN(Cc2ccc(Br)cc2O)C1 1964721229 ALQDSSSUDAWZMZ-CYBMUJFWSA-N 330.178 1.566 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CNC(=O)Nc2ccc(N)cc2)C1 1999159172 VXXUFUWVNCBINO-UHFFFAOYSA-N 336.392 1.372 10 10 EDCE Oc1cccc(F)c1CN=c1[nH]ccnc1I 2008700936 GQWIGISMBLUWOM-UHFFFAOYSA-N 345.115 1.960 10 10 EDCE NCc1ccc(N2CCC(O)(CO)CC2)c(F)c1Br 313659059 ONPXSZRZZHAEMS-UHFFFAOYSA-N 333.201 1.371 10 10 EDCE O=C(NCc1c(O)cc(O)cc1O)[C@@H]1CCCN(CC(F)F)C1 2062463191 ZOMWANAJZHLZPX-SECBINFHSA-N 330.331 1.397 10 10 EDCE CC[C@@H](NC(=O)c1cnn2c(O)cc(C)nc12)[C@H](O)C(F)(F)F 2064293998 ZAZANMINRSLDAH-SCZZXKLOSA-N 332.282 1.175 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1 2076777307 CLFJHQNEZRDMSZ-SFHVURJKSA-N 349.431 1.599 10 10 EDCE N[C@@H]1CN(Cc2cc(Br)cc(F)c2O)[C@H]2COC[C@H]12 2102138791 XLHVQBSMTDMYCC-JLLWLGSASA-N 331.185 1.452 10 10 EDCE C[C@@H](O)CN(C[C@@H](C)O)c1cc(Br)c(CN)cc1F 2103485412 VCJPEGHTWWKJGC-RKDXNWHRSA-N 335.217 1.615 10 10 EDCE NCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@H]32)c(Br)c1 2090540589 COFZHOVPCTVPCZ-ZLKJLUDKSA-N 327.222 1.636 10 10 EDCE C[C@@H]1CC[C@@H](C(N)=O)CN1c1ccc(CN)c(Br)c1 228150158 YRYTZAKKTYWHBX-MWLCHTKSSA-N 326.238 1.998 10 10 EDCE CN(CCn1cncn1)c1ccc(CN)c(Br)c1F 2113773553 CAYCUTXRIDFLAF-UHFFFAOYSA-N 328.189 1.775 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CCC2)C[C@@H]1COc1nnc(=N)[nH]n1 2213785626 OOZPHRFPPPGOFF-SNVBAGLBSA-N 336.396 1.238 10 10 EDCE COC(=O)CN1C(=O)NC(=Cc2ccc(N3CCCC3)cc2)C1=O 2294371424 YAVUFILUCKCKAS-UHFFFAOYSA-N 329.356 1.353 10 10 EDCE COC(=O)CN1C(=O)C(=Cc2ccc(O)c(OC)c2)SC1=S 2293039612 SQRXHNXWBTUUJP-UHFFFAOYSA-N 339.394 1.775 10 10 EDCE O=C1NC(=O)N(C2CCCCCC2)C(=O)C1=CNCc1cccnc1 2296938946 XQMKLBLSIYVMEB-UHFFFAOYSA-N 342.399 1.856 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N(C)c2ccc(OC)cn2)c1 492644300 SKZNTYVQTGYXKI-DAXSKMNVSA-N 326.356 1.521 10 10 EDCE CC(C)OCCN1CCN(C(=O)C=Cc2ccc(O)c(O)c2)CC1 2307989803 LDYYDGREETXKKD-UHFFFAOYSA-N 334.416 1.680 10 10 EDCE O=C(O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccsc2)SC1=S 2318683559 HMHFQQOHQDQSLK-ZETCQYMHSA-N 343.407 1.877 10 10 EDCE Cc1ccc(CN2C(=O)CCCS2(=O)=O)c(O)c1Br 2352943763 YEVSGVYXLGORKR-UHFFFAOYSA-N 348.218 1.915 10 10 EDCE C[C@@H](NCC1CN(S(C)(=O)=O)C1)c1cc2c(cc1O)CCCC2 187817878 ARTQHAKDDWGBPZ-GFCCVEGCSA-N 338.473 1.813 10 10 EDCE O=C(c1cc(Br)n[nH]1)N1CCc2cc(O)c(O)cc2C1 2366851624 YMGITOSYOUNVBW-UHFFFAOYSA-N 338.161 1.782 10 10 EDCE CC(C)[C@@H](CO)N(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2367104929 WKZFKCTUNPVVSQ-OLZOCXBDSA-N 343.221 1.888 10 10 EDCE CC[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@@]2(CCOC2)O1 366525093 WCVKVTWSTQLXCR-DBTGMAAUSA-N 333.384 1.908 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CCOC[C@@H]2N)c(O)c1Br 2380745240 HWAZIVWFOJWZMJ-QWRGUYRKSA-N 343.221 1.443 10 10 EDCE CO[C@]1(CN[C@@H](C)c2cc(Cl)ccc2O)CCS(=O)(=O)C1 903365807 QLFKMZPFWFQJTF-HZMBPMFUSA-N 333.837 1.900 10 10 EDCE CN1CCCc2cc(CNC(=O)c3coc(S(C)(=O)=O)c3)ccc21 844358393 WTBIBNAJJJIIPP-UHFFFAOYSA-N 348.424 1.996 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCC3=CCNCC3)C2)cc1 851666529 HQDHBEDYDLEDTK-INIZCTEOSA-N 344.459 1.883 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCn4cnnc4C3)C2)cc1 854302033 WWTUVMSLBNWKFI-CYBMUJFWSA-N 342.403 1.091 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1(N2CCOCC2)CC1 868889008 GFSSEUTVHJVZHS-MRXNPFEDSA-N 345.487 1.973 10 10 EDCE CN(C)c1cc(F)c(CN2CCC[C@@H]2CS(N)(=O)=O)cc1F 862245322 NBSYTWGYIVWJRR-LLVKDONJSA-N 333.404 1.284 10 10 EDCE CCOC(=O)C[C@H]1CCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1118939610 DNDIFMNUOBAGKE-CYBMUJFWSA-N 346.383 1.179 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CO[C@@H](CCC(=O)OC(C)(C)C)C1 884995671 YKZAOCNAGGWMPW-RYUDHWBXSA-N 328.361 1.215 10 10 EDCE CC[C@@H](NC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)O 780477498 AQRFXSPJRQESQR-IUODEOHRSA-N 335.404 1.747 10 10 EDCE O[C@@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)CC(F)(F)C1 787438071 GVBROTCNGQSIAV-ZDUSSCGKSA-N 330.350 1.864 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CS(=O)(=O)N(C)C 785371615 ULIQVMQCMISUPO-UHFFFAOYSA-N 341.477 1.381 10 10 EDCE Cc1cc(Br)c(O)c(CNC[C@H](C)S(C)(=O)=O)c1 781636160 OGBSOBMTNCMGQS-VIFPVBQESA-N 336.251 1.986 10 10 EDCE CC1(C)CNC(=O)c2c(C(=O)NCc3ccc(O)c(O)c3)coc2C1 1137443426 PDBLLVYGAPARJK-UHFFFAOYSA-N 344.367 1.933 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1cc(S(N)(=O)=O)ccc1O 1137345486 KYIMHAYWGVQWTB-UHFFFAOYSA-N 336.369 1.017 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H](CO)C[C@H](O)c1ccccc1 1153511052 ASDGPNKFTSHQPA-HOCLYGCPSA-N 331.368 1.241 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@](C)(C(F)F)C1 1327631723 JBYZQKJFTQWDNX-INIZCTEOSA-N 342.342 1.233 10 10 EDCE C[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C[C@H]1CCN 1333175764 LLNKWQNOTJCLKW-NVXWUHKLSA-N 334.483 1.994 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1C[C@@H](CCO)[C@@H](CO)C1 1346297753 ZGMJXFCHPLQECV-HZPDHXFCSA-N 335.448 1.193 10 10 EDCE COc1ccc(CNC2CC(N(C)C(=O)CNC(C)=O)C2)cc1C 1508093053 QAFOYENXRRANCB-UHFFFAOYSA-N 333.432 1.219 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)C[C@@H]2CO)cc1Br 2136089149 XFYQCWKKMLWROW-WCQGTBRESA-N 329.238 1.791 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCC(=O)NC(C)C 1511778681 JMZJIRHAZCAXDU-UHFFFAOYSA-N 331.420 1.843 10 10 EDCE CCN(CC)CC[C@H](CO)NC(=O)c1ccc(N=NC(N)=O)cc1 1618205097 OCNFWTYGICPKAT-CQSZACIVSA-N 335.408 1.672 10 10 EDCE CCOC(=O)c1c(NC(=O)[C@H]2C[C@H]2C(N)=O)sc2c1CCCC2 1625374970 GXYVHUJSWHVJNZ-ZJUUUORDSA-N 336.413 1.864 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)Cc2nc[nH]n2)cc1C 1485001062 RHBFWYRFGGGLLL-ZDUSSCGKSA-N 331.420 1.349 10 10 EDCE COCC[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)C(=O)OC 1629193464 HHNMNWGZDXQHJU-VIFPVBQESA-N 339.369 1.620 10 10 EDCE O=Cc1ccc(OCC(=O)NCc2ccc(O)cc2O)c([N+](=O)[O-])c1 1639444680 VTAAFFVUNVQMRA-UHFFFAOYSA-N 346.295 1.514 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@]2(C)CCNC2=O)cc1C 1725509490 XOUMAWIYZUXUEK-LIRRHRJNSA-N 347.459 1.466 10 10 EDCE CC[C@@H](CNC(=O)C(=O)NCC1CC1)NCc1ccc(OC)c(C)c1 1495079825 LCFHNXHUVZRXON-INIZCTEOSA-N 347.459 1.514 10 10 EDCE Cn1cc(-c2nn(C)cc2C(=O)NCc2ccc(O)cc2O)cn1 1639444597 RHEVEPLTNUXKGG-UHFFFAOYSA-N 327.344 1.162 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2c(C)ccn2C)cc1C 1496972687 XJTUKWSZRVHTRE-INIZCTEOSA-N 345.443 1.531 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H]2CCCCN2C)cc1C 1568575097 RNWUVPGVUZWYDE-SJORKVTESA-N 349.475 1.055 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(-n2cncn2)n1 1567467584 MRSDUFWSIBXSQL-LLVKDONJSA-N 339.355 1.435 10 10 EDCE CCCC(=O)NC[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1736058720 HZCIOGUOGJMLME-BJHJDKERSA-N 335.404 1.524 10 10 EDCE C[C@H](O)CN(C)CCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1733781711 PMFKQJJMFFJGED-LBPRGKRZSA-N 335.408 1.624 10 10 EDCE CS(=O)(=O)c1ccc(/C=C/C(=O)NCc2c(O)cccc2F)o1 1646034036 FPVWINSGFRYOCH-FNORWQNLSA-N 339.344 1.857 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCCN(C(C)=O)CC2)c([N+](=O)[O-])c1 1772821497 QMVZULDTXGYDQW-ALCCZGGFSA-N 347.371 1.840 10 10 EDCE N[C@@H](CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(=O)O 1865998388 KUCRFXSYZGDAFK-LBPRGKRZSA-N 338.319 1.203 10 10 EDCE CC[C@@](COC)(NC(=O)OC(C)(C)C)C(=O)N1CC(N=[N+]=[N-])C1 1985103517 WMYCBAYLUNBTKF-AWEZNQCLSA-N 327.385 1.827 10 10 EDCE O=C1Nc2cc(N3C[C@H]4CO[C@@H](C4)C3)c(Br)cc2[C@H]1O 2152270654 VCVVTFGZRCCRAA-UVPNAGLESA-N 339.189 1.660 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CCCOC1 2010393917 ZEJBEHYIEIDONB-IAQYHMDHSA-N 339.396 1.972 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1cccnc1 2022926048 HXWZGEIZVRLOFL-KGLIPLIRSA-N 333.388 1.629 10 10 EDCE CS(=O)(=O)N[C@@H]1CCN(Cc2c(O)cccc2Br)C1 707134136 FXEXNGCOYWZSOR-SECBINFHSA-N 349.250 1.278 10 10 EDCE COc1ccc(N2CC[C@H](N)[C@H](CO)C2)c(OC)c1Br 2178907262 OZQPASHLZHIRIV-UWVGGRQHSA-N 345.237 1.612 10 10 EDCE O=C(O)C1(O)CCN(Cc2cc(Br)cc(F)c2O)CC1 2197435301 UPDWBWNIDKDBJL-UHFFFAOYSA-N 348.168 1.705 10 10 EDCE Cc1cn(CCNCc2cc(Br)cc(F)c2O)nn1 2094301259 KSJKUHPRJKKEMN-UHFFFAOYSA-N 329.173 1.984 10 10 EDCE C[C@@](O)(CO)[C@H]1CCN(c2cc(Br)c(CN)cc2F)C1 2202841337 SUMAWKFOVTWPFG-IINYFYTJSA-N 347.228 1.617 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2225798915 IJCLBQVGKAQAQM-JGVFFNPUSA-N 349.214 1.692 10 10 EDCE COc1ccc(Br)c(CN(C)C[C@H]2COCCN2)c1O 2236053600 XCPOOUDSTWHISC-JTQLQIEISA-N 345.237 1.584 10 10 EDCE C[C@]1(CO)C=CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2237170898 MLPNCEHXFJMXTI-GXTWGEPZSA-N 339.189 1.562 10 10 EDCE O=C(NCCc1conc1Br)c1cc(O)c(O)c(O)c1 2238728991 MPFORQBDMJZEJN-UHFFFAOYSA-N 343.133 1.526 10 10 EDCE O=C(NCc1ccccc1O)C1(COCc2ccccc2)CNC1 2248505947 YDPWFLUTRXDCPY-UHFFFAOYSA-N 326.396 1.815 10 10 EDCE O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)C1=CNN1CCCCC1 2296348745 ZBZGRCRXOZNVQE-UHFFFAOYSA-N 348.790 1.797 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3c(O)cccc3Br)C[C@@H]21 2314963385 MWBMKLMWRTYMGA-UFBFGSQYSA-N 332.219 1.384 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCSCC3)c(Br)cc21 118589822 KKIBPGGJJNXECS-LLVKDONJSA-N 328.235 1.954 10 10 EDCE CCNS(=O)(=O)[C@H]1CCN(Cc2cc(Cl)cc(C)c2O)C1 181557907 PNPJKPFYXHMDDX-ZDUSSCGKSA-N 332.853 1.868 10 10 EDCE COc1cc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)O)cc(O)c1O 44300102 BGMCRFMBRRKSOB-SECBINFHSA-N 327.333 1.627 10 10 EDCE COc1cc(Br)cc(CN2CCCN(C)C(=O)C2)c1O 191665968 SBEIJIMTYNVDHH-UHFFFAOYSA-N 343.221 1.827 10 10 EDCE Cc1cc(O)c(CN2CCCN(S(=O)(=O)N(C)C)CC2)cc1C 368190500 NZQCINWQSOZIBS-UHFFFAOYSA-N 341.477 1.323 10 10 EDCE COC(=O)[C@@]12CCOC[C@@H]1CN(C(=O)c1ccc(C)c(O)c1O)C2 373628282 JUDWUDIQJPPXHL-APPDUMDISA-N 335.356 1.058 10 10 EDCE CCNCc1ccc(N2CC3(COC(=O)N3)C2)c(Br)c1 2379983906 SBDPFXYHHRNWCT-UHFFFAOYSA-N 340.221 1.857 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](C)c1ccnn1C 819699392 DAWYLEKOYOVVFB-CYBMUJFWSA-N 345.399 1.821 10 10 EDCE O=[N+]([O-])c1cc(Br)c(O)c([C@H](CF)N2CCNCC2)c1 575267785 RGKRTRVWSIENSF-NSHDSACASA-N 348.172 1.979 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@H]3CCC[C@@H]3O)C2)cc1 824682032 UGNUMJBFCPDCJN-DAYGRLMNSA-N 347.459 1.982 10 10 EDCE C[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)CCN1S(C)(=O)=O 827271889 WJWLAPGPVNDKMS-SECBINFHSA-N 336.816 1.650 10 10 EDCE COc1cc(O)c(CN2CCS(=O)(=O)[C@@H]3CCC[C@@H]32)cc1OC 825201022 IIKKVDSNWDMFCU-BLLLJJGKSA-N 341.429 1.561 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H]3CCCN(C)C3)C2)cc1 823248738 USVDAVWHUXMYCS-HOTGVXAUSA-N 346.475 1.915 10 10 EDCE CO[C@]1(CN[C@H]2C[C@@H](C)c3c(F)ccc(O)c32)CCS(=O)(=O)C1 903367131 XSXFKDXUOUXJEK-XAGWURHQSA-N 343.420 1.873 10 10 EDCE COc1cc(NS(=O)(=O)CC2(OC)CCOCC2)ccc1O 844663675 WJBBSDHKDOEQNN-UHFFFAOYSA-N 331.390 1.338 10 10 EDCE COc1cc([C@@]2(C(=O)O)C[C@H]2NC(=O)OC(C)(C)C)cc(O)c1O 1952829109 HXPMWLZVANAVHX-BZNIZROVSA-N 339.344 1.726 10 10 EDCE CO[C@@H]1C[C@H](C(=O)N(C)CCN=[N+]=[N-])N(C(=O)OC(C)(C)C)C1 1895874891 CXKMCOLAQNRLGN-GHMZBOCLSA-N 327.385 1.780 10 10 EDCE CO[C@@H](CS(=O)(=O)NCc1c(O)cccc1F)C1CCOCC1 921451776 VTOGTMFELCABTI-HNNXBMFYSA-N 347.408 1.392 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3[C@H]4CC[C@H]3[C@H](CO)C4)C2)cc1 854297064 JKJMWABJBROPLG-KPEUIFRASA-N 345.443 1.829 10 10 EDCE CN1CCN(c2ccc(CNC[C@]3(O)C[C@H]4C=C[C@H]3C4)cc2)CC1 850373670 CDYQRQKGGRIUGM-CMKODMSKSA-N 327.472 1.855 10 10 EDCE CO[C@]1(CNCc2cc(F)c(N(C)C)cc2F)CCS(=O)(=O)C1 922617835 WGSGWDJOOJFZRZ-HNNXBMFYSA-N 348.415 1.324 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCC[C@H](N)C3)C2)cc1 851664082 QODDCRDMKFHQCJ-KKUMJFAQSA-N 332.448 1.843 10 10 EDCE O=C([C@H](O)C1CCOCC1)N(Cc1ccccc1O)C[C@H]1CCCO1 752152032 SJJSPBXKOMAYQD-SJLPKXTDSA-N 349.427 1.687 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCc3cnccn3)C2)cc1 855223259 FAHRTOKLIXUVOK-HNNXBMFYSA-N 326.400 1.813 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCCCN(C)C1=O 935945002 HHYHIURYNUDZEU-GFCCVEGCSA-N 325.405 1.753 10 10 EDCE CCOC(=O)[C@@H](Cc1ccccn1)NC(=O)c1ccc(C)c(O)c1O 760622394 MFUSTQPIFULOIM-CQSZACIVSA-N 344.367 1.705 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)NCCCF)CC2)cc1 767937457 BRMYRFFQHAJWKK-UHFFFAOYSA-N 338.427 1.476 10 10 EDCE CCN(C)c1ccc(CN(C)CCN2CCCS2(=O)=O)cc1 773753310 GACJQZCUBNURJI-UHFFFAOYSA-N 325.478 1.610 10 10 EDCE COCCc1cc(NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n(C)n1 797635746 HIUCUTDCFRYICX-LLVKDONJSA-N 348.403 1.773 10 10 EDCE C[C@@H]1COC[C@@H]1N(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 688222904 MQYSRRDBZAOZOK-HYJLZEBJSA-N 341.205 1.906 10 10 EDCE O=C(COC(=O)c1cnc(OCC2CC2)cn1)c1ccc(O)c(O)c1 792843833 BLBHFUBVKINZGV-UHFFFAOYSA-N 344.323 1.716 10 10 EDCE COCCNC(=O)[C@@H](C)NCc1ccc(Br)cc1O 691501958 RRJUYXNVBZARQX-SECBINFHSA-N 331.210 1.395 10 10 EDCE Nc1cccc(Br)c1NC1CCN(S(N)(=O)=O)CC1 698683250 ITVYYPZLVLTKRJ-UHFFFAOYSA-N 349.254 1.111 10 10 EDCE 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VVDZOTJRIPQUNQ-ZLCVWYCYSA-N 346.221 1.059 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](CCC(=O)N2CC(N=[N+]=[N-])C2)C1 2252702844 GMOIENLQUDZMAC-GFCCVEGCSA-N 339.396 1.924 10 10 EDCE C[C@H](O)c1ccc(N2CC3(CNC(=O)CO3)C2)cc1Br 2289660905 SDUCQOAGWYIIQZ-VIFPVBQESA-N 341.205 1.208 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)C(C)(C)OC)CC2)cc1 171587669 ORALEAVFWSYNHR-UHFFFAOYSA-N 349.475 1.749 10 10 EDCE O=C(NCCCSc1nccs1)N1C[C@@H](CO)[C@@H](CCO)C1 1348591850 PPDATIILDQPKSE-RYUDHWBXSA-N 345.490 1.258 10 10 EDCE C[C@@H]1C[C@@H](O)CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 401693421 HVOAUEGEWQISMM-RBDZCENOSA-N 340.221 1.608 10 10 EDCE Cc1cc(COCC(=O)N2CCOc3cc(N(C)C)ccc32)on1 193713137 NZKSWIZEFOGBGJ-UHFFFAOYSA-N 331.372 1.991 10 10 EDCE Cc1ccc(CN2C[C@@H]3CN[C@H](CO)[C@@H]3C2)c(O)c1Br 2380800714 KTYDITCHNFSTHI-YNEHKIRRSA-N 341.249 1.475 10 10 EDCE CCN1CC[C@@H](NC(=O)NCc2ccc3c(c2)CCCN3C)C1=O 801798169 TUZSAKWLQJKYJC-OAHLLOKOSA-N 330.432 1.489 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)NCc1cscn1 804017137 DHJAOWHBVIRVGC-UHFFFAOYSA-N 342.471 1.514 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCO[C@H](C(=O)C3CC3)C2)c1O 811502268 OJTLSDWMRZRJOF-ZDUSSCGKSA-N 336.344 1.489 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)[C@@H](C)CN1CCO 841715871 FHMCWYNUEGTCAM-GJZGRUSLSA-N 334.464 1.349 10 10 EDCE CC(C)(C)OC(=O)CN1CC[C@H](OC(=O)c2cc(O)cs2)C1=O 849728047 LPWDMNMOEYWRDW-JTQLQIEISA-N 341.385 1.553 10 10 EDCE Nc1ccc(NC(=O)C(=O)N[C@H](C[C@H]2CCCO2)C(F)(F)F)cc1 848602642 GSBNUERWNKPCCO-VXGBXAGGSA-N 345.321 1.824 10 10 EDCE COc1ccc(N2CCN(CCNCc3ccc(C)nn3)CC2)cc1 840885897 IBBDPMWDIMKCIQ-UHFFFAOYSA-N 341.459 1.705 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCCNC(=O)C3CC3)C2)cc1 855233009 VNKXNIGZKQZOCV-OAHLLOKOSA-N 345.443 1.697 10 10 EDCE C[C@H]1COCC[C@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852281078 OXAHNJPULWWTCZ-KBXCAEBGSA-N 347.459 1.872 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@H](OC)[C@@H]3CCOC3)C2)cc1 854980482 CAPIVGXLGJBHHL-IIDMSEBBSA-N 348.443 1.689 10 10 EDCE COC(=O)[C@@H](NCc1ccc(N2CCOCC2)cc1)C1CCOCC1 931692793 ZFZAVDHKTJXMHV-SFHVURJKSA-N 348.443 1.581 10 10 EDCE COC[C@@H](C)OC(=O)N1CCN(c2ccc(OC)cc2OC)CC1 867731257 SDJVQNYNQGPIMO-CYBMUJFWSA-N 338.404 1.997 10 10 EDCE Cc1cc(Cl)cc(CNCC2(O)CCS(=O)(=O)CC2)c1O 776215067 VYYMDKABHYTKGQ-UHFFFAOYSA-N 333.837 1.383 10 10 EDCE Cc1cncc(/C=C\C(=O)N2CCc3ccc(S(N)(=O)=O)cc32)c1 772697842 PRIDEWYHMOJAGR-DJWKRKHSSA-N 343.408 1.640 10 10 EDCE CC(C)[C@H](NC(=O)c1ccccn1)C(=O)NCc1ccc(O)c(O)c1 778917154 ZUGGPEKKGVYRSK-INIZCTEOSA-N 343.383 1.564 10 10 EDCE O=C(CNC(=O)c1ccsc1)OCC(=O)c1ccc(O)c(O)c1 783138108 NYRJJLBNAFUDKD-UHFFFAOYSA-N 335.337 1.315 10 10 EDCE COc1ccc(N2CCC(NC(=O)NCc3cn(C)nn3)CC2)cc1 783014273 WYGGETYZWSHYOW-UHFFFAOYSA-N 344.419 1.292 10 10 EDCE CC(=O)N1CCN(c2ccc(CNc3cnc(CO)cn3)cc2)CC1 893400417 CTIADSDOQNOTQU-UHFFFAOYSA-N 341.415 1.250 10 10 EDCE CCN1C(=O)NC(=O)/C(=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)C1=O 1084312689 OSBQWOSUJVNYJK-BUYRESAOSA-N 345.399 1.766 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)[C@H](C)CC(N)=O)C2)cc1C 1316634581 HUAXMEYDKROFJO-FVQBIDKESA-N 347.459 1.500 10 10 EDCE O=C(C(=O)N1CC[C@H]([C@@H]2CCOC2)C1)N1Cc2cccc(O)c2C1 1329845023 YTFPYLIAUIBIGB-GXTWGEPZSA-N 330.384 1.119 10 10 EDCE O=S1(=O)CCNC[C@H]1CCNCc1ccc(N2CCCC2)cc1 1332014882 XQNPCRCJPOIQQQ-QGZVFWFLSA-N 337.489 1.153 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N[C@@H]2CC[C@@H]3[C@@H](C2)C3(F)F)cc1 1333544593 WVFSJMRFHHQBBV-MGPQQGTHSA-N 337.370 1.478 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cn3ccnc3)CC2)cc1C 1269544302 ABQQFDHNBGRZPG-UHFFFAOYSA-N 328.416 1.639 10 10 EDCE CN(C)C[C@H]1C[C@@H](O)CN1c1ccc(CN)cc1Br 212891827 PVUCAVUKHKXTQK-VXGBXAGGSA-N 328.254 1.409 10 10 EDCE CN1CCC(CCO)(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1447218157 HUKCRNCENCVQOF-UHFFFAOYSA-N 333.392 1.426 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1C 1715950159 QNDATTGRUNQVQU-GDBMZVCRSA-N 333.476 1.940 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)Cn2cccn2)cc1C 1485120802 JBQDOTATLQAGQC-GJZGRUSLSA-N 330.432 1.883 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cnn(CCF)c2)c1 1557510383 ODKKIELEBWAPMQ-UHFFFAOYSA-N 342.352 1.182 10 10 EDCE COc1ccc(N2CCN(C(=O)C[C@H]3CCC(=O)NC3)CC2)cc1 1566326626 TYPPUVIDSDZCAI-CQSZACIVSA-N 331.416 1.260 10 10 EDCE CN1C(=O)CS/C1=C/C(=O)NCc1ccc2cccnc2c1O 1638573335 SGBLQRJQJYGXQT-VGOFMYFVSA-N 329.381 1.603 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C2(C)CCCC2)cc(OC)n1 1720927082 FXEDXESZKCXLRN-LBPRGKRZSA-N 349.431 1.914 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](O)CC(C)(C)C3)nc12 1648050479 WDROFRZIOZTVAD-LBPRGKRZSA-N 348.403 1.204 10 10 EDCE CC(C)(C)OC(=O)N1CC(CC(=O)NCc2c(O)cccc2O)C1 1652625280 AAAVESKHXGEIII-UHFFFAOYSA-N 336.388 1.971 10 10 EDCE Cc1cn2nnc(C(=O)NCc3cc(Cl)ccc3O)c2c(O)n1 1583820936 QLNDXORHKVOBEV-UHFFFAOYSA-N 333.735 1.427 10 10 EDCE CS(=O)(=O)c1ccccc1CC(=O)NCc1cc(O)ccc1O 1651225673 SWIJZFFOTZCYBM-UHFFFAOYSA-N 335.381 1.360 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N(C)[C@@H](C)CO)c(Br)cc21 122543992 VUOQSXIQSJSUAH-SDBXPKJASA-N 342.237 1.869 10 10 EDCE Nc1ccnn1CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1597088914 CJMUXMAEQNOGBD-CQSZACIVSA-N 330.388 1.379 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCO[C@]3(CCOC3)C2)c([N+](=O)[O-])c1 1772918005 KPXVKMLUTPZMKS-MAVJXHJTSA-N 348.355 1.777 10 10 EDCE CN(CCNC(=O)c1cc[nH]c1)C(=O)c1ccc(N=NC(N)=O)cc1 1688337444 CVENWJXJEMTQCS-UHFFFAOYSA-N 342.359 1.679 10 10 EDCE Cn1cnnc1NC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 157190561 OMIKUNYAWOITOT-UHFFFAOYSA-N 332.319 1.843 10 10 EDCE C[C@@H](Oc1ccc(N)cc1)C(=O)N1CCN(c2ncccn2)CC1 1860081878 GQMBDGJYSUWYLU-CYBMUJFWSA-N 327.388 1.175 10 10 EDCE Nc1ccc(OCCN2CCC[C@H](NC(=O)[C@H]3CCCO3)C2)cc1 586067943 ZAUJRXQPPCWOCZ-DOTOQJQBSA-N 333.432 1.407 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@]4(CO)C3)c(Br)cc2[C@@H]1O 2146304872 ALWAGYHDFYHEBU-ATMGAIRJSA-N 339.189 1.253 10 10 EDCE CN1CCc2cc([C@@]3(O)COC[C@H]3NC(=O)OC(C)(C)C)ccc21 1999512269 NZRBFNAFCHBEAX-QAPCUYQASA-N 334.416 1.790 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 2010393694 WCCDEPMXNJLZOL-NSHDSACASA-N 339.396 1.517 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCCN=[N+]=[N-])C[C@H]2OCC[C@H]21 2010392451 ZTUSMDZRHWJJMQ-GRYCIOLGSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N=c1[nH][nH]cc1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2010399523 ZJOJJWSWWVVSIV-SECBINFHSA-N 335.368 1.951 10 10 EDCE C[C@@H]1[C@@H](NCc2cc(Br)ccc2O)CCS1(=O)=O 386552913 UDEXSFSNVIMNCK-KCJUWKMLSA-N 334.235 1.820 10 10 EDCE OCc1ccc(N2CCN([C@H]3CCOC3)CC2)c(Br)c1 2171299513 DJASQDRYPSXQFP-ZDUSSCGKSA-N 341.249 1.852 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H]4COC[C@@H]43)c(Br)cc21 2198566473 XDCYMMBYZNJXOH-RDZIJCNDSA-N 338.205 1.626 10 10 EDCE NCc1cc(F)c(N2CCCNC(=O)CC2)cc1Br 2089098737 HFVHREDAJAHKLM-UHFFFAOYSA-N 330.201 1.763 10 10 EDCE NCc1cc(F)c(N2C[C@H](CO)C[C@H]2CO)cc1Br 2089907892 ONESDYNXGPFXLB-SCZZXKLOSA-N 333.201 1.226 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCOc1nnc(=N)[nH]n1)C1CCCC1 2213786736 BRZVPWWEBPCALA-NSHDSACASA-N 338.412 1.532 10 10 EDCE COc1ccc(N2CCOC[C@@H](O)C2)c(OC)c1Br 2226548215 AHAWRBCEKDSUTR-VIFPVBQESA-N 332.194 1.664 10 10 EDCE CN[C@@H](c1ccccc1O)[C@@](O)(CF)CNC(=O)OC(C)(C)C 2242773600 WAJWZEAKTYPQIW-XJKSGUPXSA-N 328.384 1.878 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)C[C@H]21 2249687441 YHOGZDKBORMZJN-DHGKCCLASA-N 336.432 1.898 10 10 EDCE O=C(O)COc1ccc(C=C2SC(=S)N(CCO)C2=O)cc1 2294874773 TXIYFGFNLZWTKU-UHFFFAOYSA-N 339.394 1.344 10 10 EDCE CCNC(=O)C1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2297786464 CPWGCUZZXNHZSM-UHFFFAOYSA-N 343.427 1.131 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N[C@H]1CC(=O)N(CC(F)(F)F)C1 2307987813 MQHHMQBZVJDPEL-JTQLQIEISA-N 344.289 1.390 10 10 EDCE CCNCc1ccc(N2CC([C@H](O)CO)C2)cc1Br 2336773029 CQHGFBCFOYYNKX-CQSZACIVSA-N 329.238 1.348 10 10 EDCE Cc1ccc(CN2C[C@H](O)CC23CNC3)c(O)c1Br 2352944872 NNDNZIRCFGNGOE-LLVKDONJSA-N 327.222 1.372 10 10 EDCE CCOCCOCC(=O)N1CCCN(c2ccc(OC)cc2)CC1 56985593 OHLBUWUMUVRTEV-UHFFFAOYSA-N 336.432 1.787 10 10 EDCE CN1C(=O)NC(=O)/C(=C\c2cc([N+](=O)[O-])ccc2N2CCCC2)C1=O 59498878 CGPBUNSWZXIILZ-FMIVXFBMSA-N 344.327 1.287 10 10 EDCE CC(=O)N(C(=O)c1ccc2c(c1)C(=O)N(C)C2=O)c1ccc(N)cc1 170223998 NYCJLLUXMWLXRG-UHFFFAOYSA-N 337.335 1.688 10 10 EDCE CCOCCN1CCN(C(=O)c2ccc(C)c(O)c2O)C[C@H]1CC 182460193 ZXXPWFWSPCUACR-CQSZACIVSA-N 336.432 1.979 10 10 EDCE C[C@H](NS(=O)(=O)CCOc1ccc(N)cc1)c1nccs1 80258361 DCYJCUGPVLDAGL-JTQLQIEISA-N 327.431 1.785 10 10 EDCE CC(=O)N1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H](C)C1 268718117 VDQQNFZHTFWYIG-HNNXBMFYSA-N 346.475 1.264 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@@H](NCc2ccc(N3CCOCC3)cc2)CC1=O 377836586 CKHBMGUSMHAMRT-HFTRVMKXSA-N 329.444 1.622 10 10 EDCE NS(=O)(=O)C[C@@H]1CCCN(Cc2cc(Cl)c(F)cc2O)C1 295278629 IESZRIGGWRQQNB-SECBINFHSA-N 336.816 1.685 10 10 EDCE CC(=O)NCCCNC(=O)NCc1cc(Br)ccc1O 804895127 YSMOYGGDQWTFGP-UHFFFAOYSA-N 344.209 1.480 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H]3CO4)c(Br)cc21 718373454 AKPZDQBIXNUQDO-UPFKWVMWSA-N 338.205 1.639 10 10 EDCE COC(=O)[C@@H]1CSCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 840567564 VOBFAIHCGUJLMR-FHMRSRPSSA-N 337.397 1.476 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)N(C)C3CC3)C2)cc1 849415910 HQWSBEUZUASXNT-LBPRGKRZSA-N 325.434 1.203 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)NC[C@H]1CN(C2CC2)C(=O)O1 847464946 ABVFWAMKNFIAJU-LBPRGKRZSA-N 339.779 1.828 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)c3ccccc3N)C2)cc1 849415876 GSVHHILNMAWFBT-CYBMUJFWSA-N 347.440 1.835 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCCN3C(C)=O)C2)cc1 869228485 JSJQODZDSQHRRG-RHSMWYFYSA-N 331.416 1.401 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN[C@H]2CCN(C3CCC3)C2=O)c1O 862550770 HPWPYHKAEDITTC-LBPRGKRZSA-N 335.360 1.552 10 10 EDCE CCCN1C[C@H](C(=O)NCc2ccc3cccnc3c2O)CC1=O 862024941 JYJGXLPXSSBKRV-CQSZACIVSA-N 327.384 1.815 10 10 EDCE CC(=O)N(CCc1ccccc1)CC(=O)NCc1c(O)cccc1O 1178910640 GMNVTVLOCNMGIA-UHFFFAOYSA-N 342.395 1.805 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)COc2cc(C)on2)cc1C 1321550099 KOCUTMBHYNUDAD-CYBMUJFWSA-N 347.415 1.973 10 10 EDCE C[C@H](CNCc1csnn1)NC(=O)c1ccc(N=NC(N)=O)cc1 1321760889 VIBDEEHRNPBSML-SECBINFHSA-N 347.404 1.609 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](C(=O)O)[C@H](c2cc(O)c(O)c(O)c2)C1 1906074276 ODNHALMTKQYCFX-UWVGGRQHSA-N 339.344 1.839 10 10 EDCE Cc1nc(Cn2nnc(C(=O)N[C@@H](C)c3ccccc3O)c2C)no1 1454821053 VGQIFWKQEDHLEU-VIFPVBQESA-N 342.359 1.523 10 10 EDCE O=C(CCCn1c(O)nnc1O)NCc1ccc2cccnc2c1O 1469249319 NKNVLTLTVPMTSL-UHFFFAOYSA-N 343.343 1.040 10 10 EDCE CNC(=O)N[C@H]1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 1624819256 GNDBUMRGZBLLOH-AWEZNQCLSA-N 341.415 1.633 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCc2nnnn2CC1 1556515548 CNCSKCZLCCMTHG-LLVKDONJSA-N 336.392 1.133 10 10 EDCE COC(=O)c1nc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cs1 1624955058 QDLOWVFKHYTYHR-QMMMGPOBSA-N 336.369 1.702 10 10 EDCE CC(C)(CO)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1cccnc1 1639152632 QBPTWOWFUMWYIX-KRWDZBQOSA-N 330.384 1.911 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@H](C)NC(=O)C2(C)CC2)cc1 1498044189 HIYOVXUCTIUIRO-LBPRGKRZSA-N 344.419 1.065 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@H]2CC2(C)C)cc(OC)n1 1494680175 LRUZCGSXJSTTFZ-ZYHUDNBSSA-N 335.404 1.379 10 10 EDCE Cc1cc(Cn2nnc(C(=O)NCc3c(O)cccc3O)c2C)no1 1645362987 HVLAXAVZRBXGLN-UHFFFAOYSA-N 343.343 1.272 10 10 EDCE C[C@H]1C[C@H]1C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1686871232 RIRAFZVKBWRANF-GXFFZTMASA-N 331.376 1.741 10 10 EDCE COc1ccc(N2CCCN(C[C@H](C)CS(C)(=O)=O)CC2)cc1 163068228 OGRQPMLKSZJIEP-HNNXBMFYSA-N 340.489 1.888 10 10 EDCE O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C/N1CCOCC1 208227657 GLXLFVKQDIGDCI-FMIVXFBMSA-N 335.747 1.139 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CC(=O)NCCCN=[N+]=[N-])C1 1964880972 UNIWPNCCKREWRA-AWEZNQCLSA-N 327.385 1.565 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@H]1COC[C@H]1C(=O)NCCCN=[N+]=[N-] 1985101876 YZKMHVBZIAJJMY-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985101874 YYHJZPKNEARRBG-WDEREUQCSA-N 327.385 1.827 10 10 EDCE C[C@@H](NC[C@H](CO)NC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985859416 SDZTURMYCMNQTJ-GHMZBOCLSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@](O)(C(=O)N2CC(N=[N+]=[N-])C2)C1 1986139745 BJERWJGRVFZJRG-AWEZNQCLSA-N 325.369 1.270 10 10 EDCE CC(C)(C)OC(=O)N[C@@]12C[C@H]1CN(C(=O)c1cccc(O)c1O)C2 2006284504 RGJVSWAWMHDOKQ-DYZYQPBXSA-N 334.372 1.837 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(N)cc1 2022864093 QWVVFZXDGVZPPX-FZMZJTMJSA-N 337.420 1.501 10 10 EDCE CN[C@H](C)c1ccc(N2CCS(=O)(=O)CC2)cc1Br 300520009 VLQJUIWATUSGMX-SNVBAGLBSA-N 347.278 1.964 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1CCO[C@@H]2CNC[C@@H]21 708134195 PCVHHBFTFWQPJC-NWDGAFQWSA-N 347.640 1.981 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@](O)(C(N)=O)C2)cc1Br 383542652 DZUVXINIIPCPMI-LKFCYVNXSA-N 342.237 1.285 10 10 EDCE CNCc1ccc(N2C[C@H]3[C@@H](C2)OC(=O)N3C)cc1Br 2176933059 MGLYEYALMGJMEY-QWHCGFSZSA-N 340.221 1.808 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)c(Br)c1 2173316621 DFDFXLNKVFYRGG-IWMZPUPSSA-N 341.249 1.789 10 10 EDCE COc1ccc(O)c(Cn2cc(I)c(O)n2)c1 2070640533 PUXMTDLRRPEHAR-UHFFFAOYSA-N 346.124 1.956 10 10 EDCE O=S1(=O)C[C@H]2C(NCc3cccc(Br)c3O)[C@@H]2C1 2054279430 ZSDBAXPPXQENGK-RKDXNWHRSA-N 332.219 1.287 10 10 EDCE Nc1ccc(CS(=O)(=O)N2CCC[C@@H](C3OCCO3)C2)cc1 2089610126 WJIBVKCARKZRRE-CYBMUJFWSA-N 326.418 1.184 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2COC[C@H]2N(C)C)c1O 2236029456 BDOXPEFQXHNBJZ-VXGBXAGGSA-N 345.237 1.582 10 10 EDCE COc1ccc(N2[C@@H](C(=O)O)CC[C@@H]2C(=O)O)c(Br)c1 2237309413 AAXLRIGNZVGMPG-GHMZBOCLSA-N 344.161 1.964 10 10 EDCE COC(=O)[C@H](CS(=O)(=O)N=[N+]=[N-])NC(=O)OCc1ccccc1 2241756749 LJZIGGULAVGRBV-JTQLQIEISA-N 342.333 1.095 10 10 EDCE NCc1cc(F)c(N2CCC[C@@H]2CC(N)=O)cc1Br 2270082474 TVIYMGWXOFGBTB-SECBINFHSA-N 330.201 1.891 10 10 EDCE COc1cc(NC(=O)C=Cc2ccc(N3CCOCC3)cc2)ncn1 2303761365 LQTUQYDDEVXAMN-UHFFFAOYSA-N 340.383 1.974 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2330369470 IXPJZKOPCGBOAU-DGJRKYIQSA-N 327.222 1.228 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)c(Br)c1 2336465848 MLNBMXFAPSKOJP-JQEORGNBSA-N 346.246 1.736 10 10 EDCE Cc1ccc(CNC[C@@H]2CCS(=O)(=O)N2)c(O)c1Br 2352940284 CTBAKBPYMLBNFZ-JTQLQIEISA-N 349.250 1.244 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC[C@H](O)C(F)(F)F)cc2)CC1 1346325046 IGFWCNVLHBTMHW-HNNXBMFYSA-N 345.365 1.368 10 10 EDCE NC(=O)[C@@H]1CCN(c2ccc(/C=C/C(=O)O)c(Br)c2)C1 300535029 XTXPMHXJVZSEJV-XCRNYIDWSA-N 339.189 1.859 10 10 EDCE CCOC(=O)c1cn(C)nc1NC(=O)NCc1ccc(N(C)C)cc1 182791413 WOBHVERNEINGBS-UHFFFAOYSA-N 345.403 1.985 10 10 EDCE CC(C)[C@H](CO)N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2367092368 LJTQUPHZEMCOAR-STQMWFEESA-N 342.237 1.854 10 10 EDCE COc1cccc(CNC(=O)NCCCCN2CCOCC2)c1O 266714567 ZTAPJLVZJZSBQQ-UHFFFAOYSA-N 337.420 1.312 10 10 EDCE Cc1ccc(CN2C[C@@H](O)C[C@H]2CN(C)C)c(O)c1Br 2380813366 FXXKLYLCGBVMRS-STQMWFEESA-N 343.265 1.960 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)cc1 836226386 DTLUORLUXHNPDI-CGTJXYLNSA-N 347.459 1.824 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(c2cc(O)c(O)c(O)c2)C[C@@H]1C(=O)O 1952775409 OYMYLMZIHREAML-ANRSDYALSA-N 325.317 1.628 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NC[C@@H]1CCCN1 841937189 OTMUYUBAFRFWQM-NSHDSACASA-N 328.210 1.706 10 10 EDCE CCc1cc(CN2CCN(CC(N)=O)C(=O)C2)c(O)c(C(C)(C)C)c1 840158628 CZNMVAWILNQVEP-UHFFFAOYSA-N 347.459 1.382 10 10 EDCE CC(=O)C(=O)COC(=O)Cn1c(-c2ccccc2)c(C)sc1=O 923503491 JJFDDTAFRDSXHL-UHFFFAOYSA-N 333.365 1.587 10 10 EDCE C[C@H]1CNCC[C@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851664360 XZFCAJLCXKHREC-KBXCAEBGSA-N 346.475 1.445 10 10 EDCE C/C=C\CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 858889674 IEVKJNQSVNORDJ-GWQWAINWSA-N 330.432 1.764 10 10 EDCE CCN1CC[C@@H](NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1=O 852315548 YJVDAGJRPGWQFP-XJKSGUPXSA-N 346.431 1.194 10 10 EDCE COc1ccc(N2CC[C@@H](Nc3ccc(C(=O)N(C)C)nn3)C2)cc1 853758545 GMXWKACMHKEPNO-CYBMUJFWSA-N 341.415 1.878 10 10 EDCE CCn1ncc(CNC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)n1 858600103 SVGFZLVNKKEFOD-ZDUSSCGKSA-N 344.419 1.385 10 10 EDCE C[C@@H]1COCC[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 763192475 FJTQSWYILMAIRZ-RHSMWYFYSA-N 333.432 1.747 10 10 EDCE COc1ccc(N2CCCN(C(=O)Cc3ccnn3C)CC2)cc1 766434053 VWLNTCLCHMJBOT-UHFFFAOYSA-N 328.416 1.710 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](O)c3cnc[nH]3)C2)cc1 868955128 IXXDZFOLCAYRNT-WBMJQRKESA-N 330.388 1.094 10 10 EDCE CS(=O)(=O)C1CN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 897936970 CQXUFWJHTPIGFZ-UHFFFAOYSA-N 327.383 1.182 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)/C=C\C3CC3)cc2)CC1 894598093 UFYOWGMWAXLTJU-YVMONPNESA-N 327.428 1.971 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C1CN([C@H]2CCOC2)C1 895710161 HCBAODPPWXONLS-SFHVURJKSA-N 329.444 1.624 10 10 EDCE CN1C[C@@H]2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)[C@H]2C1 794926601 CNEOEYDLLRBDHT-WMZOPIPTSA-N 330.476 1.347 10 10 EDCE O=C1COCCN1CC(=O)N(Cc1ccco1)Cc1ccccc1O 790742294 UQLCWOXHQURPAE-UHFFFAOYSA-N 344.367 1.373 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](NC(N)=O)C2)cc1Br 690738167 NEZFMODVBQFJAG-RKDXNWHRSA-N 328.210 1.749 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC[C@@H]2CCN(CCO)C2)cc1 1317811170 IUIQPGRAARPPOC-GFCCVEGCSA-N 333.392 1.283 10 10 EDCE CC1(C)C[C@H](NC(=O)Cc2ccc(O)c(O)c2)CCS1(=O)=O 1179551285 DXJSPOQKZTXHNJ-LLVKDONJSA-N 327.402 1.112 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)C(C)(C)NC(C)=O)cc1C 1268407285 AWRJKMHOKHSPLA-CQSZACIVSA-N 349.475 1.903 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)CCCCC(N)=O)C2)cc1C 1267022538 RBPZYQHDAVOVEV-INIZCTEOSA-N 347.459 1.740 10 10 EDCE C[C@H]1CN(c2ccc(C=CC(=O)O)c(Br)c2)CC(=O)N1 1912126913 CLUBVLZOIMQFKE-VIFPVBQESA-N 339.189 1.872 10 10 EDCE CC(C)NC1(CO)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1449955351 WNZUGIIMINSNGV-UHFFFAOYSA-N 347.419 1.814 10 10 EDCE CCN[C@H](C)c1ccc(N2CC(O)(C(N)=O)C2)c(Br)c1 1915248674 KGPYTPWGYFZHJK-SECBINFHSA-N 342.237 1.156 10 10 EDCE O=C(Cn1ncc2ccccc2c1=O)NCc1ccc(O)cc1O 1451773599 YQTMTDXAZJCADR-UHFFFAOYSA-N 325.324 1.124 10 10 EDCE CSc1ccccc1C(=O)N1CCS(=O)(=O)[C@H]2COCC[C@H]21 1451145187 RYTTWNMFMXFIOV-OCCSQVGLSA-N 341.454 1.437 10 10 EDCE COc1ccc(O)c([C@@H](C)N[C@@H](C)c2nc(N)nc(N(C)C)n2)c1 1459849052 KAELMGZTECFDOS-ZJUUUORDSA-N 332.408 1.646 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@H](O)C(F)(F)C(F)(F)F 1471524914 DJPYXJIOUIYZIW-VIFPVBQESA-N 329.221 1.315 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccccn2)cc1C 1715577061 ZFJSPWYETJCXPD-HNNXBMFYSA-N 329.400 1.279 10 10 EDCE O=C(Cn1ncc(=O)c2ccccc21)NCc1ccc(O)c(O)c1 1622664057 FBICDKSVUNCCEB-UHFFFAOYSA-N 325.324 1.124 10 10 EDCE Cc1ccc(C(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)c(O)c1O 1637397188 MWFYQJJKZNFRCL-LBPRGKRZSA-N 345.355 1.880 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@H]2CCN(C)C2)cc1C 1568964034 NBAYRLCFAJWMLS-BDUNBXCCSA-N 331.460 1.717 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCc1cnn(C)n1 1635489796 HTKVZPQZGMUNLD-UHFFFAOYSA-N 328.420 1.757 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cc2cnn(C)c2)cc1C 1731897396 VVTMHVGEWMNDQA-UHFFFAOYSA-N 330.432 1.528 10 10 EDCE Cc1cc2c(N3CC(NC(=O)c4cc(O)cs4)C3)nccn2n1 1640708359 ZOIPRTCBHLEZPD-UHFFFAOYSA-N 329.385 1.423 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccc(-n2ccnc2O)cc1 1643103806 GJQWCIPNFMMSAS-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE O=Cc1ccc(OCC(=O)NCc2cc(O)ccc2O)c([N+](=O)[O-])c1 1644754066 PWSLANWPYGXBFN-UHFFFAOYSA-N 346.295 1.514 10 10 EDCE CC(=O)N[C@@H]1CCCN(C(=O)NCCCSc2nccs2)C1 154629504 RMMTUAIWEVPCOL-GFCCVEGCSA-N 342.490 1.935 10 10 EDCE NCc1ccc(N2C[C@@]3(CO)CC[C@]3(CO)C2)cc1Br 2145749290 QEUVPDUSDXTTAT-HUUCEWRRSA-N 341.249 1.479 10 10 EDCE CC(C)(C)OC(=O)NOCCCNC(=O)c1cc(O)c(O)c(O)c1 2015120233 QPXPQDVQOKXESX-UHFFFAOYSA-N 342.348 1.380 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)NCCCN=[N+]=[N-])C[C@H](O)C1(C)C 2018047551 QWHVHGZKACOUSE-ZUZCIYMTSA-N 341.412 1.857 10 10 EDCE CN1CCN(C2CN(c3ccc(CN)c(Br)c3)C2)CC1 700522640 LCXSEMAZSNLGQU-UHFFFAOYSA-N 339.281 1.344 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)c(Br)c1 2173320396 OWCRJFDWJUDZFB-QZKOUSHUSA-N 341.249 1.489 10 10 EDCE CCNC(=O)c1cn(Cc2ccc(Br)cc2O)nc1O 2070638672 SIJSOMZRFLJAIN-UHFFFAOYSA-N 340.177 1.855 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@H]3[C@H](C)O)c(Br)cc21 2182238076 CBKSIHKHTDBMTH-CQOUMUIBSA-N 340.221 1.621 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCOC[C@H]3CF)c(Br)cc21 2182607172 XMRURYNWKQEEAW-KRTXAFLBSA-N 344.184 1.576 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1C[C@@H](O)C[C@@H](N)C1 2111819719 PEMADUPPJGVJIK-NTZNESFSSA-N 329.238 2.000 10 10 EDCE CCNCc1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)cc1Br 2201293103 JJAKARKRIGNJKB-IMRBUKKESA-N 338.249 1.726 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)c(Br)c1 2201284051 JXOAAXQTCRPTSK-GJTWSCIVSA-N 338.249 1.897 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)c(Br)c1 2205600294 PKWAXLVCYODCSR-DGJRKYIQSA-N 347.228 1.609 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3NC(=O)O[C@H]3C2)c1O 2236092061 JDGQVDWIHUQKQU-ONGXEEELSA-N 343.177 1.456 10 10 EDCE C[C@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)c1nc[nH]n1 2297957117 MUQIMPPXLULZPO-ZDUSSCGKSA-N 327.388 1.532 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCC[C@H](Cn2ccnn2)C1 2308005931 MGSOAOJMHVTPSM-AWEZNQCLSA-N 328.372 1.641 10 10 EDCE N[C@@H]1CC[C@H]2CN(C(=O)C=Cc3ccc(N4CCOCC4)cc3)C[C@@H]12 2308750407 PLOPMPNXOXYWJD-QXAKKESOSA-N 341.455 1.732 10 10 EDCE Nc1ccc(OCC(=O)N[C@@H](CCO)COCc2ccccc2)cc1 2320384005 PKFXNIQRDIBDLG-KRWDZBQOSA-N 344.411 1.732 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NC[C@H](O)COCC1CC1 304625048 JJOPYFHDKMDVSR-AWEZNQCLSA-N 343.383 1.768 10 10 EDCE Cc1c(NS(=O)(=O)c2cccc3nsnc23)cccc1C(N)=O 32602519 MEGJRMNPUKSTBT-UHFFFAOYSA-N 348.409 1.899 10 10 EDCE O=C(NC[C@H]1N[C@@H](CO)Cc2cccc(O)c21)OCc1ccccc1 309652732 AQLMNCJLAAWHDE-HZPDHXFCSA-N 342.395 1.866 10 10 EDCE CC[C@H](O)CN1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 123513676 PDUCJBFXDQJYMY-ZDUSSCGKSA-N 343.811 1.842 10 10 EDCE NCc1cc(F)c(N2CCn3nncc3C2)cc1Br 2130061399 HHYKZVRAIBNPOK-UHFFFAOYSA-N 326.173 1.659 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@H]3C(=O)NCC[C@H]3C)CC2)cc1 194036169 GZAZSSDBOBFBDQ-CZUORRHYSA-N 346.431 1.051 10 10 EDCE C[C@H](N[C@@H]1CC(=O)N(C2CC2)C1)c1ccc(N2CCOCC2)cc1 90180725 GEIKAQUMRGXSJV-GOEBONIOSA-N 329.444 1.937 10 10 EDCE CC(C)Oc1ccc(N2CCN(S(=O)(=O)N(C)C)CC2)cc1 243054959 IHCBGWVBPFMPGS-UHFFFAOYSA-N 327.450 1.402 10 10 EDCE O=C1CO[C@H]2CCN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)C[C@@H]2N1 366766405 FTFLIIAFUNJKGI-JQWIXIFHSA-N 341.751 1.043 10 10 EDCE C[C@H](NC[C@H]1CCC[C@@]12NC(=O)N(C)C2=O)c1ccc(F)cc1O 363846413 CITSMKJHSDIOBM-WVQJBOLRSA-N 335.379 1.902 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H](C)O[C@@H](C)[C@H]1C 807102449 ZMYSAAWBYBFKER-ZNMIVQPWSA-N 347.459 1.702 10 10 EDCE C[C@H]1CC[C@](CO)(N(C)CC(=O)NCc2ccc(N(C)C)cc2)C1 299345819 PARRXLCKAKZIQR-KXBFYZLASA-N 333.476 1.852 10 10 EDCE CC(=O)C(=O)CSc1nnc(COc2cc(C)cc(C)c2)n1N 808018918 QSDGZBGBJDNFMV-UHFFFAOYSA-N 334.401 1.438 10 10 EDCE C[C@@H]1C[C@H]1N1C[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CC1=O 819170971 QZRWGMJGTSAFQR-KWCYVHTRSA-N 343.383 1.166 10 10 EDCE CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)/C=C/c1cnccn1 491188020 VXNBBBLDTKLQDS-QPJJXVBHSA-N 343.408 1.873 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CN(C2CCOCC2)C1 907272664 HJSOGMWHNYXXLD-GFCCVEGCSA-N 334.416 1.256 10 10 EDCE CN1CCCc2cc(CNC(=O)CN3CCN(C4CC4)C3=O)ccc21 824683087 VBTZRDCLACUBKI-UHFFFAOYSA-N 342.443 1.585 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1[C@H]2COC[C@H]21 831706778 LFAVLXWBCCGWJO-JYAVWHMHSA-N 339.775 1.440 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN3C[C@H](O)C[C@H]3C2)c([N+](=O)[O-])c1 848767910 SAQOAWJEABVOAZ-XEKFUKFUSA-N 347.371 1.036 10 10 EDCE O=C(NCCCN1CCOC1=O)NCc1cc(Cl)ccc1O 844950479 LSPQEPQLXFQJHK-UHFFFAOYSA-N 327.768 1.687 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H](O)C3CCC3)cc2)CC1 924254794 UYKXWVATACULHT-KRWDZBQOSA-N 345.443 1.166 10 10 EDCE COc1ccc(N2CC[C@@H](NCc3cnc(N(C)C)nc3)C2)cc1 850346011 PGJQAEAETAGKLC-OAHLLOKOSA-N 327.432 1.920 10 10 EDCE Nc1n[nH]c(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)n1 854504579 CESFGQUATLEFAN-DUXPYHPUSA-N 329.360 1.218 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3n[nH]cc3[N+](=O)[O-])C2)cc1 855234384 YRUBQZBIJWZFNB-SNVBAGLBSA-N 331.332 1.335 10 10 EDCE O=C(NCC1(C2(O)CCOCC2)CC1)N1Cc2cccc(O)c2C1 925664661 GHANBGXHPUTMFN-UHFFFAOYSA-N 332.400 1.739 10 10 EDCE CCN1C[C@H](S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 866418664 PXHDOJYLQYWUIE-OAHLLOKOSA-N 339.461 1.135 10 10 EDCE O=C1[C@H]2[C@H]3C[C@H]4[C@@H]2[C@@]2(C(=O)NCc5ccc6cccnc6c5O)[C@@H]4[C@@H]3[C@@H]12 862026185 IAOMFUMFQJFYQU-OESCXKKCSA-N 346.386 1.884 10 10 EDCE CC1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H]2C[C@H]2C1 863124656 ZFYRCRNWZWHECB-QWRGUYRKSA-N 338.429 1.930 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC2(c3nn[nH]n3)CCCC2)c1O 775051119 MCCCDNPWSXVFKS-UHFFFAOYSA-N 334.336 1.381 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(c2ncc[nH]2)CC1 1119004131 PWRJBVAROVGBCX-UHFFFAOYSA-N 340.383 1.364 10 10 EDCE CCOCc1cc(CN[C@H]2C(=O)NCC23CCOCC3)ccc1OC 895773785 SVHOHEGTQIYODK-KRWDZBQOSA-N 348.443 1.617 10 10 EDCE O=C(NC1CCN(C(=O)CC(F)(F)F)CC1)c1cccc(O)c1O 790629808 PCTQXPWYEHZHJB-UHFFFAOYSA-N 346.305 1.771 10 10 EDCE C[C@H](O)C1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 719752310 IMCVZWNEFUAGLF-PWCHPLFNSA-N 326.194 1.218 10 10 EDCE C[C@H](N)c1ccc(N2CC(=O)NC(=O)C2(C)C)c(Br)c1 97301204 HECVJARMEPOHSE-QMMMGPOBSA-N 340.221 1.710 10 10 EDCE O=C(NCc1cccc(Cl)c1O)NCc1nnc2n1CCOC2 1227618602 NOYGPPCEEPWPNH-UHFFFAOYSA-N 337.767 1.167 10 10 EDCE Cc1nc2c(cc1C(=O)NCc1ccc(O)cc1O)c(C)nn2C 1162278763 LOGJDDQDMNBKKV-UHFFFAOYSA-N 326.356 1.926 10 10 EDCE COCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N=NC(N)=O)cc1 1318228767 QVEPYBHZTLVALC-GJZGRUSLSA-N 345.403 1.784 10 10 EDCE O=C(NCCNC(=O)c1cccc(O)c1O)OCc1ccccc1 1640829674 JTOUFNQAUQHKPN-UHFFFAOYSA-N 330.340 1.754 10 10 EDCE CN1C(=O)O[C@H]2CN(c3ccc(CN)c(Br)c3)C[C@@H]21 2120409967 MQVRRJICYJZJAP-RYUDHWBXSA-N 326.194 1.547 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cc2cnn(C)c2)cc1C 1273901983 XBVUAWGSRWNTPH-PLNGDYQASA-N 342.443 1.742 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)/C=C/c2cn(C)cn2)c2ccccc2O1 1352671107 MUCUELVPJIHKMX-KIUWMYQTSA-N 327.340 1.401 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccc([C@H]2NC(=O)NC2=O)cc1 1454191596 DXHQFDOBFOFKBT-OAHLLOKOSA-N 341.323 1.160 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1NC(=O)CC1(C)C 1290718530 FCQWHJLPYLMGOA-HNNXBMFYSA-N 343.431 1.843 10 10 EDCE Cc1ccc(S(N)(=O)=O)cc1C(=O)N[C@@H](C)c1ccccc1O 1454820885 UDIVEQHXMCTTPY-NSHDSACASA-N 334.397 1.839 10 10 EDCE Cc1cc(O)nc(C(C)(C)NC(=O)/C=C\c2ccc(O)c(O)c2)n1 1452712333 NNEXDCNVDRLGIF-ALCCZGGFSA-N 329.356 1.967 10 10 EDCE CN(C#N)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1539083191 JPRWIWHGABLKLD-UHFFFAOYSA-N 335.275 1.923 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2CCNC(=O)C2)cc1C 1482271905 HGRYMAYZTLOHPP-GOEBONIOSA-N 347.459 1.466 10 10 EDCE CCN1C[C@@H](C(=O)N(C)CCNCc2ccc(OC)c(C)c2)CC1=O 1713598627 XTWBPRFHJLNYOV-INIZCTEOSA-N 347.459 1.420 10 10 EDCE CN(CC(=O)NCc1c(O)cccc1O)C(=O)OCc1ccccc1 1558535350 HTVTYDXOPXJKJX-UHFFFAOYSA-N 344.367 1.983 10 10 EDCE Cc1cc(Cn2nnc(C(=O)NCc3cc(O)ccc3O)c2C)on1 1633599254 VCZDQFSYQFLZSD-UHFFFAOYSA-N 343.343 1.272 10 10 EDCE COc1ccc(CNC2CC(N(C)C(=O)[C@H](C)CC(N)=O)C2)cc1C 1734597993 JSLJWZQMJOAALY-IUDNXUCKSA-N 347.459 1.594 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)C2CN(C(C)=O)C2)cc1C 1731724149 ABQRCZZUMCDPNE-CQSZACIVSA-N 347.459 1.466 10 10 EDCE CCCCC(=O)NC[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1684191207 PKQOTODUASSCEA-XBXGTLAGSA-N 349.431 1.914 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCn3cncc3C2)c([N+](=O)[O-])c1 1773523822 FKJQIQYCVFMTEL-HYXAFXHYSA-N 328.328 1.998 10 10 EDCE C[C@@H](Cn1cncn1)N[C@H](C)c1ccc(N2CCOCC2)c(F)c1 164220269 WEASJEAEJFYXLY-UONOGXRCSA-N 333.411 1.993 10 10 EDCE C[C@@H](O)[C@@H](C(=O)O)N1C(=O)/C(=C\c2cccc(O)c2)SC1=S 1858592045 GZHHBUOCCCYKON-QEXLZLQKSA-N 339.394 1.427 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)cc1Br 2146307291 YSCRJTQUVFJYTP-KMUNFCNLSA-N 341.249 1.650 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@H]1CCOC1 1985097025 ZRUABHNLVHZXFG-ONGXEEELSA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 1986143070 LXOZNAQNFYUKQN-QMTHXVAHSA-N 325.369 1.270 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2ccc(O)c(O)c2)CCO1 2006283213 HKYNVJOXEVQGMQ-LLVKDONJSA-N 338.360 1.769 10 10 EDCE CC(C)(C)OC(=O)N1CC(C)(C)OC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010389823 VFDLYKDCEDXZTC-LLVKDONJSA-N 339.396 1.922 10 10 EDCE O=C(O)C[C@]1(O)CCCN(Cc2c(O)cccc2Br)C1 2160875459 CPXPLVLBRFVPSA-CQSZACIVSA-N 344.205 1.956 10 10 EDCE CN1CCO[C@H](CN(C)c2cc(Br)c(CN)cc2F)C1 707820901 WLDBVHRZGGDHIX-NSHDSACASA-N 346.244 1.814 10 10 EDCE O=C(O)[C@@H]1CO[C@H](CNCc2cc(Br)cc(F)c2O)C1 715788390 MJBGGTHESGEHBS-WPRPVWTQSA-N 348.168 1.873 10 10 EDCE NCc1ccc(N2CCCN(C3COC3)CC2)c(Br)c1 2169593610 NCGRNBCJQYFIOF-UHFFFAOYSA-N 340.265 1.819 10 10 EDCE CNCc1ccc(N2CCN3CCOC[C@@H]3C2)cc1Br 2185883207 WKVZTQPZPKPDNB-AWEZNQCLSA-N 340.265 1.689 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)cc1Br 2102176379 BUMZANOQOZZGSP-GFCLTOETSA-N 328.206 1.698 10 10 EDCE CNCc1ccc(N2C[C@@H](OC)C[C@@H](O)C2)c(Br)c1 2109018287 NPFYSKUXRFIVRF-NEPJUHHUSA-N 329.238 1.755 10 10 EDCE NCc1ccc(N2CCCCC2(CO)CO)cc1Br 2089869934 JIVSGIMKARCIKL-UHFFFAOYSA-N 329.238 1.622 10 10 EDCE CN(C[C@@H]1CCS(=O)(=O)C1)c1ccc(CN)cc1Br 2092351429 CHDSSXUCRYBXNB-NSHDSACASA-N 347.278 1.779 10 10 EDCE OCC[C@]1(CO)CCN(c2ccc(CO)cc2Br)C1 2097023991 HOTMHXAVFNCGMC-CQSZACIVSA-N 330.222 1.513 10 10 EDCE COc1ccc(Br)c(CN2CC[C@H]3CNC[C@@H]32)c1O 2227743047 NHSCNUKLCANGMV-CABZTGNLSA-N 327.222 1.957 10 10 EDCE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=CNN1CCCCCC1 2297062178 UDMWEEXJFYRUKP-UHFFFAOYSA-N 332.360 1.123 10 10 EDCE CC(C)S(=O)(=O)N(C)NCc1cccc(Br)c1O 2317494711 CQGNHUKGSFRPAP-UHFFFAOYSA-N 337.239 1.829 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@H](O)C[C@@H]2CO)c(Br)c1 2335171963 ZQSYCODGMUJSNR-MVWJERBFSA-N 329.238 1.661 10 10 EDCE Cc1ccc(CNS(=O)(=O)c2cc[nH]n2)c(O)c1Br 2352626160 QCXNARNLADOKSL-UHFFFAOYSA-N 346.206 1.665 10 10 EDCE CN(C)CCNC(=O)c1ccc(/C=C2/SC(=S)N(C)C2=O)cc1 27532992 XXPGQULOAIRXBR-JLHYYAGUSA-N 349.481 1.809 10 10 EDCE CC(C)(C)OC(=O)N1CC(CC(=O)O)(NCc2ccccc2O)C1 303964795 OQZPWCVBZFCYKK-UHFFFAOYSA-N 336.388 1.946 10 10 EDCE COC[C@@H](O)CNC(=O)c1cc(C)n(-c2ccc(C#N)cc2)c1C 305188432 JFIGNBPEROGTAS-INIZCTEOSA-N 327.384 1.703 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@@H]3[C@H]4CO)c(Br)cc2[C@H]1O 2358060593 VKVFVBGIRNGYLT-HUHPYQOSSA-N 339.189 1.252 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@](C)(CN)CO 1952204543 MCEQJXGNWBSHNS-WMLDXEAASA-N 340.420 1.491 10 10 EDCE COc1cccc(CNC(=O)N[C@@H]2CCCn3nc(C)nc32)c1O 83741325 WAHKVCNKRUBVJX-GFCCVEGCSA-N 331.376 1.635 10 10 EDCE COc1ccc(CNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3C)C2)c(O)c1 373398727 HYCFNJNCOWMGME-ZKYQVNSYSA-N 333.388 1.209 10 10 EDCE CC(=O)C(=O)COC(=O)c1cccc(NC(=O)c2cccnc2)c1 808503006 XUHGEDCOIXVVAF-UHFFFAOYSA-N 326.308 1.649 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](C)NC(N)=O)c(O)c1Br 2380770403 AVOOHBUCRGUWEI-MRVPVSSYSA-N 344.209 1.478 10 10 EDCE COC[C@@H]1CN(c2cc(Br)c(CN)cc2F)CCO1 705817813 BKBRYLCCRWXCFD-JTQLQIEISA-N 333.201 1.899 10 10 EDCE CN(C)c1ccc(CNC(=O)CCCn2ccc(C(=O)O)n2)cc1 911119388 HYQJNZBNVDZGKK-UHFFFAOYSA-N 330.388 1.744 10 10 EDCE C[C@@H](CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)NC(N)=O 847393921 RHWIKTOHMKBVGY-QWHCGFSZSA-N 334.420 1.147 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@@H]2CC[C@@H]3C[C@@H]23)c1 927481275 CATSQPGRWAIRJG-LOWVWBTDSA-N 338.429 1.930 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C2CS(=O)(=O)C2)cc1F 865635229 BKVIFQUOPIURJU-UHFFFAOYSA-N 328.409 1.333 10 10 EDCE COC[C@@]1(C)CN(CC(=O)NCc2ccc(N(C)C)cc2)CCO1 860202937 SSIPCYHNHUTEDI-GOSISDBHSA-N 335.448 1.106 10 10 EDCE Cn1c(CNC(=O)/C=C\c2ccc(O)c(O)c2)nnc1C1CCC1 764349116 ITDCZLWCPFUFDV-VURMDHGXSA-N 328.372 1.823 10 10 EDCE CC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 869294505 AXMWLGJFAXLLEK-SFHVURJKSA-N 345.443 1.275 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](O)[C@@H](C)O)c1 871144521 YHEDOMZNXSXUQI-CXAGYDPISA-N 330.384 1.378 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1Cc2cccc(O)c2C1 871207238 LCAWHQHTDIDFAJ-GFCCVEGCSA-N 336.388 1.510 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CNCC(C)(C)F)CC2)cc1 872217119 NQHHBEWBILMSCR-INIZCTEOSA-N 339.455 1.516 10 10 EDCE CN1CC(CN(C)c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 709352113 BPOABOMUEPVCEK-CYBMUJFWSA-N 340.221 1.432 10 10 EDCE Cc1[nH]c2ccnn2c(=O)c1CC(=O)NCc1c(O)cccc1F 1156170855 VGFMDOFZUVQIOJ-UHFFFAOYSA-N 330.319 1.035 10 10 EDCE NS(=O)(=O)Cc1ccc(C(=O)NCc2c(O)cccc2F)cc1 1156170667 RDOLAZMCTMSLJS-UHFFFAOYSA-N 338.360 1.250 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H]2CCNC(=O)C2)cc1C 1317390336 OESYPYVAIGRMJK-ZBFHGGJFSA-N 347.459 1.514 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@@H]2[C@@H](O)CO)c(Br)c1 2123209237 HCKUAYORHSPPIJ-FZZIBODNSA-N 329.238 1.791 10 10 EDCE O=C(C(=O)N1CCO[C@@H](C(F)(F)F)C1)N1Cc2cccc(O)c2C1 1329365754 NASPFNQVPUVCTR-GFCCVEGCSA-N 344.289 1.024 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H]3CC3(C)C)C2)cc1 1328513965 OUELFWYDWNWSKY-DOMZBBRYSA-N 331.416 1.305 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3[C@H]4CCC[C@H]43)C2)cc1 1347617594 SSYFZKRLDJFDFP-SJWGOKEGSA-N 343.427 1.305 10 10 EDCE COc1nccc(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)n1 1267401491 NCVCDTKIUVHCFT-UHFFFAOYSA-N 344.415 1.664 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C[C@@H]2CCN(C)C2)cc1C 1265850318 CRYFHBBUIAJJOX-WBVHZDCISA-N 333.476 1.940 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CN(C)[C@@H]1CCC[C@H]1O 1469103429 HDFBTXXVOHYUSV-KFKAGJAMSA-N 347.503 1.953 10 10 EDCE CC(C)(C)n1nnc(CNC(=O)c2cc3cc(O)c(O)cc3s2)n1 1469637863 ZTIWYJUZWTUQTR-UHFFFAOYSA-N 347.400 1.984 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2nccn2C)cc1C 1714738784 TZPJCNUERIXZRV-UHFFFAOYSA-N 344.459 1.918 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nn(C)cc1[N+](=O)[O-] 1623574577 RYAZRSMOTNVSEB-UHFFFAOYSA-N 325.321 1.450 10 10 EDCE Cc1nc(O)c2ccc(C(=O)NCc3ccc(O)cc3O)cc2n1 1557085867 YQVJXTXVZOAKFE-UHFFFAOYSA-N 325.324 1.985 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cccc[n+]1[O-] 1630481181 OGHFLYVFHONVRI-UHFFFAOYSA-N 330.340 1.231 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccnc2[nH]c(O)nc12 1633818267 GMEKCOKXELZSFG-QMMMGPOBSA-N 328.328 1.436 10 10 EDCE COc1ccc(CNC[C@@H]2CCCN2C(=O)CCNC(N)=O)cc1C 1723976036 GEYVWEGBFZWXRF-HNNXBMFYSA-N 348.447 1.143 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@@](C)(O)CCOC 1727507228 ISEYGYDVEGJWNW-SFHVURJKSA-N 348.447 1.970 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2ccc(O)nn2)cc1C 1725485504 ZPHCHDBTLLPLBC-CYBMUJFWSA-N 344.415 1.750 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C(C)(C)CNC(C)=O)cc1C 1567060083 AAAIXXKXRFATRG-AWEZNQCLSA-N 349.475 1.760 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CNC(=O)c1ccoc1C 1634939835 UNNNCODWHOJCOR-UHFFFAOYSA-N 337.372 1.826 10 10 EDCE Cc1cc(C(=O)N2CCN(C)[C@H](CO)C2)c(C)n1-c1ccc(F)cc1 1642567298 PPVYZNYQIWUREU-KRWDZBQOSA-N 345.418 1.982 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)N3CC(CO)(CO)C3)c2C)c1 1651649938 RAPQDJIPMOKOJF-UHFFFAOYSA-N 328.412 1.829 10 10 EDCE CC[C@@H](CNC(=O)CC(C)C)NC(=O)c1cc(OC)nc(OC)c1 1759296827 UQOIIBMTKZCQBL-ZDUSSCGKSA-N 337.420 1.770 10 10 EDCE CC(C)Oc1nc2sc(=Cc3ccc(N(C)C)cc3)c(=O)n2n1 1772719877 KCPAITLHXQMLRY-UHFFFAOYSA-N 330.413 1.552 10 10 EDCE O=C(Nc1ccccc1S(=O)(=O)O)c1cc(O)c(O)c(O)c1 1865876005 MEYRLPVUKCEWEO-UHFFFAOYSA-N 325.298 1.302 10 10 EDCE O=C(NC1CN(C(=O)c2cccc(O)c2O)C1)OCc1ccccc1 1962353077 FXLVYMBADIDAAT-UHFFFAOYSA-N 342.351 1.849 10 10 EDCE Oc1cccc(Br)c1CN[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@H]2O 1974164004 WERSDYMGGMPIPL-XSMGVEEHSA-N 328.206 1.375 10 10 EDCE [N-]=[N+]=N[C@@H]1CCN(S(=O)(=O)N2CC(OCc3ccccc3)C2)C1 1977425088 IWPUBNUDEKOGGW-CYBMUJFWSA-N 337.405 1.517 10 10 EDCE CNCc1ccc(N2CCCCC2(CO)CO)c(Br)c1 2146076478 ITVVEMXOUBPZTQ-UHFFFAOYSA-N 343.265 1.882 10 10 EDCE CCN(C(=O)OC(C)(C)C)[C@@H]1COC[C@H]1C(=O)NCCN=[N+]=[N-] 1985093735 DRAMRODVROUFSV-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C1(F)F 1985095618 GZCBUAWOIPSZDQ-DTWKUNHWSA-N 331.323 1.914 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)NCCCCN=[N+]=[N-] 1985102650 KAVMRGOEIOSRGL-UHFFFAOYSA-N 328.417 1.650 10 10 EDCE C[C@@H](CNC(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 1988131988 YNRYXNDOPSGIDP-QMMMGPOBSA-N 326.349 1.446 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 2010396611 OLKIZSPHDYVBKU-JTQLQIEISA-N 345.375 1.465 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2010402372 PZHBOEDHHPSLKX-LLVKDONJSA-N 339.396 1.829 10 10 EDCE CS(=O)(=O)N[C@@H]1CCN(c2ccc(CN)cc2Br)C1 703006736 PYSMGBZEWVVSLW-SNVBAGLBSA-N 348.266 1.036 10 10 EDCE NCc1ccc(N2CC[C@]3(CNC(=O)C3)C2)c(F)c1Br 2163341320 KIFKNLFYIHQZSF-AWEZNQCLSA-N 342.212 1.763 10 10 EDCE CCNCc1ccc(N2CC3(CNC(=O)C3)C2)cc1Br 2176158710 WERIOWHQNMZREE-UHFFFAOYSA-N 338.249 1.885 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 1906905818 GIMUGWFCGBQIKE-TWDLFLEPSA-N 336.432 1.945 10 10 EDCE NC(=O)N1C[C@@H]2C[C@H]1CN2Cc1cc(Br)cc(F)c1O 2192231855 GGCHWFFHPRSYLK-UWVGGRQHSA-N 344.184 1.631 10 10 EDCE Nc1ccc(CCC(=O)NCCn2cc(Br)nn2)cc1 2192982216 NXEYBMWBFHWEOL-UHFFFAOYSA-N 338.209 1.372 10 10 EDCE CCn1nnc(Br)c1CNCc1cccc(O)c1O 2100253319 ZBGFXMDCKVBKFU-UHFFFAOYSA-N 327.182 1.762 10 10 EDCE O=S1(=O)C[C@H]2CCN(Cc3cccc(Br)c3O)[C@H]2C1 2094883574 WYZCNVCFARBKCU-PWSUYJOCSA-N 346.246 1.774 10 10 EDCE Nc1ccc(CS(=O)(=O)NCc2conc2Br)cc1 2230525617 CXYQIPABBXLDQQ-UHFFFAOYSA-N 346.206 1.639 10 10 EDCE CNCc1ccc(N2CC(N3CCOC3=O)C2)c(Br)c1 2235666658 OSFTZJZAELGNPT-UHFFFAOYSA-N 340.221 1.809 10 10 EDCE COCC1(NCc2c(Br)ccc(OC)c2O)COC1 2227748647 PNARSNHXUKPOPD-UHFFFAOYSA-N 332.194 1.668 10 10 EDCE O=C(O)[C@@]12CCO[C@H]1CN(Cc1cc(Br)ccc1O)C2 2296424090 YFGUWSYGIOTNBM-GXTWGEPZSA-N 342.189 1.830 10 10 EDCE CC=CC[S@](=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 2297494965 JODAQQYDPIKHAF-QHCPKHFHSA-N 336.457 1.669 10 10 EDCE Cn1cc(C=CC(=O)N2CCc3c(Cl)cccc32)c(=O)n(C)c1=O 2298533964 LGPIRTIYSKZVRK-UHFFFAOYSA-N 345.786 1.340 10 10 EDCE C[C@H]1C(=O)N(C)CCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2310227989 NFAJYJXRSMQYPY-HNNXBMFYSA-N 343.427 1.226 10 10 EDCE Cc1ccc(CN(C)C[C@@]2(O)CCNC2)c(O)c1Br 2352641024 PDOSYUZPGHRDPI-CQSZACIVSA-N 329.238 1.619 10 10 EDCE CNC1CCN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)CC1 179143350 ZABSPVFEHHLOOZ-QPJJXVBHSA-N 329.444 1.747 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@](C)(O)CN 1951699903 SIONKVFYRBKJFD-XJKSGUPXSA-N 326.393 1.243 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cn2c(n1)COCC2 65231623 JNQXYBWOPGQQCY-UHFFFAOYSA-N 342.399 1.180 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)c(Br)c1 2357053417 VSHVOIBIAJWZBJ-FSJWZZSZSA-N 341.249 1.932 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1nnc2ccccc21 186418508 FRYFZSHKQNMQJL-LLVKDONJSA-N 326.356 1.590 10 10 EDCE Cn1cnc(Br)c1C(=O)NCCc1ccc(O)c(O)c1 2362361878 OFSSSSWMNNBDBV-UHFFFAOYSA-N 340.177 1.566 10 10 EDCE CCN1CCN(C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 244046462 SZPBEHJFZMAVBS-UHFFFAOYSA-N 332.448 1.575 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)C[C@@H]1CCCCO1 297701865 CQHGQKIMDPAVIN-KRWDZBQOSA-N 347.459 1.739 10 10 EDCE CC(=O)C(=O)COC(=O)CCS(=O)(=O)c1ccc2c(c1)CCC2 808503412 CLIRZAMRHFFBMX-UHFFFAOYSA-N 338.381 1.040 10 10 EDCE CC[C@H](O)CN(C)c1cc2c(cc1Br)[C@H](NC)C(=O)N2 2162893110 GQCQKFVEYHLFSY-SDBXPKJASA-N 342.237 1.869 10 10 EDCE COc1ccc(C(=O)NCC(=O)NCc2cccc(OC)c2O)cc1 727760919 DIFARZDPZFTNOF-UHFFFAOYSA-N 344.367 1.456 10 10 EDCE Cn1ccc(C2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)n1 905721550 FOHSDWGBJBQPPV-QGZVFWFLSA-N 329.400 1.931 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@](C)(O)[C@H](O)C2)c(Br)c1 1893331925 NMWMJINUJYEULT-CUOATXAZSA-N 330.222 1.824 10 10 EDCE CN(C)CCOc1ccc(N(C)C[C@H]2CCCN(C(=O)CN)C2)cc1 841011292 HJHCUGAKPPPXKL-MRXNPFEDSA-N 348.491 1.261 10 10 EDCE COc1cccc(O)c1CNC[C@@H]1CCC[C@@]12NC(=O)N(C)C2=O 748098415 CFNZOYHIVAWCSB-APPDUMDISA-N 333.388 1.211 10 10 EDCE Cc1noc(C)c1CN(C)Cc1cc(O)n2ncc(C(=O)O)c2n1 846237330 DXIJBLAMEHDUMB-UHFFFAOYSA-N 331.332 1.370 10 10 EDCE COC(=O)[C@@H]1C[C@H]1[C@H]1NC(=O)N(Cc2ccc(N(C)C)c(F)c2)C1=O 924540061 BMSPPNJZEDOHTB-JTNHKYCSSA-N 349.362 1.121 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCN3CC=CCC3)C2)cc1 854298278 ZLTOKHHMIAVZNS-INIZCTEOSA-N 344.459 1.835 10 10 EDCE O=C(/C=C/[C@H]1CCCO1)NCc1ccc(N2CCC(O)CC2)cc1 856209522 RCUJHZGDZZJZKQ-LKGOPFMKSA-N 330.428 1.999 10 10 EDCE COc1ccc(CNCC[C@H]2CNC(=O)C2)cc1Cn1cccn1 922779871 BSAXZXAYDPIDBL-OAHLLOKOSA-N 328.416 1.556 10 10 EDCE C[C@H]1CNCC[C@@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851664362 XZFCAJLCXKHREC-KSSFIOAISA-N 346.475 1.445 10 10 EDCE COCCc1cc(NC(=O)NCCc2ccc(O)c(O)c2)n(C)n1 768997595 BNEFYVIKNFUSPQ-UHFFFAOYSA-N 334.376 1.384 10 10 EDCE CC(C)(CO)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 769444697 BWLQQCVZINPSKL-UHFFFAOYSA-N 333.476 1.412 10 10 EDCE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1c(O)cccc1OC 770377200 YMXQSBQRHMTNTD-BHTHQVBYSA-N 349.383 1.326 10 10 EDCE CCN1CC[C@@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)[C@@H](C)C1 1118946404 ZQCCHOWJPCZMMS-XJKSGUPXSA-N 345.443 1.423 10 10 EDCE COc1ccc(N2CCCN(C(=O)CCCCC(N)=O)CC2)cc1 779610037 NTKGTJLIQDPIKO-UHFFFAOYSA-N 333.432 1.780 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC[C@H]3OCCNC(=O)[C@@H]32)c1O 879720750 VBNKAVFINABPOG-HUUCEWRRSA-N 336.363 1.213 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCC[C@@H]3CO)c(Br)cc21 92775390 LDIMATJXFROJKP-OQPBUACISA-N 340.221 1.623 10 10 EDCE CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(=O)N1Cc2cccc(O)c2C1 1329476457 AKRCRCVFZIQDFC-CABCVRRESA-N 343.427 1.320 10 10 EDCE CN1CCN(c2ccc(CN3C[C@H]4COC[C@@H](C3)O4)cc2F)CC1 1321274345 BZGCNADGANUVIQ-IYBDPMFKSA-N 335.423 1.177 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3C[C@H]4CC[C@H]3C4)ccc21 1324795031 OUVWUKXICHPMKX-JLJPHGGASA-N 341.455 1.990 10 10 EDCE COc1ccc(N2C[C@H](OC)[C@H](N)C2)c(OC)c1Br 2122514210 XTYDUEZNPLZAKH-KCJUWKMLSA-N 331.210 1.629 10 10 EDCE NCc1ccc(N2CCN3CCOC[C@H]3C2)c(Br)c1 2129378202 MALAKFNSHUIRDC-GFCCVEGCSA-N 326.238 1.429 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCC[C@@H]3C)C2)cc1 1261694535 SMUBCFSEYYMHFN-ZQIUZPCESA-N 345.443 1.695 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@H]1CCCN(CC(F)(F)F)C1=O 1347235898 ZUXLGUNWFHKBOM-SNVBAGLBSA-N 346.305 1.515 10 10 EDCE O=C(O)C=Cc1ccc(N2CC(=O)NC(=O)C2)cc1Br 1911906956 QYGPEEDZENSARH-UHFFFAOYSA-N 339.145 1.010 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C(C(N)=O)[C@H]3C2)cc1Br 2136584471 CGEKIXYICGTKPM-SWPVVBRQSA-N 325.206 1.670 10 10 EDCE COC(=O)C[C@@](C)(NC(=O)c1cccc(O)c1O)c1ccncc1 1467369857 WWNKFLJAVCFIFY-QGZVFWFLSA-N 330.340 1.701 10 10 EDCE C[C@H](NC(=O)N[C@H]1CCN(c2cc(O)ncn2)C1)c1ccccc1O 1479509468 SHGYTHPLPJDFOI-RYUDHWBXSA-N 343.387 1.527 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@H]2CC23CC3)cc1C 1700952246 QQEIGZGBQBTGFQ-JKSUJKDBSA-N 332.444 1.713 10 10 EDCE C[C@](O)(CO)[C@H]1CCN(c2ccc(CN)c(Br)c2)C1 2138099265 AUIVHYNWEQGQLG-FZMZJTMJSA-N 329.238 1.477 10 10 EDCE CC(=O)N/C(=C/c1ccccc1)C(=O)NCc1cccc(O)c1O 1633509348 ULXJYNDMQGHUMO-XNTDXEJSSA-N 326.352 1.891 10 10 EDCE C[C@H]1C[C@@H](NCCCO)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1676784606 XWIKWDCQQDFMRI-SMDDNHRTSA-N 333.392 1.424 10 10 EDCE COc1ccc(N2N=C(C)/C(=C(/C)NN3CCOCC3)C2=O)cc1 13626149 MXLZMMKFWMSAEW-FOWTUZBSSA-N 330.388 1.529 10 10 EDCE O=C(O)[C@@H]1CCCN(C(=O)CCNCc2cc(Cl)ccc2O)C1 1857864896 MFBSIWXNVDZQMG-LLVKDONJSA-N 340.807 1.849 10 10 EDCE Cc1c(OCC(=O)O)c(=O)ccn1CCCOc1ccc(N)cc1 1857919562 LXDLMCSYEMEUNE-UHFFFAOYSA-N 332.356 1.671 10 10 EDCE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1C(=O)c1cccc(O)c1O 1965241522 PMSIRPMTEWVXEV-IUCAKERBSA-N 346.305 1.769 10 10 EDCE Nc1ccc(CCN=c2nc(C(=O)O)c(Br)c[nH]2)cc1 2162267814 HPZFSEGBDJJBQF-UHFFFAOYSA-N 337.177 1.596 10 10 EDCE NCc1ccc(N2CCC[C@]3(CNC(=O)N3)C2)cc1Br 2177692188 STLKNXBHCFMRDJ-AWEZNQCLSA-N 339.237 1.560 10 10 EDCE Cn1c(Br)nnc1CCNCc1ccc(O)c(O)c1O 2185198861 YLYZMCOQHHVMCA-UHFFFAOYSA-N 343.181 1.027 10 10 EDCE NCc1ccc(N2CCN3CCOC[C@@H]3C2)c(F)c1Br 2185886988 GGJIGCUXQJNATI-NSHDSACASA-N 344.228 1.568 10 10 EDCE CC1(CO)CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2101059522 QAZSYOYDJIGFIC-LLVKDONJSA-N 326.194 1.220 10 10 EDCE O=c1cc[nH]c(CNCc2c(O)cccc2Br)c1O 2230950060 NLSLFWPCUCIQQS-UHFFFAOYSA-N 325.162 1.838 10 10 EDCE NCc1ccc(N2C[C@@H]3CCO[C@]3(CO)C2)c(F)c1Br 2239915028 GVIMJYHCYJWWTB-HZMBPMFUSA-N 345.212 1.635 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-])C(C)(C)O 2250342705 YOECZYHCHIUEJZ-MXWKQRLJSA-N 341.412 1.998 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](CCC(=O)NCCN=[N+]=[N-])C1 2245921739 OMQHROYWDAANAH-LLVKDONJSA-N 327.385 1.829 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H](C3)[C@H]4O)c(Br)cc21 2286234593 DAZLYAGUJLXESX-NDHFTHCPSA-N 338.205 1.218 10 10 EDCE O=C(NC[C@H](C(=O)O)c1cc(O)nc(O)c1)OCc1ccccc1 1952150210 WXWLHPBFHDKRER-LBPRGKRZSA-N 332.312 1.587 10 10 EDCE CN1C(=O)CNC[C@@H]1c1cc(I)ccc1O 1952068195 NSJQJPVIWXVLBP-SECBINFHSA-N 332.141 1.100 10 10 EDCE COc1cccc(CNC(=O)NCc2cccnc2N(C)C)c1O 73656700 QIEWXAKZMFMDGD-UHFFFAOYSA-N 330.388 1.861 10 10 EDCE CN(C)c1ccc(/C=c2\sc3nc(-c4cccnc4)nn3c2=O)cc1 34107610 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GWLOJFZLSNTMDX-CYBMUJFWSA-N 349.391 1.366 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H]2C[C@@H]3C[C@@H]3C2)cc1C 1278137805 JLQAUIOSFKFTTR-HZMVEIRTSA-N 332.444 1.616 10 10 EDCE CCC(=O)NCCN(CCOC)C(=O)c1ccc(N=NC(N)=O)cc1 1281321510 AGFSHNRVPPKUBT-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE CCN[C@@H](C)c1ccc(N2CC(CO)(CO)C2)c(Br)c1 1914979098 UKHWYQUYZUODAU-NSHDSACASA-N 343.265 1.911 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CN(C)[C@@H]3CCC[C@H]3O)C2)cc1 1453219009 RDUYBKUDSXCCLQ-BMGDILEWSA-N 347.459 1.235 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1coc(S(C)(=O)=O)c1 1297562405 KLXFWFIECFQFAI-UHFFFAOYSA-N 344.385 1.804 10 10 EDCE Cc1nc2ccccc2c(=O)n1CC(=O)N1Cc2cccc(O)c2C1 1471355591 LZLDDGRVRPXPSA-UHFFFAOYSA-N 335.363 1.953 10 10 EDCE Cc1cc(CCC(=O)NCc2ccc(N3CCC(O)CC3)cc2)n[nH]1 1633793305 DZGFKDNERMCBBT-UHFFFAOYSA-N 342.443 1.928 10 10 EDCE C[C@H](NC(=O)NCc1cc(Cl)ccc1O)c1nnc(O)n1C 1565377339 OXQKJXUAMPLKIJ-ZETCQYMHSA-N 325.756 1.440 10 10 EDCE CC(C)[C@@H](C(=O)NCc1c(O)cccc1O)N1C[C@@H](C)O[C@H](C)C1 1635843304 LGIBOJJCMZPOKA-XNJGSVPQSA-N 336.432 1.848 10 10 EDCE C[C@@H](C(=O)NCc1cc(Cl)ccc1O)n1cnc2c(N)ncnc21 1644590505 CPHGGGWQTCWNIL-QMMMGPOBSA-N 346.778 1.645 10 10 EDCE Cc1ccc(C(=O)NC[C@H](O)C(=O)OCc2ccccc2)c(O)c1O 1650925874 DNVIIIIDXUWINP-AWEZNQCLSA-N 345.351 1.240 10 10 EDCE COCCN(C)c1nnc(C)n1Cc1ccc(N2CCOCC2)cc1 1771066064 KZPGDRIOGQDFJI-UHFFFAOYSA-N 345.447 1.554 10 10 EDCE CN(C)C[C@@H]1COC[C@@H]1NCc1cccc(Br)c1O 2141466763 UGMPFDJDDLNYMP-YPMHNXCESA-N 329.238 1.821 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2[C@@H](C(=O)NCCCN=[N+]=[N-])[C@H]21 1964884951 VBLDXOFKEKQLCH-HBNTYKKESA-N 325.369 1.437 10 10 EDCE CO[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NCCN=[N+]=[N-])C1 1965101392 CIBQPPUEWRCWMT-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE C[C@H](N[C@@H](CO)CNC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985776998 GDAKXRBRCPDADK-WDEREUQCSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)NC1[C@H]2CN(C(=O)c3cccc(O)c3O)C[C@H]12 2006281318 KGBZNRNOCOAQKH-QWRGUYRKSA-N 334.372 1.693 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C 2022892881 DOHRXDOGJGXXJQ-AWEZNQCLSA-N 337.420 1.503 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](C(CO)CO)C2)c(Br)c1 2170642224 ISGMMKQRCCQPCP-PWSUYJOCSA-N 344.249 1.930 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)C[C@@H]2CO)c(Br)c1 2089870482 PUNCRNBOUXCRJE-NWDGAFQWSA-N 329.238 1.348 10 10 EDCE NCc1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)c(Br)c1 2090120665 AFSLECHVYHUYIL-ZIAGYGMSSA-N 327.222 1.089 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)cc1Br 2205602383 UEOTVNLBCAGXMR-NGSVMEPUSA-N 347.228 1.609 10 10 EDCE CC(C)(C)OC(=O)NCCN(CCO)c1ccc2c(c1)OCCO2 2247486502 VZDDKIJWKOHEQD-UHFFFAOYSA-N 338.404 1.781 10 10 EDCE COc1ccc(N2CC[C@H]2[C@H](O)CO)c(OC)c1Br 2270692703 BVGJECRNCFFYQT-WCBMZHEXSA-N 332.194 1.398 10 10 EDCE CCNC[C@H](C1CC1)S(=O)(=O)NCc1cnc(SC)s1 2284687831 IGRYPGAHDFBMRX-LLVKDONJSA-N 335.520 1.673 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C=C[C@H](N)C2)c(O)c1Br 2352624597 KZWOLUKEDFBCNI-KOLCDFICSA-N 325.206 1.983 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCc1cc(O)c(O)c(O)c1)C(=O)O 1951402381 MDVCWUQJBQCUSK-SECBINFHSA-N 327.333 1.714 10 10 EDCE COC(=O)CC(C)(C)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 172775585 TVTXQBHSNAJOPR-RMKNXTFCSA-N 346.427 1.994 10 10 EDCE CC(=O)[C@@H](O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951994172 UJWUGKBYZRAQNX-BXUZGUMPSA-N 325.361 1.484 10 10 EDCE C[C@@H]1CN(C(=O)[C@@H](C)N2CCOc3cc(N(C)C)ccc32)C[C@@H](C)O1 181123450 NFWHKZBGZQOOHZ-RBSFLKMASA-N 347.459 1.976 10 10 EDCE COC(=O)[C@H]1C[C@@H](OC)CN1Cc1cc(Br)ccc1O 125713698 IGBSASNNWPHEHO-VXGBXAGGSA-N 344.205 1.917 10 10 EDCE CO[C@H](C)[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 187845447 ZWFFTQOQWVLONK-QWHCGFSZSA-N 339.411 1.885 10 10 EDCE NCc1ccc(N2CCS(=O)(=O)CC2)c(F)c1Br 231839113 IKNLKVKZAKFWJD-UHFFFAOYSA-N 337.214 1.282 10 10 EDCE C[C@@H](NC[C@]1(CO)COCC2(CCC2)N1C)c1cc(F)ccc1O 527954920 NABOOSJHOHGGOK-ACJLOTCBSA-N 338.423 1.798 10 10 EDCE CS(=O)(=O)N1CCC[C@@H](NCc2cc(Cl)c(F)cc2O)C1 294250427 NHSRAMPWTBAQBU-SNVBAGLBSA-N 336.816 1.698 10 10 EDCE CC[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCO1 817274981 VKPVKPOKNCSFPE-HOCLYGCPSA-N 333.432 1.443 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3cncnc3OC)C2)cc1 821883452 GQZUALNENOQFLG-GFCCVEGCSA-N 343.387 1.894 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCN([C@H]2CCOC2)CC1 827114831 XIZZRHYWEZWAPV-IBGZPJMESA-N 331.460 1.430 10 10 EDCE CC1(C)[C@@H](O)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823524347 RIDDWWVDMGSEON-KRWDZBQOSA-N 347.459 1.703 10 10 EDCE Cn1ccc([C@H]2CCCN(Cc3cc4c(cc3O)OC[C@H]4O)C2)n1 905716796 WXMSAOYJIGCDHT-YVEFUNNKSA-N 329.400 1.931 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@](O)(C(F)F)C3)cc2)CC1 824726380 KTSAETXJWWZBRP-QGZVFWFLSA-N 325.403 1.640 10 10 EDCE CC1(NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)CCNCC1 588595407 OLCHNXBBKOPTRC-DAXSKMNVSA-N 329.444 1.795 10 10 EDCE COc1ccc(O)c(CNC(=O)NC[C@@]2(OC)CCSC2)c1 918745178 FGZVZPKTTLIOHI-HNNXBMFYSA-N 326.418 1.722 10 10 EDCE CN1CC[C@H](C(=O)NCc2ccc(O)cc2O)[C@H](c2cnn(C)c2)C1 910942927 ISNRJFONBLNMOE-HOTGVXAUSA-N 344.415 1.183 10 10 EDCE CCN1CCN(CC(=O)N(C)CCN(C)c2ccc(OC)cc2)CC1 846447662 UQLVPSMCPJCNQK-UHFFFAOYSA-N 348.491 1.227 10 10 EDCE O=C1N(Cc2ccc(N3CCOCC3)cc2)C(=O)C23CC(CN12)C3 849352861 ZUBJSPVXGUOCGV-UHFFFAOYSA-N 327.384 1.450 10 10 EDCE C[C@@H]1C(=O)N(CCN(C)C)CN1Cc1cc(Cl)cc(F)c1O 843429147 RYDIBHUEDMTCRR-SNVBAGLBSA-N 329.803 1.737 10 10 EDCE Nc1ccc(NC(=O)C(=O)NC[C@H]2CC[C@H](C(F)(F)F)O2)cc1 927837796 PCNMGOACOLSMNY-GHMZBOCLSA-N 331.294 1.433 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3cc(C)on3)C2)cc1 850535757 BAUQBYLXBXRYQQ-LBPRGKRZSA-N 344.371 1.325 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](NC(N)=O)C(C)(C)C)C2)cc1 855226643 RTZLGLJEUARUEG-DOMZBBRYSA-N 348.447 1.473 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCCCN3C(C)=O)C2)cc1 855229435 KIWIYZGABLKFRT-QAPCUYQASA-N 345.443 1.791 10 10 EDCE Cc1cc(CNC(=O)CS(=O)(=O)N(C)C)c(C)n1-c1ccccc1 863166288 WUUXNSAZKIZULI-UHFFFAOYSA-N 349.456 1.602 10 10 EDCE OCCCCCN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 931493265 UESAJNZNJLJNAZ-UHFFFAOYSA-N 347.503 1.803 10 10 EDCE C[C@H](NC[C@@]12COCCN1C(=O)OC2)c1cc(F)cc(F)c1O 866522234 UGBSFOLAYSZMGC-VFZGTOFNSA-N 328.315 1.542 10 10 EDCE CC(C)(C)OC(=O)CSCC(=O)NCc1ccc(O)c(O)c1 778926222 APMNITLBGFUUEQ-UHFFFAOYSA-N 327.402 1.789 10 10 EDCE Cc1nn(C)c(Br)c1C(=O)NCc1ccc(O)cc1O 1142534110 ZPZYSAQWOOTNCB-UHFFFAOYSA-N 340.177 1.832 10 10 EDCE CNCc1ccc(N(C)C[C@@H](O)CN(C)C)c(Br)c1 690233935 QAQLXYSPAQSTHH-LBPRGKRZSA-N 330.270 1.527 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc2c(c([N+](=O)[O-])c1)OCO2 1303225722 OKEXIXLHNNLAMP-UHFFFAOYSA-N 332.268 1.665 10 10 EDCE COCCn1cc(C(=O)NCc2cc(O)ccc2O)c(=O)cc1C 1176754727 FYEMTYXTVARRGF-UHFFFAOYSA-N 332.356 1.144 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)cc1Br 2126157195 QBLXSVLPFQEYGK-RDBQEKCUSA-N 328.206 1.119 10 10 EDCE CCn1nc(C)c(C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)n1 1321767477 FYQAUFVFOYGRKJ-CYBMUJFWSA-N 345.447 1.832 10 10 EDCE CCN1CC[C@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H]1C 1329812705 WYIWJPXKACFYAM-HIFRSBDPSA-N 345.443 1.566 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)Cc2cc[nH]n2)cc1C 1322451513 DETTUAYWVVKMHQ-UHFFFAOYSA-N 330.432 1.908 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)[C@@H]2C[C@H]2C)cc(OC)n1 1337355836 AYBCTHXWZVSCHG-NTZNESFSSA-N 335.404 1.332 10 10 EDCE O=C(N[C@@H]1CCC[C@]12CCCO2)C(=O)N1Cc2cccc(O)c2C1 1262145781 FMWLFJLQYCSSIK-QAPCUYQASA-N 330.384 1.452 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H]2CCC(=O)N2C)cc1C 1267141944 MNJNALHJXDATIG-GDBMZVCRSA-N 347.459 1.609 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)Cc1cnsn1 1266365395 ZCWQZCQRLPXMQK-UHFFFAOYSA-N 347.404 1.562 10 10 EDCE C[C@@H](NC(=O)NCc1cccc(Cl)c1O)[C@@H]1CN(C)CCN1C 1346765645 BMTGESSFOHTWII-RISCZKNCSA-N 340.855 1.479 10 10 EDCE C[C@H](O)CNC[C@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1270316153 SVUUODKVETZPIT-SMDDNHRTSA-N 333.392 1.424 10 10 EDCE COC(=O)c1ccn(CC(=O)NCc2ccc3cccnc3c2O)n1 1299725278 LHTYXCUNHBEHOS-UHFFFAOYSA-N 340.339 1.240 10 10 EDCE CC(C)(C)OCC(=O)NC(C)(C)C(=O)NCc1ccc(O)cc1O 1299572911 GRMLUANWMQGGMP-UHFFFAOYSA-N 338.404 1.424 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 1294331525 BWFODIJJIINKRB-BPUTZDHNSA-N 330.428 1.973 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cccc(N2CCNC2=O)c1 1471661040 FICOVHPOOOWFJC-UHFFFAOYSA-N 327.340 1.557 10 10 EDCE COCC(=O)NC[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1718133695 MNKBFBGQSKJTEF-JTQLQIEISA-N 335.364 1.072 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2[nH]nnc2C)cc1C 1715670909 NVTVSSFXCHTFMH-GFCCVEGCSA-N 331.420 1.728 10 10 EDCE CCNC(=O)CC(=O)N[C@H](C)[C@H](C)NCc1ccc(OC)c(C)c1 1717406437 GVJSKWIZUWBCET-UONOGXRCSA-N 335.448 1.513 10 10 EDCE Cc1cccc2c(=O)n(CC(=O)NCc3cc(O)ccc3O)cnc12 1637122700 NCXSRQJYLXLVEF-UHFFFAOYSA-N 339.351 1.433 10 10 EDCE CCS(=O)(=O)c1ccccc1C(=O)NCc1c(O)cccc1O 1647270428 RZUFJTCMDICMLF-UHFFFAOYSA-N 335.381 1.821 10 10 EDCE COC(=O)Cc1csc(NC(=O)CN[C@H](C)c2ccccc2O)n1 1659815349 GPPKXYAQXCFTFK-SNVBAGLBSA-N 349.412 1.854 10 10 EDCE O=C(NC1CN(C(=O)OCc2ccccc2)C1)c1ccc(O)c(O)c1 1962360855 ZTUVTSLTKPPMNZ-UHFFFAOYSA-N 342.351 1.849 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)[C@H]1CCc2nnnn2CC1 1179032896 QSZZKSNGOCCTFJ-ZDUSSCGKSA-N 337.383 1.801 10 10 EDCE COC[C@](C)(CO)NCc1c(Br)ccc(OC)c1O 1965982009 LWSNQHDRNSSYJS-ZDUSSCGKSA-N 334.210 1.650 10 10 EDCE C[C@@H](N[C@@H](CO)CNC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985778187 XLOGUTYWZAJGGP-GHMZBOCLSA-N 326.393 1.634 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O 1987680909 NSMZIQKAJWXFNR-SNVBAGLBSA-N 329.401 1.809 10 10 EDCE C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)c2ccc(O)c(O)c2)C1 2006280487 XFECLJHLQIINHV-ZDUSSCGKSA-N 332.278 1.381 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3OCCN(C)[C@@H]3C2)cc1Br 2153995294 QEKPOECYLYAJLZ-VQISRLSMSA-N 340.265 1.988 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1C 2010389237 NAOGIXCXBFOXRE-GFCCVEGCSA-N 340.428 1.696 10 10 EDCE OCCN(Cc1cc(Br)cc(F)c1O)C[C@H]1CCCN1 715778850 NBXQEOXAIZPILW-GFCCVEGCSA-N 347.228 1.840 10 10 EDCE Cn1nncc1C=Cc1nc2ccccc2c(=O)n1CCCC(=O)O 2065304350 YINHSUGNFXVLGJ-UHFFFAOYSA-N 339.355 1.560 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)cc1Br 2178087058 OYPBZGSEPPCXSQ-FJHTZYQYSA-N 342.233 1.946 10 10 EDCE CN1CCN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)[C@H]2C[C@H]21 2168397032 VBPZWWVWZYXLED-AGIUHOORSA-N 338.205 1.327 10 10 EDCE Oc1c(F)cc(Br)cc1CNC1CN([C@H]2CCOC2)C1 2169351245 BUWGJRCOPJGBCH-LBPRGKRZSA-N 345.212 1.857 10 10 EDCE C[C@]1(CO)COCCN(c2ccc(CN)c(Br)c2F)C1 2199845271 MZIFMCQWJZFVKF-AWEZNQCLSA-N 347.228 1.882 10 10 EDCE C[C@H](O)CN1CCN(c2ccc(CN)c(Br)c2)CC1 2113860098 ZEVVGIWDFFGCBY-NSHDSACASA-N 328.254 1.411 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCCC[C@H]1COc1nnc(=N)[nH]n1 2213779142 PRDQEFPPTPLXIT-MNOVXSKESA-N 338.412 1.389 10 10 EDCE CC(C)(C)OC(=O)NCc1cn(CCNc2ccc(N)cc2)nn1 2250016317 LVYSOJLMVKRDQG-UHFFFAOYSA-N 332.408 1.997 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(CNC(=O)CO3)C2)c(Br)c1 2289659167 HGTRGUILBAJEGX-SECBINFHSA-N 341.205 1.208 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)OCCN1CCCC1=O 2297507214 YRMHGLTXBQCUMC-UHFFFAOYSA-N 344.411 1.702 10 10 EDCE Cc1ccc(CN2C[C@H]3CS(=O)(=O)[C@@H]3C2)c(O)c1Br 2352623352 KWPRSWLPGOVYCK-WDEREUQCSA-N 346.246 1.692 10 10 EDCE CC(C)N1C[C@@H](C(=O)NCc2ccc3c(c2)CCCN3C)CC1=O 58769597 QSQNGYIINWCPQW-INIZCTEOSA-N 329.444 1.942 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1CC(=O)CN1 1952233189 FXPUOAVBIKAUKV-QWHCGFSZSA-N 336.388 1.465 10 10 EDCE CC[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)CCN1C[C@@H](C)O 120713948 GHSMJZACNAKIOD-IEBWSBKVSA-N 347.503 1.800 10 10 EDCE COc1ccc(N2CCN(C(=O)Cn3ccc([C@@H](C)O)n3)CC2)cc1 133733077 GGJUWOHAHSKKPH-CQSZACIVSA-N 344.415 1.294 10 10 EDCE CCS(=O)(=O)N1CC(CN[C@@H](C)c2cc(OC)ccc2O)C1 190691247 KQANIDHCTPWEQT-NSHDSACASA-N 328.434 1.333 10 10 EDCE CCNCc1ccc(N2CC(O)(CN(C)C)C2)cc1Br 2369672567 OHHRKKJJWILQSH-UHFFFAOYSA-N 342.281 1.671 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)N3CC[C@@](O)(C(N)=O)C3)c2C)c1 276508886 QXGBSBPQUDJYMS-IBGZPJMESA-N 341.411 1.465 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1cccc(Cl)c1 808519226 XKVVWYLQOJWOKV-SWLSCSKDSA-N 337.759 1.561 10 10 EDCE C/C(=C\C(=O)N1CCOc2cc(N(C)C)ccc21)CN1CCOCC1 900894838 IFNPSKNEIMCSGS-NTCAYCPXSA-N 345.443 1.757 10 10 EDCE Cc1cc(N2CCN(C(=O)c3cc(O)cs3)CC2)n2ncnc2n1 731872403 IKULOONQDFEJMO-UHFFFAOYSA-N 344.400 1.162 10 10 EDCE CN1C[C@@H](CCNC(=O)NCc2ccc(N3CC=CC3)cc2)CC1=O 919909657 UYTXISKSHKTKGM-INIZCTEOSA-N 342.443 1.730 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)Cc3ccon3)CC2)cc1 746175192 QMIBGMGBMTUSHC-UHFFFAOYSA-N 344.415 1.164 10 10 EDCE COC(=O)CC[C@@H]1CC[C@H](C(=O)NCc2c(O)cccc2F)O1 928708401 GUNXZYFYDLVBRL-IINYFYTJSA-N 325.336 1.648 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3nnc(C)s3)C2)cc1 852248770 MHBUOIGEFMFRRS-LBPRGKRZSA-N 347.444 1.933 10 10 EDCE COC[C@@H](NCC(=O)NCc1ccc(N(C)C)cc1)C1CCOCC1 852321348 MBYHTUQPFOYZSZ-GOSISDBHSA-N 349.475 1.400 10 10 EDCE C[C@@H]1C[C@H](NCC[C@H]2CNCCS2(=O)=O)c2c(O)ccc(F)c21 925791759 GSZLYMYTCNRGFC-MDZLAQPJSA-N 342.436 1.446 10 10 EDCE CN1C(=O)N[C@]2(CCC[C@H]2CNCc2ccc3c(c2)CCCO3)C1=O 921813106 BLEKYFUEKMCAEZ-KXBFYZLASA-N 343.427 1.822 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CNC[C@H]3CCCO3)C2)cc1 851639522 HBFUKKYMUIDXDS-WMLDXEAASA-N 333.432 1.159 10 10 EDCE CO[C@H](CC(C)C)CS(=O)(=O)NNc1nc2cccnc2s1 857225820 SGNXBAQZGUHTDI-SNVBAGLBSA-N 344.462 1.999 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC3(CC(F)C3)C2)c1 753820136 MYXCQOOLZYEFFQ-UHFFFAOYSA-N 328.365 1.338 10 10 EDCE Cn1ccc(=O)c(C(=O)NCc2ccc(N3CCOCC3)cc2)c1 930521314 ZAVXBCGKHOTMQH-UHFFFAOYSA-N 327.384 1.152 10 10 EDCE Oc1ccc(F)cc1CNC[C@@H]1CN(Cc2ccncc2)CCO1 862536603 QCCVDBBWNDXJFB-QGZVFWFLSA-N 331.391 1.917 10 10 EDCE COC(=O)[C@]1(C)C[C@@H](OC)CN1C(=O)/C=C\c1ccc(O)c(O)c1 869991336 NAGXXUMZUMYIDF-WKPBYQEPSA-N 335.356 1.290 10 10 EDCE CCOC[C@H]1C(=O)N(Cc2ccc(N3CC=CC3)cc2)C(=O)N1C 761378135 FZYRBKYBJVEHBE-INIZCTEOSA-N 329.400 1.862 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1(C)C 873463556 ICVIAOBKKBPEQJ-CMPLNLGQSA-N 327.377 1.627 10 10 EDCE CC(C)N(C[C@H](C)O)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788931373 DWQRVBUGXLDWRD-HNNXBMFYSA-N 347.459 1.521 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H](C)O[C@@H](CO)C2)c([N+](=O)[O-])c1 786809965 BAQGPPRMUHRMOW-BNHDAMHGSA-N 336.344 1.367 10 10 EDCE Cc1cc(C)n(CC(=O)NCc2ccc(N(C)C)c(F)c2)c(=O)n1 1136453926 BVOHRZITYGVWAM-UHFFFAOYSA-N 332.379 1.382 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)C[C@H]2CCC(=O)N2)cc1C 1319256664 IAVFRHPMNYTORF-XJKSGUPXSA-N 347.459 1.514 10 10 EDCE CC[C@H](CNC(=O)[C@H]1C[C@H]1C(N)=O)NCc1ccc(OC)c(C)c1 1318577252 QEPQXHRNDHYASJ-KFWWJZLASA-N 333.432 1.109 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)cc1Br 2116736546 KFELOEAIUPNAGD-OJICRYGUSA-N 328.206 1.262 10 10 EDCE CCOCC(=O)N(C)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1506254918 DSDDHUYZLCPBRP-UHFFFAOYSA-N 347.375 1.168 10 10 EDCE CC[C@@H](CNC(=O)C1CCC1)NC(=O)c1cc(OC)nc(OC)c1 1285023550 GSQGMRGPQWMZST-ZDUSSCGKSA-N 335.404 1.524 10 10 EDCE C/C(=C\C(=O)N(C)c1ccccc1S(C)(=O)=O)c1cnccn1 1524280010 ALBYOTYLSKFPNZ-ZRDIBKRKSA-N 331.397 1.946 10 10 EDCE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1CC(=O)N(C)C 1603310364 KJCNNKBACMTSGT-UHFFFAOYSA-N 345.447 1.907 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@@H]2CCNC2=O)cc1C 1482860750 MBURIQPVJVQDJC-DZGCQCFKSA-N 333.432 1.124 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2ccncc2)cc1C 1484474883 WIIPFUSGJWXKBQ-UHFFFAOYSA-N 343.427 1.623 10 10 EDCE O=C(Cn1ncc(=O)c2ccccc21)NCc1cccc(O)c1O 1558159269 CQQGKHFMVDDHIN-UHFFFAOYSA-N 325.324 1.124 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC[C@H]1COc2ccccc2O1 1638281944 UVLTUHSFPYUFQZ-ZDUSSCGKSA-N 329.352 1.987 10 10 EDCE C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@@H](C)N1CCOCC1 1585549838 ISBYXJSFFJOYJC-VXGBXAGGSA-N 333.392 1.688 10 10 EDCE COC(=O)c1ccccc1NC(=O)CN1C(=O)[C@H](C)SC1=S 11635423 AEPQEFPTZJXLFO-QMMMGPOBSA-N 338.410 1.661 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](C)Cn1cncn1 158148322 IDEYOROIYGQRKK-AWEZNQCLSA-N 330.436 1.964 10 10 EDCE COC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)Cc1ccc(N)cc1 1865956824 HBDNCAKBPMZAIY-MRXNPFEDSA-N 328.368 1.417 10 10 EDCE CCOC1(C(=O)O)CN(Cc2cc(Br)cc(F)c2O)C1 1972382086 KWKUPORFZPVDGU-UHFFFAOYSA-N 348.168 1.969 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 1985103288 SJXKRNWMHDFEAX-WDEREUQCSA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCN(CC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010393705 WIKCVQGSCKFNID-NEPJUHHUSA-N 338.412 1.497 10 10 EDCE NCc1ccc(N2CCC[C@@H](CO)[C@H]2CO)c(Br)c1 709803712 DCRBNBVRGIBIGQ-SMDDNHRTSA-N 329.238 1.477 10 10 EDCE CN(Cc1cnn(C)c1Br)C(=O)c1cc(O)nc(O)c1 2173260517 AXHLNFRHFDRJKK-UHFFFAOYSA-N 341.165 1.261 10 10 EDCE CO[C@H]1C[C@@H](N(C)C(=O)c2cnn3c(O)cc(C)nc23)C12CCC2 2062331859 QXVMWXFOCMKUIA-OLZOCXBDSA-N 330.388 1.773 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCN(c4cccs4)CC3)c2n1 2063289489 LNBXDZCFPJGZOT-UHFFFAOYSA-N 343.412 1.767 10 10 EDCE O=C1Nc2cc(N3CCCC[C@H](O)C3)c(Br)cc2[C@H]1O 2169201062 DGPISXOJEVNHNX-ISVAXAHUSA-N 341.205 1.786 10 10 EDCE C[C@H](CO)N1CCN(c2ccc(CN)c(Br)c2F)CC1 2169363083 IIBKRHAHDLRSBD-SNVBAGLBSA-N 346.244 1.550 10 10 EDCE O=C1Nc2cc(N3CCC=C[C@H]3CO)c(Br)cc2[C@@H]1O 2182333824 VUSNREJNFUSGCQ-SDBXPKJASA-N 339.189 1.562 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@H](O)C3)cc1Br 2190452457 DWQRSCAAJRNHQH-UJZSJCAASA-N 342.233 1.965 10 10 EDCE CN(C)[C@H]1CN(c2ccc(CN)c(Br)c2F)C[C@@H]1O 2089923894 ROJRAFNVCFVROH-QWRGUYRKSA-N 332.217 1.158 10 10 EDCE CC[C@@]1(CO)COCCN1c1ccc(CN)c(Br)c1 2112708342 NTCPKNYOYMFVMV-CQSZACIVSA-N 329.238 1.886 10 10 EDCE CCn1nnnc1CNCc1cc(Br)cc(F)c1O 2113072260 XDMVZQYHNFBMHT-UHFFFAOYSA-N 330.161 1.590 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)C[C@H]3C2)c(Br)c1 2236979103 MBYJIUARNAPVMJ-HGSJOUDDSA-N 341.249 1.476 10 10 EDCE CO[C@@H](CN)CC(=O)NCc1ccc(C)c(Br)c1O 2352948720 SUQSJYZXBIYUCH-SNVBAGLBSA-N 331.210 1.443 10 10 EDCE CCCN1C(=O)/C(=C/Nc2ccc([N+](=O)[O-])cc2)C(=O)NC1=S 105490588 UVRYWZLDMIFTCF-DHZHZOJOSA-N 334.357 1.544 10 10 EDCE Nc1ccc(CS(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 310152317 GCTROWXJKDCEFI-SFHVURJKSA-N 345.468 1.963 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H](N)CC(=O)O 1951454434 NHHKZUWYXZIRFW-QWRGUYRKSA-N 340.376 1.336 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)O[C@H]1CCNC1 1951831634 AQEVLODWYSXSBP-WFASDCNBSA-N 338.404 1.870 10 10 EDCE CC(=O)NC1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 189843762 SRPRTDYEEIQGMX-UHFFFAOYSA-N 348.472 1.270 10 10 EDCE C[C@H](NCCCn1ccnn1)c1ccc(N2CCC(O)CC2)cc1 184269394 QSUAFGNZAONAMI-HNNXBMFYSA-N 329.448 1.980 10 10 EDCE CC(=O)N1CCc2c(c(C(=O)O)nn2Cc2ccc(N(C)C)cc2)C1 74535845 CIUGBMAGJMVKMS-UHFFFAOYSA-N 342.399 1.600 10 10 EDCE CCOc1ccc(O)c(CN2CCN(Cc3nccn3C)CC2)c1 93131972 WNXLABVYCMKOLG-UHFFFAOYSA-N 330.432 1.842 10 10 EDCE CNC(=O)[C@@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(C)C 255672442 CIJYKEAVZUQRFE-KKMIYCERSA-N 345.443 1.423 10 10 EDCE CCc1n[nH]c(NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)n1 255684101 CPBZOQQQYAOHFY-YVMONPNESA-N 327.388 1.856 10 10 EDCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@H](C2CC2)O1 366507635 VOAKFVQFPPXFAF-VFZGTOFNSA-N 333.344 1.929 10 10 EDCE COc1ccc(O)c(CN[C@H]2CCC[C@H]2CNS(C)(=O)=O)c1 800541944 WWAMEKYIKDXJMC-FZMZJTMJSA-N 328.434 1.208 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCC(=O)N(c2ccc(C)c(C)c2)C1 808531375 RALKXEILVVTCAK-CQSZACIVSA-N 331.368 1.748 10 10 EDCE Cc1ccc(CNC(=O)C[C@@]2(O)CCNC2)c(O)c1Br 2380745076 HFQVZYIRTXMRDO-AWEZNQCLSA-N 343.221 1.194 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](C)c3ccnn3C)CC2)cc1 817421950 PCUFHKUSHRNUSX-AWEZNQCLSA-N 328.416 1.881 10 10 EDCE CN(C)C(=O)N(C)[C@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 827544725 IYDRKGYNAPHXAI-SFHVURJKSA-N 346.475 1.711 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2COC(C)(C)C2)cc1F 827575167 MUSUEBQRQCIQHH-LBPRGKRZSA-N 337.395 1.192 10 10 EDCE O=C(CN1CCN(C2CC2)C1=O)NCc1ccc(N2CCCC2)cc1 821843520 SVBALCDRCQHELC-UHFFFAOYSA-N 342.443 1.803 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cccn(CC(=O)O)c1=O 901605240 PEMKFRALRVSSMW-UHFFFAOYSA-N 343.383 1.271 10 10 EDCE CCC/C=C\[C@@H](O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 900268464 CLWHXGSPFKUSHG-VGOKWCNXSA-N 336.407 1.996 10 10 EDCE O=C(NCc1c(O)cccc1F)NCc1nnc2n1CCCCC2 913913402 BXDPDUQAJKYRFX-UHFFFAOYSA-N 333.367 1.849 10 10 EDCE CO[C@@H]1C[C@@H](CC(=O)O)N(Cc2cc(F)cc(C(C)=O)c2O)C1 846284969 MUCOAPZWEUGAOD-QWHCGFSZSA-N 325.336 1.798 10 10 EDCE CN(C)c1ccc([C@@H](N)CNS(=O)(=O)c2cscn2)cc1 842785009 KAOSXUKEJSFGEZ-LBPRGKRZSA-N 326.447 1.187 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@H]3CCOC[C@H]3OC)C2)cc1 855226231 OKMHNOWABNHCQH-RVKKMQEKSA-N 348.443 1.832 10 10 EDCE CC(C)[C@H](N)CCNC(=O)C(=O)NCCCSc1nccs1 851686322 ZAOLWYZIBRNTKM-LLVKDONJSA-N 344.506 1.231 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cc3cn(C)nc3C)C2)cc1 855224025 JXMQHYBIGFSCHI-HNNXBMFYSA-N 328.416 1.675 10 10 EDCE O=C(NCCN1C[C@@H]2CCCCN2C1=O)NCc1ccccc1O 852651889 KNUJMHWCYPXODP-AWEZNQCLSA-N 332.404 1.482 10 10 EDCE CC(=O)N1CCN(c2ccc(CNc3nccnc3F)cc2)CC1 858508755 YMCGPBJIIKKUTE-UHFFFAOYSA-N 329.379 1.896 10 10 EDCE CO[C@H](CNC(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CCOC1 852138043 FDROZPDDAKABRT-FUHWJXTLSA-N 345.443 1.914 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc(C=O)cn3C)C2)cc1 855226340 RGEFYQIWUUHWHI-CQSZACIVSA-N 327.384 1.855 10 10 EDCE COc1cc(Br)cc(CNCCOCCCN)c1O 863484857 OEJIASPJQPEDMF-UHFFFAOYSA-N 333.226 1.618 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)c1ccc2c(c1)COB2O 863875848 GVNDWRADWVGNLI-UHFFFAOYSA-N 325.173 1.662 10 10 EDCE CC(C)(C)n1nnc(C(=O)NCc2ccc3cccnc3c2O)n1 862025465 VJOWUFWPSRKZFK-UHFFFAOYSA-N 326.360 1.612 10 10 EDCE COc1cc(CN2CCN(CCC(=O)N(C)C)CC2)c(O)cc1C 768461394 CDCXKWJDYCBAPF-UHFFFAOYSA-N 335.448 1.305 10 10 EDCE C[C@H](N)c1ccc(N2CC(NS(C)(=O)=O)C2)c(Br)c1 703155632 HDENTPBUXSILLX-QMMMGPOBSA-N 348.266 1.207 10 10 EDCE C[C@H](OCc1ccccc1)[C@@H](NC(=O)Cc1ccc(N)cc1)C(=O)O 706005866 UQQHCUKFEBIMAK-SCLBCKFNSA-N 342.395 1.986 10 10 EDCE Cc1oc(C(=O)NCc2cc(O)ccc2O)cc1S(C)(=O)=O 1153885370 MQPGABZWLVGNOL-UHFFFAOYSA-N 325.342 1.333 10 10 EDCE CCC(=O)NC[C@H]1C[C@@H](NCc2nnnn2-c2ccc(OC)cc2)C1 1316609196 BECBFVPQLAQIFY-BETUJISGSA-N 344.419 1.065 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC[C@H]2CCN(CCO)C2)cc1 1317811171 IUIQPGRAARPPOC-LBPRGKRZSA-N 333.392 1.283 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@@H]2[C@@H](O)CO)c(Br)c1 2123209232 HCKUAYORHSPPIJ-FZQKWOKYSA-N 329.238 1.791 10 10 EDCE CNS(=O)(=O)c1cccc(C(=O)NCc2c(O)cccc2F)c1 1178410105 MNIQYLIGPNCJMK-UHFFFAOYSA-N 338.360 1.369 10 10 EDCE CCCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(C)C1 1329435321 BRUBKAXDHOSMDN-CQSZACIVSA-N 331.416 1.177 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3cc(C)cc(C)c3O)C[C@@H]12 1328553328 NMPZUHQMODPTNM-ZNMIVQPWSA-N 325.430 1.253 10 10 EDCE C[C@H](N)c1ccc(N2CC(C(=O)N(C)C)C2)cc1Br 2121048006 YAWPFAZEQFMLDE-VIFPVBQESA-N 326.238 1.993 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)CC[C@@H](O)CNC(=O)OC(C)(C)C 1900607489 NLGILEHRHXWAMO-LLVKDONJSA-N 329.401 1.811 10 10 EDCE COc1ncc(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)cn1 1266984556 WRBGTYLERJOKHE-ZDUSSCGKSA-N 344.415 1.710 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC2CCC(NCCCO)CC2)cc1 1265744808 WEIBKAPAEAJLPG-UHFFFAOYSA-N 347.419 1.862 10 10 EDCE CN1C[C@@H](N(C)c2ccc(CO)c(Br)c2)CCC1=O 2131957132 ZFFAINOKNMWZCI-LBPRGKRZSA-N 327.222 1.998 10 10 EDCE COC[C@@H](C)N[C@H]1C[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1263851634 QRFZOXZBKUNTQX-JMSVASOKSA-N 347.419 1.982 10 10 EDCE Cc1nc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)co1 1288913339 RNNZYTVBXLPYGW-UHFFFAOYSA-N 342.399 1.615 10 10 EDCE C[C@H](CNC(=O)C1(CF)CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1285659323 BQYVOKHJIIMOSG-SNVBAGLBSA-N 349.366 1.833 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)CCO1 221236393 JUVUEZDCKRLCBM-JMCQJSRRSA-N 326.194 1.626 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1290479674 USXGCHPSZHGATG-UHFFFAOYSA-N 336.388 1.720 10 10 EDCE NS(=O)(=O)c1cc(C(=O)NCc2c(O)ccc3ccccc23)co1 1472084589 AJSVCJDGRRHLPX-UHFFFAOYSA-N 346.364 1.716 10 10 EDCE COc1cc(N(C)Cc2nnc3n2CCC3)c([N+](=O)[O-])cc1OC 1472648859 NIGCUJZJDHYJQO-UHFFFAOYSA-N 333.348 1.786 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2cc(S(N)(=O)=O)sc2C)c1 1470254901 NSDZOUNLDGDPSH-UHFFFAOYSA-N 340.426 1.648 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@@H](c2nnc3n2CCC3)C1 1616496950 ZYTLAYPHVWFTBP-CYBMUJFWSA-N 342.399 1.584 10 10 EDCE CC(C)[C@H](C(=O)NCc1c(O)cccc1O)N1C[C@@H](C)O[C@H](C)C1 1635843303 LGIBOJJCMZPOKA-PBFPGSCMSA-N 336.432 1.848 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)Cc2cc[nH]n2)cc1C 1568264738 MNMVMWHSVJGPCF-CQSZACIVSA-N 330.432 1.906 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)Cc2ncc[nH]2)cc1C 1732446426 DNPIGQQCDYXIKV-CQSZACIVSA-N 330.432 1.906 10 10 EDCE CCC(=O)NC[C@@H](CC)NCc1nnnn1-c1ccc(OC)cc1 1732188652 LDGQCMRSDDXKHP-GFCCVEGCSA-N 332.408 1.065 10 10 EDCE COC(=O)[C@]1(OC)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1645733821 UPFUVPCXVCCPBA-HNNXBMFYSA-N 334.332 1.253 10 10 EDCE Cn1cc(-c2nn(C)cc2C(=O)NCc2c(O)cccc2O)cn1 1645362996 IDCKSWIWUBZMGH-UHFFFAOYSA-N 327.344 1.162 10 10 EDCE O=C(CNC(=O)NCc1ccco1)NCc1cccc(Cl)c1O 1653563553 BXGSNZPEGHHQCE-UHFFFAOYSA-N 337.763 1.754 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CCN(c2ccc(F)cc2)C1=O 1597568480 FAPSCKSYQWQPML-ZDUSSCGKSA-N 344.342 1.906 10 10 EDCE Nc1ncnc2c1ncn2CCCCC(=O)NCc1ccccc1O 1595792340 GHSRJWMLLSQVKO-UHFFFAOYSA-N 340.387 1.601 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccncc2F)cc1C 1667802288 FVZHTZQSCLWPFE-CQSZACIVSA-N 347.390 1.418 10 10 EDCE COc1cc(Cl)c(C)cc1NC(=O)C[C@H]1C(=O)NN(C)C1=O 169996365 WOYWHJSFTJADMG-QMMMGPOBSA-N 325.752 1.105 10 10 EDCE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@@H]3C[C@@H](O)CN3)cccc21 1866040629 SWSHWCUIASIVJC-BMIGLBTASA-N 336.347 1.123 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(=O)NC(=O)[C@@H]2C)cc1Br 234444994 UZONGMYWVMSGPY-IUCAKERBSA-N 340.221 1.581 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NCc1c(O)cccc1F 1898129391 WAAVHKFDLYZFSD-CHWSQXEVSA-N 326.368 1.913 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)NCCCCN=[N+]=[N-])CC(O)C1 1964942846 IQFFKWPKEKGTHQ-UHFFFAOYSA-N 327.385 1.611 10 10 EDCE CN(C(=O)Cn1cc(Br)ccc1=O)c1ccc(N)cc1 37273961 FRLPYPDJHUDPKS-UHFFFAOYSA-N 336.189 1.856 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@](O)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2011938699 CKMVOPYWVPJEBY-IAQYHMDHSA-N 339.396 1.660 10 10 EDCE CC(C)(C)OC(=O)NCC1(O)CC(C(=O)Nc2ccc(N)cc2)C1 2022901225 IKRVALSZVHHPLK-UHFFFAOYSA-N 335.404 1.873 10 10 EDCE C[C@@H]1CN(C)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 300556293 YVROJIKQJCNAPQ-OQPBUACISA-N 339.237 1.541 10 10 EDCE C[C@@H](CO)CN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 688404691 NOHZFHYAWGQLPF-KRTXAFLBSA-N 328.210 1.466 10 10 EDCE CN1CCO[C@@H](CN(C)c2ccc(CN)c(Br)c2F)C1 707828995 DHPUDJLRNWTXDJ-LLVKDONJSA-N 346.244 1.814 10 10 EDCE COCCNCc1ccc(N(C)CCC(N)=O)c(Br)c1 382061724 GFLHKHXOVLFQFG-UHFFFAOYSA-N 344.253 1.497 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@H](N)C(N)=O 2044377256 DIOYVZAZMDSLJU-AWEZNQCLSA-N 348.447 1.277 10 10 EDCE NCc1ccc(N2[C@H](CO)C[C@@H]3OCC[C@H]32)cc1Br 2090543715 ZDNVYLNMSBXTKM-YUTCNCBUSA-N 327.222 1.636 10 10 EDCE CN[C@H](c1ccccc1O)[C@H](O)c1c(Br)cnn1C 2091868556 SPHSISFSRAHEPT-YPMHNXCESA-N 326.194 1.882 10 10 EDCE CN(C)c1ccc([C@H](NN)c2nn(C)nc2Br)cc1 2226976242 GGFUNQWPYQHIPX-JTQLQIEISA-N 325.214 1.196 10 10 EDCE CC1(C)OC(=CC=C2C(=O)NC(=O)NC2=O)C=C(c2ccccc2)O1 2296656440 MKPULMPYJJPLDZ-UHFFFAOYSA-N 340.335 1.987 10 10 EDCE Cc1nc2ccccn2c1C=C1SC(=S)N(CC(=O)O)C1=O 2323687878 AAQSUGBWLCONHO-UHFFFAOYSA-N 333.394 1.929 10 10 EDCE CN(NCc1cccc(Br)c1O)S(=O)(=O)C1CCC1 2339723184 SWUGHHYJGMPOGR-UHFFFAOYSA-N 349.250 1.973 10 10 EDCE Cc1ccc(CNCCc2nncn2C)c(O)c1Br 2352684162 ORHWTSOQBQNQIV-UHFFFAOYSA-N 325.210 1.924 10 10 EDCE CCCC(=O)NCC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 68529953 WVSQPCZUTQKQEN-AWEZNQCLSA-N 333.432 1.617 10 10 EDCE CCc1nc2n(n1)CCC[C@H]2NC(=O)NCc1cccc(OC)c1O 88755964 TZUQZFNXDKVDQF-GFCCVEGCSA-N 345.403 1.889 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(I)c(O)c1 808536287 HHUMMMBIUOIYIY-UHFFFAOYSA-N 348.092 1.312 10 10 EDCE COc1ccc(N2C[C@H](N)[C@@H]3COC[C@H]32)c(OC)c1Br 2162633858 BZPJQMGOENOYNL-ATZCPNFKSA-N 343.221 1.629 10 10 EDCE CCOC(=O)c1cc(NS(=O)(=O)c2ccnn2CC)ccc1O 295255173 XHLFDBBVJJKWFY-UHFFFAOYSA-N 339.373 1.586 10 10 EDCE CC(=O)C(=O)COC(=O)CCCOc1ccc2c(c1)CCC(=O)N2 808501530 QYBXBLZAVDSDRQ-UHFFFAOYSA-N 333.340 1.432 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3C(=O)NC[C@@H]3C2)c(Br)c1 723182805 OWJKTIFYWKWGGR-MWLCHTKSSA-N 339.237 1.683 10 10 EDCE N[C@H](c1cc(Br)cc([N+](=O)[O-])c1O)[C@@H](O)C(F)(F)F 575281959 VFJKTKDMFRZLRV-HTRCEHHLSA-N 345.071 1.986 10 10 EDCE CN(C)c1ccc(CN2CCN([C@@H]3CCNC(=O)CC3)CC2)cc1F 825147392 FHURXRMZVBHXIM-INIZCTEOSA-N 348.466 1.678 10 10 EDCE CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)/C=C\c1cnccn1 491188018 VXNBBBLDTKLQDS-DAXSKMNVSA-N 343.408 1.873 10 10 EDCE O=C(NCCCSc1nccs1)N1CCC[C@@](O)(CO)C1 838513416 IXMQNCIWNXWTIB-ZDUSSCGKSA-N 331.463 1.154 10 10 EDCE COc1cc(Br)cc(CNC2(C(=O)N(C)C)CC2)c1O 840956755 DCRIMIJWEDVXDT-UHFFFAOYSA-N 343.221 1.874 10 10 EDCE C[C@H]1CN([C@H](C)CNC(=O)NCCc2ccc(N)cc2)C[C@@H](C)O1 848603901 VNKSBWOXDIZYGN-KFWWJZLASA-N 334.464 1.608 10 10 EDCE O=S1(=O)CCN(c2ccc(CN[C@@H]3CN4CCC[C@H]3C4)cc2)CC1 925056684 ZWKMMDAZNQZXJF-FUHWJXTLSA-N 349.500 1.105 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2C=C[C@H]3C[C@@H]2CO3)cc1 929236484 KZGVIENEUCYNGU-UXLLHSPISA-N 343.427 1.076 10 10 EDCE COC(=O)CCCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852456137 XLIWKVLBFWCCIN-ZDUSSCGKSA-N 335.404 1.526 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](OC)c3cnn(C)c3)C2)cc1 855225447 NHFYXQCONOVADP-YOEHRIQHSA-N 344.415 1.511 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)/C=C\c3cnn(C)c3)C2)cc1 855230762 XRAZYRVNFCQTJD-JBGNVSFKSA-N 326.400 1.837 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)Cc3cnc[nH]3)C2)cc1 855225161 OPOUXWFAFIFXTC-ZIAGYGMSSA-N 328.416 1.992 10 10 EDCE CCOc1ccc(CNCCS(=O)(=O)CC(F)(F)F)c(O)c1 850364288 YRFDPWHFOPAPDU-UHFFFAOYSA-N 341.351 1.858 10 10 EDCE C[C@@H](CN1CCOCC1)C(=O)NCc1ccc2cccnc2c1O 862026959 FHHWYGYNLYVUMI-ZDUSSCGKSA-N 329.400 1.525 10 10 EDCE O=C(N[C@H]1CCN(c2ccccc2)C1=O)c1c(F)ccc(O)c1O 789977177 RCFCATVHDJIBCP-LBPRGKRZSA-N 330.315 1.772 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)C2(N3CCOCC3)CCC2)c1 782739564 QAGKAVCWYDAJTC-CYBMUJFWSA-N 334.416 1.833 10 10 EDCE Cc1ccc(/C=C\C(=O)N2CCc3ccc(S(N)(=O)=O)cc32)cn1 1136755937 NNIQWTXDHLWTMI-DAXSKMNVSA-N 343.408 1.640 10 10 EDCE C[C@H]1[C@@H](C(N)=O)CC[C@@H](C)N1C(=O)c1ccc(N=NC(N)=O)cc1 1143584513 CIDIBOBSZHYYTC-NRUUGDAUSA-N 331.376 1.964 10 10 EDCE COc1cc(N2C[C@@H](CO)[C@@H](CCO)C2)c([N+](=O)[O-])cc1OC 1307234220 LNCZMOSDZVRSIW-QWRGUYRKSA-N 326.349 1.039 10 10 EDCE COC(=O)C[C@@H]1CCC[C@H]1NC(=O)NCc1cccc(OC)c1O 1313428374 JMKONGLZKOMUSI-WCQYABFASA-N 336.388 1.932 10 10 EDCE CCC(=O)NCC(=O)N1C[C@H](C)[C@H](NCc2ccc(OC)c(C)c2)C1 1327850479 WDIMCGXFOVHSRV-GOEBONIOSA-N 347.459 1.466 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)c(Br)c1 2116693858 DSCYSXCWTJEJDB-QQUHWDOBSA-N 327.222 1.228 10 10 EDCE NCc1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)c(Br)c1 2121591593 JFQIQAZMLYMMKF-SUNKGSAMSA-N 327.222 1.351 10 10 EDCE Oc1cc(Br)ccc1CN1CCO[C@H]2CCNC[C@H]21 2129071690 MMEFHVXRGXIUQJ-OCCSQVGLSA-N 327.222 1.717 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@@H]3CCNC(=O)CC3)CC2)cc1 1330396684 COFGYOIBGPQSKI-HNNXBMFYSA-N 345.443 1.650 10 10 EDCE OC[C@@]12CC[C@@](NCc3cccc(Br)c3O)(CO1)C2 2133661928 MIKGEYSXQGDSSK-KBPBESRZSA-N 328.206 1.928 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1C[C@@H](O)CN(C(=O)OC(C)(C)C)C1 1908254649 RVMZEINCLMPNMX-VXGBXAGGSA-N 341.412 1.763 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCOC[C@H]2[C@@H]2CCCO2)cc1 1556550162 LGEPJFVNSIXBLY-KBPBESRZSA-N 332.360 1.869 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(C(=O)N2CCCC2)CC1 1623757813 QQFHCLLRJPLIEF-UHFFFAOYSA-N 333.388 1.000 10 10 EDCE Nc1ncc2c(n1)CN(C(=O)c1cc3cc(O)c(O)cc3s1)CC2 1629490953 YCXHBELLMVEGFC-UHFFFAOYSA-N 342.380 1.883 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCc2nc[nH]c2C12CCOCC2 1627572614 GIIDBMVYANXXIY-UHFFFAOYSA-N 343.383 1.454 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cnn(C)c2OC)cc1C 1498174164 NVAQPZMDBXPRRT-ZDUSSCGKSA-N 346.431 1.654 10 10 EDCE CC(F)(F)C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1491066356 CGFFRIURFAOYNZ-UHFFFAOYSA-N 327.291 1.350 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@](O)(c2ccc(F)cc2)C1 1637384425 NIIDHWTWGWHGMG-GOSISDBHSA-N 331.343 1.900 10 10 EDCE C[C@H](NC(=O)COCC(=O)NCc1cccnc1)c1ccccc1O 1635798888 GTVHOSVPOPXHNT-ZDUSSCGKSA-N 343.383 1.297 10 10 EDCE Cc1nnnn1-c1ccc(C(=O)NCc2cccc(O)c2O)cc1 1644711019 OTFVDGJEXXTYDO-UHFFFAOYSA-N 325.328 1.312 10 10 EDCE Cc1ccc(C(=O)N[C@@H](C)C(=O)Nc2cccnc2C)c(O)c1O 1570093077 CZQXUHYYYLIYQF-NSHDSACASA-N 329.356 1.867 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C2=CCCC2)cc(OC)n1 1744640748 UTNNGICMJUOHAL-LLVKDONJSA-N 333.388 1.444 10 10 EDCE COc1cc(N2CC[C@H](c3nncn3C)C2)c([N+](=O)[O-])cc1OC 1652186504 XCSQNCOCOCRLGS-JTQLQIEISA-N 333.348 1.734 10 10 EDCE NC(=O)C[C@@H](NCc1ccc(N2CCOCC2)cc1)C1CCOCC1 153956109 AMAQQGOOJNZKRZ-GOSISDBHSA-N 347.459 1.283 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1ccc(-n2cncn2)c(F)c1 159144347 JUVGAUDZNFOTLV-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2COCCN2C)c1O 1964569117 CUHBWSUYWACGPY-JTQLQIEISA-N 345.237 1.584 10 10 EDCE CN1[C@H](CNCc2cccc(Br)c2O)CCS1(=O)=O 1967746292 DVQVYOLFLNOHSV-JTQLQIEISA-N 349.250 1.278 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N(C)CCCN=[N+]=[N-] 1985095148 ZOKQRMWJSZEFGB-JTQLQIEISA-N 331.373 1.617 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCCN=[N+]=[N-])[C@H]1CCCO1 1985101988 AGDNARPEKSFCMY-GHMZBOCLSA-N 327.385 1.875 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985104245 HQACDKHLXRGAAT-OUAUKWLOSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCCN=[N+]=[N-])C1(O)CCC1 1987681836 RTIIRDBUANKUFD-JTQLQIEISA-N 327.385 1.611 10 10 EDCE CO[C@H](CCNC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 2010099435 XTBWFIJVCWIYJZ-CQSZACIVSA-N 338.404 1.938 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 2010403259 BLFWICGNYLPVSO-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE CN(c1ccc(CNC2CC2)c(Br)c1)C(CO)CO 311762215 VDCNROSHGYQTEH-UHFFFAOYSA-N 329.238 1.491 10 10 EDCE CNCc1ccc(N2CC[C@H](NC(N)=O)C2)c(Br)c1 700655434 VKCKJIWTUHPJLP-JTQLQIEISA-N 327.226 1.416 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3CCOC4(CCCC4)C3)c2n1 2064657260 NEUKAVFVWCXPFN-LBPRGKRZSA-N 330.388 1.965 10 10 EDCE CC(C)[C@@H](O)CN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2167604818 ULXCVCWCWZMHDL-STQMWFEESA-N 342.237 1.854 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213589020 CXXCWAVJCIRJQV-UTUOFQBUSA-N 340.428 1.789 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2CCCC(=O)N2)c1O 2236055462 PZHVTHIFWCMDSB-VIFPVBQESA-N 343.221 1.922 10 10 EDCE CSc1ncc(CNC(=O)N[C@H](CC(F)F)C(=O)O)s1 2284504149 JYNVHCPBBYIPND-ZCFIWIBFSA-N 325.362 1.773 10 10 EDCE Cc1nc(COC(=O)C=Cc2ccc(N3CCOCC3)cc2)no1 2297509597 MTXKSSCHOABSRU-UHFFFAOYSA-N 329.356 1.971 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 2300529486 AUGTWELSQSXGID-SNVBAGLBSA-N 345.375 1.465 10 10 EDCE O=C(N[C@H](CCO)COCc1ccccc1)c1cc(O)nc(O)c1 2303562519 UYCWLNAECZPNHP-CQSZACIVSA-N 332.356 1.190 10 10 EDCE CN1CCC(N(C)CCN(C)C(=O)C=Cc2ccc(O)c(O)c2)CC1 2308001122 BCLNMVJKIUHTGX-UHFFFAOYSA-N 347.459 1.595 10 10 EDCE COC(=O)CN(CCC(=O)NC(C)C)Cc1cc(Cl)ccc1O 171938168 LGJFGMYEKVQMHY-UHFFFAOYSA-N 342.823 1.935 10 10 EDCE CCN(C)c1ccc([C@@H](C)NCC2CN(S(C)(=O)=O)C2)cc1 187825781 UJVBGXYEZREBTD-CYBMUJFWSA-N 325.478 1.685 10 10 EDCE COc1ccc(O)c(CN2CCN([C@H](C)c3nc(C)no3)CC2)c1 180101161 IOMUITVQVSSPHE-GFCCVEGCSA-N 332.404 1.971 10 10 EDCE CCN(C(=O)CN1CCOCC1)C1(C)C(=O)c2ccccc2C1=O 33317461 VXAFKMRYWAONHL-UHFFFAOYSA-N 330.384 1.005 10 10 EDCE CCOC(=O)N1CCN(C(=O)[C@H](C)Cc2ccc(O)c(O)c2)CC1 96785397 RUCXEJLFONNKNZ-GFCCVEGCSA-N 336.388 1.577 10 10 EDCE COCCCNCCC(=O)N1CCN(c2ccc(OC)cc2)CC1 243789574 QKAJBKFEBQMIRF-UHFFFAOYSA-N 335.448 1.360 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCCn1ccnc1 255541935 VKVZLPJFBMPZRJ-UTCJRWHESA-N 326.400 1.549 10 10 EDCE CO[C@@H]1CC[C@@H]2OCCN(C(=O)/C=C/c3ccc(O)c(O)c3)[C@H]2C1 378554923 SFICWCCNYCJJKS-LMOMMZFKSA-N 333.384 1.906 10 10 EDCE Cc1nc2ccc(N(C)Cc3ccc(N4CCOCC4)cc3)nn2n1 286300817 YHVFGHNTQUKASW-UHFFFAOYSA-N 338.415 1.906 10 10 EDCE CC(C)NC(=O)CNC(=O)NCc1cc(Br)ccc1O 804872633 OAGMZSJALBSLEG-UHFFFAOYSA-N 344.209 1.479 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN[C@H]3C[C@@H]4C[C@@H]4C3)CC2)cc1 819383864 SPXXOGASJBBUDU-SFNKJDCFSA-N 345.487 1.566 10 10 EDCE COc1ccc(N2CC[C@H](CNC3CCN(C(N)=O)CC3)C2)cc1 818221854 OFHZPEMLPLCJON-CQSZACIVSA-N 332.448 1.654 10 10 EDCE COC1(C[C@H](NC(=O)NCc2ccc(N(C)C)cc2)C(=O)O)CCC1 908758592 NZWWFCSUZQDIJK-HNNXBMFYSA-N 349.431 1.964 10 10 EDCE O=C(N(Cc1ccccc1O)C[C@@H]1CCCO1)C12CCN(CC1)C2 901177794 UWCXGMMXLSYZNU-INIZCTEOSA-N 330.428 1.996 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1COC2(CCC2)C1 830080383 VBPARRKHRPAXFN-OAHLLOKOSA-N 346.427 1.959 10 10 EDCE COc1ccc(N2CCN(C(=O)c3c(CO)noc3C)CC2)cc1 847285965 AFYPYVCTTMTMBE-UHFFFAOYSA-N 331.372 1.446 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)c(O)c1O 856083682 LWRRDPHONLOAKR-HUUCEWRRSA-N 346.427 1.779 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CNCCC3(F)F)C2)cc1 851639121 BHYFMKBPNIJLTB-WFASDCNBSA-N 339.386 1.635 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCc2nnn(C)c2C1 927845921 AMQLKYDHKLMORY-AWEZNQCLSA-N 342.447 1.580 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)NCCc2ccc(N)cc2)CS1(=O)=O 851662948 OQDZFCULKSMAJP-RISCZKNCSA-N 325.434 1.076 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC(F)(F)CO)C2)cc1 854298520 DPTHFISNKHAVRE-LLVKDONJSA-N 329.347 1.201 10 10 EDCE CCOC(=O)C1(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 855231383 LJSMDHDNZFPKIY-ZDUSSCGKSA-N 332.400 1.733 10 10 EDCE NC(=O)[C@H]1C[C@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)C1 863525193 XFAJDPHMOHFMPB-JLIMDTESSA-N 337.763 1.074 10 10 EDCE COC(=O)[C@@H]1CN(Cc2cc(OC)c(OC)cc2O)C[C@@H](C)O1 862487094 LWSYXKHOGDMAIH-BMIGLBTASA-N 325.361 1.172 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)Nc2ccc[n+]([O-])c2)N(C)C)cc1 1344833135 YAJANOSIAWBNAT-QGZVFWFLSA-N 343.431 1.810 10 10 EDCE COc1ccc(O)c(CNC(=O)Nc2cccc(C(N)=O)c2OC)c1 782704545 BYTHMTJFPVPURG-UHFFFAOYSA-N 345.355 1.830 10 10 EDCE O=C(NCc1cccc(Cl)c1O)[C@@H]1[C@H]2CC[C@]3(COC(=O)[C@H]13)O2 890760830 AHRRVTGKZIAIGA-LSSIXWDNSA-N 337.759 1.382 10 10 EDCE CNCc1ccc(N2CCO[C@H]([C@@H](C)O)C2)c(Br)c1 2117532583 UKWQGBXCTBMCLC-YGRLFVJLSA-N 329.238 1.755 10 10 EDCE Cc1cc(Cn2nnc(C(=O)N3Cc4cccc(O)c4C3)c2C)no1 1175039044 UXDKRKGSBMLXLP-UHFFFAOYSA-N 339.355 1.793 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@H](O)C2(C)C)cc1Br 2124804282 QZHGZSFXNNFZOW-STQMWFEESA-N 329.238 1.489 10 10 EDCE O=C1OC[C@@]2(CNCc3ccc(N4CCCC4)cc3)COCCN12 1330343846 SGLHVFPZNGPGJV-GOSISDBHSA-N 331.416 1.598 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C(=O)C(C)(C)C)cc1C 1278054905 XYNMFLXDXWYHHS-AWEZNQCLSA-N 336.432 1.186 10 10 EDCE O=C(NCc1nc(-c2ccccn2)n[nH]1)c1c(F)ccc(O)c1O 1472562367 DKEOCOISKMHKAC-UHFFFAOYSA-N 329.291 1.347 10 10 EDCE Cc1ccc(C(=O)N2CC(c3n[nH]c4c3COCC4)C2)c(O)c1O 1558820791 XDQWKUJZYJHWET-UHFFFAOYSA-N 329.356 1.442 10 10 EDCE CCOCCC(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1494636482 HCPGHSGIRCYWTN-LLVKDONJSA-N 349.391 1.510 10 10 EDCE COCCNC1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1725790299 SKVKDEXEWMLLDA-UHFFFAOYSA-N 333.392 1.688 10 10 EDCE CNC(=O)[C@@H](Cc1ccccc1)NC(=O)/C=C/c1ccc(O)c(O)c1 1632897562 UGBOWCGQOOBDQW-TUPIDYKKSA-N 340.379 1.585 10 10 EDCE COC(=O)Cn1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)n1 1632393172 YZOREEAXSFUMHT-UHFFFAOYSA-N 347.352 1.934 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H](C)CC(N)=O)cc1C 1734336306 GPIZMVJCRPXKEL-KGLIPLIRSA-N 335.448 1.452 10 10 EDCE CCn1nccc1C(=O)NC[C@H](CO)NCc1ccc(OC)c(C)c1 1734366133 RGYWSUMHWBZQKC-OAHLLOKOSA-N 346.431 1.101 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc(Cl)ccc1-n1cnnn1 1643100785 KIPPDFBDWQQLFV-UHFFFAOYSA-N 345.746 1.657 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2c[nH]c(=O)cn2)cc1C 1676407614 XFOPYIIQRJYPQB-ZDUSSCGKSA-N 344.415 1.337 10 10 EDCE CC[C@@H](CNC(=O)c1cnc(O)n1C)NCc1ccc(OC)c(C)c1 1698609570 PQJZIWLNUIIHJZ-AWEZNQCLSA-N 346.431 1.741 10 10 EDCE Cc1c(OCCN(C)C)c(=O)ccn1CCOc1ccc(N)cc1 1857919781 XJTUPBMDNMLTTD-UHFFFAOYSA-N 331.416 1.758 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C(CO)[C@H]4C3)c(Br)cc2[C@@H]1O 2146874408 HDYYRNLLETVYAJ-UPFKWVMWSA-N 339.189 1.109 10 10 EDCE C[C@@H](NCc1c(O)cccc1F)C1(O)CN(C(=O)OC(C)(C)C)C1 1997945938 LPMCRFFZXAIPBL-LLVKDONJSA-N 340.395 1.991 10 10 EDCE CC(=O)Oc1ccccc1C=C1SC(=S)N(CC(=O)O)C1=O 2040489384 BQAQWJSHRSIFPX-UHFFFAOYSA-N 337.378 1.898 10 10 EDCE O=C1NCCN(c2ccc(CO)c(Br)c2)CC1(F)F 2090578666 CYCVAURUHLBCFZ-UHFFFAOYSA-N 335.148 1.513 10 10 EDCE C[C@H]1[C@@H](C)N(c2ccc(CN)c(Br)c2)CCS1(=O)=O 2113894934 QNXLLFZVBCUDST-ZJUUUORDSA-N 347.278 1.920 10 10 EDCE C[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1CCOc1nnc(=N)[nH]n1 2213790057 PORGITSALKGDLZ-GHMZBOCLSA-N 338.412 1.484 10 10 EDCE CSc1ncc(CNS(=O)(=O)C[C@@H](C)CNC2CC2)s1 2284687137 DKDHPOQEQCPSHS-VIFPVBQESA-N 335.520 1.673 10 10 EDCE CN1C(=O)C(=Cc2ccc(OS(C)(=O)=O)cc2)SC1=S 2297499269 NAFOWMDCWBTTIR-UHFFFAOYSA-N 329.424 1.856 10 10 EDCE Cc1ccc(CN[C@H]2CS(=O)(=O)C[C@@H]2C)c(O)c1Br 2352947727 JREQKZUWPCGUQV-ONGXEEELSA-N 348.262 1.986 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)c(Br)c1 2355338503 BVUPWACLWUUMEU-TYWRASTISA-N 342.233 1.823 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cccn(C)c2=O)cc1C 1265851710 RBTGIWPYHFXGRZ-AWEZNQCLSA-N 343.427 1.610 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H]3CNC[C@H]3O)c2C)c1 262308992 QIBZVCJROFNRFZ-MAUKXSAKSA-N 327.428 1.713 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1cn[nH]c1 270394541 IORSTAIZQVRDMG-CYBMUJFWSA-N 329.404 1.807 10 10 EDCE C[C@@H]1C[C@H]1N1C[C@@H](NCc2ccc(N3CCOCC3)cc2)CC1=O 377836589 CKHBMGUSMHAMRT-UWWQBHOKSA-N 329.444 1.622 10 10 EDCE COC(=O)C(C)(C)CS(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1 288454759 JMOVDNSAGJJZKR-UHFFFAOYSA-N 332.334 1.241 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2CNC(=O)C2)c(O)c1Br 2380773509 KSFOPJBEOOVAJX-SNVBAGLBSA-N 341.205 1.558 10 10 EDCE Cc1ccc(CNC(=O)N2CCNC[C@H]2C)c(O)c1Br 2381127038 DLQFVEFQBBKVEU-SNVBAGLBSA-N 342.237 1.966 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2OCC[C@H]2N)c(O)c1Br 2381131277 LLZLFNFFUCNRFP-MFKMUULPSA-N 343.221 1.538 10 10 EDCE Cc1ccc(CN2CC[C@H](C(=O)O)[C@H](O)C2)c(O)c1Br 2381141730 DIHMZWVSEPHPEO-WDEREUQCSA-N 344.205 1.731 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C)NC(=O)c1cccc(Cl)c1Cl 808505235 VOTBYZJAGFGOEM-ZETCQYMHSA-N 346.166 1.813 10 10 EDCE O=C(NCc1cc(Br)ccc1O)[C@H](O)C1CCOCC1 804739764 RQUKBKUPLPPHAV-CYBMUJFWSA-N 344.205 1.558 10 10 EDCE COC[C@@]1(C(=O)O)CCCN1Cc1ccc(N2CCN(C)CC2)cc1 818629561 HOCGHVOJTDWBQO-LJQANCHMSA-N 347.459 1.504 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCN(CC[S@](C)=O)CC2)cc1 835026374 RZBUADDWFBGLHE-OIUIXCLQSA-N 335.517 1.762 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)O)c1 911387357 PTUVTKYQWFRTPF-KUDNYVPYSA-N 331.368 1.930 10 10 EDCE CO[C@@H](c1cc(O)nc(O)c1)[C@H](NC(=O)OC(C)(C)C)C(=O)O 1952776414 UMURSTAOPISXQJ-QWRGUYRKSA-N 328.321 1.158 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)c2cn(C3CCC3)nn2)cc1 843296926 CUGRMSRYSPDLCO-HNNXBMFYSA-N 328.420 1.499 10 10 EDCE Cn1c2c(ccc1=O)[C@H](NC(=O)NCc1ccccc1O)CCC2 844935501 CXFLODTUPJDULP-CQSZACIVSA-N 327.384 1.968 10 10 EDCE Cc1noc([C@@H](C)N(C)Cc2cc(O)n3ncc(C(=O)O)c3n2)n1 848712299 HUMVCRHUBBIYPG-SSDOTTSWSA-N 332.320 1.018 10 10 EDCE CN1CCN(c2ccc(CN3C(=O)N[C@](C)(CCF)C3=O)cc2)CC1 925080528 VPVRTOZQAAINKH-GOSISDBHSA-N 348.422 1.609 10 10 EDCE NC(=O)[C@H]1CC[C@H]1C(=O)NCc1cc(Br)ccc1O 848067799 CEWMWFZGFMHXEP-VHSXEESVSA-N 327.178 1.282 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCn2c(O)nnc2C1 853749641 YWNPCSNVJMRRMY-UHFFFAOYSA-N 330.392 1.084 10 10 EDCE CC[C@]1(O)CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 854299735 REJYYAGNSFVQRA-KSSFIOAISA-N 333.432 1.830 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](OC)[C@@H]3CCOC3)C2)cc1 855227269 WWHUQKVFOCAYTO-KEYYUXOJSA-N 334.416 1.442 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3ccc(O)nn3)C2)cc1 854098794 UAZLGLROXDGGMW-ZDUSSCGKSA-N 343.387 1.269 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCNC(=O)C(C)C)C2)cc1 851939002 DGNFLBIHNIUYQN-CQSZACIVSA-N 348.447 1.345 10 10 EDCE COCCC1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 853475052 XPDJIWJVJCIONG-UHFFFAOYSA-N 333.432 1.701 10 10 EDCE CCS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCC[C@@H]2C)cc1 769865178 GKOCLLSERONFHZ-NSHDSACASA-N 347.462 1.589 10 10 EDCE O=C(NCc1cccc(Br)c1O)[C@@H](O)C1CCOCC1 765751146 PREZTBCCEJPZEA-ZDUSSCGKSA-N 344.205 1.558 10 10 EDCE C[C@@]12CN(Cc3cc(F)cc(F)c3O)C[C@]1(C)CS(=O)(=O)C2 895473602 PGPIQAXPQXPJCT-GASCZTMLSA-N 331.384 1.927 10 10 EDCE Fc1cc(CNc2ccc3nnnn3n2)cc(F)c1N1CCOCC1 1186661948 OLRMNCLRUCMVCL-UHFFFAOYSA-N 347.329 1.246 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCC[C@](O)(C2CC2)C1 1330351437 ARFQATCSJYJGKS-GOSISDBHSA-N 332.400 1.114 10 10 EDCE CO[C@]1(CO)CCCN(C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1330666909 SIWWQDHVWZZCJW-QGZVFWFLSA-N 339.411 1.575 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)CC(C)C)cc(OC)n1 1287553300 HSAVJRYPPPTUFN-GFCCVEGCSA-N 337.420 1.722 10 10 EDCE C[C@H]1C[C@@H](C(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)CO1 1283079813 YJDLMNWMHPIWID-CMPLNLGQSA-N 347.375 1.120 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC3(CCNC(=O)O3)C2)c([N+](=O)[O-])c1 1458668967 QKYSBANTNKCRQD-HWKANZROSA-N 347.327 1.470 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc(O)cn3)CC2)c(OC)c1 1470857684 BMZOUHZAALNRQE-UHFFFAOYSA-N 343.383 1.767 10 10 EDCE COC1(OC)CCOC[C@@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1470329062 XNKYOFDJLBUSOZ-LBPRGKRZSA-N 336.348 1.357 10 10 EDCE CC(C)(C)c1cn(C[C@@H]2OC[C@H](O)[C@@H]2NCc2ccccc2O)nn1 1615716301 UOLYYZWXGXNOAV-ZOBUZTSGSA-N 346.431 1.199 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H]2CCC(=O)NC2)cc1C 1482847869 JLUZOJSILCDIJV-ZBFHGGJFSA-N 347.459 1.514 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@H]2CCC(=O)N2C)cc1C 1485911050 LOXNADZVDKVEEH-ZBFHGGJFSA-N 347.459 1.561 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H](C)C(C)(F)F)cc1C 1717777894 OVVXEWSDJJUZBY-OCCSQVGLSA-N 344.402 1.862 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCn2c(CC3CC3)nnc2C1 1557365701 SJNUWGDYLOSBJP-UHFFFAOYSA-N 328.372 1.227 10 10 EDCE Cn1cc([C@@H](O)CNC(=O)c2cc3cc(O)c(O)cc3s2)cn1 1630019058 PINREGRBPAYPDJ-LBPRGKRZSA-N 333.369 1.509 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H](CCO)C3)c(Br)cc21 229184546 CPHHVNBMUPXYFV-SDBXPKJASA-N 340.221 1.610 10 10 EDCE CCNC(=O)CN(C)C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1498462599 AAXVMYIIEACIQV-LLVKDONJSA-N 348.407 1.035 10 10 EDCE CN(Cc1ccccc1S(N)(=O)=O)C(=O)c1cc(O)cs1 1641411994 XWBYNIRDMYQHJW-UHFFFAOYSA-N 326.399 1.373 10 10 EDCE NS(=O)(=O)c1sccc1C(=O)NCc1c(O)cccc1F 1596916491 HZPJVMJAJCTFMG-UHFFFAOYSA-N 330.362 1.170 10 10 EDCE C[C@H]1C[C@@H](O)CN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C1 1684608016 YUOSPTYSVNJDNL-QGTPRVQTSA-N 348.491 1.768 10 10 EDCE COc1cc(/C=C2/SC(=S)N(C[C@H](C)O)C2=O)ccc1O 1858587193 WPCWGGFCMFPCHE-UGZWPXFQSA-N 325.411 1.983 10 10 EDCE OC[C@H]1COCC[C@H]1NCc1cc(Br)cc(F)c1O 1878773175 BERICPNYAQDWDE-JOYOIKCWSA-N 334.185 1.781 10 10 EDCE COC1(C(=O)NCc2ccccc2O)CN(C(=O)OC(C)(C)C)C1 1964890703 SJJJOKNKRXFPNI-UHFFFAOYSA-N 336.388 1.644 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003172920 RMIPGOWKVFIFKJ-HKUMRIAESA-N 340.420 1.134 10 10 EDCE C[C@H](O)c1ccc(N2CCOC[C@H]2[C@H](O)CO)cc1Br 2146324242 TYDZYTQNNJTNFW-QCZZGDTMSA-N 346.221 1.061 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CCOC1 1985102198 CWDPIUXZDPCMFA-HZMBPMFUSA-N 325.369 1.581 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985100891 KJKOVJZMDHWENA-LLVKDONJSA-N 327.385 1.829 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1987701648 IXUWBNDQHQLBBH-MNOVXSKESA-N 327.385 1.278 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)NCc2ccccc2O)C1 2010084799 LIDUIIBXSLCUMW-UHFFFAOYSA-N 336.388 1.238 10 10 EDCE Cc1cccc(CNC(=O)[C@H](N)CN(C)Cc2ccccc2)c1O 2024806619 WKQMSYDKBAOCBN-QGZVFWFLSA-N 327.428 1.776 10 10 EDCE OC[C@@H]1CN(c2ccc(CNC3CC3)cc2Br)C[C@@H]1O 316251377 DTSKJBORWQHJER-NHYWBVRUSA-N 341.249 1.491 10 10 EDCE CS(=O)(=O)N[C@H]1CCN(Cc2ccc(Br)cc2O)C1 703136800 FERXSFYMMKRUNX-NSHDSACASA-N 349.250 1.278 10 10 EDCE C[C@H]1CN(C)C[C@H](CNCc2cccc(Br)c2O)O1 697317537 SCIFRMXUTXSCGJ-JQWIXIFHSA-N 329.238 1.963 10 10 EDCE O=C(NCc1c(O)cc(O)cc1O)[C@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2 2062056690 PYNYXHXAXWPFGD-FDYHWXHSSA-N 347.289 1.776 10 10 EDCE C[C@@H]1[C@H](NC(=O)C(F)(F)F)CCCN1C(=O)Cc1ccc(N)cc1 2044623786 YGQSACNMJDIRDN-ZWNOBZJWSA-N 343.349 1.869 10 10 EDCE NCc1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)c(F)c1Br 2102192767 YRIKYUREJWQATM-GDPRMGEGSA-N 331.185 1.243 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2104416891 ZOJRWECEBDIRNK-PCDDKUFXSA-N 327.222 1.099 10 10 EDCE CNC(=O)[C@@H]1[C@H](C)CCN1c1ccc(CO)c(Br)c1 2090261515 ICJBCGBGEMGBJM-RNCFNFMXSA-N 327.222 1.902 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@@]2(CO)CO3)c(Br)c1 2094647619 WRBARAZFRPSTDG-DRCTWCGVSA-N 327.222 1.809 10 10 EDCE CN1CCO[C@H]2CN(c3ccc(CN)cc3Br)C[C@H]21 2097704509 YOBWJRBGPGCJQC-KGLIPLIRSA-N 326.238 1.427 10 10 EDCE COCC1(C(=O)O)CN(Cc2cc(Br)ccc2O)C1 2112831893 GJWAAGNSVDOQDI-UHFFFAOYSA-N 330.178 1.688 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N(CC(N)=O)CC(=O)O 2201038716 SDFYQSAOUPDOIT-SNVBAGLBSA-N 345.193 1.478 10 10 EDCE CC(C)(C)OC(=O)N1C[C@](C)(COc2nnc(=N)[nH]n2)CC1(C)C 2213789991 OPJGASXJFBJLJL-OAHLLOKOSA-N 338.412 1.484 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@H]3COC[C@@H]32)c1O 2236089374 DAMVOMIYRPDCND-AAEUAGOBSA-N 344.205 1.763 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H](C3)[C@@H]4O)c(Br)cc2[C@@H]1O 2286215613 WJUUKMPILAKNPK-CLBUKXALSA-N 339.189 1.252 10 10 EDCE Cc1ccc(CN2CC[C@@H](O)C[C@@H]2CO)c(O)c1Br 2352677743 CLNYGEOKENVYMS-VXGBXAGGSA-N 330.222 1.781 10 10 EDCE CN(C)c1ccc(CNC(=O)NCCCN2CCCC2=O)cc1F 58483024 KRRJWHIYHVOZLW-UHFFFAOYSA-N 336.411 1.703 10 10 EDCE CC(=O)C(=O)COC(=O)c1cccc(S(=O)(=O)C(F)(F)F)c1 1261598266 VCUOXUQBYJJIOG-UHFFFAOYSA-N 338.259 1.295 10 10 EDCE CN[C@@H](COC)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952207391 CZQZCJZVLYYSID-STQMWFEESA-N 340.420 1.768 10 10 EDCE Cc1cc(C)n2nc(CC(=O)N(C)Cc3ccccc3O)nc2n1 77258399 UMGSZBSALYVXLC-UHFFFAOYSA-N 325.372 1.648 10 10 EDCE COc1cc(Cl)cc(CN2CC[C@@H](NS(C)(=O)=O)C2)c1O 184696188 HFCQBEKHGCOACT-LLVKDONJSA-N 334.825 1.178 10 10 EDCE Cc1nc(-c2ccc(O)c(O)c2)[nH]c(=O)c1I 235952544 KVKZQAPKFZKRNO-UHFFFAOYSA-N 344.108 1.761 10 10 EDCE CN(C[C@H]1CCCO1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 285726672 NSDMGLLEACVKSS-CYBMUJFWSA-N 337.395 1.145 10 10 EDCE Cc1ccc(CN(C)C(=O)Cn2cnnc2)c(O)c1Br 2380774995 PAAIHEUPOCDTHX-UHFFFAOYSA-N 339.193 1.713 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]12[C@@H]3[C@H]4C(=O)[C@H]1[C@@H]1[C@@H]4C[C@@H]3[C@@H]12 800532517 QQPSOKPJUJRHHX-YWZDJIROSA-N 339.391 1.472 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)CC(C)(C)OC)CC2)cc1 809804315 DNWDBQSRMCVQAA-UHFFFAOYSA-N 342.461 1.572 10 10 EDCE CC(=O)C(=O)COC(=O)CCc1nc(-c2ccc(F)c(C)c2)no1 808507426 LYZNHLCRLJSJKQ-UHFFFAOYSA-N 334.303 1.818 10 10 EDCE C[C@H](N)c1ccc(N2CCN(C(N)=O)CC2)cc1Br 722196624 SSTNIFSDRURFDV-VIFPVBQESA-N 327.226 1.670 10 10 EDCE C[C@@H]1Oc2cccc(N)c2N(OCCOc2ccc(N)cc2)C1=O 821300748 YRAWFRVKPYQFGP-NSHDSACASA-N 329.356 1.976 10 10 EDCE Cc1cnn(C[C@@H]2CN(C(=O)/C=C\c3ccc(O)c(O)c3)CCO2)c1 588406495 HUTOPXIZKOOZJA-QTLSWZBMSA-N 343.383 1.544 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)c(Br)c1 1893331931 NMWMJINUJYEULT-QCZZGDTMSA-N 330.222 1.824 10 10 EDCE COc1cc(O)c(CN2CCn3c(CC4CC4)nnc3C2)cc1OC 844721167 XLQLJKXFZGZBKV-UHFFFAOYSA-N 344.415 1.969 10 10 EDCE C[C@@H]1CN=C(NCc2ccc(N3CCN(CC4CC4)CC3)cc2)N1 849052729 SJWIKCNTZYZPBP-OAHLLOKOSA-N 327.476 1.656 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCC3CCNCC3)C2)cc1 851668583 GXONNKHHTMGFCZ-INIZCTEOSA-N 346.475 1.963 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCO[C@@H](CC(F)(F)F)C2)cc1 850865707 RYSLEQWWEWDTLX-NSHDSACASA-N 331.294 1.387 10 10 EDCE CCN(CC)C(=O)CN(C)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 757507370 YNVNVSMZKLUXDE-UHFFFAOYSA-N 336.348 1.230 10 10 EDCE C[C@@H]1NCC[C@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 861653314 ZCTRIRCRFBJERQ-SUMWQHHRSA-N 332.448 1.197 10 10 EDCE CNCCOCCNC(=O)NCc1cccc(Br)c1O 861675390 CVFSRBBWEQNGDV-UHFFFAOYSA-N 346.225 1.190 10 10 EDCE O=C(NCc1cc(Cl)cc(Cl)c1O)C1=C2CCCN=C2NN1 1160599467 JWVFTAZQDCUPAE-UHFFFAOYSA-N 341.198 1.869 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H](c2ccccn2)C1 1324809018 OPSYTLTZDGUTCL-AWEZNQCLSA-N 339.395 1.762 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)/C=C/c2ccco2)cc1C 1320186123 KPCHNBZZXYBCPG-IQIBNGDESA-N 344.411 1.877 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H](C)S(C)(=O)=O)cc1C 1268693216 TUEAJKQFBGLXLN-STQMWFEESA-N 342.461 1.031 10 10 EDCE CCn1ccnc1C(=O)NC[C@H](O)CNCc1ccc(OC)c(C)c1 1272406513 LHESSYDETZFCBN-OAHLLOKOSA-N 346.431 1.101 10 10 EDCE Cn1ccnc1C[C@@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1445626497 KAJXYTUHEZFKAX-AWEZNQCLSA-N 329.400 1.855 10 10 EDCE Cc1cc(N2CCC[C@H](NC(=O)Cc3ccc(O)c(O)c3)C2)n(C)n1 1618331526 PJZQVARATWGSOB-AWEZNQCLSA-N 344.415 1.467 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)c2nnn(C)c2C)cc1C 1713405763 UXPRNDRFLWOWKZ-CYBMUJFWSA-N 345.447 1.739 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H](CCNCCO)C2)cc1 1715163176 UYQROXMOTOLANM-ZDUSSCGKSA-N 347.419 1.673 10 10 EDCE Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N[C@@H](C)c1ccccc1O 1557968410 YFXOXJYSUSDWAD-QMMMGPOBSA-N 338.385 1.740 10 10 EDCE COCn1ccc(C(=O)NCc2cccc(Br)c2O)n1 1568604231 BDSOHJZRVWLBIQ-UHFFFAOYSA-N 340.177 1.885 10 10 EDCE COc1ccc(CNC(=O)c2cc3c(nc2O)CCC[C@@H]3O)c(O)c1 1633927349 TUJDRXAVAMKWEP-HNNXBMFYSA-N 344.367 1.801 10 10 EDCE CC1(C)C[C@H](NC(=O)c2c(F)ccc(O)c2O)CCS1(=O)=O 1654836621 CAKOLYGNTVLPIX-MRVPVSSYSA-N 331.365 1.323 10 10 EDCE CC[C@H](C)CNC[C@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1699072470 KNWCEWZXYHZVRO-FZMZJTMJSA-N 335.408 1.575 10 10 EDCE Cn1c(Br)nnc1CCNCc1ccc(F)cc1O 2139883940 AXUPFPJFJUYPJJ-UHFFFAOYSA-N 329.173 1.755 10 10 EDCE Cc1cc(=O)c(OCC(=O)c2ccc(O)c(O)c2)cn1CCCN 1857914176 RKRQBEZAQRIGHY-UHFFFAOYSA-N 332.356 1.178 10 10 EDCE NC(=O)N1C[C@H]2C[C@H]1CN2Cc1cccc(Br)c1O 1877020164 XAXIFHYMICUQRC-ZJUUUORDSA-N 326.194 1.492 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003172921 RMIPGOWKVFIFKJ-MNXVOIDGSA-N 340.420 1.134 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2CCO[C@]2(C(=O)NCCN=[N+]=[N-])C1 1985094265 MIWFCWTUHSZCHW-QMTHXVAHSA-N 325.369 1.439 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985100889 KHJLCDQGMSFGIV-NSHDSACASA-N 327.385 1.827 10 10 EDCE CN(Cc1c(Br)cnn1C)C(=O)c1cc(O)nc(O)c1 2156460283 AQBBOBPNGSRTHT-UHFFFAOYSA-N 341.165 1.261 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)C[C@H]2CN(C)C)cc1Br 300522563 ZBJYAEICRWWEQE-KGYLQXTDSA-N 342.281 1.970 10 10 EDCE COCCN1CCN(c2ccc(CO)c(Br)c2)CC1=O 2158790294 UVZYKTQBVRORNS-UHFFFAOYSA-N 343.221 1.236 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CNCc2ccc(O)cc2O)[C@@H](O)C1 702786722 GDEPAVWCCYRAKP-WFASDCNBSA-N 338.404 1.415 10 10 EDCE CN(CCNCc1c(O)cccc1Br)S(C)(=O)=O 706831968 YAZLMZDNRKTJDA-UHFFFAOYSA-N 337.239 1.136 10 10 EDCE Oc1c(Br)cc(Cl)cc1CNCCn1ncnn1 708158724 TWTBWTVMBWMEPX-UHFFFAOYSA-N 332.589 1.584 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](C(=O)NCCN=[N+]=[N-])CO1 2242735625 VSTJFDVVNLKPPX-QWRGUYRKSA-N 327.385 1.733 10 10 EDCE CC(C)n1ncc2cc(/C=C/C(=O)N3CCn4nccc43)c(=O)[nH]c21 375973831 KEXZIISVYHOQOW-ONEGZZNKSA-N 338.371 1.562 10 10 EDCE NCc1cc(F)c(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)cc1Br 2355333839 HDXPFVQBJUVOMP-DQRILILZSA-N 345.212 1.367 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](N)CC(=O)O 1951454435 NHHKZUWYXZIRFW-WDEREUQCSA-N 340.376 1.336 10 10 EDCE Cc1noc([C@@H](C)N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)n1 182418781 YGTRBCTUJBPHHW-LLVKDONJSA-N 346.387 1.617 10 10 EDCE Cc1ccc(C(=O)N2CCC(c3nc(N(C)C)no3)CC2)c(O)c1O 193961644 DSPHVSKYMUNRAL-UHFFFAOYSA-N 346.387 1.875 10 10 EDCE O=C(NCCN1C(=O)CSC1=S)c1ccc(Br)o1 49755950 UIWHDJWOQOWAES-UHFFFAOYSA-N 349.231 1.632 10 10 EDCE C[C@@H](N[C@H]1CC(=O)N(C2CC2)C1)c1ccc(N2CCOCC2)cc1 90180728 GEIKAQUMRGXSJV-ZBFHGGJFSA-N 329.444 1.937 10 10 EDCE CN(C)S(=O)(=O)N1CCCN(Cc2cccc(Cl)c2O)CC1 367971784 FJYFHXGQUNWOCZ-UHFFFAOYSA-N 347.868 1.360 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2C[C@@H]2C(N)=O)c(O)c1Br 2380766517 RXIQJEDDXCUCSL-VHSXEESVSA-N 341.205 1.543 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2C[C@H]2C(N)=O)c(O)c1Br 2381138037 RXIQJEDDXCUCSL-ZJUUUORDSA-N 341.205 1.543 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN(C(=O)c2cc(C)cc(C)c2)C1 808506505 KNMGEHKICFKBOK-OAHLLOKOSA-N 345.395 1.857 10 10 EDCE C[C@@H]1CCNC[C@H]1NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 817888269 CHNBPEFIWAZDTI-UWWQBHOKSA-N 330.476 1.476 10 10 EDCE C[C@H](NC(=O)CCc1cn(C)nn1)c1ccc(N2CCOCC2)cc1 823835514 ZSTRYMJOQBWAEG-AWEZNQCLSA-N 343.431 1.462 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)C[C@@]23CCCN(CC2)C3)cc1 823732440 DBORCTBUPZXISY-KRWDZBQOSA-N 337.489 1.658 10 10 EDCE COc1ccc(N2CCCN(S(=O)(=O)N(C)C3CC3)CC2)cc1 736329485 HYIGMVXTIGRXEX-UHFFFAOYSA-N 339.461 1.546 10 10 EDCE C[C@H](NC(=O)N1CC(C)(CO)C1)c1ccc(N2CCOCC2)cc1 837882150 KYPINIZQHGTPBO-AWEZNQCLSA-N 333.432 1.608 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(C(=O)OC)CC2)c([N+](=O)[O-])c1 917091131 KMZPVUBTGMOELC-XQRVVYSFSA-N 349.343 1.669 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnc(O)n(C)c1=O 839920165 MEZUJRORQSYEFP-LBPRGKRZSA-N 344.415 1.221 10 10 EDCE CCc1cc(NC(=O)C(=O)N[C@H](C)c2cc(OC)ccc2O)no1 740496210 VCWOFWPAYGBJQP-SECBINFHSA-N 333.344 1.767 10 10 EDCE C[C@H]1CCc2nc(C(=O)N(CC(=O)O)Cc3ccccc3O)cn2C1 911488230 IEKZGFZBIFPERK-LBPRGKRZSA-N 343.383 1.898 10 10 EDCE O=C(NC[C@]1(CO)CCc2ccccc21)c1c(F)ccc(O)c1O 846659302 LTQDLYJJXPTZAU-SFHVURJKSA-N 331.343 1.843 10 10 EDCE COC(=O)[C@@H]1CN(C)CCN(C/C=C\c2ccc(N(C)C)cc2)C1 840958655 QZJQBFMDZDLWGJ-KEGWNNHHSA-N 331.460 1.802 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCC[C@@]4(CCCOC4)C3)nc12 846249573 HPMKFDIVZGCUQF-QGZVFWFLSA-N 346.387 1.526 10 10 EDCE COC(C)(C)C(=O)NCc1cc(NC(=O)C(C)(C)OC)ccc1O 923123011 UOSBLYQQPHMASB-UHFFFAOYSA-N 338.404 1.797 10 10 EDCE O=C1N[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CS1 856210134 OPUVDQYRUMBSOP-AWEZNQCLSA-N 335.429 1.089 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3cncnc3N)C2)cc1 854300118 UZYNFWNZVYZHAV-ZDUSSCGKSA-N 342.403 1.146 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc(C(N)=O)cn3)C2)cc1 855229689 LJEUXOADMKVYGY-ZDUSSCGKSA-N 340.383 1.198 10 10 EDCE COCc1ncc2c(n1)CCN(C(=O)/C=C/c1ccc(O)c(O)c1)C2 869683838 KGQSJFQCSSUULV-HWKANZROSA-N 341.367 1.632 10 10 EDCE COC(=O)[C@@H]1C[C@@H]2C[C@H](NC(=O)NCc3cccc(OC)c3O)[C@@H]2C1 897722736 ICIIVEGJKBBEIK-SYQHCUMBSA-N 348.399 1.788 10 10 EDCE C[C@H](O)c1ccc(N2CCN(C)C[C@@H]2CO)cc1Br 699437758 ZDDFXMULPJSDCV-CMPLNLGQSA-N 329.238 1.615 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1coc(Sc2ncccn2)n1 1153886189 ZQMDHFJABBEEPW-UHFFFAOYSA-N 344.352 1.957 10 10 EDCE Cc1oc(C(=O)NCc2ccc(N(C)C)cc2)cc1S(C)(=O)=O 1329626384 OLXRYMSJWPNVJI-UHFFFAOYSA-N 336.413 1.988 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(Br)c1 2126156872 OOXGCAWVGHJIEV-DHPDLVEQSA-N 327.222 1.086 10 10 EDCE CCN(CC)[C@@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1331936640 GQIHHIUQYRESFG-CQSZACIVSA-N 331.416 1.177 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2CCC(O)CC2)c1 1331279071 FMOXEPMMUOQCLP-UHFFFAOYSA-N 342.417 1.045 10 10 EDCE COC1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 1353592178 DAQPVHZZZGHHLK-UHFFFAOYSA-N 331.416 1.184 10 10 EDCE COc1ccc(-n2nnnc2CNC/C=C/CNC(=O)C(C)C)cc1 1273862201 UTCDFYDGYGGVLF-SNAWJCMRSA-N 344.419 1.089 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cccc(Nc2nn[nH]n2)c1 1299572950 HUHPKYBYKVOEDC-UHFFFAOYSA-N 326.316 1.285 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCc1nc(-c2ccncc2)n[nH]1 1451598892 VNVAQTCTQXLOOO-RQOWECAXSA-N 337.339 1.608 10 10 EDCE CC(C)CNC(=O)C1(NC(=O)Cc2ccc(O)c(O)c2)CCCC1 1465693823 OFAOEYUCVSAZAY-UHFFFAOYSA-N 334.416 1.842 10 10 EDCE Cc1ccc(C(=O)NCc2cc(=O)n3ccccc3n2)c(O)c1O 1469732405 CVFXAGKWNFXRNK-UHFFFAOYSA-N 325.324 1.344 10 10 EDCE COc1cc([C@](C)(CN)CNC(=O)OC(C)(C)C)cc(O)c1O 1535974822 KJERJVYOSHAXCH-MRXNPFEDSA-N 326.393 1.848 10 10 EDCE COc1cccc(-n2cc(NC(=O)c3cccc(O)c3O)nn2)c1 1627620579 NDEPTQJYJMGMCT-UHFFFAOYSA-N 326.312 1.939 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)Cc2nonc2C)cc1C 1485210085 NEAVBSMLCZFWSX-STQMWFEESA-N 346.431 1.921 10 10 EDCE C[C@H](CN(C)Cc1cnon1)NC(=O)c1ccc(N=NC(N)=O)cc1 1498467505 ZOROZMOSGMHSSV-SNVBAGLBSA-N 345.363 1.482 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H]2CCN(C)[C@@H]2C)cc1C 1491457826 VGYZISOHRJAWCU-BFYDXBDKSA-N 333.476 1.938 10 10 EDCE O=C(N[C@@H](Cc1ccccc1)c1nc(O)n[nH]1)c1cccc(O)c1O 1631927972 DSQYDFPGITXOGW-LBPRGKRZSA-N 340.339 1.635 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1cccc(C(=O)N2CCCC2)n1 1631434723 VLQQKYCSPGSITE-UHFFFAOYSA-N 341.367 1.659 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@@H]2CCN(C)C2)cc1C 1568709891 FYHKZKXPJSJYJO-DOTOQJQBSA-N 333.476 1.940 10 10 EDCE CS(=O)(=O)[C@H]1CCCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1635397843 REWLDFIIWHHSKQ-LBPRGKRZSA-N 327.402 1.066 10 10 EDCE CCC(=O)N[C@H](C)C(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 1733244664 SWYBWWRHDAMVCD-CQSZACIVSA-N 347.459 1.657 10 10 EDCE CC(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C(C)(C)C1 1597741591 YWGLNYOVGCMIBU-UHFFFAOYSA-N 331.376 1.932 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)C2(CF)CCC2)cc1 1758044065 GRCVYKACIQLCEI-UHFFFAOYSA-N 349.366 1.835 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)C2(C(N)=O)CC2)C2CC2)cc1C 1670512749 PBCHUPOZXWXKMI-HNNXBMFYSA-N 345.443 1.254 10 10 EDCE COc1ccc(CNC[C@@](C)(NC(=O)c2nc[nH]n2)C2CC2)cc1C 1698653837 WHXCCNBDGQNACK-GOSISDBHSA-N 343.431 1.810 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cc(C(=O)O)ncn3)CC2)cc1 1858182429 UUMGYISCKPKHAW-UHFFFAOYSA-N 342.355 1.146 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)Nc3ccccn3)CC2)cc1 9859172 IXHZIIXYFQVEJR-UHFFFAOYSA-N 340.383 1.378 10 10 EDCE COCCNCc1ccc(N2C[C@H](O)[C@@H](F)C2)c(Br)c1 2149256729 HGEHUMXMRZXFPG-JSGCOSHPSA-N 347.228 1.704 10 10 EDCE O=C1Nc2cc(N3CCOC(F)(F)C3)c(Br)cc2[C@H]1O 2152274096 OQGLUSHQRCTKES-SNVBAGLBSA-N 349.131 1.864 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCCOCc1ccccc1 2007820530 GCPHFWLBMNDNFZ-HNNXBMFYSA-N 331.368 1.728 10 10 EDCE C[C@H](C(=O)NCCCCN=[N+]=[N-])N1CC(NC(=O)OC(C)(C)C)C1 2014682729 FSUUEMZHJCLHIT-LLVKDONJSA-N 340.428 1.791 10 10 EDCE [N-]=[N+]=NCCN[C@@]1(C(N)=O)CN(Cc2ccccc2)[C@@]2(CCOC2)C1 2038665961 NSNZLVWGVWHRRI-DLBZAZTESA-N 344.419 1.175 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](N3CC(O)C3)C2)cc1Br 2158744244 SOHWUJAAFIYFGD-CMPLNLGQSA-N 340.265 1.724 10 10 EDCE CC(C)NCc1ccc(N2CC[C@H](O)[C@H](O)C2)cc1Br 2188629630 INLMWEBTSIQWNN-LSDHHAIUSA-N 343.265 1.879 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2104412759 XNRMVXRKWXLDSE-XPBUTXNASA-N 328.206 1.433 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2104412285 UEWXVWRUKHUVPS-SMGVIWHKSA-N 328.206 1.433 10 10 EDCE COc1ccc(Br)c(CNC[C@@H](O)c2cnc[nH]2)c1O 2236056171 UOMMKCLGYRTLMI-LLVKDONJSA-N 342.193 1.710 10 10 EDCE NCc1ccc(N2CCNCCNCC2)c(F)c1Br 2227924390 YQFCQUJFGAJKOE-UHFFFAOYSA-N 331.233 1.046 10 10 EDCE CNC[C@H]1CC[C@@H](S(=O)(=O)NCc2cnc(SC)s2)C1 2284692764 WGYIRQFNPSMHRD-GXSJLCMTSA-N 335.520 1.673 10 10 EDCE CC[C@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2288906484 WYDSHDYKWIDMMP-CYZMBNFOSA-N 341.205 1.784 10 10 EDCE COc1ccc(OC)c(N2C(=O)NC(=O)C(=Cc3ccco3)C2=O)c1 2296733067 TXXVFQBQMFDVHP-UHFFFAOYSA-N 342.307 1.963 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2354479486 YPHVDERAVJLPHU-QWCIBXROSA-N 341.249 1.660 10 10 EDCE CCCCN1C(=O)N=C(O)/C(=C/N[C@@H](CCSC)C(=O)O)C1=O 103116422 UCUAATNSIGAMGO-QROTZFDESA-N 343.405 1.385 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1NCC[C@H]1O 1952346504 MOKDOMCFWUUEQA-UXIGCNINSA-N 338.404 1.256 10 10 EDCE COCCN(C(=S)Nc1ccc(N)cc1)[C@H]1CCS(=O)(=O)C1 242659539 CSZSXIBKQHMHNS-ZDUSSCGKSA-N 343.474 1.101 10 10 EDCE Cc1cc(N2CCC[C@@H](NC(=O)c3cccc(O)c3O)C2)n(C)n1 369331084 NWODEIAHJCICAM-GFCCVEGCSA-N 330.388 1.539 10 10 EDCE COc1cc(Cl)cc(CN2CCC[C@H](CS(N)(=O)=O)C2)c1O 273703619 DXZNGAQSQBIHAI-JTQLQIEISA-N 348.852 1.555 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@H]3CSC(=O)N3)CC2)cc1 363247488 PCLIMYRXRREIQX-CQSZACIVSA-N 335.429 1.559 10 10 EDCE O=C(NCc1cccc(N2CCOCC2)n1)c1cccc(O)c1O 279827126 AXGKIBDWTFXVEF-UHFFFAOYSA-N 329.356 1.259 10 10 EDCE CC(=O)C(=O)CSc1nnc(-c2cccc(OC(C)C)c2)n1N 289665366 OTDDNANQYAUYNI-UHFFFAOYSA-N 334.401 1.696 10 10 EDCE CN1CCc2cc([C@H](NN)c3cc(Br)n(C)n3)ccc21 2163140707 MKDRCTHUURACPL-AWEZNQCLSA-N 336.237 1.728 10 10 EDCE COc1ccc(N2CCN(CCN[C@H](C)[C@H]3CCCCN3)CC2)cc1 817892594 BFZKJFYYKPOLTJ-YLJYHZDGSA-N 346.519 1.937 10 10 EDCE O=[N+]([O-])c1cc(CN2CCOC[C@H](O)C2)ccc1N1CCCCC1 824620319 JMRFAFOQALHSNU-OAHLLOKOSA-N 335.404 1.778 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCSC3)C2)cc1 828083057 JYXKARDEHDZRJM-STQMWFEESA-N 349.456 1.012 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)c2cccn(C)c2=O)cc1 844854865 UXQSWKVJOOGQJT-UHFFFAOYSA-N 329.400 1.602 10 10 EDCE O=C(NCCCSc1nccs1)NCC[C@@]1(O)CCOC1 845047428 TZLDGNPOKDJBNJ-CYBMUJFWSA-N 331.463 1.466 10 10 EDCE O=C1[C@H]2[C@H]3C[C@H]4[C@@H]2[C@]2(C(=O)NCc5cc(Cl)ccc5O)[C@H]1[C@H]3[C@@H]42 846477057 QAHOZHUHTNVOAH-CREWJEJQSA-N 329.783 1.989 10 10 EDCE CNC[C@@H]1C[C@H](F)CN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 844196720 NEWWOUPXBZZFAG-AZTQUHGTSA-N 347.434 1.695 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CC34CCNCC4)C2)cc1 852843567 BFNUXDXDAQSYJS-YOEHRIQHSA-N 329.444 1.780 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)CN3CCOCC3)C2)cc1 855234150 TXOPVGCBVUYCPA-CVEARBPZSA-N 347.459 1.358 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3cn(C)nn3)C2)cc1 852450805 WNYRDWJIWQDOSM-ZDUSSCGKSA-N 344.419 1.244 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3C(=O)NCC[C@H]3C)C2)cc1 852308595 JQBFVACXBZFRBL-DVOMOZLQSA-N 346.431 1.098 10 10 EDCE Cc1cc(C)c([C@H](C)NC[C@]23COCCN2C(=O)COC3)c(O)c1 866551520 APXQEPCHZGBLBR-KBXCAEBGSA-N 334.416 1.287 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc2c(c1)B(O)OC2 863871716 YQEOSNUMRNEPKJ-UHFFFAOYSA-N 338.216 1.633 10 10 EDCE COC[C@@](C)(CO)NCc1cc(Br)cc(OC)c1O 777483599 WGEOGHYEKAUFQS-CYBMUJFWSA-N 334.210 1.650 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCc4nccn4C3)CC2)cc1 786686289 COSNOBSFCKKGSA-OAHLLOKOSA-N 340.427 1.803 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cc3nc(C4CC4)n[nH]3)C2)cc1 1300634546 YHIBYZJZHUUXFN-ZDUSSCGKSA-N 341.415 1.628 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)/C=C\c2ccco2)cc1C 1320186120 KPCHNBZZXYBCPG-IOBAAEILSA-N 344.411 1.877 10 10 EDCE CS[C@H]1CCCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1329484880 SIMYKHVLODZODT-ZDUSSCGKSA-N 334.441 1.979 10 10 EDCE Cc1ccncc1CCNC(=O)C(=O)N(C)Cc1ccccc1O 1330352134 GOLAOHOYMGIYQL-UHFFFAOYSA-N 327.384 1.413 10 10 EDCE C[C@H](NC(=O)C(=O)N1CC[C@@H]2COC[C@H]2C1)c1ccc(N(C)C)cc1 1330968556 KQIDSERADVLVPP-NUEKZKHPSA-N 345.443 1.425 10 10 EDCE OC[C@@]12CC[C@@](NCc3cc(Br)ccc3O)(CO1)C2 2133659778 INMZAFFIMAADKY-KBPBESRZSA-N 328.206 1.928 10 10 EDCE COc1ccc(C(=O)N[C@H](C)c2ccccc2O)cc1-n1cnnn1 1454807221 QWYJSKJHVNKZON-LLVKDONJSA-N 339.355 1.868 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 1456235736 NMKAFEUPIXQGHD-MRVPVSSYSA-N 332.278 1.125 10 10 EDCE CO[C@@H](C)C(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1534213850 KQRMPHSAPRXWCN-UWVGGRQHSA-N 335.364 1.118 10 10 EDCE COc1cc(N2CCN(c3cnn(C)c3)CC2)c([N+](=O)[O-])cc1OC 1612076871 MSVBBUXEOGCTEX-UHFFFAOYSA-N 347.375 1.672 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1715823492 JPLCVZLFDZNIDQ-DWTRPJMMSA-N 345.443 1.244 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)CNC(=O)C2CC2)cc1C 1568261131 STGFHFJMNLVWDF-AWEZNQCLSA-N 347.459 1.466 10 10 EDCE NC(=O)[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@H]1c1ccccc1 1638800824 QVPACXRNCVBXAT-NWDGAFQWSA-N 344.342 1.578 10 10 EDCE Cc1cccnc1[C@@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1647937763 RVQCMXUGZHFAER-LLVKDONJSA-N 349.412 1.958 10 10 EDCE C[C@@H]1C[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CCS1(=O)=O 1646493927 QAXKPQJFUQAYBG-PEWKINPCSA-N 325.386 1.193 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C1=C[S@@](=O)CCC1 1641203940 MFLPECFVOGGMDX-DEOSSOPVSA-N 348.468 1.690 10 10 EDCE COc1cc(C(=O)N[C@H](C)C[C@H](C)NC(=O)C(C)C)cc(OC)n1 1735553871 CEXJDBKLHHULGT-NWDGAFQWSA-N 337.420 1.768 10 10 EDCE O=C(C[C@@H]1CCS(=O)(=O)C1)NCc1c(O)ccc2ccccc12 1647788941 UZPQTPOASVJKMG-LBPRGKRZSA-N 333.409 1.986 10 10 EDCE O=C1CNC(=O)c2ccc(C(=O)N3Cc4cccc(O)c4C3)cc2N1 1650674393 ALWJYZKALQFEMT-UHFFFAOYSA-N 337.335 1.230 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2nccnc2N)cc1C 1774111343 HQEABDPWNQITQQ-ZDUSSCGKSA-N 343.431 1.626 10 10 EDCE C[C@@H](O)CN(CCCNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1690016386 UOQCIUZYSVRZSK-GFCCVEGCSA-N 347.419 1.814 10 10 EDCE C[C@@H](NC(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)c1ccccc1O 2017963629 PRJMVLPTYWQJDF-DGCLKSJQSA-N 338.404 1.845 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2018048675 KWVWJQOLJOPCIK-NEPJUHHUSA-N 341.412 1.811 10 10 EDCE NCc1cc(F)c(N2C[C@H](O)C(F)(F)C2)cc1Br 2034596291 WHUQXFOMMKGAST-JTQLQIEISA-N 325.128 1.863 10 10 EDCE CN(C)C(=O)CN(Cc1ccccc1)C(=O)COc1ccc(N)cc1 2034783272 QJXDGXHTJVLJQT-UHFFFAOYSA-N 341.411 1.765 10 10 EDCE CO[C@@H]1C[C@H](CO)N(c2ccc(CN)c(Br)c2F)C1 389126290 SGRMIUNELGNVSC-NXEZZACHSA-N 333.201 1.633 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3CCCc4c3cnn4C)c2n1 2064477156 QTFCYPFDIXHEHI-LBPRGKRZSA-N 326.360 1.284 10 10 EDCE C[C@H]1C[C@@H]2CN(c3ccc(CN)cc3Br)CCN2C1=O 2181270493 WBPVJWZFDUEWRL-CMPLNLGQSA-N 338.249 1.965 10 10 EDCE COc1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)c(O)c1 1908511541 QXFGNNITQPPRBG-HIFRSBDPSA-N 338.404 1.471 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C1(CCO)CC1 2190077624 YCAZCIVJOYFMCJ-GFCCVEGCSA-N 341.205 1.786 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(CC(=O)Nc3ccc(N)cc3)C[C@@H]21 2045669025 YZCNSZPDSVHWMI-FOLVSLTJSA-N 346.431 1.662 10 10 EDCE CN(C(=O)C1(CNC(=O)OC(C)(C)C)CC(O)C1)c1ccc(N)cc1 2080837653 LFSBGANVGSYPEP-UHFFFAOYSA-N 349.431 1.897 10 10 EDCE O=C(O)[C@@H]1CCC2(CN(Cc3c(O)cccc3Br)C2)O1 2205354590 FLEPKBRSFGTSST-LBPRGKRZSA-N 342.189 1.973 10 10 EDCE C[C@]1(CO)C=CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2237170901 MLPNCEHXFJMXTI-TZMCWYRMSA-N 339.189 1.562 10 10 EDCE NCc1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2228405153 UQFUXIGPFSOZMR-PHIMTYICSA-N 329.238 1.335 10 10 EDCE O=C1NC(=O)N(Cc2ccccc2)C(=O)C1=Cc1ccc(O)c(O)c1 2296660092 FFAIRQXEOKNZTP-UHFFFAOYSA-N 338.319 1.760 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@@H](O)CN(C(=O)OC(C)(C)C)C1 2300531863 MZUKGCMUIUBGMU-VXGBXAGGSA-N 341.412 1.763 10 10 EDCE CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)NCCO 2313681704 LINPNMRJAFTTKO-UHFFFAOYSA-N 332.360 1.953 10 10 EDCE Cc1ccc(C=C2SC(=S)N([C@@H](CC(N)=O)C(=O)O)C2=O)o1 2314541304 JIDZLPNQALBHTH-QMMMGPOBSA-N 340.382 1.118 10 10 EDCE CS(=O)(=O)[C@H]1CC[C@@H]1NCc1cc(Br)ccc1O 2319818592 UUCULYAEGXMGIL-JQWIXIFHSA-N 334.235 1.820 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@@H]2O 2355461068 DJPSSSOQCIFMJE-ZTWXESEWSA-N 342.233 1.622 10 10 EDCE COC(=O)[C@@H](O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951701042 VKIYAILWRSSUJE-MFKMUULPSA-N 341.360 1.068 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@@H]3[C@@H]4CO)c(Br)cc2[C@@H]1O 2358060592 VKVFVBGIRNGYLT-AJNLAUMFSA-N 339.189 1.252 10 10 EDCE CO[C@@H](c1cccc(O)c1O)[C@H](NC(=O)OC(C)(C)C)C(=O)O 1952308271 JSZLPQXQSIFKCU-JQWIXIFHSA-N 327.333 1.763 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)CC(N)=O)C1 443939254 KIMIMEJIOCGCRZ-UHFFFAOYSA-N 342.443 1.352 10 10 EDCE CCN1C(=O)[C@H]2CN(Cc3cc(Cl)cc(C)c3O)CCN2C1=O 378440712 DPIHFJNLNGXQEU-CYBMUJFWSA-N 337.807 1.822 10 10 EDCE CO[C@@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC[C@H]1C 807675333 WNIGYLVNTALNDY-CKEIUWERSA-N 347.459 1.813 10 10 EDCE Cc1ccc(CN[C@@H]2C[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(O)c1Br 2380794202 YFSHXHTXGJVCAG-VIDBKGRSSA-N 342.233 1.683 10 10 EDCE C[C@@H](OCC(=O)N1CCOc2cc(N(C)C)ccc21)c1nccn1C 576189103 ZYOFUNBPDYZXTC-CYBMUJFWSA-N 344.415 1.989 10 10 EDCE O=C(C[C@H]1CCCC(=O)N1)NCc1cc(Br)ccc1O 811523901 RDURENOCKDKEGK-LLVKDONJSA-N 341.205 1.830 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3CSC(=O)N3)C2)cc1 819582596 JRJDFHDFGAHMSX-FZMZJTMJSA-N 335.429 1.463 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@@H](OC)[C@H]2CCOC2)c1O 826822016 IXTCNNLGAHORLA-WCQYABFASA-N 326.349 1.450 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC3CCCCC3)C2)cc1 826601134 XVPVPMBFESKFIK-HNNXBMFYSA-N 345.443 1.839 10 10 EDCE CN(C)S(=O)(=O)N1CCC[C@@H](N[C@@H]2CCc3cccc(O)c32)C1 834803453 UBKXZLNCSPBUAQ-ZIAGYGMSSA-N 339.461 1.240 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1C[C@H]2CC[C@H]1[C@H]1CNC[C@@H]21 903962849 LLZRAECVRPCADG-GTAWCEEGSA-N 327.472 1.953 10 10 EDCE CCN1CCN(CC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CC1 839919616 RXWKWIIGLOOCGS-QGZVFWFLSA-N 346.519 1.746 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)Cc2cn3c(n2)CCCC3)cc1 846664148 VQFFBACFROQUMX-QGZVFWFLSA-N 341.459 1.644 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C2CN(CC(F)F)C2)cc1 846441665 CJNORKXMVVKGPG-UHFFFAOYSA-N 341.402 1.787 10 10 EDCE Cn1nccc1[C@H]1C[C@@H](NC(=O)NCc2c(O)cccc2F)CCO1 922749509 QCEUORWSSXARDW-MEDUHNTESA-N 348.378 1.984 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC(F)(F)CN)C2)cc1 851664040 PHUUCWKASSWQRS-NSHDSACASA-N 328.363 1.167 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C1CS(=O)(=O)C1 864637163 ITWWVERAVZKDTL-UHFFFAOYSA-N 336.457 1.680 10 10 EDCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 861765898 ANDHXZYXNIOAAJ-UHOFOFEASA-N 332.448 1.187 10 10 EDCE C[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)[C@@H](C)O1 868131102 YQYUABUQVAJXRZ-CKEIUWERSA-N 333.432 1.888 10 10 EDCE Cc1nn(CC(=O)NCc2ccc(N3CCCCC3)cc2)c(=O)o1 878489821 VHLGAXICURKPCX-UHFFFAOYSA-N 330.388 1.451 10 10 EDCE C/C(=C\C(=O)N(C[C@H]1CCCO1)c1ccnnc1)c1cnccn1 893109516 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COc1cccc(CNC2(CO)CN(C(=O)OC(C)(C)C)C2)c1O 1918376252 YMFNRKXQUZUMRE-UHFFFAOYSA-N 338.404 1.472 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)/C=C/c2ccc(C(N)=O)o2)c1 1150543363 MOQROQXWYCVHHY-YVFTVSHDSA-N 330.340 1.983 10 10 EDCE COC(=O)[C@@H]1C[C@@H](O)CN1Cc1cc(C)cc(Br)c1O 1320240730 DHCHCEZJTGLWSU-PWSUYJOCSA-N 344.205 1.571 10 10 EDCE CO[C@H]1CC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1326205407 WRVPNAGNRLFYPL-KOLCDFICSA-N 328.390 1.061 10 10 EDCE CCOCCN1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1267753873 PWEIISDOWVAGFD-CQSZACIVSA-N 333.392 1.690 10 10 EDCE CN1CCO[C@@H](C(=O)N(C)Cc2ccc(N3CCCC3)cc2)C1=O 1539469319 XUPOLDMPIOCCLV-MRXNPFEDSA-N 331.416 1.102 10 10 EDCE CC[C@H](CNC(=O)Cc1cnc[nH]1)NCc1ccc(OC)c(C)c1 1714107902 VWQSZTSVPGOWKD-OAHLLOKOSA-N 330.432 1.954 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)CCn2ccnn2)cc1C 1482274830 CRFQFHOSILJCSO-OAHLLOKOSA-N 345.447 1.622 10 10 EDCE COc1ccc(CN[C@@H]2CCC[C@@H](NC(=O)CNC(C)=O)C2)cc1C 1567157125 JBNMUHGFHRKWCP-IAGOWNOFSA-N 347.459 1.657 10 10 EDCE 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2234557520 BPMMKXGNUOJMSR-YGRLFVJLSA-N 345.212 1.492 10 10 EDCE CC(C)(C)OC(=O)N1CCOCC[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2249053897 DAENMVZUBMHHJS-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE C[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2273223527 ASSUMBKPPAWWOY-HQDFOZKBSA-N 326.194 1.361 10 10 EDCE CSc1ncc(CNC(=O)N[C@@H](C(=O)O)[C@H](C)SC)s1 2284494724 QRJUIEBHFBKCMT-POYBYMJQSA-N 335.476 1.869 10 10 EDCE Cn1cc(NC(=O)C=Cc2ccc(N3CCOCC3)cc2)ccc1=O 2297505339 FGIQVYQARPAMJH-UHFFFAOYSA-N 339.395 1.874 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H](N)CCO 1951703831 VXDSXZFEEJSJHL-RYUDHWBXSA-N 326.393 1.243 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H](N)CCO 1951703829 VXDSXZFEEJSJHL-NEPJUHHUSA-N 326.393 1.243 10 10 EDCE NCc1cc(F)c(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)cc1Br 2357054755 LVWQLBSDVLKOBE-MGNUUCGSSA-N 345.212 1.510 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)c(Br)c1 2357056179 GBLSXPWNIMXTCR-SDJAHQOYSA-N 341.249 1.631 10 10 EDCE Oc1ccccc1CN(Cc1ccco1)C[C@@H](O)CN1CCOCC1 121026458 ALRPZLUPRDLDAK-KRWDZBQOSA-N 346.427 1.681 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@]1(C)CC(=O)N1 1952208958 PBCSRURWBNWKRI-DYVFJYSZSA-N 336.388 1.812 10 10 EDCE COc1cccc(CNC(=O)[C@H]2COCCN2CC(F)(F)F)c1O 287437873 ANDVYLDNWJEBGB-LLVKDONJSA-N 348.321 1.280 10 10 EDCE CN1CCN(Cc2cc(C(N)=O)cc(Br)c2O)CC1 642879824 BEVDMQCSSNJLAV-UHFFFAOYSA-N 328.210 1.001 10 10 EDCE O=C(OCc1ccccc1)N1C[C@@H](O)[C@H](NCc2ccccc2O)C1 713832870 SOVACMIBIIUINZ-SJLPKXTDSA-N 342.395 1.864 10 10 EDCE Cc1cc(CC(=O)N2C[C@@H](O)C[C@@H](O)C2)c(C)n1-c1ccccc1 829473265 NQXLWJHKAZWWRQ-HDICACEKSA-N 328.412 1.591 10 10 EDCE C[C@@H]1CN(c2ccc(CNC(=O)[C@@H]3[C@H]4COC[C@H]43)cc2F)C[C@@H](C)O1 822688059 KACRQDPAYLWNJZ-KBGZAFCFSA-N 348.418 1.948 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N=c1nc2ccccn2[nH]1 588386807 OJNYKLJTYSMGQW-TWGQIWQCSA-N 349.394 1.640 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C[C@@]2(O)CCCN(C)C2)cc1 911891994 ICODQWNOWQQGCA-IBGZPJMESA-N 349.475 1.437 10 10 EDCE C/C(=C\C(=O)N(CC(=O)O)Cc1ccccc1O)CN1CCOCC1 911490556 ZOQXLUXSYXRVGI-GXDHUFHOSA-N 348.399 1.084 10 10 EDCE Cc1cnc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)o1 744855235 UWOYEPFBEIBVPK-UHFFFAOYSA-N 326.330 1.417 10 10 EDCE COC(=O)c1cnc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1 853759872 CIXJTGCDGQWLLO-ZDUSSCGKSA-N 328.372 1.963 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](C)[C@@H](CO)C3)C2)cc1 856920274 RZLOCRJRGUXNQA-OAGGEKHMSA-N 347.459 1.934 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1ccnc(N2CCOCC2)n1 862130485 IIKJGUGEMAMXIT-UHFFFAOYSA-N 348.790 1.602 10 10 EDCE COc1cc(Br)cc(CNCC2(N)CCOCC2)c1O 863482220 WIKWLCMZSUGACU-UHFFFAOYSA-N 345.237 1.761 10 10 EDCE C[C@@H](C(=O)NCc1ccc2cccnc2c1O)[C@H](C)S(C)(=O)=O 862025791 BAJYBYWYOAVFLL-MNOVXSKESA-N 336.413 1.626 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCO[C@H](C)CC2)cc1 1119755176 WBPWMQWEJLFZAU-OAHLLOKOSA-N 347.459 1.786 10 10 EDCE CCOc1cccc(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c1O 872255423 WQSPETCBHMDVCG-FMKPAKJESA-N 347.415 1.158 10 10 EDCE 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347.375 1.120 10 10 EDCE Cc1cc(C(=O)N2CC[C@H](O)[C@@H](CO)C2)c(C)n1-c1ccccn1 1299450502 MLNSXAACESLXIL-ZBFHGGJFSA-N 329.400 1.304 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@H](F)C(C)C)cc1C 1700948502 PXFSBJKAGXOOOA-DOTOQJQBSA-N 340.439 1.907 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCNC(=O)c1ccccc1Cl 1629913472 JUNRHHLNRAQWFB-UHFFFAOYSA-N 348.786 1.840 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cn(C)nn2)cc1C 1714388130 DIZSTFCMIAKXOM-LBPRGKRZSA-N 331.420 1.288 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H]2CC23CCC3)cc1C 1482772162 DATCIBSCRXHFPE-JKSUJKDBSA-N 332.444 1.761 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1cnn(C)c1 1567083401 KGCHCFLQCWFTDF-LLVKDONJSA-N 343.391 1.491 10 10 EDCE CC[C@H](CNC(=O)[C@H](C)C1CC1)NC(=O)c1cc(OC)nc(OC)c1 1721458728 SMLNFLGGEOAOBI-BXUZGUMPSA-N 349.431 1.770 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCn2nc(C(F)(F)F)cc2C1 1646046676 PDFDUSZRPLVFSE-UHFFFAOYSA-N 341.289 1.898 10 10 EDCE O=C(N[C@@H]1CS(=O)(=O)Cc2ccccc21)c1cccc(O)c1O 1646266818 ILGAQZLFDDENFV-CYBMUJFWSA-N 333.365 1.497 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@@H]2CCCNC2=O)cc1C 1668097361 UXRYTSVGWQVFKM-GDBMZVCRSA-N 347.459 1.514 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC2(CNCCO)CCCC2)cc1 1698639701 UYOOTUSJHRJAHO-UHFFFAOYSA-N 333.392 1.474 10 10 EDCE COc1cccc(C(=O)NCCNC(=O)Cc2ccc(N)cc2)c1 150901302 BYSSWPIQOLPRDW-UHFFFAOYSA-N 327.384 1.366 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@]1(C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003169473 KZYVBKNHQHHBHV-YAMOITTJSA-N 340.420 1.182 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C1 2010402817 WIEOVMCDCRQURA-NWDGAFQWSA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)N1CC[C@H](CN=[N+]=[N-])C1 2010402397 QEPSHPWBCOKGRE-NEPJUHHUSA-N 341.412 1.811 10 10 EDCE CC(C)(CNC(=O)OC(C)(C)C)NC(=O)c1cc(O)c(O)c(O)c1 2015120641 VLRXFUIQBKCAIZ-UHFFFAOYSA-N 340.376 1.837 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCO[C@@H](CF)C3)c(Br)cc21 2172041861 QHPSEPCUGITYQE-MADCSZMMSA-N 344.184 1.576 10 10 EDCE CCCN(c1ccc(CN)cc1Br)[C@@H]1CC(=O)NC1=O 2171198231 WPRKGCJHLKDNAF-GFCCVEGCSA-N 340.221 1.539 10 10 EDCE CCc1nn([C@@H](c2ccc(OC)cc2O)C2CC2)c(N)c1C(N)=O 2079986166 NFLSXKBWQSRJRC-OAHLLOKOSA-N 330.388 1.840 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCCC[C@@H]1CCn1ccnn1 1457133801 DRFRJQSLZRLWNZ-CQSZACIVSA-N 330.388 1.703 10 10 EDCE NCc1ccc(N2CCO[C@H]3COCC[C@H]32)c(Br)c1 2087484395 JZZRIUMDTFFHAA-KGLIPLIRSA-N 327.222 1.902 10 10 EDCE CC(C)(C)OC(=O)NC[C@]12CCC[C@]1(COc1nnc(=N)[nH]n1)C2 2213781304 QEBNGAJDCKNCQP-HUUCEWRRSA-N 336.396 1.143 10 10 EDCE CN=c1ccc(S(=O)(=O)NCc2cnc(SC)s2)c[nH]1 2284692735 WCASCJGHCXIQGK-UHFFFAOYSA-N 330.460 1.202 10 10 EDCE COC[C@H]1C[C@H](CN)N(Cc2c(O)cccc2Br)C1 2273873357 FESPFLVNOYAUNQ-WDEREUQCSA-N 329.238 1.950 10 10 EDCE COc1cccc(N2C(=O)NC(=O)C(=CNN3CCCCC3)C2=O)c1 2296400387 ZEHLFPXSQGFHII-UHFFFAOYSA-N 344.371 1.152 10 10 EDCE CNC=C1C(=O)NC(=O)N(c2ccc(Br)c(C)c2)C1=O 2297534433 ZUKWPSLHTZNAJQ-UHFFFAOYSA-N 338.161 1.444 10 10 EDCE Cc1ccc(CN[C@@H]2[C@H]3CS(=O)(=O)C[C@H]32)c(O)c1Br 2352670067 GUHWONWCLBIHLH-IAZYJMLFSA-N 346.246 1.596 10 10 EDCE Cc1ccc(CN2CC[C@](O)(C(=O)O)C2)c(O)c1Br 2352944630 KIUXPEWHHRKNFF-CYBMUJFWSA-N 330.178 1.485 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCC[S@](C)=O)CC2)cc1 172072507 ZCVFCHKDGBGFOJ-QHCPKHFHSA-N 339.461 1.295 10 10 EDCE COc1ccc(N2CCN(C(=O)CCCCC(N)=O)CC2)cc1F 188914350 MWOAEOPUJSCYHB-UHFFFAOYSA-N 337.395 1.529 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)NC[C@H](O)C(F)(F)F 265960867 QPAAQYQBYVUAEH-ZDUSSCGKSA-N 329.322 1.785 10 10 EDCE CCC(=O)N[C@@H](C)C(=O)NCc1cc(Br)ccc1O 804734333 IJIQXTCJFOSGNT-QMMMGPOBSA-N 329.194 1.686 10 10 EDCE COc1ccc(CNC(=O)N[C@@H](C)C2(S(C)(=O)=O)CC2)c(O)c1 805789873 MTBZAXIZGVZGRK-JTQLQIEISA-N 342.417 1.166 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@]23[C@@H]4[C@H]5C(=O)[C@H]2[C@@H]2[C@@H]5C[C@@H]4[C@@H]23)c1 800518704 IBFWGEOIZGGOIS-PFVAUFDBSA-N 339.391 1.905 10 10 EDCE CNC(=O)c1ccccc1NS(=O)(=O)c1cc(F)cc(F)c1O 821136029 ZMIXDXUEAGFCPO-UHFFFAOYSA-N 342.323 1.831 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@H]2CCCCN2CCO)c1O 824583501 NOWJEXHVGKPGJY-CYBMUJFWSA-N 339.392 1.245 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@@H]2CNCCC2(F)F)c1O 903957435 QVSKVMNIWSPONT-JTQLQIEISA-N 331.319 1.643 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](CO)[C@@H]3CC)nc12 830715126 VTRYBRHDARAUTN-FZMZJTMJSA-N 348.403 1.204 10 10 EDCE COCC1(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 848934789 OEUQKWZHUHBDSR-UHFFFAOYSA-N 333.432 1.220 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C1(F)F 1895875207 GZCBUAWOIPSZDQ-RKDXNWHRSA-N 331.323 1.914 10 10 EDCE O=S1(=O)CC[C@]2(CN(Cc3c(O)ccc(Cl)c3F)CCO2)C1 843425916 JZISWNMCSBPKAW-AWEZNQCLSA-N 349.811 1.574 10 10 EDCE CSC[C@H](NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)O 929046430 UCOHANSXMZXNMD-GWCFXTLKSA-N 325.434 1.929 10 10 EDCE CC[C@H](C)[C@@H](O)CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 854301848 UZHHSYJMGFBQRB-ZQIUZPCESA-N 335.448 1.980 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CNC(=O)C(C)(C)C)C2)cc1 855228346 AILXMQFCRHMEMK-ZDUSSCGKSA-N 333.432 1.552 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)[C@@H]4CSCN4C3=O)C2)cc1 924976529 BZBDSYYMLJODNB-JSGCOSHPSA-N 333.413 1.611 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCC[S@](=O)CC(F)(F)F 855275801 LTOXDZINMBDPAM-RQQCXYQZSA-N 337.319 1.538 10 10 EDCE CCCOC(=O)CCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852456581 ZBXDMFQBGUHBKC-AWEZNQCLSA-N 349.431 1.916 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C[C@H](C)O1 853862862 KRJNYPQYDVZYDI-GJZGRUSLSA-N 347.459 1.967 10 10 EDCE C[C@@H](NC(=O)[C@]1(N)CC1(F)F)c1ccc(N2CCOCC2)cc1 867961259 CDVTVDPZPRCXQE-IAQYHMDHSA-N 325.359 1.437 10 10 EDCE CCO[C@H](C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)[C@H]1CCOC1 869231599 SLMISRFRPRYUFJ-MPGHIAIKSA-N 348.443 1.832 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CNCC(C)(C)F)CC2)cc1 872217120 NQHHBEWBILMSCR-MRXNPFEDSA-N 339.455 1.516 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cc3c(O)ncnc3cn2)c1 779002618 YWKQXVQTMBHKBG-SECBINFHSA-N 340.339 1.936 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CS(=O)(=O)Cc2ccccc21 1148523307 RFIHHBVFRBZVTI-CQSZACIVSA-N 347.392 1.426 10 10 EDCE COc1ccc(CNC(=O)NCc2nc(C(F)F)no2)c(O)c1 1255621177 IWUVUSSPQRZLJI-UHFFFAOYSA-N 328.275 1.721 10 10 EDCE CN1CC[C@@H](N(C)c2ccc(CN)c(Br)c2)CC1=O 2131957593 HUWSJODXMJHZOR-GFCCVEGCSA-N 326.238 1.965 10 10 EDCE C[C@@H](CNCCC[C@@H](C)O)NC(=O)c1ccc(N=NC(N)=O)cc1 1716466808 ZOMJPIANUVONNO-NWDGAFQWSA-N 335.408 1.718 10 10 EDCE Cc1cc(C(=O)NCc2cc(O)ccc2O)nn1C1CCOCC1 1637126325 SSNLTDKYSLNYAM-UHFFFAOYSA-N 331.372 1.884 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cn2ccnc2)cc1C 1732942690 OUFWGEISYGXYGK-ONEGZZNKSA-N 328.416 1.662 10 10 EDCE O=C(COc1ccc2ccc(=O)oc2c1)NCc1c(O)cccc1O 1597569915 WLMFCFIVSDJHNL-UHFFFAOYSA-N 341.319 1.899 10 10 EDCE CCn1cc(C(=O)NCC2(NCc3ccc(OC)c(C)c3)CC2)nn1 1670880696 RFCGLVXIAJMIOF-UHFFFAOYSA-N 343.431 1.667 10 10 EDCE CCN1CCO[C@H](CNCc2cccc(Br)c2O)C1 134435228 GPDVHNLLGFJYLL-GFCCVEGCSA-N 329.238 1.965 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H](O)[C@H]2CF)cc1Br 2140659151 RHQVGWUBMMLDSR-GUQKDYTMSA-N 333.201 1.349 10 10 EDCE CO[C@@H](C)[C@H](CC(=O)N1CC(N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1985094526 QBWHIGPFRQHAIG-ONGXEEELSA-N 327.385 1.826 10 10 EDCE CO[C@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCN(C(=O)OC(C)(C)C)C1 1985094771 UEOXVDVQTNNWIM-CQSZACIVSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H](C(=O)NCCCCN=[N+]=[N-])C1 2010406239 RJNFHYSCEZKKCF-VXGBXAGGSA-N 341.412 1.811 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](NCc1ccc2c(c1)CCO2)C(=O)O 2022035750 YPVLCTXXZPKKOH-ZDUSSCGKSA-N 336.388 1.689 10 10 EDCE NCc1ccc(N2CC3(C2)OCCC[C@H]3O)c(F)c1Br 2159649257 ZWFNPKDRYAIUQM-LLVKDONJSA-N 345.212 1.777 10 10 EDCE CN=c1[nH]sc(=NCc2ccc(C)c(Br)c2O)[nH]1 2327796927 OYFOQAFZVDZDAW-UHFFFAOYSA-N 329.223 1.812 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H](F)[C@H](CO)C3)c(Br)cc21 2177144359 RGRIKHMFQZPONH-RMUHFYJVSA-N 344.184 1.168 10 10 EDCE CCn1nc(Br)c([C@H](O)[C@@H](NC)c2ccccc2O)n1 2167716976 MSYNDHFCOUPSIY-CMPLNLGQSA-N 341.209 1.760 10 10 EDCE CC1(C)C[C@@H](O)[C@@H](O)CN1c1cc(Br)c(CN)cc1F 2188631634 DRACUBMRZRVJMK-OLZOCXBDSA-N 347.228 1.757 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NCc2cccc(F)c2O)C1 1908634228 MSCLUBZENNCWAY-ZIAGYGMSSA-N 340.395 1.991 10 10 EDCE OCC1(CO)CCN1c1ccc(CNC2CC2)cc1Br 2194354181 UGXAMAWQYWTYBX-UHFFFAOYSA-N 341.249 1.635 10 10 EDCE CN1CCO[C@H]2CCN(c3ccc(CN)cc3Br)C[C@@H]21 2185491720 HDGRHVJMXDNTNN-GJZGRUSLSA-N 340.265 1.817 10 10 EDCE CCNCc1ccc(N2C[C@@H]3C(C(N)=O)[C@H]3C2)cc1Br 2201298707 JJAKARKRIGNJKB-RYUDHWBXSA-N 338.249 1.726 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@H]3[C@H]4CO)c(Br)cc2[C@H]1O 2203022442 VKVFVBGIRNGYLT-UBOMVKISSA-N 339.189 1.252 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])CC(O)C1 2213587626 JSVWLSSTQBRDNY-FMCALUSXSA-N 339.396 1.752 10 10 EDCE Oc1c(F)cc(Br)cc1CN1[C@H]2CCNC[C@H]1COC2 2204642114 KRSOQSPQKKQWEO-RYUDHWBXSA-N 345.212 1.857 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCOC[C@@H]2CO)c1O 2236045684 SGYMLJNJLXFNCO-JOYOIKCWSA-N 346.221 1.650 10 10 EDCE CCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1cccc(Cl)c1 490638751 JJPWJBYFMAXKPR-HJWRWDBZSA-N 347.802 1.804 10 10 EDCE COc1ccc(C=C2SC(=S)N([C@@H](CO)C(=O)O)C2=O)cc1 2323832092 JMSINZGMROQXFS-JTQLQIEISA-N 339.394 1.342 10 10 EDCE O=C(O)Cc1ccc(N=NN2CCN(c3ncccn3)CC2)cc1 2330154941 WELUATRLGMSQOJ-UHFFFAOYSA-N 326.360 1.925 10 10 EDCE CN1CC[C@H](NC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)C1=O 175368632 SGBOTHSHXXNCFT-HNNXBMFYSA-N 348.358 1.423 10 10 EDCE CC[C@H](C)N1C(=O)/C(=C\NNCCN(CC)CC)C(O)=NC1=S 38168698 JPVIHZOGKHRJOQ-NIANNCQZSA-N 341.481 1.188 10 10 EDCE CC(=O)c1cc(F)cc(CN(C)CC(C)(C)S(C)(=O)=O)c1O 123812857 YGIWFCFTZMXQJR-UHFFFAOYSA-N 331.409 1.989 10 10 EDCE CC[C@H](C)NC(=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 244255461 WJMUHFJHMMZPOE-AWEZNQCLSA-N 333.432 1.649 10 10 EDCE COc1cc(O)c(CN2CCS(=O)(=O)C(C)(C)C2)cc1OC 271067348 CRBARZWDXAMIMV-UHFFFAOYSA-N 329.418 1.418 10 10 EDCE COc1ccc(N2CCN(C(=O)Cn3ccc(C(C)=O)n3)CC2)cc1 283705470 DAIXXLQVTGGOCA-UHFFFAOYSA-N 342.399 1.443 10 10 EDCE CC1CCN(c2ccc(CNC(=O)Cc3cnnn3C)cc2)CC1 826861234 CBWYPZZPBZBAQJ-UHFFFAOYSA-N 327.432 1.910 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCO[C@@H]([C@H](C)O)C1 840484537 PLKMHHXJXJIDKD-RLFYNMQTSA-N 349.475 1.783 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@H]1CNCC[C@@H]1C)c1ccc(N(C)C)cc1 842203176 QCFKPRXYLSBLKX-XEZPLFJOSA-N 332.448 1.044 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2C[C@]34CCCC[C@@]3(COC4)C2)cc1 850866651 CXEHRCUGENWYAJ-ROUUACIJSA-N 329.400 1.627 10 10 EDCE COc1ccc(CN[C@H]2CCN(c3ccc4nncn4n3)C2)cc1C 858245494 RYXQTYICRBPRMZ-HNNXBMFYSA-N 338.415 1.810 10 10 EDCE Cn1ccc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 765658238 IXCAIMRIHOOLSZ-UHFFFAOYSA-N 347.394 1.395 10 10 EDCE COCCN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCOC1 786188409 FJAQGFYAYNMVDY-SFHVURJKSA-N 349.475 1.448 10 10 EDCE COC[C@@]1(CO)CCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 897930770 GNLOTRABXRRFNW-INIZCTEOSA-N 337.397 1.784 10 10 EDCE Cc1ccncc1CN(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 794202827 DXAQIXIFGWHZAV-UHFFFAOYSA-N 349.412 1.739 10 10 EDCE C[C@@H](NCc1ccc(N2CCN(C)CC2)cc1)c1nnc(O)n1C 895176823 PCCBLXLVFGIEQQ-CYBMUJFWSA-N 330.436 1.123 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H](F)[C@H](F)C3)c(Br)cc21 714733749 IJXRFKJLCTUZKM-RNSXUZJQSA-N 332.148 1.897 10 10 EDCE Nc1ccc(N2C(=O)N[C@]3(CCN(Cc4ccccc4)C3)C2=O)cc1 692368894 WYMMHOCXUFQWNN-IBGZPJMESA-N 336.395 1.970 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cc([N+](=O)[O-])c2nsnc2c1 1156881028 MEJHUNNTBYXUBL-UHFFFAOYSA-N 346.324 1.941 10 10 EDCE Cc1c(C(=O)N2Cc3cccc(O)c3C2)nnn1Cc1ccncc1 1302788588 YDKGMBCPMPWFJD-UHFFFAOYSA-N 335.367 1.891 10 10 EDCE O=C(NC[C@H](CO)Cc1ccc(F)cc1)c1c(F)ccc(O)c1O 1160998887 YFQOTJBOPGUYKQ-LLVKDONJSA-N 337.322 1.957 10 10 EDCE CN(CCCNC[C@H]1CCOC1)C(=O)c1ccc(N=NC(N)=O)cc1 1322854107 KNBKYAPFLTVSQH-CYBMUJFWSA-N 347.419 1.937 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCO[C@@H](C(=O)C3CC3)C2)cc1 1297345296 CXTCIUZAKKZHOX-CYBMUJFWSA-N 330.344 1.669 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCCN(CC(F)(F)F)C1 1450677862 KPWOILRVEBOSCV-LLVKDONJSA-N 332.322 1.783 10 10 EDCE CO[C@@]1(Cn2c(C)nnc2N(C)Cc2ccccc2O)CCOC1 1299797367 MKETXEOJXAQIDP-QGZVFWFLSA-N 332.404 1.734 10 10 EDCE CC1CCN(c2ccc(CNC(=O)Cn3c(O)nnc3O)cc2)CC1 1627467950 SKZKLSZBLWAELX-UHFFFAOYSA-N 345.403 1.242 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)Cc2cncn2C)cc1C 1715267954 HVYRDHZWBDKBKV-AWEZNQCLSA-N 344.459 1.822 10 10 EDCE COc1ccc(-n2nnnc2CN[C@@H](C)[C@@H](C)NC(=O)C2CC2)cc1 1717395583 NSIAINVXNFENHT-NWDGAFQWSA-N 344.419 1.064 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2c[nH]c(C)cc2=O)cc1C 1498154882 VGGHJFMDSAYRJE-AWEZNQCLSA-N 343.427 1.908 10 10 EDCE COc1cnc([C@@H]2CCCN2C(=O)c2ccc(C)c(O)c2O)nc1O 1636888621 PCZOXGVYJOQSQM-NSHDSACASA-N 345.355 1.888 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCc1cnc2c(Cl)cnn2c1 1636768956 SRJFUADUSMYZFK-UHFFFAOYSA-N 346.774 1.695 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](NC(N)=O)C(C)(C)C)CC2)cc1 1566326559 QRQZMOBIMFGHAH-HNNXBMFYSA-N 348.447 1.427 10 10 EDCE C[C@H](F)CCNC[C@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1732667102 OIRZHNPXWDGHKB-GWCFXTLKSA-N 339.371 1.277 10 10 EDCE CC[C@H](C)C(=O)N(C)C[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1738792430 LOUNUJURQFKNFL-RYUDHWBXSA-N 337.420 1.722 10 10 EDCE C[C@@H](O)CN(C)CCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1733781710 PMFKQJJMFFJGED-GFCCVEGCSA-N 335.408 1.624 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)c2ccnc(CO)c2)N(C)C)cc1 1648477721 BBCDJKXZHCOPHO-GOSISDBHSA-N 342.443 1.673 10 10 EDCE CCN1CC[C@@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1586799486 CJHBVWLKWHMIAU-GOSISDBHSA-N 331.460 1.606 10 10 EDCE Cc1cnn(-c2c(C(=O)NCc3c(O)cccc3O)c(C)nn2C)c1 1652625297 AJRUQYXFLKZRPR-UHFFFAOYSA-N 341.371 1.564 10 10 EDCE C[C@@H](Oc1ccc(N)cc1)C(=O)N1CCN(C(=O)c2ccco2)CC1 1860081654 BDZJLGWSWPSACO-CYBMUJFWSA-N 343.383 1.614 10 10 EDCE COc1cccc(O)c1CNCCn1ncc(Br)n1 1875997697 GPOXUDBDZWWNCO-UHFFFAOYSA-N 327.182 1.545 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1ccc2c(c1)NC(=O)[C@@H]2O 1946869506 WAAOEBUFAXCKSK-QGZVFWFLSA-N 325.368 1.425 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCCCCN=[N+]=[N-])C(C)(C)O 1963733109 VFWVAZJAKOZVTK-SNVBAGLBSA-N 329.401 1.857 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](C1)[C@@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003168228 FQSUNUIMLAUIQQ-XLFUENPSSA-N 336.432 1.755 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985104239 HQACDKHLXRGAAT-AXFHLTTASA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 1985102676 KLRBOOTXIOJGEA-QWRGUYRKSA-N 325.369 1.534 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985101847 YNENYFXJKFRURK-KOLCDFICSA-N 327.385 1.562 10 10 EDCE C[C@H](NC[C@@H](O)CNC(=O)OC(C)(C)C)c1c(O)cccc1O 1985772574 YKQNICVUWGONOY-WDEREUQCSA-N 326.393 1.634 10 10 EDCE C[C@H](CS(C)(=O)=O)N(C)c1ccc(CO)cc1Br 688587545 QUNVSQFPZZJVHW-SECBINFHSA-N 336.251 1.811 10 10 EDCE CNCc1ccc(N2CCC(=O)N(C)CC2)cc1Br 688979284 NVJAVJSILKSEDK-UHFFFAOYSA-N 326.238 1.837 10 10 EDCE O=C1Nc2cc(N3CCOC4(CC4)C3)c(Br)cc2[C@@H]1O 2168294200 OZVRRBBPGVURLV-LBPRGKRZSA-N 339.189 1.804 10 10 EDCE NCc1ccc(N2C[C@@H](O)[C@@H](O)CC23CCC3)cc1Br 2169893407 CMELYWANJBTPMQ-UONOGXRCSA-N 341.249 1.762 10 10 EDCE CNCc1ccc(N2CC(N3CCCC3=O)C2)c(Br)c1 2182230296 UEADQYYKMLZOIW-UHFFFAOYSA-N 338.249 1.980 10 10 EDCE NC(=O)[C@@H]1CCN1c1ccc(C=CC(=O)O)c(Br)c1 2089362681 OXAOKEXJVNYGER-NSHDSACASA-N 325.162 1.611 10 10 EDCE CN[C@H](c1ccccc1O)[C@@H](O)c1c(Br)cnn1C 2091868554 SPHSISFSRAHEPT-DGCLKSJQSA-N 326.194 1.882 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2210537673 JVWMSHASTRVUHL-NAKRPEOUSA-N 327.385 1.608 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](COc1nnc(=N)[nH]n1)Cc1ccccc1 2219013085 OGAINGHEZALQQT-GFCCVEGCSA-N 346.391 1.194 10 10 EDCE CC[C@H](C)N1C(=O)C(=CNc2cccc3nonc23)C(=O)NC1=S 2296555058 NASGDXJYSRVWFW-QMMMGPOBSA-N 345.384 1.560 10 10 EDCE NCc1ccc(N2CC3(CC[C@H](CO)O3)C2)c(Br)c1 2336703758 CPKYJXJGXHUHCL-LLVKDONJSA-N 327.222 1.638 10 10 EDCE CCN1C(=O)NC(=O)/C(=C/Nc2ccc(Cl)c(C(=O)O)c2)C1=O 104937185 VGVGNGKOXKKXKF-TWGQIWQCSA-N 337.719 1.432 10 10 EDCE CN1CCCc2cc(/C=C\C(=O)NC3CCN(C(N)=O)CC3)ccc21 96294960 SYRRQRSQKGDPGW-ALCCZGGFSA-N 342.443 1.742 10 10 EDCE Cn1ccnc(NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)c1=O 255241601 YRJXBZUFFFUBBT-DAXSKMNVSA-N 340.383 1.269 10 10 EDCE Cc1ccc(CN2CCN3C[C@@H](O)C[C@@H]3C2)c(O)c1Br 2381132433 AVHZAVSBQBBTJV-OLZOCXBDSA-N 341.249 1.714 10 10 EDCE CN(C[C@H]1CCCO1)C(=O)C(=O)NCCCSc1nccs1 806277821 JYATXXJPLHWBFN-LLVKDONJSA-N 343.474 1.379 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1C[C@@]12CCN(C(=O)OC(C)(C)C)C2 808539203 WAJUAXQSXGSRKG-BDJLRTHQSA-N 325.361 1.335 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCOC[C@H]2CC(F)F)cc1 298632064 VYTCFXHDBVJMEJ-OAHLLOKOSA-N 341.402 1.725 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]4CC[C@H]3NC4)CC2)cc1 394635876 CHMJQZZVXQTGKK-ZTFGCOKTSA-N 329.444 1.732 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CC[C@@]2(CNCCO2)C1 719952748 ZBBXUCORGPPUPW-CQSZACIVSA-N 345.212 1.858 10 10 EDCE CCO[C@@H]1C[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)[C@H]1n1cccn1 819397465 KEIRMNIIRBOCQU-VNWKVRJHSA-N 343.383 1.842 10 10 EDCE COc1ccc(N2CCCN(C(=O)CCc3cnn(C)n3)CC2)cc1 822656184 OGFHMXAGZIAKOZ-UHFFFAOYSA-N 343.431 1.495 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3C(=O)NC[C@H]3C2)cc1Br 723182610 MWUJCQMUZCDPHQ-KOLCDFICSA-N 339.237 1.683 10 10 EDCE Cc1cc(N(C)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)ccc1O 913530409 GJWGMYGLIZIVDZ-UHFFFAOYSA-N 347.396 1.161 10 10 EDCE CN(C[C@H]1CCS(=O)(=O)C1)C(=O)NCc1ccc(N(C)C)cc1 740902125 QNFJNPVFJQBRBA-CQSZACIVSA-N 339.461 1.329 10 10 EDCE COc1ncc(/C=C\C(=O)N2C[C@H](CO)Cc3cccc(F)c32)cn1 911692336 OMGTYFMZXYZVDN-CFHLNLSMSA-N 343.358 1.835 10 10 EDCE COCC(COC)N1CCN(Cc2cc3c(cc2O)CCC3)CC1 840171413 JQZBBKSPJSZDPC-UHFFFAOYSA-N 334.460 1.660 10 10 EDCE CC(C)COC1CCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)CC1 846241929 VJWBCAREMYJQOD-UHFFFAOYSA-N 348.403 1.770 10 10 EDCE CC(C)n1cnc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n1 845850529 SRNSYZNNRMZLJA-UHFFFAOYSA-N 348.382 1.319 10 10 EDCE O=S1(=O)CCN(Cc2cc3c(cc2O)CCC3)[C@H]2CCOC[C@@H]21 840168074 YGPWSMZPCJQISZ-RDJZCZTQSA-N 337.441 1.269 10 10 EDCE Cn1cc(N2CCC[C@H](NC(=O)NCCc3ccc(N)cc3)C2)cn1 841836006 LTTLHRUQCLJEAA-INIZCTEOSA-N 342.447 1.513 10 10 EDCE CN1CCCc2cc(CN3C(=O)N[C@H](c4ccnn4C)C3=O)ccc21 843308738 ZSADXFRDWNGGMT-MRXNPFEDSA-N 339.399 1.596 10 10 EDCE CN1C[C@@H](CCNCc2ccc(N3CCOCC3)c(F)c2)CC1=O 922490299 XZEATXLMZWRGRB-HNNXBMFYSA-N 335.423 1.620 10 10 EDCE COc1ccc(N2CC[C@H](Nc3nc(N)nc4c3cnn4C)C2)cc1 853761721 VOFUTKAHPJTGTJ-NSHDSACASA-N 339.403 1.645 10 10 EDCE CCc1nn(C)cc1C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855226433 OUMPFSRGYXCAAR-ZDUSSCGKSA-N 328.416 2.000 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(C)(C)n3ccc(N)n3)C2)cc1 852900981 XLDJUXLNZXWMBH-CYBMUJFWSA-N 343.431 1.604 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@]12CCC(=O)N1CCS2 935946179 AHTKOMCLDSKWJZ-INIZCTEOSA-N 341.429 1.560 10 10 EDCE O=C([C@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1)N1CCCC1 768447383 OQUFLGWLKKJRHV-SUMWQHHRSA-N 346.427 1.652 10 10 EDCE C[C@H](NC(=O)NC[C@H]1COC2(CCOCC2)O1)c1ccccc1O 868481054 IWOUMGFUEQKBFT-STQMWFEESA-N 336.388 1.675 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCC[C@H]4COCC[C@H]43)nc12 1118319531 OJLNWPLRIDBRMK-GXFFZTMASA-N 332.360 1.134 10 10 EDCE CC(=O)N1CCN(C(=O)NCCCSc2nccs2)[C@H](C)C1 764360549 NSKURKQNYSYUCM-LLVKDONJSA-N 342.490 1.888 10 10 EDCE COc1ccc(O)c([C@H](C)N[C@H](C)C(=O)N(C)CC(=O)NC2CC2)c1 775369790 QWONHPMBSGKMIN-NWDGAFQWSA-N 349.431 1.177 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN3C(=O)NC[C@H]3C2)c1 781909988 SGKFCYBNGQDILO-NSHDSACASA-N 340.221 1.673 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN3C(=O)NC[C@@H]3C2)c1 781909985 SGKFCYBNGQDILO-LLVKDONJSA-N 340.221 1.673 10 10 EDCE COC(=O)c1c(CNCC(=O)NC2CC2)c2cc(F)ccc2n1C 894783426 UHPSRXKYVXENEH-UHFFFAOYSA-N 333.363 1.472 10 10 EDCE COC(=O)c1c(CN[C@@H]2CCN(C(C)=O)C2)c2cc(F)ccc2n1C 895378667 RMJPGKXMQRDUTD-CYBMUJFWSA-N 347.390 1.814 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1[C@@H]2CCCO[C@H]21 780325554 HIINCMMOZJXTQP-RCCFBDPRSA-N 330.428 1.907 10 10 EDCE CS(=O)(=O)N[C@@H]1CCN(c2ccc(CO)cc2Br)C1 702982984 CNNMPIPRVNTMQJ-SNVBAGLBSA-N 349.250 1.069 10 10 EDCE COc1cc(NS(=O)(=O)c2cccc3c2COC3=O)ccc1O 797820298 PUQSBZFBFYNECH-UHFFFAOYSA-N 335.337 1.872 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3CC[C@H]3C(N)=O)CC2)cc1C 1323515788 FFBSLLZTZJJAQB-HUUCEWRRSA-N 345.443 1.254 10 10 EDCE CNCc1ccc(N2C[C@@H]3NC(=O)O[C@@H]3C2)c(Br)c1 2120408325 XOMZNJRDLLCGKO-CMPLNLGQSA-N 326.194 1.466 10 10 EDCE CO[C@@H]1COC[C@H]1N(C)c1cc(Br)c(CN)cc1F 2120774806 IHPRQOVUNSQIEV-CHWSQXEVSA-N 333.201 1.897 10 10 EDCE O=C(NCc1cc(Br)no1)c1cc(O)c(O)c(O)c1 2132349693 GMELDVYSTSWNDX-UHFFFAOYSA-N 329.106 1.484 10 10 EDCE CCCC(=O)NCC1(NCc2nnnn2-c2ccc(OC)cc2)CC1 1269361920 MOZJPIFZURIPFO-UHFFFAOYSA-N 344.419 1.209 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CC(=O)N(C)C2)cc1C 1270988976 WCUXBBXGCZRLJY-ZBFHGGJFSA-N 347.459 1.418 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2CN(C)CCO2)cc1C 1281703352 OMBGWIVJTKTPTK-YJBOKZPZSA-N 349.475 1.319 10 10 EDCE CCOC(=O)N[C@@H](CNC(=O)Cc1ccc(O)c(O)c1)CC(C)C 1441255529 ZYVWFCKQELQXRD-CYBMUJFWSA-N 338.404 1.917 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Br)n[nH]1 1447560032 DTNOJTWCBUXJFH-ZETCQYMHSA-N 340.177 1.944 10 10 EDCE CCOC(=O)[C@@H](F)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1450261049 VLQVPXWTZKWVFG-LBPRGKRZSA-N 336.323 1.822 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CCc2cn(C)nn2)cc1C 1483299871 FCGGJVJLDBREAF-AWEZNQCLSA-N 345.447 1.359 10 10 EDCE CS(=O)(=O)Nc1ccc(C(=O)NCc2c(O)cccc2F)cc1 1638863317 MCIZHURGMHMDQL-UHFFFAOYSA-N 338.360 1.833 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1coc2c1C(=O)NCCC2 1567467261 FPPLXIIPKDNLIO-SNVBAGLBSA-N 344.367 1.728 10 10 EDCE CCCN1CC(CCO)(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1725208700 MNQVNISLADUQMG-UHFFFAOYSA-N 333.392 1.426 10 10 EDCE O=C(NCC(=O)N1CCc2ccccc2C1)c1c(F)ccc(O)c1O 1638274870 HWRQKFTXTOHLGQ-UHFFFAOYSA-N 344.342 1.552 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2conc2C)cc1C 1732654212 VCTBRZTZZFNARJ-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE C[C@H](Sc1nnnn1C1CC1)C(=O)NCc1ccc(O)cc1O 1570462539 XINSPZCRIGIZLP-QMMMGPOBSA-N 335.389 1.216 10 10 EDCE Cc1ccccc1[C@H](CC(=O)NCc1cc(O)ccc1O)NC(N)=O 1651222546 JQFYLVSRCMNRHL-HNNXBMFYSA-N 343.383 1.822 10 10 EDCE CC[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)[C@@H](CC)CN1C(C)=O 1587395188 UOYKHRHJFMOHRW-GJZGRUSLSA-N 334.416 1.888 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@H]2CCCNC2=O)cc1C 1662249746 PJHKVVHTAPDYEL-HIFRSBDPSA-N 333.432 1.124 10 10 EDCE CC(C)(C)NCc1ccc(N2C[C@H](O)[C@@H](O)C2)c(Br)c1 232494412 SCPPRYCKRPFXOO-KBPBESRZSA-N 343.265 1.879 10 10 EDCE C[C@@H](O)CNC[C@H]1CCCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1673136524 YTQNYJUPSFIJMZ-IUODEOHRSA-N 347.419 1.814 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)/C=C\C3CC3)cc2)CC1 1772696423 UOZGKPSOETXKDU-TWGQIWQCSA-N 327.428 1.938 10 10 EDCE COCCNC[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1690759676 GHRFELIZDDZJLR-GFCCVEGCSA-N 333.392 1.547 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@@H](C)NC(=O)CC(C)C)cc1 1699352840 KAJYSUUHLZHTSB-CYBMUJFWSA-N 346.435 1.311 10 10 EDCE COCCNC[C@H]1CCC[C@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1699037443 VAYFZACXXIWBNG-UKRRQHHQSA-N 347.419 1.984 10 10 EDCE Cc1nnc(CN(C)CCNC(=O)c2ccc(N=NC(N)=O)cc2)o1 1691002765 RPMIPSKXPDMSPB-UHFFFAOYSA-N 345.363 1.402 10 10 EDCE CN(C)C[C@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 155710493 PPDIYNAAOQKOID-SFHVURJKSA-N 344.459 1.535 10 10 EDCE CCN(CCC(=O)O)C(=O)CCNCc1cc(Cl)ccc1O 1857864997 QKCBLCCKXMOAMH-UHFFFAOYSA-N 328.796 1.849 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CCOC1 1985102201 CWDPIUXZDPCMFA-YGRLFVJLSA-N 325.369 1.581 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCCN=[N+]=[N-])C[C@@H]2OCC[C@H]21 2010392453 ZTUSMDZRHWJJMQ-WOPDTQHZSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(CO)CNC(=O)Nc1ccc(N)cc1 2010536779 ICTMRKLPEOXZKI-INIZCTEOSA-N 338.408 1.666 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(N)cc1 2022850306 QWVVFZXDGVZPPX-BXUZGUMPSA-N 337.420 1.501 10 10 EDCE O=C1NC[C@@]2(CCCN(c3ccc(CO)c(Br)c3)C2)N1 2177668537 MLJDXMLFETWCNN-CQSZACIVSA-N 340.221 1.593 10 10 EDCE NCc1ccc(N2C[C@H](O)[C@@H](O)CC23CCC3)cc1Br 2169893399 CMELYWANJBTPMQ-KBPBESRZSA-N 341.249 1.762 10 10 EDCE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1c(Br)nn(C)c1C 2188103936 QWWBWFUFZASGNJ-SECBINFHSA-N 345.201 1.995 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@H](O)CC2(C)C)cc1Br 2188639478 ZLEHZMRSVSMGPV-KGLIPLIRSA-N 343.265 1.879 10 10 EDCE CO[C@@H]1C[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)C1 1908252542 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OCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)cc1Br 2331966546 JVRZYXPEVZSIOV-SAXRGWBVSA-N 328.206 1.404 10 10 EDCE Cc1ccc(CN2CCC[C@@](O)(CO)C2)c(O)c1Br 2352945091 QPNSYERDTAIYPC-AWEZNQCLSA-N 330.222 1.782 10 10 EDCE COc1cc([C@H](CNC(=O)OC(C)(C)C)C(=O)O)cc(O)c1O 1951720877 AMOCULMDPUWUGQ-VIFPVBQESA-N 327.333 1.799 10 10 EDCE Cc1cnn(C[C@H]2CN(C(=O)c3ccc(C)c(O)c3O)CCO2)c1 182430740 VQSBUJSPUAWAMI-CYBMUJFWSA-N 331.372 1.452 10 10 EDCE Cn1nccc1CCC(=O)NCc1ccc(N2CCOCC2)cc1 132957630 HREIWRMRZZYTII-UHFFFAOYSA-N 328.416 1.506 10 10 EDCE CC(C)NC(=O)CN(C)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255064712 ZQGFOMNWTMHRDS-TWGQIWQCSA-N 345.443 1.519 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3CCOC[C@@H]3C)CC2)cc1 279801974 DWUANLRHCJYBHL-LPHOPBHVSA-N 333.476 1.832 10 10 EDCE COc1cc(N2CCC[C@H](c3nc(=O)[nH][nH]3)C2)c([N+](=O)[O-])cc1OC 285724822 SIWLIMWFEWHERY-VIFPVBQESA-N 349.347 1.407 10 10 EDCE O=C1C[C@H](C(=O)NCc2cc(Br)ccc2O)CCN1 804739766 RTKQFEWUISIDAJ-MRVPVSSYSA-N 327.178 1.297 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCN1c1ncnc2sccc12 808514490 GCQAWVBAVNQHKB-LLVKDONJSA-N 333.369 1.361 10 10 EDCE COC(=O)CC[C@@H]1CC[C@H](C(=O)NCc2ccc(OC)cc2O)O1 822611416 ABGOFLDTFCHZPQ-SWLSCSKDSA-N 337.372 1.518 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCN=C2C1=NNN2C 824234347 JHQOSSRXJLEKQA-OAHLLOKOSA-N 342.447 1.326 10 10 EDCE Cc1cc(CNC(=O)/C=C\c2ccc(O)c(O)c2)nc(N(C)C)n1 588575617 FTSANUSQJAHRCD-ALCCZGGFSA-N 328.372 1.592 10 10 EDCE N[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@H]1C(F)(F)F 903980765 ZIMXEAJMWTZNRW-HUUCEWRRSA-N 329.366 1.845 10 10 EDCE CNS(=O)(=O)CCCN1CCCN(c2ccc(OC)cc2)CC1 732197895 CUTQCMIJQKNOOZ-UHFFFAOYSA-N 341.477 1.147 10 10 EDCE CCOC(=O)[C@H](F)[C@@H]1CCN(C(=O)c2ccc(C)c(O)c2O)C1 912251812 CNCVGGJNVORUNL-ZYHUDNBSSA-N 325.336 1.770 10 10 EDCE CCc1cc(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)no1 741096741 FKIQVJIUZUVAIR-UHFFFAOYSA-N 340.383 1.868 10 10 EDCE CNC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)Nc2ccc(N)cc2)C1 843043358 PPZFBDIBDAYKPL-CYBMUJFWSA-N 330.310 1.801 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)C2C[C@H]3COC[C@@H](C2)C3=O)c1 740081613 FGWBJDZCEVRURZ-ODWCKFRGSA-N 333.384 1.820 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCC(CO)(CO)C1 912555747 IIKHEKSXVLSHCF-UHFFFAOYSA-N 334.441 1.973 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCC2(COC2)C1 850625777 JDMPUGNCTKPIQD-UHFFFAOYSA-N 332.400 1.380 10 10 EDCE CCO[C@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 855522339 JFENXCYTYJGYGA-XYPYZODXSA-N 328.390 1.061 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](CO)CC(F)F)C2)cc1 854299331 OEYVOIXQHUCRJE-VXGBXAGGSA-N 343.374 1.589 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC[C@@H](N)C(C)C 851684564 JCKNRZHCMUFKHR-MRXNPFEDSA-N 334.464 1.167 10 10 EDCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)CC2(OC)CCC2)c1 866842641 YBDGJKJCQBNHBD-LLVKDONJSA-N 329.418 1.950 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2 865315174 IREKCNUBQMWDRL-AVVLXZEZSA-N 328.368 1.580 10 10 EDCE CCOC(=O)[C@@]1(C)CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCO1 871224283 HAFNUJJEQCLNKQ-XTKXOIQPSA-N 335.356 1.292 10 10 EDCE CSc1nc(O)cc(CNC(=O)/C=C\c2ccc(O)c(O)c2)n1 1163576443 CORFCRSGXMBLDP-HYXAFXHYSA-N 333.369 1.645 10 10 EDCE O=S1(=O)C[C@H]2[C@H](CNCc3c(O)cccc3Br)[C@H]2C1 2117986033 QXIOLUUXQHPBDW-UIKWRGBMSA-N 346.246 1.535 10 10 EDCE CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@@H]1CCCOC1 1326697224 XLIDDDFHSAIULK-QGZVFWFLSA-N 347.459 1.705 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)NCC2(CN=[N+]=[N-])CC2)n1 2121909461 DCWZNMNSFXBTEN-UHFFFAOYSA-N 349.214 1.551 10 10 EDCE CS[C@@H]1CC[C@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332040949 GUOMOBKETHTKDK-QWHCGFSZSA-N 334.441 1.977 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2C[C@H]3[C@H](C2)C3(F)F)c1 1331247338 LJJMBZVWQHMXMU-QWRGUYRKSA-N 346.355 1.537 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCc2cc(F)ccc2C1 1330416638 CEMZPEUQZXJAIF-UHFFFAOYSA-N 340.354 1.958 10 10 EDCE O=C(C(=O)N1CCOCC2(CCCC2)C1)N1Cc2cccc(O)c2C1 1348640309 SOXXDUNEZHNLHV-UHFFFAOYSA-N 344.411 1.654 10 10 EDCE COC(=O)[C@H]1CN(C(=O)/C=C(\C)c2cnccn2)c2ccccc2O1 1532446114 MMDWXTSLVCONCW-ONOODXEBSA-N 339.351 1.847 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)/C=C/C(=O)O)c2nccn2C)cc1 1615096823 ZOKAJDUCLOHLCF-FDMDGMSGSA-N 328.372 1.333 10 10 EDCE CC(=O)O[C@H]1[C@@H](N=[N+]=[N-])CO[C@]2(COC(C)(C)O2)[C@@H]1OC(C)=O 6363549 YWEMWEKIXSKBDT-KQXIARHKSA-N 329.309 1.038 10 10 EDCE in-vitro Cc1noc([C@@H]2OCC[C@@H]2NC(=O)N[C@@H](C)c2ccccc2O)n1 1470976928 ZSWSGNSUDXGQHF-DUFXMDAXSA-N 332.360 1.974 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H](C)CC(N)=O)cc1C 1482316643 JTPATYUVYJABQB-KBPBESRZSA-N 335.448 1.452 10 10 EDCE C[C@@H](N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1)C(F)(F)F 1620689185 IYANQSOKCGWJQJ-SNVBAGLBSA-N 332.322 1.735 10 10 EDCE Cc1ccc(C[C@@H](CO)NC(=O)Cc2ccc(O)c(O)c2)cc1C 1556917155 FXBNXPVAYXWQSL-INIZCTEOSA-N 329.396 1.977 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccc(C)nc2)cc1C 1568550716 OCVUVFRKTHJPQF-QGZVFWFLSA-N 343.427 1.588 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@H](C)c2nnc(O)n2C)c1 1565377373 PMCGTQKMHLKBGZ-DTWKUNHWSA-N 335.364 1.356 10 10 EDCE CC(C)CN1CC[C@](O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1733492935 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333.344 1.545 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN3CCOC[C@H]3C2)c([N+](=O)[O-])c1 371808527 JCVBLQCXSSFVJG-LYKUJDHUSA-N 347.371 1.302 10 10 EDCE COC[C@@H]1[C@@H](O)[C@H](O)CN1Cc1ccc(C)c(Br)c1O 2381141725 DHYGOUCGEBTGJH-JTNHKYCSSA-N 346.221 1.016 10 10 EDCE Cc1ccc(Cn2cc(CNCCO)nn2)c(O)c1Br 2380810338 GAQVVHWJNUQEEN-UHFFFAOYSA-N 341.209 1.185 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N3CCCO3)CC2)cc1 291404838 XOCCVKOQVRMXTC-UHFFFAOYSA-N 334.420 1.164 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@]23[C@@H]4[C@H]5C(=O)[C@H]2[C@@H]2[C@@H]5C[C@@H]4[C@H]23)c1 800518702 IBFWGEOIZGGOIS-GVYJZKSUSA-N 339.391 1.905 10 10 EDCE CN(C)C(=O)CN1CCC(NCc2cc(Cl)c(F)cc2O)CC1 293760635 YZPNQYQWOLVJGM-UHFFFAOYSA-N 343.830 1.827 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)CN2CC(=O)NC2=O)cc1 732259832 YFORLXKLOMKKKY-UHFFFAOYSA-N 332.404 1.043 10 10 EDCE O=C(Cc1ccon1)NCc1cc(F)c(N2CCOCC2)c(F)c1 837709977 YTDOGQBHHBGERC-UHFFFAOYSA-N 337.326 1.648 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCn2c(CC3CC3)nnc2C1 846362025 CROZIEUSAAHLQK-XQRVVYSFSA-N 340.383 1.697 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccc(CN2CCOCC2)cn1 910946371 NIEPYSDPNGTWHM-UHFFFAOYSA-N 343.383 1.255 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@H]1CC(=O)N(CC(F)(F)F)C1 928711669 LBGNFHRQAHDDDU-QMMMGPOBSA-N 334.269 1.558 10 10 EDCE COc1ccc(N2CC[C@@H](N=c3nc4[nH][nH]cc-4c(O)n3)C2)cc1 853758138 AHMCQNXPYZCXDI-SNVBAGLBSA-N 326.360 1.131 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N3C[C@H]4[C@H](C3)C4(F)F)ccc21 1332774471 BSDHEZVRTMBTEO-KBPBESRZSA-N 349.381 1.409 10 10 EDCE COc1ccc(N2CCCN(C[C@H]3CCC4(CNC4)O3)CC2)cc1 852747148 YCEGIDFAXRIAQA-GOSISDBHSA-N 331.460 1.728 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCC[C@H](C)CO)C2)cc1 853917055 SYYSTWFTMRSNCY-GJZGRUSLSA-N 335.448 1.982 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](CN)C(F)(F)F)C2)cc1 850754203 LFPIXQWCTBKLGV-MFKMUULPSA-N 346.353 1.463 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCSC[C@H]2CO)c([N+](=O)[O-])c1 765639658 AVZGOPOMIRYZPW-OGOUPESXSA-N 338.385 1.695 10 10 EDCE O=C(OCC(=O)N1CCO[C@H]2CCCC[C@@H]21)c1cccc(O)c1O 776282125 PGIAANDXHPONKX-JSGCOSHPSA-N 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COc1ccc(CNC[C@@H](C)NC(=O)c2c[nH]c(C(N)=O)c2)cc1C 1268674770 RNHISXKSGKFQJK-GFCCVEGCSA-N 344.415 1.339 10 10 EDCE COCC(=O)N(C)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1283574963 GXWDZAZCTLAUDG-UHFFFAOYSA-N 335.364 1.074 10 10 EDCE C[C@H](CS(C)(=O)=O)NC(=O)c1cc2cc(O)c(O)cc2s1 1443942228 JJHCIYXVVYVXGU-SSDOTTSWSA-N 329.399 1.475 10 10 EDCE CO[C@H](C)C(=O)N[C@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1527613510 DOUKZXSMRKNJNV-GHMZBOCLSA-N 349.391 1.509 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H]2CCNC2=O)cc1C 1482860751 MBURIQPVJVQDJC-HIFRSBDPSA-N 333.432 1.124 10 10 EDCE CN(C)CCCN(CCCN(C)C)C(=O)Cc1ccc(O)c(O)c1 1627116474 JBJCLBLOAGMJDT-UHFFFAOYSA-N 337.464 1.372 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CN3CCC2CC3)cc1C 1569058674 PJBYFHCYXQLICP-MAUKXSAKSA-N 345.487 1.940 10 10 EDCE CN(C(=O)Cc1ccc(O)c(O)c1)c1ccc(N2CCOCC2)nc1 1638186404 JFCZJSHWFNFZTB-UHFFFAOYSA-N 343.383 1.535 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)[C@@H]2CCC(=O)N2)C2CC2)cc1C 1723343011 MDXBXPFOPHOQSN-HOTGVXAUSA-N 345.443 1.267 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)C2(C(N)=O)CC2)C2CC2)cc1C 1731404764 HLPULLKTBTZQIR-OAHLLOKOSA-N 345.443 1.254 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cn2ccccc2=O)cc1C 1731981311 IUYILXAXCNOPPT-UHFFFAOYSA-N 343.427 1.414 10 10 EDCE C[C@](O)(CO)[C@@H]1CCN(c2ccc(CO)cc2Br)C1 2138090712 BHKUSXUXRXAGLM-RISCZKNCSA-N 330.222 1.511 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2cnnc(O)c2)cc1C 1676365632 ZFPUXBXNVDETOS-ZDUSSCGKSA-N 344.415 1.750 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)N[C@H]2CCc3ncnn3C2)c1 161150089 UVHMNRBNWMHXAV-MNOVXSKESA-N 331.376 1.368 10 10 EDCE CCOC(=O)c1c(NC(=O)[C@@H](N)CC(=O)O)sc2c1CCCC2 1865999513 OLSIDQXSROUKPB-VIFPVBQESA-N 340.401 1.544 10 10 EDCE CCOC(=O)C1CCN(C(=O)CCNCc2cc(C)ccc2O)CC1 1857864438 OINNTGXWBXSARN-UHFFFAOYSA-N 348.443 1.982 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NCCCCN=[N+]=[N-])C1 1963732872 SKOGHUUKKHWJTQ-LLVKDONJSA-N 327.385 1.829 10 10 EDCE COc1ccc(Br)c(CNC2CN(C(C)=O)C2)c1O 1964069609 NBKLZKUOZIZRKZ-UHFFFAOYSA-N 329.194 1.484 10 10 EDCE COc1ccc(Br)c(CNCC[C@@]2(O)CCOC2)c1O 1965961701 HFBXSYPSLIVYDU-CQSZACIVSA-N 346.221 1.794 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010406675 XONIKSJIUWWPSP-PWSUYJOCSA-N 341.412 1.809 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC(CN=[N+]=[N-])CC1 2018047853 WKUPDMLLHKPQQR-GFCCVEGCSA-N 341.412 1.811 10 10 EDCE Nc1ccc(CCC(=O)N[C@H](COCc2ccccc2)C(=O)O)cc1 2034491339 RAKWKYGEPAMYPF-QGZVFWFLSA-N 342.395 1.988 10 10 EDCE CN1CCCc2cc(C=CC(=O)N[C@@H]3CCS(=O)(=O)C3)ccc21 2041531332 SHFZVRLJROMRKM-OAHLLOKOSA-N 334.441 1.386 10 10 EDCE C[C@@H]1C[C@@H](O)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 385095312 NOAARCXUXMKTNS-QHMRUWFYSA-N 326.194 1.361 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H](C)CN3C[C@@H](C)C[C@@H](C)C3)c2n1 2062005996 JBWDDTKXYPRILR-MBNYWOFBSA-N 345.447 1.840 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)[C@@H]1CCCS(=O)(=O)C1 2063694668 FBSIBVMXRATYFK-CYBMUJFWSA-N 333.409 1.986 10 10 EDCE CCN(c1ccc([C@@H](C)N)cc1Br)[C@H]1CC(=O)NC1=O 2171191665 BFYHIAGNYIVGTG-PELKAZGASA-N 340.221 1.710 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2199533682 XIFMLNQOXXTTIK-RELHGNMBSA-N 342.233 1.823 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)Nc1ccc(O)cc1N 2089751587 TWFZEJMUDBQFLU-UHFFFAOYSA-N 347.194 1.271 10 10 EDCE NCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@@H]32)cc1Br 2090543712 ZDNVYLNMSBXTKM-FPMFFAJLSA-N 327.222 1.636 10 10 EDCE CO[C@@H]1C[C@H](CN)N(Cc2cc(Br)cc(F)c2O)C1 2090738335 CLNDYAGMMPCREX-GHMZBOCLSA-N 333.201 1.842 10 10 EDCE Cc1nccc(N2CCN(C(=O)C=Cc3ccc(O)c(O)c3)CC2)n1 2308867124 DTBWGMFEMUHKKG-UHFFFAOYSA-N 340.383 1.558 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2329193649 RDRXOLSOWGROBM-UMGHXEBTSA-N 327.222 1.665 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)c3cccn3C)CC2)cc1 65084009 CXEIODSGULBJON-UHFFFAOYSA-N 327.384 1.565 10 10 EDCE CN1O[C@@H]2C(=O)N(Cc3ccccc3)C(=O)[C@@H]2[C@@H]1c1ccccc1O 248032623 ILRDIUAKHZMGGH-IKGGRYGDSA-N 338.363 1.864 10 10 EDCE CCn1nc2c(cc1=O)CN(C(=O)c1ccc(C)c(O)c1O)CC2 370366702 QSLJYLQMGRLFDL-UHFFFAOYSA-N 329.356 1.181 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@]4(CCCOC4)C3)cc2N1 376486973 KKORJIHHOJFWSQ-MRXNPFEDSA-N 333.344 1.933 10 10 EDCE CO[C@H]1CN[C@@H](C(=O)NCc2ccc(C)c(Br)c2O)C1 2380750570 WLLZZWRWKBTHEM-GHMZBOCLSA-N 343.221 1.456 10 10 EDCE NC(=O)NC1CN(c2ccc(CNC3CC3)cc2Br)C1 2163218324 XVDYFGPZVMMCKZ-UHFFFAOYSA-N 339.237 1.558 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@H](NC(C)=O)C2)c([N+](=O)[O-])c1 817126441 UYZMHSBKIJFIRW-AGLBCWCQSA-N 333.344 1.496 10 10 EDCE COC[C@@](C)(O)CCNC(=O)N[C@@H](C)c1cc(OC)ccc1O 836535208 ZEPXUDJMBBBXMM-ZBEGNZNMSA-N 326.393 1.549 10 10 EDCE Cc1cc(CC(=O)N[C@@H](CO)CN(C)C)c(C)n1-c1ccccc1 854466955 OLZPOMAKCHDIJJ-QGZVFWFLSA-N 329.444 1.675 10 10 EDCE CO[C@H](CNC(=O)NCc1ccc(N(C)C)cc1C)[C@@H]1CCOC1 852441053 XISOBWMTVPYNME-NVXWUHKLSA-N 335.448 1.912 10 10 EDCE CCN(CC)c1ccc(CNS(=O)(=O)[C@@H]2CCCNC2)cc1 923591436 ANVNFFVZRJJWFI-MRXNPFEDSA-N 325.478 1.704 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](C)c1nnc(O)n1C 926134684 QPJUXDVBNNLHJR-GFCCVEGCSA-N 346.435 1.879 10 10 EDCE Cc1cncn1CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 859734588 VVJHCXBCDJTILZ-UHFFFAOYSA-N 346.406 1.608 10 10 EDCE CO[C@H]1CCn2cc(C(=O)NCc3ccc(N(C)C)cc3)nc2C1 864573881 SZAPLNFJUOAPMT-HNNXBMFYSA-N 328.416 1.840 10 10 EDCE Cn1ccc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)n1 761278411 KTLQRMJAWYYIRB-UHFFFAOYSA-N 334.763 1.744 10 10 EDCE C[C@H]1CN(S(=O)(=O)N[C@H](C)c2ccc(N(C)C)cc2)C[C@@H](C)O1 773086594 DXEGYVLACHPNHO-HZSPNIEDSA-N 341.477 1.757 10 10 EDCE CCNC(=O)[C@@H](C)NCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894381393 JRJXWSIFXXNYRS-SNVBAGLBSA-N 335.379 1.718 10 10 EDCE CCNCc1ccc(N2CCN(C)[C@@H](CO)C2)cc1Br 687618436 KUUOKZPVRMJTGN-CQSZACIVSA-N 342.281 1.671 10 10 EDCE CN[C@@H](C)c1ccc(N2CCOC[C@H](O)C2)c(Br)c1 399840763 BXROAMXUBDXPBY-CMPLNLGQSA-N 329.238 1.927 10 10 EDCE COc1ccc(CNC(=O)NCc2cccnc2N(C)C)c(O)c1 792804180 LUKNUUFWQXGBGI-UHFFFAOYSA-N 330.388 1.861 10 10 EDCE Cc1ccc(C(=O)N[C@H](c2cnn(C)c2)c2ncon2)c(O)c1O 1141498344 SADLFDJEMGZWBH-LLVKDONJSA-N 329.316 1.042 10 10 EDCE Cc1cc(C(=O)NCCN=S(C)(C)=O)c(C)n1-c1ccccn1 1156229816 VBJALUGFERTWHI-UHFFFAOYSA-N 334.445 1.947 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H](C(N)=O)c2ccc(F)cc2)cc1 1153778405 ZNVNPSJYTUQQRI-ZDUSSCGKSA-N 343.318 1.945 10 10 EDCE CCCN1C[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1=O 1162249199 OWYFEAMFKUVMPN-NSHDSACASA-N 331.376 1.837 10 10 EDCE CON(C)C(=O)[C@@H](C)NC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1313099018 PKFUHAQHYMDVHK-CQSZACIVSA-N 348.447 1.837 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[C@@H]1CC1(F)F 1328535594 FHUXRHSXFKCOEB-CYBMUJFWSA-N 339.386 1.873 10 10 EDCE COC(=O)[C@@]1(OC)CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 1334929892 GNDDGEDCGHBISC-OAHLLOKOSA-N 340.332 1.380 10 10 EDCE CC[C@H](CNC(=O)c1cn(C)c(O)n1)NCc1ccc(OC)c(C)c1 1267818955 QRVMNMZZSVMFGH-CQSZACIVSA-N 346.431 1.741 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCc3nccn3C)C2)cc1 1263861157 RQCOCTAVHWUNAT-CQSZACIVSA-N 328.416 1.756 10 10 EDCE CO[C@H](C)CN[C@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1507159808 UQOQSAVQXBZECK-VXGBXAGGSA-N 335.408 1.934 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Br)n[nH]1 1447560031 DTNOJTWCBUXJFH-SSDOTTSWSA-N 340.177 1.944 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)cc1 1296520757 OXGNDEANDNXDBJ-WCFLWFBJSA-N 329.360 1.575 10 10 EDCE O=S1(=O)N[C@@H]2CN(Cc3ccccc3O)C[C@H]2Oc2ccccc21 1615259761 KLOADSRRJZYTRJ-CZUORRHYSA-N 346.408 1.316 10 10 EDCE CCOC[C@@](O)(CNC(=O)OC(C)(C)C)[C@@H](N)c1ccccc1O 1921854523 IREOEKMNOAGPDS-YOEHRIQHSA-N 340.420 1.684 10 10 EDCE OC[C@@H]1[C@H](O)[C@H](c2ccc(F)cc2)CN1Cc1cccc(F)c1O 1615116404 DWAGXWJYMAWLHU-YXJHDRRASA-N 335.350 1.992 10 10 EDCE COC(=O)[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)c2ccccc2O1 1540608600 GCHRYMFGGXUAEN-MRXNPFEDSA-N 343.335 1.608 10 10 EDCE O=C(N[C@H](CO)Cc1cnc[nH]1)c1cc2cc(O)c(O)cc2s1 1558027362 OWJFQLORBMEPSK-JTQLQIEISA-N 333.369 1.369 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccns2)cc1C 1715587587 LSGOSDJXRXEEAX-ZDUSSCGKSA-N 335.429 1.341 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)C1CN(C(C)=O)C1 1482921548 PONDFKQEMKZMBO-UHFFFAOYSA-N 347.459 1.420 10 10 EDCE CN(C)c1ccc(NC(=O)Cc2ccc(O)c(O)c2)c(C(N)=O)c1 1632034361 BIAWPPRPQFRNAK-UHFFFAOYSA-N 329.356 1.444 10 10 EDCE Cc1c(C(=O)NCc2c(O)cccc2O)cnn1-c1ccc(O)nn1 1639289407 PTRHMSURDTUGAC-UHFFFAOYSA-N 341.327 1.018 10 10 EDCE c1cc(N2CCOCC2)ccc1CNC[C@@H]1COC2(CCOCC2)O1 1650844279 LNKWQEYGJNRXAR-GOSISDBHSA-N 348.443 1.535 10 10 EDCE CC(C)(C)NCc1ccc(N2C[C@@H](O)[C@H](O)C2)c(Br)c1 232494353 SCPPRYCKRPFXOO-ZIAGYGMSSA-N 343.265 1.879 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2CCC(=O)N2C)cc1C 1670208419 IJMZRRCHMJWMBB-INIZCTEOSA-N 347.459 1.563 10 10 EDCE CCn1nc2c(c1C(=O)Nc1nnc(C3=S=CC=C3)o1)CCC2 1850189405 SJEXYFWIWBNONB-UHFFFAOYSA-N 329.385 1.653 10 10 EDCE O=C(CCN1Cc2ccccc2C1=O)NCCc1ccc(O)c(O)c1 1860214723 AFIDRMDYWYMJLB-UHFFFAOYSA-N 340.379 1.803 10 10 EDCE Oc1c(Br)cccc1CN[C@H]1COC2(CCC2)[C@H]1O 2141560261 YCRZPKHPNFNXGA-AAEUAGOBSA-N 328.206 1.927 10 10 EDCE Cc1cc(CN2C[C@H](C(N)=O)[C@@H](C(N)=O)C2)ccc1N1CCCCC1 878972134 GTEYTZSXRVOGJV-HOTGVXAUSA-N 344.459 1.004 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)[C@H](O)c2ccccn2)N(C)C)cc1 891246749 CUUUWVRBBDGGNK-QZTJIDSGSA-N 342.443 1.600 10 10 EDCE CCn1ncc(Br)c1Cn1ccc2c(c1=O)CNCC2 2150794682 AYZJJJQLWFVOAU-UHFFFAOYSA-N 337.221 1.521 10 10 EDCE CC1([C@@H]2CCCN(S(=O)(=O)Cc3ccc(N)cc3)C2)OCCO1 2145834434 GWIDXZAIOYJNSI-CQSZACIVSA-N 340.445 1.574 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2COC[C@@]2(C(=O)NCCCN=[N+]=[N-])C1 2010403245 BIALTXYSMQKIJU-ABAIWWIYSA-N 339.396 1.687 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCN1c1cc2c(cc1N)OCC(=O)N2 2044765593 AUKGHIHCXKAINB-JTQLQIEISA-N 348.403 1.703 10 10 EDCE NCc1ccc(N2CC(=O)N[C@@H]3CC[C@@H]32)c(F)c1Br 2112067707 WFWYMDGTVYIYJV-BDAKNGLRSA-N 328.185 1.514 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213592368 SKEPTMALXFFJTF-WOPDTQHZSA-N 339.396 1.970 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2236633508 AOQWGOAINJUKTC-UTUOFQBUSA-N 344.249 1.930 10 10 EDCE Cn1nc(Br)c(C(=O)N2CCC[C@H](CN=[N+]=[N-])C2)n1 2226977397 DVTVIMRJQHVCJB-SSDOTTSWSA-N 328.174 1.740 10 10 EDCE COc1ccc(Br)c(CN2CCC3(CNC3)C2)c1O 2227742367 DGMMITJNALOXFG-UHFFFAOYSA-N 327.222 1.959 10 10 EDCE CN[C@@H](c1ccccc1O)[C@](O)(CF)CNC(=O)OC(C)(C)C 2242773597 WAJWZEAKTYPQIW-BBRMVZONSA-N 328.384 1.878 10 10 EDCE CO[C@@H]1CCN(CCNCc2ccc(Br)cc2O)C1 2267900728 QOVIUYWKOVRGBC-CYBMUJFWSA-N 329.238 1.965 10 10 EDCE CN1C(=O)C(=CN[C@@H](c2ccccc2)c2ccco2)C(=O)N(C)C1=O 52528985 DHSJDRVYVYYQQI-HNNXBMFYSA-N 339.351 1.893 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1CCNC(=O)C1)NCc1ccc(OC)c(C)c1 1269390322 LHGAULDKLPELLQ-CVEARBPZSA-N 347.459 1.514 10 10 EDCE C[C@H](NC(=O)NCC1(C)COC1)c1ccc(N2CCOCC2)cc1 112718232 UCPKUMJCAMQEAV-AWEZNQCLSA-N 333.432 1.920 10 10 EDCE c1cnn(C[C@H]2CN(Cc3ccc(N4CCOCC4)cc3)CCO2)c1 122219015 AXMYNWGRJFAWDB-LJQANCHMSA-N 342.443 1.621 10 10 EDCE COc1ccc(/C=C2/SC(N3CCN(C)CC3)=NC2=O)cc1O 33323038 YIHPBSRHIFWERS-GXDHUFHOSA-N 333.413 1.619 10 10 EDCE O=S1(=O)CCC(NCc2cc(Br)ccc2O)CC1 236615210 VVAJCAAZTNVHRU-UHFFFAOYSA-N 334.235 1.822 10 10 EDCE CN1CCC[C@H](CNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255204071 XFKJYHPRGXZIRW-OTIVFRFGSA-N 343.471 1.994 10 10 EDCE Cc1ccc(CN2C[C@@H](N)CC[C@@H]2C(=O)O)c(O)c1Br 2380800792 LNBJZMMENKSXDE-WDEREUQCSA-N 343.221 1.839 10 10 EDCE COc1cccc(CNC(=O)C(=O)Nc2cccc(C3CC3)n2)c1O 293353432 JOHUZIVBWSSSLE-UHFFFAOYSA-N 341.367 1.928 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CS(=O)(=O)C(C)(C)C 808094767 DJOWZVMLCAVMRH-UHFFFAOYSA-N 334.434 1.707 10 10 EDCE CN1C[C@H](NC(=O)c2csc(Cc3ccc(N)cc3)n2)CCC1=O 817939060 YIZVDZLWBIYLOF-CYBMUJFWSA-N 344.440 1.667 10 10 EDCE CCOC(=O)C(F)(F)[C@H](N)c1c(Br)ccc(N)c1O 725274813 IKYITFAFMYBZRR-SECBINFHSA-N 339.136 1.935 10 10 EDCE COc1cc(O)c(CN2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)cc1OC 824654374 NPCJFGAWTIIPLM-YUELXQCFSA-N 337.416 1.771 10 10 EDCE C[C@@H]1OCC[C@@H]1N(CCO)Cc1cc(Cl)cc([N+](=O)[O-])c1O 825130035 KUBRIXLDDRLKPB-CABZTGNLSA-N 330.768 1.926 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\c1ccc(C(N)=O)cc1 588432682 WVLQZUQXBBTDHW-LRAPTIAOSA-N 340.379 1.957 10 10 EDCE COc1ccc(O)c(CN2CCN(C(=O)c3cc(C)[nH]n3)C[C@H]2C)c1 835074806 WMOKNPCGHCUNSO-CYBMUJFWSA-N 344.415 1.779 10 10 EDCE COc1cc(Br)cc(CNC[C@](C)(CO)OC)c1O 848560357 LURLRVUDKQNFKA-CYBMUJFWSA-N 334.210 1.650 10 10 EDCE COc1ccc(N2CCCN(C(=O)NCC[C@@H]3CCNC3)CC2)cc1 841938040 FXVDIGHXEUGDTE-INIZCTEOSA-N 346.475 1.917 10 10 EDCE CCN(CC)CCOCCNC(=O)NCc1c(O)cccc1F 921937813 PERGBCVBIMEWSS-UHFFFAOYSA-N 327.400 1.689 10 10 EDCE Nc1ccc(CCNC(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1 851663084 SNCKNBSHCXKQEP-HIFRSBDPSA-N 325.359 1.925 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@H](O)CC3)C2)cc1 854298287 ZPVLBUIPDHJLTK-GOEBONIOSA-N 333.432 1.830 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnc4[nH]nnc4c3)C2)cc1 855228164 WUDKCJXQWHDAOL-LBPRGKRZSA-N 338.371 1.370 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1(N2CCOCC2)CC1 868889007 GFSSEUTVHJVZHS-INIZCTEOSA-N 345.487 1.973 10 10 EDCE O=C(CCC(=O)N1CCOCC1)NCc1ccc2cccnc2c1O 862028748 JMHWKXYOQQMJKA-UHFFFAOYSA-N 343.383 1.196 10 10 EDCE COC(=O)c1c(CN(C)CCNC(C)=O)c2cc(F)ccc2n1C 895079257 QCKJUQSNGUHDIQ-UHFFFAOYSA-N 335.379 1.672 10 10 EDCE CCNC(=O)N1CC[C@@H](NC(=O)NCc2ccc(OC)cc2O)C1 792998693 BKGKSQUAPUMREH-GFCCVEGCSA-N 336.392 1.004 10 10 EDCE O=C(O)[C@H]1OCC[C@@H]1CNCc1cc(Br)cc(F)c1O 715786494 GBOAMRTVJLRRMT-KRTXAFLBSA-N 348.168 1.873 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCc2ccc3cccnc3c2O)o1 1162607709 WCAPQULSUDHTEY-UHFFFAOYSA-N 346.364 1.867 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@H]2CCCNC2=O)cc1C 1319201997 LXNKFTNWHJXTRD-CZUORRHYSA-N 347.459 1.372 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@H]2CCNC2=O)cc1C 1317594615 RZOANTLRWKGPHQ-OAHLLOKOSA-N 333.432 1.078 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)Nc1ncn(Cc2cccnc2)n1 1320180631 SRFXKQIJFWIDBX-XQRVVYSFSA-N 337.339 1.785 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)COC(C)(C)C)cc1C 1320217808 RLNJXHSQHFARPD-OAHLLOKOSA-N 338.448 1.385 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1CN(C)CCO1)NCc1ccc(OC)c(C)c1 1269384810 WXUPWCPXYNFBQZ-FUHWJXTLSA-N 349.475 1.319 10 10 EDCE CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)NCc1cccc(O)c1O 1347542062 IFAIDFJZXDUNES-LLVKDONJSA-N 338.429 1.662 10 10 EDCE [N-]=[N+]=N[C@@H]1CCCN(C[C@H](O)CN2C(=O)c3ccccc3C2=O)C1 1912190520 FFWBMHGZYZFAQK-NEPJUHHUSA-N 329.360 1.418 10 10 EDCE Cc1cocc1C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1283077364 BTCIMBONADHVEL-UHFFFAOYSA-N 343.343 1.910 10 10 EDCE CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(O)c1)C1CCOCC1 1295809522 WDRONULDAXKHEX-MRXNPFEDSA-N 337.372 1.115 10 10 EDCE CC(C)(C)OC(=O)NCCOC[C@@](C)(O)[C@@H](N)c1ccccc1O 1920089029 KNLDZQHRQSFONX-WMLDXEAASA-N 340.420 1.684 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CC[C@H](CNCCO)C2)cc1 1700914057 VGYQJKCBJPIBJJ-FZMZJTMJSA-N 333.392 1.329 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)CCn2cncn2)cc1C 1714548550 HAIKDXJWOOAHSW-OAHLLOKOSA-N 345.447 1.622 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@]2(C)CCC(=O)N2)cc1C 1483490102 BGPGOXDTOGJEDH-IBGZPJMESA-N 347.459 1.610 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1C(=O)NCc1cccc(O)c1O 1651176007 WMEXWJRZSUJGCF-RYUDHWBXSA-N 336.388 1.875 10 10 EDCE CC[C@@H](CNC(=O)CN1CCCC1=O)NCc1ccc(OC)c(C)c1 1665755151 WJSHTTRKCWIQCR-INIZCTEOSA-N 347.459 1.610 10 10 EDCE CC(C)[C@H](N)C(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 1865916665 NMKUBTAKZPOBIE-JKSUJKDBSA-N 329.448 1.675 10 10 EDCE COCC(COC)NCc1c(Br)ccc(OC)c1O 1964052511 ROFCNFBGFIGWDT-UHFFFAOYSA-N 334.210 1.914 10 10 EDCE O=S(=O)(NCCNCc1cc(Cl)cc(Cl)c1O)C(F)F 1964071021 OLGBXQZNLLIQGM-UHFFFAOYSA-N 349.186 1.931 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H]2[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003170304 POOZYEDNFSQPEK-XOBFJNJYSA-N 336.432 1.898 10 10 EDCE CNCc1ccc(N2CCCCC2(CO)CO)cc1Br 2146079769 SKLQQWODYAROKB-UHFFFAOYSA-N 343.265 1.882 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@](C)(C(=O)N2CC(N=[N+]=[N-])C2)C1 1985094193 LDYHTLVXJRVJMU-CQSZACIVSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](Nc2c(N)cccc2C(N)=O)CCO1 2000859773 AKXMQBXYVHPFPX-SNVBAGLBSA-N 336.392 1.721 10 10 EDCE CC(C)(C)OC(=O)NCc1nc(=NCc2cc(F)ccc2O)[nH][nH]1 2011842631 PXBZAPXKTFKNII-UHFFFAOYSA-N 337.355 1.708 10 10 EDCE CO[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 2012170477 IHAZZCISVZJEGD-NWDGAFQWSA-N 339.396 1.780 10 10 EDCE CNCc1ccc(N2CCN3C[C@@H](O)C[C@@H]3C2)cc1Br 405201073 CRVYXVMAMSVZFO-KGLIPLIRSA-N 340.265 1.424 10 10 EDCE C[C@H]1CNC(=O)CN1c1ccc(C=CC(=O)O)c(Br)c1 2181178414 TWEMBVYDYGNKGA-VIFPVBQESA-N 339.189 1.872 10 10 EDCE NCc1cc(F)c(N2CC(n3cncn3)C2)cc1Br 707644092 MEDAQAUQBKCIMC-UHFFFAOYSA-N 326.173 1.700 10 10 EDCE CNC(=O)[C@@H]1CCN(c2cc(Br)c(CN)cc2F)C1 398526190 VSHLYYJMKKVJFZ-MRVPVSSYSA-N 330.201 1.619 10 10 EDCE O=C(NCc1c(O)cc(O)cc1O)[C@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F 2062056693 PYNYXHXAXWPFGD-NDBYEHHHSA-N 347.289 1.776 10 10 EDCE CN1C[C@H](c2ccccc2)[C@@H](C(=O)NCc2c(O)cc(O)cc2O)C1 2063063996 SALPVRXSDBBDIL-CVEARBPZSA-N 342.395 1.765 10 10 EDCE O=C(O)CN1CCC[C@@H](NCc2ccc(Br)cc2O)C1 2169328184 VYNJWEQHYNSERZ-GFCCVEGCSA-N 343.221 1.793 10 10 EDCE O=C1C[C@H]2CCN(c3ccc(CO)cc3Br)C[C@@H]2N1 2088803224 GCFWYDYLJRJAQV-PWSUYJOCSA-N 325.206 1.656 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(S(C)(=O)=O)C2)c(Br)c1 2095963930 ADMIQOXIXZPRKR-VIFPVBQESA-N 347.278 1.963 10 10 EDCE CC1(C)CN(c2ccc(CO)c(Br)c2)CCS1(=O)=O 2113954076 DEANEJXMBHWXKW-UHFFFAOYSA-N 348.262 1.955 10 10 EDCE NCC1(CO)CCN(Cc2cc(Br)cc(F)c2O)CC1 2202912933 LAYMKKCCYSBTQL-UHFFFAOYSA-N 347.228 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](COc2nnc(=N)[nH]n2)C12CCC2 2213782177 BEDLKROBDUONBO-JTQLQIEISA-N 336.396 1.238 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@H]2C(N)=O)c(O)c1Br 2352646703 XFNAUVJFVUASMH-RKDXNWHRSA-N 327.178 1.201 10 10 EDCE CCNC(=O)NCCNCc1ccc(C)c(Br)c1O 2352684836 BLULQLHULRIIBL-UHFFFAOYSA-N 330.226 1.872 10 10 EDCE Cc1ccc(CNCC[C@H]2CNCCO2)c(O)c1Br 2352944498 ISRYNIVANFSHPY-LBPRGKRZSA-N 329.238 1.931 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2354485957 SPKAAABURTUJKT-PDRAWDMGSA-N 341.249 1.660 10 10 EDCE CCN(CC)c1ccc([C@H]2NC(=O)Nc3c2c(=O)[nH]c(=O)n3C)cc1 103450996 NLTCVVKLJZYIKT-CYBMUJFWSA-N 343.387 1.144 10 10 EDCE CNC(=O)c1ccc(S(=O)(=O)NCCc2ccc(N)cc2)cc1 171531607 GBGGFYRNVNDBIV-UHFFFAOYSA-N 333.413 1.149 10 10 EDCE CCn1cc([C@H]2CN(C(=O)/C=C/c3ccc(O)c(O)c3)CCO2)cn1 191766580 REOZCRBTPNEIKW-UKINESCASA-N 343.383 1.928 10 10 EDCE COC(=O)NC(C)(C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 264128759 HKSLCDVEFOGKEX-UHFFFAOYSA-N 335.404 1.478 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CC[C@H](CC(N)=O)C3)ccc21 367882449 COPBZZDPYJSBEI-CQSZACIVSA-N 330.432 1.476 10 10 EDCE Cc1ccc(CNC(=O)N2CCN(C)CC2)c(O)c1Br 2380817337 SKFOUAZOIIIQNT-UHFFFAOYSA-N 342.237 1.920 10 10 EDCE CCOC(=O)[C@@H]1C[C@H](O)[C@H](N=[N+]=[N-])C[C@H]1NC(=O)OC(C)(C)C 381071195 PETGZSIPWBXEIZ-DBIOUOCHSA-N 328.369 1.893 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC3(CCOCC3)C2)c1 816299389 GKJPEYMPOXCYGL-UHFFFAOYSA-N 340.401 1.016 10 10 EDCE COc1ccc(O)c(CNC(=O)C(=O)Nc2cccc(C3CC3)n2)c1 815496976 YGXQLJWUCFABCS-UHFFFAOYSA-N 341.367 1.928 10 10 EDCE Cc1cc(C(=O)CN2C[C@@H](O)C[C@@H](O)C2)c(C)n1-c1ccc(F)cn1 827958315 RRGBNXVGHKPNQG-GASCZTMLSA-N 347.390 1.238 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](CF)C(=O)O)C2)cc1 909133341 DSFJKFSVUWPNNV-FZMZJTMJSA-N 339.367 1.243 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CC1COC1 901325972 BNFVOFXZLFHKKL-UHFFFAOYSA-N 327.764 1.584 10 10 EDCE Cc1cc(C(=O)N[C@H](CO)c2ccnn2C)c(C)n1-c1ccccn1 838059664 KLFZAWJIVJTSMH-OAHLLOKOSA-N 339.399 1.686 10 10 EDCE C[C@H]1c2nncn2CCN1c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 844214035 NPWMPBZIHDVTMA-GFAPAMAISA-N 329.316 1.865 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@@]2(CCNC2)C1 844224893 KKTFDZVSLQYUNF-FQEVSTJZSA-N 344.503 1.787 10 10 EDCE C[C@H]1CN(CCO)[C@H](C)CN1Cc1ccc(N2CCN(C)CC2)cc1 841891111 IUQBHYGECJJWPK-MSOLQXFVSA-N 346.519 1.325 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@@H]3CCNC[C@H]3C)CC2)cc1 841779191 NBFSPGRVMFNPOU-RDTXWAMCSA-N 346.475 1.961 10 10 EDCE Cc1nn(C)c(S(=O)(=O)NCc2c(O)cccc2F)c1C(F)F 921451629 SXQFVWCBRADLKQ-UHFFFAOYSA-N 349.334 1.989 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C3(OC)CCNCC3)C2)cc1 851639762 LGROVHQHZMCFAV-CQSZACIVSA-N 333.432 1.159 10 10 EDCE O=C(NCc1ccccc1O)C(=O)Nc1cnn(-c2ccncc2)c1 768722797 UNNQRLDESYIXOA-UHFFFAOYSA-N 337.339 1.228 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CC3CSC3)cc2)C1 864954200 MNCYIUMZXUNHBR-HNNXBMFYSA-N 347.484 1.758 10 10 EDCE C[C@H]1CN(Cc2cc(F)c(N(C)C)cc2F)[C@@H](C)CN1CCO 862396744 YAHKAECMMXCRLR-STQMWFEESA-N 327.419 1.918 10 10 EDCE Cn1cc(C[C@@H](O)C(=O)NCc2c(O)ccc3c2CCCC3)cn1 787134407 XNOFOUODCXVDDX-QGZVFWFLSA-N 329.400 1.224 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc2c1NC(=O)CO2 1138152566 KMGFTHVXHCLOGW-JTQLQIEISA-N 342.351 1.790 10 10 EDCE C[C@@H](OCc1ccccc1)[C@@H](NC(=O)Cc1ccc(N)cc1)C(=O)O 706132603 UQQHCUKFEBIMAK-FZKQIMNGSA-N 342.395 1.986 10 10 EDCE Nc1ccc(CS(=O)(=O)NC[C@@H]2CCN2Cc2ccccc2)cc1 716262978 RGJCAGDOVHBJHV-SFHVURJKSA-N 345.468 1.963 10 10 EDCE O=C(Nc1ncc(Br)cn1)c1cc(O)c(O)c(O)c1 170190542 KMRGJDMGIHUIPP-UHFFFAOYSA-N 326.106 1.608 10 10 EDCE CCC[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CCN1CCOC 1151376521 WBKQLEYQOZLHAU-HNNXBMFYSA-N 336.432 1.600 10 10 EDCE CCN[C@@H](C)c1ccc(N2CC(O)(CO)C2)c(Br)c1 2115313935 MFWHEHUZYNZBFG-JTQLQIEISA-N 329.238 1.663 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccsc2)cc1C 1268301995 UGVQFLUBTHYIFY-OAHLLOKOSA-N 334.441 1.946 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H](C)[C@H](F)C1 1346555588 STAKUJKIFFWPAP-BLLLJJGKSA-N 335.423 1.884 10 10 EDCE COc1ccc(CNC[C@@H]2CCC[C@H]2NC(=O)CC(N)=O)cc1C 1272253450 PFGIECYPLYNMRE-LSDHHAIUSA-N 333.432 1.254 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3C[C@H]3C(N)=O)CCC2)cc1C 1501999941 NLAKKWSWEKCEMV-CABCVRRESA-N 345.443 1.254 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C1(CO)CCC1 1914973521 KKTWKBWMDPYDMW-GFCCVEGCSA-N 341.205 1.786 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)CCc2nc[nH]n2)cc1C 1282112701 MVQBPTFFGACIDM-ZIAGYGMSSA-N 345.447 1.737 10 10 EDCE CON1CCN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)CC1 1915553948 IZYWYYIXGKJTIJ-GFCCVEGCSA-N 342.193 1.118 10 10 EDCE C[C@@H](NCC1(O)CN(C(=O)OC(C)(C)C)C1)c1c(O)cccc1O 1918696835 LAAMMNLGFFXZEQ-LLVKDONJSA-N 338.404 1.730 10 10 EDCE CC(=O)N1CCC(CNCc2ccc(N3CCN(C)CC3)cc2)CC1 1461159421 GSHZGPTYEJNVAF-UHFFFAOYSA-N 344.503 1.787 10 10 EDCE Cc1cccc(-n2c(C)cc(CNC(=O)NC(C)(CO)CO)c2C)c1 1471033766 GZTDGHLHHYKSJV-UHFFFAOYSA-N 345.443 1.945 10 10 EDCE CC[C@@H](C)C(=O)NCC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1704125404 RVIYKCNOLYXZPC-VXGBXAGGSA-N 337.420 1.770 10 10 EDCE CN(C)[C@@H]1COC[C@@H]1NCc1cc(Br)cc(F)c1O 1921989615 CROTXZFRQMUVID-NWDGAFQWSA-N 333.201 1.712 10 10 EDCE C[C@H]1CN(C(C)(C)CNC(=O)Cc2ccc(O)c(O)c2)C[C@H](C)O1 1629103198 MBAUSGSODRZDOM-STQMWFEESA-N 336.432 1.644 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H](O)CNC/C=C/Cl)cc1 1715610387 DYGDRTDBSZVLMR-AUMQLWHNSA-N 339.783 1.282 10 10 EDCE C[C@@H](NC(=O)[C@@H]1COCCN1CC(F)F)c1ccc(N(C)C)cc1 1567777030 HDCPOEIPGROOJN-DOMZBBRYSA-N 341.402 1.896 10 10 EDCE CCNC(=O)CC(=O)N1CC[C@@H](CNCc2ccc(OC)c(C)c2)C1 1567119973 VYGKYIZUEPPCGD-INIZCTEOSA-N 347.459 1.468 10 10 EDCE CC[C@H](NCC(=O)NCc1ccc(N(C)C)cc1)c1noc(C)n1 1653240553 PKCHHSPHIXGNCI-HNNXBMFYSA-N 331.420 1.801 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)CC(F)(F)F)cc1C 1677060855 KXSWYMRRXTWGKF-CYBMUJFWSA-N 348.365 1.865 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2n[nH]c(C)c2O)cc1C 1774112230 JTGUQTGZTZMXLU-GFCCVEGCSA-N 346.431 1.991 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1C(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 1699646894 GMHMMVHJANERMA-LSDHHAIUSA-N 346.427 1.551 10 10 EDCE O=C(c1cc(O)c(O)c(O)c1)N1CCC[C@@H](C(=O)N2CCCC2)C1 1866303400 UNVMRONAXOSWPR-LLVKDONJSA-N 334.372 1.278 10 10 EDCE Nc1ccc(CCN=c2cc(I)nc[nH]2)cc1 2005206203 UEHKFXZEMLHRIL-UHFFFAOYSA-N 340.168 1.740 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@H]2[C@H](O)CO)c(Br)c1 2146333615 HLXQZBBCVVQLHF-BIGNPOOSSA-N 345.237 1.027 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]1(NC(=O)OC(C)(C)C)CCCOC1 1985094598 RBXYOUFVXVBDBB-AWEZNQCLSA-N 327.385 1.829 10 10 EDCE CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)c1ccc(O)c(O)c1 2006291959 SSIRTIRIBYRHCL-UHFFFAOYSA-N 346.330 1.988 10 10 EDCE CN(C(=O)COc1ccc(N)cc1)C1CN(C(=O)OC(C)(C)C)C1 1999494659 PHJUJCAQUMPNRU-UHFFFAOYSA-N 335.404 1.725 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC[C@H]1NC(=O)COc1ccc(N)cc1 2012864997 FFMCWODMYWZNSQ-ZIAGYGMSSA-N 335.404 1.820 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](CO)(NCc2cccc(F)c2O)C1 2016030023 QMPUZBZGYFESAB-QGZVFWFLSA-N 340.395 1.993 10 10 EDCE CNCc1ccc(N2CCO[C@H](CN(C)C)C2)c(Br)c1 2170358186 DUBSSXSJFULYJB-CYBMUJFWSA-N 342.281 1.935 10 10 EDCE CCOC(=O)c1c(C2CCCC2)nn2c(O)cc(CC(=O)O)nc12 2080933845 WGBWAUAJSXQVRG-UHFFFAOYSA-N 333.344 1.896 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(C(=O)COc3ccc(N)cc3)C[C@@H]21 2045671520 REDPZAXDVCGDSK-FOLVSLTJSA-N 347.415 1.629 10 10 EDCE Cc1nn(C)c(Br)c1CNC(=O)Cc1ccc(N)cc1 2185786177 IXDFAEMJBZSNFN-UHFFFAOYSA-N 337.221 1.932 10 10 EDCE CNC(=O)[C@@H]1[C@@H](C)CCN1c1ccc(CN)c(Br)c1 2090258872 LVUMLAOHOPDOBI-ZANVPECISA-N 326.238 1.869 10 10 EDCE O=C(O)CO[C@@H]1CCN(Cc2c(O)cccc2Br)C1 2096820140 JIYGYZHKCYHMMI-SECBINFHSA-N 330.178 1.830 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCc2cc(O)c(O)cc2C1 2302399375 LGEKFKJCQMTHSG-JTQLQIEISA-N 336.388 1.896 10 10 EDCE C[C@H]1CCNC[C@@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2310309937 ZBAINZNGSGOFLY-YJBOKZPZSA-N 329.444 1.651 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C=CCCN2)c(O)c1Br 2352941097 MGWWDCGZPUCUHE-LLVKDONJSA-N 325.206 1.997 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2[C@H]3CN[C@H]2C3)c(O)c1Br 2352947157 GLEPIYWYEKPXCL-VWYCJHECSA-N 325.206 1.687 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N[C@H]1CCc2ncnn2C1 171868148 RITPKQXMEZQYNO-HNNXBMFYSA-N 340.431 1.693 10 10 EDCE O=C(NCCc1ccc2c(c1)OCCO2)c1cc(O)c(O)c(O)c1 170190455 GXSDNZCSRYPOBX-UHFFFAOYSA-N 331.324 1.547 10 10 EDCE CCN[C@@H](C)c1ccc(N2CC([C@@H](O)CO)C2)c(Br)c1 2361914050 QREWNLDQFISJGC-BONVTDFDSA-N 343.265 1.909 10 10 EDCE CCOc1ccc(O)c(CN2CCN(S(C)(=O)=O)[C@@H](C)C2)c1 181929673 BHBKLGLYGOQVMH-LBPRGKRZSA-N 328.434 1.257 10 10 EDCE CN1CCC(CNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1 254925489 VMNZUWASSXMXJI-DAXSKMNVSA-N 343.471 1.994 10 10 EDCE Nc1nccc([C@@H]2CCCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)n1 376143457 UFSHZBOWDZYINJ-DIECRNLCSA-N 340.383 1.889 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2C[C@H]2C(N)=O)c(O)c1Br 2380766516 RXIQJEDDXCUCSL-NXEZZACHSA-N 341.205 1.543 10 10 EDCE 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EDCE Cn1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)nc1O 856215328 KAQWZJYJWFSABN-UHFFFAOYSA-N 330.388 1.017 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3cc(C)[nH]n3)C2)cc1 852129760 BOZYAVGXZBVADO-ZDUSSCGKSA-N 329.404 1.805 10 10 EDCE CCc1noc(C)c1NC(=O)C(=O)NCc1cc(OC)ccc1O 755063694 JOZBDVZVPCCFMD-UHFFFAOYSA-N 333.344 1.515 10 10 EDCE COC1CC(CO)(NCc2cc(Br)cc(F)c2O)C1 1899854785 MLKWOUBQZNFWGD-UHFFFAOYSA-N 334.185 1.923 10 10 EDCE C/C=C/C[C@H](CO)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852451348 INROCJAEUSHACT-NMONBKHDSA-N 333.432 1.900 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1 860230478 MDPDKJJBXBLGRZ-CMPLNLGQSA-N 331.340 1.283 10 10 EDCE O=C1COc2cc(NC(=O)NCCc3ccc(O)c(O)c3)ccc2N1 761629539 PFSIVOYEBNLXPI-UHFFFAOYSA-N 343.339 1.793 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC[C@@H]3OCCNC(=O)[C@H]32)c1O 879720748 VBNKAVFINABPOG-GJZGRUSLSA-N 336.363 1.213 10 10 EDCE CN1CCN(c2ccc(CN3CCO[C@@]4(CCOC4)C3)cc2F)CC1 1116648922 PPJRCYQEVCQYOT-IBGZPJMESA-N 349.450 1.569 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCC[C@@H]4COCC[C@H]43)nc12 1118319533 OJLNWPLRIDBRMK-ZWNOBZJWSA-N 332.360 1.134 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc3nccn3c2)cc1 774075324 AGBYUOIICDWUFQ-UHFFFAOYSA-N 337.383 1.655 10 10 EDCE C[C@@H]1C[C@]2(CC[C@@H](CNC(=O)c3c(F)ccc(O)c3O)O2)CO1 899476896 AOHZYRMKCSLMFE-KCWFYHRYSA-N 325.336 1.693 10 10 EDCE O=S(=O)(CCCF)NCc1cc(Br)ccc1O 796190702 KGLYNTRIBCPEQN-UHFFFAOYSA-N 326.187 1.934 10 10 EDCE CCc1cccc(CNC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c1O 715684939 RTZPUQIQDBODRV-UHFFFAOYSA-N 349.431 1.519 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2ccnc3c2CC(=O)N3)c1 1150542513 BAFZTOCHICAQBD-SECBINFHSA-N 327.340 1.781 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CSC2(C)C)cc1F 1325970737 DOGSGJDOONDQFM-ZDUSSCGKSA-N 339.436 1.518 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H](C)C(F)(F)F)cc1C 1320256395 HIFLHIWMVSWAFC-AAEUAGOBSA-N 348.365 1.769 10 10 EDCE CCOC(=O)c1nnc(NC(=O)c2c(F)ccc(O)c2O)s1 1183144145 XDEMLIHFWVGRAI-UHFFFAOYSA-N 327.293 1.517 10 10 EDCE 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1.982 10 10 EDCE COc1cc(NC(=O)Cc2ccc(O)c(O)c2)c(C(N)=O)cc1OC 1631311027 LTKSGBDEGIYJHP-UHFFFAOYSA-N 346.339 1.395 10 10 EDCE CC(C)CC(=O)N1CCCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1643098358 MWQUAORVAKCYPH-UHFFFAOYSA-N 334.416 1.747 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccn(CCn2cccn2)n1 1643104211 QJLDJGLPMNJCLD-UHFFFAOYSA-N 327.344 1.121 10 10 EDCE O=C(CCn1cc(Br)cn1)NCc1ccc(O)cc1O 1570462054 BOTKABVDIXOKBW-UHFFFAOYSA-N 340.177 1.763 10 10 EDCE CNC(=O)N[C@H]1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 1642550862 FXMWTENRAFWLMA-RNZFLTOJSA-N 348.359 1.289 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H](CO)Cc1ccc(O)cc1 1597340037 CHNGPZBMDDYYHY-SMGNDMQFSA-N 329.352 1.536 10 10 EDCE CC1CC(CN[C@@H](CO)CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1676614379 CVFFJNMOLARXSJ-KOHJWAIASA-N 347.419 1.575 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)Cc1cncc(Br)c1 167084586 WERACTLXGNNQNQ-UHFFFAOYSA-N 349.232 1.914 10 10 EDCE CC(=O)O[C@H]1[C@H](N=[N+]=[N-])CO[C@]2(COC(C)(C)O2)[C@@H]1OC(C)=O 6363548 YWEMWEKIXSKBDT-XZUYRWCXSA-N 329.309 1.038 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)C[C@@H]2CN(C)C)cc1Br 235515099 ZBJYAEICRWWEQE-CYZMBNFOSA-N 342.281 1.970 10 10 EDCE Oc1ccc(Br)cc1CN[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@@H]2O 1974124010 VEOBYEOMQDAOSS-NHAJQZOWSA-N 328.206 1.375 10 10 EDCE CN(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003166512 HJKZJFQWKITTKM-JHJVBQTASA-N 341.452 1.097 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCN=[N+]=[N-])COCC1(C)C 1985094001 IMPVSKBUGFXDGM-JTQLQIEISA-N 327.385 1.827 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985104398 IEHNHYAWPMRTHO-AXFHLTTASA-N 327.385 1.562 10 10 EDCE CC1(C)CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)[C@@H]1CO 2148967135 ZVHPLRMTADTQHK-NEPJUHHUSA-N 340.221 1.608 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CC(=O)N2CC[C@H](N=[N+]=[N-])C2)[C@@H](O)C1 2010402241 OBVMQKXZWXCVEA-SRVKXCTJSA-N 339.396 1.516 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)[C@@H]1CCCO1 2010406244 RNRLHMPXGWZHFW-SRVKXCTJSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NCc2cc(F)ccc2O)C1 2011917142 JMNQEGPBOMPPIE-ZFWWWQNUSA-N 340.395 1.991 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CCC(N=[N+]=[N-])CC2)C1 2011939369 LEZNVDRVCPDUGI-HNNXBMFYSA-N 339.396 1.660 10 10 EDCE COCCN1CCN(c2ccc(CN)c(Br)c2F)CC1 2154728277 AWGRWEGDSFBXLG-UHFFFAOYSA-N 346.244 1.815 10 10 EDCE C[C@@H](C(=O)N(C)CCCN=[N+]=[N-])N1CC(NC(=O)OC(C)(C)C)C1 2014687253 VHOAQQQDIZYKRC-NSHDSACASA-N 340.428 1.743 10 10 EDCE CN(C)c1ccc([C@@H](CN)N2CC(NC(=O)OC(C)(C)C)C2)cc1 2018794846 GBVRIOFGCVIKSM-MRXNPFEDSA-N 334.464 1.961 10 10 EDCE CCNCc1ccc(N2CC[C@](O)(CO)C2)cc1Br 314156950 KCQWQSLBZVEFOX-CQSZACIVSA-N 329.238 1.492 10 10 EDCE CN1CCN(Cc2cc(Br)ccc2O)C[C@@H]1C(=O)O 686096524 VDFJKLPSSXWWFE-LLVKDONJSA-N 329.194 1.355 10 10 EDCE COC12CC(C1)N(c1cc3c(cc1Br)[C@H](N)C(=O)N3)C2 2185472431 YNMHLKYGONUMJA-XUTOFBKGSA-N 338.205 1.769 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1 2076777306 CLFJHQNEZRDMSZ-GOSISDBHSA-N 349.431 1.599 10 10 EDCE CNCc1ccc(N2CC[C@]3(C[C@H](O)CO3)C2)c(Br)c1 2201779765 PQCYIJYGUWWRHK-WFASDCNBSA-N 341.249 1.899 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2210529354 PSWYXEFJLNOKOD-DCAQKATOSA-N 327.385 1.610 10 10 EDCE CC(C)(C)OC(=O)N1CC(n2cnc(C(=O)N3CC(N=[N+]=[N-])C3)c2)C1 2218301136 KAGHKEDFXITZHK-UHFFFAOYSA-N 347.379 1.810 10 10 EDCE CC(C)(C)OC(=O)N1CCc2ccc(Nc3nnc(=N)[nH]n3)cc2C1 2219016439 CGVCWEXZOMGFDD-UHFFFAOYSA-N 343.391 1.716 10 10 EDCE COc1ccc(N(CCO)CCN(C)C)c(OC)c1Br 2234898158 VNUKUEVHIXHPPU-UHFFFAOYSA-N 347.253 1.827 10 10 EDCE Nc1ccc(CCC(=O)N2CCC(NC(=O)C(F)(F)F)CC2)cc1 2258235282 XYOPEGKNPDTUES-UHFFFAOYSA-N 343.349 1.871 10 10 EDCE COC[C@@H]1C[C@@H](CN)N(Cc2ccc(Br)cc2O)C1 2273884572 CVMDCJGTIVZSRT-MFKMUULPSA-N 329.238 1.950 10 10 EDCE CNC[C@]1(O)CCCN(Cc2cc(Br)cc(F)c2O)C1 2286346625 YEDHHLFKHBVAFQ-CQSZACIVSA-N 347.228 1.840 10 10 EDCE COc1ccc(CN2C(=O)NC(=O)C(=Cc3ccoc3)C2=O)cc1 2296766333 ACSWDMVGOCPGIW-UHFFFAOYSA-N 326.308 1.950 10 10 EDCE O=C1NC(=O)N(C2CCCCCC2)C(=O)C1=CNC[C@H]1CCCO1 2296945860 NOCCUPKQUUYWAY-CYBMUJFWSA-N 335.404 1.440 10 10 EDCE O=C1NC[C@@H]2CN(Cc3cc(Br)ccc3O)CC[C@@H]12 365661705 RGHPFWYWVIRLMJ-ZYHUDNBSSA-N 325.206 1.723 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)OCCn1cncn1 2297507208 VJSFRISLRXWBJF-UHFFFAOYSA-N 328.372 1.371 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)cc1Br 2330385736 KFELOEAIUPNAGD-AIUZOBBOSA-N 328.206 1.262 10 10 EDCE COC(=O)[C@@H]1C[C@H](OC)CN1Cc1ccc(N2CCOCC2)cc1 125782264 CUOSWAOLTHAGBW-IRXDYDNUSA-N 334.416 1.286 10 10 EDCE C[C@H](N)[C@H](O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952207703 FFDLYCBGXJYHGW-PXWWUCIGSA-N 326.393 1.242 10 10 EDCE CCS(=O)(=O)N1CC(CNCc2c(O)ccc3ccccc23)C1 190281188 OSYKYRRNCUXILW-UHFFFAOYSA-N 334.441 1.917 10 10 EDCE O=S1(=O)C[C@@H](c2ccc(OCc3ccccc3)cc2O)NCCN1 1952553684 AODFTLJPFOHJPA-INIZCTEOSA-N 348.424 1.535 10 10 EDCE N[C@H](CCO)c1cc(I)cc([N+](=O)[O-])c1O 380473249 JJQLOEHBUBSEQP-SSDOTTSWSA-N 338.101 1.287 10 10 EDCE Cc1ccc(CN2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)c(O)c1Br 2381140868 QZHIPWGCUSGWRM-NWJSVONSSA-N 342.233 1.922 10 10 EDCE C[C@@]1(CO)CCCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 723042393 IXXJBKPUKNCMFJ-OCCSQVGLSA-N 341.205 1.786 10 10 EDCE NC(=O)NCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726625587 KCLZDTBXJFVEBR-UHFFFAOYSA-N 342.346 1.041 10 10 EDCE C[C@H](NC(=O)NC[C@H]1CCCCN1CCO)c1ccc(N(C)C)cc1 838560442 XDWYYMWLMLTYFU-MAUKXSAKSA-N 348.491 1.960 10 10 EDCE COc1ccc(N2CCN(CCNCc3cnc(C)nc3)CC2)cc1 742700613 UFJXTUAGUWUKNP-UHFFFAOYSA-N 341.459 1.705 10 10 EDCE CN1C[C@@H](CCNC(=O)NCc2ccc(N(C)C)c(F)c2)CC1=O 915373311 YTJVVOYCWWYCHT-ZDUSSCGKSA-N 336.411 1.559 10 10 EDCE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CNC(N)=O)cc1 920445160 MRZLGCJEJJHYPB-UHFFFAOYSA-N 330.388 1.543 10 10 EDCE Cc1cc(CC(=O)N[C@H]2CC(=O)N(C)C2=O)c(C)n1-c1ccccc1 854381789 RBMPSNCEPXLPAQ-INIZCTEOSA-N 339.395 1.510 10 10 EDCE COc1nccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 929538181 WTTAAZIIRLGZDT-UHFFFAOYSA-N 342.399 1.594 10 10 EDCE Oc1cccc2c1[C@@H](N[C@@H]1CCN(c3ccc4nncn4n3)C1)CC2 858490202 VNGHISWVJGCGGA-KGLIPLIRSA-N 336.399 1.686 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](CO)O[C@H](C)C3)C2)cc1 854299101 LEAYYVREBIYVDG-KEYYUXOJSA-N 349.431 1.065 10 10 EDCE CCO[C@H](C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)C1CCOCC1 867302899 WDNSBGTVJWYNNR-SJCJKPOMSA-N 337.416 1.977 10 10 EDCE CN(C)c1ccc([C@@H](N)CNS(=O)(=O)C[C@H]2CCC2(F)F)cc1 866756964 FAZVLEQJDTWKCE-OCCSQVGLSA-N 347.431 1.717 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3COC[C@@]3(C)C2)cc1F 1118669021 NJGWVLIDCBDSST-SCLBCKFNSA-N 349.406 1.003 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccnnc1 1137816277 FIKGQRZCMMRUJJ-UHFFFAOYSA-N 335.747 1.651 10 10 EDCE Cc1oc(C(=O)NCc2ccc(O)c(O)c2)cc1S(C)(=O)=O 1137443369 MVHXTSBDPNVXJR-UHFFFAOYSA-N 325.342 1.333 10 10 EDCE C[C@H](NCc1ccc(N2CCOCC2)cc1)C1(S(C)(=O)=O)CC1 796493178 WEAVNRHPRWFYAI-AWEZNQCLSA-N 338.473 1.579 10 10 EDCE CC[C@](COC)(NC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)OC 1141836210 DTVBNXKFJIXEOQ-OAHLLOKOSA-N 336.348 1.547 10 10 EDCE CS(=O)(=O)N[C@@H]1CCN(Cc2cc(Br)ccc2O)C1 93530704 NTFBEQFBVNYUGJ-LLVKDONJSA-N 349.250 1.278 10 10 EDCE C[C@H](CCNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H]1CCOC1 1317418009 RTOMFAWXJNMZMN-OLZOCXBDSA-N 347.419 1.984 10 10 EDCE NC(=O)N[C@H](CC(=O)NCc1c(O)cccc1O)c1cccs1 1178904900 CHSIRKHNWJXINE-SNVBAGLBSA-N 335.385 1.575 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2ccc(C(N)=O)[nH]2)cc1C 1275309534 BVDJWGZHFSNOAS-LBPRGKRZSA-N 344.415 1.339 10 10 EDCE CCCN(C)C[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1284519580 KOFVDUIHCVXHBW-CQSZACIVSA-N 335.408 1.624 10 10 EDCE C[C@@H](c1ccc(O)cc1O)N(Cc1ccccc1)CC1(O)CNC1 1915508128 GWGIKNJWJBRZMG-AWEZNQCLSA-N 328.412 1.995 10 10 EDCE C[C@H](NC(=O)[C@@H](NC(=O)C1CCCC1)[C@H](C)O)c1ccccc1O 1454817307 JVHGYUFJHDHRKR-MKBNYLNASA-N 334.416 1.625 10 10 EDCE Cc1cc(C(=O)NCc2nc(O)cc(O)n2)c(C)n1-c1ccccn1 1454189438 MPKZQCOPVGSAKZ-UHFFFAOYSA-N 339.355 1.620 10 10 EDCE CNCc1ccc(N2CC[C@H](O)C[C@H]2CO)c(Br)c1 2136083069 UPFVGISAFJZQGX-RYUDHWBXSA-N 329.238 1.491 10 10 EDCE COc1nccc(C(=O)NCc2cccc(Br)c2O)n1 1467763054 AUZQWUDLHSTDRV-UHFFFAOYSA-N 338.161 1.883 10 10 EDCE CNC(=O)[C@H](CCSC)NC(=O)c1ccc(N=NC(N)=O)cc1 1468631313 SLSSKHHINLZKHI-NSHDSACASA-N 337.405 1.447 10 10 EDCE CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NCc2cc(O)ccc2O)C1 1633595263 OOTDHZJZUHPYGT-STQMWFEESA-N 334.416 1.999 10 10 EDCE CCn1c(C)cc2[nH]nc(NC(=O)c3c(F)ccc(O)c3O)c2c1=O 1641673607 YXQUKAOGXAJKQT-UHFFFAOYSA-N 346.318 1.856 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1C[C@H](O)[C@H](O)C1 1652219564 OSHRARGVZFCGRQ-GBEXYDAJSA-N 342.395 1.521 10 10 EDCE C[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@H](CNCCO)C1 1656598604 UOAONLNSXGALEL-DOMZBBRYSA-N 347.419 1.672 10 10 EDCE Cc1cc(C(=O)NCc2c(O)cccc2F)ccc1S(N)(=O)=O 1596913160 WQETVSNFIPEZKP-UHFFFAOYSA-N 338.360 1.417 10 10 EDCE COc1cc(N2CCC(NC(=O)N(C)C)CC2)cc(OC)c1OC 1858044130 HXGUKBISBQKRLK-UHFFFAOYSA-N 337.420 1.952 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NCCN=[N+]=[N-])C1 1963808773 FLDSHLUJYKFUDO-LLVKDONJSA-N 327.385 1.829 10 10 EDCE OC[C@@H]1CO[C@H](CNCc2cc(Br)cc(F)c2O)C1 1966089130 VWOVIXWFMLSXHF-KCJUWKMLSA-N 334.185 1.781 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCCCN=[N+]=[N-])[C@@H]1CCCO1 1985101990 AGDNARPEKSFCMY-QWRGUYRKSA-N 327.385 1.875 10 10 EDCE COc1cccc(CN[C@@H](CO)CNC(=O)OC(C)(C)C)c1O 1985776698 ASDLJAHGMLCNLP-GFCCVEGCSA-N 326.393 1.376 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2010391753 AYWOHPQDILZOGH-LLVKDONJSA-N 339.396 1.517 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010394514 CRHCRXLUUVAPBA-ZJUUUORDSA-N 340.384 1.056 10 10 EDCE CCn1nnc(Br)c1CNC(=O)c1cccc(O)c1O 2156472921 ACOYIFKVEFCLQY-UHFFFAOYSA-N 341.165 1.402 10 10 EDCE COC(=O)C1(NC(=O)OC(C)(C)C)CC(NCc2ccc(N)cc2)C1 2033802781 IXURORKRDOFOTQ-UHFFFAOYSA-N 349.431 1.957 10 10 EDCE C[C@@H](N)c1ccc(N2CC(N3CCOCC3)C2)c(Br)c1 2169500007 KJWXJVDCKIGBLO-LLVKDONJSA-N 340.265 1.990 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213586430 XCNOXFXUOBQYPQ-MNOVXSKESA-N 339.396 1.563 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])C1 2213586429 XCNOXFXUOBQYPQ-GHMZBOCLSA-N 339.396 1.563 10 10 EDCE C[S@@](=O)(=Nc1ccc(C2=S=CC=C2)s1)N1CCNCC1 2205853700 YSGJNVNIIFBGFV-HXUWFJFHSA-N 327.500 1.923 10 10 EDCE COc1ccc(Br)c(CN(C)[C@H]2[C@@H]3CNC[C@@H]32)c1O 2227749163 BRXMPJSVJVWLQN-WOFXILAISA-N 327.222 1.813 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@H](O)CC2)c(Br)c1 2284535243 CBWMSINTUHBMFQ-GASCZTMLSA-N 343.265 1.881 10 10 EDCE CC[C@H](C)[C@H](NC(N)=O)C(=O)NCc1ccc2c(c1)CCCN2C 57558775 IKASLCGGSYTVSV-LRDDRELGSA-N 332.448 1.768 10 10 EDCE CCCCN(CC(N)=O)c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 178884056 XODPOZJEAFVIHK-SOFGYWHQSA-N 335.360 1.873 10 10 EDCE CNCc1ccc(N2CC3(CC[C@@H](CO)O3)C2)c(Br)c1 2361837021 KICOKOPFRMJXDO-LBPRGKRZSA-N 341.249 1.899 10 10 EDCE CCN1C(=O)/C(=C2/SC(=S)N(NC(C)=O)C2=O)c2ccccc21 33304146 WTEQVAXGWZVTRY-VAWYXSNFSA-N 347.421 1.676 10 10 EDCE COc1ccc(/C=C2/SC(=S)N(NC(C)=O)C2=O)c(OC)c1 95949596 AMIJYZVZIJXMKO-WUXMJOGZSA-N 338.410 1.956 10 10 EDCE O=C1N[C@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CS1 266918161 VJGHBPTZILOIJC-HNNXBMFYSA-N 349.456 1.337 10 10 EDCE Cc1ccc(CNC(=O)C[C@@H]2COCCO2)c(O)c1Br 2381135859 XERHMWCZKPTRAZ-LLVKDONJSA-N 344.205 1.885 10 10 EDCE CCOC(=O)c1cnc(NC(=O)N(C)Cc2ccccc2O)n1C 821414619 URILPGHYGGNXBO-UHFFFAOYSA-N 332.360 1.966 10 10 EDCE CCC/C=C/[C@@H](O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 900268463 CLWHXGSPFKUSHG-LAQIPUCWSA-N 336.407 1.996 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc2c(c1)B(O)OC2 584954611 NCZYRISBZKBTMB-UHFFFAOYSA-N 338.172 1.010 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(CCN2CCCC2)CC1 588405514 WJMKDYUQNBDTHS-XQRVVYSFSA-N 345.443 1.351 10 10 EDCE C[C@H]1CCNC[C@@H]1NC(=O)NCc1cc(Br)ccc1O 841978761 YMRBKMVIKKYDPJ-CABZTGNLSA-N 342.237 1.952 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCCC[C@@H]2[C@@H]2CCNC2)cc1 844223708 AEWSWHGHCSIODP-IEBWSBKVSA-N 344.503 1.833 10 10 EDCE Cc1cc(C(=O)N2CCN(C)[C@H](CO)C2)c(C)n1-c1ccccn1 913553144 BXCGXSKJTDYRTJ-HNNXBMFYSA-N 328.416 1.238 10 10 EDCE COC(=O)COc1ccc(N(C)C[C@@H]2CN(C3CC3)C(=O)O2)cc1 844320240 YAGHTFAUHCNIHB-OAHLLOKOSA-N 334.372 1.658 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1COC[C@@H]1NC(=O)OC(C)(C)C 1895874625 AWIGCYJLCGIWCS-MNOVXSKESA-N 327.385 1.685 10 10 EDCE C[C@@H]1CCN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCO1 924007557 OFHRMAKGDPDXCS-MRXNPFEDSA-N 346.475 1.759 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N3C[C@@H]4[C@H](C3)C4(F)F)ccc21 1332774475 BSDHEZVRTMBTEO-OKILXGFUSA-N 349.381 1.409 10 10 EDCE COC(=O)c1cncc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1 853758837 LDAHQUYSPOPGAR-GFCCVEGCSA-N 328.372 1.963 10 10 EDCE C[C@@H](NCC[C@H]1CNCCS1(=O)=O)c1ccc(N(C)C)cc1 925801256 XKNDUVIHIQCBSR-CJNGLKHVSA-N 325.478 1.180 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN(C)CC3CC3)CC2)cc1 754009155 YQAQFLSPUCVSBV-GOSISDBHSA-N 333.476 1.520 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@@H](C)CO3)CC2)cc1 896330988 QETQOUGTQOITEQ-CRAIPNDOSA-N 347.459 1.358 10 10 EDCE Oc1cccc(Br)c1CN1CCN([C@H]2CCNC2)CC1 706847027 UDCYVZYEQDXZSJ-LBPRGKRZSA-N 340.265 1.634 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1[C@H]2COC[C@H]21 792886136 YRYJMKVGXPJGDE-PIIMJCKOSA-N 345.443 1.339 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)Nc2ccnc(OCCO)c2)cc1 1301354037 UHUNTXMDZINWCE-UHFFFAOYSA-N 329.316 1.867 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CC3(C)C)C2)cc1 1328513968 OUELFWYDWNWSKY-WFASDCNBSA-N 331.416 1.305 10 10 EDCE CN1CCN(c2ccc(CN3CCN(C4CC4)CC3)cc2F)CC1 1324717287 ZPMFTONBHDBYOG-UHFFFAOYSA-N 332.467 1.858 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCOc1nnc(=N)[nH]n1)C(C)(C)C 1902666946 DKTBYJOLXKJONI-VIFPVBQESA-N 326.401 1.387 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H](O)C(C)(C)NC(=O)OC(C)(C)C 1900608008 UOJABMULBGCGIV-JTQLQIEISA-N 329.401 1.809 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cn(C)nc2OC)cc1C 1268657255 OINLVRYGVOLPIE-CYBMUJFWSA-N 346.431 1.654 10 10 EDCE CC(=O)c1cn(CC(=O)N(C)Cc2ccc(N3CCCC3)cc2)nn1 1351674708 XUAIWDQJBIYKNA-UHFFFAOYSA-N 341.415 1.740 10 10 EDCE CC[C@@H](F)C(=O)N(C)C[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1510713328 QNZDRPAYEIBKTI-ZYHUDNBSSA-N 341.383 1.424 10 10 EDCE C[C@@H]1OCC[C@H]1C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1522718727 WDAAPERVBMJHJJ-GXFFZTMASA-N 347.375 1.120 10 10 EDCE COc1cccc(CNC(=O)Cn2nnnc2-c2ccsc2)c1O 1622778976 CZBOHIMXWZMGGA-UHFFFAOYSA-N 345.384 1.432 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CCCNC(C)=O 1498674821 ITSNDPQJGAXZFK-UHFFFAOYSA-N 331.420 1.709 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CC[C@H](Nc2ncccn2)C1 1639943422 QHYANTYIPKRRPK-LQPUYASZSA-N 326.356 1.614 10 10 EDCE COc1cccc(CNC(=O)c2ccc3c(c2)nc(CO)n3C)c1O 1636061102 FGLCEUJQNWSKNC-UHFFFAOYSA-N 341.367 1.710 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCCn1cnnn1 1726357155 IHWHVZLUAREBGR-UHFFFAOYSA-N 328.380 1.005 10 10 EDCE CCn1cc(-c2n[nH]cc2C(=O)NCc2c(O)cccc2O)cn1 1635847087 HDGJVNHKMDELIX-UHFFFAOYSA-N 327.344 1.634 10 10 EDCE O=C(NCCn1cc(Br)ccc1=O)c1cc(O)cs1 1636663635 QEWNPQOSIFGNMK-UHFFFAOYSA-N 343.202 1.808 10 10 EDCE Cc1ccc(S(C)(=O)=O)cc1C(=O)NCc1cc(O)ccc1O 1643879230 GTVIYBISPWLZOH-UHFFFAOYSA-N 335.381 1.740 10 10 EDCE CCC(=O)NCC(=O)N1CC[C@H](CNCc2ccc(OC)c(C)c2)C1 1731654981 SUYOKRSZTXPDTM-MRXNPFEDSA-N 347.459 1.468 10 10 EDCE COCC(=O)N(C)[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1678218950 KRQVSAZEUMFOAT-SNVBAGLBSA-N 335.364 1.072 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CO)c3ncc[nH]3)C2)cc1 1687025737 UACZLTNJIHFZGK-WFASDCNBSA-N 345.403 1.030 10 10 EDCE CC[C@@H](C)C(=O)NC[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1684190245 GIHTWOWDHAGMQA-BZPMIXESSA-N 349.431 1.770 10 10 EDCE CCN(CC)c1ccc(CNCC(=O)N2CCC[C@H](C(=O)O)C2)cc1 1857866435 LLWQOGNXRLSQKV-INIZCTEOSA-N 347.459 1.946 10 10 EDCE C[C@H](NC[C@H](CO)NC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985854356 SDZTURMYCMNQTJ-WDEREUQCSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@](O)(CC(=O)N2CC(N=[N+]=[N-])C2)C1 2010404027 NPFZEMQSYFWHGZ-HNNXBMFYSA-N 339.396 1.660 10 10 EDCE C[C@H](CN(C)C(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 2015118393 AGORJCNLDYVCEI-SECBINFHSA-N 340.376 1.789 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NCc2cccc(F)c2O)C1 2011917898 MSCLUBZENNCWAY-KBPBESRZSA-N 340.395 1.991 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CC(O)C1 2014482396 JHGUMBBFKPEUJM-RWWNRMGGSA-N 339.396 1.563 10 10 EDCE C[C@H](O)CN1CCN(c2cc(Br)c(CN)cc2F)CC1 2170220813 KMWCCVBDWQWRPQ-JTQLQIEISA-N 346.244 1.550 10 10 EDCE CN(CC1(Br)CC1)C(=O)[C@@H](N)Cc1ccc(O)c(O)c1 2196929383 FXAYZKTZZCETFV-JTQLQIEISA-N 343.221 1.354 10 10 EDCE CN1C(=O)NC(=O)C(=Cc2ccc(-c3ccccc3C(=O)O)o2)C1=O 2294728478 JQXSVPPVVUUSMN-UHFFFAOYSA-N 340.291 1.736 10 10 EDCE Cn1cccc1C=C1SC(=S)N(CCS(=O)(=O)O)C1=O 2293223788 OFAHVLTZMFUOFP-UHFFFAOYSA-N 332.428 1.114 10 10 EDCE NCC[C@@H](COCc1ccccc1)NC(=O)c1cccc(O)c1O 2303738261 OOASTRGNUNKDFA-AWEZNQCLSA-N 330.384 1.762 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CC23CNC3)c(O)c1Br 2352638963 ZQJPETCSZWNRMU-SNVBAGLBSA-N 325.206 1.689 10 10 EDCE CO[C@@H](CCNC(=O)C(=O)N(C)Cc1ccccc1O)C(F)(F)F 1346982058 PGMQVOYPVPDAON-LBPRGKRZSA-N 348.321 1.434 10 10 EDCE CC(=O)N[C@H](CNCc1ccc(C)c(Br)c1O)C(=O)O 2380739219 HQBMVZJHHIPGMY-SNVBAGLBSA-N 345.193 1.142 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCCCCN1CCC[C@@H]1CO 588408326 KNFJRPALKSWPRZ-DDJMYBDESA-N 334.416 1.464 10 10 EDCE C/C=C/[C@H](O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 900268476 CWBYODJMRBUJGQ-MEZWIEOSSA-N 336.407 1.993 10 10 EDCE CN1C(=O)NC2(CCN(C/C=C\c3ccc(N(C)C)cc3)CC2)C1=O 835052464 CNBFNPPFONWZFH-PLNGDYQASA-N 342.443 1.782 10 10 EDCE COc1ccc(N2CCC(NC(=O)N3CC(C)(CO)C3)CC2)cc1 838190347 CWMYNWLZRDGHAQ-UHFFFAOYSA-N 333.432 1.688 10 10 EDCE CC[C@H](C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(O)cc1O 910956439 WEPHPWHGINWHQY-GXFFZTMASA-N 338.429 1.662 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@H](CN)C(F)(F)F)CC2)cc1 848596653 ZRGZPZOJYGTBOG-CYBMUJFWSA-N 346.353 1.416 10 10 EDCE Cc1cc(C)c([C@H](C)NCC[C@@H]2CNCCS2(=O)=O)c(O)c1 925788077 FOVXLPZTHGKSSP-UONOGXRCSA-N 326.462 1.436 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 930522915 KKHRMXLBKWKDAJ-WKULXVSPSA-N 328.412 1.563 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CCCNC1=O 858926546 FEEQXTMJZNZUSI-INIZCTEOSA-N 339.395 1.915 10 10 EDCE COC(=O)[C@]1(C)C[C@H](OC)CN1Cc1ccc(N2CCOCC2)cc1 931382992 PIRTWEKJGVVQDI-HKUYNNGSSA-N 348.443 1.676 10 10 EDCE COCCn1cc(C(=O)NCc2ccc3cccnc3c2O)nn1 862025280 ROSJZMFAYKCTQG-UHFFFAOYSA-N 327.344 1.108 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CC[C@@H](C)NC3)C2)cc1 861690784 TTZKMUAFJFECNA-ILXRZTDVSA-N 332.448 1.714 10 10 EDCE O=C(CN(C[C@H]1CCCO1)C(=O)c1cccc(O)c1O)N1CCCC1 790901053 CVCKAVNPVNZHSR-CYBMUJFWSA-N 348.399 1.341 10 10 EDCE COCC1(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 1326109264 AVUVYSYZKFRYOB-AWEZNQCLSA-N 347.459 1.863 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@]34CCOC4)ccc21 1325822624 LFQWGZNVTIVWPJ-LJQANCHMSA-N 343.427 1.077 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3C[C@H]3C3CC3)ccc21 1327981024 DSLIHIVUBZSDQX-JKSUJKDBSA-N 327.428 1.600 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1CCN1C(C)(C)C 1333367095 ZRDQMEIECPYSLJ-CQSZACIVSA-N 333.432 1.340 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H]2CCC(=O)N2C)cc1C 1267418814 HBERDAJSGUOZQN-OAHLLOKOSA-N 333.432 1.172 10 10 EDCE O=C(NCc1cnc(Br)s1)c1cc(O)c(O)c(O)c1 2132351692 ZJJVREYNIKJGBH-UHFFFAOYSA-N 345.174 1.952 10 10 EDCE CCCN1CCC[C@](CO)(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1271995642 CJEUPRGJAVUGST-KRWDZBQOSA-N 347.419 1.816 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)C2[C@@H]3CCC[C@@H]23)cc1 1522577367 OQZJWJUOHDUGCR-CHWSQXEVSA-N 343.387 1.741 10 10 EDCE CCO[C@@H](C)c1noc(CN(C)C(=O)c2c(F)ccc(O)c2O)n1 1610957778 VWVCARQWQATCLH-QMMMGPOBSA-N 339.323 1.990 10 10 EDCE CS(=O)(=O)C1CCC(CNC(=O)c2c(F)ccc(O)c2O)CC1 1559033078 VDZYXSZYIYZKRA-UHFFFAOYSA-N 345.392 1.570 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC[C@H](c2nnc3n2CCC3)C1 1558929682 OMYNADZLPSAKJU-JTQLQIEISA-N 346.362 1.794 10 10 EDCE CC(C)N(C)C(=O)[C@@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1628920158 JBKUPYHTBAQLTC-LBPRGKRZSA-N 338.429 1.409 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@]2(C)CCNC2=O)cc1C 1568918613 QSTIJFVIHLMAQQ-PXPVJAHISA-N 345.443 1.292 10 10 EDCE CC[C@H]1CN([C@@H](CC)C(=O)NCCc2ccc(O)c(O)c2)CCO1 1630335062 JYCUPNXJYHTZQJ-GJZGRUSLSA-N 336.432 1.646 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@H]2CCN(C)C2=O)cc1C 1568668484 VOQCQRKBGSQOBM-GOEBONIOSA-N 347.459 1.466 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H](C)c2ccco2)cc1C 1568579462 BOVAOOJGNRANKX-ZBFHGGJFSA-N 346.427 1.967 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccc(N2CCOCC2)cc1 1639289534 SUMPKXFOSBCZJE-UHFFFAOYSA-N 328.368 1.864 10 10 EDCE Cc1cc(C(=O)NCc2ccc(O)cc2O)ccc1-n1cnnn1 1643101156 XEQGUADPQJCBIY-UHFFFAOYSA-N 325.328 1.312 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1CCn2nnnc2C1 1875666871 OCHHACVZVXOHEH-SECBINFHSA-N 342.172 1.385 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985094842 UZRKACLAIWWIJK-ZJUUUORDSA-N 329.357 1.369 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])COC1 2010401307 CUNUOZZIJKUNLD-LLVKDONJSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NCc2cccc(O)c2O)C1 2011918903 WNNPYIHGNHLRTE-STQMWFEESA-N 338.404 1.558 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)C(=O)NCCc1ccc(N)cc1 2022916463 IYENRSXWOGIHRR-ZDUSSCGKSA-N 337.420 1.061 10 10 EDCE NC(=O)CCN(Cc1ccccc1)C(=O)[C@H]1CNc2ccccc2N1 2034754016 JVCBBNFQCBOGSY-QGZVFWFLSA-N 338.411 1.797 10 10 EDCE C[C@@H]1CO[C@@H](CO)CN1c1cc(Br)c(CN)cc1F 311414988 MIWRFKZVULCHAD-PSASIEDQSA-N 333.201 1.633 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](C(CO)CO)C2)cc1Br 2170673709 KTVMOOVXPCOBDT-GHMZBOCLSA-N 343.265 1.896 10 10 EDCE COC(=O)C=Cc1ccc(N2CCN(C[C@H](C)O)CC2)c([N+](=O)[O-])c1 2053541842 BZYJZDWMYRRWKP-ZDUSSCGKSA-N 349.387 1.284 10 10 EDCE COc1ccc(N(C)C[C@@H]2COCCN2)c(OC)c1Br 2162641667 CHTTXUSSTUXFNS-SNVBAGLBSA-N 345.237 1.891 10 10 EDCE C[C@@H](c1cc([N+](=O)[O-])ccc1O)n1ncc(S(C)(=O)=O)c1N 2070217521 PVACPPOIBXOSKA-ZETCQYMHSA-N 326.334 1.092 10 10 EDCE CCNC(=O)c1cnn(Cc2c(O)cccc2Br)c1O 2070485019 FURLZRQWSSIZFX-UHFFFAOYSA-N 340.177 1.855 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)c(Br)c1 2190454889 WBKOJJOQHYHSTD-MOLYSANOSA-N 342.233 1.965 10 10 EDCE N[C@H]1C[C@@H](O)CN(Cc2cc(Cl)cc(Br)c2O)C1 2049113234 HVGWKXZILKEBNL-VHSXEESVSA-N 335.629 1.702 10 10 EDCE C[C@@H](O)c1ccc(N2CC(=O)N[C@H]3CC[C@H]32)cc1Br 2112060448 FFBULDRWFRCFFD-OXHMUOHRSA-N 325.206 1.970 10 10 EDCE NCc1ccc(N2CC(n3ccnn3)C2)c(F)c1Br 2113831528 BATIMQKMZYSZAW-UHFFFAOYSA-N 326.173 1.700 10 10 EDCE CNCc1ccc(N2CCN(C)C[C@H]2CCO)cc1Br 2202834522 KRNYMEVPLJYEOI-CQSZACIVSA-N 342.281 1.671 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccsc2CO)s1 2269126227 XQGMTKNHQMOEFH-UHFFFAOYSA-N 336.485 1.897 10 10 EDCE CC[C@@](C)(NCc1c(Br)ccc(OC)c1O)C(N)=O 2227748924 QWPSISDDHILODE-CYBMUJFWSA-N 331.210 1.907 10 10 EDCE COc1ccc(-n2cccc2C=C2C(=O)NC(=S)N(C)C2=O)cc1 2293299422 APVVGFGKGAETPF-UHFFFAOYSA-N 341.392 1.742 10 10 EDCE Cc1ccc(CN(C)[C@@H]2C[C@H](N)C[C@@H]2O)c(O)c1Br 2352643242 MTTCPLZGMZWQCZ-TUAOUCFPSA-N 329.238 1.746 10 10 EDCE CN1C(=O)CNC[C@H]1c1cc(I)ccc1O 1952068197 NSJQJPVIWXVLBP-VIFPVBQESA-N 332.141 1.100 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)C[C@H](C)c2nnn[nH]2)c([N+](=O)[O-])c1 132912164 SWZUKVBFKIVYPF-STUBTGCMSA-N 346.347 1.534 10 10 EDCE CCS(=O)(=O)N1CC(CN[C@H](C)c2ccc(N(C)C)cc2)C1 190683116 QLKPDLQDMOXUPF-CYBMUJFWSA-N 325.478 1.685 10 10 EDCE O=C(c1cccc(O)c1O)N1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1 193144791 WLEVRALSJRPUCJ-RISCZKNCSA-N 330.384 1.713 10 10 EDCE CC(=O)Nc1ccc(S(=O)(=O)N(C(C)=O)c2ccc(N)cc2)cc1 242839781 FVHPASWJTVUKNV-UHFFFAOYSA-N 347.396 1.969 10 10 EDCE CNC(=O)CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 375366609 CNGLPJSHRKLFMT-CYBMUJFWSA-N 339.823 1.262 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@@H](O)c2cn(C)nc2Br)cc1 2163139516 YKCSUWONIIRFMY-OLZOCXBDSA-N 339.237 1.982 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CCNC[C@@H]3C)C2)cc1 818654629 DACKZHLGTXZAGC-HDMKZQKVSA-N 346.475 1.819 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)Cc3cncnc3)C2)cc1 819587009 CJRKUPJPTUNKER-AWEZNQCLSA-N 326.400 1.670 10 10 EDCE COC(=O)CCCCNC(=O)NCc1ccc(N2CCOCC2)cc1 726235566 CNHIGKFJDYPJHH-UHFFFAOYSA-N 349.431 1.666 10 10 EDCE COC[C@@](C)(O)CNCc1c(Br)ccc(OC)c1O 1964564643 URUIITOWJSHYRH-ZDUSSCGKSA-N 334.210 1.650 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)[C@@H]1CCN(C2CC2)C1 732413429 UROUBORPBJWXCI-LJQANCHMSA-N 344.503 1.880 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](O)Cc1cnn(C)c1 839922448 VBEKEZZTHZGOOH-KBXCAEBGSA-N 344.459 1.445 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1CCN(C2CC2)C1=O 831925012 QWRUZOVGWCLRQV-LLVKDONJSA-N 333.388 1.045 10 10 EDCE COCCN1CCC(NC(=O)NCc2c(O)cccc2F)CC1 914396941 HFFLEXKTPNNBEE-UHFFFAOYSA-N 325.384 1.441 10 10 EDCE COc1ccc(CNC(=O)NC[C@H]2CN(C3CC3)C(=O)O2)c(O)c1 847463229 HPCZHQYCKITRRH-ZDUSSCGKSA-N 335.360 1.183 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cc1c(O)ncnc1O 910559986 ZTZOMNSNJCCUHH-GFCCVEGCSA-N 344.415 1.552 10 10 EDCE Cc1cncc(CCN2C(=O)CN(Cc3ccccc3O)C2=O)n1 849365281 KGNXAYRXQKUKQF-UHFFFAOYSA-N 326.356 1.498 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)O[C@H](C)C(=O)O)C2)cc1 849183430 RAVYZWCNXAGAQE-XQQFMLRXSA-N 336.388 1.268 10 10 EDCE CCO[C@@H](C)C(=O)Nc1ccc(O)c(CNC(=O)[C@@H](C)OCC)c1 923124335 KXEZGFJUYXKRRK-NEPJUHHUSA-N 338.404 1.797 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CC[C@H](C(=O)O)C3)C2)cc1 852954467 IHGCUDICCQNJSP-RDBSUJKOSA-N 332.400 1.891 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCn4cncc4C3)C2)cc1 855224639 GRTZOCFWXKNBMD-GJZGRUSLSA-N 340.427 1.849 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2c(C)nn(C)c2C)c1 754489567 AROPOGBNTGQZLR-VIFPVBQESA-N 346.387 1.567 10 10 EDCE CCC[C@@H](NC(N)=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855233957 PWPSSBJTPFUPJV-SWLSCSKDSA-N 334.420 1.227 10 10 EDCE OCc1nnc2n1CCN(Cc1c(O)cccc1Br)C2 862250339 NFZZQGNZOKKSJR-UHFFFAOYSA-N 339.193 1.254 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@](C)(O)CO)cc1 861482863 AKNGLJTWNOFRIT-IBGZPJMESA-N 344.411 1.309 10 10 EDCE Cc1cc(N(C)C)ccc1CN1CC[C@H](N2C(=O)O[C@H]3CNC[C@H]32)C1 872256973 GUMSRFKFWSWCLJ-KSZLIROESA-N 344.459 1.428 10 10 EDCE O[C@H](CNCc1ccc(N2CCCC2)cc1)CC1(O)CCOCC1 872198751 ZWXDHLGBQHLGBW-SFHVURJKSA-N 334.460 1.669 10 10 EDCE COC(=O)c1c(CNCC(=O)NCC2CC2)c2cc(F)ccc2n1C 894418761 CCMBAXKWJRQAHY-UHFFFAOYSA-N 347.390 1.720 10 10 EDCE CS(=O)(=O)Cc1nc(C(=O)NCc2cc(Cl)ccc2O)co1 1146233076 QEGASCVNFFOGNK-UHFFFAOYSA-N 344.776 1.508 10 10 EDCE COc1cccc(CNC[C@@H]2CCCCN2S(C)(=O)=O)c1O 796514008 SRIWLSLFYHGTBT-ZDUSSCGKSA-N 328.434 1.305 10 10 EDCE CCOc1ccc(N2CCN(C(=O)/C=C/Cn3cncn3)CC2)cc1 1331929526 TUURISUVTONZRE-ONEGZZNKSA-N 341.415 1.582 10 10 EDCE COc1ncc(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)cn1 1266984555 WRBGTYLERJOKHE-CYBMUJFWSA-N 344.415 1.710 10 10 EDCE Cc1ccc(CCC(=O)NCC(=O)NCc2cccc(O)c2O)cc1 1352657318 CFAZEDULXDRJHJ-UHFFFAOYSA-N 342.395 1.771 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)Cc2nnc(C)o2)cc1C 1277810301 NDLSARRSDFCGGQ-ZDUSSCGKSA-N 346.431 1.874 10 10 EDCE O=C(NCc1cc(C2CC2)no1)C(=O)N1Cc2cccc(O)c2C1 1353839412 KLLDXOZGVJUMPI-UHFFFAOYSA-N 327.340 1.416 10 10 EDCE O=Cc1ccc(OCC(=O)NCc2cccc(O)c2O)c([N+](=O)[O-])c1 1455320980 VWJJANQSPOEPBJ-UHFFFAOYSA-N 346.295 1.514 10 10 EDCE C[C@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCN1c1cnccn1 1607977486 ASTMUUFCHRLOML-DXTPNHAXSA-N 340.383 1.638 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@@H]1CCS(=O)(=O)c2ccccc21 1471642413 SNOUNMBSPKQRJR-CYBMUJFWSA-N 347.392 1.675 10 10 EDCE Cc1nn(C)c(-n2cccn2)c1C(=O)NCc1cccc(O)c1O 1471642090 JXFMUAYCDURHCL-UHFFFAOYSA-N 327.344 1.255 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2csnn2)cc1C 1497644993 SCJGCBBEVKDYIJ-ONEGZZNKSA-N 332.429 1.931 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2[nH]ccc2C)cc1C 1734514799 YULLNZKWTTYZTD-MRXNPFEDSA-N 345.443 1.863 10 10 EDCE COCC(=O)N[C@@H]1C[C@H](C)N(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1738956617 GZWXPYVNCALBIZ-GXFFZTMASA-N 347.375 1.215 10 10 EDCE COC(=O)c1cc(C2CN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)[nH]n1 1653474870 JZLHZVRXKONVHN-HWKANZROSA-N 343.339 1.247 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2ccn(C)n2)cc1C 1669188643 HEBDDVREDUQUEB-PLNGDYQASA-N 328.416 1.813 10 10 EDCE CC(C)(C)NCc1ccc(N2C[C@H](O)[C@@H](O)C2)cc1Br 232494443 DAIPDNVPNOPXRI-KBPBESRZSA-N 343.265 1.879 10 10 EDCE O=C(NCc1nc([C@@H]2CCCO2)n[nH]1)N1Cc2cccc(O)c2C1 1683610669 UMGUGTMKDDNJLZ-ZDUSSCGKSA-N 329.360 1.587 10 10 EDCE C=CC(=O)NCCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 156631861 ZNFMUEPAHOTJSF-UHFFFAOYSA-N 331.416 1.174 10 10 EDCE Nc1ccc(O)c(CNc2ncc(I)cn2)c1 159177089 PENGIGVJEIZDGO-UHFFFAOYSA-N 342.140 1.981 10 10 EDCE COCC1(C(=O)O)CN(Cc2ccc(Br)cc2O)C1 1973654740 OYRIMLKGVLYBIK-UHFFFAOYSA-N 330.178 1.688 10 10 EDCE NCc1cc(F)c(N2C[C@]3(CO)C[C@]3(CO)C2)cc1Br 2146318194 JWGDMAULIGJCKI-OKILXGFUSA-N 345.212 1.228 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1COCC[C@H]1NC(=O)OC(C)(C)C 1985103670 YVABTXPKPHYHCX-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CN1CC2(C1)CN(c1cc3c(cc1Br)[C@@H](O)C(=O)N3)C2 2152254378 DNCYADSCCWNQBC-GFCCVEGCSA-N 338.205 1.186 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)c1cn(CCNC(=O)OC(C)(C)C)cn1 2010402715 UYTXYKDRQNADQN-UHFFFAOYSA-N 337.384 1.790 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C(C)(C)O 2010404153 PAUKFCLOORMTEP-BMIGLBTASA-N 341.412 1.952 10 10 EDCE O=C(O)[C@H]1OCC[C@@H]1CNCc1c(O)cccc1Br 716260330 CHXWJKRTKKKNKW-PELKAZGASA-N 330.178 1.734 10 10 EDCE CN1C(=O)O[C@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@H]21 2176933870 STPNPVJLNAOUTK-MNOVXSKESA-N 345.168 1.929 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@H](O)[C@H]3C4)c(Br)cc2[C@@H]1O 2177183018 FTYCVHZLBYNCJY-JRSMDPTOSA-N 339.189 1.394 10 10 EDCE CNCc1ccc(N2CCN(C3CC3)C(=O)C2)cc1Br 2170581581 PPWVFYMOKYZIOW-UHFFFAOYSA-N 338.249 1.980 10 10 EDCE CC(C)(O)[C@H]1CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2191157889 VGPJHDNPMCDNIX-NEPJUHHUSA-N 341.205 1.784 10 10 EDCE CN(C(=O)[C@]1(CO)CCCN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2080649395 DYQMCQVTWIMBLD-GOSISDBHSA-N 349.431 1.994 10 10 EDCE NCc1cc(F)c(N2CCCC2(CO)CO)cc1Br 2089907785 NLYLAIBKSBRCIS-UHFFFAOYSA-N 333.201 1.371 10 10 EDCE OCC[C@H]1CN(c2ccc(CO)c(Br)c2)C[C@H]1CO 2093502367 YCGGJOHRJOTTNE-JQWIXIFHSA-N 330.222 1.369 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2CCN(C)c3ccccc32)c1 110474387 WLSLKRZKIXRADI-BQYQJAHWSA-N 336.395 1.937 10 10 EDCE CNCc1ccc(OC)c(Cn2cc(Br)cnc2=O)c1 2240998927 BBTWVPWKWISYSB-UHFFFAOYSA-N 338.205 1.782 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(O)(CCO)C2)c(Br)c1 2270655881 IWDZLQUIMRJHMW-JTQLQIEISA-N 329.238 1.663 10 10 EDCE O=C1NC(=S)N(c2ccccc2F)C(=O)C1=CNN1CCCCC1 2296930186 FRBSCEFIRZGSDK-UHFFFAOYSA-N 348.403 1.448 10 10 EDCE O=C(O)CN1C(=O)C(=C2C(=O)Nc3ccc(F)cc32)SC1=S 2297365248 DMJGNHJLNTYYCN-UHFFFAOYSA-N 338.341 1.434 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N1CC[C@H](CN=[N+]=[N-])C1 2303236281 CZODPBSCTQCOPZ-GFCCVEGCSA-N 341.412 1.765 10 10 EDCE CN1CCO[C@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@H]21 1235057694 AXCNVSWVOVJQRL-OLZOCXBDSA-N 345.212 1.809 10 10 EDCE O=S1(=O)C[C@H]2CN(Cc3ccc(Br)cc3O)C[C@@H]21 2314955704 JVZXQUJABNTFIM-SKDRFNHKSA-N 332.219 1.384 10 10 EDCE Cc1ccc(CN[C@H]2CCO[C@H]2C(N)=O)c(O)c1Br 2352673707 YKGSBVWMXBKEKP-JOYOIKCWSA-N 329.194 1.196 10 10 EDCE C[C@@H](O)CCCNCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1267137127 MBNKTPNDBSNPOQ-GFCCVEGCSA-N 335.408 1.672 10 10 EDCE O=C1NN(c2ccc(F)cc2)C(=O)/C1=C/c1cccc([N+](=O)[O-])c1O 33423809 JXDSWZMSVUEUDO-XYOKQWHBSA-N 343.270 1.901 10 10 EDCE NC(=O)C[C@H]1CCCCN1Cc1ccc(N2CCOCC2)c(F)c1 92588666 FJSSSQSVVPLVTJ-OAHLLOKOSA-N 335.423 1.892 10 10 EDCE C[C@H]1CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C[C@@H](C)N1 255331078 DQBNZGJLRZXQMP-QVOOOWOGSA-N 329.444 1.745 10 10 EDCE COc1cc(O)c(CN2CCC[C@@H](c3ccnc(N)n3)C2)cc1OC 377702701 UNUXUFNXJIIIOR-GFCCVEGCSA-N 344.415 2.161 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H]3CO4)c(Br)cc21 387236010 AKPZDQBIXNUQDO-HHURGBBESA-N 338.205 1.639 10 10 EDCE COCCNC(=O)CN(C)c1ccc([C@H](C)N)c(Br)c1 723185091 HCUQNBBXAGFXJE-JTQLQIEISA-N 344.253 1.668 10 10 EDCE O=C1NCC2(CN(Cc3ccc(N4CCCCC4)c([N+](=O)[O-])c3)C2)O1 817417840 SPNSUGIYFWKZIL-UHFFFAOYSA-N 346.387 1.879 10 10 EDCE COC[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)C(=O)O 826140015 VBZKSQSCKIKDNF-MRXNPFEDSA-N 330.384 1.852 10 10 EDCE COC[C@@]1(C(=O)OC)CCCN1Cc1ccc(N2CCOCC2)cc1 827489543 SDIUARSEWFEBME-LJQANCHMSA-N 348.443 1.677 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H](C[C@@H]2CCCO2)C(=O)O)cc1 908759103 YUUBZYMCFAGNNH-GJZGRUSLSA-N 335.404 1.574 10 10 EDCE C[C@@H]1CCNC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 842213923 PJGYSCFVRDYDKM-PBHICJAKSA-N 344.459 1.017 10 10 EDCE CN(Cc1ccccc1O)C(=O)NC[C@@H]1CCN1C1CCOCC1 927646511 PRPCCHFXPJMNSQ-INIZCTEOSA-N 333.432 1.787 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCNC(=O)CC(C)C)C2)cc1 855231438 MQKSXSWQSNEPRI-OAHLLOKOSA-N 347.459 1.943 10 10 EDCE CNc1cnc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cn1 858666479 DJDVKQCWZOKPEF-UHFFFAOYSA-N 341.415 1.879 10 10 EDCE C[C@H](NC(=O)NCCCCCS(C)(=O)=O)c1ccccc1O 868517694 ZTBYIOVFFSHIET-LBPRGKRZSA-N 328.434 1.967 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@H](N4CCCCC4)C3)cc2N1 761894315 IJZCIVQPBVHZPJ-GFCCVEGCSA-N 346.387 1.990 10 10 EDCE CN(C)c1nc(O)cc(C(=O)NCc2c(O)ccc3c2CCCC3)n1 765424341 QXPRTWZTBXJPJU-UHFFFAOYSA-N 342.399 1.763 10 10 EDCE CC(=O)c1cc(F)cc(CN[C@H]2C(=O)NCC23CCOCC3)c1O 933040008 YCERYJJVKQMPQC-HNNXBMFYSA-N 336.363 1.119 10 10 EDCE Cn1cc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nn1 783296293 MJNUCIFRLSSZRM-HNNXBMFYSA-N 345.403 1.412 10 10 EDCE Cc1cc(C)c(O)c(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)c1 795654621 UQYFIJJKFNGYFQ-HNNXBMFYSA-N 326.462 1.865 10 10 EDCE COC(=O)CN(CCC(F)(F)F)C(=O)Cc1ccc(O)c(O)c1 1149463702 XXOKUZHPHHNFEG-UHFFFAOYSA-N 335.278 1.594 10 10 EDCE COC(=O)[C@H](COC1CCC1)N(C)C(=O)c1ccc(C)c(O)c1O 1150789418 HFEHLRAMGKKNCE-ZDUSSCGKSA-N 337.372 1.589 10 10 EDCE COc1ccc(CNC(=O)c2ncccc2S(C)(=O)=O)c(O)c1 1155574565 LWNBKZMZPIJIJV-UHFFFAOYSA-N 336.369 1.129 10 10 EDCE C[C@H](NC(=O)c1ccc(CS(N)(=O)=O)cc1)c1ccccc1O 1302532421 BPYROOFGSMCVDS-NSHDSACASA-N 334.397 1.672 10 10 EDCE C[C@H](NC(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1)c1ccccc1O 1171730924 RZXLPPMCRNURMM-VIFPVBQESA-N 325.324 1.413 10 10 EDCE O=S1(=O)C[C@@H]2C(CNCc3cccc(Br)c3O)[C@H]2C1 2117988672 QDMGWYGGFXDUMG-GHMZBOCLSA-N 346.246 1.535 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2CCC(=O)NC2)cc1C 1268803039 ZPLXTFBBGAXWHA-MRXNPFEDSA-N 347.459 1.468 10 10 EDCE C[C@@H](NC(=O)Cn1c(=O)n(C)c2ccccc21)c1ccccc1O 1471196393 ZQSADRNJBOVZCJ-GFCCVEGCSA-N 325.368 1.923 10 10 EDCE CCCNC(=O)CNC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1716466465 LBCUCWTTWHVRJT-NSHDSACASA-N 348.407 1.083 10 10 EDCE CCOC(=O)C[C@H](CO)NC(=O)c1cc2cc(O)c(O)cc2s1 1625388292 WSULENUQFQTOOK-SECBINFHSA-N 339.369 1.356 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1CCCC(=O)N1 1482933137 ZXEKVWYHNNYSAM-MRXNPFEDSA-N 347.459 1.610 10 10 EDCE CCn1ccnc1C(=O)NC[C@@H](CO)NCc1ccc(OC)c(C)c1 1725542784 UVQFWOCGJWDGTF-HNNXBMFYSA-N 346.431 1.101 10 10 EDCE COCCc1noc(CN(C)C(=O)c2ccc(N=NC(N)=O)cc2)n1 1566415486 LLYVHDSFXOFJSZ-UHFFFAOYSA-N 346.347 1.693 10 10 EDCE COCC(=O)N(C)C[C@@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1739766912 LNAXKHVVKAIWRS-ZDUSSCGKSA-N 347.375 1.168 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)NCc1cc(O)ccc1O 1644754063 PUWQUDPJTPOUTG-NHAGDIPZSA-N 348.399 1.827 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCO[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1 1772918002 KPXVKMLUTPZMKS-IVZVJUQRSA-N 348.355 1.777 10 10 EDCE C[C@H](N)c1ccc(N2CC(=O)NC(=O)[C@H]2C)cc1Br 235503704 OWEPYTCBFNIBEV-JGVFFNPUSA-N 326.194 1.320 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985102850 MRLWDJRPISUSAS-GMTAPVOTSA-N 325.369 1.437 10 10 EDCE CN(CCOc1ccc(N)cc1)C[C@@H](O)CNC(=O)OC(C)(C)C 1999432587 RLCSAICUYPYDIM-AWEZNQCLSA-N 339.436 1.465 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2010405581 JIGRERHYNPAJIN-RYUDHWBXSA-N 339.396 1.827 10 10 EDCE CNCc1ccc(N2CC[C@H]3C(=O)NC[C@@H]3C2)cc1Br 2157170491 BCXWVEUCQYKJJC-DGCLKSJQSA-N 338.249 1.741 10 10 EDCE CCN(CCS(C)(=O)=O)c1ccc(CN)c(Br)c1 688593273 OYJLXNQYCMMXAR-UHFFFAOYSA-N 335.267 1.779 10 10 EDCE CN(CCCCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 385234569 KCLUYHAOHUMLCY-LBPRGKRZSA-N 328.210 1.610 10 10 EDCE CCNCc1ccc(N2CCOC[C@@H](O)C2)cc1Br 399942989 RGKXXWDDFJLAEB-ZDUSSCGKSA-N 329.238 1.756 10 10 EDCE CC(C)(C)OC(=O)N1CCC12CN(CC(=O)Nc1ccc(N)cc1)C2 2044674191 DJYKCOKKVNTENC-UHFFFAOYSA-N 346.431 1.903 10 10 EDCE CO[C@@H]1CN(c2ccc(CO)c(Br)c2)[C@@H]2COC[C@H]12 2102137616 QEDUTWRDNXGUJW-IACUBPJLSA-N 328.206 1.791 10 10 EDCE CS(=O)(=O)C[C@@H]1CCN(c2ccc(CN)c(Br)c2)C1 2087365509 XBBIKXGXBHPNBE-SNVBAGLBSA-N 347.278 1.779 10 10 EDCE Cn1nnc(Br)c1CNC(=O)Nc1ccc(N)cc1 2089345339 IOVTYJXODGXFNE-UHFFFAOYSA-N 325.170 1.482 10 10 EDCE NCc1ccc(N2CC(=O)N[C@@H]3CC[C@H]32)c(F)c1Br 2112067710 WFWYMDGTVYIYJV-RKDXNWHRSA-N 328.185 1.514 10 10 EDCE C[C@@]1(C(=O)O)COCCN1Cc1cc(Br)cc(F)c1O 2201207769 XGCLPESGVDLOGX-ZDUSSCGKSA-N 348.168 1.969 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-])C1COC1 2213585026 JSXUUJBZPKBXRE-WOPDTQHZSA-N 339.396 1.874 10 10 EDCE OCc1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2228394847 IUVOOJBTHXZPSS-TXEJJXNPSA-N 330.222 1.369 10 10 EDCE CC(C)CN1C(=O)C(=CNc2ccc3[nH]ncc3c2)C(=O)NC1=S 2295113179 FXNPXEUDXOOCMX-UHFFFAOYSA-N 343.412 1.758 10 10 EDCE CCN1C(=O)C(=C2SC(=S)N(CC(=O)O)C2=O)c2ccccc21 2293031351 AACAAUQRMCLPLB-UHFFFAOYSA-N 348.405 1.709 10 10 EDCE COc1cc(N2CCCC2)c(OC)cc1C=C1NC(=S)NC1=O 2297461765 VSPILHCSSFVETN-UHFFFAOYSA-N 333.413 1.649 10 10 EDCE CCOC(=O)C[C@H](C)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2299585407 CKWLQCCHTUBQDG-HNNXBMFYSA-N 346.427 1.994 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@]1(CO)CCCN1C(=O)OC(C)(C)C 2300526701 WDNGZMHNDBZCIG-OAHLLOKOSA-N 341.412 1.907 10 10 EDCE COCCN(CCOC)C(=O)[C@@]12CC[C@@](C)(C(=O)C1=O)C2(C)C 8236774 UOGJSZCCCLYZOT-DLBZAZTESA-N 325.405 1.072 10 10 EDCE CC1=NN(c2ccccc2)C(=O)/C1=C\NNc1nnc(C)c(O)n1 101972533 QXFKEPHBURJYFT-WQLSENKSSA-N 325.332 1.109 10 10 EDCE CN1CCN(Cc2cc(Cn3ccnc3)c3cccnc3c2O)CC1 59500524 PHCHAMGQFZENRV-UHFFFAOYSA-N 337.427 1.933 10 10 EDCE CN(C)c1ccc(CNc2ncc([N+](=O)[O-])cc2C(N)=O)cc1F 301077282 DIZMHQYCPYIWLS-UHFFFAOYSA-N 333.323 1.906 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3nccs3)nc12 184390273 MNPKFWSTGGFGCH-SECBINFHSA-N 347.400 1.919 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H](C)N1CCCCC1=O 193785686 QIQDMWPHTFJIGQ-CHWSQXEVSA-N 334.416 1.936 10 10 EDCE COc1cc([N+](=O)[O-])cc([C@H]2N[C@H](C(=O)O)C(C)(C)S2)c1O 83236941 ZLUBVFJCYFVRGW-MNOVXSKESA-N 328.346 1.876 10 10 EDCE Cc1cccn2c(=O)c(C(=O)NCCc3ccc(O)c(O)c3)cnc12 91075335 PAIDOVJQZFEULG-UHFFFAOYSA-N 339.351 1.387 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCN(c3cccnn3)CC2)c1O 278186922 HMHUQCBIBRPNHV-UHFFFAOYSA-N 345.359 1.421 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@H](NCc2ccc(N3CCOCC3)cc2)CC1=O 377836587 CKHBMGUSMHAMRT-KYJSFNMBSA-N 329.444 1.622 10 10 EDCE CCCC1(O)CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 384010561 VMGYJFSJENKDFH-GFCCVEGCSA-N 340.221 1.752 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](C)c1c(C)nn(CC(F)(F)F)c1C 808534493 ODJQWGDGQXAMKQ-ZETCQYMHSA-N 334.294 1.867 10 10 EDCE Cc1ccc(Cn2c(=O)cc(O)n(C)c2=O)c(O)c1Br 2380772618 NIRRVRYYPVSIKL-UHFFFAOYSA-N 341.161 1.077 10 10 EDCE NC(=O)c1cc(C(=O)NCc2cc(Br)ccc2O)c[nH]1 804736982 HKLCSQAMXUUKIC-UHFFFAOYSA-N 338.161 1.512 10 10 EDCE COCC[C@H](COC)NC(=O)NCc1ccc2c(c1)CCCN2C 811958582 UYBMKRXEXKBISA-MRXNPFEDSA-N 335.448 1.920 10 10 EDCE COc1ccc(N2CCN(CCNC[C@H](O)C(F)(F)F)CC2)cc1 818982386 LNLNQQDJGNNMDJ-HNNXBMFYSA-N 347.381 1.330 10 10 EDCE COC(=O)NCCNC(=O)NCc1cc(Br)ccc1O 836650604 XAKXLUBQWULOES-UHFFFAOYSA-N 346.181 1.310 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CCC[C@@H]1O 745337234 PFQMTFKDUBFXLO-HOTGVXAUSA-N 334.416 1.415 10 10 EDCE COc1ccc(N2CCCN(Cn3nc(C)n(C)c3=O)CC2)cc1 844690537 XBORNPZFZIOAMN-UHFFFAOYSA-N 331.420 1.069 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CC[C@@H](C(=O)O)O3)C2)cc1 849182609 HAPSCASXDYKPQT-GLQYFDAESA-N 334.372 1.022 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCn4nncc4C3)C2)cc1 852448453 JGGXXBOHDHISTO-CYBMUJFWSA-N 342.403 1.091 10 10 EDCE CC(C)[C@H](N)CCNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 851687032 YDSHQUBZJFPUQN-CZUORRHYSA-N 334.464 1.419 10 10 EDCE Nc1ncc2c(n1)CN(Cc1ccc(N3CCOCC3)cc1)CC2 930999955 JWNLJFPGBZDPDM-UHFFFAOYSA-N 325.416 1.454 10 10 EDCE O=C1N[C@H](C(=O)NCc2cc(Br)ccc2O)CCO1 861687404 OHDXZHRDLLWJIF-VIFPVBQESA-N 329.150 1.269 10 10 EDCE CNC1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 1118042974 GUPQSLYPPVDJMS-ZDUSSCGKSA-N 332.448 1.140 10 10 EDCE O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1Cc2cccc(O)c2C1 871203568 CFSVRFYIAWJCCM-NSHDSACASA-N 328.290 1.788 10 10 EDCE Cc1nocc1CNCc1ccc(N2CCC(C(N)=O)CC2)cc1 886325092 SZRODYOENPIXNQ-UHFFFAOYSA-N 328.416 1.975 10 10 EDCE C[C@@H]1C[C@@H]1[C@H]1C[C@H]1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 899414304 QYPSIGQOQZRFLE-URBCHYCLSA-N 338.429 1.786 10 10 EDCE COC(=O)[C@@H]1C[C@@H]2C[C@H](NC(=O)NCc3ccc(OC)cc3O)[C@@H]2C1 897728562 IKLQMBMPMWGWIA-GBOPCIDUSA-N 348.399 1.788 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1[C@@H]2CCCO[C@@H]21 780325547 HIINCMMOZJXTQP-KSZLIROESA-N 330.428 1.907 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)C[C@H]2CO)cc1Br 698118139 XKMGELCTYAXRFF-ADEWGFFLSA-N 329.238 1.661 10 10 EDCE O=C1CCCN1C1CN(c2ccc(CO)cc2Br)C1 2125805250 PRSSVRXJPUKECQ-UHFFFAOYSA-N 325.206 1.752 10 10 EDCE COC(=O)[C@H]1C[C@@H](O)CN1Cc1cc(C)cc(Br)c1O 1320674006 DHCHCEZJTGLWSU-ZYHUDNBSSA-N 344.205 1.571 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H](C)n2cncn2)cc1C 1331426790 KJQJFYIBOJOFOK-LSDHHAIUSA-N 345.447 1.793 10 10 EDCE CC1(C)C[C@@H](O)[C@@H](O)CN1c1ccc(CN)c(Br)c1 2132116374 PWSXFJAMZDVPEU-OLZOCXBDSA-N 329.238 1.618 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2c[nH]nc2C)cc1C 1278792155 RGFIVMFTTQRDGX-OAHLLOKOSA-N 346.431 1.258 10 10 EDCE Cc1cc(O)nc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 1299777331 XIQLKVAOXOEDRT-UHFFFAOYSA-N 337.357 1.425 10 10 EDCE CC1(C)[C@H](O)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2136627676 BGOMPNULTPCNES-GHMZBOCLSA-N 326.194 1.361 10 10 EDCE CN(C)CCn1cc(NC(=O)c2ccc(N=NC(N)=O)cc2)cn1 1639244564 WIRKQVBJYXLBQH-UHFFFAOYSA-N 329.364 1.859 10 10 EDCE CCOC(=O)c1ccc(C(=O)NCc2c(O)cccc2O)nc1C 1639289499 RMPCKKKKRRSQRT-UHFFFAOYSA-N 330.340 1.908 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccc2c(c1)C(=O)NCCO2 1631510462 PYBQFVXMYOKNOJ-UHFFFAOYSA-N 342.351 1.193 10 10 EDCE CNC(=O)C1(C(=O)N(C)CCCNCc2ccc(OC)c(C)c2)CC1 1569248628 XLVMQCOJUGZZQW-UHFFFAOYSA-N 347.459 1.468 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H](C)c2ccco2)cc1C 1568579461 BOVAOOJGNRANKX-HOCLYGCPSA-N 346.427 1.967 10 10 EDCE COc1ccc(-n2nnnc2CNC2(CNC(=O)C(C)C)CC2)cc1 1569391450 IDCMQKRFUHXTQW-UHFFFAOYSA-N 344.419 1.065 10 10 EDCE C[C@H](CN(C)C[C@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1669936407 OAMVRKZKEWUDGD-CHWSQXEVSA-N 347.419 1.936 10 10 EDCE Cc1noc([C@@H]2OCC[C@@H]2NC(=O)N[C@H](C)c2ccccc2O)n1 1674935985 ZSWSGNSUDXGQHF-LJWDBELGSA-N 332.360 1.974 10 10 EDCE COC(=O)c1ccc(NC(=O)CN2C(=O)[C@@H](C)SC2=S)cc1 11635508 IJMOEOWUTBCLNL-MRVPVSSYSA-N 338.410 1.661 10 10 EDCE CN(C)[C@H](CNC(=O)c1cc(O)c(O)c(O)c1)c1ccc(O)cc1 1865876016 MTJKYKLGZUCBNV-CYBMUJFWSA-N 332.356 1.542 10 10 EDCE CS(=O)(=O)N1CC(NCc2cc(Cl)cc(Cl)c2O)C1 1964592905 APDMBOOUZAPQDQ-UHFFFAOYSA-N 325.217 1.432 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)[C@@H]1CCCO1 2004956443 DWADSJIEVKIBBV-AUZPSNTRSA-N 340.420 1.324 10 10 EDCE COCCC1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2152248859 QNNXZLSKSCCVOO-ZDUSSCGKSA-N 340.221 1.874 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010389958 WJLLWSLKUFDELK-WDEREUQCSA-N 343.384 1.759 10 10 EDCE CCN[C@H](C)c1ccc(N(C)C(CO)CO)cc1Br 311803754 ZZULOSICFCTUDG-SNVBAGLBSA-N 331.254 1.909 10 10 EDCE CN(C)CCN(CC(=O)O)Cc1c(O)cccc1Br 706649215 HQBWOXFLNOPROS-UHFFFAOYSA-N 331.210 1.603 10 10 EDCE CN[C@H](C)c1ccc(N2CCC(CO)(CO)C2)cc1Br 694726406 GXJYZARJBCYXNV-LLVKDONJSA-N 343.265 1.911 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H](N4CCCC4)CC3)c2n1 2064650752 BYJIMQKQZIKYML-AWEZNQCLSA-N 343.431 1.834 10 10 EDCE CNCc1ccc(N2CC(N3CCOCC3)C2)cc1Br 2169498150 IRDCVMBHGOTFBC-UHFFFAOYSA-N 340.265 1.689 10 10 EDCE CN(C(=O)CN1CC(C)(NC(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2047097594 SODGBWGHKZXBJK-UHFFFAOYSA-N 348.447 1.831 10 10 EDCE Oc1c(Br)cccc1CNCC1CN(C2COC2)C1 2114708925 WTBATZSJHGZZBI-UHFFFAOYSA-N 327.222 1.575 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213584404 CXXCWAVJCIRJQV-SRVKXCTJSA-N 340.428 1.789 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@@]2(C)CO)c(OC)c1Br 2234881155 OOVBMCKOUKOVLY-XPTSAGLGSA-N 346.221 1.788 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H](O)C[C@H]2CN)c1O 2227742782 JVUSGMSMQXGWPV-IUCAKERBSA-N 331.210 1.057 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3C[C@@H]3[C@@H]2CN)c1O 2227742868 KVANISKKKKWZRU-AUTRQRHGSA-N 327.222 1.942 10 10 EDCE CCN1CC[C@@H](CNC(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2297505929 ZHNZPHURDNWIOD-SFHVURJKSA-N 343.471 1.994 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)C(=Cc2ccc(O)cc2)SC1=S 2323832184 UNFWTFNQPRTFDA-VIFPVBQESA-N 325.367 1.039 10 10 EDCE Cc1ccc(CNS(=O)(=O)N2CCC2)c(O)c1Br 2327589157 NIKWXOXYHZKSIH-UHFFFAOYSA-N 335.223 1.503 10 10 EDCE Cc1ccc(CN2C[C@H](N)[C@@H]3COC[C@@H]32)c(O)c1Br 2352674873 ABAXBHIZBQBMQE-SRVKXCTJSA-N 327.222 1.621 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2358208405 UEOTVNLBCAGXMR-IOEYQFCTSA-N 347.228 1.609 10 10 EDCE CNC(=O)[C@H]1CCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C1 817171211 RONUATGMDFKOCP-HOCLYGCPSA-N 346.475 1.770 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3cc(Cl)c(F)cc3O)C[C@@H]12 827389630 PFADOQFHJUHWGT-FZZIBODNSA-N 349.811 1.429 10 10 EDCE CC[C@H](NCCS(=O)(=O)N=S(C)(C)=O)c1ccc(C)cc1O 903224684 AEGWIFKUNJKGHP-ZDUSSCGKSA-N 348.490 1.799 10 10 EDCE COc1ccc(N(C)CCN(C)S(=O)(=O)c2cscn2)cc1 845988121 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IQNMCOABSXSWBV-ZDUSSCGKSA-N 337.383 1.747 10 10 EDCE CCOC[C@H](C(=O)OC)N(C)Cc1ccc(N2CCOCC2)cc1 930062529 MKDALRMRODJADL-QGZVFWFLSA-N 336.432 1.533 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2cc(OC)c(C)cc2O)C1 863341889 WHXWCBXXOFUGCC-CYBMUJFWSA-N 342.461 1.470 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC[C@H]3C(F)F)CC2)cc1 931416053 FUEHKDSTBHGYDJ-HNNXBMFYSA-N 339.386 1.683 10 10 EDCE CCn1nc(C)c(CN(C)C(=O)C(=O)Nc2ccc(N)cc2)c1C 868261776 UBBAQHKPIYUKHD-UHFFFAOYSA-N 329.404 1.699 10 10 EDCE CCN(CCS(C)(=O)=O)C(=O)c1cc2cc(O)c(O)cc2s1 897178699 CZVLPXGLUMVDIF-UHFFFAOYSA-N 343.426 1.819 10 10 EDCE O=C1NCC2(CN(Cc3cc(Br)cc(F)c3O)C2)O1 895036682 OQZPAUXQPPIDHY-UHFFFAOYSA-N 331.141 1.588 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)N[C@H](C)C2(S(C)(=O)=O)CC2)c1 797069579 HEBIXEMIUQMPHT-GHMZBOCLSA-N 341.429 1.795 10 10 EDCE OCCN[C@@H]1CCCN(Cc2cc(Br)ccc2O)C1 708637737 WUPQDEJVAXZZFQ-CYBMUJFWSA-N 329.238 1.701 10 10 EDCE COCCNC(=O)CCNCc1ccc(Br)cc1O 691500143 BSTHPOGKAMSCNP-UHFFFAOYSA-N 331.210 1.397 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCCC[C@H]1N1CCOCC1 1149533148 FRXNSNZQWCXVQO-LSDHHAIUSA-N 334.416 1.400 10 10 EDCE O=C(CCn1nnc2ccccc2c1=O)NCc1c(O)cccc1F 1303878586 NWUFZBOZQISRMM-UHFFFAOYSA-N 342.330 1.343 10 10 EDCE NC(=O)[C@@H]1OCC[C@@H]1NCc1cc(Br)cc(F)c1O 2117459075 ISHVUMAPESULCG-GXSJLCMTSA-N 333.157 1.026 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C(C)(C)NC(C)=O)cc1C 1322023076 DMNMJXOXYIZEJM-ZDUSSCGKSA-N 335.448 1.513 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cccs2)cc1C 1320187207 ODYJPYBSOYPJBQ-AWEZNQCLSA-N 334.441 1.946 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2C3CCC2(CO)CC3)cc1F 1332657560 RGOHSXPNYOUERU-UHFFFAOYSA-N 349.406 1.024 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)CC(C)C)C2)cc1 1261700659 MCIFOBNPOVVKGA-HUUCEWRRSA-N 347.459 1.941 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H](n3ccnn3)C2)cc1 1626976958 ISEBOPIEULKFEZ-ZDUSSCGKSA-N 327.348 1.918 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)Cc2nonc2C)cc1C 1485210084 NEAVBSMLCZFWSX-QWHCGFSZSA-N 346.431 1.921 10 10 EDCE Cn1ncc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1N 1625657863 XIWYUGGEMOYFCY-UHFFFAOYSA-N 333.355 1.964 10 10 EDCE CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1cccc(O)c1 1566358540 GKCHTCLNUKKWSI-QGZVFWFLSA-N 345.351 1.767 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2coc(C)n2)cc1C 1571427460 PUMWYFIJDRLXSB-CQSZACIVSA-N 333.388 1.181 10 10 EDCE COCCNC[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1C 1733557997 GIVDGFFBSATXAI-JSGCOSHPSA-N 347.419 1.793 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1COCCO1 1668368045 MVRNDTNZOOVPHN-KRWDZBQOSA-N 336.432 1.357 10 10 EDCE Cn1ncc(Br)c1CNC(=O)NCc1ccccc1O 1675166799 BEHZAJMUUSKJAL-UHFFFAOYSA-N 339.193 1.888 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)C2(C(N)=O)CC2)C2CC2)cc1C 1670512750 PBCHUPOZXWXKMI-OAHLLOKOSA-N 345.443 1.254 10 10 EDCE COc1ccc(CNCC[C@@H]2CCCCN2C(=O)CC(N)=O)cc1C 1698910992 YWCQFEZEXRJOMK-INIZCTEOSA-N 347.459 1.740 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNCc1ccc2c(c1)CCO2 1876123532 RSIKYWFWXHHTKG-GOSISDBHSA-N 336.432 1.987 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1(NC(=O)OC(C)(C)C)CC(O)C1 1900613453 YLSPURHVEZEZSS-UHFFFAOYSA-N 327.385 1.563 10 10 EDCE C[C@H](O)c1ccc(N2CCOC[C@H]2[C@@H](O)CO)cc1Br 2146324239 TYDZYTQNNJTNFW-HERUPUMHSA-N 346.221 1.061 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 1985103538 WXVBKYCYAWQGNC-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC(N=[N+]=[N-])CC1 1990024935 YHZIWFYWXMHQAH-NSHDSACASA-N 327.385 1.563 10 10 EDCE C[C@@]1(NC(=O)C(F)(F)F)CCN(C(=O)Cc2ccc(N)cc2)C1 1999440531 HBPAWDPXMYFWSO-CQSZACIVSA-N 329.322 1.481 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC(N4CCC4)C3)c(Br)cc21 2152252320 YKLVZWMFWCIPLK-ZDUSSCGKSA-N 337.221 1.295 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(OC)(C(N)=O)C2)cc1Br 2161184333 XAZYVJFQACGGLZ-VIFPVBQESA-N 342.237 1.420 10 10 EDCE CNC(=O)CC1CN(c2ccc(CN)c(Br)c2F)C1 382068059 DVVJTNYRDJZGSS-UHFFFAOYSA-N 330.201 1.619 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C[C@@H]1O 387956508 FCQPWWKPXQUSIE-LNCSFIOASA-N 326.194 1.218 10 10 EDCE Cn1cc(Br)c(CNC(=O)COc2ccc(N)cc2)n1 393432735 QQLRMICAOSSTKM-UHFFFAOYSA-N 339.193 1.460 10 10 EDCE Oc1cc(Br)ccc1CNC[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@@H]2O 2174413698 PLZSZCKUIKHJMQ-JPXUEEETSA-N 342.233 1.622 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@@H](C)O[C@@](C)(C(F)F)C3)c2n1 2063585178 DHUGMGKFKHCMFS-RFAUZJTJSA-N 340.330 1.628 10 10 EDCE O=C1CO[C@@H]2CCN(c3ccc(CO)c(Br)c3)C[C@H]2N1 2185521778 KVCIMKJBKYRSOB-CHWSQXEVSA-N 341.205 1.035 10 10 EDCE Cn1c(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)cnc1CNC(=O)OC(C)(C)C 2060637274 JFFSMCLLSATNIV-SNVBAGLBSA-N 349.395 1.970 10 10 EDCE CCn1nnnc1CN(C)c1ccc(CNC)cc1Br 2196299954 FPMLASOOXJQUQF-UHFFFAOYSA-N 339.241 1.811 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2210528880 JVMBQVFZSHHVAD-OUAUKWLOSA-N 327.385 1.467 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213593608 XRLISTYTHFYEHZ-FIQHERPVSA-N 339.396 1.874 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(CCC(=O)N3)C2)c(Br)c1 2229683813 OKUSCIYVVGFQLC-SECBINFHSA-N 325.206 1.971 10 10 EDCE CN1C(=O)NC(=O)C(=Cc2cccn2-c2ccc([N+](=O)[O-])cc2)C1=O 2297329254 MTSWJDHXTLFKFI-UHFFFAOYSA-N 340.295 1.477 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N1CCC(N=[N+]=[N-])CC1 2303240287 JMEJRHGFBAZWKO-UHFFFAOYSA-N 341.412 1.907 10 10 EDCE Cc1ccc(C=C2SC(=S)N([C@H](CC(N)=O)C(=O)O)C2=O)o1 2314541303 JIDZLPNQALBHTH-MRVPVSSYSA-N 340.382 1.118 10 10 EDCE Cc1ccc(CN(C)CCOCC(N)=O)c(O)c1Br 2352664401 NXTCXQPLVBLKNP-UHFFFAOYSA-N 331.210 1.397 10 10 EDCE CN1C[C@H](NC(=O)NCc2ccc(N3CCCC3)cc2)CCC1=O 172357316 IASDWOBNTWQTNC-OAHLLOKOSA-N 330.432 1.707 10 10 EDCE CNCc1ccc(N2CC3(CC[C@H](CO)O3)C2)c(Br)c1 2361837017 KICOKOPFRMJXDO-GFCCVEGCSA-N 341.249 1.899 10 10 EDCE Cc1ccc(CC(=O)NCc2ccc(N3CCNC(=O)C3)cc2)cc1 46771552 YRIGIAKHBMXICX-UHFFFAOYSA-N 337.423 1.790 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@H](N4CCCC4)C3)cc2N1 91453333 MPXQVXXRUDIXAX-LBPRGKRZSA-N 346.387 1.990 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2[C@H]3[C@H]4CC[C@@H](C4)[C@H]23)c1 246878118 DMZQUDJWQNIKAM-WBRVRECLSA-N 336.413 1.538 10 10 EDCE CC(C)[C@@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(=O)O 255215608 MTLXEFDLBGAXAN-CTEOGUNLSA-N 332.400 1.762 10 10 EDCE COc1ccc(N=N[C@@H]2C(=O)NN=C2C2CCN(C(C)=O)CC2)cc1 254834019 QMTIUIILVXEZJB-INIZCTEOSA-N 343.387 1.892 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3cscn3)CC2)cc1 264058667 CHYXHNDZCLHBNJ-UHFFFAOYSA-N 346.456 1.704 10 10 EDCE CC[S@@](=O)c1ccccc1C(=O)N1CCS(=O)(=O)C(C)(C)C1 268441226 ZWFMMHAICPCQCU-OAQYLSRUSA-N 343.470 1.463 10 10 EDCE Cc1ccc(CNc2cnc(C(N)=O)nc2)c(O)c1Br 2381129915 RENLURSHHHPOQH-UHFFFAOYSA-N 337.177 1.964 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)C1(N2CCOCC2)CC1 631563101 ROUAZQYAYWHSFP-UHFFFAOYSA-N 331.416 1.343 10 10 EDCE C[C@@H]1C[C@@H](C(=O)O)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 398838349 JIBJLUVHODPBII-RKDXNWHRSA-N 335.316 1.473 10 10 EDCE CCOc1ccc(CN[C@H]2CCC[C@@H]2CNS(C)(=O)=O)c(O)c1 800309411 ITLUZCLKMMCZOK-DOMZBBRYSA-N 342.461 1.598 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3CC34CC4)nc12 817234720 CACRYXFTJFVLAH-NSHDSACASA-N 331.328 1.455 10 10 EDCE COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1C(=O)C(=O)Nc1ccc(N)cc1 841114550 DERDAUMPDAKMSA-GDLCADMTSA-N 331.372 1.007 10 10 EDCE Cc1cc(N2CC[C@@H](N3CCCc4cc(CN)ccc43)C2=O)n(C)n1 844219218 IWBMFBDCISJINK-QGZVFWFLSA-N 339.443 1.745 10 10 EDCE C[C@@H]1CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])CC[S@@](=O)C1 844220272 YIACVTOBXWAARW-OMDWBDPJSA-N 338.385 1.897 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)Cc1cncnc1OC 843413850 YSSUASDQLTXBAJ-UHFFFAOYSA-N 331.372 1.756 10 10 EDCE C[C@H](N[C@H](CO)c1ccnn1C)c1ccc(N2CCOCC2)c(F)c1 858434620 LGILIRGYPSEXME-XJKSGUPXSA-N 348.422 1.780 10 10 EDCE COC[C@@]1(C)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 858865682 LZTMRUGVALTYMR-OAHLLOKOSA-N 337.332 1.167 10 10 EDCE CCN(CC)c1ccc(CNS(=O)(=O)[C@@H]2CCCNC2)cc1F 923607838 DLIXZPYJFHWQRH-CQSZACIVSA-N 343.468 1.843 10 10 EDCE O=C(NCc1c(O)cccc1F)NC1CCN([C@@H]2CCOC2)CC1 923322497 LXPRTIMFRFIKMG-CYBMUJFWSA-N 337.395 1.584 10 10 EDCE COC[C@H]1C[C@@H](O)CN1C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 854296511 JFDCLPKARXNGLG-FVQBIDKESA-N 349.431 1.065 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N3CCC[C@@H](C)C3)C2)cc1 855228239 YCVJFFUFHGOFQM-CABCVRRESA-N 345.443 1.649 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC[C@H]2CCCCO2)c1 754789249 DDUIAXWQGUBILF-GFCCVEGCSA-N 343.401 1.880 10 10 EDCE CO[C@@H]1C[C@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 930321022 BAIQGGNJJFARKQ-NUEKZKHPSA-N 331.416 1.039 10 10 EDCE C[C@@H]1C[C@@H](NC[C@]23COCCN2C(=O)OC3)c2c(O)ccc(F)c21 866520975 JDZBXRQHAIEYRS-ILMHXZGMSA-N 336.363 1.890 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCC3(CCC3)O2)cc1 1119485351 ASONDYIYLGGZEF-INIZCTEOSA-N 345.443 1.587 10 10 EDCE CN1CCN(c2ccc(CNC3CCC(C(N)=O)CC3)cc2)CC1 771849292 UDEFLJMNSFREKX-UHFFFAOYSA-N 330.476 1.572 10 10 EDCE Cn1ccnc1C1(O)CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 1123895244 RCDVGYYAQGCFOL-HWKANZROSA-N 343.383 1.355 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC(=O)NCc2ccco2)cc1 1136284834 DXBAXMAJDDCQHA-UHFFFAOYSA-N 329.316 1.488 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/[C@@H]1CCCO1 1331970234 HXOOXMAULHEQRX-AJKRIUKHSA-N 349.383 1.423 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 1900612650 LSBQMJGICZCBET-MNOVXSKESA-N 327.385 1.516 10 10 EDCE CNC(=O)CN(C)c1ccc(C=CC(=O)O)c(Br)c1 1911912680 JVULBXCEOYLULM-UHFFFAOYSA-N 327.178 1.729 10 10 EDCE COC(=O)c1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1OC 1446179626 DBGNINWJIRQVNK-UHFFFAOYSA-N 345.351 1.752 10 10 EDCE C[C@H](CS(C)(=O)=O)N(C(=O)Cc1ccc(O)c(O)c1)C1CC1 1443946400 NMUFXYVNEJTFGY-SNVBAGLBSA-N 327.402 1.064 10 10 EDCE COC(=O)c1cnc(SCC2(C(=O)OC)CCOCC2)s1 1459108950 YRBLEPXFGCOSDA-UHFFFAOYSA-N 331.415 1.992 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@@H]1CC(=O)N(c2ccccc2)C1 1451770346 PYSZGAQSFODQTO-CYBMUJFWSA-N 326.352 1.767 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCc1nc(-c2ccncc2)n[nH]1 1451598890 VNVAQTCTQXLOOO-DUXPYHPUSA-N 337.339 1.608 10 10 EDCE COc1cc(C(=O)NCc2ccc(O)cc2O)c([N+](=O)[O-])cc1OC 1469160888 WGPRVNVPNZJORK-UHFFFAOYSA-N 348.311 1.953 10 10 EDCE O=C(NCc1cccc(Cl)c1O)c1ccccc1-n1cnnn1 1472316332 NIERBPCXBHLSMT-UHFFFAOYSA-N 329.747 1.951 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCn2ncnc21 1626692830 CLAQVLHJRLLLMJ-MRXNPFEDSA-N 341.415 1.309 10 10 EDCE Cc1cc(CNC(=O)c2nccnc2C(N)=O)c(C)n1-c1ccccc1 1557887201 FZANYVDQDDSBFO-UHFFFAOYSA-N 349.394 1.913 10 10 EDCE O=C(Nc1c(-c2ccccn2)nc2ccccn12)C1CS(=O)(=O)C1 1556879422 NSWWEYXKVQPJSM-UHFFFAOYSA-N 342.380 1.379 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)CN2CCOCC2)cc1C 1725477763 CZQKWGYJFRTVDC-MRXNPFEDSA-N 349.475 1.272 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCc2ccccc2NC1=O 1644146310 SIYMDVMJVRKWIG-CQSZACIVSA-N 326.352 1.710 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2C(=O)N(C)Cc3ccccc32)c(O)c1O 1641677499 JYSYGTREMPZONL-AWEZNQCLSA-N 326.352 1.849 10 10 EDCE Cc1cc2c(N3CC(NC(=O)c4cccc(O)c4O)C3)nccn2n1 1648090041 WYJFGBBJOHHEEO-UHFFFAOYSA-N 339.355 1.068 10 10 EDCE CCn1cnnc1CCNC(=O)c1cc2cc(O)c(O)cc2s1 1585554263 JWTFKGGAPYOOOR-UHFFFAOYSA-N 332.385 1.896 10 10 EDCE COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(O)c1O 1583322740 LHCCZGLGYMKHCE-AWEZNQCLSA-N 327.336 1.838 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@]2(C)CCNC2=O)cc1C 1674233600 YETZSRNJWQGZPQ-IFXJQAMLSA-N 347.459 1.514 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCS(=O)(=O)C(C)(C)C2)c1O 155281806 GLQVYZZLHGTTHX-UHFFFAOYSA-N 329.393 1.743 10 10 EDCE COc1ccc(N2CCN(C(=O)C(C)(C)NC(=O)C(C)C)CC2)cc1 1862300008 PLXFXPWSQYFYJH-UHFFFAOYSA-N 347.459 1.895 10 10 EDCE C[C@H](NCc1ccc(N2CCN(C)CC2)c(F)c1)[C@H](O)C(F)(F)F 1118926291 HJBHUIZENVGPHU-NHYWBVRUSA-N 349.372 1.979 10 10 EDCE CN1C[C@H](C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)N(C)C1=O 1889664560 YYAJCSZQTKXNCQ-BHYGNILZSA-N 342.443 1.657 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)[C@H](CCO)C2)cc1Br 2149910912 BLJZTYRNVPJWGO-OLZOCXBDSA-N 343.265 1.596 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)c(Br)c1 2146313407 JTBBXLIYQYTPDU-COLVAYQJSA-N 342.233 1.684 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@@H]2OCCN(C(=O)OC(C)(C)C)[C@H]21 1985093789 FNBHSSKZICRSEZ-DCAQKATOSA-N 325.369 1.389 10 10 EDCE CC1(C)C[C@@H](O)CN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2154827022 BZJOELYCSKBINO-JMCQJSRRSA-N 341.205 1.784 10 10 EDCE CN(Cc1nc(=NCc2ccccc2O)[nH][nH]1)C(=O)OC(C)(C)C 2012985227 HABNYAUVCJHIFK-UHFFFAOYSA-N 333.392 1.911 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@H](CCO)NC(=O)OC(C)(C)C 2018032967 GAURMHKJSXGDPS-AWEZNQCLSA-N 337.420 1.503 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(C)c1O 2024805875 ULKYFDVGTIXVQO-CYBMUJFWSA-N 338.404 1.857 10 10 EDCE CCCNCc1ccc(N2C[C@H](O)C[C@@H](O)C2)cc1Br 2161358129 WWJBQOAPOZGXKN-ZIAGYGMSSA-N 343.265 1.881 10 10 EDCE NCc1cc(F)c(N2CCC[C@@H](CO)[C@@H]2CO)cc1Br 709806214 LAGMCIITHRASAT-XPTSAGLGSA-N 347.228 1.617 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCCc3nnn(C)c32)c1 2062455464 HYLVKTHLLWVQQI-ZYHUDNBSSA-N 330.388 1.827 10 10 EDCE C[C@@H](N=c1nc(CNC(=O)OC(C)(C)C)[nH][nH]1)c1ccc(O)cc1O 2063196335 QSBYJPADGABDPY-SECBINFHSA-N 349.391 1.836 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)Nc1ccc(O)cc1N 2089752873 MJSGRKWEAOUBMO-UHFFFAOYSA-N 347.194 1.271 10 10 EDCE CN(C)[C@@H]1CN(c2cc(Br)c(CN)cc2F)C[C@H]1O 2089923358 OGKKAFUEZNHPEX-CHWSQXEVSA-N 332.217 1.158 10 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327.226 1.670 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3CCSC3)C2)cc1 828083054 JYXKARDEHDZRJM-CHWSQXEVSA-N 349.456 1.012 10 10 EDCE C[C@H](NC(=O)c1cn([C@@H]2CC[C@H]2O)nn1)c1ccc(N(C)C)cc1 907494230 WPBMROLRGUOAJJ-IUIKQTSFSA-N 329.404 1.531 10 10 EDCE Cc1cc(CC(=O)NCCS(C)(=O)=O)c(C)n1-c1ccccc1 822445212 OOXKIYWWINUKSU-UHFFFAOYSA-N 334.441 1.797 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H](CN2CCOCC2)C1 588405033 IVOOGPVJHCKCSJ-LEXSJLIMSA-N 346.427 1.682 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CC[C@@H]4C[C@@H]4C3)ccc21 834677060 CYRUKIMXVPFQFA-DJIMGWMZSA-N 341.455 1.990 10 10 EDCE COc1cc(Br)cc([C@@H](C)NC[C@@H](O)CN(C)C)c1O 848527359 AFZJKPQKNMNITB-MWLCHTKSSA-N 347.253 1.736 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cn(C2CCC2)nn1 843775950 WWOQUSNWLHHXGF-UHFFFAOYSA-N 341.415 1.770 10 10 EDCE CC[C@@H](CNC(=O)C(=O)NCc1ccc(N(CC)CC)cc1)C(=O)O 927939992 BCRFMVFLZLIODR-AWEZNQCLSA-N 349.431 1.376 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@](C)(CO)C3CC3)C2)cc1 854300756 ZREFKNDNQGAINQ-RDTXWAMCSA-N 333.432 1.734 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)C(C)(C)n2cc(N)cn2)cc1 852792310 VKLIUYFMSAMUKL-HNNXBMFYSA-N 330.436 1.083 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3cnccn3)C2)cc1 854298730 APZXPFZJEOVCRR-CQSZACIVSA-N 341.415 1.906 10 10 EDCE COC[C@@]1(C)CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 860200319 SRQROEHUBWRBII-LJQANCHMSA-N 349.475 1.448 10 10 EDCE CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 875285304 UYEBMGUDKROTOP-ZDUSSCGKSA-N 345.443 1.757 10 10 EDCE COC(=O)c1c(CNC[C@@H]2COCCN2C)c2cc(F)ccc2n1C 895401898 DHKCXWWSCYBLEY-CYBMUJFWSA-N 349.406 1.524 10 10 EDCE CN[C@H](C)c1ccc(N2CCOC[C@H](O)C2)c(Br)c1 399840769 BXROAMXUBDXPBY-ZYHUDNBSSA-N 329.238 1.927 10 10 EDCE CCNCc1ccc(N2CCC(CO)(CO)C2)cc1Br 694680230 CGVYATDNANSTBC-UHFFFAOYSA-N 343.265 1.740 10 10 EDCE COC(=O)C[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccncc1 1300058908 AHOJXNLPANPNFZ-ZDUSSCGKSA-N 330.340 1.456 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCS(=O)(=O)C2(CCC2)C1 1156395049 AWALFCLSBDVOGD-GFCCVEGCSA-N 339.413 1.256 10 10 EDCE Cc1nc([C@@H]2CCN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)n[nH]1 1162028745 IFWGCJZXRIMFRE-LLVKDONJSA-N 327.348 1.905 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2c(C)ncnc2O)cc1C 1317623479 NJGYHITZYVJZAR-UHFFFAOYSA-N 344.415 1.669 10 10 EDCE COc1ccc(C(=O)NCc2c(O)cccc2F)cc1-n1cnnn1 1178412794 FTHUWWAEWHCLNI-UHFFFAOYSA-N 343.318 1.446 10 10 EDCE Oc1ccc(Br)cc1CN1CCO[C@H]2CCNC[C@H]21 2129072646 RWJFFBXEWNLYOO-OCCSQVGLSA-N 327.222 1.717 10 10 EDCE CC(=O)NC1CN(c2ccc(C=CC(=O)O)cc2Br)C1 1911934470 FXFKZGVNIVWZDA-UHFFFAOYSA-N 339.189 1.872 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(-c2ccn(C)n2)on1 1611431145 KZVQZGGMEXGDMR-JTQLQIEISA-N 342.355 1.847 10 10 EDCE CS(=O)(=O)Nc1ccccc1C(=O)NCc1c(O)cccc1O 1472064448 XGMVCDYJGTUCJO-UHFFFAOYSA-N 336.369 1.399 10 10 EDCE NC(=O)CSc1ccccc1NC(=O)Cc1ccc(O)c(O)c1 1540436945 VWFRWRXCSLBWIX-UHFFFAOYSA-N 332.381 1.856 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)Cc1ccn(C)n1 1480954549 CWODXALJRIRDFR-UHFFFAOYSA-N 343.391 1.444 10 10 EDCE CC(C)(C)[C@H](CNCCCO)NC(=O)c1ccc(N=NC(N)=O)cc1 1717974341 YYEKKQGCKMWJHN-AWEZNQCLSA-N 349.435 1.966 10 10 EDCE Cn1nnc2c1CC[C@@H](NC(=O)c1cc3cc(O)c(O)cc3s1)C2 1557237197 WFKFBCXLMMRTLA-SECBINFHSA-N 344.396 1.728 10 10 EDCE COc1ccc(CNC(=O)c2cccc(Nc3nn[nH]n3)c2)c(O)c1 1556354842 WEWOHSHBEBVCOF-UHFFFAOYSA-N 340.343 1.588 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1cncc(-n2ccnn2)c1 1640920787 WJEBAFLBLJHGGG-UHFFFAOYSA-N 329.747 1.951 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C[C@@H]2C=CCC2)cc(OC)n1 1737548519 AIQYSMUXCZUFKR-QWHCGFSZSA-N 347.415 1.690 10 10 EDCE COCCC(=O)N[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1578749456 UYAHLKAQGVSMTL-BETUJISGSA-N 347.375 1.263 10 10 EDCE COCCCCN1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1665235990 ZHXSJHDVMBCVIC-UHFFFAOYSA-N 333.392 1.690 10 10 EDCE CNCc1ccc(N2CC(=O)NC(=O)[C@H]2C)c(Br)c1 234423085 XANCUSHGTXTLPU-MRVPVSSYSA-N 326.194 1.020 10 10 EDCE CC(C)(C)OC(=O)NCCOCCNCc1cccc(O)c1O 1939420897 OJERAKUTHYFDJN-UHFFFAOYSA-N 326.393 1.729 10 10 EDCE CCOc1cccc(CNCCC(=O)NCc2ccncc2)c1O 1857859870 LACOOAJHFOZIOU-UHFFFAOYSA-N 329.400 1.982 10 10 EDCE O=C(CNCc1cc(Br)ccc1O)NCC(F)(F)F 238045973 KYGDBWOTNLSANS-UHFFFAOYSA-N 341.127 1.923 10 10 EDCE O=C1NC(=O)[C@@H](CCCNCc2c(O)cccc2Br)N1 2150333898 OISDRPXSSHVDDC-SNVBAGLBSA-N 342.193 1.233 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)NCCCCN=[N+]=[N-] 1985094588 QXVFQFRBGLLSFK-MNOVXSKESA-N 327.385 1.563 10 10 EDCE CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)CCN=[N+]=[N-] 1985103045 PMYQEDATGLUNRL-VIFPVBQESA-N 329.357 1.212 10 10 EDCE O=C(C[C@@]1(O)CCOC1)Nc1c(-c2ccccn2)nc2ccccn12 2064148848 MFVRZSFKZQBHLO-SFHVURJKSA-N 338.367 1.876 10 10 EDCE C[C@@H](c1cc(Br)ccc1O)N1CC[C@@]2(CNC(=O)N2)C1 2177680593 OHAXWWYNHRJNEE-LKFCYVNXSA-N 340.221 1.973 10 10 EDCE O=C1Nc2cc(N3CC(CCO)C3)c(Br)cc2[C@@H]1O 2095988642 NUVSFGHZCORBCI-LBPRGKRZSA-N 327.178 1.253 10 10 EDCE CNCc1ccc(N2CC[C@]3(C[C@H](O)CO3)C2)cc1Br 2201781011 SZTSVBIQJNPNLE-ZFWWWQNUSA-N 341.249 1.899 10 10 EDCE CC(=O)C(=O)[C@]1(O)CCC[C@@H]2CN(C(=O)OC(C)(C)C)CC[C@H]21 2210375911 ZLDMGJVTSOZSHL-XNJGSVPQSA-N 325.405 1.933 10 10 EDCE CNC(=O)[C@@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)C(C)C 2302416522 CIJYKEAVZUQRFE-SFHVURJKSA-N 345.443 1.423 10 10 EDCE Cc1ccc(CN(C)[C@@](C)(CN)C(=O)O)c(O)c1Br 2352652639 SRLWWCVXWGHEJT-ZDUSSCGKSA-N 331.210 1.697 10 10 EDCE Cc1ccc(CN(C)C(=O)CNCCO)c(O)c1Br 2352653336 ZKXQVDSUKQFIKW-UHFFFAOYSA-N 331.210 1.003 10 10 EDCE CNC[C@@H]1CN(Cc2ccc(C)c(Br)c2O)CCO1 2352677449 ACSBNHTVEDRHJO-GFCCVEGCSA-N 329.238 1.883 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)cc1Br 2357051976 DWQRSCAAJRNHQH-AMPPCDIJSA-N 342.233 1.965 10 10 EDCE CC(C)NCc1ccc(N2CC([C@H](O)CO)C2)c(Br)c1 2361908442 SOMJCZIGAYGPCV-OAHLLOKOSA-N 343.265 1.737 10 10 EDCE Cn1nccc1CCNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 185851067 IAWNFFLNASDRGD-QPJJXVBHSA-N 340.427 1.629 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(C[C@@H](C)O)CC2)c([N+](=O)[O-])c1 97299827 BZYJZDWMYRRWKP-RYWCDNDXSA-N 349.387 1.284 10 10 EDCE CC(C)NCc1ccc(N2CC(=O)NC(=O)C2)cc1Br 232693126 WLIGGFPSSPARCT-UHFFFAOYSA-N 340.221 1.410 10 10 EDCE CCC[C@@H]1C(=O)NCCN1c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 270844809 XJUORRDSUGTKAQ-IZPAUZPXSA-N 347.371 1.886 10 10 EDCE COc1ccc(O)c(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)c1 289345054 IKHBJQKSXGWTOV-CQSZACIVSA-N 328.434 1.257 10 10 EDCE Cc1ccc(CN2CC(=O)NC(C)(C)C2=O)c(O)c1Br 2380812034 RAJJKRYGAUHCFY-UHFFFAOYSA-N 341.205 1.700 10 10 EDCE CC(=O)C(=O)COC(=O)c1nn(-c2ccc(C)cc2)c2c1CCC2 808500822 BAKGEXQSNGTHRW-UHFFFAOYSA-N 326.352 1.984 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC(C)(C(=O)O)CC2)cc1 842940222 ZPWOGOHHFFYOQC-UHFFFAOYSA-N 333.432 1.556 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)[C@@H]4[C@H](O)CCCN4C3=O)C2)cc1 849356361 DUEIVTQHKSYJNC-IMJJTQAJSA-N 345.399 1.061 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCN(C)C(C)C)C2)cc1 852064050 JENNJPFUEQWHBG-HNNXBMFYSA-N 334.464 1.913 10 10 EDCE CCN1C[C@H](NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 852369241 TVBORRIOWZVQGA-ZIAGYGMSSA-N 346.431 1.194 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1 853987139 IVVRBQBNLIKJFH-ZDUSSCGKSA-N 349.431 1.725 10 10 EDCE CC[C@@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)CCN1CC(F)F 768466327 ZCCAZQBGSWMKGK-IUODEOHRSA-N 342.386 1.979 10 10 EDCE Cc1cnc(N)c(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)c1 766793639 SSWIQTOJTFZKEV-UHFFFAOYSA-N 346.456 1.833 10 10 EDCE CN(C)C(=O)CCN1CCN(Cc2c(O)ccc3ccncc23)CC1 760415168 RVBYEGQVBSJCFT-UHFFFAOYSA-N 342.443 1.536 10 10 EDCE NS(=O)(=O)C[C@@H]1CCCN1Cc1ccc(N2CCCCC2)cc1 769428242 ODTYDERLHWKIFM-KRWDZBQOSA-N 337.489 1.930 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CSC1(C)C 1117397998 WUSWDUQNMNSJHF-CQSZACIVSA-N 335.473 1.687 10 10 EDCE C[C@@]1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCCO1 894597901 RETSCXDFFFJWBM-IBGZPJMESA-N 345.443 1.574 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\[C@@H]1CCOC1 1138055451 YQWNWXQWPUKNGA-LJXYTEIVSA-N 349.383 1.281 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCCCCO)cc2)C1 1141996470 WERZMBPVCLGKTL-MRXNPFEDSA-N 347.459 1.557 10 10 EDCE NCc1cc(F)c(N2CCO[C@@H](CCO)C2)cc1Br 2116236084 JQSINQKCIMALLW-JTQLQIEISA-N 333.201 1.635 10 10 EDCE NS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(N3CCCC3)cc2)C1 1321180371 VDRUCCGIYWADHD-MRXNPFEDSA-N 337.489 1.787 10 10 EDCE N[C@H]1CC[C@H](C(=O)O)N(Cc2c(O)cccc2Br)C1 2132273884 NSPOTWVTZUYCPI-GZMMTYOYSA-N 329.194 1.531 10 10 EDCE NC(=O)c1cc(CNC(=O)c2cc3cc(O)c(O)cc3s2)on1 1465996853 LOJRHKKTKXPTPM-UHFFFAOYSA-N 333.325 1.329 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(c2cnn(C)c2)=NO1 1624955095 RLAVZYSGRIRQBJ-QFYYESIMSA-N 344.371 1.072 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cnn(C)c2OC)cc1C 1567596843 QVPHGJDQZKPDQG-UHFFFAOYSA-N 346.431 1.608 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2CCC(=O)N2)cc1C 1491992538 XHRUWLWVRQXNCC-DZGCQCFKSA-N 333.432 1.267 10 10 EDCE C[C@]1(CC(=O)NCc2c(O)ccc3ccccc23)CCS(=O)(=O)N1 1639388200 XZFLAOKYTFGVGT-QGZVFWFLSA-N 348.424 1.634 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2nccnc2N)cc1C 1732991611 JJUFZBKGLZYAOK-LBPRGKRZSA-N 329.404 1.284 10 10 EDCE CN(CCNC(=O)C1(C)CC1)C(=O)c1ccc(N=NC(N)=O)cc1 1737737748 MHZNYYRADFAIGI-UHFFFAOYSA-N 331.376 1.837 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@H](C)NC(C)=O)C(C)C)cc1C 1732554899 ODAQOZYCDCQHMS-YOEHRIQHSA-N 349.475 1.759 10 10 EDCE CCC[C@H](C)C(=O)NC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1744638019 LZXFAMCRGFKYMX-RYUDHWBXSA-N 337.420 1.770 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C[C@H]2CCNC2=O)cc1C 1669313284 SNSNPIYKPVDYJI-UKRRQHHQSA-N 333.432 1.124 10 10 EDCE COCCC(=O)N(C)CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1759535141 PGNLUKXULYKCDM-UHFFFAOYSA-N 349.391 1.416 10 10 EDCE Cc1noc(CCNC(=O)NCCCSc2nccs2)n1 153050819 AGWWSGPVDYQWAK-UHFFFAOYSA-N 327.435 1.859 10 10 EDCE Cc1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1-n1cnnn1 1860168805 QHDVQIZOYJJHIG-UHFFFAOYSA-N 339.355 1.354 10 10 EDCE CNCc1ccc(N2C[C@H](C)O[C@@H](CO)C2)cc1Br 234380612 OYGSTBDSNQJISA-GXFFZTMASA-N 329.238 1.755 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)c(Br)c1 2146307011 VTVNOJHMBODHDY-KMUNFCNLSA-N 341.249 1.650 10 10 EDCE COC(=O)Cn1nnnc1Sc1ncc(C(F)(F)F)s1 2156065162 FEJXWWRZNLJQMZ-UHFFFAOYSA-N 325.297 1.473 10 10 EDCE O=C(O)[C@]12COC[C@@H]1CN(Cc1c(O)cccc1Br)C2 2161010330 MQADTYPUVJXULM-LKFCYVNXSA-N 342.189 1.688 10 10 EDCE O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1cccc(O)c1O 702598331 DPWMJUWHIGFFGS-IBGZPJMESA-N 342.395 1.465 10 10 EDCE CN(C)C[C@H](O)CN(C)c1cc(Br)c(CN)cc1F 690204573 OQQMCNLDGNNNGO-JTQLQIEISA-N 334.233 1.406 10 10 EDCE CN1CCN(C(=O)[C@@H]2C[C@H](N=[N+]=[N-])CN2C(=O)OC(C)(C)C)CC1 2060377028 ZQLBYMAVKVMPQN-RYUDHWBXSA-N 338.412 1.449 10 10 EDCE Cc1ccc(NC(=O)c2cnn3c(O)cc(C)nc23)c(N(C)C)n1 2062486877 FHHRUCAWHBKICE-UHFFFAOYSA-N 326.360 1.765 10 10 EDCE CCCC(=O)N[C@H]1CCCN(C(=O)c2cnn3c(O)cc(C)nc23)C1 2062512893 FVWHNHNXRBKKLW-LBPRGKRZSA-N 345.403 1.264 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)cc1Br 2182555739 KPPRLZPSHLZPNP-UZGCMYEVSA-N 341.249 1.647 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NC(=O)c1cccc(O)c1O 1907374036 OEXOVXXQZILTEV-WDEREUQCSA-N 338.360 1.120 10 10 EDCE N[C@H]1C[C@H](O)CN(Cc2cc(Cl)cc(Br)c2O)C1 2049113233 HVGWKXZILKEBNL-UWVGGRQHSA-N 335.629 1.702 10 10 EDCE NCc1ccc(N2CC[C@H](N3CC(O)C3)C2)c(Br)c1 2102527904 OOJXWNLQZHBCFQ-NSHDSACASA-N 326.238 1.163 10 10 EDCE NCc1ccc(N2CCN(C3COC3)CC2)cc1Br 2113283120 HADKUWNJBPKQOA-UHFFFAOYSA-N 326.238 1.429 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@@H](CCN)C2)c1O 2236044439 OMLUSQSBHDMFQE-JTQLQIEISA-N 345.237 1.713 10 10 EDCE COc1ccccc1N1C(=O)NC(=O)C(=Cc2cccn2C)C1=O 2295987658 IZDAEEJSGCCKRR-UHFFFAOYSA-N 325.324 1.700 10 10 EDCE COc1ccc(OC)c(NC=C2C(=O)NC(=O)N(C(C)(C)C)C2=O)c1 2296940548 BLWZLZMXJXPXCT-UHFFFAOYSA-N 347.371 1.877 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H]1C(=O)N1CCc2cc(O)c(O)cc2C1 2318659629 GJMIJFNUIVDCNJ-OLZOCXBDSA-N 348.399 1.896 10 10 EDCE CS(=O)(=O)[C@H]1CC[C@H]1NCc1cc(Br)ccc1O 2319818593 UUCULYAEGXMGIL-PWSUYJOCSA-N 334.235 1.820 10 10 EDCE Cc1ccc(CNC[C@H]2CCS(=O)(=O)N2)c(O)c1Br 2352940285 CTBAKBPYMLBNFZ-SNVBAGLBSA-N 349.250 1.244 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1ccc(O)cc1C)c1ccc(N)cc1 170318231 QICIQNSCAJCCBK-UHFFFAOYSA-N 327.340 1.801 10 10 EDCE CN[C@@H](C)c1ccc(N2CCN(S(C)(=O)=O)CC2)c(Cl)c1 62084951 GIFOIVSXTMXEGM-NSHDSACASA-N 331.869 1.702 10 10 EDCE COC(=O)[C@H]1C[C@@H]1C(=O)N1CCCN(c2ccc(OC)cc2)CC1 170762206 KICGDMAXQVTNED-HOTGVXAUSA-N 332.400 1.543 10 10 EDCE CCn1cc([C@@H]2CN(C(=O)c3ccc(C)c(O)c3O)CCO2)cn1 191779510 OCXOSAWHLBVEAM-AWEZNQCLSA-N 331.372 1.836 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)/C=C/C3CC3)cc2)CC1 276178615 UOZGKPSOETXKDU-RMKNXTFCSA-N 327.428 1.938 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@@H](NC(N)=O)C2)c([N+](=O)[O-])c1 270741076 UYABMPKGHMNNCW-JOAKQRRISA-N 334.332 1.028 10 10 EDCE Cc1ccc(CNC(=O)[C@]23C[C@](N)(CO2)C3)c(O)c1Br 2381130707 CROPWNYNXRMWOT-HDJSIYSDSA-N 341.205 1.340 10 10 EDCE Cc1ccc(CN2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(O)c1Br 2381140485 LBNQUONOGCUAFL-LHAJWOIZSA-N 342.233 1.779 10 10 EDCE CN(CC1CC1)C(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 297708429 CLHAWTLRICHRSD-INIZCTEOSA-N 346.427 1.768 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N[C@@H]1CC[C@H](C(=O)O)C1 588616715 YLZIWBSPPGHYAR-FWVCVXLZSA-N 344.411 1.906 10 10 EDCE CO[C@@H](C(=O)NCc1cccc(Br)c1O)[C@@H]1CCOC1 834476119 NYFUFAMDWGARCC-ZWNOBZJWSA-N 344.205 1.822 10 10 EDCE Cc1cc(CC(=O)NC[C@@H](C)S(N)(=O)=O)c(C)n1-c1ccccc1 831543431 JDRWZZNIBKFGHV-CYBMUJFWSA-N 349.456 1.430 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)[C@@H]2CCO[C@H](C)C2)c1 830623336 KSBMZXWJPFUCRX-NTZNESFSSA-N 329.418 1.949 10 10 EDCE CCOC(=O)[C@H]1C[C@]1(N)c1cc(I)ccc1O 1952774467 HSFLWYJSHHQEIQ-SKDRFNHKSA-N 347.152 1.734 10 10 EDCE CC(C)(C)OC(=O)N=c1[nH][nH]cc1[C@@H](N)Cc1ccc(O)c(O)c1 1952711448 RPBSPLOERBIDNJ-NSHDSACASA-N 334.376 1.832 10 10 EDCE COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2C2CCOCC2)c1 918745630 PPDXJVJTWCUMJJ-OAHLLOKOSA-N 349.431 1.453 10 10 EDCE COc1cc(Cl)cc(CN2CN(CCN(C)C)C(=O)[C@H]2C)c1O 843428735 MSEUHZJWVMYTOW-LLVKDONJSA-N 341.839 1.606 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@H]3C[C@H](N)C34CCC4)cc2)C1 925484224 CSQUFGDPRMLPBR-NJAFHUGGSA-N 342.487 1.748 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)NCC23CC(CN2)C3)cc1 851677318 UKMMLCHYSUARHT-UHFFFAOYSA-N 332.448 1.525 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3cnn(C)c3)C2)cc1 852455782 NZRQMMZPERMEJZ-OAHLLOKOSA-N 343.431 1.849 10 10 EDCE CO[C@@]1(CNCc2c(O)ccc(Cl)c2F)CCS(=O)(=O)C1 922619084 NMTUXLFBXHMIDZ-CYBMUJFWSA-N 337.800 1.478 10 10 EDCE C[C@@H](NC(=O)[C@@H]1OCCO[C@@H]1C)c1ccc(N2CCOCC2)cc1 930745533 ZSALHJQXIWFASY-CKEIUWERSA-N 334.416 1.504 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCNC12CCC2 861750301 HUCUVMRWIJPKSB-MRXNPFEDSA-N 344.459 1.078 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@](C)(O)CO)c1 861486146 SCNJQYNMQNSWCV-GOSISDBHSA-N 330.384 1.380 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccnc(N3CCN(C)CC3)c2)c1 862758538 CHGSIUJIGQERJK-UHFFFAOYSA-N 340.427 1.777 10 10 EDCE CCO[C@H](C(=O)NCc1ccc2cccnc2c1O)[C@H]1CCOC1 868937982 PQQUFYLGDTVVLK-YOEHRIQHSA-N 330.384 1.998 10 10 EDCE O=C(NCCCSc1nccs1)N1CCO[C@@]2(CCOC2)C1 769518437 ZALAWRJXPRTKPV-AWEZNQCLSA-N 343.474 1.826 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@H]2COC[C@@]2(C)C1 1118494585 IPLSGMBIHKESQJ-HNAYVOBHSA-N 345.443 1.206 10 10 EDCE COC[C@]1(CO)CCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 897930771 GNLOTRABXRRFNW-MRXNPFEDSA-N 337.397 1.784 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CC[C@H](n2cncn2)C1 897441650 XEGSAQXQOPIZFI-JTQLQIEISA-N 330.369 1.991 10 10 EDCE C[C@H](N)c1ccc(N(C)Cc2nnnn2C)c(Br)c1 707668909 QQQBCKOZKCZBNQ-QMMMGPOBSA-N 325.214 1.629 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CN3CC(C(C)C)C3)CC2)cc1 795542766 AJQMCGOYFFSIDV-LJQANCHMSA-N 347.503 1.766 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CCS(=O)(=O)C(C)(C)C2)c(O)c1O 1179551631 HJIBNQSRJJPAHE-JTQLQIEISA-N 327.402 1.492 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccsn2)cc1C 1268310676 CBVUJNXEFXZWTP-ZDUSSCGKSA-N 335.429 1.341 10 10 EDCE C[C@H](CNC(=O)CCCF)NC(=O)c1ccc(N=NC(N)=O)cc1 1526880361 QNSPXKCFPLXBST-SNVBAGLBSA-N 337.355 1.833 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cn(C)nc2C)cc1C 1714692872 VTMQDVLVUBLKGA-UHFFFAOYSA-N 330.432 1.907 10 10 EDCE CN(Cc1ccccc1O)c1nnc([C@@H]2CCC(=O)N2)n1C1CC1 1554175666 RRKHKEJSPHTYJF-ZDUSSCGKSA-N 327.388 1.906 10 10 EDCE CN(CCNCc1nncs1)C(=O)c1ccc(N=NC(N)=O)cc1 1714805258 PAHKSMIDUIGVDL-UHFFFAOYSA-N 347.404 1.562 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN[C@@H](c2ccc(O)cc2)C1 1631048478 SSXNIBRWZLAMOT-OAHLLOKOSA-N 328.368 1.519 10 10 EDCE CN(CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1)C[C@@H]1CCOC1 1732600431 PEOWKCFJOYUUMK-ZDUSSCGKSA-N 347.419 1.889 10 10 EDCE O=C(CNC(=O)OCc1ccccc1)NCc1c(O)cccc1O 1647268819 DUKZZXJWTBXMRZ-UHFFFAOYSA-N 330.340 1.640 10 10 EDCE COc1ccc(CNC2CC(N(C)C(=O)CCCC(N)=O)C2)cc1C 1677448792 WZWOKMZIBKOISC-UHFFFAOYSA-N 347.459 1.738 10 10 EDCE CCCCN1CC(O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1672146915 KOKDRDZQSINQNG-UHFFFAOYSA-N 333.392 1.426 10 10 EDCE CCOC(OCC)[C@H](C)NC(=O)NCc1ccc(OC)cc1O 1684869174 IQCYYGBNUOLXDA-NSHDSACASA-N 326.393 1.988 10 10 EDCE C[C@@H](NC(=O)NCc1cn(C)c(=O)nc1O)c1ccc(N(C)C)cc1 1681553413 YLTIXVKSZINISS-LLVKDONJSA-N 345.403 1.112 10 10 EDCE CC1CCN(c2ccc(CNC(=O)NCc3nc(N)n[nH]3)cc2)CC1 1683465376 WCOOHKOQRZCABP-UHFFFAOYSA-N 343.435 1.623 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)[C@H]2CCCO2)c2nccn2C)cc1 169813581 BTMXCMUEPZRPKE-CVEARBPZSA-N 328.416 1.871 10 10 EDCE CCc1c(OCCOc2ccc(N)cc2)c(=O)ccn1C[C@H](C)O 1857913277 BGOSGLMXBQNDPP-ZDUSSCGKSA-N 332.400 1.832 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985099716 AWFFHYWPECTCTE-GARJFASQSA-N 327.385 1.419 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@H](O)CN(C(=O)OC(C)(C)C)C1 1985102767 LPTYCLGVOAONSG-MNOVXSKESA-N 327.385 1.373 10 10 EDCE CNCc1ccc(N2[C@H](CO)C[C@@H]3OCC[C@H]32)cc1Br 2146698663 KXDHDHDPNWZLEC-CFVMTHIKSA-N 341.249 1.897 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)CCc2ccc(N)cc2)CO1 1999123098 VRHIODNWMBJHTN-CQSZACIVSA-N 335.404 1.869 10 10 EDCE CC(C)(C)OC(=O)NCC1(O)CN(CCOc2ccc(N)cc2)C1 1999483218 KCPPTOWEQPOCDJ-UHFFFAOYSA-N 337.420 1.219 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@]4(CCO4)C3)c(Br)cc21 2153334923 RFHSKVZSPRQSKU-GXTWGEPZSA-N 338.205 1.770 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010406551 WBAWYSUINSHBQC-SRVKXCTJSA-N 341.412 1.809 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)CNCc1ccc2c(c1)CCCO2 2011516545 JFJPQCSNULZVDX-HNNXBMFYSA-N 336.432 1.987 10 10 EDCE NCc1ccc(N2CC[C@H]3C(=O)NC[C@@H]3C2)c(F)c1Br 2157192970 ZIOCAAXONRWLCW-NXEZZACHSA-N 342.212 1.619 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@](O)(CO)C2)c(Br)c1 313746229 PJNRSQXHWVDZFJ-QMTHXVAHSA-N 329.238 1.663 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)c(F)c1Br 2173318824 ZACMVFHHEMOBKY-YRDLKWHLSA-N 345.212 1.367 10 10 EDCE NCc1cc(F)c(N2CC[C@@H](C(CO)CO)C2)cc1Br 2170640721 GQCXVLBNCQWTON-SECBINFHSA-N 347.228 1.474 10 10 EDCE NCc1ccc(N2CCC(C(CO)CO)CC2)cc1Br 2170674542 SRTTWOUVFUHJHZ-UHFFFAOYSA-N 343.265 1.725 10 10 EDCE NCc1cc(F)c(N2CCN3CCOC[C@@H]3C2)cc1Br 2185888851 YAHYBUGNHYRFDJ-NSHDSACASA-N 344.228 1.568 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CC(=O)NCc2ccc(N)cc2)C1 2080713761 JXVHAKNEOLTKRN-DZGCQCFKSA-N 349.431 1.503 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)cc1Br 2102181151 NLBQEDUDWLPGEV-UBHSHLNASA-N 327.222 1.364 10 10 EDCE NC(=O)[C@@H]1CCN1c1ccc(C=CC(=O)O)cc1Br 2089361085 CSNAIINLJKIXHE-NSHDSACASA-N 325.162 1.611 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC4(CSC4)C3)c(Br)cc21 2090182980 XAAOEJAWOMJSLU-NSHDSACASA-N 340.246 1.954 10 10 EDCE CC(C)(C)OC(=O)NCC1(O)CN(c2ccc3c(c2)COCC3)C1 2214153491 YGQVHHHZKGBUPO-UHFFFAOYSA-N 334.416 1.835 10 10 EDCE O=C(O)CN1C(=O)C(=Cc2cccc([N+](=O)[O-])c2O)SC1=S 2294732706 CNWGWZABZWJOHG-UHFFFAOYSA-N 340.338 1.586 10 10 EDCE O=C1Nc2cc(N3C[C@H]4COC[C@H]3C4)c(Br)cc2[C@H]1O 2286932276 DEQMGSCDLYIBII-HHURGBBESA-N 339.189 1.660 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(COC(=O)N3)C2)c(Br)c1 2351836909 LSTZCAOSEWOWQZ-MRVPVSSYSA-N 327.178 1.801 10 10 EDCE Cc1ccc(CN(C)CC(=O)NC(N)=O)c(O)c1Br 2352653297 ZCVZLSLWMVAJMN-UHFFFAOYSA-N 330.182 1.090 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2354485956 SPKAAABURTUJKT-AISOMTMTSA-N 341.249 1.660 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@H](C)C[S@@](C)=O)CC2)cc1 183632903 OKUGXQONFYCVHQ-JCQPUDPBSA-N 339.461 1.294 10 10 EDCE Nc1ccc(CCNS(=O)(=O)c2cnn(-c3ccccc3)c2)cc1 193338567 BHJYXELNSAQWBX-UHFFFAOYSA-N 342.424 1.976 10 10 EDCE CCOC(=O)C1=S=C(NC(=O)c2cccc3ncnn23)C=C1C 359642314 JGTSLQPVZDWMPP-UHFFFAOYSA-N 330.369 1.018 10 10 EDCE C[C@@H](NC(=O)N1C[C@H]2CC[C@H]1CN2)c1ccc(N2CCOCC2)cc1 817876290 BQIRQEUFHQOZGM-KYJSFNMBSA-N 344.459 1.730 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3CCCN(C)C3=O)C2)cc1 819589882 HMUORMASUMVGFS-YOEHRIQHSA-N 345.443 1.506 10 10 EDCE CCOC(=O)CCNC(=O)N1CCOc2ccc(N(C)C)cc2C1 575541110 MMQPTYITWGCZCJ-UHFFFAOYSA-N 335.404 1.610 10 10 EDCE CNC(=O)C1CN(c2ccc([C@H](C)NC)c(Br)c2)C1 723158750 OYSYYTRCSKMWFL-VIFPVBQESA-N 326.238 1.912 10 10 EDCE O=C(/C=C/Cn1cncn1)N(Cc1ccccc1O)C[C@H]1CCCO1 901174725 HMCGHOOOHQFSRS-ILNGBFOMSA-N 342.399 1.748 10 10 EDCE Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832293312 UVTQODNSASVAOR-INIZCTEOSA-N 343.387 1.794 10 10 EDCE CN1CCN(c2ccc(CNS(=O)(=O)CC3(F)CC3)cc2)CC1 919740093 CQAAOWCWWGYHJC-UHFFFAOYSA-N 341.452 1.360 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=S)NC[C@H]3CCCO3)C2)cc1 849271101 AEOYAHRVTMDPPE-CZUORRHYSA-N 335.473 1.917 10 10 EDCE CC1(C)C[C@H](OC(=O)c2cc(NS(C)(=O)=O)ccc2O)CO1 849712082 HKHANVZSZOVFQF-JTQLQIEISA-N 329.374 1.488 10 10 EDCE Cc1cc(C)c(O)c(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)c1 842635074 ZMFABVNFAGQTQF-MRXNPFEDSA-N 325.430 1.399 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@]3(C)CCN(C(C)=O)C3)C2)cc1 855232796 XYIZIJXREOJUER-BEFAXECRSA-N 345.443 1.649 10 10 EDCE C[C@@H](NC(=O)N(C)CC1CN(C)C1)c1ccc(N2CCOCC2)cc1 852011868 BLMDHMPJABNOOY-OAHLLOKOSA-N 346.475 1.787 10 10 EDCE C[C@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCCO1 755213156 SFDVWTFNXSLBRG-DNVCBOLYSA-N 345.443 1.574 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)[C@H]1CCN=C2C1=NNN2C 854373302 DIORAKVFOMRABD-AWEZNQCLSA-N 343.431 1.745 10 10 EDCE CCO[C@@H](C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@H]1CCOC1 864470991 UVTXHAAGYPUKSR-MAUKXSAKSA-N 348.443 1.785 10 10 EDCE CON1CCC(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CC1 899211367 KWMXAPQSEBTGJQ-UHFFFAOYSA-N 346.475 1.328 10 10 EDCE CNC(=O)[C@H]1CN(Cc2cc(C)cc(Br)c2O)CCO1 781927092 SEVNFRZLOYOKCE-GFCCVEGCSA-N 343.221 1.410 10 10 EDCE C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1cc(F)ccc1O 797121502 ZWJFMNOEQISJMW-YPMHNXCESA-N 330.425 1.996 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CSc1n[nH]c(C)n1 1157102947 SNRAYOOUQUNOJN-UHFFFAOYSA-N 327.406 1.713 10 10 EDCE CN1CCN(c2ccc(CNCCOCCCO)cc2F)CC1 1322070638 PFYCROAXMNPCJD-UHFFFAOYSA-N 325.428 1.066 10 10 EDCE O=C(C(=O)N1CC[C@@H](CN2CCCC2)C1)N1Cc2cccc(O)c2C1 1331980247 IFKMNIIYELVNBO-AWEZNQCLSA-N 343.427 1.179 10 10 EDCE CCC[C@]1(CO)CCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1330487363 RKKSSYSIPXVZPK-GOSISDBHSA-N 332.400 1.388 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)/C=C(\C)C2CC2)cc(OC)n1 1284202468 COGCDMRFMZEKNV-VNKGSWCUSA-N 347.415 1.690 10 10 EDCE Cn1cc(C(=O)C[C@@H]2CCCN2C(=O)Cc2ccc(O)c(O)c2)cn1 1545938770 FRKRILASNAGTTD-AWEZNQCLSA-N 343.383 1.638 10 10 EDCE CN(C)c1ccc(CNC(=O)c2ccc3c(c2)COB3O)cc1F 1544308607 OSKBVVADBXZXKX-UHFFFAOYSA-N 328.152 1.039 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)Cc3cc[nH]n3)C2)cc1C 1488718337 NJNWVIPVEJHLNA-WOVMCDHWSA-N 342.443 1.954 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cn(C)nc2C)cc1C 1483214901 LLAMFRJTAUZZKH-ZDUSSCGKSA-N 330.432 1.954 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)[C@@H]2CCCN2C)cc1C 1717047073 UWVQHWGPMHHFEY-KRWDZBQOSA-N 349.475 1.008 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)/C=C/C(=O)N(C)C)C2)cc1 1557133496 MRFICSYPIFSVCT-VFNNOXKTSA-N 331.416 1.282 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)C2CC(C)C2)cc(OC)n1 1738803051 APMMNMHZSYZBRM-MBHSVXNSSA-N 349.431 1.722 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2CCCNC2=O)cc1C 1666927710 MZGJTYNOESOWAK-GOEBONIOSA-N 347.459 1.466 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 1858596476 UNFWTFNQPRTFDA-UMYFRRCYSA-N 325.367 1.039 10 10 EDCE COCCNCc1ccc(N2CC[C@@H](O)C2)c(Br)c1 234690989 QEYZRDXDMGANEP-GFCCVEGCSA-N 329.238 1.756 10 10 EDCE CCOc1cccc(CNCC(=O)N(C)CCc2ccncc2)c1O 1857866920 KHBZBLLCSVTXOB-UHFFFAOYSA-N 343.427 1.977 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1C(=O)NCCN=[N+]=[N-] 1963817512 OFJQBBFOFYLTHW-MNOVXSKESA-N 327.385 1.685 10 10 EDCE C[C@H]1OCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)NCCCN=[N+]=[N-] 1985101617 VFWBUDCFYLJWKC-MNOVXSKESA-N 327.385 1.827 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccccc1O 2010256004 ZONVLXQXLOTCQF-FZMZJTMJSA-N 338.404 1.625 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2010391311 PFKQNDNMDXRRBY-NSHDSACASA-N 339.396 1.660 10 10 EDCE CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)COCC1(C)C 2010391933 CEBACJHXACRBGF-LLVKDONJSA-N 339.396 1.922 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H](CNC(=O)OC(C)(C)C)[C@@H]1CCOC1 2010388995 KABZPYXAZBDJCR-NEPJUHHUSA-N 341.412 1.933 10 10 EDCE CNCc1ccc(N2C[C@H]3[C@@H](C2)OC(=O)N3C)c(Br)c1 2176930765 NNACTGQFJJZLOO-QWHCGFSZSA-N 340.221 1.808 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])COC1 2213582531 IUDQPPNJLYOUOQ-GHMZBOCLSA-N 339.396 1.875 10 10 EDCE NC1CN(C2CCN(Cc3ccc(Br)cc3O)CC2)C1 2233401867 UGNGOYSGGOQFBY-UHFFFAOYSA-N 340.265 1.762 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](CO)C[C@@H](CO)C2)c(Br)c1 2236633648 RCHZCWDGGKWHCR-IJLUTSLNSA-N 343.265 1.896 10 10 EDCE COCCN(C[C@@H](C)O)c1cc(Br)c(CN)cc1F 2272395415 OMGICYXRSSWJFN-SECBINFHSA-N 335.217 1.881 10 10 EDCE CN=c1cc(S(=O)(=O)NCc2cnc(SC)s2)cc[nH]1 2284687984 IUCUTVVLPCENSM-UHFFFAOYSA-N 330.460 1.202 10 10 EDCE O=C1NC(=S)N(c2ccccc2F)C(=O)C1=CNC1CCCC1 2297559533 GSXIKHWDNPENNC-UHFFFAOYSA-N 333.388 1.990 10 10 EDCE Cc1cc(Br)cc(CN2C[C@H]3CS(=O)(=O)[C@@H]3C2)c1O 2336548179 HDMLLKRRUMBHTO-CMPLNLGQSA-N 346.246 1.692 10 10 EDCE Cc1ccc(CN(C)C[C@@H](O)CC(=N)N)c(O)c1Br 2352638864 TWKZLXNGKRCHSJ-JTQLQIEISA-N 330.226 1.582 10 10 EDCE CN(Cc1ccccc1O)C(=O)CCCCCCS(N)(=O)=O 293798305 SSMMPXLVHHYWEM-UHFFFAOYSA-N 328.434 1.590 10 10 EDCE CN1CCc2cc([C@H](NN)c3nn(C)cc3Br)ccc21 2163158263 NKPVWOLUQFPJOG-ZDUSSCGKSA-N 336.237 1.728 10 10 EDCE O=[N+]([O-])c1cc([C@H](C2CCOCC2)N2CCNCC2)cc(O)c1O 575259897 NDQHEBAMGXZIDY-HNNXBMFYSA-N 337.376 1.379 10 10 EDCE NS(=O)(=O)C[C@@H]1CCCN1Cc1ccc(Br)cc1O 824815136 ZTBTVUBZDHPHBP-NSHDSACASA-N 349.250 1.408 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@](C)(O)[C@H](O)C2)c(Br)c1 1893331927 NMWMJINUJYEULT-FZZIBODNSA-N 330.222 1.824 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccn4nccc4n3)C2)cc1 912292639 NWVIXWUVRVBHKZ-CYBMUJFWSA-N 337.383 1.747 10 10 EDCE C[C@H](NC(=O)NCc1c(O)cccc1F)[C@H](C)N1CCOCC1 917015211 FYLXOUIZISTZSY-RYUDHWBXSA-N 325.384 1.440 10 10 EDCE Oc1cc2c(cc1CNC1CCC(N3CCNCC3)CC1)OCO2 841086658 BXXTUXWMUFZALF-UHFFFAOYSA-N 333.432 1.427 10 10 EDCE CNc1cnc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cn1 918838634 LANTWWAWUGFEIV-UHFFFAOYSA-N 340.431 1.200 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)c2ccc3c(n2)OCCO3)cc1 848394055 MKSAXKOGJSOTIF-AWEZNQCLSA-N 342.399 1.349 10 10 EDCE COc1cccc(CNC(=O)NC[C@@H]2CCN2C2CCOCC2)c1O 927639499 BKXWKNJUMOGUQG-HNNXBMFYSA-N 349.431 1.453 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCC[C@H](C(=O)NCCN=[N+]=[N-])O1 1896927654 IPDYJWFRKOTCLX-WDEREUQCSA-N 327.385 1.875 10 10 EDCE CN1CCCc2cc(CNC(=O)C(C)(C)n3cc(N)cn3)ccc21 852863336 MRBZJNJZNMQEMP-UHFFFAOYSA-N 327.432 1.899 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)COCc3ncc(C)o3)C2)cc1 855225738 LXOAZZNWKJDASX-AWEZNQCLSA-N 345.399 1.903 10 10 EDCE O=C(C[C@@H]1CCC(=O)N1)NCc1cc(Br)ccc1O 854442766 XACXVHFVGCVJMO-JTQLQIEISA-N 327.178 1.440 10 10 EDCE COC[C@@H](CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)OC 853974390 XFCGZNAKHSICCW-CZUORRHYSA-N 337.420 1.235 10 10 EDCE COc1cc(Br)cc(CN2C[C@@H](O)C[C@@H](O)C2)c1O 769563463 JXXUNQFUCSLRMH-PHIMTYICSA-N 332.194 1.091 10 10 EDCE OC[C@@H]1CCCN(c2cc(N3Cc4cccc(O)c4C3)ncn2)C1 866119799 SNWNJBOIZUQTGE-CYBMUJFWSA-N 326.400 1.911 10 10 EDCE C[C@@]1(c2ccccn2)NC(=O)N(CCOc2ccc(N)cc2)C1=O 57849829 QHUZKJDRLMOLTF-KRWDZBQOSA-N 326.356 1.510 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(C)C(=O)[C@@H]2C)c([N+](=O)[O-])c1 777821239 SIEUBJKWCRFIRP-XOIDGJRKSA-N 333.344 1.448 10 10 EDCE Cn1nccc1[C@H]1C[C@@H](NC(=O)NCc2ccccc2O)CCO1 1228458817 LTVBKTQHIKTPIY-XJKSGUPXSA-N 330.388 1.845 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC3(C)CC3)C2)cc1 1328408367 RQWKNEQTBJRJRI-CYBMUJFWSA-N 331.416 1.306 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3C[C@@H]4C[C@@H]4C3)C2)cc1 1328210065 OJCIUOASKBSEQY-XGUBFFRZSA-N 343.427 1.305 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CC[C@H](C)C3)C2)cc1 1332163279 BZXLIZZGOXXNHZ-KKUMJFAQSA-N 345.443 1.695 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCC[C@@H]3C)C2)cc1 1261694532 SMUBCFSEYYMHFN-GRDNDAEWSA-N 345.443 1.695 10 10 EDCE COc1ccc(CNC[C@H]2CCN(C(=O)[C@@H](C)CC(N)=O)C2)cc1C 1267052478 DLIQLSKSRCNKRT-GOEBONIOSA-N 347.459 1.453 10 10 EDCE Cc1cc(C(=O)N2C[C@H](CO)[C@@H](CCO)C2)c(C)n1-c1ccccn1 1350989290 BYLRBHYFOMVAFH-JKSUJKDBSA-N 343.427 1.552 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1COc2ccc(O)cc2O1 1447561667 JPOLMDQYVNDMLC-DYZYQPBXSA-N 345.351 1.691 10 10 EDCE CCCOc1ccnc(CC(=O)NCCc2ccc(O)c(O)c2)n1 1445935964 FJUXBWXWAGOHIT-UHFFFAOYSA-N 331.372 1.578 10 10 EDCE CN(Cc1ccccc1O)c1nnc(C2CC2)n1C[C@@H]1COCCO1 1298363836 MJFXDIIIXHRPEE-OAHLLOKOSA-N 344.415 1.913 10 10 EDCE O=C(COCCNC(=O)c1ccccc1)NCc1cc(O)ccc1O 1455356717 KCWKNOVKDWPMLG-UHFFFAOYSA-N 344.367 1.161 10 10 EDCE Cc1ccc(C(=O)NCCCONC(=O)OC(C)(C)C)c(O)c1O 1456478342 OWBJVIFKIAOSLT-UHFFFAOYSA-N 340.376 1.982 10 10 EDCE NCc1cc(F)c(N2CC[C@@H](O)C[C@H]2CO)cc1Br 2136084073 HMBDKRRFJYNWOL-VHSXEESVSA-N 333.201 1.369 10 10 EDCE C=CCCC(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1703902104 ORZNOEQGTCFIIQ-JOCQHMNTSA-N 333.388 1.442 10 10 EDCE COC[C@@H](C)C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1703333930 YQNLOENZSMRPAT-LLVKDONJSA-N 349.391 1.368 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cnc(O)c(Br)c1 1626837687 DCXNZLDKNNWZIO-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE CCCCC(=O)N(C)C[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1487710279 FYYTUBXLGOMDSC-GFCCVEGCSA-N 337.420 1.866 10 10 EDCE CC1=CC(C(=O)Nc2ccc(-c3nc(C)no3)nc2)=S=C1C=O 1627913252 SMWYKUSYRRRYOW-UHFFFAOYSA-N 328.353 1.615 10 10 EDCE C[C@H]1CN(c2cc(Br)c(CN)cc2F)CC(=O)N1C 1925970585 NVKRZEZIUTYEMN-QMMMGPOBSA-N 330.201 1.714 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCCN2CCC[C@@H]2CO)cc1 1631274455 QXADNTZDWUTLPI-OAHLLOKOSA-N 347.419 1.816 10 10 EDCE Cc1nc([N+](=O)[O-])cn1CC(=O)NCc1ccc2cccnc2c1O 1630531775 CMCNEZSZDFKLCF-UHFFFAOYSA-N 341.327 1.670 10 10 EDCE COc1cccc(CNC(=O)[C@@H]2CCN(c3ccncc3)C2)c1O 1641247140 PUUWLFKXUQVAPH-CQSZACIVSA-N 327.384 1.939 10 10 EDCE CC[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C(F)F 1738134545 TUNCMAKNSIAFHK-VIFPVBQESA-N 341.318 1.739 10 10 EDCE CC(C)OCCN[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1731638095 FWUCUUPJLWYDNQ-LBPRGKRZSA-N 335.408 1.982 10 10 EDCE C[C@@H](NC(=O)CCn1nnc2ccccc2c1=O)c1ccccc1O 1642824041 CRZUPSXCSXJYHM-GFCCVEGCSA-N 338.367 1.765 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)COC 1746167454 VFOGFLBKEICYOA-LLVKDONJSA-N 335.364 1.120 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CCC[C@]1(C)NC(=O)NC1=O 1587405813 ZTSMYQVBACVUQK-SFHVURJKSA-N 346.431 1.479 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)C(C)(C)NC(C)=O)cc1C 1674743246 ZQJFLVYBSJTNAN-UONOGXRCSA-N 349.475 1.901 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCc2nc(C)no2)cc1C 1690608419 LXVQFLASXITXAL-CYBMUJFWSA-N 346.431 1.922 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NC[C@H]1CCCS1(=O)=O 153521433 VPHMEDXDWUSYJJ-GFCCVEGCSA-N 347.396 1.557 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)[C@@H]2CSCN2)c2nccn2C)cc1 1866108912 SGGSUCVCKYHMNJ-GJZGRUSLSA-N 345.472 1.354 10 10 EDCE C[C@@H]1CN(Cc2cc(Br)cc(F)c2O)[C@H](C(=O)O)CO1 1964733299 TZIIKVVLMKVUOY-HQJQHLMTSA-N 348.168 1.968 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)[C@H](CCO)C2)cc1Br 2149915567 VRBIFQZRKGOFMU-TUAOUCFPSA-N 343.265 1.896 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985102030 AWFFHYWPECTCTE-GARJFASQSA-N 327.385 1.419 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010396003 LTXKCGZLZVZVOO-NWDGAFQWSA-N 339.396 1.924 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C1CC(O)(CNC(=O)OC(C)(C)C)C1 2010405939 NZIBQYRYWPTGSI-UHFFFAOYSA-N 341.412 1.811 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](CO)[C@@H](O)C2)cc1Br 316975186 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MIKUAYLWFXGCHG-UONOGXRCSA-N 336.436 1.389 10 10 EDCE CN(C)CCNC(=O)CN1C(=O)C(=Cc2ccco2)SC1=S 2297500846 MGKHCBUFLKYIDD-UHFFFAOYSA-N 339.442 1.159 10 10 EDCE Cc1ccc(CN2CC(F)(C(=N)NO)C2)c(O)c1Br 2352951097 BWQZDXFAIPWVCJ-UHFFFAOYSA-N 332.173 1.943 10 10 EDCE COc1ccc(N2CCN(C[C@@H](C)CS(C)(=O)=O)CC2)cc1F 119933784 LOGLBWVBIFQTFJ-CYBMUJFWSA-N 344.452 1.637 10 10 EDCE CNC(=O)[C@@H](C)CN(C)c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 175051325 HHQFZLMLFZSRPC-IOCXFXADSA-N 335.360 1.599 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1 212672252 GOUGKRBIYJUDPO-HWPRWLFBSA-N 333.344 1.483 10 10 EDCE Cn1c(=O)c2[nH]c(-c3ccc(N4CCCCC4)cc3)nc2n(C)c1=O 194105422 FJCUHZACILRYPW-UHFFFAOYSA-N 339.399 1.618 10 10 EDCE O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NCc1ccccc1O 269125118 GXBDKTLJALJWJN-DUVNUKRYSA-N 349.456 1.734 10 10 EDCE Cc1nc([C@H]2COCCN2Cc2ccc(N3CCOCC3)cc2)no1 369460803 FSIMCPNNCIPKHJ-QGZVFWFLSA-N 344.415 1.788 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCO[C@]2(CCCOC2)C1 368046774 ZVBHWGWPRQYZDB-LJQANCHMSA-N 332.444 1.905 10 10 EDCE Cc1ccc(CN(C)[C@@]2(C(=O)O)CN[C@@H]2C)c(O)c1Br 2380765468 MNJLXBSSVNWCKO-OTYXRUKQSA-N 343.221 1.710 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H](N)CN(C)C)c(O)c1Br 2381131337 MFTQHSRJTPKMFX-LLVKDONJSA-N 344.253 1.310 10 10 EDCE Cn1ccnc1CNC(=O)NCc1cc(Br)ccc1O 805136430 JEIQTBJCYQRDIH-UHFFFAOYSA-N 339.193 1.888 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H](C)[C@H]3C)CC2)cc1 815163881 RWTGYYKLLOINNH-NUJGCVRESA-N 333.476 1.518 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=O)NCCc1ccc(N)cc1)C2 818654257 AKGBMGHPFFAIQV-BPUTZDHNSA-N 346.431 1.730 10 10 EDCE CN[C@@H](C)c1ccc(N2CCOC[C@@H]2C(N)=O)cc1Br 723150708 LHKBFYVORDERER-TVQRCGJNSA-N 342.237 1.420 10 10 EDCE CO[C@]1(CN[C@@H](C)c2ccc(Cl)cc2O)CCS(=O)(=O)C1 903362306 DFWGUEPGWKESOR-HZMBPMFUSA-N 333.837 1.900 10 10 EDCE Cc1cc(C)nc(O[C@H]2CCCN(C(=O)c3cc(O)nc(O)c3)C2)n1 585339878 JCNBIVVPRDSHBG-ZDUSSCGKSA-N 344.371 1.583 10 10 EDCE O=C(/C=C\Cn1cncn1)N(Cc1ccccc1O)C[C@@H]1CCCO1 901174727 HMCGHOOOHQFSRS-XOYTVWKISA-N 342.399 1.748 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@](O)(C(F)F)C1 831169520 AEOCBLMAUXBLLV-KRWDZBQOSA-N 341.402 1.413 10 10 EDCE CCO[C@H](CNC(=O)NCc1cc(OC)ccc1O)CN(C)C 918745855 SKKFFOXPPGZWQW-CQSZACIVSA-N 325.409 1.167 10 10 EDCE Cc1cc(N(C)C)ccc1CN1CCO[C@@]2(CCS(=O)(=O)C2)C1 843426348 UFXNYKJHFGDZGC-KRWDZBQOSA-N 338.473 1.451 10 10 EDCE CC[C@@H]1C[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CO1 850135930 SKPOQPYPISMCBB-DOTOQJQBSA-N 338.473 1.579 10 10 EDCE CC(C)(C)N1C[C@@H](CNC(=O)NCc2c(O)cccc2F)CC1=O 923324155 CFOFAHRGIAIOQI-LLVKDONJSA-N 337.395 1.978 10 10 EDCE CCOCc1cc(CNC[C@]2(CO)COCCN2C)ccc1OC 922536751 ZKWYMYZGTMGNBY-SFHVURJKSA-N 338.448 1.014 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NO[C@@H](CO)C(C)C)C2)cc1 854296579 DZUKHNFRWJJXDK-BBRMVZONSA-N 337.420 1.522 10 10 EDCE CC[C@H](NCC[C@H]1CNCCS1(=O)=O)c1ccc(C)cc1O 925787960 DNTRBFRFXOHJMJ-ZFWWWQNUSA-N 326.462 1.518 10 10 EDCE CC(C)(C)OC(=O)Cn1ccc(NC(=O)c2cccc(O)c2O)n1 856437891 DVERXRXOUYZINF-UHFFFAOYSA-N 333.344 1.888 10 10 EDCE CN1CCN(C(=O)NCCCSc2nccs2)CCC1=O 853859850 ZYHBLUKVABZRSN-UHFFFAOYSA-N 328.463 1.499 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CN(C)C(=O)C3CC3)C2)cc1 855230738 IUTMKXZABVZJRS-AWEZNQCLSA-N 331.416 1.259 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CC[C@@H](C)NC1 861804444 JHOLDXYPEXRVEA-ZBFHGGJFSA-N 347.459 1.778 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(N2CCCOCC2)CC1 861984543 GWWRSNVLMSQXJX-HYXAFXHYSA-N 346.427 1.824 10 10 EDCE CO[C@@H](CS(=O)(=O)NCc1cc(C)ccc1O)[C@@H]1CCOC1 1118821518 HLPFZEBGZSIKIX-DOMZBBRYSA-N 329.418 1.172 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1cc(C)ccc1O)[C@@H]1CCOC1 1118821519 HLPFZEBGZSIKIX-IUODEOHRSA-N 329.418 1.172 10 10 EDCE N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 870869387 QILXPELJOJAXRX-IQUTYRLHSA-N 347.434 1.530 10 10 EDCE C[C@H](NC(=O)NC[C@@]1(CCO)CCOC1)c1ccc(N(C)C)cc1 776238324 IYIZBCMJJVRGBC-KBXCAEBGSA-N 335.448 1.902 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)NC(=O)c1ccccc1 773755556 DFPNQJSPNYSPEK-CHWSQXEVSA-N 342.395 1.964 10 10 EDCE CN(Cc1cnc(N(C)C)nc1)C(=O)NCc1ccc(N(C)C)cc1 780014467 ILODTVNYVXZXHS-UHFFFAOYSA-N 342.447 1.950 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C1CN([C@@H]2CCOC2)C1 895710147 HCBAODPPWXONLS-GOSISDBHSA-N 329.444 1.624 10 10 EDCE Cn1cc([C@@H](NC(=O)Cc2ccc(O)c(O)c2)C(F)(F)F)cn1 1139541343 PTSLYGBMKQCOOK-CYBMUJFWSA-N 329.278 1.794 10 10 EDCE Cn1ncc(Br)c1CNCc1ccc(O)c(O)c1O 710552070 PFSHACZYJWJZAU-UHFFFAOYSA-N 328.166 1.589 10 10 EDCE CC1(CS(C)(=O)=O)CN(c2ccc(CO)c(Br)c2)C1 2116568438 FSBVRYZMLQXXPX-UHFFFAOYSA-N 348.262 1.812 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21 1328957707 RNLAMLVRIOULFR-USXIJHARSA-N 345.443 1.083 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NC2C[C@@H]3C[C@H]3C2)cc1 1332820735 YDMLQVSXRDFPLT-KBPBESRZSA-N 345.443 1.505 10 10 EDCE COC(=O)c1c(CN[C@@H](CO)CCF)c2cc(F)ccc2n1C 1331579874 AWBFOIZTRPXEIW-LLVKDONJSA-N 326.343 1.914 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1COC[C@@H]1NC(=O)OC(C)(C)C 1900606981 ITJFQGXHRMSWMP-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE O=C(O)C=Cc1ccc(N2CC(=O)NC(=O)C2)c(Br)c1 1912086106 YXSBLJPNNDRLTC-UHFFFAOYSA-N 339.145 1.010 10 10 EDCE COC(=O)c1cc(C(=O)NCc2c(O)ccc3c2CCCC3)no1 1445900286 JATBYIBFLIPVAM-UHFFFAOYSA-N 330.340 1.976 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](C)CCN(C)C 1299700110 YHQOINDGTORKLN-AWEZNQCLSA-N 336.432 1.872 10 10 EDCE Cn1c(=O)n(C)c2cc(OC(=O)Cc3ccc(O)c(O)c3)ccc21 1467813975 BMVOMBMAPKVUSA-UHFFFAOYSA-N 328.324 1.436 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CC[C@@H](C(N)=O)O2)cc1 1539307868 LQJTYKHURQOXHY-JKSUJKDBSA-N 333.432 1.524 10 10 EDCE COc1ccc(CNC(=O)[C@H]2C[C@H]2NC(=O)OC(C)(C)C)c(O)c1 1617752732 ISOMHLJYKURRSY-QWHCGFSZSA-N 336.388 1.930 10 10 EDCE CCn1cc(-c2nn(C)cc2C(=O)NCc2cc(O)ccc2O)cn1 1471661375 PSJNXERZESBCKZ-UHFFFAOYSA-N 341.371 1.645 10 10 EDCE NC(=O)NC[C@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 1625715981 YNOBFZLKECEPGT-SECBINFHSA-N 349.412 1.833 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)CCn3cncn3)C2)cc1C 1480126623 DZUPGBAFRFZWBD-WKILWMFISA-N 343.431 1.422 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)NCc1cccc(Cl)c1O 1558757435 DPZYPHVFYRUVDM-LLVKDONJSA-N 344.795 1.547 10 10 EDCE O=C(CN1C(=O)COc2ccccc21)NCc1c(O)cccc1O 1635843560 XACASBJFENEKTE-UHFFFAOYSA-N 328.324 1.140 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CCNC(=O)C2)cc1C 1569051689 AHWNQTGJNLXWMD-DZGCQCFKSA-N 333.432 1.124 10 10 EDCE COCCCN(C)CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1732600919 ZJGHKSPGDGLAHJ-UHFFFAOYSA-N 335.408 1.889 10 10 EDCE CC[C@@H](O)Cn1cc(C(=O)NCc2c(O)ccc3ccccc23)nn1 1647790999 FTBKDALLCPNFPI-CYBMUJFWSA-N 340.383 1.838 10 10 EDCE COc1cc(OCC(=O)NCc2cc(O)ccc2O)ccc1[N+](=O)[O-] 1593873625 UKENLAWRPVROKS-UHFFFAOYSA-N 348.311 1.710 10 10 EDCE C[C@](O)(CO)[C@H]1CCN(c2ccc(CN)cc2Br)C1 2138099707 BXEXAKGVAHXJEH-FZMZJTMJSA-N 329.238 1.477 10 10 EDCE CN1C(=O)/C(=C\c2ccc(N3CCCC3)c(F)c2)C(=O)NC1=S 4467682 JWAYCOXURSFSIZ-FLIBITNWSA-N 333.388 1.682 10 10 EDCE COc1ccc(Br)c(CNCCNC(=O)C2CC2)c1O 1964037062 FNHVAEVMWJUMLY-UHFFFAOYSA-N 343.221 1.779 10 10 EDCE [N-]=[N+]=NCCN[C@]1(C(N)=O)CCN(Cc2ccccc2)C2(CC2)C1 1997672295 WZEOYOCVKWWOMI-QGZVFWFLSA-N 328.420 1.939 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@H](Nc3c(N)cccc3C(N)=O)[C@H]2C1 2000889917 VMDNZTXTEWCLIO-PJXYFTJBSA-N 332.404 1.645 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010392177 XMSYJXZRUNUNID-VXGBXAGGSA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 2010394305 BLFWICGNYLPVSO-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE C[C@@H](CS(N)(=O)=O)NCc1cc(Br)cc(F)c1O 2035454006 XJTLIPCYIPELRI-LURJTMIESA-N 341.202 1.060 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)c(Br)c1 2173356263 BVUPWACLWUUMEU-XSXLEWDISA-N 342.233 1.823 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1908253055 LTWNBSXRMXPRTJ-GRYCIOLGSA-N 339.396 1.658 10 10 EDCE CN1CCO[C@H]2CCN(c3ccc(CN)c(Br)c3)C[C@@H]21 2185493217 PFIVLHBDLHTUBI-GJZGRUSLSA-N 340.265 1.817 10 10 EDCE Oc1c(F)cc(Br)cc1CNC[C@H]1C[C@H](O)CCO1 2097944340 CKXHAYIZWQHHTN-GHMZBOCLSA-N 334.185 1.923 10 10 EDCE CCN[C@@H]1CC[C@@H]1CS(=O)(=O)NCc1cnc(SC)s1 2284693843 ZCMKKBQVHLLNHO-MWLCHTKSSA-N 335.520 1.673 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2303240233 IQSUFQTYBZYMQZ-VXGBXAGGSA-N 341.412 1.954 10 10 EDCE O=C(CCCOc1ccccc1)NCCN1C(=O)CSC1=S 49755778 LJTHFOSHNQQCAH-UHFFFAOYSA-N 338.454 1.822 10 10 EDCE CCS(=O)(=O)N1CC(CN[C@H](C)c2cc(OC)ccc2O)C1 190691266 KQANIDHCTPWEQT-LLVKDONJSA-N 328.434 1.333 10 10 EDCE O=C(NCc1ccccn1)N1CCN(c2ccc3c(c2)OCO3)CC1 242774018 DTOQNBZSWCQDJW-UHFFFAOYSA-N 340.383 1.842 10 10 EDCE Cc1nn(C)c(C)c1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 269895967 CHAWJJAKSROBEA-UHFFFAOYSA-N 329.404 1.358 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@]2(CCOC2)O1 366491409 KPKNCHAIMBDYOH-HWPZZCPQSA-N 349.343 1.310 10 10 EDCE c1cc(N2CCOCC2)ccc1CNC[C@H]1CN2CCC[C@H]2CO1 378903895 YDAZTDGWADXNFA-OALUTQOASA-N 331.460 1.476 10 10 EDCE Cc1ccc(CN(C)C(=O)C2(O)CC(N)C2)c(O)c1Br 2381135954 YLFWTPLTROLEMG-UHFFFAOYSA-N 343.221 1.274 10 10 EDCE COCC[C@H](N)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380789613 KZUOHGVYOYFHIJ-NSHDSACASA-N 345.237 1.785 10 10 EDCE CCN1CC[C@H]2OCCN(C(=O)/C=C/c3ccc(O)c(O)c3)[C@H]2C1 293914209 NYMHYZPMWFTDSW-HMHLKJFASA-N 332.400 1.433 10 10 EDCE CCCn1c(=O)n(CCC(=O)OCC(=O)C(C)=O)c2ccccc21 808497719 BABPMPFINDCMMO-UHFFFAOYSA-N 332.356 1.304 10 10 EDCE CN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)[C@@H]1CCN2CCO[C@H]1C2 295138157 PLVSUCDECAKUNK-OCCSQVGLSA-N 341.795 1.859 10 10 EDCE CN(C[C@@H](O)CNCc1ccc2c(c1)CCO2)C(=O)OC(C)(C)C 818996203 CPFPRWJSXOWVIK-HNNXBMFYSA-N 336.432 1.939 10 10 EDCE Cn1cccc1C(=O)N1CCOc2ccc(N3CCOCC3)cc2C1 575315080 XRSSGPVUXHIMSD-UHFFFAOYSA-N 341.411 1.897 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@@H](O)[C@@H](O)C3)c2C)cc1 827624253 JICASEZCXWGNNX-MSOLQXFVSA-N 344.411 1.670 10 10 EDCE Nc1ccoc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1326673565 BZPLTZOYUUCYQL-UHFFFAOYSA-N 333.363 1.892 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(c2ccc(O)c(O)c2O)C[C@H]1C(=O)O 1952829256 JJFVUWNMFPXGKH-AYVTZFPOSA-N 325.317 1.628 10 10 EDCE COc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)nc1 743716831 MFQKANNDSJGSMG-UHFFFAOYSA-N 337.357 1.420 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCN(CC(=O)O)C1=O 852726560 SGOXHBCPJHSBGS-QGZVFWFLSA-N 345.443 1.794 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2C[C@]34CCCC[C@]3(COC4)C2)cc1 850866649 CXEHRCUGENWYAJ-HDICACEKSA-N 329.400 1.627 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@@H](N)C(C)C)C2)cc1 851677045 AWQARORCWKAFKQ-RHSMWYFYSA-N 334.464 1.947 10 10 EDCE CN1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCC1(C)C 866112544 FONOLTGFDQPBBM-UHFFFAOYSA-N 334.376 1.846 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(N2CCNC2=O)CC1 779498577 HRXUWIAOHOAALJ-RQOWECAXSA-N 331.372 1.127 10 10 EDCE C[C@@H](NC(=O)NC[C@]1(CCO)CCOC1)c1ccc(N(C)C)cc1 776238325 IYIZBCMJJVRGBC-KDOFPFPSSA-N 335.448 1.902 10 10 EDCE CC(C)[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCN1C 1329925546 HFBCHOSEZRGDID-OAHLLOKOSA-N 331.416 1.033 10 10 EDCE C[C@@H](O)c1ccc(N2CCNC(=O)C23CC3)c(Br)c1 2132029324 LNTDTMFXPJEFDX-SECBINFHSA-N 325.206 1.971 10 10 EDCE C[C@@H](CO)[C@H]1CCCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1351929029 FPQLCHBJQSPTTN-SWLSCSKDSA-N 332.400 1.244 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2cncc(F)c2)cc1C 1507185998 MZTUFNKPMUUUCY-MRXNPFEDSA-N 347.390 1.418 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@](F)(CO)C3)c(Br)cc21 1917073744 JCWCODFZCIZMEV-DGCLKSJQSA-N 344.184 1.312 10 10 EDCE COCC1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 1916896110 GGNOGOPDNMUARI-GFCCVEGCSA-N 326.194 1.484 10 10 EDCE Cc1occc(=O)c1OCC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 1296245064 BNIYCZBNANOZHZ-JTQLQIEISA-N 333.340 1.486 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2cn(C)c3c(cnn3C)c2=O)c1 1470255221 TYRZOLOVAWUNHL-UHFFFAOYSA-N 326.356 1.216 10 10 EDCE CN1C(=O)[C@H](/N=N/[C@@H]2CCC[C@H]([N+](=O)[O-])C2)[C@H](O)[C@H]2CCCC[C@@H]21 1615013322 IWFZIMAGKPMOOH-KOXVGKLHSA-N 338.408 1.787 10 10 EDCE C[C@H](NC(=O)c1cc(S(N)(=O)=O)oc1Cl)c1ccccc1O 1642831403 ZSEXRJUILBJYLS-ZETCQYMHSA-N 344.776 1.777 10 10 EDCE C[C@H](NC(=O)CCNS(=O)(=O)c1cccnc1)c1ccccc1O 1643742302 XUEHHSMRVCKYNG-LBPRGKRZSA-N 349.412 1.333 10 10 EDCE COCCCN[C@H]1C[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1656241518 VHEWRGOBVIVEGS-NNUKFRKNSA-N 347.419 1.984 10 10 EDCE COCCN1C(=O)/C(=C/c2ccccc2[N+](=O)[O-])C(C(=O)OC)=C1C 6241645 FMZQUJBUVRAXBD-JLHYYAGUSA-N 346.339 1.914 10 10 EDCE CN1[C@@H](CNCc2cc(Cl)cc(Cl)c2O)CCS1(=O)=O 1965948725 NITGEQCSNRLNSZ-SNVBAGLBSA-N 339.244 1.823 10 10 EDCE OC[C@H]1CO[C@@H](CNCc2cc(Br)cc(F)c2O)C1 1966089129 VWOVIXWFMLSXHF-GZMMTYOYSA-N 334.185 1.781 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)N(C)CCN=[N+]=[N-])CO1 1985094511 PYOZOXRLDKUELV-QWRGUYRKSA-N 327.385 1.780 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985094841 UZRKACLAIWWIJK-VHSXEESVSA-N 329.357 1.369 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 1985100480 WXVBKYCYAWQGNC-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE NCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@H]32)c(F)c1Br 2146702726 LUNQOHGPVNZACB-HOSYDEDBSA-N 345.212 1.775 10 10 EDCE CNCc1ccc(N2CCC([C@H](O)CO)CC2)cc1Br 2152466789 FHHPQAFHNYHHJY-OAHLLOKOSA-N 343.265 1.738 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@]1(C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2023001631 AQZBYZBNGLKYJL-ABAIWWIYSA-N 339.396 1.924 10 10 EDCE Oc1c(Br)cc(Cl)cc1CNCCn1cnnn1 2029964375 MPUCYAMWZQGEIF-UHFFFAOYSA-N 332.589 1.584 10 10 EDCE Nc1ccc(CC(=O)NCCN(CC(=O)O)Cc2ccccc2)cc1 2035444010 VECONMYTEXDPLS-UHFFFAOYSA-N 341.411 1.514 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@@H](O)[C@H](O)C2)c(Br)c1 300139822 PDEPYYSVCPJBBV-OWYVNGRQSA-N 329.238 1.661 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H]2CS3(=O)=O)c(Br)c1 320949868 FICAVRMQOSWERK-DVVUODLYSA-N 345.262 1.845 10 10 EDCE O=S(=O)(C[C@H]1CC2(CCCC2)CO1)NCc1ccc(O)cc1O 2064529610 RNSUDGSWTDXCBE-CQSZACIVSA-N 341.429 1.867 10 10 EDCE CO[C@@H]1C[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)N(C(=O)OC(C)(C)C)C1 1906905796 FZUSDZVWTDMOCA-FDYHWXHSSA-N 340.420 1.276 10 10 EDCE CCn1nnc(Br)c1[C@@H](O)[C@H](N)c1ccccc1O 2100283462 VWFVVTJVUQXUFT-KOLCDFICSA-N 327.182 1.500 10 10 EDCE CNCc1ccc(N2CCOC[C@@]2(C)CO)c(Br)c1 2112713315 MEAFGYPXCKIRSL-CQSZACIVSA-N 329.238 1.756 10 10 EDCE COc1ccc(N2C[C@H](O)[C@H](O)C2(C)C)c(OC)c1Br 2234900865 ZQCDYVFTOWCCGL-ZANVPECISA-N 346.221 1.787 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](O)C[C@@H]2CN)c1O 2227742783 JVUSGMSMQXGWPV-RKDXNWHRSA-N 331.210 1.057 10 10 EDCE OCc1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2228399430 IUVOOJBTHXZPSS-TXEJJXNPSA-N 330.222 1.369 10 10 EDCE Cn1cc(C=CC(=O)N2CCc3ccc(Cl)cc32)c(=O)n(C)c1=O 2297413628 NBTZWJIIYHXJRW-UHFFFAOYSA-N 345.786 1.340 10 10 EDCE COC[C@H](O)CN(C)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297786144 QKISMPHCALXDAF-QGZVFWFLSA-N 334.416 1.002 10 10 EDCE C[C@@H]1CCNC(=O)[C@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2312521848 YVOGZCLSYUOYKV-KDOFPFPSSA-N 343.427 1.177 10 10 EDCE CCN1CCN(CCCNC(=O)C=Cc2ccc(N(C)C)cc2)CC1 2320615687 SVUQPQCBTMOREY-UHFFFAOYSA-N 344.503 1.910 10 10 EDCE CO[C@@H]1CN(C)C[C@@H]1NCc1ccc(C)c(Br)c1O 2352689747 PLNUBCYWWFZOHW-NWDGAFQWSA-N 329.238 1.882 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCc2cnn(C)n2)cc1C 1265826848 LCEKCOKDHJLEAQ-AWEZNQCLSA-N 345.447 1.359 10 10 EDCE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cn2ccnn2)cc1 177762797 MJAOCIXEYBRUGH-UHFFFAOYSA-N 341.337 1.935 10 10 EDCE CNC(=O)[C@@H](NC(=O)NCc1ccc2c(c1)CCCN2C)C(C)C 178455502 UNFCWAPSDFEBLA-INIZCTEOSA-N 332.448 1.639 10 10 EDCE O=C(Nc1cc(O)c(O)c(O)c1)N1CCN(c2ccccn2)CC1 217278967 VGEFFRFIYPVXNW-UHFFFAOYSA-N 330.344 1.553 10 10 EDCE CN(CC(=O)N1CCNCC1)Cc1cc(Cl)cc(Cl)c1O 38030929 BXTOVYDNHZOTCQ-UHFFFAOYSA-N 332.231 1.563 10 10 EDCE COCCN1CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1C 121555679 ICCUFYLRGCSQNI-GFCCVEGCSA-N 339.392 1.769 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)CNC(=O)c1cccnc1 137069700 CZUUDOJCEILSSY-UHFFFAOYSA-N 327.384 1.956 10 10 EDCE COc1ccc(CN[C@H]2CCC[C@@H]2CNS(C)(=O)=O)cc1C 800309023 BMQRZONZTZPNNF-CABCVRRESA-N 326.462 1.811 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](O)c1ccccn1 819697920 FYHRZAKMKSKHHA-KRWDZBQOSA-N 344.367 1.413 10 10 EDCE CCn1ccnc1CN1CCN(C(=O)Cc2ccc(N)cc2)CC1 829302755 LFGMDRSMOWHWCP-UHFFFAOYSA-N 327.432 1.372 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCC2(COC2)C1 827164785 NGYXFKPMMLGEPV-UHFFFAOYSA-N 343.427 1.152 10 10 EDCE COC(=O)[C@@](C)(CCF)NCc1ccc([N+](=O)[O-])c(OC)c1O 827352722 OBVMCTMUTNRSTG-CQSZACIVSA-N 330.312 1.690 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H]3CC[C@H](C(=O)O)O3)CC2)cc1 901918058 PSXWPOZYXLCIMW-JKSUJKDBSA-N 348.399 1.366 10 10 EDCE COC[C@@H](C1CCOCC1)N1C(=O)CN(Cc2ccccc2O)C1=O 849358709 BMICYKVMTSBWHT-HNNXBMFYSA-N 348.399 1.598 10 10 EDCE C[C@H]1CN(C(=N)NCc2cc(Br)ccc2O)CCO1 849051770 HXDYMHQHEXEMMP-VIFPVBQESA-N 328.210 1.900 10 10 EDCE Nc1ccc(NC(=O)C(=O)NC[C@@H]2C[C@H](c3ccccc3)CO2)cc1 850845911 IPFJOHKCWTWJMC-YOEHRIQHSA-N 339.395 1.896 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCCN(C)CC3)C2)cc1 854303566 YAUYHLSIXNVVQN-OAHLLOKOSA-N 332.448 1.621 10 10 EDCE CC(C)n1cc(S(=O)(=O)NNc2nc3cccnc3s2)cn1 857225249 JMCSCYATPOGFNZ-UHFFFAOYSA-N 338.418 1.774 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)c2cc(C)cnc2N)c1 766816972 IHDICCKOBCQWNC-JTQLQIEISA-N 337.401 1.726 10 10 EDCE O=[N+]([O-])c1cc(CN2C[C@@H](O)C[C@@H](O)C2)ccc1N1CCCCC1 769564238 MUQVZICLLJSVFH-GASCZTMLSA-N 335.404 1.513 10 10 EDCE Cc1cc(N(C)C)ccc1CNCc1cn(C[C@H]2CCOC2)nn1 865466537 XNDLCUKKJAQAOR-OAHLLOKOSA-N 329.448 1.979 10 10 EDCE COC(=O)C1CC2(C1)C[C@H](NC(=O)c1cc(O)cs1)CCO2 899677269 ASDJJEWDSCJLBD-KGXJWFGYSA-N 325.386 1.684 10 10 EDCE CS(=O)(=O)N1CCCC[C@H]1CNCc1cc2c(cc1O)OCO2 796514052 UUTBZYADRSKSFY-LBPRGKRZSA-N 342.417 1.025 10 10 EDCE COCCN(CCF)c1cc2c(cc1Br)[C@H](N)C(=O)N2 697293543 GZCGUCKHQREJHH-LBPRGKRZSA-N 346.200 1.823 10 10 EDCE CO[C@H]1CC[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)C1 1321778364 TZLFEEQKRYBBEL-WBVHZDCISA-N 333.432 1.890 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2C[C@@H]3[C@@H](C2)C3(F)F)c1 1331247334 LJJMBZVWQHMXMU-GHMZBOCLSA-N 346.355 1.537 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cc2ccon2)cc1C 1273920179 YWDPGHOBSLMMQO-ARJAWSKDSA-N 329.400 1.996 10 10 EDCE CN(C[C@H](O)COCc1ccccc1)C(=O)c1ccc(O)c(O)c1 1916384732 CXYFBGBRONPMMT-HNNXBMFYSA-N 331.368 1.748 10 10 EDCE O=C(O)[C@H]1C[C@H](O)CCN1Cc1c(O)cccc1Br 2136386165 GUVCFYCHZYQVKF-LDYMZIIASA-N 330.178 1.565 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)/C=C(\C)c2cnccn2)c2ccccc2O1 1532446115 MMDWXTSLVCONCW-YHVDPYDOSA-N 339.351 1.847 10 10 EDCE CC(C)(C)[C@@H](O)C[C@@H](CO)NC(=O)c1ccc(N=NC(N)=O)cc1 1467973224 VHZKDEPYAOJULN-STQMWFEESA-N 336.392 1.737 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CC[C@@H]1NC(=O)NC1=O 1540567723 XRKXQNKUWRAQAT-HNNXBMFYSA-N 344.415 1.233 10 10 EDCE COC(=O)NCC(=O)N1C[C@H](NCc2ccc(OC)c(C)c2)C[C@H]1C 1700830508 LRAISQAMYPGOAC-UKRRQHHQSA-N 349.431 1.439 10 10 EDCE O=C(Cn1nnc(-c2ccccc2)n1)NCc1c(O)cccc1F 1558454948 IGJVGUVZUBIUOM-UHFFFAOYSA-N 327.319 1.501 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cn2cncc2C)cc1C 1497640233 OUVBDOBHNKKICU-SNAWJCMRSA-N 342.443 1.971 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)C2CN(C(C)=O)C2)cc1C 1568166935 GDZWGKGZXMDOHU-ZDUSSCGKSA-N 347.459 1.324 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@]2(C)CCC(=O)N2)cc1C 1568674156 HATDUZIKZIVGQX-LIRRHRJNSA-N 347.459 1.657 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H](C)[C@@H]2CCC(=O)N2)cc1C 1493701775 KKXHGMZWLSSYGI-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@]1(CO)C[C@H]1c1ccccc1 1569883068 SKWSXMIYWOCEHB-KXBFYZLASA-N 327.380 1.923 10 10 EDCE COc1ccc(CNC[C@H]2C[C@H](NC(=O)[C@@H](C)CC(N)=O)C2)cc1C 1734214408 VSERBOXEBYJKGF-BPUTZDHNSA-N 347.459 1.500 10 10 EDCE Cc1ccc(C(=O)NCCc2ccc(N)cc2)cc1S(C)(=O)=O 152513089 RYBGEGYZYFTYMR-UHFFFAOYSA-N 332.425 1.953 10 10 EDCE CNCc1ccc(N2CC(=O)NC(=O)[C@@H]2C)c(Br)c1 234422897 XANCUSHGTXTLPU-QMMMGPOBSA-N 326.194 1.020 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@]2(CC(C(=O)NCCN=[N+]=[N-])=NO2)C1 1963815833 BXYAYFHUKDOANK-AWEZNQCLSA-N 338.368 1.569 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003168901 XFTBICLIYNZLOJ-NTASLKFISA-N 336.432 1.898 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)NCc1ccccc1O 269144010 NOQZQJAAUCTAOM-OLZOCXBDSA-N 336.388 1.379 10 10 EDCE CO[C@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C1CN(C(=O)OC(C)(C)C)C1 2010396172 MXYUAPDULVCRDH-NEPJUHHUSA-N 339.396 1.780 10 10 EDCE C[C@](NCCCN=[N+]=[N-])(C(N)=O)c1ccnn1Cc1ccccc1 2024697808 VBBMKMGXCXPAGX-MRXNPFEDSA-N 327.392 1.922 10 10 EDCE CNCc1ccc(N2C[C@@H](OC)C[C@@H]2CO)c(Br)c1 311562618 SIZMUZWGFVLLKQ-NEPJUHHUSA-N 329.238 1.755 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)[C@@H](CO)C2)cc1Br 316619701 XJHWAXAZINMJIB-IUODEOHRSA-N 343.265 1.738 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1CN2CCN1CC2 394694626 MKDXDUCXSJOGDX-GFCCVEGCSA-N 326.238 1.244 10 10 EDCE CCN(CCc1ccccn1)C(=O)c1cnn2c(O)cc(C)nc12 2062914973 KOVZVXRETILFSI-UHFFFAOYSA-N 325.372 1.843 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2210543068 XRAUJAYBOYOABF-GARJFASQSA-N 327.385 1.874 10 10 EDCE NCc1ccc(N2CCC[C@@H](OCCO)C2)cc1Br 2113853575 HLGOMGOQTOSYIV-CYBMUJFWSA-N 329.238 1.886 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2236633665 RCHZCWDGGKWHCR-UTUOFQBUSA-N 343.265 1.896 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1nccnc1Br 2283033968 BJBBIJDWDBFPNC-UHFFFAOYSA-N 338.161 1.623 10 10 EDCE CC(=O)N1CCN(C2=NC(=O)C(=Cc3ccccc3O)S2)CC1 2293034650 KGIUTIANTQIKIP-UHFFFAOYSA-N 331.397 1.527 10 10 EDCE O[C@H]1COC2(CN(c3ccc(OCc4ccccc4)cc3)C2)[C@H]1O 2299525789 QWYUDVYVWYHXNN-ROUUACIJSA-N 327.380 1.576 10 10 EDCE O=C1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CCN1 105152389 WFMKREFYUSLQOP-UHFFFAOYSA-N 348.472 1.271 10 10 EDCE CCCn1nc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccc1=O 183444856 CMTPRWQVAMBGTL-NSHDSACASA-N 331.372 1.426 10 10 EDCE CNC(=O)CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 187378266 MDVATDYQLJYKDL-LLVKDONJSA-N 341.358 1.509 10 10 EDCE Cc1ccc(CNC(=O)c2cc(O)ncn2)c(O)c1Br 2380753401 GCNNTPVPTCCJDG-UHFFFAOYSA-N 338.161 1.889 10 10 EDCE COCCN(Cc1cc(Cl)cc(C)c1O)[C@@H]1CCS(=O)(=O)C1 809764296 WBIWLMOLTBKLAB-CQSZACIVSA-N 347.864 1.990 10 10 EDCE CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NCc1cccc(Cl)c1O 800541572 NBNHSXYQARQHDW-GWCFXTLKSA-N 332.853 1.853 10 10 EDCE CNC(=O)[C@@H]1CCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C1 817171210 RONUATGMDFKOCP-GOEBONIOSA-N 346.475 1.770 10 10 EDCE Oc1ccc(Br)cc1CNCC1(F)COCCOC1 2130653233 VSNNPPVXRWPQRD-UHFFFAOYSA-N 334.185 1.999 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NCc3noc(C)n3)C2)cc1 823140667 KUGBFUOZUPSRSY-ZDUSSCGKSA-N 345.403 1.712 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCCC[C@@H]2CC(N)=O)cc1 839481169 OVKZTYWQYNRNBW-MRXNPFEDSA-N 332.448 1.099 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N3CC[C@H]3C)CC2)cc1 743362598 GCCSNDNSWAWJOD-OAHLLOKOSA-N 332.448 1.621 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)NCC[C@H]2CCCN2)cc1 842206367 DXIMFQVNWYZTAA-MRXNPFEDSA-N 346.475 1.407 10 10 EDCE COC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2ccccc2O)n(C)c1 919118839 LNNXWVCNVNKMFK-JTQLQIEISA-N 338.385 1.557 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@@H](n3cc(CN)nn3)C2)c1 841099076 CWSQLGWTAQCOGW-OAHLLOKOSA-N 331.420 1.678 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCCOC2CCOCC2)c1 927500209 KVXVXKPDFQABMK-LBPRGKRZSA-N 338.404 1.957 10 10 EDCE CO[C@H]1CN2C(=O)N(Cc3ccc(N(C)C)c(F)c3)C(=O)[C@@]2(C)C1 865301185 IRWIJAWDQXBOGY-SJKOYZFVSA-N 335.379 1.833 10 10 EDCE CN(CC(=O)NCCc1ccc(O)c(O)c1)c1ccc(Cl)cn1 762275782 ZYSVQVRYRZCMPS-UHFFFAOYSA-N 335.791 1.941 10 10 EDCE CCOc1cccc(CN(C)CCN2CCCS2(=O)=O)c1O 769556688 LMICCRFMHVCGJU-UHFFFAOYSA-N 328.434 1.258 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)[C@H]3CCC(=O)N3)C2)cc1 862158611 IWSDKRLVBPSCPN-DVOMOZLQSA-N 331.416 1.305 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)N1Cc2cccc(O)c2C1 871202371 FVGVAIILDKLCES-UHFFFAOYSA-N 336.388 1.776 10 10 EDCE Cc1cc(O)c(CNCCc2nnc3c(=O)n(C)ccn23)cc1Cl 895788800 HVGFLEOVVQLVKX-UHFFFAOYSA-N 347.806 1.428 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C(=O)OC)on1 1140198352 AMUVWGPJZLMRGR-UHFFFAOYSA-N 325.317 1.583 10 10 EDCE C[C@@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1322198274 VIIOOMREIHXTAO-RHSMWYFYSA-N 345.443 1.444 10 10 EDCE COc1nc(C(=O)N[C@@H](C)CNCc2ccc(OC)c(C)c2)co1 1268697307 NKELDMRSSBXNGF-LBPRGKRZSA-N 333.388 1.908 10 10 EDCE COC[C@@H](C)NC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1276712478 VEZKNQMPJIDKKL-ABAIWWIYSA-N 347.419 1.982 10 10 EDCE Cc1cc(C(=O)N[C@@H](C)c2ccccc2O)ccc1S(N)(=O)=O 1454822126 XDKPQKDMZMBDNV-NSHDSACASA-N 334.397 1.839 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CN(C)[C@@H]1CCC[C@H]1O 1469103428 HDFBTXXVOHYUSV-ATZDWAIDSA-N 347.503 1.953 10 10 EDCE O=C1C[C@H](c2ccccc2)N(C(=O)Cc2ccc(O)c(O)c2)CCN1 1542075577 SMWLTGUHWKEGPT-OAHLLOKOSA-N 340.379 1.730 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H](Cc1nc[nH]n1)c1ccccc1 1616723777 MOSUWJVDDBPSCS-AWEZNQCLSA-N 338.367 1.859 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)Cn2cc(C)cn2)cc1C 1483212539 WENZZDWCRGVRAJ-HNNXBMFYSA-N 330.432 1.803 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)Cc2cccs2)cc1C 1715574414 LYCSDUXCVDIZOF-OAHLLOKOSA-N 348.468 1.875 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@H]2COCCO2)C2CC2)cc1C 1713861951 NMLACXBMVHGYQU-SJLPKXTDSA-N 348.443 1.403 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N(C)C[C@@H](C)O)c(Br)cc21 118712321 LYGJZMKQPSIESP-AMIZOPFISA-N 342.237 1.869 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)C23CCN(CC2)C3)cc1C 1714443629 FFEQCJCKMKPTBM-OAHLLOKOSA-N 345.487 1.941 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CN2CC[C@H](C)C2)cc1C 1567560929 UXWLAJLGQPVBSG-HNNXBMFYSA-N 333.476 1.893 10 10 EDCE COc1ccc(C=O)c(OCC(=O)NCc2cccc(O)c2O)c1 1637045521 DQRLOWPFWXKYFY-UHFFFAOYSA-N 331.324 1.614 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)c1ccc(-n2cnnn2)cn1 1647791067 IPPLSCNRTONJLP-UHFFFAOYSA-N 346.350 1.846 10 10 EDCE CC(=O)N1C[C@H](C(=O)NCc2cc(O)ccc2O)Oc2ccccc21 1651222818 QBYNBIPAEAXITG-QGZVFWFLSA-N 342.351 1.528 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)N[C@H]2CS(=O)(=O)C[C@H]2C)c1 1685295631 UFAJGRKNYOBRMW-BREBYQMCSA-N 342.417 1.194 10 10 EDCE CCOC(=O)c1c(NC(=O)[C@H](N)CC(=O)OC)sc2c1CCC2 1865966344 WQANRGZDFOSZEH-SECBINFHSA-N 340.401 1.242 10 10 EDCE CC[C@@H]1C(=O)NC(=O)CN1c1ccc(CNC)c(Br)c1 234127506 NJRQGWSSSDTNNT-GFCCVEGCSA-N 340.221 1.410 10 10 EDCE COc1cccc(O)c1CNCC1(NC(=O)OC(C)(C)C)COC1 1967809703 UALSWHCTEQEINJ-UHFFFAOYSA-N 338.404 1.784 10 10 EDCE NCc1cc(F)c(N2CC[C@H](OCC(N)=O)C2)cc1Br 2145371830 PAAIKCUSLATFSM-VIFPVBQESA-N 346.200 1.128 10 10 EDCE N[C@H]1C[C@H](CC(=O)C(=O)[C@]2(COCc3ccccc3)CCNC2)C1 2003167816 DGKZWDKSRYKRAT-GPMSIDNRSA-N 330.428 1.449 10 10 EDCE CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1CCN=[N+]=[N-] 1982240910 DVYLYEIDVDWVLB-LLVKDONJSA-N 327.385 1.781 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 1985102542 IHNWBGPMEOVLDZ-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985104404 IEHNHYAWPMRTHO-OUAUKWLOSA-N 327.385 1.562 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 2010388459 BUFCSZZXERLNCY-LLVKDONJSA-N 343.384 1.759 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](N=[N+]=[N-])C1)C1COC1 2010401224 BNIRGXFFQJMACZ-VXGBXAGGSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)C1(O)CCC1 2014483726 VEJIGYMEQZDDFI-WDEREUQCSA-N 339.396 1.706 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H](CCC(N)=O)NC(=O)OC(C)(C)C 2025612801 RZEDLVLQMAQZFU-SNVBAGLBSA-N 342.400 1.304 10 10 EDCE CNCc1ccc(N2CC[C@](CO)(OC)C2)c(Br)c1 402909231 BIQHHRKDCBGOOT-AWEZNQCLSA-N 329.238 1.756 10 10 EDCE O=C1Nc2cc(N3CC4(CCCO4)C3)c(Br)cc2[C@H]1O 705741338 HHVJTDGSHCFJOK-GFCCVEGCSA-N 339.189 1.804 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1908253463 SYFYOVMZCZICAU-SDDRHHMPSA-N 339.396 1.516 10 10 EDCE Nc1ccc(OCCN2[C@H]3CC[C@H]2CN(C(=O)C(F)(F)F)C3)cc1 2044681996 SMCOJRLAQMBGJF-STQMWFEESA-N 343.349 1.885 10 10 EDCE CN(C[C@@H](O)COCc1ccccc1)C(=O)c1cc(O)c(O)c(O)c1 2068579952 ZSFSKMONSUYJHY-CQSZACIVSA-N 347.367 1.453 10 10 EDCE O=S1(=O)C[C@@H]2[C@@H](CCN2Cc2ccc(Br)cc2O)C1 2094882766 MWYSPFPPXMCHQJ-CMPLNLGQSA-N 346.246 1.774 10 10 EDCE CSc1ncc(CNS(=O)(=O)C[C@H]2N[C@H]3CC[C@H]2C3)s1 2284499506 PFWQEXBIMKZOMA-ATZCPNFKSA-N 333.504 1.425 10 10 EDCE CC[C@@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2288913278 WYDSHDYKWIDMMP-KGYLQXTDSA-N 341.205 1.784 10 10 EDCE Cc1ccc(CN(C)[C@@H]2C[C@H](N)C[C@H]2O)c(O)c1Br 2352643241 MTTCPLZGMZWQCZ-QJPTWQEYSA-N 329.238 1.746 10 10 EDCE Cc1ccc(CN2CCOC[C@H]2C(N)=S)c(O)c1Br 2352672765 OGLHDAHVSWZPBR-JTQLQIEISA-N 345.262 1.950 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H](O)[C@H]3C4)c(Br)cc21 2355620117 LRDICHARJIJKQR-YRWCUGRBSA-N 338.205 1.361 10 10 EDCE Cc1cnn(C[C@@H]2CN(Cc3cc([N+](=O)[O-])ccc3O)CCO2)c1 171608677 WMSMICYTMVZBLB-HNNXBMFYSA-N 332.360 1.706 10 10 EDCE CN(C)c1ccc(CNC(=O)c2ccnc(N3CCOCC3)n2)cc1 1348458448 MQSAZLXYAMVAPI-UHFFFAOYSA-N 341.415 1.309 10 10 EDCE CC(=O)N1CC[C@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 175267599 ZZSKMBOPEALJPF-IRXDYDNUSA-N 346.427 1.768 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cn4c(n3)COCC4)CC2)cc1 75531168 RZJIHPCDYSFPNO-UHFFFAOYSA-N 342.399 1.384 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CCCSCC3)CC2)cc1 89982055 HLKHCWRYSTXLQF-UHFFFAOYSA-N 349.500 1.783 10 10 EDCE C[C@@H](Cn1cncn1)N1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 278056896 WVPDQYFAOGUAJS-JTQLQIEISA-N 349.778 1.490 10 10 EDCE O=C(NCc1cc(Br)ccc1O)c1ccc2nnnn2c1 804734442 LIAZKJFEPORVHV-UHFFFAOYSA-N 348.160 1.522 10 10 EDCE Cc1nocc1CNCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 815117176 MXQJTVJPWBRWTI-HNNXBMFYSA-N 328.416 1.975 10 10 EDCE O=S(=O)(c1cc(F)cc(F)c1O)N(CCO)c1cccc(F)c1 821190613 CORRTSPQMYNKKH-UHFFFAOYSA-N 347.314 1.997 10 10 EDCE COc1cc(O)ccc1NS(=O)(=O)CC1(OC)CCOCC1 901703200 DMRWZVISKAPJIA-UHFFFAOYSA-N 331.390 1.338 10 10 EDCE Cc1cc(CNC(=O)CCNC(=O)CO)c(C)n1-c1ccccc1 913166950 KWYNHXRGNCBRCN-UHFFFAOYSA-N 329.400 1.209 10 10 EDCE CC(C)(C)OC(=O)COCC(=O)NCCc1ccc(O)c(O)c1 843832344 LTGXKOLFDZJECE-UHFFFAOYSA-N 325.361 1.115 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)c3cnccn3)C2)cc1 912292992 RMRXVYNGGKIEST-KGLIPLIRSA-N 326.400 1.984 10 10 EDCE CN1CCCc2cc(CNC(=O)NC[C@@H]3C[C@@H]4COC[C@@H]4O3)ccc21 915390828 RPKPKLMOXARWQT-RYRKJORJSA-N 345.443 1.672 10 10 EDCE Cc1cc(N(C)C)ccc1CN1C(=O)N[C@@H](c2ccnn2C)C1=O 843307515 IEXZJGFOELMQHU-HNNXBMFYSA-N 327.388 1.588 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1C[C@@H](C(N)=O)C1 845445264 HSRDOXGTQPAORH-GASCZTMLSA-N 332.448 1.937 10 10 EDCE Nc1ccc(NC(=O)C(=O)N[C@@H](C[C@H]2CCCO2)C(F)(F)F)cc1 848602550 GSBNUERWNKPCCO-NEPJUHHUSA-N 345.321 1.824 10 10 EDCE O=C(NCC[S@@](=O)CC(F)(F)F)NCc1c(O)cccc1F 923188886 TULQHEODBWMREI-JOCHJYFZSA-N 342.314 1.642 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCN([C@H]2CCNC2)CC1 843123731 OTUWXLRPYNVEBC-IBGZPJMESA-N 330.476 1.003 10 10 EDCE CCS(=O)(=O)C[C@H](C)N[C@H]1CCN(c2ccc(OC)cc2)C1 850487071 FEJRFWIITFVUIE-KBPBESRZSA-N 326.462 1.687 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)C[C@H]2CO)cc1Br 698196418 GQIGVGPRRXGUBV-KBPBESRZSA-N 343.265 1.879 10 10 EDCE CC1(C)COC[C@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852374765 XVIAGVWXNLCWDC-QGZVFWFLSA-N 347.459 1.872 10 10 EDCE O=C1N[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CS1 856210135 OPUVDQYRUMBSOP-CQSZACIVSA-N 335.429 1.089 10 10 EDCE Cc1cc(CNC(=O)N[C@H]2CCNC2=O)c(C)n1-c1ccccc1 858596400 FMQCHJCOIUKWAQ-INIZCTEOSA-N 326.400 1.782 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nnc(C4CC4)o3)CC2)cc1 865892483 ARLJMXIAXXYSEB-UHFFFAOYSA-N 328.372 1.918 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCN(C4CCC4)CC3)cc2N1 761898459 PUVXDKMVGSGGKY-UHFFFAOYSA-N 332.360 1.600 10 10 EDCE COc1ccc(N2CCN(CCNC[C@]3(OC)CCOC3)CC2)cc1 876979857 BCXWACFBIIGWRA-LJQANCHMSA-N 349.475 1.212 10 10 EDCE O=C1N[C@H](C(F)(F)F)CC[C@H]1C(=O)N1Cc2cccc(O)c2C1 871198264 FCZPAHVQISQUSQ-SKDRFNHKSA-N 328.290 1.692 10 10 EDCE C[C@H]1CN(CCNC(=O)c2cc3cc(O)c(O)cc3s2)CCO1 896043151 NETSTKIWVCQZEN-JTQLQIEISA-N 336.413 1.763 10 10 EDCE COC(=O)[C@@]1(O)CCN(Cc2c(O)cccc2Br)C1 895702337 NLVWHCRHCCFRAA-CYBMUJFWSA-N 330.178 1.265 10 10 EDCE COC(=O)[C@](C)(NC(=O)Cc1ccc(O)c(O)c1)c1ccccc1 1136593548 GSCKWVUVYKSOAV-GOSISDBHSA-N 329.352 1.845 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@@H](C)CO1 1153664228 RRWCAGBHKUYPFA-GMXABZIVSA-N 337.372 1.113 10 10 EDCE O=C(Cc1ccn(CC(F)(F)F)n1)NCc1c(O)cccc1O 1156885735 MTEPYXYWZLZHSD-UHFFFAOYSA-N 329.278 1.716 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)/C=C/c2ccc(C(N)=O)o2)c1 1150543362 MOQROQXWYCVHHY-VHODGJRUSA-N 330.340 1.983 10 10 EDCE CCN(C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)[C@H]1CCCOC1 1332787899 GWQSIADZTUICCU-PBHICJAKSA-N 347.459 1.957 10 10 EDCE CCn1nncc1C(=O)NC[C@@H](C)CNCc1ccc(OC)c(C)c1 1267979282 KUQZSNALFXPMGR-ZDUSSCGKSA-N 345.447 1.771 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@H](c2nncn2C2CC2)C1 1443538918 LYAQKVCEGGBDRO-ZDUSSCGKSA-N 342.399 1.973 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cccnc1C(N)=O 1465408358 CLVDEMKTTMPZNG-UHFFFAOYSA-N 326.356 1.286 10 10 EDCE CCN1CCN(C[C@H](C)CNC(=O)Cc2ccc(O)c(O)c2)CC1 1464886810 HRFOMTRXXDSUCK-CQSZACIVSA-N 335.448 1.030 10 10 EDCE CCC(CC)C(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1470386596 HNEXDHBLMMYSRO-UHFFFAOYSA-N 334.416 1.747 10 10 EDCE COc1ccc(-n2nnnc2CN[C@@H](C)[C@H](C)NC(=O)C(C)C)cc1 1700385282 COGXOABNVJQTRX-STQMWFEESA-N 346.435 1.310 10 10 EDCE Nc1snnc1-c1nc(-c2ncccc2Br)no1 1923197940 STROOUARABSBMB-UHFFFAOYSA-N 325.151 1.995 10 10 EDCE O=C(C[C@@H]1C(=O)Nc2c(F)cccc21)NCc1ccc(O)c(O)c1 1622663988 BPVRMXBCUOZUMV-NSHDSACASA-N 330.315 1.979 10 10 EDCE COC(=O)c1cnc(SCC(=O)[C@H]2CCS(=O)(=O)C2)s1 1559416554 NUKDKRJCJAPQRD-ZETCQYMHSA-N 335.428 1.026 10 10 EDCE Cc1cccc2nc(CCNC(=O)Cc3ccc(O)c(O)c3)cn12 1557318760 IAJIANIEAOXENN-UHFFFAOYSA-N 325.368 1.955 10 10 EDCE CN1C(=O)CCc2cc(C(=O)NCc3cc(O)ccc3O)ccc21 1558175432 QDTRQWXSOKKGSH-UHFFFAOYSA-N 326.352 1.937 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@]2(CCOC2)O1 1634917498 LKGGIUMIRMGDRL-ZBEGNZNMSA-N 332.360 1.869 10 10 EDCE CN(C(=O)Cc1ccc(O)c(O)c1)[C@@H]1CCCC[C@H]1S(C)(=O)=O 1565975177 GAXFNDONKKVARV-IUODEOHRSA-N 341.429 1.455 10 10 EDCE Cc1ccc(N(C)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)cc1C 1772823866 MFAAGBFHYOBFOD-CLFYSBASSA-N 327.384 1.377 10 10 EDCE CNCc1ccc(N2CC[C@](C)(C(N)=O)C2)c(Br)c1 234376996 CYWNEWVNJPUNJO-AWEZNQCLSA-N 326.238 1.870 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@]2(C)C[C@]2(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003166201 DHZQSCRNAJDHRA-GWIYSAMLSA-N 336.432 1.899 10 10 EDCE COC(=O)[C@@H](O)CN(C)c1ccc(CNC(=O)OC(C)(C)C)cc1 1999353094 FYYJPPWQACQZLY-AWEZNQCLSA-N 338.404 1.681 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010392661 IDGYWYZDTWLQLK-TUAOUCFPSA-N 339.396 1.658 10 10 EDCE COC1CC(NC(=O)OC(C)(C)C)(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010403085 ZSUPCTZNCMLVPQ-NLTNOIMHSA-N 339.396 1.970 10 10 EDCE O=C(O)[C@@H]1CO[C@@H]2CN(Cc3c(O)cccc3Br)C[C@H]21 2160867461 KMYOZWOLVPSYND-IYYTYJHQSA-N 342.189 1.686 10 10 EDCE CC(C)(C)NCc1ccc(N2CC(O)(CO)C2)c(Br)c1 2171950913 JXAJEGAUUISRCS-UHFFFAOYSA-N 343.265 1.881 10 10 EDCE CN1CCO[C@H](CN(C)Cc2ccc(Br)cc2O)C1 709417534 BTGZUBHCSMBZAF-ZDUSSCGKSA-N 329.238 1.917 10 10 EDCE C[C@@H]1OCCN(Cc2ccc(Br)cc2O)[C@@H]1C(=O)O 691423820 SPAZUWNULNYJDF-UFBFGSQYSA-N 330.178 1.829 10 10 EDCE CS(=O)(=O)C1CC(NCc2cccc(Br)c2O)C1 715188324 VAZGHTFBKKGQEW-UHFFFAOYSA-N 334.235 1.820 10 10 EDCE NCCC1(O)CCN(Cc2c(O)cccc2Br)CC1 717949892 CZABNIVSARHNNX-UHFFFAOYSA-N 329.238 1.830 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H](c4ccn(C)n4)C3)c2n1 2062366836 AMIFWGYSXPUHOF-LBPRGKRZSA-N 340.387 1.497 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCC(C)(C)c3ccncc3)c2n1 2065134464 PRIAINYMKUBCNF-UHFFFAOYSA-N 325.372 1.846 10 10 EDCE OCc1ccc(N2CCC(C(CO)CO)CC2)c(Br)c1 2170672795 DUDRJWZCLYBGPA-UHFFFAOYSA-N 344.249 1.759 10 10 EDCE Nc1cnc(NC(=O)c2cc(O)c(O)c(O)c2)c(Br)c1 2188924234 PQOSLWDXANDUJW-UHFFFAOYSA-N 340.133 1.795 10 10 EDCE C[C@@H](O)[C@@H]1CCCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2193595460 HXJSSPGGYPJXCA-RESLBDFXSA-N 341.205 1.784 10 10 EDCE O=C(c1ccc(O)c(O)c1)N1CCC[C@H](CNC(=O)C(F)(F)F)C1 2054397779 MDFJXCIHYCIMBE-SECBINFHSA-N 346.305 1.629 10 10 EDCE CN1C[C@@H]2C[C@H]1CN2c1cc2c(cc1Br)[C@H](O)C(=O)N2 2187610467 HNZPTLFUTDWKOP-UPFKWVMWSA-N 338.205 1.327 10 10 EDCE CN1CCc2cc([C@@H](CN)N3CC(NC(=O)C(F)(F)F)C3)ccc21 2074456451 OFZNUDNTIIUAFH-CQSZACIVSA-N 342.365 1.041 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2210535387 LSSBBCVUIZHQSQ-AXFHLTTASA-N 327.385 1.610 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2210535739 MMPOOTNCOIQNQW-OUAUKWLOSA-N 327.385 1.610 10 10 EDCE O=C(O)[C@H]1CC[C@H](O)CN1Cc1ccc(Br)cc1O 2264528104 FTBAAZFAYFXLES-WDEREUQCSA-N 330.178 1.565 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCC[C@@H](CN2CCOCC2)C1 2307987167 IVOOGPVJHCKCSJ-INIZCTEOSA-N 346.427 1.682 10 10 EDCE C[C@H]1CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)[C@H]1CO 2310988527 OUILPAKJLPNHIP-YJBOKZPZSA-N 330.428 1.766 10 10 EDCE Cc1ccc(CNS(=O)(=O)CCCO)c(O)c1Br 2327630565 KMQILECWCRJMNT-UHFFFAOYSA-N 338.223 1.265 10 10 EDCE CN(C)C[C@H]1CN(C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 117040777 VMLYKYMEHHZCOT-AWEZNQCLSA-N 338.427 1.364 10 10 EDCE CC(=O)N1CSC[C@@H]1C(=O)N1CCOc2cc(N(C)C)ccc21 408415118 NNOVMHXKHGQBHZ-CQSZACIVSA-N 335.429 1.399 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@](C)(N)CO 1951698566 PMYZKQFJBLHUPB-XJKSGUPXSA-N 326.393 1.243 10 10 EDCE Nc1cccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 178730082 WROHUGUCBOCOIS-UHFFFAOYSA-N 345.424 1.756 10 10 EDCE CCN(C(=O)[C@H](C)Cc1ccc(O)c(O)c1)[C@H]1CCS(=O)(=O)C1 170245291 FGDNIKVIHQIJPU-YPMHNXCESA-N 341.429 1.312 10 10 EDCE C[C@@H]1C[C@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)CCN1C 1348613387 IABAUYUPGWJQQT-TZMCWYRMSA-N 331.416 1.176 10 10 EDCE C[C@@H]1CC[C@H](C(N)=O)CN1c1ccc(CN)c(Br)c1 228150181 YRYTZAKKTYWHBX-KOLCDFICSA-N 326.238 1.998 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCO[C@@H](CN(C)C)C2)c([N+](=O)[O-])c1 255342128 ODPZMRXLVLUWMD-VSKVDJIOSA-N 349.387 1.548 10 10 EDCE C[C@H]1[C@@H](C)N(C(=O)NCc2ccc(N(C)C)c(F)c2)CC[S@@]1=O 265524270 AMKOZBQXJOZKJM-WCBZVUCDSA-N 341.452 1.943 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN[C@@H]2CC(=O)N([C@@H]3C[C@H]3C)C2)c1O 376055045 PILZCQZVBZNCEX-IRUJWGPZSA-N 335.360 1.408 10 10 EDCE CC(=O)C(=O)COC(=O)c1cccc(CNc2ccnc(C)n2)c1 808535994 IKEMKJMGNKFMIT-UHFFFAOYSA-N 327.340 1.712 10 10 EDCE COc1ccc(N2CC[C@@H](CNc3cncc(OCCO)n3)C2)cc1 819936338 RWYNZHUCMMXVOO-AWEZNQCLSA-N 344.415 1.795 10 10 EDCE CCn1ncc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)n1 815258883 MWKBPVHZQATNQV-UHFFFAOYSA-N 329.404 1.705 10 10 EDCE COCC[C@H](COC)NC(=O)NCc1ccc(N2CC=CC2)cc1 811884365 FQTXKTVBSXLFAO-MRXNPFEDSA-N 333.432 1.914 10 10 EDCE O=C(NCc1ccccc1O)c1ccc(-n2cnnn2)cc1Cl 729529676 BIGOJHAQXHUMJH-UHFFFAOYSA-N 329.747 1.951 10 10 EDCE CN1CCCc2cc(CNC(=O)NCCCc3ncn(C)n3)ccc21 826020354 RWGYBPPKUGYASP-UHFFFAOYSA-N 342.447 1.630 10 10 EDCE CC1(C)C[C@@H](OC(=O)c2cc(NS(C)(=O)=O)ccc2O)CO1 849712083 HKHANVZSZOVFQF-SNVBAGLBSA-N 329.374 1.488 10 10 EDCE O=C(NCCN=c1cc[nH]cc1)NCc1ccc(N2CC=CC2)cc1 741090571 KZDGWIQGSXEHRX-UHFFFAOYSA-N 337.427 1.791 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC[C@](O)(CO)C2)c([N+](=O)[O-])c1 840329629 NDESWMZTGXZTKE-DQOPKJQZSA-N 336.344 1.105 10 10 EDCE CN(C)c1ccc(CNC(=O)CN(C)C2C[C@@H]3CC[C@H](C2)N3)cc1 844221189 JSQLUVFVMPWWRQ-BYICEURKSA-N 330.476 1.584 10 10 EDCE C[C@@H]1C(=O)N(CCN(C)C)CN1Cc1ccc(N2CCOCC2)cc1 843427749 CBRLGTVMLJYSGX-MRXNPFEDSA-N 346.475 1.075 10 10 EDCE Cc1cc(N(C)C)ccc1CN1CCN([C@@H]2CCNC(=O)CC2)CC1 840951630 CQSJZQKGPARYFV-SFHVURJKSA-N 344.503 1.847 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@@](O)(C2CC2)C1 852503322 SNHOUELWAWUSBJ-FQEVSTJZSA-N 345.487 1.948 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H](O)C(F)(F)C3)cc2N1 853804367 QXRLKIPXPUTTBZ-NSHDSACASA-N 329.259 1.132 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCNC(=O)C(C)C)C2)cc1 851939001 DGNFLBIHNIUYQN-AWEZNQCLSA-N 348.447 1.345 10 10 EDCE CC[C@@H](CN1CCOCC1)NC(=O)NCc1c(O)cccc1F 925614013 WBGQAYAUARJBHX-LBPRGKRZSA-N 325.384 1.441 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3c(C)nn(C)c3OC)C2)cc1 855230718 IKHKTCDBNJZDEF-ZDUSSCGKSA-N 344.415 1.754 10 10 EDCE COc1ccc(N2CCN(C(=O)C3(N4CCOCC4)CC3)CC2)cc1 864470631 LOFCSUXLPHMNQP-UHFFFAOYSA-N 345.443 1.209 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)COCC(F)F)C2)cc1 862035618 ZLLGHEGKFLUARA-LBPRGKRZSA-N 328.359 1.919 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@@H](C)NC2)cc1 861767586 SXMDXMXNQSHEPB-GDBMZVCRSA-N 346.475 1.406 10 10 EDCE COC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)O1 862158492 IPKBNVJPJKEJJD-WQVCFCJDSA-N 348.399 1.111 10 10 EDCE CC1(C)CC[C@@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)O1 779330809 DHOFMVQQEMWPHN-NSHDSACASA-N 342.417 1.451 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(CNCc2ccc(O)c(O)c2)CCOC1 688913036 RRCIQKQDWQRDJA-KRWDZBQOSA-N 338.404 1.871 10 10 EDCE CN[C@H](C)c1ccc(N2CC(=O)NC(=O)[C@@H]2C)c(Br)c1 97292475 RLSCJFMHRDEJTN-BDAKNGLRSA-N 340.221 1.581 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(Cc2ncon2)CC1 1303862374 YCOXFTJXJNYGTP-DUXPYHPUSA-N 329.356 1.975 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cc2cn(C)nc2C)cc1C 1317595583 ZFZOPYDQHBARRZ-UHFFFAOYSA-N 344.459 1.836 10 10 EDCE O=S1(=O)C[C@H]2C(CNCc3c(O)cccc3Br)[C@@H]2C1 2117986032 QXIOLUUXQHPBDW-QWRGUYRKSA-N 346.246 1.535 10 10 EDCE CN1CC[C@H](C(=O)N2Cc3cccc(O)c3C2)[C@@H](c2cnn(C)c2)C1 1330662161 JHGPZBPNISOMGY-JKSUJKDBSA-N 340.427 1.703 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C(C)(C)CNC(C)=O)cc1C 1268709490 VYNMVWSDTGIJLC-AWEZNQCLSA-N 349.475 1.760 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1csc(-c2cnccn2)n1 1299574318 PJBGAQDDXKJYFH-UHFFFAOYSA-N 328.353 1.941 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CC[C@H]1NC(=O)NC1=O 1540567724 XRKXQNKUWRAQAT-OAHLLOKOSA-N 344.415 1.233 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)COCc1nnc(C)s1 1623574736 ZBGHDVROHCSOBW-UHFFFAOYSA-N 342.417 1.871 10 10 EDCE CCn1ncc(C(=O)NC/C=C\CNCc2ccc(OC)c(C)c2)n1 1716291861 YGNVSTRQIFJHEX-WAYWQWQTSA-N 343.431 1.691 10 10 EDCE CC[C@H]1C(=O)NC(=O)CN1c1ccc(CN)c(Br)c1 228153872 FYVFIIDJBQPOBK-NSHDSACASA-N 326.194 1.149 10 10 EDCE NCc1ccc(N2CCN3C(=O)NC[C@H]3C2)cc1Br 228153988 GJYATZLLCJUPPO-NSHDSACASA-N 325.210 1.122 10 10 EDCE COC1(c2nccn2C)CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1558184755 AZOBLQVSNIRXSX-UHFFFAOYSA-N 345.399 1.538 10 10 EDCE CC(C)CNC[C@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1725765093 DUNVPTYJGYXTOH-AWEZNQCLSA-N 335.408 1.528 10 10 EDCE CCCCC(=O)N1CSC[C@H]1C(=O)NCc1c(O)cccc1O 1647270144 NCCJXKRSDSUQAV-LBPRGKRZSA-N 338.429 1.806 10 10 EDCE COc1ccc(CNC[C@H]2C[C@H](NC(=O)CN(C)C(C)=O)C2)cc1C 1734202836 IMCVMSPTSJDJNN-QAQDUYKDSA-N 347.459 1.466 10 10 EDCE CC[C@H](NC(C)=O)C(=O)N[C@H](C)CNCc1ccc(OC)c(C)c1 1669403682 UUXGIDWNQMFMSK-CJNGLKHVSA-N 335.448 1.513 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)OCC(=O)NC(N)=O)c2C)c1 5924693 GYKNKRHJWPJDOZ-UHFFFAOYSA-N 329.356 1.754 10 10 EDCE CCc1nnc(NC(=O)CN2C(=O)[C@@H](CC)SC2=S)s1 11635631 VUNQDLXPYPCJAS-ZCFIWIBFSA-N 330.460 1.678 10 10 EDCE CC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(CO)cc1Br 1877084235 TWOSJCDJXJHDED-RYUDHWBXSA-N 325.206 1.751 10 10 EDCE Cn1nnc(Br)c1CNCc1cc(F)cc(F)c1O 1966012491 TXHGHWFDXHCOQP-UHFFFAOYSA-N 333.136 1.851 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985096729 VWFQRTFPJFJSNZ-WDEREUQCSA-N 325.369 1.389 10 10 EDCE COc1cccc(O)c1CNC1(CO)CN(C(=O)OC(C)(C)C)C1 1997922890 ONANYCDWEICPEJ-UHFFFAOYSA-N 338.404 1.472 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCCN=[N+]=[N-])C[C@H]2OCC[C@@H]21 2010392452 ZTUSMDZRHWJJMQ-SDDRHHMPSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2018048678 KWVWJQOLJOPCIK-VXGBXAGGSA-N 341.412 1.811 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@]12CC[C@@H](C1)[C@@H](O)[C@@H]2O 2176916917 KTWGTMJEEMUYED-MBTXQYBYSA-N 346.196 1.658 10 10 EDCE NCc1ccc(N2CC(C(=O)NC3CC3)C2)c(F)c1Br 2168042488 LPYLHOWVJDUVTP-UHFFFAOYSA-N 342.212 1.762 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@H](O)C2(C)C)cc1Br 2181215220 QQZIDNVORKOLMU-KBPBESRZSA-N 343.265 1.879 10 10 EDCE O=C1CC[C@@H](CNCc2cc(Br)cc(F)c2O)CN1 2103197774 WTGHTCILUHHMNW-QMMMGPOBSA-N 331.185 1.910 10 10 EDCE NCc1ccc(N2CC3(C2)OCCC[C@H]3O)c(Br)c1 2103409981 ZYEBWJUWNYNHLN-CYBMUJFWSA-N 327.222 1.638 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@H](COc1nnc(=N)[nH]n1)C(C)(C)C 2210652614 YFIXNPLWUOWXRK-SECBINFHSA-N 326.401 1.340 10 10 EDCE CN[C@H](C)c1ccc(N2CC(O)(CCO)C2)c(Br)c1 2270655882 IWDZLQUIMRJHMW-SNVBAGLBSA-N 329.238 1.663 10 10 EDCE C[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2273223528 ASSUMBKPPAWWOY-QNRPFLCFSA-N 326.194 1.361 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](O)[C@H](O)CC2)c(Br)c1 2269122311 BGTCLYPJXVNJFF-FZQKWOKYSA-N 330.222 1.824 10 10 EDCE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)cc(OC)c1O 2296223392 IFUMDQUWDOODSR-UHFFFAOYSA-N 329.312 1.860 10 10 EDCE CSc1ncc(CNC(=O)[C@@H]2CNC[C@H]2C(F)(F)F)s1 2284638143 FTYMNIUGTOXDTQ-HTQZYQBOSA-N 325.381 1.879 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)NCC1(CN=[N+]=[N-])CC1 2303240574 NDTZXNTTZFADSM-UHFFFAOYSA-N 341.412 1.813 10 10 EDCE Cc1ccc(CN2CCOC[C@@H]2C(=N)N)c(O)c1Br 2352933082 VYFQPCYZUNIDDQ-SNVBAGLBSA-N 328.210 1.600 10 10 EDCE Cc1ccc(CN2C[C@H]3C(C(N)=O)[C@@H]3C2)c(O)c1Br 2352943356 SCDOAJPRMARKOK-NXEZZACHSA-N 325.206 1.626 10 10 EDCE CNCc1ccc(N2CCN3C[C@H](O)C[C@H]3C2)c(Br)c1 405242172 WTAAXDLZRXLNKN-QWHCGFSZSA-N 340.265 1.424 10 10 EDCE NC(=O)[C@H]1CCCN(C(=O)COc2ccc(N3CCCC3)cc2)C1 132036178 IMCXLFBGVRFJOY-AWEZNQCLSA-N 331.416 1.390 10 10 EDCE COc1cccc(CNCc2nn(C)nc2Br)c1O 2208487247 OFOISGNFXFQOOQ-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE CC(=O)N1CCC[C@]2(CN(Cc3ccc(N(C)C)cc3)CCO2)C1 96268754 NUQVEAJHKOHRFX-IBGZPJMESA-N 331.460 1.966 10 10 EDCE C[C@H](O)CN1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C[C@@H]1C 245753445 OETNQIVJTMWVJP-QWRGUYRKSA-N 343.811 1.841 10 10 EDCE CO[C@H]1C[C@@H](N(C)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 287071727 HKUKEEOWURNNNY-CALCHBBNSA-N 333.432 1.842 10 10 EDCE COCCNC(=O)CCNCc1ccc(C)c(Br)c1O 2381138427 OHDRIXJERPNKQA-UHFFFAOYSA-N 345.237 1.705 10 10 EDCE Cc1ccc(CNC(=O)C2(CN)CC(O)C2)c(O)c1Br 2380751232 IKZYKYLROQUZDU-UHFFFAOYSA-N 343.221 1.179 10 10 EDCE CC(=O)C(=O)COC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2 808505551 FPLVMRXPVPOMFC-UHFFFAOYSA-N 348.305 1.954 10 10 EDCE CCO[C@@H]1C[C@H](NCc2cc3c(cc2O)OCO3)[C@H]1n1cccn1 815166747 IXSHFHDIVXYELC-JCURWCKSSA-N 331.372 1.826 10 10 EDCE COc1ccc(N2CCCN(C(=O)CCOC3CNC3)CC2)cc1 827458426 AOZXZOLZYMYPTG-UHFFFAOYSA-N 333.432 1.112 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N[C@@H](CO)c1ccnn1C 838480576 YNCZBHAOTJSYHT-HNNXBMFYSA-N 331.420 1.327 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)O[C@@H]2CCNC2=O)CCCC1 845297653 CXAYGJCVRVKUNA-QGZVFWFLSA-N 342.395 1.960 10 10 EDCE CN(C)CCN1CCN(C/C=C\c2ccc(N(C)C)cc2)CC1=O 846012439 AWIWQAGUQVRNDT-WAYWQWQTSA-N 330.476 1.472 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cn2c(n1)CCCC2 845929370 BYDPGRIUDRYEHB-LBPRGKRZSA-N 329.400 1.921 10 10 EDCE C[C@]1(CCF)NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 849351821 NLTFMTNXWMAHRR-QGZVFWFLSA-N 335.379 1.693 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CN(C(C)=O)CCO2)cc1 929537973 WAYZKHUCOIMNGK-SFHVURJKSA-N 347.459 1.739 10 10 EDCE O=C(NCc1cc(NC(=O)[C@H]2CCCO2)ccc1O)[C@@H]1CCCO1 923125944 LBHPKORSFBVWFA-LSDHHAIUSA-N 334.372 1.305 10 10 EDCE CC[S@@](C)(=O)=NS(=O)(=O)N[C@@H](C)c1ccc(N(C)C)cc1 867125985 RRCDZUGNVJJLMM-PRWKNARSSA-N 333.479 1.766 10 10 EDCE C[C@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CN1 861765327 AGKUZFFHZBEAQS-HOCLYGCPSA-N 344.459 1.160 10 10 EDCE O=C1N[C@@]2(C(=O)NCc3ccc4cccnc4c3O)C[C@H]3C[C@H]1[C@H]2C3 862025498 WOUKKLFRRFYLQO-SFTOLCTDSA-N 337.379 1.471 10 10 EDCE O=C1CN(C2CCC2)C(=O)N1Cc1ccc(N2CCOCC2)c(F)c1 761089120 FTOKNTDAHXFGAB-UHFFFAOYSA-N 347.390 1.979 10 10 EDCE O=C([C@H]1COCCN1CC(F)(F)F)N1Cc2cccc(O)c2C1 871204183 AISVLVXPQQWJRL-GFCCVEGCSA-N 330.306 1.498 10 10 EDCE CCCNC(=O)Cc1csc(NC(=O)c2cccc(O)c2O)n1 1174885969 FBJHJKYKGWIHHY-UHFFFAOYSA-N 335.385 1.875 10 10 EDCE Nc1ccc(OC[C@H](O)CN2CCC(=CBr)C2)cc1 2115740071 JWLFPVMVMNXYQY-CYBMUJFWSA-N 327.222 1.993 10 10 EDCE C[C@H](NC(=O)N[C@@H](C)c1ccccc1O)C(=O)NCC(F)(F)F 1335692772 SQLLBRUYKBQYMR-IUCAKERBSA-N 333.310 1.819 10 10 EDCE C[C@]1(CCNC(=O)C(=O)NCCc2ccc(N)cc2)CC1(F)F 1347075513 RTPSIMUDXHCGDH-HNNXBMFYSA-N 325.359 1.479 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cc(C(N)=O)c[nH]2)cc1C 1268707528 FCUAJSXPSXJYRP-LBPRGKRZSA-N 344.415 1.339 10 10 EDCE CCn1ccnc1C(=O)NC[C@@H](O)CNCc1ccc(OC)c(C)c1 1272406512 LHESSYDETZFCBN-HNNXBMFYSA-N 346.431 1.101 10 10 EDCE CN1C(=O)[C@@H](N)c2ccc(N3CC(N(C)Cc4ccccc4)C3)cc21 1914200112 PPTWEERZOMQYNI-IBGZPJMESA-N 336.439 1.983 10 10 EDCE CON1CCN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)CC1 1915553949 IZYWYYIXGKJTIJ-LBPRGKRZSA-N 342.193 1.118 10 10 EDCE CNS(=O)(=O)c1ccc(N2Cc3cccc(O)c3C2)c([N+](=O)[O-])c1 1458545874 PDDZTGYYGRCYPF-UHFFFAOYSA-N 349.368 1.729 10 10 EDCE COC(=O)c1ccn(CCCC(=O)NCc2ccc(O)cc2O)n1 1451770179 PUSLUXVGCFPNTA-UHFFFAOYSA-N 333.344 1.178 10 10 EDCE COc1ccc(O)c([C@@H](C)N[C@H](C)c2nc(N)nc(N(C)C)n2)c1 1459849049 KAELMGZTECFDOS-NXEZZACHSA-N 332.408 1.646 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)Cn3cccn3)C2)cc1C 1479278889 MBUJEWXTZJBPAB-CALCHBBNSA-N 342.443 1.885 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cc3n(n2)CCC[C@@H]3O)c1 1545684058 ISFLQGYFOZHREZ-HWPZZCPQSA-N 331.372 1.916 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)/C=C\C(C)(C)C)cc(OC)n1 1720901176 DMJPCOWPILLTHQ-QDZRJHCZSA-N 349.431 1.936 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)CC(N)=O)C2CCCC2)cc1C 1724077460 PMISEAWBEJWODS-MRXNPFEDSA-N 347.459 1.644 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2[nH]c(O)nc2C)cc1C 1568175938 ADKQHDFTSQZMPU-NSHDSACASA-N 346.431 1.896 10 10 EDCE CO[C@H](C)CN(C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1733067550 PXRPYJANGNFPIR-NWDGAFQWSA-N 335.408 1.934 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@]2(C)CCNC2=O)cc1C 1732359707 FMYYLFXLGQXNBO-YJYMSZOUSA-N 347.459 1.372 10 10 EDCE C[C@@]1(CNC(=O)Cc2ccc(O)c(O)c2)COc2ccccc2O1 1646507131 KHZFIDJBUMWPDZ-GOSISDBHSA-N 329.352 1.987 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)C(=O)NCC2CC2)cc1C 1733998423 OYDZSNKJINNFRC-UONOGXRCSA-N 347.459 1.513 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C[C@@H]1CCOC1 1663342251 KRUXGHVUDXXQPB-LBPRGKRZSA-N 333.392 1.547 10 10 EDCE CC(C)C(=O)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1759898234 GWXIUDWSTMTZDW-UHFFFAOYSA-N 331.376 1.884 10 10 EDCE COc1ccc(CNC(=O)NCC[C@@H]2CCCS2(=O)=O)c(O)c1 1684901366 QBXBMKPUFJMVNR-ZDUSSCGKSA-N 342.417 1.167 10 10 EDCE C[C@H]1C[C@@H]1C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1686871231 RIRAFZVKBWRANF-GWCFXTLKSA-N 331.376 1.741 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@H]1NCc1ccc(O)cc1O 1943955396 QXYZVACTYPVEMF-ZIAGYGMSSA-N 338.404 1.870 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H](O)CN(Cc2cc(N)ccc2O)C1 2002701023 LGGZODDQHFAUFD-KBPBESRZSA-N 337.420 1.434 10 10 EDCE COC[C@@H](CC(=O)N1CC[C@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1985096981 ZHMGHSLJGNXNRE-WDEREUQCSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010404689 BXBAVMBABCNAJA-WDEREUQCSA-N 341.412 1.952 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010406673 XONIKSJIUWWPSP-CMPLNLGQSA-N 341.412 1.809 10 10 EDCE O=C1C[C@@H](NCc2cc(Cl)cc(Br)c2O)C(=O)N1 2034960219 ZRNHBPMMASFEAM-MRVPVSSYSA-N 333.569 1.313 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCC(F)(F)Br 312029895 YPKVLXSZOAMKRX-ZETCQYMHSA-N 339.136 1.072 10 10 EDCE CNCc1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)cc1Br 2178088233 WMZFLPZDNGGWFX-ZLDLUXBVSA-N 341.249 1.612 10 10 EDCE CNCc1ccc(N2C[C@@H]3OCCO[C@@H]3C2)cc1Br 2093343759 FYFRWVKXULNSDM-OKILXGFUSA-N 327.222 1.773 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2210536662 HWQWDABXWCNVRP-UKKRHICBSA-N 327.385 1.608 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210529355 PSWYXEFJLNOKOD-MXWKQRLJSA-N 327.385 1.610 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])C1 2213582459 HXLLZFNGIYSHEK-YJVGMPMCSA-N 339.396 1.752 10 10 EDCE NCc1ccc(N2C[C@@H]3COC[C@]3(CO)C2)cc1Br 2226162593 DSWJFAUXYQHODO-BXUZGUMPSA-N 327.222 1.353 10 10 EDCE O=C(CN1C(=O)SC(=Cc2ccc(O)c(O)c2)C1=O)N1CCCC1 2297535052 YDZBCURSMPNLHM-UHFFFAOYSA-N 348.380 1.757 10 10 EDCE CN(C(=O)C=Cc1ccc(N2CCOCC2)cc1)C1CCNCC1 2301594311 FOENUMZGGUPPMJ-UHFFFAOYSA-N 329.444 1.747 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H](CCO)COCc1ccccc1 2320373473 SJWCSDBUVISWLD-INIZCTEOSA-N 345.395 1.724 10 10 EDCE CCN(CC)CCNC(=O)c1ccc(N=NN2CCNCC2)cc1 2330149615 VKWNCHBVDBFFOJ-UHFFFAOYSA-N 332.452 1.662 10 10 EDCE CN(Cc1ccccc1O)C(=O)NC[C@H](c1cnn(C)c1)N(C)C 118087445 CENTZGWTOCANBP-OAHLLOKOSA-N 331.420 1.570 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2357585984 SVGVGHINUXPFQT-IKRVOCLZSA-N 342.233 1.823 10 10 EDCE COCC[C@@H](N)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951943173 KFTLXMLEPXPEKQ-OLZOCXBDSA-N 340.420 1.897 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CC[C@H](C(=O)O)O1 328329591 OLEOMNGPLKFWNE-JKSUJKDBSA-N 348.399 1.114 10 10 EDCE COc1ccc(N2CCN(C(=O)NCC3CCOCC3)CC2)cc1 194805018 QDIQUVPKYAMNNH-UHFFFAOYSA-N 333.432 1.953 10 10 EDCE COc1ccc(N2CCN([C@@H](C)C(=O)NCC(F)(F)F)CC2)cc1 97653815 FSCCBWVNQXJIDT-LBPRGKRZSA-N 345.365 1.884 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cn(C[C@H]3CCOC3)nn2)c1 528860831 MWNDRIFGNJUHDN-VXGBXAGGSA-N 346.387 1.520 10 10 EDCE C[C@H](N)c1ccc(N(C)Cc2nnn(C)n2)c(Br)c1 1892990596 BGINSWSMIYFBIN-QMMMGPOBSA-N 325.214 1.629 10 10 EDCE CCOc1cccc(CN2C[C@H]3COCC[C@@]3(C(=O)OC)C2)c1O 369542659 WLEBUCFOOYZXRA-KBXCAEBGSA-N 335.400 1.802 10 10 EDCE Cc1ccc(CNC(=O)C2COCCOC2)c(O)c1Br 2380755051 XQBOSVQKVXINIJ-UHFFFAOYSA-N 344.205 1.742 10 10 EDCE CCN[C@H](C)c1ccc(N2CC(NC(N)=O)C2)c(Br)c1 2163214936 BVJPLYOTNLDMNM-SECBINFHSA-N 341.253 1.977 10 10 EDCE CC[S@@](=O)CCNC(=O)NCc1cc(Br)ccc1O 805125514 MXSKXSUJFVTCBH-LJQANCHMSA-N 349.250 1.723 10 10 EDCE CCCCS(=O)(=O)c1ccc(C(=O)OCC(=O)C(C)=O)cc1 808542040 ZZOBRMBZGSLVDV-UHFFFAOYSA-N 326.370 1.575 10 10 EDCE CNCc1ccc(N2CC[C@@](C)(O)[C@H](O)C2)cc1Br 1893332589 SMCHYQNTWPOOLE-ZIAGYGMSSA-N 329.238 1.491 10 10 EDCE COc1cc(CN2CCN3C[C@H](O)C[C@H]3C2)c(O)c(C(C)(C)C)c1 826535459 XJMLJJDBTDVSJF-LSDHHAIUSA-N 334.460 1.949 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H](N)CC(C)C)CC2)cc1 829499837 DWCSOYGXMLGPLD-GOSISDBHSA-N 348.491 1.307 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCSC3)C2)cc1 828083056 JYXKARDEHDZRJM-QWHCGFSZSA-N 349.456 1.012 10 10 EDCE C[C@H](NCCS(=O)(=O)N=S(C)(C)=O)c1c(O)cccc1F 903225675 HELJHNAVUDFJNW-VIFPVBQESA-N 338.426 1.239 10 10 EDCE CC[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@]2(CCOC2)O1 831020331 QOLQNELDFSWPKZ-HWPZZCPQSA-N 325.336 1.647 10 10 EDCE CN1CCC[C@](O)(CC(=O)NCc2ccc3cccnc3c2O)C1 911262089 OGDKHRXUKPDMRH-SFHVURJKSA-N 329.400 1.403 10 10 EDCE COc1cc(Br)cc(CN2C[C@@H]3C[C@H]2C[S@@]3=O)c1O 846103762 XELUTVSCMODVHU-ADWYPQAOSA-N 346.246 1.869 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)C3(N)CCCC3)CC2)cc1 844190206 GKBGJBCWPDSSBG-UHFFFAOYSA-N 346.475 1.205 10 10 EDCE COc1ccc(N(C)CCN(C)S(=O)(=O)N(C)C2CC2)cc1 845988522 ZAEXFKMGOWIAHS-UHFFFAOYSA-N 327.450 1.402 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCc3cnn(C)n3)C2)cc1 855225037 NJGMJTIUYGJCKK-CQSZACIVSA-N 329.404 1.151 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NO[C@@H](CO)C(C)C)C2)cc1 854296581 DZUKHNFRWJJXDK-CJNGLKHVSA-N 337.420 1.522 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cn3nnnc3C(C)C)C2)cc1 855232781 XTHBNESMKUNGDS-CYBMUJFWSA-N 344.419 1.200 10 10 EDCE O=C(/C=C\c1cnccn1)NCc1ccc(N2CCC(O)CC2)cc1 856210432 BOONKOUWJPRELW-UTCJRWHESA-N 338.411 1.767 10 10 EDCE O=C(NCC1CCN(C2CCOCC2)CC1)c1cccc(O)c1O 855200534 DOAODKYOIKGVOR-UHFFFAOYSA-N 334.416 1.719 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC([C@H]4CCOC4)C3)C2)cc1 854296912 HPBFALDXHQLVGX-GOEBONIOSA-N 345.443 1.952 10 10 EDCE Cc1cc(Br)c(O)c(CNC[C@@H]2CC(C(N)=O)=NO2)c1 789560320 IOXJCPUISZVICZ-VIFPVBQESA-N 342.193 1.183 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cscn1 788934646 XBVZVNHSXPBVNO-UHFFFAOYSA-N 344.440 1.676 10 10 EDCE COC(=O)c1c(CN2C[C@@H](O)[C@H](OC)C2)c2cc(F)ccc2n1C 894911016 CIBDCZARXQSZMK-HUUCEWRRSA-N 336.363 1.296 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc(N2CCOCC2)ccn1 1176747803 BGPQIOXOIWJXMV-UHFFFAOYSA-N 329.356 1.259 10 10 EDCE CO[C@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1322535378 GJSNBANLQVJSGR-OLZOCXBDSA-N 337.395 1.192 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)Cc2cnn(C)c2)cc1C 1700388838 BOGGTASTINKQSI-HUUCEWRRSA-N 344.459 1.963 10 10 EDCE CCO[C@H]1C[C@@H]1C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1623928449 NFNQCMMKWHYCGL-JSGCOSHPSA-N 341.791 1.972 10 10 EDCE CS(=O)(=O)Cc1ccc(C(=O)NCc2c(O)cccc2O)cc1 1558534701 WQTVOEIDRKLUOP-UHFFFAOYSA-N 335.381 1.572 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCc2c(O)cccc2O)c(N)c1 1558535791 NYVZXTQECGDNHD-UHFFFAOYSA-N 336.369 1.014 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)c2cnn(C)n2)cc1C 1725117575 XCRDAAPFEFXDJX-CHWSQXEVSA-N 331.420 1.429 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1CCC(=O)NC1)NCc1ccc(OC)c(C)c1 1495014028 VWSNLHZAWYHUMJ-HZPDHXFCSA-N 347.459 1.514 10 10 EDCE CC(=O)NCc1cccc(C(=O)NCCc2ccc(O)c(O)c2)c1 1636022832 PXPWAWIIWUZPSE-UHFFFAOYSA-N 328.368 1.706 10 10 EDCE CN1CC[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1=O 1638273500 XZPBDYAKYANWHL-LBPRGKRZSA-N 335.367 1.813 10 10 EDCE CS(=O)(=O)Cc1cccc(C(=O)NCc2ccc(O)cc2O)c1 1639441119 JOKFUKQRPVEAPO-UHFFFAOYSA-N 335.381 1.572 10 10 EDCE CCOCC(=O)NC[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1738233079 UUKJWSBVAYUTLG-LLVKDONJSA-N 349.391 1.368 10 10 EDCE CC[C@H](CNC(=O)c1cocn1)NC(=O)c1cc(OC)nc(OC)c1 1738108006 IZBUDWDUGOWSJU-LLVKDONJSA-N 348.359 1.025 10 10 EDCE CNC(=O)N[C@H]1CCN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 1680281277 XFVPEFRFGNOYRT-JSGCOSHPSA-N 333.436 1.527 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cccnn3)CC2)cc1C 1699668078 KNNICEKSIWDZHX-UHFFFAOYSA-N 326.400 1.846 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](C(=O)N2CC(N=[N+]=[N-])C2)O1 1985101121 OECKEGRDMPRZGE-GHMZBOCLSA-N 325.369 1.580 10 10 EDCE CC(C)(C)OC(=O)N1CC(CCO)(CNCc2ccc(N)cc2)C1 2006991580 UAJVCWNWMAZKCD-UHFFFAOYSA-N 335.448 1.978 10 10 EDCE CC(C)(C)OC(=O)NCC1(CNCc2ccc(O)cc2O)COC1 2007820979 CCMIXAJVOWMKOK-UHFFFAOYSA-N 338.404 1.729 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2158392999 OZVKCKBBPCNRCU-UGFHNGPFSA-N 341.249 1.755 10 10 EDCE CNCc1ccc(N2C[C@H](OC)C[C@@H]2CO)cc1Br 381695859 FLNVCGNWRXQUIW-CHWSQXEVSA-N 329.238 1.755 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCO[C@H](c4ccco4)C3)c2n1 2063332255 NIUBYSNOLAKTFT-ZDUSSCGKSA-N 328.328 1.550 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H](C)C(=O)N3CCCC[C@@H]3C)c2n1 2063448484 PGONSOIEHVYRSZ-RYUDHWBXSA-N 345.403 1.263 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)Nc2ccc(N)cc2)=C[C@@H]1O 1910968211 RDZYYMYLIQLFIV-KGLIPLIRSA-N 333.388 1.792 10 10 EDCE C[C@@H](O)c1ccc(N2CC(=O)N[C@@H]3CC[C@@H]32)c(Br)c1 2112061623 MKSBVZIASRNGMW-DYLAAIIWSA-N 325.206 1.970 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC(CO)C3)c(Br)cc21 2092541767 JAXPDMQHDSYDMQ-GFCCVEGCSA-N 326.194 1.090 10 10 EDCE O=S1(=O)C[C@@H]2CN(c3ccc(CO)c(Br)c3)C[C@@H]21 2314891880 QWZNLFOFXBFKQP-CABZTGNLSA-N 332.219 1.175 10 10 EDCE CCN1C(=O)/C(=C2/SC(=S)N(CC(=O)O)C2=O)c2ccccc21 33323899 AACAAUQRMCLPLB-VAWYXSNFSA-N 348.405 1.709 10 10 EDCE O=C(NC[C@@H](C(=O)O)c1cc(O)nc(O)c1)OCc1ccccc1 1952150207 WXWLHPBFHDKRER-GFCCVEGCSA-N 332.312 1.587 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@@H]4C[C@H]5C[C@H]4[C@@H]3[C@H]5O)ccc21 249546548 KGAFLKUVSBOEEQ-APWQULEDSA-N 341.455 1.980 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3CCOC[C@H]3C)nc12 277316392 DFHHHYQMIGGXLQ-ZWNOBZJWSA-N 334.376 1.126 10 10 EDCE Cc1ccc(CN(C)C(=O)C[C@@H](N)C(=O)O)c(O)c1Br 2380759390 NRCPROOGPYHBCY-SECBINFHSA-N 345.193 1.224 10 10 EDCE O=C(NCCc1cn[nH]c1)NCc1cc(Br)ccc1O 811932194 HLYSTGFXLAKRPD-UHFFFAOYSA-N 339.193 1.920 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(OC)c1O)C2 819397823 GZEKSPRVKGDGMI-YUTCNCBUSA-N 348.399 1.884 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)C2 819792014 HWZGJLCZLYKSSM-CQCMJSDYSA-N 346.383 1.847 10 10 EDCE O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)C(F)(F)F 819358494 JFPLPLFUNCPURD-LBPRGKRZSA-N 340.292 1.814 10 10 EDCE COc1ccc(N2CCN(CCN[C@H](C)[C@@H]3CCCN3)CC2)cc1 817892458 AEGASODEPWMWSR-APWZRJJASA-N 332.492 1.547 10 10 EDCE C[C@@H](N)CCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 827469502 ZQYLSENHRMIWKT-UKRRQHHQSA-N 332.448 1.132 10 10 EDCE Cn1cc(CCC(=O)NCc2ccc(N3CCSCC3)cc2)nn1 822553402 JGHUVIDGDMJYFE-UHFFFAOYSA-N 345.472 1.617 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)c3n[nH]cc3F)cc2F)CC1 900611805 SULPSNSXKGWTFI-UHFFFAOYSA-N 349.385 1.760 10 10 EDCE C[C@@H](NCCS(=O)(=O)N=S(C)(C)=O)c1ccc(F)cc1O 903226753 NWNCLWLTLWFREQ-SECBINFHSA-N 338.426 1.239 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCC(Cn3cnnc3)CC2)c1O 846056550 NZDGAOHFXSVIHA-UHFFFAOYSA-N 347.375 1.813 10 10 EDCE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(C)c(C)cc1O 747830522 WBAXXIFGTUZZRD-SRABZTEZSA-N 347.411 1.934 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@]2(CCCNC2)C1 844223569 CQISGFDMABMRET-FQEVSTJZSA-N 344.503 1.787 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)CS(C)(=O)=O)C2)cc1 855232647 WEUWPMRPYIHANS-CHWSQXEVSA-N 340.445 1.071 10 10 EDCE CNCc1ccc(N(C)CC(C)(CO)CO)c(Br)c1 689678550 OTCWSCPSVTZIQS-UHFFFAOYSA-N 331.254 1.596 10 10 EDCE CN(OCC(F)(F)F)C(=O)CNC(=O)/C=C/c1ccc(O)c(O)c1 857745527 SQICFAKIWUDSIO-HWKANZROSA-N 348.277 1.180 10 10 EDCE COc1ccc(N2CC[C@@H](Nc3ncc([N+](=O)[O-])c(N)n3)C2)cc1 853758375 DAXMACWXYGMPKS-SNVBAGLBSA-N 330.348 1.666 10 10 EDCE CC[C@@H]1NCC[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 861565624 VKDLCYVOVXWSJT-DLBZAZTESA-N 332.448 1.463 10 10 EDCE CC[C@H](C(=O)NCc1ccc2cccnc2c1O)N1CCCC1=O 862027961 LAXJEODHRHHTRL-CQSZACIVSA-N 327.384 1.958 10 10 EDCE O=C1O[C@H]2CNC[C@H]2N1C1CCN(Cc2cc(F)ccc2O)CC1 863642439 OKZNSKVHRYWMSL-ZBFHGGJFSA-N 335.379 1.288 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCCC[C@H](N)C1 866670107 AQQYLGGDJVEFCQ-KRWDZBQOSA-N 332.492 1.914 10 10 EDCE Cc1cc(C(=O)N2CCn3c(O)nnc3C2)c(C)n1-c1ccccn1 763228504 SJNVUTYNNHJSJW-UHFFFAOYSA-N 338.371 1.442 10 10 EDCE COCCO[C@@H]1COCC[C@H]1NC(=O)N[C@@H](C)c1ccccc1O 868517797 NBNKZTLRBZJNKK-JGGQBBKZSA-N 338.404 1.573 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)NCCC2CS(=O)(=O)C2)c1 786946346 RVNWJHKGAVSJTI-SNVBAGLBSA-N 327.402 1.264 10 10 EDCE NC(=O)[C@@H]1C[C@@H](O)CN1Cc1ccc(OCc2ccccc2)cc1O 895367592 FOSWOGCVMNQZTG-WBVHZDCISA-N 342.395 1.392 10 10 EDCE CN(CCN1CCOCC1)C(=O)c1cc2cc(O)c(O)cc2s1 896103452 VJBULPPGHZIUGA-UHFFFAOYSA-N 336.413 1.717 10 10 EDCE CCOC(=O)c1n[nH]c([C@@H](C)NC(=O)/C=C/c2ccc(O)c(O)c2)n1 1146857509 ZUZOHFJKYPTKFT-VPIOIWJLSA-N 346.343 1.283 10 10 EDCE O=C(C(=O)N1CC[C@H]([C@H]2CCOC2)C1)N1Cc2cccc(O)c2C1 1329845025 YTFPYLIAUIBIGB-JSGCOSHPSA-N 330.384 1.119 10 10 EDCE CNC(=O)[C@@H](NCc1ccc(N2CCN(C)CC2)c(F)c1)C(C)C 1324796683 ZEXVTHYMNZBAJJ-KRWDZBQOSA-N 336.455 1.438 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H]2CC=CCC2)cc1C 1331668595 SREQNMPIEXNSRL-IAGOWNOFSA-N 332.444 1.927 10 10 EDCE C[C@H](O)c1ccc(N2CCC[C@H]2[C@H](O)CO)cc1Br 2123170529 IGICYNSRGZVRFS-QCZZGDTMSA-N 330.222 1.824 10 10 EDCE Cn1cc(I)c(CN2CC[C@H](N=[N+]=[N-])C2)n1 1902313620 LHGALXGGIACZGH-ZETCQYMHSA-N 332.149 1.909 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H]1CCOC1 1269517392 XDBMOKJLNVUOSU-GXTWGEPZSA-N 347.419 1.984 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 1900608311 YUKSUNYQQDZMBV-NSHDSACASA-N 327.385 1.781 10 10 EDCE Cc1ncc(C)c(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 1347195160 XJRHSHXKJHLHOF-UHFFFAOYSA-N 346.456 1.940 10 10 EDCE COCCC(=O)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1283834737 SGBABBGCCDMZDW-ZDUSSCGKSA-N 347.375 1.216 10 10 EDCE CCCC(=O)N(C)C[C@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1281238225 CJZQEVGDGOSYIW-CYBMUJFWSA-N 349.391 1.198 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(CO)(CO)C2)cc1Br 1914971040 NCGFUHZWOSANHF-JTQLQIEISA-N 329.238 1.521 10 10 EDCE O=C1Nc2cc(N3CC[C@]34CCOC4)c(Br)cc2[C@H]1O 1915351191 SAGXAYPLHWBRJF-TZMCWYRMSA-N 339.189 1.804 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@](O)([C@@H](N)c2ccccc2O)C1 1920324351 JWXZXPZQXYPXRR-WMLDXEAASA-N 338.404 1.390 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)C[C@H](C)NC(N)=O)C2)cc1C 1480204614 OQOPOLVQOKYRDJ-AEGPPILISA-N 348.447 1.187 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2nccc(C)n2)cc1C 1713587666 AGPWXWOAASGQQU-UHFFFAOYSA-N 328.416 1.964 10 10 EDCE O=C1CN(C(=O)Cc2ccc(O)c(O)c2)[C@@H](c2ccccc2)CN1 1639027711 VRYOLMJSLRYOGU-CQSZACIVSA-N 326.352 1.340 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1ncc2cccnc21 1633817804 BALWBJJNQQVOHB-LLVKDONJSA-N 326.356 1.590 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CNC(=O)c1ccncc1 1640260214 VUXCXVBKEBUPEQ-UHFFFAOYSA-N 334.372 1.319 10 10 EDCE C/C=C(/C)C(=O)NC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1745841975 UBKZNFFPHIBLMG-DLYLFSKTSA-N 329.360 1.756 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cc3n(n2)CCC[C@@H]3O)cc1F 1598028852 OWGRMVAYSMSWQT-INIZCTEOSA-N 332.379 1.845 10 10 EDCE CO[C@H]1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 234851798 MFNZQYKCMCITLR-JVXZTZIISA-N 326.194 1.626 10 10 EDCE CCCN(CCC(=O)O)C(=O)CNCc1cc(Cl)ccc1O 1857868602 RKRPKDCHDBJYRO-UHFFFAOYSA-N 328.796 1.849 10 10 EDCE Cn1ncc(Br)c1CNC(=O)Cc1ccc(O)c(O)c1 1302366147 ZZOPIHVIIKGXEP-UHFFFAOYSA-N 340.177 1.453 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)NCc2ccccc2O)CCOC1 1963718227 YTOJSOVSFUJXMI-KRWDZBQOSA-N 336.388 1.692 10 10 EDCE CCOC(=O)C[C@@H](N)c1cc(I)ccc1O 1951377096 NFQRZVGHSOPGOI-SECBINFHSA-N 335.141 1.950 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985093921 HHBQHKHYOKLNKF-MNOVXSKESA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCCCN=[N+]=[N-])C1(O)CCC1 1987681837 RTIIRDBUANKUFD-SNVBAGLBSA-N 327.385 1.611 10 10 EDCE COC(=O)[C@@H](CC(=O)N1CC[C@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 2010394122 AJRALRPZNLBLGY-VHSXEESVSA-N 341.368 1.354 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](CO)C2)c(Br)c1 316967138 IBWGPYTUBYPNNF-UDZFHETQSA-N 329.238 1.519 10 10 EDCE COc1ccc(N2CCN[C@@H](CCO)C2)c(OC)c1Br 2162665512 CENVMDMTLHXKMJ-JTQLQIEISA-N 345.237 1.627 10 10 EDCE C[C@@]1(CO)CN(c2ccc(CN)c(Br)c2)C[C@]1(C)CO 704771456 PAXBTVIQMRSHHP-GASCZTMLSA-N 343.265 1.725 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2n1 2064439782 CYCIFYASIWDARZ-GDLCADMTSA-N 330.388 1.365 10 10 EDCE CC(C)(C)OC(=O)N1Cc2[nH]cnc2C[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2060616407 AFTFSTZQJDXAJF-LBPRGKRZSA-N 347.379 1.593 10 10 EDCE CCC(CC)(CNC(=O)OC(C)(C)C)COc1nnc(=N)[nH]n1 2210643934 AXIJVQMFIKZJMV-UHFFFAOYSA-N 326.401 1.389 10 10 EDCE Oc1ccc(Br)cc1CN[C@H]1CCN(C2COC2)C1 2113267232 XFHFKNPMDOYYEK-LBPRGKRZSA-N 327.222 1.717 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccc(C)nc2O)s1 2284691680 TWECSMDGJQCRDZ-UHFFFAOYSA-N 331.444 1.753 10 10 EDCE COc1ccc(Br)c(CN2C[C@H]3C[C@@]3(CN)C2)c1O 2272651791 YVEGUCJXTLGANC-YMTOWFKASA-N 327.222 1.944 10 10 EDCE CCOC(=O)[C@@H]1CCCN(C=C2SC(=S)N(CC)C2=O)C1 2293863915 UDCZKMFPYCKGFS-SNVBAGLBSA-N 328.459 1.983 10 10 EDCE CCN1C(=O)NC(=Cc2ccc(N3CCOCC3)c([N+](=O)[O-])c2)C1=O 2297617481 OBMBWRHDMUCMEU-UHFFFAOYSA-N 346.343 1.344 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@@H](O)[C@H]2CF)cc1Br 2333237784 RHQVGWUBMMLDSR-YAUNCSCZSA-N 333.201 1.349 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCC[C@H]2C(=O)NC)cc1 179248389 QKHQTAPMDQPCHQ-INIZCTEOSA-N 332.448 1.953 10 10 EDCE CCS(=O)(=O)N1C[C@@H]2CN(Cc3ccc(N(C)C)cc3)C[C@H]2C1 96094141 KOPTWENAKWQRGD-HOTGVXAUSA-N 337.489 1.466 10 10 EDCE C[C@H](N)c1ccc(N(C)CCS(C)(=O)=O)cc1Br 235489652 FTOLXEYYTNDPNS-VIFPVBQESA-N 335.267 1.950 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CC[C@H]3C)CC2)cc1 805013887 JKLNHGCPSHXVEE-CRAIPNDOSA-N 346.475 1.915 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCc2nc(C)nc(C(F)(F)F)c2C1 808526246 MTDKLAMQBZOWJX-SECBINFHSA-N 344.289 1.610 10 10 EDCE C[C@H](N[C@@H]1CCC(=O)N(C)C1=O)c1cc(Br)ccc1O 818362243 SMYORFKEAOMTOZ-GZMMTYOYSA-N 341.205 1.953 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3c(C(=O)O)cnn3C)C2)cc1 902045527 GGEMLQUDCGZORH-NSHDSACASA-N 344.371 1.136 10 10 EDCE C[C@@H]1CN(C2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)CCO1 588405175 ROEQAOOJNSNYLJ-PKXJPQMGSA-N 346.427 1.823 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(CC)[C@H]3CCCOC3)nc12 844403196 DIQSMFDQGBMRQZ-ZDUSSCGKSA-N 348.403 1.613 10 10 EDCE CCNCCCNC(=O)NCc1cc(Br)ccc1O 841917593 PJVSIBBYNJGAQF-UHFFFAOYSA-N 330.226 1.954 10 10 EDCE C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@@H](c2ccnn2C)C1=O 843308966 VTJLKWAPRIIHHK-NHYWBVRUSA-N 327.388 1.840 10 10 EDCE CC(C)OC[C@@H](O)CNCc1ccc(N2CCC(CO)CC2)cc1 843064065 FYRLVBAAGBCPAC-IBGZPJMESA-N 336.476 1.771 10 10 EDCE C[C@H]1C(=O)N(CCN(C)C)CN1Cc1ccc(N2CCOCC2)cc1 843427748 CBRLGTVMLJYSGX-INIZCTEOSA-N 346.475 1.075 10 10 EDCE C[C@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@H]1[C@H]2CN[C@H]1C2 925485503 NTJCKQRPJFAKCY-XYNXIRJESA-N 342.487 1.474 10 10 EDCE O=C(NCC[C@]1(O)CCOC1)NCc1ccc(N2CC=CC2)cc1 845002799 OAMLTKOTSFLZKY-SFHVURJKSA-N 331.416 1.404 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]4O[C@H]3[C@H]3C[C@@H]43)CC2)cc1 929249567 JQLBQEMBHTUPMH-WKULXVSPSA-N 328.412 1.767 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCN(c3nccnn3)CC2)c1O 859407693 SBPOICFUKLNBJA-UHFFFAOYSA-N 331.351 1.241 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC(N3CC[C@H](O)C3)CC2)c1O 852708589 FPZSLMUIMICWGN-INIZCTEOSA-N 336.407 1.765 10 10 EDCE COC(=O)/C=C\c1ccc(N2Cc3c(N)nn(C)c3C2)c([N+](=O)[O-])c1 853680024 UDACADIAIYMXAW-XQRVVYSFSA-N 343.343 1.617 10 10 EDCE CCN(CC)c1ccc(CNC[C@]23COCCN2C(=O)COC3)cc1 865799481 AWTATDCYNFJUNH-LJQANCHMSA-N 347.459 1.250 10 10 EDCE C/C=C\C[C@H]1NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 761068658 ISPJDUOOTGRGNK-RXYHWBRQSA-N 329.400 1.910 10 10 EDCE CC[C@H](NC[C@@]12COCCN1C(=O)COC2)c1ccc(C)cc1O 866553811 OAMRKPQUUOKMFH-YJBOKZPZSA-N 334.416 1.369 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H](OC(F)F)C2)cc1 785444276 RFNPBXFVFYNGNT-ZDUSSCGKSA-N 341.358 1.209 10 10 EDCE C[C@@H]1OC[C@]2(CC[C@H](CNC(=O)c3c(F)ccc(O)c3O)O2)[C@@H]1C 899485992 XMUKHUMMANQJRV-WMEBDMIVSA-N 339.363 1.939 10 10 EDCE COC(=O)c1cc(CN(C)C(=O)Cc2ccc(O)c(O)c2)oc1C 1136069250 FWLWBEUMGQMXAY-UHFFFAOYSA-N 333.340 1.987 10 10 EDCE Cc1ccc(C(=O)NCc2ccc(-c3nncnn3)cc2)c(O)c1O 1144645203 NYFVNYUKRYLJRB-UHFFFAOYSA-N 337.339 1.583 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@]3(CCOC3=O)C2)cc1 1308170333 KNDQZEZVUSEENP-SFHVURJKSA-N 331.416 1.008 10 10 EDCE C[C@@H]1[C@H](CO)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1313065885 ZAQJFZPWAFLVSS-ZBFHGGJFSA-N 347.459 1.560 10 10 EDCE NCc1ccc(N2C[C@@H](CO)OCC23CC3)c(Br)c1 2127546558 YNSNQOPIVYVPEV-NSHDSACASA-N 327.222 1.638 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H]3C=CCC3)C2)cc1 1330652826 HRQMDPGZHDOPJK-UONOGXRCSA-N 329.400 1.225 10 10 EDCE COc1ccc(C(=O)NCC(=O)NCc2ccc(N(C)C)cc2)cc1 15134467 DJYGMZPBODZHFU-UHFFFAOYSA-N 341.411 1.807 10 10 EDCE C[C@@H](NC(=O)c1cc(S(C)(=O)=O)ccc1N)c1ccccc1O 1454808439 WACHHNXWVWFOLD-SNVBAGLBSA-N 334.397 1.869 10 10 EDCE O=C(CN1C(=O)c2ccccc2C1=O)NCc1c(O)cccc1F 1456082917 BWHYNOJUIWCMHG-UHFFFAOYSA-N 328.299 1.444 10 10 EDCE C[C@@H](NC(=O)c1cn(CC(=O)OC(C)(C)C)nn1)c1ccccc1O 1471196380 ZLFZECLUEDYGLI-LLVKDONJSA-N 346.387 1.816 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccnc(NC(=O)C2CC2)c1 1638352711 UYSWCIUKGHSZFA-UHFFFAOYSA-N 327.340 1.771 10 10 EDCE CCC(=O)NCC(=O)N1C[C@H](NCc2ccc(OC)c(C)c2)C[C@@H]1C 1734409867 LVWQTMQFMVRWEA-GOEBONIOSA-N 347.459 1.609 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@H](C(F)(F)F)[C@H](CO)C1 1640497800 AULPTZPZKZWHDI-QWRGUYRKSA-N 333.306 1.660 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2nonc2C)cc1C 1732755717 AYQXDYKUEKMCFM-GFCCVEGCSA-N 332.404 1.993 10 10 EDCE CO[C@@H](C)C(=O)NCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1747762257 VFJDFBHTBUWECW-JTQLQIEISA-N 347.375 1.263 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2ccnn2C)cc1C 1666519030 APNWTLXKTLHCQT-ZDUSSCGKSA-N 330.432 1.893 10 10 EDCE O=C1CC[C@@H](C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)N1 1866204397 YVCHEFCLOFSSEQ-AWEZNQCLSA-N 334.331 1.679 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](NC(C)=O)C(C)C)CC2)cc1 6967666 GGSNKCTVDPCUFO-QGZVFWFLSA-N 333.432 1.505 10 10 EDCE CC(=O)Nc1cccc(NC(=O)c2nnn(-c3ccc(N)cc3)n2)c1 1857878754 LEMSRPKPKGOMIL-UHFFFAOYSA-N 337.343 1.455 10 10 EDCE CC(=O)O[C@H]1[C@@H](N=[N+]=[N-])CO[C@]2(COC(C)(C)O2)[C@H]1OC(C)=O 1775955154 YWEMWEKIXSKBDT-ZPFDUUQYSA-N 329.309 1.038 10 10 EDCE in-vitro N[C@@H]1C(=O)Nc2cc(N3CCOC(F)(F)C3)c(Br)cc21 2152293153 GDPPUPSJQMFKRU-JTQLQIEISA-N 348.147 1.830 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](OCC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010403848 KOPRRLRTLJQYTA-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010404480 ASTLQIHDGAZASU-WDEREUQCSA-N 341.412 1.809 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)C[C@H]1C(=O)Nc1ccc(N)cc1 2022912141 JVYBHFDRXFOGGO-KBPBESRZSA-N 335.404 1.968 10 10 EDCE CCNCc1ccc(N2C[C@@H](CO)[C@@H](CO)C2)c(Br)c1 704764444 LISFRABMKURYPE-BETUJISGSA-N 343.265 1.596 10 10 EDCE CN(C)C[C@H](O)CNCc1cc(Cl)cc(Br)c1O 708057325 TYSGCLACGYAMLW-SNVBAGLBSA-N 337.645 1.820 10 10 EDCE CNC(=O)CC1CN(c2cc(Br)c(CN)cc2F)C1 382113437 SGSLTSBFHWQPTN-UHFFFAOYSA-N 330.201 1.619 10 10 EDCE CO[C@@H]1CN(Cc2cc(Br)cc(F)c2O)C[C@H]1C(=O)O 715794007 YLZYJFVHLOMCOO-MWLCHTKSSA-N 348.168 1.825 10 10 EDCE CCNCc1ccc(N2C[C@@H]3NC(=O)O[C@@H]3C2)c(Br)c1 2176922225 WUOJGWRVBDUHQR-WCQYABFASA-N 340.221 1.856 10 10 EDCE NC[C@@H]1CCN(C(=O)c2c[nH]nc2[C@@H]2CCNC2)c2ccccc21 2062576517 LACZWVJLCTUNCM-QWHCGFSZSA-N 325.416 1.579 10 10 EDCE C[C@H](N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)c1c(O)cccc1O 1908512386 XTNWTPYVXANWHR-MISXGVKJSA-N 338.404 1.729 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](CO)C[C@@H]2CO)cc1Br 2089864585 VKONHADHOSVJKS-HOSYDEDBSA-N 330.222 1.682 10 10 EDCE COc1ccc(N(CCN)CCN(C)C)c(OC)c1Br 2280522633 ISQDGWYEXWBBKC-UHFFFAOYSA-N 346.269 1.793 10 10 EDCE Cc1ccc(CN(CCO)CCN(C)C)c(O)c1Br 2352691832 WVUBADHESDFXDJ-UHFFFAOYSA-N 331.254 1.819 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)N1C[C@H](CO)OC[C@@H]1C 305135650 KTSYJUOGDAEDKV-WCQYABFASA-N 329.356 1.472 10 10 EDCE COc1ccc(N2CCCN(C(=O)NCc3ncnn3C)CC2)cc1 76791871 ODMQSQWGIUVKDY-UHFFFAOYSA-N 344.419 1.246 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCNC(=O)C3CC3)CC2)cc1 43308999 MJNWBRAQXYCBAO-UHFFFAOYSA-N 346.431 1.053 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(C(=O)c2ccco2)CC1 244372876 XZWSJRVAARVNHL-UHFFFAOYSA-N 330.340 1.218 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C[C@@H]3CNC[C@@H]32)c(O)c1Br 2380750798 XTWLXWXQRYKPED-WOPDTQHZSA-N 339.233 1.935 10 10 EDCE CC(C)N(C[C@H](C)O)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686178 YHDPGIIGHMBOAO-AWEZNQCLSA-N 347.459 1.303 10 10 EDCE Cc1cc(O)c(CN[C@H]2CCC[C@@H]2CNS(C)(=O)=O)cc1C 800309820 SBWJZHYQCGRFEX-HIFRSBDPSA-N 326.462 1.817 10 10 EDCE Cc1cc(Br)cc(CN2CCN(CCO)C[C@H]2C)c1O 825338312 OHMJZVRCRSTEEO-GFCCVEGCSA-N 343.265 1.962 10 10 EDCE CN1C[C@H](O)C[C@]1(C)C(=O)NCc1ccc(N2CCCCC2)cc1 900405591 YVINMWUJKNUTON-IEBWSBKVSA-N 331.460 1.748 10 10 EDCE C/C=C\[C@H](O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 900268475 CWBYODJMRBUJGQ-JXZFVUEUSA-N 336.407 1.993 10 10 EDCE COc1ccc(N2CCC(NS(=O)(=O)N(C)C3CC3)CC2)cc1 736331267 BZSMBQZUUAKUJE-UHFFFAOYSA-N 339.461 1.593 10 10 EDCE Cc1ncc2c(n1)CC[C@H](NC(=O)NCc1c(O)cccc1F)C2 914004889 VQWAABPJSMFJTK-LBPRGKRZSA-N 330.363 1.986 10 10 EDCE CN(C)c1ccc(CNC(=O)NCC[C@]2(O)CCOC2)cc1F 844935125 RYRWXFQFRQUECU-INIZCTEOSA-N 325.384 1.232 10 10 EDCE CCC[C@@H](CC)S(=O)(=O)Nc1ccc(NS(=O)(=O)NC)cc1 844660847 CTAPWBZKXVKOQE-CYBMUJFWSA-N 349.478 1.883 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)CC[C@H]21 923110441 XADJFUKXCWWWQC-MDZLAQPJSA-N 325.361 1.191 10 10 EDCE COC[C@H](NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)C1CC1 852226157 XDOYJOCPWGLRFX-PBHICJAKSA-N 333.432 1.998 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3nc(C)no3)C2)cc1 854296949 LRCJDRBGRBDUPH-CYBMUJFWSA-N 345.403 1.807 10 10 EDCE Cc1cc(C)c([C@@H](C)NCC[C@H]2CNCCS2(=O)=O)c(O)c1 925788075 FOVXLPZTHGKSSP-KGLIPLIRSA-N 326.462 1.436 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@H]2OCCO[C@@H]2C(F)(F)F)cc1 864574042 XBURGBNHRMRTBL-OLZOCXBDSA-N 332.322 1.715 10 10 EDCE CC(C)C1(S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)CC1 866756997 GKICQUPKOZBHJR-HNNXBMFYSA-N 325.478 1.860 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC(=O)CC[C@H]3C)nc12 932873209 CZZZRLLOBABEDH-SNVBAGLBSA-N 332.360 1.165 10 10 EDCE COCCOc1ccccc1NC[C@H](O)CC1(O)CCOCC1 872210471 AOWQEAYFNVLROO-CQSZACIVSA-N 325.405 1.416 10 10 EDCE COC(=O)c1cc(C(=O)NCc2ccc(N3CCCC3)cc2)no1 798161313 RGILOTJJIGMHFD-UHFFFAOYSA-N 329.356 1.991 10 10 EDCE CCOc1ccc(N2CCN(C(=O)CN3CCOCC3)CC2)cc1 1151503483 WYRBAUCVRHPQFO-UHFFFAOYSA-N 333.432 1.066 10 10 EDCE C[C@@H](NC(=O)c1cccc(O)c1O)[C@@H](C)C(=O)Nc1ncccc1O 1306836928 FYBOEVMJGQAUPH-NXEZZACHSA-N 345.355 1.592 10 10 EDCE O=C(CCSc1ncnc2[nH]cnc12)NCc1ccc(O)cc1O 1299572137 BQLXWTMMEDTQGD-UHFFFAOYSA-N 345.384 1.563 10 10 EDCE Cc1ccc(CCC(=O)NCC(=O)NCc2c(O)cccc2O)cc1 1456233861 GFWDEMPVESKFIO-UHFFFAOYSA-N 342.395 1.771 10 10 EDCE C[C@@H](NC(=O)c1ccc(F)c(S(N)(=O)=O)c1)c1ccccc1O 1454806928 PJESCOUNNFRIJZ-SECBINFHSA-N 338.360 1.670 10 10 EDCE COCCOc1ccc(CC(=O)NCc2cccc(O)c2O)cc1 1528770890 FFBWSCMQHJXZKE-UHFFFAOYSA-N 331.368 1.982 10 10 EDCE COC(=O)c1cc(CNC(=O)/C=C\c2ccc(O)c(O)c2)ccn1 1454221048 OPNAKVPVIPGJMY-HYXAFXHYSA-N 328.324 1.609 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(c2cccc(F)n2)CC1 1468275640 WQWDHGKGZLRDBJ-FNORWQNLSA-N 343.358 1.994 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1c[nH]c(C(=O)N2CCCC2)c1 1465953041 BIHIGDSZQUIEMW-UHFFFAOYSA-N 329.356 1.592 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C\c3ccncn3)CC2)cc1F 1545606290 KFHCIYUUKURKRC-DJWKRKHSSA-N 342.374 1.986 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C[C@@H]2CCC(=O)N2)cc1C 1714284972 RFRVFWQWPAQNKO-HIFRSBDPSA-N 333.432 1.267 10 10 EDCE COc1ccc(CNC[C@H]2CCCN2C(=O)[C@H](C)CC(N)=O)cc1C 1482060653 KVYKENGLAFVCSA-GDBMZVCRSA-N 347.459 1.596 10 10 EDCE Cc1cc(CN(C)Cc2nnc3c(=O)n(C)ccn23)ccc1N(C)C 1620573276 GPNRHZRCEGGDTO-UHFFFAOYSA-N 340.431 1.434 10 10 EDCE COC(=O)[C@H](CNC(=O)Cc1ccc(O)c(O)c1)c1ccc(F)cc1 1626883473 ICWWSKADJUKRGH-CQSZACIVSA-N 347.342 1.852 10 10 EDCE CCN(Cc1c(CO)cnc(C)c1O)C(=O)Cc1ccc(O)c(O)c1 1639132996 KAFKEKDTYNGXFY-UHFFFAOYSA-N 346.383 1.590 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cn(C)cn1 1637247932 VRSPRIWAFDERHW-UHFFFAOYSA-N 337.763 1.595 10 10 EDCE CO[C@H](C)C(=O)NC[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1688860324 WFTWYWDUONBVHC-GHMZBOCLSA-N 349.391 1.366 10 10 EDCE COc1ccnc(N2CCN(Cc3cc(OC)c(C)cc3O)CC2)n1 159919265 AZAQSRWUGGDRDI-UHFFFAOYSA-N 344.415 1.830 10 10 EDCE CN1C(=O)COc2cc(NN=NCCCN3CCOCC3)ccc21 1860493952 JJJJFCQPYKVDJH-UHFFFAOYSA-N 333.392 1.543 10 10 EDCE CC(C)(C)OC(=O)NC1(CNCc2cc(F)ccc2O)COC1 1938403277 XVIFSUHPPYOQCN-UHFFFAOYSA-N 326.368 1.915 10 10 EDCE CN1C(=O)[C@H](O)c2ccc(N(CC(N)=O)Cc3ccccc3)cc21 1946829757 BGBLJRMKRBRVBU-QGZVFWFLSA-N 325.368 1.188 10 10 EDCE CO[C@H]1C[C@@H](C(=O)O)N(Cc2ccc(Br)cc2O)C1 1964719678 ZKHXAUNWGQPORU-QWRGUYRKSA-N 330.178 1.829 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](C(=O)NCCN=[N+]=[N-])[C@@H]1CCOC1 1965103317 ZYBUDOOYISAJQH-GHMZBOCLSA-N 327.385 1.590 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)[C@@H](CCO)C2)c(Br)c1 2149906870 BBIRGAGUJPWNIS-WXHSDQCUSA-N 344.249 1.930 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NCc1c(O)cccc1F 1976861425 WAAVHKFDLYZFSD-STQMWFEESA-N 326.368 1.913 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 1985100482 WXVBKYCYAWQGNC-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE COc1cccc(CNC[C@@H](O)CNC(=O)OC(C)(C)C)c1O 1985776285 VCJPIYLQJIHOAA-GFCCVEGCSA-N 326.393 1.376 10 10 EDCE O=C1Nc2cc(N3CC[C@]4(CCO4)C3)c(Br)cc2[C@@H]1O 2153333885 PDEWGTOUFSLBCT-JSGCOSHPSA-N 339.189 1.804 10 10 EDCE COc1cc(C=C2SC(=S)N(CC(=O)O)C2=O)ccc1O 2053466484 MXJYMMBWGRJYDW-UHFFFAOYSA-N 325.367 1.687 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N3CC(C)(O)C3)c(Br)cc21 384030292 FXWHLBMHFWBVFE-LBPRGKRZSA-N 340.221 1.623 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@@H](O)CC2(C)C)c(Br)c1 2188630056 JJWYABRDQZCMML-UONOGXRCSA-N 343.265 1.879 10 10 EDCE NCc1ccc(N2CCN3CCOC[C@H]3C2)c(F)c1Br 2185886987 GGJIGCUXQJNATI-LLVKDONJSA-N 344.228 1.568 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2225798918 IJCLBQVGKAQAQM-YUMQZZPRSA-N 349.214 1.692 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CO[C@H]3COC[C@H]23)c1O 2236055651 QVWSTRRRERQONX-XWIASGKRSA-N 344.205 1.667 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccc(CCN)s2)s1 2284501071 QRWXOBROAUVGJY-UHFFFAOYSA-N 349.528 1.906 10 10 EDCE COC[C@@]1(C(=O)N2CC(N=[N+]=[N-])C2)C=CCN1C(=O)OC(C)(C)C 2299700765 SJSCIRAFQHNKTB-OAHLLOKOSA-N 337.380 1.700 10 10 EDCE CN1CCO[C@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@@H]21 1276155184 AXCNVSWVOVJQRL-STQMWFEESA-N 345.212 1.809 10 10 EDCE CC(C)[C@H](Sc1nccs1)C(=O)N1CCC(C(N)=O)CC1 52914599 STYLZGRYDJZLTR-NSHDSACASA-N 327.475 1.984 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1[C@H]2CC[C@@H]1CC(O)C2 171976274 ZEEOBPPRHWDURN-JWTNVVGKSA-N 331.460 1.699 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cn(C[C@@H]3CCOC3)nn2)cc1F 1261793411 HYSRQSCBRONURS-ZDUSSCGKSA-N 347.394 1.450 10 10 EDCE COc1ccc(CN2CCC(C(=O)N3CCOCC3)CC2)c(O)c1 179691329 XOKPVZDUDNRNOF-UHFFFAOYSA-N 334.416 1.472 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2357585983 SVGVGHINUXPFQT-IDNCBAHPSA-N 342.233 1.823 10 10 EDCE O=C1CCCN1C[C@@H](O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 121038114 PKLPIXIWALBCCB-IRXDYDNUSA-N 348.443 1.357 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1NCC[C@H]1O 1952346502 MOKDOMCFWUUEQA-KYOSRNDESA-N 338.404 1.256 10 10 EDCE O=C1NC(=O)[C@]2(CCCN(Cc3c(O)ccc4ccccc34)C2)N1 193465503 CZYLZMCDGJJZEH-GOSISDBHSA-N 325.368 1.719 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1OCCC1=O 1952404275 YJGOAZNWCHOBCN-IAQYHMDHSA-N 337.372 1.892 10 10 EDCE CCC(=O)N1CSC[C@@H]1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 273180069 OEDXVSOXGKUNRG-ZYHUDNBSSA-N 338.429 1.457 10 10 EDCE Cc1ccc(CNC(=O)N2CCNC[C@@H]2C)c(O)c1Br 2381127037 DLQFVEFQBBKVEU-JTQLQIEISA-N 342.237 1.966 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@](C)(O)[C@H](O)C2)c(Br)c1 1893326911 YQXUXHJLRJIKDM-OWYVNGRQSA-N 329.238 1.791 10 10 EDCE CCN(C(=O)NCc1ccc(N2CCOCC2)cc1)[C@H]1CCOC1 813044653 BGGLVRILCCMIGL-KRWDZBQOSA-N 333.432 1.844 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H]3CC[C@H]2CN3)cc1 817910552 VVDOYIRMIQWDBL-WBVHZDCISA-N 344.459 1.112 10 10 EDCE CCO[C@@H]1C[C@H](NCc2cc3c(cc2O)OCO3)[C@@H]1n1cccn1 815166749 IXSHFHDIVXYELC-VUCTXSBTSA-N 331.372 1.826 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@](O)(C3CC3)C2)cc1 826707004 PEYWEQOKEBUAOG-LJQANCHMSA-N 345.443 1.132 10 10 EDCE CCN(C)C(=O)[C@@H](C)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588576433 BZQGZZKOWNIGOS-YYRKOSNBSA-N 345.443 1.519 10 10 EDCE COc1cccc([C@H](C)NC[C@]2(OC)CCS(=O)(=O)C2)c1O 903362482 GHBGVKZYXZAJKQ-XHDPSFHLSA-N 329.418 1.255 10 10 EDCE CN1CC[C@@H](NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1=O 588563135 DZVHZYZOTLDIFR-HQQUCIOCSA-N 343.427 1.273 10 10 EDCE CCc1cccc(CNCCCN2CCC[C@H]2C(=O)N(C)C)c1O 848894069 GCCGZFUDLLHCRU-KRWDZBQOSA-N 333.476 1.987 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](N)Cc3ccccc3)C2)cc1 851639897 MTFUHHNKAOZTAT-QFBILLFUSA-N 339.439 1.960 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@H]3CC[C@@H](C2)[S@]3=O)cc1 859885964 PMSGFZPKRLICQR-KCYKTTMJSA-N 349.500 1.354 10 10 EDCE CCN(CC)c1ccc(CNC(=O)c2nc(COC)nn2C)cc1 853798560 OAZDHTBXZDJFPY-UHFFFAOYSA-N 331.420 1.738 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3C[C@@]34CCCNC4)C2)cc1 851639094 AWGRDEYUGWFERJ-POZUXBRTSA-N 329.444 1.780 10 10 EDCE CN(C)c1ccc(CNCCS(=O)(=O)CC(F)(F)F)cc1F 850364579 KQXJNPRUEOQJEK-UHFFFAOYSA-N 342.358 1.958 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)c3coc(OC)n3)C2)cc1 862035630 ZVPUAIPYCSRFLJ-GFCCVEGCSA-N 331.372 1.948 10 10 EDCE CCc1cc(CC(=O)NCc2ccc(N3CCOCC3)cc2)n(C)n1 930519999 PQHCKUJARBKIBT-UHFFFAOYSA-N 342.443 1.678 10 10 EDCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccnn1 861947341 WGKRXXCHHWOYDN-UHFFFAOYSA-N 334.326 1.521 10 10 EDCE O=C1C[C@H](S(=O)(=O)NCc2cc(Cl)ccc2O)CN1C1CC1 867463155 HONRPYREVLGBGC-LBPRGKRZSA-N 344.820 1.228 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C[C@@H]1F 1117407055 JHRHNQZBDDLNDH-PBHICJAKSA-N 345.418 1.886 10 10 EDCE CCN(C)c1ccc(CN2CCN(CCC(=O)N(C)C)CC2)cc1 773766598 TYOWXQUHCBWVKL-UHFFFAOYSA-N 332.492 1.739 10 10 EDCE COc1ccccc1Cc1nn(Cc2ccc(N)cc2)c(=O)nc1O 96841091 ALSRJUCAJFWPME-UHFFFAOYSA-N 338.367 1.574 10 10 EDCE COC(=O)c1c(CNC[C@]2(O)CCOC2)c2cc(F)ccc2n1C 894359784 RJAZJYTWGSIELE-QGZVFWFLSA-N 336.363 1.345 10 10 EDCE COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(O)c(O)c1)n2C 1138513510 QLHZQDSNEAIWGS-UHFFFAOYSA-N 341.367 1.852 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC4(CCCO4)C3)c(Br)cc21 702876819 XGUSJIBFNPSUBG-LBPRGKRZSA-N 338.205 1.770 10 10 EDCE C[S@](=O)C1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2115310635 ONWOPKAJEXLJNM-WLRWDXFRSA-N 345.218 1.002 10 10 EDCE Cc1cc(Br)cc(CN2C[C@@H]3NC(=O)O[C@@H]3C2)c1O 2120406536 RJXUFJYENZSEPL-WDEREUQCSA-N 327.178 1.756 10 10 EDCE CN1C(=O)NCC12CN(c1ccc(CN)c(Br)c1)C2 2121200746 YHRYBZNMRYMWCT-UHFFFAOYSA-N 325.210 1.122 10 10 EDCE CO[C@@]1(C)C[C@@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1(C)C 1332023993 XCSYXQYHJMFFOB-BEFAXECRSA-N 346.427 1.896 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC([C@H](F)C(N)=O)CC2)cc1 1348384255 FQOLKVNBRXVMKR-HNNXBMFYSA-N 336.411 1.498 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccn(C)c2)cc1C 1278069750 DPWDWPAALNQVBD-MRXNPFEDSA-N 331.416 1.223 10 10 EDCE CCCN1C[C@H](C(=O)N(C)CCN(C)c2ccc(OC)cc2)CC1=O 1278288213 HIWFLYVCHPKCRZ-OAHLLOKOSA-N 347.459 1.848 10 10 EDCE CCC(=O)NCCOCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1510176043 RDPKCMHPVIWZCV-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H](C(=O)NC3CC3)C2)cc1 1442676373 VELBULOZZMGBDV-LBPRGKRZSA-N 343.387 1.980 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC(N3CC[C@H](O)C3)CC2)cc1 1453729061 AXDQWCAHDQJWMZ-HNNXBMFYSA-N 345.403 1.520 10 10 EDCE CC(C)=CCN[C@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1486065753 LWTMZZYDEXKTCJ-AWEZNQCLSA-N 333.392 1.496 10 10 EDCE COC[C@@H](C)N(C)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1566521045 ILEXSKHGEONLDW-GFCCVEGCSA-N 335.408 1.936 10 10 EDCE CN1C(=O)C[C@@H](C(=O)NCc2c(O)cccc2O)c2ccccc21 1647270487 SVOFESFCSBZAMZ-GFCCVEGCSA-N 326.352 1.864 10 10 EDCE CO[C@H](C)CN[C@H]1C[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1688950978 DMHCKCUIUFKOSY-LALPHHSUSA-N 347.419 1.982 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@H]2COC(=O)N2)C(C)C)cc1C 1698964676 IOIBXVGPWACLOT-LSDHHAIUSA-N 349.431 1.342 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)c(Br)c1 2146307015 VTVNOJHMBODHDY-VCTAVGKDSA-N 341.249 1.650 10 10 EDCE C[C@@H](NC[C@@H](O)CNC(=O)OC(C)(C)C)c1c(O)cccc1O 1985776542 YKQNICVUWGONOY-GHMZBOCLSA-N 326.393 1.634 10 10 EDCE CS[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1995249510 GIUAXUGVLMAPCM-ZPFDUUQYSA-N 344.477 1.897 10 10 EDCE C[C@@H]1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C[C@@H]1O 300006474 MESRSFMXDOFXHS-RDZIJCNDSA-N 340.221 1.608 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C[C@@H]1CO 709218543 BGJIVPYPKSAMQY-OTPXZMOZSA-N 340.221 1.466 10 10 EDCE NS(=O)(=O)C1(CNCc2cc(Br)ccc2O)CC1 713919371 DGIOADBMGTVYAV-UHFFFAOYSA-N 335.223 1.065 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@]3(CNC(=O)N3)C2)c(Br)c1 2177669316 VBOMLNKCNMXGHL-OTYXRUKQSA-N 340.221 1.764 10 10 EDCE CN[C@H](c1ccc2c(c1)CCN2C)c1nn(C)nc1Br 2167746827 FTIVLZPGPRVFGS-GFCCVEGCSA-N 336.237 1.879 10 10 EDCE COc1ccc(N2C[C@H](O)CC23CNC3)c(OC)c1Br 2186606745 IUHCYLBZQSDSFT-SECBINFHSA-N 343.221 1.379 10 10 EDCE CC1(C)[C@@H](CO)OCCN1c1ccc(CO)cc1Br 2103400529 KUNXAWVPFYPYEB-CYBMUJFWSA-N 330.222 1.918 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2104424363 NDGLWLGBOQPOSX-GURXAOECSA-N 327.222 1.399 10 10 EDCE OCc1ccc(N2CC[C@@H]3OCCO[C@@H]3C2)cc1Br 2095427849 WWCBCSVHAYGOKK-UONOGXRCSA-N 328.206 1.936 10 10 EDCE O=S1(=O)C[C@H]2CN(Cc3cccc(Br)c3O)C[C@@H]21 2314965111 TYEJMWLAUWKPMP-KOLCDFICSA-N 332.219 1.384 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3CS(=O)(=O)[C@H]3C2)c(Br)c1 2336470992 NNANWOXQXLYXCX-DVYJOKAKSA-N 345.262 1.702 10 10 EDCE Cc1ccc(CN2CCNCCNCC2)c(O)c1Br 2352947883 WBKPQIPNJKSECV-UHFFFAOYSA-N 328.254 1.458 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CN(CCO)CCOCC(F)(F)F)c1 173392243 OKRBSBQLGIWBKC-UHFFFAOYSA-N 338.282 1.674 10 10 EDCE CN(c1cccnn1)C1CCN(C(=O)c2cccc(O)c2O)CC1 187098020 MUABTPWCPOROBA-UHFFFAOYSA-N 328.372 1.629 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1COC(=O)N1 1951941930 ZKMOBNAFKRBSDW-QWRGUYRKSA-N 338.360 1.642 10 10 EDCE COC[C@H]1[C@@H](O)[C@@H](O)CN1c1ccc([C@H](C)N)cc1Br 2358565396 LODCVMCVWFOERD-PWURMNTRSA-N 345.237 1.026 10 10 EDCE COc1ccc(N(C)C[C@@H]2CCN(S(C)(=O)=O)C2)c(OC)c1 801523505 BHLKOEJQACABAM-LBPRGKRZSA-N 328.434 1.422 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(-n2cncn2)nc1 808095498 HJJOIIOYRJXXEZ-UHFFFAOYSA-N 344.371 1.784 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CNCC[C@@H]3C)C2)cc1 818655921 QBIMRYDTEUIHJL-DAYGRLMNSA-N 346.475 1.819 10 10 EDCE COCC[C@@H](COC)NC(=O)N[C@H](C)c1cc(OC)ccc1O 811956209 NEGIITMPOKUACS-NEPJUHHUSA-N 326.393 1.813 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CN[C@@H]3[C@H]4CCC[C@H]43)CC2)cc1 819270929 LYWQNORMFJBJNG-IJXRJRJASA-N 345.487 1.566 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3cccn(C)c3=O)C2)cc1 821239611 PQXPMCDYZYJFTJ-CYBMUJFWSA-N 342.399 1.794 10 10 EDCE COC[C@@](C)(O)CCNC(=O)NCc1ccc2c(c1)CCCN2C 836530482 COSAZZGWYLAJLL-SFHVURJKSA-N 335.448 1.656 10 10 EDCE Cc1ccc(C(=O)N[C@H]2C[C@H](N3CCOCC3)C2(C)C)c(O)c1O 911843360 LUNIBNBOPVHJJC-KBPBESRZSA-N 334.416 1.635 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1 1896286807 LRVYXEHSBPRJQA-WDEREUQCSA-N 325.369 1.339 10 10 EDCE COCCS(=O)(=O)CCCN1CCCc2cc(CN)ccc21 843349784 CHOBGDNBEREPEF-UHFFFAOYSA-N 326.462 1.349 10 10 EDCE Cc1cc(N(C)C)ccc1CN1CCO[C@]2(CCS(=O)(=O)C2)C1 843426349 UFXNYKJHFGDZGC-QGZVFWFLSA-N 338.473 1.451 10 10 EDCE CC(C)(CNC(=O)NCc1c(O)cccc1F)CS(C)(=O)=O 926744044 KRQOWMPITYHGTJ-UHFFFAOYSA-N 332.397 1.401 10 10 EDCE C[C@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCCO1 755213159 SFDVWTFNXSLBRG-HNAYVOBHSA-N 345.443 1.574 10 10 EDCE COC(=O)C12CC(C(=O)N[C@@H]3CCN(c4ccc(OC)cc4)C3)(C1)C2 855227283 WXLRIIFREVFLIV-XYJCDUHRSA-N 344.411 1.733 10 10 EDCE O=C1[C@H](NCc2ccc(N3CCOCC3)c(F)c2)CCN1C1CCC1 858343286 WRLLFDMOVFVVEJ-QGZVFWFLSA-N 347.434 1.905 10 10 EDCE Cc1ccc(C(=O)NCCC2(CS(C)(=O)=O)CC2)c(O)c1O 855215755 ZDYLTOIIBHCNGG-UHFFFAOYSA-N 327.402 1.351 10 10 EDCE Cc1cc(C)c(O)c(CN2CCN(c3nccn(C)c3=O)CC2)c1 754738346 YVLHGDMNKGZCKQ-UHFFFAOYSA-N 328.416 1.425 10 10 EDCE CO[C@H](CS(=O)(=O)N[C@H](C)c1ccccc1O)[C@H]1CCOC1 867834439 IHYLKCMJYOUTPC-TYNCELHUSA-N 329.418 1.424 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)N3C[C@H](O)C[C@H]3C(N)=O)c2C)c1 862682971 NLPZFNFUIBXGDV-WBVHZDCISA-N 341.411 1.463 10 10 EDCE CC[C@@H]1NCC[C@H]1NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 861677354 SKSKLZXWFCCIRK-ZWKOTPCHSA-N 346.475 1.805 10 10 EDCE C[C@@H](NC(=O)c1ccc(S(N)(=O)=O)cn1)c1ccc(N(C)C)cc1 773989005 NGNOMLJUWKFADJ-LLVKDONJSA-N 348.428 1.286 10 10 EDCE CCn1ncnc1CNCCN1CCN(c2ccc(OC)cc2)CC1 876980389 GVTJEUUEIPPWIO-UHFFFAOYSA-N 344.463 1.218 10 10 EDCE O=C1OCC[C@H]2CN(Cc3ccc(N4CCOCC4)cc3)CCN12 770388498 BQACPFRAWWRFMW-KRWDZBQOSA-N 331.416 1.550 10 10 EDCE Cc1ccc(C(=O)N2CCC(O)(c3nccn3C)CC2)c(O)c1O 1123894429 GNLNJAKOOVVRCC-UHFFFAOYSA-N 331.372 1.264 10 10 EDCE CCN(CC)c1ccc(CNC(=O)CCS(=O)(=O)N(C)C)cc1 1141865957 KWQIWTGWXUSPPA-UHFFFAOYSA-N 341.477 1.431 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H]2CCCNC2=O)cc1C 1319201999 LXNKFTNWHJXTRD-XJKSGUPXSA-N 347.459 1.372 10 10 EDCE C[C@H](NC(=O)c1cnc2nc(O)nc(O)c2c1)c1ccccc1O 1171730945 TWPLRQYGQALKAZ-QMMMGPOBSA-N 326.312 1.633 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CNc2ccccc2C1 1326875543 QFUBHXBQOMBOJV-OAHLLOKOSA-N 339.395 1.504 10 10 EDCE Nc1ccc(CCCn2c(O)nnc(Br)c2=O)cc1 2118566085 VRZLIUSYDPXBEA-UHFFFAOYSA-N 325.166 1.321 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2cncnc2O)cc1C 1331473089 DFTUGTQCZIGWTF-CYBMUJFWSA-N 344.415 1.750 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2cn(C)c(O)n2)cc1C 1268082724 FTXKWGUODUWDMT-ZDUSSCGKSA-N 346.431 1.693 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC/C=C/CNC(=O)C(F)F)cc1 1501620936 ZNYNJEYUIPEMSA-DBZUVFRKSA-N 339.302 1.516 10 10 EDCE CCc1cnc(CN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)s1 1351907619 OYDNMGLWZFYECI-UHFFFAOYSA-N 345.424 1.912 10 10 EDCE CCN[C@@H](C)c1ccc(N2CC(CO)(CO)C2)cc1Br 1914978648 LJNRMUWUFBKQOQ-NSHDSACASA-N 343.265 1.911 10 10 EDCE O=C(CC1(N2CCOCC2)CCCC1)NCc1cccc(O)c1O 1528770742 DRPHAQMWGQXYLL-UHFFFAOYSA-N 334.416 1.749 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2ccccn2)cc(OC)n1 1526345530 UPGOYPUPYKRWNF-LLVKDONJSA-N 344.371 1.042 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(CO)on1 1451912547 HAVGIJCURSZNQE-UHFFFAOYSA-N 334.328 1.078 10 10 EDCE CN(C[C@H](O)COCc1ccccc1)C(=O)c1cc(O)nc(O)c1 1916383153 DKYDIOCMIZLBRB-AWEZNQCLSA-N 332.356 1.143 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cnc3nccn3c2)c1 1470325651 HJUZAXOFWVTZMD-UHFFFAOYSA-N 347.356 1.059 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C2CC(C)C2)cc(OC)n1 1704015697 SCTFWWOPKYVCRF-CXQJBGSLSA-N 335.404 1.379 10 10 EDCE CCN1CC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1542180406 KTFMKCOFSIHEIU-NVXWUHKLSA-N 344.459 1.099 10 10 EDCE CN(C)[C@@H]1COC[C@H]1NCc1cc(Br)cc(F)c1O 1921989617 CROTXZFRQMUVID-VXGBXAGGSA-N 333.201 1.712 10 10 EDCE Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 1556157964 NZZHTYRJEIXTHB-VIFPVBQESA-N 334.332 1.258 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2ocnc2C)cc1C 1717914335 XDRMUFKYNLOGDN-OAHLLOKOSA-N 347.415 1.523 10 10 EDCE CC1=CC(C(=O)Nc2ccc(-c3ncn(C)n3)cc2)=S=C1C=O 1632647555 MZQHANVHPTXTOO-UHFFFAOYSA-N 326.381 1.657 10 10 EDCE CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(O)c1)[C@H]1CCCOC1 1633782067 KENJQMBUVVEAAW-BLLLJJGKSA-N 337.372 1.115 10 10 EDCE COC(=O)[C@H](Cc1ccncc1)NC(=O)c1ccc(C)c(O)c1O 1569605345 RYJIELWVTDPZSA-ZDUSSCGKSA-N 330.340 1.315 10 10 EDCE CS(=O)(=O)c1ccccc1CC(=O)NCc1ccc(O)cc1O 1638352187 LHWLNKTUYOABNH-UHFFFAOYSA-N 335.381 1.360 10 10 EDCE CN(C(=O)Cc1ccc(O)c(O)c1)[C@H]1CCCC[C@@H]1S(C)(=O)=O 1565975179 GAXFNDONKKVARV-WFASDCNBSA-N 341.429 1.455 10 10 EDCE CCC(=O)NCC(=O)NC1CC(CNCc2ccc(OC)c(C)c2)C1 1570556951 PUKSQJSEBOOIJJ-UHFFFAOYSA-N 347.459 1.514 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@H]2CC[C@@H](C(N)=O)C2)cc1C 1731616569 GDZVXWMUNXRAIY-BMFZPTHFSA-N 347.459 1.500 10 10 EDCE O=C(CNC(=O)c1cc2ccccc2[nH]1)NCc1cc(O)ccc1O 1644754059 PLMWTENYZPFGCN-UHFFFAOYSA-N 339.351 1.625 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@]1(c2ccccc2)C[C@H](O)C1 1596193599 DDOQUCVCMXUYHX-RHDGDCLCSA-N 327.380 1.849 10 10 EDCE CC(=O)NCCC(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1866087250 VDZUELHJFAWXLQ-KRWDZBQOSA-N 343.431 1.218 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC([C@@H]2CCOC2)C1 1323041078 CBXZNSPQEWRKEE-OAHLLOKOSA-N 345.443 1.172 10 10 EDCE NC(=O)CO[C@@H]1CCCN(c2ccc(CO)c(Br)c2)C1 2145382488 NSBLABHKRGZEOP-GFCCVEGCSA-N 343.221 1.412 10 10 EDCE COC(=O)[C@H](CC(=O)NCCCN=[N+]=[N-])NC(=O)OC(C)(C)C 1985100217 VYPJBHHRNKXIHE-VIFPVBQESA-N 329.357 1.259 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)[C@@H](CCO)C2)cc1Br 2149915569 VRBIFQZRKGOFMU-WOPDTQHZSA-N 343.265 1.896 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)cc1Br 2173357567 NRYWULHGYCXGKD-NIQAVCIQSA-N 342.233 1.823 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCCN(C4CCCC4)CC3)c2n1 2063120530 RHVOVPZOUACXDR-UHFFFAOYSA-N 343.431 1.834 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCC[C@H](C(=O)N2CC(N=[N+]=[N-])C2)O1 1909806351 GQABBQGQGIQXJJ-NWDGAFQWSA-N 339.396 1.970 10 10 EDCE C[P@]1(=O)C[C@@H](O)[C@H](NCc2c(O)cccc2Br)C1 2057718211 GVEYKMUTXARHFL-AJLCLMPTSA-N 334.150 1.980 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CC[C@H]1COc1nnc(=N)[nH]n1)CC2 2213790185 QVYDTKQRLSBALN-JTQLQIEISA-N 336.396 1.238 10 10 EDCE COc1ccc(Br)c(CN[C@H](C)C(=O)N(C)C)c1O 2227747863 GKKZROOIGYIIPA-MRVPVSSYSA-N 331.210 1.730 10 10 EDCE NCc1cc(F)c(N2CCNCCNCC2)cc1Br 2227912096 PDUGCLBXUOLZNA-UHFFFAOYSA-N 331.233 1.046 10 10 EDCE COc1ccc(Br)c(CNCC2(O)CSC2)c1O 2255986279 TWVAEHMEALMIQA-UHFFFAOYSA-N 334.235 1.731 10 10 EDCE C[C@@H](CN1CCOCC1)NCc1cc(Br)c(O)cc1O 2282985057 WTWVUJFPZVIERS-JTQLQIEISA-N 345.237 1.671 10 10 EDCE CCN1C(=O)C(=C2SC(N3CCOCC3)=NC2=O)c2ccccc21 2296537487 QMTRMWMRYMGITN-UHFFFAOYSA-N 343.408 1.726 10 10 EDCE Cn1cc(N2CCC[C@H](NC(=O)C=Cc3ccc(O)c(O)c3)C2)cn1 2308001584 VSYGIYIHNCJDIF-AWEZNQCLSA-N 342.399 1.630 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)C(=Cc2cccc(O)c2)SC1=S 2323832013 BBXLPVMAFFCZJA-SECBINFHSA-N 325.367 1.039 10 10 EDCE Cc1cc(C(=O)N[C@H]2CCc3ncnn3C2)c(C)n1-c1ccccn1 112651329 AHHOLRPMIGEKKK-AWEZNQCLSA-N 336.399 1.825 10 10 EDCE CN1CCN(C(=O)CC2CCN(Cc3cc(F)ccc3O)CC2)CC1 180088241 HKSBUNBXBWPYMS-UHFFFAOYSA-N 349.450 1.907 10 10 EDCE C[C@@H](NC[C@@H]1CN(C)CCO1)c1ccc(N2CCC(O)CC2)cc1 180486084 AWWHMLHAWOMESG-DNVCBOLYSA-N 333.476 1.629 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@]4(CCCOC4)C3)cc2N1 368542827 FKUCCYACJRJFRP-MRXNPFEDSA-N 349.343 1.312 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CNCC2(F)F)c(O)c1Br 2381141494 ZZDWRXQJGXQIPC-VIFPVBQESA-N 349.175 1.934 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc([N+](=O)[O-])cc1Br 808520646 UZRVVSWZZLIPPV-UHFFFAOYSA-N 330.090 1.672 10 10 EDCE CN1CCN(C[C@@H](O)CNc2ccccc2OCC(F)F)CC1 819460994 YKJPKZMKZXINMA-ZDUSSCGKSA-N 329.391 1.351 10 10 EDCE COc1cccc(CNC(=O)N[C@H]2CC[C@H](C)S(=O)(=O)C2)c1O 822001270 SDDZUAQVXPRAGX-JQWIXIFHSA-N 342.417 1.166 10 10 EDCE Cc1cnn(C[C@H]2CN(C(=O)/C=C\c3ccc(O)c(O)c3)CCO2)c1 588406496 HUTOPXIZKOOZJA-UYWPIULCSA-N 343.383 1.544 10 10 EDCE C[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCN1CC(C)(C)O 588540778 LMMIIMIZZZKPIT-SCXUMTSISA-N 334.416 1.415 10 10 EDCE Cc1cc(O)c(CN(C)CCN2CCCS2(=O)=O)c(Cl)c1 840923303 SHNRQOZXYUPKHV-UHFFFAOYSA-N 332.853 1.821 10 10 EDCE O=C(NCC[C@@]1(O)CCOC1)NCc1ccc(N2CCCC2)cc1 844887468 GVWVSHTXAVHTRE-GOSISDBHSA-N 333.432 1.628 10 10 EDCE NCC12CC(CN1C(=O)NCc1ccc(N3CCOCC3)cc1)C2 851654398 BIVSALCJPOQZSB-UHFFFAOYSA-N 330.432 1.156 10 10 EDCE CCN1CCN(CC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 855232065 QGWGSDMQWFQJPO-INIZCTEOSA-N 346.475 1.028 10 10 EDCE C[C@H](NC(=O)N[C@@H](C)c1nnc(O)n1C)c1ccc(N(C)C)cc1 922050599 CTOOKGMUEFSRHJ-QWRGUYRKSA-N 332.408 1.708 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCOC[C@H]3C)C2)cc1 852281210 RFPVZKYZIXIOOH-KEYYUXOJSA-N 333.432 1.998 10 10 EDCE O=S(=O)(CCOCC(F)(F)F)N1Cc2cccc(O)c2C1 867690205 CNJVQBKAJSDCIM-UHFFFAOYSA-N 325.308 1.617 10 10 EDCE CO[C@@H](CS(=O)(=O)N[C@H](C)c1ccccc1O)[C@H]1CCOC1 867834441 IHYLKCMJYOUTPC-XUJVJEKNSA-N 329.418 1.424 10 10 EDCE N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 870868406 GSSAAAOWURBWAE-HDMKZQKVSA-N 331.485 1.983 10 10 EDCE CCS(=O)(=O)c1ccc(CC(=O)NCc2ccc(O)c(O)c2)cc1 778916379 GHPJMRIRLAWRTL-UHFFFAOYSA-N 349.408 1.750 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN(C)C[C@H]2CCS(=O)(=O)C2)c1O 774903263 LYQNPIVFMJEUJJ-SNVBAGLBSA-N 344.389 1.176 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)Cc3ccon3)cc2)CC1 786655536 FMMKXWMBNYASMN-UHFFFAOYSA-N 342.399 1.202 10 10 EDCE CC(C)[C@H](C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788312538 IMPHKNREIAQERX-OAHLLOKOSA-N 347.459 1.548 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H](C)O[C@H](CO)C2)c([N+](=O)[O-])c1 786809967 BAQGPPRMUHRMOW-IKHFIWMDSA-N 336.344 1.367 10 10 EDCE CC(C)(C)OC(=O)C1=NO[C@H](C(=O)NCc2cccc(O)c2O)C1 1303195489 VALJCKTXOHEESG-LBPRGKRZSA-N 336.344 1.201 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)[C@@H]2CC23CC3)cc1C 1326093892 AZWXWHCQDCQJEZ-INIZCTEOSA-N 332.444 1.714 10 10 EDCE CC(C)[C@H]1CNC(=O)CN1c1ccc(CO)cc1Br 2124760275 XPFBLNYWADMAQJ-CYBMUJFWSA-N 327.222 1.902 10 10 EDCE NCc1ccc(N2C[C@H]3NC(=O)O[C@@H]3C2)c(F)c1Br 2120407785 FOZLVYVKRDJRQJ-VXNVDRBHSA-N 330.157 1.344 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@@H](OC)C2)cc1 1257176836 PBJGOBXHIQZVRY-NVXWUHKLSA-N 347.459 1.833 10 10 EDCE C[C@@H]1CCOCCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1332565170 QJXRIHPLZICIIS-GFCCVEGCSA-N 337.395 1.145 10 10 EDCE O=C(O)[C@@]1(CNCc2ccc(N3CCOCC3)cc2)CCCOC1 1262157127 RNJAZVHXVKRTQK-GOSISDBHSA-N 334.416 1.494 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@@]2(C)CC2(F)F)cc1 1261680015 LLPUWNQNRGODSO-INIZCTEOSA-N 339.386 1.920 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cncs2)cc1C 1278738024 YCTFEQYFLVNEEN-CQSZACIVSA-N 349.456 1.683 10 10 EDCE COC(C)(C)[C@H](C)NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 1351286404 CVKDSWRMMYHASJ-ZDUSSCGKSA-N 335.448 1.607 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)C[C@@H](C)O)c(Br)cc21 221246098 ZZBBAOKWJVGYBZ-JMCQJSRRSA-N 328.210 1.479 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@H]1CCS(=O)(=O)c2ccccc21 1471642414 SNOUNMBSPKQRJR-ZDUSSCGKSA-N 347.392 1.675 10 10 EDCE CCc1cc(C(=O)NC[C@@H](O)CNCc2ccc(OC)c(C)c2)n[nH]1 1715584021 ZHJCQFGJKPXJBE-HNNXBMFYSA-N 346.431 1.170 10 10 EDCE CS(=O)(=O)c1cc(C(=O)NCc2ccc(O)cc2O)ccc1F 1557084702 LCXZRSCFBZTZCG-UHFFFAOYSA-N 339.344 1.570 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1ccc2c(c1)C(=O)NCCO2 1566304751 TYQIFEBGDQADCW-UHFFFAOYSA-N 326.352 1.787 10 10 EDCE COc1cc(C(=O)NCc2cccc(Br)c2O)ncn1 1568610646 TZMSWJLXGNRZJP-UHFFFAOYSA-N 338.161 1.883 10 10 EDCE Cn1cc([C@@H]2CCCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)nn1 1640447728 DFZKXCVKDKAXRQ-VUDGCMKMSA-N 328.372 1.646 10 10 EDCE O=C(NCc1cc(O)ccc1O)C1=NN(c2ccccc2)C(=O)CC1 1643879364 MTMSNJANEJHKLJ-UHFFFAOYSA-N 339.351 1.897 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2C[C@@H](O)CC3(CCOCC3)C2)cc1 1650841238 SZKUUJXRAQSVFX-AWEZNQCLSA-N 346.387 1.853 10 10 EDCE CC(C)(C)NC(=O)[C@@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1598443418 RFEXEYZLAOUMJV-NSHDSACASA-N 338.429 1.457 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H]2CCC2(F)F)cc1C 1667843941 YTSQPWJMOYVEJB-UONOGXRCSA-N 342.386 1.616 10 10 EDCE CCNCc1ccc(N2CC[C@@H](C(N)=O)C2)c(Br)c1 233536250 JYWKAHZBHPMCCK-LLVKDONJSA-N 326.238 1.870 10 10 EDCE CCOc1cccc(CNCCC(=O)N2C[C@H](C)O[C@H](C)C2)c1O 1857863905 MOIVEGKNTWWEAR-OKILXGFUSA-N 336.432 1.906 10 10 EDCE O=C(O)CCN1CCN(Cc2cc(Br)ccc2O)CC1 236426104 ZUHVHWRSNCPCML-UHFFFAOYSA-N 343.221 1.747 10 10 EDCE COCCN(C)CCNCc1c(Br)ccc(OC)c1O 1964043426 PMVQYUFSIAPWCL-UHFFFAOYSA-N 347.253 1.831 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCC[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003168942 YALVMDJVWVHBDK-FDYHWXHSSA-N 340.420 1.182 10 10 EDCE C[C@H]1COC[C@@H](C(=O)N(C)CCN=[N+]=[N-])N1C(=O)OC(C)(C)C 1985095264 BQWJCUZJCVRMSH-QWRGUYRKSA-N 327.385 1.780 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985101392 RNPVNYZIHFXKRZ-WDEREUQCSA-N 325.369 1.534 10 10 EDCE CN(CC(C)(C)CO)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2150983688 ZLNPNICOGVNHTJ-LBPRGKRZSA-N 343.221 1.889 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010402879 XONIKSJIUWWPSP-PWSUYJOCSA-N 341.412 1.809 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(N)cc1 2022875910 QWVVFZXDGVZPPX-FZMZJTMJSA-N 337.420 1.501 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](NC(N)=O)C2)c(Br)c1 690736822 SHDAYQFTXUZUTD-WPRPVWTQSA-N 328.210 1.749 10 10 EDCE Oc1ccc(CNCCCn2cc(Br)cn2)c(O)c1O 379970416 HTUIEFOBJQLAOM-UHFFFAOYSA-N 342.193 1.942 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCOC4(CCCC4)C3)c2n1 2064657259 NEUKAVFVWCXPFN-GFCCVEGCSA-N 330.388 1.965 10 10 EDCE CCOC(=O)c1c(C2CCC2)nn2c(O)cc(CC(=O)OC)nc12 2080933752 TVFOPVDDHXBPPP-UHFFFAOYSA-N 333.344 1.595 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)c(Br)c1 2189046069 ZMZUDKQGPMEGAS-NYMYIZQJSA-N 342.233 1.946 10 10 EDCE C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)COc2ccc(N)cc2)C1 2044621879 VPARYVOGIIBHPC-AWEZNQCLSA-N 345.321 1.317 10 10 EDCE O=C1C[C@@H]2CCN(Cc3cc(Br)ccc3O)C[C@@H]2N1 2088805001 ASNXOLUUAKPTQA-CABZTGNLSA-N 325.206 1.865 10 10 EDCE O=C(O)CN1CC[C@H](NCc2c(O)cccc2Br)C1 2113032164 XWBQPYYZKKULDY-VIFPVBQESA-N 329.194 1.403 10 10 EDCE CN1CCN(c2ccc(CN)c(Br)c2F)[C@H](CCO)C1 2202820772 OAWIOZSZKYRVON-LLVKDONJSA-N 346.244 1.550 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2246444091 BLWZQSBBUOFDFO-UTUOFQBUSA-N 339.396 1.658 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)[C@H](O)CC2)cc1Br 2269137227 HALXVVGKTXCJIX-CUOATXAZSA-N 329.238 1.791 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](O)[C@@H](O)CC2)cc1Br 2269122752 XQBVURCKCOKYLS-IIMNLJJBSA-N 330.222 1.824 10 10 EDCE O=C(CN1C(=O)C(=CC=Cc2ccccc2)SC1=S)NCCO 2294872016 MJCNLWUIOHECCD-UHFFFAOYSA-N 348.449 1.553 10 10 EDCE Cn1cccc1C=C1SC(=S)N(NC(=O)c2cccnc2)C1=O 2297470044 PBDRDPPQOGLVDK-UHFFFAOYSA-N 344.421 1.966 10 10 EDCE C[C@](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)(C(=O)O)C1CC1 2311974059 UCKWCHJPEFKMTF-LJQANCHMSA-N 344.411 1.906 10 10 EDCE CCN(Cc1cc(Br)ccc1O)C(=O)Cn1ccnn1 120997936 QZQVEERISDGELT-UHFFFAOYSA-N 339.193 1.795 10 10 EDCE C[C@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)c1ncon1 254970726 RCQOKQGIMYUWSC-IRBQFCFKSA-N 328.372 1.797 10 10 EDCE COCC(=O)N1CCc2c(NC(=O)c3cccc(O)c3O)cccc21 365672579 NINBOXSOPICMKN-UHFFFAOYSA-N 342.351 1.886 10 10 EDCE Cc1ccc(CN2C[C@@H](O)C[C@@H]2CN(C)C)c(O)c1Br 2380813364 FXXKLYLCGBVMRS-OLZOCXBDSA-N 343.265 1.960 10 10 EDCE NCc1cc(F)c(N2CC(C(=O)NC3CC3)C2)cc1Br 2168042659 OBOZUHIJKBOUNO-UHFFFAOYSA-N 342.212 1.762 10 10 EDCE C[C@H](CONC(=O)c1c(F)ccc(O)c1O)NC(=O)OC(C)(C)C 297034167 HLOBJBKONXCSHK-MRVPVSSYSA-N 344.339 1.812 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCCCN1CCCC1=O 734652135 GUHKQPSYEKDMIW-UHFFFAOYSA-N 332.448 1.873 10 10 EDCE COC(=O)[C@@H](O)CNC(=O)/C=C\c1cc(C)n(-c2ccccc2)c1C 588407502 BKYBFBGKIZAIIO-IBSYWUHOSA-N 342.395 1.757 10 10 EDCE CCCN1CCC(CNC(=O)C(=O)NCCc2ccc(N)cc2)CC1 842036058 RIVSLCRMTQVLKB-UHFFFAOYSA-N 346.475 1.166 10 10 EDCE Cc1cc(N(C)C)ccc1CNC[C@@H]1CCCCN1S(C)(=O)=O 840947508 XBWGVQKRVGWHMP-KRWDZBQOSA-N 339.505 1.965 10 10 EDCE CC(=O)c1cc(F)cc(CN2C[C@H]3COCC[C@@]3(C(=O)O)C2)c1O 846287515 YOKNKYXUKZFWFE-YVEFUNNKSA-N 337.347 1.657 10 10 EDCE C[C@@H](NC(=O)NC[C@@H](O)c1ccnn1C)c1ccc(N(C)C)cc1 922053985 HWAKCBHFHPNZLC-MLGOLLRUSA-N 331.420 1.580 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1CCCN1C(C)=O 868966610 TVCQQWRZIIIRQW-HNNXBMFYSA-N 348.399 1.295 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCc3nccnc3C2)cc1F 1118593549 SQQCPCXOHCOUNG-UHFFFAOYSA-N 329.379 1.950 10 10 EDCE CNC[C@@H](C)CNC(=O)NCc1cc(Br)ccc1O 1325367066 UVPODKLIAMDOLS-SECBINFHSA-N 330.226 1.809 10 10 EDCE CN1CCN(C2CN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)CC1 1334934741 JCZMHAFWNMLNDV-UHFFFAOYSA-N 347.440 1.384 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1C[C@@H](O)CC12CNC2 2130052535 DAEHSDQQUYGRPM-JTQLQIEISA-N 347.640 1.717 10 10 EDCE O=C(O)[C@]1(CNCc2ccc(N3CCOCC3)cc2)CCCOC1 1262157128 RNJAZVHXVKRTQK-SFHVURJKSA-N 334.416 1.494 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)CCc2nc[nH]n2)cc1C 1277793297 OWKGLFMRYMMSEH-AWEZNQCLSA-N 345.447 1.691 10 10 EDCE O=C(Nc1cn[nH]c1)[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 1449968729 HMXMWISCAVSGOX-KMOQFTEPSA-N 342.355 1.321 10 10 EDCE COCCC(=O)N(C)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1294148735 FTSOZEUTGDBBHA-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE Cn1ncc(Br)c1CC(=O)NCc1ccc(O)c(O)c1 1294870254 SIDIIYGSHBDOOO-UHFFFAOYSA-N 340.177 1.453 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1Cc1nnc2n1CCC2 1290718827 IIOVPGJBCHAUNK-UHFFFAOYSA-N 339.403 1.515 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1ccnc2[nH]c(O)nc12 1465028220 FXMBFFLAFMMVOB-UHFFFAOYSA-N 325.372 1.968 10 10 EDCE COC(=O)c1cnc(CNC(=O)/C=C/c2ccc(O)c(O)c2)s1 1471902424 PEPWETFSQQNVOM-HWKANZROSA-N 334.353 1.671 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2ccncn2)cc1C 1486305785 MYSIBTBUMOUSDA-OAHLLOKOSA-N 344.415 1.016 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@@H](C)NC(=O)C(F)F 1486627202 KCXXDGJQPFUGHF-JGVFFNPUSA-N 341.318 1.737 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)CCn2cnnn2)cc1C 1714791745 BWAFRUVAMGRLAC-CQSZACIVSA-N 346.435 1.017 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@H]2CCC(=O)NC2)cc1C 1568877124 GPJYHFJLFGEZFU-CWDCEQMOSA-N 345.443 1.292 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)Cc2ccn(C)n2)cc1C 1725485306 YWCHHHZPJPGRAW-OAHLLOKOSA-N 344.459 1.916 10 10 EDCE CC[C@@H](CNC(=O)C1(C)CC1)NC(=O)c1cc(OC)nc(OC)c1 1759325265 KWKVZYIDFMHGNF-LBPRGKRZSA-N 335.404 1.524 10 10 EDCE CC(C)CN(CC(N)=O)c1ccc(CN)c(Br)c1F 231839642 DCTXKWJAEVMIRM-UHFFFAOYSA-N 332.217 1.995 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@@H]3CN(C)C[C@@H]3C2)c([N+](=O)[O-])c1 1772964073 MKPJHKOXEQEIBF-HFBDLHNASA-N 331.372 1.779 10 10 EDCE C[C@@H](O)[C@H](C(=O)O)N1C(=O)/C(=C\c2cccc(O)c2)SC1=S 1858592046 GZHHBUOCCCYKON-TVNLMNMCSA-N 339.394 1.427 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@](C)(C(=O)N2CC(N=[N+]=[N-])C2)C1 1985094192 LDYHTLVXJRVJMU-AWEZNQCLSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)CCOC1 2010406707 XZHWIXBEYWVVIM-NHYWBVRUSA-N 339.396 1.972 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](N=[N+]=[N-])C1)C(C)(C)O 2014480880 UWSIYJZXHCGMKK-MNOVXSKESA-N 341.412 1.952 10 10 EDCE CN1CCc2cc([C@@H](NN)c3cn(C)nc3Br)ccc21 2173188901 IGCAJDDXXIUCCH-CYBMUJFWSA-N 336.237 1.728 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](CNCc2cccc(O)c2O)C1 397473103 KNQBLLBPLCLDNJ-CYBMUJFWSA-N 338.404 1.823 10 10 EDCE COC[C@H]1C=CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2182373217 VLOKENVYGGASQC-AMIZOPFISA-N 338.205 1.792 10 10 EDCE O=C1Nc2cc(N3CCC=C[C@H]3CO)c(Br)cc2[C@H]1O 2182333822 VUSNREJNFUSGCQ-ISVAXAHUSA-N 339.189 1.562 10 10 EDCE O=S1(=O)C[C@@H]2CN(c3ccc(CO)cc3Br)C[C@@H]2C1 2087855580 DJMYWTKJKUGCDC-PHIMTYICSA-N 346.246 1.422 10 10 EDCE O=S1(=O)C[C@H]2CCN(Cc3c(O)cccc3Br)[C@@H]2C1 2094882870 NXODYBBJXPAGBC-BXKDBHETSA-N 346.246 1.774 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2210536660 HWQWDABXWCNVRP-MMWGEVLESA-N 327.385 1.608 10 10 EDCE COc1ccc(N2CCN(C)C[C@@H]2CO)c(OC)c1Br 2234881720 RLVMBAAWTVSWQV-SNVBAGLBSA-N 345.237 1.579 10 10 EDCE COc1ccc(Br)c(CN(C)[C@H]2CC(=O)NC2=O)c1O 2236093629 WVQYMMWHMKDABJ-VIFPVBQESA-N 343.177 1.010 10 10 EDCE COc1ccc(Br)c(CN2CCN[C@@H]3COC[C@H]32)c1O 2236043484 LJEAHKRTTJVKOV-VXGBXAGGSA-N 343.221 1.336 10 10 EDCE COc1ccc(Br)c(CN(C)C2[C@@H]3CNC[C@@H]23)c1O 2227749162 BRXMPJSVJVWLQN-RKDXNWHRSA-N 327.222 1.813 10 10 EDCE CC[C@@H](C)NCc1ccc(N2CC(O)(CO)C2)c(Br)c1 2240000871 VLBKBTPZSDJTHB-LLVKDONJSA-N 343.265 1.881 10 10 EDCE CN1C(=O)NC(=O)C(=Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1=O 2297329662 MWFSBCBVVJLBIB-UHFFFAOYSA-N 341.279 1.946 10 10 EDCE O=C1Nc2cc(N3C[C@@H](F)[C@H](F)C3)c(Br)cc2[C@H]1O 2330041188 ASXBZMDKAACEMM-SOCHQFKDSA-N 333.132 1.931 10 10 EDCE COCCn1[nH]c(Br)nc1=NCc1ccccc1O 2353708674 FIVIHXAIUSIBJD-UHFFFAOYSA-N 327.182 1.427 10 10 EDCE NCc1cc(F)c(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2355333841 HDXPFVQBJUVOMP-SPEPIWJRSA-N 345.212 1.367 10 10 EDCE C[C@@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1346767621 FKXVIWNZYCNSDN-CJNGLKHVSA-N 345.443 1.226 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@]2(C)CCNC(=O)C2)cc1C 1275201812 ATTVWDKQODXCKW-IFXJQAMLSA-N 347.459 1.514 10 10 EDCE NC(=O)N[C@@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1 270793097 VRRHTGJIGNBINW-CQSZACIVSA-N 331.420 1.239 10 10 EDCE CN(C)CCN(CCN(C)C)Cc1ccc(N2CCN(C)CC2)cc1 809740956 GYWHRTRBOSYAQP-UHFFFAOYSA-N 347.551 1.364 10 10 EDCE CC(=O)C(=O)COC(=O)c1cccc(C)c1I 808503901 OQMNTKJXFDFGLN-UHFFFAOYSA-N 346.120 1.915 10 10 EDCE CN(C)c1ccc(CN[C@@H]2CCC[C@H]2CNS(C)(=O)=O)cc1 800309210 JKXONBSXVUVNGV-GOEBONIOSA-N 325.478 1.560 10 10 EDCE O=C(NCc1cc(Br)ccc1O)N[C@@H]1[C@H]2COC[C@H]21 807193918 YJBBTUCTRWIRAE-IAZYJMLFSA-N 327.178 1.599 10 10 EDCE CNC(=O)[C@H]1COCCN1c1ccc([C@@H](C)N)c(Br)c1 723181878 RUGAQECICJUCBU-NOZJJQNGSA-N 342.237 1.420 10 10 EDCE Oc1ccccc1CN(C[C@H](O)CN1CCOCC1)C1CCCC1 733613748 JVYPVCFUYYOEOF-GOSISDBHSA-N 334.460 1.830 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)/C=C/Cn1cncn1 911303254 HJNKQQXADKSWCL-VMPITWQZSA-N 344.371 1.132 10 10 EDCE O=C(N[C@]1(c2cc(O)nc(O)c2)C[C@H]1C(=O)O)OCc1ccccc1 1952976960 YCBZDOCFEKPMGZ-SJCJKPOMSA-N 344.323 1.719 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CC[C@@H](Nc3ncccn3)C2)c1O 843416182 ZQWJAWMXBLUREB-GFCCVEGCSA-N 345.359 1.785 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@@H]1CC(=O)N(CC(F)(F)F)C1 928711668 LBGNFHRQAHDDDU-MRVPVSSYSA-N 334.269 1.558 10 10 EDCE CO[C@H](CNC(=O)NCc1ccc2c(c1)CCCN2C)[C@H]1CCOC1 852438995 ARIIEXJJQQNIIX-FUHWJXTLSA-N 347.459 1.920 10 10 EDCE CCc1nn(C)c(CC)c1S(=O)(=O)NCc1c(O)cccc1F 921452321 LOXZNTNHHWKECO-UHFFFAOYSA-N 341.408 1.868 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)Cc2ccc(O)nc2)cc1 855020422 PCUXQHNZKHLPJJ-UHFFFAOYSA-N 329.400 1.933 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](O)c3ccccn3)CC2)cc1F 857464338 CGIVZGSLKPYNMN-KRWDZBQOSA-N 345.374 1.612 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)c2cnc3n2CCOC3)cc1 855020617 TXMHLFSBOJRKSR-UHFFFAOYSA-N 344.415 1.630 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H]2CC[C@H]1[C@H](CO)C2 852775426 UHMFPIGNHDZBLI-LNLFQRSKSA-N 345.487 1.804 10 10 EDCE CN(CCN1CCCS1(=O)=O)Cc1c(O)ccc2ccncc12 751934466 OEBNUNTXHHOONW-UHFFFAOYSA-N 335.429 1.408 10 10 EDCE Cc1cc(Br)cc(CN2CCO[C@@H](CC(N)=O)C2)c1O 862535406 LUTXBVHYIWDPFW-LBPRGKRZSA-N 343.221 1.539 10 10 EDCE C[C@H](NS(=O)(=O)CCCN1CCOCC1)c1ccccc1O 867834533 QFMKRMSGODNZSB-ZDUSSCGKSA-N 328.434 1.095 10 10 EDCE CC[C@](C)(O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 930940505 HLOOFORBBGOJIY-SFHVURJKSA-N 335.448 1.094 10 10 EDCE Cn1nc2c(c1/C=C1/SC(N3CCOCC3)=NC1=O)CCCC2 865215933 AVQMYFNRIZJYAA-GXDHUFHOSA-N 332.429 1.601 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H]3CCC[C@@H]3O)C2)cc1 875678411 AKOKEMVRMAULLA-JQFCIGGWSA-N 333.432 1.734 10 10 EDCE CCn1ncc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)n1 1118805361 YHSMSFAPPDLUBH-UHFFFAOYSA-N 344.419 1.134 10 10 EDCE CCN(Cc1cn(C)nn1)c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 781684369 OOXIUGAJTITJLB-SOFGYWHQSA-N 345.359 1.936 10 10 EDCE CC(C)(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cnc[nH]1 788288079 MMSSNUJIENCEOP-UHFFFAOYSA-N 346.406 1.979 10 10 EDCE COC1=C(C(=O)O)NC(=O)N[C@@H]1c1ccc(N2CCCCC2)cc1 76256710 JPEKQROOQDRXSK-CYBMUJFWSA-N 331.372 1.973 10 10 EDCE O=S1(=O)CC(C2CN(Cc3cccc(Br)c3O)C2)C1 895428312 OWFIPMVLCJXERN-UHFFFAOYSA-N 346.246 1.631 10 10 EDCE C[C@H](OCc1ccccc1)[C@H](NC(=O)c1ccc(O)c(O)c1)C(=O)O 706114684 PMZZHQIMUNOWMR-ZBEGNZNMSA-N 345.351 1.886 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC4(CN(Cc5ccccc5)C4)C3)ccc21 706609674 TXXZFHSWZBDAEV-GOSISDBHSA-N 334.423 1.961 10 10 EDCE COc1cc(NS(=O)(=O)c2ccc3c(c2)OCCO3)ccc1O 797819380 HPMDCZQTGUQZRQ-UHFFFAOYSA-N 337.353 1.973 10 10 EDCE O=S1(=O)C[C@@H]2C(CNCc3ccc(Br)cc3O)[C@H]2C1 2117982285 OUCRAHXGNHJAJA-VXGBXAGGSA-N 346.246 1.535 10 10 EDCE CCC(=O)N1CCN(c2ccc(CN)c(Br)c2)CC1 2126211771 ROGHCJWIRYUMRP-UHFFFAOYSA-N 326.238 1.966 10 10 EDCE Cn1c(C2=C[C@@H](O)[C@@H](N)C2)nc2c(Br)cc(F)cc21 2131466945 VIXIUENYVSTPQB-GXSJLCMTSA-N 326.169 1.950 10 10 EDCE C[C@H]1C[C@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)CCN1C 1348613384 IABAUYUPGWJQQT-GXTWGEPZSA-N 331.416 1.176 10 10 EDCE CO[C@@H]1CC[C@H]1N(C)C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1262270441 WOTGSHGAZYAYFN-DAXOMENPSA-N 333.432 1.566 10 10 EDCE COc1cnc(C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)nc1 1274836691 JSEYKADJPIKGPW-CYBMUJFWSA-N 344.415 1.710 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2cnnn2C)cc1C 1277811135 QHNRMDPBKQPKIO-ZDUSSCGKSA-N 331.420 1.382 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CCC(=O)c1cnn(C)c1 1449119698 KQYJKELALMGXJP-UHFFFAOYSA-N 336.388 1.891 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)CN2CCCC2)cc1C 1715270488 JFTNXJLVPROJSA-OAHLLOKOSA-N 333.476 1.941 10 10 EDCE CN1CCC(=O)Nc2cc(C(=O)NCc3c(O)cccc3O)ccc21 1558534559 UQLZARJEGQEVOS-UHFFFAOYSA-N 341.367 1.806 10 10 EDCE COc1ccc(CNC[C@H]2CN(C(=O)CNC(C)=O)C[C@@H]2C)cc1C 1724569672 JAOANRVARQMYMI-YOEHRIQHSA-N 347.459 1.324 10 10 EDCE CN1CCc2ccc(NC(=O)Cc3ccc(O)c(O)c3)cc2C1=O 1630900183 FQLFDXZJBBVNNI-UHFFFAOYSA-N 326.352 1.907 10 10 EDCE CO[C@H]1O[C@H](CN=[N+]=[N-])[C@@H](OC(=O)c2ccccc2)C[C@H]1NC(C)=O 1848440626 OEPYXGQOCPRRFX-CTASWTNQSA-N 348.359 1.788 10 10 EDCE CC/C=C(/C)C(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1688013421 MKAIUKPDNTVHKY-ZCDQOCIJSA-N 347.415 1.832 10 10 EDCE CCNC(=O)[C@@H](C)NCc1c(Br)ccc(OC)c1O 1964023497 MJKIXHKAVJEZDO-MRVPVSSYSA-N 331.210 1.778 10 10 EDCE COc1ccc(Br)c(CN(C)[C@H]2CCN(C)C2=O)c1O 1964580491 YLKZPGPFVLRTMJ-NSHDSACASA-N 343.221 1.826 10 10 EDCE CN(C)CC1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 382346843 NOKCTFXYHDWCME-CYBMUJFWSA-N 339.237 1.399 10 10 EDCE CNCc1ccc(N2C[C@@H](O)C[C@@]2(C)CO)c(Br)c1 698226792 HLNMWDSUCAHSRT-FZMZJTMJSA-N 329.238 1.491 10 10 EDCE CCNCc1ccc(N2CCOC[C@H](O)C2)c(Br)c1 399952828 VYNNWDGAFXXRLB-GFCCVEGCSA-N 329.238 1.756 10 10 EDCE CS(=O)(=O)c1cnn(Cc2c(O)cccc2F)c1Br 2070221805 BMMNHTWDEFEPAH-UHFFFAOYSA-N 349.181 1.942 10 10 EDCE CN1CCc2cc([C@@H](CN)N3CC(NC(=O)OC(C)(C)C)C3)ccc21 2074411105 OVHGQDJIVZVROL-QGZVFWFLSA-N 346.475 1.888 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3COC[C@]3(CO)C2)c(Br)c1 2234551142 IRKCZCLKKCJTES-IFUGULHKSA-N 341.249 1.914 10 10 EDCE Cc1ccc(CN2CC[C@](C)(O)[C@H](O)C2)c(O)c1Br 2352677631 BJLQERHIVTWSJD-RISCZKNCSA-N 330.222 1.781 10 10 EDCE Cc1ccc(CN(C)C2(C(=O)O)CNC2)c(O)c1Br 2352940693 HEHMXVBUAVLRCK-UHFFFAOYSA-N 329.194 1.322 10 10 EDCE O=C1N=C(S)N(c2ccccc2)C(=O)/C1=C\NCc1ccccn1 103115685 PNVSPGMAEAKWJL-KAMYIIQDSA-N 338.392 1.914 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCN(C)C)CC2)cc1OC 26160102 UVSMZLQEMMOEMC-UHFFFAOYSA-N 336.436 1.097 10 10 EDCE COc1ccc(/C=C2\C(=O)NC(=O)N(C)C2=O)cc1Br 59861414 PGBOGQWPRDDRGB-VMPITWQZSA-N 339.145 1.549 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC(N)=O)C1 435625452 LMZMFYWOSIGNPS-UHFFFAOYSA-N 328.416 1.009 10 10 EDCE CC[S@](=O)c1ccccc1C(=O)N1CCS(=O)(=O)[C@@H](C)C1 265663382 FHTIZKWCWSHKHE-YBTHPKLGSA-N 329.443 1.073 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C)CCCO)cc1F 286565721 XEMOJBCTLLXIDC-UHFFFAOYSA-N 339.411 1.129 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 808501119 HZNZJDNGRCQADG-AWEZNQCLSA-N 329.352 1.230 10 10 EDCE CCOc1ccc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)c(O)c1 809689113 UIZXJNYRFPEEBT-OAHLLOKOSA-N 342.461 1.647 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CC[C@@H]3C)CC2)cc1 805013888 JKLNHGCPSHXVEE-MAUKXSAKSA-N 346.475 1.915 10 10 EDCE COC1CCN(c2ccc(CN3CC(=O)N(C)[C@@H](C)C3)cc2)CC1 295441147 VOISCWRXDOXTRH-HNNXBMFYSA-N 331.460 1.964 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](C)c1ccnn1C 819699393 DAWYLEKOYOVVFB-ZDUSSCGKSA-N 345.399 1.821 10 10 EDCE CCOc1ccc(O)c(CN2CCS(=O)(=O)[C@@H]3CCC[C@@H]32)c1 825202670 SWBWBWUMOUZLRM-GOEBONIOSA-N 325.430 1.942 10 10 EDCE Cc1ccc(=O)n([C@@H]2COC[C@@H]2NCc2ccc3c(c2)CCO3)n1 585626445 PQJDLWDQDDNMNN-JKSUJKDBSA-N 327.384 1.216 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C1[C@H]2CNC[C@H]12 1952692367 QITSEUXMPMTVLC-RWMBFGLXSA-N 334.416 1.999 10 10 EDCE CC(C)(C)NS(=O)(=O)CC(=O)NCc1cc(Cl)ccc1O 846472333 IDGRXEVXWAJHQC-UHFFFAOYSA-N 334.825 1.380 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)N2CC(O)(C(N)=O)C2)c1C 913075714 FPNDFQSJXUQAFN-UHFFFAOYSA-N 327.384 1.075 10 10 EDCE COc1ccc(N(C)CC(=O)NC[C@H]2CN(CC(C)C)CCO2)cc1 844353506 QJAHYHQVEJFFPJ-SFHVURJKSA-N 349.475 1.604 10 10 EDCE Cc1nn(C)c(S(=O)(=O)NCc2ccccc2O)c1C(F)F 841491942 GWNXMIORGKIRDD-UHFFFAOYSA-N 331.344 1.850 10 10 EDCE COC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NCCc2ccc(N)cc2)C1 841881021 MQZFFEORBSRIDQ-DZGCQCFKSA-N 348.447 1.977 10 10 EDCE CCN(CC)c1ccc(CN2CCN(CCN(C)C)C(=O)C2)cc1 846011125 LNQMQTQNARTESC-UHFFFAOYSA-N 332.492 1.739 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C3CN(CC(F)F)C3)C2)cc1 855223168 CCPJPTPGJRNEIK-CYBMUJFWSA-N 339.386 1.587 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4COC[C@]4(C)C3)nc12 852534404 LVKSRASHFJAXJA-DIFFPNOSSA-N 346.387 1.080 10 10 EDCE C[C@]12COC[C@@H]1CN(C(=O)NCc1ccc(N3CCOCC3)cc1)C2 852005361 SSCKVKXXYJBYGV-LPHOPBHVSA-N 345.443 1.701 10 10 EDCE COC(=O)[C@@]1(OC)CCN(Cc2cc(F)c(N(C)C)cc2F)C1 862475228 DCNMRWDMMMDMCN-MRXNPFEDSA-N 328.359 1.795 10 10 EDCE CO[C@H](C)c1noc(CN(C)Cc2cc3c(cc2O)OC[C@@H]3O)n1 768463663 LCYXLCWUTVWQOT-RNCFNFMXSA-N 335.360 1.540 10 10 EDCE CCC1(CC)CN(C(=O)c2ccc(C)c(O)c2O)CCS1(=O)=O 779361227 QICYDCPAQULMKU-UHFFFAOYSA-N 341.429 1.836 10 10 EDCE C[C@H](O)CNCC(C)(C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1275750637 JXHRJZVNSQTSMH-LBPRGKRZSA-N 349.435 1.918 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1c([N+](=O)[O-])cnc1C 1449117065 GGQWMCLXNCQZCO-UHFFFAOYSA-N 339.348 1.607 10 10 EDCE Cc1c(C(=O)NCc2c(O)cccc2O)cnn1C1CCOCC1 1456234924 KCUULADDBMGZHJ-UHFFFAOYSA-N 331.372 1.884 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](O)C[C@@H]2CO)cc1Br 2136081165 BBTBFOBAGBKRHJ-MVWJERBFSA-N 330.222 1.824 10 10 EDCE COc1ccc(CN[C@@H]2CCN(C(=O)CCNC(N)=O)[C@H]2C)cc1C 1700826647 RHHFWNUTWYCGOJ-DZGCQCFKSA-N 348.447 1.141 10 10 EDCE CN1CC(=O)Nc2cc(C(=O)NCc3cccc(Cl)c3O)cnc21 1640404956 JCUKLIHNVUREFZ-UHFFFAOYSA-N 346.774 1.759 10 10 EDCE COc1cccc(C(=O)NCC(=O)NCc2c(O)cccc2O)c1 1645360968 QXCRINLVMDCEIA-UHFFFAOYSA-N 330.340 1.153 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC1CCN([C@H]2CCOC2=O)CC1 1597147906 KTTUXYGWINNWHM-XBPVQUQDSA-N 346.383 1.007 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)c2cncnc2O)cc1C 1674681629 UBUOCEKMDLTXNN-OLZOCXBDSA-N 344.415 1.796 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2cn(C)cn2)cc1C 1676331725 YLCDUUWKPVQPML-AWEZNQCLSA-N 330.432 1.987 10 10 EDCE COc1ccc(-c2oc3c(O)c(O)c(O)c(O)c3c(=O)c2O)cc1 14437211 CFCHRLUZDGKQII-UHFFFAOYSA-N 332.264 1.997 10 10 EDCE biogenic,in-vitro COc1ccc([C@@H](CNC(=O)c2cc(O)c(O)c(O)c2)N(C)C)cc1 1865876042 OKCSLBOIPIZLQC-CQSZACIVSA-N 346.383 1.845 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CCNCc2ccc(O)c(O)c2)C1 1940383736 UXAJCDSIEYLMMR-UHFFFAOYSA-N 338.404 1.559 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](OCC(N)=O)C2)cc1Br 2145374766 GVJAQKFIMKPNIJ-MWLCHTKSSA-N 342.237 1.549 10 10 EDCE CONC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1984750354 FAVAGCPLWFSFQP-JTQLQIEISA-N 326.349 1.211 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010393339 QYZNBINZIDTOOR-NEPJUHHUSA-N 341.412 1.811 10 10 EDCE COC[C@H](NCc1cc(Cl)cc(Br)c1O)C(N)=O 2034954179 UNHGFCXIAFJEOW-VIFPVBQESA-N 337.601 1.398 10 10 EDCE NCc1ccc(N2CC(N3CCOCC3)C2)c(F)c1Br 2169499716 GGLIEAWAWYYUPS-UHFFFAOYSA-N 344.228 1.568 10 10 EDCE C[C@H]1[C@@H](C)S(=O)(=O)CCN1c1ccc(CN)c(Br)c1 2113894933 QNXLLFZVBCUDST-VHSXEESVSA-N 347.278 1.920 10 10 EDCE CC(C)(C)OC(=O)NCC1CCC(COc2nnc(=N)[nH]n2)CC1 2213788303 WAHTXIMCAPUWKX-UHFFFAOYSA-N 338.412 1.389 10 10 EDCE CN(c1ccc(CO)cc1Br)[C@@H]1COC2(COC2)C1 2270775519 PZOVDDRFAKHRDY-NSHDSACASA-N 328.206 1.936 10 10 EDCE NCc1ccc(N2C[C@H]3OCCC[C@@]3(CO)C2)cc1Br 2238821275 UMIUNVITLKOIGB-CABCVRRESA-N 341.249 1.886 10 10 EDCE COCCN(C[C@@H](C)O)c1ccc(CN)c(Br)c1F 2272409458 SSIAYQVWZPJIJH-SECBINFHSA-N 335.217 1.881 10 10 EDCE Nc1ccc(OCCNC(=O)c2nccnc2Br)cc1 2283060637 RHJGIYYQPSXECR-UHFFFAOYSA-N 337.177 1.630 10 10 EDCE COc1ccc(CN2C(=O)NC(=O)C(=Cc3ccco3)C2=O)cc1 2296740356 YWBQLJPBFAEUSW-UHFFFAOYSA-N 326.308 1.950 10 10 EDCE CCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C)C1=O 2314414996 UAOHEIYXEAYFOC-UHFFFAOYSA-N 346.437 1.957 10 10 EDCE Cc1ccc(CN2CCNC[C@@H]2C(=O)O)c(O)c1Br 2352690561 BXYJRBQTKMDDSH-SNVBAGLBSA-N 329.194 1.322 10 10 EDCE Cn1ccnc1CN1CCN(Cc2cc3c(cc2O)OCO3)CC1 106063732 INAGYYMPMBPYCX-UHFFFAOYSA-N 330.388 1.172 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)NCC1CCN(CCO)CC1 111869572 SIRXCCHXSKMFTE-UHFFFAOYSA-N 348.491 1.598 10 10 EDCE CC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 55523199 FDNIDITVUGGAMK-KRWDZBQOSA-N 349.406 1.289 10 10 EDCE COc1cccc(OCC(=O)NC2=NN(c3ccccc3)C(=O)C2)c1 21024388 YIXKMSASFCKUFK-UHFFFAOYSA-N 339.351 1.941 10 10 EDCE C[C@@H]1CN2CCC[C@@H]2CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 172081276 YITMKBHHDYHNPC-VQIMIIECSA-N 344.503 1.880 10 10 EDCE Cn1cc(N2CCN(Cc3cc4c(cc3O)CCC4)CC2=O)cn1 176176714 VORLHECZYMGPPT-UHFFFAOYSA-N 326.400 1.463 10 10 EDCE CCN(CC)[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 301706374 VPHRLSXXICDSDT-NSHDSACASA-N 334.376 1.846 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2nnn(C)c2c1 186417454 YYPBMHMFMBKOAS-JTQLQIEISA-N 326.356 1.741 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)N1CCN2CCC1CC2 188844718 STUUNHIZRVKJIL-ZZXKWVIFSA-N 341.455 1.843 10 10 EDCE C[C@H](NC[C@]1(CO)COCC2(CCC2)N1C)c1cc(F)ccc1O 527954923 NABOOSJHOHGGOK-UGSOOPFHSA-N 338.423 1.798 10 10 EDCE COc1ccc(N2CCN(C(=O)COc3cccnc3)CC2)cc1 263740996 AEAVMEAVASZNQC-UHFFFAOYSA-N 327.384 1.818 10 10 EDCE O=C(Nc1nccs1)[C@@H]1CCCN1C(=O)c1cccc(O)c1O 364390083 OYMJACAAZRTDPN-JTQLQIEISA-N 333.369 1.798 10 10 EDCE CCn1nc(C)c(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)c1C 274879173 CFZPCTZDBZIXBS-UHFFFAOYSA-N 339.373 1.724 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CN1CCOCC1=O 280157459 SBBUIEXWMVWEKK-UHFFFAOYSA-N 345.443 1.494 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC[C@H]1CCOC1 807098621 ZXGCKXOAKAMGBI-AWEZNQCLSA-N 333.432 1.220 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CCNC[C@H]3C)C2)cc1 818654630 DACKZHLGTXZAGC-IIDMSEBBSA-N 346.475 1.819 10 10 EDCE CNC(=O)N1CCN(c2ccc(CN)cc2Br)CC1 721791086 YJQMRMQTMCUYFE-UHFFFAOYSA-N 327.226 1.369 10 10 EDCE C[C@@H](NC[C@]1(CO)COCCN1C)c1cccc(C(F)(F)F)c1O 903281550 YHNXCJAGMUIVAQ-ABAIWWIYSA-N 348.365 1.755 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N2CC=CC2)cc1)c1nnc(O)n1C 919909766 YFOCRNDOWMHTGN-GFCCVEGCSA-N 342.403 1.457 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@H]1C[C@@H]2COC[C@@H]2O1 919080343 ACVOFWBQMWSLJX-OIISXLGYSA-N 333.432 1.664 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)O[C@H](C)C(=O)O)C2)cc1 849183429 RAVYZWCNXAGAQE-UPJWGTAASA-N 336.388 1.268 10 10 EDCE CCC(=O)N[C@@H](CCSC)C(=O)NCc1c(O)cccc1F 928712863 ZPBDHBATQTZQOG-LBPRGKRZSA-N 328.409 1.795 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@]3(O)CCO[C@@H]3C)C2)cc1 854298342 AVILWHCOHLBKOY-GLJUWKHASA-N 349.431 1.113 10 10 EDCE C[C@@H](CN(C)CCCN(C)C)NC(=O)NCc1c(O)cccc1F 923201372 NQECUEFIIXIPSB-ZDUSSCGKSA-N 340.443 1.603 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc4nn[nH]c4n3)C2)cc1 855225535 KHPSXUSDXOOWGM-LLVKDONJSA-N 338.371 1.370 10 10 EDCE CO[C@@H](CNC(=O)NCc1ccc(N(C)C)cc1C)[C@@H]1CCOC1 852441055 XISOBWMTVPYNME-WBVHZDCISA-N 335.448 1.912 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cncc(OC)n3)C2)cc1 855225396 MRZHIHAWDSSQKT-GFCCVEGCSA-N 328.372 1.503 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@]3(C)CCC(=O)NC3)C2)cc1 855227469 ZFTWQEVRKOIQOY-ACJLOTCBSA-N 331.416 1.306 10 10 EDCE Cc1cc(C2(C(=O)NCc3ccc(O)c(O)c3)CCOCC2)on1 860243287 JIGIDAMMRFAQHG-UHFFFAOYSA-N 332.356 1.759 10 10 EDCE CCOc1ccc(CN2CCN(Cc3nccn3C)CC2)c(O)c1 769334724 QBJIKPQGIGIUFC-UHFFFAOYSA-N 330.432 1.842 10 10 EDCE COc1ccc(O)c([C@@H](C)N[C@H](C)C(=O)N(C)CC(=O)NC2CC2)c1 775369797 QWONHPMBSGKMIN-VXGBXAGGSA-N 349.431 1.177 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](C)[C@@H](F)C3)nc12 778237463 PRRDZEDMPBIBLC-MFKMUULPSA-N 336.367 1.792 10 10 EDCE CCc1nc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)no1 775378433 WKLTXDOLBIZQMN-LBPRGKRZSA-N 330.388 1.960 10 10 EDCE C[C@@H](CN[C@H](C)c1ccc(N2CCOCC2)cc1)CS(C)(=O)=O 775259042 MVUDLDOJTSWPDA-LSDHHAIUSA-N 340.489 1.855 10 10 EDCE C[C@H](NCc1c(O)cccc1Br)[C@H]1CN(C)CCN1C 1462587051 DRWBLPZQQMHEMA-SMDDNHRTSA-N 342.281 1.879 10 10 EDCE CS(=O)(=O)c1cccnc1CNC(=O)/C=C/c1ccc(O)c(O)c1 787713117 QODQIYBMYUWNBI-FNORWQNLSA-N 348.380 1.226 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@]12CCCN(CC1)C2 895784866 FNNDAQGYOHNOHD-IBGZPJMESA-N 347.434 1.764 10 10 EDCE O=C(NCCC1CS(=O)(=O)C1)NCc1ccc(N2CC=CC2)cc1 786777666 MRLLSSNRZZIYDT-UHFFFAOYSA-N 349.456 1.297 10 10 EDCE COc1cc(Cl)cc([C@@H]2NC(=O)NC(C(=O)O)=C2Cl)c1O 76256678 OWXHSIBPBPLADH-QMMMGPOBSA-N 333.127 1.943 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@]12CCCN(CC1)C2 895494703 IQMBBMYLQAHZOX-FQEVSTJZSA-N 343.471 1.968 10 10 EDCE COCc1nc([C@@H]2COCCN2C(=O)c2cc(O)cs2)no1 780751081 RWLKOOPXLICMSJ-VIFPVBQESA-N 325.346 1.197 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCC(OCCO)CC1 897230406 GSTMDYACIVNRSD-UHFFFAOYSA-N 337.397 1.926 10 10 EDCE CS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCC2)cc1Cl 795289617 FISQGIKQUGRFOS-UHFFFAOYSA-N 339.826 1.074 10 10 EDCE O=C1Nc2cc(N3CC[C@](F)(CO)C3)c(Br)cc2[C@@H]1O 1917136831 WTDMJMNLQXYJHT-WCQYABFASA-N 345.168 1.345 10 10 EDCE Cc1ccc(O)c(CNC(=O)CNc2ccc(S(C)(=O)=O)cc2)c1 1167294124 ZRTOYQORHGTLIP-UHFFFAOYSA-N 348.424 1.832 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2126154402 CSZXIXDJKICSJB-DHPDLVEQSA-N 327.222 1.086 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CCOC1(C)C 1329206688 DXUFGXJYXMISCB-HNNXBMFYSA-N 347.459 1.642 10 10 EDCE CN1CCN(c2ccc(CN3C[C@H](O)CC(F)(F)C3)cc2F)CC1 1320642600 BNFVTTNBDSPFEK-CQSZACIVSA-N 343.393 1.779 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@H](C)C3CC3)C2)cc1 1327972654 BLZCCIZXBYZQHR-HIFRSBDPSA-N 345.443 1.552 10 10 EDCE O=C(C(=O)N1CC(CC(F)(F)F)C1)N1Cc2cccc(O)c2C1 1332057409 UWYRRFGCEBCUPK-UHFFFAOYSA-N 328.290 1.645 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@@H]2CN(C(C)=O)CCO2)cc1 1332949199 TWAGNJOJPWLDEX-KRWDZBQOSA-N 333.432 1.396 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c[nH]nc1CC 1338287544 KSHSEPYYMCYZLF-ZDUSSCGKSA-N 347.371 1.288 10 10 EDCE C[C@H](O)C(C)(C)CNC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1347847320 ZIPDUZNEKDQHDY-HNNXBMFYSA-N 348.491 1.645 10 10 EDCE CC(C)(F)C(=O)NC[C@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1505587514 YRNMCJZEMWVTJU-GFCCVEGCSA-N 349.366 1.928 10 10 EDCE [N-]=[N+]=NC1CN(C(=O)CNC(=O)c2ccc(Br)o2)C1 1912207896 ZBRHTPQJZKFCHV-UHFFFAOYSA-N 328.126 1.293 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1cn(-c2cccnc2)nn1 1360075371 AAOWQLLMSYREJJ-UHFFFAOYSA-N 336.399 1.967 10 10 EDCE Nc1ccc(OC[C@@H](O)CN(CCCO)Cc2ccccc2)cc1 1914619886 DOZVGEMSCKLQKU-SFHVURJKSA-N 330.428 1.893 10 10 EDCE CCO[C@@H](C)C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1295590387 HDCUXRFRDAKOKV-JTQLQIEISA-N 329.780 1.972 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1cnc2nc(O)nc(O)c2c1 1452948760 YYAYYIIWLQNFQG-UHFFFAOYSA-N 346.730 1.725 10 10 EDCE COc1cccc(CNC(=O)[C@H]2CNC(=O)c3ccccc32)c1O 1294924443 DWDBOAARQKEJFN-AWEZNQCLSA-N 326.352 1.544 10 10 EDCE C[C@@H](NC(=O)CCCCCCS(N)(=O)=O)c1ccccc1O 1471195837 NIWMLKPCCZCYHC-GFCCVEGCSA-N 328.434 1.808 10 10 EDCE CC1=C(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)Cn2nnnc2N1C 1616834362 DUBSRZBRQHBCNA-LLVKDONJSA-N 341.419 1.340 10 10 EDCE CN(CC(C)(C)O)c1cc2c(cc1Br)[C@H](N)C(=O)N2 118619021 XMDOEXFUMDIHPP-NSHDSACASA-N 328.210 1.608 10 10 EDCE C[C@H](O)CNCCC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1485752459 WKBVSLVFZDVRLN-RYUDHWBXSA-N 335.408 1.718 10 10 EDCE O=C(CNC(=O)c1c(F)ccc(O)c1O)Nc1ccc(F)c(F)c1 1558907983 RCXJVGLFPDGNCO-UHFFFAOYSA-N 340.257 1.884 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)Cc2ccco2)cc1 1720146146 GZYGQLGKHSVDKQ-UHFFFAOYSA-N 343.343 1.531 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@H](C)NC(C)=O)C2CC2)cc1C 1569293953 KYQZMSLCAGFRSP-SUMWQHHRSA-N 347.459 1.513 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2ncn(C)n2)C2CC2)cc1C 1731391403 MFVIVDLJFZHTFI-HNNXBMFYSA-N 343.431 1.430 10 10 EDCE Cn1cc([C@H]2CCCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)nn1 1640447727 DFZKXCVKDKAXRQ-VGVVRCBHSA-N 328.372 1.646 10 10 EDCE O=C1CC[C@@](C(=O)NCc2c(O)cccc2O)(c2ccccc2)CN1 1597574808 TUJMAROEAGDZKG-IBGZPJMESA-N 340.379 1.562 10 10 EDCE NS(=O)(=O)c1cccc(CNCc2cccc(Cl)c2O)c1 165019509 REBKPADQNRMKEY-UHFFFAOYSA-N 326.805 1.983 10 10 EDCE Cn1nnc(CNC(=O)OC(C)(C)C)c1[C@@H](N)c1ccccc1O 1945005336 ZMOGTURRYVJEGN-ZDUSSCGKSA-N 333.392 1.594 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@H](CC(=O)NCCN=[N+]=[N-])C1 1965101639 GCNYESHBGVPADV-QWRGUYRKSA-N 327.385 1.875 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)cc1Br 2149908168 QMAGTSUZZBIECF-IJLUTSLNSA-N 344.249 1.930 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccccc1O 2010263746 ZONVLXQXLOTCQF-SMDDNHRTSA-N 338.404 1.625 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2010403257 BLFWICGNYLPVSO-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE O=C(O)C[C@]1(O)CCN(Cc2cc(Br)cc(F)c2O)C1 2160859227 JTWJFZZPPXOCJO-CYBMUJFWSA-N 348.168 1.705 10 10 EDCE Cn1ncc(C(=O)N2CC[C@H](N=[N+]=[N-])C2)c1CNC(=O)OC(C)(C)C 2060609200 SALUYEZTWOLZHQ-JTQLQIEISA-N 349.395 1.970 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@@H](O)C2)cc1Br 2105075571 UDDOZJZUTQXTER-BETUJISGSA-N 329.238 1.491 10 10 EDCE CN[C@@H](c1ccccc1O)[C@H](O)c1c(Br)nnn1C 2091867682 NOGCCNHLYGYYIN-ONGXEEELSA-N 327.182 1.277 10 10 EDCE CN1CCO[C@@H]2CN(c3ccc(CO)c(Br)c3)C[C@H]21 2097692159 GCOKLWBKERVYSZ-ZIAGYGMSSA-N 327.222 1.461 10 10 EDCE CCN(CC)c1ccc(NC=C2C(=O)NC(=S)N(C)C2=O)cc1 2296924081 RQZNHCVBMFZFFX-UHFFFAOYSA-N 332.429 1.702 10 10 EDCE COc1ccccc1N1C(=O)NC(=O)C(=CNN2CCCCC2)C1=O 2296936451 SXLKGOSZDFLCTL-UHFFFAOYSA-N 344.371 1.152 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2303240232 IQSUFQTYBZYMQZ-RYUDHWBXSA-N 341.412 1.954 10 10 EDCE CCN(CC)c1ccc(C=c2sc3nc(COC)nn3c2=O)cc1 2326211825 NHRMGBPBLJRFKA-UHFFFAOYSA-N 344.440 1.691 10 10 EDCE Cc1ccc(CNC(=O)c2c[nH]c(=N)o2)c(O)c1Br 2352641206 RCCIALCQYJGNKR-UHFFFAOYSA-N 326.150 1.794 10 10 EDCE COc1ccc(N2CCCN(CC(=O)NCCCN(C)C)CC2)cc1 178983794 QKDOKOZVOZUPFL-UHFFFAOYSA-N 348.491 1.275 10 10 EDCE COCCS(=O)(=O)NC(=O)c1cc(C)n(-c2ccccc2)c1C 111994067 RZWYVZSPCYGVAN-UHFFFAOYSA-N 336.413 1.800 10 10 EDCE COc1ccc(N2CCN([C@@H](C)C(=O)N3CCOCC3)CC2)cc1 34684273 ZKVOLQBWOLDRHC-HNNXBMFYSA-N 333.432 1.065 10 10 EDCE O=C(O)[C@H]1CC[C@@H](c2cccc(I)c2O)N1 309568334 UUBFAEOXZXWLCB-DTWKUNHWSA-N 333.125 1.875 10 10 EDCE CN1CCCc2cc(CNC(=O)NCCCn3ccnn3)ccc21 183570949 YINFKNGNMMVCDP-UHFFFAOYSA-N 328.420 1.550 10 10 EDCE CO[C@H](c1ccc(O)c(O)c1)[C@@H](NC(=O)OC(C)(C)C)C(=O)O 1952306012 HBJSJMIUJDXDSS-VXGBXAGGSA-N 327.333 1.763 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1NCCC1=O 1952208798 NFCJTRNBZFIWTE-NHYWBVRUSA-N 336.388 1.465 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1COCCN1CC(F)(F)F 287847748 DECGBMFHUNLAPT-NSHDSACASA-N 348.321 1.020 10 10 EDCE COc1ccc(CN[C@H]2CCC[C@H]2CNS(C)(=O)=O)cc1C 800309024 BMQRZONZTZPNNF-GJZGRUSLSA-N 326.462 1.811 10 10 EDCE COC(=O)[C@@H]1CC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 824711824 HJUZQJDXDQDWJE-DLBZAZTESA-N 346.427 1.463 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3COC(C)(C)C3)ccc21 827580040 ORKMKKWBSXZZHZ-HNNXBMFYSA-N 345.443 1.369 10 10 EDCE C/C=C/[C@@H](O)C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 901327615 QSLDPFBGUBUJFH-ITDFMYJTSA-N 327.764 1.484 10 10 EDCE COc1cc(Cl)cc(CNC[C@H]2CCCCN2CCO)c1O 824584273 ZWWBOMIWOWVVQU-CQSZACIVSA-N 328.840 1.991 10 10 EDCE COc1ccc(N2CC[C@@H](N[C@@H](Cc3ccccc3)C(N)=O)C2)cc1 849321715 KTWRRMHEGJLMSP-APWZRJJASA-N 339.439 1.960 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(C)(C(=O)O)CC1 842938479 KCYROCPCKDALMI-UHFFFAOYSA-N 347.459 1.898 10 10 EDCE CCOC(=O)[C@H](F)[C@@H]1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 912250410 AKJKFLGWIZAWDI-XYMBJPKESA-N 337.347 1.861 10 10 EDCE CCN1CC[C@H]2OCCN(Cc3cc4c(cc3O)OC[C@H]4O)[C@H]2C1 840083043 CQGGUZQOARGUIV-USXIJHARSA-N 334.416 1.113 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)NCC(C)(C)CS(C)(=O)=O)c1 926953165 JTQKWQVGDDKIOZ-LLVKDONJSA-N 343.445 1.900 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1C[C@H](C)N(CCO)C[C@H]1C 842181471 YGRVRCXWTWYBGS-JKSUJKDBSA-N 348.491 1.658 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc(C=O)cn3)CC2)cc1 929250291 PGOUSNQBJMGJNF-UHFFFAOYSA-N 325.368 1.865 10 10 EDCE CN1CC(CN(C)C(=O)NCc2ccc(N3CCSCC3)cc2)C1 851991586 RMCUNVYHFWWSHX-UHFFFAOYSA-N 348.516 1.943 10 10 EDCE CSC[C@@H]1NC(=O)N([C@@H](C)c2ccc(N3CCOCC3)cc2)C1=O 924533877 NKEBLTKOORBOOQ-WFASDCNBSA-N 349.456 1.868 10 10 EDCE C[C@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1cc(F)ccc1O 858489026 QESVOUWYZTXGTJ-AAEUAGOBSA-N 342.378 1.899 10 10 EDCE C[C@H](CO)[C@@H](C)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 853776559 RMEYXXMQCQERGF-ZIAGYGMSSA-N 335.448 1.464 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1 751316793 BETQYKJZBQXUQH-UTUOFQBUSA-N 344.433 1.405 10 10 EDCE NC(=O)[C@H]1CCC[C@@H](C(=O)NCc2ccc3cccnc3c2O)C1 862026012 FCIJTDXRNRPRAO-QWHCGFSZSA-N 327.384 1.848 10 10 EDCE O=C([C@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1)N1CCCC1 768447380 OQUFLGWLKKJRHV-GUYCJALGSA-N 346.427 1.652 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)COCC(F)F 862039758 NVNMYBBFSDENGL-UHFFFAOYSA-N 331.315 1.566 10 10 EDCE COC(=O)CCc1nnc(NC(=O)/C=C\c2ccc(O)c(O)c2)s1 779518197 JSCUNAYNPPDQPC-HYXAFXHYSA-N 349.368 1.707 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](CO)[C@H](CO)C2)c(Br)c1 704786546 WQTBFEHYTRQKDG-WXHSDQCUSA-N 343.265 1.767 10 10 EDCE CN1C(=O)CN(C(=O)Cc2ccc(O)c(O)c2)Cc2ccccc21 1147755778 XOJARNQNMQBPPH-UHFFFAOYSA-N 326.352 1.646 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2ccns2)c1 1153443522 LXKJFQMFAILLPR-UHFFFAOYSA-N 341.414 1.193 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N(C)CCO)c(Br)cc21 92775313 BYOALFUPVNPEPU-LBPRGKRZSA-N 328.210 1.480 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1[C@H]2CC[C@H]1CC(CCO)C2 1329490695 CLJHGMNJTPTASD-HOTGVXAUSA-N 346.427 1.503 10 10 EDCE Oc1cccc(Br)c1CN[C@@]12CC[C@@H](C1)[C@H](O)[C@H]2O 2120393812 HELKHUPRAWSIAM-IOEYQFCTSA-N 328.206 1.519 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC3CC(C)(C)C3)C2)cc1 1328321089 IVAIUPRFERHKPD-ZDUSSCGKSA-N 345.443 1.695 10 10 EDCE NCc1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)cc1Br 2121593451 QFNICTKGCUYCAN-JKOKRWQUSA-N 327.222 1.351 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)cc1Br 2126157190 QBLXSVLPFQEYGK-DJBIQUGXSA-N 328.206 1.119 10 10 EDCE C[C@@H](O)C[C@@H]1COCCN1c1ccc(CN)cc1Br 2128868268 VMGQKCRRPSCIGJ-ZYHUDNBSSA-N 329.238 1.884 10 10 EDCE CC[C@@H](NC(=O)C(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCCOC1 1334671317 SOPRIZRKBDLDPN-UKRRQHHQSA-N 332.400 1.556 10 10 EDCE C[C@H](CO)[C@H]1CCCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1351929027 FPQLCHBJQSPTTN-IUODEOHRSA-N 332.400 1.244 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@H](C)NC(=O)C(C)(C)C)cc1 1275417709 PTUOVSXWBYUJQH-LBPRGKRZSA-N 346.435 1.311 10 10 EDCE C[C@H]1C[C@@H]1C(=O)NCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1285952879 ORVLKUVYTPLFMA-GWCFXTLKSA-N 343.387 1.884 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1Cc2cnccc2NC1=O 1455338529 INIDHPRYCVOHOF-QDOCKXBDSA-N 325.324 1.186 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)NCc1c(O)cccc1F 1456026636 BQKXVYSETCJETK-JTQLQIEISA-N 342.367 1.423 10 10 EDCE Cc1nn(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c2ncccc12 1611431072 JQFZGADVBHRYBH-LLVKDONJSA-N 340.383 1.898 10 10 EDCE CC(C)N1CCC(CO)(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1700342238 LCWWYJUGBPWVJG-UHFFFAOYSA-N 347.419 1.814 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(OC)ncn1 1557115418 YTZMMLBOPDSEND-UHFFFAOYSA-N 345.355 1.396 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H](Cn3ccnn3)C2)cc1 1636871787 WKCYWQRFVCCQCM-LBPRGKRZSA-N 341.375 1.993 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@H](OCCN2CCCC2)C1 1566316868 LQRFORNEDIFRET-HNNXBMFYSA-N 334.416 1.354 10 10 EDCE C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@]2(CCOC2)O1 1634917493 LKGGIUMIRMGDRL-BZNIZROVSA-N 332.360 1.869 10 10 EDCE O=C1C[C@](C(=O)NCc2c(O)cccc2F)(c2ccccc2)CN1 1635367102 ZAOXREVDPHRFME-GOSISDBHSA-N 328.343 1.605 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(-n2ccnc2)nn1 1568736021 RPYTUMACDGAFHP-UHFFFAOYSA-N 344.371 1.784 10 10 EDCE NS(=O)(=O)c1cc(C(=O)NCc2cccc(Cl)c2O)co1 1648606174 KBEMJFFFZBRHPX-UHFFFAOYSA-N 330.749 1.216 10 10 EDCE CC(C)(C)OC(=O)N1CCC(N(CCN=[N+]=[N-])CC(N)=O)CC1 1982240158 BAMDYJCYWMCTRY-UHFFFAOYSA-N 326.401 1.484 10 10 EDCE CC(C)(C)OC(=O)NCCOCCC(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985100915 KYWGOEMCRVPWMF-LLVKDONJSA-N 327.385 1.829 10 10 EDCE CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CC1 2011933786 LTGABVNNINEPGW-NSHDSACASA-N 339.396 1.660 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@]3(CNC(=O)N3)C2)c(Br)c1 2177669317 VBOMLNKCNMXGHL-XPTSAGLGSA-N 340.221 1.764 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)c(Br)c1 2173356262 BVUPWACLWUUMEU-WBGBGRJVSA-N 342.233 1.823 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCN(C)[C@@H](C(C)(C)C)C3)c2n1 2062887393 ISBUNTAKJAVXTP-CYBMUJFWSA-N 331.420 1.546 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)cc1Br 2182558066 AQYLSLHUOHQBAB-RWDPWNMBSA-N 342.233 1.680 10 10 EDCE CC(C)(C)OC(=O)N[C@@]12C[C@H]1CN(C(=O)COc1ccc(N)cc1)C2 2044622166 ZHHBBBOGHUAKHD-KPZWWZAWSA-N 347.415 1.773 10 10 EDCE O=C1Nc2cc(N3CC[C@]4(O)C[C@H]4C3)c(Br)cc2[C@H]1O 2279953277 WNVXMKWXKKRIOM-DSBAHLMNSA-N 339.189 1.396 10 10 EDCE CC[C@H](C(N)=S)S(=O)(=O)NCc1cnc(SC)s1 2257134075 WZGMPCVDZMOKAK-SSDOTTSWSA-N 325.506 1.349 10 10 EDCE COc1ccccc1NC=C1C(=O)N(c2ccc3nncn3n2)N=C1C 2296891654 VBFHGVQHILYKIE-UHFFFAOYSA-N 349.354 1.851 10 10 EDCE CC1=NN(c2ccc3nncn3n2)C(=O)C1=CNc1ccccc1F 2296902349 GOUNGSBPLPJPNR-UHFFFAOYSA-N 337.318 1.982 10 10 EDCE CC(C)(C)OC(=O)NC[C@]12C[C@H](C1)[C@@H](C(=O)NCCN=[N+]=[N-])CO2 2303352660 MQSMISBASWEBFI-ZIBATOQPSA-N 339.396 1.733 10 10 EDCE NCc1ccc(N2C[C@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2314952956 FWYKEPXRBMAEIY-CABZTGNLSA-N 331.235 1.141 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)[C@@H](O)[C@H]2CF)cc1Br 2333237782 RHQVGWUBMMLDSR-LDICSKNTSA-N 333.201 1.349 10 10 EDCE CN1C(=O)C(=Cc2ccc(N3CCC(Cl)=N3)cc2)C(=O)N(C)C1=O 59862412 RYFSZJCUGWSSDD-UHFFFAOYSA-N 346.774 1.883 10 10 EDCE CCc1nc2n(n1)C[C@@H](NC(=O)NCc1ccc(N(C)C)cc1)CC2 114875425 PBRYFUOIQOFMDX-AWEZNQCLSA-N 342.447 1.721 10 10 EDCE CN(Cc1ccccc1O)C(=O)NC[C@@H](c1cnn(C)c1)N(C)C 118087448 CENTZGWTOCANBP-HNNXBMFYSA-N 331.420 1.570 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@H](C)NC(C)=O)cc1C 1270348119 OEXCLPUARQZPKT-OCCSQVGLSA-N 335.448 1.370 10 10 EDCE CC[C@H](C)[C@@H](NC(N)=O)C(=O)N1CCN(c2ccc(OC)cc2)CC1 70719015 ADEZDWWAPUGKIT-XJKSGUPXSA-N 348.447 1.427 10 10 EDCE COc1ccc(N=N[C@H]2C(=O)NN=C2C2CCN(C(C)=O)CC2)cc1 254834020 QMTIUIILVXEZJB-MRXNPFEDSA-N 343.387 1.892 10 10 EDCE CN[C@@H](c1ccc2c(c1)CCN2C)c1nn(C)nc1Br 2167746828 FTIVLZPGPRVFGS-LBPRGKRZSA-N 336.237 1.879 10 10 EDCE C[C@@H](NC(=O)C(=O)N1CCN(C2CC2)CC1)c1ccc(N(C)C)cc1 807672976 KVOHKRYBPRDYNE-CQSZACIVSA-N 344.459 1.236 10 10 EDCE COc1cccc([C@@H](C)NC[C@@]2(OC)CCS(=O)(=O)C2)c1O 903362477 GHBGVKZYXZAJKQ-ABAIWWIYSA-N 329.418 1.255 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1c(C(=O)O)cnn1C 901605205 NTQXJRGOOPISIQ-UHFFFAOYSA-N 330.388 1.847 10 10 EDCE CN(C)C(=O)[C@@H]1CC[C@H](CNC/C=C/c2ccc(N(C)C)cc2)O1 835043741 YLVRPBILUJBGBI-VGRIIWOTSA-N 331.460 1.991 10 10 EDCE C[C@@H](NC(=O)C(=O)NC[C@H]1C[C@@H](N(C)C)C1)c1ccc(N(C)C)cc1 848933934 GWYOZKBDVPOAFK-CPUCHLNUSA-N 346.475 1.386 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN(C2CC2)C(=O)C1 748632157 NUHUTGUQWZNIEP-UHFFFAOYSA-N 340.427 1.579 10 10 EDCE CC(=O)N1CSC[C@@H]1C(=O)NCc1ccc2cccnc2c1O 862027844 HREWWEKOIKKULN-CYBMUJFWSA-N 331.397 1.478 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1C 864634991 VYPDPQIRXNWKEH-DAXOMENPSA-N 334.416 1.678 10 10 EDCE CC[C@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)CCN1CC(F)F 768466328 ZCCAZQBGSWMKGK-SWLSCSKDSA-N 342.386 1.979 10 10 EDCE COCc1csc(NC(=O)C(=O)NCc2cc(C)ccc2O)n1 862026001 UMQISMDPCAFCDW-UHFFFAOYSA-N 335.385 1.558 10 10 EDCE O=C(N[C@@H]1CCCC[C@H]1NS(=O)(=O)C1CC1)c1cc(O)cs1 871159442 USCKEVCPAYELDY-VXGBXAGGSA-N 344.458 1.577 10 10 EDCE CCn1cnc(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)c1 775287229 WEONOCJAVBJHHU-UHFFFAOYSA-N 325.346 1.196 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCC(=O)NCC23COC3)c1O 880399387 HSXRGYGEURWNTQ-UHFFFAOYSA-N 338.791 1.339 10 10 EDCE OCc1nnn2c1CN(Cc1cc(Br)ccc1O)CC2 894802409 CRXQULPNFUHAIL-UHFFFAOYSA-N 339.193 1.254 10 10 EDCE C[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)[C@H]1CN(C)CCN1C 896534845 WQKVKMULVLYNNR-CMPLNLGQSA-N 349.456 1.677 10 10 EDCE CN1CCO[C@H](CN(C)Cc2cccc(Br)c2O)C1 709413048 BJAXJDOXLZPVQA-LBPRGKRZSA-N 329.238 1.917 10 10 EDCE C[C@H](N)[C@@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 715768901 GJPZNSRXVGOSQV-UFBFGSQYSA-N 333.201 1.842 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccnc(O[C@H]2CCOC2)c1 1142533139 DSJYACQVRNXVST-AWEZNQCLSA-N 330.340 1.591 10 10 EDCE COC(=O)CC1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329829888 IPBMYGLLEWBJRF-UHFFFAOYSA-N 346.383 1.036 10 10 EDCE CCCC(=O)N[C@@H](C)[C@@H](C)NCc1nnnn1-c1ccc(OC)cc1 1328967461 DQHDWECXRNILPJ-OLZOCXBDSA-N 346.435 1.454 10 10 EDCE C[C@@H]1C[C@H]1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1257235055 XYZRNWJSPFJBPV-ZBFHGGJFSA-N 345.443 1.254 10 10 EDCE COc1ccc(CNC2CCC(NC(=O)CC(N)=O)CC2)cc1C 1265732322 IREZJLCRWBZLDG-UHFFFAOYSA-N 333.432 1.396 10 10 EDCE CC[C@@H](NC(C)=O)C(=O)N(C)[C@@H](C)CNCc1ccc(OC)c(C)c1 1271113040 KSFPCSBXMAMIQT-WMLDXEAASA-N 349.475 1.855 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C1=CS(=O)(=O)CCC1 1441189192 SPZCBDHYKVJHDF-UHFFFAOYSA-N 334.441 1.996 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1Cc2cnccc2NC1=O 1455338528 INIDHPRYCVOHOF-OHVSUOQFSA-N 325.324 1.186 10 10 EDCE CC[C@@H](N[C@@H]1CC(=O)N(C)C1=O)c1cc(Br)ccc1O 116072823 MEBXEQNKIIPJJY-GHMZBOCLSA-N 341.205 1.953 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cnc2c[nH]nc2c1 1626697127 CIJCAEBVEUJTOU-UHFFFAOYSA-N 337.383 1.725 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCCN(c2ncccc2F)CC1 1633367438 PWDPVOARUFUIQF-UHFFFAOYSA-N 345.374 1.913 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@H]2CCC(=O)N2)cc1C 1498134491 SLGPVYMFRHMQCJ-DZGCQCFKSA-N 333.432 1.267 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1568188887 RZAMAMUNJRZDIE-BWUSGFMJSA-N 332.444 1.738 10 10 EDCE CCc1n[nH]cc1C(=O)NC[C@@H](O)CNCc1ccc(OC)c(C)c1 1568566843 FTXMTQDJRYPTDK-AWEZNQCLSA-N 346.431 1.170 10 10 EDCE COc1ccc(CN[C@H]2CCC[C@@H](NC(=O)CNC(C)=O)C2)cc1C 1567157124 JBNMUHGFHRKWCP-DLBZAZTESA-N 347.459 1.657 10 10 EDCE C/C=C(/C)C(=O)N(C)C[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1738805483 PETISWVNIHAHFQ-SEVUFMINSA-N 335.404 1.642 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCn2ccnn2)c1 1640177988 BSOZCZUXRLGXKS-UHFFFAOYSA-N 337.383 1.928 10 10 EDCE COCCN[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C(C)C 1698981951 XTRVLYVNIUEIJM-CQSZACIVSA-N 335.408 1.839 10 10 EDCE Cc1ccc(O)c(CNCCC(=O)NCCCN2CCOCC2)c1 1857861663 CMDFGZMFFVIKBK-UHFFFAOYSA-N 335.448 1.019 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CC(=O)NCCCCN=[N+]=[N-])C1 1964942806 IEOGUSCKHOKUDJ-OAHLLOKOSA-N 341.412 1.955 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)c2cccc(O)c2O)CCO1 2006285080 VQBJEJAHCIYXOG-JTQLQIEISA-N 338.360 1.769 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@H]1CNC(=O)c1cccc(O)c1O 2006290937 AGQJQUURUDQAHC-WDEREUQCSA-N 336.388 1.988 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)NCC1(CN=[N+]=[N-])CC1 2010404414 AEXJZBNNBHYXGJ-SNVBAGLBSA-N 341.412 1.857 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2010404237 PZHBOEDHHPSLKX-LLVKDONJSA-N 339.396 1.829 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC[C@H](N=[N+]=[N-])C1)C(C)(C)O 2014480882 UWSIYJZXHCGMKK-WDEREUQCSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)Nc2ccc(N)cc2)CC(CO)C1 2018346020 PZOXLWSIANDWFT-UHFFFAOYSA-N 335.404 1.873 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)c(Br)c1 2158392998 OZVKCKBBPCNRCU-GLQYFDAESA-N 341.249 1.755 10 10 EDCE CCN=c1[nH]cc(Br)c(=NCCc2ccc(N)cc2)[nH]1 2174022197 VPXAHKDAZXRDDA-UHFFFAOYSA-N 336.237 1.752 10 10 EDCE Cn1cc(CNC(=O)c2cc(O)c(O)c(O)c2)c(Br)n1 2188913429 RRUGHSVLBDRAHA-UHFFFAOYSA-N 342.149 1.229 10 10 EDCE COCCCNC=C1C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O 2293370022 NRHPBVOPESTUCE-UHFFFAOYSA-N 337.763 1.433 10 10 EDCE COc1cccc(CNC(=O)Cn2cnc3ccccc3c2=O)c1O 68488863 NLWWLYHQPTUSEH-UHFFFAOYSA-N 339.351 1.427 10 10 EDCE COc1ccc([C@@H](O)CNC(=O)c2cc(O)c(O)c(O)c2)cc1OC 170190461 LBEMUYNALBAZDF-ZDUSSCGKSA-N 349.339 1.284 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(Cc1cc(O)c(O)c(O)c1)C(=O)O 1951738259 XUDOOSHDMHISTB-OAHLLOKOSA-N 327.333 1.714 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NC[C@@]1(O)CCSC1 304488702 MMWQBVJIDOIODT-INIZCTEOSA-N 331.397 1.848 10 10 EDCE COC(=O)[C@@H](C)CC(=O)NC1CCN(c2ccc(OC)cc2)CC1 178270751 RWHJYDBONLNHDW-ZDUSSCGKSA-N 334.416 1.979 10 10 EDCE COc1ccc(O)c(CN2CCN(c3ccc4nncn4n3)CC2)c1 180081430 NSKNRQSECHHJMC-UHFFFAOYSA-N 340.387 1.161 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3c(C)nn(C)c3C)CC2)cc1 74716250 CCPATKWQNPNLNC-UHFFFAOYSA-N 342.443 1.937 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCNC(=O)c1ccco1 186419623 UNRPDQNNKAEYMR-GFCCVEGCSA-N 346.383 1.948 10 10 EDCE CS(=O)(=O)[C@H]1CSCCN1c1ccc(CNC2CC2)cc1 90923208 FFPWAYGNQZJFBS-HNNXBMFYSA-N 326.487 1.863 10 10 EDCE C[C@H]1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)C[C@H]1N(C)C 266141745 FSBQAFQXLCPNQB-MKTWQISGSA-N 343.471 1.945 10 10 EDCE COc1cccc(CNC(=O)c2cnc(OCC3CC3)cn2)c1O 286656499 CXZUDJDFTSUGMF-UHFFFAOYSA-N 329.356 1.910 10 10 EDCE NC(=O)C1CN(c2ccc(/C=C\C(=O)O)cc2Br)C1 381961037 FSAOAOUVGDQDQP-RQOWECAXSA-N 325.162 1.468 10 10 EDCE Cc1ccc(CN(C)c2cncc(=NN)[nH]2)c(O)c1Br 2380742775 VLRGELYRIKAEFJ-UHFFFAOYSA-N 338.209 1.597 10 10 EDCE Cc1ccc(CN(C)C(=O)COC[C@@H](C)N)c(O)c1Br 2380766645 SHMBHPUABJWOCJ-SNVBAGLBSA-N 345.237 1.785 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@H](C)C2(S(C)(=O)=O)CC2)c1 806809954 FBWITHQAXOLOKP-SNVBAGLBSA-N 342.417 1.166 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCO[C@@H](C2CC2)C1 807101294 RHVGVRLODRTZQY-QGZVFWFLSA-N 345.443 1.315 10 10 EDCE COc1ccc(N2CCN(CCNCC3(O)CCCC3)CC2)cc1 818982095 FSOHNTVAUSUNHA-UHFFFAOYSA-N 333.476 1.712 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c2n(c(=O)n1C)CCCC2 828884960 PJPUFGDKWSEGHZ-LLVKDONJSA-N 345.399 1.295 10 10 EDCE CCN1C(=O)[C@@H]2CN(C/C=C\c3ccc(N(C)C)cc3)CCN2C1=O 835027976 FRMOZULLIRHHTM-OSJSJHBBSA-N 342.443 1.734 10 10 EDCE CNS(=O)(=O)C1CCN(C/C=C/c2ccc(N(C)C)cc2)CC1 835028146 JXJVKUXXYRXHHZ-SNAWJCMRSA-N 337.489 1.779 10 10 EDCE COC(=O)[C@H](O)CNC(=O)/C=C\c1cc(C)n(-c2ccccc2)c1C 588407501 BKYBFBGKIZAIIO-DOOKAGJSSA-N 342.395 1.757 10 10 EDCE COC(=O)c1cncc(NCc2ccc(N3CCOCC3)cc2)n1 746430294 BUZUQCUWEXWEKP-UHFFFAOYSA-N 328.372 1.712 10 10 EDCE COC(=O)c1cc(O)c(F)cc1NS(=O)(=O)C[C@@H](OC)C1CC1 842586957 SFAVCUJHKNIWDN-CYBMUJFWSA-N 347.364 1.485 10 10 EDCE COc1cc(CNC[C@@H](O)CS(C)(=O)=O)c(O)c(C(C)(C)C)c1 922826232 WSZOCVQZXWNGSO-GFCCVEGCSA-N 345.461 1.193 10 10 EDCE COCc1nc(C(=O)NCc2cc(Cl)cc(Cl)c2O)n(C)n1 853806477 HSNMHQXKBCHUMB-UHFFFAOYSA-N 345.186 1.904 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)Nc2c(C)cnn2C)cc1 850351520 PBLUJVJWTFBCBP-UHFFFAOYSA-N 343.431 1.830 10 10 EDCE C[C@H](O)CNC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 765533941 AMTUSBGHZSKISX-HNNXBMFYSA-N 346.475 1.399 10 10 EDCE C[C@H](NC(=O)c1cn(C[C@@H]2CCOC2)nn1)c1ccc(N(C)C)cc1 860951036 XAYOXZRCQJPPOL-KBPBESRZSA-N 343.431 1.872 10 10 EDCE O=C(c1cccc(O)c1O)N1CCC(c2nnc3n2CCC3)CC1 790545537 IIAVIKDDCQLLIT-UHFFFAOYSA-N 328.372 1.655 10 10 EDCE C[C@@H](c1cc(Br)ccc1O)N1CC[C@@H](NC(N)=O)C1 690733516 RLFZUDLFJZTCHN-WCBMZHEXSA-N 328.210 1.958 10 10 EDCE CC(C)(C)OC(=O)C1=NO[C@H](C(=O)NCc2cc(O)ccc2O)C1 1153885879 QQMHMUNUGUNWIX-ZDUSSCGKSA-N 336.344 1.201 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1(S(C)(=O)=O)CC1 1157533651 AHBLWBRZNSEBPE-VIFPVBQESA-N 338.389 1.545 10 10 EDCE O=C1C[C@@]2(CCN(Cc3cccc(Br)c3O)C2)CN1 789767859 LQWYXNSAVGFFBL-AWEZNQCLSA-N 325.206 1.867 10 10 EDCE COc1ccc(CNCC[C@H]2CCCCN2C(=O)C(N)=O)cc1C 1319774326 JQYLTTFDHPKTPZ-OAHLLOKOSA-N 333.432 1.350 10 10 EDCE CO[C@H](C)CN[C@H]1C[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1316623559 DMHCKCUIUFKOSY-JMSVASOKSA-N 347.419 1.982 10 10 EDCE CN(CCCO)C[C@@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1328798270 RCCCSBNVUGNWHO-HNNXBMFYSA-N 347.419 1.768 10 10 EDCE C[C@H]1COC2(CCCC2)CN1C(=O)C(=O)N(C)Cc1ccccc1O 1329767454 DGSDTWQBQDATKM-AWEZNQCLSA-N 346.427 1.911 10 10 EDCE O=C1Nc2cc(N3CC=C[C@@H]3CO)c(Br)cc2[C@H]1O 2119853769 RNRWUUJWVHMIAQ-JMCQJSRRSA-N 325.162 1.172 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2(NCCCO)CCC2)cc1 1273208103 JGMLQLVQTVCJCG-UHFFFAOYSA-N 333.392 1.474 10 10 EDCE COC[C@@H](C)N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 221243341 ZKOAKTJOXOQOFG-JMCQJSRRSA-N 328.210 1.872 10 10 EDCE CC(C)[C@H](NC(N)=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1295405035 DOUJHCHECZIYMJ-HOCLYGCPSA-N 349.431 1.593 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCS(=O)(=O)[C@@H]2CCC[C@@H]21 1468069678 BPDATGPQJHCLSN-SPYVTISKSA-N 337.397 1.289 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCS(=O)(=O)[C@@H]2CCC[C@H]21 1468069679 BPDATGPQJHCLSN-SQWULWQPSA-N 337.397 1.289 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@]2(C)C=CCC2)cc1C 1497031371 BVJHSVKQFDLQHX-LPHOPBHVSA-N 332.444 1.927 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)/C=C(/C)C2CC2)cc1C 1734361376 LBCLOZMATJYRIO-HOFZKYPUSA-N 332.444 1.927 10 10 EDCE C[C@H](CN[C@H](C)C(=O)N(C)C)NC(=O)c1ccc(N=NC(N)=O)cc1 1732984577 BNPNJDWRFHINKP-GHMZBOCLSA-N 348.407 1.034 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC(O)(c3ccnn3C)CC2)c1O 1655488473 CHHBRSGJWFNAFW-UHFFFAOYSA-N 347.390 1.951 10 10 EDCE CCOCC(=O)N(CC)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1745326850 ZELCVVRSRXNCMS-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE CCCCNC[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1677142723 KTMFQXXBADKZEV-CQSZACIVSA-N 335.408 1.672 10 10 EDCE O=C1NC(=S)NC(=O)C1=C/C=C\c1coc2ccccc2c1=O 6197573 POIIEOXVQATVNY-ARJAWSKDSA-N 326.333 1.264 10 10 EDCE Cn1nnc(Br)c1CNC(=O)CCc1ccc(N)cc1 2145574442 IVZYFLHYHHFOPF-UHFFFAOYSA-N 338.209 1.409 10 10 EDCE CN1CCc2cc([C@H](N)C3(NC(=O)OC(C)(C)C)COC3)ccc21 2005297847 QVGRKSNTFQUUBX-HNNXBMFYSA-N 333.432 1.972 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985101415 RUYBMCVMIGYHSH-SNVBAGLBSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)NCCCCN=[N+]=[N-])CCOC1 1985102881 NEFSACOAZKDONF-AWEZNQCLSA-N 327.385 1.877 10 10 EDCE CC(C)(C)OC(=O)N1CCN(Cc2cc(N)ccc2O)[C@@H](CO)C1 1999484993 RAHCHHSXDAJAAV-CQSZACIVSA-N 337.420 1.388 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)c(Br)c1 2178087513 RMTNZZXWORIHPG-LIBKGXAOSA-N 342.233 1.946 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC([N+](=O)[O-])C3)c(Br)cc21 2191516605 JWVFEPHXELEEIZ-LLVKDONJSA-N 341.165 1.127 10 10 EDCE C[C@]1(O)CN(c2cc(Br)c(CN)cc2F)CC[C@@]1(C)O 2194602100 ZYRVKVQBXOCMNC-KGLIPLIRSA-N 347.228 1.759 10 10 EDCE OC[C@@]1(NCc2cc(Br)ccc2O)C[C@H](O)C12CCC2 2193970450 ZDYWKUUDNYBVDY-ZFWWWQNUSA-N 342.233 1.910 10 10 EDCE C[C@H](N)c1ccc(N2CCN3CCOC[C@H]3C2)c(Br)c1 2185896131 LIEOMHVDZLMSQC-WCQYABFASA-N 340.265 1.990 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3C[C@@H]4C(N)[C@H]4C3)ccc(N)c2C1 2071575426 ZKPZPHLFZWMKPC-KBPBESRZSA-N 344.459 1.955 10 10 EDCE N[C@@H]1[C@H]2C[C@@H](CN(Cc3ccc(Br)cc3O)C2)[C@H]1CO 2239342316 WXWAGVNTQIDWEG-HTTKSJEASA-N 341.249 1.542 10 10 EDCE Cc1cccc(N2C(=O)NC(=O)C(=CNCCCN(C)C)C2=O)c1 2296193907 FFNVRFRNYKXXEL-UHFFFAOYSA-N 330.388 1.003 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccc(CO)cn2)s1 2284499825 QJRBGGFTFCNFOC-UHFFFAOYSA-N 331.444 1.231 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N[C@@H]1C[C@H]2CC[C@H]1O2 2298958905 AFSMSRGTAMNKIZ-KZNAEPCWSA-N 328.412 1.973 10 10 EDCE Cc1ccc(CN(C2CNC2)C2COC2)c(O)c1Br 2352941431 QOLVVOKRNLHHRO-UHFFFAOYSA-N 327.222 1.636 10 10 EDCE COCC[C@](C)(O)CNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255090843 LVRMIVMJYKOOPD-ZXYDQQDNSA-N 348.443 1.440 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCN(C2CCOCC2)C1=O 364982319 FESDWPNMWUXTAW-KWEXDPCDSA-N 346.383 1.007 10 10 EDCE Cc1ccc(CN2CCN3CCNC[C@H]3C2)c(O)c1Br 2380653784 LEPFVNMIYPYDGO-ZDUSSCGKSA-N 340.265 1.553 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2nn[nH]n2)C1 569659826 BICSNLOFGVURQY-UHFFFAOYSA-N 339.403 1.560 10 10 EDCE COc1ccc(N2CCC(NC(=O)c3cccn(C)c3=O)CC2)cc1 729532207 UWWFXALYAXOWNI-UHFFFAOYSA-N 341.411 1.793 10 10 EDCE Cc1cccc(NS(=O)(=O)c2cc(F)cc(F)c2O)c1C(N)=O 821158157 WINOHDAPVPSTEX-UHFFFAOYSA-N 342.323 1.879 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CC[C@H](CN2CCOCC2)C1 588405797 ROBVHDHJPWZURK-NSRYLSIASA-N 332.400 1.292 10 10 EDCE COc1ncncc1CNCc1ccc(N2CCOCC2)c(F)c1 842672529 UUWZIUUUWCPVDD-UHFFFAOYSA-N 332.379 1.751 10 10 EDCE CCC[C@H](C)[C@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 846359021 GFSOVGKYVRINSR-GWCFXTLKSA-N 344.433 1.291 10 10 EDCE Cn1nccc1[C@H](O)CNCc1ccc(N2CCC(O)CC2)cc1 922969552 DPIGNHLBFAPWKC-GOSISDBHSA-N 330.432 1.204 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3nccn4ccnc34)C2)cc1 855227767 YRRXRDJQQKJROU-ZDUSSCGKSA-N 337.383 1.747 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)N[C@@H](C)c2cc(OC)ccc2O)C[C@H]1C 866764772 OVIPHOKKCKIDEZ-ANGCBRKESA-N 337.372 1.545 10 10 EDCE CCOc1ccc(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c(O)c1 872255491 YKICYWGOUCEJBA-UNEWFSDZSA-N 347.415 1.158 10 10 EDCE C[C@H]1C[C@H](NCc2ccc(N3CCN(C)CC3)c(F)c2)c2ncnn21 1118484065 BTZWDAIXGALWJA-BBRMVZONSA-N 344.438 1.965 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(C(=O)N2Cc3cccc(O)c3C2)C1 871205814 YWHGIBOHYMBEGN-UHFFFAOYSA-N 334.372 1.216 10 10 EDCE COc1cccc(CNS(=O)(=O)c2cccc(N(C)C)c2)c1O 788058496 RPFYARUTNQISKZ-UHFFFAOYSA-N 336.413 1.945 10 10 EDCE COC(=O)[C@@H]1[C@@H](CNCc2ccc(N3CCOCC3)cc2)C1(F)F 894199670 BXTSDNKVRKMKQE-CABCVRRESA-N 340.370 1.667 10 10 EDCE Cc1nccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 793760976 HZLOTIBCMMEKOC-GFCCVEGCSA-N 341.415 1.345 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CC[C@H](C(N)=O)CC2)cc1 1162271877 USYXDIORJAPJNS-XYPYZODXSA-N 331.376 1.871 10 10 EDCE CNCCOCCN(C)Cc1ccc(N2CCN(C)CC2)c(F)c1 1330198555 LJTZDGNFYNORQJ-UHFFFAOYSA-N 338.471 1.245 10 10 EDCE N[C@H]1CCCC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1346103537 IWMHRYAYKPZAIC-WBVHZDCISA-N 349.450 1.921 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2133919333 JVRZYXPEVZSIOV-DEQVHRJGSA-N 328.206 1.404 10 10 EDCE 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2190458162 LVWQLBSDVLKOBE-MSRLKIHKSA-N 345.212 1.510 10 10 EDCE OCc1ccc(N2CC[C@]3(O)CCOC[C@H]3C2)c(Br)c1 2194564538 JTUGUGJSXDPCCW-DOMZBBRYSA-N 342.233 1.919 10 10 EDCE CNCc1ccc(N2CC[C@](C)(O)[C@@](C)(O)C2)c(Br)c1 2194607882 CGJLXTLUEASQDB-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE NCc1ccc(N2[C@H](CO)C[C@@H]3OCC[C@@H]32)c(Br)c1 2090540586 COFZHOVPCTVPCZ-BPNCWPANSA-N 327.222 1.636 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@@H]3COC[C@@H]32)c1O 2236089382 DAMVOMIYRPDCND-WCQYABFASA-N 344.205 1.763 10 10 EDCE NC(=O)c1cccc(N)c1N[C@H](CCO)COCc1ccccc1 2303654440 NWXHJDWZCVBPKY-CQSZACIVSA-N 329.400 1.747 10 10 EDCE CC(C)CN1CCO[C@H](CNC(=O)C=Cc2ccc(O)c(O)c2)C1 2307987615 YOLPTDMIPMDKMK-OAHLLOKOSA-N 334.416 1.584 10 10 EDCE COc1cc(C=C2C(=O)NC(=O)N(C)C2=O)ccc1OCC(C)C 2313548629 AHVNNCBBKDSNSI-UHFFFAOYSA-N 332.356 1.822 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)C(=Cc2ccc(O)cc2)SC1=S 2323832183 UNFWTFNQPRTFDA-SECBINFHSA-N 325.367 1.039 10 10 EDCE COc1cc(C(=O)NCc2cc(Br)ccc2O)nn1C 804739268 CVKMGWSUPQGGOG-UHFFFAOYSA-N 340.177 1.827 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1c1ncccn1 808537324 XECYOCHKDQMWOF-MJBXVCDLSA-N 331.372 1.315 10 10 EDCE CO[C@@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC[C@@H]1C 807675335 WNIGYLVNTALNDY-JJRVBVJISA-N 347.459 1.813 10 10 EDCE COCc1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCO1 812269088 PDORPJJTQKHKJG-CQSZACIVSA-N 332.404 1.946 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@H](C3CCC3)C2)cc1 817274705 PPSFLDQVMAQENS-KRWDZBQOSA-N 345.443 1.396 10 10 EDCE CCOC(=O)c1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)on1 828884414 BEQFKHHKBHDAIN-VIFPVBQESA-N 334.328 1.624 10 10 EDCE Cn1cc(CNC(=O)c2ccc(O)c(O)c2)c(Br)n1 720668470 UYCAGVCLKWUKFB-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN(CC(=O)O)CC1CC1 844838140 TUNMSQURAUBGMT-UHFFFAOYSA-N 333.432 1.508 10 10 EDCE COC(=O)c1cc(O)c(F)cc1NS(=O)(=O)CC(C)(C)OC 840913088 AMEZDCVSFCFWFX-UHFFFAOYSA-N 335.353 1.485 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C[C@@H](C)O)C3CC3)C2)cc1 854295970 FQJRMEBANSBPLS-KGLIPLIRSA-N 333.432 1.829 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cc(C=O)n(C)n3)CC2)cc1 929249013 BXLNUPVBCRINBN-UHFFFAOYSA-N 328.372 1.204 10 10 EDCE Cc1cc(CC(=O)O[C@H]2CCC(=O)NC2=O)c(C)n1-c1ccccc1 853935485 ZNUMWNPRKMEDGZ-INIZCTEOSA-N 340.379 1.985 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H](N)COC(C)C)CC2)cc1 851630408 LLVOJWPALVUUCO-KRWDZBQOSA-N 335.448 1.486 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCCN(C(C)=O)C3)C2)cc1 855228421 CAJDRHYSNDRBNV-HZPDHXFCSA-N 345.443 1.649 10 10 EDCE COC(=O)c1cc(C)ccc1S(=O)(=O)NCc1ccccc1O 754021043 CNJUTAAVAPUGBB-UHFFFAOYSA-N 335.381 1.966 10 10 EDCE COc1ccc(CNC(=O)COCc2ccnc(OC)c2)c(O)c1 861490411 UDNSBPLIBBKXTE-UHFFFAOYSA-N 332.356 1.637 10 10 EDCE COC(=O)c1cc(OCC(=O)C(C)(C)C(=O)OC)ccc1N(C)C 865395461 QNDQEXOVQQNGQZ-UHFFFAOYSA-N 337.372 1.686 10 10 EDCE COc1ccc(N2CCN(C(=O)Cn3ccnc3)CC2)c(OC)c1 870164174 QRFSESCBUPTSGM-UHFFFAOYSA-N 330.388 1.249 10 10 EDCE CC[C@H](NCc1c(C(=O)OC)n(C)c2ccc(F)cc12)C(=O)NC 894945980 CFMARKRDPMFUHR-ZDUSSCGKSA-N 335.379 1.718 10 10 EDCE COCC[C@@](C)(O)CNC(=O)c1cc2cc(O)c(O)cc2s1 896833307 DCHPEVHMXKJJTM-OAHLLOKOSA-N 325.386 1.830 10 10 EDCE Cc1nn(C)cc1CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1135732984 PHAYGPDJTQTPIM-UHFFFAOYSA-N 342.443 1.766 10 10 EDCE O=S1(=O)CCC(NCc2ccc(Br)cc2O)CC1 691393264 SCWXWOMFPAURLG-UHFFFAOYSA-N 334.235 1.822 10 10 EDCE COc1ccc(CNC(=O)C(=O)Nc2ccc3nccn3c2)c(O)c1 797388050 SSAXOYGICXILCE-UHFFFAOYSA-N 340.339 1.303 10 10 EDCE Cn1c(O)nnc1CNCc1cc(Br)cc(F)c1O 715826550 INZQVOJIEQKIAP-UHFFFAOYSA-N 331.145 1.418 10 10 EDCE O=C(NCc1c(O)cccc1O)C1CCN(C(=O)N2CCCC2)CC1 1178912325 SAEYLSJSRLWVKV-UHFFFAOYSA-N 347.415 1.642 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(CNC(=O)C3)C2)cc1Br 2119572336 DJHMLEWSLNCKCD-SECBINFHSA-N 325.206 1.829 10 10 EDCE COc1ccc(N2CC[C@@H](NCC(C)(C)S(C)(=O)=O)C2)cc1 1261599761 IXNMMXZLNHXXHF-CYBMUJFWSA-N 326.462 1.687 10 10 EDCE Cn1nc(C2CCOCC2)cc1C(=O)NCCc1ccc(O)c(O)c1 1346450966 OVMAQUALKXNOJY-UHFFFAOYSA-N 345.399 1.698 10 10 EDCE CC[C@H](CNC(=O)[C@H]1CN(C)CCO1)NCc1ccc(OC)c(C)c1 1269384811 WXUPWCPXYNFBQZ-SJLPKXTDSA-N 349.475 1.319 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)C2(C)CC2)cc(OC)n1 1701627656 NEQWQMQIVRMPSY-NSHDSACASA-N 335.404 1.476 10 10 EDCE COC(=O)NCC(=O)N[C@@H](C)[C@H](C)NCc1ccc(OC)c(C)c1 1717401206 OQRBBSYESSSUJE-STQMWFEESA-N 337.420 1.342 10 10 EDCE C[C@@H](O)CCCN[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1491775856 WWVAATOQMFGCDY-DOMZBBRYSA-N 347.419 1.814 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1O2 1624658474 GPRWVUQAQPOTAR-LMOYCYGVSA-N 347.367 1.032 10 10 EDCE CN(CCCNC(=O)c1ccc(N=NC(N)=O)cc1)C[C@H]1CCOC1 1490283456 PGEDNPVAWYFZSC-CYBMUJFWSA-N 347.419 1.937 10 10 EDCE NC(=O)c1cn(CC(=O)NCc2c(O)cccc2O)c2ccccc12 1635843195 IXUNKFJEWRSIIY-UHFFFAOYSA-N 339.351 1.468 10 10 EDCE CCN1C[C@H](C(=O)N[C@@H](C)CNCc2ccc(OC)c(C)c2)CC1=O 1669572394 ZWKIKAFCCIWHTJ-GOEBONIOSA-N 347.459 1.466 10 10 EDCE CCOC(=O)C(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 169813617 FNURXFBYFHDDQM-AWEZNQCLSA-N 330.388 1.255 10 10 EDCE Cc1cc(=O)c(OCCCO)cn1CCCOc1ccc(N)cc1 1857916612 DHOCULRVAMVALL-UHFFFAOYSA-N 332.400 1.969 10 10 EDCE NC(=O)CCN(Cc1ccccc1)c1ccc([N+](=O)[O-])c(CO)c1 1946834174 LYXPWQLODKIABQ-UHFFFAOYSA-N 329.356 1.969 10 10 EDCE O=C1Nc2cc(N3CC4(CC(O)C4)C3)c(Br)cc2[C@@H]1O 2146329869 SNQPROKSNGYHKE-LBPRGKRZSA-N 339.189 1.396 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H](O)C4(CC4)C3)c(Br)cc21 2149753917 JBYUNMXEFXVKDT-NEPJUHHUSA-N 338.205 1.362 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2012305207 CFCDTCDSUIJKRR-RWWNRMGGSA-N 339.396 1.706 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC(CN=[N+]=[N-])CC1 2012343844 REVOFTQNENNTFZ-GFCCVEGCSA-N 341.412 1.811 10 10 EDCE CN(C)C[C@H]1CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2160848122 TVUZPEGTGMVVTJ-OQPBUACISA-N 340.221 1.575 10 10 EDCE CCOc1cccc(CNCc2nnc(Br)n2C)c1O 2178000152 DVWUKWKNTBCSDK-UHFFFAOYSA-N 341.209 1.972 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C(CNC(=O)c3cccc(O)c3O)[C@H]2C1 832051010 CQTBOALNFQDAFZ-CHWSQXEVSA-N 348.399 1.941 10 10 EDCE OC[C@]1(NCc2c(O)cccc2Br)C[C@H](O)C12CCC2 2193966847 MQBCQCMBFZCFSF-DZGCQCFKSA-N 342.233 1.910 10 10 EDCE O=C1C[C@@H]2CCN(Cc3ccc(Br)cc3O)C[C@H]2N1 2088807152 YBVRPHPWOBEJID-JOYOIKCWSA-N 325.206 1.865 10 10 EDCE COc1ccc(N(C)Cc2nn(C)nc2Br)c(CN)c1 2235957758 HNYVUEJGSCHEFK-UHFFFAOYSA-N 340.225 1.681 10 10 EDCE COc1ccc(N2CCNCCNCC2)c(OC)c1Br 2236197069 LBXJRLXOZGSCMM-UHFFFAOYSA-N 344.253 1.466 10 10 EDCE CCN(CCC(=O)O)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2311968546 QRZJDDGBWJPPQR-UHFFFAOYSA-N 332.400 1.860 10 10 EDCE C[C@@](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)(C(=O)O)C1CC1 2311974058 UCKWCHJPEFKMTF-IBGZPJMESA-N 344.411 1.906 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(OCC(F)(F)C(F)F)nc1 808514909 VJNJXCJOLHRVCU-UHFFFAOYSA-N 337.225 1.676 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C)Oc1ccccc1Br 808516649 JFYVBMPSQXDANY-VIFPVBQESA-N 329.146 1.918 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCC(=O)NCC1CC1 588395008 RYFWPZPLLIQHLQ-YVMONPNESA-N 343.427 1.179 10 10 EDCE C[C@H]1CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CCC1=O 588532403 PBAMSTSBFIITHK-QZDDGCDVSA-N 328.412 1.974 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)COCC(=O)OC(C)(C)C 843850791 ITOYGIZYLZPXFV-NSHDSACASA-N 339.388 1.503 10 10 EDCE CCNC(=O)C[C@H]1CCCCN1C(=O)C(=O)Nc1ccc(N)cc1 841128617 DWCBOIZFFXDQHI-CQSZACIVSA-N 332.404 1.115 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C[C@@]3(C(=O)O)CCOC3)C2)cc1 849183760 UHAINHJRTFYCBA-ACJLOTCBSA-N 348.399 1.272 10 10 EDCE COc1cc(Br)cc([C@H](C)NC[C@@H]2CNC(=O)C2)c1O 848553448 SVHGCFGBLCPKIZ-DTWKUNHWSA-N 343.221 1.950 10 10 EDCE COC(=O)c1cc(CNC(=O)NCc2c(O)cccc2F)n(C)c1C 924018874 ACHCDVZLVLBVKF-UHFFFAOYSA-N 349.362 1.964 10 10 EDCE CC(=O)c1cc(F)cc(CN(C)C[C@H]2CCS(=O)(=O)C2)c1O 750825982 HJZJBVOSEPYPFC-LLVKDONJSA-N 329.393 1.600 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@H](OC)[C@H](OC)C3)C2)cc1 854300147 VIPJHQVEMUHAAC-XYPHTWIQSA-N 349.431 1.329 10 10 EDCE Nc1ccc(CCNC(=O)NCCN2C[C@@H]3CCCCN3C2=O)cc1 851662993 PZWKEJDVTHXYAF-INIZCTEOSA-N 345.447 1.401 10 10 EDCE COc1cc(N2CC[C@H](Cn3ccnn3)C2)c([N+](=O)[O-])cc1OC 853760330 JOQXLPGDAVUIFC-NSHDSACASA-N 333.348 1.730 10 10 EDCE CCOC(=O)[C@@H]1NCC[C@@H]1N[C@H]1CCN(c2ccc(OC)cc2)C1 854218606 ZEAKAFWWNUFQNP-RRQGHBQHSA-N 333.432 1.157 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCOc3ccccc32)c1 769695794 ZFCPKVHECNDLGW-UHFFFAOYSA-N 348.380 1.803 10 10 EDCE C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 899414297 QYPSIGQOQZRFLE-AAXDQBDMSA-N 338.429 1.786 10 10 EDCE CS(=O)(=O)N[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2O)C1 93531138 MSIHPWYLUYXVQO-JTQLQIEISA-N 339.244 1.823 10 10 EDCE Cc1cc(Br)cc(CN2C[C@@H]3NC(=O)O[C@H]3C2)c1O 2120406535 RJXUFJYENZSEPL-QWRGUYRKSA-N 327.178 1.756 10 10 EDCE COC(=O)c1cnc(CN(C)CCN(C)c2ccc(OC)cc2)cn1 1329843093 ZXKKJWGHWUUBJP-UHFFFAOYSA-N 344.415 1.840 10 10 EDCE CN1CCC2(CCCN2C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1335584849 NWXLXBTWSGJXIM-UHFFFAOYSA-N 343.427 1.321 10 10 EDCE CCS(=O)(=O)[C@@H]1CCN(c2ccc(CO)c(Br)c2)C1 2123308072 INXFSBXOGPGTKH-GFCCVEGCSA-N 348.262 1.955 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@@H](C)C2CC2)cc1C 1332487277 GBJVUDYYWJCRSX-YOEHRIQHSA-N 334.460 1.959 10 10 EDCE CNC(=O)[C@@H]1CN(C(=O)/C=C\c2cccnc2C)c2ccccc2O1 1264275928 URCNJLCUYLCSPJ-IBSYWUHOSA-N 337.379 1.943 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2[nH]c(O)nc2C)cc1C 1268650433 KZELGORPNMEVTM-LLVKDONJSA-N 332.404 1.649 10 10 EDCE Cc1nc(S(=O)(=O)N2CC(N=[N+]=[N-])C2)c(Br)n1C 1912150512 URMMBFGNSPSBIY-UHFFFAOYSA-N 335.187 1.174 10 10 EDCE COC(=O)NCC(=O)N1CC[C@@H](NCc2ccc(OC)c(C)c2)[C@H]1C 1278232420 ISZQVVXHEIITEE-UKRRQHHQSA-N 349.431 1.439 10 10 EDCE C[C@H](CNC(=O)C1CCC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1285660251 RIGGLRMAQXFOJG-SNVBAGLBSA-N 331.376 1.884 10 10 EDCE Cc1c(C(=O)NCc2cc(O)ccc2O)cnn1-c1ccc(O)nn1 1455349139 OVMZPLBDMAWDQN-UHFFFAOYSA-N 341.327 1.018 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)CC2OCCCO2)cc1C 1497574393 ROERSFAONYMWGY-ONEGZZNKSA-N 348.443 1.919 10 10 EDCE Cc1cn2nnc(C(=O)NCc3c(O)ccc4ccccc34)c2c(O)n1 1635969456 QMEISWYHBHWHHR-UHFFFAOYSA-N 349.350 1.927 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)CN(C)[C@@H]1CCC[C@H]1O 1634387359 PTGXHQNIDWXUFI-GDBMZVCRSA-N 333.432 1.323 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2CCC(=O)N2)cc1C 1569258906 NYOGWMQUSYFLAO-HNNXBMFYSA-N 333.432 1.220 10 10 EDCE CN1CCN(c2ccc(CNC(=O)C3(N(C)C)CCCC3)cc2)CC1 1633253022 WXSUGMSTLYYOTB-UHFFFAOYSA-N 344.503 1.929 10 10 EDCE CCN1CCC[C@@](CO)(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1569902355 VYVSQQGFBNHKML-MRXNPFEDSA-N 333.392 1.426 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@H](C(F)(F)F)[C@@H](CO)C1 1640497799 AULPTZPZKZWHDI-MNOVXSKESA-N 333.306 1.660 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@H](C)OC 1582482866 OTODUISASOJEBA-CMPLNLGQSA-N 349.391 1.509 10 10 EDCE CNC(=O)[C@@H](C)CN(C)c1ccc(CN)c(Br)c1F 231841009 MQRMBDIKCWDXBQ-QMMMGPOBSA-N 332.217 1.865 10 10 EDCE O=C(NCc1ccccc1O)NC[C@@H]1CS(=O)(=O)c2ccccc21 1681385914 VASGOKNCAMDQIL-CYBMUJFWSA-N 346.408 1.763 10 10 EDCE CO[C@@H](C)CNC[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1698776963 LIOXCODXAWCFCZ-RYUDHWBXSA-N 335.408 1.839 10 10 EDCE O=S1(=O)CC2(CC(NCc3cc(Br)ccc3O)C2)C1 1967803877 YROCXIDXOPCBQI-UHFFFAOYSA-N 346.246 1.822 10 10 EDCE O=C(O)[C@]12COC[C@H]1CN(Cc1ccc(Br)cc1O)C2 2160994961 JXWNRUWPBWXPIV-QMTHXVAHSA-N 342.189 1.688 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2010390008 XIPBZDBSSOJXKK-NSHDSACASA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010396001 LTXKCGZLZVZVOO-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010389044 KPDOXLBZDDJRET-WDEREUQCSA-N 343.384 1.759 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCC2(CN=[N+]=[N-])CC2)CCOC1 2010406847 ZWMKXIJQOQQPLB-OAHLLOKOSA-N 339.396 1.877 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CNCc1cc2c(cc1O)OCO2 2011422322 RGKDJRJBPRFQHC-NSHDSACASA-N 340.376 1.096 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H]1CN=[N+]=[N-])C(C)(C)O 2014478746 HXPYTMSPPQGFBV-MNOVXSKESA-N 341.412 1.952 10 10 EDCE CS(=O)(=O)[C@@H]1CCCN(c2ccc(CN)cc2Br)C1 389045303 GRMMITFURRKPKV-LLVKDONJSA-N 347.278 1.921 10 10 EDCE CC[C@@H](NC(=O)c1cnn2c(O)cc(C)nc12)[C@@H](O)C(F)(F)F 2064293997 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O=C(COCCO)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 188894221 KZHNWELYEDRFJB-LBPRGKRZSA-N 344.358 1.382 10 10 EDCE COC(=O)CC[C@H](N)c1ccc(I)cc1O 95770489 BBYONQVXTBAPPE-VIFPVBQESA-N 335.141 1.950 10 10 EDCE CS(=O)(=O)C[C@H](N)c1cc(I)ccc1O 95769530 DGVUCNHPDBYWRP-QMMMGPOBSA-N 341.170 1.041 10 10 EDCE CCCN(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)=O 240823556 BDNRVZXMIXJYQO-UHFFFAOYSA-N 333.432 1.602 10 10 EDCE COC[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C)O1 252016958 YHAASYDMQROMKC-QAPCUYQASA-N 349.475 1.447 10 10 EDCE CCc1c(C(=O)OCC(=O)C(C)=O)cnn1-c1ccc(OC)cc1 808538429 RFUIHODZQRHDBP-UHFFFAOYSA-N 330.340 1.758 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CC[C@@H]1C(=O)O 397034986 NEVJHQMYQHPKTL-CVEARBPZSA-N 332.400 1.592 10 10 EDCE OCCN1CCCC[C@H]1CNCc1ccc(N2CCOCC2)cc1 824583447 LTINOBPTQPRXHG-IBGZPJMESA-N 333.476 1.460 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](O)Cc1cnn(C)c1 839922450 VBEKEZZTHZGOOH-KSSFIOAISA-N 344.459 1.445 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N[C@@H]1CCc2nnn(C)c2C1 919080687 DWOOJRZFWZWIBC-CQSZACIVSA-N 342.447 1.546 10 10 EDCE CN(C)C[C@H](Cc1ccccc1)NC(=O)C(=O)Nc1ccc(N)cc1 841019467 IHKCPKRBEPSULD-KRWDZBQOSA-N 340.427 1.496 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ncn(C(C)C)n1 845930969 KTORBQPZXMCIIW-UHFFFAOYSA-N 345.403 1.942 10 10 EDCE Fc1cc(CNC[C@@H]2C[C@@H]3COC[C@@H]3O2)ccc1N1CCOCC1 922723613 AOUOJXBMJPQHFQ-VKJFTORMSA-N 336.407 1.556 10 10 EDCE C[C@@H](NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H]1[C@H]2CN[C@H]1C2 925689900 DFJIEANSCMLLMA-AQMVCYDESA-N 337.414 1.887 10 10 EDCE Cn1cc(CCOC(=O)c2csc(Cc3ccc(N)cc3)n2)nn1 859633243 XBDYWARBEQBWMZ-UHFFFAOYSA-N 343.412 1.844 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(C(N)=O)cn3)C2)cc1 855229686 LJEUXOADMKVYGY-CYBMUJFWSA-N 340.383 1.198 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H]4COC[C@H]4C3)C2)cc1 852450715 STROXYSNHHTXNI-OAGGEKHMSA-N 345.443 1.952 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@]1(C)CCCO1 756540903 AJLMFVDNRXOTIR-SFHVURJKSA-N 334.416 1.823 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@](C)(O)C3CC3)C2)cc1 854301861 VJAHPCXEAMDIBG-KBXCAEBGSA-N 333.432 1.734 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)CS1(=O)=O 855699963 DLLRFQNTWXHNLL-ZOZIERIHSA-N 325.386 1.193 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NOC[C@H]3CCOC3)C2)cc1 852273761 HHRXOONGIAYZQY-KBPBESRZSA-N 335.404 1.541 10 10 EDCE COCCO[C@@H]1COCC[C@@H]1NC(=O)N[C@@H](C)c1ccccc1O 868517794 NBNKZTLRBZJNKK-DUVNUKRYSA-N 338.404 1.573 10 10 EDCE C[C@@H](Cn1ncc2ccccc2c1=O)NC(=O)c1cc(O)cs1 765403632 QSFBNEVIBATNAW-JTQLQIEISA-N 329.381 1.982 10 10 EDCE C[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)c1cncnc1 764425601 KOHMCBVOKRJUEL-AWEZNQCLSA-N 326.400 1.733 10 10 EDCE COc1cccc(O)c1CNC[C@]1(O)[C@H]2[C@H]3C[C@@H]4[C@H]5[C@@H](C[C@H]42)[C@@H]1[C@@H]53 785543269 GRAATZROPDVWDZ-LXONHHPUSA-N 327.424 1.999 10 10 EDCE Nc1ccc(OC[C@@H](O)CN2CCC(=CBr)C2)cc1 2115740072 JWLFPVMVMNXYQY-ZDUSSCGKSA-N 327.222 1.993 10 10 EDCE CN(CC[C@@H]1CCCCN1C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329810397 KWGLIKIHXVHVJS-HNNXBMFYSA-N 345.443 1.567 10 10 EDCE CCOc1ccc(N2CCN(C[C@H](O)CC3(O)CCC3)CC2)cc1 1331351329 WSAMDHFKUPOURW-QGZVFWFLSA-N 334.460 1.873 10 10 EDCE C[C@H]1CC[C@@H](C(N)=O)CN1Cc1ccc(N2CCN(C)CC2)c(F)c1 1337001606 XSAKRVFYTOVRAG-GOEBONIOSA-N 348.466 1.663 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H](C)NC(C)=O 1268434029 WZKGXMKBYXIUAH-CQSZACIVSA-N 335.448 1.466 10 10 EDCE CN1CC[C@@H](N(C)c2ccc(CO)c(Br)c2)CC1=O 2131950057 MVRRHAADYISXOG-GFCCVEGCSA-N 327.222 1.998 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CN1CCC(=O)NC1=O 1351673155 IWKMMQDHCSRYIO-UHFFFAOYSA-N 344.415 1.187 10 10 EDCE CC(=O)N1C[C@H](C(=O)NCc2c(O)cccc2O)Oc2ccccc21 1456233847 GDGJZQDHOQCOEA-QGZVFWFLSA-N 342.351 1.528 10 10 EDCE CCOC[C@@](O)(CNC(=O)OC(C)(C)C)[C@H](N)c1ccccc1O 1921854520 IREOEKMNOAGPDS-PBHICJAKSA-N 340.420 1.684 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CC[C@@H](CNCCO)C2)cc1 1700914056 VGYQJKCBJPIBJJ-BXUZGUMPSA-N 333.392 1.329 10 10 EDCE CC[C@H](CNC(=O)c1cnco1)NC(=O)c1cc(OC)nc(OC)c1 1704662185 CHKVGKBJZIWILR-LLVKDONJSA-N 348.359 1.025 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cnccn3)cc2)CC1 1626090367 DWDOJSVRQCJCDM-UHFFFAOYSA-N 339.399 1.108 10 10 EDCE NCc1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)c(F)c1Br 2136612722 IBISIQYRDQTUCA-MBTKJCJQSA-N 328.185 1.214 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1csc(-c2ncccn2)n1 1633594811 AGSBXKSVIIBCGD-UHFFFAOYSA-N 328.353 1.941 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1coc(Sc2ncccn2)n1 1631435080 YAVYCDSSFZTGAX-UHFFFAOYSA-N 344.352 1.957 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC(NC(N)=O)CC2)c([N+](=O)[O-])c1 1772836760 DOTJMNPZPJIGNG-HYXAFXHYSA-N 348.359 1.418 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@H](C)[C@@H](C)CO)CC2)cc1 154529454 AAWCZIKRCIIPON-UONOGXRCSA-N 335.448 1.980 10 10 EDCE CCN(CC)c1ccc(CNCC(=O)N2CCC[C@@H](C(=O)O)C2)cc1 1857866436 LLWQOGNXRLSQKV-MRXNPFEDSA-N 347.459 1.946 10 10 EDCE CC(C)(C)OC(=O)NC[C@@]1(C(=O)NCCN=[N+]=[N-])CCCOC1 1965101861 ILQZXSHQBKYWSJ-AWEZNQCLSA-N 327.385 1.734 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]1CNC(=O)c1cccc(O)c1O 2006290936 AGQJQUURUDQAHC-GHMZBOCLSA-N 336.388 1.988 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](C1)[C@@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003168222 FQSUNUIMLAUIQQ-FTQJZPFOSA-N 336.432 1.755 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@](O)(C(=O)NCc2ccc(N)cc2)C1 2076959697 FINXJVLYUKUJGW-SFHVURJKSA-N 349.431 1.647 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2199527167 OMMZMMCTXLEQQK-HMUFECAUSA-N 341.249 1.789 10 10 EDCE O=c1c2c(ccn1Cc1cc(Br)sn1)CCNC2 2084078208 CSAABQRPLSKTMC-UHFFFAOYSA-N 326.219 1.761 10 10 EDCE Oc1ccc(Br)cc1CN[C@@H]1CCN(C2COC2)C1 2113267231 XFHFKNPMDOYYEK-GFCCVEGCSA-N 327.222 1.717 10 10 EDCE CCN(Cc1cccc(Br)c1O)[C@@H]1CC(=O)NC1=O 2114731902 IGLBAUCJFHNZRB-SNVBAGLBSA-N 327.178 1.392 10 10 EDCE CN(C)c1ccc(NC=C2C(=O)NC(=S)N(C3CC3)C2=O)cc1 2297059772 IAZWQWGLPITWNJ-UHFFFAOYSA-N 330.413 1.454 10 10 EDCE CC=CC[S@@](=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 2297494964 JODAQQYDPIKHAF-HSZRJFAPSA-N 336.457 1.669 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](N)C2COC2)c(O)c1Br 2352932604 OZQUKPHKOVKCHU-NSHDSACASA-N 329.194 1.053 10 10 EDCE CN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)Cc1cnccn1 177235627 GSBPJHCZEZNORT-UHFFFAOYSA-N 327.432 1.633 10 10 EDCE Cc1ccc(C(=O)N2CCCC[C@H]2CN2CCOCC2)c(O)c1O 179490804 RYHQCECQOFTLLX-AWEZNQCLSA-N 334.416 1.733 10 10 EDCE CCCN(CC(=O)OC)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 171709622 DYFUWGCRDYLQMT-RMKNXTFCSA-N 346.427 1.948 10 10 EDCE CO[C@@H](CN)C[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951993725 QSKCJQYPMXKCNN-QWHCGFSZSA-N 340.420 1.897 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCN3C)CC2)cc1 264810940 CCRTXLWYATZROE-GOSISDBHSA-N 346.475 1.028 10 10 EDCE COc1nnc(NC(=O)NCc2ccc(N3CCOCC3)cc2)s1 282984348 ZVNMZKFJZRMUOU-UHFFFAOYSA-N 349.416 1.705 10 10 EDCE CCN(Cc1cc(Br)ccc1O)C[C@@](C)(O)C(=O)OC 808731925 CYKIJIVWDUFCLM-CQSZACIVSA-N 346.221 1.901 10 10 EDCE CN(C)c1ccc([C@H](Cc2cn(C)nc2Br)NN)cc1 713825257 GHHACCPJJVBBBN-ZDUSSCGKSA-N 338.253 1.996 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](N)C(C)(C)C1 903735839 QCWUCOJQERWNLZ-OAHLLOKOSA-N 333.432 1.327 10 10 EDCE Cc1ccc(O)c([C@H](C)NCCS(=O)(=O)N=S(C)(C)=O)c1 903228409 ZJAMSAHCRAFRKP-NSHDSACASA-N 334.463 1.409 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)NC3=NCC(=O)N3C)c2C)cc1 912499388 HFRYZFGYJAINLB-UHFFFAOYSA-N 340.383 1.661 10 10 EDCE C[C@H](NC(=O)N[C@H]1CCN(C)[C@H]1C)c1ccc(N2CCOCC2)cc1 914400716 RWLCZMHGQKZSLK-MPGHIAIKSA-N 346.475 1.976 10 10 EDCE CCCN(C[C@H]1CCCCO1)C(=O)C(=O)NCCc1ccc(N)cc1 842237262 CBGOTZWXDINVPS-QGZVFWFLSA-N 347.459 1.735 10 10 EDCE COC(=O)c1cc2ccccc2c(CN2CC(=O)N[C@H](C)C2)c1O 840135082 QUDFQHSOHHHCSA-LLVKDONJSA-N 328.368 1.652 10 10 EDCE CCO[C@@H](CNC(=O)NCc1ccc(N2CC=CC2)cc1)CN(C)C 919918620 PCVIFOIOVGXRHD-SFHVURJKSA-N 346.475 1.829 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCNC[C@H]1C 842264672 BKNBZRFKBXXPLT-UKRRQHHQSA-N 333.432 1.245 10 10 EDCE CC[C@H]1CN(C(=O)NCCc2ccc(N)cc2)C[C@@]2(CCOC2)O1 841959698 OXUFCFAMNLJNPX-FUHWJXTLSA-N 333.432 1.791 10 10 EDCE Cc1[nH]nc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1C 856211685 ZAPLKCPNBZFGFU-UHFFFAOYSA-N 328.416 1.918 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCCCN3C(C)=O)C2)cc1 855229434 KIWIYZGABLKFRT-MAUKXSAKSA-N 345.443 1.791 10 10 EDCE CC(C)O[C@@]1(CS(=O)(=O)NCc2c(O)cccc2F)CCOC1 921451031 JEBMHBDASRGYLA-HNNXBMFYSA-N 347.408 1.535 10 10 EDCE COc1cc(N2CCN([C@@H]3CCCNC3=O)CC2)cc(OC)c1OC 759884046 AAORJGJJJVRCEX-CQSZACIVSA-N 349.431 1.113 10 10 EDCE Cc1cc(C(=O)OCCc2nnnn2C)c(C)n1-c1ccccn1 869344754 IBJXYKWMWRHRBS-UHFFFAOYSA-N 326.360 1.412 10 10 EDCE O=C(CC1CS(=O)(=O)C1)NCc1cc(Cl)cc(Cl)c1O 868358075 LNEFEQLERUDWNW-UHFFFAOYSA-N 338.212 1.750 10 10 EDCE COc1ccc(N2CCC(NC(=O)C[C@@H]3CCNC3=O)CC2)cc1 878633406 SKSWTAWRISKIJZ-ZDUSSCGKSA-N 331.416 1.306 10 10 EDCE CCc1c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)[nH]c(C)c1C(N)=O 773746163 YNTDWAHDKVXLLT-VIFPVBQESA-N 345.399 1.757 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](O)[C@H](C)O 871143720 RGXBAPSCMFVWTG-GUYCJALGSA-N 330.384 1.378 10 10 EDCE CCOc1ccc(CN[C@@H]2CCN(C3CCOCC3)C2=O)c(O)c1 776229756 CTWLWEUQKGHPJJ-MRXNPFEDSA-N 334.416 1.660 10 10 EDCE O=C1OCC[C@H]2CN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)CCN12 770394169 WTOILTWDVSFPJO-NSHDSACASA-N 341.751 1.980 10 10 EDCE CCS(=O)(=O)CCN(C)C(=O)c1cc2cc(O)c(O)cc2s1 897243843 WSYZSUIQMUPSTK-UHFFFAOYSA-N 343.426 1.819 10 10 EDCE O=C1NCC2(CCOCC2)[C@@H]1NCc1cc(Cl)c(F)cc1O 895768192 FZBSGPWATNJBKN-CYBMUJFWSA-N 328.771 1.570 10 10 EDCE CNC(=O)[C@@H](C)CN(C)Cc1c(C(=O)OC)n(C)c2ccc(F)cc12 894085233 NJSRWZGRWSWGAL-NSHDSACASA-N 349.406 1.918 10 10 EDCE C[C@@H]1C[C@]2(CCO1)CN(Cc1cc3c(cc1O)OC[C@@H]3O)C[C@@H](C)O2 797418380 RZZCQGYPNKNSDE-XBDAZTQTSA-N 349.427 1.976 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)c2c(Cl)cnn2C)c1 797447619 HEPWDYOXTQQHRM-UHFFFAOYSA-N 331.781 1.266 10 10 EDCE CNS(=O)(=O)c1cccc(NC(=O)c2cccc(O)c2O)c1C 1149655676 JIZKHXWQWFGROM-UHFFFAOYSA-N 336.369 1.567 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1cn(C(F)(F)CO)nn1 1165508221 NPBPMGWMOJHYSB-UHFFFAOYSA-N 332.694 1.109 10 10 EDCE C[C@@H](NC(=O)C(=O)N1CCC[C@@H](O)[C@H]1C)c1ccc(N(C)C)cc1 1331705595 OWTXBTZEDWVPTH-XJKCOSOUSA-N 333.432 1.302 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1=NN2CCCN=C2N1 1440716220 UVXLLCZPXBROPD-UHFFFAOYSA-N 340.431 1.224 10 10 EDCE Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N[C@H](C)c1ccccc1O 1454808849 YFXOXJYSUSDWAD-MRVPVSSYSA-N 338.385 1.740 10 10 EDCE CCS(=O)(=O)N(C)CC(=O)N[C@H](C)c1ccc(N(C)C)cc1 1538975551 JBAAPZVRIHLNJC-GFCCVEGCSA-N 327.450 1.211 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](O)C[C@H]2CO)c(Br)c1 2136084262 ZVGPQEIQFOHTKU-ZMLRMANQSA-N 330.222 1.824 10 10 EDCE NC(=O)CCN(Cc1ccccc1)C(=O)Cc1ccc(O)c(O)c1 1542586725 SXLBJAGDKSBQHF-UHFFFAOYSA-N 328.368 1.545 10 10 EDCE CCN1CCOC[C@H]1C(=O)N(C)CCNCc1ccc(OC)c(C)c1 1481248319 KCEOHVVFLLVDJU-KRWDZBQOSA-N 349.475 1.272 10 10 EDCE COC[C@@H](C)N[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1480069641 QVXCEZVKJGYTKO-IAQYHMDHSA-N 347.419 1.982 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCc2ccnn2C)cc1C 1716397842 XTWJTPJOQKDIPS-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE O=C(COCCNC(=O)c1ccccc1)NCc1cccc(O)c1O 1558161030 FMEJSXQUPRSWML-UHFFFAOYSA-N 344.367 1.161 10 10 EDCE Cc1cc(C(=O)NCc2c(O)cccc2O)c2c(C)nn(C)c2n1 1639289871 ZNTWBDBXSQFYSS-UHFFFAOYSA-N 326.356 1.926 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H]2CCN(C)C2)cc1C 1734353730 CNFTXWRMDBFBTM-DOTOQJQBSA-N 333.476 1.892 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)Cc2cccnc2)cc1C 1734362405 BFLSLUWMLXDQOD-QGZVFWFLSA-N 343.427 1.208 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@@H]2CCCNC2=O)cc1C 1662249745 PJHKVVHTAPDYEL-DZGCQCFKSA-N 333.432 1.124 10 10 EDCE O=C(NC1CCN(C(=O)C(F)(F)F)CC1)c1cc(O)c(O)c(O)c1 169859600 RZGRNJWQZYELEI-UHFFFAOYSA-N 348.277 1.087 10 10 EDCE Nc1ccc(Cc2ccc(NC(=O)CC[C@H](N)C(=O)O)cc2)cc1 1866016139 LLJPOLNOQAZBLY-INIZCTEOSA-N 327.384 1.990 10 10 EDCE CO[C@@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)C1CN(C(=O)OC(C)(C)C)C1 2004773046 BYCUQTOCAXURTE-IXPVHAAZSA-N 340.420 1.134 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@@H]2[C@@H](O)CO)cc1Br 2146330647 ZNSWPFXGXQAXPV-FZQKWOKYSA-N 345.237 1.027 10 10 EDCE CCCN(Cc1cc(Br)ccc1O)[C@H]1CC(=O)NC1=O 2171200151 CXMTXDGSNFVVJC-NSHDSACASA-N 341.205 1.782 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3Cc4c[nH]nc4C[C@H](C)C3)c2n1 2064988337 UMOKOPBSPOQQSK-VIFPVBQESA-N 326.360 1.301 10 10 EDCE C[C@@H]1C[C@H]1N(CCO)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2167110379 VRVYDAPCQZOJTC-TWPQKTAQSA-N 341.205 1.642 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)c(Br)c1 2178087511 RMTNZZXWORIHPG-CGEWXTDFSA-N 342.233 1.946 10 10 EDCE COCC(=O)N1CCN(c2ccc(CO)c(Br)c2)CC1 2182581200 CZVRJNPBPVPOGX-UHFFFAOYSA-N 343.221 1.236 10 10 EDCE CC(C)(C)OC(=O)N1CCN(NC(=O)CCc2ccc(N)cc2)CC1 2044213301 UIBAQSMMQLKEKF-UHFFFAOYSA-N 348.447 1.785 10 10 EDCE C[C@]1(O)CCN(c2cc(Br)c(CN)cc2F)C[C@]1(C)O 2194602099 ZYRVKVQBXOCMNC-KBPBESRZSA-N 347.228 1.759 10 10 EDCE COc1ccc(N2CC(O)(CNC(=O)OC(C)(C)C)C2)c(F)c1 2210888379 DJEFWDXOMYRUGA-UHFFFAOYSA-N 326.368 1.910 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213586273 ABSHRHKSYDFOGK-RHYQMDGZSA-N 339.396 1.704 10 10 EDCE CNC(=O)[C@@H](C)N(C)Cc1c(Br)ccc(OC)c1O 2227780265 QNXKGAXNNFRAMA-MRVPVSSYSA-N 331.210 1.730 10 10 EDCE CNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1c1ccc(N)cc1 2320236363 XRNGOTQOFRTBJT-OAHLLOKOSA-N 348.447 1.831 10 10 EDCE COc1ccc(N(CC(=O)NCCNC(C)=O)C(C)C)cc1F 170653320 ZEOOPSXPOBRUQS-UHFFFAOYSA-N 325.384 1.301 10 10 EDCE COc1ccc(N2CCN(C=O)CC2)cc1NC(=O)NCC(C)C 62275225 QXYKRHNVMLDSGK-UHFFFAOYSA-N 334.420 1.751 10 10 EDCE C[C@H](NCCCNS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 121121420 PGDGULBFAVBTPQ-AWEZNQCLSA-N 341.477 1.113 10 10 EDCE CCn1nncc1/C=C1\CCn2c1nc1ccc([N+](=O)[O-])cc1c2=O 416395119 YPEXAWMJMZGKLI-JXMROGBWSA-N 338.327 1.860 10 10 EDCE CC(C)NC(=O)C(=O)N1CCN(Cc2cc3c(cc2O)CCC3)CC1 194568591 NVISQSCMPMMXMJ-UHFFFAOYSA-N 345.443 1.050 10 10 EDCE COCCn1ccc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)n1 190393429 FWCVBIOHSJRXJD-UHFFFAOYSA-N 344.415 1.501 10 10 EDCE COc1cc2c(c(OC)c1OC)[C@@H](CCN1CCNCC1)CN2C 527417191 JTBSHWFXVWHRPD-ZDUSSCGKSA-N 335.448 1.541 10 10 EDCE CCNC(=O)N1CC[C@@H](NCc2ccc([N+](=O)[O-])c(OC)c2O)C1 278104157 AJHSYWCWHVAMIG-LLVKDONJSA-N 338.364 1.202 10 10 EDCE CC(=O)NC1CN(c2ccc(/C=C/C(=O)O)cc2Br)C1 388314215 FXFKZGVNIVWZDA-HWKANZROSA-N 339.189 1.872 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](C3CC3)C2)cc1F 803663867 COLAJPRALONJLR-MRXNPFEDSA-N 349.406 1.145 10 10 EDCE COC[C@]1(CO)C=CCN1c1cc(Br)c(CN)cc1F 2379823541 VBDMDZUFSPXUBH-CQSZACIVSA-N 345.212 1.801 10 10 EDCE O=S(=O)(C[C@H]1CNCCO1)Nc1cc(Cl)c(O)c(Cl)c1 722221846 QINFUHBNIREMOS-MRVPVSSYSA-N 341.216 1.429 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](C)c1cncnc1 819698069 IQIPRVSXSGDXNW-CYBMUJFWSA-N 343.383 1.878 10 10 EDCE C[C@H](NC[C@@]1(CO)COCCN1C)c1cccc(C(F)(F)F)c1O 903281553 YHNXCJAGMUIVAQ-XHDPSFHLSA-N 348.365 1.755 10 10 EDCE Cc1cc(C)c(O)c(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1 842635073 ZMFABVNFAGQTQF-INIZCTEOSA-N 325.430 1.399 10 10 EDCE C[C@@H]1CCC[C@@H](C)N1CCNC(=O)C(=O)NCCc1ccc(N)cc1 842238604 UHTHQRQRYFKUOO-HUUCEWRRSA-N 346.475 1.307 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(C2CC2)C(=O)C1 748635951 UKQKKGMKVMAONJ-UHFFFAOYSA-N 330.432 1.577 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@]23C[C@H]4C[C@H](C(=O)N2)[C@H]3C4)c1 845835136 ZKVSPFKBHHOPBN-LIPSQFKGSA-N 330.384 1.493 10 10 EDCE Cc1cc(Cl)cc(CN2CN(CCN(C)C)C(=O)[C@@H]2C)c1O 843428895 ODKMOBVRYJFUAK-LBPRGKRZSA-N 325.840 1.906 10 10 EDCE CN(C)CCCN(C)CCNC(=O)NCc1ccc(N(C)C)cc1 853244402 LGTTTXUYDJQUTO-UHFFFAOYSA-N 335.496 1.435 10 10 EDCE NC1(CNC(=O)NCc2c(O)ccc3c2CCCC3)CCOCC1 861669296 OBRICIBSMVWQNH-UHFFFAOYSA-N 333.432 1.578 10 10 EDCE COC1CCN(c2ccc(CN3CCN(C)[C@@H](CO)C3)cc2)CC1 931400175 UPPBRQZTFAASBQ-GOSISDBHSA-N 333.476 1.410 10 10 EDCE COC[C@@H](C)OC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 866564086 VPHYVXVWFSNSQQ-HIFRSBDPSA-N 349.431 1.649 10 10 EDCE CC[S@](C)(=O)=NS(=O)(=O)N[C@@H](C)c1ccc(N(C)C)cc1 867125986 RRCDZUGNVJJLMM-YBTHPKLGSA-N 333.479 1.766 10 10 EDCE Nc1ccc(Cn2cccc(OCCN3CCOCC3)c2=O)cc1 57874941 XKYPQEHSWLJMGJ-UHFFFAOYSA-N 329.400 1.190 10 10 EDCE NC(=O)c1ccccc1OCC(=O)OCC(=O)c1ccc(O)c(O)c1 782563539 CJEXAZKOXCNOHM-UHFFFAOYSA-N 345.307 1.002 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CC[C@H](C(N)=O)C1 895495537 RTOVLBYHQDZGTA-JKSUJKDBSA-N 345.443 1.383 10 10 EDCE COc1ccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])s2)c(O)c1 795357645 HSDHZHMHEMLART-UHFFFAOYSA-N 344.370 1.849 10 10 EDCE CC1(F)CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 792045324 RMVJKNHRUWHKME-CQSZACIVSA-N 348.422 1.642 10 10 EDCE Cc1cc(C(=O)N[C@@H]2CC[C@@H](O)[C@@H](O)C2)c(C)n1-c1ccccn1 1304145032 YQFLXXGXSGPHQI-BMFZPTHFSA-N 329.400 1.493 10 10 EDCE Cc1nnc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)s1 1303852148 FCIJUSXUFOYHNP-UHFFFAOYSA-N 334.401 1.149 10 10 EDCE Cn1ccnc1C(NC(=O)NCc1ccccc1O)c1nccn1C 1231210159 DAYQSSRXBKBOCK-UHFFFAOYSA-N 340.387 1.448 10 10 EDCE CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCc1c(O)cccc1O 1178904889 BVFHDNMHGKZHLT-INIZCTEOSA-N 340.379 1.687 10 10 EDCE C[C@H](NCc1nnc(Br)n1C)c1c(O)cccc1O 2121515027 SINNOJJSDFCKNI-ZETCQYMHSA-N 327.182 1.840 10 10 EDCE OCc1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)c(Br)c1 2121593421 QACIMTBRRUHZEC-SUNKGSAMSA-N 328.206 1.385 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3C=CCCC3)C2)cc1 1350766498 FSQVSLKYCUQYPF-GJZGRUSLSA-N 343.427 1.615 10 10 EDCE Cc1cc(CCNC(=O)Cn2nnc(N)n2)c(C)n1-c1ccccc1 1454477728 SZDYSKPMALOJNF-UHFFFAOYSA-N 339.403 1.022 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1=C[S@](=O)CCC1 1540536590 KGWQFTBAAJQZDS-XMMPIXPASA-N 348.468 1.908 10 10 EDCE CO[C@H](C)C(=O)N(C)[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1718173526 VFSYLMMQFKFFQP-GHMZBOCLSA-N 349.391 1.461 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)Cc2cncn2C)cc1C 1496207582 QSADWBXWAPEHBX-OAHLLOKOSA-N 344.459 1.916 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@H]1CCC2(CCOCC2)[C@H]1O 1634026855 HFFBIXFJHVVKNJ-DYVFJYSZSA-N 335.400 1.324 10 10 EDCE O=C(NC[C@]1(Br)CC1(F)F)c1cc(O)c(O)c(O)c1 2137776369 HMZWBBWJDXZVFJ-SNVBAGLBSA-N 338.104 1.706 10 10 EDCE C[C@@H](O)CCCNC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1569041073 ZOMJPIANUVONNO-VXGBXAGGSA-N 335.408 1.718 10 10 EDCE COC[C@@H](C)N[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1731493172 PUHGNOCTOKJZEU-HONMWMINSA-N 333.392 1.734 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@H](C)n2cncn2)cc1C 1732685444 OEALVUVMKOSNQV-GJZGRUSLSA-N 345.447 1.841 10 10 EDCE Cc1cc(S(N)(=O)=O)c(C)cc1NC(=O)c1cccc(O)c1O 1651569415 YZCLAVUEPJUJHE-UHFFFAOYSA-N 336.369 1.614 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@H](O)[C@H]2CF)c(Br)c1 2140662525 MIRHUDLBPKEIJZ-FRRDWIJNSA-N 333.201 1.048 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)OC[C@@H]2C)c(Br)c1 234378891 BQBNBIHVHZPABB-JQWIXIFHSA-N 329.238 1.755 10 10 EDCE COc1ccc(Br)c(CN[C@H](C)C(=O)NC2CC2)c1O 1964609845 KXUPASVQGWECPD-MRVPVSSYSA-N 343.221 1.920 10 10 EDCE COCCNCc1ccc(N2CC[C@H]2C(N)=O)c(Br)c1 2145598284 FFCUEDOPUJHRJD-ZDUSSCGKSA-N 342.237 1.249 10 10 EDCE COCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003169970 NRWGYXPIKBJVPH-JHJVBQTASA-N 342.436 1.572 10 10 EDCE CN(C)C(=O)OC1CN(c2cc(Br)c(CN)cc2F)C1 2146488571 ROHOIUWFQUMQIL-UHFFFAOYSA-N 346.200 1.934 10 10 EDCE CC(C)(C)OC(=O)NC1[C@@H]2CN(C(=O)Cc3ccc(N)cc3)C[C@@H]12 2000278206 HZOHNLLBBMZQPI-ZIAGYGMSSA-N 331.416 1.793 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010404918 VPCDVPLSORRUBY-WOPDTQHZSA-N 341.412 1.952 10 10 EDCE Cc1nc2n(n1)CCN(c1cc(Br)c(CN)cc1F)C2 2170405129 ANODAWXHBQXQDD-UHFFFAOYSA-N 340.200 1.967 10 10 EDCE CNC(=O)Cn1cc(NCc2ccc(Br)cc2O)cn1 691450229 KEXVWLJOCPAXTC-UHFFFAOYSA-N 339.193 1.709 10 10 EDCE NCc1ccc(N2CCC3(CC2)CNC(=O)N3)cc1Br 2177692932 BVMGKPBFCZRHNM-UHFFFAOYSA-N 339.237 1.560 10 10 EDCE NCc1cnn(Cc2c(O)cccc2F)c1I 2070409709 UXJLNCLDPWRDRG-UHFFFAOYSA-N 347.131 1.839 10 10 EDCE O=C1C[C@H]2CCN(c3ccc(CO)c(Br)c3)C[C@@H]2N1 2088803496 JAKGKTKORZYMCW-RNCFNFMXSA-N 325.206 1.656 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H](N(C)C)C2)cc1Br 2089926828 NJKURMXCQGZJMC-IIMNLJJBSA-N 329.238 1.614 10 10 EDCE CN(CCN1CCOC1=O)c1ccc(CO)c(Br)c1 2114622003 KZIDGOIINVRDCR-UHFFFAOYSA-N 329.194 1.830 10 10 EDCE CN1CCN(c2cc(Br)c(CN)cc2F)[C@@H](CCO)C1 2202819767 CTIFAFYIXGTOOW-NSHDSACASA-N 346.244 1.550 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCOC[C@@H]2CO)c1O 2236045681 SGYMLJNJLXFNCO-CABZTGNLSA-N 346.221 1.650 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C=Cc1ccnn1C 2296968052 ZLMQXUJESQEXJQ-UHFFFAOYSA-N 340.427 1.929 10 10 EDCE COc1ccc(Br)c(CNCC[C@@H](O)CCO)c1O 2351739542 JVELOWAOPBOKQW-SECBINFHSA-N 334.210 1.386 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2355340220 NRYWULHGYCXGKD-UDQBKAKJSA-N 342.233 1.823 10 10 EDCE C[C@H](NC=C1C(=O)NC(=S)NC1=O)c1ccc2ccccc2c1 72680440 HCUPRYVVNOFWTQ-JTQLQIEISA-N 325.393 1.905 10 10 EDCE c1cnc(N2CCN(c3ccc(CN4CCOCC4)cc3)CC2)nc1 71702492 OZWYHTAGZYKDHX-UHFFFAOYSA-N 339.443 1.635 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)N2C[C@H](O)C[C@H]2CO)c1C 366625921 ALCQXDZDPQXBBP-JKSUJKDBSA-N 328.412 1.970 10 10 EDCE CC(C)c1nn(C)cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 281052506 PAJFHDLZACKKOS-UHFFFAOYSA-N 346.387 1.252 10 10 EDCE CC(=O)C(=O)COC(=O)c1nnn(-c2ccc(F)c(Cl)c2)c1C 808516468 KBLCDARRFFIHGK-UHFFFAOYSA-N 339.710 1.683 10 10 EDCE CC(=O)C(=O)COC(=O)C1(c2cncc(Br)c2)CC1 808548286 IKJWDQFDKXOEPG-UHFFFAOYSA-N 326.146 1.577 10 10 EDCE CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)OCC(=O)C(C)=O 808517901 RFYFLFZYIOGVOQ-MLGOLLRUSA-N 345.395 1.687 10 10 EDCE CC(=O)C(=O)COC(=O)COc1ccc(Oc2ccccn2)cc1 808493374 BPGYYILIQWTDFP-UHFFFAOYSA-N 329.308 1.954 10 10 EDCE O=C1CC[C@@H](C(=O)NCc2cccc(Br)c2O)CCN1 816496497 MCLBJWGMSNPSSC-SECBINFHSA-N 341.205 1.687 10 10 EDCE CCn1cc(-c2nn(C)cc2C(=O)N2CCCn3nccc32)cn1 488717111 KESIIOJCEGCORH-UHFFFAOYSA-N 325.376 1.551 10 10 EDCE CNC(=O)N1CCN(c2ccc([C@@H](C)N)cc2Br)CC1 722153804 SKZASOWHMDNALO-SNVBAGLBSA-N 341.253 1.930 10 10 EDCE CCOC(=O)C(=O)[C@H](N)c1cc([N+](=O)[O-])cc(Br)c1O 725426828 LMIZNRFIPBYCGI-MRVPVSSYSA-N 347.121 1.195 10 10 EDCE CNCc1ccc(N2CCN(C(=O)NC)CC2)c(Br)c1 722193983 MTLMGYKMNFXVKD-UHFFFAOYSA-N 341.253 1.630 10 10 EDCE CC[C@@H]1OCC[C@H]1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 829296637 LKQONQVGYUIWSN-MSOLQXFVSA-N 331.460 1.870 10 10 EDCE Cc1cc(CC(=O)NC[C@]2(O)CCOC2)c(C)n1-c1ccccc1 831186247 MBCPWYWIEJAWON-LJQANCHMSA-N 328.412 1.904 10 10 EDCE Oc1cc2c(cc1CN1CC[C@H](Nc3ncccn3)C1)[C@H](O)CO2 842617782 WGUZXSRCLNTAKN-SWLSCSKDSA-N 328.372 1.294 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3(O)CCCC3)C2)cc1 854301683 SDRMKEQWSGWCMZ-AWEZNQCLSA-N 333.432 1.878 10 10 EDCE C[C@@H](NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@@H]1[C@H]2CN[C@H]1C2 925777334 MMRUWCNENYOLSQ-VLDUQVBPSA-N 342.487 1.474 10 10 EDCE O=CN1CCC[C@H]1C(=O)NCc1cc(Br)ccc1O 854442516 SVPYQRDURDERBO-NSHDSACASA-N 327.178 1.392 10 10 EDCE C[C@@H](CN(C)CCCN(C)C)NC(=O)/C=C\c1ccc(O)c(O)c1 855346338 XLFZQWWKQWZVAO-LEJCZOIISA-N 335.448 1.499 10 10 EDCE COCCOC1CN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 854298866 IXLASWVNKJZLGL-AWEZNQCLSA-N 349.431 1.331 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@H]2CC[C@@H](C)S(=O)(=O)C2)c1 853736639 ISMJKCZJXBKTBN-PWSUYJOCSA-N 342.417 1.166 10 10 EDCE C[C@H](CO)[C@H](C)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 853776556 RMEYXXMQCQERGF-KGLIPLIRSA-N 335.448 1.464 10 10 EDCE CCO[C@@H]1CN(Cc2ccc(Br)cc2O)C[C@H]1CN 691385567 GUWOHGWWMZSVRE-BXUZGUMPSA-N 329.238 1.950 10 10 EDCE COc1cc(Br)cc([C@@H](C)N[C@@H]2COCC[C@H]2O)c1O 866497473 MNUFBLSMUIZACC-GGZOMVNGSA-N 346.221 1.964 10 10 EDCE CC[S@](C)(=O)=NS(=O)(=O)N(C)Cc1ccc(N(C)C)cc1 866418790 UGIBTJPDHKTFBH-FQEVSTJZSA-N 333.479 1.547 10 10 EDCE COc1ccc(N2CCN(Cc3nnnn3C(C)(C)C)CC2)cc1F 766797606 SULUAUALXHUDQN-UHFFFAOYSA-N 348.426 1.898 10 10 EDCE CN1CCn2nc(N3C(=O)CN(Cc4ccccc4O)C3=O)cc2C1 864576458 XQDRVNZKKMDJQQ-UHFFFAOYSA-N 341.371 1.003 10 10 EDCE C[C@@H](NC(=O)CN1C(=O)NC(=O)C1(C)C)c1ccc(N(C)C)cc1 775406717 ZQKPBEMOJLZINA-LLVKDONJSA-N 332.404 1.260 10 10 EDCE CS(=O)(=O)N[C@H]1CCN(c2ccc(CO)cc2Br)C1 702982980 CNNMPIPRVNTMQJ-JTQLQIEISA-N 349.250 1.069 10 10 EDCE C[C@@H]1CN(c2ccc(CNC(=O)[C@H]3C[C@H]3C(N)=O)cc2F)C[C@@H](C)O1 1136310943 BHSIMQZWPPSCMC-OXHZDVMGSA-N 349.406 1.177 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1C[C@H](C)CO1 1153664235 RRWCAGBHKUYPFA-ITDIGPHOSA-N 337.372 1.113 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@@H](OCc2ccccn2)C1 1150052766 KCHHTTVAALOQEP-OAHLLOKOSA-N 328.368 1.853 10 10 EDCE CN1CCN(c2cc(C(=O)NCc3cccc(O)c3O)ccn2)CC1 1347543271 ZUAVUYDFKSGDMX-UHFFFAOYSA-N 342.399 1.175 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1C[C@H]2CCC[C@@H]21 1354610949 AAMFFAFOWLKHAV-BPQIPLTHSA-N 339.439 1.984 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2cncc(F)c2)cc1C 1507185996 MZTUFNKPMUUUCY-INIZCTEOSA-N 347.390 1.418 10 10 EDCE COCC(=O)NCCC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1287244726 AQTTZOQPKMNREP-NSHDSACASA-N 349.391 1.510 10 10 EDCE O=C(O)[C@H]1C[C@@H](O)CCN1Cc1c(O)cccc1Br 2136386162 GUVCFYCHZYQVKF-GZMMTYOYSA-N 330.178 1.565 10 10 EDCE O=C(CCn1cnc2ccccc2c1=O)NCc1ccc(O)cc1O 1469159479 KDTKNMUBUBHERQ-UHFFFAOYSA-N 339.351 1.514 10 10 EDCE N[C@H]1C(=O)Nc2cc(N(CCO)C3CCC3)c(Br)cc21 228395583 SFGIKJHVHRARES-CYBMUJFWSA-N 340.221 1.752 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCc3cnc(N)nc3C2)cc1 1557516492 JUGFMMXCTFOZTO-UHFFFAOYSA-N 325.332 1.420 10 10 EDCE CCOC(=O)Cn1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)n1 1557274446 AZGIAJWYHYTQMD-XQRVVYSFSA-N 331.328 1.509 10 10 EDCE Cn1ccnc1C(NC(=O)c1cccc(O)c1O)c1nccn1C 1633213729 BMANOVOXBQWKJF-UHFFFAOYSA-N 327.344 1.084 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCn2cncn2)cc1C 1568980514 IIKLQOICMXQKIP-CQSZACIVSA-N 331.420 1.280 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@@H](OCc2ccncc2)C1 1632814522 HLVIUXLUXKUCCK-OAHLLOKOSA-N 328.368 1.853 10 10 EDCE COC(=O)[C@]1(NC(=O)c2cc3cc(O)c(O)cc3s2)C[C@@H](O)C1 1636537715 COYQAJBLUQMVCQ-HWJBBNHMSA-N 337.353 1.109 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2[nH]c(C)nc2C)cc1C 1497056274 BMVWITXOPOSQEB-HNNXBMFYSA-N 346.431 1.224 10 10 EDCE CN(C)[C@@]1(C(=O)NCc2ccc(O)c(O)c2)COc2ccccc2C1 1630272917 GZZGUWLILGHRBF-LJQANCHMSA-N 342.395 1.650 10 10 EDCE COc1ccc(CN[C@@H]2C[C@@H](C)N(C(=O)CNC(C)=O)C2)cc1C 1725573213 HMVNVTKLHVRAHS-CZUORRHYSA-N 333.432 1.219 10 10 EDCE Cc1ccc(N2CC[C@H](NC(=O)Cc3ccc(O)c(O)c3)C2=O)cc1 1633837865 KJBKXOBJOQDVJR-HNNXBMFYSA-N 340.379 1.870 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)Cn2ccnc2)C2CC2)cc1C 1731412372 APEWAWNCPOQSMC-KRWDZBQOSA-N 342.443 1.885 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CN3CCN2C[C@H]3C)cc1 1587459628 DHLGGORGMVKIRF-VQIMIIECSA-N 344.503 1.880 10 10 EDCE CCCC(=O)N[C@H]1[C@@H]2CN(C(=O)c3ccc(N=NC(N)=O)cc3)C[C@@H]21 1758740897 PYAJYVASPQCZHU-NHAGDIPZSA-N 343.387 1.836 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCc2cnc[nH]2)cc1C 1690584378 LPXQIHVGERRWKO-CQSZACIVSA-N 330.432 1.954 10 10 EDCE CCOCc1nnc(N(C)Cc2ccccc2O)n1CC1(O)CC1 1696251387 LTPZUUHCTGSXHN-UHFFFAOYSA-N 332.404 1.682 10 10 EDCE CCCNCc1ccc(N2C[C@H](O)[C@@H](O)C2)c(Br)c1 233113893 FMFHRACCRIQWSC-KBPBESRZSA-N 329.238 1.491 10 10 EDCE C[C@H](NC(=O)C(=O)N1CC[C@@H]1C)c1ccc(N2CCOCC2)cc1 1119436569 CCHUFMBASAAYSZ-KBPBESRZSA-N 331.416 1.321 10 10 EDCE Cc1c(OCC(=O)c2ccc(O)c(O)c2)c(=O)ccn1[C@@H](C)C(=O)O 1857918678 CRJDLUYZMNCPSZ-JTQLQIEISA-N 347.323 1.475 10 10 EDCE O=C(O)[C@@H]1C[C@@H](NCc2c(O)cccc2Br)CCO1 1880033279 FZLZJWBTNFFWTA-UFBFGSQYSA-N 330.178 1.877 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1 1985099883 BMQIGDBOMLQKPB-NSHDSACASA-N 327.385 1.781 10 10 EDCE CO[C@H]1C[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 2010394170 BAJFXMOSDZHDMV-PWSUYJOCSA-N 339.396 1.780 10 10 EDCE C[C@@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C[C@@H](C)N1 2053909252 DQBNZGJLRZXQMP-HZPDHXFCSA-N 329.444 1.745 10 10 EDCE NCc1ccc(N2CCS[C@H](CO)C2)c(F)c1Br 720067529 LLGQFRFPYZZVPH-VIFPVBQESA-N 335.242 1.961 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1COCCN1C(=O)Cc1ccc(N)cc1 2044618692 FCBIFDRGJGFXII-OAHLLOKOSA-N 349.431 1.563 10 10 EDCE Cn1c(=O)c(Nc2ccc(N)cc2)c(N)n(Cc2ccccc2)c1=O 2064498392 SCGAPUPWXQMNNJ-UHFFFAOYSA-N 337.383 1.503 10 10 EDCE CNC1(C(N)=O)CN(Cc2cc(Cl)cc(Br)c2O)C1 2109489846 VLXBJJMCRUZOTJ-UHFFFAOYSA-N 348.628 1.067 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])C1 2213593569 SKEPTMALXFFJTF-UTUOFQBUSA-N 339.396 1.970 10 10 EDCE COCCN(CCO)c1ccc(OC)c(Br)c1OC 2226548164 ZQGZHHWFPHKTCM-UHFFFAOYSA-N 334.210 1.911 10 10 EDCE NCc1cc(F)c(N2CCC[C@@H]3CNC(=O)[C@H]32)cc1Br 2279274696 ILYGOOXBKCCPRZ-OQPBUACISA-N 342.212 1.762 10 10 EDCE CC(=O)C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1 2245899363 YKXMYWFRVPQFNL-NOZJJQNGSA-N 339.310 1.837 10 10 EDCE O=C1NC(=S)SC1=CN1N=C(c2ccccc2)C[C@@H]1C(=O)O 2294778284 HYQCCICNCXPUNR-SNVBAGLBSA-N 333.394 1.539 10 10 EDCE Cc1ccc(N2C(=O)NC(=O)C(=CNCCCN(C)C)C2=O)cc1 2296331099 PWXJHQJMCYETLW-UHFFFAOYSA-N 330.388 1.003 10 10 EDCE CCCN(C[C@@H](C)O)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2288047019 FBGGYXCHTSFMMY-AMIZOPFISA-N 342.237 1.998 10 10 EDCE COc1cccc(C=C2SC(N3CCN(C)CC3)=NC2=O)c1OC 2296659664 CXUFGPOVUYHDJP-UHFFFAOYSA-N 347.440 1.922 10 10 EDCE O=[N+]([O-])c1c(O)nc(O)nc1C=Cc1ccc(N2CCOCC2)cc1 2297368270 PFDIVRLXNHSQJZ-UHFFFAOYSA-N 344.327 1.803 10 10 EDCE COC(=O)c1ccc(C=C2SC(=S)N(NC(C)=O)C2=O)cc1 2314735737 AFXLAAOVBJHHTA-UHFFFAOYSA-N 336.394 1.726 10 10 EDCE C[C@@H](O)[C@H](C(=O)O)N1C(=O)C(=Cc2ccsc2)SC1=S 2323823468 KZNJOTIHVBKYSP-HZGVNTEJSA-N 329.424 1.783 10 10 EDCE Cc1ccc(CN[C@@H]2CCS(=O)(=O)C2)c(O)c1Br 2327800141 GQSZKRUTYRLULD-SNVBAGLBSA-N 334.235 1.740 10 10 EDCE Cc1ccc(CNc2nnc(O)nc2O)c(O)c1Br 2352940812 IPMNMWLLVNUCTA-UHFFFAOYSA-N 327.138 1.671 10 10 EDCE COCCNC(=O)CNCc1ccc(C)c(Br)c1O 2352954259 XSAHJVLYYFYFJF-UHFFFAOYSA-N 331.210 1.315 10 10 EDCE CCN(CC)C(=O)CN1CCCN(Cc2ccc(OC)cc2O)CC1 129261571 MISNMTWASXVNBM-UHFFFAOYSA-N 349.475 1.777 10 10 EDCE CN1CCN(C2=NC(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)S2)CC1 33299860 MVQNHKGAFFBNKR-JLHYYAGUSA-N 332.385 1.813 10 10 EDCE COc1ccc(N2CCN(c3cncc(OCCO)n3)CC2)cc1 130680225 LCDGPHASOVJWKU-UHFFFAOYSA-N 330.388 1.183 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CSC(=O)N3)CC2)cc1F 267995352 RXAMJUYBPKWOGY-LBPRGKRZSA-N 339.392 1.308 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@]23[C@H]4C(=O)[C@H]5[C@H]6C[C@@H]([C@@H]52)[C@@H]3[C@H]64)cc1F 800471132 PGLCMPBFRMYYQX-FSBZEHLASA-N 340.398 1.835 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N(C)CC1(CO)CC1 298027428 NCQAVICJLFPSAX-UHFFFAOYSA-N 348.443 1.752 10 10 EDCE C[C@@H](NC(=O)C(=O)N1CCC2(CCN2)CC1)c1ccc(N(C)C)cc1 817910658 XQLLVUWFNHWDCU-CQSZACIVSA-N 344.459 1.284 10 10 EDCE CCN1CC[C@@H](N(CC)C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 826707420 UFHOPKZMQLSBSV-QGZVFWFLSA-N 346.475 1.312 10 10 EDCE C/C(=C/C(=O)NCc1ccc2cccnc2c1O)CN1CCOCC1 911261558 INMCQBXUPGVQIX-KAMYIIQDSA-N 341.411 1.835 10 10 EDCE Cc1cnc(C)c(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 845946000 IAUKCLNMUKRLKH-LLVKDONJSA-N 343.383 1.796 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)CS1(=O)=O 855699960 DLLRFQNTWXHNLL-BABHQGDISA-N 325.386 1.193 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])n3C)C2)cc1 855228766 GCXIDPNBVMMGGM-LBPRGKRZSA-N 344.371 1.951 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3noc(C)n3)C2)cc1 852143786 HRJPOIBVFAXOQI-GFCCVEGCSA-N 331.376 1.465 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCN(C)C(=O)[C@@H]3C)C2)cc1 852451322 HXCGKUYLBPYWAK-KBPBESRZSA-N 346.431 1.146 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCC[C@@H](N)C(C)C 851692342 ZXZDWFIFBFVTHK-OAHLLOKOSA-N 335.448 1.620 10 10 EDCE CN1CCC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1=O 856214897 GBXARJCCMXYCRD-KRWDZBQOSA-N 345.443 1.132 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(N2CCCOCC2)CC1 861984542 GWWRSNVLMSQXJX-HWKANZROSA-N 346.427 1.824 10 10 EDCE COC(=O)[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)[C@H]1C 786813670 LYHFWPMUQVLSTO-IUCAKERBSA-N 335.316 1.314 10 10 EDCE COCCN1CCC[C@H]1CNC(=O)NCc1ccc(OC)cc1O 792950066 GRVOEQGOCNPKEZ-AWEZNQCLSA-N 337.420 1.311 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN([C@H]2CCCC[C@H]2O)CC1 1150771314 SKRJBIRBUTVYFR-JKSUJKDBSA-N 348.443 1.524 10 10 EDCE CN(C1COC1)C1CN(c2ccc(CO)c(Br)c2)C1 2116487710 ILJJCTCFRZGQGA-UHFFFAOYSA-N 327.222 1.461 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCC[C@@](O)(C2CC2)C1 1330351438 ARFQATCSJYJGKS-SFHVURJKSA-N 332.400 1.114 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1C[C@H]1C1CC1 1340545308 SFEYPKPVBKHJRV-DLBZAZTESA-N 343.427 1.054 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)Cc2ccc[nH]2)cc1C 1268334680 LFGBUYBOJNEFPO-MRXNPFEDSA-N 331.416 1.141 10 10 EDCE CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 1350711113 JEVWPIQUOUUHMM-WKILWMFISA-N 345.443 1.369 10 10 EDCE CN1CCN(c2ccc(C=CC(=O)O)c(Br)c2)CC1=O 1911887625 CMLKFIIBMIPZMF-UHFFFAOYSA-N 339.189 1.825 10 10 EDCE Cc1nc(CCn2c(C)nnc2N(C)Cc2ccccc2O)n[nH]1 1511560447 MCOFQHCOHVCYQI-UHFFFAOYSA-N 327.392 1.598 10 10 EDCE CC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)Cc3ccc(O)c(O)c3)[C@H]2C1 1298839098 HRGUBWVEIVHLIH-SOUVJXGZSA-N 332.400 1.404 10 10 EDCE C[C@@H](O)[C@H](O)CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1612667013 JLRRZNCTGGIKPQ-BDJLRTHQSA-N 330.340 1.979 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)C#CC2CC2)cc1 1703174957 WLEOWCICPRWYQX-UHFFFAOYSA-N 327.344 1.108 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)Cc2cncn2C)cc1C 1700423426 AHHPSQYVVMSDRZ-CABCVRRESA-N 344.459 1.963 10 10 EDCE C[C@@](CO)(NC(=O)/C=C/c1ccc(O)c(O)c1)c1ccc(O)cc1 1627650266 AINMORNXPLHGLA-NUTIFNJFSA-N 329.352 1.841 10 10 EDCE Nc1c(C(=O)NCc2ccc(O)c(O)c2)cnn1Cc1ccccc1 1622664156 IYOCWTAXLKRROT-UHFFFAOYSA-N 338.367 1.855 10 10 EDCE O=C(Cc1cccc(F)c1)NCCNC(=O)Cc1ccc(O)c(O)c1 1627764657 BNRNMWRMGZIYJI-UHFFFAOYSA-N 346.358 1.255 10 10 EDCE CC[C@@H](F)C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1491733839 AAXRYVALYIANLO-GFCCVEGCSA-N 337.355 1.833 10 10 EDCE CCCC(=O)NC[C@H](C)N(C)Cc1nnnn1-c1ccc(OC)cc1 1725157718 RTGXXJUSZLKBFX-ZDUSSCGKSA-N 346.435 1.408 10 10 EDCE CO[C@H](C)C(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1737551615 KQRMPHSAPRXWCN-NXEZZACHSA-N 335.364 1.118 10 10 EDCE Cc1ccc(S(N)(=O)=O)cc1C(=O)N1Cc2cccc(O)c2C1 1650673039 PYXKPWWMVOFPAO-UHFFFAOYSA-N 332.381 1.504 10 10 EDCE Cc1ccc(S(N)(=O)=O)c(C(=O)N2Cc3cccc(O)c3C2)c1 1650674566 HUHSZORUJOTDTB-UHFFFAOYSA-N 332.381 1.504 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H](C)SC)cc1C 1676504755 CJSTULLVMGLIRM-OCCSQVGLSA-N 326.462 1.322 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3cccnc3N)C2)cc1 1683945677 VOZXQNQGCSNGAA-AWEZNQCLSA-N 341.415 1.751 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2cnnn2C)C2CC2)cc1C 1690149315 IJMDEMXBICSOGM-OAHLLOKOSA-N 343.431 1.430 10 10 EDCE CNCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1Br 234442785 DLHRGRSYTOLUJU-NSHDSACASA-N 326.238 1.870 10 10 EDCE Cc1cc(OCc2ccc(N)cc2)cc(=O)n1CCN1CCOCC1 1857922107 VWUPUJLANGBHDW-UHFFFAOYSA-N 343.427 1.650 10 10 EDCE CN(C)C(=O)CN(Cc1ccccc1)C(=O)c1cccc(O)c1O 1946863748 OYCIAGLWSLSUAD-UHFFFAOYSA-N 328.368 1.828 10 10 EDCE COc1ccc(Br)c(CNCCNC(=O)N(C)C)c1O 1964048406 NDYRWBVYXULXGC-UHFFFAOYSA-N 346.225 1.524 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]1(CO)CCCN1C(=O)OC(C)(C)C 1985094678 SANSGCZPTLGQQP-AWEZNQCLSA-N 327.385 1.517 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985106339 YNENYFXJKFRURK-ONGXEEELSA-N 327.385 1.562 10 10 EDCE CN=c1[nH]cc(Br)c(=NCCc2ccc(O)c(O)c2)[nH]1 2148002361 APZBADPODHSHKW-UHFFFAOYSA-N 339.193 1.190 10 10 EDCE C[C@@]1(O)CCCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 163263140 YKLGQHSLUZVDGB-GXTWGEPZSA-N 340.221 1.752 10 10 EDCE CC(C)(C)OC(=O)N1CCN(Cc2cc(N)ccc2O)C[C@@H](O)C1 1999473835 BGXVQSWURJPAHU-CQSZACIVSA-N 337.420 1.388 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CC1(O)CCN(C(=O)OC(C)(C)C)CC1 2010404562 SLWMGGCRRKUXSO-UHFFFAOYSA-N 341.412 1.907 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)=C[C@H]1O 2014504389 JFIGNDNGJRRSDC-IJLUTSLNSA-N 337.380 1.482 10 10 EDCE C[C@@H]1CN(c2cc(Br)c(CN)cc2F)C[C@H](CO)O1 311423507 ONXHEAZUTQONMY-PSASIEDQSA-N 333.201 1.633 10 10 EDCE CNCc1ccc(N2C[C@H]3OC(=O)N(C)[C@@H]3C2)c(Br)c1 2176930763 NNACTGQFJJZLOO-CHWSQXEVSA-N 340.221 1.808 10 10 EDCE CN(CCN1CCOC1=O)c1cc(Br)c(CN)cc1F 2171070534 PKOUGIXACMCHLF-UHFFFAOYSA-N 346.200 1.935 10 10 EDCE C[C@H](N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)c1cc(O)ccc1O 1908511355 PACGBUPNGYPWKC-PSOPSSQASA-N 338.404 1.729 10 10 EDCE CNCc1ccc(N2CC[C@@H](C)[C@@H]2C(N)=O)c(Br)c1 2090262597 PUPJOLHMMADSJE-NOZJJQNGSA-N 326.238 1.869 10 10 EDCE C[C@H]1[C@@H](C)N(c2ccc(CN)cc2Br)CCS1(=O)=O 2113895113 RQIWBQPOOWTBMX-ZJUUUORDSA-N 347.278 1.920 10 10 EDCE COc1ccc(CN2CCN([C@H](C)C(=O)NC3CC3)CC2)c(O)c1 123367655 XRWRFMFGQFJMOH-CYBMUJFWSA-N 333.432 1.186 10 10 EDCE Cc1ccccc1C(=O)NCC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 185385671 WEPJXEDOGDCXGA-CYBMUJFWSA-N 342.395 1.883 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCCN(c2ncccn2)C1 180941992 YZUHOXLSHMPVET-HZRUHFOJSA-N 340.383 1.686 10 10 EDCE Cc1cn2c(n1)CN(CC(=O)NCc1ccc(N(C)C)cc1)CC2 373311790 UTPVJNTZEBYIOP-UHFFFAOYSA-N 327.432 1.390 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1CC(=O)CO1 1952400401 GKAHREGIVMJAEV-IUODEOHRSA-N 337.372 1.892 10 10 EDCE Cc1ccc(CNC(=O)c2conc2CN)c(O)c1Br 2381140652 NWHCEQPQDOIRCS-UHFFFAOYSA-N 340.177 1.840 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 808511248 YDRGVTJLTXQTDJ-UHFFFAOYSA-N 332.400 1.532 10 10 EDCE CCn1ncc(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)n1 819590645 LWQPFNRJSYDACN-ZDUSSCGKSA-N 329.404 1.563 10 10 EDCE C[C@@H]1CCNC[C@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 817891391 BMIFSXARUMLAAT-RHSMWYFYSA-N 337.489 1.009 10 10 EDCE C[C@@H]1CN(Cc2cc(Cl)c(F)cc2O)CCN1S(C)(=O)=O 827265385 JPZMCUAEZBZMHA-SECBINFHSA-N 336.816 1.650 10 10 EDCE CC[C@@H]1[C@H](CO)CCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 830707480 FTKZBKLNVGIWQB-FUHWJXTLSA-N 333.476 1.804 10 10 EDCE CC[C@](C)(CO)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 838204996 PQMUEHXOQUBOOL-GOSISDBHSA-N 336.432 1.663 10 10 EDCE CCN1CCN(CC(=O)N(CC)Cc2ccc(N(C)C)cc2)CC1 742249569 WLZCCBQZPONXJN-UHFFFAOYSA-N 332.492 1.739 10 10 EDCE COC1CCN(c2ccc(CN3CCn4nncc4C3)cc2)CC1 847029955 XDFMBTBUMBCVJU-UHFFFAOYSA-N 327.432 1.909 10 10 EDCE CCO[C@@H]1CN(C(=O)NCCCSc2nccs2)C[C@H]1CN 846152321 AHFPDGXNWJHBPB-VXGBXAGGSA-N 344.506 1.631 10 10 EDCE COc1cc(Br)cc([C@H](C)NC[C@H]2CNC(=O)C2)c1O 848553450 SVHGCFGBLCPKIZ-IUCAKERBSA-N 343.221 1.950 10 10 EDCE N[C@@H]1CCO[C@@H]([C@H]2CCCCN2Cc2cc3c(cc2O)OCO3)C1 844911985 QOABTJSLQKKHGC-IIAWOOMASA-N 334.416 1.982 10 10 EDCE O=C(NCc1ccccc1O)N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 853569677 CZZFJSLQQBAZIV-IAGOWNOFSA-N 345.443 1.835 10 10 EDCE CCO[C@@H](CNCc1ccc(N2CCC(O)CC2)cc1)CN(C)C 922755283 AEJBDAQEBRJNSZ-IBGZPJMESA-N 335.492 1.704 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H]3CCCN(C)C3)C2)cc1 852188740 LQERWWSVWRGZQR-JKSUJKDBSA-N 346.475 1.915 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCCCNC(N)=O)C2)cc1 855229741 PXCSNDQLLIRHMH-CYBMUJFWSA-N 334.420 1.229 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCNC34CCC4)C2)cc1 861658811 OBVICVMZKDRMRW-YOEHRIQHSA-N 344.459 1.858 10 10 EDCE O=C1COc2cc(NS(=O)(=O)c3cccc4nonc34)ccc2N1 765050061 DDMBEPNVJVMGLA-UHFFFAOYSA-N 346.324 1.355 10 10 EDCE CC(=O)c1cncc(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)c1 884010460 COHUHKRZZOTBKI-QGZVFWFLSA-N 326.400 1.780 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1cc2c(nc1O)CCC[C@H]2O 1137443043 AAJLFCMMHZIJKD-CYBMUJFWSA-N 330.340 1.498 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@H]2CO)cc1Br 698180114 KCUGCGHFYBNHFJ-STQMWFEESA-N 329.238 1.491 10 10 EDCE O=C(Cn1cc(C(F)(F)F)ccc1=O)NCc1cc(O)ccc1O 1153879406 NPRDUNPJEJGBNB-UHFFFAOYSA-N 342.273 1.595 10 10 EDCE CNCc1ccc(N2CC[C@@H](S(C)(=O)=O)C2)c(Br)c1 2123321307 RDUDISAHEVDXLJ-LLVKDONJSA-N 347.278 1.792 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1C[C@H](OCC)C1 1328227636 DCMYNUZHJZTFRJ-SHTZXODSSA-N 334.416 1.815 10 10 EDCE Cc1cccc(CNCCc2nnc(Br)n2C)c1O 2128772643 ONTDCXRXEDPYEA-UHFFFAOYSA-N 325.210 1.924 10 10 EDCE Cc1c([C@H](NCCCN=[N+]=[N-])C(N)=O)c(Br)nn1C 2131552142 OSMWZHOHSZDWGS-QMMMGPOBSA-N 330.190 1.307 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)Cc2ncc[nH]2)cc1C 1507137979 YEHNTNSHWHNZEY-AWEZNQCLSA-N 330.432 1.906 10 10 EDCE O=C(C(=O)N1CCC[C@@H](OC2CCC2)C1)N1Cc2cccc(O)c2C1 1351932642 YZYSLEKPJVIWMX-OAHLLOKOSA-N 344.411 1.795 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@@H]2CC2(F)F)cc1C 1284399815 IQMNBVKAPDPJRO-KGLIPLIRSA-N 342.386 1.568 10 10 EDCE COc1cccc(-n2cc(C(=O)NCc3cccc(O)c3O)nn2)c1 1558161712 RIYWLBVRMGCKEV-UHFFFAOYSA-N 340.339 1.617 10 10 EDCE CCO[C@H]1C[C@H]1C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1623928450 NFNQCMMKWHYCGL-OCCSQVGLSA-N 341.791 1.972 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)CCn2cnnn2)cc1C 1717431733 XBNWMXOYADFBAC-UONOGXRCSA-N 346.435 1.063 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2c(C)ccn2C)cc1C 1496972688 XJTUKWSZRVHTRE-MRXNPFEDSA-N 345.443 1.531 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3[nH]cnc3C)CC2)cc1F 1566347023 UUHREOJNRXCXEC-UHFFFAOYSA-N 332.379 1.757 10 10 EDCE CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NCc2cc(O)ccc2O)C1 1633595262 OOTDHZJZUHPYGT-QWHCGFSZSA-N 334.416 1.999 10 10 EDCE O=C(NCCCn1cccnc1=O)c1cc2cc(O)c(O)cc2s1 1568701451 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10 EDCE C[C@H](NC[C@H](O)c1ccnn1C)c1ccc(N2CCOCC2)c(F)c1 927135310 XSVMKCSHUTYSKI-UGSOOPFHSA-N 348.422 1.780 10 10 EDCE COCCn1cc(CN[C@H]2CCN(c3ccc(OC)cc3)C2)cn1 850347829 YMHBSIMRWIJHFZ-INIZCTEOSA-N 330.432 1.907 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3CN4CCC[C@H]3C4)CC2)cc1 924832571 SHRYJAGKJDRPKJ-PXNSSMCTSA-N 344.503 1.501 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC[C@H]3CCNC3)C2)cc1 851664505 CQSNEOLSVKFOGD-CABCVRRESA-N 332.448 1.573 10 10 EDCE Cc1ccc(S(=O)(=O)NCCC(=O)NCc2ccccc2O)cc1 769365625 OYRKLJVSXMXROV-UHFFFAOYSA-N 348.424 1.685 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3c3cnc[nH]3)CC2)cc1 873778962 MHRFXDSFSZVPLK-HZPDHXFCSA-N 326.400 1.871 10 10 EDCE COC1=C(C(=O)O)NC(=O)N[C@@H]1c1cc(Br)ccc1O 76257110 KSMDTVUCBUYRBL-MRVPVSSYSA-N 343.133 1.451 10 10 EDCE CCOC(=O)[C@@H](C[C@@H]1CCCO1)NC(=O)c1ccc(C)c(O)c1O 1177476343 QFWNXTQOJUUTRD-WCQYABFASA-N 337.372 1.637 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1ncn(C)n1 1320723900 BKLBXDVRRJIYQG-UHFFFAOYSA-N 331.420 1.384 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cn(Cc2cccc(F)c2)nn1 1176748493 UKVPZDHWSWRVIK-UHFFFAOYSA-N 342.330 1.807 10 10 EDCE CCOC(=O)COCCN1CCN(c2ccc(OCC)cc2)CC1 1261199267 JVOUPDWIFWNVTM-UHFFFAOYSA-N 336.432 1.787 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@H]2CCC2(F)F)cc1C 1507199466 CGTFAGFFRIMGEY-ZIAGYGMSSA-N 342.386 1.616 10 10 EDCE O=C(C(=O)N1CCC[C@H](OC2CCC2)C1)N1Cc2cccc(O)c2C1 1351932640 YZYSLEKPJVIWMX-HNNXBMFYSA-N 344.411 1.795 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)CC(F)(F)F)cc1C 1507179804 OXFFDIOJTOYITP-GFCCVEGCSA-N 334.338 1.523 10 10 EDCE CN1CCN(C(=O)c2ccnc3c2CC(=O)N3)c2cc(F)ccc21 1465511963 MVIUNCMKKHFWGG-UHFFFAOYSA-N 326.331 1.812 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@H]2CC2(C)C)cc1C 1700936769 HKXMUOZHTVVENX-JKSUJKDBSA-N 334.460 1.959 10 10 EDCE Cc1cc(CN(C)Cc2nnc3n2CCNC3=O)ccc1N(C)C 1620574601 YWADQGNSOKEVSX-UHFFFAOYSA-N 328.420 1.028 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@H]2CCCC(=O)N2)cc1C 1714404935 NHGWWCCJRLQCGZ-CZUORRHYSA-N 347.459 1.514 10 10 EDCE NC(=O)c1ccc(C(=O)NCc2cccc(Br)c2O)[nH]1 1556480939 HULJORCJLNGZOG-UHFFFAOYSA-N 338.161 1.512 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)/C=C/c2ccc[nH]2)cc1C 1725531830 ZXOWENRHCZLQLT-JKNJVXJCSA-N 343.427 1.612 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)Cc2ncc[nH]2)C2CC2)cc1C 1490725036 WRBRUVJXJXAYTL-MRXNPFEDSA-N 342.443 1.954 10 10 EDCE CN(C)c1nccc(CNC(=O)c2ccc(N=NC(N)=O)cc2)n1 1631609412 MAOATCWJERSLQC-UHFFFAOYSA-N 327.348 1.635 10 10 EDCE O=C(CNS(=O)(=O)c1ccccc1)NCc1c(O)cccc1F 1638858437 USKKTGIDBDZPDS-UHFFFAOYSA-N 338.360 1.126 10 10 EDCE O=C(NCc1n[nH]cc1Br)c1c(F)ccc(O)c1O 1648547646 LLICVYFHROABOQ-UHFFFAOYSA-N 330.113 1.653 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CC[C@H](CO)O1 1742754453 OFQBGZYTODXHPA-LSDHHAIUSA-N 332.404 1.468 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)[C@@H]1CCOC1 159747106 HQCGZSBZSOZLGN-JMCQJSRRSA-N 326.194 1.626 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(CO)CNCc1ccc(F)cc1O 1876124192 ZIRYBABOUNQHJY-INIZCTEOSA-N 328.384 1.897 10 10 EDCE COc1ccc(N2C[C@H](O)C[C@@H](NC(=O)OC(C)(C)C)C2)c(N)c1 2002706787 CXCARRDHNXFVOL-VXGBXAGGSA-N 337.420 1.742 10 10 EDCE CC(=O)C(=O)C1(O)CCC2(CC1)C[C@@H]2CNC(=O)OC(C)(C)C 1975889906 UTANNVLRXWGTQL-AXOLYNHLSA-N 325.405 1.981 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(OCC(N)=O)C2)cc1Br 2145378330 XVIZKKYSJMMJJY-VIFPVBQESA-N 342.237 1.420 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2C[C@]2(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003172099 GIMUGWFCGBQIKE-HQILRLMSSA-N 336.432 1.945 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@]1(C)C(=O)N1CC(N=[N+]=[N-])C1 1985101465 SUOVRDFHCOLXAA-HZMBPMFUSA-N 325.369 1.437 10 10 EDCE Nc1ccc(OCCNc2nc[nH]c(=O)c2Br)cc1 164286437 IIFQXYBSGWNSFF-UHFFFAOYSA-N 325.166 1.606 10 10 EDCE CC(C)(C)OC(=O)NC1CN(C(=O)CCOc2ccc(N)cc2)C1 1999441717 NJJFOKVDWHEXEF-UHFFFAOYSA-N 335.404 1.773 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2C[C@@]21C(=O)C(=O)C[C@H]1C[C@H](N)C1 2008508789 QUUIVHOKQNUSQU-LUIWMBBWSA-N 336.432 1.945 10 10 EDCE CO[C@H]1C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 2010394169 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QMYFNOTVPVRANN-HNNXBMFYSA-N 331.368 1.864 10 10 EDCE CN(C)c1ccc(CN(C(=O)NCc2cnn(C)n2)C2CC2)cc1 807571092 QSILHFWJPNKLMY-UHFFFAOYSA-N 328.420 1.755 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1cc(C2CCNCC2)nn1 900602078 SUYNDJLUVXGXQT-UHFFFAOYSA-N 327.432 1.630 10 10 EDCE CC(C)N1CCC([C@H]2C[C@@H]2CNC(=O)c2cc(O)nc(O)c2)CC1 585509674 ZPBATAGAJOBQTO-HUUCEWRRSA-N 333.432 1.979 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CN(C2CC2)C(=O)O1 847455103 QMRLQMDCSMSJHX-INIZCTEOSA-N 346.431 1.877 10 10 EDCE CN(C)CCN1CCN(Cc2cc3c(cc2O)CCCC3)CC1=O 844713405 BALRMZGRLSNKPV-UHFFFAOYSA-N 331.460 1.477 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1C[C@@H]2COC[C@@H]2O1 926641084 QSKGJOHJHMGTTA-OIISXLGYSA-N 333.432 1.698 10 10 EDCE CCc1ccncc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 845943792 BSLDKJZHPWPZOA-NSHDSACASA-N 343.383 1.741 10 10 EDCE COC[C@H](CCNC(=O)N[C@@H](C)c1cc(OC)ccc1O)OC 852448695 NBXQKWIABMYLCE-AAEUAGOBSA-N 326.393 1.813 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CC[C@H](O)C3)C2)cc1 854299674 QPCKKMIWHZAVCL-YCPHGPKFSA-N 333.432 1.734 10 10 EDCE CO[C@]1(CO)CCCN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 853775915 GVNUGNZYEXEZDB-LJQANCHMSA-N 345.443 1.746 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)Cc3cnnn3C)C2)cc1 854981677 YPDCUODNECSSCB-ZDUSSCGKSA-N 329.404 1.009 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)C[C@](C)(C(F)F)O1 853335526 ALBUYAKILZSUEH-RFAUZJTJSA-N 327.331 1.478 10 10 EDCE C[C@H](NC(=O)NC[C@H]1CC[C@H](C(=O)N(C)C)O1)c1ccccc1O 868477644 ZINAGRSKUXPRBX-YWPYICTPSA-N 335.404 1.388 10 10 EDCE C[C@H](NC(=O)NC[C@@H]1CC[C@@H](C(=O)N(C)C)O1)c1ccccc1O 868477632 ZINAGRSKUXPRBX-HUBLWGQQSA-N 335.404 1.388 10 10 EDCE COc1cc(O)c(CN(C)C[C@H]2CCS(=O)(=O)C2)cc1OC 768445165 GAURYVZLUMRCES-LLVKDONJSA-N 329.418 1.276 10 10 EDCE CC(C)N(Cc1cc(Br)cc(F)c1O)C[C@@H](O)CO 895036672 OGHYIRZOTOWTOV-LLVKDONJSA-N 336.201 1.857 10 10 EDCE COC(=O)[C@@]1(O)CCN(Cc2cc(Br)ccc2O)C1 895706576 HDUBDAVSLKVTLI-CYBMUJFWSA-N 330.178 1.265 10 10 EDCE C[C@@H]1CN(CCNC(=O)c2cc3cc(O)c(O)cc3s2)CCO1 896043152 NETSTKIWVCQZEN-SNVBAGLBSA-N 336.413 1.763 10 10 EDCE O=C(Cc1csc(N2CCOCC2)n1)NCc1ccc(O)c(O)c1 1137443058 AMPVYXDENXVGLF-UHFFFAOYSA-N 349.412 1.250 10 10 EDCE C[C@@H]1CC[C@H](O)CN1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 899098406 NKZLWUNTZGVWIQ-FHLIZLRMSA-N 348.491 1.910 10 10 EDCE COC(=O)c1c(CNCC(=O)N(C)OC)c2cc(F)ccc2n1C 895046572 MWPXCBPFWBBCSG-UHFFFAOYSA-N 337.351 1.213 10 10 EDCE CN(C)S(=O)(=O)CCC(=O)NCc1c(O)ccc2ccccc12 1304091216 ZNZGXJIAVYYNQR-UHFFFAOYSA-N 336.413 1.443 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@]2(C)CCC(=O)N2)cc1C 1319530344 ZDHRZYZSOXMZPD-KUHUBIRLSA-N 347.459 1.609 10 10 EDCE N[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1327581689 BMAAVCMDFPJVQY-QZTJIDSGSA-N 331.460 1.781 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2cc[n+]([O-])cc2)cc1C 1320341109 CGFMIFSDPZRDNN-OAHLLOKOSA-N 343.427 1.935 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)CCn2cnnn2)cc1C 1331594543 LMMNDBCZHPYXOS-AWEZNQCLSA-N 346.435 1.017 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)C(=O)NCC2CC2)cc1C 1266180341 DTHHYGLAWNNEGQ-CQSZACIVSA-N 347.459 1.514 10 10 EDCE C[C@@H](O)CCCN1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1269352776 WFZZNLOERXEQIV-DOMZBBRYSA-N 347.419 1.814 10 10 EDCE C[C@H]1CNc2c(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cnn2C1 1346737291 YFUNFKPUKHKWLT-QWRGUYRKSA-N 330.388 1.717 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)Cc2ccsc2)cc1C 1272351269 HGJQALVQIVMZKZ-INIZCTEOSA-N 348.468 1.875 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1441134343 WDXIKWPTAWNQMU-MRXNPFEDSA-N 334.416 1.558 10 10 EDCE COc1ccc(N(Cc2ccccc2)CC2(O)CNC2)c([N+](=O)[O-])c1 1915496973 VTHGJUFJTLXRNM-UHFFFAOYSA-N 343.383 1.944 10 10 EDCE CS(=O)(=O)Cc1cccc(C(=O)NCc2c(O)cccc2O)c1 1456236743 UZHVUIUBUXWIBI-UHFFFAOYSA-N 335.381 1.572 10 10 EDCE COC[C@@H](C)C(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1295538862 LSHYRNGSLNVPBI-MNOVXSKESA-N 349.391 1.366 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc([N+](=O)[O-])c2nsnc2c1 1455355608 DPADDHAKGBWFQF-UHFFFAOYSA-N 346.324 1.941 10 10 EDCE C[C@@H](CC(=O)Nc1c(-c2ccccn2)nc2ccccn12)NC(N)=O 1450715738 OYRHYMKEFXZDMM-NSHDSACASA-N 338.371 1.782 10 10 EDCE COc1ccc(CNC(=O)c2cnn3cccc(OC)c23)c(O)c1 1467470856 PHDOZGQOUAAFLY-UHFFFAOYSA-N 327.340 1.987 10 10 EDCE CN(C)C(=O)/C=C\C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1465423655 XAXODOKTBXHPQZ-WAYWQWQTSA-N 349.406 1.047 10 10 EDCE O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NCc1cccc(O)c1O 1471644741 XTODYTYEHOPEFT-UHFFFAOYSA-N 342.311 1.672 10 10 EDCE CCN1CC[C@@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1542180405 KTFMKCOFSIHEIU-DOTOQJQBSA-N 344.459 1.099 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@]34COC[C@@H]3C4)CC2)cc1C 1483735337 SVVITFCMMJUVHF-KXBFYZLASA-N 330.428 1.779 10 10 EDCE C[C@@H](c1ccccc1)[C@H](NC(=O)Cc1ccc(O)c(O)c1)C(N)=O 1628757966 DDEDPGQCVMSZBW-GTNSWQLSSA-N 328.368 1.414 10 10 EDCE COCC(=O)NCCN1CCC(NCc2ccc(OC)c(C)c2)CC1 1717015121 ROAQDJVHXILQMB-UHFFFAOYSA-N 349.475 1.320 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C\c3cnc(N)nc3)CC2)cc1 1565521064 CJBUZNATMZNUPQ-UQCOIBPSSA-N 339.399 1.429 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)cc1C 1497058955 YDOCZLJMFCLJFA-KONPQCLYSA-N 348.443 1.138 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNCc2ccc(OC)c(C)c2)ncn1 1569058339 BBCSWCOLZFNILZ-ZDUSSCGKSA-N 344.415 1.710 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cccc(-c2nc(=O)o[nH]2)c1 1630307628 XOEKCEMDYZYNDN-UHFFFAOYSA-N 327.296 1.371 10 10 EDCE COc1c(C)[nH]cc(CN(C)C(=O)Cc2ccc(O)c(O)c2)c1=O 1642655467 PGPSNVYZPKWDIM-UHFFFAOYSA-N 332.356 1.304 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@H]2CN(C)CCO2)cc1C 1676324804 XSICCOBNIRSDRE-QAPCUYQASA-N 349.475 1.271 10 10 EDCE C[C@@H](O)CCCNC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1670906977 LGQYFKKIANOGAD-GFCCVEGCSA-N 347.419 1.862 10 10 EDCE CCNCc1ccc(N2CC[C@@H](C(N)=O)C2)cc1Br 233536390 GDAJZKUAQSQCQL-LLVKDONJSA-N 326.238 1.870 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](C(=O)NCCCN=[N+]=[N-])O1 1895876108 RDOXVTKWDRDWJR-WDEREUQCSA-N 327.385 1.875 10 10 EDCE C[C@@H](NCc1ccc(Br)cc1O)C1CS(=O)(=O)C1 1967838468 CAWGQPRLECZAGE-MRVPVSSYSA-N 334.235 1.677 10 10 EDCE CON(C)C1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2144637665 WNUZQFCXFBLPTN-GFCCVEGCSA-N 342.193 1.116 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985103547 XAGBUYAYDOGFRV-MXWKQRLJSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC[C@@H](CN=[N+]=[N-])C2)COC1 2010404106 OOSCPZVCRYVZQO-NSHDSACASA-N 339.396 1.829 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2018525992 CQSUBPRMJZMMOO-WOPDTQHZSA-N 339.396 1.970 10 10 EDCE O=C1C(=Cc2ccccn2)SC(=S)N1CCN1CCOCC1 2040489663 OOMRXDYPEWLKRA-UHFFFAOYSA-N 335.454 1.615 10 10 EDCE CNCc1ccc(N2CC[C@@](CO)(OC)C2)c(Br)c1 402909233 BIQHHRKDCBGOOT-CQSZACIVSA-N 329.238 1.756 10 10 EDCE C[C@]1(CO)CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 381807994 VBBGOCZQKIGGMY-JSGCOSHPSA-N 340.221 1.610 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC(NC4CCC4)CC3)c2n1 2062307524 FPQQTOMGCPWWOI-UHFFFAOYSA-N 329.404 1.490 10 10 EDCE C[C@H]1CC[C@H](NC(=O)C(F)(F)F)CN1C(=O)c1cccc(O)c1O 2054401438 RWSIRSPPHADTGH-IUCAKERBSA-N 346.305 1.769 10 10 EDCE COCCOCCOCCNCc1c(O)cccc1Br 2187125437 DMGZABNDUCHMFU-UHFFFAOYSA-N 348.237 1.924 10 10 EDCE CN[C@H](c1ccccc1O)[C@@H](O)c1nn(C)nc1Br 2111421692 BOFSXPPHWGMTBW-MWLCHTKSSA-N 327.182 1.277 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCCC=CBr 2114290267 VKSZZDVFILZYMG-JTQLQIEISA-N 329.194 1.383 10 10 EDCE CSc1ncc(CNS(=O)(=O)CCC(F)(F)CN)s1 2269278102 FPPDWRGKZMFRBB-UHFFFAOYSA-N 331.435 1.269 10 10 EDCE COCCN1C(=O)C(=Cc2ccccc2[N+](=O)[O-])C(C(=O)OC)=C1C 2294028390 FMZQUJBUVRAXBD-UHFFFAOYSA-N 346.339 1.914 10 10 EDCE COc1ccc(C=C2SC(=S)N(NC(C)=O)C2=O)cc1OC 2297259319 ZIKCWUWPFNYIAG-UHFFFAOYSA-N 338.410 1.956 10 10 EDCE O=C1NC(=O)N(Cc2ccccc2)C(=O)C1=CNNc1ccccc1 2313625062 UFLRFDBMVWFRPJ-UHFFFAOYSA-N 336.351 1.766 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C)C[C@H]3CCCO3)CC2)cc1 52101840 KAPKESWIDOPOIP-GOSISDBHSA-N 347.459 1.455 10 10 EDCE COc1ccc(CN2CCN([C@H](C)c3nc(C)no3)CC2)c(O)c1 121337958 IJBRSOVSOHCCQV-GFCCVEGCSA-N 332.404 1.971 10 10 EDCE CO[C@@H](C(=O)O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951836397 YSPUVPDEDOQVML-ZWNOBZJWSA-N 341.360 1.633 10 10 EDCE C[C@@H](NCCS(=O)(=O)N1CCSCC1)c1ccccc1O 183502906 KNNPQUHQOUAFON-GFCCVEGCSA-N 330.475 1.421 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1CC(=O)CO1 1952400409 GKAHREGIVMJAEV-WFASDCNBSA-N 337.372 1.892 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)NC[C@H]3CNC[C@@H]3O)c2C)c1 262308994 QIBZVCJROFNRFZ-QAPCUYQASA-N 327.428 1.713 10 10 EDCE CCC[C@@]1(CO)CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 377154642 ZIFWCLQILKEFNZ-MRXNPFEDSA-N 335.360 1.915 10 10 EDCE C[C@H]1C[C@H](N2CCCC2)CN1c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 376206580 ZUHWYTSRNDZAKO-RYUDHWBXSA-N 346.387 1.989 10 10 EDCE Cc1ccc(CN2C[C@@H]3OCCN(C)[C@@H]3C2)c(O)c1Br 2381142235 JSSCLZPUQNROFI-OLZOCXBDSA-N 341.249 1.978 10 10 EDCE CCCOCC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 299489858 FVWPSLDLNMWSEQ-UHFFFAOYSA-N 335.448 1.360 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCC3=C(CCC(=O)N3)C2)c1O 826785555 XCODZZAUKNRRTF-UHFFFAOYSA-N 333.344 1.679 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@](O)(C3CC3)C2)cc1 826707002 PEYWEQOKEBUAOG-IBGZPJMESA-N 345.443 1.132 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H](n3ccnc3)C2)cc1 729919763 CPZHHLXSSUXLSU-GOSISDBHSA-N 341.459 1.902 10 10 EDCE COc1cc(C)cc(CN2CCN(CC(=O)NC3CC3)CC2)c1O 732476784 WKZAPXJBNMHQMX-UHFFFAOYSA-N 333.432 1.105 10 10 EDCE O=C(NC[C@]1(O)[C@H]2[C@H]3C[C@@H]4[C@@H]5[C@H]3[C@H]1[C@@H]5C[C@H]42)c1c(F)ccc(O)c1O 830689805 BTIJOYILVISPOP-XGFPZRDUSA-N 345.370 1.476 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CC[C@](O)(C(F)F)C1 838486733 RUCXHSHEELHXNC-QGZVFWFLSA-N 337.370 1.974 10 10 EDCE Cc1cc(O[C@@H]2CCCN(C(=O)c3cc(O)nc(O)c3)C2)nc(C)n1 585345273 KQDIDBJVVZJHIT-CYBMUJFWSA-N 344.371 1.583 10 10 EDCE COC1CCN(c2ccc(CN3CCO[C@H]([C@@H](C)O)C3)cc2)CC1 839670533 HFEDAHMHIQIIGJ-BEFAXECRSA-N 334.460 1.883 10 10 EDCE CN(C1CCN(Cc2cc3c(cc2O)CCC3)CC1)S(C)(=O)=O 748072496 RTOYCEZQFNIHPK-UHFFFAOYSA-N 338.473 1.737 10 10 EDCE COc1cc(N2CCN(C[C@H](O)C3CC3)CC2)cc(OC)c1OC 838932009 LFSJHZRGUQGROL-HNNXBMFYSA-N 336.432 1.605 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)C[C@H](N)Cc1ccc(O)c(O)c1 1952893434 KSXXKUMMSDFCHP-CHWSQXEVSA-N 340.420 1.897 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@]23C[C@H]4C[C@@H](C(=O)N2)[C@H]3C4)cc1F 844357705 OWCGICRBWCSPPI-OFEPTWOUSA-N 331.391 1.423 10 10 EDCE CN1C(=O)N[C@@]2(CCC[C@H]2CNCc2ccc3c(c2)CCCO3)C1=O 921813103 BLEKYFUEKMCAEZ-HNAYVOBHSA-N 343.427 1.822 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)[C@H](N)c1ccccc1O 1899562368 SCZPUMNDOVTQAN-WCQYABFASA-N 344.433 1.330 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)COC3CCOCC3)C2)cc1 855231140 KSXYPKLAQYFJEP-CQSZACIVSA-N 334.416 1.586 10 10 EDCE C[C@H](NC(=O)NC[C@H](O)c1ccnn1C)c1ccc(N(C)C)cc1 922053984 HWAKCBHFHPNZLC-LRDDRELGSA-N 331.420 1.580 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3nnc(C)s3)C2)cc1 852248768 MHBUOIGEFMFRRS-GFCCVEGCSA-N 347.444 1.933 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCCC(=O)N(C)C)C2)cc1 852006425 NIOQJISDRQLWPE-AWEZNQCLSA-N 348.447 1.442 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C)C(O)[C@@H](C)C3)nc12 852503462 OTFAULOAYUMNRP-QWRGUYRKSA-N 348.403 1.060 10 10 EDCE COC(=O)CCNC(=O)CCNCc1cc(Cl)cc(C)c1O 862527460 AOMRGCHXMCFWLN-UHFFFAOYSA-N 328.796 1.513 10 10 EDCE CO[C@@H](CS(=O)(=O)N[C@@H](C)c1ccccc1O)[C@@H]1CCOC1 867836170 IHYLKCMJYOUTPC-ZOWXZIJZSA-N 329.418 1.424 10 10 EDCE Cc1cc(=NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc(C)[nH]1 1116394457 YFDPXVCTXDLBCP-UHFFFAOYSA-N 335.385 1.450 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCc1nnnn1C 772578005 OJIOFDHHPCZCBS-UHFFFAOYSA-N 331.424 1.050 10 10 EDCE Cc1cc(C(=O)CN2C[C@H](O)C[C@H]2CO)c(C)n1-c1ccccc1 770665424 AKQIIFCKALZPTA-DLBZAZTESA-N 328.412 1.704 10 10 EDCE CC(=O)CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)C 1159526867 YCHBRPIVRDAVRJ-UHFFFAOYSA-N 328.390 1.203 10 10 EDCE CNCc1ccc(N2CCC[C@@H]2[C@H](O)CO)cc1Br 2123223622 SOIATJGCEKPVFB-ZIAGYGMSSA-N 329.238 1.491 10 10 EDCE CCNCc1ccc(N2CC(=O)NC[C@H]2C)c(Br)c1 2124757879 BGSGWZIGFIBWFS-SNVBAGLBSA-N 326.238 1.883 10 10 EDCE CCN(Cc1ccccn1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329359519 CDVNGMYKNAEBME-UHFFFAOYSA-N 325.368 1.678 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccsn2)cc1C 1268310675 CBVUJNXEFXZWTP-CYBMUJFWSA-N 335.429 1.341 10 10 EDCE CCc1cnc(CCNC(=O)C(=O)N(C)Cc2ccccc2O)s1 1261121627 NAPBVHBXYJNLJW-UHFFFAOYSA-N 347.440 1.728 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCS(C)(=O)=O)cc1C 1266949254 SAKHJOHVXWXFIA-CYBMUJFWSA-N 342.461 1.033 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)NC3C[C@@H]4C[C@H]4C3)ccc21 1349022246 BIBZAYDHIALYKT-GJZGRUSLSA-N 327.428 1.600 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC(CC2CC2)C1 1351175504 OWMPFKJHGDLHLL-UHFFFAOYSA-N 329.444 1.936 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2C[C@H]3CCC[C@H]32)cc1F 1354438763 QNKCJGJYLMUVKT-UMVBOHGHSA-N 333.407 1.813 10 10 EDCE CO[C@H](C)CN[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1713885632 NOAGQEVARPRGAJ-ABAIWWIYSA-N 347.419 1.982 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cc(OC)n(C)n2)cc1C 1497854370 JTBXPACHFKMZMO-CYBMUJFWSA-N 346.431 1.654 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCN2CCCC2=O)cc1C 1716423787 ISJQYCJJOCSALH-OAHLLOKOSA-N 347.459 1.610 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@H](CO)Cc1ccc(F)cc1 1631598210 KLBWMMXENDUFTF-CQSZACIVSA-N 333.359 1.747 10 10 EDCE O=C(Cn1c(=O)cnc2ccccc21)NCc1cc(O)ccc1O 1637123179 ZREFPCMWZXZZBV-UHFFFAOYSA-N 325.324 1.124 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@H]2C(=O)N=S(C)(C)=O)c(O)c1O 1637450619 DBWOBVMOIRJFBE-NSHDSACASA-N 340.401 1.265 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCc1nc(C2CCOCC2)n[nH]1 1635254621 IQWCVGMIEQKJIA-RQOWECAXSA-N 344.371 1.440 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](O)C(C)(C)C 1631530932 AXPLSRWYMNKYKN-AWEZNQCLSA-N 343.807 1.954 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C(=O)NCC2CC2)cc1C 1731626978 OTYLEYBWDGLKLV-CYBMUJFWSA-N 333.432 1.124 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)CCNC(N)=O)C2)cc1C 1691537934 WFLPZHLAIGYHGR-SHTZXODSSA-N 348.447 1.046 10 10 EDCE COC(=O)[C@H](O)CNC(=O)c1cc(C)ccc1-n1c(C)ccc1C 155361757 YKCORVMCVYZWFU-MRXNPFEDSA-N 330.384 1.666 10 10 EDCE O=C(Nc1cccc(S(=O)(=O)O)c1)c1cc(O)c(O)c(O)c1 1865876059 OVNMISOSTXMVAY-UHFFFAOYSA-N 325.298 1.302 10 10 EDCE Nc1ccc(-n2nnc(C(=O)NCCc3nc4ccccc4[nH]3)n2)cc1 1857878915 OANZTWFODACIJL-UHFFFAOYSA-N 348.370 1.093 10 10 EDCE COc1ccc(N(C)C[C@H](O)CNC(=O)OC(C)(C)C)c(N)c1 1977905791 OAFHBSPIJFVCGB-LLVKDONJSA-N 325.409 1.599 10 10 EDCE CON(C(=O)Cc1ccc(N)cc1)C1CN(C(=O)OC(C)(C)C)C1 2003436697 XHLQQLULJSKGNK-UHFFFAOYSA-N 335.404 1.821 10 10 EDCE CO[C@@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C[C@H]1F 2146468803 CSMNNWKVLBSOFE-FXAINCCUSA-N 344.184 1.574 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)NCCc1ccc(N)cc1 2022880192 IWNAWEJOBZSVTD-BXUZGUMPSA-N 337.420 1.202 10 10 EDCE CN[C@](CSc1nccs1)(C(N)=O)C1(Br)CC1 2025895454 LEMVNSGAWBJLCN-SNVBAGLBSA-N 336.280 1.606 10 10 EDCE CNC(=O)[C@H](C)CN(C)c1cc(Br)c(CN)cc1F 311325376 BIGOUMUJBPCCTM-MRVPVSSYSA-N 332.217 1.865 10 10 EDCE O[C@@H]1C[C@@H](O)CN(c2ccc(CNC3CC3)cc2Br)C1 2161356014 BQSGCIDEZNSHMW-CHWSQXEVSA-N 341.249 1.633 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@@](O)(C(N)=O)C2)cc1Br 380450873 DZUVXINIIPCPMI-OTYXRUKQSA-N 342.237 1.285 10 10 EDCE CN(C)C[C@]1(O)CCN(c2ccc(CN)cc2Br)C1 713652550 BOVODKDFTZTNBG-CQSZACIVSA-N 328.254 1.411 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)c(Br)c1 2182555787 WSPDHYHJRLKELL-ZKOAOSJTSA-N 342.233 1.680 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NCc1ccc(O)c(O)c1 1907971488 RKIQTEVIWLQFCA-IUODEOHRSA-N 338.404 1.822 10 10 EDCE COc1cccc(CNCCc2nnc(Br)n2C)c1O 2185197187 BXKLXLRHUQNCCH-UHFFFAOYSA-N 341.209 1.624 10 10 EDCE CNCc1ccc(N2CC[C@@]3(C[C@@H](O)CO3)C2)cc1Br 2201781010 SZTSVBIQJNPNLE-UKRRQHHQSA-N 341.249 1.899 10 10 EDCE CC1(C)CN(c2ccc(CN)c(Br)c2)CCS1(=O)=O 2113900684 HAWCFOKGGGYIMC-UHFFFAOYSA-N 347.278 1.921 10 10 EDCE COc1ccc(N2C[C@H](O)[C@@H]3COC[C@@H]32)c(OC)c1Br 2234896382 BAUPNWCEISUMEH-MIMYLULJSA-N 344.205 1.662 10 10 EDCE CC(C)(C)OC(=O)N1CCOCC[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2249052580 XRDUHJMTLNNPRK-AVGNSLFASA-N 340.420 1.278 10 10 EDCE NC(=O)c1nc(CNCc2cc(Br)cc(F)c2O)no1 2285834572 BTHSZQQWBCTQBO-UHFFFAOYSA-N 345.128 1.066 10 10 EDCE Cc1nc(CNC(=O)C=Cc2ccc(N3CCOCC3)cc2)no1 2297610122 ORTKOCJBSHMGMP-UHFFFAOYSA-N 328.372 1.544 10 10 EDCE CN(C)CC=CC(=O)NCc1ccc(N2CCN3CCC[C@H]3C2)cc1 2297716420 WJHALOSEUMRSHO-IBGZPJMESA-N 342.487 1.705 10 10 EDCE Cc1ccc(C(=O)NC2(C(=O)NCC3CC3)CCCC2)c(O)c1O 179537304 GLPZBWIVTQHIIQ-UHFFFAOYSA-N 332.400 1.975 10 10 EDCE Cc1cc(C(=O)NC[C@@H]2CN(C)CCO2)c(C)n1-c1ccccn1 171287352 TZSFOGCMNMVMIM-OAHLLOKOSA-N 328.416 1.550 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1c(=O)[nH]c2ccccc21 183424359 BATUKBLRPUEKLN-LLVKDONJSA-N 341.367 1.488 10 10 EDCE COCC(=O)NC1CN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 186313032 MJLQDLSNDGLWPF-UHFFFAOYSA-N 341.411 1.681 10 10 EDCE COc1cccc(N2C[C@@H](NC(=O)Cc3ccc(N)cc3)CC2=O)c1 364237434 NUCIGYOTTFEOEC-HNNXBMFYSA-N 339.395 1.742 10 10 EDCE Cc1ccc(CN2C[C@@H]3CN[C@@H](CO)[C@H]3C2)c(O)c1Br 2380800711 KTYDITCHNFSTHI-AVGNSLFASA-N 341.249 1.475 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCCOCC(F)F 588563875 YJCUZFHLHBLHOO-UTCJRWHESA-N 340.370 1.934 10 10 EDCE COC[C@](C)(O)CCNC(=O)NCc1ccc(N2CCCC2)cc1 836243536 BWRURBAPYKPDNV-GOSISDBHSA-N 335.448 1.874 10 10 EDCE CC(=O)N1CCN(CCNC/C=C\c2ccc(N(C)C)cc2)CC1 835037894 YTNKXUVUXPYECG-PLNGDYQASA-N 330.476 1.520 10 10 EDCE Cc1ccc(C(=O)N2CCS(=O)(=O)[C@@H]3CCC[C@@H]32)c(O)c1O 837095369 CIOJSVZZPJZRHV-NWDGAFQWSA-N 325.386 1.198 10 10 EDCE C[C@H](N)[C@@H](C)NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 841915656 SPNPKSPMVQSAOG-WDEREUQCSA-N 342.390 1.336 10 10 EDCE O=C(NCCCCN1CCOCC1)NCc1c(O)cccc1F 914098005 RRGTUSQENHHQOM-UHFFFAOYSA-N 325.384 1.443 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ncn(C(C)C)n2)c1 845857949 WXGITIYSQCKLRT-SNVBAGLBSA-N 347.375 1.389 10 10 EDCE C[C@H](Sc1nnnn1C1CC1)C(=O)NCc1c(O)cccc1F 928711111 DSFMLAQBZYFZJL-QMMMGPOBSA-N 337.380 1.650 10 10 EDCE CC1(C)CCCN[C@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 844171805 XTBQBOSSDLIUFS-KRWDZBQOSA-N 331.460 1.918 10 10 EDCE CN1C[C@H](CCNCc2ccc(N3CCC(O)CC3)cc2)CC1=O 922483828 BLYYQZOGWFWKHG-MRXNPFEDSA-N 331.460 1.606 10 10 EDCE Cc1cncn1CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 858784905 BEBCCQJULZIYIX-HNNXBMFYSA-N 328.416 1.906 10 10 EDCE COC[C@@H]1CC[C@@H]([C@H]2COCCN2C(=O)Nc2ccc(N)cc2)O1 926141485 DNNRUOLPUZFSEH-XHSDSOJGSA-N 335.404 1.696 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CN3CC4CC3(C)C4)CC2)cc1 852786963 QPONPBSJDPDKOF-KGXSXCIVSA-N 345.487 1.662 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)CCCN(C)C)C2)cc1 867497094 MQSWVRJCBXYNGW-AWEZNQCLSA-N 341.477 1.145 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1nnc(C2CC2)o1 865909465 QZOWFQTVSWAOSW-UHFFFAOYSA-N 346.362 1.853 10 10 EDCE Cn1nnnc1SCCC(=O)NCc1ccc2cccnc2c1O 862027938 KGTSDBMFMAQLJE-UHFFFAOYSA-N 344.400 1.263 10 10 EDCE O=C1OC[C@@]2(CNCc3ccc(N4CCCCC4)cc3)COCCN12 865769104 UBSNSRKKOYZGCX-LJQANCHMSA-N 345.443 1.988 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCO[C@H](CC(N)=O)C2)c1 862535609 SUBFYNFOLMXGSS-LLVKDONJSA-N 343.221 1.539 10 10 EDCE COC(=O)C[C@]1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCOC1 1138102802 CFZQRGNFLDZFNQ-OAHLLOKOSA-N 334.332 1.301 10 10 EDCE O=C1C[C@]2(CCN(Cc3cccc(Br)c3O)C2)CN1 789767861 LQWYXNSAVGFFBL-CQSZACIVSA-N 325.206 1.867 10 10 EDCE CN(C1COC1)C1CN(c2ccc(CN)c(Br)c2)C1 2116494657 KMTHNSSCLWDQIL-UHFFFAOYSA-N 326.238 1.427 10 10 EDCE C[C@H](CO)C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329497751 STURMTHVDFZXCO-GFCCVEGCSA-N 332.400 1.101 10 10 EDCE C[C@H]1CN(c2ccc(CN)cc2Br)C[C@@H](CCO)O1 2122800134 OWYSZVCWXIGQOR-CMPLNLGQSA-N 329.238 1.884 10 10 EDCE CC/C=C(\C)C(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1295178212 MKAIUKPDNTVHKY-JKCCJBJRSA-N 347.415 1.832 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1ccc(-c2nn[nH]n2)cn1 1627072832 FGXIRCOVXDONHL-UHFFFAOYSA-N 347.338 1.446 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC(=O)N[C@@H]3CCCC[C@H]32)cc1 1622868994 LVIBZBOZDVIRIJ-CHWSQXEVSA-N 329.360 1.732 10 10 EDCE CC[C@@H](C)CC(=O)NC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1720906849 LQMXWRAJHAWQTM-NEPJUHHUSA-N 337.420 1.770 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2nonc2C)cc1C 1497766938 UQDDBAPERNMERY-SNAWJCMRSA-N 330.388 1.771 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccc(C)o2)cc1C 1568550563 NAUXKCHFRCSEOL-HNNXBMFYSA-N 332.400 1.786 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)C2=COCCO2)cc1C 1567205973 NJPDSMOIYMDRMC-AWEZNQCLSA-N 334.416 1.876 10 10 EDCE CNC(=O)[C@H](C)CN(C)c1ccc(CN)c(Br)c1F 231841012 MQRMBDIKCWDXBQ-MRVPVSSYSA-N 332.217 1.865 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1(F)F 2003170370 QCRGKAUPNAKSGY-QFOLPQNPSA-N 346.374 1.658 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CC(=O)N2CC(N=[N+]=[N-])C2)C1 1985100858 JZEJRFPMVFVRQB-GXSJLCMTSA-N 325.369 1.125 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2C[C@]21C(=O)C(=O)C[C@H]1C[C@H](N)C1 2008508788 QUUIVHOKQNUSQU-LCTGZXLESA-N 336.432 1.945 10 10 EDCE CC(C)(C)OC(=O)N=c1cc(C(=O)NCc2ccccc2O)[nH][nH]1 2010084835 LQQIASBRYFBUBZ-UHFFFAOYSA-N 332.360 1.814 10 10 EDCE CN[C@@H](C)c1ccc(N2CC[C@@](O)(CO)C2)cc1Br 313753622 RFUCJYAZSVAVBP-HZMBPMFUSA-N 329.238 1.663 10 10 EDCE C[C@H]1CS(=O)(=O)C[C@H]1NCc1c(O)cccc1Br 711773100 DVSAMEXJULXEDY-GZMMTYOYSA-N 334.235 1.677 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC(CN4CCCC4)CC3)c2n1 2063977722 ABQPYNFLBSYNPI-UHFFFAOYSA-N 343.431 1.691 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cccc(O)c2O)[C@H]2C[C@@H]21 884842920 GZMBMTZBPCWOII-RYUDHWBXSA-N 334.372 1.932 10 10 EDCE CN[C@H](C)c1ccc(N(C)[C@H]2CC(=O)NC2=O)c(Br)c1 2171209870 ZBPYJGBZBDTTDT-PELKAZGASA-N 340.221 1.581 10 10 EDCE OCc1ccc(N2CC[C@@H](N3CC(O)C3)C2)cc1Br 2102519505 HBZZPFIPVRFSLA-GFCCVEGCSA-N 327.222 1.197 10 10 EDCE CN(C)C(=O)[C@@H]1CCN(c2ccc(CO)cc2Br)C1 2087357384 MUXUIOOVCNLXAK-LLVKDONJSA-N 327.222 1.856 10 10 EDCE CCN(c1cc(Br)c(CN)cc1F)[C@H]1CCNC1=O 2114765416 VZCZXIFHIDOTFN-NSHDSACASA-N 330.201 1.762 10 10 EDCE COc1ccc(Br)c(CNCC[C@H]2CCNC2=O)c1O 2236050449 FZNLZQUDOOIPSO-VIFPVBQESA-N 343.221 1.779 10 10 EDCE COc1cccc(C=C2SC(NC(C)=O)=NC2=O)c1OC(C)=O 2294010821 LZMHGYLWOWDJJC-UHFFFAOYSA-N 334.353 1.727 10 10 EDCE O=C(O)[C@]12CCO[C@H]1CN(Cc1c(O)cccc1Br)C2 2296418539 LDYIEQBWLGUAAC-JSGCOSHPSA-N 342.189 1.830 10 10 EDCE Cc1ccc(=NCCCNC(=O)C=Cc2ccc(O)c(O)c2)[nH]c1 2307989978 RCVOAMAZNGDLMN-UHFFFAOYSA-N 327.384 1.855 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCC1=CCNCC1 2310294633 MHOZSOPTUNBBAR-UHFFFAOYSA-N 327.428 1.572 10 10 EDCE C[C@H](CCC(=O)O)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2311977682 QZEAUVOXHXLGJB-CQSZACIVSA-N 332.400 1.906 10 10 EDCE CCC(=O)N(C)C1CN(c2ccc(CO)c(Br)c2)C1 2352223867 TUEDIVQOBISNQW-UHFFFAOYSA-N 327.222 1.998 10 10 EDCE C[C@H](NC[C@@]1(CCO)CCOC1)c1ccc(N2CCOCC2)cc1 125438111 AWOXUNDFJZGDHC-QFBILLFUSA-N 334.460 1.963 10 10 EDCE O=[N+]([O-])c1cc(Cl)cc(CN2CCO[C@@]3(CCOC3)C2)c1O 187537837 XYYGKIGGZVJIGI-AWEZNQCLSA-N 328.752 1.945 10 10 EDCE CCN[C@H](C)c1ccc(N2CC([C@H](O)CO)C2)cc1Br 2361913667 OOVUPFVOULJLDP-MEBBXXQBSA-N 343.265 1.909 10 10 EDCE COC[C@H](O)CN1CCC(N[C@@H](C)c2cc(F)ccc2O)CC1 186195191 WQFBLPOTXCVACO-SWLSCSKDSA-N 326.412 1.654 10 10 EDCE COc1ccc(N2CCN(C(=O)Nc3ccc(=O)n(C)c3)CC2)cc1 194726709 OXSAXDBMYVNAMH-UHFFFAOYSA-N 342.399 1.748 10 10 EDCE CCn1cncc1S(=O)(=O)N1CCOc2cc(N(C)C)ccc21 433683572 FERPISBRPBXBSA-UHFFFAOYSA-N 336.417 1.557 10 10 EDCE CCC[C@](C)(O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 269284511 BVJFETHCZHSPLI-IBGZPJMESA-N 349.475 1.485 10 10 EDCE Cc1ccc(CNC(=O)C2(O)CCNCC2)c(O)c1Br 2381129420 KAKMLSTUJBMQKN-UHFFFAOYSA-N 343.221 1.194 10 10 EDCE CO[C@]1(CN[C@H](C)c2ccc(Cl)cc2O)CCS(=O)(=O)C1 903362309 DFWGUEPGWKESOR-YGRLFVJLSA-N 333.837 1.900 10 10 EDCE C[C@H](O)C[C@H]1COCCN1C(=O)c1cc2cc(O)c(O)cc2s1 907416060 GAKZXTPUVDJZMR-ONGXEEELSA-N 337.397 1.924 10 10 EDCE CCNS(=O)(=O)[C@@H]1CCN(C/C=C\c2ccc(N(C)C)cc2)C1 835045646 XPDWKEBYUWYSDY-KEGWNNHHSA-N 337.489 1.779 10 10 EDCE COc1cc([C@]2(C(=O)O)C[C@H]2NC(=O)OC(C)(C)C)cc(O)c1O 1952829108 HXPMWLZVANAVHX-BDJLRTHQSA-N 339.344 1.726 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CC[C@H](C(=O)O)O3)C2)cc1 849182610 HAPSCASXDYKPQT-NILFDRSVSA-N 334.372 1.022 10 10 EDCE COCCNC1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 846222599 KHMUFFUOADUYNI-UHFFFAOYSA-N 348.491 1.069 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC2(CCN2)CC1 844224420 JYUJHMBQPLTVMU-UHFFFAOYSA-N 330.476 1.539 10 10 EDCE CCC[C@@H](C(=O)OCC)S(=O)(=O)NCc1c(O)cccc1F 921451631 SYCNXFJIMIHHLT-ZDUSSCGKSA-N 333.381 1.683 10 10 EDCE CN(C[C@@H](O)COCc1ccccc1)C(=O)NCc1ccc(N)cc1 1337077822 BGOCBTGGSJXEMG-GOSISDBHSA-N 343.427 1.988 10 10 EDCE O=C(C=C1CCNCC1)NCc1ccc(N2CCC(CO)CC2)cc1 852860675 UMGNHHFQFFHXCR-UHFFFAOYSA-N 343.471 1.821 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccnc4[nH]nnc34)C2)cc1 855227348 XKRWLZMBMQOQBQ-NSHDSACASA-N 338.371 1.370 10 10 EDCE CC(=O)c1cc(F)cc(CN(C)C[C@@H]2CCS(=O)(=O)C2)c1O 750825995 HJZJBVOSEPYPFC-NSHDSACASA-N 329.393 1.600 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@H]4CC[C@@H](C3)[S@@]4=O)cc2)CC1 862526410 AUSGYZOCUXAPLO-YDIMBITNSA-N 347.528 1.924 10 10 EDCE C/C=C/C[C@@H]1NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 761068657 ISPJDUOOTGRGNK-KZSQQDEKSA-N 329.400 1.910 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H](C)S(N)(=O)=O 768613623 JJBKTCCANBGKDV-LLVKDONJSA-N 341.458 1.562 10 10 EDCE Cn1ccnc1C1(O)CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 1123895245 RCDVGYYAQGCFOL-HYXAFXHYSA-N 343.383 1.355 10 10 EDCE C[C@H]1COCCN1C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1141597767 FVGIKKMVPBELRD-ZDUSSCGKSA-N 334.416 1.352 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H](O)Cc1ccccc1F 1177982228 VELKQYNVGHNTIG-IZPAUZPXSA-N 331.343 1.970 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)C[C@H](O)C2)cc1Br 2126909453 PZUQMMLRWHDLEL-DLOVCJGASA-N 329.238 1.661 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ncoc2C)cc1C 1331682972 KLYSXMGFWZLDGF-CQSZACIVSA-N 333.388 1.181 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC([C@H]2CCCN2)CC1 1261875793 RBGIZCPGENLVKM-MRXNPFEDSA-N 343.427 1.225 10 10 EDCE COCC(=O)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@@H]1C 1281140040 JYJDOFPFCSQLRQ-MFKMUULPSA-N 347.375 1.215 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@@H]2CC23CC3)cc(OC)n1 1284344558 QSKREVOLBJUULS-JQWIXIFHSA-N 333.388 1.133 10 10 EDCE CN(CC1(CO)CC1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 1915533437 PEJBXDLMHGVENE-LBPRGKRZSA-N 340.221 1.610 10 10 EDCE CCn1cc(CNC(=O)NCc2ccc(N(C)C)cc2)c(O)nc1=O 1527367539 WZCPRFNPACXOOK-UHFFFAOYSA-N 345.403 1.034 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)C[C@@H]2COC(=O)C2)cc1C 1483460844 KHVZGFCIBGCPBI-INIZCTEOSA-N 348.443 1.895 10 10 EDCE CN(C)C[C@@H]1C[C@H](O)CN1c1ccc(CN)c(Br)c1 228153774 FZZPZPHONUCWMI-STQMWFEESA-N 328.254 1.409 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CN1C(=O)CCC1=O 1623545791 FAHHMLSUWDMEAG-UHFFFAOYSA-N 329.400 1.394 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccnc(C)n1 1631531052 FRCRVPJIQBQUJM-UHFFFAOYSA-N 349.774 1.959 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc[n+]([O-])c1 1639585304 UFYXMSYHKAGMPG-UHFFFAOYSA-N 330.340 1.231 10 10 EDCE COc1ccc(CNC(=O)c2ccn(CCn3cccn3)n2)c(O)c1 1568097326 FLXFISHRUIPBNG-UHFFFAOYSA-N 341.371 1.424 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCCS(=O)(=O)C[C@@H]1C1CC1 1636377154 ADTHWNRYKHCVHE-CYBMUJFWSA-N 339.413 1.066 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H]2CNC(=O)CC2CC2)cc1 1584554458 QVEPZHNRBWDIRG-CQSZACIVSA-N 343.387 1.980 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)C[C@@H]2CCNC2=O)cc1C 1674196695 PGVMIXQJVHBQJA-HOCLYGCPSA-N 347.459 1.514 10 10 EDCE C[C@]1(C(N)=O)CCN(c2ccc(CN)c(Br)c2F)C1 235759711 AMCRYZJNRFKFFQ-ZDUSSCGKSA-N 330.201 1.749 10 10 EDCE O=C(NC1CN(C(=O)c2ccc(O)c(O)c2)C1)OCc1ccccc1 1962353270 KZBJPPLDLWYGQW-UHFFFAOYSA-N 342.351 1.849 10 10 EDCE NCc1ccc(N2C[C@]3(CO)CC[C@@]3(CO)C2)c(Br)c1 2145750140 XPWJFOXBBOMLQQ-GJZGRUSLSA-N 341.249 1.479 10 10 EDCE COC1CC(NC(=O)OC(C)(C)C)(C(=O)N(C)CCN=[N+]=[N-])C1 1985101447 SLMCWJFXDNBABQ-UHFFFAOYSA-N 327.385 1.827 10 10 EDCE O=C1Nc2cc(N3C[C@H]4[C@@H](O)C[C@H]4C3)c(Br)cc2[C@H]1O 2151389553 BAPMBWKVGOYXOA-BAJQXQOGSA-N 339.189 1.252 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)COc2ccc(N)cc2)CO1 1999121958 DNJRZSCEWRBRSJ-GFCCVEGCSA-N 337.376 1.315 10 10 EDCE Cn1cc(Br)c(C(=O)Nc2ccc(O)cc2C(=O)O)n1 693092398 QJSKCGAKWIHKEK-UHFFFAOYSA-N 340.133 1.839 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC[C@@H](CN4CCCCC4)C3)c2n1 2063369208 FZEUUTDQVKATFM-AWEZNQCLSA-N 343.431 1.691 10 10 EDCE COC1(CF)CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2168888702 LXCCEFMTIOSNDH-LLVKDONJSA-N 344.184 1.576 10 10 EDCE Cn1nc(CNC(=O)OC(C)(C)C)cc1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2060613587 SWKLYQIALWVWOT-JTQLQIEISA-N 349.395 1.970 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)NCc2ccccc2O)=C[C@@H]1O 2067793008 QQKBEAFEXRKPEB-HIFRSBDPSA-N 348.399 1.593 10 10 EDCE C[C@@H]1CN(Cc2c(O)cccc2Br)[C@H](C(=O)O)CO1 2109527059 USVPXJIMVPEDIP-KCJUWKMLSA-N 330.178 1.829 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@H](N(C)C)C2)cc1Br 2089926805 NCAPQIIAOFDPEH-FZQKWOKYSA-N 328.254 1.580 10 10 EDCE NCc1ccc(N2C[C@@H]3OCCO[C@H]3C2)c(F)c1Br 2093346293 VHQADYNHTBKSCJ-QWRGUYRKSA-N 331.185 1.651 10 10 EDCE Oc1c(Br)cccc1CN[C@@H]1CCN(C2COC2)C1 2113266235 NHYIWRHRMWCLJE-LLVKDONJSA-N 327.222 1.717 10 10 EDCE O=C1Nc2cc(N3C[C@@H](O)C[C@H](F)C3)c(Br)cc2[C@@H]1O 2234673716 VCWCNUUFELRVTG-WSFZALMZSA-N 345.168 1.344 10 10 EDCE OC[C@@H]1NC[C@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@@H]21 2235576896 UZLLEXZVMVEEBV-GAFUQQFSSA-N 345.212 1.306 10 10 EDCE CCc1cccc(N(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c1 493821518 WULQFWRXWYCENU-MDZDMXLPSA-N 327.384 1.323 10 10 EDCE COCCS(=O)(=O)NCc1ccc(C)c(Br)c1O 2327804396 PJZVJQFOKKZFAA-UHFFFAOYSA-N 338.223 1.529 10 10 EDCE CNCc1ccc(N2CC(O)(CN(C)C)C2)c(Br)c1 2343639964 AOUUIFJCRWMCQU-UHFFFAOYSA-N 328.254 1.281 10 10 EDCE CO[C@@H](CN)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2352660977 KJDDGXINAGNVPU-JTQLQIEISA-N 331.210 1.395 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2355340215 NRYWULHGYCXGKD-FWYKCERLSA-N 342.233 1.823 10 10 EDCE Cc1nn(C)c(Cl)c1S(=O)(=O)NCc1ccc(N(C)C)cc1 55985636 ICZBWVNIKKWNBX-UHFFFAOYSA-N 342.852 1.926 10 10 EDCE CCCC(=O)NCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 117975862 MZUQDYJRCYZFIU-HNNXBMFYSA-N 334.416 1.816 10 10 EDCE C[C@H]1CC[C@@H](C(N)=O)CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 78490037 NWVMQPXKMVCEHJ-GOEBONIOSA-N 346.475 1.297 10 10 EDCE Cc1ccnc(CNC(=S)Nc2ccc(S(N)(=O)=O)cc2)c1 242551993 CBQUNUZTAVGNHK-UHFFFAOYSA-N 336.442 1.524 10 10 EDCE Oc1cc2c(cc1CN1CCC(CO[C@@H]3CCNC3)CC1)OCO2 530249824 ZASJYNQPGWZKOC-OAHLLOKOSA-N 334.416 1.711 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(C)COC[C@H]2N)c(O)c1Br 2380725248 JDCFXBPXAROPDO-YGRLFVJLSA-N 343.221 1.443 10 10 EDCE CCOc1ccc(O)c(CN[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)c1 800310280 VRGRFYKYLOTKMQ-IUODEOHRSA-N 342.461 1.598 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCC[C@H](CO)C2)c1 298125657 AFQNAIBEXAXIBG-QWRGUYRKSA-N 342.417 1.045 10 10 EDCE CC(=O)C(=O)COC(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2 808496632 YRAVJVLCSAOICW-UHFFFAOYSA-N 335.400 1.410 10 10 EDCE COCCOc1cn(-c2ccccc2)nc1C(=O)OCC(=O)C(C)=O 808515012 HDNXKFHNTPWUGA-UHFFFAOYSA-N 346.339 1.212 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)N3CCCO3)CC2)cc1 292243307 FIBKVJDMYBDAAQ-UHFFFAOYSA-N 348.447 1.554 10 10 EDCE C[C@H]1CN(CCO)CCN1Cc1cccc(Br)c1O 825338321 OJVHOJUSKVHMKV-NSHDSACASA-N 329.238 1.653 10 10 EDCE COCCC1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 828497379 WNDLFNHLNJBYJH-UHFFFAOYSA-N 343.427 1.174 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NCc3ccnn3C)C2)cc1 822605789 AOMUESAGXGNIHU-CQSZACIVSA-N 343.431 1.754 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](C(=O)O)C3CC3)CC2)c(OC)c1 902413039 RXFHTPVPRHIHIU-MRXNPFEDSA-N 348.399 1.463 10 10 EDCE CN1C[C@H](O)C[C@@]1(C)C(=O)NCc1ccc(N2CCCCC2)cc1 900405592 YVINMWUJKNUTON-MJGOQNOKSA-N 331.460 1.748 10 10 EDCE CC(=O)C(=O)COC(=O)c1cnn(C(C)(C)C)c1Br 849978261 LDRJHMRRZCOAOR-UHFFFAOYSA-N 331.166 1.716 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@H](C)CCO)C2)cc1 854296647 FMQOFOBZCINLOU-LSDHHAIUSA-N 335.448 1.982 10 10 EDCE COC(=O)Cc1ccccc1NC(=O)C(=O)NCc1ccccc1O 752096445 HERTZZCXODRNGR-UHFFFAOYSA-N 342.351 1.363 10 10 EDCE CC(C)(CNS(C)(=O)=O)NCc1ccc(N2CCCC2)cc1 1119614607 FPPLWFKAVYKIJV-UHFFFAOYSA-N 325.478 1.704 10 10 EDCE CN1CCN(c2ccc(CN3CCSC[C@H]3CCO)cc2)CC1 775737236 LHIKLICQYAWIIG-GOSISDBHSA-N 335.517 1.738 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C(=O)OCC)no1 1157102988 UJLMCUSVQKNATM-UHFFFAOYSA-N 339.344 1.973 10 10 EDCE O=C(Cc1csc(-c2nc[nH]n2)n1)NCc1c(O)cccc1O 1178911884 QKPOKZFACXCEKH-UHFFFAOYSA-N 331.357 1.198 10 10 EDCE Oc1c(Br)cccc1CN[C@@]12CC[C@@H](C1)[C@H](O)[C@H]2O 2120387799 BZGHEFAYOJHCES-IOEYQFCTSA-N 328.206 1.519 10 10 EDCE CO[C@H](CCNC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1902037569 SZMPVZFFJBNWFI-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE O=C(C(=O)N1CC[C@@H](N2CCCCC2)C1)N1Cc2cccc(O)c2C1 1330415561 NVYHRVQLQIGDAQ-OAHLLOKOSA-N 343.427 1.321 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@H]2C[C@H]2C(N)=O)C2CC2)cc1C 1266431590 PSFQUOIZPWXHLE-PMPSAXMXSA-N 345.443 1.109 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H](C)NC(C)=O)cc1C 1277750886 DGWQNJKBAUJBLF-KGLIPLIRSA-N 335.448 1.465 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C[C@H]2CCCO2)cc1C 1283733697 JJLJGAOMWBYSRV-JKSUJKDBSA-N 336.432 1.139 10 10 EDCE COC[C@H](C)N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 221243413 ZKOAKTJOXOQOFG-JVXZTZIISA-N 328.210 1.872 10 10 EDCE O=C(Cc1ccnc(F)c1)NCc1ccc(N2CCOCC2)cc1 1464449662 HLIKAGNXAWDGFV-UHFFFAOYSA-N 329.375 1.916 10 10 EDCE CN(CC(=O)NCc1cccc(Cl)c1O)c1ncnc2[nH]cnc12 1606860507 OEBNJKMGUVAOER-UHFFFAOYSA-N 346.778 1.465 10 10 EDCE O=C(NCc1ccccc1O)NCC1(N2CCOCC2)CCOCC1 1470452271 MUGBHWUTVQSFBW-UHFFFAOYSA-N 349.431 1.073 10 10 EDCE O=C([C@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1)N1CCCC1 1540502715 IGFZBOYDICMOIS-GFCCVEGCSA-N 336.413 1.164 10 10 EDCE C/C(=C\C(=O)N(C)c1cccc(S(C)(=O)=O)c1)c1cnccn1 1544790607 KWOPFRIJCYCHPI-FMIVXFBMSA-N 331.397 1.946 10 10 EDCE C[C@]1(O)CN(c2ccc(CN)c(Br)c2F)CC[C@H]1O 2136845634 KAQHPAYWUBWYIE-MFKMUULPSA-N 333.201 1.369 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](O)[C@@](C)(O)C2)cc1Br 2136877650 JAUWKGOJWOUQNP-IIMNLJJBSA-N 330.222 1.824 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccc(C)o2)cc1C 1568550564 NAUXKCHFRCSEOL-OAHLLOKOSA-N 332.400 1.786 10 10 EDCE C[C@@H](F)CCNC[C@@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1732667105 OIRZHNPXWDGHKB-ZWNOBZJWSA-N 339.371 1.277 10 10 EDCE O=C(N[C@@H]1CN(c2ccc(F)cc2)C1=O)c1c(F)ccc(O)c1O 1648708802 YCBIQJPRBUEENR-LLVKDONJSA-N 334.278 1.521 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@@H]1C[C@H]1C 1758781597 RIYVTHOGDJZLCC-GIPNMCIBSA-N 331.376 1.740 10 10 EDCE C[C@@]1(O)CC[C@@H](O)c2c1ccc1c2C(=O)C(=O)c2c(CO)coc2-1 102474715 GSUXVWUEFDCUBE-ADLMAVQZSA-N 328.320 1.853 10 10 EDCE biogenic O=C(O)[C@]1(O)CCCN(Cc2ccc(Br)cc2O)C1 1964721230 ALQDSSSUDAWZMZ-ZDUSSCGKSA-N 330.178 1.566 10 10 EDCE CN(Cc1cn(C)nc1Br)C(=O)c1cc(O)nc(O)c1 2173260608 CDWDHSLFVQLEJA-UHFFFAOYSA-N 341.165 1.261 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@]1(O)CCc2cc(F)ccc21 2062521480 KQJYEGITFFCFAU-SFHVURJKSA-N 331.343 1.730 10 10 EDCE CCCN1CCN(C(=O)c2cnn3c(O)cc(C)nc23)C(C)(C)C1=O 2064425866 YTWKQMUYBUEHJZ-UHFFFAOYSA-N 345.403 1.216 10 10 EDCE CC(C)(C)OC(=O)N1CCOCC[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2249052581 XRDUHJMTLNNPRK-JHJVBQTASA-N 340.420 1.278 10 10 EDCE CN1C(=O)C(=Cc2ccc(C(=O)NCC(=O)O)cc2)SC1=S 2297480134 BJAZPEKTPJYSNC-UHFFFAOYSA-N 336.394 1.332 10 10 EDCE C[C@H]1NCCC[C@@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2312036081 PZZPXJPLXZVXFN-QAPCUYQASA-N 329.444 1.793 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)c(F)c1Br 2355335293 ZACMVFHHEMOBKY-VTEVMWQTSA-N 345.212 1.367 10 10 EDCE COc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(OC)c1Br 2358637174 SGSHODTWALLFBL-MPZLTGKNSA-N 344.205 1.397 10 10 EDCE Cc1nc(C)n(C[C@H]2CCCN(C(=O)c3cccc(O)c3O)C2)n1 193074771 MSVPKPOEBWAYAJ-ZDUSSCGKSA-N 330.388 1.859 10 10 EDCE O=[N+]([O-])c1cc(Cl)cc(CN2CCN3CCOC[C@H]3C2)c1O 363891303 TYSBXBWDGOFMJM-GFCCVEGCSA-N 327.768 1.470 10 10 EDCE Oc1cc2c(cc1CNC[C@H]1CCC3(CCOCC3)[C@@H]1O)OCO2 282843847 OZDUOVJQHWXDRV-SJKOYZFVSA-N 335.400 1.778 10 10 EDCE COc1cccc(CNC(=O)N[C@@H]2CCC(=O)NC23CCC3)c1O 282789022 FVWYYBXPVVPYFG-CYBMUJFWSA-N 333.388 1.401 10 10 EDCE CC[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CCO1 817828640 KVGYQTYIQGCJQH-DOTOQJQBSA-N 347.459 1.751 10 10 EDCE CC[C@H](O)CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 828259749 SLKAHHSQASCMLV-IBGZPJMESA-N 345.487 1.996 10 10 EDCE CCN(CC)c1ccc(CNC(=O)c2cn([C@@H]3CC[C@H]3O)nn2)cc1 900261684 WIUWDSIBDHHDGB-IAGOWNOFSA-N 343.431 1.750 10 10 EDCE CNC(=O)[C@@H]1CN(Cc2cccc3c2CCNC3)c2ccccc2O1 662248802 JUTNDFCGLPBBJU-IBGZPJMESA-N 337.423 1.846 10 10 EDCE CCO[C@@H]1[C@H](C)[C@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 906318596 ZVMXFPGJIFEXIS-CSMYWGQOSA-N 336.407 1.950 10 10 EDCE C[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 914336492 ZIAWYCJHBLUFNW-HNNXBMFYSA-N 333.432 1.844 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CO[C@H](CNC(=O)OC(C)(C)C)C1 1895875964 OYUZVIMVXMQDEM-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@@](O)(C(F)(F)F)C2)cc1 747868009 LIBLKGPCACECNK-AWEZNQCLSA-N 331.338 1.961 10 10 EDCE COC/C=C\C(=O)NCc1cc(NC(=O)/C=C\COC)ccc1O 923118880 JYPOKKZCTXHTGQ-GLIMQPGKSA-N 334.372 1.352 10 10 EDCE CCOC(=O)[C@@H](N)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 852866208 GHNIKULYKPKTFA-INIZCTEOSA-N 333.432 1.430 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@]3(C)CCC(=O)N3)C2)cc1 852379500 RHRXNGMBJXTTKW-ACJLOTCBSA-N 346.431 1.242 10 10 EDCE COc1ccc(N(C)C[C@@H](O)COC[C@@H]2CCCO2)c(OC)c1 752126476 SUSXLYNNISQBQL-HIFRSBDPSA-N 325.405 1.697 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H](CCF)C2)c1 855826482 DFXNLDSMKCEMMH-NSHDSACASA-N 344.408 1.976 10 10 EDCE O=C(NC[C@@H]1CN(Cc2ccncc2)CCO1)c1cc(O)cs1 863497594 XUHZVNAGZOMDRO-CQSZACIVSA-N 333.413 1.480 10 10 EDCE CO[C@H]1CC[C@@H](C)N(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 867721393 UVVJIHPQOJCLQB-PBHICJAKSA-N 347.459 1.737 10 10 EDCE O=C1OC[C@@]2(CNCc3c(O)ccc(Cl)c3F)COCCN12 865770917 VWKWZQAJJMJXPD-CQSZACIVSA-N 330.743 1.496 10 10 EDCE O=C1N[C@H](CC2CC2)C(=O)N1Cc1ccc(N2CCOCC2)cc1 761070204 PQYMPCURXBXVEH-MRXNPFEDSA-N 329.400 1.744 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCN([S@](C)(=N)=O)CC2)c1O 879943364 FYPIRVURDWLXJS-QFIPXVFZSA-N 345.852 1.957 10 10 EDCE C[C@H](NC(=O)N(C)CCCCO)c1ccc(N2CCOCC2)cc1 788313509 LPUBFCJHBDRSTR-HNNXBMFYSA-N 335.448 1.998 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C3CN([C@@H]4CCOC4)C3)C2)cc1 898580109 BSRCJFNLSJUZQB-NVXWUHKLSA-N 345.443 1.111 10 10 EDCE C[C@H]1CS(=O)(=O)CCN1C(=O)c1cc2cc(O)c(O)cc2s1 896508438 CSOVGCRMPLWPSG-QMMMGPOBSA-N 341.410 1.572 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1C(C)(C)C1(F)F 1329630903 IQHPPZIEPBTYPN-GFCCVEGCSA-N 326.343 1.758 10 10 EDCE C[C@H](c1ccccn1)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329353082 OYTNATAZDARKGS-GFCCVEGCSA-N 325.368 1.849 10 10 EDCE C[C@@H](NC(=O)CNC(=O)c1ccc2c(c1)OCO2)c1ccccc1O 1171716902 DMWPBPMKUUOUTI-LLVKDONJSA-N 342.351 1.728 10 10 EDCE C[C@H]1CN(c2ccc(CO)c(Br)c2)C[C@@H](CCO)O1 2122797930 GEHXJZUMCMBRHV-GXFFZTMASA-N 330.222 1.918 10 10 EDCE CCn1nncc1C(=O)NC[C@H](C)CNCc1ccc(OC)c(C)c1 1267979279 KUQZSNALFXPMGR-CYBMUJFWSA-N 345.447 1.771 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](c2cc(O)c(O)c(O)c2)[C@@H](C(=O)O)C1 1906097134 ODNHALMTKQYCFX-ZJUUUORDSA-N 339.344 1.839 10 10 EDCE CO[C@@H](C)CN[C@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1507159805 UQOQSAVQXBZECK-NEPJUHHUSA-N 335.408 1.934 10 10 EDCE Cc1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(C)n1NC(N)=O 1447561559 JIROVFLUHXVAIY-VIFPVBQESA-N 346.387 1.499 10 10 EDCE CN(C[C@H](N)COCc1ccccc1)C(=O)c1ccc(O)c(O)c1 1916340433 RMZTVTLNRGEENT-HNNXBMFYSA-N 330.384 1.714 10 10 EDCE CCC[C@H](C(=O)NCc1c(O)ccc2ccccc12)S(N)(=O)=O 1472085605 XCBVMDGONCXRRD-OAHLLOKOSA-N 336.413 1.619 10 10 EDCE NS(=O)(=O)c1cc(C(=O)N2Cc3cccc(O)c3C2)oc1Cl 1471355783 VHTRZIUJIZQNHK-UHFFFAOYSA-N 342.760 1.442 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCc2cnn[nH]2)cc1C 1480537408 DHAMBJRZHKLKAD-CYBMUJFWSA-N 331.420 1.349 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1conc1C 1556102064 PSSPBTABCNIEHO-LBPRGKRZSA-N 334.328 1.298 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@H]1CCN(CC(F)(F)F)C1 1630755419 HZMNVZVZPBHOSI-LLVKDONJSA-N 332.322 1.641 10 10 EDCE COCCN1CCCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 1639284298 QTCHACRETDTEHT-UHFFFAOYSA-N 339.392 1.771 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2[nH]ccc2C)cc1C 1734514798 YULLNZKWTTYZTD-INIZCTEOSA-N 345.443 1.863 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1640623029 MGMCTNPJTQPHSZ-HAQNSBGRSA-N 336.388 1.812 10 10 EDCE C[C@H](O)CCCN1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1692270875 RTPLROYGKUNNGT-NSHDSACASA-N 333.392 1.424 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc(N(C)C)nn3)CC2)cc1 1890509612 ADFOFRUBMBXIBN-UHFFFAOYSA-N 341.415 1.514 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@H]1COC[C@H]1NC(=O)OC(C)(C)C 1987648283 YYGUIPCNPQBCPX-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CCC(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010402339 PQNPCEUYAJGCQJ-VXGBXAGGSA-N 341.412 1.954 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@H](O)C[C@H]3C)c(Br)cc21 385109361 SBHLYSCPQZJTGP-RBDZCENOSA-N 340.221 1.621 10 10 EDCE NCc1ccc(N2CCSC[C@@H]2CO)c(F)c1Br 387794389 NZRPUWYERPFSPA-VIFPVBQESA-N 335.242 1.961 10 10 EDCE NCc1cc(F)c(N2C[C@H]3COC[C@@H](C2)[C@H]3O)cc1Br 2189071472 LRGMMGLEAYIKRB-WDAIWFPHSA-N 345.212 1.490 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)cc1Br 2189048985 KHHDRGURKHHTMX-KIGUWFBYSA-N 341.249 1.912 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CN(c3ccc(N)cc3)CCN2C1=O 2053193877 GQHPMQWANAVQFN-GJZGRUSLSA-N 346.431 1.583 10 10 EDCE Nc1ccc(NC(=O)NC[C@H]2CNCCN2Cc2ccccc2)cc1 2084721724 KJDRXUGCGMYGSK-GOSISDBHSA-N 339.443 1.864 10 10 EDCE C[C@H]1[C@H](C)S(=O)(=O)CCN1c1ccc(CN)cc1Br 2113895111 RQIWBQPOOWTBMX-UWVGGRQHSA-N 347.278 1.920 10 10 EDCE CN1CCc2cc(N3CC(O)(CNC(=O)OC(C)(C)C)C3)ccc21 2214255754 MYPCAGNGLOGCGV-UHFFFAOYSA-N 333.432 1.755 10 10 EDCE O=C1NC(=S)SC1=CN1N=C(c2ccccc2)C[C@H]1C(=O)O 2294778283 HYQCCICNCXPUNR-JTQLQIEISA-N 333.394 1.539 10 10 EDCE CSc1ncc(CNS(=O)(=O)C[C@H]2CCNC2(C)C)s1 2284725770 RPGPVVQIDZPIMS-SECBINFHSA-N 335.520 1.673 10 10 EDCE Cc1cc(CNC(=O)C=Cc2ccc(O)c(O)c2)nc(N(C)C)n1 2311475001 FTSANUSQJAHRCD-UHFFFAOYSA-N 328.372 1.592 10 10 EDCE Cc1ccc(CN(C)C(=O)c2cnn[nH]2)c(O)c1Br 2352658055 WAKJMHMMOMKING-UHFFFAOYSA-N 325.166 1.853 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)C3CCOCC3)CC2)cc1 57876820 PUMRGGWFISOUBG-UHFFFAOYSA-N 340.445 1.326 10 10 EDCE COc1ccc(N2CCN(C(=O)C3(O)CCSCC3)CC2)cc1 179627398 FTAZNYKXDVZYOR-UHFFFAOYSA-N 336.457 1.602 10 10 EDCE N[C@H]1[C@H]2C[C@H](CN(Cc3cc(Br)ccc3O)C2)[C@H]1CO 2358896370 LRWXUTPAVGKTEB-DLXBUUHESA-N 341.249 1.542 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)NC[C@@H]2CC3CCC2CC3)cc1 1345992871 LQOIIPBURORSCY-GPANFISMSA-N 329.444 1.870 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CN1CC(=O)NC1=O 265423352 BKTTWDZZCRLSGC-UHFFFAOYSA-N 332.404 1.041 10 10 EDCE Cc1cc(N2CCC[C@H](NC(=O)c3cccc(O)c3O)C2)n(C)n1 369331085 NWODEIAHJCICAM-LBPRGKRZSA-N 330.388 1.539 10 10 EDCE COC(=O)c1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)no1 280796507 OXMCWDANAUZDPH-UHFFFAOYSA-N 345.355 1.228 10 10 EDCE COc1cccc(CNC(=O)[C@@]23[C@@H]4[C@H]5C(=O)[C@H]2[C@@H]2[C@@H]5C[C@@H]4[C@H]23)c1O 800518893 JOGATLLCNPBQPL-NWIKOXLUSA-N 325.364 1.344 10 10 EDCE O=C1CC[C@@H](N2CCN(Cc3cc(Cl)ccc3O)CC2)CCN1 825148146 QWZKHQXOUUIOCB-OAHLLOKOSA-N 337.851 1.832 10 10 EDCE NC1CCC(OCC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 827567805 XTUQVEMFFNYCQB-UHFFFAOYSA-N 347.459 1.426 10 10 EDCE CO[C@@]1(C(=O)O)CCN(Cc2ccc(N3CCN(C)CC3)cc2)C1 901540384 CUNZWLYXKNKMJP-SFHVURJKSA-N 333.432 1.114 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CS(=O)(=O)NC(C)(C)C 734467832 GOPBGHCIPYCWKL-UHFFFAOYSA-N 341.477 1.395 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@@H]1CCNC12CCC2 903469757 BTGRGFFTKVHCMC-QGZVFWFLSA-N 330.476 1.585 10 10 EDCE Cn1nccc1[C@H](O)CNC(=O)NCc1ccc(N2CCCC2)cc1 914180631 SSTQRVUHNRQRKZ-QGZVFWFLSA-N 343.431 1.553 10 10 EDCE CCc1nn(CN2CCN(c3ccc(OC)cc3)CC2)c(=O)n1CC 842592269 HNMRXAFIXWNRAT-UHFFFAOYSA-N 345.447 1.415 10 10 EDCE CCCN(CCC)S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 747604665 PGNCOYLCHXVTOX-UHFFFAOYSA-N 349.478 1.837 10 10 EDCE C[C@@H]1C(=O)N(C)CN1Cc1c(O)ccc(C(=O)c2ccccc2)c1O 842643236 YJOVSFWDDKLYOU-GFCCVEGCSA-N 340.379 1.949 10 10 EDCE O=C(CN1CCN(c2ccccn2)CC1)NCc1c(O)cccc1F 928705965 POGCFZYOEDUEBX-UHFFFAOYSA-N 344.390 1.365 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCc3ccn(C)n3)C2)cc1 852254569 YSFWLPNKIDCURV-HNNXBMFYSA-N 343.431 1.549 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](O)C3CCC3)C2)cc1 854297241 LDSJALZFZXUMGI-PBHICJAKSA-N 333.432 1.734 10 10 EDCE CCC(=O)N1CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 852447882 GDMUEAKDYMZCTA-AWEZNQCLSA-N 346.431 1.495 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCCn3ccnn3)C2)cc1 852251466 WOTIZVJZGSHTBZ-CQSZACIVSA-N 344.419 1.255 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCc1cn(C)nn1 854987895 LYFMYKOXQJOKCI-UHFFFAOYSA-N 346.387 1.045 10 10 EDCE O=C1CC[C@@H](CNC(=O)NCc2ccc(N3CCSCC3)cc2)N1 853435727 NGPBCROAWSIVLR-AWEZNQCLSA-N 348.472 1.318 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCCC34OCCO4)C2)cc1 855224397 KISLXMYEEFVTSZ-WMLDXEAASA-N 346.427 1.933 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)CCN(C)C)C2)cc1 852188085 WGBHZUGRPUYOHC-HUUCEWRRSA-N 334.464 1.913 10 10 EDCE NC(=O)N[C@H]1CCN(C(=O)NCCCSc2nccs2)C1 763029775 TZXUYCGYKNRSLR-VIFPVBQESA-N 329.451 1.078 10 10 EDCE CCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc2cccnc2c1O 862027947 KREAHWQPOIUXMJ-CYBMUJFWSA-N 345.424 1.868 10 10 EDCE C[C@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)N(C)CC(=O)NC1CC1 774483352 KAHOBMURCDPDAM-KGLIPLIRSA-N 346.475 1.529 10 10 EDCE CC(C)N1C(=O)CN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1(C)C 779526154 PDSLVSHPWHYWPG-SOFGYWHQSA-N 332.400 1.969 10 10 EDCE COCCN(C(=O)NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCOC1 787126295 QVIGCHVURKXBFK-CQSZACIVSA-N 339.411 1.839 10 10 EDCE Cc1cc(N(C)C)ccc1CNCc1nnc2c(=O)n(C)ccn12 895639613 LYCHODMQFLTATR-UHFFFAOYSA-N 326.404 1.092 10 10 EDCE CS(=O)(=O)N1CCCC[C@@H]1CNCc1cc(Cl)ccc1O 796512556 DFFGNOJMYCIUAT-CYBMUJFWSA-N 332.853 1.949 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)CC(N)=O 1137816520 JJBGSPSJYXLRDY-VIFPVBQESA-N 342.779 1.059 10 10 EDCE C[C@H](NCc1c(O)cccc1Br)C(=O)N1CCOCC1 706843363 SZDOANWRPIAYCC-JTQLQIEISA-N 343.221 1.492 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3CC(C)(F)C3)CC2)cc1 795544992 UHLBOBNODCLCGW-INIZCTEOSA-N 337.439 1.222 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)C(C)(C)C(N)=O)C2)cc1C 1317111879 RXMONLCLMPJZDP-OKILXGFUSA-N 333.432 1.252 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCCC[C@H]2CNCCO)cc1 1317197471 ASCHBPRXVYRENQ-AWEZNQCLSA-N 333.392 1.426 10 10 EDCE CC[C@@H](CNC(=O)C[C@@H]1CCNC1=O)NCc1ccc(OC)c(C)c1 1318526941 BBKDINDSWXEGEP-HOTGVXAUSA-N 347.459 1.514 10 10 EDCE CC(C)N[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1329864259 AIPGGYAFKQRBNL-CQSZACIVSA-N 331.416 1.223 10 10 EDCE O=C(C(=O)N1CC[C@H]2OCCC[C@@H]2C1)N1Cc2cccc(O)c2C1 1331981455 PWVVTRXFVCSJDG-CZUORRHYSA-N 330.384 1.262 10 10 EDCE CN(CC(=O)N1CCCC1)c1ccc(CN)cc1Br 212940049 FQWBSHZRUVPJIJ-UHFFFAOYSA-N 326.238 1.966 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@@H](O)CN(C)CC(F)(F)F)c1 1192780992 ODEWWAWIAPSWLE-GHMZBOCLSA-N 336.354 1.906 10 10 EDCE O=C(C[C@H]1Oc2ccccc2NC1=O)NCc1ccc(O)cc1O 1299570988 OLANQURRYQULMQ-OAHLLOKOSA-N 328.324 1.504 10 10 EDCE CC(=O)N/C(=C/c1cccs1)C(=O)NCc1ccc(O)c(O)c1 1465953340 FLKGUIMGJKYSKZ-MDWZMJQESA-N 332.381 1.953 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cc(-n2ccnn2)ccc1F 1545669318 VFMQANWXAWIZFR-UHFFFAOYSA-N 342.330 1.790 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C(C)(C)C(F)F)cc1C 1715601083 DEPBEUJPKOPRPX-CYBMUJFWSA-N 344.402 1.862 10 10 EDCE C[C@@H](NC(=O)Cn1nccc1N)c1ccc(N2CCOCC2)cc1 1626978329 MOVZJIAZRPVGCU-CYBMUJFWSA-N 329.404 1.179 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H](CO)Cc2cccnc2)cc1 1626913815 VPGDBSZJXVIQDS-CYBMUJFWSA-N 341.371 1.825 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H]2CCN(C)C2=O)cc1C 1497654642 KRQHDRQQTYWBTF-APHBUQMISA-N 345.443 1.244 10 10 EDCE CN1CC[C@@H](C(=O)NCc2cc(O)ccc2O)[C@@H](c2cnn(C)c2)C1 1633599310 WYYZYLKJCMPAIZ-HZPDHXFCSA-N 344.415 1.183 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)[C@H](N)c1ccc2c(c1)CCN2C 2000228277 CJGYENMQGHAEOC-XZJROXQQSA-N 335.448 1.953 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)OCC12CC2 2012209021 AYTUBAFBAIBVCJ-LLVKDONJSA-N 337.380 1.676 10 10 EDCE CN1CC[C@H]2OCCN(c3ccc(CO)c(Br)c3)[C@H]2C1 2185588186 HJHAKUFJZSWMKI-LSDHHAIUSA-N 341.249 1.851 10 10 EDCE Cn1cc([C@@H](NC(=O)OC(C)(C)C)C(=O)N2CC[C@@H](N=[N+]=[N-])C2)cn1 2060635659 NXXBSJSZMKRAMB-VXGBXAGGSA-N 349.395 1.897 10 10 EDCE O=C(NC[C@H]1COCCN1Cc1ccccc1)c1cccc(O)c1O 2074174241 MJULUZOIWDDRAK-HNNXBMFYSA-N 342.395 1.729 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)cc1Br 2201289205 PBNQKVUUUXNRMZ-HDRXNWCYSA-N 338.249 1.897 10 10 EDCE Nc1ccc(CS(=O)(=O)Nc2nccc(Br)n2)cc1 2271988824 BJVSSTHPBQPMQU-UHFFFAOYSA-N 343.206 1.763 10 10 EDCE C[C@H]1CN(Cc2cc(Br)cc(F)c2O)CC2(CNC2)O1 2288444961 LGDJDRQCCNHLRT-VIFPVBQESA-N 345.212 1.857 10 10 EDCE C[C@H](O)[C@H](C(=O)O)N1C(=O)C(=Cc2cccc(F)c2)SC1=S 2323823489 MCNIRAFVAUGWKE-WRWORJQWSA-N 341.385 1.861 10 10 EDCE Cc1cc(C=C2SC(=S)N([C@H](CO)C(=O)O)C2=O)ccc1F 2323831668 PQRTXGFRVSABFV-SNVBAGLBSA-N 341.385 1.781 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)c(Br)c1 2355335597 DFDFXLNKVFYRGG-TYWRASTISA-N 341.249 1.789 10 10 EDCE COc1ccc([C@H](O)CNC(=O)c2cc(O)c(O)c(O)c2)cc1OC 170190463 LBEMUYNALBAZDF-CYBMUJFWSA-N 349.339 1.284 10 10 EDCE COc1cc([N+](=O)[O-])c(OC)c([C@@H]2N[C@@H](C(=O)O)CS2)c1O 83236703 HSVKCHGGRCGOJQ-BLTYZCFWSA-N 330.318 1.106 10 10 EDCE Cc1nn(C)c(C)c1CN1CCN(C(=O)c2cccc(O)c2O)CC1 193072567 OMSUXHMHPWZJPA-UHFFFAOYSA-N 344.415 1.406 10 10 EDCE Cc1ccc(N2CCCN(Cc3cc4c(cc3O)OCO4)CC2)nn1 93272208 AEEXUVGCACUNPT-UHFFFAOYSA-N 342.399 1.932 10 10 EDCE O=C(OCc1ccccc1)N1C[C@H](NCc2ccccc2O)[C@H](O)C1 713840850 SOVACMIBIIUINZ-FUHWJXTLSA-N 342.395 1.864 10 10 EDCE Cc1cc(CC(=O)NCCOCC(=O)O)c(C)n1-c1ccccc1 826139816 OWAMBTMHRAZWJY-UHFFFAOYSA-N 330.384 1.854 10 10 EDCE C[C@@H](CF)NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 838738566 FSCVVVHITRAINJ-JTQLQIEISA-N 331.338 1.959 10 10 EDCE CNCCNC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 841868490 DTDKUVXLFSFERA-UHFFFAOYSA-N 345.491 1.237 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)c3ccc(N)cc3)C2)cc1 849415983 JCEIRDALJJCVTE-CQSZACIVSA-N 347.440 1.835 10 10 EDCE O=C(N[C@@]1(c2cc(O)nc(O)c2)C[C@H]1C(=O)O)OCc1ccccc1 1952976962 YCBZDOCFEKPMGZ-YVEFUNNKSA-N 344.323 1.719 10 10 EDCE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@@H](O)C(C)(C)O)cc1 912109101 DRSGSVLBSWOGNQ-CYBMUJFWSA-N 348.365 1.775 10 10 EDCE C[C@H]1CCn2ncc(C(=O)NC[C@@H](N)c3ccc(N(C)C)cc3)c2C1 843296579 BEXHVAQWCUOOJM-SUMWQHHRSA-N 341.459 1.961 10 10 EDCE COc1ccc(CNC(=O)NC[C@]2(OC(C)C)CCOC2)c(O)c1 925761548 XDZDSLAURMUCLW-QGZVFWFLSA-N 338.404 1.784 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3cccnc3)no2)c1 758291771 PWLXISFYICHTHG-UHFFFAOYSA-N 332.341 1.876 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)C)C2)cc1 855228939 HWCRIAXEWUQFSJ-PBHICJAKSA-N 333.432 1.551 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CC[C@H](CN)C3)C2)cc1 851666859 LKGDBZRQIYNMTE-KKUMJFAQSA-N 332.448 1.701 10 10 EDCE CN1CCN(c2ccc(CN[C@H]3CCN(C4CCC4)C3=O)cc2)CC1 858342558 NMFKDEUYLMOFRF-IBGZPJMESA-N 342.487 1.681 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3[C@H](C)O[C@@H](C)[C@@H]3C)nc12 859827999 VMKPJVUPPFZVBN-VEABSNGSSA-N 348.403 1.513 10 10 EDCE COc1ccc(N2CC[C@@H](N=c3nn[nH]n3-c3ccccc3)C2)cc1 853758432 GAOGSWFPPNPPRF-CQSZACIVSA-N 336.399 1.784 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCCS(C)(=O)=O)C2)cc1 855232291 SNFHYDQXFMRUEY-CYBMUJFWSA-N 340.445 1.215 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@H](O)C(F)(F)C1 852413706 ZZUVITDYOKXTOL-OAHLLOKOSA-N 341.402 1.413 10 10 EDCE CCOC(=O)c1cn(C)nc1NC(=O)N1Cc2cccc(O)c2C1 930734100 AVVQSCZKPIKXFP-UHFFFAOYSA-N 330.344 1.850 10 10 EDCE CCn1nc(C)cc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 861729082 SMVXSCNBPSPQBQ-UHFFFAOYSA-N 347.394 1.671 10 10 EDCE CCOC(=O)[C@H]1c2ccoc2CCN1C(=O)c1cccc(O)c1O 862685915 YITLIEHVBNQWKO-CQSZACIVSA-N 331.324 1.994 10 10 EDCE CCc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)no1 785296130 BTKTWGJXKGEGQQ-SECBINFHSA-N 333.344 1.334 10 10 EDCE COC[C@@H](CCO)NCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894280527 LKFRDSAXAFXADI-GFCCVEGCSA-N 338.379 1.591 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2C(=O)NC[C@H]2C1 896873819 MTROSDGRJILVRW-VIFPVBQESA-N 333.369 1.162 10 10 EDCE COc1ccc(CNC[C@H]2CCCCN2S(C)(=O)=O)cc1C 796511298 QHSXENBGAUNTTF-OAHLLOKOSA-N 326.462 1.907 10 10 EDCE CN1C[C@H](C(=O)NCc2c(O)cccc2O)c2ccccc2C1=O 1156885614 KYNGPDYRJBXJKU-AWEZNQCLSA-N 326.352 1.583 10 10 EDCE C[C@H]1C(=O)NC(=O)CN1c1ccc([C@@H](C)N)cc1Br 97292483 GCRCHOACHPBSNJ-SFYZADRCSA-N 326.194 1.320 10 10 EDCE CO[C@H]1COC[C@H]1N(C)c1cc(Br)c(CN)cc1F 2120774807 IHPRQOVUNSQIEV-OLZOCXBDSA-N 333.201 1.897 10 10 EDCE COc1cc(NS(=O)(=O)c2cnc3c(cnn3C)c2)ccc1O 1321115554 MVNGDZQSDOBUTI-UHFFFAOYSA-N 334.357 1.483 10 10 EDCE COC(=O)NCC(=O)NC1CC(CNCc2ccc(OC)c(C)c2)C1 1717381421 LICQEXWQIOUEOD-UHFFFAOYSA-N 349.431 1.344 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cnnn2C)cc1C 1483002711 KRRAHNMQASRFAC-PLNGDYQASA-N 329.404 1.208 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2cccnc2)cc1C 1571422345 YENGONAFLLCCKM-INIZCTEOSA-N 329.400 1.279 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)Cn2cncn2)cc1C 1670334191 HALDWQPKHQVSFP-UHFFFAOYSA-N 331.420 1.233 10 10 EDCE CC[C@@H](C)C(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1688040102 GEUYUXXRAJJKHV-RTXFEEFZSA-N 335.404 1.522 10 10 EDCE CC(C)CNCc1ccc(N2C[C@H](O)[C@H](O)C2)cc1Br 232638853 IYEABXZZKTYINY-GASCZTMLSA-N 343.265 1.737 10 10 EDCE Nc1ccc(-n2nnc(C(=O)NCCc3ccc(F)cc3)n2)cc1 1857878943 PFWCQSFHKIKTLV-UHFFFAOYSA-N 326.335 1.356 10 10 EDCE CN1CCC(N(C)C(=O)CNCc2cc(Cl)ccc2O)CC1 1857868306 BJRZXLKJJWCEPB-UHFFFAOYSA-N 325.840 1.688 10 10 EDCE OCCN(Cc1cc(Br)ccc1O)C[C@H]1CCCN1 236512416 JBDGLIPBUYPJDB-CYBMUJFWSA-N 329.238 1.701 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(=O)C(=O)C[C@H]1C[C@H](N)C1)C(F)F 1980371724 WOHFGWPLXVNTCC-GUBZILKMSA-N 334.363 1.801 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCO[C@@H]1C(=O)NCCCN=[N+]=[N-] 1985094037 JCBRVFQEKOMVOH-MNOVXSKESA-N 327.385 1.733 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985104246 HQACDKHLXRGAAT-VWYCJHECSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N1CC(C)(OCC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010401295 CNPWKWLAEPYBQW-LLVKDONJSA-N 339.396 1.924 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@H](CO)C[C@@H]32)c(Br)c1 2199785559 ICKCRPOLYJJSLZ-BYCMXARLSA-N 341.249 1.884 10 10 EDCE NCc1nnc2n1CCN(Cc1c(O)cccc1Br)C2 2203315827 OQZPBCHNWGVZPB-UHFFFAOYSA-N 338.209 1.221 10 10 EDCE NCc1ccc(N2CC(CN3CCNCC3)C2)cc1Br 2236844259 UTZJMAXDSMNWND-UHFFFAOYSA-N 339.281 1.249 10 10 EDCE COc1ccc(Br)c(CNC(C)(C)CC(N)=O)c1O 2227748128 KDPHJPXEIXGFCT-UHFFFAOYSA-N 331.210 1.907 10 10 EDCE C[C@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2273250969 LTJLYRWAMZQEJR-ZYDDLXRUSA-N 327.178 1.394 10 10 EDCE COCCNCCN(C)Cc1cc(Br)c(O)cc1O 2267811368 YZFFUQOXYSDRAQ-UHFFFAOYSA-N 333.226 1.528 10 10 EDCE Cc1cccc(N2C(=O)NC(=O)C(=CNc3c(C)n[nH]c3C)C2=O)c1 2313548049 JYFNUNKWEFRXNS-UHFFFAOYSA-N 339.355 1.914 10 10 EDCE O=S1(=O)C[C@H]2CN(Cc3c(O)cccc3Br)C[C@@H]21 2314963376 MWBMKLMWRTYMGA-PELKAZGASA-N 332.219 1.384 10 10 EDCE Cc1ccc(CN2C[C@H](N)[C@H]3COC[C@@H]32)c(O)c1Br 2352674874 ABAXBHIZBQBMQE-WOPDTQHZSA-N 327.222 1.621 10 10 EDCE NC(=O)[C@@H]1CCC[C@H](NC(=O)NCCCSc2nccs2)C1 177833250 OLPPJCMAYVWWAN-MNOVXSKESA-N 342.490 1.969 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)NC[C@@]1(CCO)CCOC1 177595593 PUQYRSVGFZVHQV-LJQANCHMSA-N 347.459 1.875 10 10 EDCE O=C(O)[C@]12CO[C@H](C1)[C@@H](NCc1ccc(Br)cc1O)C2 2359171500 HKFZQDOGRWEDAQ-SUHUHFCYSA-N 342.189 1.877 10 10 EDCE CC[C@@]1(CO)CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 302380338 GOZVUBLJBYQNLB-MRXNPFEDSA-N 335.360 1.915 10 10 EDCE CCN(C)CC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 193796972 VURMYOYIFWQIIV-UHFFFAOYSA-N 348.491 1.275 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCO[C@@H](c4ccco4)C3)nc12 1327340077 DXLBPEUJXCJWLH-CYBMUJFWSA-N 344.327 1.300 10 10 EDCE CNC(=O)c1ccc(/C=C\C(=O)NCCc2ccc(O)c(O)c2)cc1 255540547 CALIHKZPMAVMMW-UITAMQMPSA-N 340.379 1.830 10 10 EDCE COC(=O)C(C)(C)CS(=O)(=O)Nc1ccc(O)cc1C(=O)O 287214837 MRLFTINMDOWQIL-UHFFFAOYSA-N 331.346 1.031 10 10 EDCE CN(C)c1ccc(CNC(=O)C[C@H]2CCCS(=O)(=O)C2)cc1F 293199151 XNWMKUTXLICJTO-CYBMUJFWSA-N 342.436 1.723 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@]23[C@H]4C(=O)[C@H]5[C@H]6C[C@@H]([C@@H]52)[C@H]3[C@H]64)c1 800518703 IBFWGEOIZGGOIS-LXKVGCDBSA-N 339.391 1.905 10 10 EDCE Cn1cc(C[C@H](O)C(=O)NCc2cc(Cl)cc(Cl)c2O)cn1 807837902 FVGTZQLILDVXOV-LBPRGKRZSA-N 344.198 1.652 10 10 EDCE CNC[C@@H]1CN(c2ccc(OC)c(Br)c2OC)CCO1 2162625701 XPYHFPUBGBWZTI-SNVBAGLBSA-N 345.237 1.891 10 10 EDCE Cc1cc(C)c(O)c(CN2CCCN(S(=O)(=O)N(C)C)CC2)c1 811788756 KFPDPQZMVGAOMP-UHFFFAOYSA-N 341.477 1.323 10 10 EDCE CC[C@H](O)CC(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 828519364 NTKAAGNRGQUPJJ-LBPRGKRZSA-N 329.780 1.708 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN[C@@H]2CC[C@@H](C)S(=O)(=O)C2)c1O 827164365 GNEDFNRCZPXLGG-MWLCHTKSSA-N 344.389 1.364 10 10 EDCE CO[C@]1(CO)CCCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 826952867 VLWCDVCXXKMVRG-CQSZACIVSA-N 330.768 1.927 10 10 EDCE COC(=O)C1(C(=O)NCCc2ccc(O)c(O)c2)CC2(CCC2)C1 830532720 ZANDOPAUTXWJLA-UHFFFAOYSA-N 333.384 1.880 10 10 EDCE O=C(CC1COC1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 901287437 NWKIMILJLBTJAZ-UHFFFAOYSA-N 343.471 1.871 10 10 EDCE C[C@@H]1CCNC[C@@H]1NC(=O)NCc1cccc(Br)c1O 841976634 MYDTUSRWAKQKAU-SKDRFNHKSA-N 342.237 1.952 10 10 EDCE CC[C@@H](COCC1CC1)NC(=O)C(=O)NCCc1ccc(N)cc1 851687934 LWAMUQLGUNEXEU-INIZCTEOSA-N 333.432 1.249 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@](O)(C4CC4)C3)cc2N1 853833167 MCJPJCGPGLNPMV-MRXNPFEDSA-N 333.344 1.667 10 10 EDCE COC(=O)[C@H]1CCCC[C@H]1S(=O)(=O)NCc1c(O)cccc1F 921452678 WGLBZWFZDYUTQE-IINYFYTJSA-N 345.392 1.683 10 10 EDCE CC[C@H](C)OCC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 751753779 HPRNCSDPVQRZKG-INIZCTEOSA-N 349.475 1.749 10 10 EDCE COc1ccc(N2CCN(C(=O)Cn3cncc3C)CC2)cc1F 859965911 KFLUXCYVKOCWGE-UHFFFAOYSA-N 332.379 1.688 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](CO)C3CCC3)C2)cc1 852447832 FHIVPNPASCZLDR-PBHICJAKSA-N 333.432 1.734 10 10 EDCE CC[S@](C)(=O)=NS(=O)(=O)NCc1ccc(N(C)C)c(F)c1 866673052 VSCRPYHDQVGFOS-FQEVSTJZSA-N 337.442 1.344 10 10 EDCE 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CC[C@@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@@H]1CCCOC1 1333947552 KBIVXGXXDRIWSL-HUUCEWRRSA-N 334.416 1.672 10 10 EDCE CN1CC[C@H](N(C)c2ccc(CO)cc2Br)CC1=O 2131950997 WQRSYPBEDTYWAY-NSHDSACASA-N 327.222 1.998 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@@H]2CCC(=O)N2C)cc1C 1268390932 AELVBYHIEPGRRK-ZBFHGGJFSA-N 347.459 1.609 10 10 EDCE CCOCC(=O)NC[C@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1358582617 FQCDLAGREQDGMO-CYBMUJFWSA-N 347.375 1.216 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@H]1CC12CC2 1285703544 ZPIOTRDUVQJTES-ZWNOBZJWSA-N 343.387 1.884 10 10 EDCE C[C@H](Sc1ccccc1C(=O)NCc1cc(O)ccc1O)C(N)=O 1455356641 JVISQNRTMGIIGQ-JTQLQIEISA-N 346.408 1.994 10 10 EDCE CCOC(=O)[C@@H]1C2CCC(CC2)N1C(=O)Cc1ccc(O)c(O)c1 1450105949 ZTNYFFRNDGIJTE-FVKWTLKZSA-N 333.384 1.973 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1nsnc1O 1291756038 MMLMFRGHZNZXAJ-UHFFFAOYSA-N 338.364 1.149 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cnc(C)[nH]2)cc1C 1486264010 BFCNWJLMRIMEQI-OAHLLOKOSA-N 346.431 1.258 10 10 EDCE O=C(Cn1nc(-c2ccccc2)oc1=O)NCc1ccc(O)cc1O 1557084656 ITNKACQECPDNIQ-UHFFFAOYSA-N 341.323 1.231 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)C)CC2)cc1F 1630202051 KCLPILFVRDMLLP-VOTSOKGWSA-N 335.379 1.127 10 10 EDCE CONC(=O)CNC(=O)N(Cc1ccco1)Cc1ccccc1O 1565420518 GDLVQURJMZCXOE-UHFFFAOYSA-N 333.344 1.375 10 10 EDCE CS(=O)(=O)c1ccc(F)c(C(=O)NCc2cc(O)ccc2O)c1 1633595201 LSFCEXGTJNJWEF-UHFFFAOYSA-N 339.344 1.570 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@@H]2CCCC(=O)N2C)cc1C 1690642657 ACSHXPFWLWQIFL-HOCLYGCPSA-N 347.459 1.609 10 10 EDCE CN(CCNC(=O)c1cc(O)c(O)c(O)c1)C(=O)OC(C)(C)C 1988130295 JBVGNOKGFLANHK-UHFFFAOYSA-N 326.349 1.400 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCN(CC(=O)Nc2ccc(N)cc2)C1 1999433354 ZMQGGNDVWANOOE-CQSZACIVSA-N 334.420 1.806 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H]1CN=[N+]=[N-])C(C)(C)O 2014482262 HXPYTMSPPQGFBV-MNOVXSKESA-N 341.412 1.952 10 10 EDCE CO[C@@H]1CN(Cc2c(O)cccc2Br)C[C@H]1C(=O)O 706627956 JWUZLUOBIWOXQR-BXKDBHETSA-N 330.178 1.686 10 10 EDCE O=C(Cc1csc(N2CCOCC2)n1)Nc1ccc(O)c(O)c1 2064671458 UWDLJFSPQZIFTO-UHFFFAOYSA-N 335.385 1.572 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3[C@H]4CCO[C@@H]4C34CCCC4)c2n1 2064908315 WYXBKZLOWUAXRX-DFBGVHRSSA-N 342.399 1.821 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)cc1Br 2173320648 RJDMAUDHQFQHBI-QUAZDUCUSA-N 341.249 1.489 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@H]2O 2174411403 DJPSSSOQCIFMJE-DOEPTHPASA-N 342.233 1.622 10 10 EDCE NC[C@]12CN(Cc3cc(Br)cc(F)c3O)C[C@H]1CCO2 2175178706 BTRSDQSDHUJWSC-YGRLFVJLSA-N 345.212 1.843 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)CCc2ccc(N)cc2)[C@H](O)C1 2062452478 WOMRBYIMEHESSW-LSDHHAIUSA-N 349.431 1.298 10 10 EDCE C[C@H](O)CN1CCN(c2ccc(CN)cc2Br)CC1 2113859808 WIKWRUOTIQHNFZ-NSHDSACASA-N 328.254 1.411 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213589018 CXXCWAVJCIRJQV-TUAOUCFPSA-N 340.428 1.789 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@]3(CO)C2)c(F)c1Br 2234560168 UQKLSJAYBMBSOX-IINYFYTJSA-N 345.212 1.492 10 10 EDCE CN(CC(F)(F)C(=O)C(=O)C[C@H]1C[C@H](N)C1)C(=O)OC(C)(C)C 2245998988 CECUFJAWYJOPIC-MGCOHNPYSA-N 334.363 1.754 10 10 EDCE Cc1cc(Br)ccc1N1C(=O)NC(=O)C(=CO)C1=O 2293367107 FXXQBISRVZMQCC-UHFFFAOYSA-N 325.118 1.782 10 10 EDCE COc1ccc(OC)c(NC=C2C(=O)NC(=S)N(C3CC3)C2=O)c1 2296944761 IDSZUWWOVYYUSV-UHFFFAOYSA-N 347.396 1.405 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1CNCCO1 1952195405 CTTYUKGMBAHJGS-IUODEOHRSA-N 338.404 1.522 10 10 EDCE COc1ncccc1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 283298808 ATQOLKBTBCFCJX-UHFFFAOYSA-N 342.399 1.089 10 10 EDCE Cc1ccc(CN2CC[C@H](O)[C@@H](C(=O)O)C2)c(O)c1Br 2380676970 JDISGGVJWOBXOJ-QWRGUYRKSA-N 344.205 1.731 10 10 EDCE Cc1ccc(O)c([C@H](C)N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)c1 806171032 PIVIPDNGCFHJMZ-UONOGXRCSA-N 341.477 1.622 10 10 EDCE CCOCC1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2165851917 VKBFCSHFFFQIHH-ZDUSSCGKSA-N 341.205 1.907 10 10 EDCE CCO[C@@H]1CN(Cc2c(O)cccc2Br)C[C@H]1CN 706867258 VMNVYFKWAAQTDX-QMTHXVAHSA-N 329.238 1.950 10 10 EDCE Cc1cc(C(=O)CN(C)CC(N)=O)c(C)n1-c1ccc2c(c1)OCO2 725797330 WSMJPRCXXWYMJL-UHFFFAOYSA-N 343.383 1.423 10 10 EDCE CO[C@@]1(CN[C@@H](C)c2ccc(C)c(C)c2O)CCS(=O)(=O)C1 903364781 BSLVCEIWHMDIDE-XJKSGUPXSA-N 327.446 1.863 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)C[C@@]23CCCN(CC2)C3)c1 914163299 XQPNOSQTUCZLGR-INIZCTEOSA-N 340.445 1.306 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)CCN2CCCC2=O)c([N+](=O)[O-])c1 732983896 VLVZIXZPUCBNRD-SOFGYWHQSA-N 347.371 1.840 10 10 EDCE O=C1O[C@H](CNCc2ccc(N3CCOCC3)cc2)CN1C1CC1 848578266 PTYTVEXMLBTQNJ-QGZVFWFLSA-N 331.416 1.596 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCNC[C@H]1C 842264910 FMMJPORTWZGIDJ-GDBMZVCRSA-N 347.459 1.635 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)/C=C/c1cnccn1 918216515 SAYRDPKBHYSVJM-QPJJXVBHSA-N 338.411 1.985 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)CNC(=O)c2ccccn2)c1 740082731 UFIUJGVGGQNOIU-LLVKDONJSA-N 329.356 1.403 10 10 EDCE C[C@H](CC(=O)NCc1cc(Br)ccc1O)NC(N)=O 848068725 NPKCPYVEDXLIHL-SSDOTTSWSA-N 330.182 1.218 10 10 EDCE CN1CCN(c2ccc(CN3C(=O)N[C@@H](CCF)C3=O)cc2)CC1 925079532 JWZLNVHUHDIEAU-HNNXBMFYSA-N 334.395 1.218 10 10 EDCE CCNC(=O)CN(CC)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852455413 SQTIEZOLFVZHDS-AWEZNQCLSA-N 348.447 1.442 10 10 EDCE CC[C@H](C)[C@H](O)CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 854301845 UZHHSYJMGFBQRB-GRDNDAEWSA-N 335.448 1.980 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCO[C@H](CF)C3)C2)cc1 852449591 ULLOMPUQELYGJD-XJKSGUPXSA-N 337.395 1.654 10 10 EDCE C[C@H](NC(=O)NC[C@H]1CC[C@@H](C(=O)N(C)C)O1)c1ccccc1O 868477649 ZINAGRSKUXPRBX-ZOWXZIJZSA-N 335.404 1.388 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3nnc(C4CC4)o3)C2)cc1 866019109 QYAZPXYHTLMZCA-LBPRGKRZSA-N 328.372 1.964 10 10 EDCE C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1ccc(N2CCN(C)CC2)cc1 775648848 GRBJSWKBZKLUHE-NVXWUHKLSA-N 330.476 1.524 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)[C@@H]3CCC[C@H]3O)C2)cc1 889327261 KPFUYJMVVUYDGV-KBRIMQKVSA-N 333.432 1.829 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@H](O)CC(F)(F)C2)cc1 787367872 LMKJAZKXPBIHIA-CQSZACIVSA-N 327.375 1.071 10 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CCN(CCNC[C@H](C)OC)C(=O)c1ccc(N=NC(N)=O)cc1 1320928974 KJJWOESCNNNHKH-LBPRGKRZSA-N 335.408 1.936 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@@H]2CC[C@@H]2OC)cc1 1333088791 NTROICJLMFPQLR-SJORKVTESA-N 347.459 1.785 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCOC[C@@H]1C 1261119203 JDLZXWJUFPAUTK-DZGCQCFKSA-N 334.416 1.672 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCc2nncn2CC1 1447566421 XKOKTKCLVAOSKW-AAEUAGOBSA-N 330.388 1.389 10 10 EDCE C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@@H]1CN(C)CCN1C 1444416578 RPCHISSEUWNDBC-RISCZKNCSA-N 332.408 1.213 10 10 EDCE CCn1cc(-c2n[nH]cc2C(=O)NCc2cc(O)ccc2O)cn1 1455355559 CUVKKDLMGPVYBO-UHFFFAOYSA-N 327.344 1.634 10 10 EDCE Cc1cnc(S(C)(=O)=O)nc1C(=O)N1Cc2cccc(O)c2C1 1471355625 NZMREFHGJNAASI-UHFFFAOYSA-N 333.369 1.050 10 10 EDCE CS(=O)(=O)Cc1nc(C(=O)NCc2cccc(Cl)c2O)co1 1472316959 OTQXMJYDQBYVFP-UHFFFAOYSA-N 344.776 1.508 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CCCN(C(=O)N2CCCC2)C1 1471661720 ZTKFPAKCLGOEBG-ZDUSSCGKSA-N 347.415 1.642 10 10 EDCE CN(C)Cc1ccc(C(N)=O)cc1NC(=O)Cc1ccc(O)c(O)c1 1628354223 AZDZPOFJVHODIV-UHFFFAOYSA-N 343.383 1.440 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@@H](C)NC(C)=O)C2CC2)cc1C 1480001783 QHXCBUFBMFANEQ-DYVFJYSZSA-N 347.459 1.513 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1nnc2ccccc21 1623573859 GSVAAAHRMAWBOD-UHFFFAOYSA-N 331.372 1.939 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2coc(C)n2)cc1C 1716085875 LPCZEGNJKLCXMN-CQSZACIVSA-N 333.388 1.181 10 10 EDCE CN(CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1)Cc1cnon1 1715540575 RTHCCZNOXSZJSQ-UHFFFAOYSA-N 345.363 1.436 10 10 EDCE NS(=O)(=O)c1cc(CNC(=O)c2cc(O)cs2)ccc1F 1641254479 VYFBBJDRWIZVKZ-UHFFFAOYSA-N 330.362 1.170 10 10 EDCE CCOCC(=O)N(C)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1737159062 RSTJNXSRANLEAW-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE CC[C@H](CNC(=O)Cc1ccn(C)n1)NCc1ccc(OC)c(C)c1 1665789547 YETVARWTMOJSBB-MRXNPFEDSA-N 344.459 1.964 10 10 EDCE CC[C@@H](NC(C)=O)C(=O)N[C@H](C)CNCc1ccc(OC)c(C)c1 1669403684 UUXGIDWNQMFMSK-CZUORRHYSA-N 335.448 1.513 10 10 EDCE CON(C)C(=O)[C@H](C)NC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1684417591 PKFUHAQHYMDVHK-AWEZNQCLSA-N 348.447 1.837 10 10 EDCE Cc1ccc(NC(=O)C[C@H]2C(=O)NN(C)C2=O)c(Br)c1 169996252 ICHXSXSLUBHTML-QMMMGPOBSA-N 340.177 1.206 10 10 EDCE CCCN(CC(=O)N1CCC[C@H](C(N)=O)C1)Cc1ccccc1O 154569197 PSISZQCSQCAKRF-HNNXBMFYSA-N 333.432 1.328 10 10 EDCE Cc1nn(C)c([C@@H](O)[C@H](N)c2ccccc2O)c1Br 1877195190 VMGDNCMNZRIOBW-YPMHNXCESA-N 326.194 1.930 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H](O)C(F)(F)C3)c(Br)cc21 2152098633 PTSGYRKPYWDWPL-VHSXEESVSA-N 348.147 1.217 10 10 EDCE C[C@@H](C(=O)NCCCN=[N+]=[N-])N1CCN(C(=O)OC(C)(C)C)CC1 2010393195 PBKUDWPPWKQJIC-LBPRGKRZSA-N 340.428 1.744 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CCC(=O)N1CC[C@H](CN=[N+]=[N-])C1 2010402400 QEPSHPWBCOKGRE-VXGBXAGGSA-N 341.412 1.811 10 10 EDCE CO[C@H]1CN(Cc2cc(Br)cc(F)c2O)C[C@@H]1C(=O)O 715794009 YLZYJFVHLOMCOO-ONGXEEELSA-N 348.168 1.825 10 10 EDCE CCC1(O)CN(c2cc3c(cc2Br)[C@@H](NC)C(=O)N3)C1 384154483 QBCLIXJTXDWBOX-GFCCVEGCSA-N 340.221 1.623 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNC(=O)Cc2ccc(N)cc2)C1 2044205547 ACGGMIDHESMTLW-DZGCQCFKSA-N 349.431 1.155 10 10 EDCE Cc1nnc(CCNCc2cccc(Br)c2O)n1C 2104144480 LTEXPSGLZSIIAD-UHFFFAOYSA-N 325.210 1.924 10 10 EDCE O=C(O)CO[C@H]1CCN(Cc2ccc(Br)cc2O)C1 2096821014 UFLSUUYSLIXAKJ-NSHDSACASA-N 330.178 1.830 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213583406 RKCAZRPCDHZPMQ-DCAQKATOSA-N 343.384 1.805 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCCC[C@@H]1CCOc1nnc(=N)[nH]n1 2213780597 HYWSYOFVYLBBKJ-GHMZBOCLSA-N 338.412 1.532 10 10 EDCE COC[C@@H]1[C@H](O)[C@H](O)CN1c1ccc([C@H](C)O)c(Br)c1 2233867096 VVDZOTJRIPQUNQ-IYMWITQMSA-N 346.221 1.059 10 10 EDCE COC[C@@H]1[C@H](O)[C@@H](O)CN1c1ccc([C@@H](C)N)c(Br)c1 2234068675 PVLJDVFDKLTYOB-NGSVMEPUSA-N 345.237 1.026 10 10 EDCE COc1ccc(Br)c(CN(CC(=O)O)CC(=O)O)c1O 2236045364 RKWXFCRROULTQJ-UHFFFAOYSA-N 348.149 1.135 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCC[C@@H]2C(N)=O)c1O 2236054474 IOFNPZQZGJXYCD-KWQFWETISA-N 343.221 1.907 10 10 EDCE COc1ccc(Br)c(CN2CC[C@@H](N)[C@@H](CO)C2)c1O 2236039778 DIPSCPJQUGOKON-BXKDBHETSA-N 345.237 1.305 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](C)CS(C)(=O)=O)CC2)cc1 176409912 CSTFHRWNHBVDEE-ZDUSSCGKSA-N 340.445 1.025 10 10 EDCE C[C@@H](NC[C@@H](C)N1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 127305304 DOCGLPAHHLRYMM-QZTJIDSGSA-N 346.519 1.810 10 10 EDCE Cc1ccc(C(=O)N(C)CC2CCN(C[C@@H](C)O)CC2)c(O)c1O 182549522 LPOWFAJPTDIMAH-CYBMUJFWSA-N 336.432 1.571 10 10 EDCE C[C@H]1CN(C(=O)[C@@H](C)N2CCOc3cc(N(C)C)ccc32)C[C@@H](C)O1 181123411 NFWHKZBGZQOOHZ-QLFBSQMISA-N 347.459 1.976 10 10 EDCE CNC(=O)C[C@H]1CNCCN1Cc1cc(Br)ccc1O 2369315060 LLSWDQRKJLGGAO-LBPRGKRZSA-N 342.237 1.065 10 10 EDCE COC(=O)c1cc(C)ccc1S(=O)(=O)NCCc1ccc(N)cc1 193336816 COICMYICPQABCV-UHFFFAOYSA-N 348.424 1.885 10 10 EDCE O=C(Cn1cccnc1=O)NCc1cc(Br)ccc1O 804738795 FAVCYMXGMQDTEO-UHFFFAOYSA-N 338.161 1.028 10 10 EDCE Cc1ccc(CN2CCOC[C@@H]2[C@@H](O)CO)c(O)c1Br 2380813037 BSGWRCISVCGWPQ-NEPJUHHUSA-N 346.221 1.017 10 10 EDCE O=C(OCc1ccccc1)N1C[C@H](O)[C@H](NCc2ccccc2O)C1 713840846 SOVACMIBIIUINZ-AEFFLSMTSA-N 342.395 1.864 10 10 EDCE COc1ccc(CNC(=O)[C@@H]2CCc3nnc(C4CC4)n3C2)c(O)c1 816550051 GZWKSEDGDNOZGF-CYBMUJFWSA-N 342.399 1.749 10 10 EDCE C[C@H](NC(=O)[C@]1(C)C[C@H](O)CN1C)c1ccc(N2CCOCC2)cc1 900386819 HUCCZCXVKSYQHE-FNHZYXHNSA-N 347.459 1.156 10 10 EDCE O=C(NCc1cc(Br)ccc1O)N[C@H]1CCCNC1 841941028 JWTLVEHLPSUGMG-NSHDSACASA-N 328.210 1.706 10 10 EDCE CC(C)C(=O)N1CCC[C@H]1C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 843296668 CZSXOFOCKOWJQA-IRXDYDNUSA-N 346.475 1.516 10 10 EDCE CSC[C@@H](NC(=O)N[C@H](C)c1ccc(N(C)C)cc1)C(=O)O 929046433 UCOHANSXMZXNMD-ZWNOBZJWSA-N 325.434 1.929 10 10 EDCE C[C@@H](NCC[C@H]1CNCCS1(=O)=O)c1cc(F)cc(F)c1O 925800597 VTYSOOAQPGJSKT-KOLCDFICSA-N 334.388 1.098 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)N3C[C@@H](O)C[C@@H](O)C3)c2C)cc1 755443271 PKZFBKFSEQUSQX-IYBDPMFKSA-N 344.411 1.670 10 10 EDCE COC(=O)/C(C)=C/CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 923183005 JXDNHWQKYIMUJZ-CZAWJFPGSA-N 347.415 1.692 10 10 EDCE COCCn1ccc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)n1 855228335 ZZJKJCXXWCEGPO-AWEZNQCLSA-N 344.415 1.547 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CN)C(F)(F)F)C2)cc1 850754202 LFPIXQWCTBKLGV-GXFFZTMASA-N 346.353 1.463 10 10 EDCE COc1ccc2c(n1)N(C)CCN2C(=O)/C=C\c1cnc(OC)nc1 928398284 SVTXGDRGBRTHMB-DAXSKMNVSA-N 341.371 1.385 10 10 EDCE Cc1ccc(C(=O)Nc2ccc3c(c2)B(O)OC(C)(C)C3)c(O)c1O 863869798 WODARMGRNXHGOT-UHFFFAOYSA-N 341.172 1.697 10 10 EDCE COc1cccc(CNC(=O)[C@H](OC)C(=O)OC(C)(C)C)c1O 866762784 CBLKABXGBQWSPW-ZDUSSCGKSA-N 325.361 1.374 10 10 EDCE CO[C@H](C)CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)C 769908872 GEOUUGSXDFOLFC-LLVKDONJSA-N 344.433 1.649 10 10 EDCE COc1ccnc(OC)c1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 1138152578 KVZJFBCDGTZJNK-JTQLQIEISA-N 332.356 1.871 10 10 EDCE CN1CCN(c2ccc(CNC(=O)/C=C/[C@@H]3CCCO3)cc2)CC1 893608619 XGYOYTFZDIALBD-BLGFXRMMSA-N 329.444 1.790 10 10 EDCE CC(=O)N1C[C@H]2CN(C(=O)c3cc4cc(O)c(O)cc4s3)C[C@H]2C1 899208536 ZHWHYLNMBCYMQU-TXEJJXNPSA-N 346.408 1.863 10 10 EDCE COc1cccc(CNC[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@H]6[C@@H](C[C@H]53)[C@@H]2[C@@H]64)c1O 785543667 HQJCPTJEPDXTGN-ASMCQDBPSA-N 327.424 1.999 10 10 EDCE COc1ccc(NC(=O)c2cccc(O)c2O)cc1-n1cnnn1 1137090710 SXTSXFZGNSVQMH-UHFFFAOYSA-N 327.300 1.334 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)C[C@H]2CCNC2=O)cc1C 1320448175 UCKMLHGPWRMGOV-GOEBONIOSA-N 347.459 1.514 10 10 EDCE COc1ccc(CNC2(CNC(=O)C3CN(C(C)=O)C3)CC2)cc1C 1323435915 QITRZKQGFZAEAJ-UHFFFAOYSA-N 345.443 1.220 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C(C)(C)C(N)=O)cc1C 1321109770 WSFXTZRHLMSUDW-AATRIKPKSA-N 333.432 1.277 10 10 EDCE COC(=O)C1=CC[C@H](NCc2ccc(N3CCN(C)CC3)c(F)c2)C1 1329173312 VACQTVCMNLSMRN-INIZCTEOSA-N 347.434 1.929 10 10 EDCE C[C@@H](NC(=O)C(=O)N[C@H]1COC(C)(C)C1)c1ccc(N(C)C)cc1 1335677261 HRSULNNFNCLPQJ-TZMCWYRMSA-N 333.432 1.614 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(n2ccnc2)CC1 1335556183 FXXUEIMEJWXKDF-UHFFFAOYSA-N 340.383 1.295 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@]34CCOC4)C2)cc1 1347297954 MTRCFHRIEPHZJB-KBXCAEBGSA-N 331.416 1.848 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H]2CCCCN2C)cc1C 1507200317 FMMZZDAORLZFEE-IRXDYDNUSA-N 349.475 1.055 10 10 EDCE COCCNC[C@H]1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1278618053 GKYALTHANAOSBY-SWLSCSKDSA-N 347.419 1.984 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1C[C@@H]2CCC[C@@H]21 1351287419 JYGNOENEPBMTAV-RRQGHBQHSA-N 329.444 1.982 10 10 EDCE CC(=O)C(=O)[C@]1(O)[C@H]2CCCN(C(=O)OC(C)(C)C)[C@H]2C1(C)C 1919201481 SKKXHGJCZUPSPS-XWCIJXRUSA-N 325.405 1.931 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)Cc2cncn2C)cc1C 1700423431 AHHPSQYVVMSDRZ-LSDHHAIUSA-N 344.459 1.963 10 10 EDCE COc1ccc(CNCC[C@@H]2CCN(C(=O)CC(N)=O)C2)cc1C 1700053888 OGVRMJCTUZPEAB-CQSZACIVSA-N 333.432 1.207 10 10 EDCE CC[C@@H](CNC(=O)CN1CCOCC1)NCc1ccc(OC)c(C)c1 1714069273 ZBOPIMWTFUHGGW-KRWDZBQOSA-N 349.475 1.320 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccn(CCN(C)C)n1 1627026866 ZZAVZIXXVBHEEW-UHFFFAOYSA-N 337.420 1.566 10 10 EDCE CCNC(=O)CC(=O)N[C@H](C)[C@@H](C)NCc1ccc(OC)c(C)c1 1717406438 GVJSKWIZUWBCET-ZIAGYGMSSA-N 335.448 1.513 10 10 EDCE CCNC(=O)CC(=O)N1C[C@H](NCc2ccc(OC)c(C)c2)C[C@H]1C 1717810357 USOJOECMWXTZLU-GDBMZVCRSA-N 347.459 1.609 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)CCC(F)F)cc(OC)n1 1494855320 UPNJCUSDKOQYOI-VIFPVBQESA-N 345.346 1.379 10 10 EDCE O=C(N[C@H]1CCCS(=O)(=O)C1)c1cc2cc(O)c(O)cc2s1 1565757935 IYSURGKITAAFRR-VIFPVBQESA-N 341.410 1.620 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1cnns1 1567083020 AZRXYSPRTNVOBP-VIFPVBQESA-N 347.404 1.609 10 10 EDCE Nc1nnc([C@H]2CCCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)o1 1641506951 KLHSUUMOGRUSCX-QZPNVGJNSA-N 330.344 1.482 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)Cn2ccnc2)cc1C 1734007098 RZMVTFMEISSFBQ-CABCVRRESA-N 330.432 1.883 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC[S@](=O)Cc1ccccc1 1584994792 GBEWUDCGQQLBFC-QHCPKHFHSA-N 333.409 1.705 10 10 EDCE COc1cccc([S@@](=O)CC(=O)NCc2ccc(O)c(O)c2)c1 1595595637 IOFSYHTYMJRINZ-QHCPKHFHSA-N 335.381 1.530 10 10 EDCE CN(C)S(=O)(=O)c1c[nH]c(C(=O)NCc2c(O)cccc2F)c1 1596912525 NZQGVLUVBCEPMP-UHFFFAOYSA-N 341.364 1.040 10 10 EDCE COC(=O)NCC(=O)N[C@@H](C)CCNCc1ccc(OC)c(C)c1 1699086912 STWGUSVOSHWCTA-ZDUSSCGKSA-N 337.420 1.344 10 10 EDCE COC[C@H](C)NC[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1698863726 IACWCAUHVBXHPF-RYUDHWBXSA-N 335.408 1.934 10 10 EDCE Cc1c(C(=O)N(C)Cc2ccccc2O)cccc1S(N)(=O)=O 159079046 CEKYQSAKKLHOGK-UHFFFAOYSA-N 334.397 1.620 10 10 EDCE CC(C)(C)OC(=O)NC1CN(CC(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 2010390120 ZKBQEVMYLVVNJC-NSHDSACASA-N 338.412 1.497 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2010395832 LDZJFTIFNZTNMC-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)[C@H]1CCOC1 2010391101 MQVUYKXWKGUXSU-TUAOUCFPSA-N 339.396 1.827 10 10 EDCE CN(C(=O)[C@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2022783963 FQWIRIWYQFWSCX-ZIAGYGMSSA-N 335.404 1.602 10 10 EDCE NCc1cc(F)c(N2C[C@@H](O)C(F)(F)C2)cc1Br 2034596292 WHUQXFOMMKGAST-SNVBAGLBSA-N 325.128 1.863 10 10 EDCE CNC(=O)CN(Cc1ccccc1)C[C@H](O)COc1ccc(N)cc1 2034782828 MOXDCQZUTMFRMA-KRWDZBQOSA-N 343.427 1.257 10 10 EDCE O=C(O)C[C@@]1(O)CCCN(Cc2c(O)cccc2Br)C1 2160875458 CPXPLVLBRFVPSA-AWEZNQCLSA-N 344.205 1.956 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H](c4ncccn4)C3)c2n1 2063702065 WGXALJOODMRTBV-GFCCVEGCSA-N 338.371 1.553 10 10 EDCE CN1C(=O)O[C@H]2CN(c3ccc(CO)cc3Br)C[C@H]21 2120405291 YLZWIABOKAEISP-NEPJUHHUSA-N 327.178 1.581 10 10 EDCE COc1ccc(Br)c(CN[C@@H](CO)CCCO)c1O 2208684002 MEMITCQPXNORLO-SECBINFHSA-N 334.210 1.386 10 10 EDCE C[C@H](N)c1ccc(N(C)Cc2nn(C)nc2Br)cc1O 2235286362 VVMGYQPEKONECN-QMMMGPOBSA-N 340.225 1.939 10 10 EDCE COCCN(CC(=O)O)Cc1c(Br)ccc(OC)c1O 2236047792 ZJNBNZGREMGWMQ-UHFFFAOYSA-N 348.193 1.696 10 10 EDCE Cc1ccc(C=C2SC(=S)N([C@H](CC(=O)O)C(=O)O)C2=O)o1 2293031474 FFMXTRJXIVZHPN-MRVPVSSYSA-N 341.366 1.717 10 10 EDCE CS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C/c1cnccn1)CCO2 492116557 VPYUFQXNJVIINB-GORDUTHDSA-N 345.380 1.319 10 10 EDCE C[C@@H](O)c1ccc(N2CC(O)(CN(C)C)C2)c(Br)c1 2343628933 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COc1ccc(CNCC[C@H](C)NC(=O)Cc2n[nH]c(C)n2)cc1C 1699101189 UTZJSOCJKBQHPA-ZDUSSCGKSA-N 345.447 1.657 10 10 EDCE COc1ccc(S(=O)(=O)c2nnn(-c3ccc(N)cc3)c2C)cc1 11730522 XZEZLFUZCCZKRB-UHFFFAOYSA-N 344.396 1.999 10 10 EDCE CCc1noc(C)c1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 160003579 DMPSBKRENIFSSK-UHFFFAOYSA-N 330.388 1.866 10 10 EDCE COc1cc(CN2C[C@@H](C)O[C@@H](C(N)=O)C2)c(O)c(C(C)(C)C)c1 164499632 PKBVXSIRPCSUSU-IAQYHMDHSA-N 336.432 1.773 10 10 EDCE Oc1ccc(Br)cc1CN[C@H]1COC2(CCC2)[C@@H]1O 2141559871 WLZVTUCOLDBBMT-WCQYABFASA-N 328.206 1.927 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)O1 2003171145 UYEJRORNPJVIRV-BYNQJWBRSA-N 340.420 1.324 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(=O)C(=O)C[C@H]1C[C@H](N)C1)C(F)F 1980371725 WOHFGWPLXVNTCC-OPRDCNLKSA-N 334.363 1.801 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)C1COC1 1985102840 MMTIHMPWJPDMKY-QWRGUYRKSA-N 325.369 1.437 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985103984 CWEGMUIPQJBVIW-NXEZZACHSA-N 327.385 1.467 10 10 EDCE C[C@@H](N[C@H](CO)CNC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985776996 GDAKXRBRCPDADK-MNOVXSKESA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H]1CNC(=O)c1cc(O)c(O)c(O)c1 2015120642 VMASTYDDXNYBJY-JTQLQIEISA-N 338.360 1.543 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)C[C@@H]1C(=O)Nc1ccc(N)cc1 2022912142 JVYBHFDRXFOGGO-UONOGXRCSA-N 335.404 1.968 10 10 EDCE C[C@@H]1[C@H](O)CCCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 384730401 JKLXDPJRENMNGJ-BLBGDKDGSA-N 340.221 1.751 10 10 EDCE CC(C)NCc1ccc(N2CC[C@@H](O)[C@@H](O)C2)cc1Br 2188629627 INLMWEBTSIQWNN-CABCVRRESA-N 343.265 1.879 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(Br)c1 2182557116 SENBRMLAJNFQGC-GVMTXOEMSA-N 341.249 1.647 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2104412283 UEWXVWRUKHUVPS-NKOSQPIISA-N 328.206 1.433 10 10 EDCE Oc1ccc(Br)cc1CN1CCOCCC12CNC2 2111337884 WAHJKYFRZOIERS-UHFFFAOYSA-N 327.222 1.719 10 10 EDCE O=S1(=O)C[C@H]2[C@H](CNCc3cccc(Br)c3O)[C@H]2C1 2117982601 QDMGWYGGFXDUMG-RTCCRHLQSA-N 346.246 1.535 10 10 EDCE N[C@H](Cc1ccc(Br)cc1)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2237416151 NLXXWIMACYCQLZ-RAIGVLPGSA-N 339.233 1.585 10 10 EDCE OCc1ccc(N2C[C@@H](CO)C[C@H](CO)C2)c(Br)c1 2228399429 IUVOOJBTHXZPSS-RYUDHWBXSA-N 330.222 1.369 10 10 EDCE O=C1NC(=O)N(c2ccccc2)C(=O)C1=Cc1ccc([N+](=O)[O-])o1 2296382105 ATVFSAAATHUBBJ-UHFFFAOYSA-N 327.252 1.854 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@@H](O)[C@H]4C3)c(Br)cc2[C@@H]1O 2358429772 BAPMBWKVGOYXOA-VZPRYOCXSA-N 339.189 1.252 10 10 EDCE CCNC(=O)N1CC[C@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 132138397 STVLHKOIGHVSIW-HNNXBMFYSA-N 347.463 1.698 10 10 EDCE C[C@@H]([C@H](C)S(C)(=O)=O)N(C)Cc1ccc(N2CCOCC2)cc1 93420621 QWVPUWMUMMMXEN-GJZGRUSLSA-N 340.489 1.777 10 10 EDCE CCCNC(=O)[C@H]1C[C@@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 244532043 ZTQAWBSEBZXERG-IRXDYDNUSA-N 345.443 1.506 10 10 EDCE C[S@](=O)CCCNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255341524 ANOVKFUOZNGPNT-VSFNPRRYSA-N 336.457 1.421 10 10 EDCE Cc1ccc(CN=c2cc(C(=O)O)nc[nH]2)c(O)c1Br 2380725165 IFKPNVLFZUTPRO-UHFFFAOYSA-N 338.161 1.985 10 10 EDCE Cc1ccc(CNC(=O)c2ccc(O)nn2)c(O)c1Br 2380740511 WUPMMWZMTZZIGI-UHFFFAOYSA-N 338.161 1.889 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1ccc(I)cc1 808540961 LVUYCEWKJPOIFZ-UHFFFAOYSA-N 346.120 1.535 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@H]2COC[C@@H](C1)O2 801024193 ZCKHMCVQRLRWAG-CALCHBBNSA-N 329.400 1.372 10 10 EDCE O=C1CN(C(=O)c2c(F)ccc(O)c2O)CCN1CC(F)(F)F 295692505 JINSHZBUNVFVCU-UHFFFAOYSA-N 336.241 1.084 10 10 EDCE CN(C)c1ccc(CN[C@H]2CCC[C@H]2CNS(C)(=O)=O)cc1 800309211 JKXONBSXVUVNGV-HOCLYGCPSA-N 325.478 1.560 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@H]2CCN=C3C2=NNN3C)cc1 822608483 VVBBFHRCALXWQC-HNNXBMFYSA-N 342.447 1.373 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@@]4(CCOC4)C3)cc2N1 829327482 JWMKEIWEMKQLQC-MRXNPFEDSA-N 333.344 1.933 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cn([C@@H]2CC[C@H]2O)nn1 900401552 XDVJBFAUQBEFII-IAGOWNOFSA-N 343.431 1.702 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C[C@]1(O)CCCN(C)C1 910557448 ASLYGUKPBAAHKI-OXQOHEQNSA-N 347.503 1.955 10 10 EDCE CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2cccc(OC)c2O)C1 843431942 FIPSPPPLKMVEFW-AWEZNQCLSA-N 332.322 1.901 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NC[C@@H]2C[C@@H]3COC[C@@H]3O2)c1 926648565 ASHBSCFGNFSHBI-DZJQYVJYSA-N 336.388 1.565 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)CC1CN(C)C1 850601337 FQYHVGCRONPCTK-UHFFFAOYSA-N 346.475 1.121 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@H]3CCO)C2)cc1 854297881 SPILEUDIQTXDKT-HOCLYGCPSA-N 333.432 1.830 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCNC(=O)C[C@H]3C)C2)cc1 854299907 LWUGDIUEVFFFTP-ZIAGYGMSSA-N 346.431 1.194 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CN1 861765325 AGKUZFFHZBEAQS-GDBMZVCRSA-N 344.459 1.160 10 10 EDCE COc1nc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)co1 862226231 XCCFEPCPGAPQAE-UHFFFAOYSA-N 331.372 1.574 10 10 EDCE C[C@H](NC(=O)C(=O)N1C2CCC1(CO)CC2)c1ccc(N(C)C)cc1 1119836964 JJFSFNLFBJHLRY-ISWZSGDOSA-N 345.443 1.446 10 10 EDCE Cc1cc(NS(=O)(=O)c2ccccc2S(C)(=O)=O)ccc1O 771219613 KLPJRXOHXDWVJM-UHFFFAOYSA-N 341.410 1.905 10 10 EDCE CNS(=O)(=O)CCCN[C@@H](C)c1ccc(N2CCOCC2)cc1 775258990 DIGXRNOSKZGZFG-AWEZNQCLSA-N 341.477 1.113 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)C[C@]2(C)CO)cc1Br 698158841 WUBIMIPSVXEAHH-OLUVUFQESA-N 330.222 1.824 10 10 EDCE Cc1cc(C)nc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)n1 1152122304 BPVQJJGKNFBYBT-UHFFFAOYSA-N 342.399 1.396 10 10 EDCE C[C@H]1COCC[C@@H]1NC(=O)C(=O)NCCCSc1nccs1 1323025995 LASDRLQAVNJJSO-QWRGUYRKSA-N 343.474 1.283 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H]2[C@H]3CCC[C@H]32)cc1 1326674058 GNDCXCMHMODUBM-FVQHAEBGSA-N 345.443 1.505 10 10 EDCE CN1CCN(c2ccc(CN3CCN(C4CC4)C(=O)C3)cc2F)CC1 1254010995 QVKMWASJRRWLJG-UHFFFAOYSA-N 346.450 1.384 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NC(=O)Cc1ccc(N)cc1 1906103520 FIGQVAJGARXYRB-UONOGXRCSA-N 335.404 1.220 10 10 EDCE CNC(=O)C1(C(=O)N(C)[C@@H](C)CNCc2ccc(OC)c(C)c2)CC1 1268090640 WAMNAMYJQBZVQU-AWEZNQCLSA-N 347.459 1.466 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1cnn(C)n1 1268486393 XEFVBMDYOSLIPR-UHFFFAOYSA-N 331.420 1.384 10 10 EDCE COc1ccc(CN[C@@H](COC(C)C)C(=O)O)cc1Cn1cccn1 1348806289 HBSARRNYMVGMES-INIZCTEOSA-N 347.415 1.908 10 10 EDCE C[C@H](NC[C@@H]1CN=C(c2cnn(C)c2)O1)c1ccc(N(C)C)cc1 1354624806 AAHXNHOHUYPYQD-SUMWQHHRSA-N 327.432 1.982 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1ccc(C(N)=O)cc1 1449127185 WTEVZYXYZLIGFF-UHFFFAOYSA-N 333.384 1.836 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@H]1C[C@@H]2CC[C@H](C1)S2(=O)=O 1469163242 QXFFYHSOYCOSPD-UOJUARBOSA-N 325.386 1.070 10 10 EDCE COC[C@H](C)NC[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1485706312 DDYXUIKEWDYMBE-HUBLWGQQSA-N 347.419 1.982 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)C=C(C)C)cc(OC)n1 1718523775 XQGKMXUYCJRWJP-GFCCVEGCSA-N 335.404 1.642 10 10 EDCE Cc1csc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)n1 1625370038 YQPNJNFYBHVPSB-UHFFFAOYSA-N 333.413 1.754 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)c2cnn[nH]2)C2CC2)cc1C 1483570284 IVBIVUXGDCQCGY-CQSZACIVSA-N 329.404 1.420 10 10 EDCE COC(=O)c1coc(/C=C/C(=O)NCCc2ccc(O)c(O)c2)c1 1622753508 ZKEBITWJTPXCND-HWKANZROSA-N 331.324 1.850 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)c2ccc(O)nn2)cc1C 1491979797 PLXOQZHMVBHAHS-CYBMUJFWSA-N 344.415 1.797 10 10 EDCE Cc1cc(CNC(=O)Cc2ccc(O)c(O)c2)nc(N2CCCC2)n1 1637078391 NVOLRXPKCZGXOA-UHFFFAOYSA-N 342.399 1.655 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cnn(C)c2)cc1C 1732332254 BTQYQPKFIXMLLO-ZDUSSCGKSA-N 330.432 1.893 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@@H]2CCC(=O)NC2)cc1C 1731918473 OTKNHTAXRZGMRA-INIZCTEOSA-N 347.459 1.468 10 10 EDCE O=C(CN1CCc2ccccc2C1=O)NCc1ccc(O)cc1O 1570462147 FVJTUHLTNAKGDO-UHFFFAOYSA-N 326.352 1.413 10 10 EDCE NC(=O)N1CCC[C@@H](C(=O)NCc2c(O)ccc3ccccc23)C1 1652705990 SLFRNDDQLMYFPM-CYBMUJFWSA-N 327.384 1.952 10 10 EDCE CNC(=O)[C@@H]1CCCN1C(=O)NCc1ccc(N2CC=CC2)cc1 158914165 WUWWEIOOHAQZQU-INIZCTEOSA-N 328.416 1.483 10 10 EDCE CN(C)c1ccc(/C=c2\sc3nc(C(F)(F)F)nn3c2=O)cc1 1860794484 ZSMWMTJFOCTYLO-YFHOEESVSA-N 340.330 1.784 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1CN2CCCN1CC2 394817654 SKHFBCPDPXQRLR-CQSZACIVSA-N 340.265 1.634 10 10 EDCE CN(C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1ccncc1 1910970209 XZAMFJIPVSVGEQ-UONOGXRCSA-N 333.388 1.629 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC(=O)COc3ccc(N)cc3)[C@H]2C1 2044209391 FJJLTLVJQSPMSN-FOLVSLTJSA-N 347.415 1.629 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COCCN(C(=O)Cc2ccc(N)cc2)C1 2044624515 IXRMDYRNHANVGB-OAHLLOKOSA-N 349.431 1.563 10 10 EDCE CN(C[C@@H]1COCCO1)c1ccc(CN)c(Br)c1F 2087371038 GXWGLYVTOVMPCG-SNVBAGLBSA-N 333.201 1.899 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)C(=Cc2ccc(F)cc2F)SC1=S 2323832097 JWXLDKCTWZMRLS-SECBINFHSA-N 345.348 1.612 10 10 EDCE Cc1ccc(CN(C)[C@H]2CN(C)C[C@@H]2O)c(O)c1Br 2352633252 HDRIZIMUKYFRHK-RYUDHWBXSA-N 329.238 1.570 10 10 EDCE COc1ccc(N2CCN(C(=O)COC[C@@H]3CCOC3)CC2)cc1 172030983 CRQIZRPDYJPDAZ-OAHLLOKOSA-N 334.416 1.397 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc2ccccn2c1=O 183485298 ORNZDZAGFREYKN-NSHDSACASA-N 339.351 1.467 10 10 EDCE CCc1nc2n(n1)CCC[C@H]2NC(=O)NCc1cc(OC)ccc1O 88563507 ICXOQAXARRKGJO-CYBMUJFWSA-N 345.403 1.889 10 10 EDCE CNCc1ccc(N2C[C@H](C(N)=O)C3(CC3)C2)cc1Br 2370421727 WSQHTYGWYWYWOZ-GFCCVEGCSA-N 338.249 1.870 10 10 EDCE CCN(CC)c1ccc(CNC(=O)CSc2n[nH]c(=O)[nH]2)cc1 287132740 KWMHPBUNTMNYQX-UHFFFAOYSA-N 335.433 1.353 10 10 EDCE Cc1ccc(CNC(=O)C[C@]2(O)CCNC2)c(O)c1Br 2380745079 HFQVZYIRTXMRDO-CQSZACIVSA-N 343.221 1.194 10 10 EDCE CN(C)c1ccc([C@H](N)[C@H](O)c2c(Br)cnn2C)cc1 2163131737 UPPQIDQKKAFHOA-JSGCOSHPSA-N 339.237 1.982 10 10 EDCE Cn1ccc(CNC(=O)NCc2cc(Br)ccc2O)n1 805245777 BMYAVMDJXHROQI-UHFFFAOYSA-N 339.193 1.888 10 10 EDCE O=C1CC[C@@H](C(=O)NCc2cc(Br)ccc2O)CN1 804737973 XRCQSTXCALZPRX-MRVPVSSYSA-N 327.178 1.297 10 10 EDCE CCNC(=O)CNC(=O)NCc1cc(Br)ccc1O 804871137 SCSUQVRUVCSEGE-UHFFFAOYSA-N 330.182 1.090 10 10 EDCE CSCCCCNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 807102103 DAHLZZIRPATGGA-UHFFFAOYSA-N 337.489 1.937 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)c3nnn(C)c3C)C2)cc1 819583860 AZBMQFOJHNVSQS-ZDUSSCGKSA-N 329.404 1.388 10 10 EDCE O=[N+]([O-])c1cc(CN2CCC(CO)(CO)C2)ccc1N1CCCCC1 827481076 JTVPELSPIQFAEL-UHFFFAOYSA-N 349.431 1.762 10 10 EDCE CCNS(=O)(=O)[C@H]1CCN(C/C=C\c2ccc(N(C)C)cc2)C1 835045647 XPDWKEBYUWYSDY-OSJSJHBBSA-N 337.489 1.779 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2coc(S(C)(=O)=O)c2)c1 845833219 KHHZXYDVBUPZEG-SECBINFHSA-N 339.369 1.888 10 10 EDCE N=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC[C@@H]1CCCO1 849016903 QOQPPBJXZXRJAS-SFHVURJKSA-N 346.475 1.688 10 10 EDCE CCNC(=O)CN(C)Cc1c(O)c(C(=O)OC)cc2ccccc12 747074828 WDIHWUHTMQHTPA-UHFFFAOYSA-N 330.384 1.900 10 10 EDCE COc1cc(Cl)cc(CN2C[C@H](C)N(CCO)C[C@@H]2C)c1O 841890405 AKRKGSLDPDPDPE-RYUDHWBXSA-N 328.840 1.941 10 10 EDCE COCCNC1CCN(C(=O)NCc2ccc(N(C)C)cc2)CC1 846134248 PVLMCTVNMUGDDI-UHFFFAOYSA-N 334.464 1.663 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)c3cscn3)C2)cc1 849417376 PVZOVEOZBUPTSR-LLVKDONJSA-N 339.442 1.709 10 10 EDCE C[C@H]1C(=O)N(C)CN1Cc1c(O)ccc(C(=O)c2ccccc2)c1O 842643239 YJOVSFWDDKLYOU-LBPRGKRZSA-N 340.379 1.949 10 10 EDCE CSC[C@H]1NC(=O)N(Cc2ccc(N3CCN(C)CC3)cc2)C1=O 925078985 BYXDBHKTGKZXNM-OAHLLOKOSA-N 348.472 1.222 10 10 EDCE Cc1cc(CCNCc2ccc(N3CCN(C)CC3)cc2)nn1C 922690894 WLNIWYJWYIUAQL-UHFFFAOYSA-N 327.476 1.813 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1C[C@@H](O)CC2(CCOCC2)C1 922897658 BEMMXXUTKLIVLG-PMUGQKEBSA-N 333.384 1.501 10 10 EDCE O=C(/C=C/c1cnccn1)NCc1ccc(N2CCC(O)CC2)cc1 856210433 BOONKOUWJPRELW-ZZXKWVIFSA-N 338.411 1.767 10 10 EDCE NC[C@@H]1CC(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)=NO1 852882501 JBEUDFKPJZBIRA-KBPBESRZSA-N 333.388 1.003 10 10 EDCE CN(C)C(=O)N(C)[C@H]1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 853585219 WNVVNCWWHVKZAP-WFASDCNBSA-N 335.404 1.006 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C[C@H]1F 1117407057 JHRHNQZBDDLNDH-WMLDXEAASA-N 345.418 1.886 10 10 EDCE CC(C)(C)n1cc(C(=O)C(=O)OCC(=O)c2ccc(O)c(O)c2)cn1 783047021 OUAVWHRXQLOZGF-UHFFFAOYSA-N 346.339 1.658 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cncnc1C 1137816339 GSSKDVGBMMGRKU-UHFFFAOYSA-N 349.774 1.959 10 10 EDCE CNCc1ccc(N(C)[C@@H]2CCN(C)C2=O)c(Br)c1 690313637 FGLVDKVORDFWCS-CYBMUJFWSA-N 326.238 1.835 10 10 EDCE COC(=O)c1cncc(NC(=O)NCc2ccc(OC)cc2O)c1 797635985 OKOCLKWYFVQDFB-UHFFFAOYSA-N 331.328 1.904 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)c2cncnc2O)cc1C 1317400427 ZQLGNQASJMFSDW-CYBMUJFWSA-N 344.415 1.797 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@H]2[C@@H](O)CO)cc1Br 2123209832 JUVDWNYYPMTEGR-IIMNLJJBSA-N 329.238 1.791 10 10 EDCE CNCc1ccc(N(C)C[C@@]2(O)CCOC2)cc1Br 2129431598 QBTCUQWHIRPZLO-AWEZNQCLSA-N 329.238 1.756 10 10 EDCE O=C(CN1CCCC2(CC2)S1(=O)=O)NCc1c(O)cccc1F 1349384348 RMUFBECRXAEDEP-UHFFFAOYSA-N 342.392 1.106 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)C2(C(N)=O)CC2)cc1C 1282183465 DYUWTCKZWCQJMU-CHWSQXEVSA-N 333.432 1.252 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccnc1OCCO 1449122105 NLGLFXGZYKJFOF-UHFFFAOYSA-N 337.372 1.574 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccccc2)cc1C 1485971409 ZPAXWLDSHOITEA-KRWDZBQOSA-N 328.412 1.884 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CC(=O)N(Cc2ccccn2)C1 1558174202 HFIWZIIBTGTIEL-ZDUSSCGKSA-N 341.367 1.158 10 10 EDCE O=C(C1CC1)N1CC(NCc2c(O)cccc2Br)C1 1926310477 UODLEFLXVLOZCY-UHFFFAOYSA-N 325.206 1.865 10 10 EDCE C[C@](O)(CO)[C@@H]1CCN(c2ccc(CN)cc2Br)C1 2138099710 BXEXAKGVAHXJEH-RISCZKNCSA-N 329.238 1.477 10 10 EDCE C[C@H](C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1740513481 FZVXMRPPQOCYES-JTQLQIEISA-N 331.376 1.741 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H]2CCCC(=O)N2C)cc1C 1690642658 ACSHXPFWLWQIFL-ZBFHGGJFSA-N 347.459 1.609 10 10 EDCE OC[C@@]1(CNCc2cc(Br)cc(F)c2O)CCCO1 1879593292 YWHBQRSYOLNVSK-ZDUSSCGKSA-N 334.185 1.925 10 10 EDCE CN[C@H](c1ccc(N(C)C)cc1)C1(O)CN(C(=O)OC(C)(C)C)C1 1999536816 PDUBWAXNUJIKJF-OAHLLOKOSA-N 335.448 1.995 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@]1(C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010398864 WVAYHOOGPUIJKO-FIXISWKDSA-N 339.396 1.827 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@H](CO)C2)c(Br)c1 316967132 IBWGPYTUBYPNNF-OLUVUFQESA-N 329.238 1.519 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@](O)(C(N)=O)C2)cc1Br 380495116 NDMSEMFZWBISDS-YMTOWFKASA-N 342.237 1.156 10 10 EDCE C[C@H]1C[C@H]2CN(c3ccc(CN)c(Br)c3)CCN2C1=O 2181290292 UNGHWFCIRRLOBD-GWCFXTLKSA-N 338.249 1.965 10 10 EDCE OCc1ccc(N2CC3(C2)OCCC[C@H]3O)c(Br)c1 2103414664 SNCSDLYNSTVHOF-CYBMUJFWSA-N 328.206 1.672 10 10 EDCE Oc1c(F)cc(Br)cc1CNC[C@@H]1C[C@H](O)CCO1 2097944341 CKXHAYIZWQHHTN-MNOVXSKESA-N 334.185 1.923 10 10 EDCE COc1ccc(N(C)CCN(C)CCO)c(OC)c1Br 2234881927 SZEQREXNXWPPPZ-UHFFFAOYSA-N 347.253 1.827 10 10 EDCE COc1ccc(Br)c(CNCC(C)(CO)CO)c1O 2227748182 KYUSJYUWQBDKIS-UHFFFAOYSA-N 334.210 1.244 10 10 EDCE CN(C)CC1(O)CN(c2cc(Br)c(CN)cc2F)C1 2343652754 HVXUFEFGTLKWOD-UHFFFAOYSA-N 332.217 1.160 10 10 EDCE COC[C@@H](C)S(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 172195897 ADUQARIGYJGIAF-CYBMUJFWSA-N 328.434 1.182 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nc(C)c(C)[nH]c3=O)CC2)cc1 179176361 ASEYVWPJZNPSCS-UHFFFAOYSA-N 342.399 1.358 10 10 EDCE NCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(F)c1Br 2357592652 LOLNESDBYYDTBP-LSYYBOQUSA-N 345.212 1.367 10 10 EDCE COC[C@@H](O)CN[C@H](C)c1ccc(N2CCOCC2)cc1Cl 129603701 OJGGSNYIINFFGF-OCCSQVGLSA-N 328.840 1.835 10 10 EDCE CCCCN(C)C(=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 244468718 ZFSPPZBKWGMFJW-UHFFFAOYSA-N 347.459 1.992 10 10 EDCE CNC(=O)CCCN(C)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 255111752 UGOZQRQTMFDKLY-CLFYSBASSA-N 335.360 1.743 10 10 EDCE CC[C@H](C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(O)c(O)c1 272269116 CWHVBVKEKSSHQA-JQWIXIFHSA-N 338.429 1.662 10 10 EDCE Cc1ccc(CNC(=O)C[C@H]2CNCCO2)c(O)c1Br 2381138392 VBCJBNMRGIEIFZ-NSHDSACASA-N 343.221 1.458 10 10 EDCE COc1ccc(N2CCN(C(=O)C[C@@H]3CCOC[C@@H]3OC)CC2)cc1 294251304 FRXKHFKCIYIWIN-YJBOKZPZSA-N 348.443 1.785 10 10 EDCE CNC(=O)CN1CCC(NCc2cc(Cl)c(F)cc2O)CC1 294132985 GYHBEBLYXZGSDX-UHFFFAOYSA-N 329.803 1.485 10 10 EDCE COC(=O)c1cscc1C(=O)OCC(=O)c1ccc(O)c(O)c1 808642453 PIPBJEVLIFVCBZ-UHFFFAOYSA-N 336.321 1.986 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cc(C=O)cn3C)CC2)cc1 822196907 ATTSSUXBTURMDX-UHFFFAOYSA-N 327.384 1.809 10 10 EDCE COC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)c2c(F)ccc(O)c2O)C1 828857433 CBSQAECYCCMMSV-NXEZZACHSA-N 340.351 1.834 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H](C[C@@H]2CCCOC2)C(=O)O)cc1 908758384 JSIFLLCSTGLKPV-HOCLYGCPSA-N 349.431 1.822 10 10 EDCE CN(C/C=C\c1ccc(N(C)C)cc1)C[C@@H](O)CN1CCOCC1 835026407 TUBCSVWIBGUFHW-PHWHVTFISA-N 333.476 1.391 10 10 EDCE COC(=O)c1cc2ccccc2c(CN(C)[C@H]2CCN(C)C2=O)c1O 738270376 WBQIQJLPVAOXDN-INIZCTEOSA-N 342.395 1.995 10 10 EDCE C[C@H]1CN(C2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)CCO1 588405171 ROEQAOOJNSNYLJ-MFBWXBCUSA-N 346.427 1.823 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)/C=C\Cn3cncn3)C2)cc1 912291868 FFBTZHXNUGXHFF-SFAKSCPVSA-N 327.388 1.238 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)C2C[C@H]3COC[C@@H](C2)C3=O)cc1 832273460 OEEAXPHVXXRGRN-BTFYYFJDSA-N 345.443 1.110 10 10 EDCE COCC[C@H]1NC(=O)N([C@@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849357157 KQEBXURGUYYDSP-UKRRQHHQSA-N 333.388 1.231 10 10 EDCE C[C@@H](NC(=O)c1c[nH]ccc1=N)c1ccc(N2CCOCC2)cc1 844176845 VZNYUXNYNKITHZ-CYBMUJFWSA-N 326.400 1.822 10 10 EDCE CC1CCC2(CC1)NC(=O)N(CC(=O)NCc1ccccc1O)C2=O 748353909 FLNAYLXMUZFEKN-UHFFFAOYSA-N 345.399 1.509 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1C(=O)NCc1ccc(N2CCCC2)cc1 844887486 HDXJXNHHXWHJHL-DLBZAZTESA-N 333.432 1.578 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3ccn(C)n3)C2)cc1 852235482 ZPYIZTYKFHIHNH-CQSZACIVSA-N 329.404 1.507 10 10 EDCE O=S1(=O)CCN(c2ccc(CNc3nccnc3F)cc2)CC1 858386562 QUOPCDPUOVOLQI-UHFFFAOYSA-N 336.392 1.463 10 10 EDCE CCOC(=O)[C@H](CC)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855224535 LMRUAQFAFXHUIZ-CZUORRHYSA-N 334.416 1.979 10 10 EDCE CCOC(=O)C[C@@H](O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 859190409 JXULWYOIPXFTBA-CVEARBPZSA-N 337.416 1.687 10 10 EDCE C[C@@H](NC(=O)[C@@]1(N)CC1(F)F)c1ccc(N2CCOCC2)cc1 867961258 CDVTVDPZPRCXQE-ABAIWWIYSA-N 325.359 1.437 10 10 EDCE CCOC[C@@H]1C(=O)N(Cc2ccc(N3CC=CC3)cc2)C(=O)N1C 761378137 FZYRBKYBJVEHBE-MRXNPFEDSA-N 329.400 1.862 10 10 EDCE CC(C)N[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 761887734 SNRDNFUGVGFARQ-LLVKDONJSA-N 334.376 1.893 10 10 EDCE CCN(C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)[C@@H]1CCN(C)C1 1118690859 AWOLBRBIPSXRHW-RHSMWYFYSA-N 346.475 1.482 10 10 EDCE CC(=O)c1cc(F)cc(CN2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c1O 879934177 YQYODIJINHWEQH-DGCLKSJQSA-N 341.404 1.600 10 10 EDCE CCNCc1ccc(N2CCN(C)[C@H](CO)C2)cc1Br 687618433 KUUOKZPVRMJTGN-AWEZNQCLSA-N 342.281 1.671 10 10 EDCE O=Cc1ccc(OCC(=O)NCc2c(O)cccc2F)c([N+](=O)[O-])c1 1156170328 LGWFFGGFGHHOIS-UHFFFAOYSA-N 348.286 1.947 10 10 EDCE CCCCC(=O)N1CSC[C@H]1C(=O)NCc1cc(O)ccc1O 1153879079 DCTPFPSPJVYJOS-ZDUSSCGKSA-N 338.429 1.806 10 10 EDCE COc1ccc(-n2nnnc2CN[C@H](C)CCNC(=O)C2CC2)cc1 1317384431 NTVFAFSTOXVLPU-GFCCVEGCSA-N 344.419 1.065 10 10 EDCE Cc1cc([C@H]2CCCN2C(=O)C(=O)N2Cc3cccc(O)c3C2)on1 1335549052 VHVRJUJCUZKFQV-CQSZACIVSA-N 341.367 1.895 10 10 EDCE O=C1C[C@@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)NC(=O)N1 1445636847 DQLNGWCTWONFCQ-ZDUSSCGKSA-N 343.339 1.112 10 10 EDCE NC(=O)Cc1ccc(CNC(=O)c2ccc(N=NC(N)=O)cc2)cc1 1298805027 VEMPVUTZGPRTNG-UHFFFAOYSA-N 339.355 1.807 10 10 EDCE O=C(/C=C\c1ccc2c(c1)NC(=O)CO2)NCc1ccc(O)c(O)c1 1465954312 OVFGKAPRBMZIFV-UTCJRWHESA-N 340.335 1.758 10 10 EDCE CC(C)(C)OCC(=O)NC(C)(C)C(=O)NCc1cccc(O)c1O 1633515854 SZXQQZSUIVRPGW-UHFFFAOYSA-N 338.404 1.424 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(CO)nc3)C2)cc1 1639682570 HAHGKJFPZJQZHH-AWEZNQCLSA-N 341.411 1.839 10 10 EDCE COc1cccc(CNC(=O)[C@@H]2Cc3cc(F)ccc3NC2=O)c1O 1566374304 CIAFWZCRQMHBGD-ZDUSSCGKSA-N 344.342 1.967 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@]2(F)CCOC2)cc1C 1732891561 LAQGPXMBNFWFFL-WHLIDYPQSA-N 336.407 1.894 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCc2nccn2C)cc1C 1662293967 WDTPELCMJJVMDI-HNNXBMFYSA-N 344.459 1.964 10 10 EDCE O=C(C[C@H]1C(=O)Nc2ccc(F)cc21)NCc1ccc(O)c(O)c1 1595596461 WOWWRIKDFUMPEZ-GFCCVEGCSA-N 330.315 1.979 10 10 EDCE Cc1cc(=O)c(OCCC(=O)O)cn1CCOc1ccc(N)cc1 1857916944 UNGQEYRMGSMHIM-UHFFFAOYSA-N 332.356 1.671 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@@H]1CCOC1 1985097023 ZRUABHNLVHZXFG-KOLCDFICSA-N 325.369 1.437 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1COC[C@@H]1N(C)C(=O)OC(C)(C)C 1985101775 XLKXTCBGLQJTCS-MNOVXSKESA-N 327.385 1.637 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2NC(=O)Cc1ccc(N)cc1 1999123364 ZZMGXCLNKADCRD-IVMMDQJWSA-N 331.416 1.935 10 10 EDCE CON(CCNC(=O)COc1ccc(N)cc1)C(=O)OC(C)(C)C 1999123248 YIVCLKJVWWIMET-UHFFFAOYSA-N 339.392 1.562 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)[C@@H](N)c1ccc2c(c1)CCN2C 2000228275 CJGYENMQGHAEOC-KNXALSJPSA-N 335.448 1.953 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2007216220 PHZIKVVOWQFVCK-CYDGBPFRSA-N 340.420 1.182 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc[nH]1)C(=O)N1CC(N=[N+]=[N-])C1 2010389158 LZEICJKAZOGGJP-LBPRGKRZSA-N 334.380 1.972 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@H](CO)NC(=O)OC(C)(C)C)c1 2011516634 KTBNPQLVBGSNRS-NWDGAFQWSA-N 340.420 1.937 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccccc1O 797191761 XKSDESSIULELOL-CYBMUJFWSA-N 338.404 1.890 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N(C)[C@H](C)C3CCN(C)CC3)c2n1 2065033357 KWMQOUPGZTZABA-GFCCVEGCSA-N 331.420 1.546 10 10 EDCE C[C@@H](c1cc([N+](=O)[O-])ccc1O)n1ncc(S(C)(=O)=O)c1O 2070260318 XPUOAOWSCNOCCN-ZETCQYMHSA-N 327.318 1.215 10 10 EDCE COC(=O)Cc1cc(O)n2nc(C3CCCCC3)c(C(=O)OC)c2n1 2080933923 YMEVPBRZMLSROS-UHFFFAOYSA-N 347.371 1.985 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)cc1Br 2190457644 KNLOKVZNYDKAAK-PDRAWDMGSA-N 341.249 1.932 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213588201 OYCLXYNCLXYUPA-QWRGUYRKSA-N 339.396 1.706 10 10 EDCE CC(C)(C)OC(=O)NCCCn1cnc(C(=O)N2CC(N=[N+]=[N-])C2)c1 2218275871 GIYYNROBRQAMNR-UHFFFAOYSA-N 349.395 1.933 10 10 EDCE OCc1ccc(N2C[C@H](CO)C[C@@H](CO)C2)c(Br)c1 2228399431 IUVOOJBTHXZPSS-VXGBXAGGSA-N 330.222 1.369 10 10 EDCE CN(c1ccc(CN)c(Br)c1)[C@@H]1COC2(COC2)C1 2270767308 HAIOKSGBWDEORM-LBPRGKRZSA-N 327.222 1.902 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@]1(O)CCCN(C(=O)OC(C)(C)C)C1 2300530800 WOOWBGZNMBUNIB-OAHLLOKOSA-N 341.412 1.907 10 10 EDCE C[C@@]1(C(=O)O)CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2311974158 YHQBLHNVUWKBDC-LJQANCHMSA-N 344.411 1.860 10 10 EDCE CCS(=O)(=O)N(C)CC(=O)NCc1c(O)ccc2c1CCCC2 175406683 OVDQCNGHIIOHNN-UHFFFAOYSA-N 340.445 1.169 10 10 EDCE CCCS(=O)(=O)N1CCC[C@@H]1C(=O)N(C)Cc1ccccc1O 175311541 CXZJIPZECYANDU-CQSZACIVSA-N 340.445 1.555 10 10 EDCE Cc1ccc(CN(C)c2nc(CO)n(C)n2)c(O)c1Br 2381129446 KJINVTQOVGFPLA-UHFFFAOYSA-N 341.209 1.720 10 10 EDCE O=C(NCc1cc(Br)ccc1O)C(=O)NCC(F)F 804739594 KUTJEHOQVCSVRY-UHFFFAOYSA-N 337.120 1.152 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)CCNC(C)C)CC2)cc1 829504571 FTCCIKDMXAWNTI-UHFFFAOYSA-N 348.491 1.322 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)Cc1nnnn1C(C)(C)C 823576781 YWCURRZNTYVJLU-UHFFFAOYSA-N 347.419 1.699 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H](CCF)C2)cc1 826706748 LTEFAIJTBZMRFC-OAHLLOKOSA-N 335.423 1.967 10 10 EDCE COC(=O)[C@]12C[C@H](N)C[C@H]1CN(Cc1c(O)ccc(Cl)c1F)C2 903977231 MGTJZBNGYZBRLX-IEVXNVSRSA-N 342.798 1.897 10 10 EDCE Nc1ccc(NC(=O)C(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)O2)cc1 927867776 PELTXZNZKKSFHB-NWDGAFQWSA-N 345.321 1.824 10 10 EDCE C[C@H](NC(=O)COCC(F)F)c1ccc(N2CCOCC2)cc1 858785055 CSAFORZJNBVSNQ-LBPRGKRZSA-N 328.359 1.982 10 10 EDCE CC(=O)C(=O)COC(=O)C[C@@H]1CC[C@H](NC(=O)OC(C)(C)C)C1 922955118 QPGKTPBXIXPCNE-NEPJUHHUSA-N 327.377 1.771 10 10 EDCE COC(=O)CCNC(=O)CCN[C@H](C)c1ccc(Cl)cc1O 858540820 AZFJQVGKNGPKIW-SNVBAGLBSA-N 328.796 1.766 10 10 EDCE CC(=O)N1CCO[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)C1 930297396 YVWCZBJDADMXIS-SFHVURJKSA-N 347.459 1.737 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3C[C@H]4COC[C@@H]4O3)CC2)c(OC)c1 931531069 WSYJOYGVQIJTFQ-QOKNQOGYSA-N 348.443 1.630 10 10 EDCE NC(=O)CC[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 761890168 YLXUDHIDARGDNH-JTQLQIEISA-N 348.359 1.408 10 10 EDCE CCOC(=O)[C@@H]1CCCN1S(=O)(=O)N[C@@H](C)c1ccccc1O 867833987 JBNVOKVUIGBECX-AAEUAGOBSA-N 342.417 1.315 10 10 EDCE COCCOc1ncccc1NC(=O)NCCc1ccc(O)c(O)c1 761640604 GKNYDQQNLPQSDK-UHFFFAOYSA-N 347.371 1.882 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1cnc2c1CCCC2 773760542 AZZNYCSZKSMGBR-GFCCVEGCSA-N 329.400 1.921 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1ccsc1 773761836 JCWQSECYVCRDFS-SNVBAGLBSA-N 334.397 1.637 10 10 EDCE CCOc1ccc(CNCC2(S(=O)(=O)N(C)C)CC2)c(O)c1 886321955 DQQLEONGZVTGBA-UHFFFAOYSA-N 328.434 1.305 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cc(Br)n[nH]2)c1 788297512 CWOSUBHFBMELHF-UHFFFAOYSA-N 326.150 1.816 10 10 EDCE O=C(NC[C@H](CO)[C@@H]1CCOC1)c1cc2cc(O)c(O)cc2s1 897633127 ZLHDIVQKMICHPX-MWLCHTKSSA-N 337.397 1.687 10 10 EDCE C[C@@H]1CO[C@@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 895780343 HWVSNGGHJJVDCF-KBXCAEBGSA-N 332.444 1.937 10 10 EDCE O=C(c1ccccc1)c1nc[nH]c1C(=O)NCc1cc(O)ccc1O 1153884660 FDPZPSJCQJVQON-UHFFFAOYSA-N 337.335 1.982 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@](CN)(C(C)(C)C)C1 1329506614 AXDWDLHVMTWDRA-IBGZPJMESA-N 347.459 1.574 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(Br)c1 2126160501 AVRXTJXJPKRRAT-DHPDLVEQSA-N 328.206 1.119 10 10 EDCE Cc1cn2nc(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)cc2c(=O)[nH]1 1263777723 VCLGNKFUUBWUEM-GFCCVEGCSA-N 339.399 1.888 10 10 EDCE CC1(C)C[C@@H](O)[C@@H](O)CN1c1ccc(CO)cc1Br 2132174007 MULJJOHTWPZBCQ-OLZOCXBDSA-N 330.222 1.652 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)C[C@H]2CO)cc1Br 2136089151 XFYQCWKKMLWROW-ZMLRMANQSA-N 329.238 1.791 10 10 EDCE CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1621215700 BBMAWSYUNLYKIN-SASJJMKUSA-N 325.430 1.836 10 10 EDCE O=C(Cc1nc2ncccn2n1)NCc1c(O)ccc2ccccc12 1558554276 ODSCQQJHADQNPY-UHFFFAOYSA-N 333.351 1.842 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cn(C)cn2)cc1C 1495642408 HREQGROZAFYDJZ-ZDUSSCGKSA-N 330.432 1.893 10 10 EDCE C[C@@H](CCS(C)(=O)=O)NC(=O)c1ccc(N=NC(N)=O)cc1 1636147626 YBUSANFSLBQNJW-VIFPVBQESA-N 326.378 1.402 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)CCc2cnn[nH]2)cc1C 1725503843 HDCPXCKXUACNGG-CQSZACIVSA-N 345.447 1.691 10 10 EDCE COC(=O)c1cnc(Sc2cc(C(N)=O)nc(Cl)n2)s1 1655509164 GBOYXIYSXHLQMA-UHFFFAOYSA-N 330.778 1.623 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CN(Cc2ccccc2)CCO1 1651222287 DSRBQKNUCYSVCW-GOSISDBHSA-N 342.395 1.615 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H]2CCCC(=O)N2C)cc1C 1669458487 YMZADMBUTBYMIJ-GDBMZVCRSA-N 347.459 1.609 10 10 EDCE COc1cc(C(=O)N[C@H](C)C[C@H](C)NC(=O)CC2CC2)cc(OC)n1 1681525535 ILXCIQDVUGXZHE-NWDGAFQWSA-N 349.431 1.912 10 10 EDCE NC(=O)CN(CCC(=O)Nc1ccc(N)cc1)Cc1ccccc1 1946833000 LZTWLQOVXQDBLB-UHFFFAOYSA-N 326.400 1.585 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C 1985094050 JHXLCTWRTXQXQS-NSHDSACASA-N 326.401 1.306 10 10 EDCE COCCN(CC(=O)N1CC[C@@H](N=[N+]=[N-])C1)C(=O)OC(C)(C)C 1985101685 WFMJWLGNZZVKFS-LLVKDONJSA-N 327.385 1.781 10 10 EDCE C[C@](NC(=O)C(F)(F)F)(C(=O)N1CC(N=[N+]=[N-])C1)C(F)(F)F 1985102985 OOVJTSNMXGQIGW-ZETCQYMHSA-N 333.192 1.507 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C1 2010389035 KMKYVXYOUQUHII-NSHDSACASA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC[C@H](CN=[N+]=[N-])C1)C(C)(C)O 2014484143 ZAJXFOPLKFQQTA-MNOVXSKESA-N 341.412 1.809 10 10 EDCE CCN(c1ccc([C@@H](C)O)cc1Br)[C@H]1CC(=O)NC1=O 2171207248 UPANNXOHZZVSIJ-PELKAZGASA-N 341.205 1.744 10 10 EDCE CNCc1ccc(N(C)CCN(C)C2COC2)cc1Br 2173115091 SAIDHXLWVIBNLP-UHFFFAOYSA-N 342.281 1.935 10 10 EDCE Oc1cc(O)c(Cn2cc(I)cn2)c(O)c1 2069927026 OUZVVLJHYWIFIF-UHFFFAOYSA-N 332.097 1.653 10 10 EDCE CCNCc1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)c(Br)c1 2197965414 JAABAUTUMGEIQU-LSDHHAIUSA-N 343.265 1.881 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OCCN(Cc3cc(N)ccc3O)[C@H]2C1 2044612174 UOJMWARZAJQCMS-HOCLYGCPSA-N 349.431 1.795 10 10 EDCE CCN(C(=O)C1=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1cccnn1 2080942197 IKFICYKEHWFWAV-STQMWFEESA-N 348.403 1.414 10 10 EDCE CN[C@H](c1ccccc1O)[C@@H](O)c1cn(C)nc1Br 2091863017 KQGSHIJJIWMMGX-NEPJUHHUSA-N 326.194 1.882 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])CC(O)C1 2213587629 JSVWLSSTQBRDNY-SSOKKCIESA-N 339.396 1.752 10 10 EDCE COc1ccc(Br)c(CN[C@@H](C)Cn2cnnc2)c1O 2208873073 UGDIPKAFANTLNS-VIFPVBQESA-N 341.209 1.933 10 10 EDCE O=C(O)[C@@]12CO[C@@H](C1)[C@H](NCc1c(O)cccc1Br)C2 2280791329 PQGXPQXTWQKCBI-SCDSUCTJSA-N 342.189 1.877 10 10 EDCE CN(C)c1ccc(C=C2C(=O)NC(=O)N(C[C@@H]3CCCO3)C2=O)cc1 2297347107 ZYUZFHHCUMSGSZ-AWEZNQCLSA-N 343.383 1.393 10 10 EDCE NCc1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)cc1Br 2314790759 FWYKEPXRBMAEIY-BXKDBHETSA-N 331.235 1.141 10 10 EDCE Cc1ccc(CN2CCCNS2(=O)=O)c(O)c1Br 2327801358 RPUMLSJSLUGERR-UHFFFAOYSA-N 335.223 1.503 10 10 EDCE CN1CCCC[C@H]1CN1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1 171933616 SLNZDOBAKYXOBI-KRWDZBQOSA-N 348.447 1.902 10 10 EDCE O=C(COCCO)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 188894244 KZHNWELYEDRFJB-GFCCVEGCSA-N 344.358 1.382 10 10 EDCE CN1C(=O)/C(=C2/SC(=S)N(CC(=O)O)C2=O)c2ccccc21 33326005 ROKVNEQXDYAWBY-ZHACJKMWSA-N 334.378 1.319 10 10 EDCE CC[C@@H](O)CN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 123528963 OMRPRWKGHPLNCL-LJQANCHMSA-N 333.476 1.412 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)NCCCn1ccnn1 182969057 PBFFILIDYKBYDN-QPJJXVBHSA-N 341.415 1.334 10 10 EDCE C[C@H](NC[C@]1(CO)COCC2(CCC2)N1C)c1ccc(F)cc1O 527955330 NOMCYCOXACIFHO-UGSOOPFHSA-N 338.423 1.798 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N1CCN2CCC[C@H]2C1 255616196 UYTANRLDYQWAOF-ZXYDQQDNSA-N 341.455 1.843 10 10 EDCE Cc1ccc(C(=O)N2CCOC[C@@H]2c2c(C)nn(C)c2C)c(O)c1O 378558786 JCVHWEZWLFQRRB-CQSZACIVSA-N 345.399 1.970 10 10 EDCE CN(C)S(=O)(=O)[C@@H]1CCCN(Cc2c(O)cccc2Cl)C1 289374755 LVDVMDDLSPTSJQ-LLVKDONJSA-N 332.853 1.901 10 10 EDCE COc1cccc(O)c1CN1CCC[C@H](S(=O)(=O)N(C)C)C1 809688146 CGDAHDYOEFWHCL-LBPRGKRZSA-N 328.434 1.257 10 10 EDCE CN1C(=O)CC[C@@H]1C(=O)NCc1cc(Br)ccc1O 804733352 PGMOYEVPIRWBPL-SNVBAGLBSA-N 327.178 1.392 10 10 EDCE O=C(NCc1ccc(N2CCSCC2)cc1)N1C[C@H]2CC[C@H]1CN2 817876322 DJXWFOUUOSPUPQ-WBVHZDCISA-N 346.500 1.886 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCNC(=O)CC3)CC2)cc1F 815773642 VEQJKYGDTOQNEG-CYBMUJFWSA-N 349.406 1.399 10 10 EDCE COC(=O)[C@@H]1[C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2)C1(F)F 918276906 OXQURUMSTUYCTQ-NXOHGQNRSA-N 327.283 1.282 10 10 EDCE Cc1cc(N(C)C)ccc1CN1CCC[C@H](S(=O)(=O)N(C)C)C1 840948503 SZJDWAKARNAUHI-KRWDZBQOSA-N 339.505 1.917 10 10 EDCE C[C@@H]1CNCC[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 841730712 VBDIDCAQZJPSIT-RHSMWYFYSA-N 332.448 1.320 10 10 EDCE CCOc1ccc(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)c(O)c1 843425533 BOKLWVLOPGRSGW-MRXNPFEDSA-N 341.429 1.180 10 10 EDCE COC(=O)[C@@H]1CN(C)CCN(Cc2ccc(N3CCOCC3)cc2)C1 840958597 QOHGYRVKECUQEM-QGZVFWFLSA-N 347.459 1.060 10 10 EDCE O=C1[C@H]2[C@H]3C[C@H]4[C@@H]2[C@]2(C(=O)NCc5cc(Cl)ccc5O)[C@H]1[C@@H]3[C@@H]42 846477071 QAHOZHUHTNVOAH-OSXWDHSYSA-N 329.783 1.989 10 10 EDCE C[C@@H]1CC[C@H](C(=O)O)N1CC(=O)N(C)Cc1ccc(N(C)C)cc1 844836375 AZXGBONBVLMWDS-CZUORRHYSA-N 333.432 1.649 10 10 EDCE C[C@@H]1C[C@@H](C)CN(S(=O)(=O)NNc2nc3cccnc3s2)C1 857225525 OJLNDKRLIQGLEL-NXEZZACHSA-N 341.462 1.831 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CNC(=O)CC(C)(C)C)C2)cc1 855231174 TXRRXAOUNFXTQT-AWEZNQCLSA-N 347.459 1.943 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCc3cn(C)cn3)C2)cc1 852377426 IRDSWVJFLJMDGA-HNNXBMFYSA-N 343.431 1.549 10 10 EDCE CSC[C@H]1NC(=O)N([C@@H](C)c2ccc(N3CCOCC3)cc2)C1=O 924533871 NKEBLTKOORBOOQ-SWLSCSKDSA-N 349.456 1.868 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CNCC(F)(F)F)C2)cc1 851640623 ZTHXVPSIVIHNLG-NSHDSACASA-N 331.338 1.542 10 10 EDCE CO[C@@H]1CN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)C[C@H]1O 854846181 IDLSFBYBIPORHN-QZTJIDSGSA-N 328.412 1.855 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CNC3(CCO)CCCC3)nc12 852120252 PBDBZUOFZRHGNJ-UHFFFAOYSA-N 348.403 1.396 10 10 EDCE COc1ccc(N2CCC(NC(=O)c3cn(C)ccc3=O)CC2)cc1 931577857 FFSGXVLYDIHDMD-UHFFFAOYSA-N 341.411 1.793 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)NCc2ccc3cccnc3c2O)C[C@H]1C 868937845 NVVIGIZKSJZITH-CKUKBARFSA-N 344.367 1.523 10 10 EDCE Cc1cc(O)c(CN2CCC(n3cc(C(N)=O)nn3)CC2)c(Cl)c1 862483763 SSNCVNCKZKZUOT-UHFFFAOYSA-N 349.822 1.882 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2cc(C)cc(C)c2O)C1 863341803 VAUVFICHNAWOPO-CQSZACIVSA-N 326.462 1.770 10 10 EDCE CN1CCCc2cc(CN3C(=O)N[C@]4(CCSC4)C3=O)ccc21 761182744 ZSUNWEQFTDTDRA-KRWDZBQOSA-N 331.441 1.997 10 10 EDCE COC(=O)c1c(CN2CC(=O)N(C)[C@H](C)C2)c2cc(F)ccc2n1C 1119512235 OHZZNCDJWFUETD-LLVKDONJSA-N 347.390 1.767 10 10 EDCE CN(C)c1ccc(CN(C)S(=O)(=O)c2cnc3n2CCC3)cc1 772359023 NYWSHXTZQXVEFW-UHFFFAOYSA-N 334.445 1.716 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)C2(N3CCOCC3)CCC2)c1 782739566 QAGKAVCWYDAJTC-ZDUSSCGKSA-N 334.416 1.833 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@]3(OC)CCSC3)C2)cc1 892686082 YHMSJBSZKBXKEN-SUMWQHHRSA-N 336.457 1.912 10 10 EDCE CN1CCN(c2ccc(CNC(=O)[C@]34C[C@@H]3COC4(C)C)cc2)CC1 893608487 VDKQDDMTQDUZGX-UZLBHIALSA-N 343.471 1.870 10 10 EDCE CCNC(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1135775993 VDMOOFQKUQWCDS-UHFFFAOYSA-N 332.364 1.336 10 10 EDCE C[C@H]1CO[C@H](C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 891515525 OBWLLMDQLXJGIV-ABAIWWIYSA-N 340.370 1.843 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)Cn2nccc2C)cc1C 1321662379 HRDGXOFTUCEVIA-CQSZACIVSA-N 330.432 1.803 10 10 EDCE CCn1cc(CN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)cn1 1329360984 NEYLIUDMNXJBNX-UHFFFAOYSA-N 328.372 1.109 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1[C@H]2CCC[C@H]21 1324119337 QXWMWCSURMTTHV-FVQHAEBGSA-N 343.427 1.054 10 10 EDCE C[C@H](O)[C@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CCO1 1326050960 OSFQLUSMUCGTHD-KBXCAEBGSA-N 337.439 1.159 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N1CC[C@@H](N=[N+]=[N-])C1 1902571819 TVMGNYYCVMUNJK-LLVKDONJSA-N 327.385 1.517 10 10 EDCE CN1C[C@H](N(C)c2cc(Br)c(CN)cc2F)CC1=O 2131951737 DSAGIEGMZGBQKQ-SECBINFHSA-N 330.201 1.714 10 10 EDCE COC[C@H](C)N[C@@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1266192053 PUJVYYPGXCKODV-RYUDHWBXSA-N 335.408 1.982 10 10 EDCE O=C(O)C[C@H](NCc1ccc(N2CCOCC2)cc1)C1CCOCC1 1345173387 KFCJBRBCYYPIAK-SFHVURJKSA-N 348.443 1.883 10 10 EDCE COCCn1cc(NC(=O)c2ccc(N=NC(N)=O)cc2)ccc1=O 1292392475 UMIFMESCISIWSI-UHFFFAOYSA-N 343.343 1.909 10 10 EDCE Cc1cc(O)nc(C(C)(C)NC(=O)/C=C/c2ccc(O)c(O)c2)n1 1452712334 NNEXDCNVDRLGIF-FNORWQNLSA-N 329.356 1.967 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)c(Br)c1 2136877656 JBGVXQPVNFMDBS-FZQKWOKYSA-N 330.222 1.824 10 10 EDCE C[C@@H](NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)c1ccccc1O 1471195453 IZBVTFRDBAIFDW-SSDOTTSWSA-N 344.776 1.777 10 10 EDCE CC(C)[C@@H](NS(C)(=O)=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1540518236 GNAWJOXKXIHXIK-OAHLLOKOSA-N 341.477 1.285 10 10 EDCE CCNC(=O)CN[C@H](C)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1717440255 BFKVPMAXMFOJHJ-GHMZBOCLSA-N 348.407 1.082 10 10 EDCE C[C@H](Sc1ccccc1C(=O)NCc1ccc(O)cc1O)C(N)=O 1639444285 FSSOJTMXYDCTGM-JTQLQIEISA-N 346.408 1.994 10 10 EDCE C[C@H](NC(=O)CN1CCOCC1)c1ccc(N2CCOCC2)cc1 1583676879 RYFSXHBZPLHNEK-HNNXBMFYSA-N 333.432 1.033 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@@H](COC)OC 1762871104 OSPCSPGWJJHMTA-AWEZNQCLSA-N 334.420 1.844 10 10 EDCE O=C(NCc1cc(=O)n2ccccc2n1)NCc1c(O)cccc1F 1682392168 IHDYMEKLNIHTJB-UHFFFAOYSA-N 342.330 1.539 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)/C(=C\c2c[nH]c3ccccc23)SC1=S 1858595362 AXXUOPSVBBGMEC-UMQYOCJBSA-N 348.405 1.815 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@H](N)COCc2ccccc2)cc1 1946505409 YNNJKKRADNWIDG-GOSISDBHSA-N 327.428 1.913 10 10 EDCE COc1cccc(CN[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)c1O 2011488218 UNMGNVOWDLDAPR-QWHCGFSZSA-N 338.404 1.471 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H](CN=[N+]=[N-])C1)C(C)(C)O 2014484142 ZAJXFOPLKFQQTA-GHMZBOCLSA-N 341.412 1.809 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@](Oc2ccc(N)cc2)(C(N)=O)C1 2021610649 VCTFPFONUYMQAY-KRWDZBQOSA-N 335.404 1.903 10 10 EDCE C[C@@H]1C[C@H](CO)CN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2156550987 KIBAMGGAOFFHCD-UJVNDKKSSA-N 341.205 1.642 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3[C@@H]4CCO[C@H]4C34CCC4)c2n1 2064302020 FPNAUOZZOOBAPV-ZLKJLUDKSA-N 328.372 1.431 10 10 EDCE CNCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)c(Br)c1 2189067434 NBOOZFCUFFMPPN-JJLQDPRZSA-N 341.249 1.612 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)c(F)c1Br 2182541579 CHBLALBFTSXXEC-WAYYCVMKSA-N 345.212 1.225 10 10 EDCE Cn1c(Br)nnc1CCNC(=O)Cc1ccc(N)cc1 2185198423 SIWZVQLNZYZLAB-UHFFFAOYSA-N 338.209 1.061 10 10 EDCE C[C@H](CO)N1CCN(c2ccc(CN)c(Br)c2)CC1 2113061939 MNOOWPCKKDWDQF-LLVKDONJSA-N 328.254 1.411 10 10 EDCE O=C(O)CN1CC(NCc2cc(Br)cc(F)c2O)C1 2113027965 VJPXAWCRRSKPCX-UHFFFAOYSA-N 333.157 1.152 10 10 EDCE C[C@@H](C(=O)O)N1C(=O)C(=C2C(=O)Nc3ccccc32)SC1=S 2293188538 SQTWVYNREXHISB-LURJTMIESA-N 334.378 1.683 10 10 EDCE CSc1ncc(CNS(=O)(=O)C2CCC(CN)CC2)s1 2284686699 ALCXGLPPZBFUQV-UHFFFAOYSA-N 335.520 1.802 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C1 2300530671 UUOLSHHZCBUVNI-NEPJUHHUSA-N 339.396 1.730 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@@H]3CCC[C@H]3O)CC2)cc1 172578433 RRQUJPNMWFKMBP-IAGOWNOFSA-N 333.432 1.877 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)CNC(=O)c1ccccn1 172403485 LSPVPYMAMVHBOW-UHFFFAOYSA-N 327.384 1.956 10 10 EDCE Cc1cc(C(=O)CN2C[C@H](O)C[C@@H]2CO)c(C)n1-c1cccc(F)c1 184733838 CIHDPQGVNINGBC-IAGOWNOFSA-N 346.402 1.843 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@](C)(O)CCN 1951832808 JEEGMUZFIRVUAW-WMLDXEAASA-N 340.420 1.633 10 10 EDCE CS(=O)(=O)C[C@H](N)c1cc(Br)cc(Cl)c1O 95769613 GMYQMJOXBIKNAU-QMMMGPOBSA-N 328.615 1.853 10 10 EDCE CC(=O)N(C(=S)NCCCN1CCCC1=O)c1ccc(N)cc1 243402378 MNVCSVCDBHJCME-UHFFFAOYSA-N 334.445 1.509 10 10 EDCE CC(=O)N(C(=S)N(C)[C@H]1CCS(=O)(=O)C1)c1ccc(N)cc1 243817169 QTCVHCYGCBAPQA-ZDUSSCGKSA-N 341.458 1.026 10 10 EDCE Cc1ccc(NN/C=C2/C(=O)NC(=S)N(CC(C)C)C2=O)nc1 263885258 WEPDDOGDAZMAOH-XFFZJAGNSA-N 333.417 1.090 10 10 EDCE Cc1ccc(CN2CCNC[C@@H]2CC(N)=O)c(O)c1Br 2381135809 WPIQVFSQSGXHGI-NSHDSACASA-N 342.237 1.112 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1 808543507 WMSPDUFANOOUHM-AWEZNQCLSA-N 333.340 1.346 10 10 EDCE CO[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC[C@H]1C 807098212 UFMNAFTXENIVIL-CXAGYDPISA-N 347.459 1.561 10 10 EDCE CCN(CC)[C@H](C)CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 807097437 MZJQSAYRFJPHKD-OAHLLOKOSA-N 348.491 1.524 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)Cc3ccnn3C)C2)cc1 819587672 GOZBGSTVKZPBHL-AWEZNQCLSA-N 328.416 1.614 10 10 EDCE C[C@H](NC(=O)N1C[C@H]2CC[C@H]1CN2)c1ccc(N2CCOCC2)cc1 817876291 BQIRQEUFHQOZGM-LESCRADOSA-N 344.459 1.730 10 10 EDCE C[C@@H](NC(=O)N1CCN(CCO)C[C@H]1C)c1ccc(N(C)C)cc1 838560045 SYMJUDCQGNXOLD-HUUCEWRRSA-N 334.464 1.522 10 10 EDCE Cc1cc(CC(=O)NC[C@@]2(O)CCOC2)c(C)n1-c1ccccc1 831186246 MBCPWYWIEJAWON-IBGZPJMESA-N 328.412 1.904 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)N(C)CCN=[N+]=[N-])CO1 1895876054 PYOZOXRLDKUELV-MNOVXSKESA-N 327.385 1.780 10 10 EDCE COC[C@H](C)S(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849416670 UXBIRPZDYXHKGR-QWHCGFSZSA-N 328.434 1.228 10 10 EDCE Cn1nnc2c1C[C@@H](NCc1ccc(N3CCC(O)CC3)cc1)CC2 922992566 RJELDAKTTPYMNS-HNNXBMFYSA-N 341.459 1.423 10 10 EDCE O=C(CCN1C(=O)NC2(CCCC2)C1=O)NCc1c(O)cccc1F 928711057 ZMFVHQYHBKFPIN-UHFFFAOYSA-N 349.362 1.402 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CCCN2CCSC[C@@H]12 928088303 GGMYPXTVVGQTSG-BVUKWYMNSA-N 334.441 1.807 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cn(C4CCC4)nn3)CC2)cc1 843517699 QAJYKVBILCEQIX-UHFFFAOYSA-N 341.415 1.974 10 10 EDCE CCN1C[C@H](NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 852369240 TVBORRIOWZVQGA-UONOGXRCSA-N 346.431 1.194 10 10 EDCE CC(=O)C(=O)COC(=O)c1nc(C(C)C)ncc1Br 923958795 NSPMSLVIQKKJDH-UHFFFAOYSA-N 329.150 1.677 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cccnn1 859460444 QIVYMGHBHSNVRL-UHFFFAOYSA-N 326.400 1.615 10 10 EDCE CCn1nc(C)cc1C(=O)NCc1ccc(N2CCOCC2)cc1 751357937 KZPOTGZIOWSLOV-UHFFFAOYSA-N 328.416 1.978 10 10 EDCE CC[C@H](CCO)CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 854300661 XRUIWDKWMVUCSQ-HUUCEWRRSA-N 335.448 1.982 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H](C[C@H]3CCCOC3)C2=O)cc1 863500217 QJAWWBZRCCZWEG-GDBMZVCRSA-N 331.416 1.990 10 10 EDCE C[C@H](NCCOCCCN)c1ccc(N2CCOCC2)c(F)c1 863547163 PSDVHXLKTCWNSU-AWEZNQCLSA-N 325.428 1.678 10 10 EDCE NC(=O)C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCO1 862534775 GQBUYUFPQJZFNL-JTQLQIEISA-N 329.740 1.030 10 10 EDCE COc1ccccc1[C@H](O)CNC(=O)/C=C\c1ccc(O)c(O)c1 779528387 HNROHOHWDYAUHI-DZFYGRHCSA-N 329.352 1.969 10 10 EDCE COC(=O)[C@@H]1[C@@H](CN[C@H]2CCN(c3ccc(OC)cc3)C2)C1(F)F 895229449 VQHKMJIGLLHXEQ-GLQYFDAESA-N 340.370 1.918 10 10 EDCE CCS(=O)(=O)C1CN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 897908696 LMFYNARJISSZIZ-UHFFFAOYSA-N 341.410 1.572 10 10 EDCE CN(c1ccc(CNC2CC2)c(Br)c1)[C@H]1COC[C@H]1O 708112349 FYCNYZBOQYRVGG-LSDHHAIUSA-N 341.249 1.897 10 10 EDCE COc1ccc([C@]2(C(=O)NCc3cc(O)ccc3O)C[C@H](O)C2)cc1 1153886118 WZFZKYFFAGIDPP-RHDGDCLCSA-N 343.379 1.815 10 10 EDCE COc1ccc(-n2nnnc2CN[C@H](C)CNC(=O)CC(C)C)cc1 1317224008 JGLJLYJLGXSICU-CYBMUJFWSA-N 346.435 1.311 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@H]2CCCC(=O)N2)cc1C 1317247646 NGRHTDBCGNAQOQ-UKRRQHHQSA-N 333.432 1.267 10 10 EDCE CC1(CS(C)(=O)=O)CN(c2ccc(CN)c(Br)c2)C1 2116581533 MAOHUJJJPRAXBK-UHFFFAOYSA-N 347.278 1.779 10 10 EDCE CCCNC(=O)[C@H](C)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1346292109 YGMRMKLVLCVWHR-KBPBESRZSA-N 348.447 1.488 10 10 EDCE COC[C@@H](C)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1269544354 CSOHCVTXKROWTE-LLVKDONJSA-N 333.392 1.736 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C[C@H]1F 1346326536 INRSVNWJLCHERM-GHMZBOCLSA-N 345.465 1.948 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC(CO)(CO)C1 1455621623 NMJVCGZJDYZKQR-UHFFFAOYSA-N 342.395 1.333 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@H]2COCCN2CC(F)F)c1 1294937370 ODTBNAAZMQWXMX-GXFFZTMASA-N 344.358 1.544 10 10 EDCE C[C@@H]1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)[C@@H]1CO 227037339 VJKIJAAPSVYMCF-KEMBBXRSSA-N 340.221 1.608 10 10 EDCE COc1cccc(CNC(=O)c2cc(Br)n(C)n2)c1O 1545683802 ACSRPMVWWVNDEA-UHFFFAOYSA-N 340.177 1.827 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)Cn2c(O)nnc2O)cc1 1623451596 JQJCDRIMMOADCA-UHFFFAOYSA-N 333.392 1.194 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCc1cccc2c1OCCO2 1558508707 VRODMHJFSDYKGQ-UHFFFAOYSA-N 329.352 1.770 10 10 EDCE CCOCC(=O)N(C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1718523732 XFNAJLUACNSERX-NSHDSACASA-N 349.391 1.462 10 10 EDCE CC(=O)N/C(=C/C1=S=CC=C1)C(=O)Nc1cccc2nsnc12 1557732699 UFCNOBWJOTUBSG-MDWZMJQESA-N 344.421 1.927 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2c[nH]c(=O)cn2)cc1C 1568671040 JWKROZHPFPZXIP-CYBMUJFWSA-N 344.415 1.385 10 10 EDCE CCOC(OCC)[C@H](C)NC(=O)NCc1cccc(OC)c1O 1565495330 HSTQQTIYHVGWLY-NSHDSACASA-N 326.393 1.988 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)c2ccco2)cc(OC)n1 1572233385 PPNUVPLSMIQBIU-LLVKDONJSA-N 347.371 1.582 10 10 EDCE CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)NCc2c(O)cccc2O)C1 1597573869 IKYCSPAIYICILG-CHWSQXEVSA-N 334.416 1.999 10 10 EDCE CCN(Cc1c(Br)ccc(OC)c1O)[C@H]1CCNC1=O 1964597319 DUXSXEDHEYADPX-NSHDSACASA-N 343.221 1.874 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@]2(C(=O)C(=O)C[C@H]3C[C@H](N)C3)C[C@H]2C1 2003171706 ZZPOLBNJNYPWIV-PAKFGRKTSA-N 336.432 1.899 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@]1(O)CCN(C(=O)OC(C)(C)C)C1 1985099970 UCTFNSSJYTWESV-CQSZACIVSA-N 327.385 1.517 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)N(C)CCCN=[N+]=[N-] 1985103227 RXPTUIIBHCILKW-UHFFFAOYSA-N 328.417 1.602 10 10 EDCE CN(C)c1ccc([C@H](O)[C@@H](N)c2c(Br)nnn2C)cc1 2148220271 QGOLXDYXXRUNRF-JQWIXIFHSA-N 340.225 1.377 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2010394303 BLFWICGNYLPVSO-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)NC/C=C/CNC(=O)c1cc(O)c(O)c(O)c1 2015120476 SUFXALPYBXMPFI-SNAWJCMRSA-N 338.360 1.614 10 10 EDCE COC(=O)Cc1cc(O)n2nc(C3CCCC3)c(C(=O)OC)c2n1 2080934265 ICURUIPYZNCRMK-UHFFFAOYSA-N 333.344 1.595 10 10 EDCE CNCc1ccc(N2CCN3CCOC[C@@H]3C2)c(Br)c1 2185877706 WDBVNDKLOIFTPT-ZDUSSCGKSA-N 340.265 1.689 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1CO[C@@H]2COC[C@@H]21 2101857761 YTPYDBUCNSFQLA-MPKXVKKWSA-N 328.206 1.906 10 10 EDCE COc1ccc(Br)c(CN2CC[C@H](N)[C@@H](CO)C2)c1O 2236039789 DIPSCPJQUGOKON-SKDRFNHKSA-N 345.237 1.305 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)[C@H](O)CC2)c(Br)c1 2269120357 CNERMTRAVIINOH-CUOATXAZSA-N 329.238 1.791 10 10 EDCE C[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(O)c(O)c2)SC1=S 2293031150 UBUWBGLWQWRFHG-ZCFIWIBFSA-N 325.367 1.772 10 10 EDCE Cc1cccc(N2C(=O)C(=CNN3CCCCC3)C(=O)NC2=S)c1 2296256044 UOIQSYAWOPRFAA-UHFFFAOYSA-N 344.440 1.617 10 10 EDCE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=CNc1cccc(O)c1 2297620296 YHRSZFVCFQHIPM-UHFFFAOYSA-N 327.296 1.560 10 10 EDCE CNC(=O)c1ccc(C=CC(=O)NCc2ccc(O)c(O)c2)cc1 2301402063 FMMXGXQYIWCESK-UHFFFAOYSA-N 326.352 1.787 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCc2cc(O)c(O)cc2C1 2318659630 GJMIJFNUIVDCNJ-QWHCGFSZSA-N 348.399 1.896 10 10 EDCE Cn1cnc(Br)c1CNCCc1ccc(O)c(O)c1 2337349731 VDQQFQPKGOMXMO-UHFFFAOYSA-N 326.194 1.926 10 10 EDCE Cc1noc(CCNC(=O)NCc2ccc(N3CCOCC3)cc2)n1 101608595 CUKGCRSLQCGIBO-UHFFFAOYSA-N 345.403 1.257 10 10 EDCE Nc1ccc(OCCNS(=O)(=O)CCCC(F)(F)F)cc1 211956227 BGHVEGXJCFCJTL-UHFFFAOYSA-N 326.340 1.910 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CCCN(c3cnn(C)c3)C2)c(O)c1O 182504812 RLWRHNAWWRBMKT-GFCCVEGCSA-N 330.388 1.539 10 10 EDCE NC(=O)[C@H]1CCN(c2ccc(/C=C/C(=O)O)c(Br)c2)C1 236283983 XTXPMHXJVZSEJV-YWNRKNDBSA-N 339.189 1.859 10 10 EDCE CN(Cc1cc(Br)ccc1O)[C@]1(C(=O)O)CCOC1 382460460 XRWQXOMJHABTQX-CYBMUJFWSA-N 330.178 1.830 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCCN(C(N)=O)CC2)c([N+](=O)[O-])c1 263640789 BAEVGWNJJHVMLB-GQCTYLIASA-N 348.359 1.372 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1c1ncccn1 808537323 XECYOCHKDQMWOF-MCIONIFRSA-N 331.372 1.315 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1c1ncccn1 808537325 XECYOCHKDQMWOF-RDBSUJKOSA-N 331.372 1.315 10 10 EDCE COC1(C(=O)NCc2cc(Br)ccc2O)CCOCC1 804737807 YHZUGNHKVPWBPB-UHFFFAOYSA-N 344.205 1.967 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)Nn3c(O)nnc3O)ccc21 816731703 BHXQRWQSNVNFFP-UHFFFAOYSA-N 345.359 1.291 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@@H](NC(C)=O)C2)c([N+](=O)[O-])c1 817126443 UYZMHSBKIJFIRW-DIECRNLCSA-N 333.344 1.496 10 10 EDCE COc1cc(Cl)cc(CNC[C@]2(OCCO)CCOC2)c1O 826943700 YNUPDSSJBZMGRX-OAHLLOKOSA-N 331.796 1.312 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 830703053 LXWPUEVQTVJVHP-LBPRGKRZSA-N 327.377 1.725 10 10 EDCE COC[C@](C)(O)CCNC(=O)NCCCSc1nccs1 838514138 OTBGZCMZYGVWPN-CYBMUJFWSA-N 333.479 1.712 10 10 EDCE CCO[C@H](C(=O)N(CC(=O)O)Cc1ccccc1O)[C@@H]1CCOC1 911492588 IGCKHNJULICKIE-CJNGLKHVSA-N 337.372 1.247 10 10 EDCE CCNC(=O)C[C@@H]1CCCCN1C(=O)NCCc1ccc(N)cc1 841957508 CICUTROFBYUVEE-INIZCTEOSA-N 332.448 1.902 10 10 EDCE C[C@@H](NCC[C@@]1(O)CCOC1)c1ccc(N2CCOCC2)c(F)c1 846194169 LVOULKPCIBMESV-RDTXWAMCSA-N 338.423 1.854 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)[C@@H]4CSCCN4C3=O)C2)cc1 849356644 GGHLGSXCEYITRP-HIFRSBDPSA-N 347.440 1.654 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cccc(C(N)=O)n3)C2)cc1 855223590 AXDCPUNZBLQWFU-LBPRGKRZSA-N 340.383 1.198 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCN(C4CC4)C3)C2)cc1 852186401 FFGAITZGGXQUHL-HUUCEWRRSA-N 344.459 1.810 10 10 EDCE O=C1O[C@H]2CNC[C@H]2N1C1CCN(Cc2cccc(F)c2O)CC1 863642816 YGGCJHNIOIYDSN-CABCVRRESA-N 335.379 1.288 10 10 EDCE COC[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C(C)C 1119756379 KARVGPMJSZWRNJ-GOEBONIOSA-N 349.475 1.965 10 10 EDCE COC(=O)C(C)(C)N1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779170088 YVUQLVFXWUPBTH-ALCCZGGFSA-N 348.399 1.207 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](C)[C@@H](F)C3)nc12 778237453 PRRDZEDMPBIBLC-GWCFXTLKSA-N 336.367 1.792 10 10 EDCE Cc1ccc(C(=O)NCCC2CCS(=O)(=O)CC2)c(O)c1O 781007974 MBRRQYCHSVQUFI-UHFFFAOYSA-N 327.402 1.351 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCS(=O)(=O)CCO1 1305773435 YJUQJCLTOLNAKW-UHFFFAOYSA-N 343.382 1.115 10 10 EDCE CCn1cc(Br)c(=NC(=O)c2ccc(O)c(O)c2)[nH]1 2124747652 MJWNATCYEQMUCP-UHFFFAOYSA-N 326.150 1.751 10 10 EDCE COC(=O)[C@H](CF)NCc1ccc(N2CCN(C)CC2)c(F)c1 1323768642 UXHSXYRQLIHFHG-AWEZNQCLSA-N 327.375 1.178 10 10 EDCE CO[C@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1332667992 DCYPLJNVKWVQTR-SJORKVTESA-N 345.443 1.321 10 10 EDCE C[C@H](C(=O)N(C)Cc1ccc(N2CCCC2)cc1)N1C(=O)CCC1=O 1264286946 DQHROXDISQIFFL-CQSZACIVSA-N 343.427 1.783 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H]2CN(C)CCO2)cc1C 1268057236 LQKBVSVCNTXAAA-QAPCUYQASA-N 349.475 1.271 10 10 EDCE CNC(=O)[C@H]1CN(C(=O)/C=C(\C)c2cnccn2)c2ccccc2O1 1350994207 BJMQIFJMCXDAIS-ONOODXEBSA-N 338.367 1.420 10 10 EDCE COC(=O)NCC(=O)N[C@H](C)[C@@H](C)NCc1ccc(OC)c(C)c1 1717401203 OQRBBSYESSSUJE-CHWSQXEVSA-N 337.420 1.342 10 10 EDCE CCC(=O)N[C@@H](CCSC)C(=O)NCc1c(O)cccc1O 1558533347 CZOXRWKPOJFZAE-NSHDSACASA-N 326.418 1.362 10 10 EDCE CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)O1 1637490014 DDALGSLNXLWIHR-CHWSQXEVSA-N 347.375 1.215 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)Cc2nonc2C)cc1C 1498151464 MAQZZORPZSMJTH-LBPRGKRZSA-N 332.404 1.532 10 10 EDCE NC(=O)N[C@@H](CC(=O)NCc1cccc(O)c1O)c1cccs1 1643809464 OKEPYRFORCPTOC-JTQLQIEISA-N 335.385 1.575 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2cnn[nH]2)C2CC2)cc1C 1661143510 XDPQOGSKNFKFGJ-CQSZACIVSA-N 329.404 1.420 10 10 EDCE COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1597633842 BTFVHHDFVLNWGN-QWHCGFSZSA-N 348.359 1.642 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@H](NC(C)=O)C(C)(C)C)cc1 1677223555 POWRJSJZPMVNPZ-HNNXBMFYSA-N 346.435 1.311 10 10 EDCE COC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)c1cc(O)c(O)c(O)c1 1865876038 OCIKZQNOKCPEMB-GFCCVEGCSA-N 347.323 1.023 10 10 EDCE NC(=O)N1C[C@H]2C[C@H]1CN2Cc1ccc(Br)cc1O 1877019564 UYXZKPWCQYRHNG-MNOVXSKESA-N 326.194 1.492 10 10 EDCE COc1ccc(Br)c(CNCc2ncn(C)n2)c1O 1964047031 ABEWQKGWAMHYNE-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE [N-]=[N+]=N[C@H]1CCN(S(=O)(=O)N2CC(OCc3ccccc3)C2)C1 1977425090 IWPUBNUDEKOGGW-ZDUSSCGKSA-N 337.405 1.517 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](CO)C[C@@H]2CO)cc1Br 2146084076 XHNZZRAIQUBXSX-NTZNESFSSA-N 343.265 1.909 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N1CCC(N=[N+]=[N-])CC1 1985102624 JTMPQCWQBQTIPW-GXSJLCMTSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)NCc1ccccc1O 2010322299 KDVLTNNPTULNKK-CYBMUJFWSA-N 338.404 1.673 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NCCCN=[N+]=[N-] 2010389028 KKEPEBGZRBOGKJ-NSHDSACASA-N 337.384 1.662 10 10 EDCE NCc1ccc(N2CC[C@H]3C(=O)NC(=O)[C@@H]3C2)c(Br)c1 2158786471 WJYWOSQEAKLWNP-NXEZZACHSA-N 338.205 1.007 10 10 EDCE CCn1nnc(Br)c1CNC(=O)Cc1ccc(N)cc1 2156473824 INDOEWQBZBKCIL-UHFFFAOYSA-N 338.209 1.502 10 10 EDCE CC(C)NCc1ccc(N2CC[C@@](O)(CO)C2)cc1Br 313908215 SUTWUUYACPDMQA-HNNXBMFYSA-N 343.265 1.881 10 10 EDCE O=C(Nc1ccc(O)c(O)c1)[C@@H]1CCCN(CC(F)(F)F)C1=O 2063954254 XCTKAFFDYVNUHF-VIFPVBQESA-N 332.278 1.837 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)CO1 1908253707 YYFDKPHZVYZZTD-WOPDTQHZSA-N 339.396 1.922 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2104414312 JJRCKHCJHBKQSZ-HYNSBDGHSA-N 327.222 1.099 10 10 EDCE C[C@@H]1CN(Cc2cc(Br)ccc2O)[C@@H](C(=O)O)CO1 2109518398 MHKDBRGHSAHJKB-LDYMZIIASA-N 330.178 1.829 10 10 EDCE NCc1ccc(N2CC[C@@H]3OCCO[C@H]3C2)c(Br)c1 2095386729 UMESQRBZEGYAPT-KBPBESRZSA-N 327.222 1.902 10 10 EDCE NCc1ccc(N2CCn3ncnc3C2)c(F)c1Br 2114038476 NHHMOYMBIIRHNW-UHFFFAOYSA-N 326.173 1.659 10 10 EDCE COc1ccc(N2[C@H](C(=O)O)CC[C@H]2C(=O)O)c(Br)c1 2237309420 AAXLRIGNZVGMPG-QWRGUYRKSA-N 344.161 1.964 10 10 EDCE CCN(CCN=[N+]=[N-])S(=O)(=O)c1c(Br)cnn1C 2315992968 UVRWYBVDEMSMDL-UHFFFAOYSA-N 337.203 1.504 10 10 EDCE Cc1ccc(CN2CC3(CCC(=O)N3)C2)c(O)c1Br 2352940729 HOHZVISCHKFEAH-UHFFFAOYSA-N 325.206 1.928 10 10 EDCE Cc1nn(C)cc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 179147116 NDQYOMJWGNWMOI-UHFFFAOYSA-N 342.399 1.568 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2357592854 OMMZMMCTXLEQQK-CDAHBRHOSA-N 341.249 1.789 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cncnc3N)CC2)cc1F 192363959 MGZVOOIYJPJHSI-UHFFFAOYSA-N 331.351 1.169 10 10 EDCE CS(=O)(=O)[C@H]1CSCCN1c1ccc(/C=C/C(=O)O)cc1 90923224 GNMKLGHONFCHHP-LVDDQXARSA-N 327.427 1.708 10 10 EDCE Cc1ccc(CNC[C@@H]2CN(C)CCN2C)c(O)c1Br 2381137938 LBXCFMJALHQXAX-CYBMUJFWSA-N 342.281 1.799 10 10 EDCE COC(=O)[C@H]1COCCN1Cc1ccc(C)c(Br)c1O 2380672486 NCTNOQSRPOVDDY-LLVKDONJSA-N 344.205 1.837 10 10 EDCE CC(=O)C(=O)COC(=O)c1cnc2ncc(Br)cc2c1 808539017 ODDPDEYJJUKWRZ-UHFFFAOYSA-N 337.129 1.707 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C2CCC1(CO)CC2 1351286421 DLYUMMRNYNNHTG-UHFFFAOYSA-N 345.443 1.193 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H]2COC[C@@H]2C1 828436683 DAGXKKSTWUZZBW-CVEARBPZSA-N 345.443 1.172 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@H]3COC[C@@H]3C2)cc1F 827575715 TTWHSOZECDGZDS-KGLIPLIRSA-N 349.406 1.003 10 10 EDCE CN(C)c1ccc(/C=C\CNCC[C@@H]2CNCCS2(=O)=O)cc1 903969666 IREBBUYNBQVWKE-CWIOURORSA-N 337.489 1.132 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(C4CC4)c3N)C2)cc1 912292060 ICRYCRZTVMESFL-GFCCVEGCSA-N 341.415 1.818 10 10 EDCE Cc1cc(O)c(CN2CCCN(S(C)(=O)=O)CC2)c(Cl)c1 840910988 ZNHZTZGFALVKTK-UHFFFAOYSA-N 332.853 1.821 10 10 EDCE O=C(O)/C=C\c1ccc(N2CCO[C@H](C(=O)C3CC3)C2)c([N+](=O)[O-])c1 844212795 BEADYTSNLUIJGC-ZBBQIYFKSA-N 346.339 1.877 10 10 EDCE COC(=O)CC1(NCC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 844388313 XXGUDORPEUDEBT-UHFFFAOYSA-N 333.432 1.396 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CC[C@H](C2CC2)N1 846673779 WUUINZVWAHMTCT-MSOLQXFVSA-N 329.444 1.670 10 10 EDCE C[C@H](NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1[C@H]2CN[C@H]1C2 925504540 PUINMSQUFPJGEU-XBLMQXIHSA-N 333.451 1.873 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](O)c3cccnc3)C2)cc1 855223439 AAOPBSSGYYDBLK-YOEHRIQHSA-N 327.384 1.519 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)c3nc[nH]n3)C2)cc1 854299842 SFMICEFTNXLCLC-NWDGAFQWSA-N 330.392 1.452 10 10 EDCE Cc1nn(C)c(C)c1S(=O)(=O)NNc1nc2cccnc2s1 857224632 VKBNPKZLZURLIV-UHFFFAOYSA-N 338.418 1.347 10 10 EDCE CCn1ccc(CNC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)n1 852380353 BSUFNAKJGFVKED-HNNXBMFYSA-N 343.431 1.990 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC(O)(CO)C1 861849729 UNTVDCFSJNVBIR-UHFFFAOYSA-N 328.368 1.086 10 10 EDCE COC(=O)[C@]1(OC)CCN(Cc2ccc(Br)cc2O)C1 862475704 UQOWFSOXWRHYQU-AWEZNQCLSA-N 344.205 1.919 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H]3CC(C)=NO3)C2)cc1 875954363 HHQAGZDZHUSCAG-CJNGLKHVSA-N 332.404 1.738 10 10 EDCE Cc1cc(N(C)C)ccc1CN1CC[C@@H](N2C(=O)O[C@H]3CNC[C@H]32)C1 872256974 GUMSRFKFWSWCLJ-KURKYZTESA-N 344.459 1.428 10 10 EDCE O=C(COC(=O)[C@H]1CCCN1c1nccs1)c1ccc(O)c(O)c1 784782527 KFEPKSXYWNOUKC-LLVKDONJSA-N 348.380 1.949 10 10 EDCE O=S1(=O)CC(C2CN(Cc3c(O)cccc3Br)C2)C1 895424461 YMKKVCLTXYSSHH-UHFFFAOYSA-N 346.246 1.631 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCO[C@@H]3COCC[C@@H]32)c([N+](=O)[O-])c1 897053561 CFHWYRQTHXSHAI-FMXQPZMBSA-N 348.355 1.775 10 10 EDCE NS(=O)(=O)C[C@H]1CCCN(Cc2c(O)ccc(Cl)c2F)C1 792167145 BFFMHVPLCRCPHY-VIFPVBQESA-N 336.816 1.685 10 10 EDCE CN1C(=O)c2ccc(C(=O)NCc3ccc(O)cc3O)cc2C1=O 1142530255 NLTUYVHFYYHHEW-UHFFFAOYSA-N 326.308 1.254 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(Br)c1 2126161991 OOXGCAWVGHJIEV-DHPDLVEQSA-N 327.222 1.086 10 10 EDCE O=C(N1CCOCC1)N1CCN(Cc2cc3c(cc2O)CCC3)CC1 1317747754 JGOUKZKIJILWRK-UHFFFAOYSA-N 345.443 1.451 10 10 EDCE CN1CCN(c2ccc(CN3CCN4CCOC[C@H]4C3)cc2F)CC1 1320430840 YTUKRMQNFDACPF-QGZVFWFLSA-N 348.466 1.094 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)NC[C@@H]2C[C@H]2c2ccccc2)cc1 1332391095 MDAWRMJEIAPKOL-WMZOPIPTSA-N 337.423 1.847 10 10 EDCE CO[C@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1333344289 YRPZUSRZNRMCIU-SJORKVTESA-N 343.427 1.315 10 10 EDCE CN(C)C(=O)c1cc(=NC(=O)c2ccc(N=NC(N)=O)cc2)cc[nH]1 1182798138 GCRLCYUTVMBKEQ-UHFFFAOYSA-N 340.343 1.620 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@H]2CCN(C)C2)cc1C 1265850315 CRYFHBBUIAJJOX-DOTOQJQBSA-N 333.476 1.940 10 10 EDCE CCCNCc1ccc(N2CC(CO)(CO)C2)cc1Br 1914989547 BZVRHPBQMGKKDL-UHFFFAOYSA-N 343.265 1.740 10 10 EDCE Cc1cc(C(=O)N2CC[C@@H](O)[C@@H](CO)C2)c(C)n1-c1ccccn1 1299450495 MLNSXAACESLXIL-GDBMZVCRSA-N 329.400 1.304 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)CCC2(C)CC2)cc(OC)n1 1295631692 DBMKURNRGYFXMW-GFCCVEGCSA-N 349.431 1.914 10 10 EDCE CC(C)[C@H](NC(N)=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1295405037 DOUJHCHECZIYMJ-ZBFHGGJFSA-N 349.431 1.593 10 10 EDCE O=C(NCCCSc1nccs1)c1cccnc1OCCO 1464903399 VNLICPWJENWHHA-UHFFFAOYSA-N 339.442 1.821 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)[C@@H](C)NC(C)=O)C2)cc1C 1707055202 CMYZLAILFCFHNK-XYPHTWIQSA-N 347.459 1.513 10 10 EDCE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1(O)COC1 1629055950 WLJUVIFBQGSDQY-NSHDSACASA-N 342.342 1.134 10 10 EDCE O=C(Nc1ccc(-c2nnco2)cc1)C1=S=c2c(cc[nH]c2=O)=C1 1629961462 ZWLAPKFSIAPCGB-UHFFFAOYSA-N 338.348 1.014 10 10 EDCE CN(C)[C@@H]1COC[C@@H]1CNCc1cccc(Br)c1O 1924701050 AYAJSBKJYCQMIQ-WCQYABFASA-N 329.238 1.821 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CN2CC[C@@H](C)C2)cc1C 1567560930 UXWLAJLGQPVBSG-OAHLLOKOSA-N 333.476 1.893 10 10 EDCE Cn1nccc1[C@@H]1c2[nH]cnc2CCN1C(=O)c1cccc(O)c1O 1639074391 ZHQMMHIIPWFDRP-OAHLLOKOSA-N 339.355 1.342 10 10 EDCE COc1ccc(CNCCCn2ccnc2)cc1CN1CCOCC1 13736160 MIHMGBLQZVPVMT-UHFFFAOYSA-N 344.459 1.904 10 10 EDCE C[C@@H](O)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1858592525 RIFIHEFTUCZHRO-QEXLZLQKSA-N 341.385 1.861 10 10 EDCE CC(C)(C)OC(=O)NOCCCNCc1ccc(O)c(O)c1O 1936936092 GRBCKCLUHDFXNU-UHFFFAOYSA-N 328.365 1.739 10 10 EDCE CCOC(=O)C1CCN(C(=O)CNCc2cc(C)ccc2O)CC1 1857867836 DXUPEKDQLKNONJ-UHFFFAOYSA-N 334.416 1.592 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(F)ccc2O)[C@@H](O)C1 1966004419 TYNDOWSCRZCXBG-ZFWWWQNUSA-N 340.395 1.991 10 10 EDCE COc1ccc(Br)c(CN(C)[C@H]2CCC(=O)NC2)c1O 1970965181 CGOGFTVPDIJQNH-VIFPVBQESA-N 343.221 1.874 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)C(=O)NCC1(CN=[N+]=[N-])CC1 1987702875 XSQZCZYXXSJUGH-JTQLQIEISA-N 327.385 1.326 10 10 EDCE 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Cc1cc(O)c(CN2CCN(CC[S@@](C)=O)CC2)c(Cl)c1 840917512 RIBSUWMQPQNKES-OAQYLSRUSA-N 330.881 1.850 10 10 EDCE Cc1ccc(O)c(CNC(=O)NC[C@H]2CCN2C2CCOCC2)c1 927631734 WIGJGPGGERWDIU-MRXNPFEDSA-N 333.432 1.753 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCc4nncn4C3)C2)cc1 855226144 NOAPTCFLEQISRS-ZIAGYGMSSA-N 341.415 1.244 10 10 EDCE Cc1cc(Br)c(O)c(CNCc2cc(C(N)=O)no2)c1 757905054 FBKPQMPQEIMRSJ-UHFFFAOYSA-N 340.177 1.840 10 10 EDCE Cc1cc(CC(=O)N2CC[C@@H](O)[C@H](CO)C2)c(C)n1-c1ccccc1 854946309 KEAJNWHEASVOEW-PKOBYXMFSA-N 342.439 1.838 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cn1cncc1C 862040004 WWIBMRMIWXLLNE-UHFFFAOYSA-N 331.372 1.489 10 10 EDCE CCN1CCN(CC(=O)NCc2ccc3cccnc3c2O)CC1 862027775 FHHFAVOYPINFFE-UHFFFAOYSA-N 328.416 1.194 10 10 EDCE COC1CCC(N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1119006343 ZHHVNGGQYMTIQT-UHFFFAOYSA-N 332.400 1.650 10 10 EDCE Cn1cc(C[C@@H](O)C(=O)NCCCSc2nccs2)cn1 786974936 MNYKXPHJMMDHKY-LLVKDONJSA-N 326.447 1.079 10 10 EDCE CCC(=O)N1CSC[C@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 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HHLJMNJATVTZHB-GWCFXTLKSA-N 333.201 1.369 10 10 EDCE CCOCCOCC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 124882304 SVSYMRVJAJZPAD-OAHLLOKOSA-N 336.432 1.754 10 10 EDCE N[C@@H]1CCCC[C@@H]1N/C=C1\C(=O)N(Cc2ccco2)C(=O)N=C1O 229121198 NQMLYQHGLIYKKQ-ASDJVNKTSA-N 332.360 1.442 10 10 EDCE COc1ccc(Br)c(CN(C)[C@H]2CCNC2=O)c1O 1964604509 BORCOPZKLGRUQU-JTQLQIEISA-N 329.194 1.484 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CC(=O)N1C 282610652 RAUUQMFGRHPKOD-AWEZNQCLSA-N 330.432 1.659 10 10 EDCE Cc1ccc(CN(C)Cc2noc(CN)n2)c(O)c1Br 2381143246 PUJALXOQLFLTHV-UHFFFAOYSA-N 341.209 1.937 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)c1ccnc(S(C)(=O)=O)n1 816914610 XSCFIEIJYFXGEO-UHFFFAOYSA-N 349.412 1.638 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H](O)C3CCC3)CC2)cc1 825472536 QBLQMLSJRRTXQJ-SFHVURJKSA-N 347.459 1.094 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN(CCO)C[C@@H]2C)c([N+](=O)[O-])c1 829577017 IFIQDLJUPREYBQ-BPJJOFIESA-N 349.387 1.284 10 10 EDCE COc1ccc(N2CC[C@H](NC[C@H]3CCCN(C(=O)CN)C3)C2)cc1 849350825 XPYYKQRBXJBTNN-CVEARBPZSA-N 346.475 1.061 10 10 EDCE COc1cc(Br)cc(CN2CN(C)C(=O)[C@H]2C)c1O 843435470 OKLJDVFKBKKVJU-MRVPVSSYSA-N 329.194 1.783 10 10 EDCE COCCCCS(=O)(=O)NC[C@H](N)c1ccc(N(C)C)cc1 842784258 DPBHLKDDDWMEIP-HNNXBMFYSA-N 329.466 1.098 10 10 EDCE CON1CC[C@H](OC(=O)c2cc(C)n(-c3ccccn3)c2C)C1=O 922324046 XCKCPEAPISKANW-AWEZNQCLSA-N 329.356 1.808 10 10 EDCE CO[C@H](C(=O)OCC(=O)C(C)=O)c1ccccc1Br 848804061 HOQKSSGGPXDGBQ-LBPRGKRZSA-N 329.146 1.838 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NCC[C@@H]2CC(=O)N(C)C2)c1 924737533 QHUPRANDMDEOMQ-VXGBXAGGSA-N 335.404 1.629 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3CCC4(COC4)O3)CC2)c(OC)c1 931531109 XFCBJJJSBQOLHO-INIZCTEOSA-N 348.443 1.774 10 10 EDCE CC1CCN(C(=O)C(=O)NCc2ccc3cccnc3c2O)CC1 862027381 QAPGHJSHVVOFIJ-UHFFFAOYSA-N 327.384 1.815 10 10 EDCE CC(C)C[C@@]1(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)CCNC1=O 867302497 PWFQPOQTIURZAH-XIKOKIGWSA-N 334.416 1.697 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ncccc3N)CC2)cc1F 866458795 AUSMMACBAHPEBS-UHFFFAOYSA-N 330.363 1.774 10 10 EDCE CCOc1ccc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)c(O)c1 768235239 YQQLCLYFACEIJI-MRXNPFEDSA-N 348.443 1.862 10 10 EDCE CN1CCCC[C@H](N(C)CC(=O)NCc2ccc(N(C)C)cc2)C1=O 872263328 BQOYWXKAIFVMIK-KRWDZBQOSA-N 346.475 1.312 10 10 EDCE O[C@@H](CNCc1ccc(N2CCOCC2)c(F)c1)c1cccnc1 771978172 JTGBBBGWWJDNRX-SFHVURJKSA-N 331.391 1.881 10 10 EDCE CCN1C[C@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)CC1=O 898277837 VNRCVEYCMRFMFV-VIFPVBQESA-N 334.397 1.911 10 10 EDCE C[C@@H](O)c1ccc(N(C)CCN(C)CCO)c(Br)c1 691271963 MXMAEMXLVOWDDB-LLVKDONJSA-N 331.254 1.863 10 10 EDCE Cn1cc(-c2nsc(NC(=O)Cc3ccc(O)c(O)c3)n2)cn1 1304498857 RXYGRUOTPXOZBG-UHFFFAOYSA-N 331.357 1.531 10 10 EDCE COc1nscc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1303231118 CFRLEEOKFOBCMQ-UHFFFAOYSA-N 343.386 1.481 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCCS(=O)(=O)C(F)(F)F 1166281884 PFBFCEWVMCACHZ-DUXPYHPUSA-N 339.291 1.162 10 10 EDCE Cc1cc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)n[nH]1 1178038393 AKDFONMDXIFMEI-UHFFFAOYSA-N 341.415 1.350 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)c(Br)c1 2126161994 OOXGCAWVGHJIEV-RDBQEKCUSA-N 327.222 1.086 10 10 EDCE CN(C)c1ccc(CN(C(=O)C2=C3CCCN=C3NN2)C2CC2)cc1 1290739253 CJKKOCLJYUVLDC-UHFFFAOYSA-N 339.443 1.798 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)NCCCCS(N)(=O)=O 1470329587 WTDFVSPQFWDLAU-UHFFFAOYSA-N 343.449 1.383 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CCCN3C)CC2)cc1C 1483721740 HOICSCHRARPPTL-MRXNPFEDSA-N 331.460 1.836 10 10 EDCE NCc1ccc(N2CCN3C(=O)NC[C@@H]3C2)cc1Br 228153979 GJYATZLLCJUPPO-LLVKDONJSA-N 325.210 1.122 10 10 EDCE Cc1ccc(O)c(CNC(=O)CNC(=O)Cc2cccc(F)c2)c1 1633282358 HXDFUDIZRGACRL-UHFFFAOYSA-N 330.359 1.815 10 10 EDCE C[C@@H]1CCN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C[C@H]1O 1638917652 JKEBJJNHSVGCDJ-ZTFGCOKTSA-N 348.491 1.768 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C2(F)CCCC2)cc1C 1725536662 KFWRQWMBXRTJBC-HNNXBMFYSA-N 338.423 1.853 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2cn(C)cn2)cc1C 1495642407 HREQGROZAFYDJZ-CYBMUJFWSA-N 330.432 1.893 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)NCc2ccc(O)cc2O)c1 1639444369 JDFIESCPLFGQFZ-GORDUTHDSA-N 327.340 1.182 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)C(=O)NCC3CC3)C2)cc1C 1490942463 ZYXJQNPYNBWHNI-WKILWMFISA-N 345.443 1.267 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1C[C@@H](O)[C@H](Cc2ccccc2)C1 1640421045 RALOALPIBATBJT-CRAIPNDOSA-N 327.380 1.702 10 10 EDCE COc1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2)n1 1583334786 PTCVSALRVJWUAQ-UHFFFAOYSA-N 341.411 1.786 10 10 EDCE C[S@](=O)C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccccc1 1586034769 HQBQIDPDFSFSEL-FATZIPQQSA-N 333.409 1.876 10 10 EDCE [N-]=[N+]=N[C@H]1CCCN(C[C@@H](O)CN2C(=O)c3ccccc3C2=O)CC1 1934380326 DYRHRXJMUUOLEE-QWHCGFSZSA-N 343.387 1.808 10 10 EDCE Cn1ccc(/C=C2/SC(=S)N(CCN3CCOCC3)C2=O)c1 160307857 RIIVNEGOTXPREW-JLHYYAGUSA-N 337.470 1.559 10 10 EDCE C[C@H](O)[C@H](C(=O)O)N1C(=O)/C(=C\c2ccsc2)SC1=S 1858595982 KZNJOTIHVBKYSP-WMYHQBSZSA-N 329.424 1.783 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@H](O)[C@H](O)C2)c(Br)c1 233640526 PDEPYYSVCPJBBV-FZQKWOKYSA-N 329.238 1.661 10 10 EDCE OCCCO[C@@H]1CCN(c2ccc(CO)c(Br)c2)C1 2142046087 HHJWQFBTRRYRPP-CYBMUJFWSA-N 330.222 1.919 10 10 EDCE CNCc1ccc(N2CCO[C@@H]3COC[C@H]32)c(Br)c1 1877661011 XNEKUFJEWVQBKP-ZIAGYGMSSA-N 327.222 1.773 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985095059 YGBYZFDUQHUHBX-JTQLQIEISA-N 327.385 1.733 10 10 EDCE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)CCN=[N+]=[N-] 1985103044 PMYQEDATGLUNRL-SECBINFHSA-N 329.357 1.212 10 10 EDCE CC(C)(C)OC(=O)NCC1(NCc2ccc(F)cc2O)COC1 1994523686 BBWRJKMQWNQCIB-UHFFFAOYSA-N 326.368 1.915 10 10 EDCE CC(C)(C)OC(=O)N1CCN(NC(=O)Nc2ccc(N)cc2)CC1 1999156784 DAZIPVWWXZQCEX-UHFFFAOYSA-N 335.408 1.858 10 10 EDCE COc1ccc([C@H](C)NC[C@H](O)CNC(=O)OC(C)(C)C)c(O)c1 2011423664 VYXCHWUUBQDBKE-RYUDHWBXSA-N 340.420 1.937 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3C[C@@H](O)C[C@H]3C2)cc1Br 405475110 LRBICTBYEKCTLZ-WXHSDQCUSA-N 340.265 1.724 10 10 EDCE CN[C@@H](C)c1ccc(N2CC[C@](O)(CO)C2)cc1Br 313753624 RFUCJYAZSVAVBP-IINYFYTJSA-N 329.238 1.663 10 10 EDCE NC(=O)c1coc(CNCc2cc(Br)cc(F)c2O)n1 2160642638 VOQUCLUTZBWJJW-UHFFFAOYSA-N 344.140 1.671 10 10 EDCE N[C@@H]1CC[C@H](C(=O)O)N(Cc2cc(Br)cc(F)c2O)C1 2188782154 PETILTJGBLGLAZ-MWLCHTKSSA-N 347.184 1.670 10 10 EDCE CN(C)CCCN(CCN)Cc1c(O)cccc1Br 2265836977 LXUIGIGGOKEOBR-UHFFFAOYSA-N 330.270 1.867 10 10 EDCE CN1C(=O)C(=Cc2ccccc2OS(C)(=O)=O)SC1=S 2297356733 GIXPNKIYBXMBGC-UHFFFAOYSA-N 329.424 1.856 10 10 EDCE OCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2332592029 GCMYFCKATAJJFG-DGJRKYIQSA-N 328.206 1.262 10 10 EDCE CCNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2354481801 CMBSDFZGKYEOTE-FBUXBERBSA-N 341.249 1.489 10 10 EDCE CCCS(=O)(=O)N1CCN(c2ccc3c(c2)OCCO3)CC1 41380243 GUSVZPIIQWQRIE-UHFFFAOYSA-N 326.418 1.320 10 10 EDCE CN(C)C(=O)NCCCNCc1cc(Br)ccc1O 1964611846 MPOQZSLSZSKIKR-UHFFFAOYSA-N 330.226 1.906 10 10 EDCE C/C=C\C[S@](=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 255365267 JODAQQYDPIKHAF-XXGSHBOYSA-N 336.457 1.669 10 10 EDCE Cc1cc(C)n2nc(N)c(N=Nc3ccc(S(N)(=O)=O)cc3)c2n1 252593819 BMLHDTRCGQCDPM-UHFFFAOYSA-N 345.388 1.991 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N3CCCC3)CC2)cc1 299299984 BIZZYMYEYUMSDQ-UHFFFAOYSA-N 332.448 1.623 10 10 EDCE C[C@H]1CCCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1C(=O)O 818331674 XMVZAJFRRXQFPB-KBXCAEBGSA-N 347.459 1.896 10 10 EDCE C[C@H](NC(=O)/C=C/Cn1cncn1)c1ccc(N2CCOCC2)cc1 900386983 NDUZYHZQTRMBTN-FAAWYNLUSA-N 341.415 1.548 10 10 EDCE CSCCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917833923 VRNQRTDLECHZPV-CQSZACIVSA-N 335.473 1.758 10 10 EDCE Cc1ccc(-n2c(C)cc(C(=O)CN(CCN)CCO)c2C)cc1 843367392 GHELAMYOILTWHX-UHFFFAOYSA-N 329.444 1.838 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NCCC3(CN)CC3)C2)cc1 846180675 WOICVZYPGVWRCU-OAHLLOKOSA-N 346.475 1.950 10 10 EDCE CNC(=O)C[C@H](NC(=O)NCCc1ccc(N)cc1)c1ccccc1 841892120 FGJWDCLKDXWDPR-KRWDZBQOSA-N 340.427 1.988 10 10 EDCE O=C(N[C@@H](C1CCOCC1)C1(CO)CCC1)c1cccc(O)c1O 855121985 VXYDORAVTRZDOC-INIZCTEOSA-N 335.400 1.785 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCC(=O)N(C)C)C2)cc1 852183619 UKRPSQONWQYTOY-ZDUSSCGKSA-N 334.420 1.051 10 10 EDCE C[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[S@]1=O 758161735 WKYQZTLMCSJYJE-YGWIHHTISA-N 339.373 1.273 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCN(C)C3CC3)C2)cc1 852186515 GIEFGFXHTVIJOB-AWEZNQCLSA-N 332.448 1.667 10 10 EDCE CCOc1ccc(CN2CCN(CCC(=O)N(C)C)CC2)c(O)c1 769505896 JXYWRCATFRWRMY-UHFFFAOYSA-N 335.448 1.387 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CC[C@H](C)NC3)C2)cc1 861648617 YJVMINXFGNXPKM-XHSDSOJGSA-N 346.475 1.961 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3COC[C@]3(C)C2)cc1F 1118669022 NJGWVLIDCBDSST-UGSOOPFHSA-N 349.406 1.003 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@@H](OC)[C@@H]3CCOC3)CC2)cc1 1118749899 NUJROERNBRADCY-QAPCUYQASA-N 348.443 1.785 10 10 EDCE CNC(=O)CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 772261569 STQJMCAPWJZXQW-RYUDHWBXSA-N 337.395 1.192 10 10 EDCE COC(=O)[C@@H]1CC[C@@H]1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891245912 KELXPODTCCVXQB-BBWFWOEESA-N 347.459 1.671 10 10 EDCE COC(=O)c1c(CN2CC[C@@H](C(N)=O)C2)c2cc(F)ccc2n1C 893872221 VZABQPCPDXNNCU-SNVBAGLBSA-N 333.363 1.411 10 10 EDCE CN(CC1CC1)S(=O)(=O)NCc1cc(Br)ccc1O 796191191 QBNLQTLNTIZGDT-UHFFFAOYSA-N 349.250 1.831 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CCN(C)C1 1152401112 KOCCKGUOLMFHBM-NSHDSACASA-N 340.807 1.499 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1COC(C)(C)C1)c1ccc(N(C)C)cc1 1335677259 HRSULNNFNCLPQJ-JSGCOSHPSA-N 333.432 1.614 10 10 EDCE CCOCCN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 211558424 FQYPAZGDAMOFRU-GFCCVEGCSA-N 328.210 1.874 10 10 EDCE CCn1ncc(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)n1 1267369312 XYIZEKXPKDXRTA-UHFFFAOYSA-N 331.420 1.477 10 10 EDCE C[C@H]1CN(c2ccc(CO)cc2Br)C2(CC2)C(=O)N1 2132023460 CAOYJTVEFCFXCR-VIFPVBQESA-N 325.206 1.799 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)COc2cc(C)on2)cc1C 1266950620 PAFVONPEIHBOIF-CYBMUJFWSA-N 347.415 1.973 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)CCn2cncn2)cc1C 1507047498 MYTUBFWZQGHEKY-OAHLLOKOSA-N 345.447 1.622 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cccc(Cn2ccnn2)c1 1294913537 OFLMDFVQLBJRPX-UHFFFAOYSA-N 338.367 1.710 10 10 EDCE O=C(N[C@H]1CCN(Cc2ccccc2)C1=O)c1c(F)ccc(O)c1O 1610204804 GHNKMQHGKSSKCC-ZDUSSCGKSA-N 344.342 1.768 10 10 EDCE NCc1ccc(N2CCC(CC(N)=O)CC2)cc1Br 228150204 ZAJAADXPLRQZTF-UHFFFAOYSA-N 326.238 2.000 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H](C)n3cncn3)CC2)cc1C 1483729577 XNIPVWIELAMUMA-AWEZNQCLSA-N 343.431 1.595 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1ncccn1 1714308247 CNYWDSZBDKVYHX-NSHDSACASA-N 341.375 1.547 10 10 EDCE C[C@H](CNC(=O)C(C)(F)F)NC(=O)c1ccc(N=NC(N)=O)cc1 1494560529 YUGLIWDXJZQBEE-MRVPVSSYSA-N 341.318 1.739 10 10 EDCE CCc1ocnc1C(=O)NC[C@H](O)CNCc1ccc(OC)c(C)c1 1568554463 OJVGEOZMZQCBFM-CQSZACIVSA-N 347.415 1.435 10 10 EDCE Cc1cc(C(=O)NCc2ccc3cccnc3c2O)ncc1C(N)=O 1639624965 RKXZAQSXPLMOBU-UHFFFAOYSA-N 336.351 1.673 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2COCCO2)cc1C 1491984918 JGNDQBOZCHCHJO-PBHICJAKSA-N 336.432 1.403 10 10 EDCE CC[C@H](CNC(=O)C1CC=CC1)NC(=O)c1cc(OC)nc(OC)c1 1738112861 RKPQPBQIAGOMLY-CQSZACIVSA-N 347.415 1.690 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C2CN(C(C)=O)C2)cc1C 1662208053 VAPNFXYNIDZPGK-CYBMUJFWSA-N 333.432 1.076 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCC(=O)N(C)C 1665892914 JNEKIQFNSGIOTN-GFCCVEGCSA-N 348.407 1.035 10 10 EDCE C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CC[C@@H]1NCCCO 1667216145 FGRPXHZVBLOHAM-DOMZBBRYSA-N 347.419 1.672 10 10 EDCE CC(C)[C@@H](O)CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 154179038 AQURKNSKHQLPOF-PBHICJAKSA-N 335.448 1.900 10 10 EDCE O=C1CCC(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)=NN1 1859466253 KRHQJAWEZCYZJU-UHFFFAOYSA-N 347.330 1.667 10 10 EDCE COc1ccc(C(N)=O)cc1S(=O)(=O)Nc1ccc(O)cc1C 1871340688 LBDBOAJWFWBQOW-UHFFFAOYSA-N 336.369 1.609 10 10 EDCE Nc1ccc(OCCN2CCC[C@@H](NC(=O)[C@H]3CCCO3)C2)cc1 586067944 ZAUJRXQPPCWOCZ-NVXWUHKLSA-N 333.432 1.407 10 10 EDCE Cc1nn(C)c(Br)c1[C@H](NCCCN=[N+]=[N-])C(=O)O 1890597379 RJYACHCIMRKIEP-QMMMGPOBSA-N 331.174 1.907 10 10 EDCE CCOC1(C(=O)NCCCN=[N+]=[N-])CN(C(=O)OC(C)(C)C)C1 1985094306 MZDSJMDWPTXQRU-UHFFFAOYSA-N 327.385 1.829 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985103299 SOQZKAIWRSHDNJ-AXFHLTTASA-N 327.385 1.562 10 10 EDCE COc1cccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)c1O 2011488217 UNMGNVOWDLDAPR-OLZOCXBDSA-N 338.404 1.471 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@@](O)(CO)C2)cc1Br 313753628 RFUCJYAZSVAVBP-YGRLFVJLSA-N 329.238 1.663 10 10 EDCE NCc1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)c(F)c1Br 2178086804 NQIHTPWGYXDVFC-FOGDFJRCSA-N 345.212 1.490 10 10 EDCE CN(C)c1ccc([C@H](O)[C@@H](N)c2nc(Br)nn2C)cc1 2173169103 RTDCGUICVIIMGN-MNOVXSKESA-N 340.225 1.377 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H]3CN3CCCC3)c2n1 2062403315 QWNBVUQKFRQJTD-ZDUSSCGKSA-N 329.404 1.444 10 10 EDCE CCCN(Cc1ccc(Br)cc1O)[C@@H]1CC(=O)NC1=O 2171209417 UGBGJAAFDLPISN-LLVKDONJSA-N 341.205 1.782 10 10 EDCE CNCc1ccc(N2CC3(CNC(=O)N3C)C2)cc1Br 2177695547 HKTRZJGUMMJBFI-UHFFFAOYSA-N 339.237 1.382 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)c(Br)c1 2201288395 JXOAAXQTCRPTSK-GJTWSCIVSA-N 338.249 1.897 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)N1CC[C@H](N=[N+]=[N-])C1)[C@@H]1CCOC1 2250661823 AUPCIJWOSLZLSU-NWDGAFQWSA-N 339.396 1.924 10 10 EDCE CC(C)CN1C(=O)C(=CNc2cccnc2Cl)C(=O)NC1=S 2295113196 IQTQIIQGGWAFPS-UHFFFAOYSA-N 338.820 1.930 10 10 EDCE Cc1cc(N2C(=O)NC(=O)C(=CO)C2=O)ccc1Br 2293367105 DLGAOLANVFYWSD-UHFFFAOYSA-N 325.118 1.782 10 10 EDCE NCc1ccc(N2C[C@@H]3CC[C@@H](CO)O[C@@H]3C2)cc1Br 2289348899 IMGBPCNDXPAPNK-CORIIIEPSA-N 341.249 1.884 10 10 EDCE CC(=O)Oc1ccc(C=C2SC(=S)N(CC(=O)O)C2=O)cc1 2313676739 YUPWCMSDBGFJLZ-UHFFFAOYSA-N 337.378 1.898 10 10 EDCE Cc1ccc(CN2CCCC2(CO)CO)c(O)c1Br 2352686930 NBSDDJXMCULCEG-UHFFFAOYSA-N 330.222 1.782 10 10 EDCE CC(=O)NCCNC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 175276674 RVXYOLYDRLUPET-UHFFFAOYSA-N 336.347 1.328 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)cc1Br 2357051980 DWQRSCAAJRNHQH-IDNCBAHPSA-N 342.233 1.965 10 10 EDCE O=C(O)COc1ccccc1/C=C1/SC(=S)N(CCO)C1=O 210388109 LAGDFFNSMVMFFO-YRNVUSSQSA-N 339.394 1.344 10 10 EDCE CC(=O)[C@H](N)C[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952117449 AEKSDKWPFOXWOA-QWHCGFSZSA-N 338.404 1.840 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H](C)N1CCCCC1=O 193785675 QIQDMWPHTFJIGQ-QWHCGFSZSA-N 334.416 1.936 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@]3(O)CCCC[C@H]3C2)cc1 247491919 ZPTSVIUIMCNJLQ-PXNSSMCTSA-N 345.487 1.996 10 10 EDCE CC(C)(C)N1C(=O)[C@@H]2[C@@H](c3ccccc3O)N[C@](C)(C(=O)O)[C@H]2C1=O 248229248 KJFBWRKYRZLXEA-OFEPTWOUSA-N 346.383 1.280 10 10 EDCE O=C(c1cccc(O)c1O)N1CCOC[C@H]1C[C@@H](O)c1ccco1 279867903 QKJJFSGYLNDGAJ-BXUZGUMPSA-N 333.340 1.656 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CCOC[C@H]2N)c(O)c1Br 2380745236 HWAZIVWFOJWZMJ-GHMZBOCLSA-N 343.221 1.443 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2OCCO[C@H]2C)c(O)c1Br 2381131611 QBMKJVVWYCOADO-TVQRCGJNSA-N 344.205 1.883 10 10 EDCE NCc1ccc(N2CCCNC(=O)C(F)(F)C2)c(Br)c1 2152789982 KLBMLFXDCVMHHF-UHFFFAOYSA-N 348.191 1.869 10 10 EDCE CC(C)C[C@H](CO)N(C)C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 807679023 LZKOUIYCVRZNSS-WMLDXEAASA-N 349.475 1.795 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 808532247 PJAHGTVKAOAVMA-LBPRGKRZSA-N 339.388 1.725 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](NC(N)=O)C2)c(Br)c1 723173871 RQCSSJRHROCIDW-WCBMZHEXSA-N 327.226 1.716 10 10 EDCE COC[C@]1(C(=O)NCc2ccc(N3CCOCC3)cc2)CCOC1 825393378 DPGMZWWNMZKIPA-GOSISDBHSA-N 334.416 1.193 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C[C@H](N)Cc1ccc(O)c(O)c1 1952893435 KSXXKUMMSDFCHP-OLZOCXBDSA-N 340.420 1.897 10 10 EDCE Cn1ccnc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 741260824 JVKPNYQLOBIPOA-AWEZNQCLSA-N 341.415 1.052 10 10 EDCE COc1cc(O)c(CNCC(C)(C)[C@]2(O)CCOC2)cc1OC 843428663 LOZTUALTKIUAHD-KRWDZBQOSA-N 325.405 1.677 10 10 EDCE Cn1nccc1[C@H]1COCCN1Cc1cc2c(cc1O)OC[C@@H]2O 844754959 HVYFUGOUXMNGCD-ZBFHGGJFSA-N 331.372 1.125 10 10 EDCE C[C@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@@H]1CN 923496407 IAGDYXOKFQHRGR-DOTOQJQBSA-N 332.492 1.628 10 10 EDCE COC[C@@H](C(N)=O)N(C)C(=O)Cc1cc(C)n(-c2ccccc2)c1C 854657318 ZZTQVFWIPUYJHT-KRWDZBQOSA-N 343.427 1.595 10 10 EDCE O=C(/C=C/c1ccncn1)NCc1ccc(N2CCC(O)CC2)cc1 856213063 VQZYUHAROSEEJJ-ZZXKWVIFSA-N 338.411 1.767 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3nc(C4CC4)nn3C)C2)cc1 853817432 DUVRWPIHPYTMDS-CYBMUJFWSA-N 341.415 1.710 10 10 EDCE COCCOCCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852008851 JBHWWOPSBFKJER-AWEZNQCLSA-N 337.420 1.236 10 10 EDCE Cc1cnc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c(O)c1 856212753 QTVXSZXOYKRBLR-UHFFFAOYSA-N 341.411 1.987 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@H](O)c3cnc[nH]3)CC2)cc1 864949447 JONZNIFNHUOWSQ-MRXNPFEDSA-N 330.388 1.191 10 10 EDCE COCCc1cc(NC(=O)NCc2cccc(OC)c2O)n(C)n1 768994391 CHRCJAXQEDMKQX-UHFFFAOYSA-N 334.376 1.645 10 10 EDCE NC(=O)CN1CCc2ccc(NC(=O)c3cc(O)cs3)cc2C1 791024994 HORWWUGJRQHOGQ-UHFFFAOYSA-N 331.397 1.549 10 10 EDCE Cc1nn(C)c(C)c1-c1cc(C(=O)NCc2c(O)cccc2O)n[nH]1 1304049611 AFLHDHMUPYSOGR-UHFFFAOYSA-N 341.371 1.768 10 10 EDCE CNCc1ccc(N2CC3(CNC(=O)N3)C2)cc1Br 2121214109 OSIAJKFFBOQTHH-UHFFFAOYSA-N 325.210 1.040 10 10 EDCE CC(C)(O)CN1CCN(c2ccc(CN)cc2Br)CC1 212879990 DVFMATCCGQWMMN-UHFFFAOYSA-N 342.281 1.801 10 10 EDCE C[C@@H](C(=O)N(C)Cc1ccc(N2CCCC2)cc1)N1C(=O)CCC1=O 1264286945 DQHROXDISQIFFL-AWEZNQCLSA-N 343.427 1.783 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)Cc2nonc2C)cc1C 1274974078 MAQZZORPZSMJTH-GFCCVEGCSA-N 332.404 1.532 10 10 EDCE CC(C)(C)OC(=O)N1CC(NCc2ccc3c(c2)CCO3)(C(=O)O)C1 1913899292 QDKSKGHEULICCM-UHFFFAOYSA-N 348.399 1.785 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(C)CN(C)C1=O 1290719457 SWSJTRSEPAKMNE-KRWDZBQOSA-N 329.404 1.407 10 10 EDCE COc1cc(N2CCN3C(=O)OCC[C@@H]3C2)c([N+](=O)[O-])cc1OC 1612155030 NYVLUCGYXXRFPO-SNVBAGLBSA-N 337.332 1.643 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)[C@H]2CNC(=O)N2)cc1C 1700671059 HZBSTLUAMMBGAA-UKRRQHHQSA-N 348.447 1.060 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1nnn(C)n1 1618697702 DYFDHKSULIUCOY-UHFFFAOYSA-N 338.371 1.360 10 10 EDCE CN(C)C1(CNC(=O)Cc2ccc(O)c(O)c2)Cc2ccccc2C1 1628676451 FKCYURHECFDHGF-UHFFFAOYSA-N 340.423 1.856 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cc(C)on2)cc1C 1484477281 WIFNZPQPSAIRJK-UHFFFAOYSA-N 347.415 1.524 10 10 EDCE COc1ccnc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)c1 1628547191 VXWLNZHHBLBVRT-UHFFFAOYSA-N 343.383 1.393 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@H]2CC2(C)C)cc(OC)n1 1494680174 LRUZCGSXJSTTFZ-CMPLNLGQSA-N 335.404 1.379 10 10 EDCE Cc1sc(S(N)(=O)=O)cc1C(=O)NCc1ccccc1O 1566373754 CRSQFTLEIOGWGT-UHFFFAOYSA-N 326.399 1.340 10 10 EDCE C[C@]1(C(=O)NCc2c(O)cccc2O)Cc2ccccc2C(=O)O1 1645361057 VHBCDTSJGLHNON-GOSISDBHSA-N 327.336 1.886 10 10 EDCE Cc1cc(O)nc(N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)n1 1649061058 HCLIICRTXBVPRQ-UHFFFAOYSA-N 348.334 1.003 10 10 EDCE C[C@]1(C(=O)NCCc2ccc(O)c(O)c2)Oc2ccccc2NC1=O 1595752009 LVYZGVRSTLHRAJ-GOSISDBHSA-N 342.351 1.546 10 10 EDCE CCN1CCO[C@@H](C(=O)N[C@@H](C)CNCc2ccc(OC)c(C)c2)C1 1699433300 ZCGJLUHBCASZNN-MAUKXSAKSA-N 349.475 1.319 10 10 EDCE CCCn1nccc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 152185454 LYJFOVNMSKQDTJ-UHFFFAOYSA-N 347.394 1.753 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1COC[C@H]1NCc1ccc(O)cc1O 1948516716 CEOSQICTCXLKSV-GXTWGEPZSA-N 338.404 1.727 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CC(N=[N+]=[N-])C2)CCOCC1 1985100453 HENYIELGQMGGFL-UHFFFAOYSA-N 325.369 1.581 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2014509734 QYEYQFHTTNSZFR-NEPJUHHUSA-N 341.412 1.669 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@@H](O)[C@@H](CO)C2)cc1Br 316445479 RPVCKBRZGCELBD-UEKVPHQBSA-N 343.265 1.909 10 10 EDCE Oc1cc(Br)ccc1CNC[C@@H]1CN2CCCN1CC2 691487116 IHVFTIGLLYSTDU-CQSZACIVSA-N 340.265 1.634 10 10 EDCE CN(C[C@H]1CCOC1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 398992684 PQQSCQLEZJVPNS-OQPBUACISA-N 340.221 1.874 10 10 EDCE CNCc1ccc(N2CC[C@@]3(CNC(=O)N3)C2)c(Br)c1 2177699866 XQNQVGMPPABJAU-CQSZACIVSA-N 339.237 1.430 10 10 EDCE OC[C@]1(NCc2c(O)cccc2Br)C[C@@H](O)C12CCC2 2193966851 MQBCQCMBFZCFSF-UKRRQHHQSA-N 342.233 1.910 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@](O)(C(=O)NCc2ccc(N)cc2)C1 2076959696 FINXJVLYUKUJGW-GOSISDBHSA-N 349.431 1.647 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](C(=O)NCCN=[N+]=[N-])CO1 2242735624 VSTJFDVVNLKPPX-MNOVXSKESA-N 327.385 1.733 10 10 EDCE O=C(CN1C(=O)C(=Cc2ccc(F)cc2)SC1=S)NCCO 2294872146 WWKNMWQCOBKPOH-UHFFFAOYSA-N 340.401 1.135 10 10 EDCE CCN(CC)CCNC=C1C(=O)NC(=O)N(C2CCCCC2)C1=O 2296927162 VVJMIXNCRZZULN-UHFFFAOYSA-N 336.436 1.213 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NC1C[C@@H]2CC[C@H](C1)N2 2301612044 PFGDJJADSXIUIN-JWTNVVGKSA-N 341.455 1.936 10 10 EDCE CN(C)c1ncc(C=CC(=O)N(C)c2ccc(C(=O)O)cc2)cn1 2324675334 JZMKIAKWCKIDQH-UHFFFAOYSA-N 326.356 1.917 10 10 EDCE Cc1ccc(CN(C)c2nc(=N)n(C)[nH]2)c(O)c1Br 2352940666 GUXRONMVMSLEPO-UHFFFAOYSA-N 326.198 1.641 10 10 EDCE CCCOc1ccc(CN2CCN(S(=O)(=O)CC)CC2)c(O)c1 127260126 SGHJCODVFUEAFU-UHFFFAOYSA-N 342.461 1.648 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@H]3CCCCC(=O)N3)CC2)cc1 193873366 FMWRMVXWXIMTSD-QGZVFWFLSA-N 345.443 1.793 10 10 EDCE CCS(=O)(=O)[C@@H]1CSCCN1c1ccc(CNC)cc1F 90927601 PNDFMXKYDQECOJ-CQSZACIVSA-N 332.466 1.859 10 10 EDCE O=C(O)[C@H]1CCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255196320 ILFBLSDZMPXDTG-BYPUDFOVSA-N 330.384 1.470 10 10 EDCE O=C(N1CCNCC1)N1CCN(Cc2cccc(Cl)c2O)CC1 530241719 ILWKZSLQHFUQHB-UHFFFAOYSA-N 338.839 1.188 10 10 EDCE Cc1cc(C(=O)NC[C@H]2CNC[C@H]2O)c(C)n1-c1ccc(F)cc1 262252120 LQSDPPUHJHPXDF-CXAGYDPISA-N 331.391 1.543 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCC[C@@H]1CCOC1 807325274 FHVGRWSXTYKCIA-CQSZACIVSA-N 334.416 1.674 10 10 EDCE COCCSc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)C(C)=O 808532217 OLOVUCQHHIKBCK-UHFFFAOYSA-N 341.341 1.648 10 10 EDCE C[C@@H](NC(=O)N(C)Cc1ccccc1O)C1(S(C)(=O)=O)CC1 807481811 NIDAEMDOVIRLCG-LLVKDONJSA-N 326.418 1.499 10 10 EDCE CCN(C(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1 813044655 BGGLVRILCCMIGL-QGZVFWFLSA-N 333.432 1.844 10 10 EDCE CC(C)N(CC(=O)O)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 588592233 QGEXKBURUPIZDX-YVMONPNESA-N 332.400 1.858 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)c1cccn(CC(=O)O)c1=O 901849673 JAHPEWKNHCRBMW-UHFFFAOYSA-N 344.367 1.691 10 10 EDCE CO[C@@]1(CN[C@@H](C)c2ccc(N(C)C)cc2)CCS(=O)(=O)C1 903369621 YTWKCGDDTPHGSG-XJKSGUPXSA-N 326.462 1.607 10 10 EDCE O=C(c1c(-c2cncnc2)cc(=O)n2c1CCCC2)N1CCOCC1 581799708 MHIIUCXIDCCAER-UHFFFAOYSA-N 340.383 1.114 10 10 EDCE CO[C@H](C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)[C@@H]1CCOC1 830899489 FJBOTLXDCRLMSO-NUJGCVRESA-N 349.427 1.951 10 10 EDCE O=C(NCc1ccccc1O)NC[C@H](N1CCNCC1)C(F)(F)F 841991354 BGGYRJFBOQOKEW-ZDUSSCGKSA-N 346.353 1.028 10 10 EDCE C[C@H]1CO[C@@H](C(F)(F)F)CN1C(=O)C(=O)Nc1ccc(N)cc1 841127629 OEYMFMZRKRAXMR-GZMMTYOYSA-N 331.294 1.386 10 10 EDCE COC(=O)COc1ccc(N(C)C[C@H]2CN(C3CC3)C(=O)O2)cc1 844320239 YAGHTFAUHCNIHB-HNNXBMFYSA-N 334.372 1.658 10 10 EDCE CC(=O)c1cc(F)cc(CN2C[C@H]3COCC[C@]3(C(=O)O)C2)c1O 846287514 YOKNKYXUKZFWFE-SJCJKPOMSA-N 337.347 1.657 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cn(C(C)C)nn3)C2)cc1 855223499 AVSFHMYJWHVZGH-CYBMUJFWSA-N 329.404 1.876 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CCCN(C)C3)C2)cc1 852188737 LQERWWSVWRGZQR-CVEARBPZSA-N 346.475 1.915 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H]4NC(=O)CC[C@@H]4C3)cc2N1 853829983 PQPFSALFYXSOSR-NXEZZACHSA-N 346.343 1.031 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCN3CCOCC3)C2)cc1 855229356 JGTGZLXKWYCARR-OAHLLOKOSA-N 333.432 1.112 10 10 EDCE O=C(N[C@@H](CO)[C@@H]1CCCOC1)c1cc2cc(O)c(O)cc2s1 897975086 BADNPPPXRHVJTM-KOLCDFICSA-N 337.397 1.830 10 10 EDCE CNC(=O)[C@]1(C)CCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 897635940 LCSYBZZWWTXYJQ-MRXNPFEDSA-N 334.397 1.911 10 10 EDCE CN(C)C(=O)CCN1CCN(Cc2c(O)ccc(Cl)c2F)CC1 792170654 TWAIRGFSYOFTNM-UHFFFAOYSA-N 343.830 1.781 10 10 EDCE Cc1cc(O)c(CNCc2nnc3c(=O)n(C)ccn23)cc1Cl 895639964 NILMMYYFNUFRNG-UHFFFAOYSA-N 333.779 1.385 10 10 EDCE C[C@@H]1CO[C@H](C(F)(F)F)CN1Cc1cc2c(cc1O)OC[C@@H]2O 795688688 DMDAWJJLNNMVLQ-XOZVTBISSA-N 333.306 1.970 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cc(Br)n[nH]1 788309613 UZCJEMCWEZDSQS-UHFFFAOYSA-N 326.150 1.556 10 10 EDCE Cc1noc([C@H](C)N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)n1 1329436954 RMUQKEPDMYSFLK-VIFPVBQESA-N 330.344 1.145 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H](C)n2cncn2)cc1C 1268788951 VCRQLDQCGYTMBG-OAHLLOKOSA-N 345.447 1.794 10 10 EDCE CN(C[C@@H](O)COCc1ccccc1)c1ccc2c(c1)NC(=O)[C@H]2O 1916383246 GFGJKTQNSREFIY-QAPCUYQASA-N 342.395 1.686 10 10 EDCE [N-]=[N+]=NCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12 209365115 SWODDJWJUGOAQB-JBLDHEPKSA-N 326.426 1.529 10 10 EDCE C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1nc(C(F)(F)F)no1 1299734644 CWBBPFIXOKXGKX-ZCFIWIBFSA-N 331.250 1.920 10 10 EDCE NC(=O)N1CCC(NCc2cccc(Br)c2O)CC1 113352390 JWQUPCFLNRDYGG-UHFFFAOYSA-N 328.210 1.787 10 10 EDCE COC(=O)c1ncnc(N[C@@H](C)Cc2ccc(O)c(O)c2)c1OC 1472755411 XHNCXINBANDNLV-VIFPVBQESA-N 333.344 1.726 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)c2cn(C)c(O)n2)cc1C 1714486591 LXXUDBLLODYJLA-ZDUSSCGKSA-N 346.431 1.741 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1C[C@@H](CCO)[C@@H](CO)C1 1558826426 PKTRJCMQYMRBBP-MWLCHTKSSA-N 337.397 1.375 10 10 EDCE COc1ccc(CNC(=O)[C@@]2(C)Oc3ccccc3NC2=O)c(O)c1 1626079445 FASYBZBJZFCNRB-GOSISDBHSA-N 342.351 1.807 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)CO[C@@H]3CCOC3)C2)cc1C 1713160638 RTUSRGHKKCEAOS-BRWVUGGUSA-N 348.443 1.546 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cn(C)ccc2=O)cc1C 1569068485 SOGOZWKBLBKXRT-AWEZNQCLSA-N 343.427 1.610 10 10 EDCE COc1cc(C(=O)N[C@H](C)CCNC(=O)[C@@H]2CC2(C)C)cc(OC)n1 1495501790 KOBSYFHROBCYRR-YPMHNXCESA-N 349.431 1.770 10 10 EDCE COC(=O)c1ccc(/C=C/C(=O)NCCc2ccc(O)c(O)c2)o1 1631509712 FGUOJXMPWRDCKK-QPJJXVBHSA-N 331.324 1.850 10 10 EDCE COC(=O)c1cc(C(=O)NCc2ccc3cccnc3c2O)n(C)n1 1643284381 CHVWHULXXSMMFN-UHFFFAOYSA-N 340.339 1.391 10 10 EDCE C/C=C(\C)C(=O)NC[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1736065312 IDCORIIHSHKOAB-SKWDCGOKSA-N 347.415 1.690 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@@H](C)NCC(=O)N(C)C 1734006619 QMWHNXNSNKTKHR-MNOVXSKESA-N 348.407 1.034 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)CCn3ccnn3)C2)cc1C 1661589840 ZQHKKLIBGPRKDT-IYBDPMFKSA-N 343.431 1.422 10 10 EDCE Cn1ccnc1[C@H]1C[C@H](NC(=O)NCc2ccccc2O)CCO1 1683084195 OGUSTULVIZPIOE-UKRRQHHQSA-N 330.388 1.845 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cc(F)c[nH]2)cc1C 1699051769 MTMNWSWBXLDCHI-AWEZNQCLSA-N 335.379 1.351 10 10 EDCE O=C(c1cccc(O)c1O)N1C[C@H]2C[C@H]1CN2C(=O)C(F)(F)F 1963554461 NQRIYWJRYSFPBE-JGVFFNPUSA-N 330.262 1.085 10 10 EDCE CC(C)(C)OC(=O)N1[C@H]2C[C@H]1CN(C(=O)c1cccc(O)c1O)C2 1963828161 MBXBYVNSMYLCML-QWRGUYRKSA-N 334.372 1.932 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 1985097015 ZPIBMLOQLDHGRZ-SNVBAGLBSA-N 325.369 1.391 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCN=[N+]=[N-])[C@H](O)C(C)(C)C 1989789966 LFWKTVISXHSLFG-ZJUUUORDSA-N 329.401 1.713 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)C[C@@]2(C)CO)c(Br)c1 698134505 AZNGAFFHKAIKCR-PUYPPJJSSA-N 329.238 1.791 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1C(=O)Cc1ccc(N)cc1 2060805748 AYACGMHIOZCGTP-HUUCEWRRSA-N 349.431 1.298 10 10 EDCE NCc1cc(F)c(N2CC(N3CC(F)C3)C2)cc1Br 2102843293 GNCCMALDIAJEER-UHFFFAOYSA-N 332.192 1.889 10 10 EDCE NCc1ccc(N2C[C@H]3CCS(=O)(=O)[C@H]3C2)cc1Br 2088820380 WRILRQPCXKZREF-MFKMUULPSA-N 345.262 1.531 10 10 EDCE COC[C@@H]1[C@H](O)[C@H](O)CN1c1ccc([C@@H](C)N)cc1Br 2234066910 LODCVMCVWFOERD-OJICRYGUSA-N 345.237 1.026 10 10 EDCE COc1ccc(Br)c(CN2CC[C@](O)(C(=O)O)C2)c1O 2236035741 AKQPTVJJNFCLMH-CYBMUJFWSA-N 346.177 1.185 10 10 EDCE CNC(=O)c1cncc(C=CC(=O)N(C)c2ncccc2OC)c1 2303612393 AZTRQEHWTKIPJM-UHFFFAOYSA-N 326.356 1.521 10 10 EDCE NC(=O)CC[C@H](C(=O)O)N1C(=O)C(=Cc2ccco2)SC1=S 2314541090 DZKZBUKRPFSYHD-MRVPVSSYSA-N 340.382 1.200 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2354367062 ARVXRDCFODMUEU-CJIMWGSBSA-N 341.249 1.925 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)NCCNC(N)=O)c2C)cc1 118656612 GJYGTCOSCISSOY-UHFFFAOYSA-N 330.388 1.501 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H](CN)CO 1952116553 ZSMKZQYWHILHNF-RYUDHWBXSA-N 326.393 1.101 10 10 EDCE CCN(CC)CCNC(=O)N1CCN(c2ccc(OC)cc2)CC1 45545378 NVLWJDGOTNRQOH-UHFFFAOYSA-N 334.464 1.869 10 10 EDCE NC(=O)Cn1cc(NCc2cccc(Br)c2O)cn1 48796109 YACBGBIYNQVCEB-UHFFFAOYSA-N 325.166 1.449 10 10 EDCE CCOc1ccc(O)c(CN2CC[C@H]3CC[C@@H](C2)S3(=O)=O)c1 529671825 JVUMTEACLDLLAA-CABCVRRESA-N 325.430 1.942 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)N3CC[C@](O)(C(N)=O)C3)c2C)c1 276508896 QXGBSBPQUDJYMS-LJQANCHMSA-N 341.411 1.465 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN2CCOC[C@@H]2C1 365047525 VMQMOWPZIVVVDB-SFHVURJKSA-N 342.443 1.289 10 10 EDCE COc1cccc(CNC(=O)[C@@H]2COCCN2CC(F)(F)F)c1O 287437885 ANDVYLDNWJEBGB-NSHDSACASA-N 348.321 1.280 10 10 EDCE C[C@H]1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1C 293553377 ZIIYVABBUKTFCM-UONOGXRCSA-N 335.423 1.619 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N3C[C@H]4CC[C@@H](C4)C3)ccc21 827580899 XFTJLKBQKMOBOI-HOTGVXAUSA-N 341.455 1.944 10 10 EDCE Nc1ccc(OCCON2C(=O)COc3ccc(C=O)cc32)cc1 821300067 QOXNOKPBFGAELJ-UHFFFAOYSA-N 328.324 1.817 10 10 EDCE COc1cc([C@]2(NC(=O)OC(C)(C)C)C[C@@H]2C(=O)O)cc(O)c1O 1952888699 WNEYYETYGLIJFI-JDNHERCYSA-N 339.344 1.931 10 10 EDCE Cc1cc(O)c(CN2CCC[C@@H](N3CCNCC3=O)C2)c(Cl)c1 843065373 LJCNHNDMVDQORG-CYBMUJFWSA-N 337.851 1.750 10 10 EDCE CN(C)c1ccc(CNCc2ccc(S(N)(=O)=O)cc2F)cc1 842660646 NACXHJGQUOCCJD-UHFFFAOYSA-N 337.420 1.829 10 10 EDCE NC(=O)C1CCC(NC(=O)NCc2ccc(N3CC=CC3)cc2)CC1 747587106 QMHYJAGSAZOOKU-UHFFFAOYSA-N 342.443 1.906 10 10 EDCE COC(=O)c1cncnc1N[C@H]1CCN(c2ccc(OC)cc2)C1 853761735 VSCMHVJDSCOGMT-LBPRGKRZSA-N 328.372 1.963 10 10 EDCE Cc1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)nn1 866485208 NEKTWONNILGXKS-UHFFFAOYSA-N 332.429 1.864 10 10 EDCE COCCn1ncc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1C 867303123 ZJRWZPHQWWVRAX-LLVKDONJSA-N 333.388 1.610 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NCC[C@@]1(C)CC1(F)F 1118499776 MQLSTJOOWHMEOA-HNNXBMFYSA-N 326.343 1.902 10 10 EDCE C[C@H](CN[C@H](C)c1ccc(N2CCOCC2)cc1)CS(C)(=O)=O 775259041 MVUDLDOJTSWPDA-HUUCEWRRSA-N 340.489 1.855 10 10 EDCE Cc1nccc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)n1 793759798 AUYHYOSJOJFOPB-UHFFFAOYSA-N 341.415 1.126 10 10 EDCE COc1ccc(C(=O)N[C@@H](C)c2ccccc2O)cc1-n1cnnn1 1302538437 QWYJSKJHVNKZON-NSHDSACASA-N 339.355 1.868 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)Cn2cncn2)cc1C 1275564315 YRTZYMPNQHUKOA-KBPBESRZSA-N 331.420 1.278 10 10 EDCE CNC(=O)N[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1303522709 ZPZOHYKITSRCPI-GFCCVEGCSA-N 332.364 1.383 10 10 EDCE CC(C)[C@H]1CNC(=O)CN1c1ccc(CN)cc1Br 2124752756 YYIPIWJOSHZFAY-CYBMUJFWSA-N 326.238 1.869 10 10 EDCE NCc1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)c(Br)c1 2121591592 JFQIQAZMLYMMKF-MJVIPROJSA-N 327.222 1.351 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCCc1ccns1 1338836707 DLYGDBXQZSAQNL-UHFFFAOYSA-N 347.440 1.946 10 10 EDCE NCc1ccc(N2CCN3CCOC[C@H]3C2)cc1Br 2129377244 CFXGFPJTZAKWFJ-CYBMUJFWSA-N 326.238 1.429 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C1CC1)[C@@H]1CCCCO1 1330027643 PYFMRAJNSJEKSY-DLBZAZTESA-N 346.427 1.815 10 10 EDCE CC1(C)CC(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 1330859089 XVNZTKBNZOSLLT-UHFFFAOYSA-N 345.443 1.444 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H]2CC[C@H]2C(N)=O)cc1C 1268572612 MNHCVESOJDGSEH-OBMMGQTPSA-N 345.443 1.277 10 10 EDCE CS(=O)(=O)[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1447358236 FBZZIRVDOLAYGM-GFCCVEGCSA-N 338.389 1.498 10 10 EDCE CCN(C(=O)COC)[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1512456222 BVHIBLYGHNFNEJ-LLVKDONJSA-N 349.391 1.462 10 10 EDCE CCC(=O)NCC(=O)NC[C@H]1C[C@H](NCc2ccc(OC)c(C)c2)C1 1479357622 MQNFNJXPIQJGFA-WKILWMFISA-N 347.459 1.514 10 10 EDCE CCNC(=O)CC(=O)N1C[C@@H](NCc2ccc(OC)c(C)c2)C[C@H]1C 1717810360 USOJOECMWXTZLU-ZBFHGGJFSA-N 347.459 1.609 10 10 EDCE CC(C)CCN1CC(O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1716947789 WOKHCQGWSIEVLV-UHFFFAOYSA-N 347.419 1.672 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccccc1O[C@H]1CC(=O)N1 1557101928 DIUJWTJEULEHCW-IWHGQQBYSA-N 340.335 1.975 10 10 EDCE CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NCc2cc(O)ccc2O)C1 1633595261 OOTDHZJZUHPYGT-OLZOCXBDSA-N 334.416 1.999 10 10 EDCE O=C(Cc1cnn(-c2ccccc2)n1)NCc1c(O)cccc1F 1645048203 LDSLLHYZZJVUIK-UHFFFAOYSA-N 326.331 1.971 10 10 EDCE Cc1oc(S(N)(=O)=O)cc1C(=O)NCc1c(O)cccc1F 1652298271 IFZJRYWUSWOMJQ-UHFFFAOYSA-N 328.321 1.010 10 10 EDCE CCN(C)c1ccc(CN2C[C@H]3[C@H](OC)CS(=O)(=O)[C@H]3C2)cc1 1659466238 BTULQJURAFBRNQ-BBWFWOEESA-N 338.473 1.387 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)cc1Br 2140661883 JFTCJQKUGNUTEL-AGIUHOORSA-N 333.201 1.048 10 10 EDCE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)[C@H]1CN2CCN1CC2 1889863072 SHRRBNIGVOSQMU-YTQUADARSA-N 340.471 1.291 10 10 EDCE OC[C@H]1COCC[C@@H]1NCc1cc(Br)cc(F)c1O 1878773174 BERICPNYAQDWDE-CABZTGNLSA-N 334.185 1.781 10 10 EDCE CCn1nnnc1CN(C)c1ccc(CN)cc1Br 1885608826 WOIRMSBEAHSENP-UHFFFAOYSA-N 325.214 1.551 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2C[C@@H](CO)CO2)c1O 1966088617 REROSKCTSOBJPF-VHSXEESVSA-N 346.221 1.650 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1CCNC[C@H]1C(=O)O 251116707 VKJPNGROEUBSDH-NEPJUHHUSA-N 343.221 1.964 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)cc1Br 2146314278 QYWHJJIBZJZETI-VCTAVGKDSA-N 342.233 1.684 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC(N=[N+]=[N-])CC1 1985102627 JTMPQCWQBQTIPW-ONGXEEELSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CCOC1 1985102199 CWDPIUXZDPCMFA-IINYFYTJSA-N 325.369 1.581 10 10 EDCE COc1ccc(N2CCN(C(=O)OC(C)(C)C)C[C@@H]2CO)c(N)c1 1999512196 NJMYTYUZBLADFL-GFCCVEGCSA-N 337.420 1.695 10 10 EDCE CC(C)(C)OC(=O)N1CC(C)(C)OC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010389824 VFDLYKDCEDXZTC-NSHDSACASA-N 339.396 1.922 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1ccccn1 2022933338 GEHQPOYBEWCWHM-STQMWFEESA-N 333.388 1.629 10 10 EDCE NCc1ccc(N2C[C@@H](CO)[C@H](CO)C2)c(F)c1Br 704698635 KLQKHFTXQZOCLA-UWVGGRQHSA-N 333.201 1.084 10 10 EDCE CS(=O)(=O)C1CC(NCc2c(O)cccc2Br)C1 715266136 ITQYBMBQCLYPMU-UHFFFAOYSA-N 334.235 1.820 10 10 EDCE OCc1ccc(N2CC[C@@]3(O)CCOC[C@H]3C2)c(Br)c1 2194564539 JTUGUGJSXDPCCW-IUODEOHRSA-N 342.233 1.919 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@H](O)C3)c(Br)c1 2190462182 VSHVOIBIAJWZBJ-UJZSJCAASA-N 341.249 1.932 10 10 EDCE CO[C@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@H]1NC(=O)OC(C)(C)C 2058774563 FQXMKOSCZLAJSL-CABCVRRESA-N 349.431 1.562 10 10 EDCE C[C@H]1CCN(c2cc(Br)c(CN)cc2F)[C@@H]1C(N)=O 2090256801 SMFVGFQXJJQTDE-MADCSZMMSA-N 330.201 1.747 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@@]2(CO)CO3)cc1Br 2094645028 RCIDHPQXLOCNBX-GLXFQSAKSA-N 328.206 1.842 10 10 EDCE C[C@H]1[C@@H](C)N(c2ccc(CO)c(Br)c2)CCS1(=O)=O 2113961560 KLTRYNDRPOGISF-ZJUUUORDSA-N 348.262 1.953 10 10 EDCE CCOC(=O)c1ccc(N2NC(=O)C(=Cc3ccco3)C2=O)cc1 2297531790 JAJDPWCBFFQFOP-UHFFFAOYSA-N 326.308 1.918 10 10 EDCE COC(=O)[C@H](N)CN(C)Cc1ccc(C)c(Br)c1O 2352645871 NZCOJZWWFJVWDH-SNVBAGLBSA-N 331.210 1.395 10 10 EDCE CCNCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2354481802 CMBSDFZGKYEOTE-HJPIBITLSA-N 341.249 1.489 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 171383630 JYHYAEHJWXJITF-HUUCEWRRSA-N 334.441 1.665 10 10 EDCE CS(=O)(=O)NCCCNCc1cc(Br)ccc1O 227435946 FSNRVAHEMYPIBR-UHFFFAOYSA-N 337.239 1.184 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@@H]3CCC[C@H](C2)C3O)cc1 172037864 JHXGFEBDONKHJY-MCPYQZEQSA-N 331.460 1.462 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2nnn(C)c2c1 186417475 YYPBMHMFMBKOAS-SNVBAGLBSA-N 326.356 1.741 10 10 EDCE COCCCNC(=O)CCN1CCN(c2ccc(OC)cc2)CC1 240771710 AVWIAGIKHYPKAC-UHFFFAOYSA-N 335.448 1.360 10 10 EDCE Cc1ccc(CNC(=O)N2CCN[C@H](C)C2)c(O)c1Br 2380747048 RLTXVXPFWIKVQD-SNVBAGLBSA-N 342.237 1.966 10 10 EDCE Cc1ccc(CN(C)c2cnnc(NN)n2)c(O)c1Br 2381129072 DUDDVCMEZPATLC-UHFFFAOYSA-N 339.197 1.570 10 10 EDCE CC(=O)C(=O)COC(=O)C[C@H]1CCCN(C(=O)NCC(C)C)C1 808520720 WZYKKFMWOYMLBT-CYBMUJFWSA-N 326.393 1.155 10 10 EDCE CC(=O)C(=O)COC(=O)c1nc(C(C)C)n(-c2ccccc2F)n1 808521395 QHUROOJNCAGGMX-UHFFFAOYSA-N 333.319 1.845 10 10 EDCE COC(=O)Cc1ccc(S(=O)(=O)NCc2ccccc2O)cc1 391373831 VMBOJENNKABPQL-UHFFFAOYSA-N 335.381 1.586 10 10 EDCE COC[C@@H](CCCN)NCc1ccc(N2CCC(CO)CC2)cc1 817894985 PWPOTTBRZQIGCE-GOSISDBHSA-N 335.492 1.739 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@@](O)(C(F)F)C2)c([N+](=O)[O-])c1 828752382 WMNULPDWUGGZBE-UJAVWCLSSA-N 342.298 1.987 10 10 EDCE COCCOC(=O)c1ccc(NC(=O)c2cc(O)c(O)c(O)c2)cc1 586740681 BNUOJZFIFIIDDG-UHFFFAOYSA-N 347.323 1.859 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)CO1 1895874775 CDNHLPWLYFMKFN-MWLCHTKSSA-N 325.369 1.532 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@H]2CN(C3CC3)C(=O)O2)c1O 848928227 BBEPKHJCCLQVLG-NSHDSACASA-N 337.332 1.382 10 10 EDCE Nc1ccc(CCNC(=O)NC[C@H]2COc3ccccc3O2)cc1 841621418 FSAFUSIGKGAMAZ-HNNXBMFYSA-N 327.384 1.951 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H]([C@@H](O)c3ccncc3)C2=O)cc1 924444131 DSZIJFLDDRHPPW-CVEARBPZSA-N 340.383 1.302 10 10 EDCE CC1CCN(c2ccc(CNC(=O)[C@H](O)c3cnc[nH]3)cc2)CC1 865603831 NERFTWXQQZIBRP-QGZVFWFLSA-N 328.416 1.996 10 10 EDCE Cc1ccc(C(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)c(O)c1O 870022609 VEPPJLPPQKQCOC-ZIAGYGMSSA-N 335.448 1.218 10 10 EDCE COc1ccc(N2CCN(CCNCc3ncc(C)o3)CC2)cc1 876980030 DGTJEZQHOZPULO-UHFFFAOYSA-N 330.432 1.903 10 10 EDCE CN1CCN(c2ccc(CN3CCN4C(=O)OCC[C@H]4C3)cc2)CC1 775743953 HVHIERLZHBCUMR-SFHVURJKSA-N 344.459 1.465 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@](O)(CN(C)C)C2)c(Br)c1 713712942 SIHNZVUKGACPCQ-IAQYHMDHSA-N 342.281 1.972 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@](C)(O)Cn1ccccc1=O 790475926 WATGGAKYVUEBSM-IBGZPJMESA-N 343.427 1.324 10 10 EDCE O=C(NCc1ncccn1)NCc1cccc(Br)c1O 1313238372 SEXGWJZCWPXWSB-UHFFFAOYSA-N 337.177 1.944 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CCC(=O)N3)CC2)cc1C 1323405394 GKEHFIROKAVIOM-CQSZACIVSA-N 331.416 1.021 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC(CC2CC2)C1 1334721790 REGBNSWYUCPQIS-UHFFFAOYSA-N 329.444 1.970 10 10 EDCE [N-]=[N+]=NCCN[C@@]1(C(N)=O)C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 1912203195 BXQRUKQCPNKIMC-SCAQPMJSSA-N 328.420 1.937 10 10 EDCE COC[C@H](C)C(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1295538863 LSHYRNGSLNVPBI-QWRGUYRKSA-N 349.391 1.366 10 10 EDCE C[C@@H](NC(=O)[C@@H](c1cncn1C)N(C)C)c1ccc(N(C)C)cc1 1556260741 RNXOUDJOATXAJN-CXAGYDPISA-N 329.448 1.966 10 10 EDCE CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(O)c1O 1627232099 MDQSAWYEAMEYOJ-AWEZNQCLSA-N 326.352 1.411 10 10 EDCE CC(=O)N[C@@H]1CCN(c2ccc(CN)c(Br)c2F)C1 231840652 LPFHPXLTDPYQQC-SNVBAGLBSA-N 330.201 1.762 10 10 EDCE COCCNC(=O)[C@H](C)N(C)Cc1ccc(N2CCOCC2)cc1 16387274 PSOVRCWHHBVRPM-HNNXBMFYSA-N 335.448 1.106 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](C)NC(=O)C(C)C)CC2)cc1 1862299055 YAFFUBQIYVYHJQ-CQSZACIVSA-N 333.432 1.505 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)cc1Br 2146307295 YSCRJTQUVFJYTP-VCTAVGKDSA-N 341.249 1.650 10 10 EDCE CC(C)(C)OC(=O)N1CCN(NC(=O)c2cccc(O)c2O)CC1 2006280055 OMADGRKFHHVFEE-UHFFFAOYSA-N 337.376 1.295 10 10 EDCE COC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)C=Cc1ccc(N(C)C)cc1 2053622074 KROJOKOTJBECFK-CVEARBPZSA-N 332.400 1.555 10 10 EDCE CN(C)C[C@@H]1CN(c2ccc(CO)cc2Br)CCO1 2113971941 UWGHBWGSTFJYJT-GFCCVEGCSA-N 329.238 1.708 10 10 EDCE C[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2273244024 LTJLYRWAMZQEJR-QNRPFLCFSA-N 327.178 1.394 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](O)[C@H](O)CC2)c(Br)c1 2269120102 BGTCLYPJXVNJFF-CUOATXAZSA-N 330.222 1.824 10 10 EDCE CNC(=O)[C@H]1CN(C(=O)/C=C\c2ccc(C)nc2)c2ccccc2O1 493645879 HPUWWOOWQKEHQV-DOOKAGJSSA-N 337.379 1.943 10 10 EDCE CC(=O)NC[C@H](C)OC(=O)C=Cc1ccc(N2CCOCC2)cc1 2303807153 XEEBIGMFKBWJID-AWEZNQCLSA-N 332.400 1.604 10 10 EDCE O=C(CN1CCc2cc(O)c(O)cc2C1)C1(Br)CC1 2341192321 OHSVQURCTCLUKR-UHFFFAOYSA-N 326.190 1.953 10 10 EDCE CN(C[C@H]1CCO1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2341206175 DAYNBHQRTROUAE-JMCQJSRRSA-N 326.194 1.626 10 10 EDCE Cc1ccc(CNC(=O)CCOCCN)c(O)c1Br 2352620056 MISNEBLOGFCKKK-UHFFFAOYSA-N 331.210 1.445 10 10 EDCE CNCc1ccc(N2CCN3C[C@H](O)C[C@@H]3C2)c(Br)c1 405242165 WTAAXDLZRXLNKN-CHWSQXEVSA-N 340.265 1.424 10 10 EDCE CN1CCN[C@H](c2cc(I)ccc2O)C1=O 1951855520 NDCCKMCIJBBDSE-SNVBAGLBSA-N 332.141 1.100 10 10 EDCE C[C@@H]1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)CC[C@@H]1O 186675927 OZZWVAHJNLHLPE-TUVQABDQSA-N 330.428 1.766 10 10 EDCE CCN[C@H](C)c1ccc(N2CC([C@H](O)CO)C2)c(Br)c1 2361914051 QREWNLDQFISJGC-MEBBXXQBSA-N 343.265 1.909 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CCSC3=O)CC2)cc1 139394014 FKFXZHSWCLEEAY-UHFFFAOYSA-N 335.429 1.513 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)c1cncc(OCCO)n1 131006938 CGXULURHUMWUMK-UHFFFAOYSA-N 344.415 1.321 10 10 EDCE CCOc1cccc(CNC[C@@H]2CCC[C@@]23NC(=O)N(C)C3=O)c1O 360017461 DABYZDYYWMGQAP-SCLBCKFNSA-N 347.415 1.601 10 10 EDCE c1cc(N2CCOCC2)ccc1CN[C@@H]1CCO[C@@]2(CCOC2)C1 371407474 QJUGUYRFKJHZRN-MJGOQNOKSA-N 332.444 1.951 10 10 EDCE CN1CCC[C@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1=O 295287668 PXOJLYMQPKXMMV-HOTGVXAUSA-N 346.427 1.768 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CC[C@H](CN)O2)c(O)c1Br 2380725575 LSYSTJOQSPBFLT-GHMZBOCLSA-N 343.221 1.586 10 10 EDCE Cc1ccc(CN2CC(N3CCNCC3)C2)c(O)c1Br 2380817944 YWNUWDYZPNFNHT-UHFFFAOYSA-N 340.265 1.553 10 10 EDCE CCc1c(C(=O)OCC(=O)C(C)=O)nnn1-c1cccc(Cl)c1 808516450 JJPYDNJHCWJPOU-UHFFFAOYSA-N 335.747 1.798 10 10 EDCE CNC(=O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1 817155466 YWYBTFMSTOZBOT-OAHLLOKOSA-N 330.432 1.564 10 10 EDCE O=C(c1cnccn1)N1CCOc2ccc(N3CCOCC3)cc2C1 581789188 PYRFQAFZLSPRNK-UHFFFAOYSA-N 340.383 1.348 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@@H](C[C@@H]1COCCO1)C(F)(F)F 910942855 HFTBEOPUNHKGLD-VXGBXAGGSA-N 349.305 1.698 10 10 EDCE COc1ccc(N2CC[C@H](NC(=S)NC[C@H]3CCOC3)C2)cc1 849270695 MTTQYDNDZLABJT-KGLIPLIRSA-N 335.473 1.775 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H]4COC[C@@H]4C3)C2)cc1 852450714 STROXYSNHHTXNI-JYJNAYRXSA-N 345.443 1.952 10 10 EDCE COc1cccc(CNC(=O)NC[C@H]2CCN2C2CCOCC2)c1O 927639501 BKXWKNJUMOGUQG-OAHLLOKOSA-N 349.431 1.453 10 10 EDCE Cc1nsc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)n1 853863728 WQXGAWJVRNYOLQ-UHFFFAOYSA-N 332.429 1.738 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)C[C@@H]3COCCO3)C2)cc1 852450458 MQRZYFSBSSLUFQ-RHSMWYFYSA-N 349.431 1.331 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3cncn3C)C2)cc1 852341958 BANDAZFKIGJMRQ-CYBMUJFWSA-N 329.404 1.507 10 10 EDCE Nc1ccc(CCNS(=O)(=O)c2ccnn2CC2CCC2)cc1 923636995 TWPIHMJJXPUOHG-UHFFFAOYSA-N 334.445 1.786 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCC3CC(O)C3)C2)cc1 854298589 GFHSZMCAZWVREZ-NPCAHTBFSA-N 333.432 1.734 10 10 EDCE C[C@@]1(Br)C[C@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 860116268 MWMNERAEOIMFNZ-ISVAXAHUSA-N 329.146 1.997 10 10 EDCE COCCc1noc(COc2ccc(N(C)C)c(C(=O)OC)c2)n1 865396121 KULWUMUQOGVFJF-UHFFFAOYSA-N 335.360 1.690 10 10 EDCE Oc1cccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)c1O 702606291 YPHHXGQINPRQNR-IBGZPJMESA-N 328.412 1.824 10 10 EDCE CCS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCC2)cc1C 795305835 ZFQYAVNMNZOFCD-UHFFFAOYSA-N 333.435 1.119 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)Cn2c([N+](=O)[O-])cnc2C)c1 1150542448 AFIJOKJQAYHXQW-SECBINFHSA-N 334.332 1.691 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(CO)nc2)N(C)C)cc1 1158716863 HZEMFGDOGOCXGM-GOSISDBHSA-N 342.443 1.673 10 10 EDCE COC(=O)[C@H]1C[C@@H]1C(=O)N(C)CCNCc1ccc(OC)c(C)c1 1317573601 JSOZOTZYQOHYSW-GJZGRUSLSA-N 334.416 1.361 10 10 EDCE C[C@]1(NCc2cc(Br)ccc2O)CCC(=O)NC1=O 2116208222 JRNYYRPAOWLGDU-ZDUSSCGKSA-N 327.178 1.440 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H](C)C(F)(F)F)cc1C 1320256396 HIFLHIWMVSWAFC-DGCLKSJQSA-N 348.365 1.769 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C 1331950367 LRAQAKMBCJLRJI-NBRWMIFNSA-N 347.411 1.980 10 10 EDCE C[C@@]1(CCNC(=O)C(=O)NCCc2ccc(N)cc2)CC1(F)F 1347075514 RTPSIMUDXHCGDH-OAHLLOKOSA-N 325.359 1.479 10 10 EDCE Cc1ccc(C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)c(O)c1O 1296178235 DUPFZDXZGJBOIO-MRXNPFEDSA-N 325.361 1.229 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)c2ccccn2)cc(OC)n1 1526345531 UPGOYPUPYKRWNF-NSHDSACASA-N 344.371 1.042 10 10 EDCE COc1ccc(-n2nnnc2CN[C@H](C)[C@H](C)NC(=O)C(C)C)cc1 1700385279 COGXOABNVJQTRX-OLZOCXBDSA-N 346.435 1.310 10 10 EDCE CCn1c(S)nnc1CCNC(=O)c1ccc(N=NC(N)=O)cc1 1633595621 DXFFUEBPLAKXQF-UHFFFAOYSA-N 347.404 1.722 10 10 EDCE O=C(NCc1cccc(Br)c1O)c1ccnc(CO)c1 1568610733 VNRZJDUIKGZWHB-UHFFFAOYSA-N 337.173 1.972 10 10 EDCE CC[C@H](NCCOCC(N)=O)c1cc(Br)ccc1O 230048542 JITZRKWORRGFGE-NSHDSACASA-N 331.210 1.697 10 10 EDCE CO[C@@H](C)CC(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1579747150 ALQYEGWIWDQPEC-QWRGUYRKSA-N 349.391 1.509 10 10 EDCE COc1ccc(/C=C2\SC(=S)N(CCO)C2=O)cc1OC 16904860 LEOWXLVKXBGRGZ-WQLSENKSSA-N 325.411 1.897 10 10 EDCE CN(C)CC(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCCCC1 1866207671 DVTPQDOGVXYIGB-GOSISDBHSA-N 332.492 1.957 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCCCNC2=O)c1O 1964019376 BOMYIDUBZRKBPF-NSHDSACASA-N 343.221 1.922 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](N)C(C)(C)O 1951698107 OYJHQHGOTJFOMD-BXUZGUMPSA-N 340.420 1.632 10 10 EDCE OCc1ccc(N2C[C@]3(CO)CC[C@]3(CO)C2)cc1Br 2145746205 OMIGYCUJEIUGFW-GASCZTMLSA-N 342.233 1.513 10 10 EDCE CC(C)(C)OC(=O)N1CCS[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 1980376971 KBOXTYLVFDYIDL-NQBHXWOUSA-N 342.461 1.605 10 10 EDCE CNCc1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)cc1Br 2146312603 YDQCSPXPLLUVDJ-HUUCEWRRSA-N 341.249 1.350 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1 1986140529 FYWWNGIYZMERNA-AWEZNQCLSA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2C[C@]21C(=O)C(=O)C[C@H]1C[C@H](N)C1 2008508790 QUUIVHOKQNUSQU-MKEXSJQTSA-N 336.432 1.945 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)c1cn(C)c(CNC(=O)OC(C)(C)C)n1 2010405823 MFYFLANRQPBZFQ-UHFFFAOYSA-N 337.384 1.827 10 10 EDCE Cc1cccc(CN=c2nc(CNC(=O)OC(C)(C)C)[nH][nH]2)c1O 2011842685 HUUJZADZBCOTKU-UHFFFAOYSA-N 333.392 1.877 10 10 EDCE COc1ccc(N(C)[C@@H](CN)c2c(Br)nnn2C)cc1 312393758 OKHYGYYJVVGKKA-NSHDSACASA-N 340.225 1.722 10 10 EDCE CC(C)NCc1ccc(N2C[C@H](O)C[C@@H](O)C2)cc1Br 2161356945 LALMQVGBGUBIIX-ZIAGYGMSSA-N 343.265 1.879 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](C(CO)CO)C2)cc1Br 2170661994 KTVMOOVXPCOBDT-QWRGUYRKSA-N 343.265 1.896 10 10 EDCE C[C@H](N)c1ccc(N(C)C[C@@H](O)CN(C)C)c(Br)c1 690171669 MYVRGSZWCPCGDD-JQWIXIFHSA-N 330.270 1.828 10 10 EDCE CS(=O)(=O)N1CC[C@H](Nc2c(N)cccc2Br)C1 697448494 VJAIADHTOHQKRL-QMMMGPOBSA-N 334.239 1.477 10 10 EDCE CCNCc1ccc(N2CCOC[C@H](O)C2)cc1Br 399942986 RGKXXWDDFJLAEB-CYBMUJFWSA-N 329.238 1.756 10 10 EDCE CN1C[C@@H]2C[C@H](C1)N2c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2187623588 QIWANPFMTZWDHF-BFHDXFOESA-N 337.221 1.294 10 10 EDCE CN[C@@H](C)c1ccc(N(C)Cc2nnn(C)n2)cc1Br 2197848756 ZMCDVDPGEYGMCU-VIFPVBQESA-N 339.241 1.889 10 10 EDCE C[C@@H]1CN(c2cc(Br)c(CN)cc2F)C2(CC2)C(=O)N1 2188545367 MBHUFSYFAMRWHM-MRVPVSSYSA-N 342.212 1.904 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)Cc2ccc(N)cc2)[C@H](O)C1 2052720296 JQQPWEZVLYILMV-HUUCEWRRSA-N 349.431 1.298 10 10 EDCE NCc1ccc(N2CC[C@@]3(C[C@@H](O)CO3)C2)c(F)c1Br 2201772199 NXQUZTUFLLVJRF-QMTHXVAHSA-N 345.212 1.777 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)cc2Br)[C@H]2COC[C@H]12 2102139858 FDRRRGJLBXDYCB-LEWSCRJBSA-N 327.222 1.758 10 10 EDCE C[C@@H]1CN(Cc2ccc(Br)cc2O)[C@@H](C(=O)O)CO1 2109523114 INZNXVDFBRTNSM-LDYMZIIASA-N 330.178 1.829 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](CO)C[C@H]2CO)c(Br)c1 2089862706 CEBRDCZIVFIULX-FOGDFJRCSA-N 329.238 1.648 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2236636029 LISXGMPLLIRXTB-SDDRHHMPSA-N 344.249 1.930 10 10 EDCE CNCc1ccc(N2CC3(CCC(=O)NC3)C2)c(Br)c1 2280244932 FRFDYIWGZIHXQV-UHFFFAOYSA-N 338.249 1.885 10 10 EDCE CC(C)(C)OC(=O)NCCC(=O)N1CCc2cc(O)c(O)cc2C1 2302398634 CGWQPZVOOPWZSH-UHFFFAOYSA-N 336.388 1.897 10 10 EDCE Cc1ccc(CN[C@@H](C)c2nc(=O)o[nH]2)c(O)c1Br 2352676830 UHPLQRAFVSVSJF-ZETCQYMHSA-N 328.166 1.990 10 10 EDCE Cc1ccc(CN[C@@H]2CO[C@@H]3COC[C@@H]23)c(O)c1Br 2352944536 JFJCETUDRSAWDD-QJPTWQEYSA-N 328.206 1.967 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2355340222 NRYWULHGYCXGKD-ZAJSEHCFSA-N 342.233 1.823 10 10 EDCE COc1ccc(N2CCN(C(=O)CCn3ccc(C)n3)CC2)cc1 20989540 UOIXNCQMGKYIQE-UHFFFAOYSA-N 328.416 1.939 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC([C@H]2CCOC2)CC1 1348640046 RMBNVUKWERCMDX-HNNXBMFYSA-N 344.411 1.510 10 10 EDCE COC[C@H](O)CN1CCC(N[C@H](C)c2cc(OC)ccc2O)CC1 186194617 UYJKWNDFWKSGTK-UKRRQHHQSA-N 338.448 1.523 10 10 EDCE C[C@@H](CCS(C)(=O)=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 127102695 ZDSGBBJEEMMNBX-LSDHHAIUSA-N 340.489 1.997 10 10 EDCE CC(C)CN1CCO[C@H](CNC(=O)CSc2nccs2)C1 45080919 ZAGNCJJQBYOHNB-GFCCVEGCSA-N 329.491 1.708 10 10 EDCE Cc1ccc(Cn2nccc2NC=C2C(=O)N(C)C(=O)N(C)C2=O)o1 192693781 FBOAPFYNVQTNJC-UHFFFAOYSA-N 343.343 1.179 10 10 EDCE Nc1ccc(CC(=O)NCc2ccc(CN3CCOCC3)cc2)cc1 237906231 PBPDWCRTBDJMFP-UHFFFAOYSA-N 339.439 1.960 10 10 EDCE Cc1ccc(CN2C(=O)[C@@H]3COC[C@H]3C2=O)c(O)c1Br 2381148433 ZCHJMUARUUYCDF-NXEZZACHSA-N 340.173 1.595 10 10 EDCE CN(C[C@H]1CCCO1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 285818481 XPAPUZJLGBCHPA-MRXNPFEDSA-N 345.443 1.323 10 10 EDCE CN(C)S(=O)(=O)CC(=O)NCc1cc(Cl)cc(Cl)c1O 807836795 PKIMMBPWCMFIKO-UHFFFAOYSA-N 341.216 1.207 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)C(C)(C)n1cc(N)cn1 659285462 PKZVPKNGACPTLF-UHFFFAOYSA-N 329.404 1.692 10 10 EDCE CC1(C)OC[C@@H]2C[C@]21C(=O)NCc1ccc(N2CCOCC2)cc1 823291273 DWPWRNJGBVDEDM-HNAYVOBHSA-N 330.428 1.955 10 10 EDCE CC[C@H](NC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)C1CC1 830303686 LNHHUYXTBLZOFI-YOEHRIQHSA-N 345.443 1.695 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C\c1cnn(-c2ccccc2)n1 732579649 JYIFOPLGDBZVMR-UVTDQMKNSA-N 341.396 1.570 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC3(C2)OCCO3)c([N+](=O)[O-])c1 731209282 UURCYUCKKXACIC-HYXAFXHYSA-N 334.328 1.734 10 10 EDCE O=C(/C=C\Cn1cncn1)NCc1ccc(N2CCC(O)CC2)cc1 912709406 KMLUEULYGIVOSS-UPHRSURJSA-N 341.415 1.112 10 10 EDCE COc1ccc(N(C[C@H](O)CN2CCOCC2)C(C)C)cc1F 749150013 GPBAVRFQYVCOJV-OAHLLOKOSA-N 326.412 1.742 10 10 EDCE CCC[C@H](C(=O)OCC)S(=O)(=O)NCc1c(O)cccc1F 921451630 SYCNXFJIMIHHLT-CYBMUJFWSA-N 333.381 1.683 10 10 EDCE CN1C(=O)[C@@H](NCc2cc3c(cc2O)OCO3)Cc2ccccc21 850352825 JGRNTBGITWKEQA-ZDUSSCGKSA-N 326.352 1.798 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@](C)(CO)C(C)C)C2)cc1 854298209 YFNXIIOJUXQFIF-RDTXWAMCSA-N 335.448 1.980 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCN(C)C(=O)C3)C2)cc1 855232187 PEHAWKCGVZABSM-KBPBESRZSA-N 331.416 1.259 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCO[C@@H](CF)C3)C2)cc1 852449588 ULLOMPUQELYGJD-BBRMVZONSA-N 337.395 1.654 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)C[C@@]2(C)CO)c(Br)c1 698159139 XDQLDBRQFQNASB-UDZFHETQSA-N 330.222 1.824 10 10 EDCE CO[C@H]1COCC[C@@H]1CC(=O)NCc1ccc2cccnc2c1O 862026636 VTVRKNYUIASRAT-HIFRSBDPSA-N 330.384 1.998 10 10 EDCE Cc1cc(N(C)C)ccc1CNC[C@]1(CO)COCC2(CCC2)N1C 862463931 OYGLMEBCPADJJB-FQEVSTJZSA-N 347.503 1.766 10 10 EDCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(OC)ccc1O 775739791 SBCOXDBHYVGYDH-VDERGJSUSA-N 349.383 1.326 10 10 EDCE CCOC(=O)[C@@]1(CNC(=O)Cc2ccc(O)c(O)c2)CCCOC1 1301736568 IWJXYDIUKFWWFR-QGZVFWFLSA-N 337.372 1.116 10 10 EDCE CN(CCO)C[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1317862055 GIENSXJJNVZKKA-GFCCVEGCSA-N 333.392 1.235 10 10 EDCE CCCN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C[C@H](C)O 1266579631 WHBVMHWWMZMMQX-LBPRGKRZSA-N 335.408 1.672 10 10 EDCE C[C@H](CO)N(Cc1ccccc1)C[C@@H](O)COc1ccc(N)cc1 1914368736 VUWRKULALNRXSL-CRAIPNDOSA-N 330.428 1.892 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2(O)CN(CC3CC3)C2)cc1 1500988579 YRCBODKVTIQTAM-UHFFFAOYSA-N 331.376 1.036 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@@H]2CN3CCN2C[C@H]3C)cc1F 1293225639 ZXQZVBCPYIXNEY-KDOFPFPSSA-N 348.466 1.676 10 10 EDCE CO[C@H]1C[C@H](C(=O)O)N(Cc2c(O)cccc2Br)C1 2136350523 OIIJXTKDLHQKSU-GZMMTYOYSA-N 330.178 1.829 10 10 EDCE CC1(C)[C@H](O)CN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2136633398 YNLADXBBGUCLAB-MNOVXSKESA-N 327.178 1.394 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@H](C)N1CCOCC1 1543149226 ZPEXIIGVTLVWQO-CQSZACIVSA-N 345.447 1.649 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1C 1716292955 VKZMSTJMKZMCMF-LRPXVYOUSA-N 333.388 1.431 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H](C)n2cncn2)cc1C 1483220916 OOEDXPDDPXHFKM-KBPBESRZSA-N 331.420 1.451 10 10 EDCE CCNC(=O)CC(=O)N[C@@H](C)[C@@H](C)NCc1ccc(OC)c(C)c1 1717406436 GVJSKWIZUWBCET-KGLIPLIRSA-N 335.448 1.513 10 10 EDCE CS(=O)(=O)Nc1cccc(C(=O)NCc2ccc(O)cc2O)c1 1557085049 ZZLHMTONQKGKHA-UHFFFAOYSA-N 336.369 1.399 10 10 EDCE Cc1cnn(-c2c(C(=O)NCc3ccc(O)cc3O)c(C)nn2C)c1 1570463497 RNNRJRMMWXIRPT-UHFFFAOYSA-N 341.371 1.564 10 10 EDCE CO[C@H](C)C(=O)N(C)CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1738350481 YDMCCKHUGPJBBP-LLVKDONJSA-N 349.391 1.414 10 10 EDCE Cc1cc(C)n(C[C@H]2CN(Cc3cc4c(cc3O)OCO4)CCO2)n1 152880097 FBMQXSOXLSKKBK-OAHLLOKOSA-N 345.399 1.835 10 10 EDCE O=C(O)C[C@H](C(=O)O)N1C(=O)/C(=C\c2ccsc2)SC1=S 1858595736 HMHFQQOHQDQSLK-KOERYYGSSA-N 343.407 1.877 10 10 EDCE [N-]=[N+]=NC[C@@H]1CCCN1C[C@H](O)CN1C(=O)c2ccccc2C1=O 1885288128 TWFDRNQAJKBYIS-RYUDHWBXSA-N 329.360 1.418 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@@]1(O)CCCN(C(=O)OC(C)(C)C)C1 2010403521 FKFNJFKYLWWJQL-HNNXBMFYSA-N 341.412 1.907 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)CNC(=O)CCc1ccc(N)cc1 2011521126 YQCHJOSIUXGEQX-AWEZNQCLSA-N 337.420 1.203 10 10 EDCE Nc1ccc(CC(=O)N[C@@H](COCc2ccccc2)CC(=O)O)cc1 2035474831 DLSSFKKSLGZXFX-QGZVFWFLSA-N 342.395 1.988 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@H]2C3)c(Br)c1 2173356256 BVUPWACLWUUMEU-COXYCDLLSA-N 342.233 1.823 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)cc1Br 2178086649 MQSUGAIOWARCAZ-BILRFKGYSA-N 341.249 1.912 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H]3CN3CCCC3)c2n1 2062403314 QWNBVUQKFRQJTD-CYBMUJFWSA-N 329.404 1.444 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)c(F)c1Br 2190461610 UTEZVASQUAKTMP-GEEFMHANSA-N 345.212 1.510 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN[C@@H]1C[C@H](O)C[C@H]1O 2046481549 GSFJSUPOMUSICL-JMJZKYOTSA-N 336.613 1.782 10 10 EDCE CN1CCO[C@H]2CCN(c3ccc(CO)cc3Br)C[C@@H]21 2185528213 GFXDMZKQGKYFMI-GJZGRUSLSA-N 341.249 1.851 10 10 EDCE O=C(N[C@]12C[C@@H]1CN(Cc1ccccc1)C2)c1cc(O)c(O)c(O)c1 2068618314 PISYNUICUQHCIX-KUHUBIRLSA-N 340.379 1.808 10 10 EDCE CN[C@@H](c1ccccc1O)[C@H](O)c1cnn(C)c1Br 2091863220 LYDNBHFHQGDGSE-NWDGAFQWSA-N 326.194 1.882 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)Nc1ccc(O)c(N)c1 2227871306 UQCXHUGGEGHWPM-UHFFFAOYSA-N 347.194 1.271 10 10 EDCE CSc1ncc(CNC[C@H]2CNCC(C)(C)S2(=O)=O)s1 2284726044 RXJJMRWVEHLXEC-JTQLQIEISA-N 335.520 1.120 10 10 EDCE O=C1NC(=S)N(c2ccccc2)C(=O)C1=CNN1CCCCCC1 2296925723 XMOUETDSFIOWGG-UHFFFAOYSA-N 344.440 1.699 10 10 EDCE CCOC(=O)CN(C(=O)/C=C/c1cnccn1)c1ccc(F)cn1 491927885 VVBGXYPQRNMBPM-GQCTYLIASA-N 330.319 1.620 10 10 EDCE COC[C@]1(CO)C=CCN1c1ccc(CO)cc1Br 2351779833 YEKQIESLLGVOJP-CQSZACIVSA-N 328.206 1.695 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@@H](F)CN2)c(O)c1Br 2352634302 SNCNPMHSMUWCGJ-ZJUUUORDSA-N 331.185 1.779 10 10 EDCE COC1(C(=O)NCc2ccc(C)c(Br)c2O)CNC1 2352951269 FFTSXDRQPCYNSM-UHFFFAOYSA-N 329.194 1.068 10 10 EDCE O=C1N=C(S)N(C2CC2)C(=O)/C1=C\Nc1cccc(C(=O)O)c1 102522234 AYWPRGVKVXZIAE-XFFZJAGNSA-N 331.353 1.498 10 10 EDCE CNCc1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)cc1Br 1893332588 SMCHYQNTWPOOLE-UONOGXRCSA-N 329.238 1.491 10 10 EDCE CCCS(=O)(=O)Nc1cc(N2CCN(C=O)CC2)ccc1OC 62192181 CSVGEOJYVQDKRH-UHFFFAOYSA-N 341.433 1.125 10 10 EDCE C[C@@H](NCCNC(=O)c1ccn[nH]1)c1ccc(N2CCOCC2)cc1 180224061 ARVBHHVRNYUDFA-CQSZACIVSA-N 343.431 1.327 10 10 EDCE CNC(=O)c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)nn1 74741840 KUMHQRNRUHTIQI-UHFFFAOYSA-N 345.378 1.424 10 10 EDCE C[C@@H]1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)C[C@H](CO)O1 187882092 UPGZNNYRGPUYQI-UNGFOMBNSA-N 346.427 1.145 10 10 EDCE COC(=O)CCN1C(=O)/C(=C2/C(=O)Nc3ccccc32)SC1=S 40937836 QCGJFLPJNDJBLG-QXMHVHEDSA-N 348.405 1.773 10 10 EDCE CCNC(=O)N1CC[C@@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 132138615 STVLHKOIGHVSIW-OAHLLOKOSA-N 347.463 1.698 10 10 EDCE COc1cc(N2CCN(CC(C)(C)O)CC2)c([N+](=O)[O-])cc1OC 325366104 OGJLQHRCBLNNDS-UHFFFAOYSA-N 339.392 1.505 10 10 EDCE COC(=O)CC[C@@H](N)c1ccc(I)cc1O 95782860 BBYONQVXTBAPPE-SECBINFHSA-N 335.141 1.950 10 10 EDCE Oc1cc2c(cc1CN1CCCC[C@H]1CN1CCOCC1)OCO2 93012176 KNZCUSZUEWAXOR-HNNXBMFYSA-N 334.416 1.808 10 10 EDCE CN(C)C(=O)[C@H]1CCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 248092265 YEFFYZDUSYGSKU-QGZVFWFLSA-N 346.475 1.264 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(F)(F)C[C@@H]2CO)c([N+](=O)[O-])c1 368717892 CNAKUSNPEOJXGQ-USEMIUTHSA-N 342.298 1.987 10 10 EDCE Cc1ccc(CN(C)C(=O)N2CC(CN)C2)c(O)c1Br 2381127600 JNXVGTZZNISQTA-UHFFFAOYSA-N 342.237 1.905 10 10 EDCE Cc1ccc(CN2CC(N(C)C3COC3)C2)c(O)c1Br 2381147204 PGGWZTUZTPNSKB-UHFFFAOYSA-N 341.249 1.978 10 10 EDCE CO[C@@H](CS(=O)(=O)N1CCOc2cc(N(C)C)ccc21)C1CC1 567349200 BCRDCZMZYAAEPZ-INIZCTEOSA-N 340.445 1.706 10 10 EDCE CS(=O)(=O)NC[C@H]1CCC[C@H]1NCc1cc([N+](=O)[O-])ccc1O 800310431 ZHTDDGQABGKCDJ-ZWNOBZJWSA-N 343.405 1.108 10 10 EDCE Cc1ccn2ncc(C(=O)NC[C@H](N)c3ccc(N(C)C)cc3)c2n1 832280288 ORHRDFPELLGNSG-INIZCTEOSA-N 338.415 1.534 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC(F)(F)C[C@H]2CO)cc1 839574854 OYQKFHHRPLGHDZ-AWEZNQCLSA-N 327.375 1.071 10 10 EDCE NCC(F)(F)CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 846672754 KRLDIHDCNCDIGI-UHFFFAOYSA-N 345.365 1.387 10 10 EDCE CC[C@@]1(COC)NC(=O)N([C@@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849356958 INASBVRULFPDHK-KDOFPFPSSA-N 347.415 1.621 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NCC[C@@]2(O)CCOC2)cc1 844899134 UAMDWBKARNCKEB-GOSISDBHSA-N 335.448 1.874 10 10 EDCE C[C@H](NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@@H]1[C@H]2CN[C@H]1C2 925777330 MMRUWCNENYOLSQ-KRDRHDLTSA-N 342.487 1.474 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc(OC)n(C)n3)C2)cc1 855224574 FZVKDDDQZVUJEM-GFCCVEGCSA-N 330.388 1.446 10 10 EDCE O=C(NCc1c(O)cccc1F)NC[C@H]1CCCS(=O)(=O)C1 922482506 MYASJJSJHQNYHL-SNVBAGLBSA-N 330.381 1.155 10 10 EDCE C[C@H](C(=O)NCc1c(O)cccc1F)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 928708216 DYJFUGFZPCKDBB-IJLUTSLNSA-N 348.374 1.711 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H]4COC[C@@]4(C)C3)C2)cc1 852450659 RBSOGRSTYUENEW-YZVOILCLSA-N 345.443 1.952 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@H](C)N(C)C)C2)cc1 854295938 FCALXDSJXUMYKE-LSDHHAIUSA-N 334.464 1.913 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3nnn(C(C)(C)C)n3)C2)cc1 855224500 KZVDBQAHXPPDMJ-LBPRGKRZSA-N 344.419 1.445 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@@H](C)CCO)C2)cc1 854296645 FMQOFOBZCINLOU-HUUCEWRRSA-N 335.448 1.982 10 10 EDCE O=C(NCC1(OCCO)CCC(F)(F)CC1)c1cccc(O)c1O 862743196 NPJHPCJAUXSPTA-UHFFFAOYSA-N 345.342 1.785 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@@H](C)C(N)=O)C1 769662544 DTJCKOLDUBWHOI-ZDUSSCGKSA-N 343.427 1.825 10 10 EDCE COC(=O)c1cc(OCC(=O)N2CCO[C@@H](C)C2)ccc1N(C)C 865396619 WKUJGFRLNROPSJ-LBPRGKRZSA-N 336.388 1.165 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3ncc[nH]3)C2)cc1 868762624 RCGBYMDFYLFZKR-CYBMUJFWSA-N 329.404 1.839 10 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CCN(CC)c1ccc(CNC(=O)NC[C@@H]2COCCN2C)cc1 1261788294 QYNGKIIHTGTXCG-QGZVFWFLSA-N 334.464 1.663 10 10 EDCE COCCNC[C@@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1278015393 DVWAIHGUKMWTSK-AWEZNQCLSA-N 333.392 1.690 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2cn(C)nn2)cc1C 1283605764 JUVFGWGFMXMJJX-ZDUSSCGKSA-N 331.420 1.382 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)C2CN(C(C)=O)C2)cc1C 1507070931 NSQXQOZWUIZGEI-CQSZACIVSA-N 347.459 1.418 10 10 EDCE Cc1nnc2n1[C@@](C)(C(=O)NCc1ccc(N(C)C)cc1)COC2 1548341692 IPQSPOMGZSXCNM-QGZVFWFLSA-N 329.404 1.214 10 10 EDCE Cn1c(=O)n(C)c2cc(NC(=O)Cc3ccc(O)c(O)c3)c(O)cc21 1556869629 NKBAYDQMDXOGQD-UHFFFAOYSA-N 343.339 1.175 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC(c3nc[nH]n3)CC2)cc1 1557595416 YNTNDRISFPRNTF-UHFFFAOYSA-N 327.348 1.987 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2nc(-c3cnccn3)no2)c1 1630366614 SACXDHHFBBWUHY-SECBINFHSA-N 341.327 1.732 10 10 EDCE CCC[C@H](C)C(=O)N1CC[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1737432757 PPOYIENBMGCNED-JSGCOSHPSA-N 349.431 1.866 10 10 EDCE CN(CC(C)(C)CNCCCO)C(=O)c1ccc(N=NC(N)=O)cc1 1734025200 MNVKCCJFSOYGRE-UHFFFAOYSA-N 349.435 1.919 10 10 EDCE O=C(CNC(=O)Cc1ccccc1)NCc1ccc2cccnc2c1O 1643283284 OIFMTRAKEDVSGI-UHFFFAOYSA-N 349.390 1.916 10 10 EDCE C[C@H](NC(=O)Cc1nc(C2CCOCC2)n[nH]1)c1ccccc1O 1587451054 GLZPHAMJMRIRHK-NSHDSACASA-N 330.388 1.824 10 10 EDCE O=C(Nc1ccc(CN2CCOCC2)cn1)c1cccc(O)c1O 1650926670 MZXPRDPBPCEZQU-UHFFFAOYSA-N 329.356 1.577 10 10 EDCE CNc1nccc(C(=O)NCc2cccc(OC)c2O)c1[N+](=O)[O-] 1595800153 QONNLSNMQJIMPU-UHFFFAOYSA-N 332.316 1.676 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)CN(C)C(C)=O)C2CC2)cc1C 1690143211 QIZCEPZZWNBZJT-KRWDZBQOSA-N 347.459 1.466 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)Cn3cncn3)C2)cc1C 1691478794 OQRBXXGBQKEYKK-IYBDPMFKSA-N 343.431 1.280 10 10 EDCE COCCNCc1ccc(N2CC[C@H](O)C2)cc1Br 234694411 QRMIDSRXEFSHNC-ZDUSSCGKSA-N 329.238 1.756 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](O)C(C)(C)N 1951507019 LGPKJMBPMLNOCZ-RISCZKNCSA-N 340.420 1.632 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](N3CC(O)C3)C2)cc1Br 2158744247 SOHWUJAAFIYFGD-ZYHUDNBSSA-N 340.265 1.724 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@@H]2OCC[C@H]2N1C(=O)OC(C)(C)C 2010389791 UZGBZLKKBLXWIH-WOPDTQHZSA-N 339.396 1.922 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2010388723 GFETZEMKBDWKKE-NEPJUHHUSA-N 340.428 1.600 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CCC(=O)NCC1(CN=[N+]=[N-])CC1 2010401097 AZWKWTHETLXDLH-LLVKDONJSA-N 341.412 1.859 10 10 EDCE CNCc1ccc(N2C[C@H](O)C[C@H]2CN(C)C)cc1Br 300494513 PUXMIFXKEXGRQA-UONOGXRCSA-N 342.281 1.670 10 10 EDCE CS(=O)(=O)N[C@@H]1CCN(c2ccc(CO)c(Br)c2)C1 702985977 WSFUAQBEXHBBTN-SNVBAGLBSA-N 349.250 1.069 10 10 EDCE CN(C)C[C@@H](O)CN(C)c1cc(Br)c(CN)cc1F 690204575 OQQMCNLDGNNNGO-SNVBAGLBSA-N 334.233 1.406 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)cc1Br 2178087061 OYPBZGSEPPCXSQ-NRWDQBFYSA-N 342.233 1.946 10 10 EDCE CN(C(=O)CN(C)C1CN(C(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2044592656 AFRPHHQODJBYPN-UHFFFAOYSA-N 348.447 1.783 10 10 EDCE Cc1ccc(N(C)C(=O)C2=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C2)cn1 2080944480 YNFMUKWJJCMZEO-CABCVRRESA-N 347.415 1.937 10 10 EDCE O=C(NCCc1conc1Br)c1ccc(O)c(O)c1 2230540253 BUAUGZKESRHJIT-UHFFFAOYSA-N 327.134 1.821 10 10 EDCE COc1ccc(Br)c(CNC[C@]2(C)CCNC2=O)c1O 2236054269 GUASMOPHVGGPDI-AWEZNQCLSA-N 343.221 1.779 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](CO)C[C@@H](CO)C2)c(Br)c1 2236633504 AOQWGOAINJUKTC-IJLUTSLNSA-N 344.249 1.930 10 10 EDCE COc1cccc(C=C2SC(N3CCN(C)CC3)=NC2=O)c1O 2293735592 MOOFOXMGUIYONL-UHFFFAOYSA-N 333.413 1.619 10 10 EDCE C[C@@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C[C@H]1CO 2311665630 BTHRQVJAERYDGC-WBVHZDCISA-N 330.428 1.623 10 10 EDCE C[C@H](NC(=O)CN1C(=O)C(=Cc2ccco2)SC1=S)C(=O)O 2314827654 JQMABCMYYSNKIL-ZETCQYMHSA-N 340.382 1.070 10 10 EDCE CC(C)C1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1326840281 FRZSFXQDQGISAN-UHFFFAOYSA-N 327.428 1.793 10 10 EDCE Cc1ccc([C@@H](C)NC[C@@]2(CO)COCC3(CCC3)N2C)c(O)c1 527956545 PYNDAXCJJSGAOS-DNVCBOLYSA-N 334.460 1.967 10 10 EDCE Cc1ccc(CNC(=O)C[C@H]2COC[C@@H]2N)c(O)c1Br 2380751839 OYRVOLVSEUVOTN-QWRGUYRKSA-N 343.221 1.443 10 10 EDCE C[C@@H]1C[C@@H]1N(CCO)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2167110378 VRVYDAPCQZOJTC-RESLBDFXSA-N 341.205 1.642 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)OC(C)(C)C 808539087 QLSWXLJCOYUKPY-JQWIXIFHSA-N 327.377 1.723 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@](C)(O)CO)CCCC1 651961286 VVXCXGWRVCPRBY-IBGZPJMESA-N 346.427 1.388 10 10 EDCE C[C@H](NC(=O)[C@@]1(C)C[C@H](O)CN1C)c1ccc(N2CCOCC2)cc1 900386821 HUCCZCXVKSYQHE-UCLAIMLFSA-N 347.459 1.156 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)/C=C\Cn1cncn1 910559967 YUORADLGJQXYHQ-YVACAVLKSA-N 327.432 1.956 10 10 EDCE C[C@@H]1C(=O)N(CCN(C)C)CN1Cc1cc(Cl)c(F)cc1O 843428726 MHXXWIOUVBHUOA-SNVBAGLBSA-N 329.803 1.737 10 10 EDCE CCN(C)S(=O)(=O)NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 853110258 MRWJTTPQSUNKJN-UHFFFAOYSA-N 349.456 1.949 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCCn3ccnn3)C2)cc1 852251465 WOTIZVJZGSHTBZ-AWEZNQCLSA-N 344.419 1.255 10 10 EDCE OC[C@@]1(CNCc2ccccc2O)COCCN1Cc1ccccc1 850396627 ZMHAINUOGPWDNO-FQEVSTJZSA-N 342.439 1.745 10 10 EDCE CC(C)(C)OC(=O)COCC(=O)NCc1ccc2cccnc2c1O 862024829 IFBDUBULYCZQKI-UHFFFAOYSA-N 346.383 1.915 10 10 EDCE COC(=O)[C@@]12C[C@@H](N3C(=O)CN(Cc4ccccc4O)C3=O)C[C@@H]1C2 865323874 DOYZJWWLBUQXCD-VBHSOAQHSA-N 344.367 1.498 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3[C@@H]4CCCO[C@@H]43)CC2)cc1F 780625192 YSDHKGUCWOWYRU-XKQJLSEDSA-N 334.391 1.908 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@@]4(CNC(=O)C4)C3)cc2)CC1 789767743 JLGQBXLXIQPZTM-LJQANCHMSA-N 328.460 1.150 10 10 EDCE COc1cc(C)cc(CN[C@H]2CCC[C@@H]2CNS(C)(=O)=O)c1O 894671770 CJZKDIMGIDZGSV-OCCSQVGLSA-N 342.461 1.517 10 10 EDCE COc1ccnc(N2CCN(Cc3cc(F)cc(F)c3O)CC2)n1 893928310 PNOUGJYMULNVFE-UHFFFAOYSA-N 336.342 1.791 10 10 EDCE CS(=O)(=O)c1cc(C(=O)NCc2cc(O)ccc2O)ccc1F 1153885023 JHHAPWVRYUWONH-UHFFFAOYSA-N 339.344 1.570 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CCS(=O)(=O)c2ccccc21 1303225313 FXFRFHYPJAWWGJ-CQSZACIVSA-N 347.392 1.675 10 10 EDCE CCNC(=O)CN(C)[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1329628253 PJBULJXFEMPYLU-NSHDSACASA-N 348.407 1.035 10 10 EDCE CN(c1ccc(CN)c(Br)c1F)[C@H]1CCC(=O)NC1 2127091674 SSFRAFHSBUYWRS-VIFPVBQESA-N 330.201 1.762 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2ccn(C)c2)cc1C 1332503362 GGHDUMMKULKSDE-KRWDZBQOSA-N 345.443 1.565 10 10 EDCE CNCc1ccc(N2CCC[C@H]2[C@@H](O)CO)c(Br)c1 2123223997 XDAQRSNZIVMWQC-KBPBESRZSA-N 329.238 1.491 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)C[C@H]2CCC(=O)N2)cc1C 1268409573 ZVBMSQHFJIUQHS-GOEBONIOSA-N 347.459 1.657 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1cc(C)ccc1O)C1CCOCC1 1261797102 WVWHTCIJXKSNIW-MRXNPFEDSA-N 343.445 1.562 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)CCc2nc[nH]n2)cc1C 1277793301 OWKGLFMRYMMSEH-CQSZACIVSA-N 345.447 1.691 10 10 EDCE CCCOCC(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1466398772 SHADWNRFSDNYCZ-UHFFFAOYSA-N 329.780 1.974 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCCc1nnc2n1CCCCC2 1543495215 ZJJFPTCTRLDPTF-UHFFFAOYSA-N 344.415 1.707 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3nccnc3N)CC2)cc1C 1716677927 NYIANBCRHCEFQR-UHFFFAOYSA-N 341.415 1.428 10 10 EDCE O=C1C[C@](C(=O)NCc2ccc(O)cc2O)(c2ccccc2)CN1 1626850235 SCRDZNITSPZHDU-GOSISDBHSA-N 326.352 1.172 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H](C)NC(C)=O)CCC2)cc1C 1724781064 RVRVTQYCGKYKND-CQSZACIVSA-N 347.459 1.657 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3ccc(O)nn3)CC2)cc1C 1499155063 RFJZORNIHVEMIU-UHFFFAOYSA-N 342.399 1.551 10 10 EDCE CCOC(=O)C1(CC(=O)NCc2c(O)cccc2O)CCOCC1 1635847488 OPUOOALZYKFQDU-UHFFFAOYSA-N 337.372 1.464 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)Cc2cc[nH]n2)cc1C 1568264737 MNMVMWHSVJGPCF-AWEZNQCLSA-N 330.432 1.906 10 10 EDCE C[C@@H](O)CNC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(C)(C)C 1649473766 QLYSBHANNKBLIL-RISCZKNCSA-N 349.435 1.964 10 10 EDCE CC[C@@H]1C(=O)NCCN1c1ccc(CN)c(Br)c1F 231840009 WSSOLUUSXCSWBV-SECBINFHSA-N 330.201 1.762 10 10 EDCE CCOC(=O)c1cc(CNC(=O)N2Cc3cccc(O)c3C2)on1 1675392904 AVYLDRPBOAHZKK-UHFFFAOYSA-N 331.328 1.782 10 10 EDCE CO[C@@H](C)C(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1689439582 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330.178 1.686 10 10 EDCE CO[C@H]1C[C@H](CO)N(c2ccc(CN)c(Br)c2F)C1 389126296 SGRMIUNELGNVSC-ZJUUUORDSA-N 333.201 1.633 10 10 EDCE C[C@@H](O)[C@H]1CCCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2193600671 ZOCAZPYTPVTWIA-TWPQKTAQSA-N 340.221 1.751 10 10 EDCE NCc1ccc(N2CCN(C(=O)C3CC3)CC2)cc1Br 2182587076 FFIOJJCGTIEZFA-UHFFFAOYSA-N 338.249 1.966 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](CO)C[C@H]2CO)c(Br)c1 2089863105 HCSGPJONNQDXIF-FOGDFJRCSA-N 330.222 1.682 10 10 EDCE CN[C@@H](c1ccccc1O)[C@H](O)c1cc(Br)nn1C 2091864201 RWQFRWSWFIJUSD-QWHCGFSZSA-N 326.194 1.882 10 10 EDCE CN1CCO[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@H]21 2097750568 JLDQDVFMZWMZDQ-TZMCWYRMSA-N 327.222 1.670 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@@H](C(=O)O)C2)c1O 2236036242 BMPSTZBATJLZSF-LLVKDONJSA-N 346.177 1.449 10 10 EDCE NCc1ccc(N2C[C@H]3OCCC[C@]3(CO)C2)cc1Br 2238821277 UMIUNVITLKOIGB-HUUCEWRRSA-N 341.249 1.886 10 10 EDCE CCNC(=O)C1CN(c2ccc(C=CC(=O)OC)cc2[N+](=O)[O-])C1 2297786533 RXELHJLRPKHESS-UHFFFAOYSA-N 333.344 1.353 10 10 EDCE Cc1ccc(Cl)cc1N(C)C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 492974723 RUYXNEGODUQGQE-VURMDHGXSA-N 347.802 1.722 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2NC(=O)COc1ccc(N)cc1 2311832608 PJNLOZACAXUMLG-HZUKXOBISA-N 347.415 1.772 10 10 EDCE Cc1ccc(CNCC(=O)NCC(F)F)c(O)c1Br 2352677694 BXDXTFQPAZXFIX-UHFFFAOYSA-N 337.164 1.934 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2354486488 YPHVDERAVJLPHU-KBZKQINZSA-N 341.249 1.660 10 10 EDCE COc1ccc(CNC2(CNC(=O)C[C@@H]3COC(=O)C3)CC2)cc1C 1277036750 OCUNPCSWRNEVHL-HNNXBMFYSA-N 346.427 1.695 10 10 EDCE O=C(O)COc1cccc(/C=C2/SC(=S)N(CCO)C2=O)c1 210388056 DRGUPGOOWJUZNO-YRNVUSSQSA-N 339.394 1.344 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N1CCC2(C1)OCCO2 254971183 LAUUMMGRCQXNCW-UTCJRWHESA-N 344.411 1.512 10 10 EDCE Cc1ccc(CNc2cc(=O)n(C)c(O)n2)c(O)c1Br 2380739908 PJIBNHCLMGPHSG-UHFFFAOYSA-N 340.177 1.875 10 10 EDCE C[C@H](C[S@@](C)=O)N(C)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 398920874 LHTZIARHPNXUCW-ZYQSZCDCSA-N 326.374 1.896 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](C(C)C)n1nnc(-c2ccccc2)n1 808508261 XXCWIURQRJRCTL-CQSZACIVSA-N 330.344 1.239 10 10 EDCE COc1ccc(N2CC[C@H](CNc3cncc(C(N)=O)n3)C2)cc1 819934915 ILIILLKSAQCEFL-GFCCVEGCSA-N 327.388 1.523 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)c3cnn(C)c3OC)C2)cc1 819588500 WLUYBMVRGPBFHT-CYBMUJFWSA-N 344.415 1.694 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@@H]2CCc3nnc(C4CC4)n3C2)c1 815835317 PHKIZFADAFAMBU-GFCCVEGCSA-N 342.399 1.749 10 10 EDCE O=C(NCCCSc1nccs1)c1cn([C@@H]2CC[C@H]2O)nn1 900683224 LUDFQKRCWVZNMA-GHMZBOCLSA-N 339.446 1.343 10 10 EDCE C/C(=C\C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)CN1CCOCC1 907271623 BQLNKHBQXXMXKQ-KADHNRKRSA-N 334.416 1.424 10 10 EDCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)[C@@H](O)C1CC1 831560798 FNPSXQSAMKUCLE-IBGZPJMESA-N 343.471 1.606 10 10 EDCE CN(C[C@H](O)CN1CCOCC1)c1ccc(-c2nccs2)cc1 846994350 VNRJJSIYBZXURI-INIZCTEOSA-N 333.457 1.939 10 10 EDCE COC[C@H]1C(=O)N[C@H](c2cc(Br)cc(OC)c2O)N1C 840829060 MUXBEMLQKOQPSQ-CABZTGNLSA-N 345.193 1.239 10 10 EDCE COC(=O)[C@]1(OC)CCN(Cc2cc(F)cc(C(C)=O)c2O)C1 859558954 SWQHWHGCRRCIED-INIZCTEOSA-N 325.336 1.498 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3(N)CCCC3)C2)cc1 851671720 PMCRWTSOWWBKAT-CQSZACIVSA-N 332.448 1.845 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3C=C[C@H](CO)C3)C2)cc1 852193519 QJWNZPCONBCNFK-RRFJBIMHSA-N 331.416 1.510 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NC[C@@H](C)CC(F)F)cc1 853010377 BCLARFRWOOVPCF-NSHDSACASA-N 344.358 1.994 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc4nn[nH]c4c3)C2)cc1 855229817 RBXMMKYKBLGPKF-CYBMUJFWSA-N 337.383 1.975 10 10 EDCE C[C@H](NC(=O)CS(=O)(=O)NC(C)(C)C)c1ccc(N(C)C)cc1 773024727 NNNRBONPHTVHBQ-LBPRGKRZSA-N 341.477 1.648 10 10 EDCE C[C@@H]1O[C@H](C)CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@H]1C 785427592 DDWUGPVNNGXBMW-RDBSUJKOSA-N 333.432 1.393 10 10 EDCE COc1cnccc1N1CCN(Cc2cc3c(cc2O)OCO3)CC1 793372214 ZTISTEUPWKJUOS-UHFFFAOYSA-N 343.383 1.847 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1(CO)CN(C(=O)OC(C)(C)C)C1 1900613128 UAORVRARDGYUHV-UHFFFAOYSA-N 327.385 1.375 10 10 EDCE CC[C@H](CNC(=O)c1cnn(C)c1N)NCc1ccc(OC)c(C)c1 1267800696 VHFOZIQYNGEEBT-CQSZACIVSA-N 345.447 1.618 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCOC[C@H]1C 1261119204 JDLZXWJUFPAUTK-HIFRSBDPSA-N 334.416 1.672 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)Nc2ccc[n+]([O-])c2)cc1 1347837875 ZUGBCKCMDDYQHI-UHFFFAOYSA-N 330.388 1.929 10 10 EDCE CC(C)(F)C(=O)NC[C@@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1505587515 YRNMCJZEMWVTJU-LBPRGKRZSA-N 349.366 1.928 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@H]2CC2(F)F)cc1C 1284399818 IQMNBVKAPDPJRO-UONOGXRCSA-N 342.386 1.568 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C(C)(C)C(N)=O 1915544458 LTBLSNOUIWEUSZ-SNVBAGLBSA-N 342.193 1.135 10 10 EDCE CNS(=O)(=O)c1ccc(C)c(NC(=O)c2cc(O)cs2)c1 1291552685 UJRHHDOVDXZQCD-UHFFFAOYSA-N 326.399 1.923 10 10 EDCE Cc1sc2ncc(C(=O)NCc3ccc(O)cc3O)c(=O)n2c1C 1451772464 WKNNEXXTQAWTRP-UHFFFAOYSA-N 345.380 1.714 10 10 EDCE CO[C@H](C)C(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1534213852 KQRMPHSAPRXWCN-VHSXEESVSA-N 335.364 1.118 10 10 EDCE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C1(O)COC1 1542703884 GMCYFHAMWFJNFS-UHFFFAOYSA-N 342.342 1.134 10 10 EDCE O=C(N[C@@H]1CC[C@H](O)[C@H](O)CC1)c1cc2cc(O)c(O)cc2s1 1471952900 GLORCEPUHCOIKR-JGPRNRPPSA-N 337.397 1.707 10 10 EDCE C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@@H](C)NC(=O)C1CC1 1701115886 NEDRSFMXXMEMAH-NXEZZACHSA-N 331.376 1.882 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2cncnc2O)cc1C 1715338760 MWOHJVPVQFLXKY-CYBMUJFWSA-N 344.415 1.750 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](N3CCOC3=O)C2)cc1 1557386284 FLRLFLTVFKRZDU-GFCCVEGCSA-N 331.332 1.516 10 10 EDCE COC[C@]1(C(=O)OC)CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1632809864 NVKJFLJHCMAYBG-INIZCTEOSA-N 348.359 1.643 10 10 EDCE COc1ccc(CNCC[C@H]2CCN(C(=O)c3cnn[nH]3)C2)cc1C 1569988809 VQBQMYPSPGIGNJ-AWEZNQCLSA-N 343.431 1.764 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)CNC(C)=O)C(C)C)cc1C 1568441719 GZWGTJXKDQOKJJ-MRXNPFEDSA-N 335.448 1.370 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@H]2CCN(C)C2)cc1C 1568964035 NBAYRLCFAJWMLS-CHYADLBTSA-N 331.460 1.717 10 10 EDCE C[C@H]1OCC[C@@]12CN(C(=O)c1ccc(N=NC(N)=O)cc1)CCO2 1568618808 OAPPQYYREALMAM-BDJLRTHQSA-N 332.360 1.869 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cc(C)no2)cc1C 1571573443 KJWGIFNOLJDPPJ-OAHLLOKOSA-N 347.415 1.523 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@H](C)n2cccn2)cc1C 1734359913 COLBAEIQHYLYMK-HOCLYGCPSA-N 346.431 1.028 10 10 EDCE Cc1cccc([C@H]2C(=O)NCCN2C(=O)Cc2ccc(O)c(O)c2)c1 1585509764 WWGZVVOWDNOLFN-SFHVURJKSA-N 340.379 1.648 10 10 EDCE CCNC(=O)c1cccc(CNC(=O)Cc2ccc(O)c(O)c2)c1 1596129426 JAECHVLQZAAPJE-UHFFFAOYSA-N 328.368 1.706 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC(NCCO)CC2)c([N+](=O)[O-])c1 159427025 GMCHTZPGFRYOKI-HWKANZROSA-N 349.387 1.332 10 10 EDCE CN(CCc1ccncc1)C(=O)CNCc1ccc(N(C)C)cc1 1857865667 YPJYJXHGFIPGIC-UHFFFAOYSA-N 326.444 1.938 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1990023492 ZEINHSVUGIVLKJ-WDEREUQCSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CN2C(=O)c1cccc(O)c1O 2006282269 YRSHKCKHCZCHJU-MNOVXSKESA-N 334.372 1.932 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H](COCc1ccccc1)C(=O)O 2034492007 VCEGAFFKAZQANJ-CQSZACIVSA-N 345.351 1.427 10 10 EDCE CN[C@H](C)c1ccc(N2CC(=O)NC(=O)[C@@H]2C)cc1Br 300519956 UZONGMYWVMSGPY-BDAKNGLRSA-N 340.221 1.581 10 10 EDCE CN(Cc1cc(Br)cn1C)C(=O)c1cc(O)nc(O)c1 2171139526 HQFCIMDSXKIZHW-UHFFFAOYSA-N 340.177 1.866 10 10 EDCE OCc1ccc(N2CCC[C@H](CO)[C@H]2CO)cc1Br 710091397 OCOLNCAUHKBRCA-BXUZGUMPSA-N 330.222 1.511 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@H]2O 2174415109 XSTITNZOLDXURF-VHKOSHJNSA-N 342.233 1.622 10 10 EDCE CN(C[C@H]1COCCO1)c1ccc(CN)c(Br)c1F 2087371037 GXWGLYVTOVMPCG-JTQLQIEISA-N 333.201 1.899 10 10 EDCE CC(C)(C)OC(=O)NCCCn1cnc(C(=O)NCCN=[N+]=[N-])c1 2213258857 UUPBZOIXLNHMMQ-UHFFFAOYSA-N 337.384 1.838 10 10 EDCE COc1ccnc(Br)c1NC(=O)c1cc(O)nc(O)c1 2235441463 JONSEYADAXJNJS-UHFFFAOYSA-N 340.133 1.911 10 10 EDCE CCCS(=O)(=O)N(C)Nc1nc(Cl)c(C(N)=S)s1 2317437260 JKFIPTSHPUZDQO-UHFFFAOYSA-N 328.872 1.429 10 10 EDCE CN[C@H](c1ccccc1O)[C@H](O)c1nc(Br)cn1C 2353756841 LVYKZUCHJGXHAT-NEPJUHHUSA-N 326.194 1.882 10 10 EDCE CN1CCN(c2ccc(CN3CC4(C3)CN(C)C(=O)O4)cc2)CC1 1348635017 ZMLBWOCQHQQETJ-UHFFFAOYSA-N 330.432 1.075 10 10 EDCE NC(=O)c1cncc(NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 301442493 NOOUUAGKKPMKIO-UHFFFAOYSA-N 345.378 1.288 10 10 EDCE Cc1cc(C(=O)N2CC[C@@H](CO)[C@@H](O)C2)c(C)n1-c1ccccc1 191981354 HXZPFIRNAFQRQT-YJBOKZPZSA-N 328.412 1.909 10 10 EDCE CCN(CC)c1ccc(CNCC2CN(S(=O)(=O)CC)C2)cc1 190289510 HLYPDQPMHJMHCH-UHFFFAOYSA-N 339.505 1.904 10 10 EDCE C[C@H]1CN(S(=O)(=O)NCc2ccc(N(C)C)cc2)[C@@H](C)CO1 246057862 DBKIBSKQBZHPFW-STQMWFEESA-N 327.450 1.196 10 10 EDCE COC[C@H](O)CN(C)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255919648 QKISMPHCALXDAF-CTEOGUNLSA-N 334.416 1.002 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)c3cccc(N)c3)CC2)cc1 274346855 CLPMUTMJWLXRJY-UHFFFAOYSA-N 347.440 1.788 10 10 EDCE C[C@H](NC[C@@H]1CCC[C@]12NC(=O)N(C)C2=O)c1ccc(F)cc1O 363846395 CITSMKJHSDIOBM-DINDLPBHSA-N 335.379 1.902 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)OC(C)(C)C 808539088 QLSWXLJCOYUKPY-PWSUYJOCSA-N 327.377 1.723 10 10 EDCE O=C(CCc1nc[nH]n1)NCc1cc(Br)ccc1O 804738300 KWDBVBZUFHNTHF-UHFFFAOYSA-N 325.166 1.522 10 10 EDCE CSc1ccc(N2C[C@H](C(=O)OCC(=O)C(C)=O)CC2=O)cc1 808500666 VHUVMJPDDFGEBW-LLVKDONJSA-N 335.381 1.463 10 10 EDCE COc1ccc(O)c(CNC(=O)C(=O)Nc2cn(C)nc2C2CC2)c1 812967405 YHCVPYVWBZWUKF-UHFFFAOYSA-N 344.371 1.267 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1c2n(c(=O)n1C)CCCC2 828884961 PJPUFGDKWSEGHZ-NSHDSACASA-N 345.399 1.295 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN(CCO)[C@@H]2CCO[C@@H]2C)c1O 825129823 FZWVDNJXBAXBHO-ZYHUDNBSSA-N 326.349 1.281 10 10 EDCE CN(C)c1ccc(CNC(=O)c2coc3c2C(=O)NCCC3)cc1 905316778 DKFXQFZYUTYEBI-UHFFFAOYSA-N 327.384 1.952 10 10 EDCE Cn1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)nc1O 829265225 YNUGFGZAIXBUEP-UHFFFAOYSA-N 348.378 1.156 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(C)(C)O 738977579 SJZYNWGNHSJEBD-GFCCVEGCSA-N 339.411 1.621 10 10 EDCE CN(C)c1ccc(/C=C\CNCCCN2CCC[C@H](C(N)=O)C2)cc1 835037770 MREHBVDCGKCWBA-CJISVDGZSA-N 344.503 1.943 10 10 EDCE CCN1CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1=O 588587033 AEOYBAOMVZSHNO-YVMONPNESA-N 329.400 1.185 10 10 EDCE O=C(NCC1CC1)[C@@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 588403682 VSGZEXOPLTXNQO-DDJMYBDESA-N 344.411 1.876 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cc2c([nH]1)CCOC2 837361201 YNZNTZJGGQICBN-UHFFFAOYSA-N 341.411 1.854 10 10 EDCE NC/C=C/CNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 841915479 QLMHNNKXHKTGRY-OWOJBTEDSA-N 340.374 1.116 10 10 EDCE COC1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 843534472 LRNHBZVMPZIJNO-AWEZNQCLSA-N 331.416 1.184 10 10 EDCE COC(=O)C[C@@H](C)CC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855226692 PWYVPXWZCKLCAZ-UONOGXRCSA-N 334.416 1.979 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc4nn[nH]c4n3)C2)cc1 855225536 KHPSXUSDXOOWGM-NSHDSACASA-N 338.371 1.370 10 10 EDCE C[C@@H](NC(=O)[C@H](C(=O)O)C1CC1)c1ccc(N2CCOCC2)cc1 852950867 MYXARMNKMKXUIB-MLGOLLRUSA-N 332.400 1.811 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC(N3CC[C@H](O)C3)CC2)cc1 853244197 GUNKOZNADLIKLQ-SFHVURJKSA-N 346.475 1.493 10 10 EDCE COC(=O)C1(CS(=O)(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 867126292 WUQSVSRUPCGFFD-LBPRGKRZSA-N 340.445 1.686 10 10 EDCE CN1CC[C@@H]2CN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC[C@@H]21 866205418 LODBYCNPMYKYQV-PWSUYJOCSA-N 332.360 1.456 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H](C[C@@H]3CCCOC3)C2=O)cc1 863500219 QJAWWBZRCCZWEG-HOCLYGCPSA-N 331.416 1.990 10 10 EDCE COc1ccc(N2CCC(NC(=O)c3cc(C=O)n(C)n3)CC2)cc1 931578446 UYCFFLLVSHEZSM-UHFFFAOYSA-N 342.399 1.640 10 10 EDCE C[C@@H](NS(=O)(=O)c1cnc(O)s1)c1ccc(N(C)C)cc1 867125844 NQYJGFGZOLITOB-SECBINFHSA-N 327.431 1.954 10 10 EDCE C[C@H](NC(=O)N1CCS(=O)(=O)[C@H](C)C1)c1ccc(N(C)C)cc1 773619085 QUDYLPOEGYTYJU-OLZOCXBDSA-N 339.461 1.642 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H](C(=O)N2CCCC2)C1 779517346 QBCFXXAHLKBBAM-DDJMYBDESA-N 344.411 1.972 10 10 EDCE Cc1cc(C(=O)Nc2c(Cl)ccc3nonc23)ncc1C(N)=O 1128607974 ZWLAURACHXTWSL-UHFFFAOYSA-N 331.719 1.931 10 10 EDCE COC(=O)[C@@H](CCF)NC(=O)c1cc2cc(O)c(O)cc2s1 898273476 ZDBMKCCQUJKGLV-MRVPVSSYSA-N 327.333 1.944 10 10 EDCE COC(=O)[C@@H](NCc1c(O)ccc(Cl)c1F)c1ccn(C)n1 792179063 FMAPXHSCJHJZES-ZDUSSCGKSA-N 327.743 1.922 10 10 EDCE COC[C@](C)(CO)N(C)c1ccc(CN)c(Br)c1F 689780726 ODTBOHNREQVPPD-ZDUSSCGKSA-N 335.217 1.881 10 10 EDCE C[C@H]1CN(Cc2ccc(Br)cc2O)CCS1(=O)=O 707516057 COLHDZZMDHZTDV-VIFPVBQESA-N 334.235 1.774 10 10 EDCE CNCc1ccc(N2CC[C@H](S(C)(=O)=O)C2)cc1Br 2123324820 WHXRBAXBQMSAMX-LBPRGKRZSA-N 347.278 1.792 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)[C@@H]2CC2(F)F)cc1C 1326023628 XZMDTHUVCVOSBH-AWEZNQCLSA-N 342.386 1.569 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)c(Br)c1 2126153330 OOXGCAWVGHJIEV-IOQCUFBNSA-N 327.222 1.086 10 10 EDCE O=C(NCc1c(O)cccc1F)N[C@H]1CCN(c2cc(O)ncn2)C1 1251451222 SBODZEXSUVJZMX-JTQLQIEISA-N 347.350 1.105 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1CCN1C1CCCC1 1331590153 JCNFPGDYOZJERU-INIZCTEOSA-N 345.443 1.484 10 10 EDCE CC(C)n1cc(CNC(=O)N[C@H](C)c2ccccc2O)c(O)nc1=O 1251691804 XYRYSMJZQJNLEN-LLVKDONJSA-N 346.387 1.796 10 10 EDCE CN[C@H](C)c1ccc(N2CC(CO)(CO)C2)c(Br)c1 1914971061 NJBMOWZYJNDTRI-SNVBAGLBSA-N 329.238 1.521 10 10 EDCE Cc1cc(CN2CCCN(C(=O)Cc3ccc(O)c(O)c3)CC2)no1 1292575221 WWUNJTCRCHKWHC-UHFFFAOYSA-N 345.399 1.671 10 10 EDCE C[C@H](NC(=O)[C@@H]1CN(C(=O)C(C)(C)C)CCO1)c1ccccc1O 1454815512 GLHUDAQOLOWEEO-WFASDCNBSA-N 334.416 1.843 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCCC(N)=O 1469231839 ZCVNQPZTDWHMPR-UHFFFAOYSA-N 336.388 1.330 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2coc(C)n2)cc1C 1700938380 QGMZXGGGLGGPJJ-OAHLLOKOSA-N 347.415 1.523 10 10 EDCE C[C@@H]1C[C@@H]1C(=O)NCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1704181353 NXWBOZSPFGHAEO-MFKMUULPSA-N 331.376 1.693 10 10 EDCE COc1ccc(CNCC[C@H]2CCN(C(=O)CC(N)=O)C2)cc1C 1700053887 OGVRMJCTUZPEAB-AWEZNQCLSA-N 333.432 1.207 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@@H](C)CNC(=O)C(C)C)cc1 1482080300 JHDWJYBVSCXGII-CYBMUJFWSA-N 346.435 1.169 10 10 EDCE O=C(N[C@H](Cc1ccccc1)c1nc(O)n[nH]1)c1cccc(O)c1O 1631927971 DSQYDFPGITXOGW-GFCCVEGCSA-N 340.339 1.635 10 10 EDCE CC(C)(C[C@@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1)C(N)=O 1635896771 DGIMFACCNDPSBP-ZDUSSCGKSA-N 334.416 1.781 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H](CCO)C2CCOCC2)cc1 1638132957 GDBIJLWJTMWEJJ-CQSZACIVSA-N 334.376 1.756 10 10 EDCE CCN1CC[C@H]1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1642297659 ORPYWNRLINMZMK-HNNXBMFYSA-N 339.386 1.512 10 10 EDCE CNC(=O)COc1cccc(CC(=O)NCc2cc(O)ccc2O)c1 1651222978 VDMBNVYYXZJTDH-UHFFFAOYSA-N 344.367 1.082 10 10 EDCE CCN(CC)C(=O)CCC(=O)N1CCN(c2ccc(OC)cc2)CC1 150858067 HFNYORYDDWLIDV-UHFFFAOYSA-N 347.459 1.992 10 10 EDCE CN1CCCc2cc(CNC(=O)Nc3ccc(C(N)=O)nc3)ccc21 164384094 YCTYZUXUNWKYLS-UHFFFAOYSA-N 339.399 1.885 10 10 EDCE COCCN(CCOC)C(=O)CCNCc1ccc(N(C)C)cc1 1857863032 OGFKEOWMLXPTQE-UHFFFAOYSA-N 337.464 1.354 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@H]2[C@H](O)CO)c(Br)c1 2146333623 HLXQZBBCVVQLHF-QCZZGDTMSA-N 345.237 1.027 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@@H](O)CCN1C(=O)OC(C)(C)C 1985102934 NVYKECABVYXLMB-WDEREUQCSA-N 327.385 1.516 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)cc1Br 2178086650 MQSUGAIOWARCAZ-FJHTZYQYSA-N 341.249 1.912 10 10 EDCE COc1cccc(CNC2(CNC(=O)OC(C)(C)C)COC2)c1O 705659303 MVEFIKAXQCZNOW-UHFFFAOYSA-N 338.404 1.784 10 10 EDCE CN(Cc1cnn(C)c1Br)C(=O)Cc1ccc(N)cc1 2173265786 GPGIKFTUSTZFFS-UHFFFAOYSA-N 337.221 1.966 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCc4ccccc4[C@@H]3CO)c2n1 2062667266 DZJNZJMNYUFFEA-HNNXBMFYSA-N 338.367 1.475 10 10 EDCE NCc1cc(F)c(N2C[C@H](CO)OCC23CC3)cc1Br 2183972308 QYJPOCSLAJRGEC-SNVBAGLBSA-N 345.212 1.777 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C[C@@H]2OCC[C@@H]21 1908253888 CDHNRJWCGJBIEF-SRVKXCTJSA-N 337.380 1.674 10 10 EDCE CCn1nc(Br)c([C@@H](O)[C@H](N)c2ccccc2O)n1 2111411539 PFFHSEQQQGIJPS-KOLCDFICSA-N 327.182 1.500 10 10 EDCE NCc1ccc(N2CC(N3CCOC3=O)C2)c(F)c1Br 2235664726 CMHGQZQTTGPCAY-UHFFFAOYSA-N 344.184 1.688 10 10 EDCE COc1ccc(Br)c(CNCc2cc(=O)n(C)[nH]2)c1O 2236049710 VDKRVNDMCKICAK-UHFFFAOYSA-N 342.193 1.480 10 10 EDCE C[C@@H]1CN(C2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)CCO1 66561412 ZMKUYUSAXVFLCM-CYBMUJFWSA-N 335.404 1.986 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN[C@H](CO)C[C@@H](O)C(C)(C)C)c1O 285281797 UYJNESWSEYEDBH-WCQYABFASA-N 342.392 1.557 10 10 EDCE COc1ccc(N2CCN(c3nc(C(N)=O)cs3)CC2)cc1F 292677537 BAXSGGFFPKIVOF-UHFFFAOYSA-N 336.392 1.716 10 10 EDCE COc1ccc(N2CCN(C(=O)C[C@@H]3CCOC[C@H]3OC)CC2)cc1 294251299 FRXKHFKCIYIWIN-MAUKXSAKSA-N 348.443 1.785 10 10 EDCE CC[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCO1 817274979 VKPVKPOKNCSFPE-GDBMZVCRSA-N 333.432 1.443 10 10 EDCE CN(C)c1ccc(CNC(=O)NCC(C)(C)[C@@]2(O)CCOC2)cc1 825603298 RUZFWFUIVSODRN-GOSISDBHSA-N 335.448 1.729 10 10 EDCE COc1ccc(O)c(CNC(=O)c2c3n(c(=O)n2C)CCCC3)c1 825838919 IEUCVIOWRNLSBX-UHFFFAOYSA-N 331.372 1.167 10 10 EDCE COc1cc(O)c(CN2CC[C@@H](CN3CCOC3=O)C2)cc1OC 824454839 LLBKRIXHKJOZJU-GFCCVEGCSA-N 336.388 1.684 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CC34CC4)cc2)C1 823862258 NDEMFVONIVJSHK-GOEBONIOSA-N 342.443 1.740 10 10 EDCE C/C=C/[C@H](O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 900014284 HWVBXWUCMCIDBJ-YZTRRJNXSA-N 347.459 1.261 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCO[C@H]1C1CC1 906385031 MHESOVZMDYPACC-MSOLQXFVSA-N 330.428 1.955 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)N2CC(N=[N+]=[N-])C2)CO1 1895874772 CDNHLPWLYFMKFN-KOLCDFICSA-N 325.369 1.532 10 10 EDCE CCO/C=C/C(=O)OCc1cc(O)n2ncc(C(=O)OCC)c2n1 840592113 XHODGWGWTXFRHI-AATRIKPKSA-N 335.316 1.205 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@]23C[C@H]4C[C@H](C(=O)N2)[C@H]3C4)c1 845835135 ZKVSPFKBHHOPBN-CBSVCGTGSA-N 330.384 1.493 10 10 EDCE COc1ccc(CNC(=O)NC[C@@H]2CN(C3CC3)C(=O)O2)c(O)c1 847463227 HPCZHQYCKITRRH-CYBMUJFWSA-N 335.360 1.183 10 10 EDCE CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2cccc(OC)c2O)C1 843431943 FIPSPPPLKMVEFW-CQSZACIVSA-N 332.322 1.901 10 10 EDCE CCOC(=O)[C@H](CSC)NC(=O)/C=C/c1ccc(O)c(O)c1 928294107 VSBBEDOWJDRGLY-ZRQQLDRUSA-N 325.386 1.522 10 10 EDCE Cc1cc(CC(=O)N[C@@]2(C(N)=O)CCOC2)c(C)n1-c1ccccc1 855054132 ZFGZQPIGHVKMIA-IBGZPJMESA-N 341.411 1.397 10 10 EDCE CN(C)c1ccc(CN(C[C@@H](O)C2(O)CCOCC2)C2CC2)cc1 929295104 JHOMZVMOQAPSIE-GOSISDBHSA-N 334.460 1.619 10 10 EDCE Cc1cc(C(=O)N[C@@H]2CCNC(=O)CC2)c(C)n1-c1ccccn1 854960360 GYXYJGBYJVSNCQ-AWEZNQCLSA-N 326.400 1.888 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)C[C@H](O)C3CC3)C2)cc1 854300507 UVYMOUPYLAIDGQ-YOEHRIQHSA-N 333.432 1.686 10 10 EDCE CC[C@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)O 927942396 IAZRECMRZNQDLP-NWDGAFQWSA-N 335.404 1.157 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)CC1CN(S(C)(=O)=O)C1 929295602 MPFNHUCHDHMNOL-UHFFFAOYSA-N 339.505 1.854 10 10 EDCE CCOC[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 777459252 NPXQZUORCOCJTK-ZDUSSCGKSA-N 339.411 1.887 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3CSC[C@H]3C2)cc1 897361555 LSTBDIUSTVNGQK-OKILXGFUSA-N 333.457 1.190 10 10 EDCE C[C@H](NCc1cc(Br)cc(F)c1O)c1nc(O)n[nH]1 715719632 TTXSBOPRQGUABQ-YFKPBYRVSA-N 331.145 1.968 10 10 EDCE O=C(Nc1cccc(Cn2cccnc2=O)c1)c1cccc(O)c1O 790553242 GTPBJGHYPYCUSJ-UHFFFAOYSA-N 337.335 1.955 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](N3CC[C@H](O)C3)C2)cc1 1140117109 QDXITKCXJHUWRJ-KBPBESRZSA-N 331.376 1.130 10 10 EDCE O=C1NC[C@@]2(CCN(Cc3cccc(Br)c3O)C2)N1 2121192989 KTDOKQKQQUJJHH-CYBMUJFWSA-N 326.194 1.412 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC1C[C@H]2C[C@@H]2C1 1329195843 CLJMSGXMUPAQER-HUUCEWRRSA-N 343.427 1.054 10 10 EDCE CCOCC(=O)N1CCO[C@H](CNCc2ccc(OC)c(C)c2)C1 1502036187 OCPRRMZNJBKUAY-MRXNPFEDSA-N 336.432 1.357 10 10 EDCE C[C@](NC(=O)c1ccc(N=NC(N)=O)cc1)(C(N)=O)c1ccccc1 1465852875 QHQKNBFKOWLGNV-QGZVFWFLSA-N 339.355 1.980 10 10 EDCE C[C@H]1C[C@H]1C(=O)NCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1704181352 NXWBOZSPFGHAEO-GXFFZTMASA-N 331.376 1.693 10 10 EDCE CC1(C)[C@H](O)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2136627677 BGOMPNULTPCNES-MNOVXSKESA-N 326.194 1.361 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CC[C@H](CNCCO)CC2)cc1 1700103681 JDPMORAEPNBJMU-MQMHXKEQSA-N 347.419 1.720 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@@](C)(O)C2)c(Br)c1 2136835878 ZSOHQAGAQZGDCM-IIMNLJJBSA-N 329.238 1.791 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2CCC(=O)N2C)cc1C 1717738143 LOXNADZVDKVEEH-GDBMZVCRSA-N 347.459 1.561 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)C(C)(C)NC(C)=O)C2)cc1C 1480118684 RUDPHCWFEFRYPM-INIZCTEOSA-N 347.459 1.609 10 10 EDCE COC(=O)N1CCC([C@H](C)NC(=O)Cc2ccc(O)c(O)c2)CC1 1625539748 RJMQZBZAMHKRKY-NSHDSACASA-N 336.388 1.623 10 10 EDCE Cc1cc(CC(=O)NCc2nnc(N)o2)c(C)n1-c1ccccc1 1639224833 CHGKOYSOWYMSLE-UHFFFAOYSA-N 325.372 1.918 10 10 EDCE COC1CCN(c2ccc(CN3C[C@@H](CO)[C@@H](CCO)C3)cc2)CC1 1655900525 XKRZNSFFOVJCPW-ROUUACIJSA-N 348.487 1.725 10 10 EDCE CCN(C)c1ccc(CN2CCC(O)(c3ncnn3C)CC2)cc1 1660012149 JUVNLWZROJWHNY-UHFFFAOYSA-N 329.448 1.755 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)CCN(C)C)C2)cc1C 1691111912 ROFQLYJZLXIDJP-CALCHBBNSA-N 333.476 1.940 10 10 EDCE COCc1nocc1C(=O)N1CCN(c2ccc(OC)cc2)CC1 1261217941 CIDAPWDVIWAVJM-UHFFFAOYSA-N 331.372 1.792 10 10 EDCE COc1ccc(Br)c(CNCCc2nc[nH]n2)c1O 1964052263 NDRHZTLVWGOSSK-UHFFFAOYSA-N 327.182 1.614 10 10 EDCE O=S1(=O)CC[C@@H](CNCc2cc(Cl)cc(Cl)c2O)N1 1965981059 WOHAKIUFZBBJPX-VIFPVBQESA-N 325.217 1.480 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985093923 HHBQHKHYOKLNKF-WDEREUQCSA-N 327.385 1.563 10 10 EDCE OCc1ccc(N2CC34COCC3(COC4)C2)cc1Br 2150398216 IVTFFBLMHWKCES-UHFFFAOYSA-N 340.217 1.795 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NCc2ccc(O)c(O)c2)C1 2011918196 PFSPBKXKCVNXDG-QWHCGFSZSA-N 338.404 1.558 10 10 EDCE CN(C)C(=O)[C@@H]1COCCN1c1ccc(CN)c(Br)c1 2155016088 ALPAGEDABCUQLN-ZDUSSCGKSA-N 342.237 1.201 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N1CC[C@]2(CNC(=O)N2)C1 2177680594 OHAXWWYNHRJNEE-OTYXRUKQSA-N 340.221 1.973 10 10 EDCE CN(C)C(=O)[C@H]1CNCCN1Cc1ccc(Br)cc1O 691385811 INXNZGZLFYRWPN-GFCCVEGCSA-N 342.237 1.017 10 10 EDCE CN(C)C(=O)NCCNCc1cc(Br)cc(F)c1O 715812219 JIHUCADVSJTWNA-UHFFFAOYSA-N 334.189 1.655 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@@H](C)OC4(CCOCC4)C3)c2n1 2063819744 OURDOWOABWZNDW-GFCCVEGCSA-N 346.387 1.153 10 10 EDCE CN1CCc2cc([C@H](N)[C@H](O)C3CN(C(=O)OC(C)(C)C)C3)ccc21 2044749856 IYFHMDKHFVHGCH-DLBZAZTESA-N 347.459 1.907 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@H](N(C)C)C2)c(Br)c1 2089925701 FGOQVWKSNGFUFI-FZZIBODNSA-N 329.238 1.614 10 10 EDCE CN[C@@H](c1ccccc1O)[C@@H](O)c1cn(C)nc1Br 2091863019 KQGSHIJJIWMMGX-RYUDHWBXSA-N 326.194 1.882 10 10 EDCE CC[C@@H](N[C@H]1CC(=O)NC1=O)c1cc(Br)ccc1O 2096090293 XGBQLMLTFYDUHP-ZJUUUORDSA-N 327.178 1.611 10 10 EDCE OCC[C@@]1(CO)CCN(c2ccc(CO)cc2Br)C1 2097023990 HOTMHXAVFNCGMC-AWEZNQCLSA-N 330.222 1.513 10 10 EDCE CC(C)(C)OC(=O)N[C@H](COc1nnc(=N)[nH]n1)c1ccccc1 2213779713 XCCDXIXYRKNPNC-LLVKDONJSA-N 332.364 1.324 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(NC(=O)c2cccc(O)c2O)C1 2216762691 KVLXQFLRULWPFF-QGHHPUGFSA-N 334.372 1.837 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCOC[C@H]2CO)c1O 2236045677 SGYMLJNJLXFNCO-BXKDBHETSA-N 346.221 1.650 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@H](C(=O)O)C2)c1O 2236035840 BMPSTZBATJLZSF-NSHDSACASA-N 346.177 1.449 10 10 EDCE Nc1ccc(OCC(=O)N[C@@H](CCO)COCc2ccccc2)cc1 2320381285 PKFXNIQRDIBDLG-KRWDZBQOSA-N 344.411 1.732 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2[C@H]3CNC[C@H]32)c(O)c1Br 2352632759 AWZHHDFKINPTFU-URLYPYJESA-N 325.206 1.545 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CNCCO2)c(O)c1Br 2352634392 UETCRCPUBQRPCM-SNVBAGLBSA-N 329.194 1.068 10 10 EDCE CNS(=O)(=O)CCCN(Cc1ccccc1O)C[C@@H]1CCCO1 111232870 KYFCAEFZIFXNIP-HNNXBMFYSA-N 342.461 1.313 10 10 EDCE CCOC(=O)CN1C(=O)/C(=C2/SC(=S)NC2=O)c2ccccc21 142591526 JQEOOUQMORNYIB-VAWYXSNFSA-N 348.405 1.455 10 10 EDCE NC(=O)c1ccc(/C=C\C(=O)NCCc2ccc(O)c(O)c2)cc1 255840460 CSRPWAWSEHAJGN-YWEYNIOJSA-N 326.352 1.569 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)C[C@H]1CCCO1 297733379 FSRSOIDYOSNFLG-QGZVFWFLSA-N 347.459 1.739 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC2(COC2)C1 823518834 CKPKHXBERLMSNX-UHFFFAOYSA-N 345.443 1.580 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CC34CC4)cc2)C1 823862260 NDEMFVONIVJSHK-ZBFHGGJFSA-N 342.443 1.740 10 10 EDCE COc1cc(Br)cc(CN2CCC[C@](O)(CO)C2)c1O 839160999 YJZFTMYVASNCAH-CQSZACIVSA-N 346.221 1.483 10 10 EDCE CCc1nc2n(n1)C[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)CC2 588407954 FMDYQSVDIQCACQ-LDJOOVGUSA-N 328.372 1.396 10 10 EDCE CC(C)(C)OC(=O)N1CC(C)(O[C@H](N)Cc2ccc(O)c(O)c2)C1 1952910871 OPIPYDHIONIKBG-AWEZNQCLSA-N 338.404 1.951 10 10 EDCE CCc1cccc(CN[C@@H]2CCCN(Cc3nccn3C)C2=O)c1O 848902128 LCFWRGIJUOIGRR-MRXNPFEDSA-N 342.443 1.969 10 10 EDCE CCO[C@H](CNC(=O)NCc1ccc(OC)cc1O)CN(C)C 926841604 KKCXSVDATQMFEU-CQSZACIVSA-N 325.409 1.167 10 10 EDCE O=C(NCC[C@@H]1CCNC1)NCc1ccc(N2CCC(O)CC2)cc1 851663544 BTDMVOYAMKHYQY-INIZCTEOSA-N 346.475 1.447 10 10 EDCE CNc1cnc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cn1 859966248 RWXAUPCNLTXHSU-UHFFFAOYSA-N 345.378 1.628 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C)C[C@H](C)O)C2)cc1 854298727 AMNCAVYMWMAZAB-KKUMJFAQSA-N 335.448 1.980 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H](C)C(O)[C@@H](C)C3)C2)cc1 854297137 MYQKKPRGFLDDJG-KKUMJFAQSA-N 347.459 1.932 10 10 EDCE CCON(CC)C(=O)CNC(=O)N[C@@H](C)c1cc(OC)ccc1O 858712961 UAJWAVSZVFMINR-NSHDSACASA-N 339.392 1.561 10 10 EDCE Oc1cc(OCc2ccccc2)ccc1CN1C[C@@H](O)C[C@@H](O)C1 753545846 WLLCZRAOCWCXPA-CALCHBBNSA-N 329.396 1.899 10 10 EDCE NC(=O)C[C@@H]1CN(Cc2cccc(Br)c2O)CCO1 862535606 SPQADRLRRDIPAE-SNVBAGLBSA-N 329.194 1.231 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](O)[C@H](C)O 871143721 RGXBAPSCMFVWTG-SUMWQHHRSA-N 330.384 1.378 10 10 EDCE O=[S@]1C[C@@H]2C[C@H]1CN2Cc1cc(Br)cc(F)c1O 1119450851 ZEEQXDXGRINCED-RAALSFIWSA-N 334.210 1.999 10 10 EDCE O=C1CNC(=O)N1Cc1ccc(N2CCN(CC3CC3)CC2)cc1 777674042 VMQNDBJGYZHCKK-UHFFFAOYSA-N 328.416 1.270 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3C[C@@H]3C(C)C)nc12 772509627 WSUXEUFIRKETTH-VXGBXAGGSA-N 347.371 1.947 10 10 EDCE CNS(=O)(=O)CCNCc1cc(C)cc(Br)c1O 783998597 DKZIQKFBHANFQL-UHFFFAOYSA-N 337.239 1.102 10 10 EDCE C[C@@]1(CO)CN(c2ccc(CN)cc2Br)C[C@@]1(C)CO 704789162 QRZACWJZXXBZIZ-GJZGRUSLSA-N 343.265 1.725 10 10 EDCE C[C@H](C(=O)NCc1cc(O)ccc1O)N1CSCCSC1 1153885030 JJBRQVMJRHUIFM-SNVBAGLBSA-N 328.459 1.800 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CC(N[C@@H]2CCOC2)C1 1304083132 BELIMIIVOUTHCT-SNVBAGLBSA-N 334.397 1.515 10 10 EDCE COCC[C@H](COC)NCc1ccc(N2CCN(C)CC2)c(F)c1 1323935344 HCBMUAWELGNJPJ-MRXNPFEDSA-N 339.455 1.719 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2c[nH]cc2C)cc1C 1326145774 FWNMTTJHCRDHBX-UHFFFAOYSA-N 345.443 1.864 10 10 EDCE CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@H]1CCCOC1 1326697223 XLIDDDFHSAIULK-KRWDZBQOSA-N 347.459 1.705 10 10 EDCE CN1C[C@@H](N(C)c2ccc(CN)c(Br)c2)CCC1=O 2131953419 USSBGJIXGVTCKD-LBPRGKRZSA-N 326.238 1.965 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)cc1Br 2132548988 ZGRDPWXJABXPLF-YABSGUDNSA-N 327.222 1.351 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)Cc2ccn(C)n2)cc1C 1276001963 MWDXUTSOGFYWIM-UHFFFAOYSA-N 344.459 1.918 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2ccn(C)n2)cc1C 1283714767 PFLHRALIJHZSAK-AWEZNQCLSA-N 330.432 1.987 10 10 EDCE COC(=O)c1cc(CNC(=O)/C=C/c2ccc(O)c(O)c2)ccn1 1454221040 OPNAKVPVIPGJMY-HWKANZROSA-N 328.324 1.609 10 10 EDCE CO[C@H]1C[C@@H](C(=O)O)N(Cc2c(O)cccc2Br)C1 2136353074 OIIJXTKDLHQKSU-KWQFWETISA-N 330.178 1.829 10 10 EDCE CC(=O)C(=O)[C@]1(O)[C@H](CNC(=O)OC(C)(C)C)CCC12CCC2 1924872872 BIAVKVZBPTWODA-YVEFUNNKSA-N 325.405 1.981 10 10 EDCE Cn1ccnc1CN1CCC(C(=O)NCc2cc(O)ccc2O)CC1 1471661157 ISCJNNKUUIIQRB-UHFFFAOYSA-N 344.415 1.360 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)CS(C)(=O)=O)cc1C 1716124897 OWEIHQZWEPTTOM-ZDUSSCGKSA-N 342.461 1.033 10 10 EDCE Cc1ncccc1NC(=O)[C@H](C)NC(=O)/C=C/c1ccc(O)c(O)c1 1625863621 OUHGWSBYFMJLDU-WMADIVHISA-N 341.367 1.958 10 10 EDCE CC[C@H](CNC(=O)[C@H]1CCN(C)C1)NCc1ccc(OC)c(C)c1 1715078881 FGPIGBBWITXVNP-DLBZAZTESA-N 333.476 1.940 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCC[C@@H](NCCCO)C2)cc1 1491897579 XQKSDHIFJRZUQK-HUUCEWRRSA-N 347.419 1.862 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@]2(C)CCNC2=O)cc1C 1733014094 HNZFFONMOJWSPM-SCLBCKFNSA-N 333.432 1.124 10 10 EDCE COc1cc(N2CCC(OCC(N)=O)CC2)c([N+](=O)[O-])cc1OC 1642329941 HFIUCKOYGWIZRV-UHFFFAOYSA-N 339.348 1.083 10 10 EDCE C[C@H]1C[C@H]1C(=O)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1585023592 MEHVXKIXPWDARR-GXFFZTMASA-N 343.387 1.884 10 10 EDCE O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCc1cc(Cl)ccc1O 1583816393 ICGIAFPYNNIVSJ-UHFFFAOYSA-N 337.719 1.432 10 10 EDCE COC(=O)c1ccc2c(c1)NC(=O)CN2C(=O)/C=C/c1cn(C)cn1 1595590408 MPQAPTYJUJKWAM-GQCTYLIASA-N 340.339 1.205 10 10 EDCE COc1cc(C(=O)N[C@H](C)C[C@@H](C)NC(=O)CC2CC2)cc(OC)n1 1681525537 ILXCIQDVUGXZHE-VXGBXAGGSA-N 349.431 1.912 10 10 EDCE CCC(=O)N[C@@]1(C)CCN(Cc2nnnn2-c2ccc(OC)cc2)C1 1699811244 ZJGMIAFNUZBAAL-KRWDZBQOSA-N 344.419 1.162 10 10 EDCE O[C@H]1CN(c2ccc(CNC3CC3)c(Br)c2)C[C@H]1O 236555711 KTPGGHCPTQZVPA-OKILXGFUSA-N 327.222 1.243 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)O)[C@H](c2ccc(O)c(O)c2O)C1 1951666186 UUNMIONWWPFCRZ-VHSXEESVSA-N 339.344 1.839 10 10 EDCE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CCN1C(=O)c1cccc(O)c1O 1965241520 PMSIRPMTEWVXEV-DTWKUNHWSA-N 346.305 1.769 10 10 EDCE COc1ccc(O)c(CNCc2c(Br)nnn2C)c1 1967833938 GNISHCLXRCGFHE-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@]1(C)C(=O)N1CC(N=[N+]=[N-])C1 1985101468 SUOVRDFHCOLXAA-YGRLFVJLSA-N 325.369 1.437 10 10 EDCE CCN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C1CN(C)C1 2146886244 JJUXNOZCBUIZEY-CYBMUJFWSA-N 339.237 1.541 10 10 EDCE CCN(C[C@@H](C)O)c1cc2c(cc1Br)[C@H](N)C(=O)N2 709446773 RVWWIPPBOOHPIG-KRTXAFLBSA-N 328.210 1.608 10 10 EDCE CNCc1ccc(N2CC[C@@H](C(CO)CO)C2)cc1Br 2170660145 OACUQSUNHBSSTN-GFCCVEGCSA-N 343.265 1.596 10 10 EDCE CC[C@H]1CCCCN1CCNC(=O)c1cnn2c(O)cc(C)nc12 2062381020 RGATVAOEIYTILJ-ZDUSSCGKSA-N 331.420 1.738 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@](CO)(C(C)C)C3)c2n1 2063572255 NEAGRUKDLHEFKX-QGZVFWFLSA-N 332.404 1.614 10 10 EDCE OCc1ccc(N2C[C@@H](O)C3(CCOCC3)C2)c(Br)c1 2174374002 NFEQSEGQJWCTCS-CQSZACIVSA-N 342.233 1.919 10 10 EDCE OCc1ccc(N2CCOCCC23COC3)cc1Br 2109850633 RYCVDBOSNRBBJQ-UHFFFAOYSA-N 328.206 1.937 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@](C)(COc2nnc(=N)[nH]n2)CC1(C)C 2213789990 OPJGASXJFBJLJL-HNNXBMFYSA-N 338.412 1.484 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCC[C@H]2C(N)=O)c1O 2236054473 IOFNPZQZGJXYCD-KCJUWKMLSA-N 343.221 1.907 10 10 EDCE COc1ccc(N(CCO)CCCO)c(OC)c1Br 2226548670 GEAITKSYZYMLOB-UHFFFAOYSA-N 334.210 1.647 10 10 EDCE C[C@@H]1CN(Cc2c(O)cccc2Br)CC2(CNC2)O1 2272932504 WYMCHELFWAPYSZ-SNVBAGLBSA-N 327.222 1.717 10 10 EDCE CN1CCCc2cc(CNC(=O)N[C@H]3CCc4ncnn4C3)ccc21 112746911 BPHKLEXRGBQGLT-HNNXBMFYSA-N 340.431 1.475 10 10 EDCE C[C@@H](O)c1ccc(N(C)Cc2nnn(C)n2)c(Br)c1 1892993461 VDSSSXITNBZXIA-MRVPVSSYSA-N 326.198 1.662 10 10 EDCE CCOc1ccc(O)c(CN2CCN(c3nccc(OC)n3)CC2)c1 129602297 RLMSORCWYFFOLX-UHFFFAOYSA-N 344.415 1.912 10 10 EDCE CCS(=O)(=O)N1C[C@@H]2CN(Cc3ccc(N(C)C)cc3)C[C@@H]2C1 96094139 KOPTWENAKWQRGD-IYBDPMFKSA-N 337.489 1.466 10 10 EDCE CNC(=O)[C@H]1CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])C1 817124500 HAXBIQTYEVDAPR-FUEXJSSKSA-N 333.344 1.353 10 10 EDCE Cn1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)nc1O 828149591 KZOQWUICVUGTRF-UHFFFAOYSA-N 344.415 1.264 10 10 EDCE CC1(C)CN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])C[C@H](CO)O1 844214815 VENGHUAXMBGXNM-FVOPLDGLSA-N 336.344 1.669 10 10 EDCE O=C(NCC[C@@H]1CCNC1)NCc1cc(Br)ccc1O 841938984 SDLXCTGBOAZXNC-JTQLQIEISA-N 342.237 1.954 10 10 EDCE CNC(=O)c1cc(S(=O)(=O)Nc2ccc(O)cc2F)cn1C 758172000 XOYSFVZQNXDYCV-UHFFFAOYSA-N 327.337 1.030 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](OC)[C@@H]3CCOC3)CC2)cc1 854198899 SMMIQNRTBCEUFF-RHSMWYFYSA-N 334.416 1.395 10 10 EDCE CCc1c(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)cnn1C 855230266 FGQPBEQEYSIVFT-ZDUSSCGKSA-N 328.416 2.000 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)[C@@H]3CCCNC3)C2)cc1 851661446 JTXQCNKNUDFFIR-XHSDSOJGSA-N 346.475 1.961 10 10 EDCE COC(=O)[C@H](Cc1cccc(OC)c1)NC(=O)c1cc(O)cs1 862725566 RGFSJSNZMCNKAC-ZDUSSCGKSA-N 335.381 1.976 10 10 EDCE CN(C)c1ccc(/C=C\CN[C@H](Cc2ncccn2)C(=O)O)cc1 1119550781 YQUZTNDQTQMRIZ-OICCZTGUSA-N 326.400 1.841 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@H](C(=O)N3CCCC3)C2)c(O)c1O 780942079 ZCGZOXFFLSMZSN-ZDUSSCGKSA-N 332.400 1.881 10 10 EDCE COc1ccc(CNC(=O)Cn2cnc3ccccc3c2=O)c(O)c1 794379105 ZJZRWXQTNDWYSZ-UHFFFAOYSA-N 339.351 1.427 10 10 EDCE CN(C)C(=O)OC[C@@H]1CCCCN1C(=O)Cc1ccc(O)c(O)c1 1157231971 JXWLXLPNFKYWKS-ZDUSSCGKSA-N 336.388 1.720 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)c1cn([C@@H]2CC[C@H]2O)nn1 1157051059 PDMGQYYXZLJTIN-NVXWUHKLSA-N 338.367 1.763 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@H](C)C3CC3)C2)cc1 1327972656 BLZCCIZXBYZQHR-ZFWWWQNUSA-N 345.443 1.552 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC3C[C@H]4C[C@@H]4C3)C2)cc1 1328210059 OJCIUOASKBSEQY-MCIONIFRSA-N 343.427 1.305 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N2CCC[C@H]2CN=[N+]=[N-])n1 2121909851 IFZZZGVYPRIDOK-ZETCQYMHSA-N 349.214 1.646 10 10 EDCE COC(=O)NC1CN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 1333777233 GMKLOXBIZZQKHZ-LBPRGKRZSA-N 348.403 1.024 10 10 EDCE COC(=O)C1CC2(C1)CN(Cc1cccc(OC)c1O)C[C@H]2C(=O)O 1334824416 XWOGGRZFQJQIAW-XYEKJYRLSA-N 349.383 1.487 10 10 EDCE C[C@@H](CNCc1ccnn1C)NC(=O)c1ccc(N=NC(N)=O)cc1 1268718073 UOORNTVDCNMZOJ-NSHDSACASA-N 343.391 1.491 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C[C@H]2CCCO2)cc1C 1268302213 VYVXTDXIPVYSEM-JKSUJKDBSA-N 336.432 1.139 10 10 EDCE CO[C@H](C)CC(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1284209412 SEYHUFUSABRRCI-WDEREUQCSA-N 349.391 1.509 10 10 EDCE CNCc1ccc(N2CC[C@@H](O)C[C@H]2CO)c(Br)c1 2136083067 UPFVGISAFJZQGX-NWDGAFQWSA-N 329.238 1.491 10 10 EDCE COC(=O)[C@H](NC(=O)c1cccc(O)c1O)c1ccc(OC)c(O)c1 1467264673 DGCSMRUSSCEKLY-CQSZACIVSA-N 347.323 1.456 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NC(=O)c2cc(O)cs2)C1 1470604583 UBVBYMRFZPINQG-ZJUUUORDSA-N 328.390 1.164 10 10 EDCE COC(=O)C[C@@]1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCCOC1 1616974989 OBMBKMDNEWUONR-INIZCTEOSA-N 348.359 1.691 10 10 EDCE C[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)[C@@H](C)S(C)(=O)=O 1611430491 DHZXODHPASCTSQ-GMTAPVOTSA-N 329.418 1.214 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H](C)n2cccc2)cc1C 1715583100 VTWYDUGHNYMOID-NVXWUHKLSA-N 345.443 1.633 10 10 EDCE NC(=O)N1CCC[C@@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)C1 1641982526 CUHVITZAAWNTSA-VIFPVBQESA-N 349.412 1.833 10 10 EDCE O=C(NCc1cccc(Cl)c1O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 1647826642 CTSKTBMVSHSDAB-UHFFFAOYSA-N 345.742 1.505 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC[C@@H](CC(N)=O)C2)c([N+](=O)[O-])c1 1772835901 JASNWRZYACXLON-VGVVRCBHSA-N 347.371 1.873 10 10 EDCE CC[C@H](C)C(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1688040103 GEUYUXXRAJJKHV-WCFLWFBJSA-N 335.404 1.522 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CCNCc2cc(F)ccc2O)C1 1940385393 RDMFVVCFGAGZTQ-UHFFFAOYSA-N 340.395 1.993 10 10 EDCE COc1ccc(Br)c(CN[C@@]2(C)CCNC2=O)c1O 1969998565 RZFPPEGDZDEDGB-ZDUSSCGKSA-N 329.194 1.532 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCC[C@H]3CO)c(Br)cc21 252603328 NXGPAWIUDCIVBP-MADCSZMMSA-N 326.194 1.362 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)[C@@H](CCO)C2)cc1Br 2149908174 QMAGTSUZZBIECF-WOPDTQHZSA-N 344.249 1.930 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003172034 FHOCSBGHOHOSFY-TVUHYWCHSA-N 336.432 1.899 10 10 EDCE CSCCN(CC(=O)C(=O)C[C@H]1C[C@H](N)C1)C(=O)OC(C)(C)C 1980377034 KVUFUTJZFGPEJS-HAQNSBGRSA-N 344.477 1.852 10 10 EDCE CN1CCc2cc([C@@]3(N)COC[C@@H]3NC(=O)OC(C)(C)C)ccc21 1999527807 SEYMDQMDGCGTJI-YJBOKZPZSA-N 333.432 1.756 10 10 EDCE C[C@@H](COCC(=O)NCc1ccccc1O)NC(=O)OC(C)(C)C 2010249369 CIVMFRPPCGUPFR-LBPRGKRZSA-N 338.404 1.938 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1CC(=O)N1CC[C@H](N=[N+]=[N-])C1 2014442308 LSRPZKLPWOWFGT-SDDRHHMPSA-N 339.396 1.827 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1ccncc1 2022928576 XZAMFJIPVSVGEQ-KBPBESRZSA-N 333.388 1.629 10 10 EDCE N[C@H](COCc1ccccc1)CC(=O)NCCc1ccc(O)c(O)c1 2035460437 GYUNZKBRKBJUPK-INIZCTEOSA-N 344.411 1.691 10 10 EDCE CN[C@H](C)c1ccc(N2CC(OC)(C(N)=O)C2)cc1Br 2161184332 XAZYVJFQACGGLZ-SECBINFHSA-N 342.237 1.420 10 10 EDCE C[C@@H]1CC[C@H](O)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 399321263 IQZHOPKURUXTJC-UJVNDKKSSA-N 340.221 1.751 10 10 EDCE Cn1cc(C(=O)NCCc2ccc(O)c(O)c2)c(Br)n1 2173190096 YGWWSYINYJEXAV-UHFFFAOYSA-N 340.177 1.566 10 10 EDCE CC[C@H](NC(=O)c1cnn2c(O)cc(C)nc12)[C@@H](O)C(F)(F)F 2064293999 ZAZANMINRSLDAH-WCBMZHEXSA-N 332.282 1.175 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@@H]2O 2174414780 ZSDARITZVXUPPP-TUWBQHJRSA-N 342.233 1.622 10 10 EDCE O=C1NC[C@@H]2CN(c3ccc(CO)c(Br)c3)CC[C@H]12 2100940832 NFWKWRFGRJPURU-PWSUYJOCSA-N 325.206 1.514 10 10 EDCE O=C1C[C@@H]2CCN(Cc3cccc(Br)c3O)C[C@@H]2N1 2088806211 NEYMFKCZPMRKOF-CABZTGNLSA-N 325.206 1.865 10 10 EDCE NCc1ccc(N2C[C@@H](CO)[C@H](CCO)C2)cc1Br 2093495140 FLZIMPCJTYRYBK-NEPJUHHUSA-N 329.238 1.335 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210541436 QISIQDSDWPIREE-MXWKQRLJSA-N 327.385 1.874 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3C[C@@H]3[C@H]2CN)c1O 2227742869 KVANISKKKKWZRU-HOTUBEGUSA-N 327.222 1.942 10 10 EDCE COCCCNC=C1C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O 2293453397 MJMNZBVGXLJRPA-UHFFFAOYSA-N 337.763 1.433 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2CCN(C)c3ncccc32)c1 492091577 SIBYVQGRAURCIL-WAYWQWQTSA-N 337.383 1.332 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@@H]2C[C@H]21 2303769548 CEYYKDZSNFNSEL-HTVCTNPSSA-N 336.432 1.898 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(Br)c1 2330386771 QHNJPIXZZBHJMM-IGJVIKARSA-N 328.206 1.262 10 10 EDCE CO[C@H]1COCCN(c2cc(Br)c(CN)cc2F)C1 2351577153 AHJIDXJXAWEUKX-SNVBAGLBSA-N 333.201 1.899 10 10 EDCE COc1ccc(N2CCN(C=O)CC2)cc1NC(=O)c1cccnc1 62160244 KLXCRTZKVRYAPD-UHFFFAOYSA-N 340.383 1.621 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1ccc(N(C)C)cc1)c1ccc(N)cc1 170318769 JXAYEMQLANWKDI-UHFFFAOYSA-N 340.383 1.853 10 10 EDCE CS(=O)(=O)c1ccc(S(=O)(=O)Cc2ccc(N)cc2)cc1 63131447 LOZBWUZSDHEPNN-UHFFFAOYSA-N 325.411 1.646 10 10 EDCE CN(Nc1nc(-c2cc(C(=O)O)cs2)cs1)S(C)(=O)=O 2365340971 AITDWZDVFYKMPF-UHFFFAOYSA-N 333.416 1.788 10 10 EDCE CCN(CCC(=O)O)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 190698166 QRZJDDGBWJPPQR-VMPITWQZSA-N 332.400 1.860 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N(C)C)cc1)C(=O)N1CCCCC1 47274902 LUZDXOMFONZPHC-AWEZNQCLSA-N 332.448 1.953 10 10 EDCE O=S(=O)(c1ccccc1)N1CCN(c2ccc3c(c2)OCO3)CC1 243860065 RIRMLFZMQXPJOQ-UHFFFAOYSA-N 346.408 1.926 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CCN4CCOC[C@H]4C3)ccc21 364965784 BMIKVMXNUVXLPK-QGZVFWFLSA-N 344.459 1.295 10 10 EDCE Cc1cc(C(=O)N2CC(=O)N(C)[C@@H](C)C2)c(C)n1-c1ccccn1 282493825 WNTUZVYWXRXVFL-ZDUSSCGKSA-N 326.400 1.792 10 10 EDCE CNCc1ccc(N2CC[C@]3(CNC(=O)C3)C2)cc1Br 2163325699 KVZCHMAKZZFLPI-HNNXBMFYSA-N 338.249 1.885 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CN(C)C(=O)[C@@H]3C)C2)cc1 826993638 SSWOMJGDQSMKIA-UONOGXRCSA-N 346.431 1.351 10 10 EDCE COC(=O)CN1CCC(N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 826846576 WJLROAKGIFWNBP-INIZCTEOSA-N 347.459 1.501 10 10 EDCE CN1C[C@@H](O)C[C@@]1(C)C(=O)NCc1ccc(N2CCSCC2)cc1 900254347 GSNMYCWTUKNJDU-WMZOPIPTSA-N 349.500 1.311 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CC[C@@H]2C[C@@H]2C1 834774562 AZEPTNHYRJFICV-BRWVUGGUSA-N 339.439 1.984 10 10 EDCE CNC(=O)C[C@H](C)NC(=O)NCc1cc(Br)ccc1O 836633015 TVWLOWVVZPHNFR-QMMMGPOBSA-N 344.209 1.479 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H](CO)c2ccnn2C)cc1F 838029491 OWRQSDBFHSBOPT-ZDUSSCGKSA-N 335.383 1.158 10 10 EDCE CC(C)NS(=O)(=O)NCCNC/C=C\c1ccc(N(C)C)cc1 835048944 NNVUZPGOAZFAPL-WAYWQWQTSA-N 340.493 1.188 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1[C@H](N)Cc1ccc(O)c(O)c1 1953007514 CJDDIAOWXZBWCE-LALPHHSUSA-N 338.404 1.650 10 10 EDCE CC(=O)C(=O)COC(=O)c1nn(C(C)(C)C)cc1Br 849854644 IIYWECLYCOZWRW-UHFFFAOYSA-N 331.166 1.716 10 10 EDCE COc1cccc(CNC(=O)NCCCNCc2cccnc2)c1O 841936600 VDVUBEMKBHASBU-UHFFFAOYSA-N 344.415 1.775 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC(=O)N(C)[C@H](C)C1 840482491 XNMQZMXVYGGNLD-LSDHHAIUSA-N 346.475 1.864 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@H](O)C2CCOCC2)cc1 846447614 RMSDEFQNFZZZBG-QGZVFWFLSA-N 336.432 1.377 10 10 EDCE Cc1cc(O)c(CN2CCN(CC[S@](C)=O)CC2)c(Cl)c1 840917511 RIBSUWMQPQNKES-NRFANRHFSA-N 330.881 1.850 10 10 EDCE COC(=O)CCN1CCC[C@@H](N2CCCc3cc(CN)ccc32)C1=O 852741651 XWIBQQNHGIGYRF-QGZVFWFLSA-N 345.443 1.452 10 10 EDCE C[C@H](NCCn1nc2ccccn2c1=O)c1ccc(N(C)C)cc1 765399119 AVUGHFZAHLVXRZ-AWEZNQCLSA-N 325.416 1.913 10 10 EDCE CC(=O)N1CCO[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)C1 934942627 CDGZZXFRYXFORO-KRWDZBQOSA-N 332.400 1.135 10 10 EDCE COc1cnc(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)c(F)c1 870932934 LYMDHDCBFPFZEU-OAHLLOKOSA-N 332.379 1.725 10 10 EDCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(F)ccc1O 779033428 MVZBQFRFZQUBEE-UXOAXIEHSA-N 337.347 1.456 10 10 EDCE C[C@@H]([C@H](C)S(C)(=O)=O)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1136768446 CRJRIFBGXGKOCQ-UWVGGRQHSA-N 340.405 1.743 10 10 EDCE O=C1CCN1c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 799126457 DFWYMCJKPRXODE-UHFFFAOYSA-N 344.352 1.760 10 10 EDCE C[C@]1(CO)C[C@H](O)CN1c1cc(Br)c(CN)cc1F 698199624 GVDJKVVFSCOOIO-TVQRCGJNSA-N 333.201 1.369 10 10 EDCE CCN(C)c1ccc(CN2CC[C@@H](CNS(C)(=O)=O)C2)cc1 1308058592 IMQXLOPSRNLVOY-HNNXBMFYSA-N 325.478 1.514 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)C[C@H]2CCC(=O)N2)cc1C 1319256663 IAVFRHPMNYTORF-CZUORRHYSA-N 347.459 1.514 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@@H](O)C(F)(F)C3)cc2F)CC1 1327939166 GCHBAGADKQWQEO-MRXNPFEDSA-N 343.393 1.779 10 10 EDCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)C1=CCOCC1 1436623744 HTVQSVFDVJFKSP-UHFFFAOYSA-N 338.354 1.764 10 10 EDCE COCC(=O)NCCC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1287244725 AQTTZOQPKMNREP-LLVKDONJSA-N 349.391 1.510 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCc2nncn2CC1 1447566428 XKOKTKCLVAOSKW-WCQYABFASA-N 330.388 1.389 10 10 EDCE Cc1cc(C(=O)NC2=NCC(=O)N2C)c(C)n1-c1ccc(F)cc1 1454211077 ZVKJMTCNLBDNRO-UHFFFAOYSA-N 328.347 1.791 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1ccc(Cn2cncn2)cc1 1468569185 NDYQHJFVQRQAFH-UHFFFAOYSA-N 338.367 1.597 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1ccccc1-n1cnnn1 1627069508 OYIBMIXHNORMFO-UHFFFAOYSA-N 346.350 1.846 10 10 EDCE O=C(COc1ccc2ccc(=O)oc2c1)NCc1cc(O)ccc1O 1643879482 RPFVZUXNWIFUOV-UHFFFAOYSA-N 341.319 1.899 10 10 EDCE O=C(NC[C@H]1CCCS1(=O)=O)c1cc2cc(O)c(O)cc2s1 1640762575 UWELHVFJXPIRJV-SECBINFHSA-N 341.410 1.620 10 10 EDCE C[C@]1(C(=O)NCc2cc(O)ccc2O)Cc2ccccc2C(=O)O1 1644752796 VHMYROSXJLAZLB-GOSISDBHSA-N 327.336 1.886 10 10 EDCE CC[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)[C@H](CC)CN1C(C)=O 1587395190 UOYKHRHJFMOHRW-LSDHHAIUSA-N 334.416 1.888 10 10 EDCE CO[C@H](C)C(=O)NC[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1678095792 IDVUMJUAIOACKH-WDEREUQCSA-N 349.391 1.461 10 10 EDCE O=C1/C(=C/c2cc([N+](=O)[O-])ccc2O)SC(=S)N1CCO 16904903 FBAZUZCGGQAOOC-POHAHGRESA-N 326.355 1.494 10 10 EDCE CC1(C)[C@H](O)C[C@@]1(CO)NCc1c(O)cccc1Br 1879558125 GUUWDALJZQEYLS-OCCSQVGLSA-N 330.222 1.766 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)O1 2010398010 UWZKBIBNBGNWHX-WOPDTQHZSA-N 339.396 1.970 10 10 EDCE OCCN[C@H]1CCCN(Cc2c(O)cccc2Br)C1 708612867 OEUKQXREBNTJKD-NSHDSACASA-N 329.238 1.701 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC(c4ccn(C)n4)CC3)c2n1 2062256675 GAWGDDYAFHAVHL-UHFFFAOYSA-N 340.387 1.497 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)cc1Br 2182543943 VIZPGOOEQALJKI-OGXIQJDLSA-N 345.212 1.225 10 10 EDCE CO[C@@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@@H]1NC(=O)OC(C)(C)C 2058774566 FQXMKOSCZLAJSL-LSDHHAIUSA-N 349.431 1.562 10 10 EDCE COc1ccc(Br)c(CN[C@H](CO)CN(C)C)c1O 2227749885 VZHLCNHLKKKQCO-VIFPVBQESA-N 333.226 1.175 10 10 EDCE CN(CCn1cc(Br)cn1)C(=O)c1cc(O)nc(O)c1 2361515179 OXXITTJPXQBEEV-UHFFFAOYSA-N 341.165 1.224 10 10 EDCE CCN(CC)c1ccc(CNC(=O)Nc2cnn(CC(N)=O)c2)cc1 76331106 UQIOITAFJQEIDX-UHFFFAOYSA-N 344.419 1.536 10 10 EDCE CN1[C@H]2CC[C@H]1CC(N1CCN(C(=O)c3cccc(O)c3O)CC1)C2 193148025 KZSRCVNCERDLHI-KBPBESRZSA-N 345.443 1.481 10 10 EDCE Cn1cccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1=O 265360826 AVLXCUDOWAHAIR-OAHLLOKOSA-N 342.395 1.912 10 10 EDCE CCO[C@@H]1C[C@@](NC(=O)c2cccc(O)c2O)(C(=O)OC)C1(C)C 275530202 FNNXQQLOTSRUAV-SJKOYZFVSA-N 337.372 1.574 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCOC[C@@H]1[C@@H]1CCCO1 377709659 ZFHZDVDZUVURLV-MOPGFXCFSA-N 332.444 1.903 10 10 EDCE O=C1CC[C@@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN1 815063216 XFJDBGDXPMFNTN-CQSZACIVSA-N 349.406 1.195 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C/c1ccc2nc(O)[nH]c2c1 901442835 LUONGYREWBGJDO-XYOKQWHBSA-N 330.369 1.571 10 10 EDCE CCOCCOCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 735520182 XPTBYDKDAXSXTG-MRXNPFEDSA-N 337.416 1.953 10 10 EDCE C[C@H]1CN(CCO)CCN1C(=O)NCc1ccc(N2CCCC2)cc1 837627502 VXXBGHHQFXQIEN-INIZCTEOSA-N 346.475 1.495 10 10 EDCE COc1ncc(/C=C/C(=O)N2C[C@H](CO)Cc3cccc(F)c32)cn1 911692339 OMGTYFMZXYZVDN-URWSZGRFSA-N 343.358 1.835 10 10 EDCE COCC1(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 848931309 BLVUXBBQYQCGBQ-UHFFFAOYSA-N 337.395 1.051 10 10 EDCE CN1CCOc2ccc(NC(=O)C(=O)NCc3ccccc3O)cc21 746792670 GNPMDBIHNQMPEN-UHFFFAOYSA-N 341.367 1.476 10 10 EDCE C[C@@H]1C(=O)N(CCN(C)C)CN1C/C=C/c1ccc(N(C)C)cc1 843429427 VNGAXGLKUBJMED-FYCOFBDGSA-N 330.476 1.818 10 10 EDCE CC(C)N(C[C@@H]1CCC(=O)N1)C(=O)NCc1ccc(N(C)C)cc1 840245409 URQOCQQWZNVIMK-HNNXBMFYSA-N 332.448 1.951 10 10 EDCE CN1CCN(Cc2ccccc2)[C@@H](CNC(=O)c2cc(O)cs2)C1 856327531 ASZMAXFBUJMRKT-HNNXBMFYSA-N 345.468 2.000 10 10 EDCE CC(=O)C(=O)COC(=O)c1nc(C2CC2)ncc1Br 923975532 CVZBLWNEVJVPKN-UHFFFAOYSA-N 327.134 1.431 10 10 EDCE C[C@H](NC[C@@H](O)CS(C)(=O)=O)c1ccc(N2CCCCC2)cc1 927032989 NUTVBSZAUYADRZ-WMLDXEAASA-N 340.489 1.733 10 10 EDCE c1cc2c(cc1CN[C@@H]1CCN(c3ccc4nncn4n3)C1)CCO2 858244843 JAJSHNJICAVWGI-OAHLLOKOSA-N 336.399 1.428 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNc3nccnc3F)cc2)C1 858357368 RKHWSKUTOGZVCM-CYBMUJFWSA-N 329.379 1.930 10 10 EDCE C[C@H]1C[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCN1 852869121 VQXJCRYHFISDDD-HOCLYGCPSA-N 331.460 1.652 10 10 EDCE O=C1C[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CN1CC1CC1 925114931 SZMVMXDYRXNTSP-CQSZACIVSA-N 343.383 1.167 10 10 EDCE Cc1cc(Cl)cc([C@@H](C)NC2CN(S(=O)(=O)N(C)C)C2)c1O 858571684 JDWWEBMYADPDNJ-SNVBAGLBSA-N 347.868 1.495 10 10 EDCE CN(C)c1ccc(/C=C/CNC[C@]23COCCN2C(=O)OC3)cc1 865770367 KOMDLFHQDKGDDS-OAJJDEHYSA-N 331.416 1.577 10 10 EDCE COc1ccc(O)c(CNCCN2C(=O)c3ccccc3C2=O)c1 776073730 SBLXTQIZAHVEQG-UHFFFAOYSA-N 326.352 1.787 10 10 EDCE CN1CCc2ccc(S(=O)(=O)Nc3ccc(O)cc3C(=O)O)cc21 776434326 CHAVDQXYVVQEFD-UHFFFAOYSA-N 348.380 1.884 10 10 EDCE Cc1cc(C(=O)NCCC2CS(=O)(=O)C2)c(C)n1-c1ccccn1 787458051 ISKKAVCYLZLTPK-UHFFFAOYSA-N 347.440 1.654 10 10 EDCE COC(=O)c1c(S(=O)(=O)Nc2ccc(O)c(OC)c2)n[nH]c1C 797819957 YUOQULLJVWDGEG-UHFFFAOYSA-N 341.345 1.020 10 10 EDCE O=C(NCc1cccc(Cl)c1O)c1nc(-c2cnccn2)no1 1159041378 KLSLDYRCVSRQMN-UHFFFAOYSA-N 331.719 1.816 10 10 EDCE C[C@@]1(NCc2cccc(Br)c2O)CCC(=O)NC1=O 2116209531 UXHLDQSFNMBREO-CYBMUJFWSA-N 327.178 1.440 10 10 EDCE CCC(CC)N(CCOC)C(=O)C(=O)N1Cc2cccc(O)c2C1 1331948611 UIXAIWUVIXXGPD-UHFFFAOYSA-N 334.416 1.898 10 10 EDCE CCCC(=O)N(C)CCN(C)Cc1nnnn1-c1ccc(OC)cc1 1271950512 JNIIYKNURMYGCG-UHFFFAOYSA-N 346.435 1.361 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@@H]2CCCN2C)cc1C 1278737285 KUKNWEICECIZAU-IRXDYDNUSA-N 349.475 1.007 10 10 EDCE C[C@@H](CNC(=O)[C@@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1285742044 VQHFZJXYASHKRU-CMPLNLGQSA-N 347.375 1.120 10 10 EDCE O=C(CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)NCCO 1472723003 RLGLCKAXEFLERD-UHFFFAOYSA-N 343.339 1.346 10 10 EDCE COc1ccc(CNC2(CNC(=O)CC(N)=O)CCCC2)cc1C 1482214388 CIZHXAFIAPXORC-UHFFFAOYSA-N 333.432 1.398 10 10 EDCE CO[C@@H](C)CN(C)[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1485391535 VOMAJRABCAVVOC-RYUDHWBXSA-N 335.408 1.934 10 10 EDCE CS(=O)(=O)Cc1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 1626082338 XJAQPTDIWIZBKB-UHFFFAOYSA-N 335.381 1.824 10 10 EDCE CN(C)[C@]1(C(=O)NCc2ccc(O)c(O)c2)COc2ccccc2C1 1630272916 GZZGUWLILGHRBF-IBGZPJMESA-N 342.395 1.650 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H]2CC=CCC2)cc1C 1496935575 GBBMEQMJMJLIAF-SJORKVTESA-N 332.444 1.927 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)NCc2ccc(O)cc2O)c1 1639444368 JDFIESCPLFGQFZ-DJWKRKHSSA-N 327.340 1.182 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2cnn(C)n2)cc1C 1567561121 AFNUVCOFOSCMPI-UHFFFAOYSA-N 345.447 1.313 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC3(CCNC(=O)O3)CC2)cc1 1639734665 WJMVIMFUDYLWGA-UHFFFAOYSA-N 345.359 1.954 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)C2[C@@H]3CCC[C@@H]23)cc1C 1733612345 VUYVULKDFNIZHE-IAGOWNOFSA-N 346.471 1.960 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)Cn2ccnc2)C2CC2)cc1C 1731412378 APEWAWNCPOQSMC-QGZVFWFLSA-N 342.443 1.885 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCN(CC(F)F)C2)cc1 1570424414 YKJMLYMVQRJJPI-NSHDSACASA-N 325.319 1.918 10 10 EDCE CC[C@H](CNC(=O)C(C)C)NCc1nnnn1-c1ccc(OC)cc1 1665759842 LIABZYBGNAOODS-CYBMUJFWSA-N 346.435 1.311 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)NCCCN=[N+]=[N-])CC(O)C1 1964884761 SAQIIFRKOGWZPG-UHFFFAOYSA-N 327.385 1.469 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2010390597 GFETZEMKBDWKKE-NEPJUHHUSA-N 340.428 1.600 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](CO)(C(=O)NCCCCN=[N+]=[N-])C1 2010403808 KAWABKFHECDVAC-OAHLLOKOSA-N 341.412 1.813 10 10 EDCE CNCc1ccc(N2C[C@@H]3OCCN(C)[C@@H]3C2)c(Br)c1 2153992670 WLWSVURPNQDEFC-CABCVRRESA-N 340.265 1.688 10 10 EDCE Nc1ccc(-n2ccc(C(=O)NCC(=O)NCc3ccccc3)n2)cc1 327514710 RINZRQZLQLIOMR-UHFFFAOYSA-N 349.394 1.501 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H]3CCCO[C@@H]3C(C)C)c2n1 2063383872 LZTNTTSGJVKAQD-SWLSCSKDSA-N 332.404 1.924 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC3CC(N4CCCCC4)C3)c2n1 2064615498 JGMHSUUTGJPMNW-UHFFFAOYSA-N 329.404 1.490 10 10 EDCE CCOC(=O)c1c(C(C)(C)C)nn2c(O)cc(CC(=O)OC)nc12 2080933158 CSRKUFMOGLWXSU-UHFFFAOYSA-N 335.360 1.625 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)COc2ccc(N)cc2)[C@@H]2C[C@@H]21 2044625530 WECUJTYIHUBVQR-CABCVRRESA-N 347.415 1.868 10 10 EDCE C[C@@H]1CCN(C(=O)c2ccc(O)c(O)c2)C[C@H]1NC(=O)C(F)(F)F 2054398369 XGBBAKZJZAQRBD-PSASIEDQSA-N 346.305 1.627 10 10 EDCE CNCc1ccc(N2CC[C@H](C)[C@@H]2C(N)=O)c(Br)c1 2090262599 PUPJOLHMMADSJE-TVQRCGJNSA-N 326.238 1.869 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@](C)(O)C2)c(Br)c1 2201495355 BQGSKIDDZKKLHI-LSDHHAIUSA-N 343.265 1.881 10 10 EDCE CN(C)C[C@@H]1CN(c2ccc(CN)c(Br)c2)CCO1 2113978849 ARODJACLKLCEFP-CYBMUJFWSA-N 328.254 1.675 10 10 EDCE C[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@H]1CCOc1nnc(=N)[nH]n1 2213790058 PORGITSALKGDLZ-MNOVXSKESA-N 338.412 1.484 10 10 EDCE COc1ccc(Br)c(CN[C@H]2COC(C)(C)[C@@H]2O)c1O 2236055488 QGIPWVWXQQQHKA-GXFFZTMASA-N 346.221 1.791 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2236634445 VHZMQZACYHYJDQ-BETUJISGSA-N 343.265 1.596 10 10 EDCE CN(C)c1ccc(OC[C@](N)(CO)C2(Br)CC2)cc1 2229376690 GODYGEZTFXIJKR-CQSZACIVSA-N 329.238 1.749 10 10 EDCE COC(=O)[C@](O)(CNCc1cnc(SC)s1)C(F)(F)F 2284540599 CYKZSMYBKZVJCM-SECBINFHSA-N 330.353 1.421 10 10 EDCE C[P@@]1(=O)C[C@@H](O)[C@H](NCc2cc(Br)ccc2O)C1 2296974328 YLWLLKUFYMSLGT-QAMHXRKUSA-N 334.150 1.980 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)cc1Br 2336466406 RMAJIXSWFZUIQL-VYUIOLGVSA-N 346.246 1.736 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)cc1Br 2355336013 KCBSCCLWQDNUQP-PTPDJHTLSA-N 341.249 1.789 10 10 EDCE CN(C)c1ccc(CNC(=O)NCC2CCN(CCO)CC2)cc1 111417335 ZVCBBQUDSHJFHA-UHFFFAOYSA-N 334.464 1.256 10 10 EDCE CN(C)C(=O)[C@H]1CNCCN1Cc1cc(Cl)cc(Cl)c1O 89083142 ACLGFKJQMGHJGG-GFCCVEGCSA-N 332.231 1.561 10 10 EDCE NCc1cc(F)c(N2C[C@@H](C(N)=O)C3(CC3)C2)cc1Br 2370326013 QWSGRRUDTYZFEP-VIFPVBQESA-N 342.212 1.749 10 10 EDCE CCS(=O)(=O)N(C)CCCNCc1cc(Cl)c(F)cc1O 294182916 JTDBPSYOOMOQBP-UHFFFAOYSA-N 338.832 1.946 10 10 EDCE CC(C)OC[C@@H](O)CNCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 818967992 HJRIMCDDHGBZLU-WMZOPIPTSA-N 349.475 1.264 10 10 EDCE CC[C@H](NC/C=C\c1ccc(N(C)C)cc1)C(=O)N1CCOCC1 835044407 ZREYEVAOYIYVIO-XFHJGTJQSA-N 331.460 1.993 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C[C@@H](O)CN1CCOCC1 917013496 DJFLILKUJVXHBQ-IBGZPJMESA-N 335.492 1.656 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)c3c[nH]nc3C)C2)cc1 849415454 ADTXYXNPCSIHSU-GFCCVEGCSA-N 336.417 1.284 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(CC(N)=O)CC2)c(Br)c1 700786168 PARYBMDIROKXEK-SNVBAGLBSA-N 342.237 1.110 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1Cc1ccc(N2CCC(OC)CC2)cc1 844395646 XDGRPUWAVVCMHW-ZWKOTPCHSA-N 334.460 1.883 10 10 EDCE COc1ccc(N2CC[C@H](NC[C@@H]3CCCN(C(=O)CN)C3)C2)cc1 849350826 XPYYKQRBXJBTNN-HOTGVXAUSA-N 346.475 1.061 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](CN)C(F)(F)F)cc1 848599401 ZJTVDPZFAZBFBS-ZDUSSCGKSA-N 348.369 1.662 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c1 751316792 BETQYKJZBQXUQH-TUAOUCFPSA-N 344.433 1.405 10 10 EDCE COC(=O)[C@@]1(C)C[C@H](OC)CN1Cc1ccc(N2CCOCC2)cc1 931382995 PIRTWEKJGVVQDI-PKOBYXMFSA-N 348.443 1.676 10 10 EDCE CC(C)CS(=O)(=O)CC(=O)NCc1ccc2cccnc2c1O 862028923 PBYZALPMHLKSIW-UHFFFAOYSA-N 336.413 1.627 10 10 EDCE COC(=O)C1(CNC(=O)N[C@@H](C)c2ccccc2O)CCOCC1 868489390 AKROMYDTNCJDJF-LBPRGKRZSA-N 336.388 1.722 10 10 EDCE CN(C)c1cc(F)c(CNCC(C)(C)CS(N)(=O)=O)cc1F 865814682 YNVSZVLWDGWKMM-UHFFFAOYSA-N 335.420 1.435 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCN([S@@](C)(=N)=O)CC2)c1O 879943358 FYPIRVURDWLXJS-JOCHJYFZSA-N 345.852 1.957 10 10 EDCE CCOC(Cn1cc(C(=O)N2Cc3cccc(O)c3C2)nn1)OCC 871201396 VMDPZPREROEYAU-UHFFFAOYSA-N 346.387 1.539 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC2CCC(O)CC2)c1 1117699538 QBVCRCLPVTVXPC-UHFFFAOYSA-N 343.401 1.472 10 10 EDCE COc1cc(NC(=O)NCc2ccc(N3CCOCC3)cc2)nn1C 775907192 NVNBDFTZGVVSHS-UHFFFAOYSA-N 345.403 1.587 10 10 EDCE C[C@@H]1CC[C@@H](O)CN1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 889661187 SZXHDAMNJZZDBI-CRAIPNDOSA-N 346.475 1.493 10 10 EDCE COC[C@@H](NCc1cc(C)cc(Br)c1O)C(=O)OC 789576144 OFIRPYZSJNEVFD-LLVKDONJSA-N 332.194 1.741 10 10 EDCE CCOc1ccc(CNC[C@@H]2CCCCN2S(C)(=O)=O)c(O)c1 796512147 CUYMNIRLEJMQLO-AWEZNQCLSA-N 342.461 1.695 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(N)(=O)=O)cn1 798316947 OFKDNNLQQQEZJZ-UHFFFAOYSA-N 348.428 1.067 10 10 EDCE O=C(NCc1ccc(N2CCCCC2)cc1)C1=C2CCCN=C2NN1 1142844774 ZHBKLCXHJZIFCB-UHFFFAOYSA-N 339.443 1.847 10 10 EDCE CC[C@@H](NC(=O)Cc1ccc(O)c(O)c1)C(=O)NCc1cccs1 1143220697 NNWNPXSGZDVOTA-CYBMUJFWSA-N 348.424 1.913 10 10 EDCE CCOc1ccc(N2CCN(C(=O)C34CCN(CC3)C4)CC2)cc1 1334005458 LDGOUDMTUCAYDQ-UHFFFAOYSA-N 329.444 1.830 10 10 EDCE CC1(C)CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCS1 1335612925 DSFQIZONKJHNMH-UHFFFAOYSA-N 334.441 1.979 10 10 EDCE CC(C)(C)[C@@H](CNCCO)NC(=O)c1ccc(N=NC(N)=O)cc1 1508043111 KALXOLZUYWQICX-CYBMUJFWSA-N 335.408 1.575 10 10 EDCE CN(CC(=O)N1CCNCC1)Cc1cc(Br)ccc1O 219686968 KGFHRZAFSJCUMJ-UHFFFAOYSA-N 342.237 1.018 10 10 EDCE CN(C[C@H](O)COCc1ccccc1)C(=O)COc1ccc(N)cc1 1916344521 MPHDOBGWIZLHKO-KRWDZBQOSA-N 344.411 1.684 10 10 EDCE C[C@@H]1CCCN(c2ccc(CNC(=O)C3(O)COC3)cc2Cl)C1 1297008997 BYJCGEZUPVULGM-GFCCVEGCSA-N 338.835 1.954 10 10 EDCE C[C@]1(C(=O)NCc2cccc(O)c2O)Cc2ccccc2C(=O)O1 1455321028 WGBMTISQGWQIMC-GOSISDBHSA-N 327.336 1.886 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCOCC(F)(F)C(F)F 1467761031 LXPFJMUKYHOYPN-UHFFFAOYSA-N 325.258 1.674 10 10 EDCE CN1C(=O)[C@H](/N=N/[C@@H]2CCC[C@H]([N+](=O)[O-])C2)[C@H](O)[C@@H]2CCCC[C@H]21 1615013324 IWFZIMAGKPMOOH-PHPMRBMPSA-N 338.408 1.787 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)Cc2cncn2C)cc1C 1715267955 HVYRDHZWBDKBKV-CQSZACIVSA-N 344.459 1.822 10 10 EDCE O=C(O)[C@H](F)C1(O)CN(Cc2ccc(Br)cc2O)C1 1875537892 DXKHJPGIPALDFV-JTQLQIEISA-N 334.141 1.124 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCCCO 1633473348 NGOVXTLTTCJYAT-ZDUSSCGKSA-N 339.388 1.241 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@H]1CCC2(CCOCC2)[C@@H]1O 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CC(C)(C)OC(=O)N[C@@](C)(CO)CNC(=O)c1ccc(O)c(O)c1 2010537034 LWHLHKRTPPQNNC-MRXNPFEDSA-N 340.376 1.103 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)NCc1ccc(N)cc1 2022941667 DRWRDKJRSVALIO-AWEZNQCLSA-N 337.420 1.551 10 10 EDCE COc1ccc(C=C2SC(=S)N(NC(C)=O)C2=O)c(OC)c1 2040443867 AMIJYZVZIJXMKO-UHFFFAOYSA-N 338.410 1.956 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@H]2C[C@H]21 1906905313 WYXKAODXRNRKRJ-ARFNZGECSA-N 336.432 1.801 10 10 EDCE NC(=O)[C@@H]1CCCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297553988 ZSHVRTLGPXLAJV-INIZCTEOSA-N 329.400 1.013 10 10 EDCE CCN1CCN(CCCNC(=O)C=Cc2ccc(O)c(O)c2)CC1 2307986351 PWYFRYPESGNFIS-UHFFFAOYSA-N 333.432 1.255 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H]2CCO[C@@H]2c2cnn(C)c2)cc1 189975292 DGTVHSSDQLMHDK-DLBZAZTESA-N 343.431 1.816 10 10 EDCE COc1ccc(N2CCCN(CCN3CCOC[C@@H]3C)CC2)cc1 192699796 TUPTVWAGQQCQPI-KRWDZBQOSA-N 333.476 1.928 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H]1CCCN1C 299225567 AQIDQILAYAZWFL-SFHVURJKSA-N 346.475 1.759 10 10 EDCE Cc1cc(N2CCC[C@H](NC(=O)c3c(F)ccc(O)c3O)C2)n(C)n1 295498585 HFKMQDGFIDBXSS-NSHDSACASA-N 348.378 1.678 10 10 EDCE Cc1[nH]nc(C(=O)NCc2cc(Br)ccc2O)c1O 804734694 WJTJHGRZISHOKO-UHFFFAOYSA-N 326.150 1.822 10 10 EDCE Cc1cc(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)ccc1N(C)C 830006819 ORZWPYVICNUEMS-QGZVFWFLSA-N 338.473 1.451 10 10 EDCE CN1C[C@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)NC1=O 830137052 GLMDWABVDYQQPE-CQSZACIVSA-N 329.356 1.538 10 10 EDCE CCc1cccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)c1O 848889813 MUXJHIZAFKROEQ-CAOSSQGBSA-N 347.411 1.880 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)COCC(=O)OC(C)(C)C)c1 843830486 HEPCPIMJQYEIMR-NSHDSACASA-N 339.388 1.936 10 10 EDCE COC(=O)c1cc(O)ccc1NS(=O)(=O)C[C@H](OC)C1CC1 842589067 QQTCTBCFOHQRKT-ZDUSSCGKSA-N 329.374 1.346 10 10 EDCE C[C@H]1[C@@H](N)CCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 841713311 YFBZXZAMSLGZNM-WFASDCNBSA-N 336.411 1.293 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)[C@H](CN)c2ccc(F)cc2)cc1 841845793 DTLKJEZUJKLGIJ-MSOLQXFVSA-N 344.434 1.750 10 10 EDCE O=C1Cc2cc(NS(=O)(=O)c3cc(F)cc(F)c3O)ccc2N1 753018149 UERBUMFYNUYNTJ-UHFFFAOYSA-N 340.307 1.966 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN3CCOC[C@@H]3C2)c1 757927585 GTRCMSSNFALZLZ-ZDUSSCGKSA-N 341.249 1.980 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3CCOCC3)C2)cc1 852181402 AWSLCIYURIGQTH-HNNXBMFYSA-N 333.432 2.000 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)CS(C)(=O)=O)C2)cc1 855232650 WEUWPMRPYIHANS-STQMWFEESA-N 340.445 1.071 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@]3(C)CCOC3)C2)cc1 852108372 CUFDBTHFYCEQNM-KBXCAEBGSA-N 333.432 2.000 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1 853987138 IVVRBQBNLIKJFH-CYBMUJFWSA-N 349.431 1.725 10 10 EDCE COC[C@@H](CCNC(=O)N[C@H](C)c1cc(OC)ccc1O)OC 852448696 NBXQKWIABMYLCE-DGCLKSJQSA-N 326.393 1.813 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H]3CC=CCC3)C2)cc1 1118621079 SYSKJEZYGASYFZ-LSDHHAIUSA-N 343.427 1.615 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](O)[C@H](C)O)c2C)cc1 871125417 NGZNJQAXCDPFCB-SUMWQHHRSA-N 332.400 1.574 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN([C@H]2CCOC2)CC1 896963147 FIJWRDDRJNCEDQ-LBPRGKRZSA-N 348.424 1.859 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCO[C@@H](COc2ccccc2)C1 1138207256 ZNZYKNJGLOHKPN-MRXNPFEDSA-N 343.379 1.947 10 10 EDCE CC(C)(C)OC(=O)N1CC(CNC(=O)Cc2ccc(O)c(O)c2)C1 1137944792 FBBVDWBBRKMCGB-UHFFFAOYSA-N 336.388 1.623 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(c2nncn2C2CC2)CC1 1144178607 HVMJLRJBLYSHEX-UHFFFAOYSA-N 342.399 1.973 10 10 EDCE Cc1cc(C)cc(C(=O)NCC(=O)NCc2cc(O)ccc2O)c1 1303223561 VFCRBJUEDFEPCZ-UHFFFAOYSA-N 328.368 1.761 10 10 EDCE C[C@H](O)c1ccc(N2CCC[C@H]2[C@H](O)CO)c(Br)c1 2123168657 BPJNJGQJIPALFV-QCZZGDTMSA-N 330.222 1.824 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2nnn(C)c2C)cc1C 1268684252 KIHXJSYBVBWXFV-LBPRGKRZSA-N 331.420 1.349 10 10 EDCE O=C1C[C@@H](C(F)(F)F)[C@@H](C(=O)NCc2cccc(O)c2O)CN1 1347542167 KSQXKPSRENIWKF-DTWKUNHWSA-N 332.278 1.029 10 10 EDCE C[C@@H]1CN(Cc2cc(Br)cc(F)c2O)CC(=O)N1C 1350319204 DFGREQVYUOYFHK-MRVPVSSYSA-N 331.185 1.956 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)C[C@H]2CO)c(Br)c1 2136087380 DHPXBKGOIBVMNE-ZMLRMANQSA-N 329.238 1.791 10 10 EDCE O=C(CCc1nc(-c2ccoc2)no1)NCc1ccc(O)cc1O 1469160253 QCRKCFBEHCDOMN-UHFFFAOYSA-N 329.312 1.990 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H]2CCCN2C(N)=O)cc1C 1714309344 OFYGOEBJONWSGA-HIFRSBDPSA-N 348.447 1.141 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)c2ccco2)cc(OC)n1 1494563521 STZHCWXSJCDAPM-JTQLQIEISA-N 333.344 1.240 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@]2(C)C=CCC2)cc1C 1497031373 BVJHSVKQFDLQHX-VQIMIIECSA-N 332.444 1.927 10 10 EDCE CN(C)C(=O)c1cccc(CCNC(=O)Cc2ccc(O)c(O)c2)c1 1633595739 JUEZVJBGXXXSQP-UHFFFAOYSA-N 342.395 1.701 10 10 EDCE COC(=O)[C@@H](COC(C)C)N(C)C(=O)Cc1ccc(O)c(O)c1 1566400681 OERBAIVQUJNFMG-GFCCVEGCSA-N 325.361 1.065 10 10 EDCE O=C(NCc1cc(=O)c(O)co1)c1cc2cc(O)c(O)cc2s1 1648307823 WOOXCWJVFBWLEI-UHFFFAOYSA-N 333.321 1.901 10 10 EDCE Cc1ncc(Br)c(C(=O)NCc2c(O)cccc2O)n1 1645362700 ADGXJLOHQCJEOB-UHFFFAOYSA-N 338.161 1.889 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C2=COCCC2)cc(OC)n1 1579367968 PVMRCAIWHJFLST-LLVKDONJSA-N 349.387 1.028 10 10 EDCE COC[C@H](C)N(C)CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1699010851 HWDZKYKIVBUVEN-LBPRGKRZSA-N 335.408 1.888 10 10 EDCE CCC(=O)N(C)[C@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1698811479 NVOGKJYYFQTXKH-GFCCVEGCSA-N 332.408 1.017 10 10 EDCE O=C(c1cc(O)c(O)c(O)c1)N1CCN(c2ccc(F)cc2)CC1 1866302695 AHALHSKZUGJNTK-UHFFFAOYSA-N 332.331 1.905 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2140661772 IQBHUJYZLWGZPE-KOCKLMIUSA-N 333.201 1.349 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1CC(=O)N1CC(N=[N+]=[N-])C1 1987647460 SJILEYJAJRDCQU-MWLCHTKSSA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)NCC12COC(C(=O)NCCN=[N+]=[N-])(C1)C2 1995274412 QKGMNZOSTPLXOM-UHFFFAOYSA-N 325.369 1.487 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010403368 CRHCRXLUUVAPBA-ZJUUUORDSA-N 340.384 1.056 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2160718302 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RUCJHSXAUSDPHU-RNFRBKRXSA-N 349.214 1.692 10 10 EDCE NCc1ccc(N2CCC[C@H]3CNC(=O)[C@@H]32)c(F)c1Br 2279273050 DTTHBNUWLNYOSN-TVQRCGJNSA-N 342.212 1.762 10 10 EDCE CC(C)n1ncc2cc(/C=C\C(=O)N(C)c3cnn(C)c3)c(=O)[nH]c21 493648060 CKQGRELVKCNADU-WAYWQWQTSA-N 340.387 1.715 10 10 EDCE Cc1ccc(CNC[C@@H]2CN(C)CCO2)c(O)c1Br 2352692384 LRFZTDWZPDMQMM-GFCCVEGCSA-N 329.238 1.883 10 10 EDCE Cc1ccc(CN2CC(=O)N(C)CC2=O)c(O)c1Br 2352948718 SUMXBKDKVCJNQG-UHFFFAOYSA-N 327.178 1.264 10 10 EDCE Oc1c(Br)cccc1CNC[C@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2355467750 XSTITNZOLDXURF-VIDBKGRSSA-N 342.233 1.622 10 10 EDCE CC(=O)NCCNC(=O)CSc1ncc(-c2ccccc2)n1C 10197246 BOAJNYXNZVENTF-UHFFFAOYSA-N 332.429 1.432 10 10 EDCE CN1CCCc2cc(CNC(=O)NCc3cc(C(N)=O)co3)ccc21 186648036 PJZZXGZFOPXIMA-UHFFFAOYSA-N 342.399 1.760 10 10 EDCE CC(C)(C)OC(=O)N1CCCC[C@@H]1CCCOc1nnc(=N)[nH]n1 2213780376 FIYSFHHXTDZCKP-LLVKDONJSA-N 338.412 1.628 10 10 EDCE C[C@@H](NC[C@]1(CCO)CCOC1)c1ccc(N2CCOCC2)cc1 125437920 AWOXUNDFJZGDHC-APWZRJJASA-N 334.460 1.963 10 10 EDCE C[C@@H]1C(=O)NCCN1c1ccc(/C=C\C(=O)O)cc1Br 312199016 HHTHEVHCCZKBSX-AZVKUDOFSA-N 339.189 1.872 10 10 EDCE C[C@@]1(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCCO1 121569373 OOYNZYWLLNNOQB-SFHVURJKSA-N 336.407 1.972 10 10 EDCE COCCN(C)CCCNC(=O)c1c(C)oc(-n2cccc2)c1C#N 41967243 SYJZBFWOADHCHW-UHFFFAOYSA-N 344.415 1.949 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@@H]3O 249371940 ATIZYDKLJVRSJX-OVWALXMSSA-N 343.471 1.412 10 10 EDCE CNC(=O)CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435630526 XKWZDXMQBQPYRM-UHFFFAOYSA-N 342.443 1.270 10 10 EDCE CN(C)CCCN(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686715 HABWIGWDFBYIHH-UHFFFAOYSA-N 346.475 1.095 10 10 EDCE COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CC34CC4)CC2)cc1 817234485 AAGIYTJCXKFXEI-INIZCTEOSA-N 344.411 1.687 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)CCC[C@H]2CCOC2)c1 827199849 GFPHGVDMVZHRLF-LBPRGKRZSA-N 329.418 1.637 10 10 EDCE C[C@H](NS(=O)(=O)N(C)C1CC1)c1ccc(N2CCOCC2)cc1 736334871 WJJFJCQQEXVJRI-ZDUSSCGKSA-N 339.461 1.513 10 10 EDCE C[C@H]1CN([C@H](C)CNC(=O)c2c(F)ccc(O)c2O)C[C@@H](C)O1 848390630 DCRPHQXFZRIWQO-MXWKQRLJSA-N 326.368 1.464 10 10 EDCE Cc1cc(O)c(CN2CCC(NS(C)(=O)=O)CC2)c(Cl)c1 840910991 ZNUPUSCYRVSSNV-UHFFFAOYSA-N 332.853 1.868 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1C[C@@H](N(C)C)C1 848630412 SXUNYSHTRUPBPN-WOVMCDHWSA-N 346.475 1.167 10 10 EDCE COC[C@H]([C@H](N)Cc1ccc(O)c(O)c1)N(C)C(=O)OC(C)(C)C 1952908314 CMRVLHUQDDQQOJ-CHWSQXEVSA-N 340.420 1.850 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)C(OC)OC)C2)cc1 923186844 KDKGETKNSABNMH-OLZOCXBDSA-N 337.420 1.581 10 10 EDCE C[C@H](C(=O)N(C)CC(=O)NC1CC1)N1CCCc2cc(CN)ccc21 843350795 VIRGUNCEJIXYSZ-CYBMUJFWSA-N 344.459 1.023 10 10 EDCE O=C(NCCCSc1nccs1)NC[C@H]1C[C@@H]2COC[C@@H]2O1 921447557 MNMJXIAOLSZNGD-UTUOFQBUSA-N 343.474 1.728 10 10 EDCE Oc1ccc(Cl)cc1CN[C@H]1CCN(c2ccc3nncn3n2)C1 858243632 MELQOZCUNFVLBL-ZDUSSCGKSA-N 344.806 1.852 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CC(=O)N([C@H]3C[C@H]3C)C2)c1 756731836 IYOHIWYBCIALDD-OICBVUGWSA-N 332.400 1.839 10 10 EDCE COC(=O)N(C)CCN(C)C(=O)NCc1ccc(N(C)C)cc1C 853748443 GEGFXLCSEAEJKQ-UHFFFAOYSA-N 336.436 1.901 10 10 EDCE C[C@@H]1OC[C@H](NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@@H]1C 924728568 JKDLNNRZVLSLAP-OAOQPFQOSA-N 331.460 1.901 10 10 EDCE CN1C(=O)C(=Cc2ccc(C(=O)N3CCCC3)cc2)C(=O)N(C)C1=O 864362371 CNRNHSFXIKDDMZ-UHFFFAOYSA-N 341.367 1.356 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CC[C@H](C)NC1 861803840 GKAGCVSNTIMKLM-DZGCQCFKSA-N 333.432 1.388 10 10 EDCE COc1ccc(CNC(=O)c2cn3c(n2)C[C@H](OC)CC3)c(O)c1 867956030 KKQVFTABLQRKCF-CYBMUJFWSA-N 331.372 1.489 10 10 EDCE C[C@H](NC(=O)N[C@H]1CCN(c2cnn(C)c2)C1)c1ccccc1O 1119035251 LBWPPFIUKOGIRZ-STQMWFEESA-N 329.404 1.765 10 10 EDCE NC(=O)[C@H]1CNCCN1Cc1cc(Cl)cc(Br)c1O 708098925 LZXVPGYTOYSWNX-SNVBAGLBSA-N 348.628 1.067 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cccnc2F)c1 794015931 AKMFPTGVSVTVOE-UHFFFAOYSA-N 339.348 1.228 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 1142532985 BKWDJSVYXKDIRM-GFCCVEGCSA-N 344.342 1.906 10 10 EDCE COCc1nnc2n1CCN(C(=O)c1ccc(N=NC(N)=O)cc1)C2 1165439729 GYRPLCAZNRTCPR-UHFFFAOYSA-N 343.347 1.243 10 10 EDCE CN1CCN(c2ccc(CN3[C@H]4CC[C@H]3[C@H](CO)C4)cc2F)CC1 1323936155 GMCQARPMUUTKKG-BQFCYCMXSA-N 333.451 1.923 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H]2CCN(C)C2=O)cc1C 1321617967 RPAGDUQZRHNYLY-UKRRQHHQSA-N 333.432 1.076 10 10 EDCE COC(=O)C1CC2(C1)CN(Cc1cccc(OC)c1O)C[C@@H]2C(=O)O 1334824417 XWOGGRZFQJQIAW-YNAXMUEKSA-N 349.383 1.487 10 10 EDCE CN1C[C@@H](N(C)c2ccc(CN)cc2Br)CCC1=O 2131953560 WBJPTPSHNMWMEU-NSHDSACASA-N 326.238 1.965 10 10 EDCE CCN1C[C@@H](C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)CC1=O 1268648253 ZWKIKAFCCIWHTJ-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE [N-]=[N+]=NCCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21 209365045 SWODDJWJUGOAQB-SCVCMEIPSA-N 326.426 1.529 10 10 EDCE COC(=O)c1cccc2c1CCN2C(=O)c1ccnc2c1CC(=O)N2 1645410949 XXLSGLZPMMXGNM-UHFFFAOYSA-N 337.335 1.566 10 10 EDCE C[C@@H]1Oc2c(cccc2C(=O)NCc2cccc(O)c2O)NC1=O 1643812556 KRKADJLCLWFITB-VIFPVBQESA-N 328.324 1.747 10 10 EDCE CO[C@@H](C)CNC[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1731683537 AKFHFWCCUOLOKD-STQMWFEESA-N 347.419 1.936 10 10 EDCE CS(=O)(=O)C1CCC(C(=O)NCc2cccc(O)c2O)CC1 1643812602 MOIXYMGAOKXPNB-UHFFFAOYSA-N 327.402 1.317 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 1596952312 BDBFYACUKPZHEZ-INIZCTEOSA-N 336.432 1.804 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(Cc2cscn2)CC1 1597521884 XVMDAYSESUAZDY-UHFFFAOYSA-N 333.413 1.441 10 10 EDCE CCn1nncc1C(=O)NC/C=C\CNCc1ccc(OC)c(C)c1 1699252014 HLPAHEJHDARBGE-WAYWQWQTSA-N 343.431 1.691 10 10 EDCE C[C@H](N[C@H](C)Cn1cncn1)c1ccc(N2CCOCC2)c(F)c1 164220140 WEASJEAEJFYXLY-KGLIPLIRSA-N 333.411 1.993 10 10 EDCE CN(C)c1ccc(CNC(=O)Nc2ccc(C(N)=O)nc2)cc1F 164331741 FLCXCUWJDKYBES-UHFFFAOYSA-N 331.351 1.707 10 10 EDCE Cc1cc(=O)c(OCCN(C)C)cn1CCOc1ccc(N)cc1 1857916594 CMTAYSNZKUEFMW-UHFFFAOYSA-N 331.416 1.758 10 10 EDCE COc1ccc(O)c(CNCCn2ncc(Br)n2)c1 1875994347 LSYYQVKCAXTLJP-UHFFFAOYSA-N 327.182 1.545 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@](C)(O)CN 1951699900 SIONKVFYRBKJFD-BBRMVZONSA-N 326.393 1.243 10 10 EDCE CN(CC(CO)CO)c1ccc(CNC2CC2)cc1Br 2150417867 DTFWWFWPKBHJRA-UHFFFAOYSA-N 343.265 1.738 10 10 EDCE COC(=O)[C@H](CC(=O)N(C)CCN=[N+]=[N-])NC(=O)OC(C)(C)C 1985099337 LVXYPKYMFLPRFB-VIFPVBQESA-N 329.357 1.212 10 10 EDCE CCOc1cccc(CNC[C@H](CO)NC(=O)OC(C)(C)C)c1O 2011517129 UDGKFBRDKXXPHW-CYBMUJFWSA-N 340.420 1.766 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@@H](CO)NC(=O)OC(C)(C)C)c1 2011516635 KTBNPQLVBGSNRS-RYUDHWBXSA-N 340.420 1.937 10 10 EDCE CN(C(=O)[C@H](O)C(C)(C)NC(=O)OC(C)(C)C)c1ccc(N)cc1 2022837629 BNPOKAPSGIGUTJ-ZDUSSCGKSA-N 337.420 1.896 10 10 EDCE [N-]=[N+]=NCCNC(=O)CNC(=O)c1ccc(Br)cc1 701318548 IPPGDTIYLSDSSB-UHFFFAOYSA-N 326.154 1.605 10 10 EDCE CNC(=O)N[C@@H]1CCCN(c2ccc(CN)cc2Br)C1 702153652 RMGMPBZGZUQIDJ-LLVKDONJSA-N 341.253 1.806 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCCC(=O)N3CCCCCC3)c2n1 2062186838 YBKUKXLTFLQGKY-UHFFFAOYSA-N 345.403 1.266 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3[C@H](CO)C[C@@H]4CCCC[C@@H]43)c2n1 2063272175 UJKNKFIEINKWAI-OBJOEFQTSA-N 330.388 1.509 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@H](O)C2(C)C)c(Br)c1 2181207162 OFTUBUQTASMXJS-KBPBESRZSA-N 343.265 1.879 10 10 EDCE OCc1ccc(N2CC(c3nc(O)[nH]c3O)C2)c(Br)c1 2184935299 KROBIEYUYRZEJG-UHFFFAOYSA-N 340.177 1.680 10 10 EDCE O=C1CC[C@H](CNCc2cc(Br)cc(F)c2O)CN1 2103197770 WTGHTCILUHHMNW-MRVPVSSYSA-N 331.185 1.910 10 10 EDCE CO[C@H]1C[C@H](CN)N(Cc2cc(Br)cc(F)c2O)C1 2090738336 CLNDYAGMMPCREX-MNOVXSKESA-N 333.201 1.842 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@H](CO)C2)c(Br)c1 2098210102 XBHZZOJMPGHNLR-MNOVXSKESA-N 329.238 1.914 10 10 EDCE C[C@@H](NC(=O)C=Cc1ccc(O)c(O)c1)C(=O)NCc1ccco1 2307986965 QORJUDALRYMPJH-LLVKDONJSA-N 330.340 1.525 10 10 EDCE Cc1ccc(CNCc2nnc(O)n2C)c(O)c1Br 2352954587 ZNLBNPNMJZLMCD-UHFFFAOYSA-N 327.182 1.587 10 10 EDCE CC(=O)N(C)C1CN(c2ccc(CN)c(Br)c2F)C1 2353357105 WGBSEUYGAFEESJ-UHFFFAOYSA-N 330.201 1.714 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)NC1CCN(c2ccc(OC)cc2)CC1 170763419 AIFAURZUKITEPO-HZPDHXFCSA-N 332.400 1.589 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N(CCO)CC(F)F 192673627 NJAWKFQCTFGFST-UHFFFAOYSA-N 325.359 1.832 10 10 EDCE COc1ccc(CCN[C@H](O)Cc2ccc(O)c(O)c2)cc1OC 95934542 VINQZLXAPAFMRU-GOSISDBHSA-N 333.384 1.808 10 10 EDCE COC(=O)[C@H](N)CCN(C)Cc1ccc(C)c(Br)c1O 2381145241 CIYDRPVUMPZIPP-LLVKDONJSA-N 345.237 1.785 10 10 EDCE CN(CCC(N)=O)c1ccc(/C=C\C(=O)O)cc1Br 381927758 SQOFKAAWPJCHAS-HYXAFXHYSA-N 327.178 1.859 10 10 EDCE Cc1ccc(CN2C[C@@H](CO)[C@@H](CCO)C2)c(O)c1Br 2381134489 CVUXTIIBRYTEOK-AAEUAGOBSA-N 344.249 1.886 10 10 EDCE CC(=O)NCCC(=O)N(C)Cc1ccc(C)c(Br)c1O 2381142531 LEFHKHOTBOSDKL-UHFFFAOYSA-N 343.221 1.948 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCC[C@H](CO)C2)c1 298125661 AFQNAIBEXAXIBG-WDEREUQCSA-N 342.417 1.045 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cn(C)c(O)n1 819974521 NJRNNNVOVJJSKC-UHFFFAOYSA-N 330.388 1.235 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)c3cccn(C)c3=O)C2)cc1 819582388 LGBKNDUWYBGTEH-CQSZACIVSA-N 341.411 1.650 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 830703052 LXWPUEVQTVJVHP-GFCCVEGCSA-N 327.377 1.725 10 10 EDCE C[C@H](O)[C@H]1CN(C(=O)NCCCSc2nccs2)CCO1 840324874 HWACMGWXAJZQQR-WDEREUQCSA-N 331.463 1.417 10 10 EDCE Cn1nccc1[C@H](O)CNC(=O)NCCCSc1nccs1 921447973 ZGQZZBOJDYVCPP-LLVKDONJSA-N 341.462 1.392 10 10 EDCE Nc1ccc(NC(=O)C(=O)NCC[C@H]2CC[C@H](C(F)(F)F)O2)cc1 927866616 BARSHTXRXARZHH-VXGBXAGGSA-N 345.321 1.824 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@]12C[C@H]3C[C@@H](C(=O)N1)[C@H]2C3 845113587 BILIOTRFUZENBY-GKDNMFGBSA-N 327.428 1.626 10 10 EDCE O=S(=O)(NCc1c(O)cccc1F)c1ccnn1C1CCC1 921451078 JUHDBXLQMGZEAX-UHFFFAOYSA-N 325.365 1.931 10 10 EDCE CCCC(=O)N1CSC[C@@H]1C(=O)NCc1c(O)cccc1F 928710436 DOGIFNWHFGGJCN-GFCCVEGCSA-N 326.393 1.849 10 10 EDCE Cc1nn(C)c(Cl)c1S(=O)(=O)NCc1c(O)cccc1F 921452696 WRYNEBMSLMMEPS-UHFFFAOYSA-N 333.772 1.705 10 10 EDCE CC(=O)N1CCO[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 929935876 SKHZHMGAUHXGFH-GOSISDBHSA-N 345.443 1.491 10 10 EDCE O=C(NCc1c(O)cccc1F)N[C@@H]1CCCN2CCSC[C@@H]12 925169820 LILQISKUWKTDQW-KGLIPLIRSA-N 339.436 1.910 10 10 EDCE COc1ccc(CNC(=O)c2cc(C3CCNCC3)no2)c(O)c1 852824801 BVSXFSJMOCOZNL-UHFFFAOYSA-N 331.372 1.786 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCOC[C@H]1CCO 758519899 ZDPZGGBDFZFIPW-QGZVFWFLSA-N 331.416 1.356 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(C4OCCO4)CC3)cc2N1 761890049 VKPHCQAGSXCIID-UHFFFAOYSA-N 349.343 1.515 10 10 EDCE CCN(CC)c1ccc(CNCC(C)(C)CS(N)(=O)=O)cc1 865814213 CJDMBRBCTZPOPH-UHFFFAOYSA-N 327.494 1.937 10 10 EDCE C[C@H](NC(=O)NC[C@H]1CCCS(=O)(=O)C1)c1ccccc1O 868611679 HKVLNIBQUFQLCN-NWDGAFQWSA-N 326.418 1.577 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C[C@@H]1F 1117407058 JHRHNQZBDDLNDH-YOEHRIQHSA-N 345.418 1.886 10 10 EDCE C[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)C(=O)NCCF 897670852 LDLMXEUUXVXESW-SSDOTTSWSA-N 326.349 1.517 10 10 EDCE O=C(NCCCn1ccnn1)NCc1ccc(N2CCOCC2)cc1 784242514 YEQOCOJMCLGVRV-UHFFFAOYSA-N 344.419 1.004 10 10 EDCE CN(C)c1ccc(CNC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)cc1 715546181 PLLIDLHQJXMHGL-UHFFFAOYSA-N 348.447 1.317 10 10 EDCE NC(=O)Cn1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)n1 1142073622 LCQCIRHKIDBDPE-UHFFFAOYSA-N 332.341 1.247 10 10 EDCE Cc1[nH]c2ccnn2c(=O)c1CC(=O)NCc1cccc(Cl)c1O 1159034699 ZVILXWRVEBMVSH-UHFFFAOYSA-N 346.774 1.549 10 10 EDCE CC[C@@H]1C(=O)NC(=O)CN1c1ccc([C@H](C)N)cc1Br 97319348 CAFUYZDYVIAQIP-GZMMTYOYSA-N 340.221 1.710 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@@H](Cn3ccnn3)C2)cc1F 1333722788 RVCHJYDVGZTWRI-CQSZACIVSA-N 346.410 1.715 10 10 EDCE COc1ccc(N2CCC(NC[C@@H]3CCO[C@@H]3C(=O)O)CC2)cc1 1332423582 PRPMKGPCVDGHBL-GUYCJALGSA-N 334.416 1.743 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccn(C)c2C)cc1C 1268322348 JKFGBLFIZVTPAN-INIZCTEOSA-N 345.443 1.531 10 10 EDCE CCn1ncc(C(=O)NCC[C@H](C)NCc2ccc(OC)c(C)c2)n1 1274713753 BFXXXFMIYZHSAL-AWEZNQCLSA-N 345.447 1.913 10 10 EDCE [N-]=[N+]=N[C@@H]1CCN([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2O)C1 1912151717 KPNUVHWTXXDLPV-QLFBSQMISA-N 331.376 1.753 10 10 EDCE CN(CCCN=[N+]=[N-])S(=O)(=O)c1c(Br)cnn1C 1912174310 XORYDSNDQUPLRX-UHFFFAOYSA-N 337.203 1.504 10 10 EDCE CC[C@@H](CNC(=O)C=C1CCC1)NC(=O)c1cc(OC)nc(OC)c1 1297384251 YVTULISSQAHCOO-AWEZNQCLSA-N 347.415 1.834 10 10 EDCE CC[C@H](OC)C(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1298806444 DJUCOOVAQLUMRF-GWCFXTLKSA-N 349.391 1.509 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])N(C)C)cc1 1603555859 TYYIYCLBAKADEP-CQSZACIVSA-N 346.391 1.417 10 10 EDCE Cn1ccc(-c2cc(C(=O)NCCc3ccc(O)c(O)c3)no2)n1 1465981320 JPWLVRIRUJJHRT-UHFFFAOYSA-N 328.328 1.459 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cnco3)cc2)CC1 1558396030 DUTQQLYRRIMXRV-UHFFFAOYSA-N 328.372 1.306 10 10 EDCE CC[C@H](CNC(=O)C1=CCCC1)NC(=O)c1cc(OC)nc(OC)c1 1721461513 PZHLREWZQYOCMI-CQSZACIVSA-N 347.415 1.834 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2nnn3cc(C)nc(O)c23)c1 1636061022 BTEFJJDOBGPOPJ-VIFPVBQESA-N 343.343 1.344 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)C2CC=CC2)cc1C 1724667401 XXTFCNZHSPEODC-UHFFFAOYSA-N 332.444 1.880 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)C2(C(N)=O)CC2)C2CC2)cc1C 1731404762 HLPULLKTBTZQIR-HNNXBMFYSA-N 345.443 1.254 10 10 EDCE Cc1ccccc1[C@H](CC(=O)NCc1ccc(O)cc1O)NC(N)=O 1643100576 BSHXMTYVHZALJH-HNNXBMFYSA-N 343.383 1.822 10 10 EDCE CC[C@H](CNC(=O)CCOC)NC(=O)c1ccc(N=NC(N)=O)cc1 1582368762 LPPRVDNOJBOLSO-GFCCVEGCSA-N 349.391 1.510 10 10 EDCE CCN1CCO[C@@H](CNCc2cccc(Br)c2O)C1 134435256 GPDVHNLLGFJYLL-LBPRGKRZSA-N 329.238 1.965 10 10 EDCE NC(=O)c1csc(CNC(=O)NCc2cccc(Cl)c2O)n1 1687093127 QRTGBTVAINSPMF-UHFFFAOYSA-N 340.792 1.600 10 10 EDCE Nc1ccc(Cc2ccc(NC(=O)CC[C@H](N)C(O)O)cc2)cc1 1865959502 VXXJRNHRJIXUEP-INIZCTEOSA-N 329.400 1.216 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)[C@H](CCO)C2)cc1Br 2149915568 VRBIFQZRKGOFMU-UTUOFQBUSA-N 343.265 1.896 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980378812 XUHFIMZXMAUKCV-FIQHERPVSA-N 328.384 1.600 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CN(C(=O)Cc3ccc(N)cc3)C2)C1 1999445863 RLYQPGRTBMKWCI-UHFFFAOYSA-N 331.416 1.891 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010389955 WJLLWSLKUFDELK-GHMZBOCLSA-N 343.384 1.759 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(CCC(=O)N2CC(N=[N+]=[N-])C2)CCOC1 2010404403 RPXSLIKUHOPNIE-OAHLLOKOSA-N 339.396 1.972 10 10 EDCE C[C@H](N)c1ccc(N2CCN3C[C@H](O)C[C@@H]3C2)cc1Br 405388415 LRBICTBYEKCTLZ-CYZMBNFOSA-N 340.265 1.724 10 10 EDCE CC(=CC(=O)NCc1ccc2cccnc2c1O)CN1CCOCC1 2053336049 INMCQBXUPGVQIX-UHFFFAOYSA-N 341.411 1.835 10 10 EDCE CC1(C)[C@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 380770017 QBUWLPMEVFGTNQ-NEPJUHHUSA-N 340.221 1.751 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)cc1Br 2182555736 KPPRLZPSHLZPNP-RWDPWNMBSA-N 341.249 1.647 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3COC[C@]3(CO)C2)cc1Br 2234546824 CCSYKJBMRJVFOC-UEKVPHQBSA-N 341.249 1.914 10 10 EDCE COc1ncc(/C=C/C(=O)N2CC[C@H](C(N)=O)c3ccccc32)cn1 375405781 UDNBMEHVALHGLJ-UZYOAWRESA-N 338.367 1.504 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N[C@H]1CCCN(c2cccnn2)C1 2307987339 SUZAJMNXGYNYMT-AWEZNQCLSA-N 340.383 1.686 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2336471290 QKVQQCHMODZSRZ-RWEMILLDSA-N 345.262 1.702 10 10 EDCE CCOC[C@H](N)C(=O)NCc1ccc(C)c(Br)c1O 2352639118 VAXOTXZDTLFRHY-JTQLQIEISA-N 331.210 1.443 10 10 EDCE Cc1cc(O)c(O)cc1CCNS(=O)(=O)c1c(C)n[nH]c1C 170269413 UCPZZLNWIOIALB-UHFFFAOYSA-N 325.390 1.267 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1cccnc1 118775235 NJJLQVJYTNYKHM-MAUKXSAKSA-N 339.395 1.965 10 10 EDCE CCS(=O)(=O)N1CC(CN[C@H](C)c2ccc(F)c(F)c2O)C1 187928738 OJTQFTSHRLNRQK-SECBINFHSA-N 334.388 1.603 10 10 EDCE COCCNC(=O)[C@@H](C)N1CCCN(c2ccc(OC)cc2)CC1 122140468 FUUWOSJUSCEQQN-OAHLLOKOSA-N 335.448 1.358 10 10 EDCE CCCN(Cc1ccc(N)cc1)S(=O)(=O)NCC(F)(F)F 126030384 YHZIDWNVUBLZSU-UHFFFAOYSA-N 325.356 1.878 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2cc(Cl)cc(C)c2O)CCO1 529639483 DCEXWPKMNJRNGH-CYBMUJFWSA-N 327.812 1.484 10 10 EDCE O=C(Nc1nccs1)[C@H]1CCCN1C(=O)c1cccc(O)c1O 364390084 OYMJACAAZRTDPN-SNVBAGLBSA-N 333.369 1.798 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3cn[nH]c3)nc12 274140469 XFKYCVZKYLIPMQ-VIFPVBQESA-N 330.348 1.186 10 10 EDCE COC(=O)[C@@H]1C[C@@H](OC)CCN1Cc1ccc(N2CCOCC2)cc1 370368503 UQWFZFHORAMRAS-ROUUACIJSA-N 348.443 1.676 10 10 EDCE Cc1ccc(CNC(=O)[C@]2(N)C[C@@H](CO)C2)c(O)c1Br 2380754174 NROPENZWSDSSGZ-DEZZCRIOSA-N 343.221 1.179 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2C[C@H](O)CN2)c(O)c1Br 2380760756 AGYYPLCMIPIBSD-QWRGUYRKSA-N 343.221 1.144 10 10 EDCE Cc1ccc(CN(C)C(=O)CC2(O)CNC2)c(O)c1Br 2380769932 XECPECXWOLJJAA-UHFFFAOYSA-N 343.221 1.146 10 10 EDCE CC(=O)C(=O)COC(=O)C[C@](O)(c1nc(C)cs1)C(F)(F)F 808510429 SMFWOMBMZKNZNI-NSHDSACASA-N 339.291 1.293 10 10 EDCE C[C@H]1CC[C@H](NC(=O)NCc2cc(Cl)ccc2O)CS1(=O)=O 821968427 GYAQXBGDAXANSE-CABZTGNLSA-N 346.836 1.811 10 10 EDCE CCN(OC)C(=O)CNC(=O)NCc1ccc(N(CC)CC)cc1 825720797 FJSNTMSYQHZHEH-UHFFFAOYSA-N 336.436 1.742 10 10 EDCE CCC(=O)N[C@@H](CCSC)C(=O)NCc1cc(OC)ccc1O 734018667 BGONMASIHLHGFH-ZDUSSCGKSA-N 340.445 1.665 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cc3c(nc2O)CCOC3)cc1F 900434336 KRQXUPLHWRRTQF-UHFFFAOYSA-N 345.374 1.995 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@@H]1CCNC12CCCC2 903483964 NDDAZYGMGXHMCH-GOSISDBHSA-N 344.503 1.975 10 10 EDCE C[C@@H]1CCCN(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)C1 742026452 DXHCQXBGVDVAGA-LLVKDONJSA-N 347.462 1.447 10 10 EDCE Fc1cc(CN[C@H]2CNCCC2(F)F)ccc1N1CCOCC1 841074645 FLTJIKVEAIYFBK-HNNXBMFYSA-N 329.366 1.749 10 10 EDCE COC[C@@H](C)CS(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849416306 OLLRGCNLSILDNV-KGLIPLIRSA-N 342.461 1.476 10 10 EDCE Cc1cc(O)c(CN2CCN(CCN(C)C)C(=O)C2)c(Cl)c1 846013147 KGAQKKWJGQXPTI-UHFFFAOYSA-N 325.840 1.560 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C3(OC)CCOCC3)C2)cc1 855226546 QNIDGFVDAJTSCT-AWEZNQCLSA-N 334.416 1.586 10 10 EDCE C[C@H](Cn1ncc2ccccc2c1=O)NC(=O)c1cc(O)cs1 765403634 QSFBNEVIBATNAW-SNVBAGLBSA-N 329.381 1.982 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCN2C(=O)OCC[C@@H]2C1 764408748 WNXQDRPWPQAURW-MRXNPFEDSA-N 346.431 1.797 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCCCC[C@H](N)C1 868367224 HTJCBOLSCNCORO-INIZCTEOSA-N 347.459 1.861 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NCCc1cc(F)ccc1F 1117355277 UEXKREQTNWGULO-UHFFFAOYSA-N 348.349 1.988 10 10 EDCE CN(C)S(=O)(=O)c1ccc(C(=O)N2Cc3cccc(O)c3C2)o1 871197959 BFKZHNCUEBYQBY-UHFFFAOYSA-N 336.369 1.392 10 10 EDCE COC(=O)COc1ccc(N(C)CC(=O)N=c2cc[nH]cc2)cc1 1169186948 ANBOZBJQKNMRTN-UHFFFAOYSA-N 329.356 1.130 10 10 EDCE COC(=O)c1ccc(OCCNC(=O)c2c(F)ccc(O)c2O)cc1 1160766382 HQSIXZQGGSCANZ-UHFFFAOYSA-N 349.314 1.832 10 10 EDCE COC1CCN(c2ccc(CN3CCC(O)(C(N)=O)CC3)cc2)CC1 1170232401 NSVXHNNPCXDICK-UHFFFAOYSA-N 347.459 1.114 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3CC[C@@H]3C(N)=O)CC2)cc1C 1323515790 FFBSLLZTZJJAQB-LSDHHAIUSA-N 345.443 1.254 10 10 EDCE C[C@H](NC(=O)N[C@H](C)C(=O)NCC(F)(F)F)c1ccccc1O 1335692771 SQLLBRUYKBQYMR-DTWKUNHWSA-N 333.310 1.819 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)[C@H](O)[C@H](N)c1ccccc1O 1904964616 UUSJPOIVNJWDSQ-MCIONIFRSA-N 326.393 1.293 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@]2(C)CCNC(=O)C2)cc1C 1267390673 SFNMWPQFGAKJFK-IBGZPJMESA-N 347.459 1.468 10 10 EDCE COc1ccc(CNC[C@H]2CC[C@H](NC(=O)CC(N)=O)CC2)cc1C 1501691163 WMELZWIMRVAGIB-KOMQPUFPSA-N 347.459 1.644 10 10 EDCE CCOc1ccccc1C(=O)NCC(=O)NCc1c(O)cccc1O 1456234352 DPQGSTBGGFPLBJ-UHFFFAOYSA-N 344.367 1.543 10 10 EDCE C[C@H](CC(=O)NCc1c(O)cccc1O)NC(=O)c1ccccc1 1558534955 ZELHHLJMBJRFHT-GFCCVEGCSA-N 328.368 1.923 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1cccc(-c2nc(=O)o[nH]2)c1 1566358798 NBACJGSGNIQDDO-UHFFFAOYSA-N 327.296 1.371 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2cnn[nH]2)C(C)C)cc1C 1568456620 UFAWTZOKAHYHEY-AWEZNQCLSA-N 331.420 1.666 10 10 EDCE COc1cc(C(=O)N[C@@H](C)C[C@H](C)NC(=O)C(C)C)cc(OC)n1 1735553873 CEXJDBKLHHULGT-RYUDHWBXSA-N 337.420 1.768 10 10 EDCE C[C@H]1CO[C@H](C)CN1CCNC(=O)c1ccc(N=NC(N)=O)cc1 1640240088 OCHVLGVSJOYZQQ-NWDGAFQWSA-N 333.392 1.688 10 10 EDCE CCOc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)C)CC2)cc1 1596733589 UUGOSOIXJMRLDJ-KTKRTIGZSA-N 331.416 1.378 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccoc2C)cc1C 1699039019 IAWOKBYUXWKNQW-OAHLLOKOSA-N 332.400 1.786 10 10 EDCE C[C@@H](Oc1ccc(N)cc1)C(=O)Nc1ccc(N2CCOCC2)nc1 1860076083 QRQCGMUEYVYKSJ-CYBMUJFWSA-N 342.399 1.906 10 10 EDCE Oc1cccc(Br)c1CN[C@H]1COC2(CCC2)[C@@H]1O 2141560645 ZMMOJXLQWNKDDT-WCQYABFASA-N 328.206 1.927 10 10 EDCE CN1CCN(c2ccc(CNC(=O)N3CCC(CN)CC3)cc2)CC1 1119481959 AXWKPEUVIBBALD-UHFFFAOYSA-N 345.491 1.319 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H](N)CC(=O)O 1951454433 NHHKZUWYXZIRFW-MNOVXSKESA-N 340.376 1.336 10 10 EDCE CN1CC[C@@H](CNCc2cc(Br)cc(F)c2O)C1=O 1965964385 YFLSXXDPFOWVPA-QMMMGPOBSA-N 331.185 1.862 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1OCC[C@H]1CNC(=O)OC(C)(C)C 1985095002 XMSBIVVPYIKOMQ-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCO1 1985102720 KXXDBBOHTLIAAU-MNOVXSKESA-N 327.385 1.827 10 10 EDCE C[C@H]1OCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985101706 WNSVNQYHRFIRSO-KOLCDFICSA-N 325.369 1.532 10 10 EDCE OCCOC1CN(c2ccc(CNC3CC3)cc2Br)C1 2152288195 WMVWRCZPLJGNDL-UHFFFAOYSA-N 341.249 1.899 10 10 EDCE COCC1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 2010390821 JBDAGHTVKDXLPL-NSHDSACASA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)NCc1n[nH]c(=NCc2cccc(O)c2O)o1 2024268136 WXPMUGONPCYQHD-UHFFFAOYSA-N 336.348 1.540 10 10 EDCE Cc1cccc(CNC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)c1O 2024804341 IZNSPVHZBMFLKM-ZDUSSCGKSA-N 338.404 1.593 10 10 EDCE Oc1ccc(CNC[C@H]2CN(Cc3ccccc3)CCO2)c(O)c1O 311717857 XKYOXKBEUARFLN-INIZCTEOSA-N 344.411 1.794 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@]2(C)CO)c(Br)c1 698117175 UHCMZXJYOHKRQL-SWLSCSKDSA-N 343.265 1.881 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N(Cc3ccccc3)C[C@@H](C)O)c2n1 2062667364 HXGPHJWELRPWGA-CYBMUJFWSA-N 340.383 1.767 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3C[C@H]4C(N)[C@@H]4C3)ccc(N)c2C1 2071575427 ZKPZPHLFZWMKPC-ZIAGYGMSSA-N 344.459 1.955 10 10 EDCE COCC[S@](=O)CCNCc1c(O)cccc1Br 2085948991 UINUFVJAHGLUAH-GOSISDBHSA-N 336.251 1.639 10 10 EDCE CNCc1ccc(N2CC[C@H](C)[C@@H]2C(N)=O)cc1Br 2090267056 YSRGGKWOTQJSKV-TVQRCGJNSA-N 326.238 1.869 10 10 EDCE O=C1C[C@H]2CC[C@@H](CN1)N2c1ccc(CO)c(Br)c1 2114121357 LZEYFSWXZCUKJT-NEPJUHHUSA-N 325.206 1.799 10 10 EDCE O=S(=O)(CCNCc1ccc(Br)cc1O)C(F)F 2217602595 OKGKBWUJJBNDCZ-UHFFFAOYSA-N 344.177 1.882 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2242655886 HVLOQNRHTIDINT-MNOVXSKESA-N 325.369 1.268 10 10 EDCE Cc1ccc(CN2CC[C@H](NC(N)=O)C2)c(O)c1Br 2352946996 FOWRKCIOFBQKNP-JTQLQIEISA-N 328.210 1.706 10 10 EDCE Cc1cnn(C[C@@H]2CN(C(=O)/C=C/c3ccc(O)c(O)c3)CCO2)c1 181072286 HUTOPXIZKOOZJA-UJAVWCLSSA-N 343.383 1.544 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@H](NC(N)=O)C(C)C)CC2)cc1 193665731 FFDKEIGUIPJNRU-MRXNPFEDSA-N 348.447 1.427 10 10 EDCE C[C@]1(C(=O)O)CCN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 191041357 YHQBLHNVUWKBDC-QTWIXLPOSA-N 344.411 1.860 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@]1(C(=O)O)c1ccc(O)c(O)c1O 1952723831 LEBNBWMMBKEKRG-PSLIRLAXSA-N 325.317 1.423 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H](C)c3ncc[nH]3)CC2)cc1 285969294 HBKPVQTUFDXIQT-HNNXBMFYSA-N 329.448 1.891 10 10 EDCE O=C(CSc1n[nH]c(=O)[nH]1)NCc1c(O)ccc2c1CCCC2 288758688 KUXDHHVQBBYYLH-UHFFFAOYSA-N 334.401 1.091 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3ncncc3OC)C2)cc1 823411123 IFBXFNWDWTXQIW-GFCCVEGCSA-N 343.387 1.894 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H](CC3CCOCC3)C2=O)cc1 904135799 TXHNHRAMMINREL-INIZCTEOSA-N 331.416 1.990 10 10 EDCE Cc1cc(CC(=O)N[C@H]2CCC(=O)NC2=O)c(C)n1-c1ccccc1 830656845 SETGKTFKHMACEF-INIZCTEOSA-N 339.395 1.558 10 10 EDCE COc1cc(N2CCN(C(=O)CCF)CC2)cc(OC)c1OC 907371492 YXPSNIGXQMQDNA-UHFFFAOYSA-N 326.368 1.721 10 10 EDCE Cc1cc(C(=O)CN2CCOC[C@H](O)C2)c(C)n1-c1ccc(F)cn1 830638453 FREARZNNSQFNCX-OAHLLOKOSA-N 347.390 1.504 10 10 EDCE C[C@H]1CCNC[C@H]1NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 841975446 GEXHUYZWTFZIFX-MAUKXSAKSA-N 346.475 1.663 10 10 EDCE COC[C@@H]1CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])C[C@@H](C)O1 844212035 OVNPZIUTFCLHQU-FJYXQWIHSA-N 336.344 1.933 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NC[C@H](OC)[C@H]2CCOC2)c1 852440839 VMHSPQMTTBRUJJ-MKBNYLNASA-N 338.404 1.813 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC(F)(F)CN)C2)cc1 851664039 PHUUCWKASSWQRS-LLVKDONJSA-N 328.363 1.167 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC[C@@H]2CCCCO2)c1 754789251 DDUIAXWQGUBILF-LBPRGKRZSA-N 343.401 1.880 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(CO)(CO)C1 854176504 HEEXVTYQBBLCAN-HNNXBMFYSA-N 349.475 1.378 10 10 EDCE C[C@@H]1CNCC[C@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851664363 XZFCAJLCXKHREC-RDTXWAMCSA-N 346.475 1.445 10 10 EDCE CCC(=O)N1CC[C@@H](C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 855234028 QVHXZUMWHQDOLK-CABCVRRESA-N 345.443 1.649 10 10 EDCE O=S(=O)(c1cccc2c1OCCO2)N1Cc2cccc(O)c2C1 867691440 WMNIXENBNIWKLY-UHFFFAOYSA-N 333.365 1.868 10 10 EDCE COC(=O)[C@]1(OC)CCN(Cc2ccc(N3CCN(C)CC3)cc2)C1 862475673 SQGACFMEZYLKJH-IBGZPJMESA-N 347.459 1.202 10 10 EDCE COC(=O)CC1(CS(=O)(=O)N2Cc3cccc(O)c3C2)CC1 867691415 VZPHEIKLYIAYAW-UHFFFAOYSA-N 325.386 1.381 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CO[C@H](C3CC3)C2)c1 863284750 CYBYOPWMAJANTO-FZMZJTMJSA-N 340.401 1.061 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN[C@@H]2CCN(C3CCC3)C2=O)c1O 862550767 HPWPYHKAEDITTC-GFCCVEGCSA-N 335.360 1.552 10 10 EDCE Cn1ncc(S(=O)(=O)N2Cc3cccc(O)c3C2)c1C(F)(F)F 867690562 ITTFJEIUJZXWKN-UHFFFAOYSA-N 347.318 1.849 10 10 EDCE CNC(=O)[C@@H]1CCN(Cc2c(C(=O)OC)n(C)c3ccc(F)cc23)C1 895034012 OKJIRVYMPJWFRL-LLVKDONJSA-N 347.390 1.672 10 10 EDCE C[C@@H](NC(=O)c1ccc(=O)n(-c2cnn(C)c2)c1)c1ccccc1O 1151886149 XQJJBLFLPUHWOR-GFCCVEGCSA-N 338.367 1.768 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(O)CCO[C@H]1C 1306079654 CUCUEPAWXGNJCN-UGSOOPFHSA-N 346.431 1.722 10 10 EDCE NC(=O)N[C@H](CC(=O)NCc1cc(O)ccc1O)c1cccs1 1176748318 OQXBWHIXMFSSOG-LLVKDONJSA-N 335.385 1.575 10 10 EDCE CNCc1ccc(N(C)C[C@]2(O)CCOC2)cc1Br 2129431601 QBTCUQWHIRPZLO-CQSZACIVSA-N 329.238 1.756 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H](O)C(C)(C)NC(=O)OC(C)(C)C 1900608009 UOJABMULBGCGIV-SNVBAGLBSA-N 329.401 1.809 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NC[C@H]2C[C@@H](N(C)C)C2)cc1 1347178191 LJVVQRGQYCLCBG-OTVXOJSOSA-N 349.431 1.043 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NCc1cc(C2CC2)no1 1353839399 KIOFWQBRZONKQU-UHFFFAOYSA-N 329.356 1.532 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)C[C@@H]2COC(=O)C2)cc1C 1281707585 NLKQOZJPOVGAKX-HOCLYGCPSA-N 348.443 1.941 10 10 EDCE Cc1noc(C)c1CN1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1464163799 HPLNPVNMMVCDEB-UHFFFAOYSA-N 345.399 1.590 10 10 EDCE COC(=O)NCC(=O)NCC1(NCc2ccc(OC)c(C)c2)CCC1 1700128189 MRBMTYUKPVDHSP-UHFFFAOYSA-N 349.431 1.488 10 10 EDCE Cc1cn2c(=O)c(C(=O)NCc3c(O)cccc3O)cnc2s1 1472063653 NAAQNCPMVBBFEJ-UHFFFAOYSA-N 331.353 1.406 10 10 EDCE CNC(=O)Nc1cccc(C(=O)NCCc2ccc(O)c(O)c2)c1 1545669366 XIDJJHMCKNDMBZ-UHFFFAOYSA-N 329.356 1.822 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2cccs2)cc1C 1485969662 FVZWJFJCRUXZCA-CQSZACIVSA-N 334.441 1.946 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1ncc(Cl)cn1 1631069637 JKQLYKAXZVKHPD-UHFFFAOYSA-N 332.791 1.897 10 10 EDCE Cn1nnnc1-c1ccccc1NC(=O)/C=C\c1ccc(O)c(O)c1 1646293764 CTHPIBPUUOASIW-CLFYSBASSA-N 337.339 1.940 10 10 EDCE Cn1cc(C(=O)NCc2cccc(Br)c2O)n(C)c1=O 1640084253 PEPLBSQYKOELOP-UHFFFAOYSA-N 340.177 1.122 10 10 EDCE C[S@@](=O)C[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccccc1 1586034770 HQBQIDPDFSFSEL-LFVRLGFBSA-N 333.409 1.876 10 10 EDCE NCc1ccc(N2CCC[C@H]3C(=O)NC[C@@H]32)c(F)c1Br 231840959 ICKGEHLAHQOXHT-KOLCDFICSA-N 342.212 1.762 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@@H](NC(N)=O)C2)c([N+](=O)[O-])c1 1772905952 UYABMPKGHMNNCW-USEMIUTHSA-N 334.332 1.028 10 10 EDCE C[C@H](NC(=O)CN1C(=O)/C(=C/c2ccco2)SC1=S)C(=O)O 15036968 JQMABCMYYSNKIL-VYVBZAQUSA-N 340.382 1.070 10 10 EDCE COCCNC(=O)[C@H](C)N1CCN(c2ccc(OC)c(F)c2)CC1 151361024 YMLLFIYQCPGQGJ-ZDUSSCGKSA-N 339.411 1.107 10 10 EDCE COC(=O)CCC(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1865957521 NHIJYVNTWUBTKG-KRWDZBQOSA-N 344.415 1.645 10 10 EDCE Cc1cc(C(=O)Nc2cccc(N(C)C)c2)cc(S(N)(=O)=O)c1 1868180649 MDELZQGWXUQBHE-UHFFFAOYSA-N 333.413 1.961 10 10 EDCE COC(C)(C)n1cc(C(=O)C(=O)c2cnn(C(C)(C)OC)c2)cn1 1857779131 SOPYAAADCABNKC-UHFFFAOYSA-N 334.376 1.823 10 10 EDCE CO[C@H](C(=O)O)C1CN(Cc2ccc(Br)cc2O)C1 1875982616 VJJIBRJTWLXHCC-LBPRGKRZSA-N 330.178 1.686 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(CO)CNCc1cccc(F)c1O 1876122022 CNIWVEJUSRIWJB-INIZCTEOSA-N 328.384 1.897 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC[C@@H](N=[N+]=[N-])C1)C(C)(C)O 2014480879 UWSIYJZXHCGMKK-GHMZBOCLSA-N 341.412 1.952 10 10 EDCE CN1CCN(CCNCc2cccc(Br)c2O)CC1 48797297 CZZCOUDKZFFZQM-UHFFFAOYSA-N 328.254 1.492 10 10 EDCE CN[C@@H](C)c1ccc(N2CCOC[C@H]2CO)cc1Br 300514630 JIIMYEVLTJISAU-CMPLNLGQSA-N 329.238 1.927 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C(=O)NC(=O)[C@H]3C2)c(Br)c1 387450931 QQUVZTCLKZKVQV-JEZHCXPESA-N 338.205 1.178 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)cc1Br 2173317244 KCBSCCLWQDNUQP-LFNVJSRFSA-N 341.249 1.789 10 10 EDCE CNCc1ccc(N2CC(C(=O)NC3CC3)C2)c(Br)c1 2168046344 DQFRJTILNFHXLD-UHFFFAOYSA-N 338.249 1.883 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CC(=O)NCc2ccc(N)cc2)C1 2080754318 SGEFSYKCUWNYQI-SFHVURJKSA-N 349.431 1.647 10 10 EDCE C[C@H]1[C@@H](C)N(c2ccc(CO)cc2Br)CCS1(=O)=O 2113962111 PNEVFRBAZRNXDC-ZJUUUORDSA-N 348.262 1.953 10 10 EDCE C[C@@H](N)c1ccc(N(C)[C@H]2CC(=O)NC2=O)cc1Br 2114737839 PRBUBXVFVQBNBC-HQJQHLMTSA-N 326.194 1.320 10 10 EDCE CC1(C)CC[C@@H](COc2nnc(=N)[nH]n2)N(C(=O)OC(C)(C)C)C1 2213780833 KTCMWAQLVFRJTP-JTQLQIEISA-N 338.412 1.484 10 10 EDCE CN1CC2(CCN2c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2238612093 WRNDYSALPSKSFN-LBPRGKRZSA-N 337.221 1.295 10 10 EDCE CC(C)(C)OC(=O)NCCCN(CCO)Cc1cc(N)ccc1O 2247478792 IWSFEKVUKDKTRS-UHFFFAOYSA-N 339.436 1.684 10 10 EDCE Cc1cc(C)c(N2C(=O)NC(=O)C(=CNCCN(C)C)C2=O)c(C)c1 2296125877 RVNGDTBDHXLVTP-UHFFFAOYSA-N 344.415 1.230 10 10 EDCE O=C1NC(=O)N(Cc2ccccc2)C(=O)C1=CNCc1ccccc1 2297312821 CBBNVSJGXIIXNR-UHFFFAOYSA-N 335.363 1.939 10 10 EDCE COC(=O)COc1ccc(N(C)C(=O)/C=C\c2cnccn2)cc1 492466645 XLNGURFTLAZWGS-BAQGIRSFSA-N 327.340 1.705 10 10 EDCE COC(=O)C[C@](C)(N)c1cc(I)ccc1O 1951852564 DMGQHFWWNQOLKO-NSHDSACASA-N 335.141 1.734 10 10 EDCE OC[C@@H](NO)c1cc(Br)cc(Br)c1O 306672777 MKBKGTGPXAQIGZ-SSDOTTSWSA-N 326.972 1.929 10 10 EDCE C[C@@H](NCCCn1ccnn1)c1ccc(N2CCOCC2)c(F)c1 184264985 YZUBBKCTUWDMJT-CQSZACIVSA-N 333.411 1.995 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(c2cccnn2)CC1 181011172 MOAINZJZRQZITO-GQCTYLIASA-N 326.356 1.250 10 10 EDCE CCOc1ccc(O)c(CN2CCC(C(=O)NCCN(C)C)CC2)c1 92615832 CUFCGKZZOQEOKG-UHFFFAOYSA-N 349.475 1.681 10 10 EDCE N[C@H]1CCC[C@@H](C(=O)NCc2ccc(N3CCNCC3)c(F)c2)C1 238017481 COJBLAXISRVTII-CABCVRRESA-N 334.439 1.369 10 10 EDCE CN1C(=O)[C@H](N=N[C@@H]2CCC[C@H]([N+](=O)[O-])C2)[C@H](O)[C@H]2CCCC[C@@H]21 299804213 IWFZIMAGKPMOOH-MNQBEEPXSA-N 338.408 1.787 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N1CCC[C@@H](CO)C1 255088371 RPDFUPJFZCXFEW-CTEOGUNLSA-N 330.428 1.767 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CCC(=O)NC2)c(O)c1Br 2380744162 BXHPRRBCLYMSRA-JTQLQIEISA-N 341.205 1.606 10 10 EDCE CS(=O)(=O)CCC(=O)NCc1cc(Br)ccc1O 807739715 OFHCKMJKOMCLEW-UHFFFAOYSA-N 336.207 1.206 10 10 EDCE CN1CCN(CC(=O)NCc2cc(Br)ccc2O)CC1 804735589 FNTWJJVNPWSXPA-UHFFFAOYSA-N 342.237 1.018 10 10 EDCE C[C@@H](O)C1CCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 297764607 HSQDRYVOCNBROP-CQSZACIVSA-N 347.459 1.330 10 10 EDCE COc1ccc(N2CCC[C@@](O)(CN)C2)c(OC)c1Br 2162631401 ONOIISVTDFUXNX-CQSZACIVSA-N 345.237 1.756 10 10 EDCE COc1cc(O)c(CN2CCS(=O)(=O)[C@H]3CCC[C@@H]32)cc1OC 825201026 IIKKVDSNWDMFCU-LRDDRELGSA-N 341.429 1.561 10 10 EDCE CCOC(=O)CN(Cc1cn(CC2CC2)nn1)Cc1ccccc1O 823576317 MOJRRYIGBZYQAU-UHFFFAOYSA-N 344.415 1.959 10 10 EDCE CCOC[C@@H](C(=O)O)N(C)C(=O)NCc1ccc(N2CCCC2)cc1 908846576 AEQOSABIGHCKLO-INIZCTEOSA-N 349.431 1.918 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CC1(O)CCOCC1 905456544 JVOQYDKATURYKF-UHFFFAOYSA-N 348.443 1.413 10 10 EDCE C[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@@H]1CN 923496408 IAGDYXOKFQHRGR-NVXWUHKLSA-N 332.492 1.628 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H](C(=O)O)C3CC3)CC2)cc1 852952160 VUWKZCYZICXODT-INIZCTEOSA-N 332.400 1.845 10 10 EDCE CCc1onc(C)c1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 929238602 QAOSYOQBIJGMBJ-UHFFFAOYSA-N 344.415 1.544 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CNCCS(=O)(=O)CC(F)(F)F)c1 850364308 ZZICXNQCZUJQJS-UHFFFAOYSA-N 342.295 1.367 10 10 EDCE CC(C)(C)OC(=O)[C@]1(NC(=O)/C=C/c2ccc(O)c(O)c2)CCOC1 855639091 ADKOCSGOJULBAS-FZMUQLTDSA-N 349.383 1.728 10 10 EDCE O=C(NCC[C@H]1CCOC1)NCc1ccc(N2CCC(O)CC2)cc1 852251524 POFBTOCZIAURTI-INIZCTEOSA-N 347.459 1.874 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](O)c3ccccn3)C2)cc1 855227670 ZYYHMKSGXBCMPP-GUYCJALGSA-N 327.384 1.519 10 10 EDCE COC(=O)c1cc(OCC(=O)Nc2cc(C)nn2C)ccc1N(C)C 865396515 UOAIKFLUKWWSJM-UHFFFAOYSA-N 346.387 1.599 10 10 EDCE COc1cc(COCC(=O)NCc2cccc(OC)c2O)ccn1 860241934 VEBQEMUSTUNIAH-UHFFFAOYSA-N 332.356 1.637 10 10 EDCE Cn1nnc2c1C[C@H](C(=O)NCc1ccc3cccnc3c1O)CC2 862026092 GOOOKIMMEMFIML-GFCCVEGCSA-N 337.383 1.490 10 10 EDCE C[C@@H]1CC[C@@H](O)CN1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 899098408 NKZLWUNTZGVWIQ-OLMNPRSZSA-N 348.491 1.910 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CNC[C@@]2(O)[C@@H]3[C@@H]4[C@H]5[C@H]6C[C@@H]4[C@H]2[C@@H]6C[C@H]53)c1 785546870 UCNDREIOMPZOSC-MEXZNVEISA-N 342.395 1.899 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN(C2CC2)C(=O)C1 896837972 LYRXTAFROOJSKN-UHFFFAOYSA-N 332.381 1.759 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)[C@@H](CO)C2)c(Br)c1 704451145 JDQAIDOBBRKCLH-JLLWLGSASA-N 330.222 1.539 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@]1(O)CCN(Cc2ccccc2)C1 1176748204 MNYNEVMAKVCOSH-IBGZPJMESA-N 342.395 1.351 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@]2(O)C[C@H]2C1 1327292611 PTIQWZPJSKKVRD-HNAYVOBHSA-N 345.443 1.084 10 10 EDCE O=C1CC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCN1 1328509500 OXPKZDABHZSGSL-HNNXBMFYSA-N 345.443 1.180 10 10 EDCE Cn1c(C2=C[C@H](O)[C@@H](N)C2)nc2c(Br)cc(F)cc21 2131466948 VIXIUENYVSTPQB-ONGXEEELSA-N 326.169 1.950 10 10 EDCE CC(C)OC1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1335547810 FSHLECYYKUBQNX-UHFFFAOYSA-N 332.400 1.650 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@]23CCOC3)cc1 1345246752 NFAJMJDBGGLOAG-LJQANCHMSA-N 345.443 1.540 10 10 EDCE CC(C)[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCS1 1261864000 RLYGUWOUDFDJFX-HNNXBMFYSA-N 334.441 1.834 10 10 EDCE CC[C@@H](C)CN[C@@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1507266759 IADHTXCDTDLMEI-BXUZGUMPSA-N 335.408 1.575 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@H](O)C3)c(Br)cc21 221246689 XTQUEDDFUGHJLU-KRTXAFLBSA-N 326.194 1.233 10 10 EDCE C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)c1cc(O)cs1 1443280492 GNKCEUGJNDDOSY-SECBINFHSA-N 340.426 1.934 10 10 EDCE CN(C)c1ccc([C@@](C)(O)[C@@H](NC(=O)OC(C)(C)C)C(=O)O)cc1 1917210309 ZWJONGDJOGIBTM-SUMWQHHRSA-N 338.404 1.938 10 10 EDCE C[C@H](NC(=O)[C@H](NC(=O)C1CCCC1)[C@@H](C)O)c1ccccc1O 1454817305 JVHGYUFJHDHRKR-HWWQOWPSSA-N 334.416 1.625 10 10 EDCE NC(=O)c1ccc(OCCC(=O)NCc2ccc(O)cc2O)cc1 1299573952 MBVWWFYDZYFYPW-UHFFFAOYSA-N 330.340 1.282 10 10 EDCE O=C(O)[C@H]1C[C@@H](O)CCN1Cc1ccc(Br)cc1O 2136391273 WXTAPYLCVTWPNN-WDEREUQCSA-N 330.178 1.565 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1cnn(CC(F)(F)F)c1 1545488755 YIEOWEMZXATWMH-UHFFFAOYSA-N 329.278 1.716 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1(S(N)(=O)=O)CC1 1540567658 VKUBHYGPKTUZHE-UHFFFAOYSA-N 337.445 1.066 10 10 EDCE COc1cc(C(=O)NC2CC(N(C)C(=O)C=C(C)C)C2)cc(OC)n1 1701908795 RHJFOMOLLAUIEB-UHFFFAOYSA-N 347.415 1.784 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@H](C)NC(=O)C(F)F 1486627206 KCXXDGJQPFUGHF-YUMQZZPRSA-N 341.318 1.737 10 10 EDCE CCN(CCNCc1nnnn1-c1ccc(OC)cc1)C(=O)C(C)C 1715720877 SFSSJTDUVBJSJG-UHFFFAOYSA-N 346.435 1.265 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@H]2COC(=O)N2)C2CC2)cc1C 1713109404 UYJWDPGHVMBDEO-HUUCEWRRSA-N 347.415 1.096 10 10 EDCE CN(C)C(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1628568731 SPEBDVGKMDRHIL-UHFFFAOYSA-N 332.364 1.288 10 10 EDCE CC(=O)N/C(=C\c1ccccc1)C(=O)NCc1cccc(O)c1O 1633509347 ULXJYNDMQGHUMO-GDNBJRDFSA-N 326.352 1.891 10 10 EDCE O=C(COc1ccc2c(c1)CCC(=O)N2)NCc1ccc(O)cc1O 1639441089 IQCSRBRQANTPBL-UHFFFAOYSA-N 342.351 1.678 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)c2[nH]nnc2C)cc1C 1725138048 XHRZJAQJZQEEDB-VXGBXAGGSA-N 331.420 1.727 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@@H]2[C@H]3COC[C@H]32)C2CC2)cc1C 1569315099 SMZPBQYKKUFZJE-NTDBWNAOSA-N 344.455 1.880 10 10 EDCE Cn1cc(-c2nn(C)cc2C(=O)N2CCc3cc(F)cnc32)cn1 1596882292 YUSIHSIVPKGULE-UHFFFAOYSA-N 326.335 1.558 10 10 EDCE CCOC(=O)CN1C(=O)/C(=C2\SC(=S)NC2=O)c2ccccc21 5458422 JQEOOUQMORNYIB-QXMHVHEDSA-N 348.405 1.455 10 10 EDCE COc1ccc(N2CCN(C(=O)CC[C@H]3CCC(=O)N3)CC2)cc1 822197084 KHIUFDRYCRDFJM-CQSZACIVSA-N 331.416 1.403 10 10 EDCE OC[C@@H]1CN(c2ccc(CNC3CC3)c(Br)c2)CCO1 236518125 BZMZUQXHGNVEIX-AWEZNQCLSA-N 341.249 1.899 10 10 EDCE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CCN1C(=O)c1cccc(O)c1O 1965241524 PMSIRPMTEWVXEV-RKDXNWHRSA-N 346.305 1.769 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cccc(F)c2O)[C@@H](O)C1 1966002131 GJAIFFCRBIRDAK-KGLIPLIRSA-N 340.395 1.991 10 10 EDCE CCOc1cccc(CNC[C@H](O)CNC(=O)OC(C)(C)C)c1O 2011421566 KDTZEPDHVPDLFQ-ZDUSSCGKSA-N 340.420 1.766 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](C)NC(=O)c1cc(O)c(O)c(O)c1 2015126792 YRPKYQKYWLPIIE-BDAKNGLRSA-N 340.376 1.835 10 10 EDCE O=C1CCC(=O)N1CCNCc1cc(Br)ccc1O 405450641 PKCCAXYOPSURMA-UHFFFAOYSA-N 327.178 1.393 10 10 EDCE C[C@H](O)CN1CCCN(c2ccc(CO)cc2Br)CC1 2176853155 CWQFVDSBPRNDKB-LBPRGKRZSA-N 343.265 1.834 10 10 EDCE NCc1ccc(N2C[C@@H](O)[C@@H](O)CC23CCC3)c(Br)c1 2169893495 CSJKKWXZWIFMKS-UONOGXRCSA-N 341.249 1.762 10 10 EDCE O=C1Nc2cc(N3CC=CC[C@H]3CO)c(Br)cc2[C@H]1O 2176377905 MUXSZXVCXFGNGZ-ISVAXAHUSA-N 339.189 1.562 10 10 EDCE CN1CC[C@H]2OCCN(c3ccc(CN)cc3Br)[C@H]2C1 2185497272 PECLKHNHNWPTOC-LSDHHAIUSA-N 340.265 1.817 10 10 EDCE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(C(=O)c2ccc(O)c(O)c2)C1 2054420768 XWBRYENERLGJRM-SCZZXKLOSA-N 346.305 1.627 10 10 EDCE CNCc1ccc(N2C[C@H]3OCCO[C@@H]3C2)c(Br)c1 2093350053 XHZZSVWPPHZINP-ZIAGYGMSSA-N 327.222 1.773 10 10 EDCE C[C@@H](N)c1ccc(N(CCO)CCN(C)C)c(Br)c1 2099358235 YDIFHHSOFRQVJR-LLVKDONJSA-N 330.270 1.829 10 10 EDCE CC(C)(O)[C@@H]1CN(c2ccc(CO)c(Br)c2)CCO1 2117515943 KGLGSRLZFIUINZ-ZDUSSCGKSA-N 330.222 1.918 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(NCc2ccc(O)c(O)c2O)C1 2216759279 QJLJEJWKBGNCTC-PIGZYNQJSA-N 336.388 1.902 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CCOCCN1C(=O)OC(C)(C)C 2244008696 BBXIJDFWLCNHEZ-NSHDSACASA-N 327.385 1.781 10 10 EDCE CN(C(=O)/C=C/c1cnccn1)c1ccc(S(=O)(=O)N(C)C)cc1 493574690 AKIFMMZXYNODOJ-RUDMXATFSA-N 346.412 1.403 10 10 EDCE O=C(N[C@@H](CCO)COCc1ccccc1)c1cc(O)nc(O)c1 2303562518 UYCWLNAECZPNHP-AWEZNQCLSA-N 332.356 1.190 10 10 EDCE Nc1ccc(Cn2cncc(I)c2=O)cc1 85464354 WTZVKEJLRCZYMC-UHFFFAOYSA-N 327.125 1.478 10 10 EDCE COc1ccc(N2CCN(C(=O)NC[C@H]3CCCO3)CC2)cc1OC 243055252 IHFYHCNWWHKCJX-OAHLLOKOSA-N 349.431 1.714 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N(C)c2cccnc2N(C)C)c1 255077898 NZMVRVQIQZJDPC-FPLPWBNLSA-N 339.399 1.578 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C1C[C@H]2CNC[C@@H](C1)C2=O 368771608 ZTCQRLUWMDAEPB-MQVJKMGUSA-N 330.428 1.946 10 10 EDCE Cc1ccc(CNC(=O)C23CC(N)(CO2)C3)c(O)c1Br 2380753154 CROPWNYNXRMWOT-UHFFFAOYSA-N 341.205 1.340 10 10 EDCE CC(=O)C(=O)COC(=O)C1=Cc2cc(Br)ccc2OC1 808493517 IMFYNVKYRGKEQZ-UHFFFAOYSA-N 339.141 1.926 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc(Br)cc([N+](=O)[O-])c1 808529643 OGBYKSPSYAASSK-UHFFFAOYSA-N 330.090 1.672 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H](C)SC)CC2)cc1 299298397 APPGMQFEQOCHCR-CQSZACIVSA-N 337.489 1.685 10 10 EDCE COC(=O)c1cc(Br)cc(C(=O)OCC(=O)C(C)=O)c1 812698478 OEQPHLNNOJICIW-UHFFFAOYSA-N 343.129 1.551 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cn([C@@H]3CCCNC3)nn2)c1 818213602 IYOAZZLAKOCUMG-NWDGAFQWSA-N 345.403 1.408 10 10 EDCE O=C(C1CC1)[C@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)CCO1 811501892 BUZNATFYYWQSFC-GOSISDBHSA-N 348.418 1.842 10 10 EDCE C[C@@H](NCCS(=O)(=O)N=S(C)(C)=O)c1ccc(N(C)C)cc1 903230331 ZUDABICNSOEDJN-GFCCVEGCSA-N 347.506 1.461 10 10 EDCE CCCc1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n[nH]1 735116191 CIWOZMMCAJXXSU-UHFFFAOYSA-N 338.389 1.692 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)N1CC(S(N)(=O)=O)C1 910522999 RRIVCQJHVXQBAE-UHFFFAOYSA-N 339.442 1.269 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CC(=O)NCCCN=[N+]=[N-])C1 1895876413 VBJFPQQNWTTWRH-GHMZBOCLSA-N 327.385 1.421 10 10 EDCE CN1CCN(c2ccc(CNCC(C)(C)[C@]3(O)CCOC3)cc2)CC1 842757795 BVBBQHLSRDRKAB-FQEVSTJZSA-N 347.503 1.706 10 10 EDCE CC[C@@H](NC1CN(S(=O)(=O)N(C)C)C1)c1ccc(F)cc1O 858572223 QHNXQCKKBBAPQS-CYBMUJFWSA-N 331.413 1.063 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCC(=O)N(C)CC2)cc1 853456004 CIPPQIKWJZSGLB-UHFFFAOYSA-N 332.448 1.907 10 10 EDCE COCC1(CNC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 852402575 NLDBNIBIIXXWJB-AWEZNQCLSA-N 333.432 2.000 10 10 EDCE COc1ccc(O)c([C@H](C)NCc2coc(S(N)(=O)=O)c2)c1 851899576 AAINWUOKNROBST-VIFPVBQESA-N 326.374 1.492 10 10 EDCE C[C@H]1C[C@H](NCc2ccc(N3CCN(C)CC3)cc2)c2ncnn21 850352290 REFCGPFVDUNZBT-YOEHRIQHSA-N 326.448 1.826 10 10 EDCE COc1ccc(CNC(=O)c2cn([C@@H]3CCCNCC3)nn2)c(O)c1 852890735 LSBMZGTXDBMVBO-CYBMUJFWSA-N 345.403 1.237 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CC[C@@H](C)NC1 861803842 GKAGCVSNTIMKLM-UKRRQHHQSA-N 333.432 1.388 10 10 EDCE Cn1nccc1[C@@]1(O)C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(O)c1O 899779237 OFCMDFGBCKOZGE-FVGIMDHTSA-N 343.383 1.486 10 10 EDCE C[C@H](OCc1ccccc1)[C@H](NC(=O)Cc1ccc(N)cc1)C(=O)O 706132613 UQQHCUKFEBIMAK-UGSOOPFHSA-N 342.395 1.986 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3[C@H](C)C[C@H]3C)CC2)cc1 791567310 JJPWVWLWELRDGQ-NUJGCVRESA-N 333.476 1.661 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)NC[C@](C)(O)CO)c2C)cc1 798264594 LLTBNNMOTSHFLS-SFHVURJKSA-N 332.400 1.576 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H](O)Cc1ccc(F)cc1 1155514795 YRBLCPHILFJJKW-SGJXGLNRSA-N 331.343 1.970 10 10 EDCE COc1ccc(CNC2(CNC(=O)C34CCN(CC3)C4)CC2)cc1C 1277225198 PHVGBSURZWCEME-UHFFFAOYSA-N 343.471 1.838 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H](C)n2cccn2)cc1C 1272371469 MABVQMODBBOBPZ-HOCLYGCPSA-N 346.431 1.028 10 10 EDCE O=C(O)[C@@]1(CO)CCN(Cc2ccc(Br)cc2O)C1 2136396746 FYXZYEWQHAQKRA-ZDUSSCGKSA-N 330.178 1.424 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CCO[C@@H]1C 1466398046 GVIHVOVZFVEZSK-ZWNOBZJWSA-N 341.791 1.972 10 10 EDCE CN(C)CCN(Cc1ccccn1)C(=O)Cc1ccc(O)c(O)c1 1464969443 QFLSBHVCWUGKKA-UHFFFAOYSA-N 329.400 1.626 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@H](C)NC(=O)C2CCC2)cc1 1498002082 HRTMIETXKHQDLE-LBPRGKRZSA-N 344.419 1.065 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccnc(OC)n1 1557113455 FGCZGNRHMYKPMT-UHFFFAOYSA-N 345.355 1.396 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2C[C@H]2[C@H]2CCCO2)c1 1631493513 PCFINLCMDGRESC-MPKXVKKWSA-N 340.401 1.061 10 10 EDCE Cc1ccnc(O)c1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1633252859 SMBQBQRVYPMXQF-UHFFFAOYSA-N 340.427 1.777 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H]2CC[C@@H](C(N)=O)C2)cc1C 1497910675 MCVXRIUQGNICSF-BMFZPTHFSA-N 347.459 1.500 10 10 EDCE O=C(N[C@H]1CC(=O)N(c2ccccc2F)C1)c1c(F)ccc(O)c1O 1651048470 JLRKTNGYQNNOOU-VIFPVBQESA-N 348.305 1.911 10 10 EDCE O=C(CCC(=O)N1Cc2cccc(O)c2C1)Nc1nnc(C2CC2)o1 1587929088 WSONPRKKROJKDJ-UHFFFAOYSA-N 342.355 1.914 10 10 EDCE CN1NC(=O)[C@H](CC(=O)Nc2nc3ccc(Cl)cc3s2)C1=O 169996326 CHHKZAFRWSWTJM-ZETCQYMHSA-N 338.776 1.398 10 10 EDCE CC(=O)N1[C@H](C(=O)NCCN(C)C)CS[C@@H]1c1ccccc1O 27910607 ZTGKQJSKRCYCRF-XJKSGUPXSA-N 337.445 1.033 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H](O)CN(CCc2ccc(N)cc2)C1 2002704908 XMZYJJGWDIZJHK-HOTGVXAUSA-N 335.448 1.771 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2c(O)cccc2F)[C@H](O)C1 1972707525 ODFUDFZLJKKZMU-UKRRQHHQSA-N 340.395 1.991 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010398991 XONIKSJIUWWPSP-CMPLNLGQSA-N 341.412 1.809 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010406513 VPCDVPLSORRUBY-TUAOUCFPSA-N 341.412 1.952 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCCCn1ccnc1 2042958917 AHBNQDQVMPLEJP-UHFFFAOYSA-N 340.427 1.939 10 10 EDCE O=C(O)[C@@]12CN(Cc3c(O)cccc3Br)C[C@@H]1CCO2 706628634 VYLVONQNBILYJD-LKFCYVNXSA-N 342.189 1.830 10 10 EDCE COCC1(O)CN(c2ccc(CNC3CC3)c(Br)c2)C1 384091000 BSPHMGZRNWOFDE-UHFFFAOYSA-N 341.249 1.899 10 10 EDCE CCNCc1ccc(N2CC3(CNC(=O)C3)C2)c(Br)c1 2176161777 UJBYIGUDVNDUPG-UHFFFAOYSA-N 338.249 1.885 10 10 EDCE O=C(NCc1ncccc1Br)c1cc(O)c(O)c(O)c1 2188927525 FNVOLVWIECXUJQ-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE OCc1ccc(N2CCO[C@@H]3COCC[C@@H]32)c(Br)c1 2087482945 GDLFPIOSYDTGQL-UONOGXRCSA-N 328.206 1.936 10 10 EDCE O=C1NC(=O)N(c2ccccc2Cl)C(=O)C1=CNN1CCCCC1 2297057264 VWMYPSYUGGKKJG-UHFFFAOYSA-N 348.790 1.797 10 10 EDCE CC1(O)CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CC1 2299194577 GBNYFKWHBYADHQ-UHFFFAOYSA-N 330.428 1.910 10 10 EDCE CN[C@@H](C)c1ccc(N2CC[C@@H](O)[C@@H](O)C2)cc1Br 2331777411 YJQXTPKPSMXJNJ-FZZIBODNSA-N 329.238 1.661 10 10 EDCE CO[C@H]1CN(C)C[C@@H]1NCc1ccc(C)c(Br)c1O 2352689748 PLNUBCYWWFZOHW-RYUDHWBXSA-N 329.238 1.882 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N[C@H]2CCC(=O)N(C)C2)cc1 172357401 UTUCZNSEDUQDAR-HNNXBMFYSA-N 332.448 1.953 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCSCC3)c(Br)cc21 92774985 KKIBPGGJJNXECS-NSHDSACASA-N 328.235 1.954 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2C[C@@H](C)Oc3ncccc32)c1 255777152 VWKBHVJXTHHYKX-FOQNGQEVSA-N 338.367 1.664 10 10 EDCE COc1ncc(/C=C/C(=O)N2Cc3cnnn3Cc3ccccc32)cn1 373747431 VLCVVEIPEQJPCO-VOTSOKGWSA-N 348.366 1.685 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)c1 289595783 UWJJXMILXQYMBK-HNNXBMFYSA-N 342.461 1.647 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)COCc1nncn1C 293920685 XVNKHVRDGFEGMA-UHFFFAOYSA-N 345.447 1.835 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2COC[C@@H](C)N2)c(O)c1Br 2380748487 FJDODQXMHHBUQX-MWLCHTKSSA-N 343.221 1.456 10 10 EDCE CN1CCc2cc([C@H](NN)c3c(Br)cnn3C)ccc21 2163158740 SAXABLZZRUQSOI-ZDUSSCGKSA-N 336.237 1.728 10 10 EDCE CC1(CO)CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 823523682 IPWBZCAPKGEAMW-UHFFFAOYSA-N 333.432 1.172 10 10 EDCE COc1cc(Br)cc([C@@H](C)N[C@@H]2COC[C@H]2O)c1O 848554620 YBOMPXIOUUXJOL-AVPPRXQKSA-N 332.194 1.574 10 10 EDCE COc1ccc(N2CC[C@@H](N[C@H](Cc3ccccc3)C(N)=O)C2)cc1 849321718 KTWRRMHEGJLMSP-VQIMIIECSA-N 339.439 1.960 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3n[nH]cc3[N+](=O)[O-])C2)cc1 855234383 YRUBQZBIJWZFNB-JTQLQIEISA-N 331.332 1.335 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@H](CC(N)=O)C3)C2)cc1 852448224 IEYFGELMWWBEBV-ZIAGYGMSSA-N 346.431 1.181 10 10 EDCE CN1C[C@@H](CCNC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 924725411 DBZOGVPSZZQRHL-HNNXBMFYSA-N 332.448 1.762 10 10 EDCE COC[C@H](CCNCc1ccc(N2CCOCC2)c(F)c1)OC 850345605 FYCFPPJTVXXJHP-HNNXBMFYSA-N 326.412 1.803 10 10 EDCE Cn1nccc1[C@H](CO)NCc1c(O)cccc1Br 858178033 QSNSNCPGEVBPGA-NSHDSACASA-N 326.194 1.711 10 10 EDCE CCO[C@H](CS(=O)(=O)NCc1cc(OC)ccc1O)C1CC1 859007604 BUXYLRQWQIOFKF-OAHLLOKOSA-N 329.418 1.635 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](CO)C(C)C)C2)cc1 854297109 KCEMIEINTNPBQD-LSDHHAIUSA-N 335.448 1.838 10 10 EDCE c1noc([C@@H]2COCCN2Cc2ccc(N3CCOCC3)cc2)n1 930443122 UEKCCYHDRZGHFU-INIZCTEOSA-N 330.388 1.480 10 10 EDCE CC(C)NC1(CO)CCN(Cc2ccc(N3CCOCC3)cc2)CC1 930613509 HKYQXUJELJAIBR-UHFFFAOYSA-N 347.503 1.848 10 10 EDCE C[C@H](NS(=O)(=O)C[C@H]1CN(C)CCO1)c1ccc(N(C)C)cc1 867126304 XACKATUTNXCVJR-XJKSGUPXSA-N 341.477 1.064 10 10 EDCE NC(=O)CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 761981058 MFHQEPXGNWCXAZ-LBPRGKRZSA-N 325.796 1.002 10 10 EDCE O=C(NCCO)c1ccc(NCc2ccc(N3CCCC3)cc2)nn1 768515619 FFXFMLBCQCFJHP-UHFFFAOYSA-N 341.415 1.411 10 10 EDCE O=C1N[C@@H](C(F)(F)F)CC[C@@H]1C(=O)N1Cc2cccc(O)c2C1 871198263 FCZPAHVQISQUSQ-JOYOIKCWSA-N 328.290 1.692 10 10 EDCE CN1C[C@H]2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)[C@H]2C1 794926598 CNEOEYDLLRBDHT-AEFFLSMTSA-N 330.476 1.347 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCO[C@@H]2CNC[C@@H]21 715788287 JWFLRXVUCIMFLO-NWDGAFQWSA-N 331.185 1.466 10 10 EDCE CC1(CS(C)(=O)=O)CN(c2ccc(CN)cc2Br)C1 2116582504 RJMXECBIUKSQSJ-UHFFFAOYSA-N 347.278 1.779 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2cncc(C)c2)cc1C 1278062601 UNXXDERANJRSRS-KRWDZBQOSA-N 343.427 1.588 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)C2CN(C(C)=O)C2)cc1C 1507070929 NSQXQOZWUIZGEI-AWEZNQCLSA-N 347.459 1.418 10 10 EDCE CS(=O)(=O)c1ccc(/C=C/C(=O)NCc2ccc(O)c(O)c2)o1 1445898673 BEUMAGLZJIQRIZ-ZZXKWVIFSA-N 337.353 1.424 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)cc1 1295543872 IZMPAJZPVGVZCC-JTQLQIEISA-N 329.360 1.590 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)Cc2c(C)nc(O)nc2O)c1 1294937425 PYRKWGWZZMKPAC-MRVPVSSYSA-N 333.344 1.330 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCC(=O)N2CCCCC2)cc1 1610937658 CEFOJVJXYOMSHO-UHFFFAOYSA-N 331.376 1.981 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)CCCF 1704034457 RLNLHXOZJXDXCF-JTQLQIEISA-N 337.355 1.833 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)CN(C)C(C)=O)cc1C 1482815074 ZGWCFMKTPAKKIG-AWEZNQCLSA-N 335.448 1.466 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2cnn[nH]2)cc1C 1481281318 JTEHWBOMMBSMGG-UHFFFAOYSA-N 331.420 1.303 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cc2nonc2C)cc1C 1716359825 NFNFIWYBYLSGPG-SNAWJCMRSA-N 344.415 1.700 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@H](O)c3cnn(C)c3)CC2)cc1 1623430309 YECOXIGFAGVNID-QGZVFWFLSA-N 344.415 1.201 10 10 EDCE CO[C@H](C)CN[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1713885634 NOAGQEVARPRGAJ-IAQYHMDHSA-N 347.419 1.982 10 10 EDCE Cc1ccc(C(=O)NCc2nc(O)c3ccccc3n2)c(O)c1O 1625551268 PABMQMUMEYBNAV-UHFFFAOYSA-N 325.324 1.985 10 10 EDCE CN(C)[C@@H]1COC[C@H]1CNCc1cc(Br)cc(F)c1O 1924646814 PCSXVZHENBGIBW-ZWNOBZJWSA-N 347.228 1.960 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)Cc1nccn1C 1480954637 GUYLFLWSRWWJOC-UHFFFAOYSA-N 343.391 1.444 10 10 EDCE O=C(CNC(=O)NCc1ccc(F)cc1)NCc1c(O)cccc1O 1558534132 NWZRGAYWURPTSD-UHFFFAOYSA-N 347.346 1.353 10 10 EDCE CN(CC(C)(CO)CO)C(=O)c1cc2cc(O)c(O)cc2s1 1624301701 DKUZKYZJRPXMDB-UHFFFAOYSA-N 325.386 1.375 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccns1 1632355907 GZOCGWAZHLUGKA-JTQLQIEISA-N 336.369 1.459 10 10 EDCE CCN1CC[C@@H]1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1642297660 ORPYWNRLINMZMK-OAHLLOKOSA-N 339.386 1.512 10 10 EDCE COc1cccc(CNC(=O)c2cnc3c(c2)NC(=O)CS3)c1O 1595800489 WVBGRQVAGGIOTI-UHFFFAOYSA-N 345.380 1.770 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2cc[n+]([O-])cc2)cc1C 1666848893 BASGETWJOBWCPW-HNNXBMFYSA-N 343.427 1.887 10 10 EDCE COc1ccc(CNCCC[C@H](C)NC(=O)c2nc[nH]n2)cc1C 1675992794 SXOCCQAGXLBFHA-ZDUSSCGKSA-N 331.420 1.810 10 10 EDCE Nc1ccc(-n2nnc(C(=O)Nc3ccc([N+](=O)[O-])c(F)c3)n2)cc1 1857878919 OGEXUTXOVTZDDK-UHFFFAOYSA-N 343.278 1.544 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ncns1)C(=O)NCCN=[N+]=[N-] 1985103654 YQJNCTOTJPNQCR-MRVPVSSYSA-N 341.397 1.400 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2010404346 RFOMMQJUPPMXDA-GFCCVEGCSA-N 339.396 1.924 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N(C)CCCO)c(Br)cc21 380403181 DZWWERQUVLUQAW-ZDUSSCGKSA-N 342.237 1.870 10 10 EDCE CN1CC[C@@H](C(=O)Nc2ccc(O)c(O)c2)[C@@H](c2cnn(C)c2)C1 2063493943 POZSBVUHEYFUNN-ZIAGYGMSSA-N 330.388 1.505 10 10 EDCE Cc1nc(CNC(=O)c2cc(O)nc(O)c2)ccc1Br 2198317759 NYHGINPKXVEOIY-UHFFFAOYSA-N 338.161 1.889 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]1CNC(=O)COc1ccc(N)cc1 2053958146 SQPPMFGAJCGFEZ-CHWSQXEVSA-N 349.431 1.925 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1CO[C@@H]2COC[C@H]21 2101857764 YTPYDBUCNSFQLA-SCDSUCTJSA-N 328.206 1.906 10 10 EDCE COC1(C(N)=O)CN(c2ccc([C@@H](C)O)c(Br)c2)C1 2104898740 QDWHPTKMVZUKKT-MRVPVSSYSA-N 329.194 1.193 10 10 EDCE CNCc1ccc(N2CC[C@H](OCCO)C2)cc1Br 2109123100 NPBHGPLGJYWGKY-ZDUSSCGKSA-N 329.238 1.756 10 10 EDCE COc1ccc(Br)c(CN2C[C@H]3[C@@H](C2)[C@@H]3C(=O)O)c1O 2236047077 XSWCLDOIRYGRTC-JDICNCQASA-N 342.189 1.926 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2OCC[C@]2(C(=O)NCCCN=[N+]=[N-])C1 2253377271 SIPBOSGPVKTGBT-ABAIWWIYSA-N 339.396 1.829 10 10 EDCE CCOC(=O)[C@H](C)CNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297807088 JVKLQLQNOUAXBO-OAHLLOKOSA-N 346.427 1.852 10 10 EDCE CNC(=O)Cc1noc(C=Cc2ccc(N3CCOCC3)cc2)n1 2299105430 SKIACBHNGSUWPZ-UHFFFAOYSA-N 328.372 1.365 10 10 EDCE Cn1cnnc1SCC(=O)NCc1ccc(N2CCCC2)cc1 53326512 GMWJGVXTKIQJND-UHFFFAOYSA-N 331.445 1.824 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)NC(=O)C1(C)C 118758721 LXTDKRQWDMBUQQ-UHFFFAOYSA-N 332.404 1.041 10 10 EDCE C[C@@H](O)CCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 114824348 IQAFBETZVCTUCH-GFCCVEGCSA-N 325.384 1.232 10 10 EDCE CC(C)(C)OC(=O)NCCNC(=O)c1ccn(-c2ccc(N)cc2)n1 301890411 MVJGEZIGSJUVJI-UHFFFAOYSA-N 345.403 1.709 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C[C@H](O)CN 1952314900 JSRVMEFIDZDIET-RYUDHWBXSA-N 326.393 1.243 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@@H]4C[C@H]5C[C@H]4[C@@H]3[C@@H]5O)ccc21 249546546 KGAFLKUVSBOEEQ-AEXBHSQCSA-N 341.455 1.980 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3c[nH]c(C)n3)CC2)cc1 264811240 CLNHBYIZMZEPSD-UHFFFAOYSA-N 343.431 1.279 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1 808505178 UROPXPTURMUNLY-AWEZNQCLSA-N 349.358 1.308 10 10 EDCE CCN1C[C@H](O)[C@@H](N(C)Cc2ccc(C)c(Br)c2O)C1 2380741373 GRHCAHJNISVPCJ-STQMWFEESA-N 343.265 1.960 10 10 EDCE Cc1cc(O)c(CN[C@H]2CCC[C@H]2CNS(C)(=O)=O)cc1C 800309825 SBWJZHYQCGRFEX-ZFWWWQNUSA-N 326.462 1.817 10 10 EDCE CCOCC1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2165855184 SWCQGNWEHKJZEQ-CYBMUJFWSA-N 340.221 1.874 10 10 EDCE COc1cccc(CNC(=O)[C@H]2CCc3nnc(C4CC4)n3C2)c1O 815834374 GSNLFQLKOQEWKW-ZDUSSCGKSA-N 342.399 1.749 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1ccc2c(c1)CCCN2C)C1CC1 827071430 DTKWANYHGWRVDA-QGZVFWFLSA-N 338.473 1.913 10 10 EDCE Cc1ccc(O)c(CN2CCc3sc(S(N)(=O)=O)cc3C2)c1 827776621 YMTNKTFPQOGZJN-UHFFFAOYSA-N 338.454 1.968 10 10 EDCE O=C(NCc1cc(Br)ccc1O)[C@H]1CC[C@H]1C(=O)O 911555107 HLEDSSNRMDMLET-VHSXEESVSA-N 328.162 1.882 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cnc(N)nc1 913951516 WLSVWSYIUPDFGY-UHFFFAOYSA-N 349.460 1.724 10 10 EDCE CCN(CC)C(=O)[C@@H]1CCCN1C(=O)C(=O)Nc1ccc(N)cc1 841071233 LGUUTIFFLFQACE-AWEZNQCLSA-N 332.404 1.067 10 10 EDCE CCC(=O)N1CSC[C@@H]1C(=O)NCc1cc(Cl)ccc1O 846472184 IDAVZEAYQXFFNY-LLVKDONJSA-N 328.821 1.973 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N(C)c2ccc(Cl)nn2)c1 155810669 CTBRVBLJBZVBLN-ZZXKWVIFSA-N 331.763 1.561 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCc3cn[nH]c3)C2)cc1 852345249 HWGMZGPKADORTN-AWEZNQCLSA-N 329.404 1.539 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)C1(S(C)(=O)=O)CCC1 935945666 GFMZTFPYOQYFAM-UHFFFAOYSA-N 332.418 1.461 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1[C@H]1CCCn2nccc21 865339563 IEZCTXCUEMSDTK-AWEZNQCLSA-N 326.356 1.888 10 10 EDCE Cc1cc(O)c(CNC[C@@]23COCCN2C(=O)COC3)c(Cl)c1 865796662 ZFBANINVGOCYSP-INIZCTEOSA-N 340.807 1.071 10 10 EDCE NCCCOCCNC(=O)NCc1cccc(Br)c1O 861692874 LKWPZWAVNPMDAR-UHFFFAOYSA-N 346.225 1.319 10 10 EDCE Cn1cc(N2C[C@@H](C(=O)N3Cc4cccc(O)c4C3)CC2=O)cn1 871207321 NAXHQNHJEJLHCZ-LBPRGKRZSA-N 326.356 1.021 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCc1nnnn1C 772580602 XAYDUBXKYWGMJT-UHFFFAOYSA-N 345.451 1.439 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3COCC3(C)C)CC2)cc1 894207733 WWHRYFLTSPEPBX-SFHVURJKSA-N 333.476 1.832 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@@H](CO)C2)cc1Br 396880377 OQALCXTUYCLPFZ-DOMZBBRYSA-N 343.265 1.738 10 10 EDCE CCNCc1ccc(N2C[C@@H](CO)[C@H](CO)C2)cc1Br 704763332 DPLXKWMOLWIDMP-STQMWFEESA-N 343.265 1.596 10 10 EDCE COc1ccc(OC)c([C@@H](O)CNC(=O)Cc2ccc(O)c(O)c2)c1 1150128325 KKNIPNMNDYQFFE-INIZCTEOSA-N 347.367 1.507 10 10 EDCE O=C(NCCN1C(=O)COc2ccccc21)c1c(F)ccc(O)c1O 1160664875 MOWRRFZVIOIKSJ-UHFFFAOYSA-N 346.314 1.392 10 10 EDCE CS[C@@H]1CC[C@@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332040947 GUOMOBKETHTKDK-CHWSQXEVSA-N 334.441 1.977 10 10 EDCE C[C@@H]1CC2(CCOCC2)CN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1330494980 DMEZFJMFYNVYLZ-CYBMUJFWSA-N 344.411 1.652 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@H]1C 1331950369 LRAQAKMBCJLRJI-RCSLCFTFSA-N 347.411 1.980 10 10 EDCE C[C@H](C(N)=O)N(C)c1ccc(C=CC(=O)O)c(Br)c1 1911871008 DUOAZGIVAZSWKC-MRVPVSSYSA-N 327.178 1.857 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2cn(C)nn2)cc1C 1714597998 SUWPIHSVHRCMMA-CYBMUJFWSA-N 331.420 1.382 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCCC[C@@H]2CCNCCO)cc1 1715458198 PKHBUCHHHHIIDD-OAHLLOKOSA-N 347.419 1.816 10 10 EDCE Cn1ncc(C(=O)NCc2c(O)cccc2O)c1Br 1558535648 MJECKPQMHIWTHE-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE O=C(N[C@@H]1CCS(=O)(=O)C2(CCC2)C1)c1cccc(O)c1O 1558481096 UHFJRXJNTXEUJH-SNVBAGLBSA-N 325.386 1.328 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cn(-c2cccnc2)nn1 1566369499 IEOLKQOOWQWADX-UHFFFAOYSA-N 325.328 1.046 10 10 EDCE CON(CCNC(=O)OC(C)(C)C)C(=O)c1ccc(C)c(O)c1O 1640723310 QGBSAXZAYZXEGY-UHFFFAOYSA-N 340.376 1.935 10 10 EDCE NS(=O)(=O)c1ccc(C(=O)NCc2cccc(Cl)c2O)cn1 1647830285 QHSAMKFCWVOBJD-UHFFFAOYSA-N 341.776 1.018 10 10 EDCE CC(C)[C@@H](O)CCNC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1683697866 HXJCQBMOKIHXGR-SFHVURJKSA-N 348.491 1.645 10 10 EDCE COc1cccc(CNC(=O)c2cc(Cn3cc(C)cn3)on2)c1O 160288397 YCNHAAXHALATIO-UHFFFAOYSA-N 342.355 1.872 10 10 EDCE CC[C@@H](NC(=O)C(C)C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1862299305 ACCFMMGLVBFJKX-QGZVFWFLSA-N 347.459 1.895 10 10 EDCE NCc1ccc(N2C[C@H]3CCC[C@@]3(C(N)=O)C2)c(Br)c1 2144089875 DBCGXUGRZJDRKZ-IAQYHMDHSA-N 338.249 2.000 10 10 EDCE Oc1c(F)cc(Br)cc1CNC[C@]1(O)CCCOC1 1971053363 ISJRDPCSJLHKIM-CYBMUJFWSA-N 334.185 1.925 10 10 EDCE CC(C)(C)OC(=O)N1CC(C)(OCC(=O)N2CC(N=[N+]=[N-])C2)C1 1985101710 WOHRXGLHRVZQGZ-UHFFFAOYSA-N 325.369 1.534 10 10 EDCE CN(CC(=O)Nc1ccc(N)cc1)C1CN(C(=O)OC(C)(C)C)C1 1999424320 HNOFEODLAMHNQY-UHFFFAOYSA-N 334.420 1.758 10 10 EDCE CNCc1ccc(N2CCOC[C@@H]2CN(C)C)c(Br)c1 2153246839 KAKIAGMDCHAIKW-ZDUSSCGKSA-N 342.281 1.935 10 10 EDCE CO[C@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCCN(C(=O)OC(C)(C)C)C1 2010389076 LAOZTQOBXXPNKY-OAHLLOKOSA-N 339.396 1.924 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)NCCc1ccc(N)cc1 2022880193 IWNAWEJOBZSVTD-FZMZJTMJSA-N 337.420 1.202 10 10 EDCE Cn1cc(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)c(=NC(=O)OC(C)(C)C)[nH]1 2060619946 TVEFHMAHWYFCHD-JTQLQIEISA-N 349.395 1.961 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2102178881 XJSYVIIMEXTKMQ-HNGHSSNUSA-N 328.206 1.698 10 10 EDCE CN(C)C[C@H]1CN(c2ccc(CO)c(Br)c2)CCO1 2113972438 ZSAHMTGWXGXEDV-ZDUSSCGKSA-N 329.238 1.708 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2CCC(=O)N2)c1O 2227747317 YQOXVUQBZIMSOK-MRVPVSSYSA-N 329.194 1.532 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CC[C@@H](O)CN1C(=O)OC(C)(C)C 2242655890 HVRKZDAXIAMOGX-MNOVXSKESA-N 327.385 1.516 10 10 EDCE C[C@@H](O)[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(F)cc2)SC1=S 2323823837 RIFIHEFTUCZHRO-HQJQHLMTSA-N 341.385 1.861 10 10 EDCE Cc1ccc(CN[C@H]2CCS(=O)(=O)C2)c(O)c1Br 2327800140 GQSZKRUTYRLULD-JTQLQIEISA-N 334.235 1.740 10 10 EDCE COc1ccc(CCOc2nnc(=N)[nH]n2)c(Br)c1 2339341017 IGAMZMMTBUHPGY-UHFFFAOYSA-N 326.154 1.072 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@H](C)NC(=O)c2ccccc2)c1 114541336 YEUNRGUYGLYJMT-LBPRGKRZSA-N 328.368 1.836 10 10 EDCE CCn1cc(S(=O)(=O)NCc2ccc3c(c2)CCCN3C)cn1 66915331 NVTSVOTVOIMDSN-UHFFFAOYSA-N 334.445 1.764 10 10 EDCE O=C1CO[C@@H]2CCN(Cc3ccc(N4CCCCC4)cc3)C[C@H]2N1 366765722 FFDCZKPDYLQATK-QZTJIDSGSA-N 329.444 1.766 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C[C@H](N)CCO2)c(O)c1Br 2380755234 ZLTPWZOFAQLOIY-GHMZBOCLSA-N 343.221 1.586 10 10 EDCE O=C(N[C@H]1CCN(C(=O)COc2ccccc2)C1)c1cc(O)cs1 802659785 LZSZYLUYJROKAC-LBPRGKRZSA-N 346.408 1.863 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3cc(OC)ncn3)C2)cc1 822122403 QLYKPPIGVJVMKI-GFCCVEGCSA-N 343.387 1.894 10 10 EDCE COC(=O)C1(CNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1 588521102 YEIJPIRHIMFULL-DAXSKMNVSA-N 344.411 1.606 10 10 EDCE CCOc1ccncc1S(=O)(=O)NCc1cc(OC)ccc1O 830638608 LEMPNNDBEPDYQS-UHFFFAOYSA-N 338.385 1.673 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)/C=C\Cn2cncn2)cc1 911890901 CYSYDZGYOCSESW-PLNGDYQASA-N 329.404 1.438 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@]23C[C@H]4C[C@@H](C(=O)N2)[C@H]3C4)c1 845835138 ZKVSPFKBHHOPBN-YTWVKEDVSA-N 330.384 1.493 10 10 EDCE C[C@@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(C)(C)CO 924726832 QWDTUYWCFXANTE-GDBMZVCRSA-N 333.476 1.885 10 10 EDCE O=S(=O)(NNc1nc2cccnc2s1)N1C[C@H]2CC[C@H]1C2 857225719 RCGTVHAWFKBPDL-IUCAKERBSA-N 325.419 1.337 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CNC(=O)C(C)(C)C)C2)cc1 855228345 AILXMQFCRHMEMK-CYBMUJFWSA-N 333.432 1.552 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC(C(C)(C)O)C3)C2)cc1 854298857 IRHUIEBWOZUDOU-CQSZACIVSA-N 333.432 1.686 10 10 EDCE COc1cccc(CN2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)c1O 856533923 AJAWHXDMOMGZOT-JKSUJKDBSA-N 341.411 1.751 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@](C)(C(N)=O)C3)C2)cc1 852451928 RBUPTVYOXWCHJM-UGSOOPFHSA-N 346.431 1.181 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3ccncn3)C2)cc1 852379522 SAVFALFMJXUGPV-CQSZACIVSA-N 327.388 1.563 10 10 EDCE CC[C@H](NC1CN(S(=O)(=O)N(C)C)C1)c1ccc(C)cc1O 858572255 RGBXYQSVCMYZBY-AWEZNQCLSA-N 327.450 1.232 10 10 EDCE NC(=O)[C@H](C1CC1)N(Cc1ccc(N2CCOCC2)cc1)CC1CC1 931532021 LGPWPJICDCAFMU-IBGZPJMESA-N 343.471 1.999 10 10 EDCE COc1cc(O)c(CN(C)CC(C)(C)S(C)(=O)=O)cc1OC 768465950 UFTWKWYTNQCXNQ-UHFFFAOYSA-N 331.434 1.664 10 10 EDCE COC1CCN(c2ccc(CN3CCC[C@@H](CO)[C@H]3CO)cc2)CC1 879366730 QVULECKLWYBYPV-FXAWDEMLSA-N 348.487 1.867 10 10 EDCE CCCC[C@@H](NC(=O)NCC)C(=O)NCc1cc(OC)ccc1O 771656884 SCNTUQXFJGOBHE-CQSZACIVSA-N 337.420 1.895 10 10 EDCE C[C@H](NC(=O)C(=O)N1CC(C)(F)C1)c1ccc(N2CCOCC2)cc1 1117126711 SIQBDNCSJXSVGC-ZDUSSCGKSA-N 349.406 1.271 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCSC[C@@H]2CCO)c1O 774911965 JKFCNPLHQYZVJA-NSHDSACASA-N 328.390 1.609 10 10 EDCE CCN1CC[C@@H]1CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 897866169 SCLVZIYWOOAMFI-CZUORRHYSA-N 332.448 1.140 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@](C)(O)Cn2ccccc2=O)c1 790649566 HKGFUIVOKZTYAD-SGTLLEGYSA-N 346.383 1.191 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cccn(CC(F)(F)F)c1=O 1176576810 SYMLSDPGEUEGCE-UHFFFAOYSA-N 342.273 1.752 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@H](O)C[C@@H](O)C2)c(Br)c1 2126909978 RCNWLOYXEMVBBB-MVWJERBFSA-N 329.238 1.661 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H](CNCCO)C2CCCC2)cc1 1324518289 RQLTZUDVBVPIEM-HNNXBMFYSA-N 347.419 1.720 10 10 EDCE CNCc1ccc(N2CC(C(=O)N(C)C)C2)c(Br)c1 2121050218 LAAMHRLCDNXKMA-UHFFFAOYSA-N 326.238 1.693 10 10 EDCE C[C@H](O)CNC[C@@H]1CCCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1505412253 YTQNYJUPSFIJMZ-WFASDCNBSA-N 347.419 1.814 10 10 EDCE C[C@@H](NCCO)[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1501091663 POCNBZVAXCMBLF-YPMHNXCESA-N 333.392 1.282 10 10 EDCE C[C@@H]1Oc2ccccc2N(CC(=O)NCc2ccc(O)cc2O)C1=O 1299574023 OAXVOSMSPISWOZ-NSHDSACASA-N 342.351 1.528 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@H]1CCOC1 1526697887 HNLINCGMKIURLN-JQWIXIFHSA-N 347.375 1.120 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CC[C@@H](C(F)(F)F)NC1=O 1471661625 VQMVWSRDEQNSAY-KOLCDFICSA-N 332.278 1.171 10 10 EDCE CCc1noc(COCC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n1 1556158277 WKLPBCHCEUWSDL-JTQLQIEISA-N 335.360 1.307 10 10 EDCE CS(=O)(=O)c1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1 1625723829 BOAINUFRWCLAMR-UHFFFAOYSA-N 335.381 1.360 10 10 EDCE CCCC1(C(=O)NC[C@H](C)NC(=O)c2cc(OC)nc(OC)c2)CC1 1720937834 CACJIQREAIGXDD-LBPRGKRZSA-N 349.431 1.914 10 10 EDCE CN(CCNCc1ccnn1C)C(=O)c1ccc(N=NC(N)=O)cc1 1731990349 WGJPHWAKWYNTAU-UHFFFAOYSA-N 343.391 1.444 10 10 EDCE CNC(=O)c1c(NC(=O)c2cc3cc(O)c(O)cc3s2)n[nH]c1C 1586347393 KGYASFIZVLRGMR-UHFFFAOYSA-N 346.368 1.956 10 10 EDCE C[C@]1(C(=O)NCc2ccc(O)c(O)c2)Oc2ccccc2NC1=O 1595596506 XJBYGSKLMBKESC-QGZVFWFLSA-N 328.324 1.504 10 10 EDCE C[C@@H](C(=O)O)N1CCN(Cc2cc(Br)ccc2O)CC1 235536672 NHFAONLJQUFRLY-JTQLQIEISA-N 343.221 1.745 10 10 EDCE Cc1c(OCCCO)c(=O)ccn1CCCOc1ccc(N)cc1 1857919243 BNJHGQGJLWTTIC-UHFFFAOYSA-N 332.400 1.969 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCN1C[C@@H]2CCCCN2C1=O 1301313243 OTPRFLGFUULKPG-ZDUSSCGKSA-N 333.388 1.047 10 10 EDCE COc1ccc(Br)c(CNCCc2n[nH]c(C)n2)c1O 1964559895 KBGVNGGNSOMFRZ-UHFFFAOYSA-N 341.209 1.922 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1 1985099969 UCTFNSSJYTWESV-AWEZNQCLSA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)N1Cc2[nH]cnc2C[C@@H]1C(=O)NCCN=[N+]=[N-] 2010393068 NNHYCCWAUCPKLB-LLVKDONJSA-N 335.368 1.498 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2010390591 FXMUJVGBILMJQW-LLVKDONJSA-N 339.396 1.660 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)O[C@H](C)C2)c(Br)c1 300494720 GPIHNYMGMGWWDH-PWSUYJOCSA-N 329.238 1.755 10 10 EDCE CCNCc1ccc(N(C)[C@@H]2CC(=O)NC2=O)cc1Br 2171191627 AXLWZAGPXBTZNK-GFCCVEGCSA-N 340.221 1.410 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCN2CCOC[C@@H]12 2062403777 VVJXSCAMRVWSMO-CABCVRRESA-N 327.384 1.277 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCCC[C@H]1[C@H](O)C(F)(F)F 2064875373 OONICMZRDWXFIX-HZMBPMFUSA-N 333.306 1.945 10 10 EDCE CS(=O)(=O)[C@H]1CSCCN1c1cc(Cl)c(CN)cc1F 2177381495 NWOXTKYGNGFZBM-LBPRGKRZSA-N 338.857 1.862 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)c(Br)c1 2178087512 RMTNZZXWORIHPG-FQMFCJFBSA-N 342.233 1.946 10 10 EDCE CNCc1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)cc1Br 2178088231 WMZFLPZDNGGWFX-LNSITVRQSA-N 341.249 1.612 10 10 EDCE COC(=O)[C@H](NCCCN=[N+]=[N-])c1c(Br)nn(C)c1C 2188105547 ZJAPYZGCTMUSAK-SECBINFHSA-N 345.201 1.995 10 10 EDCE CO[C@@H]1C[C@H](O)CN(c2ccc(CN)c(Br)c2F)C1 2109020937 TYLLWSZCVGNMHK-VHSXEESVSA-N 333.201 1.633 10 10 EDCE COc1ccc(Br)c(CN2CCN(C)C[C@@H]2CN)c1O 2236033272 OODAVSMEGYPOTH-JTQLQIEISA-N 344.253 1.238 10 10 EDCE Nc1ccc(NC(=O)CCn2cc(Br)cnc2=O)cc1 2240960399 RNXXRCQMSXTKSF-UHFFFAOYSA-N 337.177 1.617 10 10 EDCE CCn1c(O)nnc1CNCc1cc(Br)ccc1O 2351538354 GFZIXPLXLGESCD-UHFFFAOYSA-N 327.182 1.762 10 10 EDCE Cc1ccc(CN2C[C@H](O)[C@H](N(C)C)C2)c(O)c1Br 2352679913 NSLJLZAODQAIKP-NEPJUHHUSA-N 329.238 1.570 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@@H](O)[C@H]3C4)c(Br)cc2[C@H]1O 2355625327 FTYCVHZLBYNCJY-AAGLOMFBSA-N 339.189 1.394 10 10 EDCE COc1ccc(OC)c([C@H](C)NC=C2C(=O)N(C)C(=O)N(C)C2=O)c1 52529206 RLZSQIKCAOWITB-JTQLQIEISA-N 347.371 1.289 10 10 EDCE CC(C)(C)c1cc(O)c(O)c(CN2CC[C@@H](NS(C)(=O)=O)C2)c1 116870092 IFSVMJTXRPTKBH-CYBMUJFWSA-N 342.461 1.519 10 10 EDCE O=C(c1cc(O)nc(O)c1)N1CC(n2ccc(Br)n2)C1 2361648158 NUKUHGGNONGVMD-UHFFFAOYSA-N 339.149 1.149 10 10 EDCE COC(=O)c1ccnc(C(=O)N2CCOc3cc(N(C)C)ccc32)c1 415243260 PZHSBQKQZLNGND-UHFFFAOYSA-N 341.367 1.973 10 10 EDCE COC(=O)CN(Cc1ccccc1)C(=O)COc1ccc(N)cc1 381690463 RNSUTUMHXVERPY-UHFFFAOYSA-N 328.368 1.849 10 10 EDCE CCS(=O)(=O)C1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1 193265741 ZPNSHNQLYPFKQW-UHFFFAOYSA-N 328.390 1.700 10 10 EDCE COCCNc1ccnc(N2CCN(c3ccc(OC)cc3)CC2)n1 243249954 KPBGGAXYNNOCOB-UHFFFAOYSA-N 343.431 1.870 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)NC[C@H]3CNC[C@H]3O)c2C)c1 262308990 QIBZVCJROFNRFZ-CRAIPNDOSA-N 327.428 1.713 10 10 EDCE O=C(N[C@@H]1CCCN(c2ncccn2)C1)c1c(F)ccc(O)c1O 279220587 OWNUBFKDPZJJDJ-SNVBAGLBSA-N 332.335 1.426 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC(F)(F)C[C@H]1CO 364616391 SSGNURWGJZKYAX-HNNXBMFYSA-N 341.402 1.413 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@]3(C)CCC(=O)NC3)CC2)cc1 366820679 FZZIPUWVYHOCBP-IBGZPJMESA-N 345.443 1.650 10 10 EDCE CC(C)C[C@@H](CO)N(C)C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 297926962 YGGQLSUUNMHLRR-KRWDZBQOSA-N 349.475 1.576 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H]3CO4)c(Br)cc21 718373457 AKPZDQBIXNUQDO-UVPNAGLESA-N 338.205 1.639 10 10 EDCE COc1c(C)cc(/C=C2/SC(=S)N(CC(N)=O)C2=O)cc1C 727175423 BDKUWMKZMYYIPO-IZZDOVSWSA-N 336.438 1.999 10 10 EDCE CN(C)[C@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)c1cnn(C)c1 588407963 HVVGLWPZUFJFKQ-BRLPQQTGSA-N 330.388 1.264 10 10 EDCE C[C@H](NC(=O)[C@@H]1CC[C@H](CN2CCOCC2)O1)c1ccccc1O 828539582 QWHUXBAIOKKDFV-VBQJREDUSA-N 334.416 1.449 10 10 EDCE CN(C)c1ccc([C@H](N)CNCc2cnnn2[C@@H]2CCCNC2)cc1 903917978 PMKAGRLCIGQFGD-SJLPKXTDSA-N 343.479 1.058 10 10 EDCE C[C@H](CCC(=O)O)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588592879 QZEAUVOXHXLGJB-BMWLXYDHSA-N 332.400 1.906 10 10 EDCE CC(=O)N1CSC[C@H]1C(=O)NCCCSc1nccs1 733972805 WPFWIPMJKXLESA-JTQLQIEISA-N 331.488 1.663 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)c2cnn3c2CCCC3)cc1 832267403 RPCNDFQLSQZNTF-INIZCTEOSA-N 327.432 1.715 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCC(=O)N=S(C)(C)=O 919071510 KYSJQUHXELIYIV-UHFFFAOYSA-N 340.449 1.114 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@](O)(C(F)F)C1 831169521 AEOCBLMAUXBLLV-QGZVFWFLSA-N 341.402 1.413 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCC(=O)N(C)C2)cc1 845003356 OIMKCYRIJLBUJL-CQSZACIVSA-N 348.447 1.394 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)c2cn(C3CCC3)nn2)cc1 843296928 CUGRMSRYSPDLCO-OAHLLOKOSA-N 328.420 1.499 10 10 EDCE C[C@@H](CN(C)Cc1cc(O)n2ncc(C(=O)O)c2n1)c1nccs1 846253152 HZSCHXCNSMQRNM-VIFPVBQESA-N 347.400 1.825 10 10 EDCE O=C(NCCc1cn2c(n1)SCC2)NCc1c(O)cccc1F 922018133 PHIVMOJGNPEAEX-UHFFFAOYSA-N 336.392 1.875 10 10 EDCE CC(C)O[C@]1(CN2C(=O)CN(Cc3ccccc3O)C2=O)CCOC1 925201141 AYPLHBRKDAOTBL-SFHVURJKSA-N 348.399 1.741 10 10 EDCE CCOC1(CS(=O)(=O)NCc2ccccc2O)CCOCC1 859002302 OIXJJGXKMTWNGO-UHFFFAOYSA-N 329.418 1.397 10 10 EDCE Cn1c(NCc2ccc(N3CCCCC3)cc2)cc(=O)n(C)c1=O 853234088 AMZNSADUTVPIEH-UHFFFAOYSA-N 328.416 1.686 10 10 EDCE CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n1 757594835 SLXCRDQTKMHGMN-VIFPVBQESA-N 334.332 1.583 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3[C@H]4CC[C@H]3CC(F)(F)C4)nc12 863471119 NNKJOUKMJRPDHV-UWVGGRQHSA-N 338.314 1.895 10 10 EDCE CN(C)c1cc(F)c(CN2CC[C@H](NS(C)(=O)=O)C2)cc1F 862246438 HTBFLVKUGYLLTQ-NSHDSACASA-N 333.404 1.154 10 10 EDCE CNCCOCCNC(=O)NCc1ccc(N2CCC(C)CC2)cc1 861574068 PSSQKMPLRAWKIV-UHFFFAOYSA-N 348.491 1.958 10 10 EDCE CO[C@@H](CS(=O)(=O)N1Cc2cccc(O)c2C1)C1CCOCC1 867691052 QGEWRLDQBULOQM-INIZCTEOSA-N 341.429 1.479 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2C[C@@H]3CCCN3C[C@@H]2CO)c1O 880069255 BFINUYIILLFMHZ-LSDHHAIUSA-N 338.835 1.889 10 10 EDCE CCN(CC)c1ccc(CN2CC(O)(c3ncnn3C)C2)cc1F 895620362 DXIFENQVYVDWCL-UHFFFAOYSA-N 333.411 1.504 10 10 EDCE Cc1cc(C(=O)N[C@@H](CO)c2cncn2C)c(C)n1-c1ccccn1 898884675 RYKRZRGCVIUWQE-HNNXBMFYSA-N 339.399 1.686 10 10 EDCE CN1CCN(c2ccc(CNC(=O)[C@@H]3C[C@H]3c3cnc[nH]3)cc2)CC1 899211753 NKHHJMQEHSXEJB-IAGOWNOFSA-N 339.443 1.581 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2ccc3c(c2)COB3O)c1 1137473715 SLLMGGMTDGAPPI-JTQLQIEISA-N 327.145 1.110 10 10 EDCE CCOC(=O)c1n[nH]c([C@H](C)NC(=O)/C=C\c2ccc(O)c(O)c2)n1 1146857508 ZUZOHFJKYPTKFT-PGBBXKAQSA-N 346.343 1.283 10 10 EDCE NC(=O)N[C@@H](CC(=O)NCc1c(O)cccc1O)c1ccccc1 1304051617 YOUWRVSYABOBMA-ZDUSSCGKSA-N 329.356 1.514 10 10 EDCE O=C(NCCNC(=O)c1c(F)ccc(O)c1O)c1ccc(F)cc1 1160747710 SOSFOCUCUSSZHS-UHFFFAOYSA-N 336.294 1.536 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)C1CN([C@@H]2CCOC2)C1 1179032412 FYUNTOOZWYHXSI-OAHLLOKOSA-N 326.396 1.882 10 10 EDCE COCCC(=O)N[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1283834736 SGBABBGCCDMZDW-CYBMUJFWSA-N 347.375 1.216 10 10 EDCE Cc1cc(C)n2nc(C)c(C(=O)NCc3ccc(O)cc3O)c2n1 1299569295 CJTDPLCZAQYEQF-UHFFFAOYSA-N 326.356 1.996 10 10 EDCE C[C@@H](NC(=O)c1ccc(NS(C)(=O)=O)nc1)c1ccccc1O 1454802506 ADCBSIKNIMNDLM-SNVBAGLBSA-N 335.385 1.650 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2nc(O)n[nH]2)c1 1294475754 PUHKJKIHWPCHRO-UHFFFAOYSA-N 339.355 1.660 10 10 EDCE COCCCCN(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1451650374 KVVVVYYGLPHPKI-UHFFFAOYSA-N 330.406 1.262 10 10 EDCE CN1CCN([C@@H]2CCN(Cc3cc(Cl)ccc3O)C[C@@H]2O)CC1 1614351583 ZAGZKFCUWAECBQ-WBVHZDCISA-N 339.867 1.228 10 10 EDCE CN1CC[C@@H](O)[C@@H](C(=O)N(C)Cc2ccc3c(c2)CCCN3C)C1 1616064435 FCMOUDGAFUFWBL-FUHWJXTLSA-N 331.460 1.340 10 10 EDCE C[C@@H](O)CCCN1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1479972066 MFIYRGNFKMSUBU-IUODEOHRSA-N 347.419 1.814 10 10 EDCE COc1nc(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)co1 1481262461 ZEENJZMQWQKIJI-UHFFFAOYSA-N 333.388 1.862 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H]2CC[C@H]2C(N)=O)cc1C 1493654468 BSZMCZIBNMIWEO-HUUCEWRRSA-N 333.432 1.063 10 10 EDCE C[C@H](NCCO)[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1496459480 IYIXFJZPCYTQOV-JSGCOSHPSA-N 347.419 1.672 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCC[C@H]1CNC(=O)C1 1638211850 VEDKBQUFEYOOII-MRXNPFEDSA-N 344.459 1.954 10 10 EDCE Cc1occc1C(=O)NCC(=O)NCc1ccc2cccnc2c1O 1630533209 YQYGTSNBLSOBMS-UHFFFAOYSA-N 339.351 1.888 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CCN2C2CCOCC2)cc1 1647729701 ZGODKIKBUXCFGA-OAHLLOKOSA-N 345.403 1.832 10 10 EDCE CC[C@H](NC(C)=O)C(=O)NC[C@H](C)NCc1ccc(OC)c(C)c1 1731626056 YUEOEDSMTKQHLJ-BBRMVZONSA-N 335.448 1.513 10 10 EDCE COc1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1[N+](=O)[O-] 1596976438 QJIDYFHWKSUWKD-UHFFFAOYSA-N 332.312 1.874 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)C(C)(C)CO)c(Br)cc21 126558713 VXWKBZJARGDDIS-LBPRGKRZSA-N 342.237 1.869 10 10 EDCE O=C(Nc1ccc(N2CCOCC2)cc1)c1cc(O)c(O)c(O)c1 1857614538 HOKAJPQFUKRQHP-UHFFFAOYSA-N 330.340 1.892 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC[C@@H](N=[N+]=[N-])C2)CC1 2010395206 HPMJVHCLUAFBAM-GFCCVEGCSA-N 338.412 1.450 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2018521652 IZLWGUUCSOBZEB-ZJQBRPOHSA-N 340.420 1.324 10 10 EDCE C[C@@H](O)c1ccc(N(C)C2CS(=O)(=O)C2)c(Br)c1 2034770783 XDRODQPAGPACMU-MRVPVSSYSA-N 334.235 1.736 10 10 EDCE CC[C@@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C[C@@H]1O 399885510 HKOZYTVBBCKXNL-RDZIJCNDSA-N 340.221 1.608 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)c(Br)c1 2182557118 SENBRMLAJNFQGC-ZKOAOSJTSA-N 341.249 1.647 10 10 EDCE COCC(=O)N1CCN(c2ccc(CN)c(Br)c2)CC1 2182577424 AAHFXGFRPMQZOW-UHFFFAOYSA-N 342.237 1.203 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)c(F)c1Br 2189070704 FOTQCNKQVTZPIP-MSRIBSCDSA-N 345.212 1.490 10 10 EDCE NCc1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(F)c1Br 2199531734 LOLNESDBYYDTBP-ZMHRIIPESA-N 345.212 1.367 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2CCC[C@@]2(COc2nnc(=N)[nH]n2)C1 2213783179 NADNMGCLMMLZCJ-BMIGLBTASA-N 336.396 1.095 10 10 EDCE Nc1ccc(CC(=O)N2CCC[C@H](NC(=O)C(F)(F)F)CC2)cc1 2258226021 MBDLGIHRXIJTCX-ZDUSSCGKSA-N 343.349 1.871 10 10 EDCE CN(C)C(=O)[C@H]1C=CCN1c1ccc(CO)c(Br)c1 2265497524 FSYRFNSNSASEDT-CYBMUJFWSA-N 325.206 1.774 10 10 EDCE COc1cc(C=C2SC(=S)N(C)C2=O)ccc1OCC(=O)O 2293020947 ZJCFLSBLFPKYFS-UHFFFAOYSA-N 339.394 1.990 10 10 EDCE COc1ccc(C=C2SC(NC(C)=O)=NC2=O)cc1OC(C)=O 2297461659 XXINNZHLCDJSPA-UHFFFAOYSA-N 334.353 1.727 10 10 EDCE CN1CCN(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CC1 170223391 OWPQHQCWQCMUQQ-UHFFFAOYSA-N 328.372 1.497 10 10 EDCE COCC(=O)NC1(CNCc2ccc(OC)c(C)c2)CCOCC1 1273937512 UIECWYQHLKHZSJ-UHFFFAOYSA-N 336.432 1.405 10 10 EDCE CCS(=O)(=O)[C@@H]1CSCCN1C(=O)c1cccc(O)c1O 126468306 HXCURYSSTINVAS-LLVKDONJSA-N 331.415 1.048 10 10 EDCE CC[C@](C)(O)CN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 189203303 VPNPWZVZUGZKAI-SFHVURJKSA-N 338.448 1.995 10 10 EDCE C[C@@H]1COCC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 194076193 YERHINZRPVGZFO-HIFRSBDPSA-N 336.407 1.951 10 10 EDCE CC[C@H]1NC(=O)CN(Cc2ccc(C)c(Br)c2O)C1=O 2380812522 WQDRQAXKTGMCOQ-SNVBAGLBSA-N 341.205 1.700 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]12[C@H]3C(=O)[C@H]4[C@H]5C[C@@H]([C@@H]41)[C@@H]2[C@H]53 800532515 QQPSOKPJUJRHHX-WIXZJLFQSA-N 339.391 1.472 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@]1(C)CCCN(C(=O)OC(C)(C)C)C1 808529441 DUDKTVOHALDWKT-INIZCTEOSA-N 327.377 1.725 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1cscn1 804020851 MFNWBRUDSYYYPC-UHFFFAOYSA-N 333.413 1.904 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1 808511262 YZRAGBSVHHRSAN-UHFFFAOYSA-N 338.381 1.718 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CCNC[C@H]3C)C2)cc1 818654631 DACKZHLGTXZAGC-RKVPGOIHSA-N 346.475 1.819 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CCNC(=O)CC3)C2)cc1 819592009 ZOXXAFZPCQBSPL-CABCVRRESA-N 345.443 1.554 10 10 EDCE Cc1cc(Cl)cc(CN(CCN(C)C)CC(=O)N(C)C)c1O 827158709 UDUVSKITMVYGMW-UHFFFAOYSA-N 327.856 1.806 10 10 EDCE CN(C)c1ccc(/C=C/CNCCCN(C)S(C)(=O)=O)cc1 835036630 PQSVDLGKSALEQC-FNORWQNLSA-N 325.478 1.637 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)c1cnc(N)nc1 913877763 IASGHNZIGXXLNC-UHFFFAOYSA-N 335.433 1.336 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CCCNC1=O 840283711 FZULECFBMGXZLH-BBRMVZONSA-N 332.448 1.570 10 10 EDCE C[C@H]1CCNC[C@H]1NC(=O)NCc1cccc(Br)c1O 841976630 MYDTUSRWAKQKAU-JOYOIKCWSA-N 342.237 1.952 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@@]3(O)CCOC3)C2)cc1 852396686 BWLGWPWEQCIEHE-RDTXWAMCSA-N 349.431 1.115 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H]4C[C@H]3C[S@@]4=O)C2)cc1 852448620 KXWLPHLIXIXYLO-IJFIWDCJSA-N 349.456 1.189 10 10 EDCE CN1CCN(CCNC(=O)NCc2c(O)cccc2F)CC1(C)C 922348455 UDNZGLLZJUEDJL-UHFFFAOYSA-N 338.427 1.357 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CC[C@H](Cn2ccnn2)C1 853749427 RVWSENQRCYMFQM-HNNXBMFYSA-N 342.447 1.884 10 10 EDCE Cc1nccnc1NC(=O)NCc1ccc(N2CCOCC2)cc1 1347911514 AGVYETDGQIFPGS-UHFFFAOYSA-N 327.388 1.943 10 10 EDCE CC1(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)COC1 852102163 WMNPDLXMLWHIEI-UHFFFAOYSA-N 333.432 1.483 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CNCC[C@@H]3C)C2)cc1 851664356 XXNITFMFSDFAOM-GRDNDAEWSA-N 332.448 1.571 10 10 EDCE C[C@H](NC(=O)NC1CCN(CC(=O)N(C)C)CC1)c1ccccc1O 868285690 LUFSYNBMUAURGR-ZDUSSCGKSA-N 348.447 1.305 10 10 EDCE Oc1cccc(Br)c1CN1CCN2C[C@H](O)C[C@H]2C1 862401415 DKUPAQSWAOBAEE-WDEREUQCSA-N 327.222 1.406 10 10 EDCE C[C@@H]1C[C@H](NC[C@@]23COCCN2C(=O)OC3)c2c(O)ccc(F)c21 866520977 JDZBXRQHAIEYRS-MOCULFSLSA-N 336.363 1.890 10 10 EDCE C[C@H]1C[C@@H](NCc2ccc(N3CCN(C)CC3)c(F)c2)c2ncnn21 1118484072 BTZWDAIXGALWJA-XJKSGUPXSA-N 344.438 1.965 10 10 EDCE Cn1cc(N2CCC[C@H](NC(=O)c3c(F)ccc(O)c3O)C2)cn1 790070561 DDNSZQPLMDXQEN-JTQLQIEISA-N 334.351 1.369 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 1158771717 MFJMROMTNKZOTN-UONOGXRCSA-N 340.379 1.448 10 10 EDCE NS(=O)(=O)C[C@H]1CCCN(Cc2ccc(N3CCCC3)cc2)C1 1321180370 VDRUCCGIYWADHD-INIZCTEOSA-N 337.489 1.787 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1CCN[C@@H]2COC[C@@H]21 2132578370 DIHPVDVHHFKFHU-NEPJUHHUSA-N 347.640 1.981 10 10 EDCE CC[C@H](F)C(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1354638328 JZJFKMRVHLVOBG-CABZTGNLSA-N 337.355 1.832 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)c1cnn(C)c1I 1912154948 FNGGOYQSDINIIN-UHFFFAOYSA-N 348.148 1.797 10 10 EDCE [N-]=[N+]=NC[C@H]1CCN(C(=O)Cn2cc(Br)ccc2=O)C1 1912187265 GHCLHRYRXLVQJX-SECBINFHSA-N 340.181 1.770 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](O)C[C@@H]2CO)cc1Br 2136081164 BBTBFOBAGBKRHJ-JLLWLGSASA-N 330.222 1.824 10 10 EDCE CC[C@H](C)C(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1524876399 GEUYUXXRAJJKHV-DRZSPHRISA-N 335.404 1.522 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CC(c2n[nH]c3c2COCC3)C1 1472386625 KYJXTEOZQXFZER-DUXPYHPUSA-N 341.367 1.533 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CC(=O)N(Cc2ccco2)C1 1471661689 YDXQLSBIFFEDIX-LBPRGKRZSA-N 330.340 1.356 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)CN(C)C(C)=O)cc1C 1482815075 ZGWCFMKTPAKKIG-CQSZACIVSA-N 335.448 1.466 10 10 EDCE COc1ccc(CNC2(CNC(=O)CCc3cnn[nH]3)CC2)cc1C 1483768243 LODHOADFIFJTMW-UHFFFAOYSA-N 343.431 1.493 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)CN2CCCC2=O)cc1C 1715783090 DXJBNNUKCIFZOO-ONEGZZNKSA-N 345.443 1.388 10 10 EDCE COC(=O)[C@@H](COC1CCC1)N(C)C(=O)/C=C/c1ccc(O)c(O)c1 1622942092 PFOLTARQBANQPC-RCQQVGEISA-N 349.383 1.680 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)Cn2cccn2)cc1C 1485120804 JBQDOTATLQAGQC-HUUCEWRRSA-N 330.432 1.883 10 10 EDCE COCCOC[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1566144174 LCPNTBROKZNDNT-GFCCVEGCSA-N 334.376 1.974 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CCN(C(=O)c2ccccc2)C1 1639292859 TXJGULQYXBKEDO-CQSZACIVSA-N 340.379 1.876 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@H](NS(C)(=O)=O)C(C)C)c1 1631542619 JPVLRABMWWMSBZ-QMTHXVAHSA-N 344.433 1.152 10 10 EDCE CCn1cc(-c2n[nH]cc2C(=O)NCc2cccc(O)c2O)cn1 1651175910 SJLPJSKXTBEIBE-UHFFFAOYSA-N 327.344 1.634 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)C2(F)CCCC2)cc1 1742543959 RDEVTEJEZVMDIY-UHFFFAOYSA-N 349.366 1.977 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1662924253 FVRARFCUGWTSSG-GOEBONIOSA-N 347.459 1.466 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1cn(C)c(O)n1 1668546715 XNZOCXRDPDSDQY-UHFFFAOYSA-N 346.431 1.695 10 10 EDCE COc1cc(/C=C2\SC(=S)N(CCCO)C2=O)ccc1O 16904774 SDZHBBUWRZLWGE-WQLSENKSSA-N 325.411 1.984 10 10 EDCE O=C(CN1C(=O)/C(=C/c2ccccc2F)SC1=S)NCCO 16905433 LMFONLIZKZIPES-XFFZJAGNSA-N 340.401 1.135 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2140661773 IQBHUJYZLWGZPE-VFFVRTRHSA-N 333.201 1.349 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H]3[C@@H](C2)OCCN3C)c([N+](=O)[O-])c1 153165737 GAYOOTSJDUQVMI-INCBCAAFSA-N 347.371 1.300 10 10 EDCE NC(=O)[C@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)C1 155400366 DPESZSSSTBOTPD-JKSUJKDBSA-N 342.443 1.906 10 10 EDCE CCOC(=O)CC(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1866121321 GRMYWXPLYDXIOI-KRWDZBQOSA-N 344.415 1.645 10 10 EDCE CCOc1cccnc1NC(=O)c1nnn(-c2ccc(N)cc2)n1 1857878942 PCKXHZOPTHLSLU-UHFFFAOYSA-N 325.332 1.291 10 10 EDCE CNCc1ccc(N2CC[C@H]3CC(=O)N[C@@H]3C2)c(Br)c1 2145075116 ZNHSGFUPGSJFML-WCQYABFASA-N 338.249 1.883 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985103543 XAGBUYAYDOGFRV-DCAQKATOSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CC(N=[N+]=[N-])C2)CC(CO)C1 1990176261 DWQLNTDHDRSEJD-UHFFFAOYSA-N 325.369 1.173 10 10 EDCE CCCn1nnc(Br)c1[C@H](O)[C@@H](N)c1ccccc1O 2156513556 FMUADFKQPXZXHD-CMPLNLGQSA-N 341.209 1.890 10 10 EDCE NCc1cc(F)c(N2CC[C@@H]3C(=O)NC[C@H]3C2)cc1Br 2157183395 IHVSGGVFRXDCOV-UWVGGRQHSA-N 342.212 1.619 10 10 EDCE NC[C@H]1COCCN1Cc1cc(Cl)cc(Br)c1O 2035630348 STEPHKGKHLEUKX-JTQLQIEISA-N 335.629 1.968 10 10 EDCE Oc1ccc(CNCCn2cc(Br)cn2)c(O)c1O 311788396 LRXGOKWEVXQRNO-UHFFFAOYSA-N 328.166 1.552 10 10 EDCE C[C@@]1(CO)CN(c2ccc(CO)cc2Br)C[C@@]1(C)CO 704291079 VDCDBDHIUTXCAB-GJZGRUSLSA-N 344.249 1.759 10 10 EDCE CC[C@@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C[C@H]1O 399885507 HKOZYTVBBCKXNL-KEMBBXRSSA-N 340.221 1.608 10 10 EDCE CCCN(c1ccc(CN)c(Br)c1)[C@H]1CC(=O)NC1=O 2171198598 XJCBPADSTLYFCM-LBPRGKRZSA-N 340.221 1.539 10 10 EDCE C[C@H](NCc1ccc(Br)cc1O)[C@H]1CN(C)CCN1C 1183919439 KFZRDDCVNQQFAG-SMDDNHRTSA-N 342.281 1.879 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](CO)C[C@@H]2CO)cc1Br 2089863701 MKNWCVXJVTXWFA-HOSYDEDBSA-N 329.238 1.648 10 10 EDCE CN(c1ccc(CN)c(Br)c1)[C@@H]1CS(=O)(=O)C1(C)C 2097548726 KGMDBJNIUVTORX-GFCCVEGCSA-N 347.278 1.920 10 10 EDCE CO[C@H]1CCN(CCNCc2cc(Br)ccc2O)C1 2267895172 KETCDOFEWCAJPE-ZDUSSCGKSA-N 329.238 1.965 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@@H](O)CC2)cc1Br 2269137230 HALXVVGKTXCJIX-IIMNLJJBSA-N 329.238 1.791 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2298024088 XRLISTYTHFYEHZ-WYUUTHIRSA-N 339.396 1.874 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCc2cc(O)c(O)cc2C1 2302401565 LGEKFKJCQMTHSG-SNVBAGLBSA-N 336.388 1.896 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCN(CC4CC4)CC3)cc2N1 301616797 JWWWLSJETNAEAI-UHFFFAOYSA-N 332.360 1.458 10 10 EDCE COc1cc([C@]2(NC(=O)OC(C)(C)C)C[C@H]2C(=O)O)cc(O)c1O 1952888700 WNEYYETYGLIJFI-XXFAHNHDSA-N 339.344 1.931 10 10 EDCE CC(=O)C(=O)COC(=O)C1CCN(C(=O)COc2ccccc2)CC1 808503026 YFEIRRUDKFCLGK-UHFFFAOYSA-N 347.367 1.005 10 10 EDCE COC[C@H](O)CNC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 801969223 IBYMQRPBVXYZKV-GOSISDBHSA-N 345.443 1.943 10 10 EDCE COC(=O)C1(CS(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)CCC1 291072103 IXFDWCGNKAZSPK-UHFFFAOYSA-N 343.357 1.175 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cn([C@H]3CCCNC3)nn2)c1 818213601 IYOAZZLAKOCUMG-NEPJUHHUSA-N 345.403 1.408 10 10 EDCE O=[N+]([O-])c1cc(CN2CCC[C@](O)(CO)C2)ccc1N1CCCCC1 839156191 YKRMEGHYLZFCHW-GOSISDBHSA-N 349.431 1.904 10 10 EDCE CC(C)(CCN1CCOCC1)NC(=O)/C=C\c1ccc(O)c(O)c1 912951832 NLDNGGNXUKAOEU-XQRVVYSFSA-N 334.416 1.728 10 10 EDCE COc1ccc(N2CCN(Cc3n[nH]c4c3COCC4)CC2)cc1 929153108 PCFYVUCIAMCIJO-UHFFFAOYSA-N 328.416 1.813 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCn3ccccc3=O)C2)cc1 855232111 NDQDSKBGZNXPOC-HNNXBMFYSA-N 341.411 1.642 10 10 EDCE COc1ccc2c(c1)CCCCN2Cc1cc(=O)n2nc(N)[nH]c2n1 856731951 CHOMLORIWRIEIR-UHFFFAOYSA-N 340.387 1.351 10 10 EDCE O=[N+]([O-])c1cc(Cl)cc(CNC[C@]2(OCCO)CCOC2)c1O 850358845 YHSOFJFJPQDPDA-CQSZACIVSA-N 346.767 1.211 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCN2CCOC[C@H]2C1 758495950 SEFHAZSAVQVPRG-QGZVFWFLSA-N 332.448 1.287 10 10 EDCE C[C@H](NCC[C@@H]1CNCCS1(=O)=O)c1cc(Cl)ccc1O 925795025 NUHPJVUSIHIELY-CMPLNLGQSA-N 332.853 1.473 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CNC(=O)CCC(C)C)C2)cc1 855230066 MNUDWATWYBRBTG-OAHLLOKOSA-N 347.459 1.943 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H]4COC[C@@]4(C)C3)C2)cc1 852450660 RBSOGRSTYUENEW-ZRGWGRIASA-N 345.443 1.952 10 10 EDCE COC(=O)[C@]1(OC)CCN(Cc2cccc(Br)c2O)C1 862473950 IWPIGOPPBDQZCG-AWEZNQCLSA-N 344.205 1.919 10 10 EDCE O=C(C1CS(=O)(=O)C1)N(Cc1ccco1)Cc1ccccc1O 866595873 REILFYCFJBBBOA-UHFFFAOYSA-N 335.381 1.559 10 10 EDCE CNC(=O)c1cccc(CCC(=O)NCc2ccc(O)c(O)c2)c1 778916275 ALQWTKGBEWVEKV-UHFFFAOYSA-N 328.368 1.706 10 10 EDCE O=C(N[C@H](CO)C[C@@H]1CCCO1)c1cc2cc(O)c(O)cc2s1 899277560 NQLBHSIWQBFVHJ-QWRGUYRKSA-N 337.397 1.972 10 10 EDCE NCc1ccc(N2CCC[C@H](CO)[C@@H]2CO)cc1Br 709811562 RUQBQDIJMDKGTK-RISCZKNCSA-N 329.238 1.477 10 10 EDCE CCN(Cc1cc(Br)ccc1O)[C@H]1CCC(=O)NC1=O 799124949 CHYJYJMODZPLMG-NSHDSACASA-N 341.205 1.782 10 10 EDCE Cc1sc2ncc(C(=O)NCc3c(O)cccc3O)c(=O)n2c1C 1156881002 LGNMIGFFRJCBJH-UHFFFAOYSA-N 345.380 1.714 10 10 EDCE O=C(CNC(=O)NCc1ccc(F)cc1)NCc1cc(O)ccc1O 1303223334 KNHFSDHUVWXPRE-UHFFFAOYSA-N 347.346 1.353 10 10 EDCE Cc1cc(Cn2nnnc2N2CCOc3cc(N(C)C)ccc32)no1 1335415321 GGHCGNPOBDKFLA-UHFFFAOYSA-N 341.375 1.614 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@@]3(C)C[C@@H](O)CN3C)CC2)cc1 1333111331 OWDCDZFJYVFVFR-VQIMIIECSA-N 347.459 1.189 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2n(n1)CCC[C@H]2O 1447561466 IZBNCQJPURDRJG-QMTHXVAHSA-N 331.372 1.483 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@@](C)(O)C2)cc1Br 2136828204 ICLIFKPBUMNJJJ-HERUPUMHSA-N 329.238 1.791 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1cn(C(F)(F)CO)nn1 1543309117 AEFWASXWNWNPKQ-UHFFFAOYSA-N 339.346 1.124 10 10 EDCE CCNC(=O)CNCCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1483511982 ZONNJIAMHPAEDS-UHFFFAOYSA-N 348.407 1.037 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCN(C(=O)CCCF)C2)cc1 1720697775 TWUYNNSYXMBFMC-ZDUSSCGKSA-N 349.366 1.929 10 10 EDCE C[C@@H](O)CNC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(C)(C)C 1649473751 QLYSBHANNKBLIL-BXUZGUMPSA-N 349.435 1.964 10 10 EDCE CC[C@H](F)C(=O)NCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1737764726 JJCCHSMVILKEQS-LBPRGKRZSA-N 337.355 1.785 10 10 EDCE CN1CC(=O)Nc2cc(C(=O)NCc3c(O)cccc3F)cnc21 1646035250 UFGMSDBPHAZKPX-UHFFFAOYSA-N 330.319 1.245 10 10 EDCE CC(C)(C)OC(=O)c1c[nH]nc1NC(=O)Cc1ccc(O)c(O)c1 1640030405 UDAUALBMBWJIDK-UHFFFAOYSA-N 333.344 1.957 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@H]1CC(=O)N(c2cccc(F)c2)C1 1570462093 DBPLQHQPNIVUDV-LBPRGKRZSA-N 344.342 1.906 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN[C@H](c2ccc(F)cc2)C1 1644066373 CXYLYZBNOAIEMO-HNNXBMFYSA-N 330.359 1.953 10 10 EDCE CC(C)[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H](C)O 1667525096 QDEOGAZLAHRCFV-BXUZGUMPSA-N 335.408 1.574 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@H]2C[C@H]2C(N)=O)cc1C 1668215288 ZUBXRRPMHHVTNN-CFVMTHIKSA-N 333.432 1.109 10 10 EDCE O=C(CNC(=O)c1cccc(Cl)c1)NCc1cc(O)ccc1O 1593869199 SGCFSBPOROPAHI-UHFFFAOYSA-N 334.759 1.797 10 10 EDCE CCC[C@H]1C(=O)NCCN1c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1772906881 XJUORRDSUGTKAQ-QPBFKRLHSA-N 347.371 1.886 10 10 EDCE CC(=O)NCCc1nc(-c2cn(-c3ccc(N)cc3)nn2)c(C)s1 887502263 FNIPWKXPZZKSAC-UHFFFAOYSA-N 342.428 1.960 10 10 EDCE COc1ccc(Br)c(CNCC(=O)NC(C)C)c1O 1964021759 JSLXKMHGSGBYAO-UHFFFAOYSA-N 331.210 1.778 10 10 EDCE CO[C@@H]1C[C@H](C(=O)NCCN=[N+]=[N-])CN(C(=O)OC(C)(C)C)C1 1965102719 SNAICFAHJFAPBB-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1986368356 FLHQPYROJDYEOF-WDEREUQCSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)C(=O)N1CCC(N=[N+]=[N-])CC1 1987702667 VILUGSYWNUOVTQ-JTQLQIEISA-N 327.385 1.421 10 10 EDCE NCc1cc(F)c(N2[C@H](CO)C[C@@H]3OCC[C@H]32)cc1Br 2146706370 ZQGPIAXELRMYNU-BHYNMZESSA-N 345.212 1.775 10 10 EDCE COc1nsc([C@H](NCCN=[N+]=[N-])C(=O)O)c1Br 702083754 NMMXGHLUWSRPLX-YFKPBYRVSA-N 336.171 1.940 10 10 EDCE CN1C(=O)N[C@H]2CN(c3ccc(CN)c(Br)c3)CC[C@H]21 2171305825 WSVFPJNMMGLIPL-QWHCGFSZSA-N 339.237 1.510 10 10 EDCE C[C@@H]1[C@@H](CO)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 385832637 UICCHGUZWAQDGE-RBDZCENOSA-N 340.221 1.608 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@H](C)[C@H](O)C3)c(Br)cc21 388158546 SXZBFVOQDGQIKF-YLJLNXRRSA-N 340.221 1.479 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)[C@@H]2C1 1907306087 GACMAEYOXIILGE-QSLWVIQJSA-N 336.432 1.755 10 10 EDCE CNCc1ccc(N2CC[C@](C)(O)[C@@](C)(O)C2)cc1Br 2194611556 UJJUVQUGXMEBFO-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE CC[C@H](NCCn1cnnn1)c1cc(Br)ccc1O 2090428905 WMYURIVOGVMAAN-NSHDSACASA-N 326.198 1.882 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCN(C)C(=O)C2)c1O 2236047201 TVWNVICSIDAABM-SECBINFHSA-N 343.221 1.874 10 10 EDCE CC(=O)NN1C(=O)C(=Cc2ccc(O)c([N+](=O)[O-])c2)SC1=S 2293069218 OZWIBTIWCILAQD-UHFFFAOYSA-N 339.354 1.553 10 10 EDCE Cc1ccc(CN2CC[C@@H](O)[C@@](C)(O)C2)c(O)c1Br 2352685491 FKJMQKXCDQAUTF-RISCZKNCSA-N 330.222 1.781 10 10 EDCE COc1ccc(O)c(CNC(=O)C2CCN(C(=O)C3CC3)CC2)c1 172043946 MYCYLKJPAOQOBN-UHFFFAOYSA-N 332.400 1.666 10 10 EDCE CNCc1ccc(N2CC[C@](C)(O)[C@H](O)C2)cc1Br 1893332587 SMCHYQNTWPOOLE-KGLIPLIRSA-N 329.238 1.491 10 10 EDCE COC(=O)c1cncnc1N1CCN(c2ccc(OC)cc2)CC1 325259831 JLXZZPYYVRCQMG-UHFFFAOYSA-N 328.372 1.598 10 10 EDCE CCOc1ncnc(N2CCN(c3ccc(OC)cc3)CC2)c1N 40727861 VITAXGWOWDGLTN-UHFFFAOYSA-N 329.404 1.793 10 10 EDCE CC(=O)NC1CN(C(=O)c2cccc3c2C(=O)c2ccccc2C3=O)C1 190611842 DNKFETWHRUHFST-UHFFFAOYSA-N 348.358 1.423 10 10 EDCE Nc1ccc(CCn2cncc(I)c2=O)cc1 90769130 BPEIIHHDECIROK-UHFFFAOYSA-N 341.152 1.673 10 10 EDCE COc1ccc(CN(C)C2CCN(S(C)(=O)=O)CC2)c(O)c1 91964022 OCGMQPNSFYXZLW-UHFFFAOYSA-N 328.434 1.257 10 10 EDCE CN(C)c1ccc(CN(C(=O)CSc2n[nH]c(=O)[nH]2)C2CC2)cc1 287722088 VLCABDCLQQBMID-UHFFFAOYSA-N 347.444 1.447 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cn(CC2CC2)nn1 556188731 ZHKUURMEXOXMGR-UHFFFAOYSA-N 327.388 1.793 10 10 EDCE O=C1[C@H]2[C@H]3C[C@H]4[C@@H]2[C@@]2(C(=O)NCCc5ccc(O)c(O)c5)[C@@H]4[C@@H]3[C@@H]12 800519188 NBMNPPAKEVXNHP-FEYQFBLXSA-N 325.364 1.084 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1C[C@H](C)CCN1C(=O)OC(C)(C)C 808539089 QLSWXLJCOYUKPY-ZYHUDNBSSA-N 327.377 1.723 10 10 EDCE CC(C)OC[C@H](O)CNCc1ccc(N2CCOCC2)c(F)c1 818967615 XBXKRCZSQIEOJT-OAHLLOKOSA-N 326.412 1.538 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2C[C@H]3CC[C@H]2[C@@H]2CNC[C@H]32)c1O 903962866 LOIKYYARPCTXMA-ZRJCITRHSA-N 333.388 1.739 10 10 EDCE CN(C)C(=O)CN1CCC(NC/C=C\c2ccc(N(C)C)cc2)CC1 835037585 QHAQAMPABHVXHC-WAYWQWQTSA-N 344.503 1.908 10 10 EDCE CC[C@H](NC[C@@]1(CO)COCCN1C)c1cc(Cl)ccc1O 903278673 MRDIGGANMNODFC-GOEBONIOSA-N 328.840 1.779 10 10 EDCE CNC(=O)C1CCC(NC(=O)NCc2cc(OC)ccc2O)CC1 734066928 HZVPSTRMBQXXQY-UHFFFAOYSA-N 335.404 1.505 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cn2c(n1)CCC2 843532067 RXFHCJRBALNRQH-UHFFFAOYSA-N 344.390 1.735 10 10 EDCE Cn1ccnc1CN1CCC(C(=O)NCc2ccccc2O)CC1 748345556 NDCIVOIXVKYJIH-UHFFFAOYSA-N 328.416 1.654 10 10 EDCE C[C@H](NC(=O)NCc1ccc2c(c1)CCCN2C)c1nnc(O)n1C 915390184 IMHWVRSIMMDSOD-NSHDSACASA-N 344.419 1.464 10 10 EDCE O=C(O)c1cncnc1NCc1ccc(N2CCC(CO)CC2)cc1 844207411 DQHCSQJURHZRPP-UHFFFAOYSA-N 342.399 1.996 10 10 EDCE O=C(NCc1ccccc1O)C(=O)N1CCc2cc(F)c(F)cc21 748481848 PJSIZGDZDCGMGJ-UHFFFAOYSA-N 332.306 1.876 10 10 EDCE CN(C)C1CCN(CCNC(=O)NCc2c(O)cccc2F)CC1 921668506 RNXDRZRWVILNBO-UHFFFAOYSA-N 338.427 1.357 10 10 EDCE COc1ccc(N2CCCN(C[C@@H]3CCCS3(=O)=O)CC2)cc1 929317020 VCYJFEGIVGJOPR-KRWDZBQOSA-N 338.473 1.785 10 10 EDCE Cc1nc(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)no1 852144155 LOXVPNJOQWQEGJ-UHFFFAOYSA-N 345.403 1.339 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](CO)[C@H](c2cc(O)c(O)cc2O)C1 687742597 DWOWNNLRVPUJEL-GXSJLCMTSA-N 325.361 1.746 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNCc3cnccn3)cc2)C1 856766497 AWWMVNXCMPGDFK-HNNXBMFYSA-N 325.416 1.468 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3c(O)ccc4ccncc34)C[C@@H]12 853570711 RKASCDYWZJIPBW-UAGQMJEPSA-N 348.424 1.184 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](O)C3(C)C)C2)cc1 852447730 DHJDKMLQXCAQTR-XJKSGUPXSA-N 333.432 1.829 10 10 EDCE C[C@H](NC(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1O 868143041 NJNSRIGIWYYCOY-NWDGAFQWSA-N 341.433 1.176 10 10 EDCE Cc1ccc(O)c(CNS(=O)(=O)c2c(C(F)(F)F)cnn2C)c1 867558743 APFUHLFXEYDOCW-UHFFFAOYSA-N 349.334 1.931 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@H]3CC[C@H]2[C@@H](CN)C3)cc1 866694589 IULGJJRJDAKZKW-JZXOWHBKSA-N 330.476 1.428 10 10 EDCE Cc1cc(Br)cc(CN(C)C2CS(=O)(=O)C2)c1O 895397827 LJEOTDHKYMBXBU-UHFFFAOYSA-N 334.235 1.692 10 10 EDCE CS(=O)(=O)Nc1ccc(NS(=O)(=O)CC(F)F)cc1Cl 695102348 RYSAHLXFBQVMAI-UHFFFAOYSA-N 348.780 1.718 10 10 EDCE CCN1C[C@H](C)N(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@@H]1C 1329437596 OCEYEKBBPNZSBP-STQMWFEESA-N 331.416 1.176 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2CCCC(=O)N2)cc1C 1328354577 XZDOKRPNKRVJJY-GOEBONIOSA-N 347.459 1.657 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)C[C@H]2COC(=O)C2)cc1C 1321024902 OXIOWYZJFMTYCR-MJSXRHKHSA-N 346.427 1.719 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 1333090734 WUEJPXUKZFGENR-HNNXBMFYSA-N 345.443 1.540 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21)c1ccc(N(C)C)cc1 1335882881 CDOSKIAKWHLWNI-JZMHTTPVSA-N 343.427 1.222 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C2(C3CC3)CC2)cc1C 1278099453 LDXZLLPCZZKDSN-INIZCTEOSA-N 332.444 1.761 10 10 EDCE Cc1cnc(OC2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)nc1 1452659977 VJKUUMCGPMRSHY-UHFFFAOYSA-N 343.383 1.809 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)NCc2c(O)cccc2F)c1 1456031021 WATZHJAQVCZFJJ-WAYWQWQTSA-N 329.331 1.616 10 10 EDCE Cc1c(Br)cnn1CC(=O)NCc1ccc(O)cc1O 1557085450 MKUBGTGSIAEFPH-UHFFFAOYSA-N 340.177 1.682 10 10 EDCE O=C(CN1C(=O)COc2ccccc21)NCc1cc(O)ccc1O 1637122411 FVFJMBSMGHEHNF-UHFFFAOYSA-N 328.324 1.140 10 10 EDCE C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)NCc1ccco1 1584130109 KNPORPYVHTYJRD-SNVBAGLBSA-N 343.343 1.877 10 10 EDCE CC(C)[C@H]1C[C@@H]1C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1742543640 LRIFNSZQPOJYHS-KGLIPLIRSA-N 345.403 1.987 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(O)CCSC1 1751880711 AGUFCLLIMAQNIO-MRXNPFEDSA-N 334.445 1.797 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)C(C)(C)C(N)=O)cc1C 1662935718 WONACNDCEAUGLZ-CYBMUJFWSA-N 335.448 1.500 10 10 EDCE CC(C)(C)NC(=O)CNC(=O)NCCCSc1nccs1 151798371 NHVRSZKMNPDFAR-UHFFFAOYSA-N 330.479 1.839 10 10 EDCE COc1cc([C@@H](CNC(=O)OC(C)(C)C)C(=O)O)cc(O)c1O 1951720871 AMOCULMDPUWUGQ-SECBINFHSA-N 327.333 1.799 10 10 EDCE C[C@H](NCc1cc(Br)ccc1O)C1CS(=O)(=O)C1 1967843776 RZVSLNRAHJUXMZ-QMMMGPOBSA-N 334.235 1.677 10 10 EDCE COCCNCc1ccc(N2CC[C@@H]2C(N)=O)cc1Br 2145604540 NTEVEXWZLRKQHY-CYBMUJFWSA-N 342.237 1.249 10 10 EDCE CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCN=[N+]=[N-] 1985102856 MSYKVVWKLDOMDK-VIFPVBQESA-N 329.357 1.259 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CNCc1cc(F)cc(F)c1O 1985775906 ONBNORAAMHMITG-NSHDSACASA-N 332.347 1.646 10 10 EDCE CNCc1ccc(N(C)C2CS(=O)(=O)C2)cc1Br 2034768410 MJRYEBHJFVAIAM-UHFFFAOYSA-N 333.251 1.402 10 10 EDCE NCCN(CC(=O)NCCc1ccc(O)c(O)c1)Cc1ccccc1 2035443910 NZXQMORPUPDHEW-UHFFFAOYSA-N 343.427 1.217 10 10 EDCE CNCc1ccc(N2CC[C@H](N3CC(O)C3)C2)cc1Br 2158750030 AGAHVKKAVWYHOZ-ZDUSSCGKSA-N 340.265 1.424 10 10 EDCE CNCc1ccc(N2CCN(CCCO)CC2)cc1Br 2169925628 FOWJCXBFSBBYBF-UHFFFAOYSA-N 342.281 1.673 10 10 EDCE OCc1ccc(N2CCC(C(CO)CO)CC2)cc1Br 2170674895 WZHRMOAGGPQCEQ-UHFFFAOYSA-N 344.249 1.759 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CCO[C@]2(C(=O)NCCCN=[N+]=[N-])C1 1908254136 HWYJFVOAYOJVPA-XHDPSFHLSA-N 339.396 1.829 10 10 EDCE C[C@H](N)c1ccc(N2CCCC2(CO)CO)c(Br)c1 2089868571 SFUIJNIWZHIYPE-JTQLQIEISA-N 329.238 1.792 10 10 EDCE COc1ccc(N2CC[C@H](O)[C@@](C)(O)C2)c(OC)c1Br 2234901961 JQXFOSJHGIWJQA-FZMZJTMJSA-N 346.221 1.788 10 10 EDCE [N-]=[N+]=NC[C@H]1CCCCN(S(=O)(=O)C2CC3(C2)OCCO3)C1 2277972140 GTYCFQZVHOOKNK-LLVKDONJSA-N 330.410 1.634 10 10 EDCE CN(C)CCN(C[C@H]1CCCO1)C(=O)C=Cc1ccc(O)c(O)c1 2308000652 HGGLDHUEXNTRRK-OAHLLOKOSA-N 334.416 1.680 10 10 EDCE Cc1cc(C=C2C(=O)NC(=S)N(C)C2=O)c(C)n1C[C@@H]1CCCO1 2313630107 JLLZGRBBBPZPOO-ZDUSSCGKSA-N 347.440 1.540 10 10 EDCE O=S1(=O)C[C@H]2CN(c3ccc(CO)c(Br)c3)C[C@H]21 2314776023 QWZNLFOFXBFKQP-BXKDBHETSA-N 332.219 1.175 10 10 EDCE COC(=O)c1sc(NN(C)S(=O)(=O)C2CC2)nc1Cl 2339726013 RQGQJRZDMIJQNJ-UHFFFAOYSA-N 325.799 1.334 10 10 EDCE CCCS(=O)(=O)N1CCN(c2ccc3c(c2)CC(=O)N3C)CC1 62576053 GTWPTVXQMIFBJA-UHFFFAOYSA-N 337.445 1.067 10 10 EDCE C[C@H](Nc1cncc(C(N)=O)n1)c1ccc(N2CCOCC2)cc1 301496278 BYWCTDSTCGFACD-LBPRGKRZSA-N 327.388 1.585 10 10 EDCE O=C(O)C[C@@H]1CS(=O)(=O)CCN1Cc1c(O)cccc1Cl 128842674 OALQZBSLBWUVGI-SECBINFHSA-N 333.793 1.119 10 10 EDCE C[C@H](O)C1CCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 297764602 HSQDRYVOCNBROP-AWEZNQCLSA-N 347.459 1.330 10 10 EDCE NS(=O)(=O)C[C@H]1CCCN(Cc2cc(Cl)c(F)cc2O)C1 295278634 IESZRIGGWRQQNB-VIFPVBQESA-N 336.816 1.685 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@@H](c3nc[nH]n3)C2)c([N+](=O)[O-])c1 819948472 FUYWEQNEHYYDRZ-OGOUPESXSA-N 343.343 1.893 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1nc(COC)n[nH]1 821178711 YSVQKXNAEWWQPM-UHFFFAOYSA-N 346.435 1.749 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@H]3CCOC3)C2)cc1 824693184 JSIZTTYIFVPLPV-ZBFHGGJFSA-N 333.432 1.952 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)c2ccc3nnn(C)c3c2)cc1 832284565 KSMPWUVKGRCATH-HNNXBMFYSA-N 338.415 1.464 10 10 EDCE Fc1cc(CN[C@@H]2CNCCC2(F)F)ccc1N1CCOCC1 841074646 FLTJIKVEAIYFBK-OAHLLOKOSA-N 329.366 1.749 10 10 EDCE O=C(NCc1c(O)cccc1F)c1cc(N2CCOCC2)ccn1 928709585 JSZFBCIDOQIZLF-UHFFFAOYSA-N 331.347 1.693 10 10 EDCE CC[C@H](NC(=O)C(=O)NCCc1ccc(N)cc1)[C@H]1CCCCO1 848613518 JULRZIUFSQMXTL-JKSUJKDBSA-N 333.432 1.391 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C(N)=O)C(C)C)C2)cc1 854296095 BQSPGXPRUJDVHH-SWLSCSKDSA-N 334.420 1.083 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)[C@H]2COC(C)(C)C2)cc1F 858925694 NJJWCOOVJGJZPP-GFCCVEGCSA-N 330.425 1.879 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCC[C@@H]2CS(N)(=O)=O)c1O 750044344 FUZCUUKGXIHXBT-GFCCVEGCSA-N 346.836 1.501 10 10 EDCE CO[C@@H](CNC(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CCOC1 852439924 JPTCDJLNGIJXQO-WBVHZDCISA-N 335.448 1.946 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)C[C@@H]2CO)c(Br)c1 698194798 AVVFPZQAHOBIPO-OLZOCXBDSA-N 343.265 1.881 10 10 EDCE O=C(NCC[S@](=O)CC(F)(F)F)c1c(F)ccc(O)c1O 857302538 UYWRCFCGJJYHRB-NRFANRHFSA-N 329.271 1.278 10 10 EDCE Cc1ccc(O)c(CNC(=O)[C@H]2CCN(C)C[C@@H]2c2cnn(C)c2)c1 862754312 XLABVOUEJIPQFT-DLBZAZTESA-N 342.443 1.786 10 10 EDCE C[C@@H](NS(=O)(=O)c1cnc2n1CCC2)c1ccc(N(C)C)cc1 773089671 UALKYXNIRQGFLH-GFCCVEGCSA-N 334.445 1.935 10 10 EDCE C[C@H](NC(=O)NCCc1nnc2n1CCC2)c1ccc(N(C)C)cc1 776160564 VOKFQMRZKQFLAX-ZDUSSCGKSA-N 342.447 1.893 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NS(C)(=O)=O)C1 774028100 IHTMTUTWCHTDQU-UHFFFAOYSA-N 349.456 1.484 10 10 EDCE COC(=O)c1ccc(CCNC(=O)Cc2ccc(O)c(O)c2)cc1 1141256242 DPPJLZVWJIRYNO-UHFFFAOYSA-N 329.352 1.786 10 10 EDCE Cn1cc([C@H](O)C(=O)Nc2c(-c3ccccn3)nc3ccccn23)cn1 1141722637 FHBWEGBOXIJWBS-INIZCTEOSA-N 348.366 1.802 10 10 EDCE CCNC(=O)CCC(=O)N[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1317107365 IUYOETLTYAXWSB-IYBDPMFKSA-N 347.459 1.657 10 10 EDCE O=C(O)C[C@@H]1CN(Cc2cc(Br)ccc2O)C[C@H]1O 2117724597 MHEXEGLCQAKRKE-BXKDBHETSA-N 330.178 1.422 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H](CNCCO)C2CCCC2)cc1 1324518290 RQLTZUDVBVPIEM-OAHLLOKOSA-N 347.419 1.720 10 10 EDCE NCc1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)cc1Br 2121593453 QFNICTKGCUYCAN-QKCSRTOESA-N 327.222 1.351 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@@H](CO)[C@@H](CCO)C2)cc1F 1346266687 HPMLTLQJSZOMMR-KBPBESRZSA-N 339.411 1.024 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@@H](O)CN(C)CC(F)(F)F)c1 1192780995 ODEWWAWIAPSWLE-WDEREUQCSA-N 336.354 1.906 10 10 EDCE O=C(NCC[C@H]1CC1(F)F)C(=O)NCc1ccc(N2CC=CC2)cc1 1347951592 IQHHPSASZUPFNS-AWEZNQCLSA-N 349.381 1.841 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@@H](CO)[C@H](CCO)C1 1348569806 FUDXZTWZIOOFAE-SJORKVTESA-N 345.443 1.195 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)C(C)(F)F)cc(OC)n1 1510426375 OGJDPPKLWSMTIT-VIFPVBQESA-N 345.346 1.331 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCNC(=O)c2ccco2)cc1 1293105999 IKILXPDDOPOESN-UHFFFAOYSA-N 343.343 1.992 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nn1c(O)nnc1O 1450470162 XLWMBWMASDJVAA-UHFFFAOYSA-N 341.327 1.293 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)COCc1nncn1C 1540488081 CPUPXCKVEJKWOJ-UHFFFAOYSA-N 343.431 1.591 10 10 EDCE CC(C)N(C)CCOCCNC(=O)c1ccc(N=NC(N)=O)cc1 1485775389 FFIDDEYKPWPBJU-UHFFFAOYSA-N 335.408 1.936 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)CCn2cnnn2)cc1C 1717431734 XBNWMXOYADFBAC-ZIAGYGMSSA-N 346.435 1.063 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@H]2COC(=O)N2)C2CC2)cc1C 1713109405 UYJWDPGHVMBDEO-LSDHHAIUSA-N 347.415 1.096 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccc(N2CCOCC2)cc1 1637126316 SKNUVINCDSGUGT-UHFFFAOYSA-N 328.368 1.864 10 10 EDCE Cc1nnc(CCNC(=O)c2cc3cc(O)c(O)cc3s2)n1C 1634400175 RYTNDUIDBMFATJ-UHFFFAOYSA-N 332.385 1.722 10 10 EDCE Cn1cnc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)cc1=O 1556879619 SWUQLAVAFBIHTN-UHFFFAOYSA-N 346.350 1.742 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1C=CS(=O)(=O)C1 1632681978 YUMPBIIJOGQPOE-JQWIXIFHSA-N 325.386 1.093 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@@H]1CSC(c2ccccc2O)=N1 1643812398 IFNYMUXCGPEAHO-LBPRGKRZSA-N 344.392 1.982 10 10 EDCE COC1CCN(c2ccc(CN[C@H](CO)c3cnn(C)c3)cc2)CC1 1642646637 SORAFVBABVQMQO-LJQANCHMSA-N 344.459 1.859 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)[C@H](O)C2)cc1Br 232729255 NVQWPHVKNANSKI-ZIAGYGMSSA-N 329.238 1.489 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1Cc1cnnn1C 1694637021 LVYYVLQDBBCANT-UHFFFAOYSA-N 327.392 1.359 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CCOC1 1985102200 CWDPIUXZDPCMFA-QMTHXVAHSA-N 325.369 1.581 10 10 EDCE Oc1ccc(Br)cc1CNCc1nnc2ncccn12 2160424321 UIEYAVDYDRRPMD-UHFFFAOYSA-N 334.177 1.882 10 10 EDCE CN1C(=CC=C2C(=O)NC(=S)NC2=O)C(C)(C)c2ccccc21 2053467535 PUSFVWZINMLTED-UHFFFAOYSA-N 327.409 1.755 10 10 EDCE CCN([C@@H](C)c1cc(Br)ccc1O)[C@@H]1CC(=O)NC1=O 2171203986 OLGYYNXDZGZGEC-GZMMTYOYSA-N 341.205 1.953 10 10 EDCE CC(C)C[C@@]1(C(=O)O)N[C@@H](c2ccccc2O)[C@H]2C(=O)N(C)C(=O)[C@H]21 4690237 FWXFFGWGMHQQTN-WZTLGTBRSA-N 346.383 1.137 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H](C(=O)NCc2ccc(N)cc2)C1 2080781006 ZZCOKJDYZLMEIB-UKRRQHHQSA-N 349.431 1.503 10 10 EDCE O=C1C[C@H]2CCN(Cc3cccc(Br)c3O)C[C@@H]2N1 2088806213 NEYMFKCZPMRKOF-SKDRFNHKSA-N 325.206 1.865 10 10 EDCE C[C@H](O)c1ccc(N2CCOC[C@H](CO)C2)c(Br)c1 2098242054 GYXXACHGURBJIG-QWRGUYRKSA-N 330.222 1.948 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2210534676 JIOKVEFSARXRHV-WDEREUQCSA-N 327.385 1.563 10 10 EDCE CN(C)C(=O)[C@H]1C=CCN1c1ccc(CN)c(Br)c1F 2280363738 CXZNWJCHDBYXJD-LLVKDONJSA-N 342.212 1.880 10 10 EDCE CSc1ncc(CNS(=O)(=O)[C@H]2CC[C@@H](C(=O)O)C2)s1 2284499438 OXGKFTGVYHBWHN-APPZFPTMSA-N 336.460 1.538 10 10 EDCE O=C1NC(=S)NC(=O)C1=CC=Cc1coc2ccccc2c1=O 2297463182 POIIEOXVQATVNY-UHFFFAOYSA-N 326.333 1.264 10 10 EDCE Cc1ccc(CN2CCS(=O)(=O)CCN2)c(O)c1Br 2352942913 MKXHWDYAKFXUQM-UHFFFAOYSA-N 349.250 1.198 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)c(Br)c1 2355334492 OWCRJFDWJUDZFB-KAOXEZKKSA-N 341.249 1.489 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)c(Br)c1 2357053459 WBKOJJOQHYHSTD-AMPPCDIJSA-N 342.233 1.965 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2357592855 OMMZMMCTXLEQQK-CNSIFVFBSA-N 341.249 1.789 10 10 EDCE N[C@@H]1CCC[C@H](C(=O)NCc2ccc(N3CCNCC3)c(F)c2)C1 237899541 COJBLAXISRVTII-LSDHHAIUSA-N 334.439 1.369 10 10 EDCE CCOc1ccc(O)c(CN2CCN(CCC(=O)N(C)C)CC2)c1 271179081 JAALJYJFSLMCAA-UHFFFAOYSA-N 335.448 1.387 10 10 EDCE Cn1cc(C(=O)NCc2cc(Br)ccc2O)ccc1=O 804739160 SUCMEPDRSZUWCW-UHFFFAOYSA-N 337.173 1.783 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(CN2C[C@H](C)O[C@H](C)C2)cc1 808504641 HQFKCPLILMIDQF-BETUJISGSA-N 333.384 1.611 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C[C@H]1CCN(S(C)(=O)=O)C1 801525747 MYMPLBOWCHYMHG-CYBMUJFWSA-N 339.461 1.233 10 10 EDCE COc1ccc(CNS(=O)(=O)CCC[C@H]2CCOC2)c(O)c1 827539400 CECJELUMSSTBLB-LBPRGKRZSA-N 329.418 1.637 10 10 EDCE O[C@@H]1CCN(C2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)C1 827700852 YESDBNPVUNTVDH-HXUWFJFHSA-N 345.487 1.554 10 10 EDCE Cc1cc(/C=C\C(=O)NC(C)(CO)CO)c(C)n1-c1ccccc1 588506386 RNDSZFSMUGYDGU-KTKRTIGZSA-N 328.412 1.967 10 10 EDCE CC1(C)COc2c(S(=O)(=O)N3Cc4cccc(O)c4C3)cnn2C1 918882269 LPQFYINSFOCFRQ-UHFFFAOYSA-N 349.412 1.712 10 10 EDCE Cc1cc(C(=O)N2CCO[C@@](C)(C(=O)O)C2)c(C)n1-c1ccccn1 910321892 AJQLAMZWJVRLBN-GOSISDBHSA-N 343.383 1.805 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3CCC3(OC)OC)CC2)cc1 924830466 APVZUTNMAPINRP-GOSISDBHSA-N 349.475 1.558 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3c[nH]c(C)cc3=O)C2)cc1 855231064 IYGJZOSINFWEEU-ZDUSSCGKSA-N 327.384 1.701 10 10 EDCE COC(=O)CCNC(=O)CCN[C@@H](C)c1cc2c(cc1O)CCCC2 858541581 LYLXPLFOZBAGBN-ZDUSSCGKSA-N 348.443 1.991 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3C[C@H](O)C3(C)C)C2)cc1 854298643 HOALFBZGUSHQFS-MAZHCROVSA-N 333.432 1.733 10 10 EDCE CN(C)c1ccc(/C=C/CN[C@H](Cc2ncccn2)C(=O)O)cc1 1119550780 YQUZTNDQTQMRIZ-LLCTXKFZSA-N 326.400 1.841 10 10 EDCE COC(=O)c1cc(OCc2nnc3n2CCOC3)ccc1N(C)C 871793284 JOAVIHWKWPXRCG-UHFFFAOYSA-N 332.360 1.240 10 10 EDCE COC(=O)[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1cccc(O)c1 779543740 YMUOJSZFRGXESU-DBWMJRBXSA-N 343.335 1.847 10 10 EDCE CN(C)c1ccc(CNC(=O)c2ccc(S(C)(=O)=O)cc2N)cc1 1135643340 SOYGFCBUDYEEDN-UHFFFAOYSA-N 347.440 1.668 10 10 EDCE COC(=O)[C@H](C[C@@H]1CCCO1)NCc1ccc(N2CCOCC2)cc1 895865585 SZUFYVQZTXWGFY-ROUUACIJSA-N 348.443 1.724 10 10 EDCE C[C@H]1CN(c2ccc(CNC(=O)[C@H]3C[C@H]3C(N)=O)cc2F)C[C@@H](C)O1 1136310945 BHSIMQZWPPSCMC-WVWOOGAGSA-N 349.406 1.177 10 10 EDCE CCOc1cccc(CNC[C@@H]2CCCCN2S(C)(=O)=O)c1O 796514283 XLTQFQAPAASQNP-AWEZNQCLSA-N 342.461 1.695 10 10 EDCE COc1ccc(N2CCC(NC(=O)C[C@@H]3CCC(=O)NC3)CC2)cc1 1136546465 JOSLFELSPNEGFQ-AWEZNQCLSA-N 345.443 1.697 10 10 EDCE CN1CCO[C@H](CN(C)Cc2cc(Br)ccc2O)C1 709417675 QEZYOBNJBBMWJC-ZDUSSCGKSA-N 329.238 1.917 10 10 EDCE Cc1oc(S(C)(=O)=O)cc1C(=O)NCc1ccc(O)cc1O 1142533449 KTWMNBLGNWRDBF-UHFFFAOYSA-N 325.342 1.333 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@H]2C3)c(Br)c1 2116693859 DSCYSXCWTJEJDB-WBMYTEFPSA-N 327.222 1.228 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CC(=O)N(c2cccc(F)c2)C1 1178912907 YUHUDWAVYKLWQL-LLVKDONJSA-N 344.342 1.906 10 10 EDCE C[C@@H](CS(C)(=O)=O)NC(=O)c1cc2cc(O)c(O)cc2s1 1443942855 JJHCIYXVVYVXGU-ZETCQYMHSA-N 329.399 1.475 10 10 EDCE Cn1cc(C[C@@H](CO)NC(=O)c2cc3cc(O)c(O)cc3s2)cn1 1299615575 XTTIKINFHZNBIS-NSHDSACASA-N 347.396 1.379 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(N2CCCCC2=O)CC1 1465800173 RTCUBPOCGCLZPV-UHFFFAOYSA-N 332.400 1.644 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N(CCO)Cc2cccnc2)cc1 1466187732 OTMDKXAYSVVUEV-UHFFFAOYSA-N 327.344 1.879 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)Cc2ccc(O)c(O)c2)CO1 1602848159 KSSOWXPKSNVESW-NSHDSACASA-N 338.360 1.307 10 10 EDCE COC(=O)CCN(Cc1ccncc1)C(=O)Cc1ccc(O)c(O)c1 1631519858 HBMBBKDHIGIOGS-UHFFFAOYSA-N 344.367 1.627 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2nccnc2N)cc1C 1493498737 CJAVZDJATHKHLS-UHFFFAOYSA-N 329.404 1.238 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CC(=O)N(Cc2ccco2)C1 1635843411 QRIQRVGZNRQVDS-LLVKDONJSA-N 330.340 1.356 10 10 EDCE NCC1(CO)CCN(Cc2cc(Br)ccc2O)CC1 2138149238 YEDKRNPMBVJRRG-UHFFFAOYSA-N 329.238 1.688 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)[C@@H]2CCN(C)C2)C2CC2)cc1C 1733189104 AWEKFAHDOOVNQP-MSOLQXFVSA-N 345.487 1.940 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)[C@H]2CSCN2)c2nccn2C)cc1 1866108911 SGGSUCVCKYHMNJ-CABCVRRESA-N 345.472 1.354 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@](C)(N)CO 1951698563 PMYZKQFJBLHUPB-BBRMVZONSA-N 326.393 1.243 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)C(F)(F)F 1980379060 ZYRAEOYIJWNMFS-LAEOZQHASA-N 338.326 1.708 10 10 EDCE C[C@@H](NC[C@@H](O)CNC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985771951 OQGUUNUGNQEPRU-ZYHUDNBSSA-N 326.393 1.634 10 10 EDCE C[C@@H](C(=O)NCCCN=[N+]=[N-])N1CC(NC(=O)OC(C)(C)C)C1 1987820450 HPINSRDLYGWUBP-JTQLQIEISA-N 326.401 1.400 10 10 EDCE C[C@@H](NC(=O)[C@H](CO)CNC(=O)OC(C)(C)C)c1ccccc1O 2017519242 QMJQRVJAZHCYIK-NEPJUHHUSA-N 338.404 1.703 10 10 EDCE CNCc1ccc(N2CCNC(=O)C[C@@H]2C)c(Br)c1 707627213 QUWLIEVXJMHARF-JTQLQIEISA-N 326.238 1.883 10 10 EDCE CC(C)N(C[C@H](C)O)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 691418552 UTUZXDRTMFDDBR-ISVAXAHUSA-N 342.237 1.997 10 10 EDCE CN1CC[C@H](N(C)c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 380692166 FLYCFVITKGDNSF-SDBXPKJASA-N 339.237 1.541 10 10 EDCE Nc1ccc(OCC(=O)NC2[C@H]3CN(Cc4ccccc4)C[C@H]23)cc1 398302374 RVWBRADUEAWEAQ-ROUUACIJSA-N 337.423 1.894 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H](C(C)C)C3(CO)CCC3)c2n1 2065100697 HEQLJJWCSPQZEV-CQSZACIVSA-N 332.404 1.660 10 10 EDCE NCc1cc(F)c(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)cc1Br 2189071471 LRGMMGLEAYIKRB-MSRIBSCDSA-N 345.212 1.490 10 10 EDCE OC[C@]1(NCc2ccc(Br)cc2O)C[C@@H](O)C12CCC2 2193970195 NHDRUSIZDOLBPL-UKRRQHHQSA-N 342.233 1.910 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)NCc1ccc(N)cc1 1910930272 VYTYPVQHTCYRLX-KBPBESRZSA-N 335.404 1.255 10 10 EDCE NCc1ccc(N2CC[C@]3(C[C@@H](O)CO3)C2)c(F)c1Br 2201772200 NXQUZTUFLLVJRF-YGRLFVJLSA-N 345.212 1.777 10 10 EDCE NCc1ccc(N2CCc3ncnc(O)c3C2)cc1Br 2206105755 CHLSEHLRLJDKLH-UHFFFAOYSA-N 335.205 1.966 10 10 EDCE Cc1ccccc1N1C(=O)C(=CNC[C@@H]2CCCO2)C(=O)NC1=S 2297317975 UHMOUURKNMAILV-LBPRGKRZSA-N 345.424 1.395 10 10 EDCE CCn1c(=O)c2c(nc(C=Cc3cn(C)nc3C)n2C)n(CC)c1=O 2297719152 REBPNIDGSCEANY-UHFFFAOYSA-N 342.403 1.149 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)c(Br)c1 2336342893 MLNBMXFAPSKOJP-ZDSQKVDBSA-N 346.246 1.736 10 10 EDCE CN(C)c1ccc(CN(C)S(=O)(=O)c2cccc(C(N)=O)c2)cc1 126143570 RZHOJANQFQOSRZ-UHFFFAOYSA-N 347.440 1.672 10 10 EDCE Nc1ccc(OC[C@H](O)CN2CCC=C(Br)C2)cc1 404349456 OGAINXZRDISURK-CYBMUJFWSA-N 327.222 1.993 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H]2CCCCC[C@H]2C(N)=O)cc1 120621983 LVWLYRCJIYCGTQ-HZPDHXFCSA-N 332.448 1.986 10 10 EDCE CN(CCc1ccncc1)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 130428914 QRTBQVDCZZFBLG-UHFFFAOYSA-N 328.328 2.000 10 10 EDCE NC(=O)c1ncccc1C(=O)NCc1c(O)ccc2c1CCCC2 279848324 LWHZYXUTEBPXEA-UHFFFAOYSA-N 325.368 1.695 10 10 EDCE COCCN(Cc1nnc2n1CCOC2)c1ccc(OC)c(OC)c1 281002577 GDSSCNRVEIKWPE-UHFFFAOYSA-N 348.403 1.479 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2(CCO)CCCC2)c1 285910714 FYJSVPAPGAQQNC-UHFFFAOYSA-N 342.417 1.189 10 10 EDCE COc1ccc(N2CCN(Cc3nnc4n3CCCC4)CC2)cc1 299577329 IBMDKSAVVYDNTG-UHFFFAOYSA-N 327.432 1.945 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H]1CCCS(=O)(=O)C1 292660975 CYOOTOHZXLXVGX-HNNXBMFYSA-N 338.473 1.926 10 10 EDCE CC(=O)C(=O)COC(=O)C[C@@](O)(c1nc(C)cs1)C(F)(F)F 808510428 SMFWOMBMZKNZNI-LLVKDONJSA-N 339.291 1.293 10 10 EDCE COC[C@H]1CCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 814363455 MBKNNDXPDCWPTD-CQSZACIVSA-N 337.395 1.593 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NCC3(CCO)CC3)C2)cc1 824687984 VKJQEMLANRPCNU-OAHLLOKOSA-N 347.459 1.983 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@H](OC)[C@@H]3CCOC3)CC2)cc1 825425903 OGVWMKHZHXZGSV-KDOFPFPSSA-N 348.443 1.832 10 10 EDCE CCCNC(=O)[C@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 588404526 BHPYAXLDNKNJHT-QPBFKRLHSA-N 332.400 1.876 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@]3(C)C[C@H](O)CN3C)CC2)cc1 900294901 NWTKYBPECQNWQT-QFBILLFUSA-N 347.459 1.189 10 10 EDCE COC(=O)c1cc2ccccc2c(CN2C[C@H]3C[C@H]2C(=O)O3)c1O 840111624 SGUJWOOEPBCHSG-ABAIWWIYSA-N 327.336 1.832 10 10 EDCE O=C(NCc1ncc2c(n1)CCOC2)NCc1cc(Cl)ccc1O 845353563 OQRQEIUCVCVFJG-UHFFFAOYSA-N 348.790 1.908 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1nnnc1N1C[C@@H]2C[C@H]2C1 1334522846 FENNOHMUNMOHBZ-GJZGRUSLSA-N 326.404 1.014 10 10 EDCE CCO[C@H](CNCc1ccc(N2CCC(O)CC2)cc1)CN(C)C 922755284 AEJBDAQEBRJNSZ-LJQANCHMSA-N 335.492 1.704 10 10 EDCE Cc1cc(CC(=O)OCc2nc(=O)n(C)[nH]2)c(C)n1-c1ccccc1 853933483 DXBHXQGXLJZDHB-UHFFFAOYSA-N 340.383 1.802 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc4n(n3)CCC4)C2)cc1 855227828 ZUGQDGVLNQINEM-CYBMUJFWSA-N 326.400 1.847 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)CCNC(C)=O)C2)cc1 852449378 RQJFZQBSTCBYLW-AWEZNQCLSA-N 334.420 1.051 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](O)C(F)(F)F)C2)cc1 854298373 BTQLHFBQVGLDRP-MFKMUULPSA-N 347.337 1.496 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3ccnn3C)C2)cc1 851948988 MZTIUDNKJOXBKU-CYBMUJFWSA-N 329.404 1.507 10 10 EDCE CCN1CN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 852451343 IMKVGKWYUHPPSN-ZDUSSCGKSA-N 332.404 1.105 10 10 EDCE COc1ccc(N2CCCN(C(=O)N[C@@]3(C)CCOC3=O)CC2)cc1 1352137955 DNNVREVDBLXTOZ-SFHVURJKSA-N 347.415 1.623 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)C[C@@H]2CO)cc1Br 698196420 GQIGVGPRRXGUBV-KGLIPLIRSA-N 343.265 1.879 10 10 EDCE CN(C)c1cc(F)c(CNC[C@@]23COCCN2C(=O)OC3)cc1F 864054481 SLIGWFXFMOJCGJ-INIZCTEOSA-N 341.358 1.342 10 10 EDCE NC(=O)C[C@@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 1118800837 DZNUSTTYTHHZIY-MRXNPFEDSA-N 346.431 1.073 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 773727652 VBSLEFUOQHPGSQ-KRWDZBQOSA-N 348.443 1.949 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3CC34CC4)cc2)CC1 894592115 HDXFRSSFQBXZPD-MRXNPFEDSA-N 327.428 1.805 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCC(c4ccon4)CC3)nc12 1328382139 ZQLAAAQJYGEJDM-UHFFFAOYSA-N 343.343 1.501 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)C[C@H](O)C2)c(Br)c1 2126909477 RCNWLOYXEMVBBB-DLOVCJGASA-N 329.238 1.661 10 10 EDCE CN(C)C[C@H]1C[C@H](O)CN1c1ccc(CN)cc1Br 212891701 PVUCAVUKHKXTQK-NEPJUHHUSA-N 328.254 1.409 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC=C[C@H]2CO)cc1F 1338502567 UOPWXXIKEIYXOZ-AWEZNQCLSA-N 349.406 1.047 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2c[nH]c(C)cc2=O)cc1C 1274974679 VGGHJFMDSAYRJE-CQSZACIVSA-N 343.427 1.908 10 10 EDCE CN(Cc1ccccc1O)c1nnc(C2CC2)n1C[C@H]1COCCO1 1503487609 MJFXDIIIXHRPEE-HNNXBMFYSA-N 344.415 1.913 10 10 EDCE CCN(C(=O)CNC(=O)Cc1ccc(O)c(O)c1)c1ccccc1 1471891952 RGNMJWJUCYHSIS-UHFFFAOYSA-N 328.368 1.810 10 10 EDCE CCC[C@@]1(C)C(=O)NCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1625425081 NNQZIKNCKSUBQK-INIZCTEOSA-N 331.376 1.980 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H]2CCN(C(=O)CNC(C)=O)C2)cc1C 1484326502 KVSZPAMXLFLIMB-RHSMWYFYSA-N 347.459 1.466 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cnn(C)c2OC)cc1C 1497971226 NVAQPZMDBXPRRT-CYBMUJFWSA-N 346.431 1.654 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cnc(C)n2C)cc1C 1498098673 LBCDLZJZYVQMEJ-ZDUSSCGKSA-N 330.432 1.954 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@H]2CCNC(=O)C2)cc1C 1497565264 PWPOMIGNNFNINC-CWDCEQMOSA-N 345.443 1.292 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CC[C@H](NCCCO)CC2)cc1 1568115076 WEIBKAPAEAJLPG-HDJSIYSDSA-N 347.419 1.862 10 10 EDCE O=C(CCc1nc(-c2ccco2)no1)NCc1ccc(O)cc1O 1570462460 UTUAOHNHLAKYGY-UHFFFAOYSA-N 329.312 1.990 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2cn(C)c(O)n2)cc1C 1676418140 NGAVZRMRQIZXBD-CYBMUJFWSA-N 346.431 1.693 10 10 EDCE CCCNC(=O)c1cccc(NC=C2C(=O)OC(C)(C)OC2=O)c1 13619994 DYPLANZSIAIQRC-UHFFFAOYSA-N 332.356 1.958 10 10 EDCE O=C(NCCNC(=O)c1cc(O)c(O)c(O)c1)c1ccc(F)cc1 169833809 AXXRRJNVTICNCR-UHFFFAOYSA-N 334.303 1.102 10 10 EDCE CS(=O)(=O)c1nc(C(=O)Nc2ccc(N)cc2)c2ccccn12 160401276 RZXVJELSAYKWOI-UHFFFAOYSA-N 330.369 1.572 10 10 EDCE C[C@H](CO)[C@@H](C)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 153806816 MYKRVZSVWJANTB-CHWSQXEVSA-N 339.411 1.478 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H](NCc2ccc(O)c(O)c2)C1 1946802385 OLJVZUYUZZLZDO-ZDUSSCGKSA-N 338.404 1.823 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C[C@@H](O)C(=O)O 1951546580 UVTILTCOGOWCNB-GXFFZTMASA-N 341.360 1.369 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H]1NS(=O)(=O)Cc1ccc(N)cc1 1977696669 NPKKYZGEFTVPPG-QWHCGFSZSA-N 341.433 1.354 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@]1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CCOC1 2010395167 HHSTWRMNVWUYCO-XHDPSFHLSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC[C@@H]1CN=[N+]=[N-])C(C)(C)O 2014478745 HXPYTMSPPQGFBV-GHMZBOCLSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2[C@@H](CN)CO 2018750582 CXIFEYBPYAOTSL-HNNXBMFYSA-N 335.448 1.784 10 10 EDCE O=S(=O)(C[C@@H]1CC2(CCCC2)CO1)NCc1ccc(O)cc1O 2064529609 RNSUDGSWTDXCBE-AWEZNQCLSA-N 341.429 1.867 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C(CNC(=O)c3ccc(O)c(O)c3)[C@H]2C1 2054397949 OQJOSVWMJUXPIR-CHWSQXEVSA-N 348.399 1.941 10 10 EDCE Nc1ccc(CC(=O)NC[C@H]2COCCN2Cc2ccccc2)cc1 2074178429 GKNCGHBDNDGDIO-IBGZPJMESA-N 339.439 1.829 10 10 EDCE CCNCc1ccc(N2C[C@H]3C(C(N)=O)[C@@H]3C2)cc1Br 2201298708 JJAKARKRIGNJKB-VXGBXAGGSA-N 338.249 1.726 10 10 EDCE CN1CCO[C@H]2CN(c3ccc(CO)c(Br)c3)C[C@@H]21 2097692156 GCOKLWBKERVYSZ-KBPBESRZSA-N 327.222 1.461 10 10 EDCE CC(C)(C)OC(=O)N[C@H](COc1nnc(=N)[nH]n1)[C@@H]1CC=CCC1 2213789461 IRNBUYKTXHJCMF-GHMZBOCLSA-N 336.396 1.308 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](COc2nnc(=N)[nH]n2)C12CCC2 2213782178 BEDLKROBDUONBO-SNVBAGLBSA-N 336.396 1.238 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(COc1nnc(=N)[nH]n1)c1ccccc1 2219017954 AIPQVUCHEMUHMI-MRXNPFEDSA-N 346.391 1.498 10 10 EDCE NCc1ccc(N2C[C@@H]3OCCC[C@]3(CO)C2)c(Br)c1 2239149557 LWZAHSCWHJOFPG-LSDHHAIUSA-N 341.249 1.886 10 10 EDCE C[P@@]1(=O)C[C@@H](O)[C@H](NCc2ccc(Br)cc2O)C1 2296640340 FSAZETFEEOTBFP-QAMHXRKUSA-N 334.150 1.980 10 10 EDCE CNCc1ccc(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)cc1Br 2336474339 WLVRSOLZMSSVOJ-GXFFZTMASA-N 345.262 1.402 10 10 EDCE Cc1ccc(CNS(=O)(=O)[C@@H]2CCNC2)c(O)c1Br 2352645502 KLYBCSWRRXQERC-SNVBAGLBSA-N 349.250 1.244 10 10 EDCE Cc1ccc(CNCCCc2nn[nH]n2)c(O)c1Br 2352681192 UOANBJDYSAUCKE-UHFFFAOYSA-N 326.198 1.699 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)c(Br)c1 2355335591 DFDFXLNKVFYRGG-BHGZDDGQSA-N 341.249 1.789 10 10 EDCE COc1ccc(N2CCN(C(=O)NC[C@@H]3CCCOC3)CC2)cc1 57162778 QTJJEINZJXWUOW-HNNXBMFYSA-N 333.432 1.953 10 10 EDCE CCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 76140483 NETOZZUWFZHLAO-CQSZACIVSA-N 339.436 1.819 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NCCc2nccs2)cc1 70490875 KWKKSNLBJPWBNH-UHFFFAOYSA-N 327.431 1.266 10 10 EDCE CCOC(=O)CN(C)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255711389 MWLXYGHZDHQAOF-TWGQIWQCSA-N 332.400 1.558 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NC[C@]1(O)CCSC1 255620180 ZHHHASUQRNCQAY-VDNIUXDYSA-N 348.468 1.521 10 10 EDCE O=S1(=O)C[C@H](CNCc2cc3c(cc2O)OCO3)c2ccccc21 824517468 WAOISNLWOACLLD-LBPRGKRZSA-N 347.392 1.782 10 10 EDCE CC1(CCNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)OCCO1 588454375 RSEPFUFHBXLINP-DAXSKMNVSA-N 346.427 1.806 10 10 EDCE C[C@@H](CC(=O)NCc1ccc(N2CCSCC2)cc1)NC(N)=O 847355728 FPMYELRYRMYGGL-LBPRGKRZSA-N 336.461 1.303 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)N[C@@](C)(C4CC4)C3=O)C2)cc1 849357161 KRHWCESDCNNLER-KSSFIOAISA-N 329.400 1.994 10 10 EDCE CN(C)CCOc1ccc(N(C)C[C@@H]2CCCN(C(=O)CN)C2)cc1 841011291 HJHCUGAKPPPXKL-INIZCTEOSA-N 348.491 1.261 10 10 EDCE CCc1cccc(CNCCCN2CCC[C@@H]2C(=O)N(C)C)c1O 848894070 GCCGZFUDLLHCRU-QGZVFWFLSA-N 333.476 1.987 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)[C@H]3CCO[C@H]3C)C2)cc1 849416335 PCYUKCQBRHLXQJ-XEZPLFJOSA-N 340.445 1.371 10 10 EDCE CC(C)(C(=O)O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 843328704 SCXDGDCQYFPLJO-UHFFFAOYSA-N 334.416 1.622 10 10 EDCE CO[C@@H](C)CC(=O)Nc1ccc(O)c(CNC(=O)C[C@@H](C)OC)c1 923123811 PWEVMXBSIGXCER-NEPJUHHUSA-N 338.404 1.797 10 10 EDCE CC[C@@H](NCC[C@H]1CNCCS1(=O)=O)c1cccc(Cl)c1O 925788323 HNOVUACXWIQDEO-SMDDNHRTSA-N 346.880 1.863 10 10 EDCE OCCO[C@@]1(CNCc2cccc(Br)c2O)CCOC1 850358217 KSAWITBWIIRZBS-CQSZACIVSA-N 346.221 1.412 10 10 EDCE CCN(CC)c1ccc(CNC(=O)c2cnc(O)n(C)c2=O)cc1 751563892 DBOCGWAODGOMII-UHFFFAOYSA-N 330.388 1.262 10 10 EDCE Cc1ncsc1CCS(=O)(=O)NCc1c(O)cccc1F 921452253 JBFZQSKHXMNJGU-UHFFFAOYSA-N 330.406 1.958 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CC[C@@]3(C)CCC(=O)N3)C2)cc1 855234114 SKOSGABZTJVBJP-KUHUBIRLSA-N 345.443 1.839 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3nnc(C)o3)C2)cc1 853487022 HIUPFYWDULYTTK-LBPRGKRZSA-N 331.376 1.465 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)C(=O)NC(C)C)C2)cc1 854296628 FJYHMPYVEQYGIA-UONOGXRCSA-N 348.447 1.486 10 10 EDCE Oc1ccccc1CN(C[C@@H]1CCC2(CNC2)O1)C[C@H]1CCCO1 852742535 JPSLKCRYZWWRJZ-SJORKVTESA-N 332.444 1.894 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cnn2c1CCCC2 867303111 ZBRDMNVJSWARJT-LBPRGKRZSA-N 329.400 1.921 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCNC12CCC2 861792941 VFTAOMBPJLRVGL-INIZCTEOSA-N 345.443 1.532 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@@H]3C=CCC3)C2)cc1 1119569930 CWWNDWSDPUSPGP-HUUCEWRRSA-N 343.427 1.473 10 10 EDCE Cc1cc([N+](=O)[O-])cn(Cc2ccc(N3CCOCC3)cc2)c1=O 877879498 GBJOUOJSCFSDII-UHFFFAOYSA-N 329.356 1.950 10 10 EDCE CC1=C(C(=O)N2Cc3cccc(O)c3C2)[C@@H](C)n2ncnc2N1C 871204588 MCCFIMBYRFGSRJ-LLVKDONJSA-N 325.372 1.811 10 10 EDCE N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 872282059 ZZVCAJDBDANAJS-SQGPQFPESA-N 343.471 1.639 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](O)Cc1cnn(C)c1 786838212 NVVYSAPJBOIKMO-KRWDZBQOSA-N 330.432 1.438 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N1CC[C@@H](NC(N)=O)C1 690733514 RLFZUDLFJZTCHN-PSASIEDQSA-N 328.210 1.958 10 10 EDCE Cc1c[nH]nc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1155603530 DMQCGAFMGFWKMH-UHFFFAOYSA-N 341.415 1.350 10 10 EDCE Cc1ccn2c(=O)c(C(=O)NCc3c(O)cccc3F)cnc2c1 1303877731 FIPTUIAVTQVONW-UHFFFAOYSA-N 327.315 1.778 10 10 EDCE O=C(CNS(=O)(=O)c1cccs1)N1Cc2cccc(O)c2C1 1175030303 QGTJWIGXZQDBHC-UHFFFAOYSA-N 338.410 1.274 10 10 EDCE CCCN(CCCN(C)C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329478746 PJICDHFHTHQRLA-UHFFFAOYSA-N 333.432 1.425 10 10 EDCE CO[C@@H]1CC[C@@H]1N(C)C(=O)C(=O)NCCCSc1nccs1 1335598489 NNOOVNRORMGDDN-WDEREUQCSA-N 343.474 1.377 10 10 EDCE COC(=O)[C@]1(N2CCN(Cc3ccc(N(C)C)cc3)CC2)CCOC1 1261801863 WXRPWEONLKEWDO-IBGZPJMESA-N 347.459 1.202 10 10 EDCE COC(=O)[C@@H]1CC[C@H](C(=O)N(C)Cc2ccc(N3CCCC3)cc2)O1 1525114094 VCDFONUWYKHLAH-SJORKVTESA-N 346.427 1.966 10 10 EDCE COc1cccc(C2=NO[C@@H](C(=O)NCc3cc(O)ccc3O)C2)c1 1455351260 FCHQXEBKXOXRNW-QGZVFWFLSA-N 342.351 1.916 10 10 EDCE Cn1c(O)nnc1CNC(=O)NCc1c(O)ccc2c1CCCC2 1471150100 HXYVBXBNCFLWAG-UHFFFAOYSA-N 331.376 1.105 10 10 EDCE COC(=O)C[C@](C)(NC(=O)c1cccc(O)c1O)c1ccccn1 1617289892 BXWYVIBSKMRNIP-KRWDZBQOSA-N 330.340 1.701 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1cccc(-n2cncn2)n1 1628680512 LFECWOLQTBMCHD-UHFFFAOYSA-N 329.747 1.951 10 10 EDCE C[C@@H](O)CNC[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1566913847 VPVSDDBTGOUQRX-CHWSQXEVSA-N 347.419 1.672 10 10 EDCE C[C@H](O)CN1CC[C@@H](CCNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1732060072 AUOBLBBCBCLOIL-QWHCGFSZSA-N 347.419 1.672 10 10 EDCE Nc1ccc(OCC(=O)Nc2ccc(C(=O)NCC(=O)O)cc2)cc1 1860077928 FAWGRHAFZQLKQK-UHFFFAOYSA-N 343.339 1.101 10 10 EDCE CCOCCOCCOC(=O)CCNCc1ccc(N(C)C)cc1 1857869170 RZUIFASDPJZIAN-UHFFFAOYSA-N 338.448 1.829 10 10 EDCE CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1895032208 WROIILWEFJMGNY-IJLUTSLNSA-N 344.477 1.898 10 10 EDCE C[C@H](NCCn1cc(Br)nn1)c1cc(O)ccc1O 1878206869 HPYJBXWIYZCXOE-QMMMGPOBSA-N 327.182 1.803 10 10 EDCE O=C(NC[C@H](C(=O)O)c1cc(O)c(O)c(O)c1)OCc1ccccc1 1951525709 WJUMTFZTBIHDJC-LBPRGKRZSA-N 347.323 1.898 10 10 EDCE C[C@H]1OCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985103519 WNSVNQYHRFIRSO-KOLCDFICSA-N 325.369 1.532 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CC(C(=O)NCCCN=[N+]=[N-])=C[C@@H]1O 1987692021 ICBXLYLRCUEDGQ-QWRGUYRKSA-N 325.369 1.387 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010403365 CRHCRXLUUVAPBA-NXEZZACHSA-N 340.384 1.056 10 10 EDCE Oc1cc(Br)ccc1CN1CCN(C2CNC2)CC1 701038710 QDKIOMLEFJREES-UHFFFAOYSA-N 326.238 1.244 10 10 EDCE O=C(O)[C@@H]1CO[C@@H]2CN(Cc3c(O)cccc3Br)C[C@@H]21 2160867464 KMYOZWOLVPSYND-ZDSQKVDBSA-N 342.189 1.686 10 10 EDCE CN(C)C[C@H]1CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2160881885 ITMBMKHWMKTGNE-OQPBUACISA-N 339.237 1.541 10 10 EDCE O=C1Nc2cc(N3CC=CC[C@@H]3CO)c(Br)cc2[C@H]1O 2176377904 MUXSZXVCXFGNGZ-AMIZOPFISA-N 339.189 1.562 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC(n4ccnc4)CC3)c2n1 2063493838 MVBZKDRNEQAXCD-UHFFFAOYSA-N 326.360 1.417 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC([C@H](F)CO)C3)c(Br)cc21 2166899669 MNJAWNLUWJUAKA-SKDRFNHKSA-N 344.184 1.168 10 10 EDCE COC(=O)c1cn(Cc2cccc(Br)c2O)nc1O 2070607169 ANHXBSXCKDEJMQ-UHFFFAOYSA-N 327.134 1.892 10 10 EDCE COc1ccc([C@H](C)n2nc(C(F)(F)F)c(C(N)=O)c2N)c(O)c1 2079848160 DMPFGZVOVULZIS-LURJTMIESA-N 344.293 1.907 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCN1c1cc2c(cc1N)OCC(=O)N2 2044765594 AUKGHIHCXKAINB-SNVBAGLBSA-N 348.403 1.703 10 10 EDCE O=C1C[C@@H]2CCN(Cc3c(O)cccc3Br)C[C@H]2N1 2088806652 RWEGELXWMQQNDB-JOYOIKCWSA-N 325.206 1.865 10 10 EDCE C[C@@H](NCc1c(Br)nnn1C)c1c(O)cccc1O 2089352468 MSQXEGQDWFUXLV-SSDOTTSWSA-N 327.182 1.840 10 10 EDCE O=C1OC[C@H]2CN(c3ccc(CO)c(Br)c3)CCN12 2114275507 WSGLOWAJNIOZSL-LLVKDONJSA-N 327.178 1.582 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(NC(=O)c2cccc(O)c2O)C1 2216767650 KVLXQFLRULWPFF-QGHHPUGFSA-N 334.372 1.837 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3OCCO[C@H]3C2)c1O 2236088238 DYASCCJHLMAOGU-STQMWFEESA-N 344.205 1.763 10 10 EDCE CCCN=c1nc(Cl)[nH]c(=NCc2cnc(SC)s2)[nH]1 2284718600 DUFVWLHTSUYPQY-UHFFFAOYSA-N 330.870 1.981 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@H](NC(N)=O)C(C)C)CC2)cc1 102484499 KZCKCKCNOKZKPA-INIZCTEOSA-N 348.447 1.473 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)S(=O)(=O)c1cccs1 35366586 CBHMSMWAWHJAIW-UHFFFAOYSA-N 325.415 1.007 10 10 EDCE CCS(=O)(=O)N(C)Nc1nc(C(F)(F)F)c(C(=O)O)s1 2365282834 HNESPBAQCQMBIW-UHFFFAOYSA-N 333.313 1.469 10 10 EDCE Cc1ccc(CNc2c(N)nc(O)nc2O)c(O)c1Br 2380726402 PQRHAZQGQAOGAG-UHFFFAOYSA-N 341.165 1.859 10 10 EDCE COC[C@H]1[C@@H](O)[C@@H](O)CN1Cc1ccc(C)c(Br)c1O 2380802400 DHYGOUCGEBTGJH-COPLHBTASA-N 346.221 1.016 10 10 EDCE C[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)CCN1S(C)(=O)=O 827271159 KVFWESOIAQHLDP-SECBINFHSA-N 336.816 1.650 10 10 EDCE CCN(C)c1ccc(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1 830014501 ZCQUOIVIRWIQKE-KRWDZBQOSA-N 338.473 1.532 10 10 EDCE CC(C)[C@H](NCC(F)(F)F)C(=O)NCCc1ccc(O)c(O)c1 830532399 WMPKUIVQLXULGL-ZDUSSCGKSA-N 334.338 1.933 10 10 EDCE COC(=O)[C@@H]1C[C@@H](O)CN1Cc1cc(OC)cc(C(C)(C)C)c1O 1328200285 HQUIKUWMVRXEFP-DOMZBBRYSA-N 337.416 1.807 10 10 EDCE Nc1ccc(CC(=O)N[C@@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1 832012919 CPFYBSOMMQAIIQ-QGZVFWFLSA-N 341.386 1.868 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)NC[C@H]1C[C@@H]2COC[C@@H]2O1 919918528 NYJQSYYBJCCKAO-NXHRZFHOSA-N 343.427 1.666 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)CCOC(C)C)C2)cc1 849415989 JIMOHQAYPSKQBE-CQSZACIVSA-N 342.461 1.618 10 10 EDCE C[C@H](NC(=O)N1C[C@@H](C)N(CCO)C[C@H]1C)c1ccc(N(C)C)cc1 842181866 CIRKVGMUGMIJRP-OAGGEKHMSA-N 348.491 1.910 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCNC[C@@](C)(F)C2)cc1F 841762273 VMNSSJNMKVPSLW-MRXNPFEDSA-N 326.391 1.735 10 10 EDCE CCCN(CCC)S(=O)(=O)NNc1nc2cccnc2s1 857225009 DDDVNNMRKFPERX-UHFFFAOYSA-N 329.451 1.975 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CC[C@]3(C)CCC(=O)N3)C2)cc1 855234113 SKOSGABZTJVBJP-IFXJQAMLSA-N 345.443 1.839 10 10 EDCE COCCN(CCF)CC(=O)N(C)Cc1ccc(N(C)C)cc1 852483596 LPVCAKSFXTVFKA-UHFFFAOYSA-N 325.428 1.629 10 10 EDCE CCOCCOCC(=O)NCc1ccc(N2CCC(O)CC2)cc1 856210713 NWQATQYNGAHUPP-UHFFFAOYSA-N 336.432 1.317 10 10 EDCE Cc1cc(CC(=O)OCc2nnn(C)n2)c(C)n1-c1ccccc1 853934560 SUAVNRTUGFIYPH-UHFFFAOYSA-N 325.372 1.904 10 10 EDCE CCN(CC)C(=O)CN1CCN(Cc2cc(C)cc(OC)c2O)CC1 754724276 SVZXMSKILFRMDV-UHFFFAOYSA-N 349.475 1.695 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CCCN3C)C2)cc1 852187135 LFAUZIFXYKOCLA-GOEBONIOSA-N 332.448 1.667 10 10 EDCE C[C@H](NC(=O)C(=O)NCC1(C(=O)O)CCC1)c1ccc(N(C)C)cc1 851680322 GJXXARTUJRAROG-LBPRGKRZSA-N 347.415 1.301 10 10 EDCE COc1ccc(N2CC[C@H](Nc3nnc(Cl)cc3C(N)=O)C2)cc1 853758930 NJRYSKGFWJEPCQ-JTQLQIEISA-N 347.806 1.928 10 10 EDCE CCN(C)c1ccc([C@@H](C)NC[C@@]23COCCN2C(=O)COC3)cc1 866556016 PONBWEDVXJEUMP-BEFAXECRSA-N 347.459 1.421 10 10 EDCE CC(C)O[C@@]1(CS(=O)(=O)N2Cc3cccc(O)c3C2)CCOC1 867691058 QLYPMTXZAFGFAL-INIZCTEOSA-N 341.429 1.622 10 10 EDCE COC(=O)c1cc(S(=O)(=O)N2Cc3cccc(O)c3C2)cnc1C 867691409 VTRAQMGIRCQPKH-UHFFFAOYSA-N 348.380 1.587 10 10 EDCE COc1ccc(N(C)CCN(C)c2nnnn2CC(F)(F)F)cc1 1355421665 DSCZSASYAUGHPK-UHFFFAOYSA-N 344.341 1.817 10 10 EDCE COc1cccc(CNC(=O)[C@@H](OC)C(=O)OC(C)(C)C)c1O 866762783 CBLKABXGBQWSPW-CYBMUJFWSA-N 325.361 1.374 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CCC(=O)O1 867223615 OTVDFNMFLHGOLY-GFCCVEGCSA-N 341.747 1.253 10 10 EDCE O=C1OCc2ccc(S(=O)(=O)Nc3ccc(O)cc3C(=O)O)cc21 776434813 NNZVQQDLDXBWTK-UHFFFAOYSA-N 349.320 1.562 10 10 EDCE Cc1cc(Br)c(O)c(CNCCN2CCOCC2)c1 781623640 FHPJSKLCGCLMDP-UHFFFAOYSA-N 329.238 1.885 10 10 EDCE CCN(C)C(=O)CNCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894490812 HFKBQWQYYYPMEP-UHFFFAOYSA-N 335.379 1.672 10 10 EDCE CN(C)c1ccc(CNC[C@H]2CCCCN2S(C)(=O)=O)cc1F 796514004 SPMOEBOJLJCLID-CQSZACIVSA-N 343.468 1.795 10 10 EDCE COC(=O)c1ccn(CCCC(=O)NCc2c(O)cccc2O)n1 1156885840 PJDVLWJNNXSPLQ-UHFFFAOYSA-N 333.344 1.178 10 10 EDCE COC(=O)[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)c2ccccc21 1156693989 OXDFEHDFRIHYLM-ZDUSSCGKSA-N 327.336 1.944 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@@H](O)C2(C)C)c(Br)c1 2124796465 PFTLCGFQHOSKFM-CHWSQXEVSA-N 329.238 1.489 10 10 EDCE C[C@@H](NCc1nnc(Br)n1C)c1ccc(O)cc1O 2121512421 BTUBBRTWOABULL-SSDOTTSWSA-N 327.182 1.840 10 10 EDCE CC(C)O[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332052883 GQDAIRRMLCOQKA-CQSZACIVSA-N 332.400 1.650 10 10 EDCE COC(=O)c1c(CNCC(=O)NCC(C)C)c2cc(F)ccc2n1C 1333706378 ZYYHKBLNCNCWLG-UHFFFAOYSA-N 349.406 1.966 10 10 EDCE CCn1cccc1C(=O)NC[C@H](CO)NCc1ccc(OC)c(C)c1 1331835148 LEOYLTRNYOHHBW-MRXNPFEDSA-N 345.443 1.706 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CC[C@]12CCOC2 1261390485 KFYGWAAFTSIDBS-LJQANCHMSA-N 343.427 1.294 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnc4[nH]ncc4c3)C2)cc1 1347821857 NPKUCVFOCGPCBQ-AWEZNQCLSA-N 337.383 1.975 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CC[C@@H](C(N)=O)C3)CC2)cc1 1435577910 NIBZWVDRFCDXDQ-KGLIPLIRSA-N 331.416 1.245 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2C[C@H]3CCCCN3C2=O)cc1 1450890930 LNDPGRXBLNMDRY-CHWSQXEVSA-N 329.360 1.732 10 10 EDCE C[C@@H](NCC1(O)CN(C(=O)OC(C)(C)C)C1)c1ccc(O)cc1O 1918696703 JTTBFFJBIJVQFD-LLVKDONJSA-N 338.404 1.730 10 10 EDCE Cc1nnnn1-c1ccc(C(=O)NCc2ccc(N(C)C)cc2)cc1 1531321391 PXWZFSYETPKCBW-UHFFFAOYSA-N 336.399 1.967 10 10 EDCE NCc1ccc(N2CC[C@H](N3CCOCC3)C2)cc1Br 228152395 RSNRMIBIMAXSIN-AWEZNQCLSA-N 340.265 1.819 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cn2cncn2)cc1C 1715901290 GPGUDLDTAYHDCL-ARJAWSKDSA-N 329.404 1.057 10 10 EDCE O=C(CN1C(=O)c2ccccc2C1=O)NCc1ccc(O)cc1O 1626838183 PWAFFZDPMJNPEJ-UHFFFAOYSA-N 326.308 1.010 10 10 EDCE O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCc1cc(O)ccc1O 1633595099 IGWMJWKLPBSDEB-KBPBESRZSA-N 346.383 1.279 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc(-c3nc(=O)o[nH]3)cc2)c1 1638941120 ZZXFJZNOZVKWMJ-UHFFFAOYSA-N 325.324 1.974 10 10 EDCE COCC[C@](C)(O)Cn1c(C)nnc1N(C)Cc1ccccc1O 1730626016 OXUPHBMTXQLEQA-KRWDZBQOSA-N 334.420 1.716 10 10 EDCE COc1ncc(/C=C\C(=O)N2CC(=O)Nc3cc(F)c(F)cc32)cn1 1584781600 BUHCLWIKGJQWAV-IHWYPQMZSA-N 346.293 1.762 10 10 EDCE CC[C@@H](NCC(=O)NCc1ccc(N(C)C)cc1)c1noc(C)n1 1653240554 PKCHHSPHIXGNCI-OAHLLOKOSA-N 331.420 1.801 10 10 EDCE O=C(C[C@H]1C(=O)Nc2ccc(F)cc21)NCc1c(O)cccc1O 1652628880 NNDYGDHRXLWSCE-LLVKDONJSA-N 330.315 1.979 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)Cc2cnn(C)c2)cc1C 1666519475 GYAQYVJSJSBBCO-CQSZACIVSA-N 344.459 1.822 10 10 EDCE Cc1cc(O)nc(N2CCC[C@H](NC(=O)c3cccc(O)c3O)C2)n1 1595959465 DHCIBJSBXSLPJQ-NSHDSACASA-N 344.371 1.301 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)/C(=C/C=C/c2ccccc2)SC1=S 5374261 JXAPEWNYYREQDN-JUTLINNMSA-N 335.406 1.890 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](CO)C[C@H]2CO)c(Br)c1 2146079300 ISCWTMGCELZKKZ-MDZLAQPJSA-N 343.265 1.909 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)N1CCC(CN=[N+]=[N-])CC1 2014508130 AIRJKAUITWUGAK-GFCCVEGCSA-N 341.412 1.669 10 10 EDCE C[C@@H](CO)CN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 688404686 NOHZFHYAWGQLPF-JMCQJSRRSA-N 328.210 1.466 10 10 EDCE CCNCc1ccc(N2CC(=O)N[C@@H](C)C2)c(Br)c1 386864333 CMVVOLUPXZCGFT-JTQLQIEISA-N 326.238 1.883 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](NCc2cc3c(cc2O)OCO3)CO1 722491275 VHGPPUWMZXQHHO-LLVKDONJSA-N 338.360 1.761 10 10 EDCE C[C@@H]1CC[C@@H](O)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 399321260 IQZHOPKURUXTJC-RBDZCENOSA-N 340.221 1.751 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1conc1Br 2230677125 ALYITAULNFPMEU-UHFFFAOYSA-N 327.134 1.707 10 10 EDCE NCc1ccc(N2CC3(CCC(=O)N3)C2)c(F)c1Br 2229690185 NIUMRVYPQKBEMO-UHFFFAOYSA-N 328.185 1.516 10 10 EDCE CNCc1ccc(N2CC[C@H](O)[C@H](O)CC2)cc1Br 2269125255 SIOLSKQPVNWPBH-OKILXGFUSA-N 329.238 1.491 10 10 EDCE CCOCCCNC=C1C(=O)NC(=O)N(c2ccc(F)cc2)C1=O 2296945947 YPAFAOWXVCJVPF-UHFFFAOYSA-N 335.335 1.309 10 10 EDCE CCOc1ccc(NC=C2C(=O)NC(=S)N(C3CC3)C2=O)cc1 2296947711 YAIZUTXBYCUQPJ-UHFFFAOYSA-N 331.397 1.787 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2329329379 UEWXVWRUKHUVPS-ZDEDFTPMSA-N 328.206 1.433 10 10 EDCE Cc1ccc(CN(C)[C@H]2CNCCOC2)c(O)c1Br 2352644319 ZBVLUODCDPNVBC-LBPRGKRZSA-N 329.238 1.883 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@@H](O)[C@H]3C4)c(Br)cc21 2355620114 LRDICHARJIJKQR-AAGLOMFBSA-N 338.205 1.361 10 10 EDCE O=C(CN1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 51087015 IFDCLKOSMIIVTM-UHFFFAOYSA-N 335.423 1.764 10 10 EDCE CC(=O)[C@H](O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951994174 UJWUGKBYZRAQNX-RISCZKNCSA-N 325.361 1.484 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(N)cc1 170318321 ODSWGAFXSBOHAB-UHFFFAOYSA-N 342.311 1.695 10 10 EDCE CCN1CCN(CCCNC(=O)/C=C/c2ccc(N(C)C)cc2)CC1 41530317 SVUQPQCBTMOREY-DHZHZOJOSA-N 344.503 1.910 10 10 EDCE CC1=CC([S@](=N)(=O)O)=S=C1C(=O)Nc1ccnc2ccnn12 346289038 DSHFRWSNJGRBIE-UHFFFAOYSA-N 337.386 1.183 10 10 EDCE C[C@@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)c1nc[nH]n1 255773371 MUQIMPPXLULZPO-LLPBQKLSSA-N 327.388 1.532 10 10 EDCE COc1ccc(N(CC(=O)N[C@H](C)C(=O)N(C)C)[C@H](C)C2CC2)cc1 252443248 PPDUCUYCHOUHMV-ZIAGYGMSSA-N 347.459 1.893 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C1C[C@H]2CNC[C@@H](C1)C2=O 368364588 ZQUDJQPFVMVBEX-ALOPSCKCSA-N 341.455 1.718 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCCSCC1 288628392 SHOAKIALKGBCMP-UHFFFAOYSA-N 345.468 1.645 10 10 EDCE Cc1cc(N2CCC[C@@H](NC(=O)c3c(F)ccc(O)c3O)C2)n(C)n1 295498572 HFKMQDGFIDBXSS-LLVKDONJSA-N 348.378 1.678 10 10 EDCE Cc1ccc(CN2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(O)c1Br 2380804211 LBNQUONOGCUAFL-GQANPOSXSA-N 342.233 1.779 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2[C@@H]3OCCN[C@@H]32)c(O)c1Br 2381141986 HINFTHKJORRWGZ-XWIASGKRSA-N 341.205 1.066 10 10 EDCE CCO[C@@H]1C[C@H]1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 299307441 DTWIVFJUDXSHBW-QZTJIDSGSA-N 347.459 1.358 10 10 EDCE COC(=O)C[C@@H]1CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CCO1 392052777 KHDLQDILFKWISQ-SNVBAGLBSA-N 340.332 1.380 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CNC[C@H]2CS(=O)(=O)c3ccccc32)c1 824514768 CFAHCLJLVWVHMC-LBPRGKRZSA-N 348.380 1.961 10 10 EDCE CC[C@H](O)CC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 822823234 DHVBJGBAMXHXSL-INIZCTEOSA-N 335.448 1.094 10 10 EDCE CCOC(=O)c1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)on1 822862090 GJCAFKAITQRLOG-UHFFFAOYSA-N 335.335 1.986 10 10 EDCE COC1CCN(c2ccc(CN3CCO[C@H]([C@H](C)O)C3)cc2)CC1 839670536 HFEDAHMHIQIIGJ-KXBFYZLASA-N 334.460 1.883 10 10 EDCE C[C@H]1CN(Cc2ccc(N3CCOCC3)cc2)[C@@H](C)CN1CCO 841892264 WAFZTDDVVJJSLS-IRXDYDNUSA-N 333.476 1.410 10 10 EDCE CN1CC[C@H](C(=O)N(C)Cc2ccccc2O)[C@H](c2cnn(C)c2)C1 849561195 HRAHDYUGYRPBRH-IRXDYDNUSA-N 342.443 1.820 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 854296510 JFDCLPKARXNGLG-CWRNSKLLSA-N 349.431 1.065 10 10 EDCE COc1cc(Br)cc(CN[C@H]2C[C@H](C(N)=O)C2)c1O 858249826 YGJQIHNULDTMPE-GVJMRKKJSA-N 329.194 1.517 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)CCNC(C)=O)C2)cc1 852449379 RQJFZQBSTCBYLW-CQSZACIVSA-N 334.420 1.051 10 10 EDCE COC[C@@H]1CN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CCO1 852452602 BPJSAYCEJGPNLN-PBHICJAKSA-N 349.431 1.331 10 10 EDCE Cn1ccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)n1 765664346 FVZCXAHTRXUMLP-UHFFFAOYSA-N 329.404 1.256 10 10 EDCE c1cn(C[C@H]2CN(Cc3ccc(N4CCOCC4)cc3)CCO2)nn1 931059023 NHQWOMOVOFAHJD-GOSISDBHSA-N 343.431 1.016 10 10 EDCE COC(=O)[C@@H]1CN(Cc2c(O)cccc2Br)C[C@@H](C)O1 862486165 AKYWXXYKYBCLND-RNCFNFMXSA-N 344.205 1.917 10 10 EDCE O=[S@@]1C[C@@H]2C[C@H]1CN2Cc1cc(Br)cc(F)c1O 1119450852 ZEEQXDXGRINCED-LXIMFEHMSA-N 334.210 1.999 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CO[C@H](CCC(=O)OC(C)(C)C)C1 884995670 YKZAOCNAGGWMPW-NWDGAFQWSA-N 328.361 1.215 10 10 EDCE NS(=O)(=O)C1(CNCc2cc(Cl)cc(Cl)c2O)CC1 713976425 ZIPLNMBETJPISA-UHFFFAOYSA-N 325.217 1.610 10 10 EDCE CN(C[C@H]1CCCS1(=O)=O)c1ccc(CO)c(Br)c1 694116198 IIKGWBZZMHALJR-GFCCVEGCSA-N 348.262 1.955 10 10 EDCE C[C@@H](NC(=O)C(=O)N[C@@H]1COC(C)(C)C1)c1ccc(N(C)C)cc1 1335677260 HRSULNNFNCLPQJ-OCCSQVGLSA-N 333.432 1.614 10 10 EDCE [N-]=[N+]=NC1CN(C(=O)CNC(=O)c2ccc(Br)cc2)C1 1912169871 PTDHWKFKKJPZMB-UHFFFAOYSA-N 338.165 1.700 10 10 EDCE CN(C)C[C@]1(O)CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1297346166 SDSQMRZKVWXWAX-MRXNPFEDSA-N 333.392 1.378 10 10 EDCE CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1cccc(O)c1O 1558159827 MWPGZYPTRPJCDP-DOMZBBRYSA-N 349.431 1.934 10 10 EDCE Cc1ccc(O)c(CNC(=O)Cc2c(C)[nH]c3ccnn3c2=O)c1 1557554004 USIIDRCARGOTPE-UHFFFAOYSA-N 326.356 1.204 10 10 EDCE CCOC(=O)Cn1nc(C)cc1NC(=O)/C=C\c1ccc(O)c(O)c1 1557309025 DFHJESQKEHQEAX-ALCCZGGFSA-N 345.355 1.818 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)COC(C)(C)C)cc1C 1734364430 HSGNPLDOZDTRRP-HNNXBMFYSA-N 338.448 1.385 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCc1cc(O)c(O)c(O)c1)C(=O)O 1951402382 MDVCWUQJBQCUSK-VIFPVBQESA-N 327.333 1.714 10 10 EDCE Cc1nc(C(=O)NCc2ccc3c(c2)CCCN3C)c(=O)[nH]c1C 155171430 VCVRPSKOAJDLTN-UHFFFAOYSA-N 326.400 1.699 10 10 EDCE C[C@@H](O)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 1858592165 IDDYOOIRZARJAI-QEXLZLQKSA-N 339.394 1.427 10 10 EDCE CCNCc1ccc(N2CC(=O)NC(=O)C2)cc1Br 233516276 CWLZVCNOJVPDBQ-UHFFFAOYSA-N 326.194 1.021 10 10 EDCE CN1C[C@@H](C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)CC1=O 1889615137 LCGXMZGWASEWFL-ZOBUZTSGSA-N 327.428 1.770 10 10 EDCE COc1ccc(Br)c(CN2CC[C@H](C(N)=O)C2)c1O 1964560808 ZKXHLRPARZRCLN-QMMMGPOBSA-N 329.194 1.471 10 10 EDCE O=C(N[C@H](Cc1ccc(O)c(O)c1O)C(=O)O)OCc1ccccc1 1951426087 XBOZYFJADXWVPM-GFCCVEGCSA-N 347.323 1.726 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)[C@H](C)CO)c(Br)cc21 252803985 CMHFNTZKWREQSS-JMCQJSRRSA-N 328.210 1.479 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 1985093999 ILLDPSPGJLTABO-JTQLQIEISA-N 325.369 1.127 10 10 EDCE CO[C@H](C)[C@H](CC(=O)N1CC(N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1985094524 QBWHIGPFRQHAIG-KOLCDFICSA-N 327.385 1.826 10 10 EDCE CC(C)(C)OC(=O)NCCn1cnc(C(=O)N2CC(N=[N+]=[N-])C2)c1 2010402719 VBWZKGCGXOGTRI-UHFFFAOYSA-N 335.368 1.543 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1cccnn1 2022930170 RDIGCHCVRJWBNY-RYUDHWBXSA-N 334.376 1.024 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@](O)(C(N)=O)C2)c(Br)c1 312237608 BSTLAIVBIYWMMS-YMTOWFKASA-N 342.237 1.285 10 10 EDCE CNCc1ccc(N2CC(CC(=O)NC)C2)c(Br)c1 382203255 GNQXNMGIWLLORA-UHFFFAOYSA-N 326.238 1.741 10 10 EDCE CCNCc1ccc(N2CC(CC(N)=O)C2)c(Br)c1 382398997 VHRABJFRPXVBTM-UHFFFAOYSA-N 326.238 1.870 10 10 EDCE CCOC(=O)Cc1cc(O)n2nc(C3CCC3)c(C(=O)OCC)c2n1 2080924373 RURBCZJXBVXDGC-UHFFFAOYSA-N 347.371 1.985 10 10 EDCE OC[C@H](O)C1(NCc2cc(Cl)cc(Br)c2O)CC1 2069747842 XRJQUUZVJMHERS-JTQLQIEISA-N 336.613 1.784 10 10 EDCE O=C1NC[C@@H]2CN(Cc3ccc(Br)cc3O)CC[C@@H]12 2100944468 NLVNNZOYWDLNQO-ZYHUDNBSSA-N 325.206 1.723 10 10 EDCE Cc1cnccc1N(C)C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1 2080952142 UVJFHMGPAUAFCN-DZGCQCFKSA-N 347.415 1.937 10 10 EDCE NCc1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)cc1Br 2090123069 ZDVZXLUZFPUEJC-KBPBESRZSA-N 327.222 1.089 10 10 EDCE Cn1ncc(Br)c1CNCCc1ccc(O)c(O)c1 2091753734 JMLQCCJBLHEPNF-UHFFFAOYSA-N 326.194 1.926 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210536659 HWQWDABXWCNVRP-LNFKQOIKSA-N 327.385 1.608 10 10 EDCE NCc1ccc(N2C[C@@H]3CC[C@H](CO)O[C@H]3C2)cc1Br 2289348900 IMGBPCNDXPAPNK-LNSITVRQSA-N 341.249 1.884 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NC[C@@H]1CC[C@@H](O)C1 2311487614 QCVWPAYWELRDNA-SJLPKXTDSA-N 330.428 1.814 10 10 EDCE NCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2332599610 SHACYTULFLPQGC-IGJVIKARSA-N 327.222 1.228 10 10 EDCE Cc1cc(Br)cc(CN2C[C@H]3CS(=O)(=O)[C@H]3C2)c1O 2336548180 HDMLLKRRUMBHTO-JQWIXIFHSA-N 346.246 1.692 10 10 EDCE C[C@@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)c(Br)c1 2357057247 VSHVOIBIAJWZBJ-RMROANFSSA-N 341.249 1.932 10 10 EDCE OCCCOC1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 93694439 MVMQBJYHSTWWKM-UHFFFAOYSA-N 334.460 1.887 10 10 EDCE COc1c(Br)cc([C@@H](N)CO)c(O)c1Br 238336632 FPRYUNSPRWWVFP-LURJTMIESA-N 340.999 1.918 10 10 EDCE CC[C@H]1CN(Cc2cc(OC)c(OC)cc2O)CCN1C[C@H](C)O 246014281 ZBNMGAOLZJWZKZ-ZFWWWQNUSA-N 338.448 1.686 10 10 EDCE COc1ccc(O)c(CN2CCCN(S(=O)(=O)C3CC3)CC2)c1 376621964 WNVOFRBKYPYEIL-UHFFFAOYSA-N 340.445 1.401 10 10 EDCE COC1(C(=O)OCC(=O)C(C)=O)CCN(C(=O)OC(C)(C)C)CC1 808506695 QBBWYCJGORRUAX-UHFFFAOYSA-N 343.376 1.104 10 10 EDCE Nc1nsc(N2CCN(Cc3cc(Cl)c(F)cc3O)CC2)n1 294308091 QIZAXVSHFCHMQQ-UHFFFAOYSA-N 343.815 1.941 10 10 EDCE CN(C)c1ccc(/C=C\CN2C[C@@H](N)[C@H](c3cnn(C)c3)C2)cc1 818431943 XGBJKBOURKBGAP-WFRZBGSESA-N 325.460 1.926 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](NC(N)=O)C2)cc1Br 723173803 POZXKWLLANHMRA-RKDXNWHRSA-N 327.226 1.716 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)CC3(CN)CC3)CC2)cc1 829499898 GZPZUPKYXCEZAF-UHFFFAOYSA-N 346.475 1.062 10 10 EDCE COC(=O)CC[C@@H](N)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 828353233 LEKCDDRXSCNHHA-MRXNPFEDSA-N 349.431 1.061 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CCN(CC(F)(F)F)C1=O 588405083 OCJXBYOKPLSUHA-WUWIAWFRSA-N 344.289 1.390 10 10 EDCE CC[C@H](O)CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 822660082 JUJDZLAZPZOVPW-ZBFHGGJFSA-N 333.432 1.166 10 10 EDCE CC[C@@H](NC[C@]1(OC)CCS(=O)(=O)C1)c1ccc(F)cc1O 903363676 QPQJWLXYPAPMKA-UKRRQHHQSA-N 331.409 1.776 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=S)NC3CCN(C)CC3)C2)cc1 849270319 BKNZBUZTYQJEBU-OAHLLOKOSA-N 348.516 1.832 10 10 EDCE Nc1ccc(CCNC(=O)N2CCN(c3cccnn3)CC2)cc1 841957677 USPWGGFAHRWUGK-UHFFFAOYSA-N 326.404 1.133 10 10 EDCE CNC(=O)Cc1nc(COC(=O)c2ccc(C)c(O)c2O)cs1 754812431 OOABJVWNDLSSCU-UHFFFAOYSA-N 336.369 1.508 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3COCC3(C)C)C2)cc1 852372737 GJUNUXPKCMBWCI-BBRMVZONSA-N 333.432 1.998 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3CCC4(CNC4)O3)CC2)c(OC)c1 866696971 DZNHDJMLRFDJJP-INIZCTEOSA-N 347.459 1.347 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1nnn(C2CC2)c1C(F)(F)F 778916290 BAEMGRKDGBVKPA-UHFFFAOYSA-N 342.277 1.973 10 10 EDCE Cc1ccn2ncc(C(=O)OCC(=O)c3ccc(O)c(O)c3)c2n1 783438682 OYFWYTSPTRUHDI-UHFFFAOYSA-N 327.296 1.489 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCCC[C@@H]1N1CCOCC1 1149533146 FRXNSNZQWCXVQO-GJZGRUSLSA-N 334.416 1.400 10 10 EDCE NCc1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)cc1Br 2121593452 QFNICTKGCUYCAN-OSMZGAPFSA-N 327.222 1.351 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cccn2C)cc1C 1268297397 FHCNTIJBJFASCB-OAHLLOKOSA-N 331.416 1.223 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)C2CC(C)C2)cc1C 1700937721 LTVMNBMYTXMSJC-QWFMPGPPSA-N 334.460 1.959 10 10 EDCE CC[C@H](C)C(=O)NCC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1704125403 RVIYKCNOLYXZPC-NWDGAFQWSA-N 337.420 1.770 10 10 EDCE COC(=O)N[C@@H]1CCN(c2ccc(CN)c(Br)c2)C1 228155364 YUJRPPNDOKPCHA-SNVBAGLBSA-N 328.210 1.843 10 10 EDCE C[C@@H](NCCCO)[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1716975281 KZZMVNXOSDERSB-TZMCWYRMSA-N 347.419 1.672 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@@H]2COCCO2)C2CC2)cc1C 1713861952 NMLACXBMVHGYQU-WMZOPIPTSA-N 348.443 1.403 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)c(Br)c1 2136835871 ZSOHQAGAQZGDCM-FZQKWOKYSA-N 329.238 1.791 10 10 EDCE CCNC(=O)CN[C@H](CC)CNC(=O)c1ccc(N=NC(N)=O)cc1 1567991147 WZWGLXVHMOXBKP-GFCCVEGCSA-N 348.407 1.083 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C[C@H]2CCC(=O)N2)cc1C 1732913157 VSPNESBOYSTFIZ-QDLOVBKTSA-N 345.443 1.434 10 10 EDCE CCc1nc(C(=O)NC[C@H](O)CNCc2ccc(OC)c(C)c2)co1 1732638190 NNNWQKZSKKYRIE-CQSZACIVSA-N 347.415 1.435 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC([C@H]3COC(=O)N3)CC2)cc1 1653003129 XMZOPGBSYCOWQA-CYBMUJFWSA-N 345.359 1.810 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)N[C@@H](C)c1nnc(O)n1C 1685391538 VMZUIHHKNIHGFG-NSHDSACASA-N 333.392 1.909 10 10 EDCE O=C(CN1C(=O)/C(=C/c2cccs2)SC1=S)NCCCO 16905448 YZJCQVFZYDXJMH-YFHOEESVSA-N 342.467 1.448 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC(n3cncn3)CC2)cc1 156601045 FPNLWTIWZAPHOD-UHFFFAOYSA-N 342.447 1.297 10 10 EDCE CCOC(=O)CC(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 1866121322 GRMYWXPLYDXIOI-QGZVFWFLSA-N 344.415 1.645 10 10 EDCE Oc1ccc(Br)cc1CN[C@@H]1COC2(CCC2)[C@H]1O 2141559875 WLZVTUCOLDBBMT-YPMHNXCESA-N 328.206 1.927 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]1(C)COCCN1C(=O)OC(C)(C)C 1993372583 OVTBRCOSUMEGMN-CQSZACIVSA-N 327.385 1.781 10 10 EDCE CN1CCN(Cc2ccc(N)cc2)[C@H](CNC(=O)C(F)(F)F)C1 1999479760 HABCPJPOTSHOOR-CYBMUJFWSA-N 330.354 1.063 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010404967 WBAWYSUINSHBQC-WOPDTQHZSA-N 341.412 1.809 10 10 EDCE CN1CCc2cc(CNCCn3cc(Br)nn3)ccc21 2192987615 XCIFTWNOYZDZCE-UHFFFAOYSA-N 336.237 1.823 10 10 EDCE C[C@H](O)[C@H]1CCCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2193592494 HXJSSPGGYPJXCA-HOCOFYGGSA-N 341.205 1.784 10 10 EDCE N[C@@H]1C[C@@H](O)CN(Cc2cc(Cl)cc(Br)c2O)C1 2049113232 HVGWKXZILKEBNL-NXEZZACHSA-N 335.629 1.702 10 10 EDCE CS(=O)(=O)C[C@@H]1CCCN1c1ccc(CN)cc1Br 2094926673 JNXXCGJYSGEKSC-NSHDSACASA-N 347.278 1.921 10 10 EDCE OCC[C@@]1(CO)CCN(c2ccc(CO)c(Br)c2)C1 2097024868 OWWDHGJZGQRBBK-AWEZNQCLSA-N 330.222 1.513 10 10 EDCE C[C@]1(CCO)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2205512611 NEFJLKRUEPSUKX-GXTWGEPZSA-N 341.205 1.786 10 10 EDCE CN(c1ccc(CO)cc1Br)[C@H]1COC2(COC2)C1 2270775518 PZOVDDRFAKHRDY-LLVKDONJSA-N 328.206 1.936 10 10 EDCE CO[C@@H]1CN(c2ccc(CO)cc2Br)[C@H](CO)[C@H]1OC 2233362847 WVCRWAGQKGFTMB-MGPQQGTHSA-N 346.221 1.152 10 10 EDCE O=C(O)CN1C(=O)C(=Cc2ccc(O)c([N+](=O)[O-])c2)SC1=S 2297320935 HVEKWGPHJZVSAS-UHFFFAOYSA-N 340.338 1.586 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)NCCCCN1CCC[C@@H]1CO 2308001987 KNFJRPALKSWPRZ-OAHLLOKOSA-N 334.416 1.464 10 10 EDCE C[C@H](Cn1cncn1)NC(=O)NCc1ccc(N2CCOCC2)cc1 101991046 CBFQGRYGCXSSMN-CQSZACIVSA-N 344.419 1.003 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1cccc(N(C)C)c1)c1ccc(N)cc1 170318836 PIFPKJIGZWTXJK-UHFFFAOYSA-N 340.383 1.853 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@@H]4C[C@H]5C[C@H]4[C@H]3[C@@H]5O)ccc21 249546553 KGAFLKUVSBOEEQ-MQOOWTBDSA-N 341.455 1.980 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H]([C@@H]4CCOC4)C3)cc2N1 366709139 IEWNLSMFIQLJQH-WDEREUQCSA-N 333.344 1.789 10 10 EDCE CSCCCCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 807264720 PHIQZQBMKDZIQD-UHFFFAOYSA-N 337.489 1.970 10 10 EDCE CO[C@H](C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@H]1CCOC1 823834318 ASJZRBCDAPGQHL-HFTRVMKXSA-N 348.443 1.752 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N[C@H]1CCC[C@H](C(N)=O)C1 739018654 DUNPBUDOHBZVIF-ZFWWWQNUSA-N 332.448 1.904 10 10 EDCE CN(C)c1ccc(CN(C[C@H](O)CN2CCOCC2)C2CC2)cc1 917014204 OHTOBZCCRNYHPL-LJQANCHMSA-N 333.476 1.410 10 10 EDCE NCc1ccc2c(c1)CCCN2CC(=O)NC(=O)NC1CCCC1 843349633 GZPCOIPFZYRQFJ-UHFFFAOYSA-N 330.432 1.666 10 10 EDCE CN(C)c1ccc(CN(C(=O)NCC[C@]2(O)CCOC2)C2CC2)cc1 845449310 LUEUYBXJLBRHSE-IBGZPJMESA-N 347.459 1.968 10 10 EDCE CC[C@H](CNC(=O)C(=O)N(CC)Cc1ccc(N(C)C)cc1)C(=O)O 927955514 GDHSIDWXAQHOIK-CQSZACIVSA-N 349.431 1.328 10 10 EDCE CN(C)c1ccc([C@H](N)CNS(=O)(=O)c2cccc(N)c2)cc1 850586650 BCTZLNUUIGOPIS-MRXNPFEDSA-N 334.445 1.313 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(CCO)CC3CC3)C2)cc1 854298302 ZZLAEDJVQVMQKR-OAHLLOKOSA-N 333.432 1.688 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3C[C@H]3c3cnn(C)c3)C2)cc1 855223990 JSFGWINHPAQMEZ-FHLIZLRMSA-N 340.427 1.927 10 10 EDCE O=C(O)CN1CC[C@H](N2CCCc3cc(OC(F)F)ccc32)C1=O 852726228 XRZOUPQZTNSTDL-ZDUSSCGKSA-N 340.326 1.726 10 10 EDCE CCOC(=O)c1nccc(N2CCN(c3ccc(OC)cc3)CC2)n1 853085142 HVUGCZUPPDTRSQ-UHFFFAOYSA-N 342.399 1.989 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCC[C@H](N2CCOCC2)C1 930602139 YUIRNJRLIBWSNL-FQEVSTJZSA-N 345.487 1.820 10 10 EDCE COC(=O)[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C[C@@H](C)O1 862487607 UBIZKPLBTOAEIQ-PELKAZGASA-N 344.751 1.716 10 10 EDCE COC(=O)c1c(CN2CC(=O)N(C)[C@@H](C)C2)c2cc(F)ccc2n1C 1119512236 OHZZNCDJWFUETD-NSHDSACASA-N 347.390 1.767 10 10 EDCE CN(C)C(=O)C1(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 788289265 GDMXFQIVIUVILJ-UHFFFAOYSA-N 331.416 1.008 10 10 EDCE O=C1NN(c2ccccc2)C(=O)/C1=C/c1cnnn1Cc1ccccc1 792882675 GUXKBFLAWYUTFU-GZTJUZNOSA-N 345.362 1.788 10 10 EDCE O=C(NCc1ccccc1O)C(=O)Nc1ccn(C2CCOCC2)n1 1328078637 JCGWIKPJGNQUPB-UHFFFAOYSA-N 344.371 1.195 10 10 EDCE C[C@@H](NCCn1ncc(Br)n1)c1ccc(O)cc1O 2123094783 KJJPSUUSMTYPTJ-MRVPVSSYSA-N 327.182 1.803 10 10 EDCE CCn1nnnc1CN(C)c1ccc(CO)c(Br)c1 1885612522 POIUJCNVUPJWCK-UHFFFAOYSA-N 326.198 1.584 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C2CC(F)(F)C2)cc1C 1507185000 DPDLHYYLCNPAMR-CQSZACIVSA-N 342.386 1.616 10 10 EDCE CCO/C=C\[C@](O)(CNC(=O)Cc1ccc(O)c(O)c1)C(F)(F)F 1450334291 BYRCOEXYZSDCFM-GXMNPTEKSA-N 349.305 1.600 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H]2CN3CCC2CC3)cc1C 1481230928 JSLGFHLZVBKYFT-SFHVURJKSA-N 345.487 1.893 10 10 EDCE C[C@H](c1ccccc1)[C@H](NC(=O)Cc1ccc(O)c(O)c1)C(N)=O 1628757965 DDEDPGQCVMSZBW-DIFFPNOSSA-N 328.368 1.414 10 10 EDCE O=C(C[C@H]1Oc2ccccc2NC1=O)NCc1c(O)cccc1F 1558454982 JKXAWGKKNBDFGG-OAHLLOKOSA-N 330.315 1.937 10 10 EDCE Cc1ccc(C(=O)NOCC(N)=O)cc1-n1c(C)cc(C=O)c1C 1632926172 UZAZLNANVYBAMH-UHFFFAOYSA-N 329.356 1.362 10 10 EDCE Cc1nnnn1-c1ccc(C(=O)NCc2c(O)cccc2O)cc1 1645363334 QUNWCHYQFKADGX-UHFFFAOYSA-N 325.328 1.312 10 10 EDCE COc1cc(C(=O)N[C@H]2CCN(C(=O)CCC(C)C)C2)cc(OC)n1 1687993319 MRDPZDPXBMSBIO-AWEZNQCLSA-N 349.431 1.866 10 10 EDCE CCSc1nnc(NC(=O)CN2C(=O)[C@H](C)SC2=S)s1 11635518 FMHRXMFXWAMMCF-YFKPBYRVSA-N 348.500 1.837 10 10 EDCE CNCc1ccc(N2CCS(=O)(=O)C[C@@H]2C)c(Br)c1 234454028 VOHDHHQOEXMSSO-JTQLQIEISA-N 347.278 1.792 10 10 EDCE O=S(=O)(NCCNCc1cc(Cl)cc(Cl)c1O)C1CC1 1964060442 GBZQXHMCXGBWNI-UHFFFAOYSA-N 339.244 1.870 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@](C)(C(=O)NCCN=[N+]=[N-])C1 1965102565 QMXXJHUTLXHSLN-QMTHXVAHSA-N 327.385 1.875 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]1(N(C)C(=O)OC(C)(C)C)CCOC1 1985101959 ZWNLPOFTNHMECB-CQSZACIVSA-N 327.385 1.781 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCC[C@H]1C(=O)NCCCN=[N+]=[N-] 1985100816 JHPIGSWWFHWQBH-GHMZBOCLSA-N 327.385 1.733 10 10 EDCE C[C@H](NC[C@@H](O)CNC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985771336 GXFBTZMFWOKHKT-CMPLNLGQSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)NC1[C@@H]2CN(C(=O)c3ccc(O)c(O)c3)C[C@@H]12 2006281719 QIMCQTSELODLMK-GHMZBOCLSA-N 334.372 1.693 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010406620 WVNSWYDSFMBNEL-SRVKXCTJSA-N 339.396 1.827 10 10 EDCE Cn1cc(C(=O)N2CC(N=[N+]=[N-])C2)nc1CNC(=O)OC(C)(C)C 2010405634 JZYXAWKWWLSYET-UHFFFAOYSA-N 335.368 1.580 10 10 EDCE COc1cccc(O)c1CN[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 2011487465 MNEPYOZPMOZVOI-GXTWGEPZSA-N 338.404 1.471 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2018525985 CQSUBPRMJZMMOO-IJLUTSLNSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CNCc2ccc(F)cc2O)C1 2024897318 HKFQVWDQQOEIMW-DOMZBBRYSA-N 340.395 1.849 10 10 EDCE C[C@H]1CO[C@@H](CO)CN1c1cc(Br)c(CN)cc1F 311414992 MIWRFKZVULCHAD-WCBMZHEXSA-N 333.201 1.633 10 10 EDCE NCc1ccc(N2CCC[C@H](CO)[C@H]2CO)c(F)c1Br 709805727 KQIMYNQIATUYKO-ZYHUDNBSSA-N 347.228 1.617 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(O)(COC)C2)c(Br)c1 394926579 JREFCOJWMZSMFO-JTQLQIEISA-N 329.238 1.927 10 10 EDCE Cn1nccc1[C@@H]1OCCC[C@H]1C(=O)NCc1c(O)cccc1O 2064378543 HOTXIYKUFQRUHL-BDJLRTHQSA-N 331.372 1.615 10 10 EDCE CCOC(=O)Cc1cc(O)n2nc(C(C)(C)C)c(C(=O)OC)c2n1 2080921317 WVOJAJACYNYSHT-UHFFFAOYSA-N 335.360 1.625 10 10 EDCE Cc1cc(O)ccc1NS(=O)(=O)c1c(Br)cnn1C 2089753165 QOBYKVMNTBCFLZ-UHFFFAOYSA-N 346.206 1.997 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCN=[N+]=[N-])C[C@@H]2OCCC[C@H]21 2250762360 LUTRSIFQOQKSCS-JRPNMDOOSA-N 339.396 1.875 10 10 EDCE NCc1ccc(N2CCC[C@@H]2CC(N)=O)c(F)c1Br 2270082853 VNRYKGCFQVBKHT-SECBINFHSA-N 330.201 1.891 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC[C@@H](O)[C@@H]3C)c(Br)cc21 2288893137 UJGNXBZJQBXORL-HAGUPOPPSA-N 340.221 1.621 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCCC[C@H]1CN1CCOCC1 2307987161 IHXPSHXRDYOZTD-INIZCTEOSA-N 346.427 1.824 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2329193519 OVMUHTDCNYSKMY-DDTOSNHZSA-N 327.222 1.364 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)cc1Br 2336345754 RMAJIXSWFZUIQL-IGJMFERPSA-N 346.246 1.736 10 10 EDCE CCc1nc2n(n1)C[C@@H](NC(=O)NCc1cc(OC)ccc1O)CC2 114969711 NECBPKRPPWRPDJ-LBPRGKRZSA-N 345.403 1.369 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CC[C@](O)(C(F)(F)F)C2)c1O 278305024 WGZQWYPITDSFGT-GFCCVEGCSA-N 336.266 1.808 10 10 EDCE CC(C)C[C@H](CO)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 274755772 PMUBIHZGWDOCDA-GFCCVEGCSA-N 344.433 1.243 10 10 EDCE CN(C)c1ccc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)cc1 285491498 DQULIKCNUDJGSS-MRXNPFEDSA-N 325.478 1.608 10 10 EDCE O=C(NCc1cc(Br)ccc1O)[C@@H](O)c1ccccn1 804739168 SXOQEUPOVGJFDC-ZDUSSCGKSA-N 337.173 1.900 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc(N)cc1)C2 818545193 NTLNNIXXBHVHFG-BPUTZDHNSA-N 331.416 1.794 10 10 EDCE CC1(C)C[C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CO1 828496886 LLBWRPNMNJDZEW-OAHLLOKOSA-N 343.427 1.363 10 10 EDCE COC(C)(C)CS(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 840910097 FPSGVFPBHAPJBQ-UHFFFAOYSA-N 336.435 1.225 10 10 EDCE COCCN(C[C@@H]1CCC2(CNC2)O1)c1ccc(OC)c(OC)c1 852746728 QWHSXUWOFBVLGC-HNNXBMFYSA-N 336.432 1.678 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC(=O)NCC3CC3)C2)cc1 852248137 PMONMWXSGJJGJH-AWEZNQCLSA-N 346.431 1.099 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CSCN3C(C)=O)C2)cc1 855228960 GMAIWBOKKTUPJH-BBRMVZONSA-N 349.456 1.312 10 10 EDCE CCc1cccc(CNC[C@@]2(CO)COCC3(CCC3)N2C)c1O 862463946 PEYJJHUMRMYWSD-LJQANCHMSA-N 334.460 1.660 10 10 EDCE COC1CCN(c2ccc(CN3CCO[C@H](CC(N)=O)C3)cc2)CC1 860011180 XELOMQRBWKUYLY-GOSISDBHSA-N 347.459 1.378 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nn2cnnc2)C1 768178404 RJONAWVDCXSLLN-UHFFFAOYSA-N 338.415 1.770 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCOCC2CCC2)c1 765751710 HILHAGFTNWAKQO-UHFFFAOYSA-N 342.417 1.310 10 10 EDCE CN1CCCN(CCCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1136653279 RCVHVZPLUWKBGQ-UHFFFAOYSA-N 346.435 1.606 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CNCc2cc(F)ccc2O)C1 702807109 AINSUHBULZCTPL-DOMZBBRYSA-N 340.395 1.849 10 10 EDCE C[C@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1136768445 CRJRIFBGXGKOCQ-NXEZZACHSA-N 340.405 1.743 10 10 EDCE Cn1nccc1[C@@H]1C[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)CCO1 1158230109 MVDZLLBASQQCFU-PSPLKBHWSA-N 343.383 1.881 10 10 EDCE COc1cc(N2C[C@H](CO)[C@@H](CCO)C2)c([N+](=O)[O-])cc1OC 1307234222 LNCZMOSDZVRSIW-WDEREUQCSA-N 326.349 1.039 10 10 EDCE COC(=O)c1cnc(CCNC(=O)c2c(F)ccc(O)c2O)s1 1161865850 DFEFGNNEUYMQBQ-UHFFFAOYSA-N 340.332 1.453 10 10 EDCE CC(C)CNC1(CO)CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1168300221 KHGWHLWDOMXAIR-UHFFFAOYSA-N 336.432 1.239 10 10 EDCE CC1(CS(C)(=O)=O)CN(c2ccc(CO)cc2Br)C1 2116568616 HLPASJXAENQEQC-UHFFFAOYSA-N 348.262 1.812 10 10 EDCE CN1C[C@@H](NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)CC1=O 1312207435 FSRAUBZSHGNWOT-HNNXBMFYSA-N 330.432 1.659 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@@H](O)C2(C)C)cc1Br 2124804280 QZHGZSFXNNFZOW-QWHCGFSZSA-N 329.238 1.489 10 10 EDCE CN(C)CC1(NCc2cc(Br)cc(F)c2O)COC1 2120343640 YKYDQZGLDJDUDO-UHFFFAOYSA-N 333.201 1.714 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 1333834137 GJKDOPWKSZYUKO-CQSZACIVSA-N 345.443 1.323 10 10 EDCE CC[C@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@@H]1CCCOC1 1333947544 KBIVXGXXDRIWSL-CABCVRRESA-N 334.416 1.672 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1OCC[C@@H]1NC(=O)OC(C)(C)C 1900609300 MBVOMLXOPAHEDO-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CO[C@H](CCNC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1902029447 XTGJJBSTXRBELY-NQBHXWOUSA-N 328.409 1.182 10 10 EDCE O=C(NCCCSc1nccs1)N1C[C@@H](CO)[C@H](CCO)C1 1348591848 PPDATIILDQPKSE-NEPJUHHUSA-N 345.490 1.258 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC(C)(C)[C@H](C)O)C2)cc1 1263731871 QSOPTCYXVKBOOR-KBPBESRZSA-N 335.448 1.980 10 10 EDCE C[C@@H]1C(=O)NCCN1c1ccc(C=CC(=O)O)c(Br)c1 1911908448 IMYARQIJDQPOAG-SECBINFHSA-N 339.189 1.872 10 10 EDCE COCCN[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1(C)C 1284350260 UJYKYEFNTJCONP-CQSZACIVSA-N 347.419 1.936 10 10 EDCE O=C(NC1CCS(=O)(=O)CC1)c1cc2cc(O)c(O)cc2s1 1290946746 KCYAFSKXKQVTCS-UHFFFAOYSA-N 341.410 1.620 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2cc(C)nc3c2c(O)nn3C)c1 1629736296 FIKCANWOVHYWMK-UHFFFAOYSA-N 326.356 1.926 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N1CCN2C(=O)NC[C@H]2C1 228178524 NKJIYOANCUTPPY-KOLCDFICSA-N 340.221 1.925 10 10 EDCE CN(CC(=O)N(C)C1CCCCC1)C(=O)Cc1ccc(O)c(O)c1 1632687195 DBFGVEOFBUOUKN-UHFFFAOYSA-N 334.416 1.890 10 10 EDCE Cc1nn(CCC(=O)NCc2ccc(O)cc2O)c(C)c1[N+](=O)[O-] 1643104244 RKAKWRJQVDGVAP-UHFFFAOYSA-N 334.332 1.526 10 10 EDCE C[C@@H]1C[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)CCS1(=O)=O 1646493930 QAXKPQJFUQAYBG-SIIXBRRKSA-N 325.386 1.193 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@H](C)N1CCOCC1 1585549837 ISBYXJSFFJOYJC-RYUDHWBXSA-N 333.392 1.688 10 10 EDCE CS(=O)(=O)Cc1cccc(CNC(=O)Cc2ccc(O)c(O)c2)c1 1584391201 MSXODRJZMFWDNI-UHFFFAOYSA-N 349.408 1.501 10 10 EDCE CCn1ncc(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)n1 1690570532 GUGYCVVCUCJQSI-CYBMUJFWSA-N 331.420 1.523 10 10 EDCE CN(C)c1ccc(/C=c2\sc3nc(-c4ccccn4)nn3c2=O)cc1 1860795100 ZDBZYBIYRHEEJY-PTNGSMBKSA-N 349.419 1.827 10 10 EDCE COC(=O)c1cccc(NC(=O)c2nnn(-c3ccc(N)cc3)n2)c1 1857878500 FCFMAFBFJFIJOR-UHFFFAOYSA-N 338.327 1.283 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1C(=O)NCCCN=[N+]=[N-] 1985102516 IAYCEPKWQWHAPR-QWRGUYRKSA-N 327.385 1.733 10 10 EDCE COc1cccc(O)c1CN(Cc1ccccc1)CC1(O)CNC1 1997941015 LKJOQCGZOJEKEF-UHFFFAOYSA-N 328.412 1.737 10 10 EDCE O=C1Nc2cc(N3CC[C@]4(CCO4)C3)c(Br)cc2[C@H]1O 2153333886 PDEWGTOUFSLBCT-OCCSQVGLSA-N 339.189 1.804 10 10 EDCE [N-]=[N+]=NCCN[C@@]1(C(=O)O)CN(Cc2ccccc2)[C@]2(CCOC2)C1 2038666306 PUUYEFRVIMJTIE-IAGOWNOFSA-N 345.403 1.775 10 10 EDCE COCCNC(=O)CN(C)Cc1ccc(Br)cc1O 701175620 RIPBVCRPJUVJOW-UHFFFAOYSA-N 331.210 1.349 10 10 EDCE O=C(O)c1cc(O)ccc1NC(=O)c1ncncc1Br 380228649 LAABCNAMHMIXTH-UHFFFAOYSA-N 338.117 1.895 10 10 EDCE C[C@H](N)c1ccc(N2CCN(CCO)C(=O)C2)c(Br)c1 2171074309 LFHBBBDKDUERHT-JTQLQIEISA-N 342.237 1.110 10 10 EDCE O=C1NC[C@@H]2CN(c3ccc(CO)c(Br)c3)CC[C@@H]12 2100940833 NFWKWRFGRJPURU-ZYHUDNBSSA-N 325.206 1.514 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)cc2Br)[C@@H]2COC[C@H]12 2102139859 FDRRRGJLBXDYCB-ZLKJLUDKSA-N 327.222 1.758 10 10 EDCE OCc1ccc(N2CCC([C@@H](O)CO)CC2)cc1Br 2096158231 PUDGCGWYHRAGLX-AWEZNQCLSA-N 330.222 1.511 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(NC(=O)Cc2ccc(N)cc2)C1 2216757255 XJDFCOMDRDBJQD-FZKQIMNGSA-N 331.416 1.937 10 10 EDCE [N-]=[N+]=NCCN[C@H](C(N)=O)c1ccc(I)cc1 304592998 ZWGBPNMQMNFAAD-VIFPVBQESA-N 345.144 1.718 10 10 EDCE NCCCN(C=O)C(=O)C(=O)N(c1ccccc1)c1ccc(N)cc1 170388773 CZPYMZXJOAGVJZ-UHFFFAOYSA-N 340.383 1.267 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2357592858 OMMZMMCTXLEQQK-MAMIUBEXSA-N 341.249 1.789 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc2c(c1)ncn2C 186443224 PQIMZLHXWVEKGM-JTQLQIEISA-N 326.356 1.741 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)NC[C@]1(CCO)CCOC1 130750506 XCTHLEBLLNSQOQ-IBGZPJMESA-N 345.443 1.651 10 10 EDCE CC(C)[C@@H](CO)N(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2367104928 WKZFKCTUNPVVSQ-CHWSQXEVSA-N 343.221 1.888 10 10 EDCE CN(Cc1cc(Br)ccc1O)[C@@]1(C(=O)O)CCOC1 382460463 XRWQXOMJHABTQX-ZDUSSCGKSA-N 330.178 1.830 10 10 EDCE COC[C@H](O)CN1CCC(N[C@H](C)c2ccc(N(C)C)cc2)CC1 90915326 APTNRCBOPAMURX-DNVCBOLYSA-N 335.492 1.875 10 10 EDCE CO[C@@]1(CN[C@@H](C)c2c(C)cc(C)cc2O)CCS(=O)(=O)C1 903363063 LTXKYHQXGNPZHM-XJKSGUPXSA-N 327.446 1.863 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)C3=COCCC3)nc12 730852205 JYLIWKFCCBOICE-UHFFFAOYSA-N 347.327 1.349 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)c3occc3N)cc2)CC1 1331831196 CYMUOSAGZMSCSY-UHFFFAOYSA-N 342.399 1.460 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)NC/C=C\CN)cc2F)CC1 841792029 DSMJLNMLDLGQNK-ARJAWSKDSA-N 349.454 1.282 10 10 EDCE COc1ccc(N(C)CCN(C)S(=O)(=O)[C@@H]2CCO[C@@H]2C)cc1 845988187 WGLVCUKNKLEYRY-CZUORRHYSA-N 342.461 1.570 10 10 EDCE CCc1cc(CC(=O)N(CC(=O)O)Cc2ccccc2O)n(C)n1 911487178 BUDRKXUGXYPFCB-UHFFFAOYSA-N 331.372 1.344 10 10 EDCE COc1ccc(CNC(=O)c2ccnn2C2CCOCC2)c(O)c1 846949171 FYFFBHQFAOKKCH-UHFFFAOYSA-N 331.372 1.879 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CC[C@@H](O)C3)C2)cc1 854299670 QPCKKMIWHZAVCL-IJEWVQPXSA-N 333.432 1.734 10 10 EDCE CCN(CC)c1ccc(CN(C)C[C@H](O)C2(O)CCOCC2)cc1 929185186 PGBVXAAOMJYVTR-SFHVURJKSA-N 336.476 1.867 10 10 EDCE C[C@@H]1CCn2cc(C(=O)NC[C@@H](N)c3ccc(N(C)C)cc3)nc2C1 870932456 FQYDBOVNKROFNP-CZUORRHYSA-N 341.459 1.961 10 10 EDCE O=C1OCC[C@@H]2CN(Cc3ccc(N4CCOCC4)c(F)c3)CCN12 770391032 JPFWNYWVIVLCML-OAHLLOKOSA-N 349.406 1.689 10 10 EDCE O=C(NC[C@H]1CCS(=O)(=O)C1)c1cc2cc(O)c(O)cc2s1 1136158743 JDGUQSOLZXZTQR-MRVPVSSYSA-N 341.410 1.477 10 10 EDCE COC(=O)c1c(CN2C[C@@H](O)C[C@@H](O)C2)c2cc(F)ccc2n1C 894085833 QUJPLZNXRMDYGP-TXEJJXNPSA-N 336.363 1.032 10 10 EDCE CC(=O)Nc1cccc(OCCNC(=O)Cc2ccc(O)c(O)c2)c1 1136686217 WZMAMEVAFDKNSX-UHFFFAOYSA-N 344.367 1.794 10 10 EDCE CCOC(=O)c1n[nH]c([C@H](C)NC(=O)/C=C/c2ccc(O)c(O)c2)n1 1146857507 ZUZOHFJKYPTKFT-IWGCBNPKSA-N 346.343 1.283 10 10 EDCE CO[C@H](C)CNC[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1319591959 FTGXUEMWWBSLNQ-NWDGAFQWSA-N 335.408 1.934 10 10 EDCE C[C@H]1[C@H](CO)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1313065884 ZAQJFZPWAFLVSS-HOCLYGCPSA-N 347.459 1.560 10 10 EDCE COC1(CS(=O)(=O)NCc2cc(C)ccc2O)CCOCC1 1329807066 SORWQZJETCPBEO-UHFFFAOYSA-N 329.418 1.316 10 10 EDCE Cc1ccc(C(=O)N2C[C@]3(CO)CCCC[C@]3(CO)C2)c(O)c1O 1179833604 YYPCEMLAXKSCKY-HDICACEKSA-N 335.400 1.393 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc(CN(C)C)on3)C2)cc1 1328758845 UWYWYPNVDXHKHI-ZDUSSCGKSA-N 344.415 1.754 10 10 EDCE CCOc1cc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)[nH]n1 1331230906 ZIRVXXZZDMBZQE-LBPRGKRZSA-N 330.388 1.826 10 10 EDCE NCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2134818003 WAZJBIYQYVWNLI-GZBPVQSJSA-N 327.222 1.228 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@H]2CCC(=O)NC2)cc1C 1275179281 BIATVIRUVNTLHF-GOEBONIOSA-N 347.459 1.514 10 10 EDCE O=S1(=O)N[C@H]2CN(Cc3ccccc3O)C[C@H]2Oc2ccccc21 1615259762 KLOADSRRJZYTRJ-XJKSGUPXSA-N 346.408 1.316 10 10 EDCE C[C@@H]1C[C@H](N2CCOCC2)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1623811167 YLLALICUFCJEBK-DOMZBBRYSA-N 345.403 1.784 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C[C@@H]2CCC(=O)N2)cc1C 1716416049 SLGPVYMFRHMQCJ-HIFRSBDPSA-N 333.432 1.267 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCc2cn[nH]c2)cc1C 1491605106 VINKDVYMKIMCOP-CQSZACIVSA-N 330.432 1.954 10 10 EDCE CN(CC(=O)NCCCSc1nccs1)[C@@H]1CCC[C@H]1O 1632807187 PUNKJHVTAOLZNX-VXGBXAGGSA-N 329.491 1.587 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1nonc1C 1497506811 UVEIRJAGHTYKQO-UHFFFAOYSA-N 332.404 1.947 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C(C)(C)CNC(C)=O)cc1C 1497939296 VYNMVWSDTGIJLC-CQSZACIVSA-N 349.475 1.760 10 10 EDCE C[C@@H]1OCC[C@@]12CN(C(=O)c1ccc(N=NC(N)=O)cc1)CCO2 1568618813 OAPPQYYREALMAM-MEDUHNTESA-N 332.360 1.869 10 10 EDCE NC(=O)CC[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1584677331 LCLHFCGUPZOBNQ-LLVKDONJSA-N 331.376 1.967 10 10 EDCE CO[C@@H](C)C(=O)N(C)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1687515237 DCEXQKAOBMNXMK-NSHDSACASA-N 349.391 1.462 10 10 EDCE Cn1nc(C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)ccc1=O 1889946070 SDCQWCFOSQCBQD-HOCLYGCPSA-N 338.411 1.699 10 10 EDCE O=C(O)CN1CCC(NCc2cc(Br)ccc2O)CC1 874050841 ULIAGQWJQTWFNY-UHFFFAOYSA-N 343.221 1.793 10 10 EDCE CO[C@H](C)[C@@H](CC(=O)N1CC(N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1985094525 QBWHIGPFRQHAIG-MWLCHTKSSA-N 327.385 1.826 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985103649 YNENYFXJKFRURK-ONGXEEELSA-N 327.385 1.562 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)C(=O)c1cc(O)c(O)c(O)c1 1988123874 PKRABCYNHDYIDG-UHFFFAOYSA-N 326.349 1.400 10 10 EDCE C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010401664 GPMPAUFSVQGXTC-TUAOUCFPSA-N 339.396 1.922 10 10 EDCE O=C1CCC(=O)N1CCNCc1c(O)cccc1Br 706844525 QAPSPNGSIQLVAS-UHFFFAOYSA-N 327.178 1.393 10 10 EDCE CC1(C)OCCN(c2ccc(CO)cc2Br)[C@@H]1CO 2267740052 ULHAHJLMVWULQS-CYBMUJFWSA-N 330.222 1.918 10 10 EDCE COC[C@@H]1[C@H](O)[C@@H](O)CN1c1ccc([C@H](C)N)cc1Br 2234066892 LODCVMCVWFOERD-ISTUKMMPSA-N 345.237 1.026 10 10 EDCE CC[C@H](C)NCc1ccc(N2C[C@@H](O)[C@H](O)C2)c(Br)c1 2240040830 VDMUGIQOADDXMF-COLVAYQJSA-N 343.265 1.879 10 10 EDCE CC(=O)NN1C(=O)C(=C2C(=O)Nc3ccc(C)cc32)SC1=S 2297322269 UMYMXKXYEVBGDO-UHFFFAOYSA-N 333.394 1.570 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2333236862 IQBHUJYZLWGZPE-YAUNCSCZSA-N 333.201 1.349 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C[C@H]2C(=O)O)c(O)c1Br 2352948127 MLJMSSOSSADFMM-DTWKUNHWSA-N 328.162 1.800 10 10 EDCE CN1O[C@@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2[C@H]1c1ccccc1O 102544787 ILRDIUAKHZMGGH-BBWFWOEESA-N 338.363 1.864 10 10 EDCE C[C@@H](N)c1ccc(N(C)Cc2nnn(C)n2)cc1Br 1892993916 ZJCRTEOSFGCBAP-MRVPVSSYSA-N 325.214 1.629 10 10 EDCE CN1CCCN(C(=O)NCCCSc2nccs2)CC1=O 190249213 NJFLQZBQOHDKLJ-UHFFFAOYSA-N 328.463 1.499 10 10 EDCE NC(=O)N[C@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1 270793096 VRRHTGJIGNBINW-AWEZNQCLSA-N 331.420 1.239 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3C)C2)c1 361899050 GBOWTQCWLOWENE-MPKXVKKWSA-N 333.388 1.209 10 10 EDCE COc1cccc(CN[C@@H]2CCC[C@H]2CNS(C)(=O)=O)c1O 800309533 KNHZBCRLLZFUMH-WCQYABFASA-N 328.434 1.208 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 728745270 QEZREBDHMDILCY-INIZCTEOSA-N 347.415 1.370 10 10 EDCE C[C@H]1CNCC[C@@H]1NC(=O)NCc1cc(Br)ccc1O 841989596 ZVRPVVUPEQZNFP-CABZTGNLSA-N 342.237 1.952 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N(C1CC1)[C@H]1CCNC1 841731156 YZWXYMYPCJPOPM-SFHVURJKSA-N 344.459 1.559 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C[C@@H](C)O)C3CC3)C2)cc1 854295974 FQJRMEBANSBPLS-ZIAGYGMSSA-N 333.432 1.829 10 10 EDCE CON1CCC(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 865018560 MRKJYAWMJJUROL-HNNXBMFYSA-N 347.459 1.974 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)C1CCN(C(C)=O)CC1 935946243 COWCHZYJXQTJKT-UHFFFAOYSA-N 325.405 1.753 10 10 EDCE CO[C@H](CS(=O)(=O)N[C@@H](C)c1ccccc1O)[C@H]1CCOC1 867836168 IHYLKCMJYOUTPC-SLEUVZQESA-N 329.418 1.424 10 10 EDCE COC(=O)c1cc(OCCN2C[C@@H]3CC[C@H](C2)O3)ccc1N(C)C 871793500 TWEIDTYSZOFAEL-GASCZTMLSA-N 334.416 1.781 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCC(OCCCO)CC2)c1O 774906735 CXRVFSCXEVDYHT-UHFFFAOYSA-N 340.376 1.672 10 10 EDCE CN(C)S(=O)(=O)[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 894740109 OMYLIHSFSDDKCV-GFCCVEGCSA-N 334.388 1.526 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc2c(c([N+](=O)[O-])c1)OCO2 1142533476 LVIJNBLVSXVLLL-UHFFFAOYSA-N 332.268 1.665 10 10 EDCE C[C@H](NC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2[nH]1)c1ccccc1O 1151892089 IMAHOMKRQWIFEH-JQAFLVLXSA-N 341.367 1.540 10 10 EDCE CNC(=O)c1ccc(NC(=O)Cc2ccc(O)c(O)c2)c(OC)c1 1301110736 HOKCGZZOUZAMAF-UHFFFAOYSA-N 330.340 1.647 10 10 EDCE CN1CCN(c2ccc(CN3[C@H]4CC[C@H]3[C@@H](CO)C4)cc2F)CC1 1323936156 GMCQARPMUUTKKG-RYRKJORJSA-N 333.451 1.923 10 10 EDCE CNC(=O)[C@@H](C)NCC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1320651787 FRFCAERXRKAUFO-GHMZBOCLSA-N 348.407 1.082 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCc3nccn3C)C2)cc1 1263861156 RQCOCTAVHWUNAT-AWEZNQCLSA-N 328.416 1.756 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H](C)NC(C)=O)cc1C 1268779981 NYKXIKKUBKGGIW-CQSZACIVSA-N 335.448 1.466 10 10 EDCE CCN1CCO[C@@H](C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)C1 1266995761 FMELSRHCQDRZCN-MAUKXSAKSA-N 349.475 1.319 10 10 EDCE NC(=O)c1ccc(/C=C/C(=O)NCc2ccc3cccnc3c2O)o1 1299724696 HEVOSAHOGDOZHP-SOFGYWHQSA-N 337.335 1.962 10 10 EDCE CN1C(=O)CC[C@@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C1=O 1299713248 QNJVEEUUIFRUFZ-MRVPVSSYSA-N 334.353 1.190 10 10 EDCE COc1ccc([C@@H](CO)CNC(=O)Cc2ccc(O)c(O)c2)cc1 1468845927 AQUVGVOQOJSLMC-CQSZACIVSA-N 331.368 1.541 10 10 EDCE Cn1c(CO)nc2cc(C(=O)NCc3ccc(O)c(O)c3)ccc21 1465953462 GRLOYBCAFXFCMF-UHFFFAOYSA-N 327.340 1.407 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2nnnn2-c2ccccc2)c1 1478961514 LERDJNVTUJIKMP-UHFFFAOYSA-N 338.371 1.676 10 10 EDCE CCCN(CCO)c1cc2c(cc1Br)[C@H](NC)C(=O)N2 118711890 YHKOHDWNGIVSLS-ZDUSSCGKSA-N 342.237 1.870 10 10 EDCE CC(C)N(C)C(=O)[C@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1628920157 JBKUPYHTBAQLTC-GFCCVEGCSA-N 338.429 1.409 10 10 EDCE 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1.618 10 10 EDCE CC(C)(C)OC(=O)N1CCN(Cc2cc(N)ccc2O)[C@H](CO)C1 1999484992 RAHCHHSXDAJAAV-AWEZNQCLSA-N 337.420 1.388 10 10 EDCE CC(C)(C)OC(=O)NC1CN(c2cc3c(cc2N)NC(=O)CC3)C1 1999505649 FZNOFDPYNXAEMQ-UHFFFAOYSA-N 332.404 1.867 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1C[C@@H](O)CN(C(=O)OC(C)(C)C)C1 2010406277 RVMZEINCLMPNMX-NWDGAFQWSA-N 341.412 1.763 10 10 EDCE C[C@H](O)c1ccc(N(C)C2CS(=O)(=O)C2)cc1Br 2034770811 XMMCJVHPBBEQNS-QMMMGPOBSA-N 334.235 1.736 10 10 EDCE O=C1OCCN1[C@H]1CCN(c2ccc(CO)c(Br)c2)C1 2171729915 MIOQBGYVMBHMLI-LBPRGKRZSA-N 341.205 1.972 10 10 EDCE C[C@@H]1C[C@@H](O)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 385095309 NOAARCXUXMKTNS-NQYJQULFSA-N 326.194 1.361 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C(CNC(=O)c3cccc(O)c3O)[C@@H]2C1 832051012 CQTBOALNFQDAFZ-STQMWFEESA-N 348.399 1.941 10 10 EDCE NCc1ccc(N2C[C@H](O)C3(CCOCC3)C2)c(Br)c1 2174367224 ZGGDBTFPXWWFJX-AWEZNQCLSA-N 341.249 1.886 10 10 EDCE CN(C)CCN(C)CCN(C)c1ccc(CO)cc1Br 2179011876 ZFTFCCKHJADRPD-UHFFFAOYSA-N 344.297 1.871 10 10 EDCE CCNCc1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)cc1Br 2197957262 ABIXFVKQVRHIBP-LSDHHAIUSA-N 343.265 1.881 10 10 EDCE CC(C)(C)OC(=O)N1CCC(N(CC(N)=O)c2ccc(N)cc2)CC1 2044721925 IYNSENISYUTULI-UHFFFAOYSA-N 348.447 1.960 10 10 EDCE CN(CC(F)(F)Br)C(=O)c1cc(O)c(O)c(O)c1 2068619796 CJNPTBLSWVUDQR-UHFFFAOYSA-N 326.093 1.863 10 10 EDCE NCc1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)c(Br)c1 2090120664 AFSLECHVYHUYIL-KBPBESRZSA-N 327.222 1.089 10 10 EDCE N[C@H]1CN(Cc2cc(Br)ccc2O)[C@@]2(CCOC2)C1 2098283995 BODVSWGUKRFROV-OCCSQVGLSA-N 327.222 1.847 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(NCc2ccc(O)c(O)c2O)C1 2216824192 QJLJEJWKBGNCTC-APPDUMDISA-N 336.388 1.902 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)C3(C)COC3)c(Br)cc21 2208303679 BIHKHLIGBGIXDK-LBPRGKRZSA-N 340.221 1.887 10 10 EDCE COc1ccc(Br)c(CN2CCN(C)C[C@H]2CN)c1O 2236033276 OODAVSMEGYPOTH-SNVBAGLBSA-N 344.253 1.238 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2236646415 VHZMQZACYHYJDQ-BETUJISGSA-N 343.265 1.596 10 10 EDCE CNC(=O)[C@@H]1CCCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297505693 NWGPMZSDNSXIPI-KRWDZBQOSA-N 343.427 1.273 10 10 EDCE O=C(N[C@H](CCO)COCc1ccccc1)c1ccc(O)c(O)c1 2303569641 VZOSDUKXAHKZCB-OAHLLOKOSA-N 331.368 1.795 10 10 EDCE C[C@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C[C@@H](CO)O1 2311236423 UPGZNNYRGPUYQI-YJBOKZPZSA-N 346.427 1.145 10 10 EDCE CC[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCN1CCOC 181096692 CFNUBAYAWQZMBR-KEDPEKRHSA-N 334.416 1.680 10 10 EDCE CCS(=O)(=O)[C@H]1CSCCN1C(=O)c1cccc(O)c1O 126468545 HXCURYSSTINVAS-NSHDSACASA-N 331.415 1.048 10 10 EDCE Cc1cccc(OCC(=O)NCCN2C(=O)CSC2=S)c1C 49756019 YJPQBBMGTGSLHH-UHFFFAOYSA-N 338.454 1.659 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(O)(CN(C)C)C2)cc1Br 2369669236 JNBRFIYAVMNBBS-NSHDSACASA-N 342.281 1.842 10 10 EDCE C[C@@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1cc(F)ccc1O 806170807 GFWGXBTYWUAJFH-DGCLKSJQSA-N 345.440 1.453 10 10 EDCE Cc1ccc(CN2CC[C@@H](C(CO)CO)C2)c(O)c1Br 2381138016 RTEZWNCICQGPCL-LLVKDONJSA-N 344.249 1.886 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCCSCC1 298559689 MJHNOKTZSKUXST-UHFFFAOYSA-N 335.473 1.677 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1c1ncccn1 808537322 XECYOCHKDQMWOF-IHRRRGAJSA-N 331.372 1.315 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@]1(C)CN 817918445 JOWPTSRDIJRBFP-AUUYWEPGSA-N 346.475 1.154 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H]3C(F)(F)F)nc12 821272037 USHLKSWTDVDTCJ-JTQLQIEISA-N 344.293 1.748 10 10 EDCE COCc1n[nH]c(CNC(=O)N[C@@H](C)c2cc(OC)ccc2O)n1 821177841 OZNJXKYYHUBHBW-VIFPVBQESA-N 335.364 1.226 10 10 EDCE C[C@]1(C2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)COC(=O)N1 905710276 HTIQHEVAYRNKIF-MAUKXSAKSA-N 348.399 1.529 10 10 EDCE COC[C@@]1(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CCOC1 825600587 MZLFXRUCLBMMBN-IBGZPJMESA-N 348.443 1.833 10 10 EDCE c1cc(N2CCOCC2)ccc1CN[C@H]1CNCC2(CCOCC2)C1 903974251 NGGCSKCPFHMHCF-GOSISDBHSA-N 345.487 1.772 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N[C@H](CF)C(=O)O)cc1F 837298120 JIOJMSMDFXFLQQ-GFCCVEGCSA-N 329.347 1.894 10 10 EDCE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H](O)C(C)(C)O)cc1 912109102 DRSGSVLBSWOGNQ-ZDUSSCGKSA-N 348.365 1.775 10 10 EDCE COc1cc([C@@]2(O)CCN(C(=O)OC(C)(C)C)C2)cc(O)c1O 687745004 OVYAJCDDZURHMG-MRXNPFEDSA-N 325.361 1.935 10 10 EDCE CC(=O)C(=O)COC(=O)[C@]12C[C@H]1CCCN2C(=O)OC(C)(C)C 924463049 JUCLYPPTCHMPPF-BZNIZROVSA-N 325.361 1.477 10 10 EDCE COc1cc(Br)cc([C@H](C)NC[C@@H](O)CN(C)C)c1O 848527357 AFZJKPQKNMNITB-GXSJLCMTSA-N 347.253 1.736 10 10 EDCE COc1ccc(N2CCCN(C[C@@H](O)CC3(O)CCC3)CC2)cc1 859086796 OKEXAQXTCXAVBK-KRWDZBQOSA-N 334.460 1.873 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CN(Cc2ccccc2)CC12CCC2 860425285 CSRFBVZPIVQUHS-INIZCTEOSA-N 329.396 1.990 10 10 EDCE CNC(=O)NC[C@@H]1CN(C/C=C/c2ccc(N(C)C)cc2)CCO1 862459108 MMXOMDJUWJNRHM-LAQIPUCWSA-N 332.448 1.396 10 10 EDCE CNCCOCCN(C)Cc1cc(Br)cc(OC)c1O 863648205 NVTIWETWJLXVET-UHFFFAOYSA-N 347.253 1.831 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@]2(C)CC2(F)F)cc1F 1118667938 GMSYDAVORJEMIA-OAHLLOKOSA-N 343.349 1.669 10 10 EDCE CCCN(CCC)S(=O)(=O)Nc1ccc(O)cc1C(=O)OC 775286398 HFVQSRVCMWISHP-UHFFFAOYSA-N 330.406 1.958 10 10 EDCE COc1ccc(CNC(=O)c2cc(S(C)(=O)=O)cs2)c(O)c1 794389619 AVXLMNWHUIWDNI-UHFFFAOYSA-N 341.410 1.796 10 10 EDCE COc1cc(NS(=O)(=O)c2ccc3c(c2)C(=O)NC3=O)ccc1O 797820193 KWOPPJAHPMOZRX-UHFFFAOYSA-N 348.336 1.085 10 10 EDCE C[C@@H](N)c1ccc(N2CC(=O)NC(=O)C2(C)C)c(Br)c1 97301205 HECVJARMEPOHSE-MRVPVSSYSA-N 340.221 1.710 10 10 EDCE COc1cccc(CNC(=O)c2ccoc2C2(O)CCOCC2)c1O 1150543995 WQLXUJSNUZZGGQ-UHFFFAOYSA-N 347.367 1.922 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H]3C[C@@H]4C[C@@H]4C3)C2)cc1 1328210057 OJCIUOASKBSEQY-LXTVHRRPSA-N 343.427 1.305 10 10 EDCE O=C1Nc2cc(N3CC=C[C@H]3CO)c(Br)cc2[C@@H]1O 2119853772 RNRWUUJWVHMIAQ-MADCSZMMSA-N 325.162 1.172 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@@H]4CN(C)C[C@@H]43)cc2F)CC1 1324821594 DNKWDDVTYZZMDA-APWZRJJASA-N 332.467 1.713 10 10 EDCE CC1(C)CC(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1330951792 PWFIONHNKDPXAJ-UHFFFAOYSA-N 327.428 1.984 10 10 EDCE O=C(C(=O)N1CCCC2(CCNCC2)C1)N1Cc2cccc(O)c2C1 1332117203 VQZOEPRDPHOFQI-UHFFFAOYSA-N 343.427 1.227 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)Cc2nc[nH]n2)C2CC2)cc1C 1265376580 QJVOCVQOJJWBRH-HNNXBMFYSA-N 343.431 1.349 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CC[C@@]12CCOC2 1345275538 JSBJSFDNWLESOG-SFHVURJKSA-N 349.406 1.737 10 10 EDCE Cn1nc(C(=O)NCc2cccc(Br)c2O)cc1C=O 1448970091 XMIKZWIBTLQYHK-UHFFFAOYSA-N 338.161 1.631 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@](O)([C@H](N)c2ccccc2O)C1 1920324350 JWXZXPZQXYPXRR-RHSMWYFYSA-N 338.404 1.390 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)C2(C)CC2)cc(OC)n1 1701627655 NEQWQMQIVRMPSY-LLVKDONJSA-N 335.404 1.476 10 10 EDCE Cc1ccnc(NC(=O)CN(C)C(=O)Cc2ccc(O)c(O)c2)c1 1557472176 UNDYVPILBZOJPX-UHFFFAOYSA-N 329.356 1.441 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc([N+](=O)[O-])c2nsnc2c1 1557084893 SACBSNMRPHOIIE-UHFFFAOYSA-N 346.324 1.941 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CC2OCCCO2)cc1C 1714227360 AOOWVNFXKKEFFT-AWEZNQCLSA-N 336.432 1.751 10 10 EDCE Cc1ncc([N+](=O)[O-])n1CC(=O)NCc1ccc2cccnc2c1O 1557124289 YZAJIUFSKMJZJC-UHFFFAOYSA-N 341.327 1.670 10 10 EDCE Cc1ccc(C(=O)NC[C@@H](O)CO)cc1-n1c(C)cc(C=O)c1C 1636700430 OHSKBRKVVXRQRX-MRXNPFEDSA-N 330.384 1.298 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(N)ccn1 1632702072 VGCBYISVWPVRIB-UHFFFAOYSA-N 349.774 1.838 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(CO)(C(F)(F)F)CC1 1648169671 MUBSJEYBMQCSFZ-UHFFFAOYSA-N 333.306 1.804 10 10 EDCE CC1(C)C(=O)NC(=O)CN1c1ccc(CN)c(Br)c1F 231840248 RXAUFRUBGPLOPI-UHFFFAOYSA-N 344.184 1.288 10 10 EDCE CNC(=O)C[C@@H](C)NC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1681194272 RUMARMMBAMQDJR-CQSZACIVSA-N 332.448 1.953 10 10 EDCE CN1/C(=C/C=C/C=C2C(=O)NC(=O)NC2=O)Sc2ccccc21 16189452 ANEVNZIIBWGVKU-CMXQFNEXSA-N 327.365 1.919 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1895031228 CFOKQUPXGSARHY-GUBZILKMSA-N 334.363 1.801 10 10 EDCE OC[C@@H]1COCC[C@H]1NCc1cc(Br)cc(F)c1O 1878773173 BERICPNYAQDWDE-BXKDBHETSA-N 334.185 1.781 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C[C@H]2OCC[C@H]21 2010388490 CDHNRJWCGJBIEF-GRYCIOLGSA-N 337.380 1.674 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)C[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010404707 BYVWXZCVHHCTBW-WOPDTQHZSA-N 339.396 1.658 10 10 EDCE C[C@H](N)c1ccc(N2CC(S(C)(=O)=O)C2)cc1Br 2034836805 AQZURBHRFSMMDY-QMMMGPOBSA-N 333.251 1.702 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCN2CCOC[C@H]12 2062403779 VVJXSCAMRVWSMO-HUUCEWRRSA-N 327.384 1.277 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)cc1Br 2178085383 FDQQPSRGDVHHJF-RULNRJAQSA-N 345.212 1.490 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(O)c(O)c2)[C@H](O)C1 1908520939 JVNFVZHMSJJGLO-IUODEOHRSA-N 338.404 1.558 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC(N=[N+]=[N-])C2)C[C@H](O)C1(C)C 1909747320 BELJYXFSDQXNTM-BONVTDFDSA-N 339.396 1.562 10 10 EDCE COc1ccc(N2C[C@@H](O)[C@H](O)C2(C)C)c(OC)c1Br 2234900863 ZQCDYVFTOWCCGL-RNCFNFMXSA-N 346.221 1.787 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)C[C@H]3C2)cc1Br 2236980681 RNUAVDCAECKPJW-BAESOJJISA-N 341.249 1.476 10 10 EDCE Cn1nc(Br)c(CNCc2cc(F)cc(F)c2O)n1 2226965861 JYJIOISQVCROMN-UHFFFAOYSA-N 333.136 1.851 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC(CCCO)C3)c(Br)cc21 2239131504 UNZUQDODYJTRBS-CYBMUJFWSA-N 340.221 1.610 10 10 EDCE COc1cccc(C=C2SC(=S)NC2=O)c1OCC(=O)O 2296820931 WXPSMJWFXALCSG-UHFFFAOYSA-N 325.367 1.647 10 10 EDCE CCN1CC[C@H](CNC(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2297505928 ZHNZPHURDNWIOD-GOSISDBHSA-N 343.471 1.994 10 10 EDCE COc1ccc([N+](=O)[O-])cc1C=C1SC(N2CCOCC2)=NC1=O 2313574019 BENSUAHAVNSMPG-UHFFFAOYSA-N 349.368 1.906 10 10 EDCE CC(=O)N[C@@H]1CCCN(C(=O)NCc2ccc(N(C)C)c(F)c2)C1 57647295 JCQNDXDEWCUAQP-CQSZACIVSA-N 336.411 1.702 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN(C2CC2)CC1 105179609 HNTQLJBDILIWCR-UHFFFAOYSA-N 344.459 1.513 10 10 EDCE CNC(=O)[C@@H](NC(=O)/C=C/c1ccc(N2CCOCC2)cc1)C(C)C 178838282 CIJYKEAVZUQRFE-YOCVDRLZSA-N 345.443 1.423 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@]34CCOC4)C2)cc1 1347297955 MTRCFHRIEPHZJB-KDOFPFPSSA-N 331.416 1.848 10 10 EDCE CN1C(=O)[C@H](N)c2ccc(N3CCN(Cc4ccccc4)CC3)cc21 301639364 DZNGJWWUZHIGAI-LJQANCHMSA-N 336.439 1.985 10 10 EDCE Nc1c(NCc2ccccc2O)c(O)nc(=O)n1Cc1ccccc1 301226501 LJWNESBZWADPHL-UHFFFAOYSA-N 338.367 1.897 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)C[C@H]1CCOC1 1276010670 ISGWXGCBCCURNW-QWHCGFSZSA-N 347.419 1.936 10 10 EDCE O=C1NCCN(C(=O)c2cccc(O)c2O)[C@@H]1c1ccccc1F 375916752 CFELOKDDBZJZBQ-CQSZACIVSA-N 330.315 1.550 10 10 EDCE Cc1cc(CCNCCC(=O)NC(N)=O)c(C)n1-c1ccccc1 800717586 MWBALDAAGNOCDW-UHFFFAOYSA-N 328.416 1.811 10 10 EDCE Nc1ccc(OCCCOn2c(=O)c(=O)oc3ccc(N)cc32)cc1 821296781 GBEUKFABKWGHHI-UHFFFAOYSA-N 343.339 1.017 10 10 EDCE COC(=O)[C@]12C[C@H](N)C[C@H]1CN(C/C=C\c1ccc(N(C)C)cc1)C2 903977379 QARQEVJFYVBLSY-DNCZNXPVSA-N 343.471 1.978 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N(C)[C@H]1CCN2CCO[C@H]1C2 838480597 YUUNNDVEWINWCY-ROUUACIJSA-N 346.475 1.676 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)N[C@](C)(CCF)C3=O)C2)cc1 849356087 CCDKOLPGDYCBPY-CXAGYDPISA-N 335.379 1.944 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NC[C@](C)(CO)OC)cc1F 847313583 JQIWFCZDRJZHOL-QGZVFWFLSA-N 341.427 1.869 10 10 EDCE COc1cc(Br)cc([C@H](C)NCCOCCO)c1O 848519659 OHLDZNANOHWLSM-VIFPVBQESA-N 334.210 1.823 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 926641085 QSKGJOHJHMGTTA-PVAVHDDUSA-N 333.432 1.698 10 10 EDCE Cc1cc(CO)oc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856213308 HFLSKMQDUMJBIP-UHFFFAOYSA-N 344.411 1.971 10 10 EDCE COC(=O)[C@@H]1CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 854301157 JKPYDBVRIQDDMM-ZIAGYGMSSA-N 347.415 1.478 10 10 EDCE CC[C@@H](NCC[C@@H]1CNCCS1(=O)=O)c1ccc(F)cc1O 925789245 RFAJFPSGRCUEOO-TZMCWYRMSA-N 330.425 1.349 10 10 EDCE CC(C)[C@@H](C(=O)NCc1c(O)cccc1F)N1CCCS1(=O)=O 928706552 WWZIRAJPMSKKJF-AWEZNQCLSA-N 344.408 1.208 10 10 EDCE Cc1nccc(N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)n1 758972756 GCPDBBJBYVBEAE-INIZCTEOSA-N 342.399 1.239 10 10 EDCE CO[C@H](CS(=O)(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCOC1 867691206 RQLSZBOTQHGTDZ-IUODEOHRSA-N 327.402 1.089 10 10 EDCE COC(=O)[C@H](C[C@H]1CCCO1)NCc1ccc(N2CCOCC2)cc1 895865581 SZUFYVQZTXWGFY-MSOLQXFVSA-N 348.443 1.724 10 10 EDCE COC(=O)c1cc(S(=O)(=O)Nc2ccc(O)c(OC)c2)oc1C 797820288 PDLSDLJWDMDZLQ-UHFFFAOYSA-N 341.341 1.890 10 10 EDCE Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1c(Cl)cnn1C 797446877 FXUWSWYGQOXVQY-UHFFFAOYSA-N 342.852 1.926 10 10 EDCE Cc1ccc(C(=O)N2CCC3(CCC3)S(=O)(=O)CC2)c(O)c1O 1161952856 GLNKZRYZIGBAIT-UHFFFAOYSA-N 339.413 1.590 10 10 EDCE O=C(C(=O)N1CC[C@@H]([C@@H]2CCOC2)C1)N1Cc2cccc(O)c2C1 1329845029 YTFPYLIAUIBIGB-TZMCWYRMSA-N 330.384 1.119 10 10 EDCE CC[C@H](NC(=O)C(=O)N1Cc2cccc(O)c2C1)[C@H]1CCCOC1 1334671318 SOPRIZRKBDLDPN-ZFWWWQNUSA-N 332.400 1.556 10 10 EDCE CON(CCNC(=O)OC(C)(C)C)C(=O)c1cccc(O)c1O 1637642585 RTWLXMCNMIFPKX-UHFFFAOYSA-N 326.349 1.626 10 10 EDCE C[C@H]1CCOCCN1C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1262219221 IJGRCILXRNWRQN-HNNXBMFYSA-N 345.443 1.540 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)C(=O)NCC3CC3)C2)cc1C 1267021699 RVNRGGURODZTKN-INIZCTEOSA-N 345.443 1.220 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)c(Br)c1 2133921065 UVZSAKSSNQZJLM-HBEIAFGSSA-N 328.206 1.404 10 10 EDCE NC(=O)C[C@@H]1COCCN1C(=O)c1cc2cc(O)c(O)cc2s1 1299467478 XGIPINBEKYKBQX-SECBINFHSA-N 336.369 1.029 10 10 EDCE C[C@H](O)[C@@H](NC(=O)C1CCCC1)C(=O)N(C)Cc1ccccc1O 1629954716 ALPJHLLWTNQELH-BLLLJJGKSA-N 334.416 1.406 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)[C@H]2CCCO2)cc1C 1717045087 ZNTFCDOOHYBFKM-QGZVFWFLSA-N 336.432 1.093 10 10 EDCE C[C@@H](CC(=O)NCc1c(O)cccc1O)NC(=O)c1ccccc1 1558534956 ZELHHLJMBJRFHT-LBPRGKRZSA-N 328.368 1.923 10 10 EDCE COc1cc([C@@H](C)NC(=O)c2cccc(O)c2O)ccc1OCCO 1566394591 SPGMNYOHLLKZEV-LLVKDONJSA-N 347.367 1.969 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]([C@H]1CCCO1)C1(CO)CCC1 1639166780 FPJONNMJYPXUBR-WBVHZDCISA-N 335.400 1.467 10 10 EDCE Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NCc1c(O)cccc1F 1646028482 IUOJWGALRGVJNA-UHFFFAOYSA-N 342.348 1.319 10 10 EDCE CCn1nncc1C(=O)N[C@H](C)CCNCc1ccc(OC)c(C)c1 1668050401 UWUMXNFOSJXCKT-CQSZACIVSA-N 345.447 1.913 10 10 EDCE CS(=O)(=O)Nc1ccccc1C(=O)NCc1cc(O)ccc1O 1593869822 XDIIDOFBXGFQHH-UHFFFAOYSA-N 336.369 1.399 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)c2cncs2)cc1 1757927070 IXHIWCMTSKUYMY-UHFFFAOYSA-N 346.372 1.465 10 10 EDCE CN(C)C[C@@H]1C[C@@H](O)CN1c1ccc(CN)c(Br)c1F 231840228 FNJYBHBMNSXFFY-WDEREUQCSA-N 346.244 1.548 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)COC(C)C 1597566866 CKRMLIHPTMJNNA-UHFFFAOYSA-N 329.780 1.972 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@@H]2CCCN2C2CCOCC2)c1 155367040 AKFHMTAXKRWRQW-INIZCTEOSA-N 334.416 1.660 10 10 EDCE Nc1ccc(OCCN2CCC[C@@H](NC(=O)c3ccncc3)C2)cc1 586058689 FPHYEJIZFARGAJ-QGZVFWFLSA-N 340.427 1.937 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)O)[C@@H](c2cc(O)c(O)c(O)c2)C1 1951592402 ODNHALMTKQYCFX-NXEZZACHSA-N 339.344 1.839 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@@H]2[C@H](O)CO)cc1Br 2146335821 ZNSWPFXGXQAXPV-CUOATXAZSA-N 345.237 1.027 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@H]2[C@@H](O)CO)cc1Br 2146330648 ZNSWPFXGXQAXPV-IIMNLJJBSA-N 345.237 1.027 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@](C)(O)C3)c(Br)cc21 300174144 YMWCWGIQROPVML-JSGCOSHPSA-N 340.221 1.623 10 10 EDCE O=S(=O)(Nc1cc(Cl)c(O)c(Cl)c1)N1CCC[C@@H]1CO 2161898525 CGNBHEFRHNUMHB-MRVPVSSYSA-N 341.216 1.812 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C[C@H]1CO 708575208 BMPFGMYPAIFJBX-BFHDXFOESA-N 341.205 1.499 10 10 EDCE CN1C[C@H](CNCc2cc(Br)cc(F)c2O)CC1=O 723590742 XRHLZTBKZYDIGV-QMMMGPOBSA-N 331.185 1.862 10 10 EDCE CN[C@H](C)c1ccc(N2CCOC[C@@H](O)C2)cc1Br 399857160 KDALETWVIPWDEJ-PWSUYJOCSA-N 329.238 1.927 10 10 EDCE CNCc1ccc(N2CCN3C(=O)OC[C@H]3C2)c(Br)c1 2170717623 QGSRTYJKCUYJDC-LLVKDONJSA-N 340.221 1.809 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@H]3[C@@H](C)O)c(Br)cc21 2182238077 CBKSIHKHTDBMTH-QUUYKZCZSA-N 340.221 1.621 10 10 EDCE O=C(N[C@@]12C[C@H]1CN(Cc1ccccc1)C2)c1cc(O)c(O)c(O)c1 2068618313 PISYNUICUQHCIX-IFXJQAMLSA-N 340.379 1.808 10 10 EDCE Cc1cccc(CNC(=O)[C@@H](N)CC(=O)OCc2ccccc2)c1O 2084052408 LLJDYIDCPARKNZ-INIZCTEOSA-N 342.395 1.778 10 10 EDCE Nc1ccc(OC[C@H](O)CN2CC=C(Br)CC2)cc1 2092393423 QICXEBSNIHSYFA-CYBMUJFWSA-N 327.222 1.993 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213583571 TZWKPMIUBKWDBF-ZIBATOQPSA-N 339.396 1.706 10 10 EDCE COc1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)c(OC)c1Br 2234896380 BAUPNWCEISUMEH-IEBDPFPHSA-N 344.205 1.662 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](O)C[C@@H]2CN)c1O 2227741038 JVUSGMSMQXGWPV-RKDXNWHRSA-N 331.210 1.057 10 10 EDCE NCc1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2228398872 CTRCFHRSNPACPL-TXEJJXNPSA-N 329.238 1.335 10 10 EDCE O=C1NCCN(C(=O)C=Cc2ccc(O)c(O)c2)[C@@H]1c1ccccc1 2307986937 OSHXSCXXJDLUPP-GOSISDBHSA-N 338.363 1.811 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2336551609 ANQGACYVPZEIQE-PELKAZGASA-N 349.225 1.280 10 10 EDCE Cc1ccc(CN2CC(=O)N[C@H]3CC[C@@H]32)c(O)c1Br 2352652058 OLGHSWJRSBBZMM-QWRGUYRKSA-N 325.206 1.926 10 10 EDCE Cc1ccc(C(=O)NC[C@@H](CC(C)C)N2CCOCC2)c(O)c1O 177667340 YPLWNSITTNLMHC-CQSZACIVSA-N 336.432 1.883 10 10 EDCE C[C@H](O)CCCN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2361180311 CZEDYARJICROEL-SDBXPKJASA-N 342.237 1.998 10 10 EDCE CC(C)C(=O)N1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 137246139 PRTKDEIFYMXGQM-UHFFFAOYSA-N 346.475 1.169 10 10 EDCE Cn1cc(/C=C2\C(=O)Nc3ccc(S(N)(=O)=O)cc32)cc1C#N 190257223 PSTQHTYOFPSELE-ACAGNQJTSA-N 328.353 1.037 10 10 EDCE Cc1nc([C@H]2COCCN2C(=O)/C=C/c2ccc(O)c(O)c2)no1 369461099 HUMNUISJJDUNCW-OGOUPESXSA-N 331.328 1.403 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc(Br)cc(N(C)C)c1 814570084 JJGUYDUOWBMXKA-UHFFFAOYSA-N 328.162 1.830 10 10 EDCE COC(=O)[C@@H]1CC[C@@H]1C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 823776424 PEUCKFORFJYMBX-RRQGHBQHSA-N 346.427 1.837 10 10 EDCE CO[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@H]1C 839219853 VDMUSQLOTFHQFX-RHSMWYFYSA-N 347.459 1.594 10 10 EDCE CN1CCC[C@H](C(=O)NCc2cc(Br)ccc2O)C1=O 831932825 JPBUCVSIEFXVES-LLVKDONJSA-N 341.205 1.639 10 10 EDCE CCc1cccc(CN[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)c1O 848910414 IMPNFBLEGZGGIV-OAHLLOKOSA-N 341.477 1.315 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1C[C@@]12CCCN(C(=O)OC(C)(C)C)C2 848826811 QZKJXAUFHAUPFG-SJKOYZFVSA-N 339.388 1.725 10 10 EDCE COCCn1cc(S(=O)(=O)N[C@@H](C)c2ccccc2O)cn1 867833903 GUFWZGIEQRVTMI-NSHDSACASA-N 325.390 1.275 10 10 EDCE COc1ccc(N2CCN(Cc3nc(C)cc(O)n3)CC2)cc1F 761885150 AECZYFMPQKBMLM-UHFFFAOYSA-N 332.379 1.961 10 10 EDCE Cc1ccc([C@@H](C)NC[C@@]23COCCN2C(=O)COC3)c(O)c1C 866551835 CRSDPLUSPKYHBD-KDOFPFPSSA-N 334.416 1.287 10 10 EDCE CC[C@H](NC(=O)N[C@@H](C)c1ccccc1O)C(=O)N1CCOCC1 868381713 VUTSQYWMOGDGEJ-JSGCOSHPSA-N 335.404 1.390 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@H]1C(C)C 1116669153 IDHSPIXXUVSCBX-MJBXVCDLSA-N 335.400 1.980 10 10 EDCE CCc1nc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)no1 775377384 JBPIHNKXGHJDHX-UHFFFAOYSA-N 330.388 1.993 10 10 EDCE O=C(COC(=O)c1ccc(-n2cncn2)cc1)c1ccc(O)c(O)c1 782600919 WNCQZULYVTXDOX-UHFFFAOYSA-N 339.307 1.718 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCn2c(O)nnc2C1 894467043 UCDISGTYKMEBKB-UHFFFAOYSA-N 343.156 1.607 10 10 EDCE COC(=O)c1c(CN2CC[C@@H](NC(N)=O)C2)c2cc(F)ccc2n1C 894094003 IEEPKZLAJLIZMF-LLVKDONJSA-N 348.378 1.347 10 10 EDCE C[C@H](O)c1ccc(N(C)CC(C)(CO)CO)cc1Br 689301438 IOVNXZQBPUTZND-JTQLQIEISA-N 332.238 1.930 10 10 EDCE CCC1(CC)CN(C(=O)c2cccc(O)c2O)CCS1(=O)=O 790942535 HOZOCXZSNYSKNC-UHFFFAOYSA-N 327.402 1.527 10 10 EDCE O=C(COc1ccc2c(c1)CCC(=O)N2)NCc1c(O)cccc1O 1304051626 YWJYKSGRXRZDAC-UHFFFAOYSA-N 342.351 1.678 10 10 EDCE C[C@H](Sc1nnnn1C1CC1)C(=O)NCc1c(O)cccc1O 1304050081 IILQXYGDXODOMH-QMMMGPOBSA-N 335.389 1.216 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@]2(C)CCNC(=O)C2)cc1C 1267390675 SFNMWPQFGAKJFK-LJQANCHMSA-N 347.459 1.468 10 10 EDCE CCn1cc(C(=O)NC[C@@H](CO)NCc2ccc(OC)c(C)c2)cn1 1278053947 MHVPHKUDNDHITR-INIZCTEOSA-N 346.431 1.101 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC2(CNC(=O)CCCF)CC2)cc1 1358684901 XYCANDKOLMHZOQ-UHFFFAOYSA-N 349.366 1.977 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1C[C@H]1CC)NC(=O)c1cc(OC)nc(OC)c1 1356927174 DCKQSFFQUVYLGE-MRVWCRGKSA-N 349.431 1.770 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@](C)(O)C2)c(Br)c1 2136835866 ZSOHQAGAQZGDCM-BIGNPOOSSA-N 329.238 1.791 10 10 EDCE COC(=O)c1ccc(CC(=O)NCCc2ccc(O)c(O)c2)cn1 1545669355 WTTIIBCHLWQCNN-UHFFFAOYSA-N 330.340 1.181 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)c2ncn(C)n2)cc1C 1700393985 HMLQREYRKGMOAE-STQMWFEESA-N 331.420 1.429 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cc(OC)n(C)n2)cc1C 1715986509 JTBXPACHFKMZMO-ZDUSSCGKSA-N 346.431 1.654 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CCCn3ncnc32)cc1 1557355111 CNYKPTHULYSRMB-INIZCTEOSA-N 343.431 1.759 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1CN(C)CCO1 1497367886 UOHVUJVGPDJNCZ-GOSISDBHSA-N 349.475 1.272 10 10 EDCE O=C1NCCN(C(=O)Cc2ccc(O)c(O)c2)[C@H]1c1ccccc1F 1631440314 LLCRJDTXVDPSRW-KRWDZBQOSA-N 344.342 1.479 10 10 EDCE NC(=O)C1(NC(=O)c2cc3cc(O)c(O)cc3s2)CCOCC1 1640027223 LEUNCEMHOJTMMY-UHFFFAOYSA-N 336.369 1.077 10 10 EDCE C[C@@H](NC(=O)[C@@H](NC(=O)C1CCCC1)[C@@H](C)O)c1ccccc1O 1643738625 JVHGYUFJHDHRKR-HSMVNMDESA-N 334.416 1.625 10 10 EDCE CC[C@@H](NC(C)=O)C(=O)NC[C@H](C)NCc1ccc(OC)c(C)c1 1731626062 YUEOEDSMTKQHLJ-XJKSGUPXSA-N 335.448 1.513 10 10 EDCE O=C1CCCN1C[C@@H]1CCCCN1C(=O)Cc1ccc(O)c(O)c1 1643571308 GLOGMZPUVIGXSR-AWEZNQCLSA-N 332.400 1.644 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CCCN(CC(F)(F)F)C1 1647270239 PAQVPZWUFKFHFE-JTQLQIEISA-N 332.322 1.988 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H](O)COc1cccc(F)c1 1595313229 GVHIBPWURFJHGY-CYBMUJFWSA-N 335.331 1.336 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H](NCc2cccc(O)c2O)C1 1946804113 WKKXVUDHIPKIIP-CYBMUJFWSA-N 338.404 1.823 10 10 EDCE O=C(O)[C@@H]1C[C@H](NCc2ccc(Br)cc2O)CCO1 1880020120 IXPMYYNSZBXQCS-PWSUYJOCSA-N 330.178 1.877 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](C(=O)NCCCN=[N+]=[N-])[C@H]1CCOC1 1964885300 YVEVXYQKHRNFLS-NWDGAFQWSA-N 341.412 1.980 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CCOC[C@H]1NC(=O)OC(C)(C)C 1985100853 JVUKRTNLIMRBKC-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 1985100481 WXVBKYCYAWQGNC-MNOVXSKESA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C(C)(C)O 1987681089 OHLKKXVVUKZXNN-NXEZZACHSA-N 327.385 1.562 10 10 EDCE C[C@H]1CCN(Cc2cc(N)ccc2O)C[C@H]1NC(=O)C(F)(F)F 1999433473 AUKHTJQGYKSDIB-JOYOIKCWSA-N 331.338 1.863 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@H]2OCC[C@@H]2N1C(=O)OC(C)(C)C 2010389790 UZGBZLKKBLXWIH-SDDRHHMPSA-N 339.396 1.922 10 10 EDCE CN(C)C(=O)CN(Cc1ccccc1)c1ccc2c(c1)NC(=O)[C@@H]2N 2034783832 UEDBTVDLKGWVCW-GOSISDBHSA-N 338.411 1.733 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H](O)[C@H]3C4)c(Br)cc21 2177159343 LRDICHARJIJKQR-JRSMDPTOSA-N 338.205 1.361 10 10 EDCE O=C(O)[C@@H]1COCCN(Cc2c(O)cccc2Br)C1 706628722 XMKUYVMKYMWOCA-VIFPVBQESA-N 330.178 1.688 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@]3(O)CCc4ccccc43)c2n1 2062431360 HXSAHVUVQXXOME-GOSISDBHSA-N 338.367 1.307 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H]3[C@@H]3CCC[C@H]3O)c2n1 2063504245 QFTJUHUAKROPTB-IACUBPJLSA-N 330.388 1.509 10 10 EDCE COc1cccc(O)c1[C@H](C)NC[C@H]1CCN(S(C)(=O)=O)C1 2064102613 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CCS(=O)(=O)c1ccc(C(=O)NCc2ccc(O)cc2O)cc1 1162277920 DELPVUKXINGPTN-UHFFFAOYSA-N 335.381 1.821 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2occc2C)cc1C 1320204735 ZAXQSFFYSJFREX-OAHLLOKOSA-N 332.400 1.786 10 10 EDCE CCS(=O)(=O)N(C)CC(=O)NCc1c(O)ccc2ccccc12 1179032207 AHSPKWZVJZQRTG-UHFFFAOYSA-N 336.413 1.443 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC[C@@]34CCOC4)CC2)cc1 1325414610 QYSDYEVPNMONQN-IBGZPJMESA-N 345.443 1.209 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)CNC(C)=O)[C@H]2C)cc1C 1507271416 OHNMEJVRVVOVDO-BBRMVZONSA-N 333.432 1.219 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2COC3(CCOCC3)O2)cc1 1295731905 MCRJFONKPIIMGH-ZDUSSCGKSA-N 348.359 1.501 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cscn2)cc1C 1700934638 JLSFFKSIAGWCQV-AWEZNQCLSA-N 349.456 1.683 10 10 EDCE CN(C)c1ccc(CNC(=O)c2coc(CS(C)(=O)=O)n2)cc1 1624402088 ZIYGCDHPUMRTMC-UHFFFAOYSA-N 337.401 1.215 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N(CCO)Cc1cccnc1Cl 1626051909 FAIFYJNDJRDVEQ-UHFFFAOYSA-N 336.775 1.710 10 10 EDCE 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CN(C)c1ccc([C@H](N)CNC(=O)c2cc3c(cn2)OCCO3)cc1 832267320 QKZQCPGXLUWPDX-CQSZACIVSA-N 342.399 1.349 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCC[C@@](O)(CO)C2)cc1 837724491 IDBJFTMEVKQHBG-SFHVURJKSA-N 335.448 1.562 10 10 EDCE Cn1ccnc(N2CCN(Cc3cc4c(cc3O)CCC4)CC2)c1=O 744441888 YUGDMEGYMCPBMY-UHFFFAOYSA-N 340.427 1.297 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)Cn3ccnc3)C2)cc1 849225067 NATSWRIIQPVZQJ-CABCVRRESA-N 343.431 1.858 10 10 EDCE CCOC(=O)[C@H](CC1(OC)CCC1)NC(=O)c1cccc(O)c1O 846510583 LEYGNUSZCSWTJL-LBPRGKRZSA-N 337.372 1.719 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(C=O)n3C)C2)cc1 855225620 PDPGNQZCNDMZGM-CYBMUJFWSA-N 327.384 1.855 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H](C)C[C@@H](CO)C3)C2)cc1 854296869 HEGXBIGMZHUKCR-OAGGEKHMSA-N 347.459 1.934 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC4(COC4)C3)C2)cc1 854188032 VCLYXGWKNPWYEK-HNNXBMFYSA-N 345.443 1.953 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC(=O)CC[C@@H]3C)nc12 932873208 CZZZRLLOBABEDH-JTQLQIEISA-N 332.360 1.165 10 10 EDCE Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1cnc(O)s1 866797019 NFIZSVRYLZWVMZ-UHFFFAOYSA-N 327.431 1.702 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCc2ncc([N+](=O)[O-])cc2C1 779544380 MDFFCFLBYGAPAV-DUXPYHPUSA-N 341.323 1.999 10 10 EDCE C[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)[C@H]1CN(C)CCN1C 896534849 WQKVKMULVLYNNR-ZYHUDNBSSA-N 349.456 1.677 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2C[C@@H](C)Cn3nccc32)c1 893889415 AAGUYTNAMLSPGD-AAOUONPWSA-N 325.372 1.334 10 10 EDCE O=C(NCc1ccccc1O)C(=O)Nc1cnc(CC2CC2)nc1 792972361 BRHVVYPSMCTBDN-UHFFFAOYSA-N 326.356 1.390 10 10 EDCE Cn1nnnc1-c1ccc(NC(=O)C2=S=c3ccsc3=C2)cc1 1131222004 DBATUZNIIUDZNI-UHFFFAOYSA-N 341.421 1.528 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2nc(-c3ccccn3)n[nH]2)c1 1228310525 VPFCZULCCKXNEE-UHFFFAOYSA-N 338.371 1.880 10 10 EDCE CN(CCN(C)C1COC1)c1ccc(CO)cc1Br 2116482538 PGOIQJAFLJLJMQ-UHFFFAOYSA-N 329.238 1.708 10 10 EDCE CO[C@@H](C)CN[C@H]1C[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1316623569 DMHCKCUIUFKOSY-SLEUVZQESA-N 347.419 1.982 10 10 EDCE C[C@H]1CN(c2nnc(-c3sccc3O)n2CC2CC2)CC(=O)N1C 1348191712 NORIZBJKEGFTST-JTQLQIEISA-N 347.444 1.789 10 10 EDCE Cc1cc(CCNC(=O)C(=O)N2CC(F)C2)c(C)n1-c1ccccc1 1351313920 LAVMOZBFZYKGKD-UHFFFAOYSA-N 343.402 1.933 10 10 EDCE CCCOCC(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1358520994 NGMNKBGBDKSMTG-NSHDSACASA-N 349.391 1.510 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1COC[C@@H]1NCc1ccc(O)c(O)c1 1948517772 ILKWJXMJOLAFMK-OLZOCXBDSA-N 338.404 1.727 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)C[C@H]2CO)cc1Br 2136089148 XFYQCWKKMLWROW-USWWRNFRSA-N 329.238 1.791 10 10 EDCE COc1ccc(CNC2CC(N(C)C(=O)C(C)(C)C(N)=O)C2)cc1C 1701019804 REXUNTVRACIPTE-UHFFFAOYSA-N 347.459 1.594 10 10 EDCE CN(C)C(=O)c1cccc(CNC(=O)Cc2ccc(O)c(O)c2)c1 1540847911 SXVSBJSMUWSSFD-UHFFFAOYSA-N 328.368 1.659 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1ccon1 1566849609 NUJXLKRQMBQCRQ-UHFFFAOYSA-N 338.747 1.778 10 10 EDCE COC(=O)c1ccc2c(c1)N(C(=O)c1ccoc1CC(N)=O)CC2 1637349345 IBMZCEFHWRWNSV-UHFFFAOYSA-N 328.324 1.297 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1C(=O)NCc1c(O)cccc1O 1635850036 FLVXCVBWCUBQRJ-QWRGUYRKSA-N 336.388 1.875 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C2(N(C)C)CCC2)cc1C 1734369038 JTNHKHOXAUHOFG-INIZCTEOSA-N 349.475 1.055 10 10 EDCE CCC(=O)NC[C@@H]1CCN(Cc2nnnn2-c2ccc(OC)cc2)C1 1731840513 DPBQTDNTFKOWPG-ZDUSSCGKSA-N 344.419 1.019 10 10 EDCE O=C(CCC(=O)Nc1nnc(C2CC2)o1)NCc1c(O)cccc1O 1647269693 JNYJSKWGLVYRTM-UHFFFAOYSA-N 346.343 1.393 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)NCc1ccco1 1584130108 KNPORPYVHTYJRD-JTQLQIEISA-N 343.343 1.877 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H]2C[C@H]2C(N)=O)cc1C 1668215289 ZUBXRRPMHHVTNN-YUELXQCFSA-N 333.432 1.109 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)Cc2ncc[nH]2)cc1C 1674746407 BLZOGDZPCVYTQI-KGLIPLIRSA-N 330.432 1.952 10 10 EDCE CC1=NN(c2ccccc2)C(=O)/C1=C(\C)NCCCN1CCOCC1 13519838 PHJGTAZNPLUVCX-OBGWFSINSA-N 342.443 1.995 10 10 EDCE CC(C)[C@H](O)CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 154178951 AQURKNSKHQLPOF-RHSMWYFYSA-N 335.448 1.900 10 10 EDCE CC1(C)CC(NC(=O)c2nnn(-c3ccc(N)cc3)n2)CC(C)(C)N1 1857878537 GJUIYGYBMATXSC-UHFFFAOYSA-N 343.435 1.284 10 10 EDCE COc1ccc(Br)c(CNC[C@](C)(O)CCO)c1O 1966083751 HXUQUVFKDUDIED-CYBMUJFWSA-N 334.210 1.386 10 10 EDCE N=C(N)c1ccc(S(=O)(=O)CCSc2nccs2)cc1 163316208 MZWKFZHJDXSSDQ-UHFFFAOYSA-N 327.456 1.993 10 10 EDCE CN1CCc2cc([C@@]3(O)COC[C@@H]3NC(=O)OC(C)(C)C)ccc21 1999512270 NZRBFNAFCHBEAX-YJBOKZPZSA-N 334.416 1.790 10 10 EDCE CN1CC2(C1)CN(c1cc3c(cc1Br)[C@@H](N)C(=O)N3)C2 2152270445 ONAQNKGEFJJSLQ-GFCCVEGCSA-N 337.221 1.153 10 10 EDCE COC[C@@](C)(NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 2010266109 ZIFJHWPIXHWWJP-QGZVFWFLSA-N 338.404 1.938 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)CCOC1 2010406708 XZHWIXBEYWVVIM-XHDPSFHLSA-N 339.396 1.972 10 10 EDCE CS(=O)(=O)c1cnn(Cc2cccc(Br)c2O)c1 2070206159 JYXXYBJMNPGYJG-UHFFFAOYSA-N 331.191 1.803 10 10 EDCE COc1ccc([C@H](C)n2nc(C3(C)CC3)c(C(N)=O)c2N)c(O)c1 2080042357 HCAGYMJGIMLCSE-VIFPVBQESA-N 330.388 1.939 10 10 EDCE C[C@@H]1C[C@H]2CN(c3ccc(CN)c(Br)c3)CCN2C1=O 2181290294 UNGHWFCIRRLOBD-MFKMUULPSA-N 338.249 1.965 10 10 EDCE NCc1ccc(N2CC[C@]3(O)CCOC[C@H]3C2)c(Br)c1 2194550427 FQVNPOHXYRSNIQ-DOMZBBRYSA-N 341.249 1.886 10 10 EDCE NC(=O)CO[C@@H]1CCN(c2ccc(CO)c(Br)c2)C1 2089139768 PFWNAKOTCFUHTB-LLVKDONJSA-N 329.194 1.022 10 10 EDCE C[C@](O)(CO)[C@H]1CCN(c2cc(Br)c(CN)cc2F)C1 2202841336 SUMAWKFOVTWPFG-HZMBPMFUSA-N 347.228 1.617 10 10 EDCE CCN(CC)CCNC=C1C(=O)NC(=O)N(c2ccc(F)cc2)C1=O 2297059668 AGQVHIPBCKTRNS-UHFFFAOYSA-N 348.378 1.224 10 10 EDCE Cc1ccc(CNC(=O)c2n[nH]cc2N)c(O)c1Br 2352942532 GOXYXLKTIMDYMP-UHFFFAOYSA-N 325.166 1.698 10 10 EDCE Cc1ccc(CN2C[C@@H](O)C[C@]2(C)CO)c(O)c1Br 2352944514 JAWWLTGHOMMMQW-SMDDNHRTSA-N 330.222 1.781 10 10 EDCE CCN(CC(=O)NC(C)C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 7355681 DBNWWWRWSHRMLY-UHFFFAOYSA-N 348.491 1.558 10 10 EDCE Nc1ccc(CCNS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1 180880569 SPYUNQCXDVXBEA-UHFFFAOYSA-N 339.348 1.837 10 10 EDCE Cc1cc(C(=O)N2CC[C@H](CO)[C@@H](O)C2)c(C)n1-c1ccccc1 191981351 HXZPFIRNAFQRQT-QAPCUYQASA-N 328.412 1.909 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)Cc2ccccc2C(N)=O)c1 190923582 ZPIDIQZLJBPZJP-LLVKDONJSA-N 328.368 1.920 10 10 EDCE CC(C)(C)OC(=O)NCCCNC(=O)c1c(F)ccc(O)c1O 276632284 SYLXCXGNTBBRRG-UHFFFAOYSA-N 328.340 1.882 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCO[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1 274390642 KPXVKMLUTPZMKS-RCFWFJCLSA-N 348.355 1.777 10 10 EDCE COc1cccc(CNC(=O)[C@]23[C@H]4C(=O)[C@H]5[C@H]6C[C@@H]([C@@H]52)[C@@H]3[C@H]64)c1O 800518887 JOGATLLCNPBQPL-BCLHILHHSA-N 325.364 1.344 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](C)SCC(=O)Nc1ccc(C)cc1 808494914 SSGQSAZOUMSTIF-GFCCVEGCSA-N 337.397 1.757 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)C[C@@H](C)c2nn[nH]n2)c([N+](=O)[O-])c1 588459572 SWZUKVBFKIVYPF-ONRRBMGISA-N 346.347 1.534 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1C[C@H]2CC[C@H]1[C@@H]1CNC[C@H]21 903962848 LLZRAECVRPCADG-AFYVEPGGSA-N 327.472 1.953 10 10 EDCE Cc1cc(C(=O)CN2CCOC[C@@H](O)C2)c(C)n1-c1ccc(F)cn1 830638452 FREARZNNSQFNCX-HNNXBMFYSA-N 347.390 1.504 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)[C@H]2CCCc3n[nH]cc32)cc1 843299533 XJVZYFJGJPVCJZ-GOEBONIOSA-N 327.432 1.712 10 10 EDCE COC(=O)[C@@H]1CN(C)CCN(Cc2cc(Cl)cc(C)c2O)C1 840957393 LLRZJMCGYGCLAQ-CYBMUJFWSA-N 326.824 1.891 10 10 EDCE CCOC(=O)[C@H]1CN(Cc2cc3c(cc2O)CCC3)CC12COC2 840099528 QVEKREIWPDKCDD-MRXNPFEDSA-N 331.412 1.892 10 10 EDCE CC1(C)CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCN1 841729416 FXMLRHUHWAJGPZ-UHFFFAOYSA-N 332.448 1.417 10 10 EDCE CC[C@H](NC(=O)C(=O)NCCc1ccc(N)cc1)[C@@H]1CCCCO1 848613516 JULRZIUFSQMXTL-HOTGVXAUSA-N 333.432 1.391 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCOCCF)C2)cc1 852450438 MIOTUFFHHPBANK-ZDUSSCGKSA-N 325.384 1.559 10 10 EDCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C12CC(C1)C2 858642152 XRRPENNCSVMDME-UHFFFAOYSA-N 334.441 1.338 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCCn3cncn3)C2)cc1 855232093 QQFQOBSEIHKLBB-CQSZACIVSA-N 329.404 1.462 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@@H]3CCC[C@]3(CO)C2)cc1 859922244 CZDMNTIIALYESD-QFBILLFUSA-N 331.460 1.463 10 10 EDCE COC(=O)N[C@H](C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)C(C)C 855230260 FERLFWBBTQIFNZ-CJNGLKHVSA-N 349.431 1.771 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCc4n[nH]cc4C3)C2)cc1 855231497 ARRRHNXJQVZYFK-UKRRQHHQSA-N 340.427 1.918 10 10 EDCE COC(=O)[C@@H](Cc1cccc(OC)c1)NC(=O)c1cc(O)cs1 862725565 RGFSJSNZMCNKAC-CYBMUJFWSA-N 335.381 1.976 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)Nc1cnn(C)c1C1CC1 770726025 NKNUWGLMFCFNLH-UHFFFAOYSA-N 328.372 1.600 10 10 EDCE Cc1ccc(C(=O)NC[C@H](Cc2ccc(F)cc2)C(N)=O)c(O)c1O 780910150 XZTNNPIQELVKBC-LBPRGKRZSA-N 346.358 1.619 10 10 EDCE O=C(NCc1cccc(O)c1O)c1ccnc(O[C@@H]2CCOC2)c1 1153798967 ZATKQXNDNUIQQF-CYBMUJFWSA-N 330.340 1.591 10 10 EDCE CNCc1ccc(N2C[C@@H]3NC(=O)O[C@H]3C2)cc1Br 2120415257 GVBLKOYSQWAZQG-RYUDHWBXSA-N 326.194 1.466 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CC[C@@H]3C(N)=O)CC2)cc1C 1323515786 FFBSLLZTZJJAQB-GJZGRUSLSA-N 345.443 1.254 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@@](C)(C(F)F)C1 1327631725 JBYZQKJFTQWDNX-MRXNPFEDSA-N 342.342 1.233 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)Cc1nc[nH]n1 1320890217 VPCCFRLMDGUANS-UHFFFAOYSA-N 331.420 1.303 10 10 EDCE COC1(c2nccn2C)CCN(C(=O)c2cccc(O)c2O)CC1 1347606637 XXWNQKUUSWXUBZ-UHFFFAOYSA-N 331.372 1.609 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C(F)F 1284265523 CYOGZJBADFSRMT-SSDOTTSWSA-N 327.291 1.349 10 10 EDCE CC(C)(C)OC(=O)NCCOC[C@](C)(O)[C@@H](N)c1ccccc1O 1920089031 KNLDZQHRQSFONX-YOEHRIQHSA-N 340.420 1.684 10 10 EDCE COC(=O)[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CCOC1 1472399017 GMSLWJWRORUKSZ-WCQYABFASA-N 348.359 1.405 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)Cc2ccco2)cc1C 1715610168 VRAVMERSTPFUCK-HNNXBMFYSA-N 332.400 1.406 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2ccn(C)n2)cc1C 1713596365 PXRKIXJNKHBLQK-UHFFFAOYSA-N 344.459 1.918 10 10 EDCE C[C@@H](C(=O)NCc1ccc(O)cc1O)N1CSCCSC1 1557085260 GQPNZRPILVYPNY-JTQLQIEISA-N 328.459 1.800 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cnn3c(=O)cc[nH]c23)cc1F 1627045694 DLYWVPVNLDNPKE-UHFFFAOYSA-N 329.335 1.158 10 10 EDCE CN(CC(=O)NCc1cc(O)ccc1O)c1ccccc1[N+](=O)[O-] 1637125909 GUAMVPDZJUQGGM-UHFFFAOYSA-N 331.328 1.759 10 10 EDCE CS(=O)(=O)c1ccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)cn1 1634523566 GWGINIIRIYNWEA-UTCJRWHESA-N 348.380 1.226 10 10 EDCE C[C@H](CCS(C)(=O)=O)NC(=O)c1cc2cc(O)c(O)cc2s1 1630463091 OVAQUGUZZVNEAJ-MRVPVSSYSA-N 343.426 1.866 10 10 EDCE CN(CCO)CC1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1732089255 NHQXRHRPSSGKRX-UHFFFAOYSA-N 347.419 1.625 10 10 EDCE Cc1nnnn1-c1ccc(C(=O)NCc2ccc(O)cc2O)cc1 1570463305 MCHFPRXPTIAKLN-UHFFFAOYSA-N 325.328 1.312 10 10 EDCE Cn1cc(O)c(=O)cc1CNC(=O)c1cc2cc(O)c(O)cc2s1 1640283210 VLSSXAVNXYCXGO-UHFFFAOYSA-N 346.364 1.647 10 10 EDCE O=C(C[C@@H](O)C(Cl)(Cl)Cl)NCc1c(O)cccc1O 1652629050 UPPBFKQPSFQQML-SECBINFHSA-N 328.579 1.835 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C(C)(C)NC(C)=O)cc1C 1662366873 KVJYEHVEMILOQH-CYBMUJFWSA-N 335.448 1.513 10 10 EDCE CNC(=O)C[C@H](C)NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1672798485 DLUKHVZXHPUUPR-AWEZNQCLSA-N 348.447 1.189 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 1699646892 GMHMMVHJANERMA-HUUCEWRRSA-N 346.427 1.551 10 10 EDCE CCNCc1ccc(N2CCN(C)C(=O)C2)c(Br)c1 233528342 XNIPSJSYIWDNOZ-UHFFFAOYSA-N 326.238 1.837 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CC[C@H]2C[C@@H]21 2003167211 MTQXAQOSNRBGMJ-MXCJQZOTSA-N 336.432 1.945 10 10 EDCE COCCC1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2152248858 QNNXZLSKSCCVOO-CYBMUJFWSA-N 340.221 1.874 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 2010403258 BLFWICGNYLPVSO-NWDGAFQWSA-N 339.396 1.924 10 10 EDCE O=C(c1cc(O)c(O)c(O)c1)N(OCc1ccccc1)C1CNC1 2015120543 UAPZSDVSKOEVDA-UHFFFAOYSA-N 330.340 1.349 10 10 EDCE Oc1cccc(Br)c1CN1CC[C@H](N2CCNCC2)C1 706843115 MOIVFGUSGSETEQ-LBPRGKRZSA-N 340.265 1.634 10 10 EDCE C[C@]1(NCc2cc(Br)cc(F)c2O)CCC(=O)NC1=O 2172836275 DTULKKOTQLJJCT-ZDUSSCGKSA-N 345.168 1.579 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@H](CO)C[C@H]32)cc1Br 2199786209 MELYCWYFVXTULB-VCTAVGKDSA-N 341.249 1.884 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C2C[C@H]3[C@@H](C2)C13C(=O)C(=O)C[C@H]1C[C@H](N)C1 2065365310 JQEPGLFBIBAYKL-PHIKCXRHSA-N 348.443 1.801 10 10 EDCE CN1CCO[C@@H]2CN(c3ccc(CN)c(Br)c3)C[C@@H]21 2097702562 IJESCCFZHJSEOU-UONOGXRCSA-N 326.238 1.427 10 10 EDCE Oc1ccc(Br)cc1CNC1CN([C@@H]2CCOC2)C1 2113046362 AWOPUXORGWJMFY-CYBMUJFWSA-N 327.222 1.717 10 10 EDCE O=C1NC(=S)SC1=CN1N=C(c2cccs2)C[C@@H]1C(=O)O 2294778288 JFACAXQFEQOQLE-SSDOTTSWSA-N 339.423 1.600 10 10 EDCE CSc1ncc(CNS(=O)(=O)C[C@H](C)CNC(C)C)s1 2284688762 LTPFJUBPEWKISM-SNVBAGLBSA-N 337.536 1.919 10 10 EDCE O=C(COC(=O)C=Cc1ccc(O)c(O)c1)Cc1ccc(O)c(O)c1 2297722553 VMNHBRAHVFOYGK-UHFFFAOYSA-N 344.319 1.877 10 10 EDCE NC(=O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2cccs2)SC1=S 2314542021 RQNURVCTBASUJR-ZETCQYMHSA-N 342.423 1.278 10 10 EDCE CCn1c(O)nnc1CNCc1cccc(Br)c1O 2351566771 WPCFTBWPFDFTPP-UHFFFAOYSA-N 327.182 1.762 10 10 EDCE Cc1ccc(CNCC[C@@H]2COC[C@@H]2O)c(O)c1Br 2352670859 KXHBBXBZISGYJZ-NEPJUHHUSA-N 330.222 1.950 10 10 EDCE COc1cccc(CNC(=O)Cn2ncc(=O)c3ccccc32)c1O 105652793 GMGFVTAOHXALOF-UHFFFAOYSA-N 339.351 1.427 10 10 EDCE CN1CCC[C@@H]1C(=O)N1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1 178146698 SUKUVSHQMXDFDH-OAHLLOKOSA-N 348.403 1.039 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCC[C@]1(C)C(N)=O 185885342 RZNIAGMQPPPJEP-LJQANCHMSA-N 346.475 1.441 10 10 EDCE CN(Cc1ccccc1)S(=O)(=O)Nc1ccc(O)cc1C(=O)O 381633388 SKZILWHLLVVUEW-UHFFFAOYSA-N 336.369 1.879 10 10 EDCE COc1ccc(N2CCN(CC(=O)Nc3ccncc3)CC2)cc1F 84866126 FHCUCJSRCAYQOV-UHFFFAOYSA-N 344.390 1.990 10 10 EDCE COC(=O)/C(=C\c1ccc2c(c1)CCN2C)CN1CCC(=O)CC1 276535840 JQQIUMSGBCWJOW-VBKFSLOCSA-N 328.412 1.900 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN3C(=O)OC[C@H]3C2)c([N+](=O)[O-])c1 374553852 HATYMAKIBGRAPI-OGOUPESXSA-N 347.327 1.422 10 10 EDCE Cc1ccc(CNCCN2C(=O)CCC2=O)c(O)c1Br 2381144279 YGNDULJWOQJPHQ-UHFFFAOYSA-N 341.205 1.702 10 10 EDCE CC(C)N(C[C@@H](C)O)C(=O)C(=O)NCCCSc1nccs1 806276838 LNFLXOKLQASSBN-LLVKDONJSA-N 345.490 1.359 10 10 EDCE CCCC(=O)NCC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 819582015 CJMUBIJZPOMYAR-CQSZACIVSA-N 333.432 1.554 10 10 EDCE CN1NN=C2C1=NCC[C@H]2C(=O)NCc1ccc(N2CCCC2)cc1 816866669 UTOSTOOOCARIMT-OAHLLOKOSA-N 340.431 1.127 10 10 EDCE COC(=O)[C@@H]1CC[C@@H]1C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 824380185 QAPCNKXXLXULNL-UHOFOFEASA-N 332.400 1.589 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@@]3(CCSC3)C2)cc1 829286175 IUKNUTWTVGMJIX-SFHVURJKSA-N 349.500 1.577 10 10 EDCE Nc1ccc(OCCCOn2c(=O)c(=O)oc3cc(O)ccc32)cc1 821297853 XYTCMRYHBWLRHQ-UHFFFAOYSA-N 344.323 1.140 10 10 EDCE N[C@H](C(=O)NCc1ccc(N2CCSCC2)cc1)C(F)(F)F 827321041 SSSFWSJEAOLHSG-GFCCVEGCSA-N 333.379 1.746 10 10 EDCE O=C(NCc1cccc(Br)c1O)C12CCN(CC1)C2 907757295 CZCPPFRUBKLKNE-UHFFFAOYSA-N 325.206 1.867 10 10 EDCE NC(=O)CCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 907192287 IQGVMWBPGVUFBW-UHFFFAOYSA-N 344.459 1.100 10 10 EDCE CN(C)c1ccc(CNCCCN2CCCS2(=O)=O)cc1F 733328666 ZGPUOJQGCINMSY-UHFFFAOYSA-N 329.441 1.407 10 10 EDCE Cc1cc(C(=O)CN2C[C@@H](O)[C@H](CO)C2)c(C)n1-c1ccc(F)cc1 839171901 LYZZIRPSOKCMPH-KBXCAEBGSA-N 346.402 1.701 10 10 EDCE COC(=O)[C@H]1CN(C)CCN(Cc2cc(Cl)cc(C)c2O)C1 840957401 LLRZJMCGYGCLAQ-ZDUSSCGKSA-N 326.824 1.891 10 10 EDCE Cn1ncc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)n1 842254526 WFHCIDROHACFIP-UHFFFAOYSA-N 335.751 1.139 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C(C)C)[C@H](C)NC(=O)OC(C)(C)C 842135769 RHJGLUVBGQYJFB-GXFFZTMASA-N 329.393 1.873 10 10 EDCE CNS(=O)(=O)CCCN(C)CCN(C)c1ccc(OC)cc1 844400365 AVXBJJYHJJUKIG-UHFFFAOYSA-N 329.466 1.003 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](CO)[C@H](c2ccc(O)c(O)c2O)C1 687737229 VYXMFVNIXFTCCX-GXSJLCMTSA-N 325.361 1.746 10 10 EDCE N=C(NCc1ccc(N2CCOCC2)c(F)c1)NC[C@@H]1CCCO1 849014338 GQJYKPFFLKSGBW-AWEZNQCLSA-N 336.411 1.455 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@@H]([C@@]3(C)COC(=O)N3)C2)c(O)c1O 928030046 XAIGGJTWSWDTBT-PIGZYNQJSA-N 334.372 1.757 10 10 EDCE CO[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCOC1 856208210 AJGPYJFXOYQLHD-QAPCUYQASA-N 348.443 1.315 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CNCC[C@@H]3C)C2)cc1 851664359 XXNITFMFSDFAOM-ZQIUZPCESA-N 332.448 1.571 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](O)C3CCOCC3)C2)cc1 855230710 IHAHFOSDHDBNNH-YOEHRIQHSA-N 334.416 1.178 10 10 EDCE Nc1n[nH]c(C2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)n1 930515776 PTXHBAWUMUNIAF-UHFFFAOYSA-N 342.447 1.603 10 10 EDCE CN1CCCc2cc(CNCc3cn(C[C@@H]4CCOC4)nn3)ccc21 865437832 SXIJFZDJTPDAIN-INIZCTEOSA-N 341.459 1.987 10 10 EDCE C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@H](c2ccn(C)n2)C1=O 761576492 NHCHIRSQQRYQCK-XHDPSFHLSA-N 327.388 1.840 10 10 EDCE Cn1cnc2cc(S(=O)(=O)Nc3ccc(O)cc3C(=O)O)ccc21 776434666 JAKSHGRREAZMHZ-UHFFFAOYSA-N 347.352 1.778 10 10 EDCE COC(=O)c1cc(O)ccc1NS(=O)(=O)N1CCC[C@@H](C)C1 775288610 YZMQNMXJPIBWOM-SNVBAGLBSA-N 328.390 1.567 10 10 EDCE O=C(NCc1cccc(Cl)c1O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 896672148 BLTUXEOUGCFEEZ-MDZLAQPJSA-N 326.780 1.649 10 10 EDCE COc1ccc(CNC[C@@H]2CCCCN2S(C)(=O)=O)cc1C 796511292 QHSXENBGAUNTTF-HNNXBMFYSA-N 326.462 1.907 10 10 EDCE CN1CCN(Cc2cc(Br)cc(F)c2O)C[C@@H]1C(=O)O 715782450 ZIIOQWSKVYXOBX-LLVKDONJSA-N 347.184 1.494 10 10 EDCE Cn1cc([C@@H](O)C(=O)Nc2c(-c3ccccn3)nc3ccccn23)cn1 1141722638 FHBWEGBOXIJWBS-MRXNPFEDSA-N 348.366 1.802 10 10 EDCE CC(C)(C)C(=O)N1CSC[C@H]1C(=O)NCc1c(O)cccc1O 1304051135 VAMDWCZVSWLXLM-NSHDSACASA-N 338.429 1.662 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccc(N2CCNC2=O)cc1 1162278920 NOYUTLZAOMXYIT-UHFFFAOYSA-N 327.340 1.557 10 10 EDCE COCC(=O)N1CCC[C@@](CO)(NCc2ccc(OC)c(C)c2)C1 1502548199 OHXISHKDLJDLGF-GOSISDBHSA-N 336.432 1.093 10 10 EDCE OCc1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2134818743 ATUZWXHLQBEMMT-NZPIUUIZSA-N 328.206 1.262 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2(NC(=O)C3CC3)CC2)cc1 1285935408 HXJMBPZHRJXPOD-UHFFFAOYSA-N 329.360 1.638 10 10 EDCE CON1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)CC1 1915777121 RZGROADTCOUTRG-GFCCVEGCSA-N 341.209 1.084 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cc([N+](=O)[O-])cc2c1OCCO2 1456237973 XHDRUAAXMLFIQK-UHFFFAOYSA-N 346.295 1.707 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C/c3ccncn3)CC2)cc1F 1545606291 KFHCIYUUKURKRC-GORDUTHDSA-N 342.374 1.986 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(=O)NC(=O)[C@@H]2C)c(Br)c1 228015113 RLSCJFMHRDEJTN-IUCAKERBSA-N 340.221 1.581 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H](O)c1cnn(C)c1 1543356925 WRVDDOISBPLBTN-QGZVFWFLSA-N 330.432 1.957 10 10 EDCE CN(C(=O)Cc1ccc(O)c(O)c1)[C@H]1CCN(c2ccccc2)C1=O 1628575603 YZJIUPSWWCKIKQ-HNNXBMFYSA-N 340.379 1.904 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1coc(C(N)=O)c1 1557113142 AQBPNANWPJJPGX-UHFFFAOYSA-N 346.339 1.290 10 10 EDCE Cc1cc2[nH]nc(NC(=O)/C=C/c3ccc(O)c(O)c3)c2c(=O)n1C 1627182910 LCNCQJADXFDNLA-GQCTYLIASA-N 340.339 1.633 10 10 EDCE C[C@@H](NC(=O)c1sccc1S(N)(=O)=O)c1ccccc1O 1635798880 GKEPWRHSMMHISZ-MRVPVSSYSA-N 326.399 1.592 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1COCCN1CC(F)F 1633819741 UUINPZVBXKWGJF-CMPLNLGQSA-N 344.358 1.111 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2ccnnc2)cc1C 1495745780 BRDOERRHMYEDBE-CYBMUJFWSA-N 328.416 1.949 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cnsn2)cc1C 1568818892 BCTIDBZAFQSARB-ARJAWSKDSA-N 332.429 1.931 10 10 EDCE COC(=O)/C(=C/c1ccc2c(c1)CCN2C)CN1CCC(=O)CC1 1772929653 JQQIUMSGBCWJOW-FOWTUZBSSA-N 328.412 1.900 10 10 EDCE CC[C@@H](F)C(=O)N[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1688053631 WYFBHKVQGDZHNM-FRRDWIJNSA-N 349.366 1.974 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@]2(C)CCC(=O)NC2)cc1C 1699376180 VUSYHIJQCDJSMC-KUHUBIRLSA-N 347.459 1.514 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)c(Br)c1 2140662019 JVENZGIMUWSRLJ-FFAVSVRISA-N 334.185 1.382 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2140664549 RHQVGWUBMMLDSR-KOCKLMIUSA-N 333.201 1.349 10 10 EDCE O=C(O)C1CCN(C(=O)CCNCc2cc(Cl)ccc2O)CC1 1857864999 QPXQFNADBQTZBF-UHFFFAOYSA-N 340.807 1.849 10 10 EDCE COC[C@@H](N)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951834169 SKJZUWAZEBCXGB-NEPJUHHUSA-N 326.393 1.507 10 10 EDCE Oc1ccc(CN=c2[nH]ccnc2I)c(O)c1 2008699691 NGDDYSXFHCQPPW-UHFFFAOYSA-N 343.124 1.526 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]12CN(C(=O)OC(C)(C)C)C[C@H]1CCO2 2010392920 LDPMXROUJHHEPG-IAQYHMDHSA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2010402025 LDZJFTIFNZTNMC-NWDGAFQWSA-N 339.396 1.924 10 10 EDCE Nc1ccc(N2C(=O)[C@@H]3[C@@H]4CC[C@@H](O4)[C@H]3C2=O)c(Br)c1 2153255732 OMAIVJDKEOGUBP-WRWGMCAJSA-N 337.173 1.698 10 10 EDCE C[C@H](C(=O)Nc1ccc(N)cc1)N(CCC(N)=O)Cc1ccccc1 2034749769 LKVUZPREVICDOD-CQSZACIVSA-N 340.427 1.973 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@](O)(CN(C)C)C2)c(Br)c1 713709118 SIHNZVUKGACPCQ-NHYWBVRUSA-N 342.281 1.972 10 10 EDCE NC[C@]12CN(Cc3cc(Br)cc(F)c3O)C[C@@H]1CCO2 2175178703 BTRSDQSDHUJWSC-HZMBPMFUSA-N 345.212 1.843 10 10 EDCE NCc1ccc(N2C[C@@H](O)[C@H](O)CC23CCC3)cc1Br 2169893410 CMELYWANJBTPMQ-ZIAGYGMSSA-N 341.249 1.762 10 10 EDCE NCc1cc(F)c(N2CC(=O)N[C@H]3CC[C@@H]32)cc1Br 2112067713 WHBVUFUXLWBBTD-QWRGUYRKSA-N 328.185 1.514 10 10 EDCE COC(=O)CCN(CC(=O)O)Cc1c(O)cccc1Br 2201049739 MPNLQDADONFFNM-UHFFFAOYSA-N 346.177 1.604 10 10 EDCE COc1ccc(Br)c(CN2CCCO[C@H](CN)C2)c1O 2236032369 LACOMWXFPJWSIY-SNVBAGLBSA-N 345.237 1.713 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2C=CS(=O)(=O)C2)c1O 2227746738 PVJOUUAAGYJWLM-MRVPVSSYSA-N 348.218 1.564 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1CCNCCNCC1 2227924849 VDARRHHRRLKAHG-UHFFFAOYSA-N 348.672 1.803 10 10 EDCE CC[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2288890922 ALSGIMXMXGZAMM-RAIGVLPGSA-N 340.221 1.751 10 10 EDCE CC[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2288913279 WYDSHDYKWIDMMP-RAIGVLPGSA-N 341.205 1.784 10 10 EDCE CCN1C(=O)C(=C2SC(=S)NC2=O)c2cc([N+](=O)[O-])ccc21 2297357179 CQPCLQXICCBRRC-UHFFFAOYSA-N 335.366 1.820 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)cc1Br 1893332430 RHGBULMBGZKFKC-QCZZGDTMSA-N 330.222 1.824 10 10 EDCE C[C@@H](CN1CCOCC1)CN1Cc2ccc(N(C)C)cc2[C@@H]1CN 71683345 YSPXTHIHSRUVFR-KXBFYZLASA-N 332.492 1.536 10 10 EDCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cn[nH]c1 122720446 YMRYBGJJIPNYFU-UHFFFAOYSA-N 339.443 1.872 10 10 EDCE COc1cc([C@H]2N[C@@H](C(=O)O)C(C)(C)S2)c(O)c([N+](=O)[O-])c1 83236924 GFRNTDCJDZAKAT-QWRGUYRKSA-N 328.346 1.876 10 10 EDCE CCc1nc(CN2CCN(Cc3ccc(OC)cc3O)CC2)no1 93284107 NXMZNGWYLWRYCH-UHFFFAOYSA-N 332.404 1.664 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCCC[C@H]2[C@H]2CNC(=O)C2)c1O 373209243 KIDNSVISXZCJFC-OLZOCXBDSA-N 349.387 1.800 10 10 EDCE Cc1ccc(CNC(=O)C[C@@H]2CNC[C@H]2O)c(O)c1Br 2380748171 BHMDUDAMGBHODH-GHMZBOCLSA-N 343.221 1.050 10 10 EDCE CO[C@@H](CN)CC(=O)N(C)Cc1ccc(C)c(Br)c1O 2380791482 ZUJOQBWDCKSIMB-LLVKDONJSA-N 345.237 1.785 10 10 EDCE COCC(O)(CNCc1ccc(C)c(Br)c1O)COC 2380799559 ZWZGKQOADFYDGY-UHFFFAOYSA-N 348.237 1.577 10 10 EDCE Cc1ccc(CN(C)[C@H]2COC[C@@H]2C(=O)O)c(O)c1Br 2380812680 YBVPCRIFLVGGSE-QWRGUYRKSA-N 344.205 1.995 10 10 EDCE O=C(NCCCO)C1CCN(Cc2cc(Cl)c(F)cc2O)CC1 295285417 IVGGTSJVZLTXIF-UHFFFAOYSA-N 344.814 1.895 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@](C)(F)C3)nc12 295378057 KENIUOFWPMIKLH-INIZCTEOSA-N 336.367 1.936 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3C[C@H]4CC[C@H]3NC4)CC2)cc1 394635867 CHMJQZZVXQTGKK-FHLIZLRMSA-N 329.444 1.732 10 10 EDCE Cn1ncc(CCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n1 825777468 VXMORTYKNGKKFK-MRXNPFEDSA-N 344.415 1.661 10 10 EDCE COC(=O)c1cnc(SCC(=O)N2CCOC[C@H]2C2CC2)s1 829681192 PXMVZTOXWJXEJK-JTQLQIEISA-N 342.442 1.659 10 10 EDCE CN(C)C(=O)CCN1CCC(N[C@@H]2CCc3cccc(O)c32)CC1 834578245 HRYKRQJTEGGSKP-MRXNPFEDSA-N 331.460 1.912 10 10 EDCE C[C@@H]1CN(CCO)CCN1C(=O)NCc1ccc2c(c1)CCCN2C 838032207 YBDDMYMKZIMFKK-OAHLLOKOSA-N 346.475 1.277 10 10 EDCE C[C@H](NCC[C@@]1(O)CCOC1)c1ccc(N2CCOCC2)c(F)c1 846194149 LVOULKPCIBMESV-KBXCAEBGSA-N 338.423 1.854 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCC1(CN)CC1 846347494 NAYVPYAQUBSBER-UHFFFAOYSA-N 346.475 1.346 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@@H]1CC[C@@H](C(F)(F)F)NC1=O 928712286 QHLFIFPMQCLGFW-CPCISQLKSA-N 334.269 1.605 10 10 EDCE CS(=O)(=O)NC[C@H]1CCC[C@@H]1NCc1ccc2c(c1)CCCO2 922106525 QQCBHUIYOQNIMX-CVEARBPZSA-N 338.473 1.819 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@H]1C[C@@H](O)C12CCC2 852584452 NNEYNXTXJBEVHX-DLBZAZTESA-N 331.460 1.604 10 10 EDCE CO[C@@H](CNC(=O)NCc1ccc2c(c1)CCCN2C)[C@H]1CCOC1 852438998 ARIIEXJJQQNIIX-WMZOPIPTSA-N 347.459 1.920 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H]4COC[C@]4(C)C3)C2)cc1 852450658 RBSOGRSTYUENEW-VCBZYWHSSA-N 345.443 1.952 10 10 EDCE C[C@H](NC(=O)NC1C[C@@H]2CC[C@H](C1)S2(=O)=O)c1ccccc1O 927322190 GXJHYRJCPKTHDU-WODVXLOZSA-N 338.429 1.861 10 10 EDCE O=[N+]([O-])c1c[nH]ccc1=NCc1ccc(N2CCC(O)CC2)cc1 853956768 ZPZFPGBRLRCRHF-UHFFFAOYSA-N 328.372 1.985 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)CN3CCOCC3)C2)cc1 855234153 TXOPVGCBVUYCPA-JKSUJKDBSA-N 347.459 1.358 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCc3cnn(C)c3)C2)cc1 851986445 LBQINLNDONKLDI-HNNXBMFYSA-N 343.431 1.549 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC2(CCO)CCOCC2)c1O 774940951 FUFHWRXCEWWRBT-UHFFFAOYSA-N 326.349 1.330 10 10 EDCE CS(C)(=O)=NC(=O)[C@@H]1CCCN1Cc1ccc(F)c(F)c1O 895199654 MWCVGYRAFMPOOL-NSHDSACASA-N 332.372 1.889 10 10 EDCE NCc1ccc(N2CCC[C@H](NC(N)=O)C2)cc1Br 702143545 BNFJQBAFKYRVCJ-JTQLQIEISA-N 327.226 1.545 10 10 EDCE CN(C)C(=O)/C=C\C(=O)NCc1cccc(Br)c1O 1139975074 STVRFFKVODOQBH-SREVYHEPSA-N 327.178 1.415 10 10 EDCE Oc1cccc(Br)c1CN1CCN([C@@H]2CCNC2)CC1 706847025 UDCYVZYEQDXZSJ-GFCCVEGCSA-N 340.265 1.634 10 10 EDCE OCCN[C@H]1CCCN(Cc2cc(Br)cc(F)c2O)C1 715789827 QXNQAAOVNYJSGS-LBPRGKRZSA-N 347.228 1.840 10 10 EDCE CN1C(=O)O[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@H]21 2120399404 FMCATPGRESTREV-ZYHUDNBSSA-N 327.178 1.790 10 10 EDCE N[C@H]1CN(Cc2cc(Br)cc(F)c2O)CC[C@@H]1CO 2122340557 CLUJVUQPTWASNT-PELKAZGASA-N 333.201 1.435 10 10 EDCE CN(C[C@H]1CCCC[C@H]1O)C(=O)C(=O)N1Cc2cccc(O)c2C1 1332019525 QTKZOPSIVKAHKT-UKRRQHHQSA-N 332.400 1.244 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2[C@@H](C1)[C@@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 1906922948 AWITZCLERWQOJR-VAUHNLMVSA-N 336.432 1.801 10 10 EDCE NC(=O)[C@@H]1CC[C@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)O1 1445981042 DANBSPWCYFDGBY-KCJUWKMLSA-N 336.369 1.075 10 10 EDCE C[C@H](NC(=O)N[C@@H]1CCN(c2cc(O)ncn2)C1)c1ccccc1O 1479509467 SHGYTHPLPJDFOI-NWDGAFQWSA-N 343.387 1.527 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H](C)CC(N)=O)cc1C 1482316645 JTPATYUVYJABQB-UONOGXRCSA-N 335.448 1.452 10 10 EDCE NC(=O)c1ccc(CNC(=O)c2cc3cc(O)c(O)cc3s2)o1 1629338418 CQDVKXWSGZNZOT-UHFFFAOYSA-N 332.337 1.934 10 10 EDCE CC(C)CCN[C@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1486065697 LDUQIIASTXBQRY-AWEZNQCLSA-N 335.408 1.575 10 10 EDCE C[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CC[C@@H]1N1CCN(C)CC1 1623046839 ZYSWTJIYBXQFTP-ZBFHGGJFSA-N 347.459 1.125 10 10 EDCE CC1(C)[C@@H](N2CCOCC2)C[C@H]1NC(=O)Cc1ccc(O)c(O)c1 1557316137 LSOVYTQQENCOSC-CVEARBPZSA-N 334.416 1.256 10 10 EDCE C[C@H](NC(=O)CNS(=O)(=O)c1cccs1)c1ccccc1O 1643742133 PUQRKOMRFXCTLL-JTQLQIEISA-N 340.426 1.609 10 10 EDCE CCNC(=O)CC(=O)N(C)C1CC(NCc2ccc(OC)c(C)c2)C1 1734591212 AIASDGMFPWKVFX-UHFFFAOYSA-N 347.459 1.609 10 10 EDCE CS(=O)(=O)CCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1643220278 ZCMPTGBQRLILDE-UHFFFAOYSA-N 326.378 1.404 10 10 EDCE C[C@H]1[C@H](CO)CCN1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1675579943 FAXNIQPLJCQTLW-RDJZCZTQSA-N 346.475 1.351 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)CN2CCCC2)cc1C 1699362223 KHJWHVDZHQOHRV-ONEGZZNKSA-N 331.460 1.861 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCCN=[N+]=[N-])[C@@H]1CCOC1 1964880586 RNOCTMHDFHFNLR-GHMZBOCLSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N1Cc2nccn2C[C@H](C(=O)NCCN=[N+]=[N-])C1 1965101987 KFLMLDWLCAUTFJ-NSHDSACASA-N 349.395 1.677 10 10 EDCE CC(C)(C)OC(=O)NOCCNS(=O)(=O)Cc1ccc(N)cc1 1977696030 FRDHGAVRRLCJCQ-UHFFFAOYSA-N 345.421 1.145 10 10 EDCE CCOC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985101134 OENUOTZRKSLSFD-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)OC(C)(C)C)c(O)c1 1985772389 VXMNLDJDBRYYDJ-LBPRGKRZSA-N 326.393 1.376 10 10 EDCE CN[C@H](c1ccc2c(c1)CCN2C)[C@H](O)CNC(=O)OC(C)(C)C 1999527434 NOULVKCSNPXGHR-HZPDHXFCSA-N 335.448 1.825 10 10 EDCE CO[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 2010169394 DAHKNHCQBMAPGX-SMDDNHRTSA-N 338.404 1.937 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010406054 PLLKYVTUSHSSDL-NWDGAFQWSA-N 339.396 1.924 10 10 EDCE COCCN1CCN(c2ccc(CN)cc2Br)CC1=O 2158787877 UEHMNQCYKCCUHP-UHFFFAOYSA-N 342.237 1.203 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2160717523 SPKAAABURTUJKT-MAMIUBEXSA-N 341.249 1.660 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H](C(C)C)C3(CO)CCC3)c2n1 2065100694 HEQLJJWCSPQZEV-AWEZNQCLSA-N 332.404 1.660 10 10 EDCE CN1CC[C@@H]2OCCN(c3ccc(CO)cc3Br)[C@H]2C1 2185592337 LRRGIRUJRYPUKA-GJZGRUSLSA-N 341.249 1.851 10 10 EDCE NCc1ccc(N2CC[C@H]3OCC(=O)N[C@H]3C2)cc1Br 2185523887 ZQMDNJKQODRXQD-QWHCGFSZSA-N 340.221 1.002 10 10 EDCE CCn1nc(Br)c([C@@H](O)[C@@H](N)c2ccccc2O)n1 2111411541 PFFHSEQQQGIJPS-ONGXEEELSA-N 327.182 1.500 10 10 EDCE Nc1ccc(CS(=O)(=O)Nc2nnc(Br)s2)cc1 2218857679 FFVNHYXBMXYVLU-UHFFFAOYSA-N 349.235 1.825 10 10 EDCE OCc1ccc(N2C[C@@H]3OCCC[C@@]3(CO)C2)cc1Br 2239155203 JDOZWGBZUNQMRY-GJZGRUSLSA-N 342.233 1.919 10 10 EDCE CSc1ncc(CN[C@@H]2CS(=O)(=O)C[C@H]2OC(C)C)s1 2284498718 JXSOACTYPDHXJL-GHMZBOCLSA-N 336.504 1.545 10 10 EDCE Cc1ccc(O)c(CNCC(CO)(CO)NC(=O)OC(C)(C)C)c1 2249537240 CLIGWXMAMWNAFG-UHFFFAOYSA-N 340.420 1.038 10 10 EDCE CN(CC1COC1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2269774603 YWEUEYIGJGRCQY-GFCCVEGCSA-N 326.194 1.484 10 10 EDCE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=CNCc1cccs1 2296943074 PCEZBJKDSDBHSH-UHFFFAOYSA-N 331.353 1.593 10 10 EDCE C[C@@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C[C@H](CO)O1 2311236420 UPGZNNYRGPUYQI-CRAIPNDOSA-N 346.427 1.145 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)C(=Cc2ccc(F)c(F)c2)SC1=S 2323832114 MIRACACIIDDGMM-SECBINFHSA-N 345.348 1.612 10 10 EDCE CS(=O)(=O)[C@H]1CC[C@@H]1NCc1ccc(Br)cc1O 2319822776 RAIJCIFQCQDNTF-JQWIXIFHSA-N 334.235 1.820 10 10 EDCE Cc1ccc(CN2C[C@@H]3[C@H](C2)CS3(=O)=O)c(O)c1Br 2352623342 KWPRSWLPGOVYCK-GHMZBOCLSA-N 346.246 1.692 10 10 EDCE Cc1cc(CC(=O)N2CCc3cc(N4CCOCC4)ccc32)no1 62526606 YKJBOLHLEZPDDU-UHFFFAOYSA-N 327.384 1.951 10 10 EDCE CN(C)c1ccc(Cn2c(=O)[nH]c3cc(C(=O)O)ccc3c2=O)cc1 70460590 IOBPPDXWWXECJR-UHFFFAOYSA-N 339.351 1.502 10 10 EDCE C[C@H](NCC(=O)N1CCOCC1)c1ccc(N2CCC(O)CC2)cc1 183364000 UDRNGQPJRHZGEY-HNNXBMFYSA-N 347.459 1.157 10 10 EDCE C[C@H](NC1CCN(S(C)(=O)=O)CC1)c1ccc(F)c(F)c1O 191196135 CBQXKYWRCCQGHB-VIFPVBQESA-N 334.388 1.745 10 10 EDCE O=C1CN(CC(=O)[n+]2nc3ccccc3s2)c2ccccc2O1 96321607 XCPJDLUKEXQPHR-UHFFFAOYSA-N 326.357 1.650 10 10 EDCE CC[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCN1C[C@H](C)O 245655465 DKMFXTAGDICOQI-KSLFURFDSA-N 334.416 1.415 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CNC3C[C@H]4C[C@@H]4C3)CC2)cc1 819383863 SPXXOGASJBBUDU-GPMSIDNRSA-N 345.487 1.566 10 10 EDCE N[C@H](c1cc(Br)cc([N+](=O)[O-])c1O)[C@H](O)C(F)(F)F 725382920 VFJKTKDMFRZLRV-SVRRBLITSA-N 345.071 1.986 10 10 EDCE CC[C@@H](NCc1ccc(N2CCN(C)CC2)cc1)[C@H](O)C(F)F 824635886 KCPMLANXLULUGX-CVEARBPZSA-N 327.419 1.933 10 10 EDCE COCCN1CCC(CNC(=O)/C=C\c2ccc(O)c(O)c2)CC1 588404160 WJZMTLUUJFUYKP-HYXAFXHYSA-N 334.416 1.586 10 10 EDCE Cc1ncc(Cl)c(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)n1 832274569 VYZLVPDQFQYRHS-CQSZACIVSA-N 333.823 1.934 10 10 EDCE C[C@H](NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1[C@H]2CN[C@H]1C2 925504539 PUINMSQUFPJGEU-HBMYEMETSA-N 333.451 1.873 10 10 EDCE Cc1cnn(C)c1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 850342879 WCAWMBTYZJYDJY-UHFFFAOYSA-N 341.415 1.584 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@@H]3[C@H](C)O)C2)cc1 854297521 RTYSOHYWMAMDHB-JJRVBVJISA-N 333.432 1.829 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(=O)n(C)c3)C2)cc1 853818849 ZUBXXJQWSCAMOF-AWEZNQCLSA-N 342.399 1.794 10 10 EDCE C[C@@H]1OC[C@@H](NCc2ccc(N3CCC(C(N)=O)CC3)cc2)[C@H]1C 926872246 BXLSXYJAAAIWJF-SUNYJGFJSA-N 331.460 1.901 10 10 EDCE COC[C@H](NCc1ccc(N2CCN(C)CC2)cc1)C1CCOCC1 850351875 WFSZREAIIXWDDS-FQEVSTJZSA-N 347.503 1.970 10 10 EDCE C[C@@H](N[C@@H]1CCN(C2CCOCC2)C1=O)c1cc([N+](=O)[O-])ccc1O 756735396 BIPZVWNOICDZCQ-IAQYHMDHSA-N 349.387 1.731 10 10 EDCE COC(=O)c1ccc(=O)n(CN2CCCc3cc(OC)ccc32)n1 766339434 HFDTXFZNWCOJPB-UHFFFAOYSA-N 329.356 1.449 10 10 EDCE CC1=C(C(=O)NCc2ccc3cccnc3c2O)S(=O)(=O)CCO1 862026989 GIVPPGXCAIXZSM-UHFFFAOYSA-N 348.380 1.233 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1[C@H]2COC[C@H]21 1117395939 HIUSMRACMXKRIY-FVQHAEBGSA-N 345.443 1.251 10 10 EDCE CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)N1Cc2cccc(O)c2C1 871203051 LENCHCVFNXTOOA-CYBMUJFWSA-N 326.418 1.198 10 10 EDCE COC[C@H](C)CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 783627502 VXUQEWXKOFZPIX-CQSZACIVSA-N 326.462 1.294 10 10 EDCE C[C@@H]1CC[C@H](O)CN1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 899098407 NKZLWUNTZGVWIQ-JLSDUUJJSA-N 348.491 1.910 10 10 EDCE CO[C@@H](C)CS(=O)(=O)NCc1cc(Br)ccc1O 796190257 DVEJIGMWRUEHTH-QMMMGPOBSA-N 338.223 1.609 10 10 EDCE CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)o2)cc1 797431283 LAEJNYUGXNXPQY-UHFFFAOYSA-N 345.402 1.265 10 10 EDCE Cc1oc(S(N)(=O)=O)cc1C(=O)NCc1cc(Cl)ccc1O 1146231643 GGXIBCODCSXPLF-UHFFFAOYSA-N 344.776 1.524 10 10 EDCE C[C@H](NC(=O)c1cn(CC(=O)OC(C)(C)C)nn1)c1ccccc1O 1302538684 ZLFZECLUEDYGLI-NSHDSACASA-N 346.387 1.816 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1(S(C)(=O)=O)CC1 1264286867 AWHNBLGNTJZODW-UHFFFAOYSA-N 336.457 1.822 10 10 EDCE CC(=O)N[C@@](C)(CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1356944716 HXGDCNDQLSOHPJ-INIZCTEOSA-N 331.376 1.884 10 10 EDCE COc1ccc(CNCC2CC(NC(=O)[C@H](C)CC(N)=O)C2)cc1C 1505512634 VSERBOXEBYJKGF-IUDNXUCKSA-N 347.459 1.500 10 10 EDCE CN(C)C(=O)N(C)[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1454146564 KOPSAKQKKUFDLE-ZDUSSCGKSA-N 346.391 1.677 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc(Br)cnc1O 1455356330 YDWLAFJQZDNNSU-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE CC(C)=CCNC[C@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1700976720 CCMXRRGNWCJYRN-HNNXBMFYSA-N 347.419 1.838 10 10 EDCE Cc1oc(C(=O)NCc2c(O)cccc2F)cc1S(N)(=O)=O 1471975687 CTESAXSLPMLWQZ-UHFFFAOYSA-N 328.321 1.010 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1c[nH]nc1-c1cnn(C)c1 1627026450 JVEYUAYNNBPGEU-UHFFFAOYSA-N 346.387 1.932 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H]2CCCN2C)cc1C 1714377695 OJYJBCRCAUYAMG-YOEHRIQHSA-N 333.476 1.940 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cccc(N2C(=O)CCC2=O)c1 1637034378 HJQZCCSCGFVOCL-UHFFFAOYSA-N 340.335 1.681 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc3c(c2)NC(=O)CNC3=O)c1 1641733184 KYEIISIXETZPMC-UHFFFAOYSA-N 339.351 1.313 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2CCN(C)C2)cc1C 1734353732 CNFTXWRMDBFBTM-RDJZCZTQSA-N 333.476 1.892 10 10 EDCE CO[C@@H](C)CN(C)C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1733067549 PXRPYJANGNFPIR-NEPJUHHUSA-N 335.408 1.934 10 10 EDCE C[C@@H](F)CCNC[C@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1732667104 OIRZHNPXWDGHKB-MFKMUULPSA-N 339.371 1.277 10 10 EDCE CNC(=O)CCn1c(CC2CC2)nnc1N(C)Cc1ccccc1O 1769336465 TWUCJUPKLRWYKZ-UHFFFAOYSA-N 343.431 1.709 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2CN(C)CCO2)cc1C 1676324802 XSICCOBNIRSDRE-CRAIPNDOSA-N 349.475 1.271 10 10 EDCE C[C@@H]1CCN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C[C@H]1O 1684872790 CCUQFVPHIXDZLR-CRAIPNDOSA-N 346.475 1.351 10 10 EDCE CC[C@]1(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)CCNC1=O 1691352441 WOSBNNKYWRDGKQ-IBGZPJMESA-N 347.459 1.468 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(CO)COCCN1CCCN=[N+]=[N-] 1982242463 NTWFTKPVQWJBSN-AWEZNQCLSA-N 329.401 1.275 10 10 EDCE C[C@H](NC[C@@H](CO)NC(=O)OC(C)(C)C)c1c(O)cccc1O 1985853819 DWEBLAZWBZGUPH-QWRGUYRKSA-N 326.393 1.634 10 10 EDCE CO[C@H]1CN(Cc2cc(N)ccc2O)C[C@@H]1NC(=O)OC(C)(C)C 2009273806 UCKYDQWGUYWETR-ZFWWWQNUSA-N 337.420 1.698 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C1=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C1 2014504805 KRVYIERDCLZNCK-NEPJUHHUSA-N 339.396 1.730 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)NCc1ccc(N)cc1 2022838196 KHXLJTQQQOLZFC-ZDUSSCGKSA-N 337.420 1.549 10 10 EDCE Cc1cccc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)O)c1O 2024812444 PDBVWXAEUPMZOT-YPMHNXCESA-N 338.404 1.591 10 10 EDCE COCCNCc1ccc(N2CC(F)(CO)C2)c(Br)c1 2172926020 GYERBCDYRKDTME-UHFFFAOYSA-N 347.228 1.706 10 10 EDCE CC[C@H](NC1CS(=O)(=O)C1)c1cc(Br)ccc1O 379964957 FMCSUJVLIXXUNI-NSHDSACASA-N 334.235 1.992 10 10 EDCE CS(=O)(=O)c1cnn(-c2ccc(O)c(O)c2)c1Br 2070078011 YVAXTIURVVYLDF-UHFFFAOYSA-N 333.163 1.450 10 10 EDCE CNCc1ccc(N2CCN(C3COC3)CC2)c(Br)c1 2169592847 IELZXOKDEARYRA-UHFFFAOYSA-N 340.265 1.689 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](C(CO)CO)C2)c(Br)c1 2170642223 ISGMMKQRCCQPCP-JQWIXIFHSA-N 344.249 1.930 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@H]3C[C@@H]4O)c(Br)cc2[C@H]1O 2172055975 NRSHVVOTOGGDEG-NFECNHKBSA-N 339.189 1.394 10 10 EDCE CN1CC[C@H]2OCCN(c3ccc(CO)cc3Br)[C@H]2C1 2185592342 LRRGIRUJRYPUKA-LSDHHAIUSA-N 341.249 1.851 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)NCCc2ccc(N)cc2)C1 2080869323 LNAHKZJCNSWYAP-UHFFFAOYSA-N 349.431 1.346 10 10 EDCE C[C@@H](O)c1ccc(N2CC(CS(C)(=O)=O)C2)cc1Br 2103219826 FIPAHOOCSQNNTL-SECBINFHSA-N 348.262 1.983 10 10 EDCE CO[C@H]1C[C@H](O)CN(c2cc(Br)c(CN)cc2F)C1 2109015061 CKCDDXMWKNMXJH-UWVGGRQHSA-N 333.201 1.633 10 10 EDCE OCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@@H]32)cc1Br 2090533204 CVFDKCYKIZDXFZ-FPMFFAJLSA-N 328.206 1.670 10 10 EDCE CO[C@@H]1[C@H](OC)CN(c2ccc(CN)c(Br)c2)[C@@H]1CO 2233356679 QNJQBTHAPJKZMO-MCIONIFRSA-N 345.237 1.119 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](OC)[C@H](N)C2)c1O 2227741992 YHCHTMOBOQYSRO-PWSUYJOCSA-N 331.210 1.321 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]12CCO[C@@H]1CN(C(=O)OC(C)(C)C)C2 2253350771 LFTXIWBPDFUZGO-IAQYHMDHSA-N 339.396 1.781 10 10 EDCE COCCN1C(=O)C(=Cc2cccc(OC)c2O)C(C(=O)OC)=C1C 2296656443 MXWCYRFNKMQVLC-UHFFFAOYSA-N 347.367 1.720 10 10 EDCE CC1(C)C(=O)NCCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297526040 IZRVIYSBWHSNSH-UHFFFAOYSA-N 343.427 1.273 10 10 EDCE CC[C@H]1CN(C(=O)C=Cc2ccc(O)c(O)c2)CCN1C[C@@H](C)O 2308001665 DKMFXTAGDICOQI-HIFRSBDPSA-N 334.416 1.415 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N[C@H]1CCN(c2ccccn2)C1 2308005858 LIAAQZVPHVPAGL-AWEZNQCLSA-N 325.368 1.901 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCC1(CO)CCC1 2308444831 LEOIYKZJDGDGCG-UHFFFAOYSA-N 330.428 1.815 10 10 EDCE C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(O)cc2O)SC1=S 2314842226 IZGRNEMRJRSATI-LURJTMIESA-N 325.367 1.772 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N1C[C@@H]2[C@H](C1)CS2(=O)=O 2336553831 MYJPKRKDNWLMOW-JRKPZEMJSA-N 346.246 1.945 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@](O)(C(F)(F)F)C2)cc1 81049993 CSIOXBGXPCNZTC-HNNXBMFYSA-N 345.365 1.368 10 10 EDCE C[C@H]1OCC[C@H]1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 274945032 NYBCHEDZXZTOEI-CZUORRHYSA-N 340.445 1.120 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1ccc(S(=O)(=O)C(C)C)cc1 808535621 SSMDTMYIVFZUDZ-UHFFFAOYSA-N 326.370 1.113 10 10 EDCE O[C@@H](CNCc1ccc(N2CCOCC2)c(F)c1)Cn1cccn1 818967309 SOXWXWWTEQIJEV-HNNXBMFYSA-N 334.395 1.010 10 10 EDCE CO[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)[C@H]1CCOC1 823292041 MDMVHLRSAMJOAC-RDJZCZTQSA-N 334.416 1.191 10 10 EDCE Cc1cc(C(=O)CN2CCNCC2)c(C)n1-c1ccc2c(c1)OCO2 844216914 BFJALPSGSBBBAR-UHFFFAOYSA-N 341.411 1.911 10 10 EDCE COC(=O)c1cc2ccccc2c(CN2CCN(C)C(=O)C2)c1O 844731597 SAJHHQMYDONDDF-UHFFFAOYSA-N 328.368 1.606 10 10 EDCE C[C@@H](CC(=O)NCc1cc(Br)ccc1O)NC(N)=O 848068726 NPKCPYVEDXLIHL-ZETCQYMHSA-N 330.182 1.218 10 10 EDCE C[C@H](NC(=O)[C@@]12C[C@H]3C[C@@H](C(=O)N1)[C@H]2C3)c1ccc(N(C)C)cc1 844486675 ZVTOMLYOMZUHDB-WDHXUJDKSA-N 327.428 1.845 10 10 EDCE Cc1cc(C)c([C@H](C)NCC[C@H]2CNCCS2(=O)=O)c(O)c1 925788073 FOVXLPZTHGKSSP-KBPBESRZSA-N 326.462 1.436 10 10 EDCE COc1cc(Cl)cc(CN2CCN(c3nccnn3)CC2)c1O 862442602 JEYYUPRCLGPTBB-UHFFFAOYSA-N 335.795 1.561 10 10 EDCE CC[C@@H](NC[C@]12COCCN1C(=O)COC2)c1ccc(C)cc1O 866553808 OAMRKPQUUOKMFH-CRAIPNDOSA-N 334.416 1.369 10 10 EDCE Cc1ccc(C(=O)N2CC(O)(CO)C2)cc1-n1c(C)cc(C=O)c1C 861848034 DMINDBQKGBGPJE-UHFFFAOYSA-N 342.395 1.394 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCO3)CC2)cc1 771454160 XYTCOBMEWCKBCM-BQYQJAHWSA-N 345.399 1.064 10 10 EDCE COCCC1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1118692643 RCAUAFRIOASEPG-CYBMUJFWSA-N 333.432 1.425 10 10 EDCE Cc1cc(O)c(CNCC2(S(=O)(=O)N(C)C)CC2)c(Cl)c1 886319897 SQMMBWUYTRNBDD-UHFFFAOYSA-N 332.853 1.868 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)[C@@H]2CCC(=O)N(C)C2)c([N+](=O)[O-])c1 895954433 ZGJFVXFPXKKZOM-WYOARUQKSA-N 347.371 1.838 10 10 EDCE COC(=O)c1c(CN[C@@H]2CCC(=O)N(C)C2)c2cc(F)ccc2n1C 894285203 RWSCWYIHGIXYED-GFCCVEGCSA-N 347.390 1.814 10 10 EDCE NC(=O)[C@@H]1CC[C@H](CCC(=O)NCc2c(O)ccc3ccccc23)O1 1304090731 PKHBXZMDTZTFGW-DYVFJYSZSA-N 342.395 1.975 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1C[C@@H]2C[C@@H]2C1 1329195844 CLJMSGXMUPAQER-MUJYYYPQSA-N 343.427 1.054 10 10 EDCE O=C(C(=O)N1CC[C@@H]2OCCC[C@H]2C1)N1Cc2cccc(O)c2C1 1331981452 PWVVTRXFVCSJDG-BBRMVZONSA-N 330.384 1.262 10 10 EDCE CC(C)NCc1ccc(N2CC(CO)(CO)C2)cc1Br 1914989947 JLXWOMMIKORXRE-UHFFFAOYSA-N 343.265 1.738 10 10 EDCE CN(c1ccc(C=CC(=O)O)c(Br)c1)[C@@H]1CCNC1=O 1916232597 OMYYNWMNRSCUGE-GFCCVEGCSA-N 339.189 1.872 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCn3nc(N)cc3C2)c([N+](=O)[O-])c1 1458563167 JRWCUAYUGHLLNN-HYXAFXHYSA-N 343.343 1.580 10 10 EDCE Cn1nccc1COCC(=O)NCc1ccc2cccnc2c1O 1451954541 MGDQNYQFBJLCLD-UHFFFAOYSA-N 326.356 1.507 10 10 EDCE CNCc1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)cc1Br 2136833221 NPOBMMYGZMMQJY-KGLIPLIRSA-N 329.238 1.491 10 10 EDCE COc1ccc(CNC[C@H]2C[C@H](NC(=O)[C@H](C)NC(N)=O)C2)cc1C 1700636299 PQIFNBPIIOIGID-QEJZJMRPSA-N 348.447 1.045 10 10 EDCE C[C@H](NCCO)C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1713685124 XQWYUFQQKJQGIW-LBPRGKRZSA-N 347.419 1.672 10 10 EDCE CN(CCNCc1ccn(C)n1)C(=O)c1ccc(N=NC(N)=O)cc1 1481321806 FVUGEWVEGYCKKC-UHFFFAOYSA-N 343.391 1.444 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@H]2CCCC(=O)N2)cc1C 1568646723 GRYMKFFCBDFBJP-GOEBONIOSA-N 347.459 1.657 10 10 EDCE Cc1noc(CNCCN(C)C(=O)c2ccc(N=NC(N)=O)cc2)n1 1731990343 WFTSTXDCHWUGHY-UHFFFAOYSA-N 345.363 1.402 10 10 EDCE CNC(=O)C1(C(=O)N[C@H](C)[C@H](C)NCc2ccc(OC)c(C)c2)CC1 1733994525 SQASBICMZILUDZ-UONOGXRCSA-N 347.459 1.513 10 10 EDCE CCOCCOC1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 1654226473 DHZKMSSSGIRFFF-UHFFFAOYSA-N 327.352 1.895 10 10 EDCE Cc1cccc(NC(=O)NCC(=O)NCc2c(O)cccc2O)c1 1652625965 PIUJGARXWGFLID-UHFFFAOYSA-N 329.356 1.844 10 10 EDCE CCCOCC(=O)NCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1580674574 QDNACKGNYCCWML-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE CO[C@H]1CN(c2ccc(CN)c(Br)c2F)C[C@@H]1OC 231840979 FNCDJDYZNOBAHU-QWRGUYRKSA-N 333.201 1.897 10 10 EDCE COc1ccc(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)nn1 1774043311 NGQVCDKGEZVCSR-ZDUSSCGKSA-N 344.415 1.710 10 10 EDCE O=C(O)COc1cccc(/C=C2\SC(=S)N(CCO)C2=O)c1 16904932 DRGUPGOOWJUZNO-XFFZJAGNSA-N 339.394 1.344 10 10 EDCE Cc1cc(CN2C[C@@H](C(N)=O)[C@@H](C(N)=O)C2)ccc1N1CCCCC1 878972143 GTEYTZSXRVOGJV-IYBDPMFKSA-N 344.459 1.004 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 1985097014 ZPIBMLOQLDHGRZ-JTQLQIEISA-N 325.369 1.391 10 10 EDCE CC(C)(C)OC(=O)N[C@@]12C[C@@H]1CN(C(=O)c1ccc(O)c(O)c1)C2 2006285560 YKIWXNMBFKRHPC-PIGZYNQJSA-N 334.372 1.837 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4[C@@H](O)C[C@H]4C3)c(Br)cc21 2151397120 MWWIPUFKYWVNDV-NXXZVQKESA-N 338.205 1.218 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(CO)CNC(=O)c1ccc(O)c(O)c1 2010537033 LWHLHKRTPPQNNC-INIZCTEOSA-N 340.376 1.103 10 10 EDCE O=S(=O)(NCCNCc1cccc(Cl)c1O)C(F)(F)F 2159525369 AZJPITFMGKTBAZ-UHFFFAOYSA-N 332.731 1.574 10 10 EDCE C[C@@H](NCc1ccc(F)cc1O)C1(O)CN(C(=O)OC(C)(C)C)C1 2024902137 OWSCXUCOMUHXKR-LLVKDONJSA-N 340.395 1.991 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(CC(N)=O)CC2)cc1Br 700786146 ONSNRGPJXZCPGF-SNVBAGLBSA-N 342.237 1.110 10 10 EDCE CNC(=O)[C@H]1CCN(c2ccc(CN)c(Br)c2F)C1 398456542 BKOONHUXWDIMJR-VIFPVBQESA-N 330.201 1.619 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@]34OCCC[C@H]3C4(F)F)c2n1 2062995639 BCRMGVLHHPOWSY-YGRLFVJLSA-N 338.314 1.287 10 10 EDCE Cn1ncc(CNC(=O)c2cc(O)c(O)c(O)c2)c1Br 2188913471 SBOULXOFSKOPCD-UHFFFAOYSA-N 342.149 1.229 10 10 EDCE CN(C)C(=O)[C@@H]1CCCN1c1ccc(CO)c(Br)c1 2087358157 XVGQRRTYPTVNON-ZDUSSCGKSA-N 327.222 1.998 10 10 EDCE NCc1ccc(N2CCO[C@@H]3COCC[C@H]32)c(Br)c1 2087484397 JZZRIUMDTFFHAA-ZIAGYGMSSA-N 327.222 1.902 10 10 EDCE COc1ccc(CNCc2nn(C)nc2Br)c(O)c1 2208734438 XZBPECPEJQWLJB-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE [N-]=[N+]=NCCCNc1cccc2c1CN([C@H]1CCC(=O)NC1=O)C2=O 2325739664 BUOALKMQQKQMCO-ZDUSSCGKSA-N 342.359 1.560 10 10 EDCE C[C@H](N)c1ccc(N2CC(O)(CN(C)C)C2)c(Br)c1 2343638932 LOONMTZBZGOEOR-JTQLQIEISA-N 328.254 1.582 10 10 EDCE CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\Nc1nnc(C(=O)O)[nH]1 101350180 QXXXDTGNIPDJIF-GHXNOFRVSA-N 340.343 1.838 10 10 EDCE CN(Cc1ccccc1O)C(=O)CCn1nc2ccccn2c1=O 109952580 UYZDUEWDXRFTLW-UHFFFAOYSA-N 326.356 1.250 10 10 EDCE COc1ccc(O)c(CNC(=O)c2nc3ccccc3c(=O)[nH]2)c1 114512458 AEYRVYSTWIHXJO-UHFFFAOYSA-N 325.324 1.567 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)c2c(C)nn(C)c2Cl)c1 119844182 GNXZNGPDJUZASY-UHFFFAOYSA-N 345.808 1.575 10 10 EDCE COc1cc(C)cc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)c1O 120838394 OAMNREOLUYZFLM-HNNXBMFYSA-N 348.443 1.780 10 10 EDCE COc1ccccc1N/C=C1\C(=O)N(c2ccc3nncn3n2)N=C1C 36357316 VBFHGVQHILYKIE-XFXZXTDPSA-N 349.354 1.851 10 10 EDCE COC(=O)N1CC(N[C@@H](C)c2ccc(N3CCC(O)CC3)cc2)C1 181462357 UYBDLYRFHZBMLZ-ZDUSSCGKSA-N 333.432 1.749 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CCCCC(=O)N1 193722505 BYTCGXXEYKEONQ-KRWDZBQOSA-N 345.443 1.540 10 10 EDCE NC(=O)[C@H]1CCCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255265434 FULLBDWBCMXKHE-UXHZXRBQSA-N 343.427 1.403 10 10 EDCE CC[C@H](C(=O)OC)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 276596116 HIQUXNXJWYTQJJ-INIZCTEOSA-N 334.416 1.681 10 10 EDCE CN1CC[C@]2(CCN(CC(=O)NCc3ccc(N(C)C)cc3)C2)C1 292215795 UMTCJOLOSSUKTJ-IBGZPJMESA-N 330.476 1.396 10 10 EDCE CN1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)[C@@H]2C[C@@H]21 2168356341 WMUOWMHVTJYIDW-XQQFMLRXSA-N 337.221 1.294 10 10 EDCE O=C(Cc1c(O)ncnc1O)NCc1ccc(N2CCCCC2)cc1 900405332 VASUMUZCCYPASF-UHFFFAOYSA-N 342.399 1.737 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)C12CCN(CC1)C2 900270099 YXURAUDMISYZLF-UHFFFAOYSA-N 333.407 1.374 10 10 EDCE CN(C)c1ccc(/C=C\CNC[C@H]2CCCN2S(C)(=O)=O)cc1 835042422 VHKKRKMLLXBNKM-XQDHMALISA-N 337.489 1.779 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCN(C(C)(C)C(N)=O)CC2)cc1 835026365 RWOJYXIDFBTXAS-AATRIKPKSA-N 330.476 1.647 10 10 EDCE Cc1c(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)nnn1C 741543700 DXFLCSCKRUVDRB-LBPRGKRZSA-N 329.404 1.451 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@@H](O)c2ccnn2C)cc1F 915367273 YRAGHTWLAOUEGJ-OAHLLOKOSA-N 335.383 1.158 10 10 EDCE COC(=O)c1cc(C(=O)N(C)CCN(C)c2ccc(OC)cc2)no1 844856778 UPTUIJFPDDVJBG-UHFFFAOYSA-N 347.371 1.678 10 10 EDCE C[C@@H]1CCCN(S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)C1 842783911 FJXYQZQWSHPHMK-CJNGLKHVSA-N 340.493 1.319 10 10 EDCE Cc1cc(Cl)cc(CN2CN(CCN(C)C)C(=O)[C@H]2C)c1O 843428894 ODKMOBVRYJFUAK-GFCCVEGCSA-N 325.840 1.906 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCCn3ccnc3)C2)cc1 849225096 NTOZHBANGCDVFS-OAHLLOKOSA-N 343.431 1.860 10 10 EDCE CN1CCN(c2ccc(CNCCOC3CCOCC3)cc2)CC1 922929552 JWYBRQNEUMPVQV-UHFFFAOYSA-N 333.476 1.724 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCOCC3CC3)C2)cc1 852078779 HKXOTWPQQONRFK-HNNXBMFYSA-N 333.432 2.000 10 10 EDCE CCN1CCO[C@H](C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 855229864 CJAFHZXEQXOKKG-YOEHRIQHSA-N 333.432 1.111 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3ncccc3O)C2)cc1 852451146 FDJVALSIFDIYIR-CYBMUJFWSA-N 342.399 1.874 10 10 EDCE COC(=O)c1cnc(CN2CCN(c3ccc(OC)cc3)CC2)cn1 859055073 GCXZKTJJCLIXCH-UHFFFAOYSA-N 342.399 1.594 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NC[C@@H]2CCC(=O)N2)cc1F 853706040 FETGSZKXSOHFKO-ZDUSSCGKSA-N 336.411 1.750 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H]1CCC(=O)N1 862210041 ZOLQBELBMHLPCF-HNNXBMFYSA-N 339.395 1.915 10 10 EDCE CNC(=O)CCOC1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779529326 OCAJEUIOUMREFQ-HYXAFXHYSA-N 348.399 1.255 10 10 EDCE COC(=O)CCc1nnc(NC(=O)c2ccc(C)c(O)c2O)s1 780947260 JFEVXDAXHNGKMW-UHFFFAOYSA-N 337.357 1.616 10 10 EDCE COc1cc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)c(O)cc1C 795653163 PJAOORGBITWVDM-CQSZACIVSA-N 342.461 1.565 10 10 EDCE C[C@H]1Oc2ccccc2N(CC(=O)NCc2cc(O)ccc2O)C1=O 1303223277 ILKGCJKJQMHXKK-LLVKDONJSA-N 342.351 1.528 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)[C@@H](C)CC(N)=O)C2)cc1C 1316634580 HUAXMEYDKROFJO-BPUTZDHNSA-N 347.459 1.500 10 10 EDCE NCc1ccc(N2CC3(CNC(=O)C3)C2)c(F)c1Br 2119572851 LZGPVDOEUMYXRO-UHFFFAOYSA-N 328.185 1.373 10 10 EDCE O=C1N[C@@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@@H]2O1 2120406608 RTJULZHMGGQFOT-ZJUUUORDSA-N 331.141 1.586 10 10 EDCE Cn1c(Br)nnc1CCNCc1ccc(O)c(O)c1 2128774525 WDPGIFRRZLKHSK-UHFFFAOYSA-N 327.182 1.321 10 10 EDCE CO[C@@H](C)CNC[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1330709533 VZSSOTUDJDSGAH-HUBLWGQQSA-N 347.419 1.982 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1 1332389996 JXJFFSPFJPDHQF-GUDVDZBRSA-N 331.460 1.727 10 10 EDCE C[C@@H](C(=O)O)N1CC(NCc2c(O)cccc2Br)C1 2131762283 AKLKRAIWNYAWGM-QMMMGPOBSA-N 329.194 1.402 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@@H]2CCNC2=O)cc1C 1268691295 SNSNPIYKPVDYJI-ZFWWWQNUSA-N 333.432 1.124 10 10 EDCE C[C@H](CNCc1nncs1)NC(=O)c1ccc(N=NC(N)=O)cc1 1268676266 NSYSVTUSARILDV-SECBINFHSA-N 347.404 1.609 10 10 EDCE COCC(=O)N[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1356735300 FLFWWVWEPYZSRB-ZDUSSCGKSA-N 347.375 1.216 10 10 EDCE C[C@H](O)CN(C)C[C@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1505466318 WKMRCTAFCXXERH-SWLSCSKDSA-N 347.419 1.766 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2cocc2C)cc1C 1507220726 BWFLGZDOFJGNOV-HNNXBMFYSA-N 332.400 1.786 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@H]3CC[C@@H](C(N)=O)C3)CC2)cc1 1295275397 RGXXUYCQMVGOJP-CABCVRRESA-N 345.443 1.636 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@H]2CC23CC3)cc1 1292893753 BZVKFWQKAPWNIX-GFCCVEGCSA-N 329.360 1.495 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2C[C@H]3CCCCN3C2=O)cc1 1450890940 LNDPGRXBLNMDRY-OLZOCXBDSA-N 329.360 1.732 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCNc1ccccc1[N+](=O)[O-] 1290274658 DCBMDTMYZJAVEQ-UHFFFAOYSA-N 331.328 1.777 10 10 EDCE COc1cccc([S@@](=O)CC(=O)NCc2cc(O)ccc2O)c1 1471661851 FJFNGAWTYAPCTK-QHCPKHFHSA-N 335.381 1.530 10 10 EDCE COC[C@@H](C)NCC1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1717394245 DDYXUIKEWDYMBE-XIKARTHZSA-N 347.419 1.982 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CN2CCCCC2=O)cc1C 1713320554 AXJHUYZOUFSZMW-HNNXBMFYSA-N 347.459 1.610 10 10 EDCE O=C(CCc1nc(-c2ccccn2)no1)NCc1ccc(O)cc1O 1570462413 SDJAONUFZKPBOD-UHFFFAOYSA-N 340.339 1.792 10 10 EDCE COCCC(=O)N1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1739452594 VFSGUDAGHUWWQU-UHFFFAOYSA-N 347.375 1.168 10 10 EDCE COC(=O)COc1cccc(C(=O)NCc2c(O)cccc2O)c1 1597569715 RCTPQGXQCALJLH-UHFFFAOYSA-N 331.324 1.580 10 10 EDCE C[C@@H](NCCNS(C)(=O)=O)c1ccc(N2CCCCC2)cc1 158236676 HMLMCKDXNUMCMS-CQSZACIVSA-N 325.478 1.877 10 10 EDCE Nc1ccc(NC(=O)CCNS(=O)(=O)c2ccc(F)cc2)cc1 160330736 AMURXAVOVSQUAI-UHFFFAOYSA-N 337.376 1.715 10 10 EDCE CC(C)(C)OC(=O)NCCCONC(=O)c1cccc(O)c1O 1962864040 HWGZYZVGYXIAJQ-UHFFFAOYSA-N 326.349 1.674 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)O[C@H]1CCNC1 1951831633 AQEVLODWYSXSBP-SWLSCSKDSA-N 338.404 1.870 10 10 EDCE COc1ccc(N(C)C[C@@H](O)CNC(=O)OC(C)(C)C)c(N)c1 1977905792 OAFHBSPIJFVCGB-NSHDSACASA-N 325.409 1.599 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(C(=O)NCCCCN=[N+]=[N-])C1 2010403807 KAWABKFHECDVAC-HNNXBMFYSA-N 341.412 1.813 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)c2n1 2064302017 FPNAUOZZOOBAPV-GDLCADMTSA-N 328.372 1.431 10 10 EDCE CCNCc1ccc(N2CC[C@@](C)(O)[C@H](O)C2)c(Br)c1 2197965413 JAABAUTUMGEIQU-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE CN1CCO[C@@H]2CCN(c3ccc(CN)c(Br)c3)C[C@@H]21 2185493219 PFIVLHBDLHTUBI-LSDHHAIUSA-N 340.265 1.817 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2210530758 HWQWDABXWCNVRP-YTWAJWBKSA-N 327.385 1.608 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2OCCC[C@]2(C(=O)NCCN=[N+]=[N-])C1 2215602375 PXWCJOFTZZVSOI-ABAIWWIYSA-N 339.396 1.829 10 10 EDCE COc1ccc(CN2C(=O)NC(=O)C(=Cc3cccn3C)C2=O)cc1 2297512963 DUVIODPZUHBFFR-UHFFFAOYSA-N 339.351 1.696 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2C[C@@H](CO)c3ccccc32)c1 492940254 IPIZVYXEMZAJKP-XHPSBEMXSA-N 337.379 1.577 10 10 EDCE CN[C@H](C)c1ccc(N2CC([C@@H](O)CO)C2)c(Br)c1 2336781727 YFJGOYDBBVHRAN-OTYXRUKQSA-N 329.238 1.519 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(Br)c1 2355335593 DFDFXLNKVFYRGG-FWYKCERLSA-N 341.249 1.789 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cc(C)nc3c2cnn3C)c1 175662966 VZIITGVFRXAYJT-UHFFFAOYSA-N 326.356 1.921 10 10 EDCE Cc1cc(N(C)C)ccc1CNS(=O)(=O)N1C[C@H](C)O[C@@H](C)C1 115592848 WMSSZPMEFAJULH-KBPBESRZSA-N 341.477 1.505 10 10 EDCE Cn1cc([C@@H]2C[C@H]2C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 68435378 AVUJZWOOTWPRFG-ZWKOTPCHSA-N 340.427 1.677 10 10 EDCE O=C(N[C@H]1CC[C@H](Oc2ncc(F)cn2)CC1)c1cc(O)nc(O)c1 238919966 SXFKFLIYCBFVGJ-HAQNSBGRSA-N 348.334 1.542 10 10 EDCE Cc1ccc(CN2CCN(C3COC3)CC2)c(O)c1Br 2380772968 OOMVCRNMBBPKIQ-UHFFFAOYSA-N 341.249 1.980 10 10 EDCE Cc1ccc(CN2[C@H]3CC[C@H]2[C@@H](O)[C@H](O)C3)c(O)c1Br 2380805574 QZHIPWGCUSGWRM-UUIJZJDISA-N 342.233 1.922 10 10 EDCE COC(=O)NCCC(=O)NCc1cc(Br)ccc1O 804739151 SNJYRKCAGGJLKN-UHFFFAOYSA-N 331.166 1.517 10 10 EDCE COCCOc1cc(C(=O)OCC(=O)C(C)=O)nc2ccccc12 808531090 KHDJBWHEBXRMND-UHFFFAOYSA-N 331.324 1.575 10 10 EDCE CNC(=O)[C@@H]1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 817161122 GZSBYGYILSXPGS-OAHLLOKOSA-N 328.416 1.340 10 10 EDCE CN1CCN(c2ccc(CN3CCO[C@H](C(=O)C4CC4)C3)cc2)CC1 811502044 HJFHQSIBOBUMRP-IBGZPJMESA-N 343.471 1.618 10 10 EDCE O=[N+]([O-])c1cc([C@@H](C2CCOCC2)N2CCOCC2)cc(O)c1O 575294980 HOGHEGMGKGIQMH-OAHLLOKOSA-N 338.360 1.806 10 10 EDCE C[C@@H](NC(=O)[C@@H]1CCCN(C)C1=O)c1ccc(N2CCOCC2)cc1 822786420 QQQXMXGPCRIZOT-PBHICJAKSA-N 345.443 1.569 10 10 EDCE COC[C@H]1CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823523780 JMMLJUNZGXOJBC-MRXNPFEDSA-N 333.432 1.578 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN2C(C)(C)C)cc1 826705944 DCPYDQUPSQBNJJ-MRXNPFEDSA-N 346.475 1.358 10 10 EDCE CNC(=O)[C@@H]1COCCN1c1ccc([C@@H](C)N)c(Br)c1 723181879 RUGAQECICJUCBU-RNCFNFMXSA-N 342.237 1.420 10 10 EDCE O=C(/C=C/c1cnccn1)NCc1ccc(N2CCOCC2)c(F)c1 918161347 DJCHJGXPSVTLQS-DUXPYHPUSA-N 342.374 1.782 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@](O)(C(F)F)C2)cc1 831174999 BWAGLWXLJLHXOR-INIZCTEOSA-N 327.375 1.071 10 10 EDCE CO[C@@H](CS(=O)(=O)N(C)Cc1ccccc1O)[C@H]1CCOC1 849376151 LZMLMWUTORNZEK-ZFWWWQNUSA-N 329.418 1.205 10 10 EDCE O=S1(=O)CCN(Cc2cc3c(cc2O)CCC3)[C@H]2CCOC[C@H]21 840168069 YGPWSMZPCJQISZ-DOTOQJQBSA-N 337.441 1.269 10 10 EDCE CN(C)c1cnn(C2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)c1 857271927 CWYBXENAWXAXJT-UHFFFAOYSA-N 348.378 1.977 10 10 EDCE CCCS(=O)(=O)CC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855228981 GUQYXHGUPYZMLL-ZDUSSCGKSA-N 340.445 1.215 10 10 EDCE CCN1CCO[C@H](C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 855229858 CJAFHZXEQXOKKG-PBHICJAKSA-N 333.432 1.111 10 10 EDCE O=C1C[C@H](CCNC(=O)NCCCSc2nccs2)CN1 921447765 RXYTVSCEJJBMRP-JTQLQIEISA-N 328.463 1.451 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)c3cncnc3)C2)cc1 855227077 WDQQBSLQYPGSNN-DZGCQCFKSA-N 326.400 1.984 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccn4nnnc4c3)C2)cc1 855223489 AUHLTOMSLHNKBZ-CYBMUJFWSA-N 338.371 1.142 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCOCCF)C2)cc1 852450437 MIOTUFFHHPBANK-CYBMUJFWSA-N 325.384 1.559 10 10 EDCE O=C(CN1C(=O)NC2(CCCC2)C1=O)N1Cc2cccc(O)c2C1 871199723 TUKSZTBRUWMVQY-UHFFFAOYSA-N 329.356 1.099 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1ccc(-n2cnnn2)cc1Cl 778918402 PXGUCDLFNFUONU-UHFFFAOYSA-N 345.746 1.657 10 10 EDCE Oc1cc2c(cc1CN1CCC(Oc3cnccn3)CC1)[C@@H](O)CO2 782893214 DNEZVPGDYDEFLU-INIZCTEOSA-N 343.383 1.651 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CC[C@@H](C(N)=O)C3)C2)cc1 1130826781 JNAHCIACNILVNK-HZSPNIEDSA-N 331.416 1.292 10 10 EDCE COC(=O)c1c(CN2CCN(C(C)=O)CC2)c2cc(F)ccc2n1C 893870404 BKZUJGRPTOCVMI-UHFFFAOYSA-N 347.390 1.768 10 10 EDCE CN(CCN1CCCS1(=O)=O)Cc1c(O)ccc(Cl)c1F 792168300 CCYIUMXETISIQC-UHFFFAOYSA-N 336.816 1.652 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCc2cccc(O)c2O)c(N)c1 1153798064 JZFYFDSDLHDQNJ-UHFFFAOYSA-N 336.369 1.014 10 10 EDCE COc1ccc(CNC(=O)[C@H]2CC(c3ccccn3)=NO2)c(O)c1 1155574428 KRULTCCDXCWGTG-MRXNPFEDSA-N 327.340 1.605 10 10 EDCE NS(=O)(=O)CCCCCCC(=O)N1Cc2cccc(O)c2C1 1302787384 MTCCXSNYAKTXIC-UHFFFAOYSA-N 326.418 1.473 10 10 EDCE CN(Cc1ccccc1O)c1nnc([C@@H]2CCOC2)n1CC(C)(C)O 1314753438 PNLQDSQHRAGCMY-CQSZACIVSA-N 346.431 1.895 10 10 EDCE NCc1ccc(N2CCO[C@H](CCO)C2)c(F)c1Br 2116238326 XIFOIOINCGKVHM-SNVBAGLBSA-N 333.201 1.635 10 10 EDCE CCCC(=O)N[C@H](C)[C@@H](C)NCc1nnnn1-c1ccc(OC)cc1 1328967460 DQHDWECXRNILPJ-CHWSQXEVSA-N 346.435 1.454 10 10 EDCE CCCN1CCC(N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329345451 WPYNZGYOQVYFBA-UHFFFAOYSA-N 345.443 1.567 10 10 EDCE C[C@H](NS(=O)(=O)c1cccc(C(N)=O)c1)c1ccc(N(C)C)cc1 1255123247 GIXUSSSVYGQRED-LBPRGKRZSA-N 347.440 1.891 10 10 EDCE CC1(C)[C@@H](O)[C@H]2CCCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)[C@H]21 1329510980 LNYFAIWITUMGEL-MAZHCROVSA-N 344.411 1.242 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@@H](O)C2(C)C)cc1Br 2124801899 QBQOTAOWKQTPEV-BZHVJNSISA-N 329.238 1.789 10 10 EDCE CNC(=O)C1(C(=O)NCC2(NCc3ccc(OC)c(C)c3)CC2)CC1 1277195080 LKEYGTIIYNBFJO-UHFFFAOYSA-N 345.443 1.268 10 10 EDCE COC(=O)[C@@]1(NC(=O)c2cc3cc(O)c(O)cc3s2)CCOC1 1545388899 ZYKCXVNUXXLOBK-OAHLLOKOSA-N 337.353 1.374 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)C[C@@H]2CCC(=O)N2)cc1C 1714795473 MRVIYXVCTIXJSU-ZBFHGGJFSA-N 347.459 1.609 10 10 EDCE C[C@@H](O)CNCCC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1485752460 WKBVSLVFZDVRLN-VXGBXAGGSA-N 335.408 1.718 10 10 EDCE CCN1CCO[C@@H](C(=O)N(C)CCNCc2ccc(OC)c(C)c2)C1 1493801749 SGUZCWWPVACSDJ-GOSISDBHSA-N 349.475 1.272 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2c[nH]c(C(N)=O)c2)cc1C 1567079068 NTDLAXKIDCTGKY-GFCCVEGCSA-N 344.415 1.339 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@@H](CO)[C@@H]3C)C2)cc1 1564962843 PHOQHGQBWSBESX-XHSDSOJGSA-N 347.459 1.934 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)C(C)(C)C)cc(OC)n1 1572298545 XPFHDUQDMHYODP-LLVKDONJSA-N 337.420 1.722 10 10 EDCE CNC(=O)c1cccc(N(C)C(=O)/C=C\c2cnc(OC)nc2)c1 1584789520 LTAFJSWYGBZUSP-FPLPWBNLSA-N 326.356 1.521 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H]2CC2(F)F)cc1C 1676529247 IZEHTVNLIIATBP-STQMWFEESA-N 328.359 1.226 10 10 EDCE CN(C)c1ccc(CNCCC(=O)N2CCC(C(=O)O)CC2)cc1 1857863001 MTOVHSVHXMIEJG-UHFFFAOYSA-N 333.432 1.556 10 10 EDCE Oc1cccc(Br)c1CN[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@H]2O 1974164002 WERSDYMGGMPIPL-NOWSUULHSA-N 328.206 1.375 10 10 EDCE C[C@H](NCc1c(O)cccc1F)C1(O)CN(C(=O)OC(C)(C)C)C1 1997945939 LPMCRFFZXAIPBL-NSHDSACASA-N 340.395 1.991 10 10 EDCE CN(C)c1ccc([C@H](N)[C@H](O)C2CN(C(=O)OC(C)(C)C)C2)cc1 1999536290 IKDBJYHCNAJEOY-JKSUJKDBSA-N 335.448 1.980 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H]1C(=O)NCCc1ccc(O)c(O)c1 2010214697 AXHMNARMVPDLKG-NEPJUHHUSA-N 336.388 1.670 10 10 EDCE CN(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)CCCN=[N+]=[N-] 2010388835 HMPWWBAKMPJLCK-LBPRGKRZSA-N 342.444 1.990 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010404186 PLLKYVTUSHSSDL-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC=C[C@H](O)C3)c(Br)cc21 2165067364 FZGXGWGVBOXVKV-SDBXPKJASA-N 338.205 1.399 10 10 EDCE O=C(O)[C@H]1OCC[C@H]1CNCc1cc(Br)ccc1O 716163955 HNPZZLXNACXZGL-UFBFGSQYSA-N 330.178 1.734 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC(C)(C)[C@@H]3[C@H]3CCCO3)c2n1 2063647645 HPMXHKUYRAYLSO-OCCSQVGLSA-N 330.388 1.773 10 10 EDCE CN1C(=O)NCC12CN(c1ccc(CN)c(Br)c1F)C2 2177687555 MMEJHANGMKYTMC-UHFFFAOYSA-N 343.200 1.261 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CN(C(=O)Cc2ccc(N)cc2)CCO1 2044692828 DXLMUCUWWXOKRG-HNNXBMFYSA-N 349.431 1.563 10 10 EDCE O=C1Nc2cc(N3CC(CCO)C3)c(Br)cc2[C@H]1O 2095988640 NUVSFGHZCORBCI-GFCCVEGCSA-N 327.178 1.253 10 10 EDCE CCN(c1ccc(CN)c(Br)c1)[C@@H]1CC(=O)NC1=O 2114733005 SLXNFZZKPMRFFW-LLVKDONJSA-N 326.194 1.149 10 10 EDCE COc1ccc(Br)c(CN[C@]2(CO)C[C@H](O)C2)c1O 2208911021 QVZSEAPTSWJPJC-KTLJEJPDSA-N 332.194 1.139 10 10 EDCE CNCc1ccc(N2CCC[C@H]3CNC(=O)[C@H]32)c(Br)c1 2279281224 RVNFHHASKAOKKF-FZMZJTMJSA-N 338.249 1.883 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)OCC(=O)N1CCCC1 2297505445 IGLGQRHYRWMVOK-UHFFFAOYSA-N 344.411 1.702 10 10 EDCE CNC(=O)c1cncc(C=CC(=O)N2CCN(C)c3ccccc32)c1 2297523819 WLSLKRZKIXRADI-UHFFFAOYSA-N 336.395 1.937 10 10 EDCE Cc1ccc(CN2CCO[C@H](C(=N)N)C2)c(O)c1Br 2352686434 BKHDAFBWWUESNX-JTQLQIEISA-N 328.210 1.600 10 10 EDCE O=C(CN1CCN(Cc2ccccc2)CC1)NCc1ccccc1O 45284741 UCCVUGOGTFONCL-UHFFFAOYSA-N 339.439 1.826 10 10 EDCE COC(=O)[C@H]1C[C@@]1(N)c1cc(I)ccc1O 1952776020 SAOYNRPZASRDJO-LDYMZIIASA-N 333.125 1.344 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC2COC2)C1 634258442 MDVDXUUXUOWFGQ-UHFFFAOYSA-N 327.428 1.923 10 10 EDCE COc1ccc(N2CCN(C(=O)C3(C(=O)N(C)C)CC3)CC2)cc1F 807032079 BJOFSQWVSYZDRX-UHFFFAOYSA-N 349.406 1.351 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)CCc3cnn(C)n3)C2)cc1 819587200 IBCXIEBYDOGRGK-AWEZNQCLSA-N 343.431 1.399 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@H]2CN)c(OC)c1Br 2131036056 RZGIJHBASZDZTI-IUCAKERBSA-N 331.210 1.365 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCOC[C@@]12CCOC2 908005673 YFNRMVGDIZYUNB-INIZCTEOSA-N 335.381 1.944 10 10 EDCE C[C@@H]1C[C@H](S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 830297724 IMLDFPGBMBMROD-DGCLKSJQSA-N 330.425 1.879 10 10 EDCE COC(=O)c1cc(O)c(F)cc1NS(=O)(=O)N1CCC[C@H](C)C1 830156421 SSZJGKAWJZLUIU-VIFPVBQESA-N 346.380 1.707 10 10 EDCE O=S1(=O)C[C@@H](CNCc2ccc3c(c2)CCO3)Oc2ccccc21 842723161 ZIRWJQZIOPGLOV-OAHLLOKOSA-N 345.420 1.946 10 10 EDCE COc1cccc([C@H](C)NC2CCN(CCC(=O)N(C)C)CC2)c1O 846143313 DTRHHOOYNXGUCK-AWEZNQCLSA-N 349.475 1.994 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C/c1ccnn1-c1ccccn1 843269091 NEWSESQUWHOZQN-ACCUITESSA-N 341.396 1.570 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)NCC(C)(C)CS(C)(=O)=O)c1 926953169 JTQKWQVGDDKIOZ-NSHDSACASA-N 343.445 1.900 10 10 EDCE COc1cccc(CNC(=O)NCc2nc3c(s2)COCC3)c1O 927688820 LSKGFZSOAKPDQN-UHFFFAOYSA-N 349.412 1.929 10 10 EDCE Cc1cc(CC(=O)N2C[C@@H](O)[C@H](CO)C2)c(C)n1-c1ccccc1 854910177 QOUHYMRKBIAREH-FUHWJXTLSA-N 328.412 1.448 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@@]3(C)COC[C@@]3(C)C2)cc1 852463905 YIOGFTJGJHQTRG-KDURUIRLSA-N 331.460 1.727 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NOCCSC)C2)cc1 852294709 HIWFXRIKBZPHCD-GFCCVEGCSA-N 325.434 1.868 10 10 EDCE CN(C)CCCN(C)C(=O)NCc1ccc(N2CCOCC2)cc1 758397434 PLTRRPFPQLBTKY-UHFFFAOYSA-N 334.464 1.616 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCC(=O)NC(C)C)C2)cc1 851973069 YQASVPWYQOQTQA-CQSZACIVSA-N 348.447 1.488 10 10 EDCE C[C@@H](NCC(=O)Nc1cccnn1)c1ccc(N2CCOCC2)cc1 930210920 QHIHSYCDIPJDPA-CQSZACIVSA-N 341.415 1.603 10 10 EDCE c1cc(N2CCOCC2)ccc1CNc1ncc2c(n1)CCOC2 865295150 ZYECIKRVDZHKCE-UHFFFAOYSA-N 326.400 1.998 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cncc(N3CCCC3=O)c2)c1 860241649 MFPPJRDTDISHJD-UHFFFAOYSA-N 341.367 1.853 10 10 EDCE C[C@H](NC(=O)NC[C@]1(CCO)CCOC1)c1ccc(N(C)C)cc1 776238326 IYIZBCMJJVRGBC-KSSFIOAISA-N 335.448 1.902 10 10 EDCE CCOC(=O)c1n[nH]c([C@@H](C)NC(=O)/C=C\c2ccc(O)c(O)c2)n1 1146857510 ZUZOHFJKYPTKFT-WILPJHFFSA-N 346.343 1.283 10 10 EDCE CN1Cc2ccccc2[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1=O 1167231154 BUVGHWBKTGPSGV-KOEDOTQGSA-N 338.363 1.941 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)CN2CCOCC2)cc1C 1321030951 WIMUPSIKBPFLGE-ONEGZZNKSA-N 347.459 1.098 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC2C[C@@H]3[C@@H](C2)C3(F)F)cc1 1261680267 SWLKYOKCCTWEFR-ZIAGYGMSSA-N 337.370 1.529 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H](C)CC(N)=O)CC2)cc1C 1277132553 DUIKWDVMRFCRLV-CYBMUJFWSA-N 333.432 1.254 10 10 EDCE CN(Cc1ccccc1)C1CN(c2cc3c(cc2N)OCC(=O)N3)C1 1914229507 SJIRYPWSFNWAMB-UHFFFAOYSA-N 338.411 1.920 10 10 EDCE O=C(CN1CCOCC1)N(Cc1ccco1)Cc1ccccc1O 1445637710 FYXBOVOYEHRFMF-UHFFFAOYSA-N 330.384 1.846 10 10 EDCE CN(C)c1ccc(CNC(=O)Cn2nnnc2-c2ccccc2)cc1 1524862133 WZDOEGHJVWAKFD-UHFFFAOYSA-N 336.399 1.723 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cnnn1-c1cccc(F)c1 1451770641 QJDJQXBRBQFZGK-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE CCOC(=O)N1CSC[C@H]1C(=O)NCc1cccc(O)c1O 1520508812 MXOGLUSGZIALFM-JTQLQIEISA-N 326.374 1.245 10 10 EDCE Nc1snnc1-c1nc(-c2cncc(Br)c2)no1 1923196822 FJCJKUHIUVKKCM-UHFFFAOYSA-N 325.151 1.995 10 10 EDCE CC[C@H](F)CNC[C@@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1715613686 ODOSTWCJAXLUEI-WCQYABFASA-N 339.371 1.277 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1CCN(C)C1=O)NCc1ccc(OC)c(C)c1 1481841909 DUZXWNUAVUXSLB-HOTGVXAUSA-N 347.459 1.466 10 10 EDCE Cc1[nH]nc(C(=O)NCc2cc(O)ccc2O)c1Br 1637122280 CVERVXSBVKGKGI-UHFFFAOYSA-N 326.150 1.822 10 10 EDCE CC[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)C[C@H](C)S1(=O)=O 1636136212 DQRCIIPAAKFWJC-JQWIXIFHSA-N 327.402 1.064 10 10 EDCE CC[C@@H](CNC(=O)CS(C)(=O)=O)NCc1ccc(OC)c(C)c1 1732193002 CFXMEQUVSCHANZ-AWEZNQCLSA-N 342.461 1.033 10 10 EDCE CCc1ccc(C(=O)NCc2ccc(O)cc2O)cc1S(C)(=O)=O 1570462030 ALJGJTMWRKFQRG-UHFFFAOYSA-N 349.408 1.994 10 10 EDCE COC1CCN(c2ccc(CN3CCn4ncnc4C3)cc2)CC1 1658344850 AQOITZVVCCFCBE-UHFFFAOYSA-N 327.432 1.909 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@H](O)[C@H]2CF)cc1Br 2140664550 RHQVGWUBMMLDSR-WXVIEYFRSA-N 333.201 1.349 10 10 EDCE CCN[C@@H](C)c1ccc(N2C[C@H](O)[C@H](O)C2)cc1Br 233574864 WMFVVRTXELOVAW-QCZZGDTMSA-N 329.238 1.661 10 10 EDCE CNCc1ccc(N2CCOC[C@H]2C(=O)NC)c(Br)c1 234452430 RDONSKWCROFPNJ-ZDUSSCGKSA-N 342.237 1.120 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCO[C@H]2COC[C@@H]21 1877615406 UQOIHNWYHZMXIQ-RYUDHWBXSA-N 332.169 1.893 10 10 EDCE CC(C)(C)OC(=O)N1CCC(O)(CC(=O)NCCCN=[N+]=[N-])CC1 1964881264 WKKXFCZPKAOPPM-UHFFFAOYSA-N 341.412 1.955 10 10 EDCE Cn1nnc(Br)c1CN1CCCc2cc(CN)ccc21 2145950122 DGGQELFZVDHNKN-UHFFFAOYSA-N 336.237 1.989 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CC(O)C1 1990022301 ASRQWOXGVASZRO-NAUIOFCNSA-N 325.369 1.316 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCc2ccccc2O)C1 2011935000 VVTXUIVCHUKGAZ-KRWDZBQOSA-N 336.388 1.380 10 10 EDCE CO[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 2014405447 UNGOQANPNUEUNE-RYUDHWBXSA-N 339.396 1.922 10 10 EDCE O=C(O)CN1CCN(Cc2ccc(Br)cc2O)CC1 691422139 LYLJWLICZZEHGL-UHFFFAOYSA-N 329.194 1.357 10 10 EDCE O=C(NCc1c(O)cc(O)cc1O)C1CCN(CC(F)F)CC1 2062305139 YCQUFJUUZUZOTQ-UHFFFAOYSA-N 330.331 1.397 10 10 EDCE NC[C@H]1CCN(C(=O)c2c[nH]nc2[C@H]2CCNC2)c2ccccc21 2062576516 LACZWVJLCTUNCM-OLZOCXBDSA-N 325.416 1.579 10 10 EDCE CN(CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N)cc1 2044728053 YMMFYYCYFBEHRQ-UHFFFAOYSA-N 348.447 1.784 10 10 EDCE NCc1cc(F)c(N2CCO[C@@H]3C[C@@H](O)C[C@@H]32)cc1Br 2185306881 JLEYZMGOIHQVOH-QCZZGDTMSA-N 345.212 1.775 10 10 EDCE C[C@]1(O)CCN(c2ccc(CN)c(Br)c2F)C[C@@]1(C)O 2194598961 CHMORQVDINKSJF-UONOGXRCSA-N 347.228 1.759 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCc2ccc(N)cc2)C[C@H](O)C1 2073256788 QSHQVKXCAAMXBJ-UJKQEGAGSA-N 349.431 1.346 10 10 EDCE NCc1ccc(N2C[C@@H]3CCS(=O)(=O)[C@@H]3C2)c(Br)c1 2088819817 MTQLERJBDBUIKW-GXFFZTMASA-N 345.262 1.531 10 10 EDCE COCc1nc(CNCc2cccc(Br)c2O)no1 2089349865 HIYJPIYQCJWSTF-UHFFFAOYSA-N 328.166 1.974 10 10 EDCE NCc1ccc(N2CC[C@H]3OCCO[C@@H]3C2)c(Br)c1 2095386732 UMESQRBZEGYAPT-ZIAGYGMSSA-N 327.222 1.902 10 10 EDCE CC(C)C[C@H](CNC(=O)OC(C)(C)C)COc1nnc(=N)[nH]n1 2210645732 WQFPYTPXDZDDTB-SNVBAGLBSA-N 326.401 1.245 10 10 EDCE CC(C)(C)OC(=O)NC[C@@]1(COc2nnc(=N)[nH]n2)CC12CCC2 2213785112 IVCFLYQLWKYDPU-OAHLLOKOSA-N 336.396 1.143 10 10 EDCE COC(=O)CC1=NN(c2ccc(OC)cc2)C(=O)C1=C(C)NC1CC1 2294492819 AAMCNXOAJLWMSC-UHFFFAOYSA-N 343.383 1.987 10 10 EDCE Cc1ccc(N2C(=O)NC(=O)C(=CNCCCN(C)C)C2=O)cc1C 2296091564 UKOKOZLAVDIAJO-UHFFFAOYSA-N 344.415 1.311 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N(C)c2ccc(OC)nc2)c1 491686758 SIFIHQCZDPBCHO-DAXSKMNVSA-N 326.356 1.521 10 10 EDCE C[C@@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CCC1=O 2310416333 PBAMSTSBFIITHK-OAHLLOKOSA-N 328.412 1.974 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3C[C@@H](O)[C@H](C)C3)c(Br)cc21 2353965920 SXZBFVOQDGQIKF-KEMBBXRSSA-N 340.221 1.479 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCO1 54787272 CULXOGZGCKHTSX-WMLDXEAASA-N 333.432 1.890 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2c[nH]nc2C)cc1C 1278792154 RGFIVMFTTQRDGX-HNNXBMFYSA-N 346.431 1.258 10 10 EDCE CC(=O)N(C(=O)N[C@@H]1CC(=O)N(C(C)(C)C)C1)c1ccc(N)cc1 217285448 XDRSMOHOLPGNPR-CYBMUJFWSA-N 332.404 1.731 10 10 EDCE CCOc1ccnc(N2CCN(Cc3cccc(OC)c3O)CC2)n1 121513093 HGWZADVHDULNTM-UHFFFAOYSA-N 344.415 1.912 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CC(=O)N(C)[C@H]1c1cccc(Cl)c1 808519227 XKVVWYLQOJWOKV-WFASDCNBSA-N 337.759 1.561 10 10 EDCE COc1cc([N+](=O)[O-])c(C(=O)OCC(=O)C(C)=O)cc1SC 808514221 WLCWFETWDSBLCU-UHFFFAOYSA-N 327.314 1.640 10 10 EDCE COc1cc(Br)cc(CN2CCOC[C@@H](O)C2)c1O 824625269 IJBYNMZBJUPEFE-NSHDSACASA-N 332.194 1.356 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(Cc2ccccn2)CC1 588403834 UUARGLBFNICRGH-ALCCZGGFSA-N 339.395 1.850 10 10 EDCE Cc1cc(O)c(CN2CN(CCN(C)C)C(=O)[C@@H]2C)c(Cl)c1 843428268 GZFWZGREXWXWJJ-LBPRGKRZSA-N 325.840 1.906 10 10 EDCE CO[C@@H]1C[C@H](CC(=O)O)N(Cc2cc(F)cc(C(C)=O)c2O)C1 846284963 MUCOAPZWEUGAOD-CHWSQXEVSA-N 325.336 1.798 10 10 EDCE C[C@@H](C(=O)NC(=O)NC(C)(C)C)N1CCCc2cc(CN)ccc21 843349664 HXHIDHFLCGBDEA-LBPRGKRZSA-N 332.448 1.911 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)[C@@H](N)c1ccccc1O 1899562366 SCZPUMNDOVTQAN-AAEUAGOBSA-N 344.433 1.330 10 10 EDCE CC(C)[C@H](N)CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 851685589 UFVLHRQKKBCSAN-MRXNPFEDSA-N 346.475 1.175 10 10 EDCE CCS(=O)(=O)C1(CN[C@@H](C)c2cc(C(=O)OC)ccc2O)CC1 850558053 PQQXMIXIDGOKMD-NSHDSACASA-N 341.429 1.797 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCCC(=O)[C@H]3C)nc12 932855777 MYROADVEUXCIFW-SNVBAGLBSA-N 332.360 1.165 10 10 EDCE Cn1ccc([C@@H]2NC(=O)N(CCCSc3nccs3)C2=O)n1 761303348 ZKMJLQVWQKEVSS-JTQLQIEISA-N 337.430 1.652 10 10 EDCE CCOc1cccc(CN2CCN(c3nccn(C)c3=O)CC2)c1O 769466515 KYMJHZHZCYJMKK-UHFFFAOYSA-N 344.415 1.207 10 10 EDCE COC(=O)N[C@H]1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 899623985 CLTZDPJUEGTJRT-VIFPVBQESA-N 336.369 1.883 10 10 EDCE CN[C@@H](C)c1ccc(N2CCN(C)[C@H](CO)C2)c(Br)c1 687613167 YTPDUXCQGOLYDW-AAEUAGOBSA-N 342.281 1.842 10 10 EDCE CNCc1ccc(N2CCN(C)C[C@H]2CO)cc1Br 699452368 XZPJHAMWDUGKSO-ZDUSSCGKSA-N 328.254 1.281 10 10 EDCE O=C(COc1ccc([N+](=O)[O-])c(F)c1)NCc1cc(O)ccc1O 1176747822 BUSQJEXNEPGPNM-UHFFFAOYSA-N 336.275 1.840 10 10 EDCE C[C@H](O)[C@H]1CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2125807648 ACZYVXBPUKNSJK-QDWQASTRSA-N 327.178 1.394 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12 1351821825 BKUFZKCMCYIHCU-AALSBFMBSA-N 328.412 1.759 10 10 EDCE O=C(c1cccc(O)c1O)N(Cc1ccccc1)CC1(O)CNC1 1915494389 RYRIKZKZOFIZJT-UHFFFAOYSA-N 328.368 1.075 10 10 EDCE O=C(CN1CCOC1=O)Nc1c(-c2ccccn2)nc2ccccn12 1298830279 RTXAWUPTHVRFOZ-UHFFFAOYSA-N 337.339 1.787 10 10 EDCE COC(=O)[C@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)[C@H]1CCOC1 1472399717 JKCADBYOJALCAI-ZTGIWPAFSA-N 335.356 1.053 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3[C@H](C(N)=O)[C@@H]3C2)cc1Br 2136584468 CGEKIXYICGTKPM-CXSMTQNASA-N 325.206 1.670 10 10 EDCE CN(C)C(=O)COc1ccccc1C(=O)NCc1c(O)cccc1O 1635843474 ULBJBTMCAKMQIF-UHFFFAOYSA-N 344.367 1.495 10 10 EDCE COC(=O)[C@@H]1c2ccccc2CCN1C(=O)Cc1ccc(O)c(O)c1 1630107028 QIAVXENFXFNWIW-SFHVURJKSA-N 341.363 1.939 10 10 EDCE COc1ccc(CNCC[C@H]2[C@H](C)CCCN2C(=O)C(N)=O)cc1C 1565938451 IPEXPABRWXYKLQ-CJNGLKHVSA-N 347.459 1.596 10 10 EDCE CCN1CCN(CC(C)(C)NC(=O)Cc2ccc(O)c(O)c2)CC1 1570410019 OFLIANBSAYZLAH-UHFFFAOYSA-N 335.448 1.173 10 10 EDCE CC[C@H](F)C(=O)N[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1736999046 YVUPLLHUWMDMJX-OLZOCXBDSA-N 349.366 1.928 10 10 EDCE C[C@@H](C(=O)NCc1c(O)cccc1O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1647177501 BLZRJRBPQBZBQJ-SDDRHHMPSA-N 346.383 1.278 10 10 EDCE CCN1CC[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1586799492 CJHBVWLKWHMIAU-SFHVURJKSA-N 331.460 1.606 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)C2(C(N)=O)CC2)C(C)C)cc1C 1698975347 IUOFQKRFULXEPC-HNNXBMFYSA-N 347.459 1.500 10 10 EDCE Oc1c(Br)cccc1CN[C@H]1COC2(CCC2)[C@@H]1O 2141560265 YCRZPKHPNFNXGA-WCQYABFASA-N 328.206 1.927 10 10 EDCE CS(=O)(=O)c1ccccc1CNC(=O)/C=C/c1ccc(O)c(O)c1 1179691559 VJDUNJOWVMHQDT-VQHVLOKHSA-N 347.392 1.831 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)[C@@H](CCO)C2)c(Br)c1 2149906806 BBIRGAGUJPWNIS-DRZSPHRISA-N 344.249 1.930 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)c(Br)c1 2146307014 VTVNOJHMBODHDY-ONERCXAPSA-N 341.249 1.650 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 2010116949 QPRIWGIVXUTEEL-CYBMUJFWSA-N 337.420 1.463 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CC(=O)NCCCCN=[N+]=[N-])[C@@H](O)C1 2010402574 SJGJQEPHSHASEF-RYUDHWBXSA-N 341.412 1.811 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)C(=O)COCc1ccccc1 404490001 AAXBBEKGIXAZPY-UHFFFAOYSA-N 327.384 1.300 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](CNCc2ccc(O)cc2O)C1 397473434 LVYABKKNAHVRQN-CQSZACIVSA-N 338.404 1.823 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@H](O)C3)cc1Br 2190457646 KNLOKVZNYDKAAK-UJZSJCAASA-N 341.249 1.932 10 10 EDCE CC[C@@H](c1cc(Br)ccc1O)N1CC(N)(C(N)=O)C1 2109486288 ROPMLQGOTJRROR-JTQLQIEISA-N 328.210 1.104 10 10 EDCE OCc1ccc(N2[C@H](CO)C[C@@H]3OCC[C@H]32)cc1Br 2090533207 CVFDKCYKIZDXFZ-YUTCNCBUSA-N 328.206 1.670 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](CO)C[C@@H](CO)C2)cc1Br 2236635948 LISXGMPLLIRXTB-QJPTWQEYSA-N 344.249 1.930 10 10 EDCE CNCc1ccc(N2C[C@H]3OCC[C@@]3(CO)C2)cc1Br 2296431019 IROJUIYEMZDNFD-CABCVRRESA-N 341.249 1.756 10 10 EDCE OC[C@H](O)CN1CCN(c2ccc(OCc3ccccc3)cc2)CC1 2314483493 FRXALRSIPHJGRH-LJQANCHMSA-N 342.439 1.741 10 10 EDCE CC1(C)C(=O)NCCN1C(=O)/C=C/c1ccc(N2CCOCC2)cc1 110708599 IZRVIYSBWHSNSH-VMPITWQZSA-N 343.427 1.273 10 10 EDCE CCCC(=O)NCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 117975863 MZUQDYJRCYZFIU-OAHLLOKOSA-N 334.416 1.816 10 10 EDCE COC(=O)[C@H]1C[C@H](O)CN1Cc1ccc(Br)cc1O 1327880355 FTOWAYNLEIBAIC-WDEREUQCSA-N 330.178 1.263 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)c(F)c1Br 2357055342 UTEZVASQUAKTMP-RTOGKPCTSA-N 345.212 1.510 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)NS(=O)(=O)C1COC1 408476700 MHWIXYPOFZGEBQ-UHFFFAOYSA-N 340.426 1.614 10 10 EDCE CC(C)C[C@H](NC(N)=O)C(=O)NCc1ccc(N2CCCC2)cc1 73955062 PWHAXDGCMPZUAK-INIZCTEOSA-N 332.448 1.986 10 10 EDCE COC(=O)CN(C)c1cn2nc(Nc3ccc(N)cc3)nc2cc1C 74376045 CNKNFJSPVXGOEY-UHFFFAOYSA-N 340.387 1.973 10 10 EDCE COc1ccc(N(C)C[C@H]2CCCN(S(C)(=O)=O)C2)c(OC)c1 132182357 ZWLSFYZWACEDBT-CYBMUJFWSA-N 342.461 1.812 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@H]2CCCn3nc(C)nc32)c1 83724428 QWPIOJJKEAFJAH-ZDUSSCGKSA-N 331.376 1.635 10 10 EDCE CC(C)n1cc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cn1 133763427 VDSDBTWZWOFEKR-UHFFFAOYSA-N 326.334 1.879 10 10 EDCE COc1cc(Br)cc(CN2CCNC(=O)CC2)c1O 93101520 CZDDIDRWGBXSCD-UHFFFAOYSA-N 329.194 1.485 10 10 EDCE CN1CCC[C@@H](C(=O)NCc2cccc(Br)c2O)C1=O 296700145 MKNRJURIECDFGA-JTQLQIEISA-N 341.205 1.639 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(CN)CCCO2)c(O)c1Br 2380746585 VTZFEGJCGPMLGK-AWEZNQCLSA-N 343.221 1.587 10 10 EDCE Cc1ccc(CN(C)C(=O)N2CCNCC2)c(O)c1Br 2381133515 PSQMNJNGIPPSNY-UHFFFAOYSA-N 342.237 1.920 10 10 EDCE Cc1ccc(CN2CCN(C)C[C@H]2CCO)c(O)c1Br 2381143038 OLWIFHFEFPDMOU-CYBMUJFWSA-N 343.265 1.962 10 10 EDCE CCN1CN(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 823725517 DFOQHWDUFFJTKM-AWEZNQCLSA-N 346.431 1.353 10 10 EDCE O=C(O)[C@@H]1CCCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 588471278 IAWURJBAYNLQLL-KQQSKNTNSA-N 344.411 1.860 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1895874833 CKZCOZMVHVNFPD-AXFHLTTASA-N 325.369 1.580 10 10 EDCE CN1CCC[C@@](O)(CC(=O)NCc2ccc3c(c2)CCCN3C)C1 900432793 HPCZBZUCRQQVRD-LJQANCHMSA-N 331.460 1.532 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCN(C2CC2)CC1 839220545 KUOBHDFPKBTGNE-UHFFFAOYSA-N 344.459 1.018 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@H]3C[C@H]3C2)cc1F 834678288 UCKLALRBBPSSKY-MELADBBJSA-N 333.407 1.813 10 10 EDCE C[C@@H](O)[C@H]1CN(C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 840274326 DRAXFHZQOVIIFU-CXAGYDPISA-N 333.432 1.360 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@@H]3C[C@H]2C[S@@]3=O)cc1F 844936228 VXJDKWVYYVZAQP-IBILFNBTSA-N 325.409 1.307 10 10 EDCE C[C@H]1CCNC[C@@H]1NC(=O)NCc1cccc(Br)c1O 841976626 MYDTUSRWAKQKAU-CABZTGNLSA-N 342.237 1.952 10 10 EDCE COc1nc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)co1 858200792 CDBYLCATUKPXGH-UHFFFAOYSA-N 331.372 1.792 10 10 EDCE CC(C)N1CCN(CCCC(=O)NCc2c(O)cccc2F)CC1 928705017 CBDWIGMQCPXNTR-UHFFFAOYSA-N 337.439 1.954 10 10 EDCE COC(=O)[C@H]1CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 854301154 JKPYDBVRIQDDMM-KBPBESRZSA-N 347.415 1.478 10 10 EDCE CNC(=O)[C@H]1CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 852449390 RUAAETORBSQKCN-UONOGXRCSA-N 346.431 1.051 10 10 EDCE COc1ccc(N2CCN(CCCN[C@@H]3CN(C)C[C@H]3C)CC2)cc1 756103301 BHRDLRHOYWPAPT-YLJYHZDGSA-N 346.519 1.747 10 10 EDCE O=C(CCCN1C(=O)CCC1=O)NCc1ccc2cccnc2c1O 862028473 ANYLTBJBSOBLNW-UHFFFAOYSA-N 341.367 1.486 10 10 EDCE CO[C@@H](C(=O)NCc1ccc2cccnc2c1O)C(=O)OC(C)(C)C 868937468 JTOZBLLGBUVYRX-HNNXBMFYSA-N 346.383 1.913 10 10 EDCE COc1ccc(N2CCC(NC(=O)NCc3ccn(C)n3)CC2)cc1 765763961 BUEJSUVJKPRTRS-UHFFFAOYSA-N 343.431 1.897 10 10 EDCE O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)N1Cc2cccc(O)c2C1 871200054 YMUYBFKTAGRRLV-BHWMQLMCSA-N 338.363 1.042 10 10 EDCE Cc1ccc(C(=O)NC[C@H](O)[C@H](C)O)cc1-n1c(C)cc(C=O)c1C 871144078 UPYBBOWQUSYTFE-KSSFIOAISA-N 344.411 1.687 10 10 EDCE COC(=O)N1C[C@H]2C=C[C@H]1[C@@H](C(=O)N1Cc3cccc(O)c3C1)C2 871206264 XPUCCGKARHVDGY-WHOFXGATSA-N 328.368 1.877 10 10 EDCE O=C(NCCCNC(=O)c1cccc(O)c1O)c1ccccc1F 1148566909 RJVIBVJIFGMNHA-UHFFFAOYSA-N 332.331 1.787 10 10 EDCE CCCCOc1ccc(/C=C2/C(=O)NC(=O)N(C)C2=O)cc1OC 1084357494 DMWREDQIUGVVHJ-XFXZXTDPSA-N 332.356 1.966 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3NC(=O)O[C@@H]3C2)cc1Br 2120402307 GHUOBSUOHQBVJB-CQFDHEJISA-N 326.194 1.766 10 10 EDCE CC(=O)N1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)[C@H](C)C1 1254011197 XBLKITQEDCGJBH-OAHLLOKOSA-N 348.466 1.630 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)NC3CC(C)(C)C3)ccc21 1330414286 YXYUTLWWWPBALR-UHFFFAOYSA-N 329.444 1.990 10 10 EDCE CO[C@@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1332667988 DCYPLJNVKWVQTR-IAGOWNOFSA-N 345.443 1.321 10 10 EDCE COc1ccc(CNC[C@H]2C[C@H](NC(=O)CNC(C)=O)C2)cc1C 1330557136 PHEMUDOGUQGZGM-WKILWMFISA-N 333.432 1.124 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C[C@@H]2CCCO2)cc1C 1268302211 VYVXTDXIPVYSEM-HOTGVXAUSA-N 336.432 1.139 10 10 EDCE C[C@@H]1CO[C@H](C(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1349229875 XZDVGKGJWUETNB-GWCFXTLKSA-N 347.375 1.120 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C2(C)CC=CC2)cc1C 1278147083 KDRHNDLVVGXBMG-INIZCTEOSA-N 332.444 1.927 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1C[C@@H]2CCC[C@H]21 1354610950 AAMFFAFOWLKHAV-CGTJXYLNSA-N 339.439 1.984 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)C2CN(C(C)=O)C2)cc1C 1282124842 QSIQRHFZSCYFCC-KBPBESRZSA-N 347.459 1.465 10 10 EDCE COc1cc(C(=O)N(C)C)ccc1NC(=O)Cc1ccc(O)c(O)c1 1444909784 RVMHBLCJAFLEGV-UHFFFAOYSA-N 344.367 1.989 10 10 EDCE Cn1nccc1[C@H]1C[C@H](NC(=O)Cc2ccc(O)c(O)c2)CCO1 1297999337 IZXGFUROKBQFQI-MLGOLLRUSA-N 331.372 1.410 10 10 EDCE C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCN1CC(C)(C)O 1466930319 LXEMXVDBWVDTNQ-GFCCVEGCSA-N 347.419 1.766 10 10 EDCE COc1cccc(CNC(=O)c2ccc3nnc(S)n3c2)c1O 1545682195 WBYVGFVMBDDBEE-UHFFFAOYSA-N 330.369 1.662 10 10 EDCE O=C1CC(CCCNC(=O)c2cc3cc(O)c(O)cc3s2)=NN1 1556868336 WJASWXYHADORSX-UHFFFAOYSA-N 333.369 1.698 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2ccc3nc(O)[nH]c3n2)c1 1630365673 CUYWOSFXACMZIP-MRVPVSSYSA-N 328.328 1.869 10 10 EDCE C[C@H](O)CCCN[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1491775857 WWVAATOQMFGCDY-WFASDCNBSA-N 347.419 1.814 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@@H](n1cncn1)C(F)(F)F 1632049095 XHDYODABSVMNIQ-DTRQGZQOSA-N 342.277 1.622 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 1637123164 ZBBVZQRRWNSXSD-SECBINFHSA-N 332.278 1.125 10 10 EDCE COc1ccc(CN[C@@]2(CO)CCCN(C(=O)C(F)F)C2)cc1C 1570276810 OGQJSIICYJFCJT-KRWDZBQOSA-N 342.386 1.712 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C2CC(F)(F)C2)cc1C 1732639033 XECNXGPWJHOBOZ-AWEZNQCLSA-N 342.386 1.616 10 10 EDCE CCOCC(=O)NCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1737705775 MDEPQZWNZXZVMC-UHFFFAOYSA-N 335.364 1.074 10 10 EDCE COc1ccc(CN(CCO)C(=O)Cc2ccc(O)c(O)c2)cc1 1650964599 FVYNEBRZEKNPQN-UHFFFAOYSA-N 331.368 1.670 10 10 EDCE COC1CCN(c2ccc(CN3C[C@@H](CO)[C@H](CCO)C3)cc2)CC1 1655900523 XKRZNSFFOVJCPW-MSOLQXFVSA-N 348.487 1.725 10 10 EDCE NC(=O)CN(Cc1ccccc1)C(=O)CCOc1ccc(N)cc1 1946829311 JSHVRTNWSBZSMI-UHFFFAOYSA-N 327.384 1.552 10 10 EDCE CNCc1ccc(N2CCO[C@H]3COC[C@H]32)cc1Br 1877659727 PABRAXTYBNASPL-KGLIPLIRSA-N 327.222 1.773 10 10 EDCE CNC(=O)[C@@H]1CCCN1c1cc(Br)c(CN)cc1F 311388965 CLVXPCHIBSQHHJ-NSHDSACASA-N 330.201 1.762 10 10 EDCE C[C@@H]1C[C@H]2CN(c3ccc(CN)cc3Br)CCN2C1=O 2181270495 WBPVJWZFDUEWRL-PWSUYJOCSA-N 338.249 1.965 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C1(CCO)CC1 2190077626 YCAZCIVJOYFMCJ-LBPRGKRZSA-N 341.205 1.786 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@H]4COC[C@H]43)c(Br)cc21 2186370563 JKZSAVYEIRCVJC-YLJLNXRRSA-N 338.205 1.497 10 10 EDCE Cn1cc(C(=O)N2CC[C@H](N=[N+]=[N-])C2)nc1CNC(=O)OC(C)(C)C 2060638107 SFCNJRZTXRPCCZ-JTQLQIEISA-N 349.395 1.970 10 10 EDCE NCc1cc(F)c(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2199532604 QPUVPPHNKUMKCM-PLVISXMQSA-N 345.212 1.367 10 10 EDCE Cn1cc(NC(=O)c2cc(O)c(O)c(O)c2)c(Br)n1 2230801713 YVMAUYKDQVPVAC-UHFFFAOYSA-N 328.122 1.552 10 10 EDCE C[C@H](NCC(CO)(CO)NC(=O)OC(C)(C)C)c1ccccc1O 2249538096 OVDWGQMBHUEMRS-LBPRGKRZSA-N 340.420 1.291 10 10 EDCE COc1ccc(N2CCC(NCCN(C)S(C)(=O)=O)CC2)cc1 67872621 RKSDWQVDLVNCKA-UHFFFAOYSA-N 341.477 1.145 10 10 EDCE COCCN1CCN(C(=O)NCc2ccc(N(C)C)cc2)C[C@@H]1C 117398092 PXDITHPAOAFDCS-HNNXBMFYSA-N 334.464 1.615 10 10 EDCE Cc1nc(CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)no1 173548443 PFSUOZIJFLLKAG-UHFFFAOYSA-N 345.403 1.556 10 10 EDCE CN(CC1CC(O)C1)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 135451084 HSWGHXJNPICPJJ-QPJJXVBHSA-N 330.428 1.766 10 10 EDCE O=S(=O)(CCN1CCCC1)NCCCSc1nccs1 192642539 LHJOJQIVINKODX-UHFFFAOYSA-N 335.520 1.641 10 10 EDCE COc1cc([C@@H]2N[C@@H](C(=O)O)C(C)(C)S2)c(O)c([N+](=O)[O-])c1 83236927 GFRNTDCJDZAKAT-WDEREUQCSA-N 328.346 1.876 10 10 EDCE CCNC(=O)N1CC[C@@H](N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 90409779 DMZBNQUOQSJPPN-DOTOQJQBSA-N 346.475 1.978 10 10 EDCE C[C@H](N)c1ccc(N(C)CCS(C)(=O)=O)c(Br)c1 94298851 NJXLZHJGKOOMCE-VIFPVBQESA-N 335.267 1.950 10 10 EDCE Cc1cc(C(=O)CN2C[C@H](O)C[C@H]2CO)c(C)n1-c1ccc(F)cc1 249373888 XNDSVYXQCNUIQY-DLBZAZTESA-N 346.402 1.843 10 10 EDCE Cc1cn2c(n1)CN(c1cc3c(cc1[N+](=O)[O-])OCC(=O)N3)CC2 374723304 YLGWBKRFXKJRSW-UHFFFAOYSA-N 329.316 1.451 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@@H]3CNC[C@H]32)c(O)c1Br 2380758769 XTWLXWXQRYKPED-IJLUTSLNSA-N 339.233 1.935 10 10 EDCE Cc1ccc(CN(C)C(=O)CC[C@H](O)CN)c(O)c1Br 2380761719 IRVYCXKKLDHPAM-NSHDSACASA-N 345.237 1.521 10 10 EDCE Cn1ncc(CNC(=O)NCc2cccc(Br)c2O)n1 805999945 HDTHTUUNVCVRCD-UHFFFAOYSA-N 340.181 1.283 10 10 EDCE CC(=O)C(=O)COC(=O)CCC(=O)Nc1nnc(C(C)C)s1 808527272 CCUWVRVORMNYPW-UHFFFAOYSA-N 327.362 1.082 10 10 EDCE Cc1c(C(=O)NCc2cc(Br)ccc2O)nnn1C 804737569 LNGNFHCMFIGGLP-UHFFFAOYSA-N 325.166 1.522 10 10 EDCE CC[C@H](Cn1cncn1)NCc1ccc(N2CCC(O)CC2)c(F)c1 810212883 GDSHNIPVHDMOSU-OAHLLOKOSA-N 347.438 1.947 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC(=O)N(CC)OC 828144967 QHPOHOPLIKXZIH-UHFFFAOYSA-N 336.436 1.694 10 10 EDCE O=C1CC[C@H](N2CCN(Cc3cccc(Cl)c3O)CC2)CCN1 825148133 QLDCSLARSSKXOA-AWEZNQCLSA-N 337.851 1.832 10 10 EDCE C[C@H](NC(=O)[C@]1(C)C[C@@H](O)CN1C)c1ccc(N2CCOCC2)cc1 900386822 HUCCZCXVKSYQHE-YJLNNSPDSA-N 347.459 1.156 10 10 EDCE COCCN(CC(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCOC1 839586826 YOHHOAJEIZJBOM-QGZVFWFLSA-N 335.448 1.106 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCN(CC[S@@](C)=O)CC2)cc1 835026373 RZBUADDWFBGLHE-NVIZVJJSSA-N 335.517 1.762 10 10 EDCE COCCN1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)C(C)(C)C1 846561760 KYVNVTPMZLPRNJ-ALCCZGGFSA-N 334.416 1.680 10 10 EDCE CCc1cccc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)c1O 848910751 PLGKXSGOTIEVOT-OAHLLOKOSA-N 326.462 1.810 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc4nn[nH]c4c3)C2)cc1 855229818 RBXMMKYKBLGPKF-ZDUSSCGKSA-N 337.383 1.975 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC(=O)N(C)[C@H](C)C3)C2)cc1 852450967 AJVHBUYTTUFVAD-ZIAGYGMSSA-N 346.431 1.146 10 10 EDCE COC(=O)[C@@H]1C[C@H]1[C@H](C)NCc1ccc(N2CCOCC2)c(F)c1 850034281 KKIZXAYRBRHBPR-AEGPPILISA-N 336.407 1.950 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@](C)(NC(C)=O)C(C)C)CC2)cc1 929249337 HRARHRLDDQQHNL-IBGZPJMESA-N 347.459 1.895 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H](C(=O)O)C1CC1 852950863 SFCYTTGKVMAPSP-MRXNPFEDSA-N 332.400 1.592 10 10 EDCE C[C@H](NC(=O)NCCCN1CCCS1(=O)=O)c1ccccc1O 868193160 KPPXFKRTYAQUIR-LBPRGKRZSA-N 341.433 1.178 10 10 EDCE C[C@@H]1COCC[C@@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 763192472 FJTQSWYILMAIRZ-PBHICJAKSA-N 333.432 1.747 10 10 EDCE O=C(NCCC(=O)N1Cc2cccc(O)c2C1)OCC(F)(F)F 871200423 BRJOTNXHMDVEPZ-UHFFFAOYSA-N 332.278 1.913 10 10 EDCE O=C(NCC[C@@]1(O)CCCOC1)c1cc2cc(O)c(O)cc2s1 898295022 SNYKGCISXWRKIF-INIZCTEOSA-N 337.397 1.974 10 10 EDCE Cn1cc(C[C@@H](O)C(=O)NCc2ccc(N3CCCCC3)cc2)cn1 786843501 YRRGNTXBBAEGJK-GOSISDBHSA-N 342.443 1.630 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)[C@H](CO)C2)c(Br)c1 704451144 JDQAIDOBBRKCLH-DLOVCJGASA-N 330.222 1.539 10 10 EDCE CN(C)c1ccc(CNC[C@@H]2CCCCN2S(C)(=O)=O)cc1 796511086 PIIBURLLVTYDFX-INIZCTEOSA-N 325.478 1.656 10 10 EDCE CCN1CC[C@H]1C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 1154275913 LJBLHEROKKKVQY-SFHVURJKSA-N 344.459 1.066 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2C[C@H](CO)[C@@H](CCO)C2)c1O 1308163443 LJXRICACKVRUBY-WCQYABFASA-N 327.808 1.671 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(CNC(=O)C3)C2)c(Br)c1 2119573377 SYTWKYQHRSPLCU-SECBINFHSA-N 325.206 1.829 10 10 EDCE Oc1ccc(Br)cc1CN[C@@]12CC[C@@H](C1)[C@H](O)[C@H]2O 2120389881 XGGWOFUYXCWYJK-IOEYQFCTSA-N 328.206 1.519 10 10 EDCE CC(C)(C)[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCO1 1329496052 XLZXMJXJVDWOME-OAHLLOKOSA-N 332.400 1.508 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H](O)[C@H]3C)c(Br)cc21 2126120034 QDDZFTNNQKFSCS-KKIHLJRUSA-N 326.194 1.231 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N[C@@H]2CC[C@H]3[C@H](C2)C3(F)F)cc1 1333544595 WVFSJMRFHHQBBV-RDBSUJKOSA-N 337.370 1.478 10 10 EDCE CCON(C)C(=O)CNCc1ccc(N2CCN(C)CC2)c(F)c1 1346204895 GPBNOMUTBWFVCH-UHFFFAOYSA-N 338.427 1.077 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2cc(C)no2)cc1C 1507171409 CWVAGRKHOVHJQC-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H](C[C@H]1COCCO1)C(F)(F)F 1455355185 QQYCLRVKLFCHNN-NWDGAFQWSA-N 349.305 1.698 10 10 EDCE Cc1[nH]nc(C(=O)NCc2ccc(N3CCSCC3)cc2)c1O 1464261836 PQPWZWWESMSQRB-UHFFFAOYSA-N 332.429 1.907 10 10 EDCE CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)/C=C/c1ccc(O)c(O)c1 1611277411 ILHWLHUKIODGJR-DBWMJRBXSA-N 337.372 1.320 10 10 EDCE C[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CC[C@@H]1N1CCN(C)CC1 1623046838 ZYSWTJIYBXQFTP-HOCLYGCPSA-N 347.459 1.125 10 10 EDCE CC(C)N(C)C(=O)C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1625508351 IIWQSCNQSRIBBG-UHFFFAOYSA-N 334.416 1.746 10 10 EDCE COC(=O)c1ccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)nc1 1625909122 GUUQKFCNSZZDJM-CLTKARDFSA-N 328.324 1.609 10 10 EDCE CC[C@H](C)CC(=O)NC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1720906851 LQMXWRAJHAWQTM-RYUDHWBXSA-N 337.420 1.770 10 10 EDCE CC(=O)C(=O)[C@H](O)c1cc(Br)c(Br)o1 1929174120 FULNSFSOVWBNPI-SSDOTTSWSA-N 325.940 1.996 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N3CC(CO)C3)c(Br)cc21 2148953604 OGJVPSUAQKRZAI-ZDUSSCGKSA-N 340.221 1.480 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@]12COCCN(CCN=[N+]=[N-])C2 2006176669 KDTRFUSYSNOVQQ-OAHLLOKOSA-N 341.412 1.635 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CS(=O)(=O)C[C@H]1Oc1ccc(N)cc1 1992470267 IWNPANFEWJNOEZ-QWHCGFSZSA-N 342.417 1.338 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)OC(C)(C)C1 2010403526 FNIDRVRJNLDCPN-LLVKDONJSA-N 339.396 1.922 10 10 EDCE COc1ccc(O)c(CN[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)c1 2011488455 WTKPMGACHAYCEG-ZFWWWQNUSA-N 338.404 1.471 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2018047563 QZRLADPADSZLBB-VXGBXAGGSA-N 341.412 1.954 10 10 EDCE NCc1ccc(N2CCN3C[C@@H](O)C[C@H]3C2)c(Br)c1 405273283 SWVKEMVCRZVUEC-RYUDHWBXSA-N 326.238 1.163 10 10 EDCE C[C@H](OCc1ccccc1)[C@H](NC(=O)c1cccc(O)c1O)C(=O)O 706115515 UAOREEAQHYNOHC-NHYWBVRUSA-N 345.351 1.886 10 10 EDCE Oc1cccc(Br)c1CNC[C@H]1CN2CCN1CC2 706872158 JKKPQLTYLPCUMS-NSHDSACASA-N 326.238 1.244 10 10 EDCE NCc1cc(F)c(N2C[C@H]3C[C@H](O)[C@H](O)[C@H]2C3)cc1Br 2173316892 HDXPFVQBJUVOMP-ARFBSJSSSA-N 345.212 1.367 10 10 EDCE NCCC1(O)CCN(Cc2ccc(Br)cc2O)CC1 717969909 HEJNPPROTHHULE-UHFFFAOYSA-N 329.238 1.830 10 10 EDCE COc1ccc(N2C[C@H]3C[C@@]2(CO)CO3)c(OC)c1Br 2234890033 BKCYSHYBDIYOJE-YMTOWFKASA-N 344.205 1.806 10 10 EDCE COc1ccc(Br)c(CN[C@@H](C(N)=O)C(C)C)c1O 2227748209 LJYFAGMRWUFVBS-LLVKDONJSA-N 331.210 1.763 10 10 EDCE CC(C)CN1C(=O)C(=CNCc2ccc(F)cc2)C(=O)NC1=S 2295113184 GSLSSGHIPWXZQA-UHFFFAOYSA-N 335.404 1.699 10 10 EDCE CNCc1ccc(N2CC3(CCC(=O)NC3)C2)cc1Br 2280249304 CHYFEDMZCPHFCE-UHFFFAOYSA-N 338.249 1.885 10 10 EDCE COC(=O)COc1ccc(N(C)C(=O)C=Cc2cnn(C)c2C)cc1 2308366667 REEHIFJBNQTEJP-UHFFFAOYSA-N 343.383 1.957 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2333233763 JVENZGIMUWSRLJ-KQXJFYCDSA-N 334.185 1.382 10 10 EDCE COc1ccc(S(=O)(=O)N2CCN(c3ccc(N)cc3)CC2)cc1 8031019 OLPFRVTXDVVYBT-UHFFFAOYSA-N 347.440 1.788 10 10 EDCE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@@H]1CCC[C@@H]1O 172551237 SVRIMZKWTQKMTO-CVEARBPZSA-N 335.473 1.952 10 10 EDCE NC(=O)[C@H]1CCC[C@@H](NC(=O)NCCCSc2nccs2)C1 177833217 OLPPJCMAYVWWAN-WDEREUQCSA-N 342.490 1.969 10 10 EDCE CCNC(=O)C1CN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 255838345 RXELHJLRPKHESS-ALCCZGGFSA-N 333.344 1.353 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN(C(C)=O)C[C@H]2C)c([N+](=O)[O-])c1 268659121 HZGQQACIZKEZER-HOSRBBHYSA-N 347.371 1.838 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnnc(C)c3)CC2)cc1F 276546030 PRXCZCKIXZFYPP-UHFFFAOYSA-N 330.363 1.895 10 10 EDCE CC1CCN(c2ccc(CNC(=O)CN3CCOCC3=O)cc2)CC1 279251711 IHFCGTDVBOWLGT-UHFFFAOYSA-N 345.443 1.398 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC[C@H]2c2nc(N)n(C)n2)c1O 284402385 WMKSGCWBBKJBSI-ZDUSSCGKSA-N 333.367 1.782 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2[C@@H](CN)C2(F)F)c(O)c1Br 2380739969 QFGRWGJDFQHCCU-BDAKNGLRSA-N 349.175 1.919 10 10 EDCE COC[C@@H]1[C@@H](O)[C@@H](O)CN1Cc1ccc(C)c(Br)c1O 2380802403 DHYGOUCGEBTGJH-UHIISALHSA-N 346.221 1.016 10 10 EDCE CNC(=O)[C@@H]1COCCN1c1ccc([C@H](C)N)c(Br)c1 723181882 RUGAQECICJUCBU-ZANVPECISA-N 342.237 1.420 10 10 EDCE Cn1nccc1C(=O)N1CCOc2ccc(N3CCOCC3)cc2C1 575542602 VQYYSIDPAQXADH-UHFFFAOYSA-N 342.399 1.292 10 10 EDCE COC[C@@](C)(NC(=O)OC(C)(C)C)[C@@H](N)Cc1ccc(O)c(O)c1 1952848580 NIUGCPFMGBSBJG-WMLDXEAASA-N 340.420 1.897 10 10 EDCE CCCN(CC(=O)O)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 588450366 ZUNPWJQGUGRSGV-YVMONPNESA-N 332.400 1.860 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@]1(C)C[C@H](O)CN1C 910557509 DAVMFXNHABKDOP-FNHZYXHNSA-N 333.476 1.563 10 10 EDCE C[C@@H]1c2nncn2CCN1c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 844214037 NPWMPBZIHDVTMA-TZGMSPROSA-N 329.316 1.865 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCNC(=O)CC3)C2)cc1 855225791 MEWIZADYINVKIX-KBPBESRZSA-N 331.416 1.306 10 10 EDCE O=C(CSCC(=O)N1CCCCC1)NCc1c(O)cccc1F 928712063 NTTBLPKCVYQNPD-UHFFFAOYSA-N 340.420 1.893 10 10 EDCE COC(=O)CCNC(=O)CCN[C@@H](C)c1cc(Cl)ccc1O 858540748 ABUFYERMEFHXQN-JTQLQIEISA-N 328.796 1.766 10 10 EDCE CNC(=O)CCCCC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855228238 YBWSDJDAMGUVBB-CQSZACIVSA-N 333.432 1.697 10 10 EDCE CCON(CC)C(=O)CNC(=O)N[C@H](C)c1cc(OC)ccc1O 858712960 UAJWAVSZVFMINR-LLVKDONJSA-N 339.392 1.561 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)NCCc2ccc(O)c(O)c2)c1 767784651 FBWRPSLAJSIXCS-HWKANZROSA-N 341.367 1.225 10 10 EDCE C[C@H](NC(=O)NC[C@@H]1CCCS(=O)(=O)C1)c1ccccc1O 868611680 HKVLNIBQUFQLCN-RYUDHWBXSA-N 326.418 1.577 10 10 EDCE COc1ccc(O)c(CNC(=O)COCc2ccnc(OC)c2)c1 860241251 HQOKJKCFRJNNSM-UHFFFAOYSA-N 332.356 1.637 10 10 EDCE CCOC(=O)[C@H](Cc1ccccn1)NC(=O)c1ccc(C)c(O)c1O 760622385 MFUSTQPIFULOIM-AWEZNQCLSA-N 344.367 1.705 10 10 EDCE COc1ccccc1[C@@H](O)CNC(=O)/C=C/c1ccc(O)c(O)c1 779528386 HNROHOHWDYAUHI-DYLHUKMJSA-N 329.352 1.969 10 10 EDCE C[C@H](NCc1nc(N(C)C)no1)c1ccc(N2CCOCC2)cc1 799154897 FZBPKBZZUFKVOC-ZDUSSCGKSA-N 331.420 1.823 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)[C@@H](CO)C2)cc1Br 704451511 KBTVKGGIWVEDSC-GARJFASQSA-N 330.222 1.539 10 10 EDCE COCCCN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 92775822 AEABTJZJGZHVBS-GFCCVEGCSA-N 328.210 1.874 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(CNC(=O)N3)C2)cc1Br 2121181939 RAQNDRMBBCSUKT-MRVPVSSYSA-N 326.194 1.374 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)NCC[C@@H]2CC2(Cl)Cl)cc1 1328561487 NMKIXKYTLZYLKO-LLVKDONJSA-N 344.242 1.628 10 10 EDCE CC1(C)C[C@H](O)[C@H](O)CN1c1ccc(CN)cc1Br 2132114637 FOFBRADIKFWSBI-QWHCGFSZSA-N 329.238 1.618 10 10 EDCE O=C1Nc2cc(N3CCOCC34CC4)c(Br)cc2[C@@H]1O 1915582894 DUJWWKFBBXLNRA-LBPRGKRZSA-N 339.189 1.804 10 10 EDCE COC(=O)NCC(=O)N1C[C@H](C)[C@H](NCc2ccc(OC)c(C)c2)C1 1502703526 MVYMBVVPBVKOAM-DZGCQCFKSA-N 349.431 1.296 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cnn[nH]2)cc1 1445406943 HMZCPHBVBWTSSX-UHFFFAOYSA-N 337.383 1.884 10 10 EDCE CN(CC(=O)Nc1ccc(N)cc1)C[C@H](O)COCc1ccccc1 1916359802 DVTFHNKLLAEWPK-SFHVURJKSA-N 343.427 1.717 10 10 EDCE CC(C)(C)c1cn(C[C@@H]2OC[C@H](O)[C@H]2NCc2ccccc2O)nn1 1615716300 UOLYYZWXGXNOAV-YQQAZPJKSA-N 346.431 1.199 10 10 EDCE CC(=O)N1CCCN(c2ccc(CN)c(Br)c2)CC1 228150639 QJOPGGIOOGRSLN-UHFFFAOYSA-N 326.238 1.966 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H](C)NC(N)=O)cc1C 1480758593 IGWUZAMMQSQGNZ-OLZOCXBDSA-N 336.436 1.045 10 10 EDCE C[C@]1(C(=O)NCc2c(O)cccc2F)Oc2ccccc2NC1=O 1645051029 SQWIGTULKRBEFQ-QGZVFWFLSA-N 330.315 1.937 10 10 EDCE COC(=O)[C@H](C[C@@H]1CCCOC1)NC(=O)Cc1ccc(O)c(O)c1 1648734816 YHFBOOAYQFNAPC-STQMWFEESA-N 337.372 1.115 10 10 EDCE COc1ccc(O)c([C@@H](C)NCc2nc(CS(C)(=O)=O)no2)c1 1658023391 JXVUZQUNKOOVQX-SECBINFHSA-N 341.389 1.179 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)[C@@H]2CCCO2)c2nccn2C)cc1 169813577 BTMXCMUEPZRPKE-HOTGVXAUSA-N 328.416 1.871 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1csc(-c2ncccn2)n1 158989346 PUDUWCYUBXNPCG-UHFFFAOYSA-N 328.353 1.941 10 10 EDCE C[C@@H](CO)[C@@H](C)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 153806695 MYKRVZSVWJANTB-QWHCGFSZSA-N 339.411 1.478 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)C(=O)O 1951545745 PMIWVDPCCKQQAU-SECBINFHSA-N 325.317 1.187 10 10 EDCE OC[C@@H]1CO[C@@H](CNCc2cc(Br)cc(F)c2O)C1 1966089132 VWOVIXWFMLSXHF-LDYMZIIASA-N 334.185 1.781 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCN=[N+]=[N-])C[C@H]2OCC[C@@H]21 1985095894 KMXPWEOKBORWQG-GARJFASQSA-N 325.369 1.580 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)NCC1(CN=[N+]=[N-])CC1 1986369621 VTAXJBIKZZIIEI-SNVBAGLBSA-N 327.385 1.469 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@H](O)C2CN(C(=O)OC(C)(C)C)C2)cc1 1999536289 IKDBJYHCNAJEOY-HZPDHXFCSA-N 335.448 1.980 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](OCC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010403847 KOPRRLRTLJQYTA-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)NCc2ccc(N)cc2)CC(O)C1 2018065972 VMADJKJVYQPLLS-UHFFFAOYSA-N 335.404 1.303 10 10 EDCE CC(C)(C)OC(=O)NCCc1n[nH]c(=NCc2ccccc2O)o1 2024247196 PDYRLHFZXGVANY-UHFFFAOYSA-N 334.376 1.876 10 10 EDCE CCN(c1ccc([C@@H](C)N)c(Br)c1)[C@H]1CC(=O)NC1=O 2171192591 KQTZDFOFMDZTBA-PELKAZGASA-N 340.221 1.710 10 10 EDCE NC(=O)Cn1cc(NCc2c(O)cccc2Br)cn1 706846567 LAEAHDAMXOHWKS-UHFFFAOYSA-N 325.166 1.449 10 10 EDCE CCNCc1ccc(N2CCN(C)[C@@H](CO)C2)c(Br)c1 687619080 YANCWXJCKDNYGF-CYBMUJFWSA-N 342.281 1.671 10 10 EDCE C[C@]1(C(=O)O)CN(Cc2c(O)cccc2Br)CCO1 711580565 NSWBULCDBDHTPB-CYBMUJFWSA-N 330.178 1.830 10 10 EDCE C[C@@H]1[C@H](CO)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 385832638 UICCHGUZWAQDGE-UJVNDKKSSA-N 340.221 1.608 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCO[C@@H](C(F)(F)F)[C@H]3C)c2n1 2064779592 NZOLPNFBZQBHTG-LDYMZIIASA-N 344.293 1.535 10 10 EDCE O=C(O)[C@]1(CO)CCCN1Cc1cc(Br)cc(F)c1O 2201057417 VBBYKGIAYCBBEH-CYBMUJFWSA-N 348.168 1.705 10 10 EDCE CC1(C)[C@@H](CO)OCCN1c1ccc(CN)c(Br)c1 2103380682 BMJYNCAUSRUSEC-CYBMUJFWSA-N 329.238 1.884 10 10 EDCE CN(C)C(=O)[C@H]1CCN(c2ccc(CO)cc2Br)C1 2087357385 MUXUIOOVCNLXAK-NSHDSACASA-N 327.222 1.856 10 10 EDCE Cn1nc(C(=O)NCc2cc(N)ccc2O)cc1Br 2094084656 QNECIUBJQOJZDJ-UHFFFAOYSA-N 325.166 1.400 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])COC1 2213594335 YKZMADCWIZLIKC-MNOVXSKESA-N 339.396 1.970 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](N)[C@@H]3COC[C@@H]32)c1O 2236039753 DHSSPVURODITIR-DLOVCJGASA-N 343.221 1.321 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CN(Cc3cc(N)ccc3O)CCO2)C1 2260048265 MPGUUVHQGYNIPO-UHFFFAOYSA-N 349.431 1.796 10 10 EDCE COCCN1C(=O)C(=Cc2ccc(N(C)C)cc2)C(=O)NC1=S 2297560278 KRSMJXDGGDNKQN-UHFFFAOYSA-N 333.413 1.026 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(COC(=O)N3)C2)cc1Br 2351837972 SBYFMATYOUBOOT-MRVPVSSYSA-N 327.178 1.801 10 10 EDCE Cc1ccc(CN(C)CCn2cnnn2)c(O)c1Br 2352659019 WJTGZFMHRWSECJ-UHFFFAOYSA-N 326.198 1.582 10 10 EDCE COCCN/C(C)=C1/C(=O)N(c2ccccc2)N=C1CC(=O)OC 101842448 RUYMIIDMHBLBRN-FOWTUZBSSA-N 331.372 1.462 10 10 EDCE O=C(NC1CCN(Cc2ccccc2)CC1)c1cc(O)nc(O)c1 170223565 LTDCXHDIVBDMNO-UHFFFAOYSA-N 327.384 1.887 10 10 EDCE C[C@@H](N[C@H]1CCc2ncnn2C1)c1ccc(N2CCOCC2)c(F)c1 180605746 MTPZMFFPUSTZKR-HIFRSBDPSA-N 345.422 1.919 10 10 EDCE COCCN1CCCN(C(=O)NCc2ccc(N(C)C)cc2)CC1=O 188509429 GWGNRUWUPABGQX-UHFFFAOYSA-N 348.447 1.143 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)[C@@H]2CCN(C)C2=O)c([N+](=O)[O-])c1 77992245 NVFFVCOJWRIAQE-VUDGCMKMSA-N 333.344 1.448 10 10 EDCE COc1ccccc1[C@H]1CNCCN1C(=O)Cc1ccc(N)cc1 262061535 VZBLTQINAWCYLA-QGZVFWFLSA-N 325.412 1.993 10 10 EDCE O=C1C[C@]2(CCN(C(=O)NCc3ccc(N4CC=CC4)cc3)C2)CN1 279582916 URCPQXQYDUSYON-LJQANCHMSA-N 340.427 1.484 10 10 EDCE C[C@@H]1CN(Cc2cc(Br)cc(F)c2O)[C@@H](C(=O)O)CO1 2165796082 TZIIKVVLMKVUOY-RDDDGLTNSA-N 348.168 1.968 10 10 EDCE CCOC(=O)CC[C@H](C)N1C(=O)CN(Cc2ccccc2O)C1=O 819168867 UMZVVTHHWISCAU-LBPRGKRZSA-N 334.372 1.888 10 10 EDCE COC[C@@]1(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)CCOC1 819587937 QWZAXSSIWKIYRC-BEFAXECRSA-N 348.443 1.691 10 10 EDCE CCC(=O)c1ccc2oc(=O)c(=O)n(OCc3ccc(N)cc3)c2c1 821296449 DDQRKCPDJNMJKB-UHFFFAOYSA-N 340.335 1.758 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3C[C@@H](N)C(C)(C)C3)CC2)cc1 903555872 FHYBUPSPEADKTM-QGZVFWFLSA-N 346.475 1.013 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H](Cn2cncn2)C1 588407186 NBSLKHBQESKUOU-SDQPKGBYSA-N 328.372 1.641 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCOC1 849369578 YWXRBMVHIVCJFX-GDBMZVCRSA-N 342.461 1.224 10 10 EDCE O=S1(=O)CC[C@]2(CN(Cc3c(O)ccc4ccccc34)CCO2)C1 842634381 UWUJCSDBDBQAOL-SFHVURJKSA-N 347.436 1.935 10 10 EDCE CC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCCCO1 848930531 UWFKATTVLBIHGB-IAGOWNOFSA-N 347.459 1.833 10 10 EDCE COc1ccc(N2CCN(C[C@H]3CC4(CNC4)CO3)CC2)c(OC)c1 923413525 GOLCALNDHGGWDO-MRXNPFEDSA-N 347.459 1.204 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1C[C@@H]2COC[C@]2(C(=O)O)C1 851649110 IYFCTJQUDDUYKQ-RDTXWAMCSA-N 347.415 1.304 10 10 EDCE COc1ccc(N2CCC(N3C(=O)N[C@H](CSC)C3=O)CC2)cc1 924578052 ODKOYIXHHVGQGF-OAHLLOKOSA-N 349.456 1.947 10 10 EDCE Cc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)nc(C)n1 755141133 SJLFTXOCSULSMP-UHFFFAOYSA-N 326.400 1.860 10 10 EDCE COc1ccc(N2CC[C@@H](N[C@H]3C(=O)NCC34CCOCC4)C2)cc1 926680683 RMXPGDZOSGWDOT-PBHICJAKSA-N 345.443 1.159 10 10 EDCE C[C@H]1CCNC[C@@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851663972 OGSGCUFNTAYBJV-KSSFIOAISA-N 346.475 1.445 10 10 EDCE CCOc1cccc(CNC2CCN(C(=O)CCCNC)CC2)c1O 853247060 AWHCWJPKYSYGGX-UHFFFAOYSA-N 349.475 1.871 10 10 EDCE C[C@]12COC[C@@]1(C)CN(c1cc3c(cc1[N+](=O)[O-])OCC(=O)N3)C2 853812854 PODOENZCEJTQAF-IYBDPMFKSA-N 333.344 1.789 10 10 EDCE COCCOC1CN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])C1 754493304 PVRHGFQEUWCAKZ-GQCTYLIASA-N 336.344 1.633 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@H](OC)C(=O)OC(C)(C)C)c1 866765681 YPEHKQSWDDWINM-YGRLFVJLSA-N 339.388 1.935 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1nnc2c1CCCC2 935945654 FSFSCNMLJBSQSA-UHFFFAOYSA-N 335.404 1.665 10 10 EDCE COc1cc(Cl)cc(CN2CCC[C@H]2CS(N)(=O)=O)c1O 761197412 DMOSGMHCOSLZIB-NSHDSACASA-N 334.825 1.307 10 10 EDCE COc1ccc(CNC(=O)Nc2cnn(-c3ncccn3)c2)c(O)c1 797630550 GLMLLWZFRXLJOX-UHFFFAOYSA-N 340.343 1.698 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC[C@]34CCOC4)CC2)cc1 1325414614 QYSDYEVPNMONQN-LJQANCHMSA-N 345.443 1.209 10 10 EDCE CN(CCC(=O)OC(C)(C)C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329377953 GKOPWWLFYLIHCS-UHFFFAOYSA-N 348.399 1.425 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@@H]1COCCN1C 1254220990 BGEFZTQBMRVZEA-GOSISDBHSA-N 346.475 1.759 10 10 EDCE Nc1ccc(COC[C@@H](O)CN2C(=O)c3ccccc3C2=O)cc1 1905313391 DTJGSHXYHOKFPJ-AWEZNQCLSA-N 326.352 1.443 10 10 EDCE CC(C)(C)OC(=O)N1CC(CC(=O)NCc2cccc(O)c2O)C1 1263894689 RACOYAFJNOWQKS-UHFFFAOYSA-N 336.388 1.971 10 10 EDCE CCOC(=O)CN(CCOC[C@@H]1CCCO1)Cc1ccccc1O 1618720319 CNRIBMCEVPJVJY-INIZCTEOSA-N 337.416 1.953 10 10 EDCE COCC(=O)N[C@@H](C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1701980056 LZNWWWJXCODCFM-QWRGUYRKSA-N 349.391 1.509 10 10 EDCE C[C@H](CNC(=O)C(F)F)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1486780794 DIJMNCZOXZXUON-MRVPVSSYSA-N 341.318 1.691 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CN2CCCNC2=O)cc1C 1480494409 YVMIOGXDXZFZOF-CQSZACIVSA-N 348.447 1.013 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc(F)c(S(N)(=O)=O)c2)c1 1557552965 IRFBBYMFVRQTCH-UHFFFAOYSA-N 338.360 1.417 10 10 EDCE Cc1nc(O)nc(S)c1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1632681062 MCMPYUDOVXLMQA-SSDOTTSWSA-N 335.385 1.552 10 10 EDCE C[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CCN1CC(F)(F)F 1637848664 AEFHRCCSNCZXQM-SNVBAGLBSA-N 332.322 1.735 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C2(C)CCCC2)cc(OC)n1 1720927081 FXEDXESZKCXLRN-GFCCVEGCSA-N 349.431 1.914 10 10 EDCE O=C1CN(C(=O)Cc2ccc(O)c(O)c2)[C@H](c2ccccc2)CN1 1639027710 VRYOLMJSLRYOGU-AWEZNQCLSA-N 326.352 1.340 10 10 EDCE NC(=O)CC[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1584677332 LCLHFCGUPZOBNQ-NSHDSACASA-N 331.376 1.967 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCc1nc(N)n[nH]1 1687348221 TYYCYSHMQTXBDY-UHFFFAOYSA-N 343.435 1.719 10 10 EDCE Cc1cc(C(=O)NC[C@H]2CC[C@H](C(N)=O)O2)c(C)n1-c1ccccc1 161311785 WVGWJTMXUKBUPL-NVXWUHKLSA-N 341.411 1.857 10 10 EDCE O=C(N[C@@H](COCc1ccccc1)C(=O)O)c1cccc(O)c1O 1946555207 NEBICOPEUNCUHD-ZDUSSCGKSA-N 331.324 1.498 10 10 EDCE CO[C@@H](C(=O)O)C1CN(Cc2cc(Br)cc(F)c2O)C1 1875978605 BKYLPGPRBXNNPD-GFCCVEGCSA-N 348.168 1.825 10 10 EDCE Nc1cccc(Br)c1N[C@@H]1CCNCC[C@@H]1C(=O)O 1876304236 KZZKYYAFDHHCAX-GZMMTYOYSA-N 328.210 1.896 10 10 EDCE NCc1ccc(N2C[C@@H]3CCC[C@@]3(C(N)=O)C2)c(Br)c1 2144089877 DBCGXUGRZJDRKZ-XHDPSFHLSA-N 338.249 2.000 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)NCCN=[N+]=[N-])C[C@@H]1CCCO1 1963818848 ZFUMVASEESHPMV-NSHDSACASA-N 327.385 1.829 10 10 EDCE COc1ccc(Br)c(CNC[C@]2(O)CCO[C@@H]2C)c1O 1964064083 GLLGGQUOEAZDAM-YMTOWFKASA-N 346.221 1.793 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 1985094895 VQIGNVRLERQHMD-JTQLQIEISA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H](C(=O)NCCCN=[N+]=[N-])C1 1985103271 SFICEFYOKBPPJX-MNOVXSKESA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NCc2ccc(F)cc2O)C1 1994520956 QVFKVAQDWFRAOQ-OCCSQVGLSA-N 326.368 1.601 10 10 EDCE O=C1NC(=O)[C@H]2CN(c3ccc(CO)c(Br)c3)CC[C@H]12 2158790180 SSKLZUKBWUJKKY-QWRGUYRKSA-N 339.189 1.040 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC(CN=[N+]=[N-])CC1 2012343845 REVOFTQNENNTFZ-LBPRGKRZSA-N 341.412 1.811 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)C[C@H](O)C1 2018045697 IICYZCFUGLRRQG-ZIBATOQPSA-N 339.396 1.706 10 10 EDCE C[C@@H](N)c1ccc(N(C)C2CS(=O)(=O)C2)c(Br)c1 2034767595 DCNMKQMBWZGUEZ-MRVPVSSYSA-N 333.251 1.702 10 10 EDCE CN1C(=O)N[C@H]2CN(c3ccc(CN)cc3Br)CC[C@@H]21 2171304543 HKEXFDBRTTXMKP-AAEUAGOBSA-N 339.237 1.510 10 10 EDCE Oc1cccc(Br)c1CN1CC(N2CCNCC2)C1 706818627 OPAGPPJFJLWSCT-UHFFFAOYSA-N 326.238 1.244 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(C)[C@H](CO)C2)c(Br)c1 687589014 FUOIOMAXVIHGNU-PWSUYJOCSA-N 329.238 1.615 10 10 EDCE CC=C[C@H](O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 2053284645 IEVXRSMSQNYVAO-KRWDZBQOSA-N 335.423 1.521 10 10 EDCE CCCNCc1ccc(N2CC[C@@H](O)[C@H](O)C2)c(Br)c1 2188637583 VGRIJHSQOUYZNG-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc(N)cc1)C1(O)CCC1 2080947872 RGUBLOARLSVVMJ-CQSZACIVSA-N 349.431 1.693 10 10 EDCE N[C@@H]1CN(Cc2cc(Cl)cc(Br)c2O)[C@H]2COC[C@H]12 2102138291 USOFSYFSAXYAHR-JLLWLGSASA-N 347.640 1.966 10 10 EDCE O=C1C[C@@H]2CCN(c3ccc(CO)cc3Br)C[C@@H]2N1 2088803223 GCFWYDYLJRJAQV-JQWIXIFHSA-N 325.206 1.656 10 10 EDCE NCc1cc(F)c(N2C[C@H](CO)C[C@@H]2CO)cc1Br 2089907891 ONESDYNXGPFXLB-PSASIEDQSA-N 333.201 1.226 10 10 EDCE O=C(O)[C@@H]1CC[C@@H](O)CN1Cc1c(O)cccc1Br 2264529377 RKOJZEIAPVNBDA-KCJUWKMLSA-N 330.178 1.565 10 10 EDCE COc1cc(C=C2C(=O)N(c3nn[nH]n3)N=C2C)cc(Cl)c1O 2296441624 VAAJSFMYDXDQPZ-UHFFFAOYSA-N 334.723 1.373 10 10 EDCE O=C1CC[C@@H](COC(=O)C=Cc2ccc(N3CCOCC3)cc2)N1 2297507178 MCDWKHTWRDZCHX-HNNXBMFYSA-N 330.384 1.358 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)cc1Br 2355340218 NRYWULHGYCXGKD-PTPDJHTLSA-N 342.233 1.823 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1C[C@@H]2C[C@H]1[C@H](O)[C@@H]2O 2355465297 XSTITNZOLDXURF-YHXLARSLSA-N 342.233 1.622 10 10 EDCE O=C1NC(=S)N/C1=C\c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 103792240 SZZCWZLDIDIZPB-FLIBITNWSA-N 332.385 1.930 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)OCCn1cncn1 66656268 VJSFRISLRXWBJF-ZZXKWVIFSA-N 328.372 1.371 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C2CC3(C2)NC(=O)NC3=O)cc1 178933164 CPFYUXMFWXUTSU-UHFFFAOYSA-N 344.415 1.137 10 10 EDCE CCCNCc1ccc(N2CC([C@@H](O)CO)C2)cc1Br 2361905477 GEHIVXHUUIQYDC-HNNXBMFYSA-N 343.265 1.738 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1CC(=O)CO1 1952400396 GKAHREGIVMJAEV-DOMZBBRYSA-N 337.372 1.892 10 10 EDCE CN1CC[C@H](NC(=O)/C=C/c2ccc(N3CCOCC3)cc2)CC1=O 190149016 DZVHZYZOTLDIFR-RRGWEWPQSA-N 343.427 1.273 10 10 EDCE CN(C)c1noc(C2CCN(Cc3cc4c(cc3O)OCO4)CC2)n1 191909624 WZYQDWZHEJIKKT-UHFFFAOYSA-N 346.387 1.950 10 10 EDCE C[C@@H]1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)C[C@@H]1N(C)C 266141743 FSBQAFQXLCPNQB-MCFURUIZSA-N 343.471 1.945 10 10 EDCE Cc1cc(N2CCC[C@@H](NC(=O)c3ccc(C)c(O)c3O)C2)n(C)n1 278079296 IHLCSIDPAMBNNA-CYBMUJFWSA-N 344.415 1.847 10 10 EDCE CS(=O)(=O)NC[C@H]1CCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1O 800310430 ZHTDDGQABGKCDJ-MFKMUULPSA-N 343.405 1.108 10 10 EDCE CC(=O)C(=O)COC(=O)c1c(C)cc(=O)n(-c2ccccc2)c1C 808505000 RYIGLHNBVMGIHB-UHFFFAOYSA-N 327.336 1.769 10 10 EDCE O=C(NCc1cc(Br)ccc1O)c1c[nH]nc1[N+](=O)[O-] 807740953 XLEPCIBTIKSOOC-UHFFFAOYSA-N 341.121 1.716 10 10 EDCE CN(C)c1ccc([C@H](N)[C@H](O)c2cn(C)nc2Br)cc1 2163139535 YKCSUWONIIRFMY-QWHCGFSZSA-N 339.237 1.982 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cn(CC4CC4)nn3)CC2)cc1 823554697 MUPUXNJQMZRPPR-UHFFFAOYSA-N 341.415 1.659 10 10 EDCE C[C@@H](NC[C@@]1(CO)COCCN1C)c1cc2c(cc1O)CCCC2 903283094 WRBGKWLFINWOPK-AUUYWEPGSA-N 334.460 1.615 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H](Cc2cncs2)C(=O)O)cc1 908759016 WEUGEWLGYJNNJB-AWEZNQCLSA-N 348.428 1.704 10 10 EDCE Cc1ccc(C(=O)N2CCS(=O)(=O)[C@H]3CCC[C@H]32)c(O)c1O 837095368 CIOJSVZZPJZRHV-NEPJUHHUSA-N 325.386 1.198 10 10 EDCE C[C@H](NC[C@@]1(CO)COCCN1C)c1ccc2ccccc2c1O 903278375 FNVBMNQPBMRUCM-IFXJQAMLSA-N 330.428 1.889 10 10 EDCE C[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccncc1 749544735 IOHFASWMVCSZDT-NSHDSACASA-N 349.412 1.692 10 10 EDCE CCN1C[C@@H](CN(CCOC)c2ccc(OC)c(OC)c2)OC1=O 846829051 PORJLZMUTNEYSB-AWEZNQCLSA-N 338.404 1.997 10 10 EDCE C[C@H]1[C@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCN1C 923338023 WZXQCNZZJNLINR-KBXCAEBGSA-N 346.475 1.540 10 10 EDCE COC(=O)[C@@H]1CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H](C)O1 858732057 IDJAEUDFJCSREA-OTYXRUKQSA-N 340.332 1.379 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3[C@H]4CC[C@H]3CC(O)C4)C2)cc1 854300782 AEMFDGDPJWTHCN-KBMXLJTQSA-N 345.443 1.971 10 10 EDCE C[C@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@@H](c2ccn(C)n2)C1=O 761576485 NHCHIRSQQRYQCK-ABAIWWIYSA-N 327.388 1.840 10 10 EDCE c1nsc(N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)n1 930630620 FNFVWNZISPJWDU-UHFFFAOYSA-N 345.472 1.697 10 10 EDCE CC[C@H](NC[C@]12COCCN1C(=O)COC2)c1ccc(N(C)C)cc1 866552736 BNTGYPSEIOTJBK-PKOBYXMFSA-N 347.459 1.421 10 10 EDCE NC(=O)c1cn(C2CCN(Cc3cc4c(cc3O)CCC4)CC2)nn1 863301297 VJJBNHZOVAAEOA-UHFFFAOYSA-N 341.415 1.408 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@H]2COC[C@]2(C)C1 1118494587 IPLSGMBIHKESQJ-KXBFYZLASA-N 345.443 1.206 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CCC(C)(C)O1 1117395678 ADLVYKLPGHDHTG-INIZCTEOSA-N 347.459 1.751 10 10 EDCE C[C@@H]1CCn2cc(C(=O)NC[C@H](N)c3ccc(N(C)C)cc3)nc2C1 870932454 FQYDBOVNKROFNP-CJNGLKHVSA-N 341.459 1.961 10 10 EDCE CNCc1ccc(N2CCO[C@H](CCO)C2)c(Br)c1 2116230278 QSPYXMKDNWMRCV-GFCCVEGCSA-N 329.238 1.756 10 10 EDCE CCOC(=O)C1([C@H](C)NC(=O)c2cccc(O)c2O)CCOCC1 1179532368 SWANVYCGQRNRLS-NSHDSACASA-N 337.372 1.576 10 10 EDCE NCc1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)cc1Br 2121593454 QFNICTKGCUYCAN-SUHUHFCYSA-N 327.222 1.351 10 10 EDCE CO[C@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 1324280071 KNIUDSSKBRMTEM-WBVHZDCISA-N 345.443 1.587 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@]2(C)CC2(F)F)cc1 1333957559 XZGFOPSLYUQTCS-OAHLLOKOSA-N 325.359 1.530 10 10 EDCE C[C@@H]1CN(c2ccc(C=CC(=O)O)cc2Br)CC(=O)N1 1912028367 TZWYOIOFUMLFMZ-SECBINFHSA-N 339.189 1.872 10 10 EDCE CC(=O)OC[C@@H](CO)NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1350992508 OCJDLXFMVMRFQP-QGZVFWFLSA-N 344.411 1.677 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)CC(C)(C)C)cc(OC)n1 1284198432 DYGIGVBAYHLRJG-NSHDSACASA-N 337.420 1.770 10 10 EDCE COC(=O)CC1(CNC(=O)Cc2ccc(O)c(O)c2)CCOCC1 1297788875 DZPBONCBUBAQTQ-UHFFFAOYSA-N 337.372 1.116 10 10 EDCE COc1cccc(CNC(=O)[C@@H]2COc3ccc(O)cc3O2)c1O 1465993566 TWRHUIWQUHKIRU-HNNXBMFYSA-N 331.324 1.563 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(-c2ccn(C)n2)on1 1611431147 KZVQZGGMEXGDMR-SNVBAGLBSA-N 342.355 1.847 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)c2ncn(C)n2)cc1C 1700393981 HMLQREYRKGMOAE-OLZOCXBDSA-N 331.420 1.429 10 10 EDCE CCOC(=O)[C@H](CSC)NC(=O)c1ccc(N=NC(N)=O)cc1 1471866680 URWAZHRYXAFZRZ-NSHDSACASA-N 338.389 1.874 10 10 EDCE C[C@H](O)[C@@H](O)CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1612667016 JLRRZNCTGGIKPQ-ZBEGNZNMSA-N 330.340 1.979 10 10 EDCE O=C(COc1ccc2c(c1)CCC(=O)N2)NCc1cc(O)ccc1O 1558174383 LNFJIOAHHIOVEH-UHFFFAOYSA-N 342.351 1.678 10 10 EDCE CCN(CCOCCO)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1639828179 YGQCKBZLILPDCD-ALCCZGGFSA-N 338.360 1.616 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)CC(C)(F)F)cc(OC)n1 1720937889 GKWWCTBOPGYNIF-SECBINFHSA-N 345.346 1.379 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)C2=COCCO2)cc1C 1568162496 YKUWKZGIULMLTF-ZDUSSCGKSA-N 334.416 1.734 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2nocc2C)cc1C 1568586527 NRRCMNWEBMZYNF-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE COCc1ncc2c(n1)CCN(C(=O)Cc1ccc(O)c(O)c1)C2 1648737230 DOHYMJAQYNADAC-UHFFFAOYSA-N 329.356 1.162 10 10 EDCE O=C(Cn1nnnc1-c1ccsc1)NCc1cc(O)ccc1O 1643882142 OXVSOHUJKITNDP-UHFFFAOYSA-N 331.357 1.129 10 10 EDCE CC[C@@H](CNC(=O)[C@@H](C)OC)NC(=O)c1ccc(N=NC(N)=O)cc1 1759302532 KBDYZXWLSUMZHY-PWSUYJOCSA-N 349.391 1.509 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2nonc2C)cc1C 1698863748 IMABELXSHMIRMV-GFCCVEGCSA-N 332.404 1.945 10 10 EDCE CCNCc1ccc(N2CCOC[C@H]2CO)cc1Br 233532176 SVAWXLSZWLXFOP-CYBMUJFWSA-N 329.238 1.756 10 10 EDCE COc1ccc(CNC2CCN(S(=O)(=O)C3CC3)CC2)c(O)c1 151266452 LYRURRCJLLBMOW-UHFFFAOYSA-N 340.445 1.447 10 10 EDCE Cn1nnc(CNC(=O)OC(C)(C)C)c1[C@H](N)c1ccccc1O 1945005335 ZMOGTURRYVJEGN-CYBMUJFWSA-N 333.392 1.594 10 10 EDCE CO[C@H]1C[C@@H](C(=O)NCCCN=[N+]=[N-])N(C(=O)OC(C)(C)C)C1 1985101751 XGFYMFKYEOYDLK-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)C[C@@H](O)C1 1985102930 NVQMLTYYRUELOD-GXSJLCMTSA-N 325.369 1.125 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCO[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010392370 FWFFGNTWTSNREQ-QJPTWQEYSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)NC(=O)CCc1ccc(N)cc1 2011423495 SNLRVIMJMRLWQC-CQSZACIVSA-N 337.420 1.203 10 10 EDCE NCc1cc(F)c(N2CCN3C[C@H](O)C[C@@H]3C2)cc1Br 405220095 ACDLZPVXHXVTIX-GHMZBOCLSA-N 344.228 1.302 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](CO)[C@@H](CO)C2)cc1Br 704814798 LAFMLTALUOKZEH-IJLUTSLNSA-N 343.265 1.767 10 10 EDCE COC[C@@H]1CN(c2ccc(CN)c(Br)c2F)CCO1 705818183 FTCNLSNZKYSJLZ-JTQLQIEISA-N 333.201 1.899 10 10 EDCE NCc1cc(F)c(N2CCCN(CCO)CC2)cc1Br 380273129 AATKVLJBVZNQEQ-UHFFFAOYSA-N 346.244 1.551 10 10 EDCE CS(=O)(=O)C1CC(NCc2ccc(Br)cc2O)C1 715289698 GLVSASDXDPGZCC-UHFFFAOYSA-N 334.235 1.820 10 10 EDCE O=C(Nc1ccc(O)c(O)c1)[C@H]1CCCN(CC(F)(F)F)C1=O 2063954253 XCTKAFFDYVNUHF-SECBINFHSA-N 332.278 1.837 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1C(=O)NCc1ccccc1O 860232687 CRHKVCLERODXJJ-OCCSQVGLSA-N 336.388 1.691 10 10 EDCE C[C@@H](N)c1ccc(N2CC3(CNC(=O)N3C)C2)c(Br)c1 2177693221 GSRQCNRYGLRTET-SECBINFHSA-N 339.237 1.683 10 10 EDCE C[C@@]1(NC(=O)C(F)(F)F)CCN(C(=O)COc2ccc(N)cc2)C1 2044621880 VPARYVOGIIBHPC-CQSZACIVSA-N 345.321 1.317 10 10 EDCE CNCc1ccc(N2CC[C@@H](C)[C@H]2C(N)=O)c(Br)c1 2090262598 PUPJOLHMMADSJE-RNCFNFMXSA-N 326.238 1.869 10 10 EDCE CCNC(=O)C1CN(c2ccc(CN)c(Br)c2F)C1 2111749685 HJHPVJVKANTOQJ-UHFFFAOYSA-N 330.201 1.619 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@@](C)(O)C2)cc1Br 2201511043 WERYKWAKBAFEHC-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H]3[C@H]4CO)c(Br)cc21 2203132143 REIXOHBKYWUFLF-UDSXGQGJSA-N 338.205 1.218 10 10 EDCE COc1ccc(N2[C@H](C(=O)O)CC[C@@H]2C(=O)O)c(Br)c1 2237309415 AAXLRIGNZVGMPG-PHIMTYICSA-N 344.161 1.964 10 10 EDCE CC(C)(C)OC(=O)N1CCOC(C)(C)[C@H]1C(=O)NCCN=[N+]=[N-] 2242757771 OLGLOXZFPXLVJP-SNVBAGLBSA-N 327.385 1.827 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2C[C@@H](O)[C@H]2OC)c1O 2271171427 UTKRBABTXXSVDX-BREBYQMCSA-N 332.194 1.401 10 10 EDCE CCN1C(=O)C(=CNc2ccc(NC(C)=O)cc2)C(=O)NC1=S 2297510220 MSZOBRUXTALURC-UHFFFAOYSA-N 332.385 1.204 10 10 EDCE C[C@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)c1ncon1 2305556550 RCQOKQGIMYUWSC-ZDUSSCGKSA-N 328.372 1.797 10 10 EDCE CC(C)(C)OC(=O)N1CC(C(=O)N2CCc3cc(O)c(O)cc3C2)C1 2318657024 ZRIQAXCEZZDGRV-UHFFFAOYSA-N 348.399 1.849 10 10 EDCE Cc1ccc(CN2CC(=O)N[C@@H]3CC[C@@H]32)c(O)c1Br 2352652057 OLGHSWJRSBBZMM-MNOVXSKESA-N 325.206 1.926 10 10 EDCE CCc1n[nH]c([C@H]2CN(Cc3cc([N+](=O)[O-])ccc3O)CCO2)n1 173686472 PNSZUVUUWMEOPB-CYBMUJFWSA-N 333.348 1.554 10 10 EDCE O=C1CCN(C(=O)c2cccc3c2C(=O)c2ccccc2C3=O)CCN1 175343064 NBJNIOGIVCQMNI-UHFFFAOYSA-N 348.358 1.424 10 10 EDCE C[C@@H]1C(=O)NCCN1c1ccc(/C=C/C(=O)O)c(Br)c1 235715567 IMYARQIJDQPOAG-HYYFJVDXSA-N 339.189 1.872 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cc(S(C)(=O)=O)c(C)o2)c1 528867296 ZZEDOUNMMWYFGM-UHFFFAOYSA-N 339.369 1.636 10 10 EDCE CCOC(=O)C1(COC)CCN(C(=O)c2cccc(O)c2O)CC1 373668685 WJDNCKXRYGFMNC-UHFFFAOYSA-N 337.372 1.530 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]2c2ccn[nH]2)cc1 298631754 VXLWFLOYUSDUEP-QGZVFWFLSA-N 327.432 1.929 10 10 EDCE COC(=O)[C@@H]1[C@H]2CN(Cc3ccc(N4CCN(C)CC4)cc3)C[C@H]21 814172756 BTERPVDOXBWVNQ-PIIMJCKOSA-N 329.444 1.289 10 10 EDCE Cc1ccc([C@@H](C2CCOCC2)N2CCNCC2)c(O)c1[N+](=O)[O-] 575285334 UVWHJCOFMITTBQ-MRXNPFEDSA-N 335.404 1.982 10 10 EDCE CN[C@@H](C)c1ccc(N2CCN(C(N)=O)CC2)c(Br)c1 722196208 KTLVWVTUSNRAOQ-JTQLQIEISA-N 341.253 1.930 10 10 EDCE N[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(F)(F)F 827364310 HLHSPTDQUDQSOM-CYBMUJFWSA-N 349.328 1.293 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)C3CC(C)(O)C3)CC2)cc1 822824565 ZICKUHNVKGEFLP-UHFFFAOYSA-N 347.459 1.094 10 10 EDCE CC1(C)[C@H](O)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823524348 RIDDWWVDMGSEON-QGZVFWFLSA-N 347.459 1.703 10 10 EDCE COC(=O)c1coc(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)c1 832285452 QPPHYEWZUQRTSR-AWEZNQCLSA-N 331.372 1.562 10 10 EDCE Cn1cc(N2CCC[C@@H](NC(=O)NCc3ccccc3O)C2)cn1 745790185 VGTBFBXRWSHLGY-CQSZACIVSA-N 329.404 1.594 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NC[C@@](C)(CO)OC)cc1F 847313582 JQIWFCZDRJZHOL-KRWDZBQOSA-N 341.427 1.869 10 10 EDCE COC1(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)CC1 843583806 PGWXNHIWEGGFQH-UHFFFAOYSA-N 331.416 1.150 10 10 EDCE C[C@H](CC(=O)NCc1cccc(Br)c1O)NC(N)=O 847927754 BTLNAIOBYOMQMJ-SSDOTTSWSA-N 330.182 1.218 10 10 EDCE CCO[C@@H](CNC(=O)N(C)Cc1ccc(N(C)C)cc1)CN(C)C 926823910 VJCVLQCJQIMIPC-KRWDZBQOSA-N 336.480 1.861 10 10 EDCE Cn1nccc1[C@@H](CO)NCc1c(O)cccc1Br 858178031 QSNSNCPGEVBPGA-LLVKDONJSA-N 326.194 1.711 10 10 EDCE O=C(CCN1C(=O)CCC1=O)NCc1ccc2cccnc2c1O 862028600 FCGWERKOPJOFNC-UHFFFAOYSA-N 327.340 1.096 10 10 EDCE COC[C@]1(C)CN(Cc2ccc(N3CCOCC3)c(F)c2)CCO1 862552447 YXJXKJAAZUAVGC-SFHVURJKSA-N 338.423 1.900 10 10 EDCE CN(C)c1cc(F)c(CNC[C@]23COCCN2C(=O)OC3)cc1F 864054483 SLIGWFXFMOJCGJ-MRXNPFEDSA-N 341.358 1.342 10 10 EDCE Cc1cc(CC(=O)N2C[C@H](O)C[C@H]2C(N)=O)c(C)n1-c1ccccc1 862680427 OTOSIFURYFDVFY-SJORKVTESA-N 341.411 1.084 10 10 EDCE C[C@@H]1C[C@H](CO)CCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 860082788 DCFUFHINKACGSB-NVXWUHKLSA-N 333.476 1.804 10 10 EDCE CCN(CCOCCO)C(=O)c1cc2cc(O)c(O)cc2s1 897670577 DEUPPLJTZJXFRI-UHFFFAOYSA-N 325.386 1.784 10 10 EDCE COC(=O)c1c(CN2CCC[C@@H](C(N)=O)C2)c2cc(F)ccc2n1C 893864200 SVNIYJORVJJLTE-LLVKDONJSA-N 347.390 1.801 10 10 EDCE CCO[C@@]1(C)C[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 1311691517 WQSWZRRVVAFKKK-AEFFLSMTSA-N 333.432 1.890 10 10 EDCE CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1cccc(O)c1O 1176565956 PWFDMUHOZZLXKA-HNNXBMFYSA-N 326.352 1.692 10 10 EDCE CO[C@H]1C[C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1331666635 KYXMHAQVZUTZIR-JOCQHMNTSA-N 337.395 1.049 10 10 EDCE CN1CC[C@H](N(C)c2ccc(CO)c(Br)c2)CC1=O 2131950058 MVRRHAADYISXOG-LBPRGKRZSA-N 327.222 1.998 10 10 EDCE CN1CCCc2cc(CNC(=O)Cc3ccc(C(N)=O)nc3)ccc21 1331333298 HPGVEGHGIQGZHG-UHFFFAOYSA-N 338.411 1.422 10 10 EDCE C[C@@H]1CN(c2nnc(-c3sccc3O)n2CC2CC2)CC(=O)N1C 1348191714 NORIZBJKEGFTST-SNVBAGLBSA-N 347.444 1.789 10 10 EDCE CC[C@H](C)CNC[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1278838192 HECGRCJSLSJRJB-SWLSCSKDSA-N 349.435 1.918 10 10 EDCE Cc1c(C(=O)NCc2c(O)cccc2O)nnn1Cc1ccncc1 1456326075 WHNBFBQMTIIYHN-UHFFFAOYSA-N 339.355 1.371 10 10 EDCE CCC(=O)NC[C@@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1296384919 PZKQGBVOZGYDTH-ZDUSSCGKSA-N 331.376 1.980 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCOC[C@H]1c1ncon1 1295079196 VPYVBNRJKMRAMI-VIFPVBQESA-N 347.352 1.909 10 10 EDCE CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)/C=C\c1ccc(O)c(O)c1 1611277410 ILHWLHUKIODGJR-BQLWYNFJSA-N 337.372 1.320 10 10 EDCE COc1cnc(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)nc1 1480499370 NFXYPPPVUNONSN-CYBMUJFWSA-N 344.415 1.710 10 10 EDCE O=C(NCCNc1cnccn1)c1cc2cc(O)c(O)cc2s1 1544051168 SRIJQJDVCUGUFR-UHFFFAOYSA-N 330.369 1.944 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(CN(C)C)nc1 1624955225 VFQKRGWNIRLYCL-GFCCVEGCSA-N 329.400 1.915 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2nc(C)c[nH]2)cc1C 1717929747 JMHWGNRUGFWICR-OAHLLOKOSA-N 346.431 1.258 10 10 EDCE O=C1CC[C@H](CC(=O)NCc2ccc(N3CCOCC3)cc2)CN1 1626693628 QIIANWIGTMJADF-OAHLLOKOSA-N 331.416 1.056 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H](C)S(C)(=O)=O)cc1C 1497841685 TUEAJKQFBGLXLN-OLZOCXBDSA-N 342.461 1.031 10 10 EDCE CC1=NS(=O)(=O)N(C)C=C1C(=O)NCc1cc(Cl)ccc1O 1632228578 QDLVQSGRXWMOGM-UHFFFAOYSA-N 343.792 1.197 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C[C@@H]2C=CCC2)cc(OC)n1 1737548517 AIQYSMUXCZUFKR-CHWSQXEVSA-N 347.415 1.690 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)Cc1nnc2n1CCN(C)C2=O 1648295124 JHUGWDFOGJXTIA-UHFFFAOYSA-N 328.420 1.062 10 10 EDCE C[C@H](C(=O)NCc1cc(O)ccc1O)c1ccc(S(C)(=O)=O)cc1 1644753567 DUPXZODOHSBSKS-NSHDSACASA-N 349.408 1.921 10 10 EDCE C[C@@H](O)CNC[C@@]1(C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1671814657 BWAYKRLNNYASIR-SJKOYZFVSA-N 347.419 1.672 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C/c1ccc(N2CCOCC2)o1 205771625 CVCVFKJFGITWJB-ACCUITESSA-N 349.412 1.419 10 10 EDCE Nc1ccc(NC(=O)c2nn(-c3ccc(F)cc3)c(=O)cc2O)cc1 1866268751 IQGZSIBRRVWNQY-UHFFFAOYSA-N 340.314 1.912 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2140661884 JFTCJQKUGNUTEL-AVGNSLFASA-N 333.201 1.048 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCC(=O)NC2)c1O 1964561077 LDKZSCQKRWNNGQ-QMMMGPOBSA-N 329.194 1.532 10 10 EDCE COc1cccc(O)c1[C@@H](C(=O)O)N(CCO)C(=O)OC(C)(C)C 1997940956 KUAQVXPSLWOKCS-ZDUSSCGKSA-N 341.360 1.756 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010402124 MOPYNHVEXRZJLY-NWDGAFQWSA-N 339.396 1.781 10 10 EDCE CNCc1ccc(N2CC(N3CCCC3=O)C2)cc1Br 2182223199 QPAJFAKIRYPYGO-UHFFFAOYSA-N 338.249 1.980 10 10 EDCE CC1(C)[C@H](O)C[C@]1(CO)NCc1cc(Br)cc(F)c1O 2193972286 ZTOVILSTUJPRRD-BXUZGUMPSA-N 348.212 1.905 10 10 EDCE CC(C)(C)OC(=O)NCCc1nc(=NCc2ccc(O)cc2O)[nH][nH]1 2063193099 RYYMIZMYQAPUBM-UHFFFAOYSA-N 349.391 1.317 10 10 EDCE CN(C)c1ccc([C@@H](CN)N2CC(CNC(=O)C(F)(F)F)C2)cc1 2074323579 ZZROQTAUCSPBPJ-CQSZACIVSA-N 344.381 1.363 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)c(Br)c1 2102177878 OVMUHTDCNYSKMY-BPNCWPANSA-N 327.222 1.364 10 10 EDCE CCN(c1cc(Br)c(CN)cc1F)[C@@H]1CCNC1=O 2114765415 VZCZXIFHIDOTFN-LLVKDONJSA-N 330.201 1.762 10 10 EDCE NCc1ccc(N2CCc3ncnc(O)c3C2)c(Br)c1 2206105951 GGYMZTIXVJIPSX-UHFFFAOYSA-N 335.205 1.966 10 10 EDCE COc1ccc(Br)c(CN(C)CC[S@@](C)=O)c1O 2220484099 YOWPWSLBJQDTNR-GOSISDBHSA-N 336.251 1.974 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@H](CCN)C2)c1O 2236044443 OMLUSQSBHDMFQE-SNVBAGLBSA-N 345.237 1.713 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2COC3(COC3)C2)c1O 2286280363 VIVIHKVEKPJVGR-VIFPVBQESA-N 344.205 1.811 10 10 EDCE CN(NCc1cc(Br)ccc1O)S(=O)(=O)C1CC1 2317479020 AHROATCQHOFBJU-UHFFFAOYSA-N 335.223 1.583 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2330385740 KFELOEAIUPNAGD-XAGKMFGPSA-N 328.206 1.262 10 10 EDCE Cc1ccc(CN(C)C[C@@H]2CNCCO2)c(O)c1Br 2352940658 GTBQXABRKYVCLM-LBPRGKRZSA-N 329.238 1.883 10 10 EDCE Cc1cc(C(=O)N[C@H]2CCN(C(N)=O)C2)c(C)n1-c1ccccc1 114138057 KSUXQFHZOOLACM-AWEZNQCLSA-N 326.400 1.977 10 10 EDCE CCN(CC(N)=O)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 302517901 OJUUAKNPALXJAN-UHFFFAOYSA-N 348.447 1.874 10 10 EDCE O=C(NCCCSc1nccs1)c1cc2c(=O)[nH]cnc2cn1 189479008 NRMVYFWRLLDGCY-UHFFFAOYSA-N 347.425 1.687 10 10 EDCE CC1(CCNC(=O)/C=C/c2ccc(N3CCOCC3)cc2)OCCO1 185649875 RSEPFUFHBXLINP-QPJJXVBHSA-N 346.427 1.806 10 10 EDCE CNC(=O)C[C@H]1CNCCN1Cc1ccc(Br)cc1O 2369382892 ZCXRLSHNGFCYFY-LBPRGKRZSA-N 342.237 1.065 10 10 EDCE CN1CCO[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 246261316 UTECHFSEZVNHLQ-WBVHZDCISA-N 334.416 1.230 10 10 EDCE CNC(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255110725 NWGPMZSDNSXIPI-SKHCZCESSA-N 343.427 1.273 10 10 EDCE CN1CCCN(C2=NC(=O)/C(=C/c3ccc(C(=O)O)cc3)S2)CC1 606631400 MZNIDOKGVNSOBA-KAMYIIQDSA-N 345.424 1.993 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C[C@@H]1CCN(S(C)(=O)=O)C1 801525748 MYMPLBOWCHYMHG-ZDUSSCGKSA-N 339.461 1.233 10 10 EDCE O=C1NC(=O)[C@]2(CCCN(Cc3cc(Cl)c(F)cc3O)C2)N1 294250707 AJTVREGADVQNEB-CQSZACIVSA-N 327.743 1.359 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1CCn2ncnc2C1 2165205657 ZKTPOSCGBZXHQX-SNVBAGLBSA-N 341.184 1.990 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(C(N)=O)cn1C 839920228 NROKLCMMPLWRSA-CYBMUJFWSA-N 342.443 1.859 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCNC[C@@](C)(F)C1 844224472 FREDWKKCNPLLDQ-GOSISDBHSA-N 336.455 1.344 10 10 EDCE Cc1cc(C(=O)NCC[C@@]2(O)CCOC2)c(C)n1-c1ccccn1 846447364 LAWLDTAUWXZBCF-GOSISDBHSA-N 329.400 1.760 10 10 EDCE CC[C@H](OC)C(=O)NCc1cc(NC(=O)[C@H](CC)OC)ccc1O 923124146 TWPRPHKIMUIUTF-GJZGRUSLSA-N 338.404 1.797 10 10 EDCE CCn1ncc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)n1 856214902 GIIBNEHQORNIBS-UHFFFAOYSA-N 329.404 1.189 10 10 EDCE CO[C@@]1(CO)CCCN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 853775914 GVNUGNZYEXEZDB-IBGZPJMESA-N 345.443 1.746 10 10 EDCE CO[C@@H](CNC(=O)NCc1cc(Cl)ccc1O)[C@H]1CCOC1 852436281 HAERTPUAWXAKHD-HZMBPMFUSA-N 328.796 1.896 10 10 EDCE Cc1cc(CC(=O)N2C[C@H](O)[C@@H](CO)C2)c(C)n1-c1ccccc1 854910176 QOUHYMRKBIAREH-AEFFLSMTSA-N 328.412 1.448 10 10 EDCE C[C@H](NC(=O)CC[C@@H]1CC[C@H](C(N)=O)O1)c1ccc(N(C)C)cc1 867504481 WMQAASXRKGRZHI-VBNZEHGJSA-N 333.432 1.743 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C3CCN(OC)CC3)C2)cc1 869229378 VNXWUMNNFIHSKR-OAHLLOKOSA-N 333.432 1.664 10 10 EDCE Cc1nnc(NNC(=S)Nc2ccc3c(c2)OCCCO3)n1C 863206788 WKEOFBGPCPHJQP-UHFFFAOYSA-N 334.405 1.598 10 10 EDCE Cc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)nn1 866583566 SUALOVGCWKLBSY-UHFFFAOYSA-N 348.428 1.100 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CNC(=O)c2ccccc21 860697278 RLMYVXPYXBUQIU-IAQYHMDHSA-N 340.379 1.672 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H]2COC[C@@]2(C)C1 1118687908 OZBMBPGJFGATKV-HNAYVOBHSA-N 345.443 1.172 10 10 EDCE COC(=O)[C@@]1(O)CCN(Cc2ccc(Br)cc2O)C1 895702494 PCHJNEDOVWUJND-CYBMUJFWSA-N 330.178 1.265 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCCC1CS(=O)(=O)C1 786766658 DFEFLJCIPBDJSN-UHFFFAOYSA-N 339.461 1.295 10 10 EDCE CCCC[C@H](NC(=O)NCC)C(=O)NCc1ccc(OC)cc1O 794377453 OGCKJRYNJXBVEV-AWEZNQCLSA-N 337.420 1.895 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNCc2cccc(O)c2O)C1 705693431 BFGLFEBEYZAHPY-TZMCWYRMSA-N 338.404 1.415 10 10 EDCE Cc1c(CN(C)CC(=O)NCc2ccc(N(C)C)cc2)cnn1C 790453103 NOSISACIXGWYSO-UHFFFAOYSA-N 329.448 1.543 10 10 EDCE COC[C@H](C)N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 92775537 ZKOAKTJOXOQOFG-MADCSZMMSA-N 328.210 1.872 10 10 EDCE C[C@H](O)[C@H]1CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2125807646 ACZYVXBPUKNSJK-ISROVCFRSA-N 327.178 1.394 10 10 EDCE CC1(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCC1 1261089089 CVWHFSPMIPAPCM-UHFFFAOYSA-N 327.428 1.985 10 10 EDCE CC[C@@H](CNC(=O)C1CC1)NCc1nnnn1-c1ccc(OC)cc1 1269361409 WSLQXDZVOKQHJJ-ZDUSSCGKSA-N 344.419 1.065 10 10 EDCE COc1ccc(CNC[C@](C)(NC(=O)c2cnn[nH]2)C2CC2)cc1C 1267856002 MNCOTWKBCMWBEV-SFHVURJKSA-N 343.431 1.810 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cnc(C)[nH]2)cc1C 1272130012 XWZWFJQFKOBFJZ-UHFFFAOYSA-N 346.431 1.259 10 10 EDCE CN1C(=O)/C(=C/c2cn(CC(N)=O)c3ccccc23)C(O)=NC1=S 555559 NBIPUFRTUREJHH-IZZDOVSWSA-N 342.380 1.223 10 10 EDCE CC[C@@H](O)Cn1cc(C(=O)NCc2ccc3cccnc3c2O)nn1 1451957790 UWHVSNXQVQITCJ-CYBMUJFWSA-N 341.371 1.233 10 10 EDCE O=C(O)[C@H]1C[C@H](O)CN1Cc1cc(Br)cc(F)c1O 2136097954 ZOEAPSTTXULBJW-WCBMZHEXSA-N 334.141 1.314 10 10 EDCE COC(=O)[C@@H](CNC(=O)Cc1ccc(O)c(O)c1)Cc1ccncc1 1293052015 PMVGGLYTRKPVBD-CQSZACIVSA-N 344.367 1.183 10 10 EDCE CO[C@@H](C)C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1703326797 XOEDZHBDUMJKQN-JTQLQIEISA-N 335.364 1.120 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccnc(C)c2)cc1C 1715611069 YGAQMHZKQAJLJR-KRWDZBQOSA-N 343.427 1.588 10 10 EDCE CC(=O)N/C(=C\C1=S=CC=C1)C(=O)Nc1cccc2nsnc12 1557732697 UFCNOBWJOTUBSG-JYRVWZFOSA-N 344.421 1.927 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cncnc2)cc1C 1725690233 HYVUHHUMYRDLMW-INIZCTEOSA-N 344.415 1.016 10 10 EDCE NCC1(CO)CCN(Cc2c(O)cccc2Br)CC1 2138157091 RKLXBYDGMSPVPN-UHFFFAOYSA-N 329.238 1.688 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C(C)(C)F)cc(OC)n1 1737546879 BEFZYXCAFJFQPD-VIFPVBQESA-N 327.356 1.081 10 10 EDCE COC(=O)[C@@]1(OC)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1645733822 UPFUVPCXVCCPBA-OAHLLOKOSA-N 334.332 1.253 10 10 EDCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc[n+]([O-])c1 1642297620 MTAFTRVXDNQHEJ-UHFFFAOYSA-N 349.337 1.365 10 10 EDCE Cc1cnc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)s1 1586717188 MQNVBMNZBMDNSF-UHFFFAOYSA-N 333.413 1.754 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@H](C)SC)cc(OC)n1 1758771295 BMJQKBJICKFEBX-UWVGGRQHSA-N 341.433 1.085 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)Cc2nonc2C)cc1C 1774043123 ZMMAAXLYXYNYJO-LBPRGKRZSA-N 332.404 1.532 10 10 EDCE COc1cc(O)c2c(c1N)C(=O)c1c(N)c(OC)cc(O)c1C2=O 206679774 CVPYFGNWMFXFEB-UHFFFAOYSA-N 330.296 1.055 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)c2cn(C)nn2)c2nccn2C)cc1 1866162261 RMFBZPWRBPGDEL-OAHLLOKOSA-N 339.403 1.134 10 10 EDCE CN(C)C[C@@H]1COC[C@@H]1NCc1cc(Br)ccc1O 2141467207 XEFNJFAZQMVBKC-YPMHNXCESA-N 329.238 1.821 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NCc1cc(F)ccc1O 1898126753 TVXYHRLGLZVMCP-CHWSQXEVSA-N 326.368 1.913 10 10 EDCE Oc1c(F)cc(F)cc1CNCCn1ncc(Br)n1 1875998311 RVKIYLCLJDZDMJ-UHFFFAOYSA-N 333.136 1.814 10 10 EDCE NC(=O)N1C[C@H]2C[C@H]1CN2c1ccc(CO)cc1Br 1877069682 VTCJMDBZMXAVCG-ZJUUUORDSA-N 326.194 1.283 10 10 EDCE CO[C@@H]1C[C@@H](C(=O)NCCN=[N+]=[N-])CN(C(=O)OC(C)(C)C)C1 1965102716 SNAICFAHJFAPBB-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE COc1ccc(Br)c(CNC2COCCOC2)c1O 1971669635 MMGXWVZWASYRLZ-UHFFFAOYSA-N 332.194 1.668 10 10 EDCE CC(C)(C)OC(=O)NCCONC(=O)COc1ccc(N)cc1 1977688328 YTOQGZOUYHQKRB-UHFFFAOYSA-N 325.365 1.220 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)[C@H]1CCCO1 2010406246 RNRLHMPXGWZHFW-UTUOFQBUSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(CNCc2ccc(F)cc2O)C1 2024897168 GQZXGEBUTZKBPM-UHFFFAOYSA-N 340.395 1.850 10 10 EDCE CN(C)c1ccc([C@H](O)[C@H](N)c2nc(Br)cn2C)cc1 2160829081 VQYIFSYVJJUGCO-STQMWFEESA-N 339.237 1.982 10 10 EDCE O=C(O)C[C@@H](COCc1ccccc1)NC(=O)c1cc(O)nc(O)c1 2035478451 XXPXYPYATCVXRM-ZDUSSCGKSA-N 346.339 1.283 10 10 EDCE CCCN[C@@H]1C(=O)Nc2cc(N3CC(O)C3)c(Br)cc21 384059182 PLBFQANPTVHDFW-ZDUSSCGKSA-N 340.221 1.623 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC[C@@H](N4CCCC4)[C@H]3C)c2n1 2064593202 OXNXQGODMIDFBP-TZMCWYRMSA-N 329.404 1.442 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3OCCO[C@@H]3C2)cc1Br 2093342771 BHBZQASZBBBYRP-BETUJISGSA-N 331.185 1.651 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CN(C(=O)OC(C)(C)C)[C@H]1CCOC1 2244946355 BBTOZVUVBWOMRW-NSHDSACASA-N 327.385 1.781 10 10 EDCE CC(=O)N[C@H]1C(=O)c2ccccc2C(=O)[C@H]1N1CCc2ccccc2C1 104878604 RGZYRNVATCVQPV-MOPGFXCFSA-N 348.402 1.997 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)c(F)c1Br 2357053336 UTEZVASQUAKTMP-KMUQISDUSA-N 345.212 1.510 10 10 EDCE COc1cc(CN2CC[C@H]3CC[C@@H](C2)S3(=O)=O)c(O)cc1C 530106928 AZJLJXQOZPVMBK-KGLIPLIRSA-N 325.430 1.861 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(Oc2cnccn2)CC1 375744813 PCEBBIKJPXMWNF-DUXPYHPUSA-N 341.367 1.971 10 10 EDCE CN[C@@H](C)c1ccc(N2CC[C@@H](NC(N)=O)C2)c(Br)c1 723183181 RCSZTZHVNGKSDQ-GXSJLCMTSA-N 341.253 1.977 10 10 EDCE Cn1cc(N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)cn1 588406793 NVVQKTOEBKMDBH-HYXAFXHYSA-N 328.372 1.193 10 10 EDCE Cc1cc(CC(=O)NCCc2nnc(N)o2)c(C)n1-c1ccccc1 832624847 WVSRYLKFPZXIHB-UHFFFAOYSA-N 339.399 1.961 10 10 EDCE C[C@@H]1CCN(Cc2ccc(N3CCN(C)CC3)cc2)C[C@@H]1C(=O)O 843041610 UICQBYSTYSKPTL-QAPCUYQASA-N 331.460 1.981 10 10 EDCE C[C@@]1(CCF)NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 849351820 NLTFMTNXWMAHRR-KRWDZBQOSA-N 335.379 1.693 10 10 EDCE CC(C)CN1CCO[C@@H](CNC(=O)NCc2c(O)cccc2F)C1 913919857 BAUARPSQUUCFSH-ZDUSSCGKSA-N 339.411 1.687 10 10 EDCE COCC1(S(=O)(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 849417215 LWIWAYKWBXPZEV-ZDUSSCGKSA-N 340.445 1.372 10 10 EDCE C[C@H](NC(=O)N[C@@H]1CNCC[C@@H]1C)c1ccc(N2CCOCC2)cc1 841739760 BZVMJLQEWZPKTL-RLFYNMQTSA-N 346.475 1.881 10 10 EDCE CC1(C)CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])C[C@H](CO)O1 844214817 VENGHUAXMBGXNM-TXNVCOODSA-N 336.344 1.669 10 10 EDCE COc1ccc(N(C)CCN(C)c2nc(C)nc(N(C)C)n2)cc1 845673986 UMKYYAVZZFUHEA-UHFFFAOYSA-N 330.436 1.827 10 10 EDCE CCO[C@@H]1[C@@H](C)[C@H]1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 923443119 QUJOZSORZBLGSM-MORSLUCNSA-N 348.443 1.925 10 10 EDCE C[C@@H](O)[C@@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 840305850 XVVCUAOXWCFYFV-PBHICJAKSA-N 331.416 1.354 10 10 EDCE COc1ccc(N(Cc2cc(=O)n3nc(N)[nH]c3n2)CC2CC2)cc1 856746208 SFXUDBHCSTXJQW-UHFFFAOYSA-N 340.387 1.425 10 10 EDCE O=C(C=C1CCNCC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 852860790 VASVXLGUHQBDBD-UHFFFAOYSA-N 347.434 1.713 10 10 EDCE O=C1N(Cc2ccc(N3CCC(O)CC3)cc2)C(=O)C23CC(CN12)C3 853089361 OVKSHTRHFPNBHR-UHFFFAOYSA-N 341.411 1.574 10 10 EDCE CCN(CC)CCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 853200630 MTQWPMCYBLOJFV-OAHLLOKOSA-N 334.464 1.915 10 10 EDCE CCN(CC)c1ccc(CNC[C@]23COCCN2C(=O)OC3)cc1 865768281 ZEKBFAQBWRXCHF-GOSISDBHSA-N 333.432 1.844 10 10 EDCE CC(=O)N1CCC[C@H]1C(=O)NCc1cc(Br)ccc1O 868306987 KLWQJILELDAYEE-LBPRGKRZSA-N 341.205 1.782 10 10 EDCE COC(=O)[C@H](NCc1cc(OC)c(OC)cc1O)c1ccn(C)n1 787438012 FYPPJCDFWMCVPW-OAHLLOKOSA-N 335.360 1.147 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCc4nccn4C3)CC2)cc1 786686281 COSNOBSFCKKGSA-HNNXBMFYSA-N 340.427 1.803 10 10 EDCE COC(=O)c1c(CNCc2cn(C)nn2)c2cc(F)ccc2n1C 894436559 HHVVTAGBUCXAMB-UHFFFAOYSA-N 331.351 1.522 10 10 EDCE CS(=O)(=O)N[C@@H]1CCN(c2ccc(CN)c(Br)c2)C1 703008172 WTBYWBVBTVUFQS-SNVBAGLBSA-N 348.266 1.036 10 10 EDCE Cc1cc(CC(=O)N[C@]2(C(=O)O)CCOC2)c(C)n1-c1ccccc1 1328210795 ZTJHDCPHYJDGCF-LJQANCHMSA-N 342.395 1.997 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNc3cnc(O)nc3O)cc2)C1 1321777048 TZHGRNGCVDTAAV-LBPRGKRZSA-N 343.387 1.202 10 10 EDCE NC(=O)CC1CN(c2ccc(C=CC(=O)O)cc2Br)C1 1912021186 WDXYMBHSRSSMMN-UHFFFAOYSA-N 339.189 1.859 10 10 EDCE COc1cc(C(=O)N[C@H](C)C[C@@H](C)NC(=O)C2(C)CC2)cc(OC)n1 1512259861 MHEDHFXGABZSST-VXGBXAGGSA-N 349.431 1.912 10 10 EDCE COCCCOc1ccc(C(=O)NCc2cccc(O)c2O)cn1 1471644691 XDUGFIUVQNFRTL-UHFFFAOYSA-N 332.356 1.838 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@H](CO)Cc1cccnc1 1626908399 CMOCHRJIUKXCGX-ZDTYVGOBSA-N 328.368 1.473 10 10 EDCE O=C(CCNS(=O)(=O)c1ccccc1)N1Cc2cccc(O)c2C1 1636230354 AKBRYYMJFBYIGE-UHFFFAOYSA-N 346.408 1.603 10 10 EDCE Cc1cccc([C@H]2C(=O)NCCN2C(=O)c2cccc(O)c2O)c1 1633766861 MBXYLLKKVUVTKW-HNNXBMFYSA-N 326.352 1.720 10 10 EDCE Cc1c(C(=O)NCc2cc(Cl)ccc2O)nnn1-c1cnn(C)c1 1639965057 BJYZHODFXCZYCP-UHFFFAOYSA-N 346.778 1.598 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)Cn2ccnc2)cc1C 1496242278 DYPLEFNRLVEXNV-OAHLLOKOSA-N 330.432 1.837 10 10 EDCE COCCn1cc(C(=O)NCc2c(O)cccc2O)c(=O)cc1C 1635847913 WLBTUSZBKSLOCT-UHFFFAOYSA-N 332.356 1.144 10 10 EDCE CN(CC(=O)NCc1ccco1)C(=O)c1ccc(N=NC(N)=O)cc1 1632682191 XWNHJNMOMIYIIQ-UHFFFAOYSA-N 343.343 1.830 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@]2(F)CCOC2)cc1C 1732356487 LOGPOZUDTAKJPP-UGSOOPFHSA-N 338.423 1.974 10 10 EDCE C/C=C(\C)C(=O)N(C)C[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1738805484 PETISWVNIHAHFQ-VNKGSWCUSA-N 335.404 1.642 10 10 EDCE C[C@H](CN(C)C[C@@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1669936408 OAMVRKZKEWUDGD-OLZOCXBDSA-N 347.419 1.936 10 10 EDCE CCN1CCS/C1=C\C=C1\SC(=S)N(CC(=O)O)C1=O 31320066 QGVPJCPOTBNOCZ-CIONDUKHSA-N 330.456 1.725 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2COCCN2C)c1O 1964569118 CUHBWSUYWACGPY-SNVBAGLBSA-N 345.237 1.584 10 10 EDCE CN[C@H](C)c1ccc(N2CCOC[C@H]2CO)c(Br)c1 253073604 OYNPLXMVGQTMMC-ZYHUDNBSSA-N 329.238 1.927 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C1(NC(=O)OC(C)(C)C)CCOCC1 1985100838 JPTHILORHTWDND-UHFFFAOYSA-N 327.385 1.829 10 10 EDCE C[C@H](CNC(=O)OC(C)(C)C)NC(=O)c1cc(O)c(O)c(O)c1 1988130350 JMRRJPFNVABLJD-MRVPVSSYSA-N 326.349 1.446 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)CCc2ccc(N)cc2)CO1 1999123097 VRHIODNWMBJHTN-AWEZNQCLSA-N 335.404 1.869 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@](O)(C(=O)Nc2ccc(N)cc2)C1 2020773578 DWIGAWLCTTVMFL-KRWDZBQOSA-N 335.404 1.969 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCN(Cc4ccco4)CC3)c2n1 2063612213 WTAWUQNZVCQCSS-UHFFFAOYSA-N 341.371 1.294 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1CNC(=O)Cc1ccc(N)cc1 2044213091 QSPVNHWAUKQTKQ-OAHLLOKOSA-N 349.431 1.563 10 10 EDCE C[C@H]1CCN(C(=O)c2ccc(O)c(O)c2)C[C@@H]1NC(=O)C(F)(F)F 2054398372 XGBBAKZJZAQRBD-WPRPVWTQSA-N 346.305 1.627 10 10 EDCE C[C@]1(CO)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2097247572 OEELVQRLUPBKFP-DGCLKSJQSA-N 327.178 1.396 10 10 EDCE O=C(Nc1ccc(O)cc1C(=O)O)c1cnc(Br)cn1 2237282407 IXTYYDGYPVMMGN-UHFFFAOYSA-N 338.117 1.895 10 10 EDCE CNC(=O)CCCN(C)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2303610121 RETBXBSFNCPJEV-UHFFFAOYSA-N 345.443 1.521 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN([C@H](C)CO)CC2)c([N+](=O)[O-])c1 103925571 AFWLLKFXOQPFOU-RYWCDNDXSA-N 349.387 1.284 10 10 EDCE CC(C)c1nc2n(n1)C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)CC2 181186348 RLZUJRMNAYHHRC-GBVBUYCNSA-N 342.399 1.957 10 10 EDCE CC(=O)N(C(=S)NC(=O)c1ccc(N)cc1)c1ccc(N)cc1 243263703 KUOJQMYKJZYMPJ-UHFFFAOYSA-N 328.397 1.919 10 10 EDCE CCN1C(=O)C(=CNNc2ccc(C)cn2)C(=O)N(CC)C1=S 263868124 KZVYNAMCLAEROM-UHFFFAOYSA-N 333.417 1.186 10 10 EDCE CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)C(C)=O)cc1 808495899 SPEGCCCTOZSFBA-JTQLQIEISA-N 341.385 1.078 10 10 EDCE COc1ccc([C@H]2[C@@H](C(=O)OCC(=O)C(C)=O)CCC(=O)N2C)cc1 808518261 FESMHEDZODCCTP-YOEHRIQHSA-N 347.367 1.306 10 10 EDCE Cn1cnc(CNC(=O)NCc2cc(Br)ccc2O)n1 805249708 BLGBURHOBRTIFQ-UHFFFAOYSA-N 340.181 1.283 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(c2cc(O)c(O)c(O)c2)C[C@H]1C(=O)O 1952775410 OYMYLMZIHREAML-AYVTZFPOSA-N 325.317 1.628 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)N(C)C3CC3)CC2)cc1 736321076 GUUCIDCKEHNWMR-UHFFFAOYSA-N 325.434 1.156 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@H]3CC[C@H](C(=O)O)O3)CC2)cc1 901934976 TUDKDDHWYWJQRY-JKSUJKDBSA-N 348.399 1.412 10 10 EDCE Cc1cc(CC(=O)N2C[C@H](O)C[C@]2(C)CO)c(C)n1-c1ccccc1 912653122 HBSFUGNVBSSACB-UYAOXDASSA-N 342.439 1.981 10 10 EDCE COCCCS(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849416596 SSZQJVFMUFNWGA-CYBMUJFWSA-N 328.434 1.230 10 10 EDCE O=C(/C=C\[C@H]1CCCO1)NCc1ccc(N2CCC(O)CC2)cc1 856209521 RCUJHZGDZZJZKQ-JTHGQSKGSA-N 330.428 1.999 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3C[C@H]4CC[C@H]3NC4)C2)cc1 851639603 HXHKIFNEBLBVLY-LTCOOKNTSA-N 329.444 1.778 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H]4COC[C@@H]4C3)nc12 852669497 STIIXLBRZREIIC-RYUDHWBXSA-N 346.387 1.080 10 10 EDCE C[C@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(C)(C)CO 924726833 QWDTUYWCFXANTE-GOEBONIOSA-N 333.476 1.885 10 10 EDCE CC[C@H](C)C(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 756387152 HONDKQXNVZXNDL-VIFPVBQESA-N 329.374 1.536 10 10 EDCE CCn1ccnc1CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852370331 WOOZXALMKFMNEQ-AWEZNQCLSA-N 343.431 1.990 10 10 EDCE C[C@@H](CCN1CCN(C)CC1)NC(=O)N[C@@H](C)c1ccccc1O 868509158 BFDJSRUACKSTRD-GJZGRUSLSA-N 334.464 1.778 10 10 EDCE C[C@@H]1NCC[C@H]1NC(=O)NCc1cccc(Br)c1O 861702766 XYMCWELBDLGYFC-GZMMTYOYSA-N 328.210 1.704 10 10 EDCE CN1CCN(c2ccc(CN3C[C@H]4[C@H]5CC[C@@H](CN5)[C@H]4C3)cc2)CC1 863653162 DIFAZXJXDOGIJW-OYNPSCLESA-N 340.515 1.868 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1CCNC12CCC2)c1ccc(N(C)C)cc1 861767600 OIRKZZFEMPZZLI-XJKSGUPXSA-N 344.459 1.331 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)c3cccnn3)cc2)CC1 861214502 ZAUBMBLVGMFDQW-UHFFFAOYSA-N 339.399 1.075 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C)c1ccnn1C 867423595 JINIWXIHXIYJPU-CYBMUJFWSA-N 344.415 1.742 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccn(C)n1 765763902 BDMMWQCNSUUHPI-UHFFFAOYSA-N 343.431 1.598 10 10 EDCE COc1cc([N+](=O)[O-])cn(Cc2ccc(N3CCOCC3)cc2)c1=O 877887543 VIVJXOQYZLTUDB-UHFFFAOYSA-N 345.355 1.650 10 10 EDCE COC(=O)[C@H](NCc1ccc(N2CCOCC2)cc1)c1ccn(C)n1 787437832 DWSKQQVKSYKEHJ-QGZVFWFLSA-N 344.415 1.261 10 10 EDCE COC(=O)N1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 895803916 GQTJDSJZTOHYND-UHFFFAOYSA-N 336.369 1.837 10 10 EDCE CC(C)n1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)nn1 794243959 LCLMRSJIVQNMTL-UHFFFAOYSA-N 329.404 1.626 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(CCO)CC2)c(Br)c1 61695697 BQPQYQOKNSGDRI-LLVKDONJSA-N 328.254 1.583 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H](F)[C@H](F)C3)c(Br)cc21 714733758 IJXRFKJLCTUZKM-XLDPMVHQSA-N 332.148 1.897 10 10 EDCE NC(=O)Cn1cc(NCc2cc(Br)cc(F)c2O)cn1 715768153 BSXKNMJHAFWMFP-UHFFFAOYSA-N 343.156 1.588 10 10 EDCE CN1CCN(c2ccc(CNC(=O)C3=C[S@@](=O)CCC3)cc2)CC1 1153443638 NBRIOFCHCGJSCC-DEOSSOPVSA-N 347.484 1.481 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2ncccn2)cc1C 1268008387 NHZSRHUMPCCGRT-CYBMUJFWSA-N 328.416 1.949 10 10 EDCE CN(CCNC(=O)C(C)(C)F)C(=O)c1ccc(N=NC(N)=O)cc1 1527867277 NMWHXIRONAASNJ-UHFFFAOYSA-N 337.355 1.785 10 10 EDCE O=C(/C=C\Cn1cncn1)NCc1cccc(Br)c1O 1623363062 APKMNFQGXCRTBW-DJWKRKHSSA-N 337.177 1.619 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H]2C[C@]23CCOC3)cc1C 1713652112 APEHBUXZOLSOLY-APWZRJJASA-N 332.444 1.978 10 10 EDCE Cn1cnnc1CC1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1558452177 AJXFNWPCISIXMY-UHFFFAOYSA-N 330.388 1.250 10 10 EDCE CCOC(=O)c1[nH]nc(NC(=O)/C=C\c2ccc(O)c(O)c2)c1C 1639431536 IZSHZIOTRJZZIW-ALCCZGGFSA-N 331.328 1.958 10 10 EDCE COC(=O)c1cccc(NC(=O)CN[C@H](C)c2ccccc2O)n1 1560075051 PLNMNXONFUGEID-LLVKDONJSA-N 329.356 1.863 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cncc(-n2ccnn2)c1 1643283368 RRAXXHXFJBWONY-UHFFFAOYSA-N 346.350 1.846 10 10 EDCE CC[C@H](CNC(=O)C[C@@H]1CCC(=O)N1)NCc1ccc(OC)c(C)c1 1732215629 WBEQXULVRVHSJS-CVEARBPZSA-N 347.459 1.657 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2cc[nH]c2C)cc(OC)n1 1758774329 MEFKBFUZGYOVLJ-SNVBAGLBSA-N 346.387 1.284 10 10 EDCE CC[C@H](CNC(=O)CN(C)C(C)=O)NCc1ccc(OC)c(C)c1 1698592757 WNWZRKFATXUKTJ-MRXNPFEDSA-N 335.448 1.466 10 10 EDCE O=C(C(=O)c1ccc(O)c([N+](=O)[O-])c1)c1ccc(O)c([N+](=O)[O-])c1 13642870 FGSBLNUFHHXQKM-UHFFFAOYSA-N 332.224 1.980 10 10 EDCE CCCn1c(SCC(=O)NCc2ccc(N(C)C)cc2)n[nH]c1=O 18524013 FAPQNEWIVCKYQK-UHFFFAOYSA-N 349.460 1.456 10 10 EDCE Cc1c(C(=O)O)c(O)cc2c1C(=O)c1c(cc(O)c(O)c1O)C2=O 14760980 CVEVVUDMNOQKMX-UHFFFAOYSA-N 330.248 1.291 10 10 EDCE biogenic COc1ccc(Br)c(CNCCN2CCNC2=O)c1O 1964544921 DHASBPULBBXYAK-UHFFFAOYSA-N 344.209 1.278 10 10 EDCE CO[C@@H]1C[C@@H](C(=O)O)N(Cc2cc(Br)ccc2O)C1 1964720596 MAFANAUHVXQNHX-MNOVXSKESA-N 330.178 1.829 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)O)[C@H](c2cc(O)c(O)c(O)c2)C1 1951592403 ODNHALMTKQYCFX-VHSXEESVSA-N 339.344 1.839 10 10 EDCE COCC[C@H](N)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951943175 KFTLXMLEPXPEKQ-STQMWFEESA-N 340.420 1.897 10 10 EDCE NC(=O)CO[C@H]1CCCN(c2ccc(CO)c(Br)c2)C1 2145382490 NSBLABHKRGZEOP-LBPRGKRZSA-N 343.221 1.412 10 10 EDCE COCCC[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003169969 NRWGYXPIKBJVPH-AVGNSLFASA-N 342.436 1.572 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNCc2ccc(F)cc2O)C1 2024897322 HKFQVWDQQOEIMW-SWLSCSKDSA-N 340.395 1.849 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)[C@H](CO)C2)cc1Br 704773250 AIMUGLQIYVAPMM-VWYCJHECSA-N 329.238 1.506 10 10 EDCE CC(C)N(C[C@H](C)O)c1cc2c(cc1Br)[C@H](N)C(=O)N2 691418554 UTUZXDRTMFDDBR-SDBXPKJASA-N 342.237 1.997 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2[C@H](CN)C(=O)O 2044378799 SVAZRZVVPUVQRP-OAHLLOKOSA-N 349.431 1.876 10 10 EDCE O=C1NC[C@@H]2CN(Cc3cccc(Br)c3O)CC[C@@H]12 2100946533 YYIGGAKBTYVCQT-GHMZBOCLSA-N 325.206 1.723 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)cc1Br 2102176378 BUMZANOQOZZGSP-DWVUBDKYSA-N 328.206 1.698 10 10 EDCE C[C@H](O)c1ccc(N2CC(=O)N[C@@H]3CC[C@@H]32)cc1Br 2112060445 FFBULDRWFRCFFD-CKLFPEKLSA-N 325.206 1.970 10 10 EDCE NCc1ccc(N2CC[C@H]3OCCO[C@H]3C2)c(Br)c1 2095386730 UMESQRBZEGYAPT-KGLIPLIRSA-N 327.222 1.902 10 10 EDCE CC[C@H](N[C@@H]1CC(=O)NC1=O)c1cc(Br)ccc1O 2096090292 XGBQLMLTFYDUHP-VHSXEESVSA-N 327.178 1.611 10 10 EDCE COc1ccc(N2CC(O)(CNC(=O)OC(C)(C)C)C2)cc1F 2210892338 SOQSCXZQSAQXAH-UHFFFAOYSA-N 326.368 1.910 10 10 EDCE CN(CCOc1ccc(N)cc1)Cc1nn(C)nc1Br 2235290362 OAWMMNGXIKIDDU-UHFFFAOYSA-N 340.225 1.671 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2CCNC2=O)c1O 2227750524 YWDXIBKQGDPANS-MRVPVSSYSA-N 329.194 1.389 10 10 EDCE O=C(O)[C@H]1CCOCCN1Cc1ccc(Br)cc1O 2269864900 GVFCHVQZCQLVJU-LLVKDONJSA-N 330.178 1.830 10 10 EDCE O=C1NC(=S)N(c2ccccc2F)C(=O)C1=CNCc1ccco1 2297358176 JDBNYYQULRTHOU-UHFFFAOYSA-N 345.355 1.840 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2333234164 PIEOMJKLILKFAE-VGYUKGMSSA-N 334.185 1.382 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2336466407 RMAJIXSWFZUIQL-ZDMBXUJBSA-N 346.246 1.736 10 10 EDCE Cn1nc(Br)c(NCc2cc3c(cc2O)OCO3)n1 2343015065 DJWKWCCLAMPPPN-UHFFFAOYSA-N 327.138 1.624 10 10 EDCE Cc1ccc(CN=c2[nH]cc(F)c(=N)[nH]2)c(O)c1Br 2352619825 KCLSPRSGSYOHPG-UHFFFAOYSA-N 327.157 1.839 10 10 EDCE CC(=O)N1CC[C@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 175812168 IHLSBJBITCTCHF-KRWDZBQOSA-N 345.443 1.350 10 10 EDCE COC(=O)Cc1sc(NC(=O)c2cc(O)c(O)c(O)c2)nc1C 170190576 FSBIEDKGVJAEEX-UHFFFAOYSA-N 338.341 1.536 10 10 EDCE CN(Cc1ccccc1O)C[C@H](O)CN1C(=O)c2ccccc2C1=O 171937232 FLDLXVMOCJZEAH-AWEZNQCLSA-N 340.379 1.481 10 10 EDCE CC(C)NCc1ccc(N2CC([C@@H](O)CO)C2)c(Br)c1 2361908440 SOMJCZIGAYGPCV-HNNXBMFYSA-N 343.265 1.737 10 10 EDCE C[C@H](N[C@H](C)CCS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 127102424 ZDSGBBJEEMMNBX-CABCVRRESA-N 340.489 1.997 10 10 EDCE C[C@H](NC(=O)N[C@H](C)[C@H](C)CO)c1ccc(N2CCOCC2)cc1 77796534 YZKGIOKPWSWXSI-KFWWJZLASA-N 335.448 1.900 10 10 EDCE O=C1c2cc(O)cc(O)c2C(=O)c2c1cc1c(c2O)[C@@H]2CCO[C@@H]2O1 6091287 BABJNKGTTYCTOO-ULCDLSAGSA-N 340.287 1.801 10 10 EDCE biogenic,in-vitro Cc1nn(C)c(C)c1/C=C\C(=O)NCc1cc([N+](=O)[O-])ccc1O 96545295 DOYNUWZDFCYJOM-ALCCZGGFSA-N 330.344 1.980 10 10 EDCE CC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ccc(N)cc1)C2=O 236624778 LFNBMFUBBVVEGW-UHFFFAOYSA-N 330.388 1.708 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCn4ccnc4C3)c(Br)cc21 92775830 OVVSOSYUKMDQED-CYBMUJFWSA-N 348.204 1.618 10 10 EDCE Cc1ccc(CN2C[C@@H](CN)N3CC[C@H]2C3)c(O)c1Br 2380647254 FYSXSUXNNVOJMX-QWHCGFSZSA-N 340.265 1.680 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C)SCC(=O)Nc1ccc(F)cc1 808494291 MSYSTXGOAJGIHC-JTQLQIEISA-N 341.360 1.587 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1[C@@H](C)OC(C)(C)N1C(=O)OC(C)(C)C 808539267 YKTCZZXNVOPXKC-ZYHUDNBSSA-N 343.376 1.448 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C)SCC(=O)Nc1ccc(C)cc1 808494916 SSGQSAZOUMSTIF-LBPRGKRZSA-N 337.397 1.757 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](CF)C(=O)O)C2)cc1 909133340 DSFJKFSVUWPNNV-BXUZGUMPSA-N 339.367 1.243 10 10 EDCE COc1c(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cnn1C 839580546 ZLKCAUXIMTXECG-CYBMUJFWSA-N 344.415 1.756 10 10 EDCE COc1cc(N(C)CC(=O)N2CCO[C@H](C)C2)cc(OC)c1OC 741798390 BBUPRFZDGWFUTI-GFCCVEGCSA-N 338.404 1.396 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)C[C@@H](C)NC(N)=O)C2)cc1 848229187 KUVUPDANRLQAOX-OLZOCXBDSA-N 334.420 1.085 10 10 EDCE Cn1ccnc1CN1CCC[C@H](NC(=O)c2cc(O)cs2)C1=O 753469178 ZZBPACFUJSXCSU-NSHDSACASA-N 334.401 1.108 10 10 EDCE CN1CCC[C@@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 852187451 OLCCAUUHBDSMAZ-MRXNPFEDSA-N 346.475 1.541 10 10 EDCE C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@H](CCC2OCCO2)C1=O 924714919 DOVXPASGBILDCM-SWLSCSKDSA-N 347.415 1.887 10 10 EDCE CNc1nc(C)cc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1 855223035 BFPWEWHTESPVIN-CYBMUJFWSA-N 341.415 1.844 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@]3(C)CCN(C(C)=O)C3)C2)cc1 855232800 XYIZIJXREOJUER-HNAYVOBHSA-N 345.443 1.649 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3(C)CCNCC3)C2)cc1 851662840 LNRFBMVPPWGICA-HNNXBMFYSA-N 346.475 1.963 10 10 EDCE Cn1cc(C(=O)NC[C@H]2CCCN2C(=O)c2cc(O)cs2)cn1 868731619 JILCSIBPVOZSDN-LLVKDONJSA-N 334.401 1.222 10 10 EDCE CN1CCN(c2ccc(CN(C)CC(=O)NC(C)(C)C)cc2)CC1 775644885 WJEJTOJLRIXWPG-UHFFFAOYSA-N 332.492 1.785 10 10 EDCE CC(=O)CCCc1cn(CC(=O)NCc2ccc(N(C)C)cc2)nn1 881094740 QQDPXSABWHKEDA-UHFFFAOYSA-N 343.431 1.572 10 10 EDCE CNC(=O)N1CCN(Cc2cc(C)cc(Br)c2O)CC1 781913281 RSPCRIOYNRYQGY-UHFFFAOYSA-N 342.237 1.920 10 10 EDCE COc1cc2c(cc1C(=O)OCC(=O)c1ccc(O)c(O)c1)OCO2 784709683 KDMGHEGFGUHILD-UHFFFAOYSA-N 346.291 1.875 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCCN(C)C2)cc1 788974979 MBLAJEICWWSOGE-INIZCTEOSA-N 346.475 1.359 10 10 EDCE C[C@H]1C[C@@H](C)N1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 791565102 FBVHSHZMDGFXEB-OKILXGFUSA-N 335.423 1.761 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@H](c2cncn2C)N(C)C)c1 1150544186 ZKUJDDHIDWEFJR-BZNIZROVSA-N 332.404 1.614 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](C)CCN(C)C)CC2)c(OC)c1 1169991587 ZSZWZUWWDUYXAL-OAHLLOKOSA-N 349.475 1.940 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@H]2CCCNC2=O)cc1C 1319201996 LXNKFTNWHJXTRD-CJNGLKHVSA-N 347.459 1.372 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)Cc2cnc(C)o2)cc1C 1320236158 VHEHOEFFXTYCMP-OAHLLOKOSA-N 347.415 1.109 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC1CCC2(CC1)COC2 1333958689 GQCPHVFJQQCOLQ-UHFFFAOYSA-N 332.400 1.426 10 10 EDCE CN(C)c1ccc([C@H](CNc2ncc([N+](=O)[O-])c(N)n2)N(C)C)cc1 1187834012 YYMVXHHLOMUGRJ-ZDUSSCGKSA-N 345.407 1.748 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CCNC(=O)CC2)cc1C 1275246920 RWXHINDMMXLVQO-HOCLYGCPSA-N 347.459 1.514 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCc2sccc2C1 1351817684 XPQUKHNKYLGUIV-UHFFFAOYSA-N 328.393 1.881 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@H]1CCOC1 1502053068 HNLINCGMKIURLN-PWSUYJOCSA-N 347.375 1.120 10 10 EDCE CN1C(=O)COc2ccc(C(=O)NCc3ccc(O)c(O)c3)cc21 1445902846 SZQPTOLPPFFZAB-UHFFFAOYSA-N 328.324 1.383 10 10 EDCE O=C(N[C@@H]1CCc2nnnn2CC1)c1cc2cc(O)c(O)cc2s1 1451703118 ZZDANIDTRBGAAU-SECBINFHSA-N 345.384 1.434 10 10 EDCE Cc1cc(CC(=O)Nn2c(O)nnc2O)c(C)n1-c1ccccc1 1298667606 GCMLRMRQWLDFBQ-UHFFFAOYSA-N 327.344 1.410 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H]2CC23CCC3)cc1C 1700807892 IETGNKAPSMAVRU-HOTGVXAUSA-N 332.444 1.761 10 10 EDCE CS(=O)(=O)Nc1ccccc1NC(=O)Cc1ccc(O)c(O)c1 1540719062 SXYAIUYEBIRHSJ-UHFFFAOYSA-N 336.369 1.651 10 10 EDCE CCOCCCN1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1714954783 RJVXFXAEEUIEPO-UHFFFAOYSA-N 333.392 1.690 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cn(C)ccc2=O)cc1C 1714252830 GKBKNAPISJWHHM-CQSZACIVSA-N 343.427 1.610 10 10 EDCE C[C@H](O)CN1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@@H](C)C1 1633634090 RLJMIRVBLMZASO-RYUDHWBXSA-N 333.392 1.376 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cc2cncn2C)cc1C 1568951210 NISSRUKAYITCAA-PLNGDYQASA-N 342.443 1.742 10 10 EDCE Cc1cc(CCC(=O)NCc2ccc(N3CCOCC3)cc2)n[nH]1 1631070460 XUEVWWVZVGPCOJ-UHFFFAOYSA-N 328.416 1.804 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H]2CC[C@@H](C(N)=O)C2)cc1C 1731616571 GDZVXWMUNXRAIY-IMJJTQAJSA-N 347.459 1.500 10 10 EDCE CCNC(=O)CN(C)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1731285362 ABAUSBOBUATRBF-UHFFFAOYSA-N 348.407 1.037 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)C(N)=O)C2CCCC2)cc1C 1733381943 GFVBVQGVQIFOTH-OAHLLOKOSA-N 333.432 1.254 10 10 EDCE CCN(C)C(=O)CN[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1731640522 WQADRNGGABVATC-LLVKDONJSA-N 348.407 1.035 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@]2(O)CCN(CC3CC3)C2)cc1 1699907443 RIJIUTRNKKSHTA-KRWDZBQOSA-N 345.403 1.426 10 10 EDCE COc1ccc(CNC[C@@](C)(NC(=O)CC(N)=O)C2CC2)cc1C 1698644396 FZFGAGYATKSJCI-GOSISDBHSA-N 333.432 1.254 10 10 EDCE Cc1c(/C=C2\SC(N3CCN4CCC[C@@H]4C3)=NC2=O)cnn1C 166631074 DNRQMJJYDIDZKA-HRYODUOUSA-N 331.445 1.479 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cn(-c2ccc(F)cc2)nn1 156708418 JOXJPXIXJJWXCP-UHFFFAOYSA-N 342.330 1.790 10 10 EDCE CN(C)C[C@@H]1COC[C@H]1NCc1cc(Br)ccc1O 2141467205 XEFNJFAZQMVBKC-DGCLKSJQSA-N 329.238 1.821 10 10 EDCE Oc1c(Br)cccc1CN[C@@H]1COC2(CCC2)[C@H]1O 2141560267 YCRZPKHPNFNXGA-YPMHNXCESA-N 328.206 1.927 10 10 EDCE CNCc1ccc(N2CCCS(=O)(=O)CC2)c(Br)c1 234435393 GGBWMFKCZQWXNP-UHFFFAOYSA-N 347.278 1.793 10 10 EDCE Cc1cc(NS(=O)(=O)c2c(C3OCCO3)cnn2C)ccc1O 2144010422 QOYQAIUUTJBHME-UHFFFAOYSA-N 339.373 1.280 10 10 EDCE COc1ccc(Br)c(CNC[C@]2(O)CCOC2)c1O 1964061930 NJFAKDYIOLZMPL-CYBMUJFWSA-N 332.194 1.404 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)c(Br)c1 2146313412 JTBBXLIYQYTPDU-VCTAVGKDSA-N 342.233 1.684 10 10 EDCE C[C@H](NC[C@@H](O)CNC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985771948 OQGUUNUGNQEPRU-CMPLNLGQSA-N 326.393 1.634 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)c(Br)c1 2158392997 OZVKCKBBPCNRCU-DFBGVHRSSA-N 341.249 1.755 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010404911 VPCDVPLSORRUBY-GRYCIOLGSA-N 341.412 1.952 10 10 EDCE O=C(O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2cccs2)SC1=S 2040482551 SHXVXJRIDDKZLK-ZETCQYMHSA-N 343.407 1.877 10 10 EDCE O=C(O)C[C@H](COCc1ccccc1)NC(=O)c1cccc(O)c1O 2035473978 UHTZMRNAINKJDG-CYBMUJFWSA-N 345.351 1.888 10 10 EDCE CC(C)(C)OC(=O)N1CC(CCO)(NCc2ccc(O)c(O)c2)C1 398005343 QCGKYLUWPFSSGS-UHFFFAOYSA-N 338.404 1.559 10 10 EDCE C[C@@H](O)[C@H]1CCCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2193600670 ZOCAZPYTPVTWIA-QUUYKZCZSA-N 340.221 1.751 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1CO[C@H]2COC[C@@H]12 2101857762 YTPYDBUCNSFQLA-OSMZGAPFSA-N 328.206 1.906 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)c(Br)c1 2089925704 FGOQVWKSNGFUFI-OWYVNGRQSA-N 329.238 1.614 10 10 EDCE COc1ccc(Br)c(CN2CCN[C@H]3COC[C@@H]32)c1O 2236043481 LJEAHKRTTJVKOV-RYUDHWBXSA-N 343.221 1.336 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1CC[C@H](O)CN1C(=O)OC(C)(C)C 2242655892 HVRKZDAXIAMOGX-WDEREUQCSA-N 327.385 1.516 10 10 EDCE NCc1ccc(N2C[C@@H]3CC[C@@H](CO)O[C@H]3C2)c(Br)c1 2289196875 GTYUSLNTZAFNSA-HUBLWGQQSA-N 341.249 1.884 10 10 EDCE COC(=O)c1cccc(NC=C2C(=O)NC(=S)N(C3CC3)C2=O)c1 2296943407 ZHIKNBVMTRSUEW-UHFFFAOYSA-N 345.380 1.175 10 10 EDCE CCOC(=O)c1ccc(NC=C2C(=O)NC(=O)N(CC)C2=O)cc1 2297358426 LMPLPGAFCZLRJD-UHFFFAOYSA-N 331.328 1.257 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCCc1ncc[nH]1 2297754942 IMDTVNLOWUYJOK-UHFFFAOYSA-N 326.400 1.618 10 10 EDCE Cc1ccc(CN(C)CCS(N)(=O)=O)c(O)c1Br 2327598360 DJYOOTHAFIAYLV-UHFFFAOYSA-N 337.239 1.183 10 10 EDCE Cc1ccc(CN2C(=O)C(=O)N(C)C2=O)c(O)c1Br 2352674180 UUGDKEIUXKKAQD-UHFFFAOYSA-N 327.134 1.384 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@@H](c2cnn(C)c2)N(C)C)cc1 117954051 ODYJDSBQSNYIQI-KRWDZBQOSA-N 344.463 1.588 10 10 EDCE COC(=O)[C@H]1C[C@@H]1C(=O)NC1CCN(c2ccc(OC)cc2)CC1 170763417 AIFAURZUKITEPO-HOTGVXAUSA-N 332.400 1.589 10 10 EDCE COc1ccc(N2CCN(C(=O)CNCC(F)(F)F)CC2)cc1 70974792 FKNKQFYQAQWILS-UHFFFAOYSA-N 331.338 1.496 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1C[C@@H](O)CN1 1952346893 PCFMJZMGVODENV-FRRDWIJNSA-N 338.404 1.256 10 10 EDCE C[C@](NC(=O)OCc1ccccc1)(C(=O)O)c1cc(O)nc(O)c1 1952371828 GCJLWIZIKKEIEX-MRXNPFEDSA-N 332.312 1.719 10 10 EDCE CCn1ncc(/C=C2\SC(N3CCN4CCC[C@@H]4C3)=NC2=O)c1C 96577737 BALSVSAAXAKYOL-WJQTUHTMSA-N 345.472 1.962 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC(C(C)C)C2)cc1 1326831567 ICTBMYSETPKPDI-UHFFFAOYSA-N 347.459 1.704 10 10 EDCE Oc1cc2c(cc1CNCc1cccc(N3CCOCC3)n1)OCO2 274778614 KAPMBHQRHWDALY-UHFFFAOYSA-N 343.383 1.642 10 10 EDCE Cc1ccc(CNC(=O)[C@]2(C)COC[C@H]2N)c(O)c1Br 2380725247 JDCFXBPXAROPDO-QMTHXVAHSA-N 343.221 1.443 10 10 EDCE COC[C@@H]1CNCCN1c1ccc(OC)c(Br)c1OC 2162847528 NLDWOTHMCYCRBD-JTQLQIEISA-N 345.237 1.891 10 10 EDCE CNC(=O)[C@H]1COCCN1c1ccc([C@H](C)N)cc1Br 723184062 YQKAIYNPLHCIKM-TVQRCGJNSA-N 342.237 1.420 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCC[C@H]3C[C@@H]32)cc1 826706402 JKGJANRJKLLATG-ZOBUZTSGSA-N 329.444 1.921 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CCOC[C@@H]1NC(=O)OC(C)(C)C 1895875483 JVUKRTNLIMRBKC-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CN(C)c1ccc(/C=C/CNCCCN2CCC[C@H](C(N)=O)C2)cc1 835037774 MREHBVDCGKCWBA-PXPSOEEZSA-N 344.503 1.943 10 10 EDCE CN(C)CCN1CCN(Cc2c(O)ccc3ccccc23)CC1=O 844714261 KPGGRLHVJPCLPR-UHFFFAOYSA-N 327.428 1.751 10 10 EDCE O=C1N(Cc2ccc(N3CCOCC3)cc2)C(=O)[C@]23C[C@H]2CCCN13 924481456 FIZRMXSLZOQQSR-BEFAXECRSA-N 341.411 1.840 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)C2)cc1 858600086 SSJJPYFEZAXYOB-XJKCOSOUSA-N 345.399 1.088 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1cn([C@H]2CCCNCC2)nn1 852817501 YFEKTKFUZPMHTD-AWEZNQCLSA-N 329.404 1.571 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cnnn2C2CCNCC2)cc1 852775321 RAMNIBFOLNBRTE-UHFFFAOYSA-N 328.420 1.199 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@H](CO)C3)C2)cc1 854301895 FXECEUHCFBDTAD-GJZGRUSLSA-N 333.432 1.688 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC(CO)CC3)C2)cc1 854301571 CAJJQKNOGDNTSE-HNNXBMFYSA-N 333.432 1.688 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCOC[C@@H]3C)C2)cc1 852281211 RFPVZKYZIXIOOH-ZQIUZPCESA-N 333.432 1.998 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@H](CN(C)C)C3)C2)cc1 854298634 HGIZYOFETQPRTG-JKSUJKDBSA-N 346.475 1.867 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@]3(C)CNC[C@]3(C)C2)cc1 863562244 HZGFVJSARDJJCY-KDURUIRLSA-N 330.476 1.300 10 10 EDCE Cc1ccc(C(=O)OCC(=O)N2CCOC[C@@H]2C2CC2)c(O)c1O 766103433 XPBHNSBYHGFEQV-CYBMUJFWSA-N 335.356 1.200 10 10 EDCE C[C@H](Sc1nncn1C)C(=O)NCc1ccc2cccnc2c1O 862029298 UYRRIXHUYJUXCS-JTQLQIEISA-N 343.412 1.866 10 10 EDCE NC(=O)[C@@H]1CC[C@H](CCC(=O)NCCCSc2nccs2)O1 865783727 ARZFQOLLDSPNKT-MNOVXSKESA-N 343.474 1.555 10 10 EDCE CN1CCN(c2cccc(C(=O)N3Cc4cccc(O)c4C3)n2)CC1 871203702 QKIITKSMLALRDR-UHFFFAOYSA-N 338.411 1.695 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)OCC(F)(F)F 1118838311 FCCUOPGYQAEDEP-UHFFFAOYSA-N 347.337 1.663 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3COCC3(C)C)CC2)cc1 894207732 WWHRYFLTSPEPBX-GOSISDBHSA-N 333.476 1.832 10 10 EDCE COC(=O)c1c(CN(C)CCOCCO)c2cc(F)ccc2n1C 894671285 CZJRXOXKBBDHJU-UHFFFAOYSA-N 338.379 1.545 10 10 EDCE O=C1OC[C@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@@H]12 895415790 YXILDCZNQGGWLV-PSASIEDQSA-N 330.153 1.899 10 10 EDCE CN(C)CCCN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 92775917 ZCOVFCWODHOXBA-CYBMUJFWSA-N 341.253 1.789 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cc[nH]c2C)cc1C 1268302784 UVNXIYKMLRIACL-OAHLLOKOSA-N 331.416 1.521 10 10 EDCE O=C(Nc1c(Cl)ccc2nonc12)[C@]1(F)CCS(=O)(=O)C1 1271356698 QAWVKPULJODTBZ-NSHDSACASA-N 333.728 1.342 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)CS(C)(=O)=O)cc1C 1505572478 ZJWXDTCFGQEBMB-QWHCGFSZSA-N 342.461 1.031 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1c[nH]c(C(N)=O)c1 1290375277 YGVVQHBIMLAHHA-UHFFFAOYSA-N 326.400 1.986 10 10 EDCE C[C@@H]1CS(=O)(=O)CCN1c1ccc(CN)c(Br)c1 228156967 VKLXCORBAHKQCZ-SECBINFHSA-N 333.251 1.531 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@]1(C)C[C@H](O)CN1C 1540567387 KNGQQJFOMJHVAJ-PKOBYXMFSA-N 331.460 1.700 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2c(C)oc3ncn(C)c(=O)c23)c1 1557552749 IBCGWWXRMCACQI-UHFFFAOYSA-N 327.340 1.779 10 10 EDCE CN1CC[C@@H](C(=O)NCc2c(O)cccc2O)[C@H](c2cnn(C)c2)C1 1558536058 RPNNARCLFIDVCB-HIFRSBDPSA-N 344.415 1.183 10 10 EDCE O=C(COc1ccsn1)NCc1ccc(N2CCC(O)CC2)cc1 1585539987 ZXLUOCXCFKHWPL-UHFFFAOYSA-N 347.440 1.799 10 10 EDCE CC(=O)NC[C@@H](C)OC(=O)/C=C/c1ccc(N2CCOCC2)cc1 157262440 XEEBIGMFKBWJID-LHRNQBEKSA-N 332.400 1.604 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)/C(=C\c2ccc(F)cc2F)SC1=S 1858595851 JWXLDKCTWZMRLS-NZGAHHFVSA-N 345.348 1.612 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NCc1cccc(F)c1O 1937553634 SWPIIYXMVZDKOW-QWHCGFSZSA-N 326.368 1.913 10 10 EDCE Cc1c(OCCN2CCOCC2)c(=O)ccn1Cc1ccc(N)cc1 1857919993 ISKGZPFMGBNHNV-UHFFFAOYSA-N 343.427 1.498 10 10 EDCE C[C@]1(O)CCN(c2ccc(CN)cc2Br)C[C@]1(C)O 1880696787 BZPNIUIHASQXTH-KBPBESRZSA-N 329.238 1.620 10 10 EDCE O=S(=O)(Nc1ccc(O)cc1)N1CC(OCc2ccccc2)C1 1977418821 ALNODJVOAUIBIL-UHFFFAOYSA-N 334.397 1.950 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010404473 ASRRBFSFZHFMDH-LBPRGKRZSA-N 340.428 1.744 10 10 EDCE CC(C)NCc1ccc(N2CC[C@](O)(CO)C2)cc1Br 313908218 SUTWUUYACPDMQA-OAHLLOKOSA-N 343.265 1.881 10 10 EDCE O=C1Nc2cc(N3CCO[C@@H](CF)C3)c(Br)cc2[C@@H]1O 2172042475 WDSVRTCTZYLMKW-MADCSZMMSA-N 345.168 1.609 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC4(CCC4)[C@H]3[C@@H]3CCCO3)c2n1 2064815460 XWNZGNAJJPFNFC-DZGCQCFKSA-N 342.399 1.917 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1908254225 JLDQNGCHSIWJSU-GRYCIOLGSA-N 339.396 1.827 10 10 EDCE CN(C)C(=O)[C@H]1CCN(c2ccc(CO)c(Br)c2)C1 2087356725 DFLPGDPUUAQPDO-JTQLQIEISA-N 327.222 1.856 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])C[C@H](O)C1 2213587627 JSVWLSSTQBRDNY-KIGUWFBYSA-N 339.396 1.752 10 10 EDCE CN(Cc1nn(C)nc1Br)c1ccc(CN)c(F)c1F 2235286607 ZBZDJJXCRYSUIO-UHFFFAOYSA-N 346.179 1.951 10 10 EDCE CNCc1ccc(N2C[C@@H]3CCO[C@@]3(CO)C2)cc1Br 2239802439 YMBKIDYUELADCP-SWLSCSKDSA-N 341.249 1.756 10 10 EDCE NCc1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2314952958 FWYKEPXRBMAEIY-SKDRFNHKSA-N 331.235 1.141 10 10 EDCE CCN(C)CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 101566906 HHUDLFRLEVRSEK-UHFFFAOYSA-N 349.456 1.876 10 10 EDCE Cc1cc(O)c(O)cc1CCNC(=O)CCNC(=O)OC(C)(C)C 170181997 ZTZCUKNBWVNBHA-UHFFFAOYSA-N 338.404 1.980 10 10 EDCE Cc1n[nH]c([C@H]2CN(Cc3ccc(N4CCOCC4)cc3)CCO2)n1 180109872 JZIREPTYKQXNFI-QGZVFWFLSA-N 343.431 1.523 10 10 EDCE COCCNC(=O)Cn1cc(N[C@H](C)c2ccc(N(C)C)cc2)cn1 180104919 WZMCJMHAVOKMKM-CQSZACIVSA-N 345.447 1.885 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NC[C@H]2C[C@H]3C=C[C@@H]2C3)cc1 231918693 HDRVLHDKWVKSLS-RRFJBIMHSA-N 344.411 1.915 10 10 EDCE CC(=O)N1CCN(C(=O)/C=C\c2ccc3c(c2)CCCN3C)CC1 96256264 MTJAZHWRGUZDTO-VURMDHGXSA-N 327.428 1.773 10 10 EDCE C[C@H]1CN(S(=O)(=O)NCc2ccc(N(C)C)cc2)C[C@@H](C)O1 248136354 RWARCOXYFVCWJG-BETUJISGSA-N 327.450 1.196 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)OCCn1cccn1 255343639 GRQZSXSKUVFFGM-DAXSKMNVSA-N 327.384 1.976 10 10 EDCE CNS(=O)(=O)[C@@H]1CCCN(Cc2cc(Cl)cc(C)c2O)C1 362236555 GQOCTGUIVAXECT-CYBMUJFWSA-N 332.853 1.868 10 10 EDCE COC(=O)[C@H]1C[C@@H](OC)CCN1Cc1ccc(N2CCOCC2)cc1 370368504 UQWFZFHORAMRAS-ZWKOTPCHSA-N 348.443 1.676 10 10 EDCE COC(C)(C)[C@@H](N)C(=O)NCc1ccc(C)c(Br)c1O 2380749352 NWMPQPWQEBMQJV-LBPRGKRZSA-N 345.237 1.832 10 10 EDCE COC[C@H]1CN(c2cc(Br)c(CN)cc2F)CCO1 705817814 BKBRYLCCRWXCFD-SNVBAGLBSA-N 333.201 1.899 10 10 EDCE NCc1ccc(COn2c(=O)c(=O)oc3ccc(Cl)cc32)cc1 821297941 ZUPHXPUCXWXXHK-UHFFFAOYSA-N 332.743 1.696 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3c(O)cc(C)cc3Cl)C[C@@H]12 827390613 YDQMRPMCTFTIOI-GLQYFDAESA-N 345.848 1.598 10 10 EDCE CCOc1ccc(CN2CCN([C@@H]3CCNC(=O)CC3)CC2)c(O)c1 825147152 CIPLCUCEOYMKDD-INIZCTEOSA-N 347.459 1.577 10 10 EDCE CN(C)[C@@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)c1cnn(C)c1 588407964 HVVGLWPZUFJFKQ-VSKVDJIOSA-N 330.388 1.264 10 10 EDCE COc1ccc(O)c(CNC(=O)NCCNC(=O)c2ccccc2)c1 734065155 WQBDCKXEXACZGT-UHFFFAOYSA-N 343.383 1.630 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N[C@H]1CCc2nnn(C)c2C1 919080686 DWOOJRZFWZWIBC-AWEZNQCLSA-N 342.447 1.546 10 10 EDCE CC(C)[C@@H]1CN(Cc2cc(O)n3ncc(C(=O)O)c3n2)CCS1 846254696 ALECQXMJKXVKDZ-LBPRGKRZSA-N 336.417 1.707 10 10 EDCE CO[C@@H](C(=O)OCC(=O)C(C)=O)c1ccccc1Br 848804060 HOQKSSGGPXDGBQ-GFCCVEGCSA-N 329.146 1.838 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C[C@H]1CN(C2CC2)C(=O)O1 844268752 AGDARPWRAYXTIQ-SFHVURJKSA-N 345.443 1.938 10 10 EDCE CCN(CC)S(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849415556 BUCONWSVAHUPEW-CYBMUJFWSA-N 327.450 1.450 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C)CCCO)C2)cc1 854297020 IITZUKVZGVMGLJ-GJZGRUSLSA-N 335.448 1.982 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](O)c3ccco3)C2)cc1 854301190 KMQFGOYSKYXRNH-CJNGLKHVSA-N 345.399 1.900 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN=C2C1=NNN2C 854373303 DIORAKVFOMRABD-CQSZACIVSA-N 343.431 1.745 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3CCN[C@H]3C)C2)cc1 861648648 ZJEHHYGGPOLLQZ-GRDNDAEWSA-N 332.448 1.571 10 10 EDCE CC[S@](C)(=O)=NS(=O)(=O)NCc1ccc(N(C)C)cc1C 866798202 XSDBFBXYQKBNAX-FQEVSTJZSA-N 333.479 1.513 10 10 EDCE CCN(C)c1ccc([C@H](C)NC[C@]23COCCN2C(=O)COC3)cc1 866556018 PONBWEDVXJEUMP-HNAYVOBHSA-N 347.459 1.421 10 10 EDCE CCO[C@@H](C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCOC1 864470990 UVTXHAAGYPUKSR-CRAIPNDOSA-N 348.443 1.785 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCN(C)C2)cc1 788974981 MBLAJEICWWSOGE-MRXNPFEDSA-N 346.475 1.359 10 10 EDCE O=C(N[C@@H]1[C@H]2COC[C@H]21)N(Cc1ccccc1O)C[C@H]1CCCO1 793455623 GABFSFYSOZFVJQ-AIANPOQGSA-N 332.400 1.728 10 10 EDCE CN(C)CCN(CC(=O)O)Cc1cc(Br)cc(F)c1O 715772040 XUIAMMXRCOKTIL-UHFFFAOYSA-N 349.200 1.742 10 10 EDCE Cn1ncc(NC(=O)COc2ccc(N)cc2)c1Br 694184853 ZOCNWMSILNHJIW-UHFFFAOYSA-N 325.166 1.782 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H]2CCCC(=O)N2)cc1C 1317247645 NGRHTDBCGNAQOQ-DZGCQCFKSA-N 333.432 1.267 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3n[nH]cc3F)cc2)CC1 1178039435 TXFDTLJYTLHAFT-UHFFFAOYSA-N 345.378 1.181 10 10 EDCE C[C@@](NCCCN=[N+]=[N-])(C(N)=O)c1ccncc1Br 2120063171 GQEXNMYXJPFXJA-NSHDSACASA-N 327.186 1.835 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2ccnnc2)cc1C 1321261338 JGAGMBPQNVECEY-ONEGZZNKSA-N 326.400 1.869 10 10 EDCE CO[C@H]1CC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 1335761096 WQLYQNWCASHEHT-HOTGVXAUSA-N 333.432 1.313 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC3(C)CCC3)C2)cc1 1350778120 DZGWCQXYNZANCC-CQSZACIVSA-N 345.443 1.697 10 10 EDCE C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@H](C)CN1CCO 1451746593 RYURYHOSLVEYRF-VXGBXAGGSA-N 333.392 1.376 10 10 EDCE COc1ccc(O)c([C@H](C)N[C@H](C)c2nc(N)nc(N(C)C)n2)c1 1459849051 KAELMGZTECFDOS-VHSXEESVSA-N 332.408 1.646 10 10 EDCE COC[C@H](C)C(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1295441844 AXCCUAMIHKMZOJ-WDEREUQCSA-N 349.391 1.366 10 10 EDCE C[C@H](CNC(=O)[C@@H]1CCCO1)NC(=O)c1ccc(N=NC(N)=O)cc1 1526372032 GSHPSYLRXDBUBC-MFKMUULPSA-N 347.375 1.263 10 10 EDCE COc1ccc(CN[C@H](C)[C@H]2CCN(C(=O)CNC(C)=O)C2)cc1C 1484326501 KVSZPAMXLFLIMB-PBHICJAKSA-N 347.459 1.466 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H](C1CC1)C1(CO)CCOCC1 1557258689 AJFKYELGSKBNRS-KRWDZBQOSA-N 335.400 1.324 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1Cc1ccn(C)n1 1498675870 UVWAAFGBAQKSLE-UHFFFAOYSA-N 326.404 1.964 10 10 EDCE COC[C@@H](C)NCC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1497329034 LNZXLBZSHPGKSA-VXGBXAGGSA-N 335.408 1.982 10 10 EDCE CC[C@@H](C)CC(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1720822603 LAHLYRLIFSWMSE-BNOWGMLFSA-N 349.431 1.912 10 10 EDCE CN1CCC(N(C)CCN(C)C(=O)Cc2ccc(O)c(O)c2)CC1 1565608567 JHKCNVFLYLVYHI-UHFFFAOYSA-N 335.448 1.125 10 10 EDCE Cc1nn(CCC(=O)NCc2cc(O)ccc2O)c(C)c1[N+](=O)[O-] 1651222611 KNGWLMIRTFQAKD-UHFFFAOYSA-N 334.332 1.526 10 10 EDCE C[C@@H]1[C@H](CO)CCN1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1675579944 FAXNIQPLJCQTLW-WBVHZDCISA-N 346.475 1.351 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@H](C)NC(C)=O)cc1C 1699227895 QZFNLVBHQOWQFW-GXMNPTEKSA-N 333.432 1.290 10 10 EDCE CCNCc1ccc(N2CCNC(=O)[C@@H]2C)c(Br)c1 233530370 HELYUTDRISDRNG-JTQLQIEISA-N 326.238 1.883 10 10 EDCE C[C@H]1OCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N(C)CCN=[N+]=[N-] 1985101947 ZTRFPDFRQFRXGM-MNOVXSKESA-N 327.385 1.780 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NCc2cc(F)ccc2O)C1 1985830841 ZMUWYOPUENCQAX-TZMCWYRMSA-N 326.368 1.601 10 10 EDCE C[C@@H]1OCCN(Cc2cc(Br)ccc2O)[C@@H]1C(=O)O 328139545 QEXCKBYSJPXNQM-UFBFGSQYSA-N 330.178 1.829 10 10 EDCE C[C@@H](NCCN1CCOCC1=O)c1cc(Br)ccc1O 2062867734 LYKOVWKMGPWZIC-SNVBAGLBSA-N 343.221 1.664 10 10 EDCE O=S1(=O)CCC2(CC1)OCC[C@H]2NCc1ccc2c(c1)CCO2 2063085405 QSRKIYSQRVWTJG-MRXNPFEDSA-N 337.441 1.447 10 10 EDCE CCCNCc1ccc(N2CC[C@H](O)[C@@H](O)C2)c(Br)c1 2188637580 VGRIJHSQOUYZNG-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)COc2ccc(N)cc2)[C@@H]2C[C@H]21 2044625532 WECUJTYIHUBVQR-HUUCEWRRSA-N 347.415 1.868 10 10 EDCE NC[C@H]1C[C@H](O)CN1Cc1cc(Cl)cc(Br)c1O 2067383610 RQWPUCQLWRJSCJ-ZJUUUORDSA-N 335.629 1.702 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1CO[C@H]2COC[C@H]12 2101857763 YTPYDBUCNSFQLA-QKCSRTOESA-N 328.206 1.906 10 10 EDCE N[C@@H]1CN(Cc2cc(Cl)cc(Br)c2O)[C@@H]2COC[C@H]12 2102138294 USOFSYFSAXYAHR-YUSALJHKSA-N 347.640 1.966 10 10 EDCE NCc1cc(F)c(N2C[C@H](O)[C@@H]3COC[C@H]32)cc1Br 2102186380 FYZUBURQXZNBCJ-WQHBLYJGSA-N 331.185 1.243 10 10 EDCE C[C@H](O)c1ccc(N2CC(=O)N[C@H]3CC[C@H]32)cc1Br 2112060443 FFBULDRWFRCFFD-AQUOVQTQSA-N 325.206 1.970 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213589540 GRHXEXVOVAIDNT-GARJFASQSA-N 341.412 1.998 10 10 EDCE CC[C@@H](C)NCc1ccc(N2C[C@H](O)[C@H](O)C2)c(Br)c1 2240040831 VDMUGIQOADDXMF-KMUNFCNLSA-N 343.265 1.879 10 10 EDCE OCc1ccc(N2C[C@H]3OCC[C@@]3(CO)C2)cc1Br 2278878481 JPKQOQYOZUAOTF-KGLIPLIRSA-N 328.206 1.529 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)NCCN1C(=O)Cc2ccccc21 2307996608 YDBDTJSGDDOVEM-UHFFFAOYSA-N 338.363 1.817 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3c(O)cccc3Br)C[C@H]21 2314963383 MWBMKLMWRTYMGA-QPUJVOFHSA-N 332.219 1.384 10 10 EDCE Cc1cc(C(=O)N2CCO[C@@H](CN(C)C)C2)c(C)n1-c1ccccn1 116791733 MCSWIODYIGRZFZ-INIZCTEOSA-N 342.443 1.892 10 10 EDCE O=C(NCCCn1ccnn1)NCc1ccc(N2CCCC2)cc1 182289942 XRASXFOLHKVHRJ-UHFFFAOYSA-N 328.420 1.768 10 10 EDCE C[C@H](CN(C)C)N(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2379903755 RWJKXYZYBFGVOO-AMIZOPFISA-N 342.237 1.821 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C)N1CCN(c2ccc(F)cc2)CC1 808519540 WIQYARZBZAKGOY-LBPRGKRZSA-N 336.363 1.038 10 10 EDCE Cc1ccc(N(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)cc1C 298975791 MFAAGBFHYOBFOD-VQHVLOKHSA-N 327.384 1.377 10 10 EDCE CN(C[C@@H]1CCCO1)C(=O)C(=O)NCCCSc1nccs1 806280105 JYATXXJPLHWBFN-NSHDSACASA-N 343.474 1.379 10 10 EDCE COC[C@@]1(C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCOC1 823555293 TZMNLRWZFVOKBR-SFHVURJKSA-N 334.416 1.397 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1n[nH]cc1F 900753617 CSKNVJRQZKUILX-UHFFFAOYSA-N 332.379 1.688 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCC[C@@](O)(CO)C1 837627808 ZZNBQXNJNHCROM-SFHVURJKSA-N 333.432 1.316 10 10 EDCE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CC(N)=O 834514642 SYTAIHCMXOSIOQ-UHFFFAOYSA-N 335.404 1.250 10 10 EDCE C[C@H](NC(=O)[C@H]1CSC(=O)N1)c1ccc(N2CCOCC2)cc1 746168363 OMPRBXPMTQBXCN-SMDDNHRTSA-N 335.429 1.525 10 10 EDCE COC(=O)[C@H](NCc1cc(Cl)c(F)cc1O)c1ccnn1C 843429587 HEBJRJDVGWCGGO-CYBMUJFWSA-N 327.743 1.922 10 10 EDCE CC(C)(CNCc1ccc(N2CCOCC2)cc1)[C@@]1(O)CCOC1 842760598 HQSRWSDCZKHTHX-LJQANCHMSA-N 334.460 1.790 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)CC3(F)CC3)C2)cc1 917169323 MPXJQYAVFJSKAM-LBPRGKRZSA-N 328.409 1.695 10 10 EDCE C[C@H]1C(=O)N(CCN(C)C)CN1C/C=C\c1ccc(N(C)C)cc1 843429430 VNGAXGLKUBJMED-WLMCBFPDSA-N 330.476 1.818 10 10 EDCE COc1cnc(NC(=O)C(=O)N[C@@H](C)c2cc(OC)ccc2O)nc1 845857924 QTSCBERZQLAPDD-VIFPVBQESA-N 346.343 1.015 10 10 EDCE CC(C)(C(=O)NCc1ccc(N2CCOCC2)cc1)n1cc(N)cn1 852859059 NELDKHNMRYJYKP-UHFFFAOYSA-N 343.431 1.353 10 10 EDCE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(C)cc(C)c1O 754741020 NXRCYZZKCFTJJR-FPCVCCKLSA-N 347.411 1.934 10 10 EDCE CO[C@@]1(CO)CCCN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 854003265 GXTHXFJZOSSOJN-KSSFIOAISA-N 335.448 1.997 10 10 EDCE CCON(CC)C(=O)CNCc1ccc(N2CCOCC2)c(F)c1 858218895 AGHWXOWWPBOBRO-UHFFFAOYSA-N 339.411 1.552 10 10 EDCE CN1C[C@]2(C)CN(CC(=O)NCc3ccc(N(C)C)cc3)C[C@@]2(C)C1 931306144 CVFHVBVHCGZHQO-WOJBJXKFSA-N 344.503 1.642 10 10 EDCE NC1(CNC(=O)NCc2ccc(N3CC=CC3)cc2)CCOCC1 861590593 UHNOIMWFYRRPEB-UHFFFAOYSA-N 330.432 1.370 10 10 EDCE C[C@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CN1 861765326 AGKUZFFHZBEAQS-GOEBONIOSA-N 344.459 1.160 10 10 EDCE CC(C)C1(S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)CC1 866756998 GKICQUPKOZBHJR-OAHLLOKOSA-N 325.478 1.860 10 10 EDCE 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340.265 1.988 10 10 EDCE NCc1ccc(N2CCn3c(CO)nnc3C2)cc1Br 2171784559 KTFGNSFLFYFJJE-UHFFFAOYSA-N 338.209 1.012 10 10 EDCE CCc1nn(C)c(CC)c1CNC(=O)c1cnn2c(O)cc(C)nc12 2063611805 PXMFXNVGFBGDBT-UHFFFAOYSA-N 342.403 1.532 10 10 EDCE CNCc1ccc(N2C[C@H]3OC(=O)N(C)[C@@H]3C2)cc1Br 2176933057 MGLYEYALMGJMEY-CHWSQXEVSA-N 340.221 1.808 10 10 EDCE NCc1ccc(N2CCN3C(=O)OC[C@H]3C2)c(F)c1Br 2170715911 CICURHVBJWMNQH-SECBINFHSA-N 344.184 1.688 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCN(CC(=O)NCc2ccccc2O)C1 2060029792 KMSKQTBUKHBATN-AWEZNQCLSA-N 349.431 1.607 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H]3COC[C@@H]32)cc1Br 2102176376 BUMZANOQOZZGSP-BLJJELEKSA-N 328.206 1.698 10 10 EDCE CNCc1ccc(N2CC[C@@](O)(COC)C2)cc1Br 2095539171 WRKUNPTWQSPJNR-AWEZNQCLSA-N 329.238 1.756 10 10 EDCE C[C@@]1(CO)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2097247574 OEELVQRLUPBKFP-YPMHNXCESA-N 327.178 1.396 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3COC[C@]3(CO)C2)c(Br)c1 2234565799 ILQNWDVJPSZQPC-JVLSTEMRSA-N 342.233 1.948 10 10 EDCE 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O=C(Cc1ccc(O)c(O)c1)NCCS(=O)(=O)Cc1ccccc1 1597322763 GOYXIQDAMGJNOM-UHFFFAOYSA-N 349.408 1.372 10 10 EDCE CNC(=O)N[C@H]1CCN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1680281278 XFVPEFRFGNOYRT-OCCSQVGLSA-N 333.436 1.527 10 10 EDCE COCCN[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C(C)C 1698981950 XTRVLYVNIUEIJM-AWEZNQCLSA-N 335.408 1.839 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN(CCN)CC(F)(F)F 883445095 HGVAZORWVGCGQK-UHFFFAOYSA-N 346.397 1.534 10 10 EDCE C[C@@H]1COC[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)N1C(=O)OC(C)(C)C 1985095228 BCWVJIDQPCNEQV-KOLCDFICSA-N 325.369 1.532 10 10 EDCE CN(CC(C)(C)CO)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2150983687 ZLNPNICOGVNHTJ-GFCCVEGCSA-N 343.221 1.889 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C[C@H](O)C1 1990022302 ASRQWOXGVASZRO-PKFCDNJMSA-N 325.369 1.316 10 10 EDCE Nc1ccc(N2C(=O)[C@@H]3[C@@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1Br 2153256011 PHLPXCSTTIBHMQ-IWDIQUIJSA-N 337.173 1.698 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010398560 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XDCPXRQGNWYHTB-RISCZKNCSA-N 327.222 1.353 10 10 EDCE COc1ncc(NC(=O)c2cc(O)nc(O)c2)cc1Br 2241001403 QJZGLPKEGSWHEU-UHFFFAOYSA-N 340.133 1.911 10 10 EDCE CNCc1ccc(N2CCC[C@@H]3CNC(=O)[C@@H]32)c(Br)c1 2279281223 RVNFHHASKAOKKF-BXUZGUMPSA-N 338.249 1.883 10 10 EDCE CO[C@H](CNC(=O)Cc1ccc(N)cc1)CNC(=O)OC(C)(C)C 2301660213 OKQIOUISLJJVRD-CQSZACIVSA-N 337.420 1.467 10 10 EDCE C[C@H](O)c1ccc(N2CC(O)(CN(C)C)C2)c(Br)c1 2343628932 UQLPMQNHRQJMCX-JTQLQIEISA-N 329.238 1.615 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCn3cc(C)cn3)CC2)cc1 172292931 RRPZSHNFNYBEJJ-UHFFFAOYSA-N 343.431 1.732 10 10 EDCE CN(C)c1ccc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)cc1 179890099 FOUWUQMFDJXDNG-QGZVFWFLSA-N 331.460 1.823 10 10 EDCE COC(=O)c1sc(NN(C)S(=O)(=O)C2CCC2)nc1Cl 2365274828 IFTJASWCDPIWBR-UHFFFAOYSA-N 339.826 1.724 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C1[C@@H]2CNC[C@@H]12 1952692365 QITSEUXMPMTVLC-JHJVBQTASA-N 334.416 1.999 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@]1(C)CCN(C(=O)OCc2ccccc2)C1 808546737 YXVSHEPVCPRUNH-SFHVURJKSA-N 347.367 1.737 10 10 EDCE COc1ccc(N2CCN(C)C[C@@H]2CN)c(OC)c1Br 2162633130 VIHSGRWIRSJWOC-JTQLQIEISA-N 344.253 1.545 10 10 EDCE CN[C@@H](C)c1ccc(N2CC[C@H](NC(N)=O)C2)cc1Br 723183207 RJBZMZHHQOTKTA-UWVGGRQHSA-N 341.253 1.977 10 10 EDCE CC(C)NS(=O)(=O)CCNC/C=C\c1ccc(N(C)C)cc1 835037801 NDGMNUXBDFZYIY-WAYWQWQTSA-N 325.478 1.683 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\c1ccc(C(N)=O)cc1 588432681 WVLQZUQXBBTDHW-DJTUGOFGSA-N 340.379 1.957 10 10 EDCE O=C(O)CN(Cc1ccccc1O)C(=O)[C@@H]1CC[C@H]2CCCCN12 911489666 VVHGWWDCOHYRIW-CABCVRRESA-N 332.400 1.822 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc(OC)n(C)n3)C2)cc1 855224575 FZVKDDDQZVUJEM-LBPRGKRZSA-N 330.388 1.446 10 10 EDCE CC(=O)N1CCO[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 929935877 SKHZHMGAUHXGFH-SFHVURJKSA-N 345.443 1.491 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](CO)CCF)C2)cc1 852449649 VMFMLRXQJLGQEY-OLZOCXBDSA-N 325.384 1.294 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)N[C@@H]2CCN(C3CCC3)C2=O)c1 858603990 YYTKXUSAMAHWID-IAQYHMDHSA-N 332.400 1.983 10 10 EDCE C[C@@H]1CN(c2ccc(CNC(=O)CC3(N)CC3)cc2F)C[C@@H](C)O1 852860806 VHDOWRMQBMHLCR-CHWSQXEVSA-N 335.423 1.937 10 10 EDCE Cc1cn(CC(=O)NCCc2ccc(O)c(O)c2)nc1C(F)(F)F 860235307 QNGLYPDXJVMCRO-UHFFFAOYSA-N 343.305 1.980 10 10 EDCE COc1cc(Cl)cc(CNC[C@@]23COCCN2C(=O)OC3)c1O 872262494 GIEIVKZFQSVIDY-HNNXBMFYSA-N 342.779 1.365 10 10 EDCE COc1ccc(O)c([C@@H](C)N[C@@H](C)C(=O)N(C)CC(=O)NC2CC2)c1 775369787 QWONHPMBSGKMIN-NEPJUHHUSA-N 349.431 1.177 10 10 EDCE COC(=O)C1(O)CN(c2ccc([C@@H](C)O)c(Br)c2)C1 714487866 LAJADIYVMZEUCW-MRVPVSSYSA-N 330.178 1.227 10 10 EDCE C[C@H](NC(=O)C(=O)NC[C@@H]1C[C@@H]1C)c1ccc(N2CCOCC2)cc1 1321666401 WANYYPVNSKGGOT-DZKIICNBSA-N 345.443 1.473 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@@H]2CCN(C)C2)cc1C 1265850317 CRYFHBBUIAJJOX-RDJZCZTQSA-N 333.476 1.940 10 10 EDCE C[C@@H]1CCOCCN1C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1262219222 IJGRCILXRNWRQN-OAHLLOKOSA-N 345.443 1.540 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2CCN(C)C2)cc1C 1267157279 LEGMIMJQDLKXLJ-DOTOQJQBSA-N 333.476 1.940 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)C[C@H]2CCNC2=O)cc1C 1270420651 VUEOVAVCWHIDCN-XJKSGUPXSA-N 347.459 1.372 10 10 EDCE CO[C@@H](C)CC(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1284209410 SEYHUFUSABRRCI-QWRGUYRKSA-N 349.391 1.509 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)[C@@H]1CCc2nnc(O)n2C1 1456309938 NKLYSXIZOHXPFI-GFCCVEGCSA-N 338.367 1.721 10 10 EDCE Cc1sc(S(N)(=O)=O)cc1C(=O)NCc1ccc(O)cc1O 1299575327 YZFHUHYHVPXIEA-UHFFFAOYSA-N 342.398 1.045 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NCc2c(O)cccc2O)C1 1472064252 YNUAHJXMLPCAKT-LBPRGKRZSA-N 348.399 1.971 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1CCN(C)C1)NCc1ccc(OC)c(C)c1 1715078886 FGPIGBBWITXVNP-IAGOWNOFSA-N 333.476 1.940 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)c2cnn[nH]2)C2CC2)cc1C 1483570282 IVBIVUXGDCQCGY-AWEZNQCLSA-N 329.404 1.420 10 10 EDCE CC(C)NC(=O)CNCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1714801276 GKKCHCNRZHYROP-UHFFFAOYSA-N 348.407 1.035 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)C(C)(F)F)cc1C 1717908807 JMMVGEMGKMASFP-ZDUSSCGKSA-N 330.375 1.568 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](C)N(C(=O)CCNC(N)=O)C2)cc1C 1717828234 PLJXMUJMCRFNBN-HIFRSBDPSA-N 348.447 1.141 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@H]2CCC(=O)N2)cc1C 1714284971 RFRVFWQWPAQNKO-DZGCQCFKSA-N 333.432 1.267 10 10 EDCE C[C@@H](NCCO)[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1496459482 IYIXFJZPCYTQOV-TZMCWYRMSA-N 347.419 1.672 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cc[n+]([O-])cc2)cc1C 1566997566 XSWOAEVMBGBFHT-CQSZACIVSA-N 329.400 1.545 10 10 EDCE O=C1CC[C@H](c2ccc(C(=O)NCc3c(O)cccc3O)cc2)N1 1645363306 QABBNNQTCBQXMT-CQSZACIVSA-N 326.352 1.979 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C2=CCCC2)cc(OC)n1 1744640750 UTNNGICMJUOHAL-NSHDSACASA-N 333.388 1.444 10 10 EDCE Cc1[nH]nc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1O 1597907978 KHHBBFGCSBPSCU-NSHDSACASA-N 330.388 1.751 10 10 EDCE COc1ccc(Br)c(CNC[C@@]2(O)CCO[C@H]2C)c1O 1964064082 GLLGGQUOEAZDAM-XPTSAGLGSA-N 346.221 1.793 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003168902 XFTBICLIYNZLOJ-XLFUENPSSA-N 336.432 1.898 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](CO)C[C@H]2CO)c(Br)c1 2146079303 ISCWTMGCELZKKZ-WZRBSPASSA-N 343.265 1.909 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@]1(C)C(=O)N1CC(N=[N+]=[N-])C1 1993371881 JYFGZNWJJALPCJ-AWEZNQCLSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010405844 MOPYNHVEXRZJLY-RYUDHWBXSA-N 339.396 1.781 10 10 EDCE C[C@@H](CNC(=O)c1cc(O)c(O)c(O)c1)N(C)C(=O)OC(C)(C)C 2015121805 GQEIVIPTJVNTHN-VIFPVBQESA-N 340.376 1.789 10 10 EDCE C[C@@]1(C(N)=O)CCN(c2cc(Br)c(CN)cc2F)C1 388211482 KLICDWGPSZFKRA-CYBMUJFWSA-N 330.201 1.749 10 10 EDCE CN(C)c1ccc([C@H](O)C(=O)c2nc(Br)nn2C)cc1 2173163296 KDQZIYVLDAYTBI-JTQLQIEISA-N 339.193 1.560 10 10 EDCE CN(Cc1cnn(C)c1Br)C(=O)c1cccc(O)c1O 2173266601 TUTBLKJJOSDDCP-UHFFFAOYSA-N 340.177 1.866 10 10 EDCE CN1CCO[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@H]21 769483562 PGMBJQDQLKRBLI-TZMCWYRMSA-N 327.222 1.670 10 10 EDCE O=C1Nc2cc(N3CCC=C[C@@H]3CO)c(Br)cc2[C@@H]1O 2182333823 VUSNREJNFUSGCQ-OQPBUACISA-N 339.189 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@@]12C[C@@H]1CN(C(=O)COc1ccc(N)cc1)C2 2044622167 ZHHBBBOGHUAKHD-KZULUSFZSA-N 347.415 1.773 10 10 EDCE NCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@@H]32)c(Br)c1 2090540588 COFZHOVPCTVPCZ-LEWSCRJBSA-N 327.222 1.636 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)cc1Br 2205602380 UEOTVNLBCAGXMR-DGJRKYIQSA-N 347.228 1.609 10 10 EDCE CSc1ncc(CNC(=O)c2nn(C)nc2Br)s1 2257100015 BCYAPQDQHFSXJP-UHFFFAOYSA-N 348.251 1.686 10 10 EDCE CN(C(=O)C=Cc1ccc(N2CCOCC2)cc1)c1cnn(C)c1 2297666209 CPFUMUFPOCZNKD-UHFFFAOYSA-N 326.400 1.933 10 10 EDCE CN(C)c1ccc([C@@H](CN2CCC(O)CC2)N2CCNCC2)cc1 107901876 NIHZWWLCCYDZSH-LJQANCHMSA-N 332.492 1.156 10 10 EDCE CN[C@@H](C)c1ccc(N2CC([C@@H](O)CO)C2)c(Br)c1 2336781728 YFJGOYDBBVHRAN-XPTSAGLGSA-N 329.238 1.519 10 10 EDCE Cc1ccc(CN2CCC[C@H]2[C@H](O)CO)c(O)c1Br 2352946921 DPNIISRGFGBLMU-NWDGAFQWSA-N 330.222 1.781 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2C[C@@H](CO)[C@@H](CCO)C2)cc1 1346255012 ARJOIROQRXAUSB-IRXDYDNUSA-N 349.475 1.665 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)c(Br)c1 2357053463 WBKOJJOQHYHSTD-IDNCBAHPSA-N 342.233 1.965 10 10 EDCE [N-]=[N+]=NCCCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21 252487106 HSSTWUOLSWCKKL-MDZLAQPJSA-N 340.453 1.919 10 10 EDCE COCCNC(=O)[C@H](C)N1CCCN(c2ccc(OC)cc2)CC1 122140251 FUUWOSJUSCEQQN-HNNXBMFYSA-N 335.448 1.358 10 10 EDCE Cc1nnc2ccc(N3CCN(Cc4cc(F)ccc4O)CC3)nn12 180096237 MPFSADXAWNIOPD-UHFFFAOYSA-N 342.378 1.600 10 10 EDCE Nc1ccc(CC(=O)N[C@@H]2CCS(=O)(=O)c3ccccc32)cc1 195141487 MNCNPCYFWBFMHG-OAHLLOKOSA-N 330.409 1.846 10 10 EDCE CN1C[C@H]2CN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)C[C@H]2C1 193643805 PUZAOTGRDNLQSW-CALCHBBNSA-N 330.476 1.204 10 10 EDCE COC[C@@H](O)CN1CCC(N[C@@H](C)c2ccc(N(C)C)cc2)CC1 90915323 APTNRCBOPAMURX-KXBFYZLASA-N 335.492 1.875 10 10 EDCE COc1cc(O)c(CN2C[C@@H](N3CCOCC3)[C@H](C)C2)cc1OC 246010754 YGMRQKWPRURRRM-UKRRQHHQSA-N 336.432 1.562 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CC[C@H](NC(N)=O)C3)ccc21 270787161 UYIBTNOLBZLKOY-AWEZNQCLSA-N 331.420 1.021 10 10 EDCE CC(C)(C(N)=O)N1CCN(Cc2cc(Cl)c(F)cc2O)CC1 295326757 LSHPFJPJDJQEEF-UHFFFAOYSA-N 329.803 1.566 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]1c1cnc[nH]1 823793195 CZMFRRJQSKZBMW-ZIAGYGMSSA-N 343.383 1.811 10 10 EDCE CN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)C1(CO)CCOCC1 827907549 BGQDDMOEFMHSSY-UHFFFAOYSA-N 330.768 1.927 10 10 EDCE CNC(=O)CN1CCC(NC/C=C/c2ccc(N(C)C)cc2)CC1 835034672 ADYHXRZIKDIKDI-SNAWJCMRSA-N 330.476 1.566 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCO[C@@H]([C@H](C)O)C2)cc1 840263422 QLIBOAOXJKWKRS-WMLDXEAASA-N 335.448 1.824 10 10 EDCE Cc1cc(C(=O)COC(=O)CC(N)=O)c(C)n1-c1ccc(Cl)cn1 840496753 SAPVYBQSGDVNMK-UHFFFAOYSA-N 349.774 1.744 10 10 EDCE C[C@@H]1CNCC[C@@H]1NC(=O)NCc1cc(Br)ccc1O 841989598 ZVRPVVUPEQZNFP-SKDRFNHKSA-N 342.237 1.952 10 10 EDCE Cc1ncc(CNCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1 917397588 VKAGBTWPOPSOMS-QGZVFWFLSA-N 339.443 1.777 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)NC1CCC(C(N)=O)CC1 914536732 AJDATJQGMFUSKT-UHFFFAOYSA-N 332.448 1.938 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H](c3ccnn3C)C2=O)cc1F 843305369 BULCVOLOBHYCKF-AWEZNQCLSA-N 331.351 1.418 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[C@@H]1CCCOC1 859275741 ATJOACZTGRZEQA-INIZCTEOSA-N 347.459 1.644 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CC[C@](CO)(C(F)(F)F)C1 924456091 KZOIUOWHBTWOJN-PMUGQKEBSA-N 331.290 1.884 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCN(S(C)(=O)=O)[C@H](C)C2)c1O 852531316 ZRFHKGNTQCQIQM-SNVBAGLBSA-N 344.408 1.200 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc4nnnn4c3)C2)cc1 855234169 UHNTYYXQJVMWTK-ZDUSSCGKSA-N 338.371 1.142 10 10 EDCE O=C1[C@@H](NCc2ccc(N3CCOCC3)c(F)c2)CCN1C1CCC1 858343285 WRLLFDMOVFVVEJ-KRWDZBQOSA-N 347.434 1.905 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3CN(C)C[C@@H]3C)CC2)cc1 756108233 UXVOKLHIUONIOK-LPHOPBHVSA-N 332.492 1.357 10 10 EDCE Nc1cccnc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 868839097 XSLIECRPFUKEQS-UHFFFAOYSA-N 348.353 1.709 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCCN(C=O)CC2)c([N+](=O)[O-])c1 866126933 MBZDJCLWCVTCHT-XQRVVYSFSA-N 333.344 1.450 10 10 EDCE COc1ccc(O)c([C@H](C)NCC(=O)N2CCOC[C@H]2C2CC2)c1 775377514 GPQPQIUUJQUMTG-LRDDRELGSA-N 334.416 1.689 10 10 EDCE COC(=O)[C@@H]1C[C@@H]2C[C@H](NC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H]2C1 888465254 FLBSLHCNTCARQM-ACTVIBPNSA-N 331.368 1.815 10 10 EDCE O=C(N[C@H](CO)C1CCOCC1)c1cc2cc(O)c(O)cc2s1 897363594 NCKJNUSGICHCDI-LLVKDONJSA-N 337.397 1.830 10 10 EDCE COc1ccc(CNC(=O)c2cnc3c(C)cccn3c2=O)c(O)c1 794372759 CYPQOHRQJCUDRO-UHFFFAOYSA-N 339.351 1.647 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)C1CN([C@@H]2CCOC2)C1 896693115 ZLFFJYDNEZGEJD-OAHLLOKOSA-N 330.428 1.608 10 10 EDCE CCNCc1ccc(N2CC(=O)NC[C@@H]2C)cc1Br 2124762456 RDWNAAICYHEKOL-JTQLQIEISA-N 326.238 1.883 10 10 EDCE CS(=O)(=O)Nc1ccc(NS(=O)(=O)CCF)cc1Cl 2121057781 WPJXTFGUYGYAPO-UHFFFAOYSA-N 330.790 1.423 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2C(C)(C)C2(F)F)cc1 1327899885 ILLQLRCJLQRYAW-ZDUSSCGKSA-N 339.386 1.776 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@@H]2CC[C@H]2OC)cc1 1333088789 NTROICJLMFPQLR-IAGOWNOFSA-N 347.459 1.785 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)NCCCCN=[N+]=[N-] 1902592092 YQHOFSKMLOMEMQ-UHFFFAOYSA-N 329.401 1.813 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@]23CCOC3)cc1 1345246751 NFAJMJDBGGLOAG-IBGZPJMESA-N 345.443 1.540 10 10 EDCE CC[C@H](CNC(=O)c1cncnc1O)NCc1ccc(OC)c(C)c1 1267809058 DHXUJOUZHVTDSU-CQSZACIVSA-N 344.415 1.797 10 10 EDCE CC[C@H](CNC(=O)Cc1ncc[nH]1)NCc1ccc(OC)c(C)c1 1267823404 HZWAXQCJAMDLKD-OAHLLOKOSA-N 330.432 1.954 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2n[nH]c(C)c2O)cc1C 1275120791 HRTRCDBDJNHXGM-NSHDSACASA-N 332.404 1.649 10 10 EDCE CCC(=O)N[C@@]1(C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1506384377 VYKMVKLPBMJUJZ-INIZCTEOSA-N 331.376 1.980 10 10 EDCE NC(=O)c1ccc(CCC(=O)NCCc2ccc(O)c(O)c2)cc1 1445935485 BQJWNVHREJFVNB-UHFFFAOYSA-N 328.368 1.488 10 10 EDCE COC1(c2nccn2C)CN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 1520480074 AXZHYSPPUKFJFY-GQCTYLIASA-N 329.356 1.229 10 10 EDCE O=C(Nc1ccccc1CN1CCNC1=O)c1cccc(O)c1O 1546247054 IGRXNJBECACVSD-UHFFFAOYSA-N 327.340 1.875 10 10 EDCE NC(=O)[C@@H]1CC[C@H](CCC(=O)NCc2cccc(Cl)c2O)O1 1472316966 PEJDUIOJAUPONL-PWSUYJOCSA-N 326.780 1.475 10 10 EDCE Cc1nn(C)c(-n2cccn2)c1C(=O)NCc1ccc(O)cc1O 1626850120 PARCSMAPDMDYPF-UHFFFAOYSA-N 327.344 1.255 10 10 EDCE C[C@@H](NC(=O)C1CCC2(CC1)NC(=O)NC2=O)c1ccccc1O 1648889530 ALOLBXKIBGLKJJ-LJRHVDQYSA-N 331.372 1.338 10 10 EDCE CC(C)(C)OC(=O)[C@]1(C(=O)NCc2cc(O)ccc2O)CCCO1 1644753543 CWDDGITYJPQIMX-QGZVFWFLSA-N 337.372 1.605 10 10 EDCE CCC(=O)NC[C@H](CC)NCc1nnnn1-c1ccc(OC)cc1 1732188653 LDGQCMRSDDXKHP-LBPRGKRZSA-N 332.408 1.065 10 10 EDCE CCN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)COC 1581118977 MUSZOGSVZSDTCM-UHFFFAOYSA-N 335.364 1.074 10 10 EDCE COc1ccc(-n2nnnc2CN(C)C[C@H](C)NC(=O)C2CC2)cc1 1669762445 HJFXAKIMQDDCIJ-LBPRGKRZSA-N 344.419 1.017 10 10 EDCE CCN1CCCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])CC1=O 1772926701 RDCBSNRSDOZTAI-VURMDHGXSA-N 347.371 1.840 10 10 EDCE CN(C)c1cccc(NS(=O)(=O)c2c[nH]c(=O)c(Cl)c2)c1 161398397 BUDQJVMPJIQDFX-UHFFFAOYSA-N 327.793 1.895 10 10 EDCE Nc1ccc(CCNC(=O)c2ccc(C(F)(F)F)[nH]c2=O)cc1 152511207 VIZAKSRTYXLFRJ-UHFFFAOYSA-N 325.290 1.948 10 10 EDCE COc1cc([C@@H](NCCN=[N+]=[N-])C(N)=O)ccc1Br 1876913427 PURZZTPDHHLQPR-SNVBAGLBSA-N 328.170 1.884 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H](NC(=O)COc2ccc(N)cc2)C1 1999146782 MTJGOILWMAIUCE-BETUJISGSA-N 335.404 1.820 10 10 EDCE CON(C)C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2009802707 RASOSOYQZVAUJW-NSHDSACASA-N 340.376 1.553 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010405843 MOPYNHVEXRZJLY-NWDGAFQWSA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)Nc2ccc(N)cc2)=C[C@H]1O 2022935888 RDZYYMYLIQLFIV-ZIAGYGMSSA-N 333.388 1.792 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H](C)CN3C[C@H](C)C[C@@H](C)C3)c2n1 2062005999 JBWDDTKXYPRILR-YRGRVCCFSA-N 345.447 1.840 10 10 EDCE OCCCN1CCN(c2ccc(CO)c(Br)c2)CC1 2113617324 YNKMOFUBDSXYBC-UHFFFAOYSA-N 329.238 1.446 10 10 EDCE COc1ccc(N2CCN(C)[C@@H](CO)C2)c(OC)c1Br 2234901677 INWRMWOSEWMIBV-SNVBAGLBSA-N 345.237 1.579 10 10 EDCE CC[C@@H](C)N1C(=O)C(=CNCCCN(CC)CC)C(=O)NC1=S 2296079768 WLJQFRZLBMPNMW-GFCCVEGCSA-N 340.493 1.234 10 10 EDCE COC(=O)C=Cc1ccc(N2CCO[C@H](CN(C)C)C2)c([N+](=O)[O-])c1 2297495624 ODPZMRXLVLUWMD-CQSZACIVSA-N 349.387 1.548 10 10 EDCE CSC1(C(=O)NCc2ccc(C)c(Br)c2O)CNC1 2352942738 JTYAUONOCBZMSG-UHFFFAOYSA-N 345.262 1.784 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CNC(=O)c1ccccn1 172499041 JIDNKQXXZKPTCO-UHFFFAOYSA-N 326.400 1.536 10 10 EDCE Cc1ccc(C)n1-c1ccc(CNC(=O)CN(C)S(C)(=O)=O)cc1 57250665 OSFFVUGWIIGNGE-UHFFFAOYSA-N 349.456 1.602 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@@H](N3CCOCC3)C2)cc1 173789435 WQIYYZFNAXUUTM-QGZVFWFLSA-N 332.448 1.369 10 10 EDCE COC(=O)c1cc(NC=C2C(=O)OC(C)(C)OC2=O)ccc1OC 118227156 HPRAJDXXAONQDT-UHFFFAOYSA-N 335.312 1.614 10 10 EDCE O=C(O)CC[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc[nH]2)SC1=S 27231389 MDPVHJGWDFPVIO-GTUWVTDSSA-N 340.382 1.534 10 10 EDCE CCOCCCN1CC[C@@H](NC(=O)c2cccc(O)c2O)[C@@H](C)C1 249122488 HVZDHMGMWABUSW-DZGCQCFKSA-N 336.432 1.965 10 10 EDCE COc1cc2c(c(OC)c1OC)C(=O)N(C)CCN2CCC(=O)O 527432261 XQFCAUSDGYQFNT-UHFFFAOYSA-N 338.360 1.079 10 10 EDCE O=C(NC[C@@H]1C[C@H](O)CN1Cc1ccccc1)c1cccc(O)c1O 248765181 RLOLTVJLLXPBOI-GJZGRUSLSA-N 342.395 1.463 10 10 EDCE Cc1ccc(CN2CCN3CCNC[C@@H]3C2)c(O)c1Br 2380653783 LEPFVNMIYPYDGO-CYBMUJFWSA-N 340.265 1.553 10 10 EDCE Cc1ccc(CN2C[C@@H]3COC[C@]3(CO)C2)c(O)c1Br 2380815314 POHWJUACQHCENE-IUODEOHRSA-N 342.233 1.904 10 10 EDCE CNC(=O)CN(C)c1ccc(/C=C\C(=O)O)cc1Br 381416985 HAWHVASZCDOTSF-XQRVVYSFSA-N 327.178 1.729 10 10 EDCE CN(C[C@H]1C[C@@H](O)C1)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 703793087 BINBDGPTCDVRPC-BFHDXFOESA-N 341.205 1.642 10 10 EDCE CC(=O)C(=O)COC(=O)c1nnn(-c2cccc3cnccc23)c1C 808517080 WRAVANAFHXADSR-UHFFFAOYSA-N 338.323 1.439 10 10 EDCE C[C@H](NC(=O)C(=O)NCC[C@H]1CCOC1)c1ccc(N(C)C)cc1 807325269 FEMOKIILJWQMJE-KBPBESRZSA-N 333.432 1.473 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CC(C)C 808513970 RALIFBYWVNIYPD-MRXNPFEDSA-N 345.395 1.687 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CCNC(=O)CC1 814824839 MVLAGLGLKVMJIY-MRXNPFEDSA-N 345.443 1.398 10 10 EDCE CN1NN=C2C1=NCC[C@@H]2C(=O)NCc1ccc(N2CCCC2)cc1 816866668 UTOSTOOOCARIMT-HNNXBMFYSA-N 340.431 1.127 10 10 EDCE CO[C@H](C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)[C@H]1CCOC1 823834321 ASJZRBCDAPGQHL-ZVZYQTTQSA-N 348.443 1.752 10 10 EDCE CNC(=O)N1CCN(c2ccc([C@@H](C)N)c(Br)c2)CC1 722153357 RGNZCRSDRADOOM-SNVBAGLBSA-N 341.253 1.930 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(CC(N)=O)CC2)c(Br)c1 723183238 SIWYRPORVVOKIQ-SNVBAGLBSA-N 341.253 1.076 10 10 EDCE Cc1cc(C(=O)N2CCN(C(=O)c3cccc(O)c3O)[C@H](C)C2)n[nH]1 837261787 DHXLEDZGUPLOIW-LLVKDONJSA-N 344.371 1.116 10 10 EDCE COC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1C(=O)C(=O)Nc1ccc(N)cc1 841114554 DERDAUMPDAKMSA-SWHYSGLUSA-N 331.372 1.007 10 10 EDCE CC[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)O 927942398 IAZRECMRZNQDLP-RYUDHWBXSA-N 335.404 1.157 10 10 EDCE COc1ccc(N2CC[C@@H](NCc3nnn(C(C)(C)C)n3)C2)cc1 850347580 UDLZZLFRWRTWPL-CYBMUJFWSA-N 330.436 1.805 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCCC1(CS(C)(=O)=O)CC1 854287383 YJPOYIKQOCSEQY-UHFFFAOYSA-N 340.445 1.749 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)Cn3cccn3)C2)cc1 851978620 NSGRILKFCFJBQS-CABCVRRESA-N 343.431 1.858 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)CC1CS(=O)(=O)C1 868110019 PZNIQVVRCBGDNQ-UHFFFAOYSA-N 325.430 1.956 10 10 EDCE COc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)nn1C 773853331 OWFQGMYGTVWLBK-LLVKDONJSA-N 345.403 1.311 10 10 EDCE CC(C)n1cnc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)c1 776433091 NGYMZFLBCLPYRO-UHFFFAOYSA-N 325.346 1.669 10 10 EDCE C[C@H](NS(=O)(=O)N1C[C@@H](C)O[C@H](C)C1)c1ccc(N(C)C)cc1 773086595 DXEGYVLACHPNHO-MCIONIFRSA-N 341.477 1.757 10 10 EDCE CNC(=O)C1(NCc2cc(Cl)cc(OC)c2O)CCOCC1 895884644 LZHSQPUNADGKKQ-UHFFFAOYSA-N 328.796 1.439 10 10 EDCE Cc1nc(CN2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)oc1C 1136615145 ZZZICRVZFSHWAF-UHFFFAOYSA-N 345.399 1.590 10 10 EDCE C[C@@H](O)C[C@H]1COCCN1c1ccc(CN)c(Br)c1 2128866373 QSLJYKDYEASTRH-MFKMUULPSA-N 329.238 1.884 10 10 EDCE Cc1nnc(CNC(=O)NCc2cc(Br)ccc2O)o1 1324682730 RABPGIJCWGXXCU-UHFFFAOYSA-N 341.165 1.846 10 10 EDCE CC1(C)CO[C@@H](CCNC(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1333041654 JSZFPZHQJVWPSP-ZDUSSCGKSA-N 332.400 1.556 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CC(=O)N(CC(F)(F)F)C1 1456235739 NMKAFEUPIXQGHD-QMMMGPOBSA-N 332.278 1.125 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)Cn2cncc2C)cc1C 1715938557 PEAAOMCRIFXSIC-CQSZACIVSA-N 330.432 1.803 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H]2C[C@@]23CCOC3)cc1C 1713652116 APEHBUXZOLSOLY-QFBILLFUSA-N 332.444 1.978 10 10 EDCE C[C@H](C(=O)NCc1ccc(O)cc1O)N1CSCCSC1 1557085261 GQPNZRPILVYPNY-SNVBAGLBSA-N 328.459 1.800 10 10 EDCE Cn1c2c(ccc1=O)[C@H](NC(=O)Cc1ccc(O)c(O)c1)CCC2 1639691960 YYPSTWMDEUESBY-CYBMUJFWSA-N 328.368 1.533 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@]2(C)CCC(=O)N2)cc1C 1568190734 OORHIKFWBKRPJW-YJYMSZOUSA-N 347.459 1.514 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)CCCF)cc(OC)n1 1735225866 NSEBRRVJVLZBJE-LLVKDONJSA-N 341.383 1.425 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C2CC3(CC3)C2)cc(OC)n1 1737584722 HVIHJXMSIRTWDU-LLVKDONJSA-N 347.415 1.524 10 10 EDCE Cc1ccc(O)c(CNC(=O)Cc2nc(C3CCOCC3)n[nH]2)c1 1584983698 RDBVEGCKMNDDHT-UHFFFAOYSA-N 330.388 1.572 10 10 EDCE C[C@H](NC(=O)Cc1ccc(S(N)(=O)=O)cc1)c1ccccc1O 1587451141 JANLQWWBXXLTRD-NSHDSACASA-N 334.397 1.460 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCc2ncnn2C1 161251190 QPFUIDXCWJGCJX-CQSZACIVSA-N 329.404 1.920 10 10 EDCE CCCOc1cccnc1NC(=O)c1nnn(-c2ccc(N)cc2)n1 1857878457 CIZFHGSPGPTGGV-UHFFFAOYSA-N 339.359 1.681 10 10 EDCE CCCN(CCC(=O)OCC)C(=O)c1nnn(-c2ccc(N)cc2)n1 1857879227 ZJUGIXGOUMANRZ-UHFFFAOYSA-N 346.391 1.050 10 10 EDCE C[C@H](ONC(=O)OC(C)(C)C)C(=O)NCCc1ccc(O)c(O)c1 2010132584 MWKDILNEVSEZLL-JTQLQIEISA-N 340.376 1.601 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)N2CCC(N=[N+]=[N-])CC2)C1 2010393605 UXZJPVLTGLDKBG-UHFFFAOYSA-N 339.396 1.517 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@H](CC(=O)N2CC(N=[N+]=[N-])C2)C1 2014405329 TXJBVQOLZGASEQ-JQWIXIFHSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)N2CC[C@H](N=[N+]=[N-])C2)=C[C@H]1O 2014504393 JFIGNDNGJRRSDC-QJPTWQEYSA-N 337.380 1.482 10 10 EDCE CCn1nnc(Br)c1[C@@H](O)[C@@H](NC)c1ccccc1O 2156519835 FYKPAMDTRQOSEL-JQWIXIFHSA-N 341.209 1.760 10 10 EDCE CN(CC1(C)COC1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 702975933 ADDBTPGUEPTCPA-GFCCVEGCSA-N 340.221 1.874 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)[C@@H](CO)C2)c(Br)c1 704796737 NFZWMRTXAGWJQT-ZMLRMANQSA-N 329.238 1.506 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC[C@@H](c4nccn4C)C3)c2n1 2062506553 MACMDKZJUCBFMT-LLVKDONJSA-N 326.360 1.107 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3CCCCC34OCCO4)c2n1 2062824352 JXCPIPAKIYTSCP-LBPRGKRZSA-N 332.360 1.159 10 10 EDCE COc1cccc(O)c1[C@@H](C)NC[C@@H]1CCN(S(C)(=O)=O)C1 2064102612 UEGRFRTWMROPFY-NEPJUHHUSA-N 328.434 1.333 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3C[C@@H]4OC(C)(C)O[C@@H]4C3)c2n1 2064444984 IKUFYARCWCNSMM-WLLOZRIZSA-N 332.360 1.156 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)c(Br)c1 2190454890 WBKOJJOQHYHSTD-PDRAWDMGSA-N 342.233 1.965 10 10 EDCE Cc1cc(Br)cc(CN2C[C@@H]3C[C@H]2CN3C(N)=O)c1O 2192234306 OTLTVYCOCCYFIC-RYUDHWBXSA-N 340.221 1.800 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2210540321 NFPJFZUZKGDHLD-WDEREUQCSA-N 327.385 1.875 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2102190068 RDRXOLSOWGROBM-PGOKHVGTSA-N 327.222 1.665 10 10 EDCE CN(C)[C@H]1CN(c2cc(Br)c(CN)cc2F)C[C@H]1O 2089923360 OGKKAFUEZNHPEX-QWHCGFSZSA-N 332.217 1.158 10 10 EDCE COc1ccc(Br)c(CN[C@H]2COC[C@@H]2N(C)C)c1O 2236029453 BDOXPEFQXHNBJZ-RYUDHWBXSA-N 345.237 1.582 10 10 EDCE O=C(O)CN(Cc1cc(Br)cc(F)c1O)[C@H]1CCOC1 2288224307 CIARJORNIVAXEA-JTQLQIEISA-N 348.168 1.969 10 10 EDCE COC[C@]1(CO)C=CCN1c1ccc(CO)c(Br)c1 2351777966 FCRJDEWQYHPEDI-CQSZACIVSA-N 328.206 1.695 10 10 EDCE Cc1ccc(CN2CC3(COC(=O)N3)C2)c(O)c1Br 2352655194 JWUGRTLZNWLPID-UHFFFAOYSA-N 327.178 1.757 10 10 EDCE Cc1ccc(CN2CCN(C)C[C@H]2CN)c(O)c1Br 2352933149 WTEBWJSTWLCYRM-GFCCVEGCSA-N 328.254 1.538 10 10 EDCE O=C(O)[C@@H]1CC[C@@H](c2cc(I)ccc2O)N1 309494977 KNIMVKOUFUYVBY-IUCAKERBSA-N 333.125 1.875 10 10 EDCE COc1ccc(CNCCNS(=O)(=O)c2cccs2)c(O)c1 122259024 CKZVJMTUYVLVFN-UHFFFAOYSA-N 342.442 1.530 10 10 EDCE CCNC(=O)N1CC[C@H](NC(=O)NCc2ccc(N(C)C)cc2C)C1 132663574 ZEHABCZXCOXSRB-HNNXBMFYSA-N 347.463 1.664 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C)CC3(CO)CC3)CC2)cc1 190037449 GWAUZBKIACRRMA-UHFFFAOYSA-N 347.459 1.048 10 10 EDCE CSc1ncc(CN[C@@](C)(C(=O)O)[C@H](C)S(C)(=O)=O)s1 2372948215 LHPQGXBYXXWLSO-WRWORJQWSA-N 338.476 1.231 10 10 EDCE COc1ccc(N2CCN(C(=O)Nc3ccnc(OC)n3)CC2)cc1 282565168 DWCNOOLAPBPSTM-UHFFFAOYSA-N 343.387 1.848 10 10 EDCE O=C(NCc1cc(Br)ccc1O)c1cc([N+](=O)[O-])n[nH]1 804738453 QIBCZEUIAPBFDP-UHFFFAOYSA-N 341.121 1.716 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H](C)SC)CC2)cc1 299298395 APPGMQFEQOCHCR-AWEZNQCLSA-N 337.489 1.685 10 10 EDCE C[C@@H]1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1C 293553380 ZIIYVABBUKTFCM-ZIAGYGMSSA-N 335.423 1.619 10 10 EDCE CCN1CC[C@H]2OCCN(Cc3ccc(N4CCOCC4)cc3)[C@H]2C1 816639380 PYMUZWLWMBHALS-VQTJNVASSA-N 345.487 1.818 10 10 EDCE Cn1ccnc1COCC(=O)NCc1c(O)ccc2c1CCCC2 816938773 JYMNEPNQNWSWBZ-UHFFFAOYSA-N 329.400 1.838 10 10 EDCE CON1CCC(CC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 823291348 FVCJIYPJFMCWED-UHFFFAOYSA-N 347.459 1.803 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N3CC(C)(CO)C3)C2)cc1 824681221 GTLAKDBMQGNHDS-AWEZNQCLSA-N 333.432 1.545 10 10 EDCE C[C@@H](NC(=O)CCOC1CNC1)c1ccc(N2CCOCC2)cc1 827725982 RAPYVDKNATVRSU-CQSZACIVSA-N 333.432 1.079 10 10 EDCE CO[C@H](C(=O)NCc1cccc(Br)c1O)[C@H]1CCOC1 834476116 NYFUFAMDWGARCC-GWCFXTLKSA-N 344.205 1.822 10 10 EDCE CCc1cccc(CN2CCN([C@H]3CCNC(=O)CC3)CC2)c1O 848915547 XIYFYLCRIJMRHX-QGZVFWFLSA-N 331.460 1.741 10 10 EDCE COCc1cc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)no1 855232214 RDAKQYQAGDQADB-LBPRGKRZSA-N 331.372 1.838 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC(=O)N(C)CC2)c([N+](=O)[O-])c1 853869405 SVMOAJZLYROTOG-XQRVVYSFSA-N 333.344 1.450 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3C[C@H]4CC[C@H]3NC4)C2)cc1 851639602 HXHKIFNEBLBVLY-KJWYOANISA-N 329.444 1.778 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1[C@H](C)NCc1ccc(N2CCC(O)CC2)cc1 850406639 NWYGEGMWTPGZJB-MORSLUCNSA-N 332.444 1.935 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc4n(n3)CCCO4)C2)cc1 855224244 JGSCAHHYCZLADR-ZDUSSCGKSA-N 342.399 1.683 10 10 EDCE CCn1ncnc1CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852296997 DDQPNCZYMMOLNM-ZDUSSCGKSA-N 344.419 1.385 10 10 EDCE O=C1N[C@H](CCF)C(=O)N1Cc1ccc(N2CCC(O)CC2)cc1 853089897 VJFBEHABVSKZLP-OAHLLOKOSA-N 335.379 1.428 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3ncccc3O)C2)cc1 852451147 FDJVALSIFDIYIR-ZDUSSCGKSA-N 342.399 1.874 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CC34CCNCC4)C2)cc1 852843565 BFNUXDXDAQSYJS-RHSMWYFYSA-N 329.444 1.780 10 10 EDCE C[C@@H]1O[C@H](C)[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H]1C 863001295 FXIHVIDLANEYJT-PUXPGTEJSA-N 342.417 1.305 10 10 EDCE CCOC(=O)c1cnc(NC(=O)N2Cc3cccc(O)c3C2)n1C 931344698 AHXCUTBXXOZDBB-UHFFFAOYSA-N 330.344 1.850 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCCCS1(=O)=O 862027606 YPWHEPZTPYMDAA-ZDUSSCGKSA-N 334.397 1.524 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1(C)C 873463558 ICVIAOBKKBPEQJ-PWSUYJOCSA-N 327.377 1.627 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@H]2[C@H]3CC[C@]4(COC(=O)[C@H]24)O3)cc1F 1125535199 SFSXXRPPPHGUDY-ZXFNITATSA-N 348.374 1.229 10 10 EDCE COC[C@H](O)CCNCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894369424 UUWRFENWGQWJPV-GFCCVEGCSA-N 338.379 1.591 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@@H](CO)C2)cc1Br 396880380 OQALCXTUYCLPFZ-IUODEOHRSA-N 343.265 1.738 10 10 EDCE Nc1ccc(CS(=O)(=O)NC[C@H]2CCN2Cc2ccccc2)cc1 716262976 RGJCAGDOVHBJHV-GOSISDBHSA-N 345.468 1.963 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](NC(N)=O)C2)cc1Br 690738159 NEZFMODVBQFJAG-DTWKUNHWSA-N 328.210 1.749 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1CCNC[C@@H]1C(N)=O 88659037 OMTZQGQWVTUQEY-VXGBXAGGSA-N 342.237 1.365 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)cc1Br 2126160790 CSZXIXDJKICSJB-RDBQEKCUSA-N 327.222 1.086 10 10 EDCE O=C1N[C@@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@H]2O1 2120406605 RTJULZHMGGQFOT-NXEZZACHSA-N 331.141 1.586 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3nc[nH]n3)CCC2)cc1C 1326903713 TVLKKJDUIFTNPR-UHFFFAOYSA-N 329.404 1.564 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@H]2[C@H](O)CO)c(Br)c1 2123209258 HCKUAYORHSPPIJ-QCZZGDTMSA-N 329.238 1.791 10 10 EDCE Cc1cc(C(=O)N2[C@H](CO)CC[C@H]2CO)c(C)n1-c1ccccn1 1299977413 SDAXYEZBWQDXGV-GJZGRUSLSA-N 329.400 1.447 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nc2ncc(C)cn2n1 1297562333 HRVJNPDVYGJUCS-UHFFFAOYSA-N 332.360 1.554 10 10 EDCE C=C/C(C)=C/CC(=O)NC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1526885239 CTAOOUBFLRFFFK-WHGQRRHOSA-N 347.415 1.856 10 10 EDCE C[C@@H](NC(=O)C[C@H]1CCC(=O)NC1)c1ccc(N2CCOCC2)cc1 1542403347 SRRWQLNGYSRGMI-HUUCEWRRSA-N 345.443 1.617 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnc2c(c1)nnn2C 1556515650 HEDIBSAEKKEFDA-UHFFFAOYSA-N 332.360 1.485 10 10 EDCE CN(CCNC(=O)[C@H]1CCCO1)C(=O)c1ccc(N=NC(N)=O)cc1 1495831993 LYKFDMUJSPZHCA-CYBMUJFWSA-N 347.375 1.216 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2nonc2C)cc1C 1497766936 UQDDBAPERNMERY-PLNGDYQASA-N 330.388 1.771 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cncnc3)CC2)cc1C 1569396758 PQMLRODOJDBUDG-UHFFFAOYSA-N 326.400 1.846 10 10 EDCE COc1cc(C(=O)N[C@H](C)CCNC(=O)c2ccco2)cc(OC)n1 1737647681 TTWHQZJDWOAAMC-LLVKDONJSA-N 347.371 1.630 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)Cn2ccnc2)cc1C 1734007112 RZMVTFMEISSFBQ-LSDHHAIUSA-N 330.432 1.883 10 10 EDCE O=C(Cn1cc(C(F)(F)F)ccc1=O)NCc1ccc(O)cc1O 1570462363 QLNKXVIVQBFXLW-UHFFFAOYSA-N 342.273 1.595 10 10 EDCE Cc1cccnc1[C@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1647937764 RVQCMXUGZHFAER-NSHDSACASA-N 349.412 1.958 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)Cc2ccoc2)cc(OC)n1 1688135283 AHXKCVUBSWQPQK-LLVKDONJSA-N 347.371 1.169 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C23CCN(CC2)C3)cc1C 1774044521 JKSWDZSXLPQNIE-HNNXBMFYSA-N 331.460 1.694 10 10 EDCE CNCc1ccc(N2CCN3C(=O)CC[C@H]3C2)cc1Br 234429792 RTCXVUZDRULAHP-ZDUSSCGKSA-N 338.249 1.980 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]1(CNC(=O)OC(C)(C)C)CCCO1 1985099664 AIXHBPSRJYJRHB-CQSZACIVSA-N 327.385 1.829 10 10 EDCE C[C@@H](NC[C@@H](CO)NC(=O)OC(C)(C)C)c1c(O)cccc1O 1985853818 DWEBLAZWBZGUPH-MNOVXSKESA-N 326.393 1.634 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C1(CNC(=O)OC(C)(C)C)COC1 1987700052 XYFRWJIYFNHFHG-UHFFFAOYSA-N 327.385 1.687 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCO1 1990349013 XSRMXWZMFSYTQT-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE Cn1cc(C(=O)NCCc2ccc(O)c(O)c2)nc1Br 2147997328 AIAHWKMEZXQRPS-UHFFFAOYSA-N 340.177 1.566 10 10 EDCE CNCc1ccc(N2CCOC[C@@H]2CN(C)C)cc1Br 2153245667 WLXJJSIOVNJISR-AWEZNQCLSA-N 342.281 1.935 10 10 EDCE [N-]=[N+]=NCCN[C@]1(C(=O)O)CN(Cc2ccccc2)[C@@]2(CCOC2)C1 2038666307 PUUYEFRVIMJTIE-IRXDYDNUSA-N 345.403 1.775 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNCc2cccc(F)c2O)C1 702811429 RCZJBBFULXAYNR-GXTWGEPZSA-N 340.395 1.849 10 10 EDCE C[C@@H](N)c1ccc(N2CC(N(C)C3COC3)C2)c(Br)c1 2173101414 OJMJAATUHQYNIC-SNVBAGLBSA-N 340.265 1.988 10 10 EDCE Nc1ccc(OCC(=O)NCc2n[nH]cc2Br)cc1 718123865 FJNYEBBCKHIIOY-UHFFFAOYSA-N 325.166 1.450 10 10 EDCE COc1ccc(N2CC[C@@H](N)[C@@H](CO)C2)c(OC)c1Br 2178907261 OZQPASHLZHIRIV-NXEZZACHSA-N 345.237 1.612 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@@H](N)C(N)=O 2044377257 DIOYVZAZMDSLJU-CQSZACIVSA-N 348.447 1.277 10 10 EDCE Nc1cc2c(cc1N1C[C@H]3C[C@H]1CN3C(=O)C(F)(F)F)OCCO2 2044725563 PAQXRVBSBAQOCG-DTWKUNHWSA-N 343.305 1.392 10 10 EDCE N[C@H]1CC(C(=O)N2CCCc3ccc(Br)cc32)=C[C@H]1O 2188018576 DSOHFDOACWWQRE-GXTWGEPZSA-N 337.217 1.747 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H]3COC[C@@H]32)cc1Br 2102194492 YCRCVZPOACPPDE-KNEYZDPSSA-N 327.222 1.665 10 10 EDCE CC(C)NC(=O)NCCNCc1cccc(Br)c1O 2092423023 SGQLJDOUKYHGNP-UHFFFAOYSA-N 330.226 1.952 10 10 EDCE NCc1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)cc1Br 2093495143 FLZIMPCJTYRYBK-VXGBXAGGSA-N 329.238 1.335 10 10 EDCE C[C@@H](O)c1ccc(N(C)[C@H]2CC(=O)NC2=O)cc1Br 2114727956 UOBFVZQGMGIREQ-HQJQHLMTSA-N 327.178 1.354 10 10 EDCE CCn1nnnc1CNCc1c(Br)ccc(OC)c1O 2236054714 LXSDWYJCAFUEON-UHFFFAOYSA-N 342.197 1.460 10 10 EDCE COc1ccc(N(CCO)C[C@@H](C)O)c(OC)c1Br 2226547019 LUYSWJKTWKMEGC-SECBINFHSA-N 334.210 1.646 10 10 EDCE OCc1ccc(N2C[C@H]3OC[C@H](CO)[C@H]3C2)c(Br)c1 2330879848 QACIMTBRRUHZEC-MISXGVKJSA-N 328.206 1.385 10 10 EDCE Cc1cccc(N2C(=O)/C(=C/NC[C@@H]3CCCO3)C(=O)NC2=S)c1 103843208 HJIQVVQRSWLPON-LFGHMXSPSA-N 345.424 1.395 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCO[C@H](Cn3cccn3)C2)cc1 111425993 FPTKFTDFHWXZOO-KRWDZBQOSA-N 343.431 1.560 10 10 EDCE CN1[C@H]2CC[C@H]1CN(c1cc3c(cc1[N+](=O)[O-])OCC(=O)N3)CC2 301685070 LBRRWESGNBYXLT-QWRGUYRKSA-N 332.360 1.599 10 10 EDCE CN(C)c1ccc(CN2CCN(c3ccc4nncn4n3)CC2)cc1 120463591 STMCFZIFKICCCG-UHFFFAOYSA-N 337.431 1.513 10 10 EDCE C[C@@]1(C(=O)O)CCN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 191041372 YHQBLHNVUWKBDC-ZLHKHBAESA-N 344.411 1.860 10 10 EDCE Cc1cc(CS(=O)(=O)NCc2ccc3c(c2)CCCN3C)no1 265312462 JCOOSKZFVGORIQ-UHFFFAOYSA-N 335.429 1.985 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2C[C@@H](O)CN2)c(O)c1Br 2380760755 AGYYPLCMIPIBSD-MNOVXSKESA-N 343.221 1.144 10 10 EDCE CSCCCCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662835 HKTNEFAWOKWPOQ-UHFFFAOYSA-N 341.452 1.767 10 10 EDCE C[C@H](NC(=O)NC1COCCOC1)c1ccc(N2CCOCC2)cc1 813606344 PPOUWOQWTGENMG-AWEZNQCLSA-N 349.431 1.299 10 10 EDCE CCC[C@@H](C(=O)OCC)S(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1 821199137 UGZZCMIBKBDBML-LBPRGKRZSA-N 346.361 1.774 10 10 EDCE COc1cc(Br)cc([C@@H]2CS(=O)(=O)CCN2)c1O 1952838899 PTIGTQXFCXMRIL-VIFPVBQESA-N 336.207 1.222 10 10 EDCE CC(C)NS(=O)(=O)c1c[nH]c(C(=O)NCc2ccc(N)cc2)c1 837303205 YORGOSSZORSWDW-UHFFFAOYSA-N 336.417 1.214 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)CC2(O)CCOCC2)cc1 911894263 XHFLQQJXJACMMP-UHFFFAOYSA-N 336.432 1.521 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNCC(C)(C)[C@@]2(O)CCOC2)c1O 843428969 RHXQLSOQZCYFQS-MRXNPFEDSA-N 340.376 1.576 10 10 EDCE COC(=O)[C@H]1CCCC[C@@H]1S(=O)(=O)NCc1c(O)cccc1F 921452677 WGLBZWFZDYUTQE-HZMBPMFUSA-N 345.392 1.683 10 10 EDCE O=C(C=C1CCNCC1)NCc1ccc(N2CCC(O)CC2)cc1 852916515 LECBCPLGOJOBOS-UHFFFAOYSA-N 329.444 1.574 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3(CC(N)=O)CC3)C2)cc1 852385473 OSUVNIKTNQFGCA-CYBMUJFWSA-N 346.431 1.229 10 10 EDCE CN1CC(=O)N(CCN(Cc2ccccc2O)C[C@@H]2CCCO2)C1=O 851840341 DBHYCRWRSCANLW-HNNXBMFYSA-N 347.415 1.267 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2C[C@H](C(N)=O)C2)cc1 858769772 GNROXBPPIPHQEK-JOCQHMNTSA-N 334.420 1.037 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCn4cncc4C3)C2)cc1 855224642 GRTZOCFWXKNBMD-LSDHHAIUSA-N 340.427 1.849 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](O)C3CCOCC3)C2)cc1 855230708 IHAHFOSDHDBNNH-RHSMWYFYSA-N 334.416 1.178 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)C[S@@](C)=O)C2)cc1 852250355 GZVJVNMJTONUAY-VQNPYFGKSA-N 339.461 1.340 10 10 EDCE COC(=O)c1nccnc1N[C@H]1CCN(c2ccc(OC)cc2)C1 853760008 GSGQDZAHARAHRO-LBPRGKRZSA-N 328.372 1.963 10 10 EDCE O=C(CN1CCCCC(=O)C1=O)NCc1ccc(N2CCCC2)cc1 864863949 SHNAOPMYMVHMRR-UHFFFAOYSA-N 343.427 1.485 10 10 EDCE CC(C)C[C@@H]1C(=O)NCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1138353618 VSEYTHKGTXDTAV-CYBMUJFWSA-N 331.376 1.836 10 10 EDCE CNC(=O)NCCC(=O)Nc1c(-c2ccccn2)nc2ccccn12 1160563790 UEXUDHGHVCHICS-UHFFFAOYSA-N 338.371 1.654 10 10 EDCE CCOC(=O)c1cc2n(n1)C[C@H](C)N(C(=O)c1cccc(O)c1O)C2 1178168670 CXCWRMSOSNYLNI-JTQLQIEISA-N 345.355 1.516 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2COCCO2)cc1C 1322420617 OYYIMRISHLPFHM-KRWDZBQOSA-N 336.432 1.357 10 10 EDCE O=C(C(=O)N1CCC[C@@]2(C1)CC2(F)F)N1Cc2cccc(O)c2C1 1329435759 ICLYQZABFGIQMC-INIZCTEOSA-N 336.338 1.882 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H](C2CC2)O1 1335602131 KHNXTWIOWDRYQR-BDJLRTHQSA-N 330.384 1.260 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H](O)C2(C)C)cc1Br 2124803263 UQYPIBXBGAZKHV-OXHMUOHRSA-N 330.222 1.823 10 10 EDCE O=C(NCCn1cc([N+](=O)[O-])cn1)c1cc2cc(O)c(O)cc2s1 1294741873 ORHAZVCTULKIMP-UHFFFAOYSA-N 348.340 1.847 10 10 EDCE CN(C)C(=O)/C=C\C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1456937205 VBNDHNVMPBAYRN-JNSOCZORSA-N 332.448 1.116 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)c2ccccc2)cc(OC)n1 1295408655 LXBQNVRGJGVHCR-LBPRGKRZSA-N 343.383 1.647 10 10 EDCE O=C(NCc1ccnc(-n2cncn2)c1)c1c(F)ccc(O)c1O 1472610177 VCLSAYITUCFXFT-UHFFFAOYSA-N 329.291 1.143 10 10 EDCE OCc1ccc(N2CC[C@]3(C[C@H](O)CO3)C2)cc1Br 2137136435 VMJRWUGVVQYQTI-JSGCOSHPSA-N 328.206 1.672 10 10 EDCE CN(C)c1nc(CCNC(=O)/C=C\c2ccc(O)c(O)c2)cs1 1546251252 KBLINNGEYKAJLB-XQRVVYSFSA-N 333.413 1.992 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cc(C(F)(F)F)ncn1 1622753459 XGRYKNAOSURLCH-UHFFFAOYSA-N 327.262 1.879 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCCn4ncnc43)CC2)cc1 1635783632 DXEOMPCTQFSUHE-INIZCTEOSA-N 341.415 1.513 10 10 EDCE CC[C@H](CNC(=O)C1CC(C)C1)NC(=O)c1cc(OC)nc(OC)c1 1721460684 ZWALBFLEPLICJI-ORHYLEIMSA-N 349.431 1.770 10 10 EDCE CC(=O)C(=O)[C@@H](O)c1ncc(Br)cc1Br 1929216426 DWHYBEHUPZPGSI-VIFPVBQESA-N 336.967 1.798 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CCN(c2ccc(F)cc2)C1=O 1593873752 ZJRRZVTUJLYDMC-OAHLLOKOSA-N 344.342 1.906 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2cn(C)nn2)cc1C 1674660283 FULNVKGWZMBXDI-QWHCGFSZSA-N 331.420 1.429 10 10 EDCE CNCc1ccc(N2CCC[C@H]2C(=O)NC)c(Br)c1 234444577 WWENTWXRNCHALO-ZDUSSCGKSA-N 326.238 1.883 10 10 EDCE CC(=O)C(=O)[C@@]1(O)CN(C(=O)OC(C)(C)C)[C@]2(CCCOC2)C1 1939683462 HESBWLBTXMFRIK-CVEARBPZSA-N 327.377 1.066 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H](N)C(C)(C)O 1951698124 OYJHQHGOTJFOMD-SMDDNHRTSA-N 340.420 1.632 10 10 EDCE CC1(C)CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)[C@@H]1CO 2148967175 ZVHPLRMTADTQHK-VXGBXAGGSA-N 340.221 1.608 10 10 EDCE CC(C)(C)OC(=O)N[C@@]12C[C@H]1CN(C(=O)c1ccc(O)c(O)c1)C2 2006285555 YKIWXNMBFKRHPC-APPDUMDISA-N 334.372 1.837 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C1)CS(=O)(=O)CCN2CCN=[N+]=[N-] 1986190075 VBZGFYLDOIVYRY-UHFFFAOYSA-N 345.425 1.017 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010404964 WBAWYSUINSHBQC-SRVKXCTJSA-N 341.412 1.809 10 10 EDCE NCc1ccc(N2CCN3C[C@H](O)C[C@@H]3C2)c(Br)c1 405273284 SWVKEMVCRZVUEC-VXGBXAGGSA-N 326.238 1.163 10 10 EDCE CN(c1cc(Br)c(CN)cc1F)C1CC(C(N)=O)C1 703529347 VAUAVBNNKMHRAA-UHFFFAOYSA-N 330.201 1.747 10 10 EDCE CN1CCO[C@H]2CCN(c3ccc(CO)c(Br)c3)C[C@@H]21 2185530521 UTSHGMWPKOYSDV-GJZGRUSLSA-N 341.249 1.851 10 10 EDCE COC1(C(N)=O)CN(c2ccc([C@@H](C)N)c(Br)c2)C1 2104899970 HISZFLKJLJFXGM-MRVPVSSYSA-N 328.210 1.159 10 10 EDCE C[C@H](O)c1ccc(N2CC(=O)N[C@@H]3CC[C@H]32)c(Br)c1 2112061627 MKSBVZIASRNGMW-RLCGTCKNSA-N 325.206 1.970 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])C[C@H](O)C1 2213587625 JSVWLSSTQBRDNY-CZFOOCMKSA-N 339.396 1.752 10 10 EDCE C[C@@H](COc1nnc(=N)[nH]n1)[C@H]1CCCCN1C(=O)OC(C)(C)C 2213789476 ITCBACPJYGEYGL-WDEREUQCSA-N 338.412 1.484 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](CCOc2nnc(=N)[nH]n2)C(C)(C)C1 2216461118 DTAVBYSOOBQQRA-SNVBAGLBSA-N 338.412 1.341 10 10 EDCE CCOCCCNC=C1C(=O)NC(=O)N(Cc2ccccc2)C1=O 2296943042 ICLZPGFGEAPWTB-UHFFFAOYSA-N 331.372 1.165 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CC[C@@]1(COc1nnc(=N)[nH]n1)C2 2298033833 YWHCVVCOVMLLBL-WMFXKJRFSA-N 336.396 1.141 10 10 EDCE CCN(CC)c1ccc([C@@H]2NC(=O)Nc3c2c(=O)[nH]c(=O)n3C)cc1 103450998 NLTCVVKLJZYIKT-ZDUSSCGKSA-N 343.387 1.144 10 10 EDCE C[C@H]1CN(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)C[C@@H](C)O1 69649730 JXOCCQDTIQLRLI-TXEJJXNPSA-N 345.440 1.335 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1cc(C)ccc1O)c1ccc(N)cc1 170318552 FQTMMRBQGATJLJ-UHFFFAOYSA-N 327.340 1.801 10 10 EDCE CCOc1ccc(O)c(CN2CCN([C@@H](C)C(=O)NC3CC3)CC2)c1 123357124 IBHQKNUEXBKXFG-AWEZNQCLSA-N 347.459 1.576 10 10 EDCE C[C@H]1CN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)CCO1 180766344 ROEQAOOJNSNYLJ-KQIUPUNMSA-N 346.427 1.823 10 10 EDCE O=C(NC[C@H]1COc2ccccc2O1)Nc1cc(O)c(O)c(O)c1 217278941 ZXXAFERZYYGPGW-JTQLQIEISA-N 332.312 1.765 10 10 EDCE COc1ccc(N2CCN(C(=O)COC3CCNCC3)CC2)cc1 324883167 DVVNUCFTVCDNHW-UHFFFAOYSA-N 333.432 1.112 10 10 EDCE Cn1cc(/C=C\C(=O)N2CCc3c(Cl)cccc32)c(=O)n(C)c1=O 255331781 LGPIRTIYSKZVRK-SREVYHEPSA-N 345.786 1.340 10 10 EDCE Cc1ccc(CN2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)c(O)c1Br 2380815528 QHZJQJXHSUVLAV-JLUCKKNBSA-N 342.233 1.637 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1[C@H](C)OC(C)(C)N1C(=O)OC(C)(C)C 808539265 YKTCZZXNVOPXKC-JQWIXIFHSA-N 343.376 1.448 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@H](NC(C)=O)C2)c([N+](=O)[O-])c1 817126442 UYZMHSBKIJFIRW-BPJJOFIESA-N 333.344 1.496 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCC3(CC2)NC(=O)NC3=O)cc1 835044518 KZSGNFUHSSBEBN-ONEGZZNKSA-N 328.416 1.440 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1c2c(nn1C)CCSC2 907275599 WNTGCMSDKCIJRW-JTQLQIEISA-N 347.440 1.982 10 10 EDCE Nc1ccc(NC(=O)C(=O)N[C@@H](C[C@@H]2CCCO2)C(F)(F)F)cc1 848602552 GSBNUERWNKPCCO-RYUDHWBXSA-N 345.321 1.824 10 10 EDCE Nc1ccc(NC(=O)NC[C@@]2(O)[C@@H]3[C@@H]4[C@H]5[C@H]6C[C@@H]4[C@H]2[C@@H]6C[C@H]53)cc1 841297339 OVZZSWKCNIASLI-KTWJRXLUSA-N 325.412 1.899 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2)cc1 841846696 SKSHLRJAGSVMCW-DDBAPUKQSA-N 330.476 1.789 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCn2nncc2C1 847288135 VIZDCUSGEBLGQK-UHFFFAOYSA-N 326.404 1.604 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCC[C@@]1(O)CCOC1 845263197 ZCCUXDPVFCVQFM-HNAYVOBHSA-N 349.475 1.833 10 10 EDCE COc1ccc(CNC[C@H](O)c2ccnn2C)cc1Cn1cccn1 922970459 OOLWRPUNXNKCPB-KRWDZBQOSA-N 341.415 1.497 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3CN(C4CC4)C(=O)O3)CC2)cc1F 844304397 COGWLOFETMRUDI-OAHLLOKOSA-N 349.406 1.940 10 10 EDCE COC[C@@H]1CN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCO1 852452609 BPJSAYCEJGPNLN-YOEHRIQHSA-N 349.431 1.331 10 10 EDCE C[C@H]1COCC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856213338 ICZINIJBFUZWJO-KBXCAEBGSA-N 332.444 1.937 10 10 EDCE COc1ccc(N2CCCN(C(=O)N[C@]3(C)CCOC3=O)CC2)cc1 1352137954 DNNVREVDBLXTOZ-GOSISDBHSA-N 347.415 1.623 10 10 EDCE NC(=O)c1cncc(NCc2ccc(N3CCC(O)CC3)cc2)n1 853956436 VZFJUDZDWLHEAA-UHFFFAOYSA-N 327.388 1.149 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@]1(C)CCCO1 756540902 AJLMFVDNRXOTIR-GOSISDBHSA-N 334.416 1.823 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2c(O)ccc3ccncc23)C1 863339887 GMSIIASNBBJFQD-ZDUSSCGKSA-N 349.456 1.702 10 10 EDCE C[C@@H](NC(=O)N1CCN2CCOC[C@H]2C1)c1ccc(N(C)C)cc1 776244164 FKWVWIBSJWYOPS-RHSMWYFYSA-N 332.448 1.540 10 10 EDCE COc1ccc(N2CCN(C(=O)Nc3cc(OC)n(C)n3)CC2)cc1 775921720 OVSZCDLHWCIVLV-UHFFFAOYSA-N 345.403 1.791 10 10 EDCE O=C(NCCn1ccnc1)NCc1cc(Br)ccc1O 794805076 RCEOHDALOKQGRR-UHFFFAOYSA-N 339.193 1.851 10 10 EDCE CN[C@@H](C)c1ccc(N(C)Cc2nnnn2C)cc1Br 707671629 MMOHDEOQHMIRAO-VIFPVBQESA-N 339.241 1.889 10 10 EDCE C[C@@]1(C(=O)O)CN(Cc2ccc(Br)cc2O)CCO1 711510886 SZVMCIIFAJUQJL-ZDUSSCGKSA-N 330.178 1.830 10 10 EDCE CCc1ccc(C(=O)NCc2c(O)cccc2O)cc1S(C)(=O)=O 1156880831 CTOJHRNSCOYUHV-UHFFFAOYSA-N 349.408 1.994 10 10 EDCE COc1ccc(N/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1 1084392966 VYVSBFTUBZVMQV-NTEUORMPSA-N 341.323 1.863 10 10 EDCE CCc1nc([C@@H]2C[C@@H](O)CN2C(=O)c2ccc(C)c(O)c2O)n[nH]1 1305718743 MZLMCCMOEOMELB-KOLCDFICSA-N 332.360 1.035 10 10 EDCE CN1CCN(c2ccc(CNC(=O)C3=C[S@](=O)CCC3)cc2)CC1 1153443639 NBRIOFCHCGJSCC-XMMPIXPASA-N 347.484 1.481 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3NC(=O)O[C@@H]3C2)cc1Br 2120414659 CJQGGSAWZONQOH-VSYUYLJXSA-N 327.178 1.799 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CC[C@@H](C3CC3)O2)cc1 1333758650 LUPWIMNAUJHCGF-IRXDYDNUSA-N 345.443 1.443 10 10 EDCE COC[C@@H](C)N[C@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1266192054 PUJVYYPGXCKODV-VXGBXAGGSA-N 335.408 1.982 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)c2c[nH]c(=O)cn2)cc1C 1275472484 XCOWFVKBTXDRBZ-CHWSQXEVSA-N 344.415 1.384 10 10 EDCE Cc1cc(C(=O)NCc2c(O)cccc2O)ccc1-n1cnnn1 1472063500 LHQNXQSVEMVSIF-UHFFFAOYSA-N 325.328 1.312 10 10 EDCE CNC(=O)CC1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1621715254 MQIWCRTUBOEMEF-UHFFFAOYSA-N 331.376 1.837 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cccc(C)n2)cc1C 1715574197 GJBYBHRRJKJZGF-INIZCTEOSA-N 343.427 1.588 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1CN(C)CCO1 1497367887 UOHVUJVGPDJNCZ-SFHVURJKSA-N 349.475 1.272 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CC[C@@H](Nc2ncccn2)C1 1639943423 QHYANTYIPKRRPK-MASHWEEQSA-N 326.356 1.614 10 10 EDCE O=C(N[C@H]1CCS(=O)(=O)C1)c1cc2cc(O)c(O)cc2s1 1588125237 XRGBEGJTTVGIRO-QMMMGPOBSA-N 327.383 1.229 10 10 EDCE Cn1c(=O)n(CCC(=O)NCc2c(O)cccc2O)c2ccccc21 1652623179 PPORRQXEZDHDQN-UHFFFAOYSA-N 341.367 1.458 10 10 EDCE CC1=NNC(=O)[C@@H]1CCNC(=O)c1cc(C)n(-c2ccccn2)c1C 1585158237 QZDCNZOPHOPSTI-CQSZACIVSA-N 339.399 1.731 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)CC1CCOCC1 1691002904 XGKIVFYDADOURZ-UHFFFAOYSA-N 347.419 1.937 10 10 EDCE CN(C)C[C@H]1COC[C@@H]1NCc1c(O)cccc1Br 2141464610 KRODOBZNEDFSTM-GWCFXTLKSA-N 329.238 1.821 10 10 EDCE CCOC(=O)N1CCN(C(=O)CNCc2ccc(N(C)C)cc2)CC1 1857865526 RHJVWKKUCVRICS-UHFFFAOYSA-N 348.447 1.143 10 10 EDCE C[C@@H](NCCn1cc(Br)nn1)c1cc(O)ccc1O 1878206868 HPYJBXWIYZCXOE-MRVPVSSYSA-N 327.182 1.803 10 10 EDCE COC[C@@H](CCO)NCc1c(Br)ccc(OC)c1O 1964049409 UJDWZKOWLQOONE-SECBINFHSA-N 334.210 1.650 10 10 EDCE COC(=O)[C@H]1CCC[C@@H]1NCc1ccc(N2CCN(C)CC2)cc1 1320707765 GCOTXKUWEOYUCC-ROUUACIJSA-N 331.460 1.870 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC([C@H]2CCOC2)C1 1325139472 HMWUACKDUFHBID-HNNXBMFYSA-N 345.443 1.206 10 10 EDCE CC(C)(C)OC(=O)NCCOCCNC(=O)c1ccc(O)c(O)c1 2006284588 PBSFDAUIECZRQR-UHFFFAOYSA-N 340.376 1.369 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2NC(=O)Cc1ccc(N)cc1 1999123363 ZZMGXCLNKADCRD-INWMFGNUSA-N 331.416 1.935 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)CNCc1ccc2c(c1)CCCO2 2011519519 JFJPQCSNULZVDX-HNNXBMFYSA-N 336.432 1.987 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]1(NC(=O)OC(C)(C)C)C[C@H](O)C1(C)C 2018046495 AQDNSZXWYNTHFX-ZUZCIYMTSA-N 341.412 1.809 10 10 EDCE C[C@@H]1C[C@H](O)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 705142672 ULSTUDONQMROKB-RBDZCENOSA-N 341.205 1.784 10 10 EDCE O=C(NCc1sncc1Br)c1cc(O)nc(O)c1 722765080 HJUYNYBUFODSLW-UHFFFAOYSA-N 330.163 1.642 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)c(Br)c1 2178087517 RMTNZZXWORIHPG-ZFVXVEAMSA-N 342.233 1.946 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)cc1Br 2102194493 YCRCVZPOACPPDE-LDZXTUBUSA-N 327.222 1.665 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213589360 VZYSBULYVRQLCD-LPEHRKFASA-N 340.384 1.103 10 10 EDCE O=C(O)CN(Cc1ccc(Br)cc1O)[C@H]1CCOC1 2272419895 YEZUSKQNVOYXFB-NSHDSACASA-N 330.178 1.830 10 10 EDCE COc1ccc(Br)c(CNC[C@H](O)c2cnc[nH]2)c1O 2236056172 UOMMKCLGYRTLMI-NSHDSACASA-N 342.193 1.710 10 10 EDCE O=C(O)[C@@H]1CC[C@H](O)CN1Cc1cc(Br)cc(F)c1O 2279185456 DQZWDVHJXTZVDO-ONGXEEELSA-N 348.168 1.704 10 10 EDCE Cn1cc(/C=C\C(=O)N2CCCc3cc(F)ccc32)c(=O)n(C)c1=O 491213644 ZDUWRMGJIWCYMJ-YVMONPNESA-N 343.358 1.216 10 10 EDCE CN1C(=O)NC(=O)/C(=C/c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1=O 59498881 TYBVNTWZFAQGGD-FLIBITNWSA-N 344.327 1.287 10 10 EDCE COC(=O)NCC1CN(c2ccc(CO)c(Br)c2)C1 2130748426 XJPMWISMBTUFBE-UHFFFAOYSA-N 329.194 1.734 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)N3CCOC[C@H]3C(N)=O)c2C)c1 91785963 GZVZISAIVGMTNB-KRWDZBQOSA-N 341.411 1.729 10 10 EDCE CCCCS(=O)(=O)N1CCN(c2ccc3c(c2)OCO3)CC1 243072648 IMASAFGQHCFNRS-UHFFFAOYSA-N 326.418 1.667 10 10 EDCE C[C@@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)c1ncon1 254970727 RCQOKQGIMYUWSC-LLPBQKLSSA-N 328.372 1.797 10 10 EDCE CC[S@@](=O)c1ccccc1C(=O)N1CCS(=O)(=O)[C@H](C)C1 265663376 FHTIZKWCWSHKHE-BIBXISHDSA-N 329.443 1.073 10 10 EDCE COc1cccc(N2C[C@H](NC(=O)Cc3ccc(N)cc3)CC2=O)c1 364237435 NUCIGYOTTFEOEC-OAHLLOKOSA-N 339.395 1.742 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CC2(CCOCC2)C1 366132441 FUKNJWGIXXFEON-UHFFFAOYSA-N 345.443 1.845 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(=O)N(CC3CC3)C2)c([N+](=O)[O-])c1 279091559 NKVVSQNEJPQLDC-FNORWQNLSA-N 345.355 1.797 10 10 EDCE CCn1nnc(C)c1C(=O)N1CCN(c2ccc(OC)cc2)CC1 294412321 QDVWIZJQEVTNOU-UHFFFAOYSA-N 329.404 1.577 10 10 EDCE Fc1cc(CN2CC[C@H](Cn3ccnn3)C2)ccc1N1CCOCC1 826846677 XKAVXEHGZKJSOJ-INIZCTEOSA-N 345.422 1.776 10 10 EDCE COCCN1[C@H](C)CN(C(=O)/C=C\c2ccc(O)c(O)c2)C[C@H]1C 588408557 BJQPOOMQPXHRLF-KMVAXQJASA-N 334.416 1.679 10 10 EDCE Cn1cc(N2CCC[C@H](NC(=O)/C=C\c3ccc(O)c(O)c3)C2)cn1 588406642 VSYGIYIHNCJDIF-VSKVDJIOSA-N 342.399 1.630 10 10 EDCE Cc1cc(C(=O)N2CCN(C3CC3)C(=O)C2)c(C)n1-c1ccccn1 748505118 XRXHQSQJZVARRM-UHFFFAOYSA-N 338.411 1.936 10 10 EDCE C[C@H]1CCn2cc(C(=O)N(CC(=O)O)Cc3ccccc3O)nc2C1 911494195 SSYAMZNMQYSBRS-LBPRGKRZSA-N 343.383 1.898 10 10 EDCE CCOC(=O)NCCC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855233336 XHPJXPYEQMXGFX-CYBMUJFWSA-N 335.404 1.526 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](CC(C)C)NC(C)=O)C2)cc1 862158691 KXZRSBKOYNNXOC-CRAIPNDOSA-N 347.459 1.941 10 10 EDCE O=C(CN1CC[C@H]2C[C@H]21)NCc1ccc(N2CCOCC2)c(F)c1 761096799 RCABTVMDHNEIHF-WMLDXEAASA-N 333.407 1.373 10 10 EDCE COC(=O)c1c(CNCC2(C)OCCO2)c2cc(F)ccc2n1C 1119445903 RJQGPFYCBYMCDD-UHFFFAOYSA-N 336.363 1.957 10 10 EDCE O=C(CN1C(=O)NC2(CCCCC2)C1=O)N1Cc2cccc(O)c2C1 871198279 FTMHVBABBITBSQ-UHFFFAOYSA-N 343.383 1.489 10 10 EDCE CN(C)S(=O)(=O)c1ccc(C(=O)N2Cc3cccc(O)c3C2)cn1 871204901 SCGBNZWQWRBLRK-UHFFFAOYSA-N 347.396 1.194 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)CNC(=O)c2ncccc2O)c1 1137473478 KRCYLFDRJNTJFB-JTQLQIEISA-N 345.355 1.109 10 10 EDCE CC(C)(C)OC(=O)NCC1(NCc2cccc(F)c2O)COC1 707876700 ILOWBAXYDNFCEO-UHFFFAOYSA-N 326.368 1.915 10 10 EDCE CCNCc1ccc(N(C)CCN(C)CCO)cc1Br 691251763 YHFUIUVNHQYAGI-UHFFFAOYSA-N 344.297 1.919 10 10 EDCE COC1CCN(c2ccc(Cn3cnnc3[S@@](C)=O)cc2)CC1 1307301779 PLHDOJPWMLPZTD-HSZRJFAPSA-N 334.445 1.679 10 10 EDCE CO[C@@]1(CO)CCCN(C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1330666908 SIWWQDHVWZZCJW-KRWDZBQOSA-N 339.411 1.575 10 10 EDCE Cc1cccc(CN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)n1 1332061202 XWBMNXZXACCBEY-UHFFFAOYSA-N 325.368 1.596 10 10 EDCE CO[C@@H]1CC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1335546077 FUKWRICWNRKRKX-LSDHHAIUSA-N 337.395 1.144 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC(C)(C)[C@@H](C)O)C2)cc1 1263731872 QSOPTCYXVKBOOR-KGLIPLIRSA-N 335.448 1.980 10 10 EDCE CCn1ncc(C(=O)N(C)C[C@@H](C)NCc2ccc(OC)c(C)c2)n1 1507074654 KTTLSCUIPMLILT-CQSZACIVSA-N 345.447 1.865 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1cccc(N2CCOCC2)c1 1298603466 XTGJVQMXXWTJAS-UHFFFAOYSA-N 342.395 1.793 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCn3nc(N)cc3C2)c([N+](=O)[O-])c1 1458563165 JRWCUAYUGHLLNN-HWKANZROSA-N 343.343 1.580 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@](C)(O)C2)cc1Br 2136828189 ICLIFKPBUMNJJJ-BIGNPOOSSA-N 329.238 1.791 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CCC(=O)NC2)cc1C 1482302263 DVTMRQCBAKGKDB-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE C[C@H](c1ccccc1)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)C(N)=O 1628757967 DDEDPGQCVMSZBW-PIGZYNQJSA-N 328.368 1.414 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@H]2CCC(=O)NC2)cc1C 1716403510 XYCMHPUEDXCZGG-UKRRQHHQSA-N 333.432 1.124 10 10 EDCE C[C@@H](NCCN1CCOC[C@H]1C)c1ccc(N2CCOCC2)cc1 1559709878 UQLBQRZRTIXXRA-IAGOWNOFSA-N 333.476 1.895 10 10 EDCE COc1ccc(CNCCC[C@H](C)NC(=O)c2cnn[nH]2)cc1C 1734241964 HXTZTTDXLONQGG-ZDUSSCGKSA-N 331.420 1.810 10 10 EDCE Cn1nc(C(=O)NCc2c(O)cccc2F)c2ccccc2c1=O 1645048504 YDPAKDCHDDSCNP-UHFFFAOYSA-N 327.315 1.708 10 10 EDCE CN(C)C(=O)c1cccc(CNC(=O)c2c(F)ccc(O)c2O)c1 1648454870 ZYMLUPORZRYHGG-UHFFFAOYSA-N 332.331 1.869 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC(O)(c3ncnn3C)CC2)c1O 1655488864 QIKSFZFVEKDUAK-UHFFFAOYSA-N 348.378 1.346 10 10 EDCE COc1cc(N2CC[C@@H](c3nncn3C)C2)c([N+](=O)[O-])cc1OC 1652186505 XCSQNCOCOCRLGS-SNVBAGLBSA-N 333.348 1.734 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2C[C@H](NCCCO)C2)cc1 1691830956 KCOBDULKRDSSRY-YEORSEQZSA-N 333.392 1.329 10 10 EDCE CC[C@H]1SC(=S)N(CCCC(=O)NC[C@H]2CCCO2)C1=O 11636355 IBWHGGHCYNPWEL-GHMZBOCLSA-N 330.475 1.701 10 10 EDCE COc1cc(O)c(CN2CCN(Cc3nccn3C)CC2)cc1OC 160156171 KDMCTWWTSDBWGT-UHFFFAOYSA-N 346.431 1.461 10 10 EDCE CCOC(=O)[C@H]1CCCN(C(=O)CCN2C(=O)CSC2=S)C1 1865765537 AYTFNAQOLJTVAA-JTQLQIEISA-N 344.458 1.039 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CC(O)C1 1990022300 ASRQWOXGVASZRO-IPWFMCSPSA-N 325.369 1.316 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C[C@@H]2OCC[C@H]21 2010388492 CDHNRJWCGJBIEF-WOPDTQHZSA-N 337.380 1.674 10 10 EDCE CO[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 2014405445 UNGOQANPNUEUNE-NEPJUHHUSA-N 339.396 1.922 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC(C)(CO)C3)c(Br)cc21 2157304980 WSGPJIWYCRSFBZ-LBPRGKRZSA-N 340.221 1.480 10 10 EDCE CNCc1ccc(N2CCN3C[C@@H](O)C[C@H]3C2)cc1Br 405201071 CRVYXVMAMSVZFO-KBPBESRZSA-N 340.265 1.424 10 10 EDCE CO[C@@]1(C(=O)O)CCN(Cc2c(O)cccc2Br)C1 706627937 HCYOZKSQSRLWTE-ZDUSSCGKSA-N 330.178 1.830 10 10 EDCE CNC(=O)c1nn(Cc2ccc(C)cc2O)c(C(F)(F)F)c1N 2079258112 UXNUHNNWLNNSMG-UHFFFAOYSA-N 328.294 1.906 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1COC[C@@H]1NC(=O)Cc1ccc(N)cc1 2044235993 WFLVOYRRBFOUHO-ZFWWWQNUSA-N 349.431 1.467 10 10 EDCE CNCc1ccc(N2CC(C[S@@](C)=O)C2)c(Br)c1 2047848248 QZOMDTPTWUTPDL-GOSISDBHSA-N 331.279 1.983 10 10 EDCE CO[C@@H]1CN(C)C[C@H]1NCc1cc(Br)cc(F)c1O 2095433333 GLARTYRWSPTBTH-VXGBXAGGSA-N 333.201 1.712 10 10 EDCE COc1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(OC)c1Br 2234897919 SGSHODTWALLFBL-OSXSSCDZSA-N 344.205 1.397 10 10 EDCE CCCC[C@H](CC)COCCCNC=C1C(=O)NC(=O)N(C)C1=O 2296565769 VMUVSQZZGKOPIM-ZDUSSCGKSA-N 339.436 1.791 10 10 EDCE COCCN1CCC[C@H]1CNC(=O)NCc1ccc(N(C)C)cc1 111413437 VHVDCVXHOXVLHO-KRWDZBQOSA-N 334.464 1.663 10 10 EDCE Cc1ccc([C@H](C)NCCS(=O)(=O)N2CCSCC2)c(O)c1 185395315 QQDIAIIUVONNAB-ZDUSSCGKSA-N 344.502 1.730 10 10 EDCE N[C@H]1[C@H]2C[C@H](CN(Cc3c(O)cccc3Br)C2)[C@H]1CO 2358889338 PNJYODBWJQUOOZ-HMDURAKOSA-N 341.249 1.542 10 10 EDCE Cc1cc(C(=O)N2CCOC[C@@H]2C(N)=O)c(C)n1-c1ccc(F)cc1 91784172 HHSMDHCUQLKBRK-MRXNPFEDSA-N 345.374 1.560 10 10 EDCE CCN(CC)[C@H](C)CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 283581154 SNRJAVLLDFPUJS-CQSZACIVSA-N 334.464 1.215 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(C(C)C)[C@@H]3CCOC3)nc12 291702157 IBDGLZCXPXYRNM-CYBMUJFWSA-N 348.403 1.611 10 10 EDCE CCN(C)c1ccc([C@@H](C)NC[C@]2(OC)CCS(=O)(=O)C2)cc1 903368655 PDDWLCPPIRUEOZ-RHSMWYFYSA-N 340.489 1.997 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(OCC(=O)OC(C)(C)C)cc1 849856909 DRKQLVHIFAZHEF-UHFFFAOYSA-N 336.340 1.722 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@](C)(O)C3)C2)cc1 854298581 FZOSNXYENVNUSE-KBXCAEBGSA-N 333.432 1.830 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2C[C@@H]3COC[C@]3(C(=O)O)C2)c1O 852733408 QBZQYJSKOCOSSY-BDJLRTHQSA-N 339.775 1.781 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCOC[C@@H](C)C3)C2)cc1 854300495 UQKZATOKOAUAND-LSDHHAIUSA-N 333.432 1.952 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](CO)CC(F)F)C2)cc1 854299328 OEYVOIXQHUCRJE-NEPJUHHUSA-N 343.374 1.589 10 10 EDCE Cc1cc(O)c(CNC[C@]23COCCN2C(=O)OC3)c(Cl)c1 865771167 SIOGEZRVXSEQNL-OAHLLOKOSA-N 326.780 1.665 10 10 EDCE CCc1c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)[nH]c(C)c1C(N)=O 773746162 YNTDWAHDKVXLLT-SECBINFHSA-N 345.399 1.757 10 10 EDCE NC(=O)CCCCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 779652160 LTALCJLIMFBBAU-HNNXBMFYSA-N 334.416 1.946 10 10 EDCE CCOc1ccc(O)c(CN2CCC(OCCC(=O)NC)CC2)c1 770286673 PNDSSTXBWOGUPQ-UHFFFAOYSA-N 336.432 1.908 10 10 EDCE CC(=O)c1cc(Cl)cc(Cn2cc([C@H]3COCCN3)nn2)c1O 881000085 ZHGZTKSKCNCESH-CQSZACIVSA-N 336.779 1.549 10 10 EDCE CN(CCNS(=O)(=O)Cc1ccc(N)cc1)Cc1ccccc1 386794411 OZGUEBGLCZQXKH-UHFFFAOYSA-N 333.457 1.820 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H](CO)C[C@@H](O)c1ccccc1 1153511050 ASDGPNKFTSHQPA-GDBMZVCRSA-N 331.368 1.241 10 10 EDCE COc1ccc(CNC(=O)c2cc(Br)n[nH]2)c(O)c1 1155575773 XVTGJLBSAODDQA-UHFFFAOYSA-N 326.150 1.816 10 10 EDCE C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cnccn1 1164181228 PJISSWUKVISNGN-SECBINFHSA-N 336.373 1.045 10 10 EDCE O=C1N[C@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@@H]2O1 2120406606 RTJULZHMGGQFOT-UWVGGRQHSA-N 331.141 1.586 10 10 EDCE O=C(O)[C@@H](NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCO1 1331846217 RCCZPPZVDHXQFJ-CVEARBPZSA-N 338.379 1.384 10 10 EDCE NCc1ccc(N2CCN3C(=O)NC[C@@H]3C2)c(Br)c1 212983091 AWELGJARABAXRC-SNVBAGLBSA-N 325.210 1.122 10 10 EDCE C[C@H](CNC(=O)NCc1cccc(Cl)c1O)N1CCN(C)CC1 1348662815 FMQULLAGHGDWMX-GFCCVEGCSA-N 340.855 1.481 10 10 EDCE COc1ccc(C(=O)N[C@@H](C)CNCc2ccc(OC)c(C)c2)nn1 1275399641 MUVNXFJEQGVBHB-ZDUSSCGKSA-N 344.415 1.710 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(c2cccc(F)n2)CC1 1468275639 WQWDHGKGZLRDBJ-ALCCZGGFSA-N 343.358 1.994 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnc(O)c([N+](=O)[O-])c1 1467839485 AKSJQKIWOUOLJQ-UHFFFAOYSA-N 338.316 1.817 10 10 EDCE COc1ccc(CNC2(CNC(=O)C(C)(C)C(N)=O)CC2)cc1C 1716684323 KRRCWECYCKQFFB-UHFFFAOYSA-N 333.432 1.254 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nn2c(O)nnc2O)c1 1628800952 WPWWARCHVDPVTA-UHFFFAOYSA-N 341.327 1.293 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccccc1O[C@H]1CC(=O)N1 1557101930 DIUJWTJEULEHCW-POZKEBTKSA-N 340.335 1.975 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC1(c2ncccn2)CCOCC1 1558493017 QDJISTOOSLYUBQ-HWKANZROSA-N 341.367 1.723 10 10 EDCE COc1cc(C(=O)N[C@H](C)c2ccccc2O)ccc1OCC(N)=O 1632247194 UUODTWYRLLTYHO-LLVKDONJSA-N 344.367 1.756 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2c[nH]c(C)cc2=O)cc1C 1567585316 JYLQWTPSJGLHJV-UHFFFAOYSA-N 343.427 1.862 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC2(CCOCC2)CC[C@@H]1CO 1638915273 FTCBYNREVFBHJD-CQSZACIVSA-N 335.400 1.420 10 10 EDCE O=C(c1ncnc(O)c1Br)N1Cc2cccc(O)c2C1 1643173256 BPRGDLQGVVOVKG-UHFFFAOYSA-N 336.145 1.806 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCN(CC(F)F)C2)cc1 1570424413 YKJMLYMVQRJJPI-LLVKDONJSA-N 325.319 1.918 10 10 EDCE CCOC(=O)[C@@H](F)[C@@H]1CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1643842683 AJPOEDWOTSXQBZ-ABAIWWIYSA-N 325.336 1.390 10 10 EDCE O=C(CN1CCCCC(=O)C1=O)Nc1c(Cl)ccc2nonc12 1586677425 UFRLOMHAPHGCKE-UHFFFAOYSA-N 336.735 1.396 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)CN2CCCC2=O)cc1C 1667970016 PXFNFLJPSDTYDD-OAHLLOKOSA-N 347.459 1.610 10 10 EDCE O=S(=O)(Nc1cc(Cl)c(O)c(Cl)c1)N1CCNCC1 232402176 ANVFLFBYNOCMLH-UHFFFAOYSA-N 326.205 1.261 10 10 EDCE COC[C@@H](C)NC[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1698863724 IACWCAUHVBXHPF-NEPJUHHUSA-N 335.408 1.934 10 10 EDCE O=C(N[C@@H](COCc1ccccc1)C(=O)O)c1ccc(O)c(O)c1 1946555950 WZRQGRWYCQKYBA-ZDUSSCGKSA-N 331.324 1.498 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@](C)(O)CCN 1951832806 JEEGMUZFIRVUAW-PBHICJAKSA-N 340.420 1.633 10 10 EDCE CN(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC(N=[N+]=[N-])C1 1985094516 PYRXVLHOIIAZCG-NSHDSACASA-N 326.401 1.353 10 10 EDCE CC1(C)C[C@H](O)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2154834267 ZXZISQSURMRQAX-MADCSZMMSA-N 340.221 1.751 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@](C)(C(=O)N2CC(N=[N+]=[N-])C2)C1 2010393540 UCFNOLJQNSOQEF-MEBBXXQBSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2010406048 PHIKWKWRUGVWIN-NEPJUHHUSA-N 341.412 1.811 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@H]([C@@H](O)C(F)(F)F)C1 2064271071 WQORIVNFWICVJG-IINYFYTJSA-N 333.306 1.802 10 10 EDCE COc1cccc(O)c1[C@@H](C)N[C@H]1CCCN(S(C)(=O)=O)C1 2064901838 NQKJHRDNGNVAIA-NEPJUHHUSA-N 328.434 1.475 10 10 EDCE O=C(O)C[C@H]1CN(Cc2cc(Br)cc(F)c2O)C[C@@H]1O 2174357049 ZCAGSMWNMJVEGN-CPCISQLKSA-N 348.168 1.561 10 10 EDCE NCc1ccc(N2CC[C@@H]3OCC(=O)N[C@H]3C2)cc1Br 2185523888 ZQMDNJKQODRXQD-STQMWFEESA-N 340.221 1.002 10 10 EDCE NCc1ccc(N2C[C@H](CO)C[C@H]2CO)c(F)c1Br 2089907567 LPRQLRZEQMWITJ-SCZZXKLOSA-N 333.201 1.226 10 10 EDCE CCOc1cccc(CNCc2nn(C)nc2Br)c1O 2235247363 BSOHRTGTYWQSFW-UHFFFAOYSA-N 341.209 1.972 10 10 EDCE CC[C@H](C)NCc1ccc(N2C[C@H](O)[C@H](O)C2)c(Br)c1 2240040833 VDMUGIQOADDXMF-NZVBXONLSA-N 343.265 1.879 10 10 EDCE Cc1ccc(N2C(=O)NC(=O)C(=CNC[C@H]3CCCO3)C2=O)c(C)c1 2297056447 DQRMKFVZQCRHMI-CYBMUJFWSA-N 343.383 1.539 10 10 EDCE CN1CCCc2cc(CNC(=O)N[C@H]3CCCn4ncnc43)ccc21 177342955 IFQHDXUTPPMWRH-HNNXBMFYSA-N 340.431 1.995 10 10 EDCE CS(=O)(=O)[C@H]1CSCCN1c1ccc(/C=C\C(=O)O)cc1 221370960 GNMKLGHONFCHHP-IRBQFCFKSA-N 327.427 1.708 10 10 EDCE C[C@@H](CN(C)C)N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2379882476 LQHUWWPJJHJJHA-ISVAXAHUSA-N 341.253 1.787 10 10 EDCE CO[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC[C@@H]1C 807098219 UFMNAFTXENIVIL-SUMWQHHRSA-N 347.459 1.561 10 10 EDCE COc1ccc(N(C)C[C@H]2CCN(S(C)(=O)=O)C2)c(OC)c1 801523504 BHLKOEJQACABAM-GFCCVEGCSA-N 328.434 1.422 10 10 EDCE CCOc1ccc(O)c(CN2CCS(=O)(=O)[C@H]3CCC[C@@H]32)c1 825202672 SWBWBWUMOUZLRM-HOCLYGCPSA-N 325.430 1.942 10 10 EDCE Cc1cc(CN2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)no1 588405415 MIPSDYQVCPWCJU-HYXAFXHYSA-N 343.383 1.752 10 10 EDCE Cc1cc(CN2CCN(CC(N)=O)C(=O)C2)ccc1N1CCCCC1 839177797 QOWMBMYXDKKYSQ-UHFFFAOYSA-N 344.459 1.115 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 919080344 ACVOFWBQMWSLJX-PVAVHDDUSA-N 333.432 1.664 10 10 EDCE COc1ccc(N2CCN(C(=O)c3csc(C(=O)O)n3)CC2)cc1 911094196 LAEWYJFEIBWVTN-UHFFFAOYSA-N 347.396 1.812 10 10 EDCE CO[C@](C)(CO)CNC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 847386093 SABYEWCCOWMHDC-KSSFIOAISA-N 337.464 1.689 10 10 EDCE N[C@H](CNC(=O)NCc1cc(Br)ccc1O)C1CC1 841964862 ASMSHFFBIIGEPH-LLVKDONJSA-N 328.210 1.691 10 10 EDCE CCO[C@@H](C(=O)N(CC(=O)O)Cc1ccccc1O)[C@@H]1CCOC1 911492590 IGCKHNJULICKIE-CZUORRHYSA-N 337.372 1.247 10 10 EDCE COc1cccc(CNS(=O)(=O)c2ccnn2C2CCC2)c1O 914153050 PYVQNOIEUIABKU-UHFFFAOYSA-N 337.401 1.801 10 10 EDCE CCOC[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 858762729 LUCGQWAIYWSWKZ-SNVBAGLBSA-N 337.332 1.167 10 10 EDCE C[C@H]1CC[C@@H](NC(=O)NCc2c(O)cccc2F)CS1(=O)=O 923270358 RKZAPSQEWWDPTF-VHSXEESVSA-N 330.381 1.296 10 10 EDCE OC[C@]1(CNCc2ccccc2O)COCCN1Cc1ccccc1 850396628 ZMHAINUOGPWDNO-HXUWFJFHSA-N 342.439 1.745 10 10 EDCE CC[C@@H](C)C(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 756387149 HONDKQXNVZXNDL-SECBINFHSA-N 329.374 1.536 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCOC[C@@H]3CCCO3)C2)cc1 855230386 CTUDGZWWPMNDBT-QAPCUYQASA-N 348.443 1.976 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H]3C(=O)OC[C@H]3C2)c([N+](=O)[O-])c1 858848843 ILXFJWKGJPJDJR-WEPHUFDCSA-N 332.312 1.390 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3occc3N)cc2)C1 1349472221 HODZCIODHNOWEF-ZDUSSCGKSA-N 342.399 1.494 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NCCc2nnnn2C)cc1 771936279 BAWSKCMLDGJOIF-UHFFFAOYSA-N 331.424 1.098 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@@]2(CCO)CCOC2)c1O 775035005 WNODFSVPGYCZKZ-OAHLLOKOSA-N 326.349 1.188 10 10 EDCE COC(=O)[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)[C@@H]1C 786813673 LYHFWPMUQVLSTO-RKDXNWHRSA-N 335.316 1.314 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccccc1CN1CCOCC1 1303223323 KHBOTJOSMKDDCM-UHFFFAOYSA-N 342.395 1.860 10 10 EDCE CC(=O)N1Cc2ccc(S(=O)(=O)NCc3ccccc3O)cc2C1 1309218296 GYSUXTMDFSQGQZ-UHFFFAOYSA-N 346.408 1.733 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cnncc1O 1162539361 COXRVJWDUABCRI-UHFFFAOYSA-N 331.328 1.093 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H]2CCNC(=O)C2)cc1C 1319178743 JCLJDISLWSPKFV-XJKSGUPXSA-N 347.459 1.372 10 10 EDCE CCCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(C)C1 1329435320 BRUBKAXDHOSMDN-AWEZNQCLSA-N 331.416 1.177 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2ccnn2C)cc1C 1322441067 PHCLASNSBNXTCR-UHFFFAOYSA-N 330.432 1.989 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1cc(CNCC2CC2)nn1 1335625420 KRKWXWHAMTZNQZ-UHFFFAOYSA-N 327.432 1.663 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)COC1CN(C(=O)OC(C)(C)C)C1 1900608030 UZLIEBLTKOGZEZ-UHFFFAOYSA-N 327.385 1.781 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCS(C)(=O)=O)cc1C 1266949259 SAKHJOHVXWXFIA-ZDUSSCGKSA-N 342.461 1.033 10 10 EDCE COC(=O)CCNC(=O)CCN[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 1351350573 DNDWVTWZMSALSY-OLZOCXBDSA-N 334.416 1.908 10 10 EDCE CO[C@H](C)C(=O)N(C)C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1280987820 ZJLRHTHWBGSHGR-GHMZBOCLSA-N 349.391 1.461 10 10 EDCE NC(=O)[C@H](C1CC1)N(CC1CC1)C(=O)/C=C/c1ccc(O)c(O)c1 1454964242 WUVAQYQSBTWQIX-AUNFYEFLSA-N 330.384 1.614 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC(Cn3cncn3)CC2)cc1 1617155378 NQZGVILSAJWETI-UHFFFAOYSA-N 341.375 1.993 10 10 EDCE C/C(=C/C(=O)N(C)c1cccc(S(C)(=O)=O)c1)c1cnccn1 1544790608 KWOPFRIJCYCHPI-XFXZXTDPSA-N 331.397 1.946 10 10 EDCE CO[C@H](C)CN[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1480122821 ZGCPKQQOYWDJBJ-RISCZKNCSA-N 333.392 1.688 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCN(Cc2ccccc2)C1=O 1631707225 XORSJUULWVQKRJ-OAHLLOKOSA-N 340.379 1.558 10 10 EDCE CCc1ncoc1C(=O)NC[C@@H](O)CNCc1ccc(OC)c(C)c1 1568579759 IPMREBNATJURAY-AWEZNQCLSA-N 347.415 1.435 10 10 EDCE CO[C@@H](C)CNC[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1731683536 AKFHFWCCUOLOKD-QWHCGFSZSA-N 347.419 1.936 10 10 EDCE CCNC(=O)OC[C@H]1CCCCN1C(=O)Cc1ccc(O)c(O)c1 1640500114 SHJIOAOWHAWEFY-CYBMUJFWSA-N 336.388 1.768 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@H](F)C(C)C)cc1C 1571438776 SZSSYQRBGRRPQV-GOEBONIOSA-N 326.412 1.564 10 10 EDCE O=C1C[C@@H](C(=O)NCc2cc(O)ccc2O)c2ccc(F)cc2N1 1644752430 FIHOFAUYCIVKIZ-CYBMUJFWSA-N 330.315 1.979 10 10 EDCE CC[C@H](OC)C(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1584049310 CCHZYBOEEFTEGU-GWCFXTLKSA-N 349.391 1.509 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(O)CCSC1 1751880710 AGUFCLLIMAQNIO-INIZCTEOSA-N 334.445 1.797 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1CC(=O)N(C)C1 1668445118 BSAHOBFHWTUIEK-INIZCTEOSA-N 347.459 1.420 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)[C@H](C)CC(N)=O)C2)cc1C 1691107558 HUAXMEYDKROFJO-BMFZPTHFSA-N 347.459 1.500 10 10 EDCE COC[C@](C)(N)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951993113 MFISJYMOEJZTNG-PBHICJAKSA-N 340.420 1.897 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CCOC[C@H]3C)c(Br)cc21 252601001 MAPBLDJVNMSDFV-AMIZOPFISA-N 340.221 1.887 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985095063 YIPFGQOXENMIDY-AXFHLTTASA-N 325.369 1.268 10 10 EDCE COC1CC(NC(=O)OC(C)(C)C)(C(=O)N2CC(N=[N+]=[N-])C2)C1 1985100974 MBDMZBNWQJUFLN-UHFFFAOYSA-N 325.369 1.580 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@](C)(NC(=O)C(F)(F)F)C(F)(F)F 1985102701 KTLBVGOWMZKFFA-ZETCQYMHSA-N 335.208 1.755 10 10 EDCE C[C@]1(O)CCCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 163263025 YKLGQHSLUZVDGB-JSGCOSHPSA-N 340.221 1.752 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)[C@@H](N)c1ccc2c(c1)CCN2C 2000228276 CJGYENMQGHAEOC-UVBJJODRSA-N 335.448 1.953 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@@H](O)[C@H](O)C2)cc1Br 300520825 WMFVVRTXELOVAW-OWYVNGRQSA-N 329.238 1.661 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)c(Br)c1 2158406573 ARVXRDCFODMUEU-GQANPOSXSA-N 341.249 1.925 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](N3CC(O)C3)C2)cc1Br 2158747399 XQPZWSXIUJXELK-CMPLNLGQSA-N 341.249 1.758 10 10 EDCE C[C@@H](O)[C@H]1CCCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2193592504 HXJSSPGGYPJXCA-TWPQKTAQSA-N 341.205 1.784 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)Nc2ccc(O)cc2)n1 2058151637 YRAFTUFYMJDSQM-UHFFFAOYSA-N 332.179 1.689 10 10 EDCE CC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(CN)c(Br)c1F 2192282579 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10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2[C@H]3CCNC[C@H]32)c(O)c1Br 2381141966 HDNGCAQVMGSCHZ-QJPTWQEYSA-N 339.233 1.935 10 10 EDCE COc1ccc(CNC(=O)[C@@]23[C@@H]4[C@H]5C(=O)[C@H]2[C@@H]2[C@@H]5C[C@@H]4[C@@H]23)c(O)c1 800560625 XXWVCSUQWWDOIH-CJHYQQOXSA-N 325.364 1.344 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]2c2ccn[nH]2)cc1 298631753 VXLWFLOYUSDUEP-KRWDZBQOSA-N 327.432 1.929 10 10 EDCE C[C@H]1COCC[C@H]1S(=O)(=O)N(C)Cc1ccc(N(C)C)cc1 809387938 HEXLIROPUUAMSB-XJKSGUPXSA-N 326.462 1.939 10 10 EDCE COCC[C@H](COC)NC(=O)NCc1ccc(N(C)C)c(F)c1 811957436 CQUFUBZGJQAFDR-CYBMUJFWSA-N 327.400 1.742 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCCC(=O)N3C)CC2)cc1 905103749 DAMGZWIMKXFWQL-INIZCTEOSA-N 331.416 1.355 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](CC(C)C)C(N)=O)CC2)cc1 839459025 DCGBHELHYAASBA-INIZCTEOSA-N 333.432 1.491 10 10 EDCE Cc1cc(CC(=O)NCCc2nc(=O)o[nH]2)c(C)n1-c1ccccc1 834697925 SHHQNIMVIQLVBS-UHFFFAOYSA-N 340.383 1.672 10 10 EDCE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CC(=O)NC 834514147 JMKVCDCPDJCLPI-UHFFFAOYSA-N 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EDCE OCc1cc(Br)c[nH]c1=NCCc1ccc(O)c(O)c1 2157703484 WFKUGAQVZARSTM-UHFFFAOYSA-N 339.189 1.824 10 10 EDCE OCc1ccc(N2CC[C@@]3(O)CCOC[C@@H]3C2)cc1Br 2194563939 FEAUEPZSECJWSR-SWLSCSKDSA-N 342.233 1.919 10 10 EDCE C[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1C(=O)Cc1ccc(N)cc1 2044626472 IAFOGSREPLOJQL-MFKMUULPSA-N 343.349 1.869 10 10 EDCE CN(Cc1nc(=NCc2ccc(O)c(O)c2)[nH][nH]1)C(=O)OC(C)(C)C 2065556732 CPUGZGCFMGMDDY-UHFFFAOYSA-N 349.391 1.617 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2210543070 XRAUJAYBOYOABF-HBNTYKKESA-N 327.385 1.874 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2210536663 HWQWDABXWCNVRP-VPOLOUISSA-N 327.385 1.608 10 10 EDCE O=C1C(=Cc2ccco2)SC(=S)N1[C@H]1CCS(=O)(=O)C1 2296664492 GXKQTSQNBJJWKH-QMMMGPOBSA-N 329.424 1.668 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@]1(O)CCCN(C(=O)OC(C)(C)C)C1 2300530799 WOOWBGZNMBUNIB-HNNXBMFYSA-N 341.412 1.907 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)C(=Cc2cccc(O)c2)SC1=S 2323832014 BBXLPVMAFFCZJA-VIFPVBQESA-N 325.367 1.039 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CSCN2)c(O)c1Br 2327586506 NYNYSZCNXSQFMC-VIFPVBQESA-N 331.235 1.742 10 10 EDCE COC(=O)c1cn(Cc2ccc(C)c(Br)c2O)nn1 2352942804 KQTXKNWTMBDBLM-UHFFFAOYSA-N 326.150 1.890 10 10 EDCE CN1C(=O)/C(=C\c2ccc(OS(C)(=O)=O)cc2)SC1=S 102468138 NAFOWMDCWBTTIR-JXMROGBWSA-N 329.424 1.856 10 10 EDCE C[C@H](N)[C@@H](O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952207701 FFDLYCBGXJYHGW-DRCTWCGVSA-N 326.393 1.242 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)C[C@@H](C)c2nnn[nH]2)c([N+](=O)[O-])c1 132912358 SWZUKVBFKIVYPF-BREXMAIKSA-N 346.347 1.534 10 10 EDCE CCN(CC)c1ccc(CNC(=O)c2cnc(O)n(C)c2=O)cc1F 267669163 JKFHGEXSMLDEDP-UHFFFAOYSA-N 348.378 1.401 10 10 EDCE O=C(Nc1nc(-c2ccncc2)n[nH]1)C1=S=c2ccsc2=C1 555789446 XCPKONAAFDZXLD-UHFFFAOYSA-N 327.394 1.517 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)[C@H](C)C[S@@](C)=O)c([N+](=O)[O-])c1 588432605 MSJSCLSYZOVYBB-LOPUWJKRSA-N 340.401 1.984 10 10 EDCE CCOC(=O)[C@H](F)[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 912250409 AKJKFLGWIZAWDI-WVKRUXSZSA-N 337.347 1.861 10 10 EDCE CC(C)n1cnc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1 845925408 UNVKZERGRWXXFP-LBPRGKRZSA-N 344.419 1.741 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)[C@@H]3CCO[C@H]3C)C2)cc1 849416333 PCYUKCQBRHLXQJ-HEHGZKQESA-N 340.445 1.371 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cn3nc(C)cc3C)C2)cc1 855228374 BAOBSAMAMQPFAC-OAHLLOKOSA-N 328.416 1.904 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CCCNC3)C2)cc1 851660870 BCDLPVSFRLLDJE-GJZGRUSLSA-N 332.448 1.573 10 10 EDCE CC(C)C(=O)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N=NC(N)=O)cc1 936422195 FHALYCMLXVNDHM-KBPBESRZSA-N 343.387 1.930 10 10 EDCE CO[C@@H]1CC[C@@H]2OCCN(C(=O)/C=C\c3ccc(O)c(O)c3)[C@H]2C1 779542737 SFICWCCNYCJJKS-DXUCGFDCSA-N 333.384 1.906 10 10 EDCE CCOc1cccc(CN[C@H]2CCN(C3CCOCC3)C2=O)c1O 776229705 AMZZGMXSOQISBC-HNNXBMFYSA-N 334.416 1.660 10 10 EDCE O=C(NCC[C@H]1CCOC1)C(=O)NCc1ccc(N2CCCC2)cc1 788938546 SMFMHLICBLPOEJ-INIZCTEOSA-N 345.443 1.446 10 10 EDCE CCN(CC)C(=O)[C@@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1136075712 GFONEJVYBKNNKH-LBPRGKRZSA-N 338.429 1.410 10 10 EDCE CN1C(=O)C[C@@H](NCc2cc(Cl)cc(Br)c2O)C1=O 708090165 OUAIZUSNBMZJAW-SECBINFHSA-N 347.596 1.655 10 10 EDCE Cn1cc(Br)c(C(=O)NCc2cc(N)ccc2O)n1 710280352 UDOIEULOPMJJSY-UHFFFAOYSA-N 325.166 1.400 10 10 EDCE COC(=O)NC[C@@H]1CCN1c1ccc(CO)c(Br)c1 2130740734 RREHOLRQIVDIEX-NSHDSACASA-N 329.194 1.876 10 10 EDCE CSC1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CN(C(=O)OC(C)(C)C)C1 1900322267 ZVRBCGHAQPFDSE-XYPYZODXSA-N 342.461 1.605 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@]1(NC(=O)OC(C)(C)C)C[C@@H](O)C1 1900613454 YLSPURHVEZEZSS-WJONMLJTSA-N 327.385 1.563 10 10 EDCE CN(CC1(CO)CC1)c1cc2c(cc1Br)[C@H](O)C(=O)N2 1915531178 JMRDXWDJOGQJOS-LBPRGKRZSA-N 341.205 1.643 10 10 EDCE C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1616983753 OYMBKFHIKJCGIK-CYBMUJFWSA-N 346.435 1.605 10 10 EDCE CN(C)C(=O)COc1cccc(NC(=O)c2cccc(O)c2O)c1 1544482825 PWZAYYVNYMVURT-UHFFFAOYSA-N 330.340 1.817 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1cnn(C)c1N 1482918857 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344.209 1.452 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@H]2O 1974156349 GHLRMTWVOYFIKJ-CUNNUPQLSA-N 346.196 1.514 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@]1(CO)C(=O)NCCCN=[N+]=[N-] 1985096156 NPXZQTHWKGQTKI-AWEZNQCLSA-N 327.385 1.565 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1CC(=O)N1CC(N=[N+]=[N-])C1 1987647461 SJILEYJAJRDCQU-ONGXEEELSA-N 325.369 1.437 10 10 EDCE CO[C@@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C1CN(C(=O)OC(C)(C)C)C1 2010396296 MXYUAPDULVCRDH-VXGBXAGGSA-N 339.396 1.780 10 10 EDCE C[C@@H]1OCCN(Cc2cc(Br)ccc2O)[C@H]1C(=O)O 328139544 QEXCKBYSJPXNQM-QPUJVOFHSA-N 330.178 1.829 10 10 EDCE C[C@H]1OCCN(Cc2cc(Br)ccc2O)[C@@H]1C(=O)O 328139542 QEXCKBYSJPXNQM-PELKAZGASA-N 330.178 1.829 10 10 EDCE C[C@]1(C(=O)O)CN(Cc2cc(Br)cc(F)c2O)CCO1 715790713 VSAZFHDVQRKBKS-CYBMUJFWSA-N 348.168 1.969 10 10 EDCE CNCc1ccc(N2CC[C@@H](C(=O)NC)C2)cc1Br 398507900 LADNGWPPIGZYPS-LLVKDONJSA-N 326.238 1.741 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC(Cc4cc[nH]n4)CC3)c2n1 2063100092 UWAKGNYZQFJDRT-UHFFFAOYSA-N 340.387 1.561 10 10 EDCE C[C@@H]1C[C@H]1N(CCO)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2167110377 VRVYDAPCQZOJTC-QUUYKZCZSA-N 341.205 1.642 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)c(Br)c1 2178087515 RMTNZZXWORIHPG-NYMYIZQJSA-N 342.233 1.946 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CC(=O)Nc2ccc(N)cc2)[C@H]2C[C@H]21 2044676186 QPEHAKBINQCFGK-LSDHHAIUSA-N 346.431 1.901 10 10 EDCE C[C@@H]1[C@@H](C)S(=O)(=O)CCN1c1ccc(CN)c(Br)c1 2113894931 QNXLLFZVBCUDST-NXEZZACHSA-N 347.278 1.920 10 10 EDCE C[C@H]1CN(CCNCc2cc(Br)ccc2O)C(=O)N1 2230849256 SBVLJUOXPWQZJX-VIFPVBQESA-N 328.210 1.658 10 10 EDCE CC1=NN(c2ccc(Br)cc2)C(=O)C1=CNn1cnnc1 2297511579 QEXGGAIRXFFCKV-UHFFFAOYSA-N 347.176 1.891 10 10 EDCE C[C@@H]1CCNC(=O)[C@@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2312521850 YVOGZCLSYUOYKV-RDTXWAMCSA-N 343.427 1.177 10 10 EDCE CCN1C(=O)NC(=O)C(=Cc2cc(C)n(C[C@@H]3CCCO3)c2C)C1=O 2313630146 OSBQWOSUJVNYJK-AWEZNQCLSA-N 345.399 1.766 10 10 EDCE N=C1/C(=C\c2ccco2)C(=O)N=C2SC(N3CCOCC3)=NN12 20356624 DDJVQOFSGJTAIF-BTIHMXIBSA-N 331.357 1.188 10 10 EDCE CNC(=O)[C@H](NC(=O)NCc1ccc(N2CCCC2)cc1)C(C)C 178434534 XHRUBNPVXNTHSB-MRXNPFEDSA-N 332.448 1.857 10 10 EDCE COC[C@]1(C(=O)O)C=CCN1Cc1cc(Br)ccc1O 2361556902 GXGIXGYAUARGSY-AWEZNQCLSA-N 342.189 1.996 10 10 EDCE CNCc1ccc(N2CC[C@H]3C[C@H]2C(=O)N3C)c(Br)c1 2360843259 FOPTZJKQPCJSGD-FZMZJTMJSA-N 338.249 1.978 10 10 EDCE CCO[C@@H]1C[C@](NC(=O)c2cccc(O)c2O)(C(=O)OC)C1(C)C 275530198 FNNXQQLOTSRUAV-PXAZEXFGSA-N 337.372 1.574 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1 817108832 NLSOKSRGTDQOFN-CQSZACIVSA-N 347.415 1.082 10 10 EDCE COc1ccc(CNC(=O)C(=O)Nc2cn(C)nc2C2CC2)c(O)c1 812990949 FKJJZHJCJPUSJD-UHFFFAOYSA-N 344.371 1.267 10 10 EDCE C[C@@H]1CN(CCO)CCN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 825338328 OKXIEWRPENKIHC-SNVBAGLBSA-N 329.784 1.452 10 10 EDCE CC(C)OCCN1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 588405137 LDYYDGREETXKKD-XQRVVYSFSA-N 334.416 1.680 10 10 EDCE Cn1ccnc1CN1CCN(Cc2cc3c(cc2O)CCC3)CC1 729986320 WHLOKRULYRZVBU-UHFFFAOYSA-N 326.444 1.932 10 10 EDCE CN1C[C@H](O)C[C@@]1(C)C(=O)NCc1cccc(Br)c1O 907757727 JGXFHYGXAFQVSF-YGRLFVJLSA-N 343.221 1.226 10 10 EDCE C[C@]1(C2CCN(Cc3cc4c(cc3O)OCO4)CC2)COC(=O)N1 905705071 LQRKLOXXYHPTLB-QGZVFWFLSA-N 334.372 1.831 10 10 EDCE CCN(CCC(N)=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 914400544 NVTIHSNRKASOGF-CQSZACIVSA-N 348.447 1.491 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)CSCC(=O)O)cc1 846719051 ZXEHIQFSNSPODK-UHFFFAOYSA-N 326.418 1.408 10 10 EDCE C[C@H](NC[C@@H](O)[C@@H]1CCCO1)c1ccc(N2CCOCC2)c(F)c1 858469671 XXALTDHPLAGWHO-VHSSKADRSA-N 338.423 1.853 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCOC[C@H]2CCO)cc1F 758429272 OFODNYOBFFEFDF-CYBMUJFWSA-N 325.384 1.185 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CO[C@@H]3CCCNC3)C2)cc1 852900654 OOSYFYWKSCUUKH-WMLDXEAASA-N 333.432 1.159 10 10 EDCE C[C@H](NC(=O)N[C@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1O 868143043 NJNSRIGIWYYCOY-RYUDHWBXSA-N 341.433 1.176 10 10 EDCE CO[C@@H]1C[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 930321021 BAIQGGNJJFARKQ-FVQBIDKESA-N 331.416 1.039 10 10 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COCCNc1nc(CC(=O)NCc2cccc(O)c2O)cs1 1176576851 UAGQTAQYRMAPRL-UHFFFAOYSA-N 337.401 1.472 10 10 EDCE NCc1ccc(N2CCN3C(=O)NC[C@H]3C2)c(F)c1Br 231840281 AUWDHLXEFMCOLJ-VIFPVBQESA-N 343.200 1.261 10 10 EDCE C[C@@H](NCc1ccc(N2CCN(C)CC2)c(F)c1)c1nnc(O)n1C 1333717355 CXJHXLXMAJZGHY-GFCCVEGCSA-N 348.426 1.262 10 10 EDCE CN(Cc1ccccc1O)C(=O)Cc1nc(C2CCOCC2)n[nH]1 1349312867 XMPNULQLYCUHKO-UHFFFAOYSA-N 330.388 1.605 10 10 EDCE N[C@@H]1CC[C@@H](C(=O)O)N(Cc2ccc(Br)cc2O)C1 2132274033 OTRZLYPXKHPLAB-MNOVXSKESA-N 329.194 1.531 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H](C)NC(C)=O)cc1C 1268048906 HPAOXWLWYYGTOP-KBPBESRZSA-N 335.448 1.465 10 10 EDCE COc1cccc(CNC(=O)c2ccc3c(c2)C(=O)NCCO3)c1O 1445963274 BFECYLZURZAPHD-UHFFFAOYSA-N 342.351 1.453 10 10 EDCE COc1ccc(CNC(=O)Cn2nnnc2-c2ccsc2)c(O)c1 1296969170 ZVRLLVFRJLXBJY-UHFFFAOYSA-N 345.384 1.432 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)Cc2cnn(C)c2)cc1C 1700388836 BOGGTASTINKQSI-GJZGRUSLSA-N 344.459 1.963 10 10 EDCE 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342.424 1.447 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@H]2CCCN(S(C)(=O)=O)C2)c1 182414338 ZZLXZHYXEGJBQH-QWHCGFSZSA-N 342.461 1.723 10 10 EDCE O=C(CN1C(=O)CSC1=S)N1CCN(Cc2ccccc2)CC1 82311209 IUNDFZXJWKGDAI-UHFFFAOYSA-N 349.481 1.191 10 10 EDCE O=C(O)[C@H]1COCCN(Cc2ccc(Br)cc2O)C1 700438768 JSFFJCUUYIBZJO-SNVBAGLBSA-N 330.178 1.688 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)NC[C@H]2CC23CCSCC3)cc1 817913838 MREAUAIXYAUMAL-CQSZACIVSA-N 347.484 1.577 10 10 EDCE CNCc1ccc(N2CCN(C(=O)NC)CC2)cc1Br 722194611 PNVICSOLYLUFKZ-UHFFFAOYSA-N 341.253 1.630 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCCCOCCO 588413528 QEHXFUPTDWCAOE-DAXSKMNVSA-N 334.416 1.052 10 10 EDCE CC(C)CN(C)CCCNC(=O)C(=O)NCc1ccc(N(C)C)cc1 846720384 BOGKRBKAEXEOEB-UHFFFAOYSA-N 348.491 1.463 10 10 EDCE CCc1cccc(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)c1O 848920211 ZFIVKTROENQDCC-MRXNPFEDSA-N 325.430 1.344 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CNCC[C@H]1C 842267286 XKHPJAGXZLXZJH-RHSMWYFYSA-N 346.475 1.215 10 10 EDCE 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2101061114 UEUNLYAVWOXGSJ-LLVKDONJSA-N 327.178 1.253 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])C1 2213592367 SKEPTMALXFFJTF-UTUOFQBUSA-N 339.396 1.970 10 10 EDCE NCc1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2228401354 CTRCFHRSNPACPL-TXEJJXNPSA-N 329.238 1.335 10 10 EDCE O=C1NC[C@H]2CCCN(c3ccc(CO)c(Br)c3)[C@H]12 2264603237 UMOUDPJUZRDEMD-RNCFNFMXSA-N 325.206 1.656 10 10 EDCE C[C@@H]1CN(C(=O)c2cc(O)c(O)c(O)c2)C[C@H](C(F)(F)F)N1C 170190639 XEEYSRJJDMBQFF-RDDDGLTNSA-N 334.294 1.510 10 10 EDCE Cc1cnn(C[C@H]2CN(Cc3cc4c(cc3O)OCO4)CCO2)c1 112071923 PRJIWRJFWWYNKI-CQSZACIVSA-N 331.372 1.527 10 10 EDCE COCCNC[C@@H]1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1278618052 GKYALTHANAOSBY-IUODEOHRSA-N 347.419 1.984 10 10 EDCE Cc1nc(C(=O)NCc2ccc(N3CCCC3)cc2)c(=O)[nH]c1C 179496950 UYHXFNQTTAKVGC-UHFFFAOYSA-N 326.400 1.917 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C[C@@](C)(N)CO 1952345616 FKMJPRLSMWCNRY-YVEFUNNKSA-N 340.420 1.633 10 10 EDCE CCOc1cccc(CN2CCN(c3cc(OC)ncn3)CC2)c1O 184438414 FBIMZJMDUGTOKD-UHFFFAOYSA-N 344.415 1.912 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc(C(N)=O)nc3)CC2)cc1 194785644 HONYWLTWVFCLAR-UHFFFAOYSA-N 340.383 1.152 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)C1C[C@H]2COC[C@@H](C1)C2=O 365607158 FFAKGKHPOSVLAC-AGUYFDCRSA-N 344.411 1.720 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@@H]([C@@H]4CCCO4)C3)cc2N1 376192455 ZFGUVKRJXPAYEC-DZGCQCFKSA-N 349.343 1.310 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)OC(C)(C)C 808539086 QLSWXLJCOYUKPY-CMPLNLGQSA-N 327.377 1.723 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CO[C@H](C)CN2)c(O)c1Br 2380746833 QIIPLRVWXVGSBF-MWLCHTKSSA-N 343.221 1.456 10 10 EDCE CCN(CC)[C@H](C)CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 809883291 HOJSLWXJZBGQEN-OAHLLOKOSA-N 348.491 1.558 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@H](C3CC3)C2)cc1F 803663866 COLAJPRALONJLR-INIZCTEOSA-N 349.406 1.145 10 10 EDCE CC[C@H](C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1)C(=O)OC 819586958 BWMLDDVSWDZNST-XJKSGUPXSA-N 334.416 1.837 10 10 EDCE COc1ccc(N2CC[C@@H](CNC3CCN(C(N)=O)CC3)C2)cc1 818221852 OFHZPEMLPLCJON-AWEZNQCLSA-N 332.448 1.654 10 10 EDCE CNC(=O)[C@@H]1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)C1 817773523 CHKVIARLGHWGSD-OAHLLOKOSA-N 330.432 1.347 10 10 EDCE CO[C@@H]1COC[C@H]1NC(=O)NCc1cc(Br)ccc1O 827473568 IEYKHDWUIFTLLJ-ZYHUDNBSSA-N 345.193 1.368 10 10 EDCE CCOc1cccc(CNCCCN2CCCS2(=O)=O)c1O 729684206 MXZVRBYPFXDUAB-UHFFFAOYSA-N 328.434 1.306 10 10 EDCE COC(=O)[C@@H](NCc1cc(Cl)cc(F)c1O)c1ccnn1C 843430245 QXBRPXXJGLRUFW-LBPRGKRZSA-N 327.743 1.922 10 10 EDCE O=C1[C@@H](NCc2cc([N+](=O)[O-])ccc2O)CCN1C1CCOCC1 747621837 AURNACOBKZOQBE-AWEZNQCLSA-N 335.360 1.170 10 10 EDCE COc1cc(Br)cc([C@H](C)NC[C@H](O)CN(C)C)c1O 848527360 AFZJKPQKNMNITB-ONGXEEELSA-N 347.253 1.736 10 10 EDCE CC[C@](C)(CO)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 847399383 CKFJEFDBNKKADW-LJQANCHMSA-N 349.475 1.342 10 10 EDCE CCc1cc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)no1 740491256 JYYFGLKKMPYETD-UHFFFAOYSA-N 330.388 1.900 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN1Cc1c(O)cc(C)cc1Cl 840919087 SZRUUZYJAQSVQQ-LLVKDONJSA-N 332.853 1.868 10 10 EDCE C[C@@H](CN(C)CCCN(C)C)NC(=O)/C=C/c1ccc(O)c(O)c1 855346337 XLFZQWWKQWZVAO-KGXGESDWSA-N 335.448 1.499 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)NCCc2ccc(N)cc2)CS1(=O)=O 851662946 OQDZFCULKSMAJP-BXUZGUMPSA-N 325.434 1.076 10 10 EDCE Cc1cc(CC(=O)N2C[C@@H](CO)[C@@H](O)C2)c(C)n1-c1ccccc1 854910179 QOUHYMRKBIAREH-WMZOPIPTSA-N 328.412 1.448 10 10 EDCE O=C1NCCO[C@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)[C@@H]12 931562509 LKLFPZWDRQQQDY-ZWKOTPCHSA-N 345.443 1.003 10 10 EDCE C[C@H](NC(=O)[C@@]1(N)CC1(F)F)c1ccc(N2CCOCC2)cc1 867961260 CDVTVDPZPRCXQE-NHYWBVRUSA-N 325.359 1.437 10 10 EDCE CNC(=O)Cn1cc(NC(=O)N[C@H](C)c2cc(OC)ccc2O)cn1 772458922 ZLPCODQJLRVWFG-SNVBAGLBSA-N 347.375 1.226 10 10 EDCE CC(=O)c1cc(F)cc(Cn2cc(C[C@H]3CCCNC3)nn2)c1O 880996231 RHSUZSHKGDIEQH-GFCCVEGCSA-N 332.379 1.916 10 10 EDCE NC[C@]12CN(Cc3c(O)cccc3Br)C[C@@H]1CCO2 2118554299 DGRFCVXSWVUSIP-HZMBPMFUSA-N 327.222 1.704 10 10 EDCE N[C@H]1CCCC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1327581691 BMAAVCMDFPJVQY-ROUUACIJSA-N 331.460 1.781 10 10 EDCE COc1n[nH]c(NC(=O)Cc2ccc(O)c(O)c2)c1Br 1175055609 RELFBRAYLZWBKM-UHFFFAOYSA-N 342.149 1.773 10 10 EDCE O=C1OC[C@]2(CNCc3ccc(N4CCCC4)cc3)COCCN12 1330343847 SGLHVFPZNGPGJV-SFHVURJKSA-N 331.416 1.598 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NCc1cccc(O)c1O 1907963329 AEJSHJLEPIIDTH-GXTWGEPZSA-N 338.404 1.822 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)Cc2ccc[nH]2)cc1C 1268334674 LFGBUYBOJNEFPO-INIZCTEOSA-N 331.416 1.141 10 10 EDCE CCN[C@H](C)c1ccc(N2CC(CO)(CO)C2)cc1Br 1914978647 LJNRMUWUFBKQOQ-LLVKDONJSA-N 343.265 1.911 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@]2(C1)C(=O)Nc1ccccc12 1448068631 IJLZQVZHSPFTJA-LJQANCHMSA-N 338.363 1.763 10 10 EDCE O=C(NCc1c(O)cccc1F)c1cn(Cc2ccccn2)nn1 1471975724 FCHMJHJFSKCPRX-UHFFFAOYSA-N 327.319 1.496 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3CCN(C)C3=O)CC2)cc1C 1716691046 XOLZBVOSLLJTIR-HNNXBMFYSA-N 345.443 1.220 10 10 EDCE CCN1CCN([C@H](C)CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1627184629 AUVAQUNQLOFMDJ-CYBMUJFWSA-N 346.435 1.605 10 10 EDCE Cn1ccnc1[C@@H]1C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CCO1 1638948037 GTDRPSOENLRSOF-TWPIFRAZSA-N 343.383 1.881 10 10 EDCE CS(=O)(=O)Nc1ccccc1C(=O)NCc1c(O)cccc1F 1635360668 POROJNOXAWWQTQ-UHFFFAOYSA-N 338.360 1.833 10 10 EDCE Cn1c(=O)oc2ccc(CNC(=O)NCc3ccccc3O)cc21 1565187542 GAAPFQVHEXBWPB-UHFFFAOYSA-N 327.340 1.837 10 10 EDCE COc1cccc([S@@](=O)CC(=O)NCc2ccc(O)cc2O)c1 1638357109 OTXYAWRWUWYKAG-QHCPKHFHSA-N 335.381 1.530 10 10 EDCE CC[C@H](CNC(=O)[C@@H](C)n1cncn1)NCc1ccc(OC)c(C)c1 1732197824 WYAAULRFPBPGAA-GDBMZVCRSA-N 345.447 1.841 10 10 EDCE CO[C@@H](C)CN(C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1733067551 PXRPYJANGNFPIR-RYUDHWBXSA-N 335.408 1.934 10 10 EDCE CCNC(=O)c1ccc(CNC(=O)c2c(F)ccc(O)c2O)cc1 1654212044 GHYQAFIUGPIEPC-UHFFFAOYSA-N 332.331 1.917 10 10 EDCE O=C(NCc1nc([C@H]2CCCO2)n[nH]1)NCc1c(O)cccc1F 1673954760 ISCYILZFZKZVLS-GFCCVEGCSA-N 335.339 1.500 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cc(C)sn2)cc1C 1699039764 HVXPXRDVZIYTTM-CQSZACIVSA-N 349.456 1.649 10 10 EDCE CC(C)CC(=O)N1CCC(NC(=O)c2cc(O)c(O)c(O)c2)CC1 169859621 URWGDLIDMSGKJO-UHFFFAOYSA-N 336.388 1.570 10 10 EDCE Cn1cc(Br)c(CNC(=O)Cc2ccc(O)c(O)c2)n1 1158614549 LKNYIBUKHUDSBG-UHFFFAOYSA-N 340.177 1.453 10 10 EDCE CC(=O)N1C[C@H]2C[C@H]1CN2Cc1ccc(Br)cc1O 1877018354 NEMMJVDUFZUGGF-OLZOCXBDSA-N 325.206 1.960 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)O)[C@@H](c2ccc(O)c(O)c2O)C1 1951666185 UUNMIONWWPFCRZ-NXEZZACHSA-N 339.344 1.839 10 10 EDCE COc1ccc(Br)c(CNCCc2cn(C)nn2)c1O 1965927125 HGBPECNVNMULRT-UHFFFAOYSA-N 341.209 1.624 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1COC[C@H]1N(C)C(=O)OC(C)(C)C 1985101777 XLKXTCBGLQJTCS-WDEREUQCSA-N 327.385 1.637 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010402244 OBVMQKXZWXCVEA-WOPDTQHZSA-N 339.396 1.516 10 10 EDCE CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)c1ccc(N)cc1 2022887822 CJNBXDAFJRZRBA-CYBMUJFWSA-N 337.420 1.896 10 10 EDCE CC(C)(C)OC(=O)NCc1nc(=NCc2ccc(F)cc2O)[nH][nH]1 2024892836 ONRASESATBCISD-UHFFFAOYSA-N 337.355 1.708 10 10 EDCE C[C@H](N)c1ccc(N2CCN(CCO)C(=O)C2)cc1Br 2171074815 SHXBRUXOUGQUMV-JTQLQIEISA-N 342.237 1.110 10 10 EDCE COc1ccc(N2CCC[C@](N)(CO)C2)c(OC)c1Br 2162645733 BYRCBKFJWGLHED-CQSZACIVSA-N 345.237 1.756 10 10 EDCE C[C@@H]1CN(C)C[C@@H](CNCc2ccc(Br)cc2O)O1 691446763 TVXMTENNLQCIFI-ZWNOBZJWSA-N 329.238 1.963 10 10 EDCE COC1(c2ccc(C(=O)NCc3c(O)cccc3O)cc2)COC1 2064761747 NVNXIDKQKDMODS-UHFFFAOYSA-N 329.352 1.900 10 10 EDCE CCOc1cccc(CNCCn2cc(Br)nn2)c1O 2192991913 NTCPDMJMELGBGT-UHFFFAOYSA-N 341.209 1.935 10 10 EDCE CC(C)NCc1ccc(N2CC[C@H](O)[C@H](O)C2)c(Br)c1 2188625976 BAQIQMJIKMZBET-LSDHHAIUSA-N 343.265 1.879 10 10 EDCE O=C(C1CC1)N1CCN(c2ccc(CO)cc2Br)CC1 2182583639 SFVSEEQXZFBSNS-UHFFFAOYSA-N 339.233 2.000 10 10 EDCE CC(C)N1CCN(c2ccc(CN)c(Br)c2)CC1=O 2114172209 AAEAIZLUGVGDES-UHFFFAOYSA-N 326.238 1.965 10 10 EDCE COC[C@@H]1[C@H](O)[C@@H](O)CN1c1ccc([C@@H](C)N)cc1Br 2234066902 LODCVMCVWFOERD-NGSVMEPUSA-N 345.237 1.026 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](CO)C[C@@H](CO)C2)cc1Br 2236633837 RYPBLUFJXYXNCF-QJPTWQEYSA-N 343.265 1.896 10 10 EDCE CC(C)CN1C(=O)C(=CNc2ccc(N(C)C)cc2)C(=O)NC1=S 2295113206 LKJXWWQMZMMZLN-UHFFFAOYSA-N 346.456 1.948 10 10 EDCE CN1C(=O)C(=C2SC(=S)N(CC(=O)O)C2=O)c2ccccc21 2293094939 ROKVNEQXDYAWBY-UHFFFAOYSA-N 334.378 1.319 10 10 EDCE CO[C@H]1COCCN(c2ccc(CN)c(Br)c2F)C1 2351588526 SITJGMOVEIKQEE-SNVBAGLBSA-N 333.201 1.899 10 10 EDCE CN1CCCc2cc(/C=C\C(=O)N[C@H]3CCS(=O)(=O)C3)ccc21 106577380 SHFZVRLJROMRKM-PKYBCLHXSA-N 334.441 1.386 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)OCC(=O)N1CCCC1 108724157 IGLGQRHYRWMVOK-VMPITWQZSA-N 344.411 1.702 10 10 EDCE CN[C@@H](COC)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952207389 CZQZCJZVLYYSID-OLZOCXBDSA-N 340.420 1.768 10 10 EDCE CCN(C)C(=O)CNC(=O)N1CCN(c2ccc(OC)cc2)CC1 186238825 YURZHHNOSDTCLK-UHFFFAOYSA-N 334.420 1.005 10 10 EDCE O=C1NC(=O)N(Cc2ccccc2Cl)C(=O)/C1=C\N1CCOCC1 33316357 YPBIYZDCSMPRGD-BENRWUELSA-N 349.774 1.135 10 10 EDCE COCCN(CCN1CCOC[C@@H]1C)c1ccc(OC)c(OC)c1 192760469 NVXXMNWCVWCKSQ-HNNXBMFYSA-N 338.448 1.877 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1 808504905 NVMZBHQHBCNOMP-OAHLLOKOSA-N 347.367 1.879 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1[C@@H]2CCCO[C@@H]21 819697281 UMGMQATWJZESHA-XKQJLSEDSA-N 333.384 1.709 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H](O)C3CCC3)CC2)cc1 825472534 QBLQMLSJRRTXQJ-GOSISDBHSA-N 347.459 1.094 10 10 EDCE CC[C@H]1[C@@H](CO)CCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 830707477 FTKZBKLNVGIWQB-AEFFLSMTSA-N 333.476 1.804 10 10 EDCE COc1ccc(N(C)Cc2cnnn2[C@H]2CCCNC2)cc1OC 903905718 MDYDGZPSLGRPLJ-AWEZNQCLSA-N 331.420 1.856 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCOCC2(CC2)C1 839391879 FILDNTUZQFRIGY-UHFFFAOYSA-N 345.443 1.350 10 10 EDCE C[C@H]1CN(S(=O)(=O)NCc2cc(Cl)ccc2O)C[C@@H](C)O1 845997813 HAZTZWNTEGCRJQ-AOOOYVTPSA-N 334.825 1.489 10 10 EDCE C[C@H](CN(C)Cc1cc(O)n2ncc(C(=O)O)c2n1)c1nccs1 846253151 HZSCHXCNSMQRNM-SECBINFHSA-N 347.400 1.825 10 10 EDCE Cn1cnc(CCCNCc2cc(Cl)cc([N+](=O)[O-])c2O)n1 842736984 JAMJLRFZDDTSCW-UHFFFAOYSA-N 325.756 1.805 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 845262239 RJODINKVCBUDGX-JCGIZDLHSA-N 349.475 1.783 10 10 EDCE COC(=O)CCNC(=O)CCNCc1cc(F)c(N(C)C)cc1F 858292619 BTQJJXWLHVOQAZ-UHFFFAOYSA-N 343.374 1.190 10 10 EDCE C[C@@H]1C[C@H](NCc2ccc(N3CCN(C)CC3)cc2)c2ncnn21 850352287 REFCGPFVDUNZBT-PBHICJAKSA-N 326.448 1.826 10 10 EDCE CCS(=O)(=O)N1CCC[C@H](C(=O)NCc2c(O)cccc2F)C1 928712045 NLKVSMPOPQINBK-NSHDSACASA-N 344.408 1.209 10 10 EDCE COC(=O)c1cn(C2CN(Cc3cc4c(cc3O)CCC4)C2)nn1 758969002 ILKGFPOHQCCYSB-UHFFFAOYSA-N 328.372 1.316 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(C)(C)N3CCOCC3)C2)cc1 855224270 JMYBLZBOTSWSTR-OAHLLOKOSA-N 347.459 1.501 10 10 EDCE COC(=O)/C=C/c1ccc(N2Cc3c(N)nn(C)c3C2)c([N+](=O)[O-])c1 853680023 UDACADIAIYMXAW-GQCTYLIASA-N 343.343 1.617 10 10 EDCE CN1C[C@@]2(C)CN(CC(=O)NCc3ccc(N(C)C)cc3)C[C@]2(C)C1 931306143 CVFHVBVHCGZHQO-PMACEKPBSA-N 344.503 1.642 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@H]3CC[C@H]2[C@H]2CNC[C@H]32)cc1 866696387 IKHIWGAXBRIZLS-YSHGAJCASA-N 342.487 1.299 10 10 EDCE Cc1ccc(/C=C/C(=O)N2CCc3ccc(S(N)(=O)=O)cc32)cn1 1136755938 NNIQWTXDHLWTMI-QPJJXVBHSA-N 343.408 1.640 10 10 EDCE CNCc1ccc(N2CC[C@](O)(CN(C)C)C2)c(Br)c1 713717975 IKXGSQAQAOOTMY-HNNXBMFYSA-N 342.281 1.671 10 10 EDCE COc1ccc([N+](=O)[O-])cc1/C=C1/SC(N2CCOCC2)=NC1=O 1084562646 BENSUAHAVNSMPG-UKTHLTGXSA-N 349.368 1.906 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](C(C)(C)O)C3)nc12 1308049431 KHMDEUJFQDPRQX-LLVKDONJSA-N 348.403 1.204 10 10 EDCE O=C(NCc1nc(O)cc(O)n1)c1cc2cc(O)c(O)cc2s1 1168431659 WXKWJRXRKLJCOB-UHFFFAOYSA-N 333.325 1.444 10 10 EDCE O=C1NC(=O)[C@@]2(CCCN(Cc3ccc(N4CCCC4)cc3)C2)N1 1321005509 ONSXGPSENGWIFI-SFHVURJKSA-N 328.416 1.461 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@@H]2CCCO2)cc1C 1332477675 XEPODNFIXYYVJV-WBVHZDCISA-N 336.432 1.092 10 10 EDCE O=C(NCc1cccc(O)c1O)C1CCC(N2CCOCC2)CC1 1263895649 CHSHTKIZYMCMLK-UHFFFAOYSA-N 334.416 1.605 10 10 EDCE CC[C@H](C)C(=O)N[C@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1268638197 IPCFYFXJNMQGTO-QWHCGFSZSA-N 346.435 1.311 10 10 EDCE CN(Cc1ccccc1O)C(=O)CN1CCCC2(CC2)S1(=O)=O 1346681217 MRMOCMMNTJRXAN-UHFFFAOYSA-N 338.429 1.309 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)C[C@@H]1CCOC1 1276010669 ISGWXGCBCCURNW-OLZOCXBDSA-N 347.419 1.936 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)/C=C(/C)C2CC2)cc(OC)n1 1284202466 COGCDMRFMZEKNV-RDQDRAATSA-N 347.415 1.690 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCCN(C(=O)N2CCCC2)C1 1297731498 ZKZXJDHDNZWSET-AWEZNQCLSA-N 347.415 1.437 10 10 EDCE CN(C)C(=O)/C=C\C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1456937223 VBNDHNVMPBAYRN-YUQCYMQKSA-N 332.448 1.116 10 10 EDCE O=C(C1CC1)N1CC(NCc2cccc(Br)c2O)C1 1926265693 HZQACFZMECKLJL-UHFFFAOYSA-N 325.206 1.865 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccc(S(=O)(=O)C2CC2)cc1 1637126370 VNVWYHYEAHHHCG-UHFFFAOYSA-N 347.392 1.964 10 10 EDCE CC[C@@H](C)C(=O)N(C)C[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1738792431 LOUNUJURQFKNFL-VXGBXAGGSA-N 337.420 1.722 10 10 EDCE O=C(CCn1nnc2ccccc2c1=O)N1Cc2cccc(O)c2C1 1650673040 QBEHDTQAKNWABO-UHFFFAOYSA-N 336.351 1.430 10 10 EDCE CCOC(=O)N(C)C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1584374529 QTMMUKVVJPSCBG-UHFFFAOYSA-N 336.388 1.720 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCCCN3C(C)=O)CC2)cc1 164793933 GMWIMXSBHVAPEI-GOSISDBHSA-N 345.443 1.745 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCC(=O)N[C@@H]2C)c1O 1971868808 IRFVSEBITXRWKW-LDYMZIIASA-N 343.221 1.920 10 10 EDCE OCc1ccc(N2C[C@@]3(CO)CC[C@]3(CO)C2)cc1Br 2145746207 OMIGYCUJEIUGFW-HUUCEWRRSA-N 342.233 1.513 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)NCCCCN=[N+]=[N-] 1985102180 CRBMJFGGWNMZCB-SNVBAGLBSA-N 329.401 1.857 10 10 EDCE CN(C)C[C@H]1COCCN1c1ccc(CN)c(Br)c1F 2153249439 QXEGYARKYHZSME-NSHDSACASA-N 346.244 1.814 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@@H](CN=[N+]=[N-])C1)C1COC1 2010402194 NIIONGRBZROCHG-JQWIXIFHSA-N 339.396 1.685 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(CNCc2c(O)cccc2F)C1 2023450720 PXUHZCWCBIKOCL-UHFFFAOYSA-N 340.395 1.850 10 10 EDCE OCc1nc(=NCCc2ccc(O)c(O)c2)[nH]cc1Br 2157702760 NIDHFYWSHLLFHH-UHFFFAOYSA-N 340.177 1.219 10 10 EDCE OC[C@@]1(O)CCN(c2ccc(CNC3CC3)c(Br)c2)C1 313862511 MJKAJFYYMSHSNM-OAHLLOKOSA-N 341.249 1.635 10 10 EDCE Cn1cc(CNC(=O)c2cccc(O)c2O)c(Br)n1 720666632 BDBQCSGCNBOJEZ-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3COc4cccc(C)c4C3)c2n1 2062199759 ZGIRQYAHWSGZFQ-GFCCVEGCSA-N 338.367 1.785 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC(Cn4ccnc4)CC3)c2n1 2062795805 MWAVXJFGYUAKPL-UHFFFAOYSA-N 340.387 1.492 10 10 EDCE CCNCc1ccc(N2CCC[C@@H]2[C@H](O)CO)cc1Br 2179801254 ZHOMMTOVDVOHDU-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC=C[C@H]3CO)c(Br)cc21 2176343607 PZPSFHVEVYVFMF-SDBXPKJASA-N 338.205 1.399 10 10 EDCE CN1CC[C@H]2OCCN(c3ccc(CO)cc3Br)[C@@H]2C1 2185592339 LRRGIRUJRYPUKA-HUUCEWRRSA-N 341.249 1.851 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213586274 ABSHRHKSYDFOGK-USZNOCQGSA-N 339.396 1.704 10 10 EDCE COC(=O)C=C1SC(NC(=O)c2cccc([N+](=O)[O-])c2)=NC1=O 2293692913 NWSBWWBPJWQURI-UHFFFAOYSA-N 335.297 1.011 10 10 EDCE CNCc1ccc(N2C[C@@H]3OCC[C@@]3(CO)C2)cc1Br 2296431020 IROJUIYEMZDNFD-GJZGRUSLSA-N 341.249 1.756 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2329329702 XNRMVXRKWXLDSE-IJTUBWEGSA-N 328.206 1.433 10 10 EDCE Cc1ccc(CN2CC[C@@](C)(O)[C@H](O)C2)c(O)c1Br 2352677626 BJLQERHIVTWSJD-BXUZGUMPSA-N 330.222 1.781 10 10 EDCE CN1CCC[C@@H](CNC(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 108816947 XFKJYHPRGXZIRW-YOCVDRLZSA-N 343.471 1.994 10 10 EDCE C[C@@H](CS(C)(=O)=O)N(Cc1cc([N+](=O)[O-])ccc1O)C1CC1 173396580 QFORSUDASQCJEF-JTQLQIEISA-N 328.390 1.698 10 10 EDCE CN1C(=O)/C(=C\c2c(N(C)C)nc3ccccn3c2=O)SC1=S 34852378 PXJRTUWDHDFIHW-CSKARUKUSA-N 346.437 1.592 10 10 EDCE CCc1nc2n(n1)CCC[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1 181180359 MDJXHGOHBWKVBW-WMADIVHISA-N 328.372 1.916 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@]3(O)CCCC[C@H]3C2)cc1 247491912 ZPTSVIUIMCNJLQ-FXAWDEMLSA-N 345.487 1.996 10 10 EDCE CC(=O)N(C(=O)CN1C(=O)c2ccccc2C1=O)c1ccc(N)cc1 242759833 DLTNPEMZPCNSBD-UHFFFAOYSA-N 337.335 1.445 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CCCN(C)C1=O 819698612 OQHORKOSPQWLKE-AWEZNQCLSA-N 348.399 1.152 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCCCc2ncn(C)n2)c1 827369681 IYDXPASOLHUCOV-NSHDSACASA-N 333.392 1.522 10 10 EDCE N[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(F)(F)F 827364648 JNRLCBYCKZNXTC-GFCCVEGCSA-N 335.301 1.168 10 10 EDCE CN(C)c1ccc(/C=C\CNCC[C@H]2CNCCS2(=O)=O)cc1 903969668 IREBBUYNBQVWKE-LIMHQNJXSA-N 337.489 1.132 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCN(CCO)C[C@H]2C)cc1 837724451 HRIJEOJHCYLHQY-MRXNPFEDSA-N 348.491 1.741 10 10 EDCE CCCCNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 743318709 FBBTXKQAWQPVOY-UHFFFAOYSA-N 334.464 1.917 10 10 EDCE C[C@@H](N)[C@@H](C)NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 841915653 SPNPKSPMVQSAOG-GHMZBOCLSA-N 342.390 1.336 10 10 EDCE Cc1ccncc1N1CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 841123994 CAMIVYARVBCCQD-UHFFFAOYSA-N 339.399 1.260 10 10 EDCE COc1cc(N2CCN(C[C@]3(C)CCNC3)CC2)cc(OC)c1OC 843119618 VUUJVNQZJFIXJO-LJQANCHMSA-N 349.475 1.834 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C[C@H](C)O)C3CC3)C2)cc1 854295972 FQJRMEBANSBPLS-UONOGXRCSA-N 333.432 1.829 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCC[C@H](C(N)=O)C3)C2)cc1 855228036 UIYMIWQXJBMCNJ-ZNMIVQPWSA-N 345.443 1.682 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCC[C@@H]3CO)C2)cc1 854297894 SUARBWGSQMAEOR-JKIFEVAISA-N 333.432 1.734 10 10 EDCE COC(=O)CCN1CCC[C@H](N2CCCc3cc(CN)ccc32)C1=O 852741650 XWIBQQNHGIGYRF-KRWDZBQOSA-N 345.443 1.452 10 10 EDCE COCCn1cc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)cn1 869227689 BQWLWYUVDGUYNJ-HNNXBMFYSA-N 344.415 1.547 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCc2ccc(Cl)cn2)cc1 785440421 ZYBUNWPMTAKSKH-UHFFFAOYSA-N 346.818 1.734 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCC[C@@H](C(N)=O)C3)CC2)cc1 786686507 FLUORQSIFXLUJL-CABCVRRESA-N 345.443 1.636 10 10 EDCE CC1CCN(c2ccc(CNC(=O)c3nnc(O)nc3O)cc2)CC1 1136705335 JAHUNNKPZZPQIF-UHFFFAOYSA-N 343.387 1.449 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)[C@H](CO)C2)cc1Br 704451520 KBTVKGGIWVEDSC-VWYCJHECSA-N 330.222 1.539 10 10 EDCE C[C@H](O)c1ccc(N2CCN(C)[C@H](CO)C2)cc1Br 687588633 JIJCCYIVTFJFMP-JQWIXIFHSA-N 329.238 1.615 10 10 EDCE Cn1cnnc1CCNCc1cc(Br)cc(F)c1O 715788265 JPLSNNFRVWXOFO-UHFFFAOYSA-N 329.173 1.755 10 10 EDCE CS(=O)(=O)N[C@H]1CCN(Cc2cc(Br)ccc2O)C1 93530705 NTFBEQFBVNYUGJ-NSHDSACASA-N 349.250 1.278 10 10 EDCE CC[C@H](C)[C@H](C)NC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1327924234 WXIZCLYCXXDOFT-KKUMJFAQSA-N 347.459 1.941 10 10 EDCE CC1(C)[C@H](CNC(=O)C(=O)NCCc2ccc(N)cc2)C1(F)F 1329838557 RRGPNCOFTKDYEU-LBPRGKRZSA-N 325.359 1.335 10 10 EDCE C[C@@H]1CN(c2ccc(CO)c(Br)c2)C[C@H](CCO)O1 2122797931 GEHXJZUMCMBRHV-MFKMUULPSA-N 330.222 1.918 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@H]2[C@@H](O)CO)c(Br)c1 2123209247 HCKUAYORHSPPIJ-IIMNLJJBSA-N 329.238 1.791 10 10 EDCE C[C@@H](O)C[C@H]1CCCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1330418652 QIDKFKZHYLRNAN-TZMCWYRMSA-N 332.400 1.386 10 10 EDCE CN1CC[C@@H](C(=O)N2Cc3cccc(O)c3C2)[C@@H](c2cnn(C)c2)C1 1330662157 JHGPZBPNISOMGY-HZPDHXFCSA-N 340.427 1.703 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCNC(=O)[C@H]2CCCO2)cc1 1349667182 KXPJUNYFVCCUHC-CYBMUJFWSA-N 347.375 1.264 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@H]2C[C@H]2C(N)=O)C2CC2)cc1C 1266431589 PSFQUOIZPWXHLE-OWCLPIDISA-N 345.443 1.109 10 10 EDCE C[C@@H](C(=O)NCc1cc(O)ccc1O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1455350800 VEVGAUHSSPRTAP-LEWSCRJBSA-N 346.383 1.278 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC3(CCNC(=O)O3)C2)c([N+](=O)[O-])c1 1458668971 QKYSBANTNKCRQD-HYXAFXHYSA-N 347.327 1.470 10 10 EDCE CCOC(Cn1cc(C(=O)NCc2cc(O)ccc2O)cn1)OCC 1455352435 IFJSWXQOUMCFEP-UHFFFAOYSA-N 349.387 1.623 10 10 EDCE CC1=C(C(=O)NCc2ccc(O)cc2O)[C@@H](C)n2ncnc2N1C 1451769957 NQEZRFBBXHNXSF-SNVBAGLBSA-N 329.360 1.291 10 10 EDCE CN(Cc1nc(O)c2ccccc2n1)C(=O)Cc1ccc(O)c(O)c1 1539361429 WNCDIJXCARFBNE-UHFFFAOYSA-N 339.351 1.948 10 10 EDCE Cc1ccc(C(=O)NCCC(=O)NCc2c(O)cccc2O)c(O)c1 1558536484 ZQUOLJDZVRRIFI-UHFFFAOYSA-N 344.367 1.548 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)C(C)(C)NC(C)=O)cc1C 1482151072 CBAWLSJBNZIDRF-ZDUSSCGKSA-N 349.475 1.760 10 10 EDCE CC(=O)N1CCc2cc(C(=O)NCc3ccc(O)cc3O)ccc21 1557084542 DMTPDGVSKYUOIG-UHFFFAOYSA-N 326.352 1.937 10 10 EDCE COc1cccc([S@](=O)CC(=O)NCc2ccc(OC)cc2O)c1 1633926300 AHVNOPHMJXADBA-XMMPIXPASA-N 349.408 1.833 10 10 EDCE O=C(CCS(=O)(=O)C1CCCC1)NCc1ccc(O)cc1O 1570462400 RTIHDSKKDQOBHB-UHFFFAOYSA-N 327.402 1.462 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccnc(O[C@@H]2CCOC2)c1 1643882381 UOASIJWYVVOHOW-CQSZACIVSA-N 330.340 1.591 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc(S(C)(=O)=O)cc2N)c1 1640800166 GJYRPHGIDIRZFJ-UHFFFAOYSA-N 334.397 1.616 10 10 EDCE CN(C[C@@H](O)CNCC1CC1)C(=O)c1ccc(N=NC(N)=O)cc1 1571598102 ZPEMBBBANWODML-AWEZNQCLSA-N 333.392 1.282 10 10 EDCE CN(C)c1ccc([C@]2(O)OC(=O)c3ccc([N+](=O)[O-])cc32)c(O)c1 1848441692 UIEQIDIYMVZOJF-INIZCTEOSA-N 330.296 1.730 10 10 EDCE C[C@@](O)(CO)[C@H]1CCN(c2ccc(CN)c(Br)c2)C1 2138099399 AUIVHYNWEQGQLG-SMDDNHRTSA-N 329.238 1.477 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)C2=COCCC2)cc1C 1677060440 FSGQHWMFVVZAAF-QGZVFWFLSA-N 348.443 1.607 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2cncn2C)cc1C 1698831974 JFSICVCWNWFILB-CQSZACIVSA-N 330.432 1.987 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc(O)c(N)c3)CC2)cc1 1866359208 CAOWSIVKIRCUTM-UHFFFAOYSA-N 327.384 1.945 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2CNC(=O)C2)c1O 1964035558 RSIULTWBFZRQDA-QMMMGPOBSA-N 329.194 1.389 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003172922 RMIPGOWKVFIFKJ-ZJQBRPOHSA-N 340.420 1.134 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)CCCN=[N+]=[N-] 1985095279 BUPOVWJRSNFZPN-NSHDSACASA-N 328.417 1.600 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCO1 1985102722 KXXDBBOHTLIAAU-WDEREUQCSA-N 327.385 1.827 10 10 EDCE C[C@@H](C(=O)N(C)CCN=[N+]=[N-])N1CC(NC(=O)OC(C)(C)C)C1 1987822134 RXUQCTBYEIVAMD-JTQLQIEISA-N 326.401 1.353 10 10 EDCE CN(CC(C)(C)CO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2150966867 BXOOPSSAZLOJRY-LBPRGKRZSA-N 342.237 1.856 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2CCO[C@@]2(C(=O)NCCCN=[N+]=[N-])C1 2010392642 HWYJFVOAYOJVPA-ABAIWWIYSA-N 339.396 1.829 10 10 EDCE C[C@H](CNC(=O)OC(C)(C)C)CNC(=O)c1cc(O)c(O)c(O)c1 2015118387 AESGKUAEDZQNHB-VIFPVBQESA-N 340.376 1.694 10 10 EDCE C[C@@H](N)c1ccc(N(C)Cc2c(Br)nnn2C)cc1O 2156470842 WXMSJVQDEPDGMS-MRVPVSSYSA-N 340.225 1.939 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)[C@H](CO)C2)c(Br)c1 316634567 ZUSFFKSPZMUIFT-SWLSCSKDSA-N 343.265 1.737 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2160718303 YPHVDERAVJLPHU-FWYKCERLSA-N 341.249 1.660 10 10 EDCE O=C1Nc2cc(N(CCO)CC3CC3)c(Br)cc2[C@H]1O 688394251 CWBYPJSIEONHBO-CYBMUJFWSA-N 341.205 1.643 10 10 EDCE CN[C@@H](C)c1ccc(N2CCN(C)[C@H](CO)C2)cc1Br 687612683 IYEHKDRUZYCVTO-AAEUAGOBSA-N 342.281 1.842 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@H](CO)C2)cc1Br 396814195 UERQJWLPKASNPL-ISTVAULSSA-N 329.238 1.648 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(C2(O)COC2)cc1 2064863019 BPZXAWQPEACYEW-GFCCVEGCSA-N 343.379 1.677 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)c(Br)c1 2173316627 DFDFXLNKVFYRGG-XSXLEWDISA-N 341.249 1.789 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H]3[C@H](C)O)c(Br)cc21 2182238079 CBKSIHKHTDBMTH-XDYOCTJHSA-N 340.221 1.621 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCCN(C(=O)Cc2ccc(N)cc2)C1 2044624514 IXRMDYRNHANVGB-HNNXBMFYSA-N 349.431 1.563 10 10 EDCE O=C1NC[C@@H]2CN(c3ccc(CO)cc3Br)CC[C@@H]12 2100940127 FOJDIWUOUBUEFE-GHMZBOCLSA-N 325.206 1.514 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3NC(=O)O[C@@H]3C2)c(Br)c1 2120405828 NVYPCSUYCIWANM-HNBZJPLGSA-N 326.194 1.766 10 10 EDCE COc1ccc(N(C)C[C@](N)(C(=O)O)C2(Br)CC2)cc1 2206636374 GDBRWGQHDITVBJ-AWEZNQCLSA-N 343.221 1.841 10 10 EDCE COc1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)c(OC)c1Br 2234896381 BAUPNWCEISUMEH-LSJOCFKGSA-N 344.205 1.662 10 10 EDCE O=C(O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc[nH]2)SC1=S 2293438627 FPTNLNSNSQCOCA-ZETCQYMHSA-N 326.355 1.144 10 10 EDCE CNCc1ccc(N2C[C@@H]3OCC[C@@]3(CO)C2)c(Br)c1 2296428185 OIBZJIMVJSVKDD-GJZGRUSLSA-N 341.249 1.756 10 10 EDCE Cc1ccc(CN2CCOC[C@H]2C(=N)N)c(O)c1Br 2352933081 VYFQPCYZUNIDDQ-JTQLQIEISA-N 328.210 1.600 10 10 EDCE CO[C@](C)(CN)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952207482 UNBJNKGYPSEWBY-RHSMWYFYSA-N 340.420 1.897 10 10 EDCE C[C@H](NC[C@H]1CN(C)CCO1)c1ccc(N2CCC(O)CC2)cc1 180486101 AWWHMLHAWOMESG-KXBFYZLASA-N 333.476 1.629 10 10 EDCE CC(C)(C)OC(=O)Nc1ccc([C@@H]2CS(=O)(=O)CCN2)c(O)c1 1952957106 TURHUNNULOOBJG-LBPRGKRZSA-N 342.417 1.798 10 10 EDCE CNc1ncnc(N2CCN(c3ccc(OC)cc3)CC2)c1[N+](=O)[O-] 40595572 RVALBLTZPKYPNQ-UHFFFAOYSA-N 344.375 1.762 10 10 EDCE CC(C)(C)OC(=O)N1CCN(c2cc3c(cc2N)OCC(=O)N3)CC1 384572638 YCSMYJOVVQLOLW-UHFFFAOYSA-N 348.403 1.657 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)N3CC[C@H](C)C3)cc2)CC1 800123734 ORYUNLFWSFPQRL-HNNXBMFYSA-N 344.459 1.907 10 10 EDCE Cn1cccc(C(=O)NCc2cc(Br)ccc2O)c1=O 804737001 AAHVRBWKDXSXDL-UHFFFAOYSA-N 337.173 1.783 10 10 EDCE COCCN1CC[C@H](NC[C@H]2CCN(c3ccc(OC)cc3)C2)C1 818220623 HQZMNAQWPCEADP-SJORKVTESA-N 333.476 1.832 10 10 EDCE COc1cccc(CNCCN2C(=O)c3ccccc3C2=O)c1O 725848696 CVRBTFLNDYEKSJ-UHFFFAOYSA-N 326.352 1.787 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CCc2nc[nH]c2C1 823296665 ZJSWPQXZYCKZQG-HNNXBMFYSA-N 340.427 1.668 10 10 EDCE Cc1c([C@@H](O)[C@@H](N)c2ccccc2O)c(Br)nn1C 2131551837 LZIUDCYNUOYHPX-NWDGAFQWSA-N 326.194 1.930 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCC(C)C)C2)cc1 826605021 UNECDFAYSSXBQY-CQSZACIVSA-N 333.432 1.552 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NC[C@@H](O)C(C)C)C2)cc1 824694176 PHDUBSBDWJHQDR-RHSMWYFYSA-N 335.448 1.838 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCCc1nnc2n1CCCCC2 588403614 REBCYNPPWKFKIM-VURMDHGXSA-N 342.399 1.788 10 10 EDCE CC1(C)CN(C(=O)NCCc2ccc(N)cc2)CCS1(=O)=O 841955936 RUOJDRWEBOFWAD-UHFFFAOYSA-N 325.434 1.030 10 10 EDCE COC(=O)c1cc(S(=O)(=O)NCc2cc(C)ccc2O)n(C)c1 918005461 YPLIFPMAZUBLOE-UHFFFAOYSA-N 338.385 1.304 10 10 EDCE O=S1(=O)CC[C@@]2(CN(Cc3cccc(Cl)c3O)CCO2)C1 843426503 XKUKWJCUIIBCSB-CQSZACIVSA-N 331.821 1.435 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)[C@]12C[C@H]3C[C@@H](C(=O)N1)[C@H]2C3 844396778 QVTXFQBJQOFHGC-GCUGWZBJSA-N 327.428 1.592 10 10 EDCE Nc1ccc(CC(=O)N[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)cc1 852864007 MOHGTZNAPWFEMU-IAGOWNOFSA-N 329.444 1.571 10 10 EDCE CON1CC[C@@H](OC(=O)c2csc(Cc3ccc(N)cc3)n2)C1=O 922599725 KUKKYDNBBRVLSM-CYBMUJFWSA-N 347.396 1.635 10 10 EDCE Cc1ccncc1S(=O)(=O)NC[C@H](N)c1ccc(N(C)C)cc1 850586899 JZMUNCMBCYCXLM-HNNXBMFYSA-N 334.445 1.434 10 10 EDCE C[C@]1(CCF)NC(=O)N(Cc2ccc(N3CCC(O)CC3)cc2)C1=O 853089490 QHPXSDFVQWHRMH-GOSISDBHSA-N 349.406 1.818 10 10 EDCE Cc1cccc(C(N)=O)c1NS(=O)(=O)c1cc(F)cc(F)c1O 753015322 CWGFFNZFAOKIEX-UHFFFAOYSA-N 342.323 1.879 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3cccnc3O)C2)cc1 858600043 SLBCPEXQHHKUPU-AWEZNQCLSA-N 342.399 1.874 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CC[C@@H](Cn2ccnn2)C1 853749428 RVWSENQRCYMFQM-OAHLLOKOSA-N 342.447 1.884 10 10 EDCE CC1(N2CCOCC2)CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 862958141 AKNRPWGWWALOTK-HWKANZROSA-N 346.427 1.824 10 10 EDCE COC(=O)[C@H](NCc1cc(F)c(N(C)C)cc1F)c1ccn(C)n1 862337470 AZZYHNOXABECHB-OAHLLOKOSA-N 338.358 1.768 10 10 EDCE CC(C)(C)C(=O)NCC(=O)OCCC(=O)N1Cc2cccc(O)c2C1 871198035 FPYFUWBLKRRPML-UHFFFAOYSA-N 348.399 1.330 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@@H](O)CC(F)(F)C2)cc1 787367868 LMKJAZKXPBIHIA-AWEZNQCLSA-N 327.375 1.071 10 10 EDCE COC(=O)[C@H]1CN(Cc2cc(C)cc(Br)c2O)CCO1 781912541 OOOFWBMUFVGOPT-GFCCVEGCSA-N 344.205 1.837 10 10 EDCE CCOC(CC(=O)NCc1ccc(N2CCOCC2)cc1)OCC 788647373 AZMSOKPMTKLJCO-UHFFFAOYSA-N 336.432 1.929 10 10 EDCE COc1cccc(CNC[C@@]2(O)[C@H]3[C@@H]4C[C@@H]5[C@@H]6C[C@@H]([C@@H]3[C@@H]64)[C@@H]52)c1O 785543668 HQJCPTJEPDXTGN-BZDODIBWSA-N 327.424 1.999 10 10 EDCE C[C@@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)CCN1CCO 897454906 IANJIUINQHLZNF-SNVBAGLBSA-N 336.413 1.451 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N(C)C)cc1)C1(S(C)(=O)=O)CC1 796621541 WFDVATGLNQDSLL-LBPRGKRZSA-N 339.461 1.518 10 10 EDCE CCn1nccc1CN(CCO)Cc1ccc(N2CCOCC2)cc1 793303942 HNIPMFRAUMPJNN-UHFFFAOYSA-N 344.459 1.734 10 10 EDCE CN1Cc2ccccc2[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C1=O 1147845125 LZAKSSXKSDAZSK-QGZVFWFLSA-N 326.352 1.470 10 10 EDCE COc1cnc([C@@H]2CCCN2C(=O)Cc2ccc(O)c(O)c2)nc1O 1304659119 ADSCCLFWGCBOTL-NSHDSACASA-N 345.355 1.508 10 10 EDCE CO[C@@H]1COC[C@@H]1N(C)c1cc(Br)c(CN)cc1F 2120774808 IHPRQOVUNSQIEV-QWHCGFSZSA-N 333.201 1.897 10 10 EDCE CC[C@@H](F)C(=O)NCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1299220366 VEVFVMCSCZFTMX-GFCCVEGCSA-N 349.366 1.976 10 10 EDCE C[C@H](NC(=O)c1ccc(-n2[nH]c(O)nc2=O)cc1)c1ccccc1O 1454818613 NHUCLVQKMUITGW-JTQLQIEISA-N 340.339 1.463 10 10 EDCE O=C(CCNC(=O)Cc1ccccc1)NCc1cccc(O)c1O 1455313970 BEKFZXZBIUGROF-UHFFFAOYSA-N 328.368 1.463 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@@H]2CC2(C)C)cc(OC)n1 1526500659 LRUZCGSXJSTTFZ-JQWIXIFHSA-N 335.404 1.379 10 10 EDCE COc1cc(CC(=O)NCc2cc(O)ccc2O)cc(OC)c1O 1471661252 LAKDREGCJDJFTH-UHFFFAOYSA-N 333.340 1.680 10 10 EDCE COC(=O)[C@H](Cc1ccccc1O)NC(=O)c1cccc(O)c1O 1470336136 SLJKEFVCYSWFJM-LBPRGKRZSA-N 331.324 1.318 10 10 EDCE C/C=C(\C)C(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1494015712 NURTVCVQNCKXPI-MIVRLDLISA-N 333.388 1.442 10 10 EDCE COC(=O)[C@@H](C[C@@H]1CCCOC1)NC(=O)Cc1ccc(O)c(O)c1 1648734815 YHFBOOAYQFNAPC-QWHCGFSZSA-N 337.372 1.115 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cc2nc[nH]n2)cc1C 1732921183 CROLSYMDXMQHBH-ARJAWSKDSA-N 329.404 1.126 10 10 EDCE O=C(NCCCSc1nccs1)N[C@@H]1CCc2ncnn2C1 153769146 GHKFYJRJZAVHIB-SNVBAGLBSA-N 338.462 1.531 10 10 EDCE COc1ccc(CN2CCCC[C@@H]2CCNS(C)(=O)=O)c(O)c1 159460546 HIWFHOBHSDITLK-CQSZACIVSA-N 342.461 1.695 10 10 EDCE O=C(O)[C@@H]1C[C@H](NCc2c(O)cccc2Br)CCO1 1880033276 FZLZJWBTNFFWTA-PELKAZGASA-N 330.178 1.877 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)NCCCCN=[N+]=[N-] 1963732031 FOHCVQOZQRYTCH-NSHDSACASA-N 327.385 1.829 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985094076 JTCQZFSBGFEWCS-LLVKDONJSA-N 327.385 1.375 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985100629 IEHNHYAWPMRTHO-OUAUKWLOSA-N 327.385 1.562 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)c(Br)c2F)[C@@H]2COC[C@H]12 2158361609 JODOSNFQQSJEND-MVWJERBFSA-N 345.212 1.897 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@]1(CO)C(=O)NCCCCN=[N+]=[N-] 2010390970 KTTDUCLQIPWADF-OAHLLOKOSA-N 341.412 1.955 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CC[C@H](CN=[N+]=[N-])C2)C1 2010404996 WIEOVMCDCRQURA-VXGBXAGGSA-N 339.396 1.781 10 10 EDCE Nc1ccc(CS(=O)(=O)NCC(=O)NCc2ccccc2)cc1 322145408 XOLUWQLAPXRFGI-UHFFFAOYSA-N 333.413 1.005 10 10 EDCE NCc1ccc(N2CC3(C2)OCCC[C@@H]3O)c(F)c1Br 2159649258 ZWFNPKDRYAIUQM-NSHDSACASA-N 345.212 1.777 10 10 EDCE NCc1ccc(N2CCC[C@@H](CO)[C@@H]2CO)c(Br)c1 709803707 DCRBNBVRGIBIGQ-FZMZJTMJSA-N 329.238 1.477 10 10 EDCE C[C@@H]1CN(C)C[C@@H](CNCc2c(O)cccc2Br)O1 706835097 QHOZVSANCHOCJD-GHMZBOCLSA-N 329.238 1.963 10 10 EDCE C[C@@H](O)CN1CCN(c2ccc(CN)cc2Br)CC1 2113859807 WIKWRUOTIQHNFZ-LLVKDONJSA-N 328.254 1.411 10 10 EDCE COc1ncc(Br)cc1NC(=O)c1cc(O)nc(O)c1 2240922160 NNLHTHZFCIMWIT-UHFFFAOYSA-N 340.133 1.911 10 10 EDCE C[C@H]1OC2(C(=O)N3CC(N=[N+]=[N-])C3)CC1(NC(=O)OC(C)(C)C)C2 2247287146 NDESMWLGXVEBAX-WFJJYUMRSA-N 337.380 1.722 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@]4(O)C[C@@H]4C3)c(Br)cc21 2280028208 OFESZZXLVSTCKU-UEXBWHTRSA-N 338.205 1.362 10 10 EDCE CC(=O)NC1=NC(=O)C(=C2C(=O)N(C(C)=O)c3ccccc32)S1 2293869316 DJCDBKUJPRKORV-UHFFFAOYSA-N 329.337 1.056 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)O)CC(NCc2ccccc2O)C1 2300209612 OANUCSPYDYFKCQ-UHFFFAOYSA-N 336.388 1.992 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CNC[C@H]2C)c(O)c1Br 2352627689 QUARNNUQIDGABY-MWLCHTKSSA-N 327.222 1.935 10 10 EDCE Cc1ccc(CNC(=O)[C@]23C[C@H](N)[C@@H]2C3)c(O)c1Br 2352933432 YZTOZCHOGGGBEJ-PKFCDNJMSA-N 325.206 1.817 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C[C@@](C)(N)CO 1952345614 FKMJPRLSMWCNRY-SJKOYZFVSA-N 340.420 1.633 10 10 EDCE CCN1CN(C(=O)c2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 191828995 JCTHOLSSPGOKRB-UHFFFAOYSA-N 348.358 1.724 10 10 EDCE c1cc(CN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)no1 93560956 VQQXTJYWTROFJQ-UHFFFAOYSA-N 342.443 1.829 10 10 EDCE C[C@H](Cn1cncn1)N1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 278056899 WVPDQYFAOGUAJS-SNVBAGLBSA-N 349.778 1.490 10 10 EDCE CCOC(=O)C[C@@H](O)CNCc1ccc(C)c(Br)c1O 2380738866 CMFYMASRXGVPQN-LLVKDONJSA-N 346.221 1.867 10 10 EDCE CCC(CO)(CO)C(=O)NCc1ccc(C)c(Br)c1O 2381136941 KGIFQDVDSMOPEI-UHFFFAOYSA-N 346.221 1.460 10 10 EDCE CCOc1ccc(CN2CCN(CC(F)(F)F)C(=O)C2)c(O)c1 809711578 ZLWRBPBFRWZHLL-UHFFFAOYSA-N 332.322 1.997 10 10 EDCE CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)/C=C/c1cccnc1 491302465 AYZUHXNHMKBQLO-QPJJXVBHSA-N 343.408 1.592 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@](O)(C(F)F)C2)c([N+](=O)[O-])c1 828752383 WMNULPDWUGGZBE-UYWPIULCSA-N 342.298 1.987 10 10 EDCE C[C@H]1Oc2cc(N)ccc2N(OCCOc2ccc(N)cc2)C1=O 821300732 YEPVETQYXCFRFM-LLVKDONJSA-N 329.356 1.976 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cn(CC2CC2)nn1 825393712 JLXZACUUCDHEHD-UHFFFAOYSA-N 341.415 1.455 10 10 EDCE Oc1cccc(F)c1CNC(=S)NCCCN1CCOCC1 905660201 FQXCIOBZTXHBSC-UHFFFAOYSA-N 327.425 1.218 10 10 EDCE COC(=O)C1CCC(S(=O)(=O)NCc2ccccc2O)CC1 914140986 VGELQXALRCYPGA-UHFFFAOYSA-N 327.402 1.543 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)C[C@H](C)OC)C2)cc1 849416304 OLKOKIJJXWZLBL-STQMWFEESA-N 328.434 1.228 10 10 EDCE CC1(CC(F)F)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 844007577 RIZKGLNZAYASNB-UHFFFAOYSA-N 348.371 1.881 10 10 EDCE COC[C@@H]([C@@H]1CCCOC1)N1C(=O)CN(Cc2ccccc2O)C1=O 925142503 OGAJNIALJQAJQF-CABCVRRESA-N 348.399 1.598 10 10 EDCE COc1ccc(N2CC[C@H](Nc3ncnc4c3nnn4C)C2)cc1 853760601 LBLJOJZFQKOPHN-NSHDSACASA-N 325.376 1.458 10 10 EDCE COc1ccc(N2CC[C@@H](NCc3cnc4n3CCOC4)C2)cc1 922238066 PZRKDWATEFCBOI-CQSZACIVSA-N 328.416 1.790 10 10 EDCE COc1cc(Br)cc([C@H](C)N[C@@H]2COCC[C@H]2O)c1O 866497474 MNUFBLSMUIZACC-XXILOJSOSA-N 346.221 1.964 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC12CCOCC2 769894696 XIPOCEAUOLOLQZ-UHFFFAOYSA-N 331.460 1.966 10 10 EDCE CC(C)(C)OC(=O)CSCC(=O)NCCc1ccc(O)c(O)c1 762263260 DAMYPHVPZPQSGE-UHFFFAOYSA-N 341.429 1.831 10 10 EDCE C[C@H](NC(=O)NCC1(CS(C)(=O)=O)CCC1)c1ccccc1O 868710019 ICDZYVYCXGRWCA-LBPRGKRZSA-N 340.445 1.967 10 10 EDCE CC(C)[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCN1C 866218545 RFCIFIYOHHKEOO-CQSZACIVSA-N 334.376 1.702 10 10 EDCE C[C@@H](NS(=O)(=O)c1c[nH]c(C(=O)O)c1)c1ccc(N(C)C)cc1 773983304 XJCJTDXNETXCRP-SNVBAGLBSA-N 337.401 1.818 10 10 EDCE CN(Cc1cn(C)nn1)c1ccc(CN)c(Br)c1F 689220373 VNQFRCSAIIIRIQ-UHFFFAOYSA-N 328.189 1.812 10 10 EDCE CN(C)S(=O)(=O)[C@H]1CCCN(Cc2cc3c(cc2O)CCC3)C1 795660049 YBZKUIOOQMZLJQ-INIZCTEOSA-N 338.473 1.737 10 10 EDCE CC(=O)O[C@H]1[C@H](OC(C)=O)[C@@H](N=[N+]=[N-])CO[C@]12COC(C)(C)O2 1083805114 YWEMWEKIXSKBDT-NOHGZBONSA-N 329.309 1.038 10 10 EDCE in-vitro C[C@@H](Sc1nnnn1C1CC1)C(=O)NCc1c(O)cccc1O 1304050080 IILQXYGDXODOMH-MRVPVSSYSA-N 335.389 1.216 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2nccnc2N)cc1C 1319167924 RBNODFGRHNYRDF-GFCCVEGCSA-N 343.431 1.532 10 10 EDCE Nc1ncc(Br)nc1NCCc1ccc(O)c(O)c1 2125884840 CHJRCZZVFZKCMY-UHFFFAOYSA-N 325.166 1.887 10 10 EDCE COC(=O)NC[C@H]1CCN1c1ccc(CO)cc1Br 2130740472 PPLRBLUSZMPCHR-SNVBAGLBSA-N 329.194 1.876 10 10 EDCE CCN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C1COC1 1915722292 VXWDMMRIDFGZAH-GFCCVEGCSA-N 327.178 1.660 10 10 EDCE CC[C@H](F)C(=O)NCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1299220368 VEVFVMCSCZFTMX-LBPRGKRZSA-N 349.366 1.976 10 10 EDCE NC(=O)c1ccc(/C=C\C(=O)NCc2ccc3cccnc3c2O)o1 1299724697 HEVOSAHOGDOZHP-VURMDHGXSA-N 337.335 1.962 10 10 EDCE C[C@@H](NC(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1)c1ccccc1O 1454808055 RZXLPPMCRNURMM-SECBINFHSA-N 325.324 1.413 10 10 EDCE CN1C(=O)c2cccnc2O[C@@H]2CN(Cc3ccccc3O)C[C@@H]21 1615259725 JUFGSRLKNSLIHK-GOEBONIOSA-N 325.368 1.505 10 10 EDCE CC(C)C[C@H](NC(=O)c1cc(O)cs1)C(=O)N1CCOCC1 1627415044 YXMMFMANPRDSIG-LBPRGKRZSA-N 326.418 1.457 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCNc1ccc([N+](=O)[O-])cc1 1629838520 AVQHJCPAOQQBBM-UHFFFAOYSA-N 331.328 1.777 10 10 EDCE CN(C)C(=O)/C=C/C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1624537098 HDXWEBLALOXTHW-CMDGGOBGSA-N 331.416 1.126 10 10 EDCE COc1ccc(CNC(=O)c2ccc3c(c2)N(C)C(=O)CO3)c(O)c1 1626080104 WLQSPNBNSOYBJM-UHFFFAOYSA-N 342.351 1.686 10 10 EDCE CN(C[C@@H](O)CNCC1CCC1)C(=O)c1ccc(N=NC(N)=O)cc1 1486319690 NBRKSBKBKKKDMD-HNNXBMFYSA-N 347.419 1.672 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2c(nc1O)CCOC2 1638348705 YHPDKRUYJAVGLF-SNVBAGLBSA-N 344.367 1.632 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC(n3ccnn3)CC2)cc1 1632279712 NISYDUCPBFNESQ-UHFFFAOYSA-N 327.348 1.918 10 10 EDCE COc1ccc(CNC[C@]2(NC(=O)C(N)=O)CCCC[C@H]2C)cc1C 1732259026 SCUVMHSGTYGLND-AUUYWEPGSA-N 347.459 1.644 10 10 EDCE Cc1c(C(=O)NCc2cc(O)ccc2O)nnn1Cc1ccncc1 1644753483 AEBFAQLRHJRUMO-UHFFFAOYSA-N 339.355 1.371 10 10 EDCE COc1ccc(CNC[C@H](C2CC2)N(C)C(=O)c2nc[nH]n2)cc1C 1734315524 QKSZHISMBJYVJY-OAHLLOKOSA-N 343.431 1.762 10 10 EDCE Cc1ccc(O)c(O)c1C[C@H](O)[C@@H]1C(=O)C[C@@H](O)[C@]2(C)C(=O)CC[C@@H]12 31541807 YFZJGCLOFUBQST-ZCGRFBNYSA-N 348.395 1.245 10 10 EDCE CCN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)[C@H](C)C(=O)NC 1691058829 KUUGTJCZCCTTPD-LLVKDONJSA-N 348.407 1.035 10 10 EDCE CN(C)C(=O)Cn1c(CC2CC2)nnc1N(C)Cc1ccccc1O 1696591329 JEWVGKMXJCPKCO-UHFFFAOYSA-N 343.431 1.661 10 10 EDCE OC/C=C/c1ccc2c(c1)O[C@@H](c1ccc(O)c(O)c1)[C@H](CO)O2 3645759 PPZYUSOIUGJLFB-QLJMBOKNSA-N 330.336 1.977 10 10 EDCE biogenic NCc1ccc(N2CCO[C@@H]3COC[C@@H]32)c(F)c1Br 1877648962 UNNIARFFDQEDGS-WDEREUQCSA-N 331.185 1.651 10 10 EDCE CC(C)(C)OC(=O)N(CCCO)CCC(=O)N1CC(N=[N+]=[N-])C1 1902571540 POMGUIFLYQEEIE-UHFFFAOYSA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)NCCCCN=[N+]=[N-])COC1 1963731869 BVQOXBJVXMUXKL-UHFFFAOYSA-N 327.385 1.734 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(C(=O)Cc3ccc(N)cc3)C[C@@H]21 2000284562 HZOHNLLBBMZQPI-FOLVSLTJSA-N 331.416 1.793 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(NCc2cccc(F)c2O)C1 2016030022 QMPUZBZGYFESAB-KRWDZBQOSA-N 340.395 1.993 10 10 EDCE C[C@H](N)c1ccc(N2CCN3C[C@@H](O)C[C@@H]3C2)cc1Br 405388419 LRBICTBYEKCTLZ-UHTWSYAYSA-N 340.265 1.724 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@]12CC[C@@H](C1)[C@@H](O)[C@H]2O 2176916919 KTWGTMJEEMUYED-PQKREGAFSA-N 346.196 1.658 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C[C@@H]1CO 708575225 BMPFGMYPAIFJBX-RBDZCENOSA-N 341.205 1.499 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4CCO[C@@H]4C3)c(Br)cc21 2172045189 PGCMTGDVCLPVOF-YLJLNXRRSA-N 338.205 1.626 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCOC[C@@H](C4CCC4)C3)c2n1 2063513327 UIFYYEAGQZXMJD-ZDUSSCGKSA-N 330.388 1.632 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@H]1CCC=C1Br 2196820759 YVEHPRUSMSZNEM-QWRGUYRKSA-N 341.205 1.525 10 10 EDCE Cc1ccc(O)c(CN=c2nc(CNC(=O)OC(C)(C)C)[nH]n2C)c1 2063130609 NZNCLPXFYBYFPM-UHFFFAOYSA-N 347.419 1.888 10 10 EDCE CN1CC2(CCN2c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2238596338 GOQDFTNGOKKZAU-GFCCVEGCSA-N 338.205 1.329 10 10 EDCE CSc1ncc(CNS(=O)(=O)[C@@H]2CCNC(C)(C)C2)s1 2284720962 JTEFNBIBUCAWAJ-SNVBAGLBSA-N 335.520 1.815 10 10 EDCE CCCNCc1ccc(N2CC[C@@H]2[C@H](O)CO)cc1Br 2286228775 QCWWWEOYOSQDOF-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE CN=c1cc[nH]cc1S(=O)(=O)NCc1cnc(SC)s1 2284701569 BKJONOIRTKZVDA-UHFFFAOYSA-N 330.460 1.202 10 10 EDCE CN(C)c1cccc(NC=C2C(=O)NC(=S)N(C3CC3)C2=O)c1 2296348811 NQOVBVIUKACVJY-UHFFFAOYSA-N 330.413 1.454 10 10 EDCE CC[C@H](C)N1C(=O)C(=CNc2ccccc2C(=O)O)C(=O)NC1=S 2297060051 ZIJNUKDAJHNQOF-VIFPVBQESA-N 347.396 1.722 10 10 EDCE CN(C)c1ccc(C=CC(=O)NCCCCN2CCOCC2)cc1 2320615637 KNVHZCMXLGYFPG-UHFFFAOYSA-N 331.460 1.994 10 10 EDCE CN(C[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccc2c(c1)OCO2 121295890 UKBCGDAHQPBVKM-LBPRGKRZSA-N 326.418 1.523 10 10 EDCE CC(=O)[C@@H](C[C@@H](N)Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952894732 ZBDLOSSHFLQUCF-QWHCGFSZSA-N 338.404 1.840 10 10 EDCE CCCS(=O)(=O)N1CCN(c2ccc(OC)c(OC)c2)CC1 41379822 UQADIWSVQBJFSC-UHFFFAOYSA-N 328.434 1.566 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@H]3CNC[C@H]32)c(O)c1Br 2380758770 XTWLXWXQRYKPED-QJPTWQEYSA-N 339.233 1.935 10 10 EDCE Cc1ccc(CN2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)c(O)c1Br 2381140869 QZHIPWGCUSGWRM-OXJKWZBOSA-N 342.233 1.922 10 10 EDCE Cn1ccc(-c2noc(-c3cc(NS(C)(=O)=O)ccc3O)n2)n1 904875418 CDJMRWKLUWHZFH-UHFFFAOYSA-N 335.345 1.214 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)N(C)CC3CC3)C2)cc1 849416296 OGRPOVKQNCZTJX-AWEZNQCLSA-N 339.461 1.450 10 10 EDCE CCN(Cc1cc(Br)ccc1O)C(=O)NCC1CNC1 841964409 FUVDQMYWYDDWMW-UHFFFAOYSA-N 342.237 1.906 10 10 EDCE Oc1ccccc1CN(Cc1ccco1)C[C@H](O)C1(O)CCOCC1 929973517 YOLAEESPOLTABA-SFHVURJKSA-N 347.411 1.890 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3CCN(C)CC3)C2)cc1 853684562 VYRYUCRCKRWOTQ-MRXNPFEDSA-N 346.475 1.915 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3n[nH]c4c3CNCC4)C2)cc1 852844366 TUKRDFLGPSYYBR-GFCCVEGCSA-N 341.415 1.073 10 10 EDCE CO[C@@H](CC(C)C)CS(=O)(=O)NNc1nc2cccnc2s1 857225819 SGNXBAQZGUHTDI-JTQLQIEISA-N 344.462 1.999 10 10 EDCE Cc1[nH]nc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1Cl 790981303 BWQLWIQVZDJREJ-UHFFFAOYSA-N 344.780 1.701 10 10 EDCE C[C@@]1(CO)C[C@H](O)CN1c1ccc(CN)c(Br)c1F 698201874 NBUHOMVKISCOPP-ZANVPECISA-N 333.201 1.369 10 10 EDCE Cc1cc(O)c(CN(C)Cc2nnc3c(=O)[nH]ccn23)c(Cl)c1 1333733216 CXCCLKODHRVDDP-UHFFFAOYSA-N 333.779 1.717 10 10 EDCE COC(C)(C)[C@H](C)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1332818834 TVCXQESVPPXBEO-ZDUSSCGKSA-N 347.459 1.615 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)cc1Br 2133919335 JVRZYXPEVZSIOV-PYJNHQTQSA-N 328.206 1.404 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@]3(C)CCNC3=O)CC2)cc1C 1277170150 JGRFALOMLDWSGU-GOSISDBHSA-N 345.443 1.268 10 10 EDCE C[C@H](NS(C)(=O)=O)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1440714743 NFQOPRWPPXPBFY-ZDUSSCGKSA-N 339.461 1.183 10 10 EDCE CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1440745788 ILUNBYAVHXRTIC-ZYHUDNBSSA-N 338.429 1.457 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2nncn2C)c1 1290708748 DXTPJRMLJDAGQP-UHFFFAOYSA-N 337.383 1.965 10 10 EDCE CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1293690606 ISLNFJNXZHGIMW-NWDGAFQWSA-N 327.402 1.112 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)C(C)(C)C(N)=O)C2)cc1C 1479374032 FXYXBKUVZFFLMO-SHTZXODSSA-N 347.459 1.500 10 10 EDCE CC(=O)Nc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cn1 1478544441 DIBHIKPLKFNZKU-UHFFFAOYSA-N 326.356 1.971 10 10 EDCE CS(=O)(=O)Nc1cccc(C(=O)NCc2c(O)cccc2O)c1 1558534625 TXJUUUIGKZDKPN-UHFFFAOYSA-N 336.369 1.399 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(N2CCCOC2=O)CC1 1636288007 CBXDJRADHKIKDB-UHFFFAOYSA-N 334.372 1.474 10 10 EDCE CS(=O)(=O)Nc1ccccc1C(=O)NCc1ccc(O)cc1O 1630302081 QOCRXPPOHSOXBW-UHFFFAOYSA-N 336.369 1.399 10 10 EDCE O=C(CCc1nc2ccccc2oc1=O)NCc1c(O)cccc1O 1635842995 DXVSEMMMQRBBLW-UHFFFAOYSA-N 340.335 1.848 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1cnns1 1567083019 AZRXYSPRTNVOBP-SECBINFHSA-N 347.404 1.609 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H]1CCCOC1 1567083508 MLLLXDDBLWTTBS-OLZOCXBDSA-N 347.419 1.984 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cccnc1N1CCOCC1 1651222111 ALBIQAQUYFERPW-UHFFFAOYSA-N 329.356 1.259 10 10 EDCE COc1ccc(N2CCN(C[C@H](C)CS(C)(=O)=O)CC2)cc1 162069995 PZMBHLCQWPYZGR-AWEZNQCLSA-N 326.462 1.498 10 10 EDCE NC(=O)c1ccc(/C=C/C(=O)NCCc2ccc(O)c(O)c2)cc1 156723312 CSRPWAWSEHAJGN-XBXARRHUSA-N 326.352 1.569 10 10 EDCE O=C(N[C@H](COCc1ccccc1)C(=O)O)c1cccc(O)c1O 1946561864 NEBICOPEUNCUHD-CYBMUJFWSA-N 331.324 1.498 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CC(=O)O)c1cc(O)c(O)c(O)c1 1951421997 REMNVAGMPWRFCR-VIFPVBQESA-N 327.333 1.886 10 10 EDCE COC(=O)[C@H](N)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951498416 RXTBSFQAMDBOPF-GXFFZTMASA-N 340.376 1.034 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ncns1)C(=O)NCCN=[N+]=[N-] 1985103655 YQJNCTOTJPNQCR-QMMMGPOBSA-N 341.397 1.400 10 10 EDCE CO[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NCCN=[N+]=[N-] 1986262038 MOGAYAJCIIJLQU-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N1CC(CNCc2ccccc2O)(C(N)=O)C1 1997023133 NOUFMSFVPJNFGT-UHFFFAOYSA-N 335.404 1.204 10 10 EDCE CC(C)CN(CCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2154258179 DNTCOEVXJRPXAL-ZDUSSCGKSA-N 342.237 1.856 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCN(CC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010393706 WIKCVQGSCKFNID-NWDGAFQWSA-N 338.412 1.497 10 10 EDCE COc1ccc([C@@H](C)N[C@H](CO)CNC(=O)OC(C)(C)C)c(O)c1 2011424305 HAGZLJDNCHEODA-NEPJUHHUSA-N 340.420 1.937 10 10 EDCE CNCc1ccc(N2C[C@H](C)O[C@H](CO)C2)cc1Br 300494024 OYGSTBDSNQJISA-GWCFXTLKSA-N 329.238 1.755 10 10 EDCE CN(Cc1c(O)cccc1Br)[C@@H]1COC[C@H]1C(=O)O 706649262 KJIQCYQOWKBKTM-MWLCHTKSSA-N 330.178 1.686 10 10 EDCE CN(C)C[C@@H]1CN(Cc2c(O)cccc2Br)CCO1 862211377 HBFFEIIWJXNPAK-LLVKDONJSA-N 329.238 1.917 10 10 EDCE Cc1cccc(CN=c2nc(CCNC(=O)OC(C)(C)C)[nH][nH]2)c1O 2063193442 YCYMFSUAYPSLBQ-UHFFFAOYSA-N 347.419 1.920 10 10 EDCE Cn1cnc(Br)c1C(=O)NCc1cc(N)ccc1O 2337280064 ZXGRSHOROPLFMC-UHFFFAOYSA-N 325.166 1.400 10 10 EDCE Cc1ccc(CN[C@H]2CCC(=O)NC2=O)c(O)c1Br 2352932456 NEQJPPLHGHPEGI-VIFPVBQESA-N 327.178 1.358 10 10 EDCE Cc1ccc(CN2CCN[C@@H]3COC[C@H]32)c(O)c1Br 2352945001 PIGMZEHIEZHNJL-VXGBXAGGSA-N 327.222 1.636 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CCS[C@@H](C)C3)CC2)cc1 171691745 UCLYYURVARIPNT-HNNXBMFYSA-N 349.500 1.781 10 10 EDCE COc1cc(N)c(N2CCSC[C@@H]2S(C)(=O)=O)cc1OC 213775611 HXGMRVFZBRHURE-ZDUSSCGKSA-N 332.447 1.210 10 10 EDCE C[C@@H]1COCCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 92775191 RYHQAIRGCLNEHZ-KRTXAFLBSA-N 326.194 1.626 10 10 EDCE COc1ccc(CCN[C@@H](O)Cc2ccc(O)c(O)c2)cc1OC 95934543 VINQZLXAPAFMRU-SFHVURJKSA-N 333.384 1.808 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2cc(Cl)cc(Cl)c2O)CCO1 529641958 KWAMSUYKUDEOCZ-NSHDSACASA-N 348.230 1.829 10 10 EDCE C[C@]1(C(=O)NCc2cccc(Br)c2O)CCC(=O)NC1 282331866 MVKKJNWJXVPDKV-AWEZNQCLSA-N 341.205 1.687 10 10 EDCE CO[C@@H]1COCC[C@H]1CC(=O)NCc1ccc(N2CCOCC2)cc1 294438288 GVAQQETWZHJQOQ-FUHWJXTLSA-N 348.443 1.581 10 10 EDCE CCOc1ccc(O)c(CN[C@@H]2CCC[C@H]2CNS(C)(=O)=O)c1 800310281 VRGRFYKYLOTKMQ-SWLSCSKDSA-N 342.461 1.598 10 10 EDCE Cc1c(Br)cc(C(N)=O)c(O)c1CN1CCN(C)CC1 642879875 DQHMHLZLMRSAAT-UHFFFAOYSA-N 342.237 1.309 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@@H](O)C(F)(F)C3)cc2)CC1 826957863 JLCRCZBGHNISRK-MRXNPFEDSA-N 325.403 1.640 10 10 EDCE COc1ccc(CNC(=O)Nc2cc(C)nnc2N(C)C)c(O)c1 824521446 FQTJOWUFTLULRA-UHFFFAOYSA-N 331.376 1.887 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)/C=C/C3CC3)cc2)C1 742566613 OEYPRSPIOWZILZ-JCVNQNCUSA-N 327.428 1.971 10 10 EDCE Cn1c2c(ccc1=O)[C@H](NCc1cc3c(cc1O)OCO3)CCC2 846106084 AXAFWHWSSOMZRL-CYBMUJFWSA-N 328.368 1.987 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(CCN(C)C)C(=O)C2)c1O 846012282 ZDYCTAFJQHEKJP-UHFFFAOYSA-N 325.840 1.560 10 10 EDCE CN1CC[C@H](C(=O)N(C)Cc2ccccc2O)[C@@H](c2cnn(C)c2)C1 849561193 HRAHDYUGYRPBRH-DLBZAZTESA-N 342.443 1.820 10 10 EDCE Oc1ccccc1CN(Cc1ccco1)C[C@@H](O)C1(O)CCOCC1 929973515 YOLAEESPOLTABA-GOSISDBHSA-N 347.411 1.890 10 10 EDCE CCO[C@@H](CS(=O)(=O)NCc1ccc(N(C)C)cc1)C1CC1 858883507 PNMIYBMCRRAXNR-INIZCTEOSA-N 326.462 1.987 10 10 EDCE C[C@@H](NC(=O)N1C[C@@H]2COC[C@]2(C(=O)O)C1)c1ccc(N(C)C)cc1 851651082 NSGYPAHFYQBSGD-RVZJWNSFSA-N 347.415 1.556 10 10 EDCE CCO[C@H](C)C(=O)NCc1cc(NC(=O)[C@@H](C)OCC)ccc1O 923124338 KXEZGFJUYXKRRK-VXGBXAGGSA-N 338.404 1.797 10 10 EDCE Nc1ccc(NC(=O)C(=O)NCC[C@@H]2CC[C@@H](C(F)(F)F)O2)cc1 927866615 BARSHTXRXARZHH-RYUDHWBXSA-N 345.321 1.824 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@H]1COCCN1CC(F)(F)F 928708530 NSQDFRHSIXVSKE-LLVKDONJSA-N 336.285 1.411 10 10 EDCE COC(=O)[C@](C)(CCF)NCC(=O)NCc1ccc(N(C)C)cc1 852579151 XWDJFWLZRBCDIF-KRWDZBQOSA-N 339.411 1.250 10 10 EDCE C[C@@H](NC[C@@H](O)CS(C)(=O)=O)c1cccc(C(F)(F)F)c1O 927023735 IVWLPGZFQINFOA-RKDXNWHRSA-N 341.351 1.467 10 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105653043 MFJDEICUSVELQW-GFCCVEGCSA-N 328.368 1.836 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NCc3ccc(O)c(O)c3O)[C@H]2C1 302104968 GOPXKJJBAJXOFA-PJXYFTJBSA-N 336.388 1.758 10 10 EDCE COc1nccc(C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)n1 1274837408 RZOHRVSMKUWFGI-CYBMUJFWSA-N 344.415 1.710 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4COCC[C@@H]43)c(Br)cc21 2357225171 CRWBUKWJCBXVLR-BITCUVMXSA-N 338.205 1.626 10 10 EDCE Cc1cc(=O)[nH]cc1C(=O)NCc1ccc(N2CCOCC2)cc1 123897940 LTXDFINEYZEFPZ-UHFFFAOYSA-N 327.384 1.450 10 10 EDCE CCOC(=O)CNCCCN1CCN(c2ccc(OC)cc2)CC1 194184168 LJHPWEUKAACDIM-UHFFFAOYSA-N 335.448 1.360 10 10 EDCE CC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(O)cc2Cl)s1 228651544 NCHKSVOXUAIPHQ-UHFFFAOYSA-N 348.793 1.656 10 10 EDCE CNS(=O)(=O)c1ccc2c(c1)CCN2Cc1cc(OC)ccc1O 191550469 CVEOSEZMNAPQMH-UHFFFAOYSA-N 348.424 1.872 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CN1CC(=O)NC1=O 264679472 KQEGUIMSSRCXEC-UHFFFAOYSA-N 344.415 1.187 10 10 EDCE CNC(=O)[C@H]1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 817638276 BAJHXBDMZPETCI-AWEZNQCLSA-N 326.400 1.697 10 10 EDCE Cc1ccc(Cl)cc1N(C)C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 492974722 RUYXNEGODUQGQE-SOFGYWHQSA-N 347.802 1.722 10 10 EDCE CC[C@H](O)CC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 822237793 JAYQLNWGUJJMMD-KRWDZBQOSA-N 349.475 1.485 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)Cc1cnnn1[C@@H]1CCCNC1 903872769 BYPIVAQYHAFXLZ-QGZVFWFLSA-N 328.464 1.901 10 10 EDCE C/C=C/[C@H](O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 901288642 YOKZUAYWHKFVNT-PHXNAMCJSA-N 343.471 1.772 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](O)c3ccccn3)C2)cc1 855227669 ZYYHMKSGXBCMPP-DYVFJYSZSA-N 327.384 1.519 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](O)c3cccnc3)C2)cc1 855223433 AAOPBSSGYYDBLK-RHSMWYFYSA-N 327.384 1.519 10 10 EDCE C[C@H](NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@H]1[C@H]2CN[C@H]1C2 925777329 MMRUWCNENYOLSQ-BIGGFVEDSA-N 342.487 1.474 10 10 EDCE CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855227042 SZZPPUPCDULGAK-JOQOYGCGSA-N 347.459 1.941 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N2CCC[C@H](C3CCC3)C2)cc1 851688049 PHSNIFNJXJYAEL-INIZCTEOSA-N 329.444 1.966 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)CC3CC3)CC2)cc1F 754039617 AKYMCHUCMVWYLC-UHFFFAOYSA-N 328.409 1.696 10 10 EDCE O=C(N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2)c1cccc(O)c1O 856084380 VHHVHFVPXCWRNX-HUUCEWRRSA-N 332.400 1.471 10 10 EDCE Nc1ccc(Cc2nc(C(=O)NCC34CC(CN3)C4)cs2)cc1 852866152 SZNRCAHZJYSDPM-UHFFFAOYSA-N 328.441 1.798 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3C[C@H]3C(C)C)nc12 772509553 WSUXEUFIRKETTH-NWDGAFQWSA-N 347.371 1.947 10 10 EDCE CN(C)C[C@@H]1CN(Cc2cc(F)cc(F)c2O)C[C@H]1CN(C)C 895419661 WLECFIVMWRPCPR-ZIAGYGMSSA-N 327.419 1.842 10 10 EDCE COc1ccc(CNS(=O)(=O)c2ccc3c(c2)N(C)CC3)c(O)c1 795362924 UKGHXESSXAZAGN-UHFFFAOYSA-N 348.424 1.872 10 10 EDCE CCn1nccc1CN(CCO)C(=O)/C=C\c1ccc(O)c(O)c1 794056996 MACUMFFQQUFNGK-XQRVVYSFSA-N 331.372 1.349 10 10 EDCE Cn1nccc1[C@@H]1C[C@@H](NC(=O)NCc2ccccc2O)CCO1 1228458806 LTVBKTQHIKTPIY-BBRMVZONSA-N 330.388 1.845 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)Cc2nc[nH]n2)cc1C 1319262588 ONRWMSQVCHPUEH-LBPRGKRZSA-N 331.420 1.206 10 10 EDCE CC(C)(C)OC(=O)c1cc(C(=O)NCc2cc(O)ccc2O)[nH]n1 1176754898 IVXWZPWQUTUUIF-UHFFFAOYSA-N 333.344 1.706 10 10 EDCE CC[C@@H]1C[C@H]1NC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1334207474 ANHDJNQPTCUEOB-XJKCOSOUSA-N 331.416 1.305 10 10 EDCE COc1ccc(CNC2(CNC(=O)C3(C(N)=O)CC3)CC2)cc1C 1277157702 IGUJAQJQDWBEHO-UHFFFAOYSA-N 331.416 1.008 10 10 EDCE CCc1ccc(S(C)(=O)=O)cc1C(=O)NCc1cc(O)ccc1O 1455357903 WYMLSAXMGHKBPU-UHFFFAOYSA-N 349.408 1.994 10 10 EDCE O=C(CNC(=O)COc1ccccc1)NCc1cccc(Cl)c1O 1606859849 AUJGCMGZYHTKKL-UHFFFAOYSA-N 348.786 1.857 10 10 EDCE CNCc1ccc(N2CC[C@@H](O)C[C@@H]2CO)cc1Br 2136084170 YRLCCAVJZRIPCW-CHWSQXEVSA-N 329.238 1.491 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2coc(C)n2)cc1C 1700938377 QGMZXGGGLGGPJJ-HNNXBMFYSA-N 347.415 1.523 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1485184518 ULXIAYUGIVSASL-DZGGMBSHSA-N 332.444 1.879 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@@H]2CCC(=O)N2)C2CC2)cc1C 1713123229 QPPDHRPUWNNRFB-HOTGVXAUSA-N 345.443 1.267 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)C1=C2CCCN=C2NN1 1622664100 GXWLPXILYASBSH-UHFFFAOYSA-N 326.400 1.441 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@@H]2CCN(C)C2)cc1C 1568709894 FYHKZKXPJSJYJO-NVXWUHKLSA-N 333.476 1.940 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cocn2)cc1C 1733612770 YFNFDMPXZOTFAH-UHFFFAOYSA-N 333.388 1.216 10 10 EDCE COc1cc(C(=O)NCc2cccc(O)c2O)c([N+](=O)[O-])cc1OC 1644708637 MOINRQBJPDXRGF-UHFFFAOYSA-N 348.311 1.953 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2cc[n+]([O-])cc2)cc1C 1676300932 ZZKRAUWVNGIDHA-OAHLLOKOSA-N 343.427 1.887 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(CO)CNCc1c(O)cccc1F 1876121776 AEVBALJHWVOJGJ-INIZCTEOSA-N 328.384 1.897 10 10 EDCE C[C@H](NCCn1cc(Br)nn1)c1ccc(O)cc1O 1878211423 VJZNACQNYHMOAC-QMMMGPOBSA-N 327.182 1.803 10 10 EDCE CC(C)(C)OC(=O)NC1C[C@@H]2C(C(=O)C(=O)C[C@H]3C[C@H](N)C3)[C@H]2C1 2003387505 AWITZCLERWQOJR-LFXOJQCLSA-N 336.432 1.801 10 10 EDCE C[C@@H]1CC[C@H]([C@H](NC(=O)OC(C)(C)C)C(=O)NCCN=[N+]=[N-])O1 1985101564 UQTHWMLDSMKOQP-MXWKQRLJSA-N 327.385 1.874 10 10 EDCE CC1(C)C[C@@H](O)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2154834266 ZXZISQSURMRQAX-KRTXAFLBSA-N 340.221 1.751 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CC(=O)Nc2ccc(N)cc2)C1 2022830061 LFZVJIMXAUUWOK-SMDDNHRTSA-N 335.404 1.825 10 10 EDCE NCc1cc(F)c(N2CCC[C@H](C(N)=O)C2)cc1Br 311502060 PMIHLKASEOQXGH-QMMMGPOBSA-N 330.201 1.749 10 10 EDCE [N-]=[N+]=NCCCNC(=O)CNC(=O)c1ccc(Br)cc1 701319560 SFIKHLHEUWEDPQ-UHFFFAOYSA-N 340.181 1.996 10 10 EDCE C[C@@H](C(=O)NCc1c(O)cc(O)cc1O)N1CCc2ccccc21 2064430821 FEICJMDMZSRVPI-NSHDSACASA-N 328.368 1.871 10 10 EDCE OCc1ccc(N2CCCN(C3COC3)CC2)c(Br)c1 2169579570 SEFUYFUWGIQWLK-UHFFFAOYSA-N 341.249 1.852 10 10 EDCE Nc1ccc(CC(=O)N2[C@H]3CC[C@H]2CN(C(=O)C(F)(F)F)C3)cc1 2044626813 LNFJFDSCCOSJFI-STQMWFEESA-N 341.333 1.575 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NC(=O)Cc2ccc(N)cc2)C1 2063348646 OMAJHFRBSSLVSK-LSDHHAIUSA-N 349.431 1.298 10 10 EDCE OCCO[C@H]1CCCN(c2ccc(CO)cc2Br)C1 2113855406 CENNIQDEEOGIRC-LBPRGKRZSA-N 330.222 1.919 10 10 EDCE CS(=O)(=O)[C@@H]1COC[C@H]1NCc1cc(Cl)cc(Cl)c1O 2207470562 MJQHAYDLPCMKNC-GHMZBOCLSA-N 340.228 1.601 10 10 EDCE COc1cc(Cl)cc(CNCCS(=O)(=O)C(F)F)c1O 2232497302 SGXUXLPPPIVQQL-UHFFFAOYSA-N 329.752 1.781 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cccc(NN)n2)s1 2284696035 AUSWIOIUHAQHFW-UHFFFAOYSA-N 331.448 1.024 10 10 EDCE Cn1nccc1CCNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2308911341 IAWNFFLNASDRGD-UHFFFAOYSA-N 340.427 1.629 10 10 EDCE CC1(NC(=O)C=Cc2ccc(N3CCOCC3)cc2)CCNCC1 2312028282 OLCHNXBBKOPTRC-UHFFFAOYSA-N 329.444 1.795 10 10 EDCE Cc1ccc(CNC2(C)CS(=O)(=O)C2)c(O)c1Br 2327626189 KDYZWEKOVHVNSM-UHFFFAOYSA-N 334.235 1.740 10 10 EDCE CCOC(=O)C1=C(COC)Nc2ncnn2[C@H]1c1ccc(O)c(O)c1 8476565 SIQDDPVLNGWWLJ-AWEZNQCLSA-N 346.343 1.168 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)NC(=O)C1(C)C 118881896 NGVAMIZDUZAFFZ-UHFFFAOYSA-N 346.431 1.432 10 10 EDCE C[C@@](NC(=O)OCc1ccccc1)(C(=O)O)c1cc(O)nc(O)c1 1952371827 GCJLWIZIKKEIEX-INIZCTEOSA-N 332.312 1.719 10 10 EDCE COC[C@H](O)CN1CCC(N[C@H](C)c2cc(F)ccc2O)CC1 186195208 WQFBLPOTXCVACO-IUODEOHRSA-N 326.412 1.654 10 10 EDCE CS(=O)(=O)NCC1CCN(Cc2cccc(Cl)c2O)CC1 289623856 WNIAUBSKRVDCQM-UHFFFAOYSA-N 332.853 1.807 10 10 EDCE CC1CCN(c2ccc(CNC(=O)[C@H]3CN(C)C(=O)N3)cc2)CC1 826861375 FJXAEOCDNNCVGC-MRXNPFEDSA-N 330.432 1.563 10 10 EDCE CN(Cc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCN2CCO[C@H]1C2 824501626 QOJKLWIIQXWKMW-OALUTQOASA-N 349.450 1.567 10 10 EDCE C[C@@H]1CC[C@H](O)CN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823520509 WOEXOORCYHWPGA-KDOFPFPSSA-N 347.459 1.703 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC(C)(C)C)C2 838088489 XUAZECPITRZRLZ-JHJVBQTASA-N 339.388 1.723 10 10 EDCE COc1c(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cnn1C 839472506 QQLRBWSDKUEBKQ-UHFFFAOYSA-N 344.415 1.538 10 10 EDCE COc1cc(Br)cc(CN2CCO[C@@H]([C@@H](C)O)C2)c1O 840979098 YZKZRAJVMKUSOD-NOZJJQNGSA-N 346.221 1.745 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)[C@H]4[C@@H](O)CCCN4C3=O)C2)cc1 849356359 DUEIVTQHKSYJNC-CWRNSKLLSA-N 345.399 1.061 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@@]3(O)CCCN(C)C3)C2)cc1 912293423 WHBQHKUYLLLMEY-KXBFYZLASA-N 347.459 1.237 10 10 EDCE COc1ccc(N2CCN(C(=O)CONC(=N)[C@H]3C[C@H]3C)CC2)cc1 848521224 SOWMFJJDSDHYTJ-CJNGLKHVSA-N 346.431 1.498 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CC[C@H](C2CC2)N1C(=O)OC(C)(C)C 845428149 JCCMQTRSWZSILF-OLZOCXBDSA-N 339.388 1.866 10 10 EDCE C[C@@H]1CCN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1338143978 FMNVDPAQNISPOK-GFCCVEGCSA-N 349.406 1.024 10 10 EDCE CO[C@@]1(CO)CCCN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 854003264 GXTHXFJZOSSOJN-KDOFPFPSSA-N 335.448 1.997 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)CCc3cn(C)nn3)C2)cc1 854981463 STCHMTUDQQHCDT-CQSZACIVSA-N 343.431 1.399 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3=CCCOC3)C2)cc1 852338934 GPGCRPRKDSJDBV-HNNXBMFYSA-N 331.416 1.920 10 10 EDCE C[C@]1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1(F)F 855799493 WAZZAQXNCQLFHM-GFCCVEGCSA-N 334.344 1.539 10 10 EDCE COc1ccc(N2CC[C@H](NCc3cnc(N(C)C)nc3)C2)cc1 850346010 PGJQAEAETAGKLC-HNNXBMFYSA-N 327.432 1.920 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCc3ccnn3C)C2)cc1 855223597 BDADCWPGMPZAEW-AWEZNQCLSA-N 328.416 1.756 10 10 EDCE COc1ccc(N2CC[C@H](N=c3nc4[nH][nH]cc-4c(O)n3)C2)cc1 853758137 AHMCQNXPYZCXDI-JTQLQIEISA-N 326.360 1.131 10 10 EDCE COc1ccc(N2CCN(C[C@H]3CCC4(CNC4)O3)CC2)c(OC)c1 866696972 DZNHDJMLRFDJJP-MRXNPFEDSA-N 347.459 1.347 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCNC2=O)c1 862152862 DSSSCSUIIMOQQI-INIZCTEOSA-N 325.368 1.525 10 10 EDCE O=C1N[C@@]2(CCSC2)C(=O)N1Cc1ccc(N2CCOCC2)cc1 761067301 AYPDFVZYZHEISX-QGZVFWFLSA-N 347.440 1.451 10 10 EDCE C[C@@H](NCc1cc(Br)ccc1O)c1nnc(O)n1C 895179735 JFKADISFEMHMHT-SSDOTTSWSA-N 327.182 1.840 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@]2(C)CCC(=O)N2)cc1C 1317406032 QKESEZCRPPLXBG-KUHUBIRLSA-N 347.459 1.657 10 10 EDCE CN1C(=O)NCC12CN(c1ccc(CO)cc1Br)C2 2121180533 BPUWPJQCDQODSR-UHFFFAOYSA-N 326.194 1.155 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@@H]2CC2(F)F)cc1 1328589483 AUVUILYOMQYRHE-GFCCVEGCSA-N 325.359 1.530 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@@H]2[C@@H](O)CO)cc1Br 2123209826 JUVDWNYYPMTEGR-FZZIBODNSA-N 329.238 1.791 10 10 EDCE COc1cccc(CNC(=O)N[C@H]2CCO[C@H]2c2nc(C)no2)c1O 1253813527 DTQNPYDZICMKCK-SMDDNHRTSA-N 348.359 1.422 10 10 EDCE C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1332018399 GBBACTJVXDJTFD-WFASDCNBSA-N 331.416 1.033 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CC[C@H]3C[C@H]2CO3)cc1 1262223156 LUSKNHBGBQONDF-VYDXJSESSA-N 345.443 1.300 10 10 EDCE CO[C@H](C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1)C(C)C 1292894291 JVHZPVWRBWNPNQ-ZDUSSCGKSA-N 349.391 1.366 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1cccc(-n2cncn2)n1 1456227591 CUFYPFKQYCPTCH-UHFFFAOYSA-N 336.399 1.967 10 10 EDCE COc1ccc(CNC(=O)c2cc3c(nc2O)CCOC3)c(O)c1 1626079659 KJLNBYCWDOOOGZ-UHFFFAOYSA-N 330.340 1.504 10 10 EDCE CN1CCC(N2CC[C@@H](N(C)C(=O)Cc3ccc(O)c(O)c3)C2)CC1 1628813635 FBJMTBVTTLHQJH-MRXNPFEDSA-N 347.459 1.267 10 10 EDCE C[C@H](NCCN1CCOC[C@H]1C)c1ccc(N2CCOCC2)cc1 1559709880 UQLBQRZRTIXXRA-SJORKVTESA-N 333.476 1.895 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCS(=O)(=O)[C@@H]2CCCC[C@H]21 1631521167 WARLZQNQBYTQLW-IUODEOHRSA-N 339.413 1.209 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cccc(-n2cncn2)n1 1595752102 NUMGNTKUBRATQP-UHFFFAOYSA-N 325.328 1.046 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2[nH]nnc2C)cc1C 1676396975 LPXJVYNIRFJJAH-LBPRGKRZSA-N 331.420 1.680 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1ccc([N+](=O)[O-])c(CO)c1 1946867230 IIFBOMIQGBNKBX-UHFFFAOYSA-N 329.356 1.840 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](C(=O)NCCCN=[N+]=[N-])CO1 1964885303 YVQHXCAIPBNANT-GHMZBOCLSA-N 327.385 1.733 10 10 EDCE CN1C(=O)N[C@H]2CN(c3ccc(CO)cc3Br)CC[C@H]21 2171298604 XHPKBYPBDUHSOK-WCQYABFASA-N 340.221 1.544 10 10 EDCE CCN(CC)C(=O)[C@H]1CCCN1C(=O)c1cnn2c(O)cc(C)nc12 2062102598 LFRGPUDOUMDYGF-CYBMUJFWSA-N 345.403 1.216 10 10 EDCE NC[C@@H]1C[C@H](O)CN1Cc1cc(Cl)cc(Br)c1O 2067383609 RQWPUCQLWRJSCJ-UWVGGRQHSA-N 335.629 1.702 10 10 EDCE CS(=O)(=O)C[C@@H]1CCN(c2ccc(CO)cc2Br)C1 2087364476 LATZYTJUZZDBCS-LLVKDONJSA-N 348.262 1.812 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2205616968 WQZLPOAJSJDEMI-IHRRRGAJSA-N 347.228 1.439 10 10 EDCE NCc1ccc(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)cc1Br 2314952957 FWYKEPXRBMAEIY-JOYOIKCWSA-N 331.235 1.141 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2329332506 MELQUKUGBSFLIO-SLZGKSLHSA-N 327.222 1.399 10 10 EDCE CN(Cc1nnn(C)n1)c1ccc(CN)c(Br)c1F 1893030958 YLNIFENQPZCQCF-UHFFFAOYSA-N 329.177 1.207 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccccc2)cc1C 1272352995 XAZKBKLCLNSPNW-QGZVFWFLSA-N 328.412 1.884 10 10 EDCE COC(=O)CC[C@@H](N)c1cccc(I)c1O 95780798 PVGDAXXCGIZEEW-SECBINFHSA-N 335.141 1.950 10 10 EDCE COCc1nc([C@H]2COCCN2Cc2cccc(OC)c2O)no1 374802448 QUPRTIAEJDBFTF-GFCCVEGCSA-N 335.360 1.504 10 10 EDCE O=C(NCCc1cn[nH]c1)NCc1ccc(N2CCOCC2)c(F)c1 290899096 UXKZJPDTGHODQA-UHFFFAOYSA-N 347.394 1.427 10 10 EDCE Cn1cnnc1COCC(=O)NCc1ccc(N2CCCC2)cc1 293398188 HIRMLHILQRQNJL-UHFFFAOYSA-N 329.404 1.248 10 10 EDCE Cc1ccc(CN2CCNC[C@H]2CC(N)=O)c(O)c1Br 2381135808 WPIQVFSQSGXHGI-LLVKDONJSA-N 342.237 1.112 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC(C)(OC)C3)c(Br)cc21 382929832 JJOKIRIUIVWHRH-GFCCVEGCSA-N 340.221 1.887 10 10 EDCE CN[C@H](C)c1ccc(N2CCOC[C@H]2C(N)=O)c(Br)c1 723151361 XRJDYOJFEIDIBD-RNCFNFMXSA-N 342.237 1.420 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cn([C@@H]3CCCNC3)nn2)cc1 825973560 LJZUPCDSOQEFRS-OAHLLOKOSA-N 328.420 1.199 10 10 EDCE c1cn(C[C@@H]2CCN(Cc3ccc(N4CCOCC4)cc3)C2)nn1 826845815 LWKSRIDETBMDTP-QGZVFWFLSA-N 327.432 1.637 10 10 EDCE CC[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCN1C[C@H](C)O 588406569 DKMFXTAGDICOQI-HIINFBLBSA-N 334.416 1.415 10 10 EDCE Cc1cc(O)c(CNCC[C@H]2CNCCS2(=O)=O)c(Cl)c1 903970351 VTPKEEZEDIBUJJ-NSHDSACASA-N 332.853 1.220 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2coc(S(C)(=O)=O)c2)c1 845833223 KHHZXYDVBUPZEG-VIFPVBQESA-N 339.369 1.888 10 10 EDCE Cc1cnc(N)c(S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)c1 842783724 BWNSTJWZSRRKHD-CQSZACIVSA-N 349.460 1.017 10 10 EDCE C[C@@H](NCC[C@]1(O)CCOC1)c1ccc(N2CCOCC2)c(F)c1 846194163 LVOULKPCIBMESV-KDOFPFPSSA-N 338.423 1.854 10 10 EDCE CCN(CC)c1ccc(CN(C)CCN2C(=O)CN(C)C2=O)cc1 851716658 OYWIVASFTDPTOO-UHFFFAOYSA-N 332.448 1.859 10 10 EDCE COC(=O)c1cc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c[nH]1 855226667 PNVISLKCRKTZCF-ZDUSSCGKSA-N 343.383 1.819 10 10 EDCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(C)cc(C)c1O 754741022 NXRCYZZKCFTJJR-WCVJEAGWSA-N 347.411 1.934 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CC34CCNCC4)C2)cc1 852843564 BFNUXDXDAQSYJS-PBHICJAKSA-N 329.444 1.780 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3cc(C)ncn3)C2)cc1 852227268 ABJRKKSCNTYOKL-AWEZNQCLSA-N 341.415 1.872 10 10 EDCE CO[C@@H](CS(=O)(=O)N[C@@H](C)c1ccccc1O)C1CCOCC1 867836238 KSHUSFGSRMEDIS-LRDDRELGSA-N 343.445 1.814 10 10 EDCE CCc1cccc(CN[C@H]2CCN(c3ccc4nncn4n3)C2)c1O 862481278 FCWHUTYRZQRKCV-HNNXBMFYSA-N 338.415 1.761 10 10 EDCE COc1cc(NC(=O)NCCc2ccc(O)c(O)c2)cnc1OC 861415827 TZAALTDFZQVFIE-UHFFFAOYSA-N 333.344 1.874 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1CCN(C2CCOCC2)C1=O 779529579 FESDWPNMWUXTAW-XBPVQUQDSA-N 346.383 1.007 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@](O)(C4CC4)C3)C2)cc1 1118545090 IFZADAZVBQXAET-KXBFYZLASA-N 345.443 1.830 10 10 EDCE CN(C)c1ccc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1F 872255724 LKAXJYXAOVWMIH-XKQJLSEDSA-N 348.422 1.259 10 10 EDCE Cc1cccc(CNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n1 788153191 KEZPKQLXPPUNNJ-UHFFFAOYSA-N 344.390 1.528 10 10 EDCE COC(=O)C1(O)CN(Cc2cc(Br)cc(F)c2O)C1 895466132 DRZNMSDZGJTVBU-UHFFFAOYSA-N 334.141 1.014 10 10 EDCE CN[C@H](C)c1ccc(N2CC(O)(C(=O)OC)C2)cc1Br 714438604 GRYYNKSHLLSVGY-SECBINFHSA-N 343.221 1.454 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)Nn1ccc(O)nc1=O 1301695919 BJQUPCJYLNJFCK-UHFFFAOYSA-N 330.369 1.802 10 10 EDCE C[C@](NCCCN=[N+]=[N-])(C(N)=O)c1ccncc1Br 2120063168 GQEXNMYXJPFXJA-LLVKDONJSA-N 327.186 1.835 10 10 EDCE O=C1NC(=O)C2(CCC(C(=O)N3Cc4cccc(O)c4C3)CC2)N1 1332242687 GCSICOHRAIHJKU-UHFFFAOYSA-N 329.356 1.003 10 10 EDCE C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1332018388 GBBACTJVXDJTFD-DOMZBBRYSA-N 331.416 1.033 10 10 EDCE COC(=O)CN(C(=O)/C=C(\C)c1cnccn1)c1cccc(C)n1 1435259698 GLLNNQLGRIIVPR-FMIVXFBMSA-N 326.356 1.790 10 10 EDCE COC(C)(C)[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1354413140 DFOSNLMRKPTQJR-CQSZACIVSA-N 347.459 1.833 10 10 EDCE CC(C)[C@H](NC(N)=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1441135415 WWZYJMIBHASJHY-INIZCTEOSA-N 332.448 1.937 10 10 EDCE C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1616983754 OYMBKFHIKJCGIK-ZDUSSCGKSA-N 346.435 1.605 10 10 EDCE CN1CCN(c2ccncc2NC(=O)c2cccc(O)c2O)CC1 1542206523 SXAARXPKHXXLCG-UHFFFAOYSA-N 328.372 1.497 10 10 EDCE O=C(CCNCc1cc(Br)ccc1O)N1CCOCC1 227440989 YGFPDVJEXUKKDR-UHFFFAOYSA-N 343.221 1.493 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CC[C@H](CNCCO)C2)cc1 1700914059 VGYQJKCBJPIBJJ-SMDDNHRTSA-N 333.392 1.329 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H]3[C@H](C2)C3(F)F)c1 1620707691 MHSFRKXBSNKZKQ-QWRGUYRKSA-N 346.355 1.491 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)CCC(F)F)cc1 1720146122 FUGDACLZYPLNCL-UHFFFAOYSA-N 341.318 1.740 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1cnc(O)n1C 1497437622 VVPQQEZUICPSTP-UHFFFAOYSA-N 346.431 1.695 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cnn(C)c2N)cc1C 1495649285 JEYUAVJHHFMYNU-LBPRGKRZSA-N 345.447 1.475 10 10 EDCE COCCN[C@@H](C)[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1724565388 XADAVGXAFUGQGT-GXTWGEPZSA-N 347.419 1.936 10 10 EDCE CC[C@@H](CN(C)CCNC(=O)c1ccc(N=NC(N)=O)cc1)OC 1492887280 HRQMWXMNDNHVHZ-AWEZNQCLSA-N 335.408 1.936 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccc(OCC(N)=O)c1 1634938693 HEFWMSFGBPERGJ-UHFFFAOYSA-N 349.383 1.672 10 10 EDCE Cn1ccnc1CN1CCC(C(=O)NCc2c(O)cccc2O)CC1 1647270244 PEROVOGYHUTXBE-UHFFFAOYSA-N 344.415 1.360 10 10 EDCE COc1ccc(N2CCN(c3ncnc4c3nnn4C)CC2)cc1 4331088 HGSOLTPBXYKOLK-UHFFFAOYSA-N 325.376 1.094 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](OCC(N)=O)C2)cc1Br 2145369464 CCJXKNZQLGCPJX-ONGXEEELSA-N 343.221 1.583 10 10 EDCE CCNCc1ccc(N2C[C@H]3C[C@@]2(CO)CO3)c(Br)c1 2151003903 QAJZLZCTSXTWEU-IUODEOHRSA-N 341.249 1.899 10 10 EDCE C[C@H](O)c1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)c(Br)c1 2146313410 JTBBXLIYQYTPDU-NZVBXONLSA-N 342.233 1.684 10 10 EDCE COC[C@](C)(NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985101139 OEPZGQVATHMPEZ-YGRLFVJLSA-N 327.385 1.827 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985103835 AWFFHYWPECTCTE-DCAQKATOSA-N 327.385 1.419 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985103204 RNPVNYZIHFXKRZ-WDEREUQCSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1CC(=O)N1CC(N=[N+]=[N-])C1 2010389713 TZWRAAQVFCVXJE-JQWIXIFHSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CC=CCN1C(=O)c1cc(O)c(O)c(O)c1 2015120354 RUCHHPHWIUTRBP-UHFFFAOYSA-N 336.344 1.968 10 10 EDCE CN(C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1ccnnc1 2022929007 HWAHCSXZIGCELJ-CHWSQXEVSA-N 334.376 1.024 10 10 EDCE O=C1C[C@H](NCc2cc(Cl)cc(Br)c2O)C(=O)N1 2034960220 ZRNHBPMMASFEAM-QMMMGPOBSA-N 333.569 1.313 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@@H](O)C[C@H]32)c(F)c1Br 2185305611 GOQVOXGEOPYHRY-MVWJERBFSA-N 345.212 1.775 10 10 EDCE COC(=O)NC[C@@H]1CCN1c1ccc(CN)c(Br)c1F 2187295060 WACSDNVQOLQNML-VIFPVBQESA-N 346.200 1.982 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)c(Br)c1 2102178882 XJSYVIIMEXTKMQ-HUJUBCJISA-N 328.206 1.698 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@@H](N(C)C)C2)c(Br)c1 2089918696 JFJBQVQHWGCFIG-KBPBESRZSA-N 328.254 1.280 10 10 EDCE COc1ccc(N(C)CCOCCO)c(OC)c1Br 2226548122 ZAGMPNWHLBNBSQ-UHFFFAOYSA-N 334.210 1.911 10 10 EDCE CC1(C)OCCN(c2ccc(CN)c(Br)c2)[C@@H]1CO 2267684229 BTRULWLDINLUJO-CYBMUJFWSA-N 329.238 1.884 10 10 EDCE CN[C@@H]1CCCC[C@@H]1S(=O)(=O)NCc1cnc(SC)s1 2284502412 WWHMFKYDBBELMF-MNOVXSKESA-N 335.520 1.815 10 10 EDCE CCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1ccccc1OC 491290961 KFNNUYNVJJTEAB-KHPPLWFESA-N 343.383 1.159 10 10 EDCE CO[C@H](CNC(=O)Nc1ccc(N)cc1)CNC(=O)OC(C)(C)C 2301725359 NLDVWXBXHPYUTL-CYBMUJFWSA-N 338.408 1.930 10 10 EDCE NC(=O)c1cccc(N)c1N[C@@H](CCO)COCc1ccccc1 2303654439 NWXHJDWZCVBPKY-AWEZNQCLSA-N 329.400 1.747 10 10 EDCE C[C@H](C(=O)NCC(=O)O)N1C(=O)C(=Cc2ccco2)SC1=S 2314837045 NLMXUHSULGKXSU-SSDOTTSWSA-N 340.382 1.070 10 10 EDCE CC(=O)N[C@@H](C)C(=O)NCc1ccc(C)c(Br)c1O 2352640599 KQYBILXTPKSGQB-QMMMGPOBSA-N 329.194 1.604 10 10 EDCE COCCCN1C(=O)N=C(O)/C(=C/Nc2cccc3nonc23)C1=O 102698812 PLSLNPUFGURLMD-HJWRWDBZSA-N 345.315 1.474 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCC(=O)NCc1ccco1 115664725 GFJFKDFCDOEBIF-UHFFFAOYSA-N 344.415 1.770 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)NCCn1cccn1 114682082 HKHSVBGLFKITIW-QPJJXVBHSA-N 326.400 1.549 10 10 EDCE CC(C)NC(=O)NCCN1CCN(Cc2cc(F)ccc2O)CC1 180018781 JCZBSQAXFKBQHY-UHFFFAOYSA-N 338.427 1.357 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](CC(C)C)NC(N)=O)CC2)cc1 70719019 OZPISVBWEQZXKQ-INIZCTEOSA-N 348.447 1.427 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1ccc(C(N)=O)cc1 183437526 WVLQZUQXBBTDHW-LHXVZLOVSA-N 340.379 1.957 10 10 EDCE CCOc1cccc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)c1O 289379161 MICYWNVUIKXZDE-AWEZNQCLSA-N 342.461 1.647 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@H]1COCCN1CC(F)(F)F 287847745 DECGBMFHUNLAPT-LLVKDONJSA-N 348.321 1.020 10 10 EDCE Cc1cc(NS(=O)(=O)c2cc(F)cc(F)c2O)ccc1C(N)=O 821178760 VPGXIMKLMICUMH-UHFFFAOYSA-N 342.323 1.879 10 10 EDCE CN(Cc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCN2CCO[C@H]1C2 824501625 QOJKLWIIQXWKMW-MOPGFXCFSA-N 349.450 1.567 10 10 EDCE O=C(C[C@H](O)C(Cl)(Cl)Cl)NCc1ccc(O)c(O)c1 907062014 ZPLWQKMPSSSFDF-VIFPVBQESA-N 328.579 1.835 10 10 EDCE C[C@@H](CO)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 838740322 VBKVXCYGAQYTMK-NSHDSACASA-N 343.374 1.324 10 10 EDCE COc1ccc(N(C)Cc2cnnn2[C@@H]2CCCNC2)cc1OC 903905719 MDYDGZPSLGRPLJ-CQSZACIVSA-N 331.420 1.856 10 10 EDCE COCCCOC1CN(Cc2ccc(N3CCN(C)CC3)cc2)C1 839134711 UZMGHDFGXGHWAE-UHFFFAOYSA-N 333.476 1.676 10 10 EDCE Cc1cn(CC(=O)NCc2ccc(O)cc2O)nc1C(F)(F)F 910956007 IXVZIDQDOLTCBW-UHFFFAOYSA-N 329.278 1.938 10 10 EDCE CCn1cncc1S(=O)(=O)NCc1ccc(N2CCCC2)cc1 748674496 BDACISHTRNWSGW-UHFFFAOYSA-N 334.445 1.982 10 10 EDCE CCN(CC)S(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849415558 BUCONWSVAHUPEW-ZDUSSCGKSA-N 327.450 1.450 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)N3CCC[C@@H]3C)C2)cc1 849416061 KBYJTZWAHVJNSA-KBPBESRZSA-N 339.461 1.593 10 10 EDCE C[C@H]1[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)CCN1C 914336501 ZMKBWMQVHIAQAZ-WMLDXEAASA-N 332.448 1.415 10 10 EDCE CC[C@@H](NCC[C@@H]1CNCCS1(=O)=O)c1ccc(N(C)C)cc1 925796521 OVHBBBQSVXFAAM-IAGOWNOFSA-N 339.505 1.570 10 10 EDCE C[C@H](NC(=O)N1C[C@H](C)N(CCO)C[C@@H]1C)c1ccc(N(C)C)cc1 842181865 CIRKVGMUGMIJRP-JYJNAYRXSA-N 348.491 1.910 10 10 EDCE COC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 855225047 NMEQAXSVPYAKIY-RRFJBIMHSA-N 346.427 1.979 10 10 EDCE Oc1cccc(Cl)c1CN[C@@H]1CCN(c2ccc3nncn3n2)C1 858243450 HWTNUCMIHPKMHW-LLVKDONJSA-N 344.806 1.852 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1c(C)nn(C)c1C 754488427 KBJNIHWMCBAJFT-UHFFFAOYSA-N 343.431 1.666 10 10 EDCE CCO[C@H](COC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 859520817 XWYIHFJOCHWIAZ-CQSZACIVSA-N 343.401 1.736 10 10 EDCE CN(C)c1ccc(CNC(=O)c2c[nH]nc2[C@H]2CCNC2)cc1F 852799815 VKMSMDYRAHUJSM-LBPRGKRZSA-N 331.395 1.622 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3c(CO)noc3C)C2)cc1 855227179 UDICNGTWWHDQRJ-LBPRGKRZSA-N 331.372 1.493 10 10 EDCE CCn1ncc(CNC(=O)NCc2ccc3c(c2)CCCN3C)n1 858661524 UMWCGTCSDQWATD-UHFFFAOYSA-N 328.420 1.680 10 10 EDCE COc1ccc(O)c(CNC[C@H]2CN(Cc3ccncc3)CCO2)c1 862535980 BKFSKJIZHVZXFV-SFHVURJKSA-N 343.427 1.786 10 10 EDCE COc1cccc(CNC(=O)[C@@H]2OCCO[C@@H]2C(F)(F)F)c1O 866762801 CROYPWJLSITNAD-NEPJUHHUSA-N 335.278 1.363 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@@H](C)Oc2cccc(CO)c2)c1 764265005 JFZBHVVXYIABGV-GFCCVEGCSA-N 331.368 1.977 10 10 EDCE COc1cccc(CNC(=O)C(=O)Nc2cnn(C)c2C2CC2)c1O 770747314 LHDCMAOAXSWKQX-UHFFFAOYSA-N 344.371 1.267 10 10 EDCE COC[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@H](C)O1 784007255 AMQLAKRFVPPIFS-ZJUUUORDSA-N 337.332 1.166 10 10 EDCE COc1ccc(CN[C@H](C)c2nnc(O)n2C)cc1Cn1cccn1 895172968 YGXCFYZFYYOHNG-GFCCVEGCSA-N 342.403 1.625 10 10 EDCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@H](C)S1=O 790798905 FAOFQMXGGSWFKW-IUCAKERBSA-N 339.373 1.271 10 10 EDCE CN(Cc1ccccc1)C[C@H](N)C(=O)N(C)Cc1ccccc1O 705288997 NUSHFKFQMSCWOD-KRWDZBQOSA-N 327.428 1.810 10 10 EDCE CC(C)C[C@H]1C(=O)NCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1138353619 VSEYTHKGTXDTAV-ZDUSSCGKSA-N 331.376 1.836 10 10 EDCE CN1CC[C@@H](N(C)c2ccc(CN)c(Br)c2F)C1=O 690230839 DQYHVKGFHLHXQQ-SNVBAGLBSA-N 330.201 1.714 10 10 EDCE C[C@@H]1C(=O)N(NC(=O)c2cc3cc(O)c(O)cc3s2)C(=O)N1C 1148186878 JGZYDZVZBBXODO-ZCFIWIBFSA-N 335.341 1.240 10 10 EDCE CCCCNC(=O)[C@@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1142787078 NGPRSXPXBRGRSF-CQSZACIVSA-N 334.416 1.795 10 10 EDCE Cc1cc(C(=O)NCc2c(O)cccc2O)nn1C1CCOCC1 1304053302 HARZWWJJESFRJR-UHFFFAOYSA-N 331.372 1.884 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2CCNC(=O)C2)cc1C 1317390329 OESYPYVAIGRMJK-GOEBONIOSA-N 347.459 1.514 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C[C@H]1F 1257535425 IOPQCXFCFXDMDC-BXUZGUMPSA-N 339.386 1.714 10 10 EDCE CC[C@H](CNC(=O)[C@H]1CCCC(=O)N1)NCc1ccc(OC)c(C)c1 1267809885 VKXQFSVTKUUGGH-HZPDHXFCSA-N 347.459 1.657 10 10 EDCE COC(=O)c1cccc(OC)c1N(C)C(=O)/C=C/c1cn(C)cn1 1269404664 GSRBJHRQDFJRAZ-CMDGGOBGSA-N 329.356 1.892 10 10 EDCE C[C@]1(CO)COCCN(c2ccc(CO)c(Br)c2)C1 2135075453 APOYBNDUZSGXLV-AWEZNQCLSA-N 330.222 1.777 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)/C=C\c2ccco2)cc1C 1485970914 WPAFAQPSBXFOQB-QKIRZYONSA-N 344.411 1.877 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H]2CC=CCC2)cc1C 1496935573 GBBMEQMJMJLIAF-IAGOWNOFSA-N 332.444 1.927 10 10 EDCE COc1ccc(C(=O)NCc2c(O)cccc2F)cc1OCCO 1596910954 BHHRPOVLNLOCKM-UHFFFAOYSA-N 335.331 1.841 10 10 EDCE C[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(O)c(O)c2)SC1=S 16904736 UBUWBGLWQWRFHG-HPWAZMHGSA-N 325.367 1.772 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)c(Br)c1 2146133269 UKZNVLWHGAKBEX-VCTAVGKDSA-N 342.281 1.841 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985099707 AUEKVTLBVPKTJN-LLVKDONJSA-N 327.385 1.829 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C 1985102823 MHWVPGQOYUUQAC-LLVKDONJSA-N 327.385 1.781 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)cc1Br 2146311284 QYWHJJIBZJZETI-KMUNFCNLSA-N 342.233 1.684 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(C)(C)C(=O)NCCN=[N+]=[N-])CC1 2010392455 ZVCBVLYQCWJVCR-UHFFFAOYSA-N 340.428 1.744 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010393520 TVIYHSYECQLZRS-SDDRHHMPSA-N 339.396 1.780 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCC(N=[N+]=[N-])CC2)C1 2011939370 LEZNVDRVCPDUGI-OAHLLOKOSA-N 339.396 1.660 10 10 EDCE CNCc1ccc(N2CC(=O)N3CCC[C@H]3C2)c(Br)c1 2158194188 WYGYITDSCHGZHV-LBPRGKRZSA-N 338.249 1.980 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](N3CC(O)C3)C2)cc1Br 2158747400 XQPZWSXIUJXELK-JQWIXIFHSA-N 341.249 1.758 10 10 EDCE CC[C@H](N[C@@H]1CCO[C@H]1C(N)=O)c1cc(Br)ccc1O 2174102524 GPQJKWDYYIOFNS-DMDPSCGWSA-N 343.221 1.838 10 10 EDCE COc1ccc(N2CCOCC23CNC3)c(OC)c1Br 2167626043 HEJOPOZARLOXMJ-UHFFFAOYSA-N 343.221 1.645 10 10 EDCE CNCc1ccc(N2CCN([C@@H](C)CO)CC2)cc1Br 2169348324 DVMCQGQASRLTTR-LBPRGKRZSA-N 342.281 1.671 10 10 EDCE CCN(Cc1cc(Br)cc(C)c1O)[C@@H]1CC(=O)NC1=O 2171201114 IKBCALMAVJMGGZ-LLVKDONJSA-N 341.205 1.700 10 10 EDCE CCn1cc(Br)c(=NC(=O)c2cc(O)c(O)c(O)c2)[nH]1 2188921264 AVSSSFPZSHRTFZ-UHFFFAOYSA-N 342.149 1.457 10 10 EDCE NCc1cc(F)c(N2C[C@H]3C[C@H]2CN3C(N)=O)cc1Br 2192284245 XOVBKHQXZMYREG-DTWKUNHWSA-N 343.200 1.389 10 10 EDCE CN(CC1(S(C)(=O)=O)CC1)c1ccc(CO)cc1Br 2111532214 CKQRSNQPEYIMCZ-UHFFFAOYSA-N 348.262 1.955 10 10 EDCE O=C(NCCc1cc(Br)no1)c1cc(O)nc(O)c1 2228778873 FBWXFKKJPQPVFN-UHFFFAOYSA-N 328.122 1.216 10 10 EDCE NCc1ccc(N2C[C@H]3OCCC[C@@]3(CO)C2)c(Br)c1 2239149554 LWZAHSCWHJOFPG-CABCVRRESA-N 341.249 1.886 10 10 EDCE CSc1ncc(CNC(=O)N2[C@@H](C)SC[C@H]2C(=O)O)s1 2284542769 BFQJBCSIMJHESS-SVRRBLITSA-N 333.460 1.923 10 10 EDCE O=C1NC(=O)N(C2CCCCCC2)C(=O)C1=CNC[C@@H]1CCCO1 2296945861 NOCCUPKQUUYWAY-ZDUSSCGKSA-N 335.404 1.440 10 10 EDCE CCc1nc2n(n1)C[C@@H](NC(=O)C=Cc1ccc(O)c(O)c1)CC2 2308001164 FMDYQSVDIQCACQ-LBPRGKRZSA-N 328.372 1.396 10 10 EDCE C[C@@H](O)CN1CCC(CN(C)C(=O)C=Cc2ccc(O)c(O)c2)CC1 2308001816 RTMFRCSYOOOJGB-CQSZACIVSA-N 348.443 1.662 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](N)CCO)c(O)c1Br 2352651569 MRYFJLQEQOXNOE-JTQLQIEISA-N 331.210 1.131 10 10 EDCE Cc1ccc(CN[C@H](C)[C@@H]2CNCCO2)c(O)c1Br 2352690654 GWXDWERYSFTGNZ-PWSUYJOCSA-N 329.238 1.930 10 10 EDCE CN(C)c1ccc(CNC(=O)Cn2ncc(=O)c3ccccc32)cc1 7051096 IQEJPOQZGGJNKQ-UHFFFAOYSA-N 336.395 1.779 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)NC(C)(C)C)CC2)cc1 38936928 DCFLCHCPQKZNAX-UHFFFAOYSA-N 334.464 1.915 10 10 EDCE COc1cccc(CNC(=O)N[C@H]2CCCn3nc(C)nc32)c1O 83741323 WAHKVCNKRUBVJX-LBPRGKRZSA-N 331.376 1.635 10 10 EDCE C[C@@H]1CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C[C@@H](C)N1 255331076 DQBNZGJLRZXQMP-BJYXUANLSA-N 329.444 1.745 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CSC(=O)N1 265827900 PLIWKZIHXAGIBR-CQSZACIVSA-N 335.429 1.307 10 10 EDCE O=C1c2cccc([S@](=O)O)c2C(=O)c2c1cccc2[S@](=O)O 616581995 HJAAHWSLWAJKPN-UHFFFAOYSA-N 336.346 1.623 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNCCCN2CCOC2=O)c1O 278624937 GEKKAUXOEAOTSA-UHFFFAOYSA-N 325.321 1.241 10 10 EDCE COc1cccc(CN2CCC(CNS(C)(=O)=O)CC2)c1O 289328816 GNHCTALBULOMPE-UHFFFAOYSA-N 328.434 1.162 10 10 EDCE COC(=O)C(C)(C)[C@H](NC(=N)N)c1cc(Br)ccc1O 575246533 HQZGMJOBRPOSKC-SNVBAGLBSA-N 344.209 1.878 10 10 EDCE O=C(CCOC1CNC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 829003501 OSXLQZOLFYIJTL-HNNXBMFYSA-N 334.416 1.278 10 10 EDCE CC(=O)c1cc(Cl)cc(CN(C)CC(=O)N2CCNCC2)c1O 843346120 BSJFXENLHYNFIP-UHFFFAOYSA-N 339.823 1.112 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CCC[C@H]1O 745337235 PFQMTFKDUBFXLO-HZPDHXFCSA-N 334.416 1.415 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CCCN(C)C2=O)cc1 846444421 CSGDTQDXCSZSHJ-MRXNPFEDSA-N 333.432 1.458 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](O)[C@@H](C)C3)C2)cc1 854297218 KQLMTOBCXWAEKQ-ZQIUZPCESA-N 333.432 1.686 10 10 EDCE CC1(C)OCC[C@H]1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 856261882 JTVXACNLWNIKJZ-JTQLQIEISA-N 342.417 1.309 10 10 EDCE C[C@H](C(=O)NCc1c(O)cccc1F)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 928708229 DYJFUGFZPCKDBB-WOPDTQHZSA-N 348.374 1.711 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3cnc[nH]3)C2)cc1 852447714 DBZMPNHXRKPQGX-CYBMUJFWSA-N 329.404 1.839 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3snnc3C)C2)cc1 852354070 WMPYDIDOIOFLNE-GFCCVEGCSA-N 347.444 1.933 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)Cc3ccc(O)nc3)C2)cc1 854981460 SQZGFRHVHBPDNI-HNNXBMFYSA-N 341.411 1.981 10 10 EDCE CCOC(=O)NCCCC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855233653 KALWAAXZBJEBAP-CQSZACIVSA-N 349.431 1.916 10 10 EDCE C[C@H]1CCCN1S(=O)(=O)NCc1cccc(Br)c1O 766201410 SUMBCCSZIAOLQN-VIFPVBQESA-N 349.250 1.973 10 10 EDCE COc1ccc(N2CCN(C(=O)CCCCC(N)=O)CC2)c(OC)c1 870167119 BBNSAZWBWDMJKN-UHFFFAOYSA-N 349.431 1.398 10 10 EDCE CC(C)N(C[C@@H](C)O)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788931375 DWQRVBUGXLDWRD-OAHLLOKOSA-N 347.459 1.521 10 10 EDCE Cc1ccnc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)n1 795793525 GWJSEFVDHUIZDP-UHFFFAOYSA-N 342.399 1.666 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CC[C@H](c2cc(O)nc(O)n2)C1 1144510248 GCZGROJJKUCTBI-FWEMWIAWSA-N 343.339 1.328 10 10 EDCE C[C@@H](CN[C@H](C)C(=O)N(C)C)NC(=O)c1ccc(N=NC(N)=O)cc1 1322093052 BNPNJDWRFHINKP-WDEREUQCSA-N 348.407 1.034 10 10 EDCE C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1NCCCO 1327955497 ATWBDEKKJVUTKP-RISCZKNCSA-N 333.392 1.282 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1CNC(=O)c1ccc(O)c(O)c1 1907374828 YWABXVDYDGRXRA-NEPJUHHUSA-N 336.388 1.988 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@H]3C[C@H]3C)C2)cc1 1347444176 GJRINGLFPDWUIZ-MCIONIFRSA-N 331.416 1.162 10 10 EDCE Cn1nccc1C1(O)CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 1528809393 FRWCUNZDZUCUEE-HYXAFXHYSA-N 343.383 1.355 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cccnn1 1466397732 DFRGMAJFZKZZBC-UHFFFAOYSA-N 335.747 1.651 10 10 EDCE CC(=O)NN1C(=O)/C(=C2/C(=O)Nc3ccc(C)cc32)SC1=S 1028563 UMYMXKXYEVBGDO-KHPPLWFESA-N 333.394 1.570 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H]2CCCCO2)cc1C 1717763742 CMJRQWOVAGHISW-RDJZCZTQSA-N 336.432 1.139 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1(CO)CCOCC1 1624537362 LFGWJSMKVJCGGE-UHFFFAOYSA-N 348.443 1.271 10 10 EDCE COc1ccc(CNCCC[C@H](C)NC(=O)c2cnnn2C)cc1C 1485720332 RQALMDGSMNBMDI-AWEZNQCLSA-N 345.447 1.820 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCN(CCCO)C2CC2)cc1 1714683219 ZXKQITWSWCDELQ-UHFFFAOYSA-N 333.392 1.426 10 10 EDCE CC1(C)C(=O)N[C@@H]1C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1637345134 KKOKCGOYGBZZMX-MRXNPFEDSA-N 332.400 1.404 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CCNC(=O)c1ccco1 1636058603 JHSDWKZJLQNICG-UHFFFAOYSA-N 337.372 1.907 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2nnn(C)c2C)cc1C 1568265078 SFBZUWBCSZTVNS-ZDUSSCGKSA-N 345.447 1.691 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](CCNCCCO)C2)cc1 1733678820 ZJMAQOUXIMBRQG-ZDUSSCGKSA-N 347.419 1.673 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC(N2CCCNC2=O)CC1 1654435893 PMOBDCFBXRZPHA-UHFFFAOYSA-N 337.351 1.257 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@@H]2CC=CCC2)cc(OC)n1 1744620264 XIWMPCKNJJQIGA-CHWSQXEVSA-N 347.415 1.690 10 10 EDCE CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NCc2c(O)cccc2O)C1 1597573871 IKYCSPAIYICILG-OLZOCXBDSA-N 334.416 1.999 10 10 EDCE CNC(=O)Cc1noc(/C=C/c2ccc(N3CCOCC3)cc2)n1 162626594 SKIACBHNGSUWPZ-QPJJXVBHSA-N 328.372 1.365 10 10 EDCE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H](O)CNC(=O)OC(C)(C)C 1968792942 UFCSIGIRSAHFLJ-RISCZKNCSA-N 338.404 1.797 10 10 EDCE CC(C)(C)OC(=O)NCCn1cnc(C(=O)NCCCN=[N+]=[N-])c1 2010402391 QCPZXXQSXAEGOU-UHFFFAOYSA-N 337.384 1.838 10 10 EDCE Cc1cccc(CNC(=O)[C@H](O)[C@H](C)NC(=O)OC(C)(C)C)c1O 2024813378 YFCFHCMLGBSXRP-SMDDNHRTSA-N 338.404 1.591 10 10 EDCE Nc1ccc(OCC(=O)NCC2CN(Cc3ccccc3)C2)cc1 716242349 MOOZTWQPQPKLDB-UHFFFAOYSA-N 325.412 1.896 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1CO[C@@H]2COC[C@@H]21 2101857802 YXEFPLGRGPHHEJ-NQBHXWOUSA-N 328.206 1.906 10 10 EDCE CN(CC(=O)O)S(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 2105194194 AIVRKVVFSKAJHC-UHFFFAOYSA-N 329.161 1.372 10 10 EDCE COc1ccc(N2CC[C@@](C)(O)[C@H](O)C2)c(OC)c1Br 2234903778 SJWVFWIIEFRKEU-BXUZGUMPSA-N 346.221 1.788 10 10 EDCE COc1ccc(N2CCOC[C@H]2CO)c(OC)c1Br 2226546993 LMENXIKJOULUCN-SECBINFHSA-N 332.194 1.664 10 10 EDCE COc1ccc(C=C2SC(=S)N(CC(=O)O)C2=O)cc1OC 2293024491 YRODMNNSVWBMBR-UHFFFAOYSA-N 339.394 1.990 10 10 EDCE CSc1ncc(CNS(=O)(=O)CCC(F)(F)C(=O)O)s1 2284500258 RWNVRMTZROOOIC-UHFFFAOYSA-N 346.402 1.394 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2333233766 JVENZGIMUWSRLJ-YAUNCSCZSA-N 334.185 1.382 10 10 EDCE Cc1ccc(CN(C)C[C@H](O)CC(N)=S)c(O)c1Br 2352661802 GLYBJCSLWDTREM-SNVBAGLBSA-N 347.278 1.932 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C[C@](C)(N)CO 1952345610 FKMJPRLSMWCNRY-PXAZEXFGSA-N 340.420 1.633 10 10 EDCE NCc1ccc(-c2csc(NS(=O)(=O)c3cn[nH]c3)n2)o1 37745160 LOHGMASBDZIYCZ-UHFFFAOYSA-N 325.375 1.386 10 10 EDCE Cc1ccc(O)c(CN2CCCN(S(=O)(=O)N(C)C)CC2)c1 367954231 AMSLZAKGIHGSBM-UHFFFAOYSA-N 327.450 1.015 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCOC[C@H]1[C@@H]1CCCO1 377709660 ZFHZDVDZUVURLV-OALUTQOASA-N 332.444 1.903 10 10 EDCE CN[C@@]1(C(=O)NCc2ccc(C)c(Br)c2O)CCOC1 2381136538 HNXOSJUVJCXIML-AWEZNQCLSA-N 343.221 1.458 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 808522771 YVQMITFKBDMQTN-AWEZNQCLSA-N 349.383 1.996 10 10 EDCE CCn1cc(C(=O)OCC(=O)C(C)=O)c(=O)c2cc(Cl)ccc21 808501247 GSSYGHJYKQXEQS-UHFFFAOYSA-N 335.743 1.990 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](CO)[C@H](CO)C2)cc1Br 704783484 LAFMLTALUOKZEH-SRVKXCTJSA-N 343.265 1.767 10 10 EDCE CN1C(=O)CC[C@H]1C(=O)NCc1cc(Br)ccc1O 804733351 PGMOYEVPIRWBPL-JTQLQIEISA-N 327.178 1.392 10 10 EDCE C[C@H](C(=O)NCc1cc(Br)ccc1O)n1cncn1 804737113 IMAMCYPQGWIUDV-MRVPVSSYSA-N 325.166 1.624 10 10 EDCE O=C1OCCN1C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 827746658 QJBVPAKWWYKZPP-UHFFFAOYSA-N 345.443 1.940 10 10 EDCE COc1cc(O)c(CN2CCS(=O)(=O)[C@H]3CCC[C@H]32)cc1OC 825201030 IIKKVDSNWDMFCU-WBMJQRKESA-N 341.429 1.561 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@]2(C)CCCS2(=O)=O)cc1F 906453573 ILHLSNLXZQNVKI-OAHLLOKOSA-N 328.409 1.475 10 10 EDCE C[C@H](NCCS(=O)(=O)N=S(C)(C)=O)c1ccc(F)cc1O 903226754 NWNCLWLTLWFREQ-VIFPVBQESA-N 338.426 1.239 10 10 EDCE COC(=O)CNC(=O)[C@H]1CCCN1C/C=C/c1ccc(N(C)C)cc1 841892342 GZRLEBZORGVIDM-UKINESCASA-N 345.443 1.519 10 10 EDCE COC(=O)COc1ccc(N(C)Cc2cnc(C(=O)OC)cn2)cc1 859245834 HYHDIWNXVAVDGY-UHFFFAOYSA-N 345.355 1.451 10 10 EDCE OCCO[C@@]1(CNCc2c(O)cccc2Br)CCOC1 858187912 LMSJIGIWUQUSCR-CQSZACIVSA-N 346.221 1.412 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C[C@@H]3CCCC(=O)N3)C2)cc1 855227447 WQXBBSYSVWFKDH-UONOGXRCSA-N 331.416 1.449 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)c3n[nH]c(C)n3)C2)cc1 854296023 ACVWTVCBXVTESE-AAEUAGOBSA-N 344.419 1.761 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCc3cnccn3)C2)cc1 852237913 SZDMYKKKTXTHAX-OAHLLOKOSA-N 341.415 1.606 10 10 EDCE COC[C@]1(C)CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 860200318 SRQROEHUBWRBII-IBGZPJMESA-N 349.475 1.448 10 10 EDCE CCC1(Cn2cc(C(=O)N3Cc4cccc(O)c4C3)nn2)COC1 871206083 QYMLRIBITSXXEK-UHFFFAOYSA-N 328.372 1.566 10 10 EDCE COCCN1CCC[C@H]1CNCc1ccc([N+](=O)[O-])c(OC)c1O 775005207 QDMWYOQGLFLFCC-ZDUSSCGKSA-N 339.392 1.509 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCc2cc(C(N)=O)co2)c1 779669787 HRSBZGGUTQAVKX-VIFPVBQESA-N 333.344 1.653 10 10 EDCE Cc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)cc2)o1 773230134 CUVZDLFCTKHBLE-UHFFFAOYSA-N 330.387 1.760 10 10 EDCE COCCO[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 780630593 JJLFLSFZKHZEJC-SNVBAGLBSA-N 337.332 1.167 10 10 EDCE C[C@@H]1Oc2ccccc2N(CC(=O)NCc2cc(O)ccc2O)C1=O 1303223278 ILKGCJKJQMHXKK-NSHDSACASA-N 342.351 1.528 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)C1(CO)CC1 2128186620 XTHKSLDLNYLZSU-NSHDSACASA-N 326.194 1.362 10 10 EDCE C[C@H](C(=O)NCc1c(O)cccc1F)n1cnc2c(N)ncnc21 1178412792 FQKMKEXISBKVAR-MRVPVSSYSA-N 330.323 1.131 10 10 EDCE NCc1ccc(N2C[C@@H]3NC(=O)O[C@H]3C2)c(F)c1Br 2120407783 FOZLVYVKRDJRQJ-CBAPKCEASA-N 330.157 1.344 10 10 EDCE Cc1nonc1CN(C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1266364901 GHNJPLOGKJOIQD-UHFFFAOYSA-N 345.363 1.402 10 10 EDCE C[C@H](O)CCCN[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1265508428 DIAXFWQLFNTILP-CQDKDKBSSA-N 347.419 1.860 10 10 EDCE NC[C@H]1CN(C(=O)c2cccc(O)c2O)CCN1Cc1ccccc1 1914862252 MEYZKAGWRMYVMR-HNNXBMFYSA-N 341.411 1.383 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2nocc2C)cc1C 1283816893 LFMGHEGLTVYEFD-CQSZACIVSA-N 333.388 1.181 10 10 EDCE COCCC(=O)NC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1285453562 ZEBVADIUPRRWBG-LCEKYLTBSA-N 347.375 1.288 10 10 EDCE COc1cccc(CNC(=O)c2cccc(Cn3ccnn3)c2)c1O 1294924717 IABIECGFVGDMMQ-UHFFFAOYSA-N 338.367 1.971 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cn(CCc2ccccc2)nn1 1299573990 MSMJUNSXHUXXND-UHFFFAOYSA-N 338.367 1.862 10 10 EDCE CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)Cc2ccc(O)c(O)c2)C1 1298839097 HRGUBWVEIVHLIH-RRFJBIMHSA-N 332.400 1.404 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@@H]1CC12CC2 1526698898 ZPIOTRDUVQJTES-GWCFXTLKSA-N 343.387 1.884 10 10 EDCE C[C@H](C(=O)NCc1cccc(O)c1O)N1CSCCSC1 1528771342 NWNMAPWEMGAOFX-SNVBAGLBSA-N 328.459 1.800 10 10 EDCE Cn1nccc1[C@@H]1C[C@H](NC(=O)c2c(F)ccc(O)c2O)CCO1 1472563092 DZXCHQJIKHMVBV-RNCFNFMXSA-N 335.335 1.621 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H](C)n2cncn2)cc1C 1715331559 NWSKNSJWZAJUHP-LSDHHAIUSA-N 345.447 1.793 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC/C=C/CNCc2ccon2)cc1 1483101091 UPJFOPYLTJQZFB-DBZUVFRKSA-N 342.359 1.913 10 10 EDCE CN(CCO)C[C@@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1725058876 MZCFHDNUVFHCRF-AWEZNQCLSA-N 333.392 1.378 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)CCc2cnn[nH]2)cc1C 1496172369 UYTMTOQKOBULMT-CQSZACIVSA-N 345.447 1.691 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)CN2CCOCC2)cc1C 1570597820 CXZVXTXJCAQVDD-HOTGVXAUSA-N 349.475 1.319 10 10 EDCE COC1CCN(c2ccc(CN3CCn4cnnc4C3)cc2)CC1 1652462322 QNOSJJGINVAMJP-UHFFFAOYSA-N 327.432 1.909 10 10 EDCE CCOc1cccc(CNCCC(=O)N2C[C@@H](C)O[C@H](C)C2)c1O 1857863906 MOIVEGKNTWWEAR-ZIAGYGMSSA-N 336.432 1.906 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(C(=O)NCCN=[N+]=[N-])CCCOC1 1965101862 ILQZXSHQBKYWSJ-CQSZACIVSA-N 327.385 1.734 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003166926 KOYVNUAJPKHRRM-AVGNSLFASA-N 340.420 1.278 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985099718 AWFFHYWPECTCTE-HBNTYKKESA-N 327.385 1.419 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985101846 YNENYFXJKFRURK-GXSJLCMTSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCCCCN=[N+]=[N-])C1COC1 1985100904 KTJGCHGWVNCFAQ-NSHDSACASA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)NCCN=[N+]=[N-])C[C@@H](O)C1(C)C 1990023058 PWBYYHNZEWPAKW-YMTOWFKASA-N 327.385 1.467 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)CCOC1 2010405473 INRDQGDUWODWAV-ABAIWWIYSA-N 339.396 1.829 10 10 EDCE CN1CCN(Cc2cc(Br)ccc2O)C[C@H]1C(=O)O 686096525 VDFJKLPSSXWWFE-NSHDSACASA-N 329.194 1.355 10 10 EDCE C[C@@H](O)CN1CCN(c2ccc([C@@H](C)N)c(Br)c2)CC1 2170217057 XCOKAWQVEZZBCI-VXGBXAGGSA-N 342.281 1.972 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@H](O)C2)c(Br)c1 2105072639 GZQXKDBDKXBDIP-RYUDHWBXSA-N 329.238 1.491 10 10 EDCE COc1ccc(Br)c(CN[C@H]2COCC[C@H]2O)c1O 2227749941 HSFXWSGFNVELHY-WDEREUQCSA-N 332.194 1.403 10 10 EDCE NCc1ccc(N2C[C@H]3CCO[C@@]3(CO)C2)c(F)c1Br 2239915034 GVIMJYHCYJWWTB-QMTHXVAHSA-N 345.212 1.635 10 10 EDCE COC[C@@H]1C[C@H](CN)N(Cc2c(O)cccc2Br)C1 2273873352 FESPFLVNOYAUNQ-GHMZBOCLSA-N 329.238 1.950 10 10 EDCE O=S1(=O)C[C@H]2CN(c3ccc(CO)cc3Br)C[C@@H]21 2314882069 ZQDPSNIYAWGEEL-SKDRFNHKSA-N 332.219 1.175 10 10 EDCE Cc1ccc(CNC(=O)N[C@@H](C)C(=O)O)c(O)c1Br 2352620578 RFOQDEOQCCVXCD-ZETCQYMHSA-N 331.166 1.735 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2[C@@H]3C[C@H]2CN3)c(O)c1Br 2352624621 GLEPIYWYEKPXCL-GARJFASQSA-N 325.206 1.687 10 10 EDCE COC(=O)[C@@](C)(O)CNCc1ccc(C)c(Br)c1O 2352634716 XOFPFJOLHIEPCH-ZDUSSCGKSA-N 332.194 1.477 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](N)C(C)(C)O)c(O)c1Br 2352641042 PJGJPTYOFONLRR-LLVKDONJSA-N 331.210 1.178 10 10 EDCE Cc1oc(-c2cnn(C)c2)nc1C(=O)NCCc1ccc(N)cc1 179042201 UERYZVQLAZPQGO-UHFFFAOYSA-N 325.372 1.938 10 10 EDCE O=C(NCCCn1ccnn1)NCc1c(O)ccc2c1CCCC2 183549166 FUICOAKJTRKFBH-UHFFFAOYSA-N 329.404 1.752 10 10 EDCE CNCc1ccc(N2C[C@@H](C(N)=O)C3(CC3)C2)c(Br)c1 2370479919 MDBMXJIXFOUQIU-NSHDSACASA-N 338.249 1.870 10 10 EDCE CNC(=O)[C@H]1CCCN1Cc1cc(Br)cc(OC)c1O 92097068 IEYLJQULZGBWKY-LLVKDONJSA-N 343.221 1.874 10 10 EDCE CC(=O)NCCCNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255339297 NYAOWEFOTOSVSQ-YVMONPNESA-N 331.416 1.179 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](N)CCN(C)C)c(O)c1Br 2380741772 KNUHAFMSEDHFGI-NSHDSACASA-N 344.253 1.358 10 10 EDCE CCOC[C@H](N)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380761269 FALOGSMCULVJJA-NSHDSACASA-N 345.237 1.785 10 10 EDCE COCCNC(=O)[C@H](C)NCc1ccc(C)c(Br)c1O 2380798130 MFTOQBNBSHCQAD-JTQLQIEISA-N 345.237 1.704 10 10 EDCE CCN1CC[C@H](NC(=O)NCc2ccc(N(CC)CC)cc2)C1=O 801745936 ZRJFRXBOIPWAJP-INIZCTEOSA-N 332.448 1.953 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NC1COCCOC1 813818750 JJCJURKXPZKRAN-UHFFFAOYSA-N 345.193 1.369 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC[C@@H](O)CN1CCN(C)CC1 819376734 IKIUIBHWQWWJKB-YLJYHZDGSA-N 348.535 1.190 10 10 EDCE COCCN1CCCN(Cc2cc(Cl)c(F)cc2O)CC1=O 816589270 RARJCYLZVQXBFM-UHFFFAOYSA-N 330.787 1.865 10 10 EDCE CN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCOC1 823553668 MIHLEQJMEIAMRX-MRXNPFEDSA-N 333.432 1.578 10 10 EDCE CN(C)c1ccc(CNC(=O)CN[C@H]2CCNC23CCCC3)cc1 903484858 XDNZIJRRMSZKDF-KRWDZBQOSA-N 330.476 1.633 10 10 EDCE CCOC(=O)CN1C(=O)/C(=C/c2cnn(CC)n2)c2ccccc21 840735726 SGEPMHXWXZRUNP-NTEUORMPSA-N 326.356 1.748 10 10 EDCE O=C(O)C1(CNCc2cc(Cl)cc([N+](=O)[O-])c2O)CCOCC1 843039670 PWANPTSILITGRO-UHFFFAOYSA-N 344.751 1.925 10 10 EDCE Cn1nccc1[C@@H]1COCCN1C(=O)/C=C\c1ccc(O)c(O)c1 846611723 KCCZAGUZKNVTKK-MFBWXBCUSA-N 329.356 1.445 10 10 EDCE C[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 928538703 LHXZQEUPBITFFP-JTQLQIEISA-N 328.390 1.015 10 10 EDCE Cn1cc(N2CCC[C@@H](NC(=O)NCc3c(O)cccc3F)C2)cn1 920412462 QTPWYGDSWUMFPC-GFCCVEGCSA-N 347.394 1.733 10 10 EDCE Cc1cc(C(=O)COC(=O)[C@@H]2COC(=O)N2)c(C)n1-c1ccccc1 859909147 JMWKGMZZBNZWMG-HNNXBMFYSA-N 342.351 1.928 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCC3(CO)CC3)C2)cc1 854297609 PCWBBZJJCQONBZ-CQSZACIVSA-N 333.432 1.736 10 10 EDCE CC(C)NC(=O)[C@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 853602294 QRCRYEXAIDNPQO-BLLLJJGKSA-N 334.416 1.555 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)COC3CCNCC3)C2)cc1 852843759 GMDNZXRECGHVSJ-AWEZNQCLSA-N 333.432 1.159 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCc4nc[nH]c4C3)C2)cc1 855226675 PRXHCYMMCLETGR-KGLIPLIRSA-N 340.427 1.918 10 10 EDCE CN(C)c1cc(F)c(CN2CCN(c3nccnn3)CC2)cc1F 862443132 MVNTYNZMZPOWLQ-UHFFFAOYSA-N 334.374 1.538 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN3C(=O)CC[C@H]3C2)c([N+](=O)[O-])c1 765658537 WQULHPDOINLPMW-QTEJZOKPSA-N 345.355 1.592 10 10 EDCE COc1cccc(CNS(=O)(=O)CC2(OC)CCCC2)c1O 866840985 QYHSZNHONIGJOR-UHFFFAOYSA-N 329.418 1.779 10 10 EDCE COCc1ncc2c(n1)CCN(C(=O)c1ccc(C)c(O)c1O)C2 869684094 QFFIAFAVRLNREZ-UHFFFAOYSA-N 329.356 1.541 10 10 EDCE O=C(NCc1ccc(N2CCSCC2)cc1)[C@H](O)c1cnc[nH]1 864917887 BPGWVWNASAJRNJ-OAHLLOKOSA-N 332.429 1.313 10 10 EDCE NC(=O)c1ccc(NC(=O)NCCCSc2nccs2)cn1 766458122 ABZNHNKFPZAHHJ-UHFFFAOYSA-N 337.430 1.941 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)NCCc3nnnn3C)c2C)c1 771775326 KNULHEHGMDPKSB-UHFFFAOYSA-N 338.415 1.899 10 10 EDCE CC(C)(O)C[C@@H](O)CNCc1cc(F)c(N2CCOCC2)c(F)c1 872209846 XSPNXRUVJBEDNG-CYBMUJFWSA-N 344.402 1.413 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1CNC(=O)N(C)CCN(C)c1ccc(OC)cc1 891231802 TYVSRVJWTVNDET-CZUORRHYSA-N 349.431 1.582 10 10 EDCE COc1cnccc1N1CCN(C(=O)c2cccc(O)c2O)CC1 794345846 SJPARLTYNWGCNI-UHFFFAOYSA-N 329.356 1.464 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CC[C@@H](c2cc(O)nc(O)n2)C1 1144510246 GCZGROJJKUCTBI-CJHWANRJSA-N 343.339 1.328 10 10 EDCE CN1CCN(Cc2c(O)cccc2Br)C[C@@H]1C(=O)O 686102457 AMAKIEDORYFMNS-LLVKDONJSA-N 329.194 1.355 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N3CCOCC3)c(Br)cc21 92774752 VZTOZSLGFQSDHV-ZDUSSCGKSA-N 340.221 1.888 10 10 EDCE OCc1cc(CNCc2cc(Br)cc(F)c2O)[nH]n1 2120114280 OHVDZAMKALYNNN-UHFFFAOYSA-N 330.157 1.799 10 10 EDCE CO[C@H]1COC[C@@H]1N(C)c1cc(Br)c(CN)cc1F 2120774809 IHPRQOVUNSQIEV-STQMWFEESA-N 333.201 1.897 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@@H]2C[C@@H]2C1 1329260917 PCXBGOQPBKDRGC-DGAVXFQQSA-N 333.384 1.734 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1 1332820737 YDMLQVSXRDFPLT-QDMKHBRRSA-N 345.443 1.505 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@H]2CN(C)CCO2)cc1C 1267984616 QODKMIWWPAAGOU-KDOFPFPSSA-N 349.475 1.176 10 10 EDCE CCCn1cc(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)nn1 1266929142 ONOKBWUGJVQNKZ-UHFFFAOYSA-N 345.447 1.867 10 10 EDCE O=C(CNC(=O)c1ccccc1Cl)NCc1ccc(O)c(O)c1 1445900625 KIIDLVDJHAFOMJ-UHFFFAOYSA-N 334.759 1.797 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)[C@H]2COC(=O)N2)C2CC2)cc1C 1483558023 KJPZMUJDEBIGEP-LSDHHAIUSA-N 347.415 1.096 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1485184519 ULXIAYUGIVSASL-LHAWGNPOSA-N 332.444 1.879 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cnc(-c2ncccn2)s1 1557084599 GUIJJQRPMLYWGA-UHFFFAOYSA-N 328.353 1.941 10 10 EDCE O=C(NCc1cccc(O)c1O)c1ccoc1C1(O)CCOCC1 1633515869 UDXBTNMQMBHIFA-UHFFFAOYSA-N 333.340 1.619 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC2(CCOCC2)CC[C@H]1CO 1638915272 FTCBYNREVFBHJD-AWEZNQCLSA-N 335.400 1.420 10 10 EDCE CC[C@@H](CNC(=O)C1CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1746100212 XJBWBTKANSKILR-LBPRGKRZSA-N 331.376 1.884 10 10 EDCE CCOCC(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1583585722 DDPYDPIJGHEMBU-SNVBAGLBSA-N 335.364 1.120 10 10 EDCE CN(Cc1ccccc1O)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 120268207 HWKKOIDUPVINMH-DHZHZOJOSA-N 340.379 1.928 10 10 EDCE C[C@@]1(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCOC1=O 1123864713 ATDFMIJYCVJOQN-RDTXWAMCSA-N 348.399 1.788 10 10 EDCE CCON(CC)C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 879797071 GEKXJJSVUUTYFX-KRWDZBQOSA-N 337.464 1.452 10 10 EDCE CO[C@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CCN(C(=O)OC(C)(C)C)C1 2003172802 QNNTZGBCNRPUGZ-PSTGCABASA-N 340.420 1.278 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H]1CNC(=O)COc1ccc(N)cc1 1999127241 ZKBMNJYYVDACGP-CYBMUJFWSA-N 335.404 1.773 10 10 EDCE Nc1ccc(N2C(=O)[C@@H]3[C@@H]4CC[C@@H](O4)[C@H]3C2=O)cc1Br 2153256022 PHLPXCSTTIBHMQ-WRWGMCAJSA-N 337.173 1.698 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2010388604 DXFIFAHTGRTKBY-LLVKDONJSA-N 339.396 1.924 10 10 EDCE CSC1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2036371006 RGCWSGAYAVJKLD-LLVKDONJSA-N 329.219 1.986 10 10 EDCE CN(C)C[C@@]1(O)CCN(c2ccc(CO)cc2Br)C1 713703825 BECJLKHYMNXNIV-AWEZNQCLSA-N 329.238 1.444 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H](n4cccn4)C3)c2n1 2063925131 LDVPZRBXCFKXPO-LBPRGKRZSA-N 326.360 1.417 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H]3CCCN(C(C)C)C3)c2n1 2064984814 JKKUEJVRVATOSA-ZDUSSCGKSA-N 331.420 1.594 10 10 EDCE COC(=O)Cc1cc(O)n2nc(-c3ccccc3)c(C(=O)OC)c2n1 2080935498 QJUUJVSHQRSAOO-UHFFFAOYSA-N 341.323 1.604 10 10 EDCE NCc1ccc(N2CC[C@H](N3CCOC3=O)C2)cc1Br 2171696387 LBENVMRKZYVOFO-LBPRGKRZSA-N 340.221 1.939 10 10 EDCE O=C1NC[C@]2(CCCN(c3ccc(CO)cc3Br)C2)N1 2177667540 AXMYTXCTAGDUEX-AWEZNQCLSA-N 340.221 1.593 10 10 EDCE CC1(C)CN(c2ccc(CN)c(Br)c2F)CC(=O)N1 2094070349 LMTQCKZIKAXHCM-UHFFFAOYSA-N 330.201 1.762 10 10 EDCE COC[C@]1(O)CCN(c2ccc(CN)c(Br)c2F)C1 2095538191 IMYHVNJUYUAXOQ-ZDUSSCGKSA-N 333.201 1.635 10 10 EDCE COC1(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])CN(C(=O)OC(C)(C)C)C1 2213582979 NJCVQAMJOJSHGX-WDEREUQCSA-N 339.396 1.970 10 10 EDCE NCc1ccc(N2CCc3nnc(O)cc3C2)c(Br)c1 2206100340 UXLHEOKNKPIOKE-UHFFFAOYSA-N 335.205 1.966 10 10 EDCE COc1ccc(Br)c(CN[C@H]2C=CS(=O)(=O)C2)c1O 2227746739 PVJOUUAAGYJWLM-QMMMGPOBSA-N 348.218 1.564 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)cc1Br 2355340214 NRYWULHGYCXGKD-DPQXWDTRSA-N 342.233 1.823 10 10 EDCE COc1ccc(N2CCN(C(=O)c3c[nH]c(=O)cc3C)CC2)cc1 177508706 ZISZOUFEXOXXKT-UHFFFAOYSA-N 327.384 1.654 10 10 EDCE COc1cccc(NC(=O)C(=O)N(C(C)=O)c2ccc(N)cc2)c1 170318464 VWCLZQSCKYWIHV-UHFFFAOYSA-N 327.340 1.796 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@](C)(O)[C@H](O)C2)cc1Br 1893324435 GOTYXHNCWZRQDJ-OWYVNGRQSA-N 329.238 1.791 10 10 EDCE CNS(=O)(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCCCC1 62370887 XAOZHJLXBKUVLM-MRXNPFEDSA-N 340.493 1.333 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@@H](C)[C@H]3CCCO3)CC2)cc1 183152431 PGVHCBMCHFHOOB-MAUKXSAKSA-N 347.459 1.501 10 10 EDCE COc1ccc(N2CCN(CCN3CCOC[C@@H]3C)CC2)cc1F 192740674 VDYBCRTVBGAAHD-HNNXBMFYSA-N 337.439 1.677 10 10 EDCE O=c1[nH]c(-c2ccc(O)c(O)c2)nc(O)c1I 236603838 XNGMQTPQBAYAQS-UHFFFAOYSA-N 346.080 1.158 10 10 EDCE Cc1ccc(O[C@@H]2CCCN(C(=O)c3cc(O)nc(O)c3)C2)nn1 238849838 JEXUHNHGGQRQFP-GFCCVEGCSA-N 330.344 1.275 10 10 EDCE COc1ccc(N(C)CC(=O)N2CCOC[C@@H]2C2CC2)c(OC)c1 367284540 DOJOWUIVSDEXMW-MRXNPFEDSA-N 334.416 1.777 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCCN(C)C3=O)CC2)cc1 294356690 MHPQPMGVCTVYSI-INIZCTEOSA-N 331.416 1.212 10 10 EDCE CN(C)c1ccc([C@H](N)[C@@H](O)c2nn(C)cc2Br)cc1 2163148565 YWCDLVALHORUAQ-GXTWGEPZSA-N 339.237 1.982 10 10 EDCE C[C@@H](O)CN1CCN(Cc2ccc(Br)cc2O)CC1 824710625 WYFNLJTXOJIYFB-LLVKDONJSA-N 329.238 1.653 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)c1cnc2n1CCOC2 821841943 HMGMOESFEPUALT-UHFFFAOYSA-N 326.400 1.944 10 10 EDCE OCc1cnc(NCc2ccc(N3CCC(CO)CC3)cc2)cn1 820629144 JLMXNQUVALNEIT-UHFFFAOYSA-N 328.416 1.790 10 10 EDCE COCCN(CC(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCOC1 839586825 YOHHOAJEIZJBOM-KRWDZBQOSA-N 335.448 1.106 10 10 EDCE CCN(CC)c1ccc(CN2CC(n3cc(C(N)=O)nn3)C2)cc1F 839142446 HDNSWJZZZSIQHK-UHFFFAOYSA-N 346.410 1.419 10 10 EDCE CCOc1cccnc1C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832267396 RNCQMEJBESCXLB-OAHLLOKOSA-N 328.416 1.976 10 10 EDCE COC(=O)C1CCC(S(=O)(=O)N2Cc3cccc(O)c3C2)CC1 918884771 YDRZWGBPDSAKLN-UHFFFAOYSA-N 339.413 1.769 10 10 EDCE C[C@@H](NC(=O)NC[C@@H]1CCCCN1CCO)c1ccc(N(C)C)cc1 838560443 XDWYYMWLMLTYFU-QAPCUYQASA-N 348.491 1.960 10 10 EDCE Cc1cc(Cl)cc(CNCCCCn2cc(C(N)=O)nn2)c1O 840978046 OWDOMBZSZOIFGM-UHFFFAOYSA-N 337.811 1.614 10 10 EDCE Cc1cc(C(=O)N2C[C@@H]3C[C@H]2C[S@@]3=O)c(C)n1-c1ccccn1 846561054 RPCWJDUNJQDSBJ-QIPPXTIRSA-N 329.425 1.835 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC3CCC2(CN)CC3)cc1 848600697 IQQXNZRXECPEEZ-UHFFFAOYSA-N 330.476 1.572 10 10 EDCE NC(=O)CC1CC(NC(=O)NCCCSc2nccs2)C1 921446468 JQWVEHFIXNFHPC-UHFFFAOYSA-N 328.463 1.579 10 10 EDCE Cc1ccc(C(=O)NC[C@@H](O)C(F)(F)C(F)(F)F)c(O)c1O 922242680 NIXFTPNLBMGHBP-SSDOTTSWSA-N 329.221 1.695 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@](C)(CO)C3CC3)C2)cc1 854300754 ZREFKNDNQGAINQ-KDOFPFPSSA-N 333.432 1.734 10 10 EDCE CN1C[C@@H](CCNC(=O)NCCCSc2nccs2)CC1=O 921446527 KZVFQQZWWDWKCE-NSHDSACASA-N 342.490 1.793 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CN(C)C(=O)[C@@H]3C)C2)cc1 852449236 RLBAVJSYSUVUQH-STQMWFEESA-N 332.404 1.104 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCNC(=O)C(C)(C)C)C2)cc1 855230424 DBDKXWBDUAUOHB-CQSZACIVSA-N 347.459 1.943 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)CC(C)(C)CO)C2)cc1 854298183 XURUDINXEGFCKV-CQSZACIVSA-N 335.448 1.934 10 10 EDCE CNC(=O)NC[C@@H]1CCCCN1Cc1ccc(N2CCOCC2)cc1 931476653 LFPJFZBPQPBMLY-SFHVURJKSA-N 346.475 1.807 10 10 EDCE CC(C)O[C@]1(CS(=O)(=O)N[C@@H](C)c2ccccc2O)CCOC1 867836123 GQDYBUAUFBXJLB-XJKSGUPXSA-N 343.445 1.957 10 10 EDCE CCO[C@@H]1COCC[C@H]1CC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 867302873 VFSJAYYSFIQTER-RVSPLBMKSA-N 337.416 1.977 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@]12CCC[C@@H]1C2 1119734780 LCHRBEHLBHBBHQ-UZLBHIALSA-N 339.439 1.985 10 10 EDCE CCCN(C)S(=O)(=O)NCc1cc(Br)ccc1O 796190861 LGYRHJCBRHGRFL-UHFFFAOYSA-N 337.239 1.831 10 10 EDCE CCOc1ccc(O)c(CNC[C@H]2CCCCN2S(C)(=O)=O)c1 796513055 JCFUSWSRAVXSDV-CQSZACIVSA-N 342.461 1.695 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H]3COC[C@@H]32)c1 1141990972 AJPHPAWGWYYRPY-MFKMUULPSA-N 340.401 1.015 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)Nc1cnc(CC2CC2)nc1 792967141 RUCJMTXKWQGAIY-UHFFFAOYSA-N 340.383 1.732 10 10 EDCE COc1ccc(CNC(=O)c2sccc2-n2ccnn2)c(O)c1 1155574643 NXNKSPXRULOGEN-UHFFFAOYSA-N 330.369 1.973 10 10 EDCE Cc1ccc(C(=O)N2CC[C@H](c3cc(O)nc(O)n3)C2)c(O)c1O 1300194122 JVWKHUFWTBFJLL-VIFPVBQESA-N 331.328 1.237 10 10 EDCE CC(C)NCc1ccc(N2CC(O)(CO)C2)cc1Br 2115305811 LGJLEGZXIQVACV-UHFFFAOYSA-N 329.238 1.491 10 10 EDCE CC1(C)NC(=O)N(CCCNC(=O)N2Cc3cccc(O)c3C2)C1=O 1313417727 YXNFUVZMKGDEIN-UHFFFAOYSA-N 346.387 1.138 10 10 EDCE NC(=O)[C@@H]1OCC[C@H]1NCc1cc(Cl)cc(Br)c1O 2117460408 PTDBBSJRLXFHKN-MWLCHTKSSA-N 349.612 1.541 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC(CC2CC2)C1 1328518078 INMUYAIGHNZZJP-UHFFFAOYSA-N 339.439 1.938 10 10 EDCE CC[C@@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@@H]1CCCCO1 1261565491 FINRJEZZQVVNJR-ZBFHGGJFSA-N 334.416 1.815 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cc[nH]c2C)cc1C 1278742688 DKQDLHPUFOGOAL-INIZCTEOSA-N 345.443 1.863 10 10 EDCE C[C@@]1(O)CCCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 222418266 YKLGQHSLUZVDGB-TZMCWYRMSA-N 340.221 1.752 10 10 EDCE O=C(NCc1cc(O)ccc1O)C(=O)c1cnn(-c2ccccc2)c1 1455357143 OPMDYGSQASEWKP-UHFFFAOYSA-N 337.335 1.783 10 10 EDCE CC(=O)O[C@@H]1[C@@H](N=[N+]=[N-])CO[C@]2(COC(C)(C)O2)[C@@H]1OC(C)=O 6363524 YWEMWEKIXSKBDT-WGBDABJCSA-N 329.309 1.038 10 10 EDCE in-vitro COC(=O)[C@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)[C@H]1CCOC1 1472399714 JKCADBYOJALCAI-QMVVBGKPSA-N 335.356 1.053 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2CCN(C)C2=O)cc1C 1700767104 XXRJZKAQNQGANO-HOCLYGCPSA-N 347.459 1.418 10 10 EDCE CC(C)(C)c1cn(C[C@@H]2OC[C@@H](O)[C@H]2NCc2ccccc2O)nn1 1615716298 UOLYYZWXGXNOAV-HLLBOEOZSA-N 346.431 1.199 10 10 EDCE C[C@H](CC(=O)NCc1ccc(O)cc1O)NC(=O)c1ccccc1 1626837592 AAMSEQZELQYMIS-GFCCVEGCSA-N 328.368 1.923 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1cnc(C(F)(F)F)nc1 1629232815 CBKCLOOLBWHJHK-UHFFFAOYSA-N 327.262 1.766 10 10 EDCE CN(C)C(=O)NC1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1637174365 RMSXWURWBDCRLL-UHFFFAOYSA-N 346.391 1.725 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ncn(C)n1 1566431315 GSSOFJUNSNMQBX-UHFFFAOYSA-N 337.383 1.965 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2ccsn2)cc1C 1569937103 LGFFXYVQSBUSIU-UHFFFAOYSA-N 349.456 1.684 10 10 EDCE COc1cccc(CNC(=O)Cn2nnnc2-c2ccccc2)c1O 1631541881 BSYGSHJBWZQWEV-UHFFFAOYSA-N 339.355 1.371 10 10 EDCE COc1ccc(CNCC2(O)CCN(C(=O)C(F)F)CC2)cc1C 1724975620 MPJJTSPFPXPQTH-UHFFFAOYSA-N 342.386 1.712 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H]2CCN(C)C2)cc1C 1568964036 NBAYRLCFAJWMLS-LAQIPUCWSA-N 331.460 1.717 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(c2cc(F)ncn2)CC1 1636070054 QZLTWLSYAOMVSM-DUXPYHPUSA-N 344.346 1.389 10 10 EDCE CO[C@@H](C)CNC/C=C/CNC(=O)c1ccc(N=NC(N)=O)cc1 1732938231 DBFAFQGJIYAKDJ-UQOKPNQJSA-N 333.392 1.760 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2ncn(C)n2)C2CC2)cc1C 1731391404 MFVIVDLJFZHTFI-OAHLLOKOSA-N 343.431 1.430 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@@H]1CC(=O)N(c2cccc(F)c2)C1 1570462092 DBPLQHQPNIVUDV-GFCCVEGCSA-N 344.342 1.906 10 10 EDCE NC(=O)c1coc(CNC(=O)c2cc3cc(O)c(O)cc3s2)n1 1584235748 QZFUZOSXVWGPBZ-UHFFFAOYSA-N 333.325 1.329 10 10 EDCE CN(C)CCC(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 169813606 XHYZIDNWRGBIPU-KRWDZBQOSA-N 329.448 1.643 10 10 EDCE O=C1NC(=S)NC(=O)C1=CNc1ccc(N2CCCCC2)cc1 31434021 BOIIALVKTIJXBT-UHFFFAOYSA-N 330.413 1.504 10 10 EDCE COC[C@@](C)(CC(=O)C(=O)C[C@H]1C[C@H](N)C1)NC(=O)OC(C)(C)C 2003167288 BHBOSWCWJUJMPJ-PSTGCABASA-N 342.436 1.572 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCCN=[N+]=[N-])[C@@H](O)C(C)(C)C 1989789965 LFWKTVISXHSLFG-VHSXEESVSA-N 329.401 1.713 10 10 EDCE COC[C@H](CC(=O)NCc1ccccc1O)NC(=O)OC(C)(C)C 2010151477 OSHOWHLOIQGYIJ-ZDUSSCGKSA-N 338.404 1.938 10 10 EDCE Cn1ncc(CNC(=O)COc2ccc(N)cc2)c1Br 2173185016 YPMYGEWTPHQXFF-UHFFFAOYSA-N 339.193 1.460 10 10 EDCE CC[C@@H](CO)N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 379127560 ZHKBFXFBKNQZQR-JVXZTZIISA-N 328.210 1.608 10 10 EDCE CO[C@@H]1C[C@H](O)CN(c2cc(Br)c(CN)cc2F)C1 2109015062 CKCDDXMWKNMXJH-VHSXEESVSA-N 333.201 1.633 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213586270 ABSHRHKSYDFOGK-NNYUYHANSA-N 339.396 1.704 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3COC[C@@]3(CO)C2)cc1Br 2234546825 CCSYKJBMRJVFOC-ZETOZRRWSA-N 341.249 1.914 10 10 EDCE OCc1ccc(N2C[C@H]3COC[C@@]3(CO)C2)cc1Br 2226176841 SYMLZYDEGUVKIZ-FZMZJTMJSA-N 328.206 1.387 10 10 EDCE OC[C@@H]1NC[C@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]21 2227311129 AIUODBZGLWQQJH-DRZSPHRISA-N 327.222 1.167 10 10 EDCE CN1CC2(CCC1=O)CN(c1ccc(CN)cc1Br)C2 2289726421 HYJKOTDPJBEBGI-UHFFFAOYSA-N 338.249 1.966 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)c1cn(C)[nH]c1=NC(=O)OC(C)(C)C 2300532678 ZKPGKFQWMCRUJE-UHFFFAOYSA-N 337.384 1.961 10 10 EDCE CO[C@H](CNCc1ccc(O)c(O)c1O)CNC(=O)OC(C)(C)C 2301664958 PQVODRPCAZYWIE-LLVKDONJSA-N 342.392 1.433 10 10 EDCE NCC[C@@H](COCc1ccccc1)NC(=O)c1cccc(O)c1O 2303742139 OOASTRGNUNKDFA-AWEZNQCLSA-N 330.384 1.762 10 10 EDCE CC(=O)NCC(=O)N(C)Cc1ccc(C)c(Br)c1O 2352655675 LWIUWIJSKNSPFJ-UHFFFAOYSA-N 329.194 1.558 10 10 EDCE C[C@H](CS(C)(=O)=O)N(Cc1cc([N+](=O)[O-])ccc1O)C1CC1 173396597 QFORSUDASQCJEF-SNVBAGLBSA-N 328.390 1.698 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@]1(C(=O)O)c1ccc(O)c(O)c1O 1952723832 LEBNBWMMBKEKRG-RFAUZJTJSA-N 325.317 1.423 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2357586332 XIFMLNQOXXTTIK-VWQNXBSZSA-N 342.233 1.823 10 10 EDCE O=C(c1ccc(O)c(O)c1)N1CC(n2ccc(Br)n2)C1 2361658363 IFFQAYQLMZPRCA-UHFFFAOYSA-N 338.161 1.754 10 10 EDCE C/C=C/C[C@@H](C)[C@@H](O)[C@H](C(=O)C(=O)[C@@H](C)NCCCC)N(C)C 77286295 KEWIYOGWOCZCJC-GJNRNENWSA-N 326.481 1.796 10 10 EDCE in-vitro O=[N+]([O-])c1cc(Cl)cc(CN2CC[C@@H](N3CCOCC3)C2)c1O 120992369 ICLFABVPZQIDCL-CYBMUJFWSA-N 341.795 1.860 10 10 EDCE Cn1ncnc1CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 74912769 DIQJLWACBLJHIH-CQSZACIVSA-N 345.403 1.412 10 10 EDCE CN(C)c1ccc(C=c2sc(=CC(=O)C(C)(C)C)n(C)c2=O)cc1 254740179 MSLMSHYSPAJPIA-UHFFFAOYSA-N 344.480 1.737 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCC[C@@H]1CCNC1 254950741 URBIRLZVOUXEFC-SVEBXFOSSA-N 329.444 1.652 10 10 EDCE CC[C@H]1NC(=O)N(CCN2CCN(c3ccc(OC)cc3)CC2)C1=O 272350873 FTAYZMQZJQIKDS-MRXNPFEDSA-N 346.431 1.148 10 10 EDCE COc1ccc(CNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3C)C2)c(O)c1 373398725 HYCFNJNCOWMGME-SUHUHFCYSA-N 333.388 1.209 10 10 EDCE CN1CCN(c2ccc(CN3CCO[C@@]4(CCCOC4)C3)cc2)CC1 809687441 ZIQPOSTZYNEPRP-FQEVSTJZSA-N 345.487 1.820 10 10 EDCE CC(=O)C(=O)COC(=O)c1cn2ccc(Br)cc2n1 808550975 XXWRAOXMMXNDCE-UHFFFAOYSA-N 325.118 1.412 10 10 EDCE COCCN(Cc1cc(Cl)cc(C)c1O)[C@H]1CCS(=O)(=O)C1 809764288 WBIWLMOLTBKLAB-AWEZNQCLSA-N 347.864 1.990 10 10 EDCE COc1ccc(O)c(CNc2nc(NCCO)nc(NC(C)C)n2)c1 811805804 ALJVHWOJRNIXAT-UHFFFAOYSA-N 348.407 1.422 10 10 EDCE CN1CCN(c2ccc(CN3C[C@H]4CC[C@H]3[C@@H]3CNC[C@H]43)cc2)CC1 903962030 HKUICRHUHWLGMU-WLRLJWMZSA-N 340.515 1.868 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)/C=C/Cn1cncn1 910559965 YUORADLGJQXYHQ-LLYBFZRZSA-N 327.432 1.956 10 10 EDCE Nc1c(C(=O)OCCCO)ccc2c1C(=O)c1ccccc1C2=O 744474008 MURPAXCUBMBOGL-UHFFFAOYSA-N 325.320 1.583 10 10 EDCE NC[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)C(F)(F)F 848594667 FQSIZRWXKJTBEY-CYBMUJFWSA-N 346.353 1.212 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCNC[C@H]1C 842265699 LZVQWNHGMMOHTI-RHSMWYFYSA-N 346.475 1.215 10 10 EDCE COC(=O)/C(C)=C\CNC(=O)N(C)CCN(C)c1ccc(OC)cc1 925012083 WKZHZMOBWKCEHK-UVTDQMKNSA-N 349.431 1.892 10 10 EDCE CC(C)NC(=O)[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 853603368 QRCRYEXAIDNPQO-MLGOLLRUSA-N 334.416 1.555 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3n[nH]c(C)c3[N+](=O)[O-])C2)cc1 855231367 VWRBGCYPFWQOEL-LLVKDONJSA-N 345.359 1.644 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](CO)CC3CC3)C2)cc1 854296595 KKQBVJRCMNPWSR-HZPDHXFCSA-N 347.459 1.982 10 10 EDCE C[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1cncnc1 856213630 QXFRNRISUSSPBX-AWEZNQCLSA-N 340.427 1.858 10 10 EDCE NC(=O)C[C@@H]1CN(Cc2cc(Br)ccc2O)CCO1 862534491 CWBWNYGXLQEKJG-LLVKDONJSA-N 329.194 1.231 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)CN1C(=O)NC(C)(C)C1=O 769293878 VKRWPANSIKZUDQ-UHFFFAOYSA-N 333.388 1.461 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)CC3(C)COC3)cc2)CC1 935568778 GRKWVILAVHNLNO-UHFFFAOYSA-N 345.443 1.398 10 10 EDCE CO[C@H](CS(=O)(=O)N[C@H](C)c1ccccc1O)[C@@H]1CCOC1 867834437 IHYLKCMJYOUTPC-LALPHHSUSA-N 329.418 1.424 10 10 EDCE Cc1cc(C)c([C@@H](C)NC[C@]23COCCN2C(=O)COC3)c(O)c1 866551529 APXQEPCHZGBLBR-RDTXWAMCSA-N 334.416 1.287 10 10 EDCE CCS(=O)(=O)c1cccc(C(=O)NCc2ccc(O)c(O)c2)c1 778923679 PHKWIQUPYJKIHC-UHFFFAOYSA-N 335.381 1.821 10 10 EDCE COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc(C)cnc1N 775286944 RLWMRLWBQRVLRZ-UHFFFAOYSA-N 337.357 1.265 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2C(=O)CC[C@@H]2C1 897272769 KFEUUXALKMSYID-SNVBAGLBSA-N 332.381 1.759 10 10 EDCE O=C(Cn1cc(NC(=O)c2cccc(O)c2O)cn1)NC1CCCC1 790597704 FCUCEMXQVDSNSN-UHFFFAOYSA-N 344.371 1.605 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNc3cnc(O)nc3O)cc2)C1 1321777047 TZHGRNGCVDTAAV-GFCCVEGCSA-N 343.387 1.202 10 10 EDCE CCC1(C(=O)N(C)C[C@@H](C)NC(=O)c2cc(OC)nc(OC)c2)CC1 1337438395 SBFSCMRPFBDKBU-GFCCVEGCSA-N 349.431 1.866 10 10 EDCE C[C@@H]1CO[C@@H](C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1332005353 UXXFAUUWLMDZIL-SUMWQHHRSA-N 345.443 1.430 10 10 EDCE CC[C@@H]1C[C@H]1NC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1334207472 ANHDJNQPTCUEOB-DVOMOZLQSA-N 331.416 1.305 10 10 EDCE NC(=O)[C@H]1CCN(c2ccc(C=CC(=O)O)c(Br)c2)C1 1911938785 XTXPMHXJVZSEJV-JTQLQIEISA-N 339.189 1.859 10 10 EDCE CCOc1ccc(NC(=O)Cc2ccc(O)c(O)c2)c(C(N)=O)c1 1293727405 ODSDMFQCPYANRN-UHFFFAOYSA-N 330.340 1.777 10 10 EDCE CCN(CC)c1ccc(CNC(=O)CC[C@H]2CC[C@@H](C(N)=O)O2)cc1 1527396149 TUSBZHIDFSQYIO-SJORKVTESA-N 347.459 1.962 10 10 EDCE C[C@@H]1Oc2ccc(NC(=O)Cc3ccc(O)c(O)c3)cc2NC1=O 1463809968 SCSDBBDPYUYHDU-VIFPVBQESA-N 328.324 1.998 10 10 EDCE C[C@@H]1C[C@@H]1C(=O)NC/C=C/CNC(=O)c1ccc(N=NC(N)=O)cc1 1533354804 PACUKZYJJURHFK-HABJLWKKSA-N 343.387 1.907 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cocn2)cc1C 1486264572 GUNPGGJDEWCYGY-AWEZNQCLSA-N 333.388 1.214 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@H]3[C@H](C2)C3(F)F)c1 1620707690 MHSFRKXBSNKZKQ-MNOVXSKESA-N 346.355 1.491 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CS(=O)(=O)Cc3ccccc32)c(O)c1O 1557618372 CYXRDOBXLCSDKF-AWEZNQCLSA-N 347.392 1.806 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC[C@H]2CCN(CCCO)C2)cc1 1494082382 FEEPAFZQMULCGM-ZDUSSCGKSA-N 347.419 1.673 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2coc(C)c2)cc1C 1732640090 FKLGPDLVYCTSHQ-MRXNPFEDSA-N 332.400 1.786 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cnn(C)c2-n2cnnc2)c1 1595800155 QSXQTJRUXLSKMZ-JTQLQIEISA-N 342.359 1.206 10 10 EDCE CCN(CCO)C(=O)CN1C(=O)/C(=C/c2ccco2)SC1=S 16905436 NFLUKXLMGAXYPK-FLIBITNWSA-N 340.426 1.322 10 10 EDCE O=C(O)[C@@H]1C[C@@H](O)CN1Cc1cc(Br)cc(F)c1O 1963597603 ZOEAPSTTXULBJW-SCZZXKLOSA-N 334.141 1.314 10 10 EDCE CO[C@@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C[C@@H]1F 2146468805 CSMNNWKVLBSOFE-XXILOJSOSA-N 344.184 1.574 10 10 EDCE CCO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NCCN=[N+]=[N-] 1985095609 GUTXLJPUUIMVRI-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CN(C)C(=O)[C@H]1COCCN1c1ccc(CO)cc1Br 2155016700 JBJACYGVYLLYEE-CYBMUJFWSA-N 343.221 1.235 10 10 EDCE OCc1cc(=NCCc2ccc(O)c(O)c2)[nH]cc1Br 2157702638 LRAOWVHCMXUAAS-UHFFFAOYSA-N 339.189 1.824 10 10 EDCE CN[C@@H](C)c1ccc(N(C)[C@@H]2CC(=O)NC2=O)cc1Br 2171205700 RBJFRFZANQUNIB-QPUJVOFHSA-N 340.221 1.581 10 10 EDCE CN1C(=O)N[C@@H]2CN(c3ccc(CN)c(Br)c3)CC[C@@H]21 2171305824 WSVFPJNMMGLIPL-OLZOCXBDSA-N 339.237 1.510 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC[S@](=O)C(C)(C)CC3)c2n1 2062767894 CILXFZVPDIIHSA-QHCPKHFHSA-N 336.417 1.117 10 10 EDCE Oc1cc(Br)ccc1CNC[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@H]2O 2174413701 PLZSZCKUIKHJMQ-ZCNHVBTFSA-N 342.233 1.622 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C[C@H](O)C1 2213587630 JSVWLSSTQBRDNY-USXUVBGUSA-N 339.396 1.752 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2C[C@@H](O)C[C@H]2O)c1O 2227748442 AJNOJWXDUWJFJE-AVPPRXQKSA-N 332.194 1.137 10 10 EDCE CNC[C@@]1(O)CCCN(Cc2c(O)cccc2Br)C1 2270832808 VACAYQCNFVHKMQ-AWEZNQCLSA-N 329.238 1.701 10 10 EDCE O=C1NC(=S)NC(=O)C1=CC=Cc1coc2ccc(F)cc2c1=O 2297463166 GRFDNEXDISOBBA-UHFFFAOYSA-N 344.323 1.403 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2329325821 JJRCKHCJHBKQSZ-NZPIUUIZSA-N 327.222 1.099 10 10 EDCE CNC(=O)c1ccc(S(=O)(=O)NCc2ccc(N(C)C)cc2)cc1 29188198 OPRNAPVXIYTECL-UHFFFAOYSA-N 347.440 1.591 10 10 EDCE CN1CCN(C2=NC(=O)/C(=C3\C(=O)Nc4ccccc43)S2)CC1 34209606 BEZGZSHNEXIRDC-OUKQBFOZSA-N 328.397 1.227 10 10 EDCE C[C@H]1COCCN1CCN(C)Cc1ccc(N2CCOCC2)cc1 192693032 JNJKWBGREWSLIH-KRWDZBQOSA-N 333.476 1.676 10 10 EDCE CS(=O)(=O)N[C@H]1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 93530970 LJSGVUNANKGUMY-JTQLQIEISA-N 349.796 1.077 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(C)Cc3cnccn3)nc12 266944659 SAIIXAYDHITYPL-UHFFFAOYSA-N 342.359 1.034 10 10 EDCE Cc1cc(C[C@@H](C)NC(=O)C(=O)NCc2ccc(N(C)C)cc2)n[nH]1 283677052 ZKDIHQSXRAQCQX-GFCCVEGCSA-N 343.431 1.148 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CNC(=O)c1cccnc1 808095269 BHZZMCIOHZDVDG-UHFFFAOYSA-N 334.372 1.319 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CC[C@H](C(=O)O)C1 393211961 SOXAEUUFQKKMHD-CVEARBPZSA-N 346.427 1.983 10 10 EDCE Cc1c(Cl)c(/C=C2/SC(N3CCOCC3)=NC2=O)nn1C 817344166 WEKJRXZNBFYLAU-JXMROGBWSA-N 326.809 1.684 10 10 EDCE CCOc1ccc(O)c(CN2CCS(=O)(=O)[C@H]3CCC[C@H]32)c1 825202673 SWBWBWUMOUZLRM-ZBFHGGJFSA-N 325.430 1.942 10 10 EDCE C[C@H](N)c1ccc(N2CCN3C(=O)NC[C@H]3C2)c(Br)c1 723182806 OWJKTIFYWKWGGR-ONGXEEELSA-N 339.237 1.683 10 10 EDCE O=C(NCc1cc(Br)ccc1O)C1(CO)CCOCC1 837643052 KUHYQRGNMSSORB-UHFFFAOYSA-N 344.205 1.560 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@@]2(C)C[C@@H](O)CN2C)cc1 911890931 DMQZKURDIPMSFY-CRAIPNDOSA-N 335.448 1.045 10 10 EDCE O=C(O)CN(Cc1ccccc1O)C(=O)Cc1cnn2c1CCCC2 911488295 KZBSZTMLPWIYKR-UHFFFAOYSA-N 343.383 1.581 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@]2(CO)COCCN2)cc1 913190961 KJLVNPJWDVJPKB-IBGZPJMESA-N 343.427 1.175 10 10 EDCE CN(C)c1ccc(CN(C(=O)c2cc(C(N)=O)cn2C)C2CC2)cc1 755128450 JQNZSSMYVOFNON-UHFFFAOYSA-N 340.427 1.995 10 10 EDCE CNc1cnc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)cn1 859096463 DSVMBELOPQWZNV-UHFFFAOYSA-N 341.415 1.926 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CC[C@H](C(N)=O)C3)C2)cc1 852375312 AFHXIJQAUWCLJM-MJBXVCDLSA-N 346.431 1.227 10 10 EDCE Cc1cc(CC(=O)N2CC(=O)N[C@H](C)C2)c(C)n1-c1ccccc1 854825496 GXBFIDMFAVOEGK-CYBMUJFWSA-N 325.412 1.984 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCN(C)[C@@H]3C)C2)cc1 923185924 QOKGDINDJIIZGW-KEYYUXOJSA-N 332.448 1.666 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3(CCO)CC3)C2)cc1 854298514 DKWOXJAEXKEYSO-CQSZACIVSA-N 333.432 1.736 10 10 EDCE CN(C[C@H](O)CN(C)C(=O)c1cc(O)cs1)C(=O)OC(C)(C)C 869568783 HPNAREYNLDFQMR-LLVKDONJSA-N 344.433 1.754 10 10 EDCE C[C@H](C(=O)NCc1cc(Br)ccc1O)[C@@H]1CCC(=O)N1 861687346 MKDCXTBBHINZBF-KWQFWETISA-N 341.205 1.686 10 10 EDCE COCCO[C@H]1COCC[C@H]1NC(=O)N[C@@H](C)c1ccccc1O 868517793 NBNKZTLRBZJNKK-BJJXKVORSA-N 338.404 1.573 10 10 EDCE OC[C@@H]1CC(F)(F)CN1Cc1ccc(N2CCOCC2)c(F)c1 783703267 WWRWPBVPXUFCBT-ZDUSSCGKSA-N 330.350 1.864 10 10 EDCE COc1cccc(CNC(=O)c2cccc(-n3cncn3)n2)c1O 1137473432 JOLAUDGSJGZUFI-UHFFFAOYSA-N 325.328 1.307 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)C[C@@H]2CO)cc1Br 698118147 XKMGELCTYAXRFF-YUSALJHKSA-N 329.238 1.661 10 10 EDCE C[C@@H](C(=O)NCc1cccc(Cl)c1O)n1cnc2c(N)ncnc21 1305084849 NYCUOGDTSCDSKH-QMMMGPOBSA-N 346.778 1.645 10 10 EDCE CNC(=O)[C@]1(C(F)(F)F)CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1300232897 KQQFNPSNQFQAEZ-AWEZNQCLSA-N 346.305 1.167 10 10 EDCE CN(CCN(C)C1COC1)c1ccc(CN)c(Br)c1 2116482077 JDRFXZHQUODHQH-UHFFFAOYSA-N 328.254 1.675 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@@H]2CCC2(C)C)cc(OC)n1 1354653988 JJIJPQOZOZHVMF-AAEUAGOBSA-N 349.431 1.770 10 10 EDCE COCC(=O)NC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(C)C 1357083046 YUGAUOZROWHSDL-CYBMUJFWSA-N 349.391 1.366 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccncc2C)cc1C 1507188465 FESMRRFBFSEHBH-INIZCTEOSA-N 343.427 1.588 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CCCn3ncnc32)cc1 1557355112 CNYKPTHULYSRMB-MRXNPFEDSA-N 343.431 1.759 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc2n(n1)CCC[C@@H]2O 1636058837 STXNCARAGOWAER-ZDUSSCGKSA-N 336.388 1.832 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCCc1nc2c(s1)COCC2 1639566628 ZHZPROLDUJZRCP-DUXPYHPUSA-N 346.408 1.999 10 10 EDCE COC(=O)[C@H]1CSCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1638436867 GBCDWGBGLBLWOJ-LLVKDONJSA-N 336.373 1.580 10 10 EDCE C[C@H]1C[C@H]1C(=O)NCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1738726380 ORVLKUVYTPLFMA-GXFFZTMASA-N 343.387 1.884 10 10 EDCE O=C(NC[C@H](O)COc1cccc(F)c1)c1c(F)ccc(O)c1O 1650705492 GVQMWRNJZVNEET-JTQLQIEISA-N 339.294 1.546 10 10 EDCE O=C(NCc1cccc(O)c1O)c1ccn(CCn2cccn2)n1 1593739500 OJGTXVDMGJZNRZ-UHFFFAOYSA-N 327.344 1.121 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)Cn2cccn2)cc1C 1698813798 JPBHXPFSHOJLQV-HNNXBMFYSA-N 330.432 1.837 10 10 EDCE CC(=O)Nc1ccc(NC(=O)CN2C(=O)[C@@H](C)SC2=S)cc1 11635451 BWWDGDNOBPZHNR-MRVPVSSYSA-N 337.426 1.832 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NCc1cc(F)ccc1O 1937553752 TVXYHRLGLZVMCP-QWHCGFSZSA-N 326.368 1.913 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C(NC(=O)c3cccc(O)c3O)[C@H]2C1 2006285576 VXTNFSRVUFRWRJ-QWRGUYRKSA-N 334.372 1.693 10 10 EDCE CNCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@@H]32)cc1Br 2146698662 KXDHDHDPNWZLEC-AEGPPILISA-N 341.249 1.897 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CC(=O)Nc2ccc(N)cc2)C1 2022830060 LFZVJIMXAUUWOK-RISCZKNCSA-N 335.404 1.825 10 10 EDCE C[C@H]1CN(C)C[C@@H](CNCc2c(O)cccc2Br)O1 706835100 QHOZVSANCHOCJD-WDEREUQCSA-N 329.238 1.963 10 10 EDCE CNCc1ccc(N2C[C@@H]3OC(=O)N(C)[C@H]3C2)cc1Br 2176933060 MGLYEYALMGJMEY-STQMWFEESA-N 340.221 1.808 10 10 EDCE CN1C(=O)O[C@H]2CN(c3cc(Br)c(CN)cc3F)C[C@@H]21 2176925302 YPSILNKSJXBJMZ-RYUDHWBXSA-N 344.184 1.686 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)CNCc2ccccc2O)CC1 378912206 JPMHFTMZZIDLKW-UHFFFAOYSA-N 349.431 1.561 10 10 EDCE CN1CCN(c2ncc(C(=O)NCc3c(O)cccc3O)s2)CC1 2062368670 ISZQHGUELQWFOE-UHFFFAOYSA-N 348.428 1.236 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N(C)C[C@@](C)(O)c3ccccc3)c2n1 2062858728 HSWIKKZYYCLYRT-GOSISDBHSA-N 340.383 1.723 10 10 EDCE O=C(NCc1ccccc1O)c1cc2n(n1)CC1(CCNCC1)OC2 2064411480 BGBDOYFIFGQKPL-UHFFFAOYSA-N 342.399 1.171 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC4(CCC4)[C@@H]3[C@@H]3CCCO3)c2n1 2064815463 XWNZGNAJJPFNFC-ZFWWWQNUSA-N 342.399 1.917 10 10 EDCE CCNCc1ccc(N2CC[C@](C)(O)[C@H](O)C2)c(Br)c1 2197965411 JAABAUTUMGEIQU-CABCVRRESA-N 343.265 1.881 10 10 EDCE Nc1ccc(CC(=O)NC[C@H]2CCCCN2C(=O)C(F)(F)F)cc1 2044203742 CFUXDTFANNOHSZ-CYBMUJFWSA-N 343.349 1.871 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(OCCO)C2)cc1Br 2095969947 QTJCWOIZZVWVFE-JTQLQIEISA-N 329.238 1.927 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@]2(C)CO)c(OC)c1Br 2234881149 OOVBMCKOUKOVLY-LKFCYVNXSA-N 346.221 1.788 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2236637053 RCHZCWDGGKWHCR-UTUOFQBUSA-N 343.265 1.896 10 10 EDCE Cn1nc(Br)c(C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)n1 2226978106 ICEWMGOOXXFCDM-SSDOTTSWSA-N 328.174 1.883 10 10 EDCE O=C1CC[C@H](COC(=O)C=Cc2ccc(N3CCOCC3)cc2)N1 2297507179 MCDWKHTWRDZCHX-OAHLLOKOSA-N 330.384 1.358 10 10 EDCE CCc1nc(NC(=O)C=Cc2ccc(N3CCOCC3)cc2)n[nH]1 2300315541 CPBZOQQQYAOHFY-UHFFFAOYSA-N 327.388 1.856 10 10 EDCE CCCS(=O)(=O)N(C)NCc1cccc(Br)c1O 2317496269 CLMACGUNILHPIS-UHFFFAOYSA-N 337.239 1.831 10 10 EDCE Cc1ccc(CN2CC(=O)NC(=O)[C@H]2C)c(O)c1Br 2352940087 BNUNPQNCHUITFL-MRVPVSSYSA-N 327.178 1.310 10 10 EDCE COC(=O)CN1C(=O)N/C(=C\c2ccc(N3CCCC3)cc2)C1=O 6714513 YAVUFILUCKCKAS-UVTDQMKNSA-N 329.356 1.353 10 10 EDCE COC(=O)c1ccc(OC(=O)[C@@]23CC[C@@H](C(=O)C2=O)C3(C)C)cc1 101103756 UDVCPVVZPCJDBG-KPZWWZAWSA-N 330.336 1.953 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCCCOCc1ccccc1 310282141 VVYWRMKZNQTTQQ-INIZCTEOSA-N 344.411 1.691 10 10 EDCE CC(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)C(C)(C)C1 184727018 GMLDSXRXIAFRMO-UHFFFAOYSA-N 331.460 1.966 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@@H](c3nc(N(C)C)no3)C2)c(O)c1O 194482024 YPHHVVGGJYNVPM-LLVKDONJSA-N 346.387 1.875 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1[C@@H](N)Cc1ccc(O)c(O)c1 1953010006 TXMVQKWLVILPJP-QWHCGFSZSA-N 338.404 1.604 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN2CCOC[C@H]2C1 365047524 VMQMOWPZIVVVDB-GOSISDBHSA-N 342.443 1.289 10 10 EDCE Cc1ccc(CN2C[C@@H]3[C@H](CO)CO[C@H]3C2)c(O)c1Br 2380802064 BNEFIKOTVPLCED-UPJWGTAASA-N 342.233 1.902 10 10 EDCE Cc1ccc(CN2CCN(C)[C@@H](C(=N)N)C2)c(O)c1Br 2381125480 HBDCEQMFCJJAPR-LLVKDONJSA-N 341.253 1.515 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2[C@H]3CNCC[C@H]32)c(O)c1Br 2381141968 HDNGCAQVMGSCHZ-WOPDTQHZSA-N 339.233 1.935 10 10 EDCE C[C@]1(C(=O)NCc2cc(Br)ccc2O)CCC(=O)NC1 804741200 UWMASKRKTRWTAI-AWEZNQCLSA-N 341.205 1.687 10 10 EDCE CCOC(=O)NCC(=O)NCc1cc(Br)ccc1O 804738724 BGJPBDKBQJLMMA-UHFFFAOYSA-N 331.166 1.517 10 10 EDCE O=C1CC[C@@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCN1 815860648 VIENHDAPQDXKMM-GDBMZVCRSA-N 346.427 1.816 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cnc2n1CCOC2 823295713 NVJXEWIHFCITLR-UHFFFAOYSA-N 342.399 1.180 10 10 EDCE C[C@@H](NC1CC(CC(N)=O)C1)c1ccc(N2CCOCC2)c(F)c1 903261708 VOUASNKSNHASEA-DNOWBOINSA-N 335.423 1.967 10 10 EDCE CCC/C=C\[C@H](O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 900268462 CLWHXGSPFKUSHG-CHYADLBTSA-N 336.407 1.996 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)Cc2c(O)ncnc2O)cc1 911892696 MTBALVSETWSDNE-UHFFFAOYSA-N 346.387 1.034 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@@H]2CN(C3CC3)C(=O)O2)cc1 847276226 FNJCXRGUBNDAOI-OAHLLOKOSA-N 332.404 1.535 10 10 EDCE COC[C@]1(C(=O)NCCN=[N+]=[N-])C=CCN1C(=O)OC(C)(C)C 1900002652 MCVZDVNKHZRJBM-AWEZNQCLSA-N 325.369 1.605 10 10 EDCE COC(=O)[C@H]1C[C@@H](N(C)CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 852694049 IWWXSRCOWMWIKN-WOVMCDHWSA-N 347.459 1.594 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cn(C)c(C)cc3=O)C2)cc1 855224966 MHDDUWAJJWQHSE-CQSZACIVSA-N 341.411 1.711 10 10 EDCE O=C1N[C@]2(C(=O)NCc3ccc4cccnc4c3O)C[C@H]3C[C@@H]1[C@H]2C3 862025499 WOUKKLFRRFYLQO-SOANZDDASA-N 337.379 1.471 10 10 EDCE COCCOCCN(CCO)Cc1ccc(Br)cc1O 862468865 QOVYKCVKTOWMNJ-UHFFFAOYSA-N 348.237 1.612 10 10 EDCE CN1CC[C@H]2CN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC[C@@H]21 866205417 LODBYCNPMYKYQV-JQWIXIFHSA-N 332.360 1.456 10 10 EDCE COC[C@@H](C)OC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 867161544 FBHIVRZIXYAEHV-CQSZACIVSA-N 349.431 1.616 10 10 EDCE CN1CCN(c2ccc(CN[C@H]3CCO[C@]4(CCOC4)C3)cc2)CC1 771873219 VEDPTADLYPSGGV-AZUAARDMSA-N 345.487 1.866 10 10 EDCE COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(OC)c1O 770374301 LBGJQHWHSBNGQR-QHSBEEBCSA-N 349.383 1.326 10 10 EDCE N[C@]1(C(=O)O)CCN(Cc2cc(Br)cc(F)c2O)C1 715770061 MTXQZRDBSAHNFT-GFCCVEGCSA-N 333.157 1.282 10 10 EDCE COc1ccc(N2CCCN(C(=O)Cn3nccc3N)CC2)cc1 1141985545 ZRUFDOSQNXWKRR-UHFFFAOYSA-N 329.404 1.213 10 10 EDCE C[C@H](NC(=O)c1ccc(S(N)(=O)=O)s1)c1ccccc1O 1302532406 BDKUSUNFERLYRM-QMMMGPOBSA-N 326.399 1.592 10 10 EDCE O=C(C(=O)N1CCOC2(CCCC2)C1)N1Cc2cccc(O)c2C1 1329436999 KFZIHPPYPDTPKP-UHFFFAOYSA-N 330.384 1.406 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)Nc2ccc[n+]([O-])c2)N(C)C)cc1 1344833134 YAJANOSIAWBNAT-KRWDZBQOSA-N 343.431 1.810 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@@H]2CC[C@H]3C[C@H]23)cc1 1351089775 GJLZDCNFJMSUDX-YQQAZPJKSA-N 329.444 1.921 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@@H]2CCC(=O)NC2)cc1C 1275179282 BIATVIRUVNTLHF-HOCLYGCPSA-N 347.459 1.514 10 10 EDCE C[C@@H](NCCO)[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1501091661 POCNBZVAXCMBLF-DGCLKSJQSA-N 333.392 1.282 10 10 EDCE CCNCc1ccc(N(CCO)C2COC2)cc1Br 1915504473 KSIOUJFGKPOVQU-UHFFFAOYSA-N 329.238 1.756 10 10 EDCE NC(=O)[C@@H]1CC[C@H](CCC(=O)NCc2ccc3cccnc3c2O)O1 1469249765 PDJACJBLDIJQLV-KGLIPLIRSA-N 343.383 1.370 10 10 EDCE Cc1oc(S(C)(=O)=O)cc1C(=O)NCc1ccc(O)c(O)c1 1545639182 FEFMVAIIJRFUHA-UHFFFAOYSA-N 325.342 1.333 10 10 EDCE O=C(CCNC(=O)Cc1ccccc1)NCc1ccc(O)cc1O 1626837810 FSLCVIITPQTMSH-UHFFFAOYSA-N 328.368 1.463 10 10 EDCE O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NCc1cc(O)ccc1O 1633595102 IINOEPLECBCLLS-UHFFFAOYSA-N 342.311 1.672 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccc(O[C@H]2CC(=O)N2)cc1 1640603271 UMNAZGACOHJBHN-NUJSQKRLSA-N 340.335 1.975 10 10 EDCE O=C(Cn1cc(Br)cn1)NCc1cc(O)ccc1O 1644752670 OKSMLPJUNNWHCB-UHFFFAOYSA-N 326.150 1.373 10 10 EDCE COC(=O)COc1cccc(C(=O)NCc2ccc(O)cc2O)c1 1570462258 LQGBGXMBRFQYRA-UHFFFAOYSA-N 331.324 1.580 10 10 EDCE CCOC(=O)[C@@H](C[C@H]1CCCO1)NC(=O)Cc1ccc(O)c(O)c1 1651634227 KCTHRSUCCNXCKD-CHWSQXEVSA-N 337.372 1.257 10 10 EDCE CCCn1c([C@@H]2CCC(=O)N2)nnc1N(C)Cc1ccccc1O 1766054517 OOKJPYRWUWHMSW-ZDUSSCGKSA-N 329.404 1.981 10 10 EDCE COc1cc(O)c(CN2CCCN(c3cccnn3)CC2)cc1OC 160282416 LJSNREURPPVPPQ-UHFFFAOYSA-N 344.415 1.912 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)c(Br)c1 2140662020 JVENZGIMUWSRLJ-GIMBAOAISA-N 334.185 1.382 10 10 EDCE Cn1ncc([C@H](NN)c2ccccc2O)c1I 1942401540 ULIJWUQCOSVSPH-SNVBAGLBSA-N 344.156 1.283 10 10 EDCE CO[C@@H](CNCc1ccc(O)c(O)c1)CNC(=O)OC(C)(C)C 1901545604 DFIUMZLVAQLBQY-LBPRGKRZSA-N 326.393 1.727 10 10 EDCE CC1(C)[C@@H](O)C[C@@]1(CO)NCc1ccc(Br)cc1O 1879557809 DTBSGHIJYGUVEU-JSGCOSHPSA-N 330.222 1.766 10 10 EDCE CC(C)(C)OC(=O)NC1(CNCc2c(O)cccc2F)COC1 1965990729 BCTNKMGEWROHQJ-UHFFFAOYSA-N 326.368 1.915 10 10 EDCE CC(C)(C)OC(=O)N[C@@]12C[C@@H]1CN(C(=O)c1cccc(O)c1O)C2 2006284500 RGJVSWAWMHDOKQ-BMLIUANNSA-N 334.372 1.837 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@]1(C)C(=O)NCCCN=[N+]=[N-] 1985099698 ATKXOAFLBSXQDX-HZMBPMFUSA-N 327.385 1.733 10 10 EDCE CN(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC(N=[N+]=[N-])C1 1985094515 PYRXVLHOIIAZCG-LLVKDONJSA-N 326.401 1.353 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOCC[C@@H]1C(=O)NCCN=[N+]=[N-] 1985103522 WNZDLWOTUWZIQI-WDEREUQCSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@]1(CO)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010389926 WEXAKWNJBNVAKR-ABAIWWIYSA-N 339.396 1.660 10 10 EDCE CN1CCc2cc(CNC[C@H](O)CNC(=O)OC(C)(C)C)ccc21 2011422387 ITUOZASVUSKCSK-HNNXBMFYSA-N 335.448 1.654 10 10 EDCE C[C@H](CN(C)C(=O)OC(C)(C)C)NC(=O)c1cc(O)c(O)c(O)c1 2015123700 VPLKQMRTAGLHCA-SECBINFHSA-N 340.376 1.789 10 10 EDCE CN[C@@H](Cn1cc(CNC(=O)OC(C)(C)C)nn1)c1ccccc1O 2029550822 SSBKATPVBOSANG-AWEZNQCLSA-N 347.419 1.969 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC=C(CO)CC3)c(Br)cc21 2171003219 WXSSAZSUCJZXGD-CYBMUJFWSA-N 338.205 1.530 10 10 EDCE CN(CCN1CCOC1=O)c1ccc(CN)c(Br)c1F 2171070775 SJEFEINAINRVGE-UHFFFAOYSA-N 346.200 1.935 10 10 EDCE CN(C[C@@H]1CCOC1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 398992681 PQQSCQLEZJVPNS-ISVAXAHUSA-N 340.221 1.874 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC(O)(C(F)F)C3)c(Br)cc21 2172118731 SXZRIITZEXCKBD-SECBINFHSA-N 348.147 1.217 10 10 EDCE CNCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2199528419 ZKFWKZDXCATQAE-JVOAXRGISA-N 341.249 1.489 10 10 EDCE CC[C@H](O)CN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2106620253 IBSKDLYJBCLDIM-MADCSZMMSA-N 328.210 1.608 10 10 EDCE O=S1(=O)CC[C@H]2CN(c3ccc(CO)cc3Br)C[C@@H]21 2088783613 FQDITFUHMPMDBH-GWCFXTLKSA-N 346.246 1.565 10 10 EDCE OCc1ccc(N2CCC([C@H](O)CO)CC2)c(Br)c1 2096159189 XPGOYGOGDIIACI-CQSZACIVSA-N 330.222 1.511 10 10 EDCE CNCc1ccc(N(C)[C@@H]2CCCNC2=O)cc1Br 2114632547 XIUCMQUCVVPKTB-CYBMUJFWSA-N 326.238 1.883 10 10 EDCE CC(C)(C)OC(=O)NCC12CC(C1)[C@@H](C(=O)NCCN=[N+]=[N-])CO2 2303344491 MQSMISBASWEBFI-VTWZXRTESA-N 339.396 1.733 10 10 EDCE CS(=O)(=O)[C@@H]1CC[C@@H]1NCc1cccc(Br)c1O 2319779117 JOQSLHDZPDDUOQ-WDEREUQCSA-N 334.235 1.820 10 10 EDCE Cc1ccc(CNC[C@]2(C)COCCN2)c(O)c1Br 2352952260 MRCAMFVKMDPTEY-CQSZACIVSA-N 329.238 1.931 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2355455541 ZSDARITZVXUPPP-WSOUCCKQSA-N 342.233 1.622 10 10 EDCE O=C1NC(=O)N(Cc2ccccc2)C(=O)/C1=C/NCc1ccccc1 103660065 CBBNVSJGXIIXNR-FOWTUZBSSA-N 335.363 1.939 10 10 EDCE COc1cccc(CNC[C@H]2CCC[C@@]23NC(=O)N(C)C3=O)c1O 371083964 FJMAWXZVPNGIMT-SJKOYZFVSA-N 333.388 1.211 10 10 EDCE CC(C)C[C@H](CO)N(C)C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 297926965 YGGQLSUUNMHLRR-QGZVFWFLSA-N 349.475 1.576 10 10 EDCE Cc1ccc(CNC(=O)c2nc(CN)no2)c(O)c1Br 2381131566 PLBNFCISUSNPHN-UHFFFAOYSA-N 341.165 1.235 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)CC1(C(=O)OC)CC1 295060340 YYIVWZCNYNNPGY-UHFFFAOYSA-N 341.791 1.974 10 10 EDCE CCn1nc(Br)c([C@@H](O)[C@@H](NC)c2ccccc2O)n1 2167716977 MSYNDHFCOUPSIY-JQWIXIFHSA-N 341.209 1.760 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1[C@H]2OCCC[C@@H]21 819697282 UMGMQATWJZESHA-XYPHTWIQSA-N 333.384 1.709 10 10 EDCE Cc1ccc2oc(=O)c(=O)n(OCCCOc3ccc(N)cc3)c2c1 821297506 VIWGEIRJNMUWJI-UHFFFAOYSA-N 342.351 1.743 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)OCCC[C@@H]2CCOC2)c1 828782332 TVYKEEALRDOBIR-LLVKDONJSA-N 343.401 1.737 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)[C@@H](O)C3CCC3)cc2F)CC1 825756361 QCRKBKWNYYXWCG-SFHVURJKSA-N 349.450 1.745 10 10 EDCE CC1(C)[C@@H](NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)C[C@H]1O 588530407 GURKMGYFCDKGPN-BGHPOGFGSA-N 330.428 1.812 10 10 EDCE CCn1c(O)nnc1C1CCN(C(=O)Cc2ccc(N)cc2)CC1 831346379 GRUULHHCGHKHFT-UHFFFAOYSA-N 329.404 1.535 10 10 EDCE CN(Cc1ccccc1O)c1nnc(-c2cn(C)nn2)n1CC1CC1 831347316 SWRRWEUFKTUARQ-UHFFFAOYSA-N 339.403 1.826 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)NC[C@H]2CN(C3CC3)C(=O)O2)c1 848573038 XGYCVVHGHMNFJB-MFKMUULPSA-N 334.372 1.813 10 10 EDCE COc1ccc(N2CC[C@H](Nc3ncc([N+](=O)[O-])c(N)n3)C2)cc1 853758374 DAXMACWXYGMPKS-JTQLQIEISA-N 330.348 1.666 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)C=C3CCNCC3)C2)cc1 852894432 WBSBVTJBAHJXDX-MRXNPFEDSA-N 329.444 1.948 10 10 EDCE CCn1cc(CC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)nn1 930745439 XVAOMQKFWFZOBO-CQSZACIVSA-N 343.431 1.555 10 10 EDCE Cc1cnc(N)c(S(=O)(=O)NCc2ccc(N(C)C)cc2C)c1 766809402 LHIABOHQQASASP-UHFFFAOYSA-N 334.445 1.825 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2[C@H]3CC[C@]4(COC(=O)[C@H]24)O3)c1 860242456 RQLULBSLLHJWBW-LLIXLZBKSA-N 347.367 1.299 10 10 EDCE COC(=O)c1cc(OCC(=O)NCC(F)(F)F)ccc1N(C)C 865395704 AOOAJLKYXFYLPK-UHFFFAOYSA-N 334.294 1.597 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCC(N)=O)C1 769663011 JOZXCTUROFYSJY-UHFFFAOYSA-N 329.400 1.436 10 10 EDCE CN1CCC[C@H]2CN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC[C@H]21 1118953520 UCUNETHRAFHEIL-GOEBONIOSA-N 343.427 1.177 10 10 EDCE CC(C)[C@H](C(=O)N1Cc2cccc(O)c2C1)N1CCCS1(=O)=O 871203470 MHDBYPIARKFJAW-OAHLLOKOSA-N 338.429 1.295 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1[C@H]2OCCC[C@@H]21 780388857 FBZRBDVPDFTUGZ-OLMNPRSZSA-N 348.418 1.828 10 10 EDCE C[C@H](O)c1ccc(N(C)C[C@H](O)CN(C)C)c(Br)c1 690318629 WGRLLXLNSYNQHS-CMPLNLGQSA-N 331.254 1.861 10 10 EDCE O=S1(=O)CCC(S(=O)(=O)Nc2ccc(O)cc2Cl)CC1 70334366 LLTMEAYVFHHAJA-UHFFFAOYSA-N 339.822 1.365 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@]3(C)C[C@@H](O)CN3C)CC2)cc1 1333111325 OWDCDZFJYVFVFR-APWZRJJASA-N 347.459 1.189 10 10 EDCE C[C@@H](CCO)N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 1917039460 ITOHOYWGBZAYOV-JVXZTZIISA-N 328.210 1.608 10 10 EDCE O=C(CNC(=O)c1cc2cc(O)c(O)cc2s1)NCC(F)(F)F 1291686869 UGFXUFQSWFXLEA-UHFFFAOYSA-N 348.302 1.721 10 10 EDCE CN(C)C(=O)N(C)[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1454146559 KOPSAKQKKUFDLE-CYBMUJFWSA-N 346.391 1.677 10 10 EDCE CC(C)(C)OC(=O)N1CCC(NCc2ccc(N)cc2)(C(N)=O)CC1 1922201169 XTSSWRKOQOXRHF-UHFFFAOYSA-N 348.447 1.613 10 10 EDCE CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)/C=C/c1ccc(O)c(O)c1 1611277412 ILHWLHUKIODGJR-JKNJVXJCSA-N 337.372 1.320 10 10 EDCE CCOc1ccccc1C(=O)NCC(=O)NCc1ccc(O)cc1O 1626838255 UGAHQAYLONGJQB-UHFFFAOYSA-N 344.367 1.543 10 10 EDCE CN(C)c1ncc(CNC(=O)c2ccc(N=NC(N)=O)cc2)n1C 1632807235 QYRRJIWGUMWVHZ-UHFFFAOYSA-N 329.364 1.579 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2[nH]ccc2C)cc1C 1568558280 QBEDQHIKYKYARZ-HNNXBMFYSA-N 331.416 1.521 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1CCN(C)C1=O 1497439471 QMCJDNFJNMLCGR-INIZCTEOSA-N 347.459 1.420 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1cc(-n2ccnn2)ccc1F 1630273711 UDUSNFYOOWJVPM-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE COc1cc(OC)c(C(=O)NCCc2ccc(O)c(O)c2)cc1C=O 1566370014 IQAYOQFZXJDQOB-UHFFFAOYSA-N 345.351 1.900 10 10 EDCE CC(C)(C)OCC(=O)NC(C)(C)C(=O)NCc1c(O)cccc1O 1645362727 ANSJMHKXTYCDGU-UHFFFAOYSA-N 338.404 1.424 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]2c2nncn2C)cc1 1642580235 JRJVTPJAXHQQJP-MRXNPFEDSA-N 342.447 1.334 10 10 EDCE C[C@@H](CNC[C@@H]1CCOC1)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1732461942 YJHMNLWYIGNYMO-STQMWFEESA-N 347.419 1.936 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCn2cncn2)cc1C 1662168865 FJWZRYMNFWEICI-AWEZNQCLSA-N 331.420 1.280 10 10 EDCE CC[C@@H](CNC(=O)C1(CC)CC1)NC(=O)c1cc(OC)nc(OC)c1 1759351505 PXEBZJOSOOCRTM-ZDUSSCGKSA-N 349.431 1.914 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)C[C@]2(C)CCS(=O)(=O)N2)c1 1595806338 HHAALNYPYNSHKF-BMIGLBTASA-N 342.417 1.050 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2nc(C3CCOCC3)n[nH]2)c1 1683287938 VOKVTPCTRFXVAH-UHFFFAOYSA-N 345.403 1.712 10 10 EDCE CCN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)[C@@H](C)C(=O)NC 1691058833 KUUGTJCZCCTTPD-NSHDSACASA-N 348.407 1.035 10 10 EDCE Nc1ccc(CCNC(=O)[C@@H]2CCCN2C(=O)c2ccccn2)cc1 152575252 RWDFJNJVQUWXEU-KRWDZBQOSA-N 338.411 1.627 10 10 EDCE CN1CCN(c2ccc(CNC(=O)NCC[C@H]3CCNC3)cc2)CC1 891997903 AUUZMPMMKJCAOQ-QGZVFWFLSA-N 345.491 1.237 10 10 EDCE C[C@H](O)[C@@H]1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 167822977 OVADIXOZUJYCPR-DAROEXNTSA-N 340.221 1.608 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4[C@@H](CO)[C@@H]4C3)c(Br)cc2[C@@H]1O 2146874407 HDYYRNLLETVYAJ-QARKVSRYSA-N 339.189 1.109 10 10 EDCE O=C1NC(=O)[C@H](CCCNCc2c(O)cccc2Br)N1 2150333897 OISDRPXSSHVDDC-JTQLQIEISA-N 342.193 1.233 10 10 EDCE Cn1ncc(C(=O)NCCCN=[N+]=[N-])c1CNC(=O)OC(C)(C)C 2010389706 TYMWVLQFCKKYOK-UHFFFAOYSA-N 337.384 1.875 10 10 EDCE CCCN(Cc1cc(Br)ccc1O)[C@@H]1CC(=O)NC1=O 2171200150 CXMTXDGSNFVVJC-LLVKDONJSA-N 341.205 1.782 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNCc2ccc(O)cc2O)C1 702786719 GDEPAVWCCYRAKP-SWLSCSKDSA-N 338.404 1.415 10 10 EDCE NC(=O)Cn1cc(NCc2ccc(Br)cc2O)cn1 691441774 ATRRZXJEYSRCHB-UHFFFAOYSA-N 325.166 1.449 10 10 EDCE C[C@@H]1OCCN(Cc2cc(Br)cc(F)c2O)[C@H]1C(=O)O 715771222 UKEJHAXCLJGUSE-WRWORJQWSA-N 348.168 1.968 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H]4COC[C@H]4C3)c(Br)cc21 718191917 MFPKHUTYMNGLLA-BFHDXFOESA-N 338.205 1.484 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)C[C@]2(C)CO)cc1Br 698136296 FZGPXVUUTRIXQZ-OLUVUFQESA-N 329.238 1.791 10 10 EDCE CNCc1ccc(N2CC[C@@H](C(CO)CO)C2)c(Br)c1 2170644014 WAXMXJXQIHVCFE-GFCCVEGCSA-N 343.265 1.596 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@H](N)C(=O)O 2044379103 WEAORJIRTLPLRZ-AWEZNQCLSA-N 349.431 1.876 10 10 EDCE C[C@@H](O)c1ccc(N2CC(=O)N[C@@H]3CC[C@H]32)c(Br)c1 2112061629 MKSBVZIASRNGMW-XTWCZFFVSA-N 325.206 1.970 10 10 EDCE CN[C@@H](C)c1ccc(N(C)CC(CO)CO)c(Br)c1 2094031094 QYVZXXQFWGVTLW-JTQLQIEISA-N 331.254 1.767 10 10 EDCE Cc1ccc2c(c1)N(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)CCC2 110983476 HYYVXZPCRKKWIW-CMDGGOBGSA-N 339.395 1.385 10 10 EDCE N[C@@H]1CN(Cc2ccc(Br)cc2O)[C@]2(CCOC2)C1 2098287995 SSXJQAKAFKRMIY-GXTWGEPZSA-N 327.222 1.847 10 10 EDCE C[C@@](O)(CO)[C@@H]1CCN(c2ccc(CN)c(Br)c2F)C1 2202839971 HRYXTONNBSTDQY-QMTHXVAHSA-N 347.228 1.617 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H]1c1ccc(Nc2nnc(=N)[nH]n2)cc1 2219017996 AVACPUYPLIOLJI-NEPJUHHUSA-N 343.391 1.803 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H](O)CC23CNC3)c1O 2236047872 ZGAYHOQZZUZESR-VIFPVBQESA-N 343.221 1.072 10 10 EDCE COc1cccc(C=C2SC(=S)N(CCO)C2=O)c1OC 2294874635 LDINFYHSAQNRMP-UHFFFAOYSA-N 325.411 1.897 10 10 EDCE COC[C@@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CCO1 2297662103 QROTTWCSIKVLMM-SFHVURJKSA-N 346.427 1.410 10 10 EDCE Cc1ccc(CNC[C@H]2COCCN2C)c(O)c1Br 2352942911 MKIWUOKMCVKXQB-LBPRGKRZSA-N 329.238 1.883 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@H]3CCN(C(C)=O)C3)CC2)cc1 176381054 CADWXASYBSXQOI-HNNXBMFYSA-N 345.443 1.649 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC3(C)C)CC2)cc1 269691581 FMDQOWQVTOWYNT-KRWDZBQOSA-N 331.460 1.980 10 10 EDCE Cc1ccc(C(=O)NCc2cccc(N3CCOCC3)n2)c(O)c1O 274914046 RFUDXOZKYCGPMX-UHFFFAOYSA-N 343.383 1.568 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@]3(CCCOC3)C2)cc1 285404086 UFMYEQPZNFASNL-LJQANCHMSA-N 347.459 1.250 10 10 EDCE C[C@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1ccccc1O 806170743 BCXKQWMROFHUJX-QWHCGFSZSA-N 327.450 1.314 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CCCN(C)C3=O)C2)cc1 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ASZMAXFBUJMRKT-OAHLLOKOSA-N 345.468 2.000 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C[C@H]3CCCC(=O)N3)C2)cc1 855227449 WQXBBSYSVWFKDH-ZIAGYGMSSA-N 331.416 1.449 10 10 EDCE C[C@@H](NS(=O)(=O)C[C@@H]1CN(C)CCO1)c1ccc(N(C)C)cc1 867126300 XACKATUTNXCVJR-CJNGLKHVSA-N 341.477 1.064 10 10 EDCE O=C1N[C@]2(C(=O)NCc3ccc4cccnc4c3O)C[C@H]3C[C@H]1[C@H]2C3 862025497 WOUKKLFRRFYLQO-KNBXBXJZSA-N 337.379 1.471 10 10 EDCE O=C1CSc2ncc(C(=O)NCc3ccc(O)c(O)c3)cc2N1 778916341 FGRYCDWNRYKFFU-UHFFFAOYSA-N 331.353 1.467 10 10 EDCE CS(=O)(=O)c1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)cn1 779495728 IDVSXRVYMQFGJY-UTCJRWHESA-N 334.353 1.548 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@@H](O)Cc2cnn(C)c2)cc1F 786927621 GOQFAVTYTALTLS-KRWDZBQOSA-N 348.422 1.625 10 10 EDCE CCN1CC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 897485157 DSULULFWVRTBIO-QGZVFWFLSA-N 344.459 1.113 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@]3(C)CCC(=O)NC3)CC2)cc1 798424805 WMYNJMOXENNMOK-LJQANCHMSA-N 345.443 1.697 10 10 EDCE C[C@@H]1CCCN1S(=O)(=O)NCc1cc(Br)ccc1O 796190661 COMIIJKWWFHHKX-SECBINFHSA-N 349.250 1.973 10 10 EDCE CCN(CC)S(=O)(=O)NCc1cc(Br)ccc1O 796191240 RPIOTIVOFSBCMC-UHFFFAOYSA-N 337.239 1.831 10 10 EDCE COC[C@@H](OC)C(=O)N[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1265557878 GRFZQWFKFZLCJO-HLLBOEOZSA-N 336.432 1.402 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)C[C@H]2CO)c(Br)c1 2136087377 DHPXBKGOIBVMNE-USWWRNFRSA-N 329.238 1.791 10 10 EDCE OCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2134819408 GCMYFCKATAJJFG-GZBPVQSJSA-N 328.206 1.262 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C2CC(F)(F)C2)cc1C 1507184997 DPDLHYYLCNPAMR-AWEZNQCLSA-N 342.386 1.616 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H](Cc2ccccc2)C(N)=O)cc1 1442291911 LMOQWOYAOCSDPI-CQSZACIVSA-N 339.355 1.675 10 10 EDCE CC[C@H](F)C(=O)N(C)C[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1510713326 QNZDRPAYEIBKTI-JQWIXIFHSA-N 341.383 1.424 10 10 EDCE CCNCc1ccc(N(C)[C@@H]2CCNC2=O)cc1Br 1916826365 OZHXORJLXUNBOM-CYBMUJFWSA-N 326.238 1.883 10 10 EDCE COC(=O)N1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1464673419 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LNHMPBXLMCZGEW-INIZCTEOSA-N 329.400 1.876 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2COCC[C@@H]2N)c(O)c1Br 2380749498 PFFJRKBLDIFUNB-MNOVXSKESA-N 343.221 1.443 10 10 EDCE O=C(c1cc(O)cs1)N1CCCN(S(=O)(=O)C2CC2)CC1 802674339 GXOFTSRGGVKMPC-UHFFFAOYSA-N 330.431 1.094 10 10 EDCE CCS(=O)(=O)CC(=O)NCc1cc(Br)ccc1O 804736224 NXHFBKZWOPANOW-UHFFFAOYSA-N 336.207 1.206 10 10 EDCE CCn1ncc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)n1 815073276 IHCNOOLGBIXKJI-UHFFFAOYSA-N 329.404 1.659 10 10 EDCE CN1NN=C2C1=NCC[C@H]2C(=O)NCc1c(O)ccc2c1CCCC2 816938564 DKQVFLVCLFYODU-CYBMUJFWSA-N 341.415 1.112 10 10 EDCE Cc1cc(O)c(CN2CCC[C@H](CS(N)(=O)=O)C2)cc1Cl 824777239 MCRRIEZVYDZRAS-NSHDSACASA-N 332.853 1.855 10 10 EDCE C[C@H]1CCN(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 725803701 OBHCUNLTQLLMOU-INIZCTEOSA-N 331.460 1.823 10 10 EDCE CO[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2C)[C@@](C)(C(=O)O)C1 909042578 HLYVXKNXZOSSJT-MAUKXSAKSA-N 349.431 1.835 10 10 EDCE CC(C)c1nnc2n1C[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)CC2 588406182 JYSWTJQZSUXRTK-IBSXUBTNSA-N 342.399 1.957 10 10 EDCE O=C(NCCCSc1nccs1)N1CCC[C@](O)(CO)C1 838513415 IXMQNCIWNXWTIB-CYBMUJFWSA-N 331.463 1.154 10 10 EDCE C[C@@H](NC(=O)NCc1cc(Cl)ccc1O)C1(S(C)(=O)=O)CC1 845195351 WUUPFZGZTOAMER-SECBINFHSA-N 346.836 1.811 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc4nncn4c3)C2)cc1 855228537 BUPNAZNFVXPSHP-AWEZNQCLSA-N 337.383 1.747 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@@H](C)C[C@@H](O)C3)C2)cc1 854297431 NLVHDVIGRGWXGH-SQWLQELKSA-N 333.432 1.686 10 10 EDCE Cn1nnc2c1C[C@@H](NC(=O)NCc1cc(Cl)ccc1O)CC2 927861133 JSLHTBIWJBNMOW-NSHDSACASA-N 335.795 1.531 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H](C)c3nonc3C)CC2)cc1 924830820 FCYCSBPKJOJVDZ-AWEZNQCLSA-N 345.447 1.859 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCc3nnn(C)c3C2)c1 927145921 MCQRCPBOIPXKBL-JQWIXIFHSA-N 330.388 1.515 10 10 EDCE CN(C)C(=O)C1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 757508429 HTNZQNCVFBFPGL-UHFFFAOYSA-N 348.359 1.230 10 10 EDCE Cc1cc(CC(=O)N2C[C@@H](O)[C@@H](CO)C2)c(C)n1-c1ccccc1 854910178 QOUHYMRKBIAREH-SJLPKXTDSA-N 328.412 1.448 10 10 EDCE COC1(OC)CCN(Cc2ccc(N3CCOCC3)cc2)C[C@@H]1O 931632369 ZEQQVXPUMHAICZ-KRWDZBQOSA-N 336.432 1.079 10 10 EDCE C[C@H]1[C@@H](C(N)=O)CC[C@@H](C)N1Cc1ccc(N2CCOCC2)cc1 930906931 HQNBHJAZZJKGIA-VKJFTORMSA-N 331.460 1.998 10 10 EDCE COC(=O)c1cc(OCC2(CS(C)(=O)=O)CC2)ccc1N(C)C 865396385 QTONBWQULDYFNI-UHFFFAOYSA-N 341.429 1.743 10 10 EDCE C[C@H](NS(=O)(=O)N1CCC2(CC1)OCCO2)c1ccccc1O 867835037 ZSYVHLZLFAHSLU-LBPRGKRZSA-N 342.417 1.127 10 10 EDCE CCC1(N2CCOCC2)CCN(C(=O)c2cccc(O)c2O)CC1 863492447 XHNPDOIWRNPWAF-UHFFFAOYSA-N 334.416 1.815 10 10 EDCE C[C@@H](NC(=O)CS(=O)(=O)NC(C)(C)C)c1ccc(N(C)C)cc1 773024726 NNNRBONPHTVHBQ-GFCCVEGCSA-N 341.477 1.648 10 10 EDCE COc1cc(O)c(CNCCC2CCS(=O)(=O)CC2)cc1OC 776252405 UBSHFVYKSZHTEK-UHFFFAOYSA-N 343.445 1.714 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC[C@H]3OCCNC(=O)[C@H]32)c1O 879720746 VBNKAVFINABPOG-CABCVRRESA-N 336.363 1.213 10 10 EDCE O=C1N[C@@H](C(F)(F)F)CC[C@H]1C(=O)N1Cc2cccc(O)c2C1 871198261 FCZPAHVQISQUSQ-BXKDBHETSA-N 328.290 1.692 10 10 EDCE C[C@H](NCc1cc(Br)cc(F)c1O)c1nnc(O)n1C 895172679 WRLYPEITFJUDJO-LURJTMIESA-N 345.172 1.979 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)[C@H]2CCC(=O)N(C)C2)c([N+](=O)[O-])c1 895954432 ZGJFVXFPXKKZOM-QGOGUYACSA-N 347.371 1.838 10 10 EDCE O=S(=O)(NCc1cc(Br)ccc1O)[C@@H]1CCOC1 796191232 RIKZHSZYJXVDCZ-SNVBAGLBSA-N 336.207 1.363 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)cc1Br 2116736544 KFELOEAIUPNAGD-HKSFMPNISA-N 328.206 1.262 10 10 EDCE CCc1ccncc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1164661145 VYSZBEWSJDFPNN-UHFFFAOYSA-N 335.385 1.973 10 10 EDCE OCc1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)cc1Br 2121590873 GILHLYUUMSISSF-SUHUHFCYSA-N 328.206 1.385 10 10 EDCE CN(C)C(=O)Cn1cc(NC(=O)NCc2c(O)cccc2F)cn1 1333446383 ILRDVGRNEDZXAR-UHFFFAOYSA-N 335.339 1.138 10 10 EDCE C[C@H](O)c1ccc(N2CCNC(=O)C23CC3)cc1Br 2132040622 OXQLWFNHUPFTLX-VIFPVBQESA-N 325.206 1.971 10 10 EDCE Cc1ccc(C(=O)Nc2n[nH]c3cc(C)n(C)c(=O)c23)c(O)c1O 1299777971 RXFQYKRQTCPMLH-UHFFFAOYSA-N 328.328 1.542 10 10 EDCE N=C(O)OC[C@H](Cc1ccccc1)NC(=O)c1cccc(O)c1O 1469023896 IWKRIDKQMYGUEA-LBPRGKRZSA-N 330.340 1.948 10 10 EDCE C[C@@](CO)(Cn1cnc2ccccc21)NC(=O)c1cc(O)cs1 1607270290 DMBCDZMPXRTEKM-INIZCTEOSA-N 331.397 1.984 10 10 EDCE O=C(CCN1C(=O)CSC1=S)NCCc1ccc(F)cc1 1865764859 DLIVPMSUZOBRKN-UHFFFAOYSA-N 326.418 1.735 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C(C)(C)C2CC2)cc(OC)n1 1704053466 PFRSXSULYDPHDF-LLVKDONJSA-N 349.431 1.770 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CCn2ccnc2)cc1C 1483253424 ALAHCBLHLYEKPO-HNNXBMFYSA-N 330.432 1.885 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CN2CC[C@H](C)C2)cc1C 1714273852 RIXRZAKXWIXHTJ-HOCLYGCPSA-N 333.476 1.940 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2ccc(=O)n(C)n2)cc1C 1715961891 QZVMZGSKIQYMIA-CYBMUJFWSA-N 344.415 1.005 10 10 EDCE NS(=O)(=O)c1ccsc1C(=O)NCc1c(O)cccc1F 1638864078 UCYOTCMACLNOOZ-UHFFFAOYSA-N 330.362 1.170 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)NCc2cccc(O)c2O)c1 1644710993 OEDGUBZRBUGBJE-WAYWQWQTSA-N 327.340 1.182 10 10 EDCE Cc1oc(-c2cnn(C)c2)nc1C(=O)NCc1c(O)cccc1O 1647270627 VEOVJHZBSFUZRO-UHFFFAOYSA-N 328.328 1.725 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)C(=O)NCC2CC2)cc1C 1571412264 VZFNMJQANPQSNM-CQSZACIVSA-N 347.459 1.466 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H](C)CC(N)=O)CCC2)cc1C 1570113484 WLXLAIBBIYXOKM-AWEZNQCLSA-N 347.459 1.644 10 10 EDCE COC(=O)C1=NO[C@@]2(CCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)C1 1649042557 SRRBMSXENJMZHG-IVZVJUQRSA-N 346.339 1.031 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCN=S2(=O)CCCC2)cc1 1644053539 CCLYCFGVMFCOIP-UHFFFAOYSA-N 337.405 1.841 10 10 EDCE COC(=O)c1cc(C)c(C(=O)Nc2nc(C3=S=CC=C3)n[nH]2)o1 1654209026 JHXRWMCIYNKNNI-UHFFFAOYSA-N 332.341 1.371 10 10 EDCE C[C@@H]1C[C@@H](NCCCO)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1676784603 XWIKWDCQQDFMRI-BXUZGUMPSA-N 333.392 1.424 10 10 EDCE Cn1cc(C(N)=O)cc1C(=O)NCc1c(O)ccc2c1CCCC2 150966482 QJEPOQAPHVVHSP-UHFFFAOYSA-N 327.384 1.638 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NC[C@H]2CCCCS2)cc1 156316013 ZZLSPKKKXFZMBE-CQSZACIVSA-N 330.475 1.853 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2140662024 JVENZGIMUWSRLJ-KOCKLMIUSA-N 334.185 1.382 10 10 EDCE CNC[C@H](O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951829431 JCLDBPJQRFAJIV-FZMZJTMJSA-N 326.393 1.114 10 10 EDCE CNCc1ccc(N2CC[C@@H]3CC(=O)N[C@@H]3C2)cc1Br 2145056389 ZUWFLURCNQNPAX-QMTHXVAHSA-N 338.249 1.883 10 10 EDCE CC(C)(C)OC(=O)NC1(C(N)=O)CCN(CCCCN=[N+]=[N-])CC1 2006177111 MUERKEPMSXVUEN-UHFFFAOYSA-N 340.428 1.922 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 1985095033 YAEMEJBPBZCPIM-WDEREUQCSA-N 327.385 1.516 10 10 EDCE CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NCCN=[N+]=[N-] 2010390082 YNQGGEGGHUCZGS-NSHDSACASA-N 342.400 1.078 10 10 EDCE Cn1nccc1[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC(N=[N+]=[N-])C1 2010392209 XVFYGAAHYSVVDT-NSHDSACASA-N 335.368 1.507 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CC(=O)NCCCCN=[N+]=[N-])C1 2010402572 SJGJQEPHSHASEF-NEPJUHHUSA-N 341.412 1.811 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010405597 JNSWKSVBEANJED-GHMZBOCLSA-N 341.412 1.952 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N(C)Cc1ccc(N)cc1 2022867254 IOEHACZMVMJVGV-BXUZGUMPSA-N 337.420 1.501 10 10 EDCE CN(C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1ccccn1 2022933336 GEHQPOYBEWCWHM-CHWSQXEVSA-N 333.388 1.629 10 10 EDCE Cc1cccc(CNC(=O)[C@@H](O)[C@@H](C)NC(=O)OC(C)(C)C)c1O 2024813377 YFCFHCMLGBSXRP-RISCZKNCSA-N 338.404 1.591 10 10 EDCE Cc1cccc(CNC(=O)[C@H](NC(=O)OC(C)(C)C)[C@H](C)O)c1O 2024812153 PDBVWXAEUPMZOT-WCQYABFASA-N 338.404 1.591 10 10 EDCE O=C1NC(=O)[C@@H]2CCN(c3ccc(CO)cc3Br)C[C@@H]12 2158789542 MOFIYHBFLZLDHB-NXEZZACHSA-N 339.189 1.040 10 10 EDCE CO[C@]1(CO)CCCN(c2ccc(CN)c(Br)c2)C1 403005024 MESFTBTZGDWKBI-CQSZACIVSA-N 329.238 1.886 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H]2CS3(=O)=O)cc1Br 322097509 LKTDMLMFYWWFLK-NWDGAFQWSA-N 345.262 1.544 10 10 EDCE Oc1c(F)cc(Br)cc1CNCC1CN(C2COC2)C1 2171180295 PTVWSRNOVJERPV-UHFFFAOYSA-N 345.212 1.714 10 10 EDCE NCc1ccc(N2CC[C@H](N3CCOC3=O)C2)c(Br)c1 2171696439 LKJGMVYCHMJZJA-NSHDSACASA-N 340.221 1.939 10 10 EDCE CCN(C[C@H](C)O)c1cc2c(cc1Br)[C@@H](NC)C(=O)N2 691437291 WYVNUCNNVKNWIT-ISVAXAHUSA-N 342.237 1.869 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NC(=O)c1cccc(O)c1O 1148220070 OEXOVXXQZILTEV-MNOVXSKESA-N 338.360 1.120 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H](NC(=O)Cc2ccc(N)cc2)C1 2044229346 UTAWPRPUZZQGPR-HNNXBMFYSA-N 349.431 1.563 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)C[C@@H]2CO)c(Br)c1 2200834782 YOOAYUWDYZWITG-OLZOCXBDSA-N 343.265 1.881 10 10 EDCE C[C@@]1(CCO)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2205509204 FIBYIANWPKVGRD-OCCSQVGLSA-N 340.221 1.752 10 10 EDCE NCc1ccc(N2CCC(C3(O)COC3)CC2)cc1Br 2287199746 CWFIGGALNWSMAA-UHFFFAOYSA-N 341.249 1.886 10 10 EDCE Cc1cc(N2CCCC2)ccc1C=C1NC(=O)N(CC(=O)O)C1=O 2297620011 AELCRCIFRTYDCD-UHFFFAOYSA-N 329.356 1.573 10 10 EDCE COC[C@@]1(CO)C=CCN1c1ccc(CN)cc1Br 2351695382 BHGHCTUNXSFSLE-AWEZNQCLSA-N 327.222 1.662 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2OCC[C@@H]2N)c(O)c1Br 2352629903 ZGRSQOUBJNXTSC-CABZTGNLSA-N 329.194 1.196 10 10 EDCE Cc1ccc(CN(C)C(=O)COCCN)c(O)c1Br 2352653528 ARFCUSHSLUYGEL-UHFFFAOYSA-N 331.210 1.397 10 10 EDCE COc1cccc(CN[C@@H]2CCCN(c3cc(C)nn3C)C2=O)c1O 173853722 UUWCJDLCCPLTRU-CQSZACIVSA-N 344.415 1.728 10 10 EDCE O=C1NN(c2ccccc2)C(=O)/C1=C\c1cc2ccccc2[nH]c1=O 34206551 LLWNBFNLXNLBLX-PTNGSMBKSA-N 331.331 1.990 10 10 EDCE C[C@H]1Oc2ccc([N+](=O)[O-])nc2N(CCOc2ccc(N)cc2)C1=O 75259536 MMMROBVMOWLKGM-SNVBAGLBSA-N 344.327 1.765 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@]1(C(=O)O)c1cc(O)c(O)c(O)c1 1952678684 UZTXYMPHNFGERX-MEBBXXQBSA-N 325.317 1.423 10 10 EDCE C[C@H](CNC(=O)NCc1ccc(N2CCCC2)cc1)N1CCOCC1 49131055 AJJOUDYMDXGJFC-MRXNPFEDSA-N 346.475 1.807 10 10 EDCE O=C(Cn1cnc2ccccc2c1=O)NCCc1ccc(O)c(O)c1 98074610 PXLULDDMKDMTNF-UHFFFAOYSA-N 339.351 1.167 10 10 EDCE C[C@@H](N)c1ccc(N2CCS(=O)(=O)CC2)cc1Br 235219057 WXXPKEYAXYUAFQ-SECBINFHSA-N 333.251 1.704 10 10 EDCE CN(C)c1ccc(CN(C(=O)CN2CCOCC2=O)C2CC2)cc1 279150567 BQSNTNNEFFVFPB-UHFFFAOYSA-N 331.416 1.102 10 10 EDCE Cc1ccc(CN(C)C(=O)COCC(=O)O)c(O)c1Br 2381137572 OPGDRXHRYZRVME-UHFFFAOYSA-N 346.177 1.523 10 10 EDCE Cn1cc(CC(=O)NCc2ccc(N3CCOCC3)cc2)c(Cl)n1 814407111 VQJLGVJDIGZVFR-UHFFFAOYSA-N 348.834 1.769 10 10 EDCE CCn1ncc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 814824860 NPRFMECPRWAQHL-UHFFFAOYSA-N 329.404 1.407 10 10 EDCE COC[C@]1(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCOC1 823771074 QNQGPHBBPASAJW-LJQANCHMSA-N 348.443 1.535 10 10 EDCE CN(C)c1ccc([C@@H](CNCc2cc(C(=O)O)no2)N(C)C)cc1 905809793 DDJCYGASMKRZLK-MRXNPFEDSA-N 332.404 1.831 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(CCCCCO)CC1 913692871 FFLOOWQMEFUNIL-FNORWQNLSA-N 334.416 1.418 10 10 EDCE COc1cc(Br)cc(CNCC[C@@]2(O)CCOC2)c1O 846050730 XWOLJBNIDUGUBQ-CQSZACIVSA-N 346.221 1.794 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)CCCCN)CC2)cc1 844190907 FNRYDVYLWLDPCF-UHFFFAOYSA-N 348.491 1.453 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@]3(C)CCOC3)C2)cc1 852108373 CUFDBTHFYCEQNM-KDOFPFPSSA-N 333.432 2.000 10 10 EDCE O=C(NCCCSc1nccs1)c1c[nH]nc1[C@@H]1CCNC1 852805793 MMPIZTZTZQVPEP-SNVBAGLBSA-N 337.474 1.855 10 10 EDCE COC(=O)c1cncnc1NCc1ccc(N2CCC(O)CC2)cc1 853955094 DFZYDZGGEQQSIX-UHFFFAOYSA-N 342.399 1.836 10 10 EDCE CCO[C@@H](CNC(=O)NCc1ccc(OC)cc1O)CN(C)C 926841603 KKCXSVDATQMFEU-AWEZNQCLSA-N 325.409 1.167 10 10 EDCE C[C@@H]1OC[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[C@@H]1C 925055388 MACNYJNSLGFFDI-KEYYUXOJSA-N 338.473 1.434 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)c3ccc(O)cc3)C2)cc1 855223289 FDIRLFZVWYZOKR-CQSZACIVSA-N 340.379 1.979 10 10 EDCE O=C(NC[C@H]1CN(Cc2ccncc2)CCO1)c1cc(O)cs1 863497593 XUHZVNAGZOMDRO-AWEZNQCLSA-N 333.413 1.480 10 10 EDCE COc1ccc(COCC(=O)NCc2cccc(OC)c2O)cn1 860241193 PJQPATQUDDMJCY-UHFFFAOYSA-N 332.356 1.637 10 10 EDCE C[C@@](O)(C[C@H](O)CNCc1ccc(N2CCOCC2)cc1)C1CC1 872200089 SXLWZWPAJZKZDF-RBUKOAKNSA-N 334.460 1.525 10 10 EDCE CN(CC(C)(C)S(C)(=O)=O)C(=O)/C=C/c1ccc(O)c(O)c1 779539537 GYPUKLXNBQJVCL-SOFGYWHQSA-N 327.402 1.393 10 10 EDCE COC(=O)c1c(CNC[C@@]2(C)CCC(=O)N2)c2cc(F)ccc2n1C 894967729 QSPPDZWPTCKGKT-GOSISDBHSA-N 347.390 1.862 10 10 EDCE CCOC(=O)[C@@H]1C[C@H]1C(=O)N(C)CCN(C)c1ccc(OC)cc1 1164597874 VNMKDNJYRZIPSL-HZPDHXFCSA-N 334.416 1.789 10 10 EDCE O=C(O)[C@H](F)C1(O)CN(Cc2c(O)cccc2Br)C1 2115657796 KRVLGXKYJXLWJM-JTQLQIEISA-N 334.141 1.124 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@H]2CCC(=O)N2)C(C)C)cc1C 1319902346 DEOAFXBMWQPRMU-CVEARBPZSA-N 347.459 1.513 10 10 EDCE CC[C@H](NC(C)=O)C(=O)N[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1317122896 LRGVNEOGENQSGB-BBWFWOEESA-N 347.459 1.655 10 10 EDCE Oc1ccc(Br)cc1CN[C@@]12CC[C@@H](C1)[C@@H](O)[C@@H]2O 2120389882 XGGWOFUYXCWYJK-ISTUKMMPSA-N 328.206 1.519 10 10 EDCE Oc1cccc(Br)c1CN1CCO[C@H]2CCNC[C@H]21 2129072080 OSHLIBQQBTVQFS-OCCSQVGLSA-N 327.222 1.717 10 10 EDCE O=C(O)[C@H](NCc1c(O)cccc1Br)[C@@H]1CCCO1 1351742990 USSCUYHBNBKGMF-NWDGAFQWSA-N 330.178 1.877 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H]2CCNC(=O)CC2)cc1C 1275246919 RWXHINDMMXLVQO-GOEBONIOSA-N 347.459 1.514 10 10 EDCE CC[C@H](CNC(=O)C1CCC1)NC(=O)c1cc(OC)nc(OC)c1 1285023546 GSQGMRGPQWMZST-CYBMUJFWSA-N 335.404 1.524 10 10 EDCE CNC(=O)COc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1464927220 HQPAWTYCXZVAMA-UHFFFAOYSA-N 330.340 1.404 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1csc(-c2ncccn2)n1 1469161374 ZEDGLRIDJRTZRA-UHFFFAOYSA-N 328.353 1.941 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCCOCC3)c(Br)cc21 118590059 FCKJEKGRCJHAPU-GFCCVEGCSA-N 326.194 1.628 10 10 EDCE O=C(CCCN1C(=O)CNC1=O)NCc1c(O)ccc2ccccc12 1472086365 WLPGHTSFINZDSE-UHFFFAOYSA-N 341.367 1.494 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@]1(C)C[C@@H](O)CN1C 1540567386 KNGQQJFOMJHVAJ-MJGOQNOKSA-N 331.460 1.700 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)Cc1n[nH]c(C)n1 1716216141 CTLQLJIACRBKOW-UHFFFAOYSA-N 345.447 1.611 10 10 EDCE CN(C[C@@]1(Br)CC1(F)F)C(=O)c1cc(O)nc(O)c1 2137810325 YIDFNLKAVJWPGK-JTQLQIEISA-N 337.120 1.738 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@@H](O)Cc1cccc(F)c1 1636600754 AVEXVOUNIFXAJI-PKYBCLHXSA-N 331.343 1.970 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@H]2CCNC(=O)C2)cc1C 1497565271 PWPOMIGNNFNINC-QGZUEGPWSA-N 345.443 1.292 10 10 EDCE CC[C@@H](CNC(=O)c1cnnn1CC)NCc1ccc(OC)c(C)c1 1698598953 OCPGBNXOOSWMHA-HNNXBMFYSA-N 345.447 1.913 10 10 EDCE CC(C)NC(=O)c1ccc(NC=C2C(=O)OC(C)(C)OC2=O)cc1 14553998 BZMLKUGKPDSMAY-UHFFFAOYSA-N 332.356 1.957 10 10 EDCE O=C(/C=C/c1ccccc1)NCCNC(=O)c1cc(O)c(O)c(O)c1 169911856 RYYCUZBGXPLDND-VOTSOKGWSA-N 342.351 1.363 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](C)NC(=O)C(C)C)CC2)cc1 1862299054 YAFFUBQIYVYHJQ-AWEZNQCLSA-N 333.432 1.505 10 10 EDCE Cc1ccc(O)c(CNCC(=O)N(CCO)Cc2ccccc2)c1 1857868085 QHXOPRDMSUALKN-UHFFFAOYSA-N 328.412 1.811 10 10 EDCE CCN(CC)c1ccc(CNCC(=O)N2CCC[C@H]2C(=O)O)cc1 1857866521 OGAASLXDKMIJPD-INIZCTEOSA-N 333.432 1.698 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@@]4(CO)C3)c(Br)cc21 2146313601 LFZDFPLYDGVCNQ-FMCKTDMXSA-N 338.205 1.220 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@H]1CC(=O)NCCN=[N+]=[N-] 1985093505 ALANQFKMXZWDHM-GHMZBOCLSA-N 327.385 1.733 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)NCCCCN=[N+]=[N-])COC1 1985100051 CKXBWRWXXIEUPQ-UHFFFAOYSA-N 327.385 1.829 10 10 EDCE CN1CCCc2cc([C@@H](N)[C@@H](O)CNC(=O)OC(C)(C)C)ccc21 1999584956 ROTYUXKFCVYRNM-JKSUJKDBSA-N 335.448 1.954 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010398240 VPCDVPLSORRUBY-SDDRHHMPSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NCCN2CCN=[N+]=[N-] 2018063582 FNBMQLTZAVCSFE-UHFFFAOYSA-N 338.412 1.498 10 10 EDCE CC(C)(C)OC(=O)NC1CC([C@@H](F)C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2021865389 XYBWRJTZOVQVHI-CUYABCBLSA-N 342.411 1.893 10 10 EDCE CCCn1nnc(Br)c1[C@@H](O)[C@H](N)c1ccccc1O 2156513558 FMUADFKQPXZXHD-PWSUYJOCSA-N 341.209 1.890 10 10 EDCE COC1(CO)CCN(c2ccc(CN)c(Br)c2)CC1 402948565 TZZPIOIZHQJFLZ-UHFFFAOYSA-N 329.238 1.886 10 10 EDCE COCCNC(=O)CCNCc1c(O)cccc1Br 706829311 WSQPKFNYPNFDKX-UHFFFAOYSA-N 331.210 1.397 10 10 EDCE CN1CCc2cc(CNCc3nnc(Br)n3C)ccc21 2178018576 SIHTYIVVINPLNX-UHFFFAOYSA-N 336.237 1.860 10 10 EDCE O=C(N=c1[nH]nc(Cl)cc1Br)c1cccc(O)c1O 2102573336 WVEGNAXCQSKQTL-UHFFFAOYSA-N 344.552 1.978 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N(C)[C@@H]1CC(=O)NC1=O 2114732087 JWPGPHZFAFMOJR-GMSGAONNSA-N 327.178 1.563 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](F)C2CNC2)c(O)c1Br 2352621056 XVPIWNQRCZRHOG-NSHDSACASA-N 331.185 1.637 10 10 EDCE CC/C=C(\C)C(=O)NC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1354268169 FLPJQHLLEAGTBO-YTRUQHMWSA-N 335.404 1.690 10 10 EDCE Cc1ccc(C(=O)NCC(=O)NCc2ccc(O)c(O)c2)cc1C 184217072 WMCCFJQVKZGJKX-UHFFFAOYSA-N 328.368 1.761 10 10 EDCE COC[C@H]1[C@@H](O)[C@@H](O)CN1c1ccc([C@H](C)O)cc1Br 2358552491 ZSKXPSZEDBDLNX-PWURMNTRSA-N 346.221 1.059 10 10 EDCE COC(=O)[C@H]1CCN[C@H]1c1cc(I)ccc1O 1952825552 LSZIHRXXICGJEP-GZMMTYOYSA-N 347.152 1.820 10 10 EDCE CN1C(=O)/C(=C2/SC(=S)N(N)C2=O)c2cc([N+](=O)[O-])ccc21 33560507 XBECSCJXBXTTHB-CMDGGOBGSA-N 336.354 1.016 10 10 EDCE COC[C@H](O)CN1CCC(N[C@@H](C)c2cc(OC)ccc2O)CC1 186194603 UYJKWNDFWKSGTK-DZGCQCFKSA-N 338.448 1.523 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCO[C@@]2(CCOC2)C1 184462299 LILLHVHZNDMQSV-IBGZPJMESA-N 343.427 1.764 10 10 EDCE CCOCCN1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@@H]1C 181095945 NBRDCUJDRJDXKL-DYLGSBMWSA-N 334.416 1.680 10 10 EDCE CNC(=O)CN(C)c1ccc(/C=C/C(=O)O)c(Br)c1 234362859 JVULBXCEOYLULM-GQCTYLIASA-N 327.178 1.729 10 10 EDCE COc1ccc(N2CCN(C(=O)CNC(=O)C3CCC3)CC2)cc1 242990400 HTQHTRRJNUDOBX-UHFFFAOYSA-N 331.416 1.260 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2COCCO2)c(O)c1Br 2380772798 OEYDDACKERCKMI-LLVKDONJSA-N 344.205 1.837 10 10 EDCE CC(=O)N1CCN(CCNCc2cc(Cl)c(F)cc2O)CC1 294140569 HJDPXINHCQQWPK-UHFFFAOYSA-N 329.803 1.438 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@]12C[C@H]3C[C@H](C(=O)N1)[C@H]2C3 649789131 MUBCRPNWVCWPPI-BJINURBMSA-N 341.411 1.393 10 10 EDCE CC(C)C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)C(=O)O 818658573 VHGCLJAYVDPOCC-CQSZACIVSA-N 349.431 1.232 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](NC(N)=O)C2)c(Br)c1 723173868 RQCSSJRHROCIDW-PSASIEDQSA-N 327.226 1.716 10 10 EDCE COc1cc(O)c(CN[C@@H]2CC[C@H](C)S(=O)(=O)C2)cc1OC 827173143 VSBMBZZXNCCZNL-CMPLNLGQSA-N 329.418 1.465 10 10 EDCE COc1cccc(CN2C[C@@H]3CC[C@H](C2)N3C2CCNCC2)c1O 903980042 DUXBBNMSMNKETL-CALCHBBNSA-N 331.460 1.801 10 10 EDCE CN(C)c1ccc(/C=C/CNCCOCCS(C)(=O)=O)cc1 835038457 AQAMYUZONKLJGP-SNAWJCMRSA-N 326.462 1.417 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)N3CC[C@@H](C)C3)C2)cc1 849416167 LIMWARZTCQERHW-ZIAGYGMSSA-N 339.461 1.450 10 10 EDCE COC(=O)/C(C)=C/CNC(=O)NCc1ccc(N2CC=CC2)cc1 919909354 QQCPUGGGFFWDJC-NTEUORMPSA-N 329.400 1.981 10 10 EDCE O=C1N[C@@H](CF)C(=O)N1Cc1cc(F)c(N2CCOCC2)c(F)c1 842256367 CNPIUIMZQUVWSD-LBPRGKRZSA-N 343.305 1.191 10 10 EDCE C[C@H]1C(=O)N(CCN(C)C)CN1Cc1c(O)ccc(Cl)c1F 843428020 FLOXFCWFHHOCAC-JTQLQIEISA-N 329.803 1.737 10 10 EDCE Cn1ncc(C2CCC2)c1/C=C1\SC(N2CCOCC2)=NC1=O 849242854 CFGKSROCZQWZRH-ZROIWOOFSA-N 332.429 1.990 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CC[C@H](O)C3)C2)cc1 854299668 QPCKKMIWHZAVCL-DZKIICNBSA-N 333.432 1.734 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H](CN)[C@@H](C)C1 926327956 KOGAVVJVXUFCTC-LSDHHAIUSA-N 347.459 1.574 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCNC(=O)CC1(C)C 931204777 DBPNWYJUOVSFNS-UHFFFAOYSA-N 346.475 1.312 10 10 EDCE CN[C@H](C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)c1cnn(C)c1 1118569367 FYBVCUYQSGRLMJ-YOEHRIQHSA-N 343.431 1.084 10 10 EDCE CO[C@@](C)(C(=O)NCc1cc(O)ccc1O)C(=O)OC(C)(C)C 1153884275 BAQLCHCVNRCDNO-INIZCTEOSA-N 325.361 1.461 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)c2cn(C)nn2)cc1C 1317395429 WMQVEJDLCPRVIE-CYBMUJFWSA-N 331.420 1.430 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H](C)n2cncn2)cc1C 1328329408 WXPCMDJMGPKTGY-LSDHHAIUSA-N 345.447 1.841 10 10 EDCE CC(=O)NC[C@]1(C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1358825327 RXNGPTYZPFDHII-INIZCTEOSA-N 331.376 1.837 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)CC(C)(F)F)cc1C 1284445950 XFJMPFLRCJPYAP-CQSZACIVSA-N 344.402 1.958 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2n[nH]c(C)c2O)cc1C 1482271843 GTNVQFVRVGYPKV-LBPRGKRZSA-N 346.431 1.991 10 10 EDCE Cc1ccc(C(=O)Nc2cccc(Cc3nn[nH]n3)c2)c(O)c1O 1638548386 CVMWNRYDZYLIFY-UHFFFAOYSA-N 325.328 1.762 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)c2nnn(C)c2C)cc1C 1568616685 LTOKCKPGTZSACC-ZDUSSCGKSA-N 345.447 1.739 10 10 EDCE C[C@H](Cc1cccnc1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1647839257 FKHAMEPOSAWMPU-LLVKDONJSA-N 349.412 1.520 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CCN2C2CCOCC2)cc1 1647729700 ZGODKIKBUXCFGA-HNNXBMFYSA-N 345.403 1.832 10 10 EDCE O=C(C[C@@H]1C(=O)Nc2ccc(F)cc21)NCc1ccc(O)c(O)c1 1595596462 WOWWRIKDFUMPEZ-LBPRGKRZSA-N 330.315 1.979 10 10 EDCE CN(C)c1ccc(CN(C(=O)NC[C@@H]2CNC(=O)C2)C2CC2)cc1 1774157489 GOASEQQVCFLAIJ-AWEZNQCLSA-N 330.432 1.563 10 10 EDCE Cc1cc(C(=O)N[C@@H]2CCC(=O)NC2=O)c(C)n1-c1ccc(F)cc1 153496387 TUDXGMCEHWRLQJ-OAHLLOKOSA-N 343.358 1.768 10 10 EDCE CCOc1cccc(CNCCC(=O)NCc2ccccn2)c1O 1857859818 HONOUYINMQCETN-UHFFFAOYSA-N 329.400 1.982 10 10 EDCE CNC(=O)CN(Cc1ccccc1)C(=O)CCc1ccc(N)cc1 1946876291 NOTUYHHVOAROJK-UHFFFAOYSA-N 325.412 1.976 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@H](O)[C@@H](F)C3)c(Br)cc21 2144574206 SSJYQINCARAMCG-UWJYBYFXSA-N 344.184 1.310 10 10 EDCE CN(C)c1ccc([C@H](O)[C@H](N)c2cc(Br)nn2C)cc1 2148508652 IBKAWYGLBUTSDK-KGLIPLIRSA-N 339.237 1.982 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985099540 PGRLAVXNKHSUGF-LLVKDONJSA-N 327.385 1.827 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@H](O)[C@@H](F)C3)c(Br)cc21 2149255949 ACHDUCCXPJNQLH-UWJYBYFXSA-N 344.184 1.181 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)NCc1cc2c(cc1O)OCO2 2011425171 UMDLYKFJHJRADC-LLVKDONJSA-N 340.376 1.096 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H]1CNC(=O)c1cc(O)c(O)c(O)c1 2015119904 NWAKPYWHEJDGCV-UWVGGRQHSA-N 338.360 1.446 10 10 EDCE NCc1cc(F)c(N2CCS(=O)(=O)CC2)cc1Br 310617735 HIYPYQHPNQOOOF-UHFFFAOYSA-N 337.214 1.282 10 10 EDCE CC(C)NCc1ccc(N2C[C@H](O)C[C@@H](O)C2)c(Br)c1 2161357847 UHMLBZZUXTWSRZ-CHWSQXEVSA-N 343.265 1.879 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)CC[C@@H]3O)cc1Br 2161395365 AEIXQBRLTVCSRS-AJNGGQMLSA-N 342.233 1.794 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N(CCN(C)C)C3CCCC3)c2n1 2065014042 MODZJFAHQWWKKQ-UHFFFAOYSA-N 331.420 1.690 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1CO[C@H]2COC[C@@H]12 2101857801 YXEFPLGRGPHHEJ-MDZLAQPJSA-N 328.206 1.906 10 10 EDCE Oc1c(F)cc(Br)cc1CNCC[C@@H]1COC[C@H]1O 2111325790 LUQKGVCMAAOKPQ-PRHODGIISA-N 334.185 1.781 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213586278 ABSHRHKSYDFOGK-WYUUTHIRSA-N 339.396 1.704 10 10 EDCE CNCc1ccc(N2C[C@@H]3COC[C@]3(CO)C2)c(Br)c1 2234553197 WQKUPGKQJOCZFY-IUODEOHRSA-N 341.249 1.614 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H](O)C[C@@H]2CN)c1O 2227742780 JVUSGMSMQXGWPV-BDAKNGLRSA-N 331.210 1.057 10 10 EDCE COc1ccc(N2NC(=O)C(=Cc3ccc(O)c(OC)c3)C2=O)cc1 2297559069 JEQRNAXGVJCWQV-UHFFFAOYSA-N 340.335 1.871 10 10 EDCE CC(=O)c1cccc(NC(=O)C(=O)N(C(C)=O)c2ccc(N)cc2)c1 170318362 SZSKDUHLWJPPOF-UHFFFAOYSA-N 339.351 1.990 10 10 EDCE CN(CC1(N(C)C)CCC1)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 302523918 ZBOXABAVVWPPPE-UHFFFAOYSA-N 334.376 1.846 10 10 EDCE Cc1ccc([C@@H](C)NCCN2CCN(c3ncccn3)CC2)c(O)c1 185065631 ZJJQWWFEHMTIEZ-MRXNPFEDSA-N 341.459 1.963 10 10 EDCE CC(C)C[C@@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)N1CCOCC1 180617676 VNQDIIYAGZXBEM-NBUZRDOWSA-N 348.443 1.974 10 10 EDCE CCS(=O)(=O)C[C@@](C)(NCc1cnc(SC)s1)C(=O)O 2371363820 CULLOURRYPIYOP-LLVKDONJSA-N 338.476 1.233 10 10 EDCE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CC[C@@](O)(C(N)=O)C2)c1 276508923 QXZPWBNZAOECJW-IBGZPJMESA-N 341.411 1.465 10 10 EDCE COC(=O)[C@@H]1C[C@H](O)CN1Cc1ccc(N(C)C)cc1C(F)(F)F 280482990 DTBNBSOFHKOIQM-JSGCOSHPSA-N 346.349 1.880 10 10 EDCE Cc1cc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)ccc1N(C)C 293717089 YEFXVASMRMLPDM-INIZCTEOSA-N 339.505 1.917 10 10 EDCE CC(C)C[C@H](CO)N(C)C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807679022 LZKOUIYCVRZNSS-RHSMWYFYSA-N 349.475 1.795 10 10 EDCE C[C@@H]1C[C@@H]1N(CCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2167109743 PXNOVCFZDICTDK-RESLBDFXSA-N 340.221 1.608 10 10 EDCE COC(=O)c1cc2ccccc2c(CN2CCS(=O)(=O)CC2)c1O 728711320 PMULQXSYVWINLP-UHFFFAOYSA-N 349.408 1.562 10 10 EDCE Cc1cc(O)c(CNCCCN2CCCS2(=O)=O)c(Cl)c1 840888988 CYXBXGONOADNCU-UHFFFAOYSA-N 332.853 1.869 10 10 EDCE Cc1cc(C(=O)CN2C[C@@H](O)C[C@@H](O)C2)c(C)n1-c1ccccc1 752307916 FYLRWWPEXZSHCU-CALCHBBNSA-N 328.412 1.704 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H](CO)C1CCC1 852004783 KDKPXSPICXBOJK-QGZVFWFLSA-N 333.432 1.483 10 10 EDCE COc1ccc(N2CC[C@H](N[C@H](C3CC3)[C@H]3CNCCO3)C2)cc1 854216934 HLXXEIZFYGLBNT-KFKAGJAMSA-N 331.460 1.631 10 10 EDCE CCc1noc(C[C@@]2(O)CCCN(Cc3cc(OC)ccc3O)C2)n1 856595053 NAWBJUDOGOJIHZ-SFHVURJKSA-N 347.415 1.916 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)NCCCSc2nccs2)C[C@H]1C 865782697 CLWYGMIWFSZAPT-GMTAPVOTSA-N 344.458 1.708 10 10 EDCE Cc1ccc(O)c(CNC(=O)C(=O)Nc2cnc(CC3CC3)nc2)c1 862025101 NIFJAJIBDHQOOK-UHFFFAOYSA-N 340.383 1.698 10 10 EDCE C[C@@H]1COCC[C@H]1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 769259073 QSESOLVOISNKFM-RHSMWYFYSA-N 348.443 1.927 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2C[C@H](C(N)=O)C2)c1 862816648 MIAAMAWNVMHLDT-KOMQPUFPSA-N 339.395 1.900 10 10 EDCE CCN(CC)C(=O)C1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768441167 WVIFUSHFARMVCL-QGZVFWFLSA-N 348.443 1.898 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCC[C@@H]4COCC[C@@H]43)nc12 1118319532 OJLNWPLRIDBRMK-MFKMUULPSA-N 332.360 1.134 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1cc(Br)no1 1468175123 HASOWPLOHSCPGF-UHFFFAOYSA-N 327.134 1.707 10 10 EDCE C[C@@H](N)c1ccc(N(C)C[C@H](O)CN(C)C)cc1Br 690174042 XLVMRWJMHPAIAT-ZYHUDNBSSA-N 330.270 1.828 10 10 EDCE O=C(O)[C@H]1CO[C@@H](CNCc2c(O)cccc2Br)C1 714029825 OKGBHAOKZBGHSE-RKDXNWHRSA-N 330.178 1.734 10 10 EDCE CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(O)cc1O 1142533239 IDGBERYFRQLKSB-WBMJQRKESA-N 349.431 1.934 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCn2c(nnc2C(F)(F)F)C1 1147337464 NJCLHAXNRWZWQM-UHFFFAOYSA-N 342.277 1.293 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cc3nc[nH]n3)CCC2)cc1C 1326911364 PJDSZKORHVKHNT-UHFFFAOYSA-N 343.431 1.493 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1ccc(NC(=O)C(F)(F)F)cc1 1261595267 NHFNREXHCMXTBK-UHFFFAOYSA-N 331.246 1.431 10 10 EDCE N[C@@H]1CC[C@H](C(=O)O)N(Cc2cc(Br)ccc2O)C1 2132271806 AFXNHDKEVHWSME-GHMZBOCLSA-N 329.194 1.531 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cnc(C)n2C)cc1C 1268658463 LBCDLZJZYVQMEJ-CYBMUJFWSA-N 330.432 1.954 10 10 EDCE CCN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C1COC1 1915722293 VXWDMMRIDFGZAH-LBPRGKRZSA-N 327.178 1.660 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@]23COC[C@@H]2C3)cc1C 1283613306 WPAPYOOQHOMIMA-QOKNQOGYSA-N 332.444 1.977 10 10 EDCE COc1cc(C(=O)N[C@H](C)C[C@H](C)NC(=O)C2(C)CC2)cc(OC)n1 1512259854 MHEDHFXGABZSST-NEPJUHHUSA-N 349.431 1.912 10 10 EDCE O=C(Nc1cn[nH]c1)[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 1449967476 HMXMWISCAVSGOX-FXMSTWTQSA-N 342.355 1.321 10 10 EDCE CCCN(CCNC(=O)COC)C(=O)c1ccc(N=NC(N)=O)cc1 1704369974 ZWMBOFOWNNOICF-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@H]3[C@@H](C2)C3(F)F)c1 1620707689 MHSFRKXBSNKZKQ-GHMZBOCLSA-N 346.355 1.491 10 10 EDCE CCN1CCO[C@H](C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)C1 1732984219 ZCGJLUHBCASZNN-QAPCUYQASA-N 349.475 1.319 10 10 EDCE Cc1cc(/C=C2/SC(=S)N([C@H](CO)C(=O)O)C2=O)ccc1F 1858596217 PQRTXGFRVSABFV-QZULDAKNSA-N 341.385 1.781 10 10 EDCE O=C(Nc1n[nH]c(Cc2ccccc2)n1)c1cc(O)c(O)c(O)c1 1865876329 DHZZSTVMACMZFE-UHFFFAOYSA-N 326.312 1.765 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)C[C@H](C)O)c(Br)cc21 252616553 ZZBBAOKWJVGYBZ-JVXZTZIISA-N 328.210 1.479 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCO[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985094833 UYTUTRCRSKAORI-MWLCHTKSSA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)NCc1ccccc1O 269163245 VQNZVGXEJVUJGF-CYBMUJFWSA-N 336.388 1.644 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010390710 HLOVJUJLZUWJOB-SDDRHHMPSA-N 339.396 1.970 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010398231 VPCDVPLSORRUBY-IJLUTSLNSA-N 341.412 1.952 10 10 EDCE CN(C)C(=O)c1cnn(Cc2cccc(Br)c2O)c1O 2070582880 HHIDASQQZIQFTO-UHFFFAOYSA-N 340.177 1.807 10 10 EDCE C[C@H](N)c1ccc(N2CCN(C3COC3)CC2)c(Br)c1 2169590402 ACGZOZMCUSGYDW-NSHDSACASA-N 340.265 1.990 10 10 EDCE CN[C@@H](C)c1ccc(N(C)C2CS(=O)(=O)C2)cc1Br 2095905108 WQUIQOZQIMHMFZ-VIFPVBQESA-N 347.278 1.963 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N1CCN2CCC1CC2 2311245364 STUUNHIZRVKJIL-UHFFFAOYSA-N 341.455 1.843 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1OCC[C@H]1O 1952399019 CEIZLQFKRDPZNW-UXIGCNINSA-N 339.388 1.683 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@@H]3CCOC[C@H]3C)CC2)cc1 277282361 BFUFOEQUZBRLCK-CRAIPNDOSA-N 347.459 1.358 10 10 EDCE Cc1ccc(CN2CC[C@@](O)(CC(=O)O)C2)c(O)c1Br 2380807374 XLSVZJPGPRLREL-CQSZACIVSA-N 344.205 1.875 10 10 EDCE Cc1ccc(CN2C[C@H](O)[C@H](CC(=O)O)C2)c(O)c1Br 2381137783 QJDNKZFPKNMBJK-MNOVXSKESA-N 344.205 1.731 10 10 EDCE Cc1ccc(CN2C(=O)[C@@H](C)NC(=O)[C@@H]2C)c(O)c1Br 2381140090 FPTSRXAFRGSQDN-BDAKNGLRSA-N 341.205 1.699 10 10 EDCE CN1CCC[C@]2(CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)C2)C1 814908395 ALUCUKSCIYPFNY-KRWDZBQOSA-N 346.387 1.848 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc2c(n1)OCCO2 653672679 XCEXXSPNAFMTBL-UHFFFAOYSA-N 341.367 1.958 10 10 EDCE Cc1c(Cl)c(/C=C2/SC(=S)N(CC(=O)O)C2=O)nn1C 817706577 COABASCBCPSGKS-XVNBXDOJSA-N 331.806 1.668 10 10 EDCE CN(C)c1ccc(/C=C\CNCC(C)(C)NS(C)(=O)=O)cc1 835036533 KTVIWEFLSUMLHQ-SREVYHEPSA-N 325.478 1.683 10 10 EDCE Cc1cc(C)c([C@@H](C)NCCS(=O)(=O)N=S(C)(C)=O)c(O)c1 903227948 WLOVVRNAMABPOL-GFCCVEGCSA-N 348.490 1.717 10 10 EDCE COCC1(CNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1 848932623 SWLYDJXYXPSPIV-UHFFFAOYSA-N 345.443 1.228 10 10 EDCE COc1ccc(CNS(=O)(=O)c2cnn(C3CCC3)c2)c(O)c1 915163930 HYISTORYXXPIES-UHFFFAOYSA-N 337.401 1.801 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCn2c(C(=O)c3ccccc3)ccc21 849839854 OUEDAIDGVGFOIX-AWEZNQCLSA-N 339.347 1.908 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@@H](C(=O)N3CCNCC3)C2)c1 843046891 HTIUWDYRSYEEOV-OAHLLOKOSA-N 347.459 1.435 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CN(C)[C@H]3CCSC3)C2)cc1 855233694 KQWNXIXGLWHQBM-HOCLYGCPSA-N 349.500 1.827 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc4ncccn4n3)C2)cc1 857635376 SRZWTWYPLXSTGV-ZDUSSCGKSA-N 337.383 1.747 10 10 EDCE Cc1ccnc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)n1 856213273 FQLCWLYKXKJMRS-UHFFFAOYSA-N 326.400 1.676 10 10 EDCE COc1ccc(N2CC[C@H](Nc3cc(NC[C@H](C)O)ncn3)C2)cc1 853758161 ATIKCZCKOFLPIT-KBPBESRZSA-N 343.431 1.969 10 10 EDCE COc1ccc(N2CCCN(CCN3C(=O)CN(C)C3=O)CC2)cc1 851733400 UKKFMIBGLOQLFE-UHFFFAOYSA-N 346.431 1.101 10 10 EDCE CCON(CC)C(=O)CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 858368279 HSBHDULYMUYAFV-ZDUSSCGKSA-N 336.436 1.913 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@H](CC(N)=O)C3)C2)cc1 852448223 IEYFGELMWWBEBV-UONOGXRCSA-N 346.431 1.181 10 10 EDCE COC(=O)[C@@H](NCc1cc(F)c(N(C)C)cc1F)c1ccnn1C 862400037 KZZSDJHBAAIJQD-HNNXBMFYSA-N 338.358 1.768 10 10 EDCE CCCN1C[C@@H](C(=O)NCc2ccc3cccnc3c2O)CC1=O 862024939 JYJGXLPXSSBKRV-AWEZNQCLSA-N 327.384 1.815 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)/C=C\CN3CCOCC3)C2)cc1 869228234 FNGCEFOFFBYHGW-YPQKKHBXSA-N 345.443 1.279 10 10 EDCE Nc1ccc(CC(=O)N2CC(NC(=O)OCc3ccccc3)C2)cc1 1959539125 CRIXWEFUHHXRLH-UHFFFAOYSA-N 339.395 1.949 10 10 EDCE Cc1ccc(C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)c(O)c1O 781015845 YQRRZDWPIGPNOA-UHFFFAOYSA-N 329.312 1.908 10 10 EDCE CC(C)(CCS(C)(=O)=O)NC(=O)c1ccc(N=NC(N)=O)cc1 1137085003 MZDVICCDELPZTE-UHFFFAOYSA-N 340.405 1.792 10 10 EDCE C[C@H](NC(=O)[C@@H](C)n1cnc2c(N)ncnc21)c1ccccc1O 1151899279 BMUUWCWEWACJJT-VHSXEESVSA-N 326.360 1.553 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(c2ccccc2O)CC1 1150395744 UGNOAQULIRDLIU-UHFFFAOYSA-N 328.368 1.695 10 10 EDCE CS(=O)(=O)C[C@H](C(=O)NCc1cccc(O)c1O)c1ccccc1 1303195120 QGRYAQABHHRZNR-AWEZNQCLSA-N 349.408 1.542 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CC[C@H](CS(N)(=O)=O)C2)c1O 1176699401 KRJBXGHVIRYIRQ-JTQLQIEISA-N 346.836 1.359 10 10 EDCE [N-]=[N+]=NC1CN(C(=O)c2cc(I)sn2)C1 1909840614 JKGLFMZMXDVRBA-UHFFFAOYSA-N 335.130 1.882 10 10 EDCE CC/C=C(/C)C(=O)NC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1354268166 FLPJQHLLEAGTBO-SEVUFMINSA-N 335.404 1.690 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCC1COC1 1351361350 KYZNTOIMMUDXLX-UHFFFAOYSA-N 337.395 1.232 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)c1ccco1 1284267291 XZPLMIFKKSUQQL-JTQLQIEISA-N 343.343 1.990 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)c1nnn2cc(C)nc(O)c12 1294681389 HOBJTRBWZUDKBI-UHFFFAOYSA-N 341.371 1.896 10 10 EDCE C[C@@H](NC(=O)Cc1ccc(S(N)(=O)=O)cc1)c1ccccc1O 1471195456 JANLQWWBXXLTRD-LLVKDONJSA-N 334.397 1.460 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2ncn(C)n2)cc1C 1715812095 SAQBQOCRGNKQOS-SNAWJCMRSA-N 329.404 1.208 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)c2cnc(O)n2C)cc1C 1725132772 MIJLONXZWSJIHD-OLZOCXBDSA-N 346.431 1.739 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)Cc2nc[nH]n2)C(C)C)cc1C 1568466664 CZLQIALVNLSDBL-HNNXBMFYSA-N 345.447 1.595 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H](C)N1CCO 1569178159 ZPJVDAQPQXJOBO-TXEJJXNPSA-N 333.392 1.376 10 10 EDCE O=C(NCCNC(=O)c1c(F)ccc(O)c1O)OCc1ccccc1 1654863919 FENWTWKQTMJOSZ-UHFFFAOYSA-N 348.330 1.893 10 10 EDCE O=C(CSc1nnc2ccccn12)NCc1c(O)cccc1O 1597574458 LSRBPNISPGKDQD-UHFFFAOYSA-N 330.369 1.549 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C[C@H]2C=CCC2)cc1C 1676499515 NCBMLHSMEHGGIN-DOTOQJQBSA-N 332.444 1.927 10 10 EDCE CCN(CC)c1ccc(CNCC(=O)N2CCN(C(C)=O)CC2)cc1 1857866699 XQURWBNYGOGFHO-UHFFFAOYSA-N 346.475 1.313 10 10 EDCE COc1cccc(CN[C@H]2COC[C@H]2NC(=O)OC(C)(C)C)c1O 1944917713 OWONDVKBGWVAKY-QWHCGFSZSA-N 338.404 1.783 10 10 EDCE COc1cc([C@](C)(NC(=O)OC(C)(C)C)C(=O)O)cc(O)c1O 1952081699 RIYNVXUWSAJFBS-HNNXBMFYSA-N 327.333 1.931 10 10 EDCE CC1(C)CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)[C@@H]1CO 2148961455 DPLAPDNUCDDALW-VXGBXAGGSA-N 341.205 1.642 10 10 EDCE CN(C[C@@H](O)CC(=O)O)c1ccc(CNC(=O)OC(C)(C)C)cc1 1999353679 NRLBKRLHZXJDTO-AWEZNQCLSA-N 338.404 1.983 10 10 EDCE C[C@H](C(=O)Nc1ccc(N)cc1)N1CC(NC(=O)OC(C)(C)C)C1 1999478222 REWASVULTLVNQT-LLVKDONJSA-N 334.420 1.805 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]1NC(=O)COc1ccc(N)cc1 2012864996 FFMCWODMYWZNSQ-UONOGXRCSA-N 335.404 1.820 10 10 EDCE O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)c1ccc(O)c(O)c1 702600367 QSOWUOFYRZASAU-LJQANCHMSA-N 342.395 1.465 10 10 EDCE C[C@@H](N)c1ccc(N2CC(NS(C)(=O)=O)C2)c(Br)c1 703155631 HDENTPBUXSILLX-MRVPVSSYSA-N 348.266 1.207 10 10 EDCE CC[C@@H](NC1CS(=O)(=O)C1)c1cc(Br)ccc1O 379964953 FMCSUJVLIXXUNI-LLVKDONJSA-N 334.235 1.992 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC(c4ccon4)CC3)c2n1 2062393608 JCRMTGVFSCRABZ-UHFFFAOYSA-N 327.344 1.751 10 10 EDCE O=C1Nc2cc(N3CC4(CC[C@H]4O)C3)c(Br)cc2[C@H]1O 2179697157 JAOPCYSAJDYREI-VXGBXAGGSA-N 339.189 1.396 10 10 EDCE CCOC(=O)c1c(C2CCCC2)nn2c(O)cc(CC(=O)OC)nc12 2080933308 HPFTXBWCLXHMQT-UHFFFAOYSA-N 347.371 1.985 10 10 EDCE C[C@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1C(=O)c1cccc(O)c1O 1643936033 MYPUUWBREHUMLY-WPRPVWTQSA-N 346.305 1.769 10 10 EDCE CN[C@H](c1ccccc1O)[C@H](O)c1cnn(C)c1Br 2091863222 LYDNBHFHQGDGSE-VXGBXAGGSA-N 326.194 1.882 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2199527170 OMMZMMCTXLEQQK-PDRAWDMGSA-N 341.249 1.789 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213589357 VZYSBULYVRQLCD-GUBZILKMSA-N 340.384 1.103 10 10 EDCE O=C(NCCCSc1nccs1)NCCCn1ccnn1 181982303 XDBSZJNTQABBMA-UHFFFAOYSA-N 326.451 1.606 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CC(NC(=O)C3CC3)C2)cc1 190349361 XPKDJGBJPRUPSE-UHFFFAOYSA-N 344.459 1.953 10 10 EDCE CCCC[C@H](NC(=O)NCC)C(=O)NCCc1ccc(O)c(O)c1 271266291 WFSSRSBTBYMKOP-ZDUSSCGKSA-N 337.420 1.634 10 10 EDCE Cc1ccc(CN2C[C@@H](O)[C@H](CC(=O)O)C2)c(O)c1Br 2380811984 QJDNKZFPKNMBJK-GHMZBOCLSA-N 344.205 1.731 10 10 EDCE Cc1ccc(CN2CCN3C(=O)NC[C@H]3C2)c(O)c1Br 2381136122 AYHMYNABDBKPIN-NSHDSACASA-N 340.221 1.673 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCc2nc(C)nc(C(F)(F)F)c2C1 808526250 MTDKLAMQBZOWJX-VIFPVBQESA-N 344.289 1.610 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NC[C@H]1COCCO1 804969474 GFQUTNCGBUWCCY-NSHDSACASA-N 345.193 1.369 10 10 EDCE C[C@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1cc(F)ccc1O 806170808 GFWGXBTYWUAJFH-WCQYABFASA-N 345.440 1.453 10 10 EDCE CCCC(=O)NCC(=O)NC1CCN(c2ccc(OC)cc2)CC1 726562718 OXFDOGNOPAOBOD-UHFFFAOYSA-N 333.432 1.697 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CCCN(C)C3)C2)cc1 823248739 USVDAVWHUXMYCS-HZPDHXFCSA-N 346.475 1.915 10 10 EDCE CN1C[C@H](O)C[C@@]1(C)C(=O)NCc1cc(Cl)cc(Cl)c1O 908211881 LZYJPCCTGYIFKM-YGRLFVJLSA-N 333.215 1.770 10 10 EDCE C[C@@H]1CCNC[C@@H]1NC(=O)NCc1cc(Br)ccc1O 841978763 YMRBKMVIKKYDPJ-SKDRFNHKSA-N 342.237 1.952 10 10 EDCE COC(=O)Cc1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1 748479910 ZEVJTBNWDDJROI-UHFFFAOYSA-N 342.351 1.363 10 10 EDCE N[C@@H](CNC(=O)NCc1cc(Br)ccc1O)C1CC1 841964863 ASMSHFFBIIGEPH-NSHDSACASA-N 328.210 1.691 10 10 EDCE COc1cc(O)c(CNC[C@H](C)N2C[C@H](C)O[C@H](C)C2)cc1OC 848924039 VGOUBTIAYUFVLJ-MELADBBJSA-N 338.448 1.997 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1 841137164 FKOSXZFRSPZNQR-OAGGEKHMSA-N 331.416 1.749 10 10 EDCE C[C@@H]1OC[C@@H](NCc2ccc(N3CCC(C(N)=O)CC3)cc2)[C@@H]1C 926872244 BXLSXYJAAAIWJF-QWQRMKEZSA-N 331.460 1.901 10 10 EDCE CO[C@H](CNC(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCOC1 852439918 JPTCDJLNGIJXQO-DOTOQJQBSA-N 335.448 1.946 10 10 EDCE COc1ccc(N2CC[C@H](Nc3nc(O)c4cnn(C)c4n3)C2)cc1 853758834 LACFKKRDPHWWRT-NSHDSACASA-N 340.387 1.768 10 10 EDCE CCc1noc(C[C@@]2(O)CCCN(C(=O)c3cccc(O)c3O)C2)n1 856710211 IDZZYUANVLWAAK-KRWDZBQOSA-N 347.371 1.253 10 10 EDCE C[C@@H]1CCC[C@@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)O1 850602264 SREVGVADZSTUQF-PBHICJAKSA-N 347.459 1.785 10 10 EDCE CS(=O)(=O)C[C@@H](O)CNCc1ccc(N2CCCCC2)cc1 922827962 XHTRGOCFNQDKJN-INIZCTEOSA-N 326.462 1.172 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCC[S@](=O)CC(F)(F)F 854307627 RBNSDTILYCDGII-QFIPXVFZSA-N 338.351 1.845 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@@H]3C[C@H]4CC[C@H]3O4)cc2)C1 1119688899 DJJJNJMWROEDLD-VDHUWJSZSA-N 329.444 1.798 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cn(C(C)C)nn3)CC2)cc1F 794372191 BUHQYPQMZRJHTL-UHFFFAOYSA-N 347.394 1.969 10 10 EDCE Cn1cnc(-c2nnc3n2CCN(Cc2cc(F)cc(F)c2O)C3)c1 895461959 QYQXQSSKOWBGMR-UHFFFAOYSA-N 346.341 1.678 10 10 EDCE CN(C)C[C@@]1(O)CCN(c2ccc(CN)c(Br)c2F)C1 713658769 BGAIHIZDFHUCSZ-AWEZNQCLSA-N 346.244 1.550 10 10 EDCE CN1CC(CN(C)c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 692189688 GYBDEUIIVZQOSB-CYBMUJFWSA-N 339.237 1.399 10 10 EDCE CCc1nc([C@@H]2C[C@@H](O)CN2C(=O)/C=C\c2ccc(O)c(O)c2)n[nH]1 1305717844 BGVAUOJNHVJUQT-GJJFQZOLSA-N 344.371 1.126 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2cnn(C)c2)cc1C 1317669830 MOXRYNUVCKOTBU-UHFFFAOYSA-N 344.459 1.918 10 10 EDCE CC(C)(C)N1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 1319240094 VATUBZDGIWGNHB-UHFFFAOYSA-N 334.376 1.846 10 10 EDCE C[C@H](N)c1ccc(N2CC(C(=O)N(C)C)C2)c(Br)c1 2121047101 TWHIGEXPCTUIRR-VIFPVBQESA-N 326.238 1.993 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N2CC[C@@H](CN=[N+]=[N-])C2)n1 2121909759 HLCXHVODQDQURF-ZETCQYMHSA-N 349.214 1.504 10 10 EDCE CC(C)n1cc(CNC(=O)N2Cc3cccc(O)c3C2)c(O)nc1=O 1251691333 HLNFEVCOWDJKDP-UHFFFAOYSA-N 344.371 1.461 10 10 EDCE C[C@H]1CC[C@H](C(N)=O)CN1c1ccc(CN)cc1Br 212868029 BBLRJEAJCLZCCY-ONGXEEELSA-N 326.238 1.998 10 10 EDCE C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CN(C)CCN1C 1444416566 RPCHISSEUWNDBC-BXUZGUMPSA-N 332.408 1.213 10 10 EDCE C[C@@H]1C[C@H]1N1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CC1=O 1294085435 YMLOKCRBSSTCBS-OASPWFOLSA-N 329.360 1.588 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1nn(-c2ccccc2)cc1O 1455353022 KMHRKZAQBNSMBS-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE NC(=O)[C@H]1c2ccccc2CCN1C(=O)Cc1ccc(O)c(O)c1 1293544302 AWRBGSHXAJQNOC-QGZVFWFLSA-N 326.352 1.252 10 10 EDCE Cc1cc(C(=O)OC[C@H]2OCCNC2=O)c(C)n1-c1ccccn1 1526569707 RAJBOFBYYYVTJF-CQSZACIVSA-N 329.356 1.161 10 10 EDCE CC(C)(C)OC(=O)c1cnc(C(=O)NCc2cccc(O)c2O)cn1 1471642141 LJIUVDFBHNZZHB-UHFFFAOYSA-N 345.355 1.773 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccnc(O)c1Br 1472063708 ODHOQWOVVDKKNK-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCc2ccc(O)cc2O)c(N)c1 1639444416 KZIDMOKOVFXXIJ-UHFFFAOYSA-N 336.369 1.014 10 10 EDCE CN(CC(=O)NCc1ccccc1)C(=O)Cc1ccc(O)c(O)c1 1630393059 WZNKGIINNYFQEJ-UHFFFAOYSA-N 328.368 1.415 10 10 EDCE CC(=O)C(=O)[C@@H](O)c1cc(Br)c(Br)o1 1929174121 FULNSFSOVWBNPI-ZETCQYMHSA-N 325.940 1.996 10 10 EDCE CC(C)N1CCN(CCCC(=O)NCc2cc(O)ccc2O)CC1 1593881115 GAUUGAPVHLERGC-UHFFFAOYSA-N 335.448 1.520 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CCCNC2=O)cc1C 1666927711 MZGJTYNOESOWAK-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE CS(=O)(=O)Cc1ccc(C(=O)NCCc2ccc(N)cc2)cc1 152505081 IQCKUNRBNVETQC-UHFFFAOYSA-N 332.425 1.786 10 10 EDCE Nc1ccc(NC(=O)c2nn(-c3ccccc3F)c(=O)cc2O)cc1 1866268320 QQHGVAYCKWGDKP-UHFFFAOYSA-N 340.314 1.912 10 10 EDCE CNC(=O)CN(C)c1ccc(CNC2CC2)cc1Br 234368025 JQVHQUQNWWFYMI-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE COc1ccc(CN(CCN(C)C)CCN(C)C)c(O)c1OC 894457809 IEYDEHHLXTWKSC-UHFFFAOYSA-N 325.453 1.335 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H](O)CN(Cc2cc(N)ccc2O)C1 2002701031 LGGZODDQHFAUFD-UONOGXRCSA-N 337.420 1.434 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)[C@H]1CCOC1 2003172211 HXAAKUFTHZLZQE-MNXVOIDGSA-N 340.420 1.182 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2cccc(O)c2O)CCO1 2006285082 VQBJEJAHCIYXOG-SNVBAGLBSA-N 338.360 1.769 10 10 EDCE CCN(CCCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 165208371 NHHUDOSRHOZRTK-LBPRGKRZSA-N 328.210 1.610 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H]4CO[C@@H](C4)C3)c(Br)cc21 2152299322 YSRWQUIWMUJQEA-UVPNAGLESA-N 338.205 1.626 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010403366 CRHCRXLUUVAPBA-UWVGGRQHSA-N 340.384 1.056 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(N)cc1 2022833159 QMSHNJBVXPFZDI-RISCZKNCSA-N 337.420 1.202 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C(=O)NCc1cccc(C)c1O 2024812828 RBWSJHTUWFBYSA-CYBMUJFWSA-N 338.404 1.857 10 10 EDCE CCn1nnc(Br)c1[C@H](NN)c1ccc(N(C)C)cc1 2156437992 MFUSLLOEKJPLCE-LLVKDONJSA-N 339.241 1.679 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@H](C)O[C@@]4(CCO[C@H]4C)C3)c2n1 2064412446 PRTLWGJRGYEZEU-PRXAMGSTSA-N 346.387 1.152 10 10 EDCE CN[C@H](C)c1ccc(N2CC(CO)(OC)C2)cc1Br 2101061919 IQWCEQBELZBBCG-SNVBAGLBSA-N 329.238 1.927 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)C[C@@H]2CO)c(Br)c1 2089862708 CEBRDCZIVFIULX-JBLDHEPKSA-N 329.238 1.648 10 10 EDCE C[C@@H](O)c1ccc(N2CC(=O)N[C@@H]3CC[C@H]32)cc1Br 2112060444 FFBULDRWFRCFFD-BZHVJNSISA-N 325.206 1.970 10 10 EDCE N[C@H]1CN(Cc2c(O)cccc2Br)[C@@]2(CCOC2)C1 2098287781 RTRVFKUIMCUZJN-YGRLFVJLSA-N 327.222 1.847 10 10 EDCE CN(C)C[C@H]1COC[C@@H]1NCc1cc(Br)cc(F)c1O 2206389153 AXRHHYWNIJREEK-GWCFXTLKSA-N 347.228 1.960 10 10 EDCE O=C(Nc1ncncc1Br)c1cc(O)c(O)c(O)c1 2230094587 KQPKVUVYFMZDEI-UHFFFAOYSA-N 326.106 1.608 10 10 EDCE O=C1NC(=O)N(CCC2=CCCCC2)C(=O)C1=CNN1CCCCC1 2296944804 LVICXXJTYPZJFH-UHFFFAOYSA-N 346.431 1.830 10 10 EDCE NCC[C@H](COCc1ccccc1)NC(=O)c1cccc(O)c1O 2303738262 OOASTRGNUNKDFA-CQSZACIVSA-N 330.384 1.762 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C=Cc1ccc(C(N)=O)cc1 2308464822 WVLQZUQXBBTDHW-GFCCVEGCSA-N 340.379 1.957 10 10 EDCE C[C@@H](N)c1ccc(N2CC3(COC(=O)N3)C2)c(Br)c1 2351881626 MGEDUBGNFDKIQG-MRVPVSSYSA-N 326.194 1.767 10 10 EDCE Cc1ccc(CNC(=O)[C@]23CNC[C@H]2C3)c(O)c1Br 2352623334 ASVTTZXUTIHSLQ-QMTHXVAHSA-N 325.206 1.689 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CNCCS2)c(O)c1Br 2352950383 RRMWWSMXYOTIBB-JTQLQIEISA-N 345.262 1.784 10 10 EDCE COC(=O)[C@H](C)N1C(=O)/C(=C2\C(=O)Nc3ccccc32)SC1=S 1810209 GRMLJIMPQNOPSF-QYQSLSSCSA-N 348.405 1.772 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1C[C@H](O)CO1 1952208709 MHFSEPFCMWXTCF-YWPYICTPSA-N 339.388 1.683 10 10 EDCE CC(C)N(Cc1ccc(N)cc1)S(=O)(=O)NCC(F)(F)F 126035659 YTFBLACTZTZJOA-UHFFFAOYSA-N 325.356 1.876 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3ccncc3)nc12 182875344 SKVONFDVTGRYTK-NSHDSACASA-N 341.371 1.857 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCC[C@H]1CN1CCOCC1 92218103 ITYZSQZCMUKRTA-FQEVSTJZSA-N 345.487 1.820 10 10 EDCE CCCN(C)S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 246200658 PMFMCESRQJIDEY-OAHLLOKOSA-N 342.461 1.960 10 10 EDCE CCN1CC[C@@H](CNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255000276 ZHNZPHURDNWIOD-MTIYJEKLSA-N 343.471 1.994 10 10 EDCE COC[C@@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)C[C@@H](C)O1 251514682 CHHYNYBXLCQQQX-PBHICJAKSA-N 335.448 1.105 10 10 EDCE CCn1nc2c(cc1=O)CN(Cc1cc(F)cc(C(C)=O)c1O)CC2 370217103 XTSBOIYGOYBOPK-UHFFFAOYSA-N 345.374 1.869 10 10 EDCE CCOCCOCC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 819582601 NVHPKIQPPGTQOL-OAHLLOKOSA-N 336.432 1.691 10 10 EDCE O=C1CC[C@@H](C(=O)NCc2ccc(N3CCSCC3)cc2)CCN1 815046146 JPIRDGIYOICZTQ-OAHLLOKOSA-N 347.484 1.772 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)NCC2CNC2)CCCC1 653127448 AJCKOGDRJITWSM-UHFFFAOYSA-N 327.428 1.864 10 10 EDCE CN1C[C@H](O)C[C@]1(C)C(=O)NCc1cc(Br)ccc1O 908171457 YJTSELPVTVEHFF-BXUZGUMPSA-N 343.221 1.226 10 10 EDCE CC[C@@H](NCCS(=O)(=O)N=S(C)(C)=O)c1ccccc1O 903225543 IZVOALDBTSSXPG-GFCCVEGCSA-N 334.463 1.490 10 10 EDCE Cc1cc(CC(=O)N2CC[C@@](O)(C(N)=O)C2)c(C)n1-c1ccccc1 832806153 IJAFNIIJXNVHJN-IBGZPJMESA-N 341.411 1.085 10 10 EDCE COc1ccc(N2CC[C@H](N[C@@H]3C(=O)NCC34CCOCC4)C2)cc1 926680785 RMXPGDZOSGWDOT-WMLDXEAASA-N 345.443 1.159 10 10 EDCE O=C(NCc1cc(NC(=O)C2=COCC2)ccc1O)C1=COCC1 923121614 DWMJVUIXHLVNPF-UHFFFAOYSA-N 330.340 1.555 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C2)cc1 855226252 OTIOXPJRFABJJF-WMLDXEAASA-N 347.459 1.941 10 10 EDCE COc1ccc(N2CC[C@H](Nc3nc(C)nc(N(C)C)n3)C2)cc1 853759227 PTGFIYXWCINSJM-ZDUSSCGKSA-N 328.420 1.945 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@H](CCF)C3)cc2N1 858797107 JIYZHGYMXNCCGR-SECBINFHSA-N 325.296 1.491 10 10 EDCE O=C1NCC[C@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)[C@H]12 931704757 VVNDIZDFIZPPNN-AEFFLSMTSA-N 329.444 1.624 10 10 EDCE OCc1nnc2n1CCN(Cc1cccc(Br)c1O)C2 769517630 QVEDTKNMHZOZQH-UHFFFAOYSA-N 339.193 1.254 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCc1cc(C(N)=O)co1 779575762 OUZHIIAMXHWAHP-UHFFFAOYSA-N 330.388 1.752 10 10 EDCE NS(=O)(=O)C[C@@H]1CCCN(Cc2cc(Cl)cc(F)c2O)C1 775687903 KPIANWDGSDNTGE-SECBINFHSA-N 336.816 1.685 10 10 EDCE C[C@@H](NC(=O)NCCC1CS(=O)(=O)C1)c1ccc(N(C)C)cc1 786817244 SYASLDIMFWAAEI-GFCCVEGCSA-N 339.461 1.548 10 10 EDCE COc1ccc(N2CCN(c3ncccn3)CC2)c2c1CCNC2 82792791 FIJBQHBJDYTCGA-UHFFFAOYSA-N 325.416 1.458 10 10 EDCE CCN1CCO[C@@H](CNCc2c(O)cccc2Br)C1 706809454 ZQWQDZZVZRZVLG-NSHDSACASA-N 329.238 1.965 10 10 EDCE CCOC(=O)c1cc(CNC(=O)NCc2c(O)cccc2F)on1 1313176800 BHSLNWOUALVFLR-UHFFFAOYSA-N 337.307 1.695 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@@H](C)C3CC3)C2)cc1 1327972655 BLZCCIZXBYZQHR-UKRRQHHQSA-N 345.443 1.552 10 10 EDCE CCOc1ccc(N2CCN(C(=O)Cn3cncc3C)CC2)cc1 1329947265 BHDKVIZGWFIEGC-UHFFFAOYSA-N 328.416 1.939 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC[C@H](O)COC(C)C)cc2)CC1 1335502151 XKVDRGVQJZLHPP-IBGZPJMESA-N 349.475 1.231 10 10 EDCE C[C@@H]1CO[C@H](C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1332005351 UXXFAUUWLMDZIL-GUYCJALGSA-N 345.443 1.430 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1908253057 LTWNBSXRMXPRTJ-SRVKXCTJSA-N 339.396 1.658 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)CN2CCOCC2)cc1C 1267979545 GCHSMOMWUCVGSD-OAHLLOKOSA-N 349.475 1.178 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H]2[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1906904875 POOZYEDNFSQPEK-MJDBTJCESA-N 336.432 1.898 10 10 EDCE CC1(C)CC(=O)NCCN1Cc1ccc(N2CCOCC2)c(F)c1 1350328733 WPVFTFPZVSAQDP-UHFFFAOYSA-N 335.423 1.763 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2c(C)nc(O)nc2S)c1 1445970824 QPNIUBKFWGCTTJ-SSDOTTSWSA-N 335.385 1.985 10 10 EDCE C[C@@H](NC(=O)[C@H](O)c1cnn(C)c1)c1ccc(N2CCOCC2)cc1 1442406231 AEPPLVJJWBNWOE-CXAGYDPISA-N 344.415 1.168 10 10 EDCE 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333.344 1.353 10 10 EDCE CC[C@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 817877806 DTPIBKFLRWALKS-WBVHZDCISA-N 347.459 1.785 10 10 EDCE COC(=O)[C@@H]1COCCN1C(=O)c1cc2cc(O)c(O)cc2s1 900925345 YDNQRPVXGRTSJU-VIFPVBQESA-N 337.353 1.327 10 10 EDCE CN(C)c1ccc(/C=C\CNCC2(OCCO)CCOCC2)cc1 835050227 QJYBBTUWVWKRSK-ARJAWSKDSA-N 334.460 1.914 10 10 EDCE COc1cc(Cl)cc(CN2C[C@H](C)N(CCO)C[C@H]2C)c1O 841890403 AKRKGSLDPDPDPE-NWDGAFQWSA-N 328.840 1.941 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCNC(=O)CC1 840478780 IOEAFMZARADJEK-AWEZNQCLSA-N 332.448 1.524 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N1CCOC[C@@H]1C1CC1 759588074 HMUHSCNMPTXDBE-OKEUPSHZSA-N 347.367 1.292 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCO[C@@H]([C@H](C)O)C3)C2)cc1 854296622 FJOBQHPVOMKSOA-GRDNDAEWSA-N 349.431 1.065 10 10 EDCE C[C@H](C(=O)NCc1ccc2cccnc2c1O)[C@@H](C)S(C)(=O)=O 862025793 BAJYBYWYOAVFLL-WDEREUQCSA-N 336.413 1.626 10 10 EDCE COc1ccc(N2CCN(c3nc(C)nc(N(C)C)n3)CC2)cc1F 768533722 JWXROLDOJGKNCK-UHFFFAOYSA-N 346.410 1.720 10 10 EDCE CC1(C)OCC(CO)(NCc2ccc(N3CCOCC3)cc2)CO1 1119772156 UUVVRSHSSNZSCO-UHFFFAOYSA-N 336.432 1.127 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCC3(CC2)COCCO3)c1O 895695795 GVFDGMLRPGBEPA-UHFFFAOYSA-N 338.360 1.690 10 10 EDCE CCNCc1ccc(N2C[C@H](CO)[C@@H](CO)C2)cc1Br 704763328 DPLXKWMOLWIDMP-CHWSQXEVSA-N 343.265 1.596 10 10 EDCE COCCn1cc(NC(=O)N2Cc3cccc(O)c3C2)ccc1=O 1333831621 APYFICPYRCZUGC-UHFFFAOYSA-N 329.356 1.748 10 10 EDCE O=C(Nc1cnc(Br)nc1)c1cc(O)c(O)c(O)c1 2132401174 SAFUBEAVEQGADE-UHFFFAOYSA-N 326.106 1.608 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H](C)NC(C)=O)cc1C 1268048908 HPAOXWLWYYGTOP-UONOGXRCSA-N 335.448 1.465 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C[C@H]2CCC(=O)NC2)cc1C 1266941378 DUOJXHQLHKTCNT-GDBMZVCRSA-N 347.459 1.514 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2c[nH]c(=O)cn2)cc1C 1268823923 CCONWEVYSPLEHZ-UHFFFAOYSA-N 344.415 1.339 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C1CC(O)C1 1914574381 NANMZSJHCWDPIJ-LBVLNNNDSA-N 327.178 1.394 10 10 EDCE 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CNC(=O)c1cncc(/C=C\C(=O)N(C)c2ccc3c(c2)OCO3)c1 492283427 LICJVOOWNNVELR-UTCJRWHESA-N 339.351 1.846 10 10 EDCE C[C@@H](NC(=O)CN1C(=O)C(=Cc2ccco2)SC1=S)C(=O)O 2314827653 JQMABCMYYSNKIL-SSDOTTSWSA-N 340.382 1.070 10 10 EDCE COc1cccc(N2C(=O)[C@H](CN3CCOCC3)SC2=S)c1 59397393 RCFOFWTWEZFQSC-ZDUSSCGKSA-N 338.454 1.761 10 10 EDCE COC(=O)/C=C1\SC(CCN2C(=O)c3ccccc3C2=O)=NC1=O 65009758 UQXFSGXGMKETDD-FLIBITNWSA-N 344.348 1.402 10 10 EDCE c1cc2c(cc1CNC[C@]1(N3CCOCC3)CCSC1)CCO2 67218372 LXSDXCKEYRKLRB-GOSISDBHSA-N 334.485 1.919 10 10 EDCE Oc1ccccc1CN(Cc1ccco1)C[C@H](O)CN1CCOCC1 121026315 ALRPZLUPRDLDAK-QGZVFWFLSA-N 346.427 1.681 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc(F)cc1F 91258200 PHAJHXSFDGYGPA-UHFFFAOYSA-N 336.294 1.673 10 10 EDCE Cc1nc([C@@H]2COCCN2Cc2ccc(N3CCOCC3)cc2)no1 369460802 FSIMCPNNCIPKHJ-KRWDZBQOSA-N 344.415 1.788 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC[C@@H](O)CN1CCOCC1 819376891 JVMFHTKWXCZDNM-VQIMIIECSA-N 335.492 1.275 10 10 EDCE CNC(=O)[C@@H]1CCN(Cc2c(O)c(C(=O)OC)cc3ccccc23)C1 817369480 AVDXFULKNRAKCC-CYBMUJFWSA-N 342.395 1.900 10 10 EDCE Cc1ccc(C(=O)OCC(=O)NC2CCN(C3CC3)CC2)c(O)c1O 727005558 SMCXEDKQKAGPHH-UHFFFAOYSA-N 348.399 1.306 10 10 EDCE COC[C@]1(C(=O)OC)CCCN1Cc1ccc(N2CCOCC2)cc1 827489541 SDIUARSEWFEBME-IBGZPJMESA-N 348.443 1.677 10 10 EDCE CN1CCN(CCNC(=O)c2cc3cc(O)c(O)cc3s2)CC1 900042934 FDFHMJHQANSDKS-UHFFFAOYSA-N 335.429 1.290 10 10 EDCE CNCCN(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 903573095 QGMYVBBUKFVXDT-UHFFFAOYSA-N 348.491 1.274 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](CF)C(=O)O)C2)cc1 909133343 DSFJKFSVUWPNNV-SMDDNHRTSA-N 339.367 1.243 10 10 EDCE Cn1nccc1[C@@H]1NC(=O)N(Cc2ccc(N3CC=CC3)cc2)C1=O 843307225 DITZITAVXKRUNX-INIZCTEOSA-N 337.383 1.589 10 10 EDCE COc1ccc(N2CCC(NC(=O)N3CC[C@H](N)[C@@H]3C)CC2)cc1 841778911 HSBYUFFDMBGZOJ-GUYCJALGSA-N 332.448 1.795 10 10 EDCE COc1ccc(N2CC[C@H](NC(=S)NCc3ccon3)C2)cc1 849270437 DAWSGBXQZQHUMZ-ZDUSSCGKSA-N 332.429 1.926 10 10 EDCE COC[C@H]1C(=O)N[C@H](c2cc(C)cc(Br)c2O)N1C 840830993 GHVNQNPHZHASJM-JQWIXIFHSA-N 329.194 1.538 10 10 EDCE CN(C)CC(C)(C)CN(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 929236316 AIADVQSEQVOKGC-UHFFFAOYSA-N 348.491 1.415 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H](C)C(OC)OC)cc1 923651578 HTSCQIIQPFZDDK-CYBMUJFWSA-N 339.436 1.780 10 10 EDCE C[C@@H]1CN(Cc2cc3c(cc2O)CCCC3)CCN1S(C)(=O)=O 853564918 YHRXLSVKIYSUDS-CYBMUJFWSA-N 338.473 1.737 10 10 EDCE COc1ccc(N2CCN(CCN[C@H](C)C(C)(C)CO)CC2)cc1 924830990 GEXQRWJGBJSZJI-MRXNPFEDSA-N 335.492 1.814 10 10 EDCE COc1cc(CN2CCO[C@H](CC(N)=O)C2)c(O)c(C(C)(C)C)c1 862535594 SKWAYXVNUUTTHP-CQSZACIVSA-N 336.432 1.775 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CC[C@@H](C)NC1 861803841 GKAGCVSNTIMKLM-HIFRSBDPSA-N 333.432 1.388 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCc2ccc(F)cc2C1 1118941400 BRJVGWIWDQXJTR-UHFFFAOYSA-N 340.354 1.958 10 10 EDCE Cn1cnc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)c1Cl 776434424 FAXVQVHSEWUFCO-UHFFFAOYSA-N 331.737 1.278 10 10 EDCE CC(=O)c1cc(F)cc(CN2C[C@@]3(C)C(=O)NC(=O)[C@@]3(C)C2)c1O 879158173 OGFUTPSMTKSOGH-CALCHBBNSA-N 334.347 1.219 10 10 EDCE Cc1cc(CC(=O)NCc2nnc(O)n2C)c(C)n1-c1ccccc1 880650775 VWZJMXMVPDPVMC-UHFFFAOYSA-N 339.399 1.787 10 10 EDCE CCN(CC)c1ccc(CNC(=O)CS(=O)(=O)N(C)C)cc1 785344123 SEJKQQXGBITATR-UHFFFAOYSA-N 327.450 1.040 10 10 EDCE CN(Cc1ccccc1)C[C@@H](N)C(=O)N(C)Cc1ccccc1O 705289002 NUSHFKFQMSCWOD-QGZVFWFLSA-N 327.428 1.810 10 10 EDCE CC(C)(C)[C@@H](O)C[C@H](CO)NCc1ccc(N2CCOCC2)cc1 790618873 IUHDJOTUCLIQKG-AEFFLSMTSA-N 336.476 1.771 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)[C@@H]2CCNC2=O)C2CC2)cc1C 1323050244 GLXIMKKVLSGGMC-CVEARBPZSA-N 345.443 1.124 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1CC(C)(F)C1 1329004632 NZXFPNXGKAMKMW-ZDUSSCGKSA-N 335.423 1.679 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@@H]2[C@H](O)CO)cc1Br 2123209819 JUVDWNYYPMTEGR-CUOATXAZSA-N 329.238 1.791 10 10 EDCE O=C(Nc1cc(Br)ncn1)c1cc(O)c(O)c(O)c1 2132404028 OOJGCVLJBOCULR-UHFFFAOYSA-N 326.106 1.608 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)C3(C(N)=O)CC3)C2)cc1C 1265555953 NBXSZPPOUNRDRY-OKILXGFUSA-N 331.416 1.006 10 10 EDCE CO[C@H](C)CN[C@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1267155008 BDPDUYVAQPVMBP-VXGBXAGGSA-N 335.408 1.982 10 10 EDCE COCC1(C)CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1351908176 VFDNPSGNUVUQCT-UHFFFAOYSA-N 332.400 1.510 10 10 EDCE COc1ccc(CN[C@@H]2C[C@@H](C)N(C(=O)CCCC(N)=O)C2)cc1C 1278430034 DBRUPIWCUJRCJK-GDBMZVCRSA-N 347.459 1.738 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)CC3CC(N)C3)cc2)CC1 1521686295 LNMAEBCYJZOMAE-UHFFFAOYSA-N 344.459 1.099 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2coc(C)c2)cc(OC)n1 1526520521 ZHLVDSRCBGRDHW-SNVBAGLBSA-N 347.371 1.549 10 10 EDCE CNC(=O)[C@@H](C)NC[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1482370978 HLIUJKDMLPRSGO-WDEREUQCSA-N 348.407 1.034 10 10 EDCE CN(C[C@H](O)CNCC1CCC1)C(=O)c1ccc(N=NC(N)=O)cc1 1486319691 NBRKSBKBKKKDMD-OAHLLOKOSA-N 347.419 1.672 10 10 EDCE COc1ccc(CNC2CC(N(C)C(=O)[C@H](C)NC(C)=O)C2)cc1C 1486454562 VVXBIDRWZMZBML-IGEOTXOUSA-N 347.459 1.607 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cccc(=O)n2C)cc1C 1716452862 OTQVOGYKHJZVRX-AWEZNQCLSA-N 343.427 1.610 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@@H]1CCCO1 1721932402 CSEDZJSSHADTPP-GWCFXTLKSA-N 347.375 1.263 10 10 EDCE C[C@H](CNC(=O)[C@@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1494628897 VQHFZJXYASHKRU-ZYHUDNBSSA-N 347.375 1.120 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@H]2COC(=O)[C@H]2C1 1636266776 IPMVXUOMRKRBPM-KMFMINBZSA-N 345.443 1.806 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)CN(C)C(C)=O)cc1C 1731722894 LWPILCSJWJNODA-CQSZACIVSA-N 335.448 1.466 10 10 EDCE CC[C@@H](CNC(=O)C[C@@H]1CCC(=O)N1)NCc1ccc(OC)c(C)c1 1732215631 WBEQXULVRVHSJS-HOTGVXAUSA-N 347.459 1.657 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1C[C@]2(CO)CCCC[C@]2(CO)C1 1646210206 RSUZJOCPCZCVJT-MWAUBTQZSA-N 347.411 1.485 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2c[nH]cc2C)cc1C 1667934389 RRLILEWLXMKRDV-OAHLLOKOSA-N 331.416 1.521 10 10 EDCE CCC(=O)N[C@H](C)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1678595846 GTXHUBCTQWBXRZ-SNVBAGLBSA-N 331.376 1.836 10 10 EDCE CC[C@@H]1C(=O)NCCN1c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1772837155 UUNLLPXDQHJAGH-SMYYYNMVSA-N 333.344 1.496 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C2(CF)CCC2)cc1C 1699067774 YXVGYMFNSHZLCH-OAHLLOKOSA-N 338.423 1.710 10 10 EDCE CCNCc1ccc(N2CCO[C@@H](CO)C2)cc1Br 233532576 AEWUJTVSBKQOCL-CYBMUJFWSA-N 329.238 1.756 10 10 EDCE C[C@@H](O)c1ccc(N2CCOC[C@H]2[C@@H](O)CO)cc1Br 2146324240 TYDZYTQNNJTNFW-IIMNLJJBSA-N 346.221 1.061 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)CO1 1985093625 CDNHLPWLYFMKFN-GXSJLCMTSA-N 325.369 1.532 10 10 EDCE CC(C)(C)OC(=O)NCC1CN(CC(=O)Nc2ccc(N)cc2)C1 1999482276 GVTDVYWILRPBAP-UHFFFAOYSA-N 334.420 1.664 10 10 EDCE CN(C)C[C@H]1COCCN1c1cc(Br)c(CN)cc1F 2153250227 YDTCXLWPCANUGG-NSHDSACASA-N 346.244 1.814 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NCCCN=[N+]=[N-] 2010392855 KKEPEBGZRBOGKJ-LLVKDONJSA-N 337.384 1.662 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(NCc2ccc(O)c(O)c2)C1 2016028149 CXVOQYPSLDCCCX-KRWDZBQOSA-N 338.404 1.559 10 10 EDCE O=C(O)[C@H]1CO[C@@H](CNCc2cc(Br)cc(F)c2O)C1 715788387 MJBGGTHESGEHBS-PSASIEDQSA-N 348.168 1.873 10 10 EDCE CCNCc1ccc(N(C)Cc2nnn(C)n2)c(Br)c1 2197848062 VFKGEPAGOCRNTP-UHFFFAOYSA-N 339.241 1.719 10 10 EDCE C[C@@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@H](O)C3)c(Br)c1 2190462177 VSHVOIBIAJWZBJ-HMUFECAUSA-N 341.249 1.932 10 10 EDCE C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)CCc2ccc(N)cc2)C1 2044621533 RLRULDANGYRWGO-HNNXBMFYSA-N 343.349 1.871 10 10 EDCE CC(C)C[C@]1(C(=O)O)N[C@@H](c2ccccc2O)[C@H]2C(=O)N(C)C(=O)[C@@H]21 19858352 FWXFFGWGMHQQTN-AHXJXLJNSA-N 346.383 1.137 10 10 EDCE CNCc1ccc(N2CC[C@@]3(C[C@@H](O)CO3)C2)c(Br)c1 2201779763 PQCYIJYGUWWRHK-IUODEOHRSA-N 341.249 1.899 10 10 EDCE CN(C)[C@@H]1CN(c2cc(Br)c(CN)cc2F)C[C@@H]1O 2089923359 OGKKAFUEZNHPEX-OLZOCXBDSA-N 332.217 1.158 10 10 EDCE CC(C)(C)OC(=O)Nc1ccc(CCOc2nnc(=N)[nH]n2)cc1 2213781034 NFWJATAAZHRDCZ-UHFFFAOYSA-N 332.364 1.648 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OCC[C@]2(C(=O)N2CC(N=[N+]=[N-])C2)C1 2253375456 KNPXYAZNHZCTQC-NHYWBVRUSA-N 337.380 1.534 10 10 EDCE OC[C@@H](O)[C@@H]1CCN1c1ccc(CNC2CC2)c(Br)c1 2286208965 MTVVLQKWTBEWGB-LSDHHAIUSA-N 341.249 1.633 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC[C@H](O)[C@@H]3C)c(Br)cc21 2288895663 UJGNXBZJQBXORL-WCDAPOTHSA-N 340.221 1.621 10 10 EDCE CC[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2288890924 ALSGIMXMXGZAMM-WCFLWFBJSA-N 340.221 1.751 10 10 EDCE COc1ccc(C=C2SC(N3CCOCC3)=NC2=O)cc1[N+](=O)[O-] 2296825656 QHKIXYOJDGKAOZ-UHFFFAOYSA-N 349.368 1.906 10 10 EDCE C[C@@H](C[S@](C)=O)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2308436001 MGMHKIWUGILBMZ-PSLXWICFSA-N 336.457 1.420 10 10 EDCE CNC[C@H]1CN(Cc2ccc(C)c(Br)c2O)CCO1 2352677450 ACSBNHTVEDRHJO-LBPRGKRZSA-N 329.238 1.883 10 10 EDCE Cc1ccc(CN2CC[C@@H](O)[C@H](CO)C2)c(O)c1Br 2352687729 QRIPLYABMXQMOE-NWDGAFQWSA-N 330.222 1.638 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC(CC(N)=O)CC2)c([N+](=O)[O-])c1 52391748 VYIRYXJOZIEQCN-HWKANZROSA-N 347.371 1.873 10 10 EDCE C[C@@H](O)CN1CCN(C(=O)NCc2ccc(N(C)C)cc2)C[C@H]1C 173234716 SJNXOSJYGSBTEO-HUUCEWRRSA-N 334.464 1.349 10 10 EDCE O=C(c1cccc(O)c1O)N1CCC(c2ccnn2CCO)CC1 185892225 RACGTZUIHSCEPG-UHFFFAOYSA-N 331.372 1.306 10 10 EDCE COC(=O)[C@@H]1C[C@H](OC)CCN1Cc1ccc(N2CCOCC2)cc1 370368501 UQWFZFHORAMRAS-MSOLQXFVSA-N 348.443 1.676 10 10 EDCE CCOC(=O)C[C@@H]1C[C@H](OC)CN1Cc1cc2c(cc1O)OCO2 376949300 NVSUNQJXQWBTTQ-STQMWFEESA-N 337.372 1.663 10 10 EDCE C[C@@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1ccc(F)cc1O 806170758 CHOOYWUQCAGNPZ-DGCLKSJQSA-N 345.440 1.453 10 10 EDCE O=C(O)c1ccccc1COn1c(=O)c(=O)oc2ccc(Cl)cc21 821296430 CGHGUIVIGBUGMD-UHFFFAOYSA-N 347.710 1.935 10 10 EDCE C[C@@H]1C(=O)N(C)CCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 588526966 NFAJYJXRSMQYPY-GTBONMDNSA-N 343.427 1.226 10 10 EDCE CN(C/C=C/c1ccc(N(C)C)cc1)CCN1CCCS1(=O)=O 835028779 KULNJSAUQDLQCG-GQCTYLIASA-N 337.489 1.733 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)NCCC2(CN)CC2)cc1 846185776 XHSQSKVGOVYKCQ-UHFFFAOYSA-N 334.464 1.902 10 10 EDCE CN(C)CCN1CCC(NC(=O)NCc2c(O)cccc2F)CC1 914017722 KEJXXRVDFXUYAD-UHFFFAOYSA-N 338.427 1.357 10 10 EDCE CNC(=O)[C@@H]1CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 852449391 RUAAETORBSQKCN-ZIAGYGMSSA-N 346.431 1.051 10 10 EDCE CO[C@H](CNC(=O)NCCCSc1nccs1)[C@@H]1CCOC1 853856191 SPPILECHZNSZNB-VXGBXAGGSA-N 345.490 1.976 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C3(C(=O)N(C)C)CC3)C2)cc1 855224860 LNDWLFYLFVOUTL-ZDUSSCGKSA-N 331.416 1.259 10 10 EDCE COC(=O)c1cc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)no1 855223172 CDPCTOUFBLHVPO-LLVKDONJSA-N 345.355 1.479 10 10 EDCE COC(=O)c1ccc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)[nH]1 855223935 CYOZMUNERVRFNR-LBPRGKRZSA-N 343.383 1.819 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CC[C@@H](O)C(F)(F)C1 853775766 BDWHRZKBGFMHGR-OAHLLOKOSA-N 337.370 1.974 10 10 EDCE CCOC(=O)[C@@H](CC(=O)NCc1ccc2cccnc2c1O)C(C)=O 862026516 QXOIJXPDEHFQIB-AWEZNQCLSA-N 344.367 1.715 10 10 EDCE NS(=O)(=O)C[C@H]1CCCN1Cc1ccc(N2CCCCC2)cc1 769428243 ODTYDERLHWKIFM-QGZVFWFLSA-N 337.489 1.930 10 10 EDCE Cc1cc(CC(=O)NCCN2CCNC2=O)c(C)n1-c1ccccc1 894569879 NBGAQVRKFWJHOW-UHFFFAOYSA-N 340.427 1.778 10 10 EDCE COc1cc(CN(C)C2CS(=O)(=O)C2)c(O)c(C(C)(C)C)c1 895399845 UYFGKXBSHOVAEA-UHFFFAOYSA-N 327.446 1.927 10 10 EDCE O=C1C[C@@](C(=O)NCc2ccc(O)c(O)c2)(c2ccccc2)CN1 1137443612 WIWMTUKRVKBQII-SFHVURJKSA-N 326.352 1.172 10 10 EDCE C[C@H](O)COC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O 791494391 NYFGZIVLPVDETN-VIFPVBQESA-N 325.320 1.582 10 10 EDCE OCCN1CCC[C@@H](NCc2ccc(Br)cc2O)C1 691476122 GXVCCDWJRQOQEN-CYBMUJFWSA-N 329.238 1.701 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCn2ncnn2)c1 1149893278 WMZZTYUMZUUDKI-UHFFFAOYSA-N 338.371 1.323 10 10 EDCE C[C@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)CCN1C 92775884 HHVCOPKUUMJJGT-SDBXPKJASA-N 339.237 1.541 10 10 EDCE COc1ccc([C@@H](CO)N(C)C(=O)Cc2ccc(O)c(O)c2)cc1 1152726834 NUYWYLSATNEVQC-OAHLLOKOSA-N 331.368 1.841 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)N(C)CCNCc1ccc(OC)c(C)c1 1317573602 JSOZOTZYQOHYSW-HUUCEWRRSA-N 334.416 1.361 10 10 EDCE C[C@H](NC(=O)Cn1nnnc1-c1ccsc1)c1ccccc1O 1171737903 SQWYYZVQIUGCSE-JTQLQIEISA-N 329.385 1.985 10 10 EDCE CCC(=O)N1CCN(c2ccc(CN)cc2Br)CC1 2126211093 HFTUAERFOGUVLH-UHFFFAOYSA-N 326.238 1.966 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@@]3(C)C[C@H](O)CN3C)CC2)cc1 1333111329 OWDCDZFJYVFVFR-QFBILLFUSA-N 347.459 1.189 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@@H](C2CC2)O1 1335602132 KHNXTWIOWDRYQR-BZNIZROVSA-N 330.384 1.260 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H]2CCCC(=O)N2C)cc1C 1267019948 MEFPVAKRXNPASO-MRXNPFEDSA-N 347.459 1.563 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1nc(O)nc(O)c1N 1352626000 FQZKHTPPKJFKCW-UHFFFAOYSA-N 343.387 1.342 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N(CCO)CCNCC2CC2)cc1 1501518740 MVFKBIFCRICHJA-UHFFFAOYSA-N 333.392 1.283 10 10 EDCE CC[C@H](F)C(=O)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1535555499 KHUFNUFGCRGHKA-LBPRGKRZSA-N 349.366 1.976 10 10 EDCE O=C(NC[C@H]1CS(=O)(=O)c2ccccc2O1)c1cc(O)cs1 1469310532 LHVOGTHEHAQYBT-JTQLQIEISA-N 339.394 1.418 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@@H](CN2CCOCC2)C1 1467416773 ACMINFAQMVVMBZ-HNNXBMFYSA-N 334.416 1.211 10 10 EDCE CNS(=O)(=O)c1ccc(C)c(C(=O)N2Cc3cccc(O)c3C2)c1 1471355166 DFYPMRXMPYXCKP-UHFFFAOYSA-N 346.408 1.765 10 10 EDCE CNCc1ccc(N2CC[C@@H](O)[C@](C)(O)C2)c(Br)c1 2136832837 MTVKIJQZCBOXRF-ZIAGYGMSSA-N 329.238 1.491 10 10 EDCE COCCOC1(CNC(=O)NCc2ccccc2O)CCOCC1 1478674553 LJUOTRTZACZJIJ-UHFFFAOYSA-N 338.404 1.404 10 10 EDCE C[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CCN1c1ccncc1 1644560063 VRJBKMHSIZPVSB-CYBMUJFWSA-N 327.384 1.773 10 10 EDCE O=C(CCn1cnc2sccc2c1=O)NCc1cc(O)ccc1O 1643879662 ZFCPEZJYFFRGFE-UHFFFAOYSA-N 345.380 1.576 10 10 EDCE O=C(CCNC(=O)Cc1ccccc1)NCc1cc(O)ccc1O 1643879654 YUNWPSJBLFOJLZ-UHFFFAOYSA-N 328.368 1.463 10 10 EDCE NCc1ccc(N2C[C@@H]3CCC[C@]3(C(N)=O)C2)c(Br)c1 2144089876 DBCGXUGRZJDRKZ-NHYWBVRUSA-N 338.249 2.000 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]1(CO)CCN(C(=O)OC(C)(C)C)C1 1985104069 FDXUDHCKCFJTKA-AWEZNQCLSA-N 327.385 1.375 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)C1(O)CCC1 1987680266 KMFJZZLJIOWNDB-JTQLQIEISA-N 327.385 1.563 10 10 EDCE OCCN1CCC[C@@H](NCc2cc(Br)ccc2O)C1 384365366 GTPSODKTJSIOTR-CYBMUJFWSA-N 329.238 1.701 10 10 EDCE OC[C@H]1CN2CCC[C@H]2CN1Cc1cc(Br)ccc1O 2062818024 XKDZUEFIQDXYOE-UONOGXRCSA-N 341.249 1.796 10 10 EDCE CC[C@H](NCC(CO)(CO)CO)c1cc(Br)ccc1O 2179802174 DIYZOXWRJPXVRV-LBPRGKRZSA-N 348.237 1.159 10 10 EDCE CCOC(=O)Cc1cc(O)n2nc(C(F)F)c(C(=O)OC)c2n1 2080923551 GGBQMYWLCAOGRE-UHFFFAOYSA-N 329.259 1.265 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N=c1nc(Br)[nH]s1 2047601090 ZCFBPDWMFNPIHD-UHFFFAOYSA-N 330.163 1.315 10 10 EDCE CCS(=O)(=O)NC1CN(c2ccc(CN)cc2Br)C1 2109344815 SHKYWZJEZJFDLN-UHFFFAOYSA-N 348.266 1.036 10 10 EDCE CN(C[C@H]1CCS(=O)(=O)C1)c1ccc(CN)c(Br)c1 2092351399 BYOMUOOSOQIFNV-SNVBAGLBSA-N 347.278 1.779 10 10 EDCE O=C(O)CN1CC(CNCc2ccc(Br)cc2O)C1 2113022874 BUOBAYHBKLKVNY-UHFFFAOYSA-N 329.194 1.261 10 10 EDCE C[C@H]1CCN(C(=O)C=Cc2cn(C)c(=O)n(C)c2=O)c2ccccc21 2297372931 VKQXOPODMWPTEQ-ZDUSSCGKSA-N 339.395 1.638 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C 2300531788 LYGNKZZTGNZGAC-LBPRGKRZSA-N 340.428 1.696 10 10 EDCE Cc1ccc(CN[C@@H]2CS(=O)(=O)C[C@@H]2C)c(O)c1Br 2352947725 JREQKZUWPCGUQV-GXSJLCMTSA-N 348.262 1.986 10 10 EDCE C[C@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)C(N)=O 10959566 IOBKGLWHFZANHB-QMMMGPOBSA-N 338.319 1.075 10 10 EDCE COC(=O)c1ccc(=O)n(CN(C)Cc2ccc(N(C)C)cc2)n1 172606760 GSLYKVCBDZDLAM-UHFFFAOYSA-N 330.388 1.185 10 10 EDCE COc1cccc(CNC(=O)c2cnoc2-c2cnn(C)c2)c1O 194368870 WNRGDUSLOJORGE-UHFFFAOYSA-N 328.328 1.719 10 10 EDCE CCCOc1ccc(CN2CCCN(CCOC)C(=O)C2)c(O)c1 191700264 OBIJIEFHNBVQLA-UHFFFAOYSA-N 336.432 1.862 10 10 EDCE CS(=O)(=O)C[C@@H](N)c1cc(I)ccc1O 95780766 DGVUCNHPDBYWRP-MRVPVSSYSA-N 341.170 1.041 10 10 EDCE Cc1ccc(CN(C)C(=O)C2[C@H]3CNC[C@H]23)c(O)c1Br 2380791705 BKGHRZFBDXBVPF-QWRGUYRKSA-N 339.233 1.887 10 10 EDCE Cc1ccc(CN2C(=O)CC(=O)N(C)C2=O)c(O)c1Br 2381132814 GNHNQFJGUNEZJX-UHFFFAOYSA-N 341.161 1.774 10 10 EDCE COCCCOCC(=O)NCc1cc(Br)ccc1O 804737667 VPVOAEOSNYOLPS-UHFFFAOYSA-N 332.194 1.824 10 10 EDCE CN(C)c1ccc([C@H](N)[C@@H](O)c2cnn(C)c2Br)cc1 2163136894 XUAVDWQOSUHDRS-STQMWFEESA-N 339.237 1.982 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NOC[C@@H]1CCOC1 805331277 JOLRCYMYYPIJAL-SECBINFHSA-N 345.193 1.922 10 10 EDCE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C1CNC1 817917072 MWRDZOFVXHDISC-INIZCTEOSA-N 328.504 1.916 10 10 EDCE NS(=O)(=O)C[C@H]1CCCN1Cc1ccc(Br)cc1O 824815134 ZTBTVUBZDHPHBP-LLVKDONJSA-N 349.250 1.408 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H](O)C1CCC1 826069390 WWFHWARVMQPENU-GOSISDBHSA-N 332.444 1.673 10 10 EDCE C[C@H]1Oc2cccc(N)c2N(OCCOc2ccc(N)cc2)C1=O 821300747 YRAWFRVKPYQFGP-LLVKDONJSA-N 329.356 1.976 10 10 EDCE COC1CCN(c2ccc(CN3C[C@H]4COC[C@@H](C3)O4)cc2)CC1 829515767 HKDHRMQNTDUNLK-KDURUIRLSA-N 332.444 1.901 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)/C=C\[C@H]1CCCO1 821409626 IQCIUKZKTSCCCP-QXPKXGMISA-N 346.427 1.989 10 10 EDCE Cc1c(C[C@H](CN)CNC[C@H](N)c2ccc(N(C)C)cc2)cnn1C 903918229 VLLTXCLWLIHDHM-BEFAXECRSA-N 344.507 1.202 10 10 EDCE O=S1(=O)CCNC[C@H]1CCNCc1cc(Cl)cc(F)c1O 903967592 CTTUJBCNBYNQAM-LLVKDONJSA-N 336.816 1.051 10 10 EDCE CCO[C@@H]1C[C@H](NC(=O)c2c(F)ccc(O)c2O)[C@H]1n1cccn1 832932926 DGZWAUSSORPFGX-ZKYQVNSYSA-N 335.335 1.582 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)NC[C@H]2CCCCN2CCO)c1 834851113 UTIVUMHCFPOOSM-DZGCQCFKSA-N 336.432 1.676 10 10 EDCE COC(=O)[C@@H]1CSCCN(C(=O)c2c(F)ccc(O)c2O)C1 839936048 YTVMVMGHKIYKFB-QMMMGPOBSA-N 329.349 1.215 10 10 EDCE Cc1cc(O)c(CN2CCN(c3nccn(C)c3=O)CC2)cc1C 744441882 YSLVHHAYRHCOOM-UHFFFAOYSA-N 328.416 1.425 10 10 EDCE COCCN(C(=O)C(=O)Nc1ccc(N)cc1)[C@H]1C[C@H]2CC[C@H]1C2 841120850 LDXGSFNFBLEOGE-XEZPLFJOSA-N 331.416 1.871 10 10 EDCE COc1cc(N2CCN(c3nncn3C)CC2)c([N+](=O)[O-])cc1OC 848764158 UQMLBGSMYMBHIP-UHFFFAOYSA-N 348.363 1.067 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H](CCC3OCCO3)C2=O)cc1 924444239 FSAPMTAXCBOXTE-AWEZNQCLSA-N 333.388 1.326 10 10 EDCE Cc1ccc(C(=O)NCC[S@@](=O)CC(F)(F)F)c(O)c1O 855275518 KAJWXRROUVKJBC-OAQYLSRUSA-N 325.308 1.447 10 10 EDCE COC[C@]1(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CCOC1 855225685 PRXJHJYEEQDVJH-RDTXWAMCSA-N 334.416 1.443 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H]2CC[C@H]1[C@H](N)C2 852767498 UUYIGECVSSJQEV-JQHSSLGASA-N 330.476 1.523 10 10 EDCE COC(=O)[C@@]1(OC)CCN(Cc2cc(Br)ccc2O)C1 862474448 TZQFTXSURLRMHY-CQSZACIVSA-N 344.205 1.919 10 10 EDCE NC(=O)CC[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 761890169 YLXUDHIDARGDNH-SNVBAGLBSA-N 348.359 1.408 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC4(CC3)COC(=O)N4)cc2N1 784209496 WZZBNHBWACZTBY-UHFFFAOYSA-N 348.315 1.005 10 10 EDCE COCCN(Cc1noc(COC)n1)c1ccc(OC)c(OC)c1 780301264 JNROUWDEHORQBL-UHFFFAOYSA-N 337.376 1.886 10 10 EDCE C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1cc(F)ccc1O 797121494 ZWJFMNOEQISJMW-AAEUAGOBSA-N 330.425 1.996 10 10 EDCE Cc1ccc(C(=O)Nc2cn(C)nc2-c2cnn(C)c2)c(O)c1O 1140072768 FGGGTSAYEUUJGR-UHFFFAOYSA-N 327.344 1.793 10 10 EDCE C[C@]1(NCc2cccc(Br)c2O)CCC(=O)NC1=O 2116209532 UXHLDQSFNMBREO-ZDUSSCGKSA-N 327.178 1.440 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@H](c3ncccn3)C2)cc1 1176525443 YOANZKICURZZTE-INIZCTEOSA-N 339.443 1.648 10 10 EDCE COC(C)(C)[C@H](C)NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1334617449 SIQUNBYSZRXPNT-NSHDSACASA-N 339.411 1.438 10 10 EDCE CN1CCN(c2ccc(CN[C@H]3C[C@H](O)C34CCC4)cc2F)CC1 1330298840 GVXGOKRYTKOIQD-ROUUACIJSA-N 333.451 1.971 10 10 EDCE C[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 1914299979 ASSUMBKPPAWWOY-KKIHLJRUSA-N 326.194 1.361 10 10 EDCE CN(Cc1nn(C)cc1Br)C(=O)c1ccc(O)c(O)c1 1912461394 CSFSQKXARDXFJP-UHFFFAOYSA-N 340.177 1.866 10 10 EDCE CS(=O)(=O)C1CCC(C(=O)NCc2ccc(O)c(O)c2)CC1 1294868679 FDTVODXUDAQOFX-UHFFFAOYSA-N 327.402 1.317 10 10 EDCE CCN(CC)CCCCNC(=O)CCN1C(=O)CSC1=S 1865764892 FYTGYKNQGIYIOY-UHFFFAOYSA-N 331.507 1.475 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H]1CCCN(Cc2ncon2)C1 1467946833 SHIZQIHFBJDYGA-ZDUSSCGKSA-N 346.387 1.052 10 10 EDCE CCN(C(=O)c1cc2cc(O)c(O)cc2s1)[C@H]1CC(=O)NC1=O 1544343530 FIMOGZZEFBREJR-QMMMGPOBSA-N 334.353 1.190 10 10 EDCE CCOCCN1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1483706187 MEEAKKJUSNZFLP-AWEZNQCLSA-N 333.392 1.690 10 10 EDCE CC(C)=CCN[C@@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1486065755 LWTMZZYDEXKTCJ-CQSZACIVSA-N 333.392 1.496 10 10 EDCE COC(=O)[C@H]1c2ccccc2OCCN1C(=O)c1cccc(O)c1O 1558656854 BUVNWZLMKWFNOD-OAHLLOKOSA-N 343.335 1.847 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H]3CCNC(=O)[C@@H]32)cc1 1558096715 NIUBYXUQRBFXKA-GXFFZTMASA-N 329.360 1.590 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)Cc2ccc[nH]2)cc1C 1486063647 ROPAUSUYIKKKAE-MRXNPFEDSA-N 331.416 1.141 10 10 EDCE CN(Cc1ccccc1O)c1nnc([C@H]2CCC(=O)N2)n1C1CC1 1554175665 RRKHKEJSPHTYJF-CYBMUJFWSA-N 327.388 1.906 10 10 EDCE CCC(=O)N[C@H](CCSC)C(=O)NCc1c(O)cccc1O 1558533346 CZOXRWKPOJFZAE-LLVKDONJSA-N 326.418 1.362 10 10 EDCE CCOCC(=O)NC/C=C/CNC(=O)c1ccc(N=NC(N)=O)cc1 1738437921 HMIGXCMRDCZTJS-XZFMURBMSA-N 347.375 1.288 10 10 EDCE CC1(C)[C@H](O)C[C@]1(CO)NCc1ccc(Br)cc1O 1879557811 DTBSGHIJYGUVEU-TZMCWYRMSA-N 330.222 1.766 10 10 EDCE C[C@H](O)[C@H](N)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952122393 UMECTTMHYOZGMB-PXWWUCIGSA-N 326.393 1.242 10 10 EDCE C[C@@H](NCc1cc(Br)ccc1O)C1CS(=O)(=O)C1 1967843773 RZVSLNRAHJUXMZ-MRVPVSSYSA-N 334.235 1.677 10 10 EDCE O=C(O)[C@@]1(O)CCN(Cc2cc(Br)cc(F)c2O)C1 1968189083 DNJIENKHYXACPS-GFCCVEGCSA-N 334.141 1.315 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985102204 CWEGMUIPQJBVIW-VHSXEESVSA-N 327.385 1.467 10 10 EDCE COc1ccc(N2CCN(C(=O)OC(C)(C)C)C[C@H](O)C2)c(N)c1 1999542517 RXUBFNSJIBFAMO-GFCCVEGCSA-N 337.420 1.695 10 10 EDCE CN(C)C(=O)[C@H]1COCCN1c1ccc(CN)cc1Br 2155018004 ZQGVQAPYXNIHPS-CYBMUJFWSA-N 342.237 1.201 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC4(CCO4)C3)c(Br)cc21 2171804550 FYSPHZCNYRSJEK-LBPRGKRZSA-N 338.205 1.641 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@](O)(CN(C)C)C2)cc1Br 713709443 UTDQRCIFRGKSKS-ABAIWWIYSA-N 342.281 1.972 10 10 EDCE Nc1ccc(OCC(=O)N[C@H]2[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1 398302376 RVWBRADUEAWEAQ-RUYXUALKSA-N 337.423 1.894 10 10 EDCE C[C@H](O)[C@H]1CCCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2193600668 ZOCAZPYTPVTWIA-CQOUMUIBSA-N 340.221 1.751 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3[C@H]4COC[C@H]3C4)c(Br)cc21 2198577390 HNVMEOUGFFKMHN-OTPXZMOZSA-N 338.205 1.639 10 10 EDCE CC(C)(C)OC(=O)NCCN1CCN(CCc2ccc(N)cc2)CC1 2044673660 YOHBZFPKVYONOD-UHFFFAOYSA-N 348.491 1.954 10 10 EDCE CN(C(=O)[C@H]1C[C@@H](O)CN(C(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2080778902 PZEWHNUBIKRLNE-SWLSCSKDSA-N 349.431 1.850 10 10 EDCE CN(C(=O)[C@@]1(CO)CCN(C(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2080754338 SJDQYBQIXODAEQ-SFHVURJKSA-N 349.431 1.851 10 10 EDCE CCN(Cc1cc(Br)ccc1O)[C@H]1CC(=O)NC1=O 2114733027 SOEZBWYZHBSEHN-JTQLQIEISA-N 327.178 1.392 10 10 EDCE COc1ccc(N2CCN(C)C[C@H]2CO)c(OC)c1Br 2234881719 RLVMBAAWTVSWQV-JTQLQIEISA-N 345.237 1.579 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2236637051 RCHZCWDGGKWHCR-SDDRHHMPSA-N 343.265 1.896 10 10 EDCE COc1ccc(N2CC[C@H]2C(=O)O)cc1I 2243014770 IOJJPTYVXSEPNH-VIFPVBQESA-N 333.125 1.963 10 10 EDCE N[C@H]1CCCC[C@@H]1NC=C1C(=O)NC(=S)N(c2ccccc2)C1=O 2296116212 VMNVYGXDZFTPSS-KBPBESRZSA-N 344.440 1.178 10 10 EDCE COc1ccc(C=C2SC(=S)N([C@H](CO)C(=O)O)C2=O)cc1 2323832093 JMSINZGMROQXFS-SNVBAGLBSA-N 339.394 1.342 10 10 EDCE C[C@@H](O)c1ccc(N2CC(O)(CN(C)C)C2)cc1Br 2343627701 BPJMMZGXUJZHMU-SNVBAGLBSA-N 329.238 1.615 10 10 EDCE CO[C@H](Cc1ccc(O)c(O)c1)[C@@H](NC(=O)OC(C)(C)C)C(=O)O 1952305734 CQBRYLWQKJHLLI-CHWSQXEVSA-N 341.360 1.633 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CN(C)CCO1 105283030 XXJFMAOUWAWNGG-QGZVFWFLSA-N 334.464 1.615 10 10 EDCE CCNC(=O)CCN(CC(=O)OC)Cc1cc(Cl)ccc1O 111238352 HANFFXMHLAZFEY-UHFFFAOYSA-N 328.796 1.547 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H]2CNC(=O)C2)cc1 126963900 OLORJVZIMCUVRD-WBVHZDCISA-N 344.459 1.953 10 10 EDCE COc1ccc(Br)cc1[C@H](NCCN=[N+]=[N-])C(N)=O 90257738 BBKLCKGFUMQXJC-JTQLQIEISA-N 328.170 1.884 10 10 EDCE C[C@H](N[C@H]1CC(=O)N(C2CC2)C1)c1ccc(N2CCOCC2)cc1 90180727 GEIKAQUMRGXSJV-HOCLYGCPSA-N 329.444 1.937 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CO[C@H](CN)C2)c(O)c1Br 2381141767 DSSVIZKFWJHYFD-MNOVXSKESA-N 343.221 1.443 10 10 EDCE C[C@@H]1CCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)[C@@H]1CO 588553440 OUILPAKJLPNHIP-JNVBQHHASA-N 330.428 1.766 10 10 EDCE CCC[C@H](C(=O)OCC)S(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1 821199123 UGZZCMIBKBDBML-GFCCVEGCSA-N 346.361 1.774 10 10 EDCE C[C@@H]1CCNC[C@@H]1NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588528682 ZBAINZNGSGOFLY-DYKRAQSHSA-N 329.444 1.651 10 10 EDCE Nc1ccc(CCNC(=O)N2CCN(CC(F)(F)F)C(=O)C2)cc1 841958029 WCFUTPHVHDLTLQ-UHFFFAOYSA-N 344.337 1.227 10 10 EDCE COc1cc(Br)cc(CNCC[C@]2(O)CCOC2)c1O 846050729 XWOLJBNIDUGUBQ-AWEZNQCLSA-N 346.221 1.794 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@@]1(O)CCOC1 845447222 BCGJJMFPCCRING-GOSISDBHSA-N 335.448 1.826 10 10 EDCE COC[C@@]1(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCOC1 855225682 PRXJHJYEEQDVJH-KSSFIOAISA-N 334.416 1.443 10 10 EDCE OC1CCN(c2ccc(CNC[C@H](O)c3cccnc3)cc2)CC1 853122909 VTRLUGXXXBNFLC-IBGZPJMESA-N 327.428 1.866 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1nn(C)cc1C 850345270 QTDXGGZAKJCWOV-UHFFFAOYSA-N 343.431 1.782 10 10 EDCE CN1CCN(c2ccc(CNCC[C@@H]3CC(=O)N(C)C3)cc2)CC1 922486100 GOHDAQTZSYOLEG-QGZVFWFLSA-N 330.476 1.396 10 10 EDCE CCN1C[C@@H](NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 852369238 TVBORRIOWZVQGA-KBPBESRZSA-N 346.431 1.194 10 10 EDCE CCO[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1 864984673 ZGRKGGUAMDFDAE-AEFFLSMTSA-N 348.443 1.581 10 10 EDCE O=C1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CCN1 769326696 MGHHOHUFKAJRPU-UHFFFAOYSA-N 332.404 1.907 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@]34CCCN(CC3)C4)C2)cc1 898581584 YUPZJWXYEPIGEW-BEFAXECRSA-N 329.444 1.876 10 10 EDCE COc1ccc(CNC(=O)NCCc2c(C)nn(C)c2C)c(O)c1 792800832 HOVSTWRXQNNHCT-UHFFFAOYSA-N 332.404 1.793 10 10 EDCE C[C@@H](O)CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)C1CC1 691390821 JMAWMNMQRHRCKW-UHLUBPPHSA-N 340.221 1.751 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCOC(F)(F)C(F)(F)F 1177052440 SQCGFDVHOCDYPA-UHFFFAOYSA-N 329.221 1.928 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC=C(C)C)C2)cc1 1327991924 LCFLQIQPUNVEGD-CQSZACIVSA-N 331.416 1.473 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@](C)(C2CC2)C1 1329630491 GHFCBXHQKZMEMA-SFHVURJKSA-N 332.400 1.378 10 10 EDCE CC[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@H]1CCOC1 1269517396 XDBMOKJLNVUOSU-OCCSQVGLSA-N 347.419 1.984 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)CS(C)(=O)=O)cc1C 1505572479 ZJWXDTCFGQEBMB-STQMWFEESA-N 342.461 1.031 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccnc(CO)c1 1540458163 BBSMBXRGPIMHAA-UHFFFAOYSA-N 341.411 1.683 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CC1([S@](C)=O)CC1 1707861603 OTLFBBRZLSHDHW-QHCPKHFHSA-N 334.445 1.840 10 10 EDCE CC[C@@H](CNC(=O)Cc1cc[nH]n1)NCc1ccc(OC)c(C)c1 1714068393 WXODUOFHTVZXCV-HNNXBMFYSA-N 330.432 1.954 10 10 EDCE COc1cncc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)c1 1557783471 XGUVIPPRWWDTFB-UHFFFAOYSA-N 343.383 1.393 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC(=O)N[C@H]3CCCC[C@@H]32)cc1 1622868997 LVIBZBOZDVIRIJ-STQMWFEESA-N 329.360 1.732 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccoc1C1(O)CCOCC1 1557084725 MBJCNUYXIJVVJQ-UHFFFAOYSA-N 333.340 1.619 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCn1cnnn1 1631166133 AZMXYBYGMPDPHW-UHFFFAOYSA-N 338.371 1.323 10 10 EDCE CCCC(=O)NC[C@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1739044120 DOIZKBWOSVQQMX-ZDUSSCGKSA-N 349.391 1.198 10 10 EDCE O=C1C[C@H](c2ccc(NC(=O)c3cc(O)cs3)cc2)NC(=O)N1 1646396593 RROOJUWENYBQQU-LLVKDONJSA-N 331.353 1.977 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C2(C(F)F)CC2)cc1C 1732640590 MBPCKTDXEZTAGH-CYBMUJFWSA-N 342.386 1.616 10 10 EDCE CO[C@H]1CN(c2ccc(CN)c(Br)c2F)C[C@H]1OC 231840976 FNCDJDYZNOBAHU-PHIMTYICSA-N 333.201 1.897 10 10 EDCE CC[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@H](C)OC 1582482867 OTODUISASOJEBA-JQWIXIFHSA-N 349.391 1.509 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCn2c(nnc2C2CCCC2)C1 1596138447 SHUTXNULJXMBBH-UHFFFAOYSA-N 342.399 1.932 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2ccc(O)nc2)cc1C 1691585607 YSINMPYWQUKQRH-UHFFFAOYSA-N 329.400 1.966 10 10 EDCE CC(C)(C)OC(=O)NC1(CNC(=O)c2ccc(O)c(O)c2)COC1 2006285349 UPDABGDKBJMVDH-UHFFFAOYSA-N 338.360 1.121 10 10 EDCE COC[C@@]1(C(=O)NCCN=[N+]=[N-])CCCN1C(=O)OC(C)(C)C 1985094988 XFXFMKFFEKWOQN-CQSZACIVSA-N 327.385 1.829 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC[C@@]12C[C@@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 2004881389 MCHAGWWWFNTFCE-MKEXSJQTSA-N 336.432 1.945 10 10 EDCE CN(CCOc1ccc(N)cc1)C[C@H](O)CNC(=O)OC(C)(C)C 1999432588 RLCSAICUYPYDIM-CQSZACIVSA-N 339.436 1.465 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010404471 ASRRBFSFZHFMDH-GFCCVEGCSA-N 340.428 1.744 10 10 EDCE CC1(NC(=O)OC(C)(C)C)CN(C(=O)c2cc(O)c(O)c(O)c2)C1 2015125908 PJLIDVFCIBYWHI-UHFFFAOYSA-N 338.360 1.543 10 10 EDCE COCCN1CCN(c2cc(Br)c(CN)cc2F)CC1 2154731964 WGHOSVIKOVAEGZ-UHFFFAOYSA-N 346.244 1.815 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@](O)(CO)C2)cc1Br 313753626 RFUCJYAZSVAVBP-QMTHXVAHSA-N 329.238 1.663 10 10 EDCE CC(C)(C)N(CCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 689973249 YALNGBLSADAKKL-LBPRGKRZSA-N 342.237 1.998 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H]3CCC4(CCC4)CO3)c2n1 2064457753 IHUJPGPLZCTSFT-GFCCVEGCSA-N 330.388 1.822 10 10 EDCE OCc1ccc(N2C[C@H](O)C3(CCOCC3)C2)cc1Br 2174374355 QFLXHTNWYXVMMP-AWEZNQCLSA-N 342.233 1.919 10 10 EDCE C[C@@H]1C[C@@H]2CN(c3ccc(CO)c(Br)c3)CCN2C1=O 2181182203 KYPJXLZGPJTVKR-ZWNOBZJWSA-N 339.233 1.998 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)c(Br)c1 2189046067 ZMZUDKQGPMEGAS-APAOZMKASA-N 342.233 1.946 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)cc1Br 2189046085 ZQQYWFFCVSRUEO-ZVXAKGHKSA-N 342.233 1.946 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)C[C@@H](O)C2)cc1Br 2105074460 PZUQMMLRWHDLEL-JLLWLGSASA-N 329.238 1.661 10 10 EDCE COc1ccc(N2CCC[C@@H]2[C@H](O)CO)c(OC)c1Br 2234900145 RTHHNWAMRWUQKV-MWLCHTKSSA-N 346.221 1.788 10 10 EDCE CCN(CC)CCNC=C1C(=O)NC(=O)N(c2cccc(C)c2)C1=O 2297056698 QWWQEJOKHAXTLW-UHFFFAOYSA-N 344.415 1.393 10 10 EDCE CC1(CNC(=O)C=Cc2ccc(N3CCOCC3)cc2)OCCCO1 2311801015 WAHWXNPOAUJIFY-UHFFFAOYSA-N 346.427 1.806 10 10 EDCE C[C@H]1CN(C2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)CCO1 66561415 ZMKUYUSAXVFLCM-ZDUSSCGKSA-N 335.404 1.986 10 10 EDCE CC[C@H](O)CN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 123528725 OMRPRWKGHPLNCL-IBGZPJMESA-N 333.476 1.412 10 10 EDCE CCOc1ccnc(N2CCN(Cc3ccc(OC)cc3O)CC2)n1 121519935 OQTDNWNFWRQSSQ-UHFFFAOYSA-N 344.415 1.912 10 10 EDCE O=C(O)/C=C\c1ccc(N2CCCNC(=O)C2)c(Br)c1 312195215 LAAJWCOWOINGGX-HYXAFXHYSA-N 339.189 1.873 10 10 EDCE CC(=O)[C@H](C[C@H](N)Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952894731 ZBDLOSSHFLQUCF-OLZOCXBDSA-N 338.404 1.840 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2O)CCO1 529641951 KWAMSUYKUDEOCZ-LLVKDONJSA-N 348.230 1.829 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1cn(C[C@@H]2CCOC2)nn1 529510427 BLMFBUYOVYHPPS-JTQLQIEISA-N 336.779 1.604 10 10 EDCE C[C@H]1C[C@H](C)CN(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)C1 386926402 NGPJGUCCDHWMRF-UWVGGRQHSA-N 328.390 1.725 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCn3cncc3C2)c([N+](=O)[O-])c1 290607751 FKJQIQYCVFMTEL-HWKANZROSA-N 328.328 1.998 10 10 EDCE Cc1cccc(CN2CCc3sc(S(N)(=O)=O)cc3C2)c1O 827775331 DTTSKUUGXJBEOZ-UHFFFAOYSA-N 338.454 1.968 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN[C@@H]2CC[C@H](C)S(=O)(=O)C2)c1O 827164361 GNEDFNRCZPXLGG-GXSJLCMTSA-N 344.389 1.364 10 10 EDCE CS(C)(=O)=NS(=O)(=O)CCN[C@H]1CCc2cccc(O)c21 903225968 KKLLCUGZPJXPRZ-NSHDSACASA-N 332.447 1.027 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C/c1cnn(-c2ccccc2)n1 732579648 JYIFOPLGDBZVMR-GXDHUFHOSA-N 341.396 1.570 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)/C=C\Cn1cncn1 911303255 HJNKQQXADKSWCL-YVMONPNESA-N 344.371 1.132 10 10 EDCE Cc1cc(O)c(CN2CCC3(CC2)NC(=O)N(C)C3=O)c(Cl)c1 840948805 KSBJQNRHLHIGGE-UHFFFAOYSA-N 337.807 1.870 10 10 EDCE CCN(OC)C(=O)CNCc1cc(Br)cc(OC)c1O 842768017 GPLIFESSHSLUIV-UHFFFAOYSA-N 347.209 1.663 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@H]3CCNC[C@H]3C)CC2)cc1 841779187 NBFSPGRVMFNPOU-KDOFPFPSSA-N 346.475 1.961 10 10 EDCE C[C@@H]1C[C@]2(CC[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3)O2)CO1 924272141 LEDFIQONEUGFDN-AGFZQEENSA-N 333.384 1.954 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)CCn3cccn3)C2)cc1 852453964 MTLJWRHDLRUGMI-HNNXBMFYSA-N 343.431 1.812 10 10 EDCE CCN(CC)c1ccc(CNC(=O)CS(=O)(=O)N(C)C)cc1F 752151398 WWVOUPIZNLDFHR-UHFFFAOYSA-N 345.440 1.180 10 10 EDCE C[C@]1(Br)C[C@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 860116270 MWMNERAEOIMFNZ-SDBXPKJASA-N 329.146 1.997 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccnc(N3CCOCC3)n2)c1 862753515 FDZLGCRCWDSITH-UHFFFAOYSA-N 328.372 1.257 10 10 EDCE C[C@H](NC[C@]12COCCN1C(=O)COC2)c1ccc(N(C)C)cc1 866555837 OONJFDGOMPXYKB-KBXCAEBGSA-N 333.432 1.031 10 10 EDCE CC[C@@H]1NCC[C@H]1NC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 861647995 OVYRKBKEQXVEDL-FHLIZLRMSA-N 346.475 1.961 10 10 EDCE CCN(CC)c1ccc(CN2CCC[C@H]2CS(N)(=O)=O)cc1 769429356 YOMSLDOLNRVHJU-INIZCTEOSA-N 325.478 1.786 10 10 EDCE CC(C)N1C(=O)CN(Cc2cc3c(cc2O)OC[C@H]3O)CC1(C)C 768465764 KRZMUXTUPRDAGA-OAHLLOKOSA-N 334.416 1.649 10 10 EDCE O=C1C[C@@H](C(=O)N2Cc3cccc(O)c3C2)CN1CC(F)(F)F 871198259 FBQLCNYLQSPTCV-SNVBAGLBSA-N 328.290 1.645 10 10 EDCE C[C@@H](NC(=O)N1CCS(=O)(=O)[C@H](C)C1)c1ccc(N(C)C)cc1 773619083 QUDYLPOEGYTYJU-CHWSQXEVSA-N 339.461 1.642 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnn4c3NCCC4)C2)cc1 1123924570 MPFGONXNBKKQPR-ZDUSSCGKSA-N 341.415 1.716 10 10 EDCE Cc1ccc(C(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)o1 1522503199 IEAJKWKFEFGJIA-UHFFFAOYSA-N 343.343 1.910 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccnc2c1nnn2C 1467840272 NFMJHKRQMMBBRQ-UHFFFAOYSA-N 332.360 1.485 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2oncc2C)cc1C 1700826490 VXADRMMIKCBOPA-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE CCc1cc(C(=O)NC[C@H](O)CNCc2ccc(OC)c(C)c2)no1 1716107681 PNQGFRSYJOAIHA-CQSZACIVSA-N 347.415 1.435 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H]2CC23CCC3)cc1C 1482772156 DATCIBSCRXHFPE-CVEARBPZSA-N 332.444 1.761 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@]2(C)C=CCC2)cc1C 1497031370 BVJHSVKQFDLQHX-APWZRJJASA-N 332.444 1.927 10 10 EDCE COC[C@H](C)NC[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1567155454 PXTOXIMLFQXZIV-STQMWFEESA-N 347.419 1.936 10 10 EDCE CC(C)(C)OC(=O)[C@H]1COCCN1C(=O)Cc1ccc(O)c(O)c1 1632839971 PGTAYVBADDTVBF-GFCCVEGCSA-N 337.372 1.209 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)/C=C/c2ccc[nH]2)cc1C 1725531829 ZXOWENRHCZLQLT-DBWMJRBXSA-N 343.427 1.612 10 10 EDCE O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NCc1ccc(O)cc1O 1643101069 URLOHHLGHMCCSZ-OKILXGFUSA-N 346.383 1.279 10 10 EDCE O=C(O)[C@]1(O)CCN(Cc2cc(Br)cc(F)c2O)C1 1968189084 DNJIENKHYXACPS-LBPRGKRZSA-N 334.141 1.315 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2CCNC(=O)C2)c1O 1969108946 AXZAHAMRTPAJQV-VIFPVBQESA-N 343.221 1.779 10 10 EDCE C[C@@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)N1CC(NC(=O)OC(C)(C)C)C1 2014687021 UBIIKVIWFSDURT-WDEREUQCSA-N 338.412 1.495 10 10 EDCE CNCc1ccc(N2CC3(C2)OCCC[C@@H]3O)cc1Br 2159648821 VNJFVOBEJSDXGB-AWEZNQCLSA-N 341.249 1.899 10 10 EDCE CNCc1ccc(N(C)C[C@@H]2CN(C)CCO2)cc1Br 707884658 BBFDRKHMCHJEDR-AWEZNQCLSA-N 342.281 1.935 10 10 EDCE CC[C@@]1(NCc2c(O)cccc2Br)CCC(=O)NC1=O 2182526946 VNSDNGONBLTNKI-CQSZACIVSA-N 341.205 1.830 10 10 EDCE CNCc1ccc(N2CC(CS(C)(=O)=O)C2)c(Br)c1 2103210196 SXWSTGYBNASWIA-UHFFFAOYSA-N 347.278 1.649 10 10 EDCE CS(=O)(=O)[C@@H]1COC[C@@H]1Nc1c(N)cccc1Br 2086312732 NARRILZEDFIQSP-VHSXEESVSA-N 335.223 1.255 10 10 EDCE OCc1ccc(N2CCOCCC23COC3)c(Br)c1 2109849757 FXEMGGLKPJPADA-UHFFFAOYSA-N 328.206 1.937 10 10 EDCE NCc1cc(F)c(N2CCOC[C@H](CO)C2)cc1Br 2098217496 IDQDZQDWUGZQBU-VIFPVBQESA-N 333.201 1.492 10 10 EDCE CC(=O)C(=O)[C@]1(O)CCC[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]21 2210375909 ZLDMGJVTSOZSHL-DCGLDWPTSA-N 325.405 1.933 10 10 EDCE COc1ccc(N2CC[C@H](O)C[C@H]2CO)c(OC)c1Br 2234903268 PZDPCHMTPZWQSO-UWVGGRQHSA-N 346.221 1.788 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C(=O)NCCN=[N+]=[N-])O[C@@H]2C1 2251289920 KNBUNTIRBZMYNT-QJPTWQEYSA-N 339.396 1.827 10 10 EDCE CSc1ncc(CNS(=O)(=O)C2CCC(CO)CC2)s1 2284541758 OODQBAPLWQKTFD-UHFFFAOYSA-N 336.504 1.836 10 10 EDCE O=S1(=O)C[C@H]2CN(Cc3c(O)cccc3Br)C[C@H]21 2314963380 MWBMKLMWRTYMGA-PRHODGIISA-N 332.219 1.384 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)c(Br)c1 2355334493 OWCRJFDWJUDZFB-KJEVXHAQSA-N 341.249 1.489 10 10 EDCE O=C1NC(=S)NC(=O)C1=Cc1ccc(F)c(Br)c1 59465601 WAUJNKJHSWBGSD-UHFFFAOYSA-N 329.150 1.503 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]3N)CC2)cc1 172021436 OTGAQSDCESFFCE-ZZCKCESHSA-N 329.444 1.717 10 10 EDCE CC[C@@H](C(=O)OC)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 276751944 HTMIUYOBHARKMS-CYBMUJFWSA-N 338.379 1.682 10 10 EDCE Cc1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cnn1 276495178 INLSHVUYMBFTOL-UHFFFAOYSA-N 340.427 1.924 10 10 EDCE O=S(=O)(C1CC1)N1CCCN(Cc2cc(F)ccc2O)CC1 376690506 QCSZEJZCHJZJAI-UHFFFAOYSA-N 328.409 1.531 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCOC[C@@H]2CC(F)F)cc1 298632057 VYTCFXHDBVJMEJ-HNNXBMFYSA-N 341.402 1.725 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3cc(F)c[nH]3)CC2)cc1 292752886 BHTAHWFZBXKRMP-UHFFFAOYSA-N 346.406 1.714 10 10 EDCE CNC(=O)c1ccc(NCc2cc(Br)ccc2O)nn1 804828749 YQBRYAUOSAYPLB-UHFFFAOYSA-N 337.177 1.916 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3cccc(Cl)c3O)C[C@@H]12 827389252 MMESXJVBDSLIER-UHTWSYAYSA-N 331.821 1.289 10 10 EDCE COC[C@@](C)(CCO)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588396619 TVTVWWHSSPUORS-NVAPOSRTSA-N 348.443 1.440 10 10 EDCE COC(=O)CCCc1nc(CN2CCCc3cc(CN)ccc32)no1 843349749 ABPLONOHTYZKFV-UHFFFAOYSA-N 344.415 1.977 10 10 EDCE Cc1nn(CN(C)Cc2ccc(N3CCCCC3)cc2)c(=O)n1C 844680465 JMQPMWGEZQUEMY-UHFFFAOYSA-N 329.448 1.970 10 10 EDCE COc1ccc(N2CC[C@H](CN3C(=O)N[C@H](CSC)C3=O)C2)cc1 924951085 QSWZBFSTAWWHAJ-SWLSCSKDSA-N 349.456 1.805 10 10 EDCE COc1cc([C@]2(O)CCN(C(=O)OC(C)(C)C)C2)cc(O)c1O 687745000 OVYAJCDDZURHMG-INIZCTEOSA-N 325.361 1.935 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)C3(CO)CC3)C2)cc1 923183340 KSBVHLOXIFLBGE-KGLIPLIRSA-N 333.432 1.734 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3CCC4(CNC4)O3)CC2)cc1F 852746647 NSEVTWGNSQBVGU-HNNXBMFYSA-N 335.423 1.477 10 10 EDCE CN(OCC(F)(F)F)C(=O)CNC(=O)/C=C\c1ccc(O)c(O)c1 857745528 SQICFAKIWUDSIO-HYXAFXHYSA-N 348.277 1.180 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)c3cccn3C)C2)cc1 855224848 HNUWUJQYNZHQAD-ZDUSSCGKSA-N 327.384 1.612 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)[C@H]2C[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1 858815034 IZFDZKKGVITXTE-FVSXHXCTSA-N 333.344 1.481 10 10 EDCE COc1ccc(N2CCN(CC(=O)Nc3cccnn3)CC2)cc1F 929823122 RYVBAEAKRLHYAQ-UHFFFAOYSA-N 345.378 1.385 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)CS(C)(=O)=O)C2)cc1 855232649 WEUWPMRPYIHANS-QWHCGFSZSA-N 340.445 1.071 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)N1CCOC[C@H]1C1CC1 759588075 HMUHSCNMPTXDBE-OLVMAOTFSA-N 347.367 1.292 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](CC(C)C)C(N)=O)C2)cc1 855224508 LFTMJVZRQBIFLJ-BBRMVZONSA-N 333.432 1.538 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cccc4nn[nH]c34)C2)cc1 855228272 YNPNDOKBFPOJKT-LBPRGKRZSA-N 337.383 1.975 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCC(=O)N(C)C3)C2)cc1 852134346 YAWJDYPWODZFMZ-ZIAGYGMSSA-N 346.431 1.194 10 10 EDCE Nc1ccc(Cc2nc(C(=O)N3CCOC4(CNC4)C3)cs2)cc1 853245302 JKVAHSVIQLFEDL-UHFFFAOYSA-N 344.440 1.131 10 10 EDCE CN(CCN1CCCS1(=O)=O)Cc1cc2c(cc1O)CCCC2 768465286 FPKYFSFZRXIQNE-UHFFFAOYSA-N 338.473 1.738 10 10 EDCE CC(C)C(=O)NCCN(C)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 767318053 OTBHWWIHDNKRNB-UHFFFAOYSA-N 336.348 1.134 10 10 EDCE C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)CC(F)F 1118206922 CPXCCXOOZRPBOZ-NSHDSACASA-N 327.375 1.776 10 10 EDCE COC(=O)c1c(CNCCc2n[nH]c(C)n2)c2cc(F)ccc2n1C 894430017 VHUVGVMRAQAFAY-UHFFFAOYSA-N 345.378 1.863 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cnn(CCN(C)C)c1 797631969 QXVUALZWWFPOBI-LBPRGKRZSA-N 347.419 1.609 10 10 EDCE COC(=O)[C@@]12CCOC[C@@H]1CN(C(=O)/C=C\c1ccc(O)c(O)c1)C2 794242892 KIJMPFXPKDMGHR-DTRLITFPSA-N 347.367 1.149 10 10 EDCE CCn1c(O)nnc1C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1143341864 ZFUVKIJGUILLMY-UHFFFAOYSA-N 346.387 1.364 10 10 EDCE C[C@@]1(C(=O)NCc2ccc(O)cc2O)Cc2ccccc2C(=O)O1 1142531347 ZBIAWPBWJFIZQG-SFHVURJKSA-N 327.336 1.886 10 10 EDCE Cn1ncc(C(=O)NCc2cc(O)ccc2O)c1Br 1153885002 IVRLIXTZVHYSMY-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cc2c(cc1[N+](=O)[O-])OCO2 1303193498 NEGWKCPAVIEOCJ-UHFFFAOYSA-N 332.268 1.665 10 10 EDCE Cn1cc(C(=O)NCc2cc(N)ccc2O)c(Br)n1 2116551562 JQHHQMRBZKZQBG-UHFFFAOYSA-N 325.166 1.400 10 10 EDCE CC(C)[C@H]1CNC(=O)CN1c1ccc(CN)c(Br)c1 2124750927 UUJYQHFDDHYQKH-CYBMUJFWSA-N 326.238 1.869 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3OC(=O)N[C@@H]3C2)cc1Br 2120402308 GHUOBSUOHQBVJB-HFKOZYHYSA-N 326.194 1.766 10 10 EDCE COC(=O)[C@]1(C)CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1329436327 MXUZIICXCRZKOJ-GOSISDBHSA-N 346.383 1.036 10 10 EDCE CC(C)O[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332052882 GQDAIRRMLCOQKA-AWEZNQCLSA-N 332.400 1.650 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2cnccn2)cc1C 1267451208 ALRFAGKLRHTWOE-UHFFFAOYSA-N 342.443 1.974 10 10 EDCE COC[C@@H](CCNCc1ccc(N2CCN(C)CC2)c(F)c1)OC 1346843498 YPRRZUVNZMYESJ-MRXNPFEDSA-N 339.455 1.719 10 10 EDCE O=C1N[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)CCO1 1450709877 HVUQYXIUJCLHPT-LBPRGKRZSA-N 337.339 1.833 10 10 EDCE C[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCN1c1cnccn1 1607977489 ASTMUUFCHRLOML-MASHWEEQSA-N 340.383 1.638 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cc(C)[nH]n2)cc1C 1700933054 ROCNPUDWFZOWSA-HNNXBMFYSA-N 346.431 1.258 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2cccs2)cc1C 1485969661 FVZWJFJCRUXZCA-AWEZNQCLSA-N 334.441 1.946 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@H]2CCCCO2)cc1C 1717763741 CMJRQWOVAGHISW-NVXWUHKLSA-N 336.432 1.139 10 10 EDCE CC(=O)N/C(=C\C1=S=CC=C1)C(=O)Nc1ccnc2cc(C)nn12 1633943306 RVVCOGFRVOHYSS-LCYFTJDESA-N 341.396 1.274 10 10 EDCE CNC(=O)CCCC(=O)N1CC[C@@H](NCc2ccc(OC)c(C)c2)C1 1567092965 KOKBXHZFGOISHS-MRXNPFEDSA-N 347.459 1.610 10 10 EDCE CCC(CC)[C@H](C(=O)NCc1c(O)cccc1O)N1CCOCC1 1635847902 WDWJOMIWGPZJAX-QGZVFWFLSA-N 336.432 1.851 10 10 EDCE COC(=O)c1ccc2c(c1)CCN2C(=O)c1ccnc2c1CC(=O)N2 1643259356 VJECDQLDHFQBHA-UHFFFAOYSA-N 337.335 1.566 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@H]3CCN(C)[C@H]3C2)c([N+](=O)[O-])c1 1651869672 VAQJVHLCVIQLNB-JZTMSUKMSA-N 331.372 1.921 10 10 EDCE C[C@@H](N[C@H]1CCC(=O)N(C)C1)c1ccc(N2CCOCC2)c(F)c1 152491990 XRSLZWLELCGJON-HIFRSBDPSA-N 335.423 1.934 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@H](c1ccccc1)n1cnnn1 1860164152 NSDNBRRLGFSARI-INIZCTEOSA-N 339.355 1.033 10 10 EDCE Nc1ccc(-n2nnc(C(=O)NCCc3c[nH]c4ccccc34)n2)cc1 1857878902 NLADZEYHKLTBGE-UHFFFAOYSA-N 347.382 1.698 10 10 EDCE NC(=O)CN(Cc1ccccc1)c1cc2c(cc1Cl)[C@@H](O)C(=O)N2 1946829965 CSWRJKAZHPMTEA-MRXNPFEDSA-N 345.786 1.817 10 10 EDCE Nc1cc(O)ccc1NS(=O)(=O)c1cncc(Br)c1 236349347 MIICSRNFYTWGNM-UHFFFAOYSA-N 344.190 1.933 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)c(Br)c1 2146313411 JTBBXLIYQYTPDU-ONERCXAPSA-N 342.233 1.684 10 10 EDCE CC(C)(C)OC(=O)NC1CC(NC(=O)COc2ccc(N)cc2)C1 1999128388 MTJGOILWMAIUCE-UHFFFAOYSA-N 335.404 1.820 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]1NC(=O)c1cc(O)c(O)c(O)c1 2015124138 ZKECBXRXKGPCAP-ZJUUUORDSA-N 338.360 1.446 10 10 EDCE N[C@@H](COCc1ccccc1)CC(=O)NCCc1ccc(O)c(O)c1 2035467775 GYUNZKBRKBJUPK-MRXNPFEDSA-N 344.411 1.691 10 10 EDCE COC(=O)[C@H]1C[C@@H](OC)CN1C(=O)C=Cc1ccc(N(C)C)cc1 2053622076 KROJOKOTJBECFK-HZPDHXFCSA-N 332.400 1.555 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)cc1Br 2178085380 FDQQPSRGDVHHJF-BFVZDQMLSA-N 345.212 1.490 10 10 EDCE O=C1NC[C@H]2CN(Cc3c(O)cccc3Br)CC[C@@H]12 2100942979 HADHYJNLIAMEOE-VHSXEESVSA-N 325.206 1.723 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210528879 JVMBQVFZSHHVAD-GMTAPVOTSA-N 327.385 1.467 10 10 EDCE CN(CCN1CCCC1=O)c1ccc(CN)cc1Br 2114621459 FSWCOGWALRVRBB-UHFFFAOYSA-N 326.238 1.966 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H]4C[C@@]4(CO)C3)c(Br)cc21 2200840880 LFZDFPLYDGVCNQ-PYSYBHHASA-N 338.205 1.220 10 10 EDCE COc1ccc(N2CCN(C)[C@H](CO)C2)c(OC)c1Br 2234901676 INWRMWOSEWMIBV-JTQLQIEISA-N 345.237 1.579 10 10 EDCE COc1ccc(N(C)[C@H]2COC[C@@H]2O)c(OC)c1Br 2226539046 RMRVUULRYOBLAA-UWVGGRQHSA-N 332.194 1.662 10 10 EDCE CC(=O)NN1C(=O)C(=Cc2cccc3nccnc23)SC1=S 2296589918 ZJJDRRYVOZYLHR-UHFFFAOYSA-N 330.394 1.882 10 10 EDCE COC(=O)C=Cc1ccc(N(CCO)CC(F)F)c([N+](=O)[O-])c1 2312466515 DYLOQRYEKDLICM-UHFFFAOYSA-N 330.287 1.845 10 10 EDCE CN(C)C(=O)c1ccc2c(c1NCCO)C(=O)c1ccccc1C2=O 4193987 OXYZXNFBUCKMKT-UHFFFAOYSA-N 338.363 1.568 10 10 EDCE CN(CC(=O)NCc1ccc(N(C)C)cc1)CC(=O)NC(C)(C)C 7243940 UVNXVMWPCZJDIN-UHFFFAOYSA-N 334.464 1.215 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCS(=O)(=O)[C@H](C)C2)c1O 177207205 SKDSAFHFGYUQDR-SECBINFHSA-N 331.821 1.867 10 10 EDCE C[C@@H](O)CN(CCNCc1ccc(O)c(O)c1)C(=O)OC(C)(C)C 305881229 BATBBIPCKYEGSL-GFCCVEGCSA-N 340.420 1.805 10 10 EDCE NS(=O)(=O)c1ccc(NC(=O)Nc2cc(O)c(O)c(O)c2)cc1 217278682 ZONXTJIFOPWMQX-UHFFFAOYSA-N 339.329 1.095 10 10 EDCE O=C(N1CCNCC1)N1CCN(Cc2cc(Cl)ccc2O)CC1 530244012 UTKRIAACMMKXHH-UHFFFAOYSA-N 338.839 1.188 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CSC(=O)N1 265827899 PLIWKZIHXAGIBR-AWEZNQCLSA-N 335.429 1.307 10 10 EDCE COC[C@]1(CO)C=CCN1c1ccc(CN)c(Br)c1F 2379850655 YOMHCYLNHMNFFJ-CQSZACIVSA-N 345.212 1.801 10 10 EDCE C[S@@](=O)CCNC(=O)NCc1cc(Br)ccc1O 805127176 ORDAPPGDXFVUSV-GOSISDBHSA-N 335.223 1.332 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CC(=O)N(C)C2)c(O)c1Br 2380741466 HPFAZDGMVXOZRY-SNVBAGLBSA-N 341.205 1.558 10 10 EDCE CCN(CC)[C@H](C)CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807674807 RBNXIEKWWXLSBF-HUUCEWRRSA-N 348.491 1.776 10 10 EDCE Cn1c(C(=O)NCc2cc(Br)ccc2O)cccc1=O 804735934 LSQKLDZOVWXTPG-UHFFFAOYSA-N 337.173 1.783 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@@H]2C(N)=O)c(Br)c1 723202873 XQYSNJRQMMFUDY-QPUJVOFHSA-N 328.210 1.159 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1c2n(c(=O)n1C)CCCC2 825874275 XVUXCWIGLRJVMK-UHFFFAOYSA-N 342.443 1.828 10 10 EDCE O=S1(=O)CCN(Cc2cc3c(cc2O)OCO3)[C@H]2CCC[C@@H]21 825200351 DEUCZCRSHDLZNW-NHYWBVRUSA-N 325.386 1.272 10 10 EDCE CCN(C(=O)C1=CC=CN2CCS(=O)(=O)N=C12)c1ccc(C)cc1 914474551 BZLYGZIHLMHRPK-UHFFFAOYSA-N 345.424 1.846 10 10 EDCE COc1ccc(N2CCCN(C(=O)C[C@H](C)NC(N)=O)CC2)cc1 847366719 WWEZVINUFULMLX-ZDUSSCGKSA-N 334.420 1.181 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1C[C@@H]1CN(C2CC2)C(=O)O1 846793182 XSURBUGHNHBLID-ZDUSSCGKSA-N 345.355 1.140 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCn2nncc2C1 847386380 XPKNBZCVZRXEBI-CQSZACIVSA-N 342.447 1.809 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@H]2CCCO2)c1 919811839 YKZDROIQNHOENR-LLVKDONJSA-N 328.390 1.063 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)NCCCc2cccc(F)c2)cc1 842018193 YYIJDFDGQWKZPW-UHFFFAOYSA-N 343.402 1.816 10 10 EDCE O=C(N[C@@H]1CCCN2CCSC[C@H]12)N1Cc2cccc(O)c2C1 925173423 XTMCGRFIYJDNDU-HUUCEWRRSA-N 333.457 1.997 10 10 EDCE CCC[C@@H](NC(N)=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855233956 PWPSSBJTPFUPJV-IUODEOHRSA-N 334.420 1.227 10 10 EDCE NC1(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC2(CCC2)C1 851629832 BEXSSVSOOWDZEL-UHFFFAOYSA-N 347.434 1.940 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CNCC(F)(F)F)C2)cc1 851640622 ZTHXVPSIVIHNLG-LLVKDONJSA-N 331.338 1.542 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@](C)(C(N)=O)C3)C2)cc1 852451926 RBUPTVYOXWCHJM-FZKQIMNGSA-N 346.431 1.181 10 10 EDCE CCC1(CC)NC(=O)N(CC(=O)NCc2c(O)cccc2F)C1=O 928709924 NZQHPGDBYJICTM-UHFFFAOYSA-N 337.351 1.258 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCN(C)C(=O)C3)C2)cc1 855232190 PEHAWKCGVZABSM-ZIAGYGMSSA-N 331.416 1.259 10 10 EDCE C[C@H]1C[C@@H](NCc2ccc(N3CCN(C)CC3)cc2)c2ncnn21 850352289 REFCGPFVDUNZBT-WMLDXEAASA-N 326.448 1.826 10 10 EDCE CN1CCCc2cc(CNC(=O)c3ccc4c(c3)COB4O)ccc21 863872062 LIFAXMNTNUBFQN-UHFFFAOYSA-N 336.200 1.217 10 10 EDCE CCOC(=O)c1cnc(NC(=O)NCc2cc(C)ccc2O)n1C 861095196 XXNPLPKKLQIHNI-UHFFFAOYSA-N 332.360 1.933 10 10 EDCE Cc1noc([C@@H]2OCC[C@@H]2NC(=O)/C=C\c2ccc(O)c(O)c2)n1 863753482 VXBNFLSMWVIEPZ-JRKASCDPSA-N 331.328 1.449 10 10 EDCE CO[C@H](CS(=O)(=O)N1Cc2cccc(O)c2C1)[C@H]1CCOC1 867691207 RQLSZBOTQHGTDZ-SWLSCSKDSA-N 327.402 1.089 10 10 EDCE CCOC(=O)[C@H]1CN(C(=O)c2cccc(O)c2O)CCC1(F)F 870918700 LXGBQGVPGSGXKC-SNVBAGLBSA-N 329.299 1.758 10 10 EDCE COC(=O)[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)[C@@H]1C 786813312 LYHFWPMUQVLSTO-BDAKNGLRSA-N 335.316 1.314 10 10 EDCE OCCOCC1(O)CCN(Cc2cc(Cl)c(F)cc2O)CC1 895829208 IOIJIYCOOBGHOM-UHFFFAOYSA-N 333.787 1.521 10 10 EDCE C[S@](=O)C1(CNC(=O)c2cc3cc(O)c(O)cc3s2)CC1 897663209 BFHZGGWTRZLKKR-NRFANRHFSA-N 325.411 1.953 10 10 EDCE CN[C@H](C)c1ccc(N(C)[C@H]2COC[C@H]2O)c(Br)c1 709229247 XIPFXBLPKDBZRI-BIGNPOOSSA-N 329.238 1.925 10 10 EDCE CN1CCO[C@@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@@H]21 894984553 AXCNVSWVOVJQRL-QWHCGFSZSA-N 345.212 1.809 10 10 EDCE C[C@]1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCCCO1 1304240201 BSFSFJDWHWKMMX-OAHLLOKOSA-N 342.417 1.453 10 10 EDCE C[C@@H](CNC[C@@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1322094010 PLTDYHHENQCIRO-RYUDHWBXSA-N 333.392 1.593 10 10 EDCE Cc1csc([C@@H](C)NC(=O)C(=O)N(C)Cc2ccccc2O)n1 1322722027 IPIUOXFQNXHCFD-LLVKDONJSA-N 333.413 1.993 10 10 EDCE CN(C)c1ccc(/C=C/CNCCN2C[C@@H](C(=O)O)CC2=O)cc1 1339240539 KDKZSUQUPDWZKP-BWPKMQGJSA-N 331.416 1.289 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCOc2ccccc2C1 1335547888 HUWATDJWBHTDOU-UHFFFAOYSA-N 338.363 1.656 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)COC3CC3)cc2)CC1 1350449708 PPSUMDDYDGVPMH-UHFFFAOYSA-N 331.416 1.184 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4CC[C@H](C3)O4)c(Br)cc21 221251369 RPAJIEIXWMAJKN-DAROEXNTSA-N 338.205 1.769 10 10 EDCE C[C@@H]1[C@H](CO)CCN1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1471547194 JXANYUUSQFDMBL-HFTRVMKXSA-N 348.491 1.768 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NN2C(=O)c3ccccc3C2=O)cc1 1556114109 RMKUDNHWFAVWGL-UHFFFAOYSA-N 337.295 1.790 10 10 EDCE CCCN(C)C(=O)[C@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1626399042 PTBJZUQPBSTHSQ-GFCCVEGCSA-N 338.429 1.410 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1cnnn1CC 1715732802 VLSGECZBCQFWGB-UHFFFAOYSA-N 345.447 1.867 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@H]2CCC(=O)NC2)cc1C 1731918474 OTKNHTAXRZGMRA-MRXNPFEDSA-N 347.459 1.468 10 10 EDCE CCO[C@H](C)C(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1744688098 KFSVTLSCJNESKA-WDEREUQCSA-N 349.391 1.509 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)NCCOCC(=O)OC 1683222507 CZMKTHBNYNWVMI-UHFFFAOYSA-N 338.404 1.894 10 10 EDCE CCNS(=O)(=O)c1ccc(CNC(=O)Cc2ccc(N)cc2)cc1 163066403 SJVJTAFBWIQUQK-UHFFFAOYSA-N 347.440 1.426 10 10 EDCE COc1ccccc1[C@@H](CNC(=O)Cc1ccc(N)cc1)C(=O)O 1865957046 QXAKXYNPSVOIGT-OAHLLOKOSA-N 328.368 1.805 10 10 EDCE CN(C)C[C@H]1CN(Cc2cccc(Br)c2O)CCO1 128197703 LUVQPFVPXOMTHI-LBPRGKRZSA-N 329.238 1.917 10 10 EDCE COc1ccc(Br)c(CNCCN2CCCC2=O)c1O 1964045005 DOOKWFGBLSISFN-UHFFFAOYSA-N 343.221 1.875 10 10 EDCE CO[C@@](C)(CN)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952207481 UNBJNKGYPSEWBY-PBHICJAKSA-N 340.420 1.897 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C[C@H]1CCCO1)C(=O)NCCN=[N+]=[N-] 1985102791 LXRZOOAXJYRGAI-MNOVXSKESA-N 327.385 1.875 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(CNCc2cccc(O)c2O)C1 1999835374 FKNQFPCNZJPXCF-UHFFFAOYSA-N 338.404 1.606 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](CO)(NCc2ccc(O)cc2O)C1 2016028635 HAFVBIDVJNCOBG-QGZVFWFLSA-N 338.404 1.559 10 10 EDCE Cn1c(Br)nnc1CNCc1cc2c(cc1O)OCO2 2178001320 JMOANLYDTIWBFI-UHFFFAOYSA-N 341.165 1.302 10 10 EDCE COc1ccc(N2CC[C@H](CO)[C@@H](N)C2)c(OC)c1Br 2178906472 KFELKJJGTSOWKW-ZJUUUORDSA-N 345.237 1.612 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](OCC(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 1906905156 UIPLVQVKIWYGJV-JHJVBQTASA-N 340.420 1.278 10 10 EDCE CNC(=O)[C@@H]1[C@H](C)CCN1c1ccc(CN)c(Br)c1 2090258870 LVUMLAOHOPDOBI-RNCFNFMXSA-N 326.238 1.869 10 10 EDCE CN(C[C@@H]1CCS(=O)(=O)C1)c1ccc(CN)c(Br)c1 2092351398 BYOMUOOSOQIFNV-JTQLQIEISA-N 347.278 1.779 10 10 EDCE C[C@@]1(CO)COCCN1c1cc(Br)c(CN)cc1F 2112705632 MAAUIHCOZRDHGV-CYBMUJFWSA-N 333.201 1.635 10 10 EDCE CCN1C(=O)NC(=O)C(=Cc2cn(CC(=O)O)c3ccccc23)C1=O 2297312784 VRZKPYNHYJWCJM-UHFFFAOYSA-N 341.323 1.208 10 10 EDCE COc1ccccc1C=C1C(=O)NC(=O)N(Cc2ccco2)C1=O 2313540631 LQDIWSHQNFEKMB-UHFFFAOYSA-N 326.308 1.950 10 10 EDCE Cc1ccc(CN(C)C[C@@H](O)CC(N)=S)c(O)c1Br 2352661799 GLYBJCSLWDTREM-JTQLQIEISA-N 347.278 1.932 10 10 EDCE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CNC(=O)C1 175841903 FOMKPGIGARNIBI-SECBINFHSA-N 341.205 1.639 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(S(C)(=O)=O)CC2)cc1Cl 78927758 GMVGHILRUFFOAE-LLVKDONJSA-N 331.869 1.702 10 10 EDCE COC[C@H](C[C@H](N)Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952893595 LPLJOOVKSNVHOW-OLZOCXBDSA-N 340.420 1.897 10 10 EDCE CCNC(=O)N1CC[C@H](NCc2ccc([N+](=O)[O-])c(OC)c2O)C1 278104160 AJHSYWCWHVAMIG-NSHDSACASA-N 338.364 1.202 10 10 EDCE CN1C(=O)C[C@@H](C(=O)NCc2ccc(O)c(O)c2)[C@H]1c1cccnc1 272303085 JCHLURTXUQNBHA-CXAGYDPISA-N 341.367 1.329 10 10 EDCE Cc1cc(N2CCC[C@H](NC(=O)NCc3ccccc3O)C2)n(C)n1 277670338 HNVSEINJMRCQTL-HNNXBMFYSA-N 343.431 1.902 10 10 EDCE CC[C@@H]1C(=O)NC(=O)CN1Cc1ccc(C)c(Br)c1O 2381129234 HFPWUZXBDONSTE-SNVBAGLBSA-N 341.205 1.700 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCC[C@@](CO)(OC)C2)c1O 826952782 STQLNXWLALVATO-OAHLLOKOSA-N 326.349 1.282 10 10 EDCE COc1cc(O)c(CN[C@@H]2CC[C@@H](C)S(=O)(=O)C2)cc1OC 827173155 VSBMBZZXNCCZNL-ZYHUDNBSSA-N 329.418 1.465 10 10 EDCE Cc1ccc(CN(CCO)CC(=O)NCc2ccc(N(C)C)cc2)o1 839588792 FEFZGUJHKGVBAQ-UHFFFAOYSA-N 345.443 1.765 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CC[C@@H](CN2CCOCC2)C1 588405793 ROBVHDHJPWZURK-HKLWWIALSA-N 332.400 1.292 10 10 EDCE C[C@@H]1O[C@H](C)CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1C 839387270 JJSGKJXKUVCNPS-KFWWJZLASA-N 347.459 1.735 10 10 EDCE CC(C)NS(=O)(=O)NCCNC/C=C/c1ccc(N(C)C)cc1 835048943 NNVUZPGOAZFAPL-AATRIKPKSA-N 340.493 1.188 10 10 EDCE Cc1cc(C(=O)N2CCC(CO)(CO)C2)c(C)n1-c1ccccn1 912558236 ZCOHBUIOYWDBTN-UHFFFAOYSA-N 329.400 1.306 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)O[C@@H](C)C(=O)O)C2)cc1 849183427 RAVYZWCNXAGAQE-AVGNSLFASA-N 336.388 1.268 10 10 EDCE C[C@H]1C[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)c2ncnn21 849360240 ZWQNGWXOUZEGNV-CMPLNLGQSA-N 327.344 1.454 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3(N(C)C)CC3)C2)cc1 922985804 KZATWHKJPKSGMQ-CQSZACIVSA-N 332.448 1.667 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3ccc(O)nn3)C2)cc1 854098793 UAZLGLROXDGGMW-CYBMUJFWSA-N 343.387 1.269 10 10 EDCE COCCN1CCC[C@H]1CN[C@H](C)c1cc(C(=O)OC)ccc1O 756535646 NVTDMVFJNAEVAY-HIFRSBDPSA-N 336.432 1.940 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H]1CCCOC1 852126497 BOUXLHLETVVOGH-HNNXBMFYSA-N 333.432 1.626 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2nn(C)cc2C)c1 850366392 XMQKJCJORXSIGX-SNVBAGLBSA-N 332.360 1.259 10 10 EDCE C[C@H](NC(=O)NC[C@@H]1CCN(S(C)(=O)=O)C1)c1ccccc1O 868435598 QGOJPKQDAWNHBD-RYUDHWBXSA-N 341.433 1.034 10 10 EDCE Cc1nnc(CN(C)CC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1C 775412594 ZPKHACXCBZUKMX-ZDUSSCGKSA-N 344.463 1.499 10 10 EDCE COC(=O)[C@@H]1C[C@H]2Cc3c(Cl)ccc(OC)c3C(=O)[C-]2C(=O)C1=O 1088680881 ANSNNXMNISCOJB-VXNVDRBHSA-N 349.746 1.609 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2cncn2C)cc1C 1319205224 LMWTXEXLVQDWNQ-CYBMUJFWSA-N 330.432 1.893 10 10 EDCE CCS(=O)(=O)[C@H]1CCN(c2ccc(CO)cc2Br)C1 2123307139 AXRMSRPUYSGRSW-NSHDSACASA-N 348.262 1.955 10 10 EDCE C[C@@H](c1cc(Br)ccc1O)N1CCN2C(=O)NC[C@@H]2C1 211554835 NKJIYOANCUTPPY-GXSJLCMTSA-N 340.221 1.925 10 10 EDCE Cn1cnc(CCCNC(=O)NCc2ccc(N3CC=CC3)cc2)n1 1349094117 ZACDVIUSYNXJHP-UHFFFAOYSA-N 340.431 1.623 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2nn(C)cc2C)cc1C 1265773050 NZZOBCAWOXRNNI-CQSZACIVSA-N 330.432 1.954 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2cnn(C)c2)cc1C 1700742891 UUUCTPOMWNTHDJ-CQSZACIVSA-N 330.432 1.987 10 10 EDCE C[C@H](O)CN[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1480067952 CMYOZTCEONHNCZ-HZMBPMFUSA-N 333.392 1.328 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cnn(C)n2)cc1C 1715884551 TWDXLWYQXCWGTM-PLNGDYQASA-N 329.404 1.208 10 10 EDCE CC(C)(C)c1cc(C(=O)NCc2ccc(O)c(O)c2)nc2ncnn12 1622663982 BOEHMPNDCDBOBB-UHFFFAOYSA-N 341.371 1.763 10 10 EDCE Cc1cc(C(F)(F)F)nn1CC(=O)NCc1cc(O)ccc1O 1633599256 VGIMQEAHCWGDIM-UHFFFAOYSA-N 329.278 1.938 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@@H](OCCN2CCCC2)C1 1566316869 LQRFORNEDIFRET-OAHLLOKOSA-N 334.416 1.354 10 10 EDCE NS(=O)(=O)Cc1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1 1636230447 DGBQOKNIDPONJV-UHFFFAOYSA-N 332.381 1.337 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@@H]2COC(=O)N2)cc1C 1568627117 MOLNPFCBDPGNHA-JSGCOSHPSA-N 335.404 1.096 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)Cc2nnc(C)o2)cc1C 1496052748 ZGQQIGQDOLYLIO-ZDUSSCGKSA-N 346.431 1.874 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2CN(C)CCO2)cc1C 1732834478 XHURGCYHSIMPMU-XDXAGZTOSA-N 347.459 1.096 10 10 EDCE CC(C)[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@H](C)O 1667525099 QDEOGAZLAHRCFV-SMDDNHRTSA-N 335.408 1.574 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCC[C@H](O)C3)c(Br)cc21 252592435 FCMQBIWDWGKJOC-MADCSZMMSA-N 326.194 1.362 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@]4(CO)C3)c(Br)cc2[C@H]1O 2146304871 ALWAGYHDFYHEBU-AAAAQAOESA-N 339.189 1.253 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985103202 RNPVNYZIHFXKRZ-MNOVXSKESA-N 325.369 1.534 10 10 EDCE C[C@]1(NC(=O)C(F)(F)F)CCN(CCOc2ccc(N)cc2)C1 1999436242 FAWWLRDEKOGXAA-AWEZNQCLSA-N 331.338 1.791 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CC(=O)Nc2ccc(N)cc2)C1 2022856092 WRIDBNXGLJUQDP-QGZVFWFLSA-N 335.404 1.969 10 10 EDCE Cc1cccc(CNCC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c1O 2041265350 JRHIQTUKCYGRCN-UHFFFAOYSA-N 349.431 1.513 10 10 EDCE C[C@H](N)c1ccc(N2CCC(O)(C(N)=O)CC2)cc1Br 312785248 NXFXGTHYAKFPHN-VIFPVBQESA-N 342.237 1.285 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)CC[C@H]3O)cc1Br 2161395366 AEIXQBRLTVCSRS-BYNSBNAKSA-N 342.233 1.794 10 10 EDCE OC[C@H]1C[C@H](O)CN1c1ccc(CNC2CC2)cc1Br 698202118 VWTDUTWXLZUEOE-OLZOCXBDSA-N 341.249 1.633 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3[C@H]4CCO[C@H]4C34CCC4)c2n1 2064302019 FPNAUOZZOOBAPV-LERXQTSPSA-N 328.372 1.431 10 10 EDCE O=C1Nc2cc(N3C[C@H](O)C[C@@H](F)C3)c(Br)cc2[C@H]1O 2234680084 VCWCNUUFELRVTG-NQYJQULFSA-N 345.168 1.344 10 10 EDCE CCNC(=O)NCCNCc1c(Br)ccc(OC)c1O 2236040145 XQSBILXJZKNAHR-UHFFFAOYSA-N 346.225 1.572 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1 2300532364 UUOLSHHZCBUVNI-NWDGAFQWSA-N 339.396 1.730 10 10 EDCE C[C@@H]1CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)[C@@H]1CO 2310988524 OUILPAKJLPNHIP-CRAIPNDOSA-N 330.428 1.766 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCCNC(=O)Cc2ccc(N)cc2)C1 2315479229 WWHVQLBOAABXNC-UHFFFAOYSA-N 349.431 1.563 10 10 EDCE CO[C@H]1CN(C)C[C@H]1NCc1ccc(C)c(Br)c1O 2352689746 PLNUBCYWWFZOHW-NEPJUHHUSA-N 329.238 1.882 10 10 EDCE Cc1ccc(CN2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(O)c1Br 2352946155 GRAFMKXBAITUOD-RDBQEKCUSA-N 328.206 1.389 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCN(CC(F)F)CC2)cc1 57986958 MVRFBGCNOQAXMI-UHFFFAOYSA-N 326.391 1.845 10 10 EDCE CN1CCC[C@H]2CN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC[C@H]21 301733785 ZDMKJCLVFSTZCQ-WCQYABFASA-N 346.387 1.846 10 10 EDCE Cc1n[nH]c([C@H]2CN(C(=O)NCc3ccc(N(C)C)cc3)CCO2)n1 175323296 YHCAMOIRLJFEET-OAHLLOKOSA-N 344.419 1.462 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)cc1Br 2357051979 DWQRSCAAJRNHQH-FSJWZZSZSA-N 342.233 1.965 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1ccc(S(C)(=O)=O)cc1N 307916334 MZEVKWWDCFVMCC-UHFFFAOYSA-N 334.397 1.650 10 10 EDCE CSc1ncc(CNC(=O)c2cc(=NN)c(Cl)c[nH]2)s1 2361442075 HDXVZJVWZOAVKH-UHFFFAOYSA-N 329.838 1.551 10 10 EDCE COC[C@@H]([C@@H](N)Cc1ccc(O)c(O)c1)N(C)C(=O)OC(C)(C)C 1952908317 CMRVLHUQDDQQOJ-STQMWFEESA-N 340.420 1.850 10 10 EDCE CC(C)(C)OC(=O)Nc1ccc(O)c([C@H]2CS(=O)(=O)CCN2)c1 1952984933 YBMKKHJKMONKRY-GFCCVEGCSA-N 342.417 1.798 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C)CC3CC(O)C3)CC2)cc1 190148349 YTTXPCLWVRUSAL-UHFFFAOYSA-N 347.459 1.047 10 10 EDCE C[C@H]1CC(O)C[C@H](C)N1CC(=O)N(C)Cc1ccc(N(C)C)cc1 191254559 YYLJYGJHCXPRLM-GJZGRUSLSA-N 333.476 1.945 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[S@](=O)C1 365221603 IWOCRTHUHINEBL-WBNWAKSLSA-N 339.373 1.131 10 10 EDCE COC(C)(C)CS(=O)(=O)N1CCOc2cc(N(C)C)ccc21 290833502 USPHJARNJROZSK-UHFFFAOYSA-N 328.434 1.706 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1nc2ncccn2n1 808095322 BZNONQUOYOIBRO-UHFFFAOYSA-N 332.360 1.175 10 10 EDCE Cc1cc(CC(=O)N2CC[C@@H](O)[C@@H](O)C2)c(C)n1-c1ccccc1 827570101 WADNVCZAZDULHA-MSOLQXFVSA-N 328.412 1.591 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)/C=C/[C@H]1CCCO1 821409627 IQCIUKZKTSCCCP-SXSDINLZSA-N 346.427 1.989 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1C[C@H](C)CO1 901326008 CZKANEFKHBMUAI-IINYFYTJSA-N 341.791 1.972 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1N(C(=O)OC(C)(C)C)CCC1(C)C 837751579 FYLAEUMISDQMOQ-GFCCVEGCSA-N 327.377 1.723 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC3(CCNC(=O)O3)CC2)cc1 913926434 CJTYWBIDQALCQJ-UHFFFAOYSA-N 346.431 1.927 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)c3cccc(N)c3)C2)cc1 849415906 HPLUXDXKFJHTMH-CQSZACIVSA-N 347.440 1.835 10 10 EDCE CCc1cccc(CN[C@H]2CCC[C@@H]2CNS(C)(=O)=O)c1O 848909514 VPKOPMLOLBOYNJ-HIFRSBDPSA-N 326.462 1.762 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)NCc2cnn(C)n2)cc1 845195441 DHEPABMHLPVDGJ-UHFFFAOYSA-N 332.408 1.102 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3CC4(CNC4)CO3)CC2)c(OC)c1 923413522 GOLCALNDHGGWDO-INIZCTEOSA-N 347.459 1.204 10 10 EDCE COC(=O)N(C)CCCC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855228510 BJOVUFQVMBOSDP-CQSZACIVSA-N 349.431 1.869 10 10 EDCE C[C@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@H]1[C@H]2CN[C@H]1C2 925485496 NTJCKQRPJFAKCY-DRACIFKTSA-N 342.487 1.474 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCc3ncccc3C2)c1 750796725 ZVMKADHSEQVDJS-UHFFFAOYSA-N 347.396 1.357 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCc3cnn(C)c3)C2)cc1 851986446 LBQINLNDONKLDI-OAHLLOKOSA-N 343.431 1.549 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCCC(=O)C1=O 864635398 ZFFJIKDQRQHQEN-UHFFFAOYSA-N 331.416 1.293 10 10 EDCE CCn1nc(C)cc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 861748215 LNDZKTMLKQCCQN-UHFFFAOYSA-N 343.431 1.841 10 10 EDCE CC(C)N(Cc1ccc(N2CCN(C)CC2)c(F)c1)C[C@H](O)CO 1118055562 ULGCOQDTZPDYSJ-INIZCTEOSA-N 339.455 1.141 10 10 EDCE COc1cc(C)cc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)c1O 795649603 FAODTWUNGZHPNN-CQSZACIVSA-N 342.461 1.565 10 10 EDCE CO[C@H]1CN(Cc2cc(Br)ccc2O)C[C@@H]1C(=O)O 690085746 FPTZHSFXOPNGOS-JQWIXIFHSA-N 330.178 1.686 10 10 EDCE CC(C)(C)OC(=O)c1cc(C(=O)NCc2ccc(O)cc2O)[nH]n1 1142537411 KGHKFEGZPYXYNZ-UHFFFAOYSA-N 333.344 1.706 10 10 EDCE C[C@@]1(NCc2c(O)cccc2Br)CCC(=O)NC1=O 2116206927 UKHYTEMKYCQMBT-CYBMUJFWSA-N 327.178 1.440 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCC(C)(C)O2)cc1 1321921793 PCSFRCBBLQYETL-OAHLLOKOSA-N 333.432 1.443 10 10 EDCE O=C(N=c1cc[nH]cc1Br)c1cc(O)c(O)c(O)c1 2132348098 DWBZGRLFCAWKLE-UHFFFAOYSA-N 325.118 1.635 10 10 EDCE Cc1cc(C(=O)NCc2cc(O)nc(O)n2)c(C)n1-c1ccccn1 1299917836 MIEIBHSRCJTLLE-UHFFFAOYSA-N 339.355 1.620 10 10 EDCE CN(C(=O)CCCF)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1536477183 JONOUEIJPYHQQT-UHFFFAOYSA-N 349.366 1.882 10 10 EDCE CO[C@@H]1C[C@@H](C(=O)O)N(Cc2c(O)cccc2Br)C1 2136353073 OIIJXTKDLHQKSU-KCJUWKMLSA-N 330.178 1.829 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCN3C[C@@H](F)C[C@H]3C2)cc1 1460895344 BBGMBYJRYPAOLV-RDJZCZTQSA-N 334.439 1.097 10 10 EDCE COc1ccc(N2CCC(NC(=O)/C=C\C(=O)N(C)C)CC2)cc1 1626479172 DKQXVMBWZYMBKI-HJWRWDBZSA-N 331.416 1.425 10 10 EDCE CCOCC(=O)NC[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1725948727 SIAZGEVPQWNVBO-NSHDSACASA-N 349.391 1.462 10 10 EDCE CC(=O)N/C(=C/c1cccs1)C(=O)NCc1cc(O)ccc1O 1637126062 KSUWFCNDBAZXDW-RIYZIHGNSA-N 332.381 1.953 10 10 EDCE C[C@H](O)CNC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CCCC1 1568247766 PJZOKLUVGOWBOZ-LBPRGKRZSA-N 347.419 1.862 10 10 EDCE Cc1nn(C)c(Br)c1C(=O)NCc1cc(O)ccc1O 1644754037 OPTZKOSMCYTNAS-UHFFFAOYSA-N 340.177 1.832 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCCn1ccnn1 1742755195 YVRHRUDTPACIKD-UHFFFAOYSA-N 327.392 1.610 10 10 EDCE O=C(C[C@@H]1C(=O)Nc2ccc(F)cc21)NCc1c(O)cccc1O 1652628881 NNDYGDHRXLWSCE-NSHDSACASA-N 330.315 1.979 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(O)c(O)c2)[C@@H](O)C1 2005084608 JVNFVZHMSJJGLO-WFASDCNBSA-N 338.404 1.558 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)CO1 2003168080 DZNMVFMNEWIERZ-LPWJVIDDSA-N 340.420 1.182 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1986368353 FLHQPYROJDYEOF-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N1CCC(O)(CC(=O)N2CC(N=[N+]=[N-])C2)CC1 2010404139 OXWHPGAZJMZGKD-UHFFFAOYSA-N 339.396 1.660 10 10 EDCE CCOc1cccc(CNC[C@H](O)CNC(=O)OC(C)(C)C)c1O 2011422593 KDTZEPDHVPDLFQ-ZDUSSCGKSA-N 340.420 1.766 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(C(=O)Nc2ccc(N)cc2)C1 2022847082 WMOOLQJSLCPBIS-KRWDZBQOSA-N 335.404 1.827 10 10 EDCE CC(C)(C)OC(=O)NCc1n[nH]c(=NCc2cccc(F)c2O)o1 2024247871 WQBAOBWLPDHIOO-UHFFFAOYSA-N 338.339 1.973 10 10 EDCE COC(=O)[C@@H](CNC(=O)OC(C)(C)C)NCc1cccc(C)c1O 2024805496 QXDYRNKWAQBTGW-CYBMUJFWSA-N 338.404 1.857 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)c(Br)c1 2173356259 BVUPWACLWUUMEU-NIQAVCIQSA-N 342.233 1.823 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2NC(=O)c1cccc(O)c1O 862065981 QJRSXFPBTHDDHH-CDMKHQONSA-N 334.372 1.835 10 10 EDCE CCN(C)C1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2169443410 SKARTBDHGSIHJE-CYBMUJFWSA-N 340.221 1.575 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC=CC[C@H]3CO)c(Br)cc21 2176342983 NBNVZVHHUHQAOA-SDBXPKJASA-N 338.205 1.528 10 10 EDCE CC1(C)[C@H](O)C[C@@]1(CO)NCc1cc(Br)cc(F)c1O 2193972288 ZTOVILSTUJPRRD-RISCZKNCSA-N 348.212 1.905 10 10 EDCE CC(C)(C)OC(=O)N[C@]12C[C@@H]1CN(CC(=O)Nc1ccc(N)cc1)C2 2044675858 CNTHVZXQOYOJQT-XIKOKIGWSA-N 346.431 1.806 10 10 EDCE N[C@@H]1CN(Cc2cc(Br)cc(F)c2O)[C@@H]2COC[C@@H]12 2102138792 XLHVQBSMTDMYCC-MVWJERBFSA-N 331.185 1.452 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213589541 GRHXEXVOVAIDNT-GMTAPVOTSA-N 341.412 1.998 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CN(c3ccc(N)cc3)C[C@@H]2[C@@H]1CO 2214630011 DBQGIOMROXLQGA-RCBQFDQVSA-N 333.432 1.933 10 10 EDCE N[C@H](Cc1cccc(Br)c1)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2237415776 DOBMTJIZAPVAJW-RAIGVLPGSA-N 339.233 1.585 10 10 EDCE CC(C)c1nnc2n1C[C@@H](NC(=O)C=Cc1ccc(O)c(O)c1)CC2 2307996494 JYSWTJQZSUXRTK-ZDUSSCGKSA-N 342.399 1.957 10 10 EDCE NC(=O)[C@@H]1CN(c2ccc(CO)c(Br)c2)CC12CC2 2344329699 BLKLRSFAIRKVSO-NSHDSACASA-N 325.206 1.643 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCCCCN1CCOCC1 115662053 XJRWEQQTOAPJIR-UHFFFAOYSA-N 348.491 1.973 10 10 EDCE COC[C@@H](O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1Cl 129603496 OJGGSNYIINFFGF-JSGCOSHPSA-N 328.840 1.835 10 10 EDCE Cn1cc(N2CCC[C@H](NC(=O)/C=C/c3ccc(O)c(O)c3)C2)cn1 181122698 VSYGIYIHNCJDIF-DYLGSBMWSA-N 342.399 1.630 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)N3CCC[C@@H]3C)CC2)cc1 184845552 LASIDFCDOXSDTH-AWEZNQCLSA-N 339.461 1.546 10 10 EDCE C[C@H](NC(=O)C(=O)NCc1cscn1)c1ccc(N(C)C)cc1 804019587 CFFFCHGUKQZDJY-NSHDSACASA-N 332.429 1.703 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2[C@H]3CNC[C@H]32)c(O)c1Br 2381132476 BKGHRZFBDXBVPF-ZSBIGDGJSA-N 339.233 1.887 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(OC)cc1O)C2 819520367 GLWREUJFPIZIPT-CQDKDKBSSA-N 348.399 1.884 10 10 EDCE CCOc1cccc(CN2CCS(=O)(=O)[C@@H]3CCC[C@H]32)c1O 825200699 GLTAEZPWTWNNIG-UKRRQHHQSA-N 325.430 1.942 10 10 EDCE COC[C@@](C)(CCO)NC(=O)c1cc2cc(O)c(O)cc2s1 901348413 NCUKVVIRVDMIIS-OAHLLOKOSA-N 325.386 1.830 10 10 EDCE CN(C)c1ccc([C@@H](N)CNCc2cnnn2[C@@H]2CCCNC2)cc1 903917976 PMKAGRLCIGQFGD-AEFFLSMTSA-N 343.479 1.058 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1cn([C@@H]2CC[C@H]2O)nn1 900731654 GQEKWIUJJKCTQE-HZPDHXFCSA-N 329.404 1.278 10 10 EDCE CN(C)c1ccc(/C=C/CN(CCO)CCN2CCOCC2)cc1 835027316 LJALEJXUOUBMGT-ONEGZZNKSA-N 333.476 1.392 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NC2CC(CC(N)=O)C2)cc1 914255070 WYURIJSKRTWWPI-UHFFFAOYSA-N 332.448 1.986 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCS(=O)(=O)[C@H]3CCC[C@@H]32)c1O 832462481 GIFVDEZULHBKQA-GJZGRUSLSA-N 341.404 1.885 10 10 EDCE C[C@@H]1C[C@H](S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)CCO1 842785488 NXFKSOULLOYZHS-DAXOMENPSA-N 341.477 1.239 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCn3nncc3C2)c([N+](=O)[O-])c1 848748604 NZENIEURYMCODH-HWKANZROSA-N 329.316 1.393 10 10 EDCE COc1ccc(CNC(=O)COCC(=O)OC(C)(C)C)c(O)c1 843874693 QNILCZADFDQBDW-UHFFFAOYSA-N 325.361 1.375 10 10 EDCE NC(=O)c1ccc(CC(=O)NCc2ccc(N3CCCC3)cc2)cn1 858451799 CIWJASAJIVBNEN-UHFFFAOYSA-N 338.411 1.640 10 10 EDCE NC(=O)[C@H]1C[C@H](NC(=O)NCc2ccc(N3CCSCC3)cc2)C1 858154383 GCZNWTJWADBHKH-HDJSIYSDSA-N 348.472 1.303 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nnn(C(C)(C)C)n3)CC2)cc1 854199069 VQIIWHSIDSQDSA-UHFFFAOYSA-N 344.419 1.399 10 10 EDCE COc1c(CNCc2ccc(N3CCC(O)CC3)cc2)c(C)nn1C 850406279 ZUIFJZIJMKPCTD-UHFFFAOYSA-N 344.459 1.988 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)Cc1ccc(C(N)=O)nc1 859420942 FHXLULCPLDXFSM-UHFFFAOYSA-N 326.400 1.414 10 10 EDCE Fc1cc(CN2CCOC[C@H]2c2ncon2)ccc1N1CCOCC1 779622507 CBUAOSTVLQUPFB-INIZCTEOSA-N 348.378 1.619 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cc2c(O)ncnc2cn1 779000303 ALMRPAQNRYBXSH-UHFFFAOYSA-N 326.312 1.114 10 10 EDCE O=C1CC2(CCC2)N(Cc2ccc(N3CCOCC3)c(F)c2)CCN1 895928531 MFKZERXQBYQZIE-UHFFFAOYSA-N 347.434 1.907 10 10 EDCE CCOC(=O)c1nn(Cc2ccc(N(C)C)cc2)c2c1CNCC2 82810653 TWGLDCDKRLWIJM-UHFFFAOYSA-N 328.416 1.820 10 10 EDCE Cc1ncn(CC(=O)Nc2ccc(N)cc2)c(=O)c1Br 90766035 KMJHOILMYUKDCD-UHFFFAOYSA-N 337.177 1.535 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CC(=O)N(C2CCCCC2)C1 1304050001 GIADGOQFJXVFAA-LBPRGKRZSA-N 332.400 1.895 10 10 EDCE CCN1CCN(CCN(C)C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1317824178 MHOQLAXCERONMT-UHFFFAOYSA-N 346.435 1.559 10 10 EDCE O=C(NCc1cccc(O)c1O)c1ccc(=O)n(-c2ccccc2)n1 1176564692 CXWZJEVGUFZFMW-UHFFFAOYSA-N 337.335 1.574 10 10 EDCE C[C@H](NC(=O)C(=O)NCCc1ccns1)c1ccc(N(C)C)cc1 1332139485 AGLPLXCIIGVYTC-LBPRGKRZSA-N 346.456 1.745 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1268372110 VNGZNTCSKPFFHK-GOEBONIOSA-N 347.459 1.466 10 10 EDCE Cc1noc(C)c1CN(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1348584385 CYFHVTYWIHAKME-UHFFFAOYSA-N 329.356 1.498 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cccn2C)cc1C 1507467249 SXQLNDUSZUASKA-INIZCTEOSA-N 345.443 1.565 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C1(CO)CCC1 1914973522 KKTWKBWMDPYDMW-LBPRGKRZSA-N 341.205 1.786 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N(Cc1ccccc1)C1COC1 1915747483 IOFCJTSAIDDUMH-INIZCTEOSA-N 342.395 1.395 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCCN(CC(F)(F)F)C1 1450677864 KPWOILRVEBOSCV-NSHDSACASA-N 332.322 1.783 10 10 EDCE COC(=O)[C@]1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCSC1 1296023403 IRNOOBLGSFLJCB-AWEZNQCLSA-N 336.373 1.628 10 10 EDCE Cc1nc[nH]c1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1464308515 PCKHWVREVZNAHA-UHFFFAOYSA-N 332.379 1.553 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2oncc2C)cc1C 1717062598 AFSBOEBLQIMSDL-UHFFFAOYSA-N 347.415 1.524 10 10 EDCE C[C@@H](CNCc1nncs1)NC(=O)c1ccc(N=NC(N)=O)cc1 1483299007 NSYSVTUSARILDV-VIFPVBQESA-N 347.404 1.609 10 10 EDCE CS(=O)(=O)c1ccccc1CNC(=O)Cc1ccc(O)c(O)c1 1630012963 IQKTVULLYHPLJT-UHFFFAOYSA-N 335.381 1.360 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2ccco2)cc(OC)n1 1494563522 STZHCWXSJCDAPM-SNVBAGLBSA-N 333.344 1.240 10 10 EDCE O=C(CNC(=O)c1ccc(F)c(F)c1)NCc1ccc(O)cc1O 1639444314 GVCVYHZQHQBFJI-UHFFFAOYSA-N 336.294 1.422 10 10 EDCE CN(C)CCOc1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1 1632669160 MLWNLRBINGWWNB-UHFFFAOYSA-N 344.411 1.897 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cnn(-c2ccc(F)cc2)n1 1593872758 CQUYQSJHBUERGN-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE CCCC(=O)N[C@@H]1[C@H]2C[C@H]1N(C(=O)c1ccc(N=NC(N)=O)cc1)C2 1689478001 PBBSPWHPFVSLLT-NJZAAPMLSA-N 343.387 1.978 10 10 EDCE Cc1cc(-c2nnc(NC(=O)C3=S=C4CCCC4=C3)o2)n(C)n1 1851837391 HOVZKVOYDJSNMH-UHFFFAOYSA-N 329.385 1.919 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)[C@@H]2CSCN2)c2nccn2C)cc1 1866108914 SGGSUCVCKYHMNJ-LSDHHAIUSA-N 345.472 1.354 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010401908 JLDQNGCHSIWJSU-QJPTWQEYSA-N 339.396 1.827 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3OCCN(C)[C@@H]3C2)cc1Br 2153995293 QEKPOECYLYAJLZ-VCTAVGKDSA-N 340.265 1.988 10 10 EDCE CN(C(=O)CN(CCC(N)=O)Cc1ccccc1)c1ccc(N)cc1 2034747241 FDRBLOZKSZBXNV-UHFFFAOYSA-N 340.427 1.609 10 10 EDCE CN(C)c1ccc([C@H](N)[C@H](O)c2cc(Br)nn2C)cc1 2163137154 ADPPOPBSFJEQSW-UONOGXRCSA-N 339.237 1.982 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCCC[C@H](O)C3)c(Br)cc21 2169207510 YGDJVABDCKBUMQ-ISVAXAHUSA-N 340.221 1.752 10 10 EDCE N[C@H]1CC[C@@H](C(=O)O)N(Cc2cc(Br)cc(F)c2O)C1 2188782155 PETILTJGBLGLAZ-ONGXEEELSA-N 347.184 1.670 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCC=C[C@@H]3CO)c(Br)cc21 2182332301 ODTPDROURCNVTG-OQPBUACISA-N 338.205 1.528 10 10 EDCE OCc1ccc(N2CC[C@]3(O)CCOC[C@H]3C2)cc1Br 2194563937 FEAUEPZSECJWSR-DOMZBBRYSA-N 342.233 1.919 10 10 EDCE CN(C[C@H](O)COCc1ccccc1)C(=O)c1cc(O)c(O)c(O)c1 2068579951 ZSFSKMONSUYJHY-AWEZNQCLSA-N 347.367 1.453 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)c(Br)c2)[C@@H]2COC[C@H]12 2102140500 IQHBHXNSUXOSFW-IACUBPJLSA-N 327.222 1.758 10 10 EDCE O=S(=O)(CCNCc1cccc(Br)c1O)C(F)F 2217595018 NMOMRCVANXPRMJ-UHFFFAOYSA-N 344.177 1.882 10 10 EDCE CN(C)CCCN(CCN)Cc1cc(Br)ccc1O 2265838495 RUMOROGBDVTCRO-UHFFFAOYSA-N 330.270 1.867 10 10 EDCE CCNC[C@H]1C[C@@H](S(=O)(=O)NCc2cnc(SC)s2)C1 2284689356 NQDAHWHECNXFPZ-JGZJWPJOSA-N 335.520 1.673 10 10 EDCE C[P@@]1(=O)C[C@@H](O)[C@H](NCc2cccc(Br)c2O)C1 2296816727 PIDWYIJCCLHINO-YRUZYCQGSA-N 334.150 1.980 10 10 EDCE C[C@H](O)[C@H](C(=O)O)N1C(=O)C(=Cc2ccccc2F)SC1=S 2323823877 VBKZOPISJXSHJH-WRWORJQWSA-N 341.385 1.861 10 10 EDCE NCc1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)c(F)c1Br 2336360686 AIJPDDRWCRHIJC-PSASIEDQSA-N 349.225 1.280 10 10 EDCE Cc1ccc(CN[C@H]2COC[C@H]2N(C)C)c(O)c1Br 2352681554 SQKSWWCURDVGLK-NWDGAFQWSA-N 329.238 1.882 10 10 EDCE Cc1ccc(CN2C[C@H](O)[C@@H](O)[C@H]2CF)c(O)c1Br 2352686044 IKHMIOLVNCZKRZ-NRUUGDAUSA-N 334.185 1.339 10 10 EDCE CO[C@@H](Cc1ccc(O)c(O)c1)[C@@H](NC(=O)OC(C)(C)C)C(=O)O 1952305736 CQBRYLWQKJHLLI-QWHCGFSZSA-N 341.360 1.633 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)cc1Br 1893324432 GOTYXHNCWZRQDJ-BIGNPOOSSA-N 329.238 1.791 10 10 EDCE CNC(=O)[C@H](C)CN(C)c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 175051342 HHQFZLMLFZSRPC-LXSSAFMLSA-N 335.360 1.599 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2358207178 SGKFDEFGWYDMJV-MJBXVCDLSA-N 347.228 1.439 10 10 EDCE COc1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(OC)c1Br 2358636899 BAUPNWCEISUMEH-DVVUODLYSA-N 344.205 1.662 10 10 EDCE O=[N+]([O-])c1cc(Cl)cc(CN2CC[C@H](N3CCOCC3)C2)c1O 120992205 ICLFABVPZQIDCL-ZDUSSCGKSA-N 341.795 1.860 10 10 EDCE Cc1cc(CS(=O)(=O)NCc2ccc(N(C)C)c(F)c2)no1 265357708 SHGBPEHHADENEK-UHFFFAOYSA-N 327.381 1.808 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(O)CCCNC2)c(O)c1Br 2380759258 MHNKMSJZXYLKNR-CQSZACIVSA-N 343.221 1.194 10 10 EDCE Cc1ccc(CN2C[C@H](N)C[C@@H](C(N)=O)C2)c(O)c1Br 2381130938 GVUAFAUYGKJTKJ-GHMZBOCLSA-N 342.237 1.098 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2OCC[C@@H]2N)c(O)c1Br 2381131276 LLZLFNFFUCNRFP-GWCFXTLKSA-N 343.221 1.538 10 10 EDCE O=C(NCc1cc(Br)ccc1O)[C@]1(O)CCSC1 804737722 WOZYMUKLNUEKCY-LBPRGKRZSA-N 332.219 1.639 10 10 EDCE C[C@@H]1C[C@H](N(C)CC(=O)NCc2ccc(N(C)C)cc2)CCN1C 299215089 HVJUDELAWKRSHL-CRAIPNDOSA-N 332.492 1.783 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3C[C@H]3C3CC3)CC2)cc1 819281761 XPJNIWFJKKRFCX-YZGWKJHDSA-N 345.487 1.566 10 10 EDCE COC[C@H](NCc1cc(OC)c(OC)cc1O)C1CCOCC1 826872536 OCWIJNCLADQQLA-AWEZNQCLSA-N 325.405 1.941 10 10 EDCE Cc1nc(S(=O)(=O)Nc2c(F)c(F)c(O)c(F)c2F)cn1C 826549870 BSDUXFZITWQHLP-UHFFFAOYSA-N 339.270 1.791 10 10 EDCE O=C1CCC2=C(CCN(Cc3ccc(N4CCOCC4)cc3)C2)N1 826781176 XHDUOOIKVGINHB-UHFFFAOYSA-N 327.428 1.893 10 10 EDCE CNC(=O)C1CN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)C1 832289124 CKNGDBZYBXCOSF-UHFFFAOYSA-N 325.412 1.841 10 10 EDCE Cc1cc(O)c(CN2CCN(CC(=O)NC(C)C)CC2)c(Cl)c1 840909229 DECMSZGCODUHDI-UHFFFAOYSA-N 339.867 1.996 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CO)C3CCC3)C2)cc1 852447835 FHIVPNPASCZLDR-YOEHRIQHSA-N 333.432 1.734 10 10 EDCE CCCNC(=O)CCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 851996929 FMSJEFQWLIUVGG-AWEZNQCLSA-N 348.447 1.489 10 10 EDCE COc1ccc(N(C)CCN(C)CC(=O)Nc2cccnn2)cc1 930852537 KRYJDPBMRYOXIR-UHFFFAOYSA-N 329.404 1.492 10 10 EDCE COC[C@H](C)OC(=O)NCc1ccc(N2CCOCC2)c(F)c1 866541815 BFJAEKAEBNMNDW-LBPRGKRZSA-N 326.368 1.923 10 10 EDCE CN1CCN(c2ccc(CNC(=O)[C@H]3CCCOCC3)cc2)CC1 881853917 OHERTEDLHXVHED-KRWDZBQOSA-N 331.460 1.871 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CSCC(=O)N1 1124622800 KZEXEFZCBWZGJB-HNNXBMFYSA-N 333.457 1.477 10 10 EDCE CCOc1ccc(N2CCN(C(=O)Cc3cncn3C)CC2)cc1 1137658591 OKLOHKJRUPVOJA-UHFFFAOYSA-N 328.416 1.710 10 10 EDCE CN1CCN(Cc2ccc(Br)cc2O)C[C@H]1C(=O)O 686105286 UQNZCOPQUPQYGO-NSHDSACASA-N 329.194 1.355 10 10 EDCE CCS(=O)(=O)c1ccc(C(=O)NCc2cc(O)ccc2O)cc1 1153879432 OQYIYGHUMPQSJM-UHFFFAOYSA-N 335.381 1.821 10 10 EDCE COc1cccc(C2=NO[C@@H](C(=O)NCc3c(O)cccc3O)C2)c1 1304053230 FDRQWZFIWLUTEB-QGZVFWFLSA-N 342.351 1.916 10 10 EDCE O=C1CCCC[C@@H]1[C@H]1COCCN1C(=O)Cc1ccc(O)c(O)c1 1151960794 PPRWHVWPNDGXGM-ZIAGYGMSSA-N 333.384 1.627 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CNC(=O)C(C)(C)C)cc1C 1321740678 ZUVXHOLOHWWZCD-CQSZACIVSA-N 349.475 1.760 10 10 EDCE O=C1NC[C@@]2(CCN(Cc3cc(Br)ccc3O)C2)N1 2121192910 JMWAKEUMUDBUQV-CYBMUJFWSA-N 326.194 1.412 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CC(C3CCOCC3)C2)cc1 1321920599 GKXXPQBJHZIUGK-UHFFFAOYSA-N 345.443 1.254 10 10 EDCE CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1330893535 LEOYVWAJGAPIHZ-JOCQHMNTSA-N 337.395 1.192 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC[C@@H](O)C(F)(F)F)cc2)CC1 1346325048 IGFWCNVLHBTMHW-OAHLLOKOSA-N 345.365 1.368 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(OC2CCC2)CC1 1351920449 PZXHWDQGHVIWEX-UHFFFAOYSA-N 344.411 1.795 10 10 EDCE COCC(=O)N[C@]1(C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1286074834 GOKJDTRDRQMPBG-MRXNPFEDSA-N 347.375 1.216 10 10 EDCE CCNCc1ccc(N2CC(CO)(CO)C2)cc1Br 1914990116 MFWIUONKGLDVIC-UHFFFAOYSA-N 329.238 1.350 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)CCCCCO)cc2)CC1 1455870038 YXJMGRTZMIQLEL-UHFFFAOYSA-N 347.459 1.557 10 10 EDCE Cc1oc(C(=O)NCc2c(O)cccc2F)cc1S(C)(=O)=O 1471976333 WUDFIGXEPOFAHI-UHFFFAOYSA-N 327.333 1.766 10 10 EDCE CN1C[C@@H](C(=O)NCc2ccc(O)cc2O)c2ccccc2C1=O 1626837719 DICSRWJBLMDGLK-OAHLLOKOSA-N 326.352 1.583 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)Cn2cncn2)cc1C 1715274104 RYRYWAKUURDPBW-CYBMUJFWSA-N 331.420 1.137 10 10 EDCE C[C@H](NC(=O)c1c2c(nn1C)CCS(=O)(=O)C2)c1ccccc1O 1632254893 JECXPYJGSOGJNI-JTQLQIEISA-N 349.412 1.088 10 10 EDCE Cc1ccc(O)c(CNC(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)c1 1641729794 YTANWFKJRSERCK-HNNXBMFYSA-N 347.396 1.047 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC(C(=O)N2CCCC2)CC1 1654156588 HUBYURGYIGZVGH-UHFFFAOYSA-N 336.363 1.712 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@@H]1C[C@H]1C 1584289279 RIYVTHOGDJZLCC-GBIKHYSHSA-N 331.376 1.740 10 10 EDCE CC(C)(C)OC(=O)N(CCO)[C@@H](C(=O)O)c1cc(F)ccc1O 1936302724 UDDYHOCOTJCBNL-GFCCVEGCSA-N 329.324 1.886 10 10 EDCE O=C(Cn1c(=O)[nH]c2ccccc21)NCCc1ccc(O)c(O)c1 156693672 FAEHTKOROYJAEJ-UHFFFAOYSA-N 327.340 1.100 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](C(=O)NCCCN=[N+]=[N-])[C@@H]1CCOC1 1964885299 YVEVXYQKHRNFLS-NEPJUHHUSA-N 341.412 1.980 10 10 EDCE CC(=O)N1C[C@@H]2C[C@H]1CN2Cc1cc(Br)ccc1O 1970759144 DWOUOMLBWFTNQD-STQMWFEESA-N 325.206 1.960 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985093764 FFNSYVUFAFNWRW-NSHDSACASA-N 327.385 1.517 10 10 EDCE CO[C@H](C(=O)N(C)CCN=[N+]=[N-])C1CN(C(=O)OC(C)(C)C)C1 1985100759 ILMWIXUKTKMFSD-NSHDSACASA-N 327.385 1.637 10 10 EDCE CC(C)(C)OC(=O)NCC1CN(CC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010388636 FEJASRFSPIPWTE-LBPRGKRZSA-N 338.412 1.354 10 10 EDCE CNCc1ccc(N(C)CC(C)(CO)CO)cc1Br 689678314 ODCUPBPIAADSHC-UHFFFAOYSA-N 331.254 1.596 10 10 EDCE Cn1cc(C(=O)NCCOc2ccc(N)cc2)c(Br)n1 2173189300 MWFQPANPHXSABM-UHFFFAOYSA-N 339.193 1.574 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@H](CO)C2)cc1Br 396814192 UERQJWLPKASNPL-BFVZDQMLSA-N 329.238 1.648 10 10 EDCE OCc1ccc(N2C[C@@H](O)C3(CCOCC3)C2)cc1Br 2174374356 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1.687 10 10 EDCE CCCNC(=O)CNC(=O)N1CCN(c2ccc(OC)cc2)CC1 54104363 HUSPXCRGZJTRAS-UHFFFAOYSA-N 334.420 1.053 10 10 EDCE CCN(C(=O)[C@@H](C)Cc1ccc(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1 170245285 FGDNIKVIHQIJPU-WCQYABFASA-N 341.429 1.312 10 10 EDCE O=C(NC[C@@H](O)c1ccc2c(c1)OCCO2)c1cc(O)c(O)c(O)c1 170190465 OEKMORVVGKBJDR-CYBMUJFWSA-N 347.323 1.038 10 10 EDCE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cn2ccnn2)cc1 175181210 WFIRQNAHPICAGI-KRWDZBQOSA-N 343.431 1.552 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1OCC[C@H]1N 1952548976 BLRTZPRHCLHEIA-LALPHHSUSA-N 338.404 1.650 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)C2CN(C(C)=O)C2)cc1C 1270948173 PRHGGYFNZDFUAJ-CQSZACIVSA-N 347.459 1.418 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H]2CCCCC[C@@H]2C(N)=O)cc1 120621654 LVWLYRCJIYCGTQ-JKSUJKDBSA-N 332.448 1.986 10 10 EDCE O=C(NC1CN(C(=O)NCc2ccc(N3CCCC3)cc2)C1)C1CC1 190284671 BGFDNRPYOWHXEB-UHFFFAOYSA-N 342.443 1.707 10 10 EDCE COc1ccc(Br)c([C@H](NCCN=[N+]=[N-])C(N)=O)c1 234840567 VTOATIUXLWGEHT-JTQLQIEISA-N 328.170 1.884 10 10 EDCE CN(C)C(=O)CCCNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255674932 QYVLLZFSYATGRZ-YFHOEESVSA-N 345.443 1.521 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCC(=O)[C@H](C)C3)nc12 275264805 SPHIKUXHAGNGCV-SNVBAGLBSA-N 332.360 1.023 10 10 EDCE CN1CCCc2cc(CNC(=O)C3(N4CCOCC4)CCC3)ccc21 367542249 NMECHPJEQUSKSU-UHFFFAOYSA-N 343.471 1.940 10 10 EDCE CC(=O)NC1CN(c2ccc(/C=C/C(=O)O)c(Br)c2)C1 388339801 MQAAIENHMJVBLF-HWKANZROSA-N 339.189 1.872 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC[C@@H](O)CN1CCOCC1 819376890 JVMFHTKWXCZDNM-QFBILLFUSA-N 335.492 1.275 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1cn([C@H]2CCCNC2)nn1 829764290 IVJKGAFSXHUWMX-INIZCTEOSA-N 342.447 1.507 10 10 EDCE CC1(O)CC(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 825492404 CBLDGHPDTPRURV-UHFFFAOYSA-N 332.444 1.673 10 10 EDCE CCN(OC)C(=O)CNC(=O)NCc1ccc(N2CCCC2)cc1 825720412 BWBUZHMGQJINNL-UHFFFAOYSA-N 334.420 1.496 10 10 EDCE Cc1cc(C(=O)COC(=O)[C@H]2CNC(=O)N2)c(C)n1-c1ccccc1 732360563 MAUPVGSXKXSVOW-OAHLLOKOSA-N 341.367 1.501 10 10 EDCE Cc1cc(Br)cc(CN2CCC[C@](O)(CO)C2)c1O 839153758 HFOTXGUWFFZJCQ-CQSZACIVSA-N 330.222 1.782 10 10 EDCE CC[C@H](CS(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)OC 849416476 AQMLIHZLAGLFIB-DZGCQCFKSA-N 342.461 1.618 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)Cn3ccnc3)C2)cc1 849225069 NATSWRIIQPVZQJ-HUUCEWRRSA-N 343.431 1.858 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCC(=O)N(C)C2)cc1 845003354 OIMKCYRIJLBUJL-AWEZNQCLSA-N 348.447 1.394 10 10 EDCE CN1C(=O)N[C@]2(CCC[C@@H]2CNCc2ccc3c(c2)CCCO3)C1=O 921813098 BLEKYFUEKMCAEZ-BEFAXECRSA-N 343.427 1.822 10 10 EDCE CCc1nnc(CNC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)o1 854296458 DJPNJRQGCQYRJU-LBPRGKRZSA-N 345.403 1.719 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@]3(C)CCN(C(C)=O)C3)C2)cc1 855232802 XYIZIJXREOJUER-KXBFYZLASA-N 345.443 1.649 10 10 EDCE COc1ccc2c(n1)N(C)CCN2C(=O)/C=C(/C)c1cnccn1 928398025 AIWDRLMOSLDZTH-BENRWUELSA-N 325.372 1.767 10 10 EDCE O=S1(=O)CCN(c2ccc(CN[C@H]3CCNC34CCC4)cc2)CC1 925485903 FAYNPCNXNQVNNQ-KRWDZBQOSA-N 349.500 1.296 10 10 EDCE 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O=C(O)[C@@H]1COCCN1Cc1cc(Br)cc(F)c1O 715763700 XPZBBLRWWYLZAP-JTQLQIEISA-N 334.141 1.579 10 10 EDCE C[C@H](O)c1ccc(N2CCC(CO)(CO)C2)c(Br)c1 694630820 WOWKMGXGHDEJAZ-JTQLQIEISA-N 330.222 1.684 10 10 EDCE NS(=O)(=O)c1cc(C(=O)NCc2ccccc2O)c(Cl)o1 1150537211 YAPJMRHLVHBISD-UHFFFAOYSA-N 330.749 1.216 10 10 EDCE O=C1C[C@@](C(=O)NCc2cccc(O)c2O)(c2ccccc2)CN1 1176576934 UXGVHKBDCYVBMM-SFHVURJKSA-N 326.352 1.172 10 10 EDCE C[C@@H]1CN(CCO)CCN1Cc1ccc(Br)cc1O 1327880877 OIKRXTYAAXYLSV-LLVKDONJSA-N 329.238 1.653 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@@H]2CC[C@H](C1)O2 1329817152 UJXSDCDEEWEULP-IYBDPMFKSA-N 331.416 1.101 10 10 EDCE C[C@H](CO)N(Cc1ccccc1)C(=O)[C@@H](N)Cc1ccc(O)c(O)c1 1914368310 RAEHXPWESXSHIY-CJNGLKHVSA-N 344.411 1.377 10 10 EDCE Cc1cccc(N(CCC(N)=O)C(=O)Cc2ccc(O)c(O)c2)c1 1292309802 WXOXAOGHBZIHIL-UHFFFAOYSA-N 328.368 1.857 10 10 EDCE Cn1nc(Br)cc1NC(=O)Cc1ccc(O)c(O)c1 1298318789 ZWSWYYVEWHXRND-UHFFFAOYSA-N 326.150 1.775 10 10 EDCE COC(=O)c1ccc(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cn1 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N[C@H]1C(=O)Nc2cc(N3CCC[C@H](CO)C3)c(Br)cc21 92775278 RRRRQHHEILKXHS-ISVAXAHUSA-N 340.221 1.610 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H]1F 1325838288 ZJCTYEHEZGSTPW-CJNGLKHVSA-N 335.423 1.918 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1F 1325838292 ZJCTYEHEZGSTPW-XJKSGUPXSA-N 335.423 1.918 10 10 EDCE CN1CCN(c2ccc(CN[C@@H](CN)C(F)(F)F)cc2F)CC1 1327711859 UXNMMMUICMGOLK-AWEZNQCLSA-N 334.361 1.557 10 10 EDCE CN1CC[C@@H](C(=O)NCc2cccc(O)c2O)[C@@H](c2cnn(C)c2)C1 1520508482 CLWVVDXAJAVKMO-HUUCEWRRSA-N 344.415 1.183 10 10 EDCE CCn1cc(C(=O)NC/C=C/CNCc2ccc(OC)c(C)c2)nn1 1716358768 KVRVFIXYLDKKOJ-AATRIKPKSA-N 343.431 1.691 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cncs2)cc1C 1717046116 PIHGDSKLZSJUGP-UHFFFAOYSA-N 349.456 1.684 10 10 EDCE Cc1cc(C(=O)N[C@H](CO)[C@@H]2CCOC2)c(C)n1-c1ccccn1 1624224758 GCOJUEZUIYRAIQ-GDBMZVCRSA-N 329.400 1.616 10 10 EDCE C[C@H]1CCN(CC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C1 1648478110 QJNJZGGFVCIPFK-MAUKXSAKSA-N 332.492 1.813 10 10 EDCE CC[C@H](CNC(=O)C[C@H]1CCC(=O)N1)NCc1ccc(OC)c(C)c1 1732215633 WBEQXULVRVHSJS-HZPDHXFCSA-N 347.459 1.657 10 10 EDCE CC(C)C(=O)NC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1689231047 NHUJXLRAPFWHEI-XWQBDTFCSA-N 331.376 1.907 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)cc1Br 2146307290 YSCRJTQUVFJYTP-COLVAYQJSA-N 341.249 1.650 10 10 EDCE CC(C)(C)OC(=O)NCCC(F)(F)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980369493 LVMVVRXTLQDOKR-MGCOHNPYSA-N 334.363 1.802 10 10 EDCE C[C@@H](NC[C@@H](O)CNC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985775306 GXFBTZMFWOKHKT-ZYHUDNBSSA-N 326.393 1.634 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@]1(O)CCCN(C(=O)OC(C)(C)C)C1 2011938790 DEBNXFDEBDSSMH-OAHLLOKOSA-N 341.412 1.907 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(NCc2cc(F)ccc2O)C1 2016029010 JRQCIPCEIZMJCT-KRWDZBQOSA-N 340.395 1.993 10 10 EDCE CC(C)(C)OC(=O)N1CCC(Oc2ccc(N)cc2)(C(N)=O)CC1 2021592152 MAMCJFZBLSJRON-UHFFFAOYSA-N 335.404 1.903 10 10 EDCE CC[C@@H](CO)N(C)c1cc2c(cc1Br)[C@@H](NC)C(=O)N2 380809924 MQVJDURIOGHRIO-ISVAXAHUSA-N 342.237 1.869 10 10 EDCE NCc1ccc(N2CCCN(C3COC3)CC2)cc1Br 2169591857 BSWATNRPBZMQFY-UHFFFAOYSA-N 340.265 1.819 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC=C[C@@H]3CO)c(Br)cc21 2176343604 PZPSFHVEVYVFMF-AMIZOPFISA-N 338.205 1.399 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1908253674 YJJGWYFDYMQPAR-SDDRHHMPSA-N 339.396 1.685 10 10 EDCE C[C@H]1CN(Cc2cc(Br)ccc2O)[C@@H](C(=O)O)CO1 2109518396 MHKDBRGHSAHJKB-GZMMTYOYSA-N 330.178 1.829 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1C[C@@H](N)C[C@H](O)C1 2111819717 PEMADUPPJGVJIK-GMXVVIOVSA-N 329.238 2.000 10 10 EDCE COC[C@@H]1[C@@H](O)[C@H](O)CN1c1ccc([C@@H](C)O)cc1Br 2233867571 ZSKXPSZEDBDLNX-HKSFMPNISA-N 346.221 1.059 10 10 EDCE Cc1cc(Br)ccc1N1C(=O)NC(=O)C(=CNO)C1=O 2297534280 DFDUYVXPOBKCPF-UHFFFAOYSA-N 340.133 1.203 10 10 EDCE Cc1ccc(CNC(=O)[C@]23C[C@@H](N)[C@@H]2C3)c(O)c1Br 2352933430 YZTOZCHOGGGBEJ-IMSIIYSGSA-N 325.206 1.817 10 10 EDCE CC1(C)[C@H]2CC[C@@]1(C(=O)N1CCN(c3ccccc3)CC1)C(=O)C2=O 101103675 CQMOBTJQHAHMOR-YWZLYKJASA-N 340.423 1.910 10 10 EDCE COc1ccc(O)c(CNC(=O)Cn2cnc3ccccc3c2=O)c1 114543851 OWAUDGQHLUHJGD-UHFFFAOYSA-N 339.351 1.427 10 10 EDCE COCC(=O)NC1CN(C(=O)c2sccc2-n2c(C)ccc2C)C1 185288335 LWLDAMPDBRQDQI-UHFFFAOYSA-N 347.440 1.743 10 10 EDCE C[C@H](N[C@@H]1CCc2ncnn2C1)c1ccc(N2CCC(O)CC2)cc1 180580393 LDOBWXYEKVNUOW-GOEBONIOSA-N 341.459 1.905 10 10 EDCE COC[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H](C)O1 252016959 YHAASYDMQROMKC-YJBOKZPZSA-N 349.475 1.447 10 10 EDCE CN(C)CCNC(=O)C1CCN(Cc2cc3c(cc2O)OCO3)CC1 271185005 JCASSQVGAZAPRS-UHFFFAOYSA-N 349.431 1.011 10 10 EDCE Cc1ccc(CN(C)[C@]2(C(=O)O)CCNC2)c(O)c1Br 2380764986 JAEYSGCXAFGVGV-CQSZACIVSA-N 343.221 1.712 10 10 EDCE Cc1ccc(CN(C)C(=O)C2[C@@H]3CNC[C@@H]23)c(O)c1Br 2380791704 BKGHRZFBDXBVPF-GHMZBOCLSA-N 339.233 1.887 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)COC1CCC(N)CC1 649347721 UJQXFAQMAHHMQV-UHFFFAOYSA-N 333.432 1.765 10 10 EDCE C[C@H]1CC[C@H](NC(=O)N(C)Cc2ccccc2O)CS1(=O)=O 822005295 LFAWVOCRHDKZOO-AAEUAGOBSA-N 326.418 1.499 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NC[C@@H]1CC[C@H](O)C1 588576134 QCVWPAYWELRDNA-UCKVFGNKSA-N 330.428 1.814 10 10 EDCE CC[C@H](NCCS(=O)(=O)N=S(C)(C)=O)c1ccccc1O 903225544 IZVOALDBTSSXPG-LBPRGKRZSA-N 334.463 1.490 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@@H](C)C(C)C)C2)cc1 828490301 BBHQFCIKQXTGNS-HUUCEWRRSA-N 347.459 1.798 10 10 EDCE CCN(C)C(=O)[C@H](C)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588576431 BZQGZZKOWNIGOS-XMELGKRDSA-N 345.443 1.519 10 10 EDCE Cn1nccc1[C@@H]1COCCN1Cc1cc2c(cc1O)OC[C@@H]2O 844754958 HVYFUGOUXMNGCD-HOCLYGCPSA-N 331.372 1.125 10 10 EDCE CC(C)(NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(F)(F)F 854905097 IRSCVXSWJSZNIW-UHFFFAOYSA-N 340.323 1.834 10 10 EDCE C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cscn1 857553886 APCNJJOBUUHPBC-MRVPVSSYSA-N 341.414 1.711 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)C3(CO)CC3)C2)cc1 923183343 KSBVHLOXIFLBGE-ZIAGYGMSSA-N 333.432 1.734 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@H]2C)C1 750642726 QIRDRRYMJZEDJB-UNEWFSDZSA-N 344.459 1.870 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2OCCO[C@@H]2C(F)(F)F)c1 866765762 ZEERYPARKQJWNJ-WQHBLYJGSA-N 349.305 1.924 10 10 EDCE C[C@H]1COCC[C@@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 763192480 FJTQSWYILMAIRZ-YOEHRIQHSA-N 333.432 1.747 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCC1(O)Cc2ccccc2C1 779521345 TYWRDJLGRYHGLX-VURMDHGXSA-N 325.364 1.757 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1[C@H]2OCCC[C@@H]21 780325552 HIINCMMOZJXTQP-KURKYZTESA-N 330.428 1.907 10 10 EDCE C[C@@H](O)CN1CCN(Cc2cc(Br)cc(F)c2O)CC1 894000673 HMFNBRCIOLFUHW-SNVBAGLBSA-N 347.228 1.792 10 10 EDCE COc1cccc(CNC(=O)c2cc3c(nc2O)CCC[C@@H]3O)c1O 1137473311 FPSIMBOHTQUUEP-AWEZNQCLSA-N 344.367 1.801 10 10 EDCE CN1CCN(c2cc(Br)c(CN)cc2F)[C@H](CO)C1 699479337 QVYPXTUJGXBEIG-JTQLQIEISA-N 332.217 1.160 10 10 EDCE O=S1(=O)CC[C@H]2CN(Cc3cccc(Br)c3O)C[C@H]21 898085257 BLTSQKBRXAWTTQ-JOYOIKCWSA-N 346.246 1.774 10 10 EDCE CC1=C(C(=O)NCc2c(O)cccc2O)[C@@H](C)n2ncnc2N1C 1156885269 BPDSWDLWXAFJGE-SNVBAGLBSA-N 329.360 1.291 10 10 EDCE CC(=O)c1nn(C)cc1OCC(=O)NCc1ccc(N(C)C)cc1 1166970236 HKNUYQJSPBQNRI-UHFFFAOYSA-N 330.388 1.384 10 10 EDCE C[C@@H](CCNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@H]1CCOC1 1317418010 RTOMFAWXJNMZMN-QWHCGFSZSA-N 347.419 1.984 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@H]2C(=O)NC3)c(Br)c1 2115749745 YRYXQXHGTARCAW-FWDPORAESA-N 325.206 1.970 10 10 EDCE CCOc1ccc(N2CCN(C[C@@H](O)CC3(O)CCC3)CC2)cc1 1331351328 WSAMDHFKUPOURW-KRWDZBQOSA-N 334.460 1.873 10 10 EDCE C[C@@H](O)c1ccc(N2CCNC(=O)C23CC3)cc1Br 2132040621 OXQLWFNHUPFTLX-SECBINFHSA-N 325.206 1.971 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)CC(C)C)C2)cc1 1261700657 MCIFOBNPOVVKGA-CABCVRRESA-N 347.459 1.941 10 10 EDCE CCC(=O)N[C@H](C)C(=O)N[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1265540640 YJFPCOVBUUMTTN-BMFZPTHFSA-N 347.459 1.655 10 10 EDCE CCN(C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCCOC1 1349614552 PTFXNFNUOWYISL-KRWDZBQOSA-N 347.459 1.739 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)Cc2ccccc2)cc1C 1507201485 KFGHHOPBMRJSII-GOSISDBHSA-N 342.439 1.813 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)C2=CCCC2)cc(OC)n1 1280992852 AWAHUZAEGXUQOI-LBPRGKRZSA-N 347.415 1.786 10 10 EDCE C[C@H](CNC(=O)[C@@H]1CC12CC2)NC(=O)c1ccc(N=NC(N)=O)cc1 1284345525 YYEZLXYTEOBWNS-MFKMUULPSA-N 343.387 1.884 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)C[C@@H]2CO)c(Br)c1 2136087375 DHPXBKGOIBVMNE-JLLWLGSASA-N 329.238 1.791 10 10 EDCE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N(C)[C@@H](C)CC(N)=O 1611963267 LLSXORFVLNHBNE-ZDUSSCGKSA-N 344.463 1.709 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2cnn(C)n2)cc1C 1700773696 UCLZFDPPLORISS-CYBMUJFWSA-N 331.420 1.382 10 10 EDCE NCc1ccc(N2CCCN(CCO)CC2)cc1Br 228157474 WYCIBRANMWVNFZ-UHFFFAOYSA-N 328.254 1.412 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1cccc(-n2cnnn2)c1 1628666414 CPCZMGJLPAXAPC-UHFFFAOYSA-N 329.747 1.951 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN(CCCCCO)CC2)cc1 1634459353 FMCKMKJKOCXFDZ-UHFFFAOYSA-N 347.419 1.769 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CC(=O)N(c2ccccc2)C1 1567563648 ARGDTOIAOLNVOC-ZDUSSCGKSA-N 326.352 1.562 10 10 EDCE Cc1nnnn1-c1cc(NC(=O)c2cccc(O)c2O)ccc1F 1632283506 UTCZBWCIMGTLKO-UHFFFAOYSA-N 329.291 1.773 10 10 EDCE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N[C@@H](C)c1ccccc1O 1642830893 KVEYQWKBEOJWBE-NSHDSACASA-N 349.431 1.379 10 10 EDCE Oc1ccc(Br)cc1CN1[C@H]2CCNC[C@H]1COC2 2139769468 SMPGJCLDRLHSSQ-STQMWFEESA-N 327.222 1.717 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2c(C)ncn2C)cc1C 1699408742 AEWORCDKPYFHMW-ZDUSSCGKSA-N 330.432 1.954 10 10 EDCE COc1cc(O)c(CN2CCO[C@H](Cn3cc(C)cn3)C2)cc1OC 160183625 ORMPMXRJHGCJMA-HNNXBMFYSA-N 347.415 1.815 10 10 EDCE O=C1NCCN(C(=O)c2cc(O)c(O)c(O)c2)[C@@H]1c1ccccc1 1866303435 WVYSUSMOHWEOPV-CQSZACIVSA-N 328.324 1.117 10 10 EDCE CC1(CNCc2cccc(Br)c2O)CS(=O)(=O)C1 1967849224 GPPZTHGTTIMGAK-UHFFFAOYSA-N 334.235 1.679 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1COC[C@@H]1NCc1ccc(O)cc1O 1948516717 CEOSQICTCXLKSV-JSGCOSHPSA-N 338.404 1.727 10 10 EDCE CO[C@@H]1C[C@H](C(=O)O)N(Cc2cc(Br)cc(F)c2O)C1 1964721553 WKFGGBFBFXJPAM-MWLCHTKSSA-N 348.168 1.968 10 10 EDCE O=C(O)[C@@]1(O)CCCN(Cc2c(O)cccc2Br)C1 1891144378 DYJVCUKDMIOHGY-CYBMUJFWSA-N 330.178 1.566 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1[C@@H](O)[C@H](N)c1ccccc1O 2005036035 MVJXJZJHDRLRIJ-BPLDGKMQSA-N 338.404 1.389 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@H]1COC[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003167466 NWJFHFYGEXWHAK-LPWJVIDDSA-N 340.420 1.134 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CCO1 1990349012 XSRMXWZMFSYTQT-MNOVXSKESA-N 327.385 1.827 10 10 EDCE CN1CCc2cc([C@@H](N)[C@@](C)(O)CNC(=O)OC(C)(C)C)ccc21 1999526576 BRMXLPXATZRLGT-QAPCUYQASA-N 335.448 1.954 10 10 EDCE CC(C)(C)OC(=O)N1CCC(O)(C(=O)Nc2ccc(N)cc2)CC1 2020660128 BKZUJRMTBHSWQF-UHFFFAOYSA-N 335.404 1.969 10 10 EDCE CCN(c1ccc([C@H](C)N)c(Br)c1)[C@@H]1CC(=O)NC1=O 2171192593 KQTZDFOFMDZTBA-QPUJVOFHSA-N 340.221 1.710 10 10 EDCE CCNCc1ccc(N(C)CC(C)(CO)CO)cc1Br 689694685 DBPLLNCROYRHLB-UHFFFAOYSA-N 345.281 1.986 10 10 EDCE C[C@H](N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C(C)(C)O 394998303 IJIZYLQHZXNIHG-JVXZTZIISA-N 342.237 1.997 10 10 EDCE CN(C(=O)CN1CC[C@@H](NC(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2044602828 XYAQNNPWSXVZRV-CQSZACIVSA-N 348.447 1.831 10 10 EDCE C[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CN(C(=O)c2cccc(O)c2O)C1 2054419364 CKPUCZLILVOSIO-RKDXNWHRSA-N 346.305 1.627 10 10 EDCE O=C1NC[C@H]2CN(c3ccc(CO)cc3Br)CC[C@H]12 2100940129 FOJDIWUOUBUEFE-QWRGUYRKSA-N 325.206 1.514 10 10 EDCE COc1ccc(Br)c(CN[C@H](CO)CCCO)c1O 2208684003 MEMITCQPXNORLO-VIFPVBQESA-N 334.210 1.386 10 10 EDCE CC1(CNC(=O)C=Cc2ccc(N3CCOCC3)cc2)OCCO1 2303009681 PWDITYKXZGBACU-UHFFFAOYSA-N 332.400 1.416 10 10 EDCE CC(C)(C)OC(=O)N(CCCO)CCC(=O)N1CC[C@H](N=[N+]=[N-])C1 2303240692 OPRGGDCPBTUKJF-LBPRGKRZSA-N 341.412 1.907 10 10 EDCE Nc1ccc(NC(=O)Cn2cc(I)cn2)cc1 79903060 GNWFLNCMTDWHKH-UHFFFAOYSA-N 342.140 1.709 10 10 EDCE NCc1ccc(N2CCCN(CCCO)CC2)cc1Br 2366635744 ACKCKPDMGVAIID-UHFFFAOYSA-N 342.281 1.802 10 10 EDCE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@@H]2CNC(=O)C2)cc1 194698191 QHFZIWVRLBFKBF-DOTOQJQBSA-N 345.443 1.396 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N(C)c2ccc(Cl)nn2)c1 255911271 CTBRVBLJBZVBLN-UTCJRWHESA-N 331.763 1.561 10 10 EDCE CS(=O)(=O)NC[C@H]1CCC[C@H]1NCc1cc(Cl)ccc1O 800310107 SBTYUQXGAPRKDS-ZWNOBZJWSA-N 332.853 1.853 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H](Cc2cncs2)C(=O)O)cc1 908759017 WEUGEWLGYJNNJB-CQSZACIVSA-N 348.428 1.704 10 10 EDCE Cn1nccc1[C@@H]1COCCN1Cc1cc2c(cc1O)OC[C@H]2O 844754955 HVYFUGOUXMNGCD-GOEBONIOSA-N 331.372 1.125 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC(=O)N(C)[C@@H](C)C1 840482488 XNMQZMXVYGGNLD-GJZGRUSLSA-N 346.475 1.864 10 10 EDCE CC[C@H](NCC[C@@H]1CNCCS1(=O)=O)c1cccc(Cl)c1O 925788322 HNOVUACXWIQDEO-RISCZKNCSA-N 346.880 1.863 10 10 EDCE C[C@H]1CNCC[C@H]1NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 841987121 GGGRBHDOJPRLFK-MAUKXSAKSA-N 346.475 1.663 10 10 EDCE CCOC(=O)C1=CC[C@H](NC(=O)NCc2ccc(OC)cc2O)C1 858788826 ZOYLXBHKWGXAKV-ZDUSSCGKSA-N 334.372 1.852 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@]3(C)CCC(=O)N3)C2)cc1 852379502 RHRXNGMBJXTTKW-SCLBCKFNSA-N 346.431 1.242 10 10 EDCE 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1.394 10 10 EDCE Cc1ccc(CN2CCO[C@@H](C(=N)NO)C2)c(O)c1Br 2380678424 DYUCORJESAYICG-SNVBAGLBSA-N 344.209 1.620 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccccc1S(=O)(=O)C(F)(F)F 808503405 NXCGHCZGCXGKBI-UHFFFAOYSA-N 338.259 1.295 10 10 EDCE CSC[C@@H](NC(=O)NCc1ccc(N(C)C)cc1C)C(=O)O 909042721 INJMDOHTAVORTL-CYBMUJFWSA-N 325.434 1.676 10 10 EDCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ncc[nH]1 831560673 DYJIYAAGLDCHHO-UHFFFAOYSA-N 339.443 1.872 10 10 EDCE CCc1nc2n(n1)CCC[C@@H]2NC(=O)/C=C\c1ccc(O)c(O)c1 588407736 MDJXHGOHBWKVBW-VFFGBVLKSA-N 328.372 1.916 10 10 EDCE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C(=O)c1cc(O)cs1 749299718 YNRUYJCYTJNOJI-IQIPOGNMSA-N 339.369 1.019 10 10 EDCE COc1ccc(O)c(CNC(=O)NC[C@@H]2CN(C3CC3)C(=O)O2)c1 847317037 OLCWWPDWEYAAHE-CYBMUJFWSA-N 335.360 1.183 10 10 EDCE COc1ccc(N2CCN(CCNC(=N)NCC3CCC3)CC2)cc1 849067374 ZMLTYANOQWLQBI-UHFFFAOYSA-N 345.491 1.731 10 10 EDCE Nc1c(Cl)cc(N2C(=O)N[C@@H](CC3OCCO3)C2=O)cc1Cl 927217264 UJUGSYKUXKTNSY-VIFPVBQESA-N 346.170 1.763 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)N[C@@H](CSC)C3=O)C2)cc1 924981465 ZPSKIJDQUSIRCY-JSGCOSHPSA-N 335.429 1.557 10 10 EDCE CCOC(=O)[C@H](CSC)NC(=O)/C=C\c1ccc(O)c(O)c1 928294106 VSBBEDOWJDRGLY-XOIDGJRKSA-N 325.386 1.522 10 10 EDCE Cc1cc(CC(=O)N[C@]2(C(N)=O)CCOC2)c(C)n1-c1ccccc1 855054137 ZFGZQPIGHVKMIA-LJQANCHMSA-N 341.411 1.397 10 10 EDCE O=[N+]([O-])c1cc(CN2CCOC3(CNC3)C2)ccc1N1CCCCC1 853249662 SWBMTLLLWWELPG-UHFFFAOYSA-N 346.431 1.759 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)[C@H]3CCC(=O)N3)C2)cc1 862158612 IWSDKRLVBPSCPN-HEHGZKQESA-N 331.416 1.305 10 10 EDCE CCO[C@@]1(C)C[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 862862824 QNBAAMLEGFFHJM-OCCSQVGLSA-N 328.390 1.061 10 10 EDCE C[C@H](NC(=S)NCCN1CCOCC1)c1ccc(N(C)C)cc1 774250461 NKLKAMMCFQQHJL-AWEZNQCLSA-N 336.505 1.610 10 10 EDCE CC[C@H](CO)N1CCN(Cc2ccc(N3CCN(C)CC3)cc2)CC1 775723544 BFYCNLRTDNPPBN-LJQANCHMSA-N 346.519 1.327 10 10 EDCE Cc1cc(Cl)cc(CN2CCC(NS(C)(=O)=O)CC2)c1O 775645255 IBPYBRPWZCAQGO-UHFFFAOYSA-N 332.853 1.868 10 10 EDCE 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COC(=O)NCCCNCc1c(Br)ccc(OC)c1O 1875636907 DCLRXACDRQNZBX-UHFFFAOYSA-N 347.209 1.999 10 10 EDCE O=C(N[C@@H](C(=O)O)c1cc(O)c(O)c(O)c1)OCc1ccccc1 1951380941 FCTKZTCPZJUSIX-CYBMUJFWSA-N 333.296 1.856 10 10 EDCE COC[C@@H](N)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951834172 SKJZUWAZEBCXGB-VXGBXAGGSA-N 326.393 1.507 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](CN)C(=O)O 1951828634 DQNXNIJQEJECLD-WDEREUQCSA-N 340.376 1.193 10 10 EDCE CCCNCc1ccc(N2C[C@H](O)C[C@@H]2CO)cc1Br 698194820 BBDOYBFISDNRMS-ZIAGYGMSSA-N 343.265 1.881 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](CNCc2ccc(O)c(O)c2)C1 397477987 YFELICDPVGSJIU-ZDUSSCGKSA-N 338.404 1.823 10 10 EDCE C[C@H](O)CN1CCCN(c2ccc(CO)c(Br)c2)CC1 2176853559 JAERHGKPKSSAGG-LBPRGKRZSA-N 343.265 1.834 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)cc1Br 2182553209 KPPRLZPSHLZPNP-BVDPADPGSA-N 341.249 1.647 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(CNC(=O)Cc2ccc(N)cc2)CCOC1 2044213054 QFBFWCAHLQTKQM-GOSISDBHSA-N 349.431 1.611 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 2080576711 BKSJBDLMFPHOLJ-GJZGRUSLSA-N 349.431 1.598 10 10 EDCE CN1CCO[C@H]2CN(Cc3ccc(Br)cc3O)C[C@H]21 2097750567 JLDQDVFMZWMZDQ-OCCSQVGLSA-N 327.222 1.670 10 10 EDCE COc1ccc(Br)c(CN2C[C@H]3CNC[C@H]2C3)c1O 2227743835 ZBHUDQLTKBYYMZ-NXEZZACHSA-N 327.222 1.957 10 10 EDCE CN(C)CCNC(=O)c1ccc(C=C2SC(=S)N(C)C2=O)cc1 2297480163 XXPGQULOAIRXBR-UHFFFAOYSA-N 349.481 1.809 10 10 EDCE CN(C[C@H]1CCO1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2341206177 DAYNBHQRTROUAE-KRTXAFLBSA-N 326.194 1.626 10 10 EDCE O=C(O)[C@H]1CO[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@@H]21 2354477032 NTAAJOKAOVCWDP-NTZNESFSSA-N 342.189 1.686 10 10 EDCE CCN1CC[C@H](CNC(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 108781542 ZHNZPHURDNWIOD-KRZKXXONSA-N 343.471 1.994 10 10 EDCE Cc1ccc(/C=C2\C(=N)N3N=C(N4CCOCC4)SC3=NC2=O)o1 20356654 SNUDVDBPSMKXRI-AHCHECIRSA-N 345.384 1.497 10 10 EDCE CN(C)C[C@@H]1COCCN1Cc1c(O)cccc1Br 1140103694 SFJXDLPSRCCKJA-LLVKDONJSA-N 329.238 1.917 10 10 EDCE CN1C[C@@H](NC(=O)NCc2ccc3c(c2)CCCN3C)CCC1=O 128808131 PTCODNPQMVZHQU-HNNXBMFYSA-N 330.432 1.489 10 10 EDCE COc1ccccc1[C@@H]1CNCCN1C(=O)Cc1ccc(N)cc1 262061534 VZBLTQINAWCYLA-KRWDZBQOSA-N 325.412 1.993 10 10 EDCE Cc1ccc(CN=c2[nH]nc3n2CCOC3)c(O)c1Br 2381146470 LTDMVTJAAAQPKJ-UHFFFAOYSA-N 339.193 1.619 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@]1(C)CCC(=O)NC1 281401128 YQFGZKXHJAXWFV-LJQANCHMSA-N 345.443 1.398 10 10 EDCE Cc1ccc(CN(C)C(=O)COC[C@H](C)N)c(O)c1Br 2380766644 SHMBHPUABJWOCJ-JTQLQIEISA-N 345.237 1.785 10 10 EDCE Cc1ccc(CN[C@H]2CCC(=O)N(C)C2=O)c(O)c1Br 2380794859 FSBVUNFKTYHIHO-JTQLQIEISA-N 341.205 1.700 10 10 EDCE CN(CCCO)C(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 297734531 FBASQNQMBWKRTL-UHFFFAOYSA-N 348.443 1.894 10 10 EDCE Cc1c([C@@H](O)[C@H](N)c2ccccc2O)c(Br)nn1C 2131551839 LZIUDCYNUOYHPX-VXGBXAGGSA-N 326.194 1.930 10 10 EDCE COCCn1c(-c2cn(C)nn2)nnc1N(C)Cc1ccccc1O 828986665 XALBEQCWKNGHQY-UHFFFAOYSA-N 343.391 1.062 10 10 EDCE O=c1cc(/C=C/c2ccc(N3CCC(O)CC3)cc2)nc2nc[nH]n12 905070818 NVZWRHHRXFMHQQ-DAFODLJHSA-N 337.383 1.549 10 10 EDCE CN(C)CCn1nccc1C(=O)NCc1ccc2cccnc2c1O 911262618 QXEMGGYYHQXTOP-UHFFFAOYSA-N 339.399 1.629 10 10 EDCE Cc1cc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)nn1C 919586911 FYCZLRJQKCMRPK-UHFFFAOYSA-N 344.415 1.610 10 10 EDCE CN1CCCc2cc(CNC(=O)NCC[C@@H]3CNC(=O)C3)ccc21 915390852 SLAMIKPNKDCZSE-AWEZNQCLSA-N 330.432 1.394 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCNC[C@@H]2C)cc1 846172418 MFELBAFNDAYAQZ-YOEHRIQHSA-N 334.464 1.771 10 10 EDCE C[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)[C@H](C)CN1CCO 841892263 WAFZTDDVVJJSLS-IAGOWNOFSA-N 333.476 1.410 10 10 EDCE Cc1ccc(O)c(CNC(=O)NC[C@H](C)N2C[C@H](C)O[C@H](C)C2)c1 858590838 RWHQALVXGGKTHP-SOUVJXGZSA-N 335.448 1.998 10 10 EDCE CCn1ncnc1CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852296995 DDQPNCZYMMOLNM-CYBMUJFWSA-N 344.419 1.385 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCCN(C(N)=O)C3)C2)cc1 855229275 LZABGCUNEYFIQE-UONOGXRCSA-N 346.431 1.181 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@@H]1CC[C@H](CN2CCOCC2)O1 934705432 OTIGQMYJHRVFPX-WBVHZDCISA-N 334.416 1.230 10 10 EDCE C[C@@H](NC[C@]12COCCN1C(=O)OC2)c1cc(F)cc(F)c1O 866522233 UGBSFOLAYSZMGC-RFAUZJTJSA-N 328.315 1.542 10 10 EDCE CCN(Cc1cn(C)nn1)C(=O)NCc1ccc(N(C)C)cc1C 781939645 JYOWYBLGUUBQEU-UHFFFAOYSA-N 330.436 1.921 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@]4(CNC(=O)C4)C3)cc2)CC1 789767742 JLGQBXLXIQPZTM-IBGZPJMESA-N 328.460 1.150 10 10 EDCE CN1CCN(C)CC(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)C1 1136025418 JSOKEXKASFAZRO-UHFFFAOYSA-N 344.503 1.739 10 10 EDCE CN(CCCC(=O)NCc1ccc(O)c(O)c1)C(=O)c1ccncc1 1150376764 CNJBCZJOLIRLII-UHFFFAOYSA-N 343.383 1.661 10 10 EDCE O=S1(=O)C[C@H]2[C@H](CNCc3cc(Br)ccc3O)[C@H]2C1 2117983880 ZHPNTEWEVVHRLI-CNDDSTCGSA-N 346.246 1.535 10 10 EDCE CCN(CCCNC(=O)c1ccc(N=NC(N)=O)cc1)CC(=O)NC 1316910543 APFRSCVBYNUGNH-UHFFFAOYSA-N 348.407 1.037 10 10 EDCE C[C@H](CNCC[C@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1321760620 UDGQKGFAJQJVNM-OLZOCXBDSA-N 347.419 1.984 10 10 EDCE CO[C@@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1335546076 FUKWRICWNRKRKX-HUUCEWRRSA-N 337.395 1.144 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@H](c3cnccn3)C2)cc1 1198163930 AYWWGMXBLYBZSN-INIZCTEOSA-N 339.443 1.648 10 10 EDCE CCCC(=O)NC[C@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1610940388 YGLYPSVDTCFVJA-CQSZACIVSA-N 334.416 1.795 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)C(C)(C)NC(C)=O)C2)cc1C 1714010556 OOZWNPNFXBHFPE-IYBDPMFKSA-N 347.459 1.655 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnc2[nH]c(O)nc2c1 1627028171 DURMWAMDKXZJIN-UHFFFAOYSA-N 333.344 1.785 10 10 EDCE CC(C)[C@@H](O)CCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1565126681 BUTDJOGGNJMUPQ-SFHVURJKSA-N 349.475 1.854 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)C(=O)NCC2CC2)cc1C 1497299092 HEYBDFREXWSNMS-AWEZNQCLSA-N 347.459 1.514 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1C=CS(=O)(=O)C1 1632681977 YUMPBIIJOGQPOE-CMPLNLGQSA-N 325.386 1.093 10 10 EDCE CO[C@H](C)C(=O)NC/C=C/CNC(=O)c1ccc(N=NC(N)=O)cc1 1721805119 DAJGGPWZZPKAEW-IMZGKNILSA-N 347.375 1.286 10 10 EDCE COCCC(=O)N[C@@H](C)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1734693163 ZXEOURRNHHNJQX-WDEREUQCSA-N 349.391 1.509 10 10 EDCE CCC(=O)N[C@@H](C)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1678595845 GTXHUBCTQWBXRZ-JTQLQIEISA-N 331.376 1.836 10 10 EDCE C[C@H]1[C@@H](O)CCN1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1685682268 XDYNKZIKHFGTKH-XKQJLSEDSA-N 334.464 1.520 10 10 EDCE CCN[C@H](C)c1ccc(N2CC(=O)NC(=O)C2)cc1Br 233632125 ZNUUZTOADIDCBC-SECBINFHSA-N 340.221 1.582 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)NCC1(CN=[N+]=[N-])CC1 1985103199 RMNBIFQNZYBGMS-VHSXEESVSA-N 327.385 1.467 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)N1CC[C@H](N=[N+]=[N-])C1 1985101257 PTHVEMXCZVWVJY-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1 1985101471 SVTMTIPUAVPCJX-LLVKDONJSA-N 327.385 1.781 10 10 EDCE CN(C)c1ccc(CN[C@H](CNC(=O)OC(C)(C)C)C(=O)O)cc1 2022034003 PKKTZXRXGBYLEV-CQSZACIVSA-N 337.420 1.820 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(N)cc1 2022840846 QWVVFZXDGVZPPX-RISCZKNCSA-N 337.420 1.501 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4CCO[C@H]4C3)c(Br)cc2[C@@H]1O 2172075447 ZXMMFEHJEXIZJA-PAWXDDDFSA-N 339.189 1.660 10 10 EDCE CS(=O)(=O)N1CC[C@@H](Nc2c(N)cccc2Br)C1 697448493 VJAIADHTOHQKRL-MRVPVSSYSA-N 334.239 1.477 10 10 EDCE OCc1ccc(N2C[C@@H](O)[C@@H](O)CC23CCC3)cc1Br 2169919838 DUGDSTPTLCZEKH-UONOGXRCSA-N 342.233 1.796 10 10 EDCE O=C(O)[C@@H]1C[C@@H](O)CN(Cc2cc(Br)cc(F)c2O)C1 2201044921 OETCTADGXDJRAJ-PSASIEDQSA-N 348.168 1.561 10 10 EDCE CN=c1cccc(S(=O)(=O)NCc2cnc(SC)s2)[nH]1 2284691046 RWRNIJFCWLHLQG-UHFFFAOYSA-N 330.460 1.202 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1CCOC2(CNC2)C1 2272929756 JUOUZRRZQIVBPQ-UHFFFAOYSA-N 347.640 1.982 10 10 EDCE CCN(CC)C(=O)[C@@H]1CCCN1C(=O)C=Cc1ccc(O)c(O)c1 2308001115 ARKSGJCYGOWIQA-AWEZNQCLSA-N 332.400 1.970 10 10 EDCE CC1CCN(c2ccc(CNC(=O)CN3CC(=O)NC3=O)cc2)CC1 111617678 WRSGFEQCQHSOHS-UHFFFAOYSA-N 344.415 1.091 10 10 EDCE COc1ccc(CN2CCN(CC(=O)N3CCCC3)CC2)c(O)c1 119654805 XJDAEXZGSCIFTF-UHFFFAOYSA-N 333.432 1.141 10 10 EDCE NCc1ccc(N2C[C@@H](C(N)=O)C3(CC3)C2)c(F)c1Br 2370345497 IFRHNPJZGGUVMP-VIFPVBQESA-N 342.212 1.749 10 10 EDCE N[C@H](CO)c1cc(O)c(O)c(Br)c1Br 238566190 ZMVJCBSILFLXNL-SCSAIBSYSA-N 326.972 1.615 10 10 EDCE C[C@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)c1nc[nH]n1 255773331 MUQIMPPXLULZPO-IRBQFCFKSA-N 327.388 1.532 10 10 EDCE CN1C(=O)C[C@@H](C(=O)NCc2ccccc2O)[C@H]1c1cccnc1 265393090 DUOTUBVOJPBFCI-RHSMWYFYSA-N 325.368 1.623 10 10 EDCE COc1cccc(CNC(=O)NC2CCN(C(=O)C(C)C)CC2)c1O 266246252 VVJUIXVNORIPRC-UHFFFAOYSA-N 349.431 1.847 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3C)C2)c1 361899052 GBOWTQCWLOWENE-SUHUHFCYSA-N 333.388 1.209 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CCOCCN2)c(O)c1Br 2380755401 APTPGZKGEYENCA-NSHDSACASA-N 343.221 1.458 10 10 EDCE CC(=O)C(=O)COC(=O)/C=C/c1ccc(I)o1 808487598 OIDOGGCORCRRSA-HWKANZROSA-N 348.092 1.599 10 10 EDCE COc1ccc(SCCC(=O)OCC(=O)C(C)=O)cc1OC 808543977 JAKFLYRJZQJROK-UHFFFAOYSA-N 326.370 1.887 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@]12C[C@H]3C[C@H](C(=O)N1)[C@H]2C3 649789133 MUBCRPNWVCWPPI-IDTLQRJASA-N 341.411 1.393 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@H](CN4CCCC4)C3)cc2N1 814852885 SQYCNUZKCGENAQ-LBPRGKRZSA-N 346.387 1.848 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H](O)C3CCC3)cc2)C1 825373113 CTURETQQBAQMKG-RDJZCZTQSA-N 345.443 1.166 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NOCCOC(C)C)C2)cc1 852350026 OMYBSWGIPIGFEJ-AWEZNQCLSA-N 337.420 1.930 10 10 EDCE Cn1nccc1CCC(=O)NCc1ccc(N2CCC(O)CC2)cc1 856213057 VODNXIHVOWWHOK-UHFFFAOYSA-N 342.443 1.630 10 10 EDCE CC1CCN(c2ccc(CNC(=O)N[C@H]3CCNC3=O)cc2)CC1 852078541 DCEFVCMHSLNEET-INIZCTEOSA-N 330.432 1.611 10 10 EDCE COC(=O)C1(C(=O)OCC(=O)c2ccc(O)c(O)c2)CC2(CCC2)C1 850277368 CEMRAMBFQVTZIZ-UHFFFAOYSA-N 348.351 1.947 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)C[C@@H](O)C3CC3)C2)cc1 854300505 UVYMOUPYLAIDGQ-RHSMWYFYSA-N 333.432 1.686 10 10 EDCE COc1ccc(N2CCN(C(=O)CC[C@@]3(C)CCC(=O)N3)CC2)cc1 753375753 ACXYBPIMBCJYRP-LJQANCHMSA-N 345.443 1.793 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCOCC(F)F)C2)cc1 852275635 ZHAHCRHMZXUTPC-LBPRGKRZSA-N 343.374 1.855 10 10 EDCE COC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2ccccc2O)cn1C 867834376 NFTOETJTKQLXLR-JTQLQIEISA-N 338.385 1.557 10 10 EDCE C[C@@H](NCC1(N)CCOCC1)c1ccc(N2CCOCC2)c(F)c1 863540086 ADOVRNLAWZQZFP-CQSZACIVSA-N 337.439 1.821 10 10 EDCE COC[C@H](C)OC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 866564085 VPHYVXVWFSNSQQ-DZGCQCFKSA-N 349.431 1.649 10 10 EDCE CN1CCN(c2ccc(CN(CC(=O)O)CC3CC3)cc2F)CC1 1118296653 STQSCBGVKXFIJA-UHFFFAOYSA-N 335.423 1.874 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)c2cccn(C3CC3)c2=O)cc1 870932745 IWAKGXVKTVPVSG-QGZVFWFLSA-N 340.427 1.679 10 10 EDCE CC(C)n1cc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)cn1 776434644 HXJKBRJGRFWNJG-UHFFFAOYSA-N 325.346 1.669 10 10 EDCE CN(Cc1c(O)cccc1Br)[C@]1(C(=O)O)CCOC1 706647210 JXJMAGBOMBBZAB-CYBMUJFWSA-N 330.178 1.830 10 10 EDCE CCN(C(=O)C1=CC=CN2CCS(=O)(=O)N=C12)c1ncccc1C 798553952 IDZJKRALFFDTGY-UHFFFAOYSA-N 346.412 1.241 10 10 EDCE N[C@@H]1CN(Cc2cc(Cl)cc(Br)c2O)CC[C@@H]1CO 2122343791 CQRSRTIUIRKHHN-PRHODGIISA-N 349.656 1.950 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccccn2)cc1C 1331662195 GENXLHNOEPNUMH-OAHLLOKOSA-N 329.400 1.279 10 10 EDCE CC(C)CO[C@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332023133 JBTFDQRTUKRNGT-AWEZNQCLSA-N 332.400 1.508 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ncc(Br)cc1O 1472064223 XKXLGYCCWYSBDE-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)Cc2cccnc2)cc1C 1482722187 OMQSICMYWLEARQ-QGZVFWFLSA-N 343.427 1.208 10 10 EDCE Cc1ccc(C(=O)Nc2ccccc2O[C@@H]2CC(=O)N2)c(O)c1O 1557105699 ZIWQHAIQLYSCOX-CQSZACIVSA-N 328.324 1.883 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1csnn1 1480600579 BKEDKTHRVGIJQV-SECBINFHSA-N 347.404 1.609 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H]2CCNC2=O)cc1C 1723091787 HVGVUQIGIPKNOK-HNNXBMFYSA-N 333.432 1.078 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCCN(C(=O)C1CCC1)C1CC1 1633495083 KRXSKNPUFDZHGT-UHFFFAOYSA-N 346.427 1.938 10 10 EDCE C[C@@H](NC(=O)c1ccc2c(c1)NC(=O)CNC2=O)c1ccccc1O 1648889707 IMJZIWVVQXOYKE-SNVBAGLBSA-N 339.351 1.565 10 10 EDCE O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCc1ccc(O)cc1O 1643101070 URLOHHLGHMCCSZ-ZIAGYGMSSA-N 346.383 1.279 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@H]2CCCC(=O)N2C)cc1C 1669458488 YMZADMBUTBYMIJ-ZBFHGGJFSA-N 347.459 1.609 10 10 EDCE COc1ccc(CNC[C@@H]2CCCC[C@@H]2NC(=O)CC(N)=O)cc1C 1669950625 WOHWMAPQIBOEIA-HOTGVXAUSA-N 347.459 1.644 10 10 EDCE CC[C@H](CNC(=O)[C@H](C)OC)NC(=O)c1ccc(N=NC(N)=O)cc1 1759302530 KBDYZXWLSUMZHY-CMPLNLGQSA-N 349.391 1.509 10 10 EDCE COC(=O)CCN1C(=O)/C(=C2\C(=O)Nc3ccccc32)SC1=S 206830181 QCGJFLPJNDJBLG-VAWYXSNFSA-N 348.405 1.773 10 10 EDCE CNC(=O)c1ccc(OC)c(S(=O)(=O)Nc2ccc(O)cc2)c1 1871337748 UXKBQKYGKLRHRK-UHFFFAOYSA-N 336.369 1.561 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](OCC(N)=O)C2)c(Br)c1 2145370951 JNYOIOPDXRJZBI-GXSJLCMTSA-N 343.221 1.583 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1CO[C@@H](CNC(=O)OC(C)(C)C)C1 1985094445 OYUZVIMVXMQDEM-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NCc2cc(F)ccc2O)C1 1985830839 ZMUWYOPUENCQAX-JSGCOSHPSA-N 326.368 1.601 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010406552 WBAWYSUINSHBQC-TUAOUCFPSA-N 341.412 1.809 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@@](O)(C(N)=O)C2)c(Br)c1 312780809 NFJJDWPAPFIGFA-OTYXRUKQSA-N 342.237 1.156 10 10 EDCE CN1CC[C@@H](N(C)c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 380692161 FLYCFVITKGDNSF-AMIZOPFISA-N 339.237 1.541 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@@](O)(C(N)=O)C2)cc1Br 383542653 DZUVXINIIPCPMI-XPTSAGLGSA-N 342.237 1.285 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@H](CO)C2)c(Br)c1 396893961 WZCVZYRNFDLKHQ-SWLSCSKDSA-N 343.265 1.738 10 10 EDCE CCn1nnc(Br)c1[C@H](O)[C@H](N)c1ccccc1O 2100283463 VWFVVTJVUQXUFT-MWLCHTKSSA-N 327.182 1.500 10 10 EDCE COc1ccc(N2CCNC[C@H](O)C2)c(OC)c1Br 2106347437 XGMUOCVLLUSMDS-VIFPVBQESA-N 331.210 1.237 10 10 EDCE C[C@H](O)c1ccc(N2CC(=O)N[C@H]3CC[C@H]32)c(Br)c1 2112061625 MKSBVZIASRNGMW-LJUAHTATSA-N 325.206 1.970 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1nnc(Br)s1 2218860357 WUEZRASGOBVPIG-UHFFFAOYSA-N 330.163 1.893 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3COC[C@@]3(CO)C2)c(Br)c1 2234565801 ILQNWDVJPSZQPC-WBIUFABUSA-N 342.233 1.948 10 10 EDCE CCCC[C@@H](CC)COCCCNC=C1C(=O)NC(=O)N(C)C1=O 2296565768 VMUVSQZZGKOPIM-CYBMUJFWSA-N 339.436 1.791 10 10 EDCE O=C(N[C@@H](CCO)COCc1ccccc1)c1cc(O)c(O)c(O)c1 2320378339 RQLYPAZFNBSIIC-AWEZNQCLSA-N 347.367 1.501 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2329326247 NDGLWLGBOQPOSX-UUGWQDNISA-N 327.222 1.399 10 10 EDCE C[C@H](NC(=O)/C=C/c1ccc(N2CCOCC2)cc1)C(=O)N(C)C 171981414 DPTOBASRACWFDL-MRZGDXHCSA-N 331.416 1.129 10 10 EDCE COC(=O)C1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 324493524 MFIZBLZPQDTWQA-UHFFFAOYSA-N 335.316 1.315 10 10 EDCE CN1CCCc2cc(/C=C\C(=O)NCCN3CCOCC3)ccc21 96400950 WLFIUGKMEGEAGC-ALCCZGGFSA-N 329.444 1.531 10 10 EDCE CC(=O)C(=O)COC(=O)c1cnn(-c2ccccn2)c1C(F)(F)F 808503730 UIGGUFABACFORF-UHFFFAOYSA-N 341.245 1.601 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)Cc3cncnc3)C2)cc1 819587011 CJRKUPJPTUNKER-CQSZACIVSA-N 326.400 1.670 10 10 EDCE O=[N+]([O-])c1cc(NS(=O)(=O)c2cnn3c2OCCC3)ccc1O 821197568 DMODEFOHRJUVJS-UHFFFAOYSA-N 340.317 1.080 10 10 EDCE O=C1NCc2ccc(NS(=O)(=O)c3cc(F)cc(F)c3O)cc21 821169130 RJSHOANKCVPOIH-UHFFFAOYSA-N 340.307 1.715 10 10 EDCE COC(=O)C1CC2(C1)CN(Cc1cc(OC)ccc1O)C[C@@H]2C(=O)O 903695380 WKUAFJHKNARWII-HZEYSBKDSA-N 349.383 1.487 10 10 EDCE Nc1ccc(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)cc1 832140643 RVFKDMMMHLWUJJ-UHFFFAOYSA-N 344.390 1.498 10 10 EDCE C[C@H]1[C@@H](C)O[C@H](C)CN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 839387272 JJSGKJXKUVCNPS-QLFBSQMISA-N 347.459 1.735 10 10 EDCE CC(C)(CCN1CCOCC1)NC(=O)/C=C/c1ccc(O)c(O)c1 912951828 NLDNGGNXUKAOEU-GQCTYLIASA-N 334.416 1.728 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC(Cn3cnnc3)CC2)cc1 844775434 LZLRGCURRBBWLK-UHFFFAOYSA-N 342.447 1.966 10 10 EDCE Cc1ccc(O)c(CNC(=O)NC2C[C@@H]3CC[C@H](C2)S3(=O)=O)c1 927323093 LJCHEGYMOQQHLT-AGUYFDCRSA-N 338.429 1.608 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1nn(C)cc1C 850423273 RWUFTVJSJFOPGE-UHFFFAOYSA-N 330.388 1.811 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CCN(C)[C@H]3C)C2)cc1 922950291 HEOXYNJQEOFYAT-DAYGRLMNSA-N 346.475 1.913 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3C[C@]34CCCNC4)C2)cc1 851639096 AWGRDEYUGWFERJ-YJLNNSPDSA-N 329.444 1.780 10 10 EDCE COc1nccnc1CNCc1ccc(N2CCC(O)CC2)cc1 850406621 NIXWVEFIOURGHW-UHFFFAOYSA-N 328.416 1.736 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC(=O)N(C)C[C@@H]3C)C2)cc1 852451162 FFGIMQNVMQXMNY-UONOGXRCSA-N 346.431 1.146 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCNC[C@H]3C)C2)cc1 851664417 ZDUGFKHKDYZZLJ-JKIFEVAISA-N 332.448 1.571 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC34CC(CN3)C4)C2)cc1 851676342 ILSUGQPSACAHOK-FVRSWCFKSA-N 330.432 1.325 10 10 EDCE Cc1ccccc1NC(=S)NNc1nc(O)c2cnn(C)c2n1 769794812 POKNAIIQURACNS-UHFFFAOYSA-N 329.389 1.691 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)C(C)(C)CN1CCOCC1 935944895 CDBXBNJFXNNQNB-UHFFFAOYSA-N 341.448 1.853 10 10 EDCE NC(=O)CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 761981056 MFHQEPXGNWCXAZ-GFCCVEGCSA-N 325.796 1.002 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)C[C@@H](C)O)c(Br)cc21 92775753 ZZBBAOKWJVGYBZ-KRTXAFLBSA-N 328.210 1.479 10 10 EDCE CO[C@@H]1CC[C@@H]1N(C)C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1262270443 WOTGSHGAZYAYFN-VBNZEHGJSA-N 333.432 1.566 10 10 EDCE N[C@H]1CC[C@H](C(=O)O)N(Cc2cc(Br)ccc2O)C1 2132271809 AFXNHDKEVHWSME-WDEREUQCSA-N 329.194 1.531 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3[C@H]4CCC[C@H]43)C2)cc1 1347617593 SSYFZKRLDJFDFP-KKBVYLPWSA-N 343.427 1.305 10 10 EDCE C[C@H](c1c(O)cccc1O)N(Cc1ccccc1)CC1(O)CNC1 1915510588 PUOGSSMPNZYWBR-CQSZACIVSA-N 328.412 1.995 10 10 EDCE COCCCC(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1284205687 DPUQCWZMFSVZEW-NSHDSACASA-N 349.391 1.510 10 10 EDCE Cc1cc(C(=O)N[C@H](C)c2ccccc2O)ccc1S(N)(=O)=O 1471196277 XDKPQKDMZMBDNV-LLVKDONJSA-N 334.397 1.839 10 10 EDCE COCCn1cc(C(=O)NCc2ccc(O)cc2O)c(=O)cc1C 1626838280 VCUHCVISCAVGLR-UHFFFAOYSA-N 332.356 1.144 10 10 EDCE CN1C(=O)c2ccc(C(=O)NCc3c(O)cccc3F)cc2C1=O 1558456442 XXZYFRBBSJQSGY-UHFFFAOYSA-N 328.299 1.687 10 10 EDCE Cc1cc(C(=O)NCc2ccc(O)cc2O)ccc1N1CCNC1=O 1626838389 ZXSSIPDDBOVXFT-UHFFFAOYSA-N 341.367 1.866 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)Cc2nonc2C)cc1C 1485210082 NEAVBSMLCZFWSX-CHWSQXEVSA-N 346.431 1.921 10 10 EDCE COC(=O)c1ncoc1COCC(=O)N[C@@H](C)c1ccccc1O 1557968382 IFYZCHSQOODDSJ-JTQLQIEISA-N 334.328 1.561 10 10 EDCE CC[C@@H](CNC(=O)c1nonc1C)NCc1ccc(OC)c(C)c1 1495117881 MYZCYKHJMBHLSK-AWEZNQCLSA-N 332.404 1.993 10 10 EDCE CNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/c1ccc(O)c(O)c1 1632897561 UGBOWCGQOOBDQW-HQPKTYMTSA-N 340.379 1.585 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(OC[C@@H]2CCCO2)CC1 1632259325 BSVOPSHSDASZNS-HNNXBMFYSA-N 335.400 1.827 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)[C@H](C)NC(N)=O)C2CC2)cc1C 1569300888 CSYLUYCQAUROFK-WFASDCNBSA-N 348.447 1.045 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC[C@H]2C(=O)OC)c([N+](=O)[O-])c1 1772930809 KSJIVZSOROGVQR-CFNZNRNTSA-N 334.328 1.923 10 10 EDCE C[C@@]1(O)CCN(c2ccc(CO)c(Br)c2)C[C@@]1(C)O 1880703327 NUJPOFUMYOLTHB-ZIAGYGMSSA-N 330.222 1.654 10 10 EDCE COc1ccc(Br)c(CNCC(=O)N2CCCC2)c1O 1968481157 HHZISLDBSBHQJQ-UHFFFAOYSA-N 343.221 1.875 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@H]2[C@@H](O)CO)cc1Br 2146335823 ZNSWPFXGXQAXPV-HERUPUMHSA-N 345.237 1.027 10 10 EDCE Nc1ccc(CN=c2[nH]ccnc2I)cc1 1982389704 WQXTXTZMDWBTBT-UHFFFAOYSA-N 326.141 1.697 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)c(Br)c2F)[C@@H]2COC[C@@H]12 2158361610 JODOSNFQQSJEND-YUSALJHKSA-N 345.212 1.897 10 10 EDCE CO[C@H]1C[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)C1 2010391604 AEFYVMHOJGNKNQ-SDDRHHMPSA-N 339.396 1.922 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C[C@@H](O)C1 2010405072 FYZSDGRZGZWNKZ-QJPTWQEYSA-N 339.396 1.516 10 10 EDCE C[C@@H]1CC[C@H]([C@H](NC(=O)OC(C)(C)C)C(=O)N2CC(N=[N+]=[N-])C2)O1 2010401064 ANEWESQPEGINJH-JLLWLGSASA-N 339.396 1.968 10 10 EDCE C[C@H](N[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)c1ccc(O)cc1O 2011487350 LHBOXNMMJNPQHP-XEGUGMAKSA-N 338.404 1.729 10 10 EDCE CCOC(=O)[C@H](CCC(=O)C=S(C)(C)=O)NC(=O)OC(C)(C)C 2037850416 PINWUJKIARKCEK-LBPRGKRZSA-N 349.449 1.138 10 10 EDCE CNCc1ccc(N2CCNC(=O)C[C@H]2C)c(Br)c1 707627214 QUWLIEVXJMHARF-SNVBAGLBSA-N 326.238 1.883 10 10 EDCE COC(=O)C1(O)CN(c2ccc([C@@H](C)N)cc2Br)C1 714428412 XHOGMSQYSCJWIR-MRVPVSSYSA-N 329.194 1.193 10 10 EDCE CC[C@@]1(NCc2cc(Br)ccc2O)CCC(=O)NC1=O 2182520245 LFBVBUBAZURAIA-CQSZACIVSA-N 341.205 1.830 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(CC(=O)Nc3ccc(N)cc3)C[C@@H]21 2045667102 YZCNSZPDSVHWMI-FOLVSLTJSA-N 346.431 1.662 10 10 EDCE Cc1nn(C)c(Br)c1CNC(=O)c1ccc(O)c(O)c1 2185787794 LVXDQMSRUWEBTI-UHFFFAOYSA-N 340.177 1.832 10 10 EDCE COc1ccc(N2CC[C@@H](O)[C@H](O)C2)c(OC)c1Br 2226549669 RKZJGPNAWMRDEE-NXEZZACHSA-N 332.194 1.398 10 10 EDCE CCCN(CC(=O)OC)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297505858 DYFUWGCRDYLQMT-UHFFFAOYSA-N 346.427 1.948 10 10 EDCE COC(=O)c1cccc2c1OCCN2C(=O)/C=C/c1cnccn1 492299880 ACERYIADAXOTFV-AATRIKPKSA-N 325.324 1.702 10 10 EDCE CCCNC(=O)[C@@H]1CCCN(C(=O)C=Cc2ccc(O)c(O)c2)C1 2307986783 BHPYAXLDNKNJHT-CQSZACIVSA-N 332.400 1.876 10 10 EDCE CN1C(=O)Cc2cc(N3CCN(C(=O)c4cccnc4)CC3)ccc21 62576029 INSWKGGYJWQBPD-UHFFFAOYSA-N 336.395 1.563 10 10 EDCE CN(C)C(=O)CCc1ccc(NC=C2C(=O)OC(C)(C)OC2=O)cc1 36566069 OUEQFOPGVUOIPA-UHFFFAOYSA-N 346.383 1.839 10 10 EDCE CCCS(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 70250556 USHWRNOWJGDQKE-UHFFFAOYSA-N 326.827 1.863 10 10 EDCE Cc1cccc(CN2CCN(C[C@@H]3CN(C(C)C)CCO3)CC2)c1O 180089458 NEXSPIXHYWDESL-LJQANCHMSA-N 347.503 1.927 10 10 EDCE COCC(=O)NC1CN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 185248137 WGRUAVIROVCSEK-UHFFFAOYSA-N 342.399 1.076 10 10 EDCE COc1ccc(N2CCN(CCN3CCOC[C@H]3C)CC2)cc1F 192740657 VDYBCRTVBGAAHD-OAHLLOKOSA-N 337.439 1.677 10 10 EDCE C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1ccc(N2CCOCC2)cc1 93420619 QWVPUWMUMMMXEN-LSDHHAIUSA-N 340.489 1.777 10 10 EDCE COc1cccc(CNC(=O)c2cnc3c(C)cccn3c2=O)c1O 91075438 URSDOSJXVNLCRQ-UHFFFAOYSA-N 339.351 1.647 10 10 EDCE Nc1ccc(N(c2ccccc2)S(=O)(=O)N2CCOCC2)cc1 243936487 RVIIBXRJCRTAFH-UHFFFAOYSA-N 333.413 1.984 10 10 EDCE NC[C@@H]1CCCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255198212 VCRNJSOFBJMAOM-KKMIYCERSA-N 329.444 1.876 10 10 EDCE C=CC(=O)NCCC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 269460860 RWFQSZPPUWKCDH-UHFFFAOYSA-N 349.406 1.095 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccnn1C 283919465 DOPYDBFBLMDRMO-UHFFFAOYSA-N 330.388 1.181 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N(C)CCF)CC2)cc1 297213140 MFMZBIHRMAOSHY-UHFFFAOYSA-N 338.427 1.428 10 10 EDCE CCOC(=O)COCCN[C@@H](C)c1ccc(N2CCOCC2)cc1 809972517 WEQJICGOFWXJJQ-HNNXBMFYSA-N 336.432 1.754 10 10 EDCE CC(=O)C(=O)COC(=O)c1ncoc1-c1ccc2c(c1)OCCO2 808521067 GNMDEGGBRZMWLV-UHFFFAOYSA-N 331.280 1.428 10 10 EDCE CN(C[C@H]1C[C@@H](O)C1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 703878034 KBBRBABOKOHJRA-BFHDXFOESA-N 340.221 1.608 10 10 EDCE COC(=O)Cc1ccc(S(=O)(=O)N(C)Cc2ccccc2O)cc1 391568878 KMILDLYVUROOSS-UHFFFAOYSA-N 349.408 1.928 10 10 EDCE Cc1cc(C(=O)N2CC3(CN(C)C(=O)O3)C2)c(C)n1-c1ccccn1 817654984 PIFUHVSYFFRDHI-UHFFFAOYSA-N 340.383 1.766 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1[C@H]1CCc2nc[nH]c2C1 819168944 DHKXNRYEYRLVCJ-LBPRGKRZSA-N 326.356 1.437 10 10 EDCE COc1cccc(CNC(=O)NCc2nccc(OC)c2F)c1O 822481478 QJTYKTCPDDIMPQ-UHFFFAOYSA-N 335.335 1.943 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3ccc(O)nc3)CC2)cc1F 829869220 KYQORYFZUHEKBA-UHFFFAOYSA-N 345.374 1.826 10 10 EDCE C/C(=C\C(=O)NCc1ccc2c(c1)CCCN2C)CN1CCOCC1 900432204 CRBXDZYHGAJOEC-FOWTUZBSSA-N 343.471 1.964 10 10 EDCE Cc1ccc(=O)n([C@@H]2COC[C@H]2NCc2ccc3c(c2)CCO3)n1 585626444 PQJDLWDQDDNMNN-HZPDHXFCSA-N 327.384 1.216 10 10 EDCE CN(C)c1ccc(/C=C\CNCCOCCS(C)(=O)=O)cc1 835038454 AQAMYUZONKLJGP-PLNGDYQASA-N 326.462 1.417 10 10 EDCE COCCOc1ccc(CNC(=O)NCc2c(O)cccc2F)cn1 914107844 RQJCQHUULSGWCA-UHFFFAOYSA-N 349.362 1.951 10 10 EDCE Cc1noc([C@H](C)N(C)Cc2cc(O)n3ncc(C(=O)O)c3n2)n1 848712300 HUMVCRHUBBIYPG-ZETCQYMHSA-N 332.320 1.018 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3CN(C4CC4)C(=O)O3)CC2)cc1 844267642 IGZSCCSJHDHBAN-QGZVFWFLSA-N 331.416 1.800 10 10 EDCE CC(C)Oc1cncc(NC(=O)C(=O)NCc2ccccc2O)n1 847483654 FLMMNKHWELUWOA-UHFFFAOYSA-N 330.344 1.224 10 10 EDCE CCN(CC)c1ccc(CNC(=O)c2nc(COC)nn2C)cc1F 853801568 CWVRXRGNTXJPLT-UHFFFAOYSA-N 349.410 1.877 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3CCN(C)CC3)C2)cc1 853684561 VYRYUCRCKRWOTQ-INIZCTEOSA-N 346.475 1.915 10 10 EDCE C[C@H](NC(=O)N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccccc1O 868288121 YARCYMCTTVLDSA-GXSJLCMTSA-N 345.321 1.916 10 10 EDCE CN(CCN1CCCS1(=O)=O)Cc1ccc(N(C)C)c(F)c1 769559776 YGGFAOAHRIFWMB-UHFFFAOYSA-N 329.441 1.359 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@](O)(C4CC4)C3)C2)cc1 1118545089 IFZADAZVBQXAET-HNAYVOBHSA-N 345.443 1.830 10 10 EDCE CCn1nccc1S(=O)(=O)N[C@@H](C)c1cc(OC)ccc1O 770254012 PKRPPPQVQFEVSP-JTQLQIEISA-N 325.390 1.657 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(S(=O)(=O)N(C)C)CC2)c1O 775649844 TXMJLEXBFZAPJA-UHFFFAOYSA-N 347.868 1.278 10 10 EDCE CN(C[C@H]1CCCO1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788939725 VQZMKQYFHWDOBR-QGZVFWFLSA-N 345.443 1.540 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C[C@@H](C)O)C(C)C)cc1 788955542 XCRMHLLLFLHNNO-OAHLLOKOSA-N 349.475 1.767 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cn(C(F)(F)CO)nn1 1135914310 BJXGYMRREWEGRY-UHFFFAOYSA-N 339.346 1.158 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@H]2CCNC(=O)C2)cc1C 1319178741 JCLJDISLWSPKFV-CJNGLKHVSA-N 347.459 1.372 10 10 EDCE CC(C)(O)[C@H]1CN(c2ccc(CN)c(Br)c2)CCO1 2117533640 PWKRRLLDYMIRAZ-CYBMUJFWSA-N 329.238 1.884 10 10 EDCE CN1CCN(c2ccc(CNC[C@@H](O)[C@@H]3CCCO3)cc2F)CC1 1331521530 QQLRGFJESVUZIX-MSOLQXFVSA-N 337.439 1.207 10 10 EDCE CC[C@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@H]1CCCCO1 1261565489 FINRJEZZQVVNJR-GOEBONIOSA-N 334.416 1.815 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@]34CCOC4)c(Br)cc21 1915825816 JCAMNLXWUSFXBH-TZMCWYRMSA-N 338.205 1.770 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@H]1NC(=O)CC1(C)C 1290718531 FCQWHJLPYLMGOA-OAHLLOKOSA-N 343.431 1.843 10 10 EDCE C[C@H](C(=O)NCc1c(O)ccc2ccccc12)N1C(=O)CCC1=O 1472085959 GDGUVIPUMNWVGM-LLVKDONJSA-N 326.352 1.699 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2[nH]cnc2C)cc1C 1700044893 BESYBHJKUMDONE-UHFFFAOYSA-N 346.431 1.259 10 10 EDCE C[C@@](CO)(NC(=O)/C=C\c1ccc(O)c(O)c1)c1ccc(O)cc1 1627650265 AINMORNXPLHGLA-MEFAVCAOSA-N 329.352 1.841 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H]2CN3CCC2CC3)cc1C 1715930013 PJBYFHCYXQLICP-QAPCUYQASA-N 345.487 1.940 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cn(C)ccc2=O)cc1C 1731931978 QSDYEOFRWHMEAA-UHFFFAOYSA-N 343.427 1.564 10 10 EDCE CN1CCN(c2ccc(CNc3ncc([N+](=O)[O-])c(N)n3)cc2)CC1 1640335566 ATWLHTMLEOCRHJ-UHFFFAOYSA-N 343.391 1.331 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)NCc2c(O)cccc2O)c1 1597573767 GALHHCJOPZKKDD-WAYWQWQTSA-N 327.340 1.182 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)Cc2ncc[nH]2)cc1C 1674746409 BLZOGDZPCVYTQI-UONOGXRCSA-N 330.432 1.952 10 10 EDCE CCC1(C(=O)NC[C@@H](C)NC(=O)c2cc(OC)nc(OC)c2)CC1 1688179261 JVHQRAUMWRJREC-LLVKDONJSA-N 335.404 1.524 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)C[C@H]1CCNC1=O 1699185086 VTSKVGBOFUNYFD-MRXNPFEDSA-N 347.459 1.468 10 10 EDCE CCOC(=O)c1c(C(F)F)nn2c(O)cc(CC(=O)OC)nc12 2080935799 XYIKOWQTEJBIMK-UHFFFAOYSA-N 329.259 1.265 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@@H]4[C@H]3CO)c(Br)cc21 2198999394 ZKAYEIZGIXYXIH-LUWVTFKDSA-N 338.205 1.218 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@H]1CNC(=O)COc1ccc(N)cc1 2053958152 SQPPMFGAJCGFEZ-QWHCGFSZSA-N 349.431 1.925 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NC(=O)Cc2ccc(N)cc2)C1 2063348645 OMAJHFRBSSLVSK-HUUCEWRRSA-N 349.431 1.298 10 10 EDCE NCc1ccc(N2CCC[C@H](OCCO)C2)c(Br)c1 2113856360 MGXVJZISWUSVEZ-LBPRGKRZSA-N 329.238 1.886 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(COc2nnc(=N)[nH]n2)CC12CCC2 2213785111 IVCFLYQLWKYDPU-HNNXBMFYSA-N 336.396 1.143 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2C[C@H]2C(=O)O)c1O 2227741121 KXNDFPKXLFLLQT-HTQZYQBOSA-N 330.178 1.974 10 10 EDCE CN(C[C@@H](O)[C@H](N)c1ccc2c(c1)CCN2C)C(=O)OC(C)(C)C 2250282965 JCFNTIHMTCAVNJ-HZPDHXFCSA-N 335.448 1.907 10 10 EDCE Cc1cc(I)ccc1Nc1nnc(=N)[nH]n1 2243566860 SXGOZFDKTHWRGG-UHFFFAOYSA-N 328.117 1.336 10 10 EDCE CC(C)Cc1nc2sc(=Cc3ccc(N(C)C)cc3)c(=O)n2n1 2326112154 KMDUTOIUXOEDKE-UHFFFAOYSA-N 328.441 1.963 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CCC(=O)N2)c(O)c1Br 2352627383 POIGJSNAZLJHRM-SECBINFHSA-N 327.178 1.358 10 10 EDCE C[C@H]1CN2CCC[C@@H]2CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 172081279 YITMKBHHDYHNPC-QFBILLFUSA-N 344.503 1.880 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3[C@H](C)CC(O)C[C@H]3C)nc12 276420064 IJXWGKJTJLZEOG-GHMZBOCLSA-N 348.403 1.345 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCO[C@H]2C2CC2)c1 362636577 CZEWLULNTAXURC-OCCSQVGLSA-N 340.401 1.061 10 10 EDCE CCOC(=O)[C@@H]1CC[C@H](NC(=O)NCc2cccc(OC)c2O)C1 280823447 SPONAGHLSMCXSJ-YPMHNXCESA-N 336.388 1.932 10 10 EDCE CC(C)N(C[C@H](C)O)C(=O)C(=O)NCCCSc1nccs1 806276840 LNFLXOKLQASSBN-NSHDSACASA-N 345.490 1.359 10 10 EDCE C/C=C\[C@H](O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 900610453 IEVXRSMSQNYVAO-IVZVJUQRSA-N 335.423 1.521 10 10 EDCE CN1C[C@@H](O)C[C@]1(C)C(=O)NCc1cccc(Br)c1O 907757723 JGXFHYGXAFQVSF-IINYFYTJSA-N 343.221 1.226 10 10 EDCE CC(C)N(Cc1ccc(N2CCN(C)CC2)cc1)C[C@H]1CCC(=O)N1 840975353 GIGCNNDPZRLBAI-GOSISDBHSA-N 344.503 1.927 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NC[C@@H](C)C(C)C)cc1 846734572 VOIJYWOAKBPQGK-OAHLLOKOSA-N 349.475 1.998 10 10 EDCE O=S1(=O)CCN(Cc2cc3c(cc2O)CCC3)[C@@H]2CCOC[C@@H]21 840168076 YGPWSMZPCJQISZ-WBVHZDCISA-N 337.441 1.269 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)CC3(O)CCC3)C2)cc1 854298540 FILSGJUXGVUMFM-CQSZACIVSA-N 333.432 1.830 10 10 EDCE C[C@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)C[C@](C)(C(F)F)O1 853335521 ALBUYAKILZSUEH-BJOHPYRUSA-N 327.331 1.478 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)c3n[nH]c(C)n3)C2)cc1 854296024 ACVWTVCBXVTESE-DGCLKSJQSA-N 344.419 1.761 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1(NC2CC2)CCC1 852860816 VVHOETGNZICPOJ-UHFFFAOYSA-N 347.434 1.953 10 10 EDCE CCCC[C@@H](NC(N)=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855229422 JZXFAQNJWQXLMT-XJKSGUPXSA-N 348.447 1.617 10 10 EDCE CCCN1C[C@H](C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 855222939 DLQIPCACWAVGEV-CABCVRRESA-N 345.443 1.649 10 10 EDCE CCOc1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)c(F)cc1OC 863176735 BLPOKWIAJMNWBX-UHFFFAOYSA-N 336.319 1.667 10 10 EDCE C[C@@H](NCC(=O)N=c1cc[nH]cc1)c1ccc(N2CCOCC2)cc1 775258849 KXRDTMWROMKHQI-OAHLLOKOSA-N 340.427 1.629 10 10 EDCE C[C@@H](N)c1ccc(N2CCC(CO)(CO)C2)c(Br)c1 694724258 SYTBQPLURMPJCM-SNVBAGLBSA-N 329.238 1.650 10 10 EDCE C[C@@H](NCc1nc(N(C)C)no1)c1ccc(N2CCOCC2)cc1 799154895 FZBPKBZZUFKVOC-CYBMUJFWSA-N 331.420 1.823 10 10 EDCE CN(Cc1nnc2n1CCCCC2)C(=O)Cc1ccc(O)c(O)c1 1141337146 VZUWHJBVUOKOFA-UHFFFAOYSA-N 330.388 1.617 10 10 EDCE Nc1ccc(NC(=O)C(=O)N[C@@H]2CCO[C@H](c3ccncc3)C2)cc1 1328799186 QNEHOCSQBABSDW-CVEARBPZSA-N 340.383 1.639 10 10 EDCE CC(C)(C)[C@@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@@H]1O 1348640903 UURUUNVNAUMRDL-ZBFHGGJFSA-N 346.427 1.490 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cccn2C)cc1C 1507467250 SXQLNDUSZUASKA-MRXNPFEDSA-N 345.443 1.565 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2CCCNC2=O)cc1C 1281726579 YNFPOJGPTUPORT-HOCLYGCPSA-N 347.459 1.514 10 10 EDCE CN(C)C(=O)/C=C/C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1465394900 GDKDAGQJDPNZKK-BQYQJAHWSA-N 345.443 1.156 10 10 EDCE COCCOc1ccc(CC(=O)NCc2c(O)cccc2O)cc1 1472064497 ZBVQEMCVLKLADW-UHFFFAOYSA-N 331.368 1.982 10 10 EDCE COC[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)C(=O)OC 1623908002 CRYYNGBLMBECHW-MRVPVSSYSA-N 325.342 1.230 10 10 EDCE Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)Cc1ccc(O)c(O)c1 1624878878 ZVICTKWRUWHPFT-SFHVURJKSA-N 340.379 1.648 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@]1(C)CCNC1=O 1568774458 BIIJDIVGUHVQAL-LJQANCHMSA-N 347.459 1.468 10 10 EDCE Cc1cccc(NC(=O)NCC(=O)NCc2ccc(O)cc2O)c1 1638352490 PXJVHQAQKBICOH-UHFFFAOYSA-N 329.356 1.844 10 10 EDCE CC(=O)N1C[C@H](C(=O)NCc2ccc(O)cc2O)Oc2ccccc21 1630302310 XGSGHQOQCUHIFI-QGZVFWFLSA-N 342.351 1.528 10 10 EDCE Cc1ccc(C(=O)NC[C@H](n2cncn2)C(F)(F)F)c(O)c1O 1648765692 BCOAEFYFMACOKL-VIFPVBQESA-N 330.266 1.531 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2cnnc(O)c2)cc1C 1676365631 ZFPUXBXNVDETOS-CYBMUJFWSA-N 344.415 1.750 10 10 EDCE CCNCc1ccc(N2CC(OCC(N)=O)C2)cc1Br 2145372412 TVZZOYLPWWPMPK-UHFFFAOYSA-N 342.237 1.249 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1CO[C@H](CNC(=O)OC(C)(C)C)C1 1985094446 OYUZVIMVXMQDEM-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@@H]1COC[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010399334 YSAMKZOTQWAMAD-IJLUTSLNSA-N 339.396 1.780 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](C)NC(=O)c1cc(O)c(O)c(O)c1 2015126794 YRPKYQKYWLPIIE-IUCAKERBSA-N 340.376 1.835 10 10 EDCE C[C@@](NCCCN=[N+]=[N-])(C(N)=O)c1cnn(Cc2ccccc2)c1 2024706865 KAGSCLISMHJYSA-INIZCTEOSA-N 327.392 1.922 10 10 EDCE NCc1cc(F)c(N2CCN3C(=O)CC[C@H]3C2)cc1Br 312672729 XVNROLKCCYGSFK-JTQLQIEISA-N 342.212 1.858 10 10 EDCE NCc1ccc(N2CCC(NC(N)=O)CC2)c(Br)c1 702129972 QGJOEJOIDLHMJH-UHFFFAOYSA-N 327.226 1.545 10 10 EDCE COC(=O)[C@H](NCCCN=[N+]=[N-])c1cnn(C)c1Br 712458960 LMDDCEXRHIOICF-MRVPVSSYSA-N 331.174 1.687 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@](O)(CN(C)C)C2)cc1Br 713709445 UTDQRCIFRGKSKS-IAQYHMDHSA-N 342.281 1.972 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)CCCCO)c(Br)cc21 385032946 CREPFORKNLBVBK-CYBMUJFWSA-N 342.237 1.870 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N1C[C@H](O)C2(CC2)C1 2058986163 KPAINAPACHQWTR-KRWDZBQOSA-N 328.412 1.520 10 10 EDCE CCCN(Cc1ccc(Br)cc1O)[C@H]1CC(=O)NC1=O 2171209420 UGBGJAAFDLPISN-NSHDSACASA-N 341.205 1.782 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CN(Cc2cc(N)ccc2O)[C@@H]2COC[C@@H]12 2044665473 IPPODTUWGHNYNV-RRFJBIMHSA-N 349.431 1.698 10 10 EDCE CCn1nnc(Br)c1[C@H](O)[C@@H](N)c1ccccc1O 2100283461 VWFVVTJVUQXUFT-GXSJLCMTSA-N 327.182 1.500 10 10 EDCE C[C@@H](N)c1ccc(N2CC(CS(C)(=O)=O)C2)cc1Br 2103211036 UBUHWXZJNOAHDH-SECBINFHSA-N 347.278 1.950 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)c(Br)c1 2201284052 JXOAAXQTCRPTSK-HJUHTLPRSA-N 338.249 1.897 10 10 EDCE NCc1ccc(N2CC(CN3CCNCC3)C2)c(Br)c1 2236844535 XGABQCNGKTXZLM-UHFFFAOYSA-N 339.281 1.249 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@H]2[C@@H](O)CO)cc1Br 2270701224 OVZATDQFEAFRQP-IIMNLJJBSA-N 329.238 1.661 10 10 EDCE CCN[C@H]1CC[C@H]1CS(=O)(=O)NCc1cnc(SC)s1 2284693844 ZCMKKBQVHLLNHO-ONGXEEELSA-N 335.520 1.673 10 10 EDCE N[C@@H]1CC[C@@H]2CN(C(=O)C=Cc3ccc(N4CCOCC4)cc3)C[C@@H]21 2308750406 PLOPMPNXOXYWJD-NZSAHSFTSA-N 341.455 1.732 10 10 EDCE Cc1ccc(CN(C)C(=O)C[C@H](O)CN)c(O)c1Br 2352943664 WVAOIURMCBSMHC-JTQLQIEISA-N 331.210 1.131 10 10 EDCE COC(=O)/C(=C\N(C)C)C1=NN(c2ccccc2)C(=O)/C1=C/N(C)C 103500547 LZFSEKQTFSZXIA-ADBGAXBCSA-N 342.399 1.453 10 10 EDCE CC(C)N1CCO[C@H](CN2CCN(Cc3ccccc3O)CC2)C1 179571922 QISXSVQRLVHSBG-GOSISDBHSA-N 333.476 1.619 10 10 EDCE CC1(C)C(=O)NC(=O)N1CC(=O)NCc1ccc(N2CCCC2)cc1 172323699 VVTOLSLUUJCMTD-UHFFFAOYSA-N 344.415 1.233 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@H](C)C2CC2)cc(OC)n1 1354320570 PWJUBPFMGKVTGK-WDEREUQCSA-N 335.404 1.379 10 10 EDCE COC(=O)[C@@H]1C[C@]1(N)c1cc(I)ccc1O 1952776019 SAOYNRPZASRDJO-KWQFWETISA-N 333.125 1.344 10 10 EDCE C[C@@H](NC(N)=O)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 120078843 FZMAWARSYGSCBU-CJNGLKHVSA-N 348.447 1.317 10 10 EDCE C[C@@H](NC(N)=O)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 120079097 FZMAWARSYGSCBU-CZUORRHYSA-N 348.447 1.317 10 10 EDCE COc1ccc(N2CCCN(CCN3CCOC[C@H]3C)CC2)cc1 192699784 TUPTVWAGQQCQPI-QGZVFWFLSA-N 333.476 1.928 10 10 EDCE CN(Cc1cc(Br)ccc1O)[C@H]1COC[C@@H]1C(=O)O 234281613 QVTMPUAMZIGONX-QWRGUYRKSA-N 330.178 1.686 10 10 EDCE NC(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255333170 ZSHVRTLGPXLAJV-KQQSKNTNSA-N 329.400 1.013 10 10 EDCE CN(C(=O)/C=C\c1ccc(N2CCOCC2)cc1)c1cnn(C)c1 254994371 CPFUMUFPOCZNKD-YVMONPNESA-N 326.400 1.933 10 10 EDCE C[C@@H](Cn1cncn1)NC(=O)NCc1c(O)ccc2c1CCCC2 266789359 SHJZDPVZUBBPBT-LBPRGKRZSA-N 329.404 1.750 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)CC1(CO)CC1 297879825 PTJPIJLRVVBVLO-UHFFFAOYSA-N 347.459 1.332 10 10 EDCE CCN[C@@H](C)c1ccc(N2CC(NC(N)=O)C2)cc1Br 2163218551 YTHJQNVKAFTEPE-VIFPVBQESA-N 341.253 1.977 10 10 EDCE CNCc1ccc(N(C)[C@H]2C[C@@H](C(N)=O)C2)cc1Br 703486578 RQCVHQBEFOHNDZ-KLPPZKSPSA-N 326.238 1.869 10 10 EDCE COc1ccc(N2CCC(N)(CO)CC2)c(OC)c1Br 2162671560 RNFMWYIQWJKZDS-UHFFFAOYSA-N 345.237 1.756 10 10 EDCE CC[C@H](NC[C@]1(OC)CCS(=O)(=O)C1)c1ccc(F)cc1O 903363674 QPQJWLXYPAPMKA-DZGCQCFKSA-N 331.409 1.776 10 10 EDCE CN1CCN(c2ccc(CN3C[C@@H](N)[C@H](C(F)(F)F)C3)cc2)CC1 903981544 FTWSDPZOPAYVAK-HZPDHXFCSA-N 342.409 1.760 10 10 EDCE Cc1cc(C(=O)N2CCC[C@](O)(CO)C2)c(C)n1-c1ccccn1 837780293 IIIKDIVULFYDFT-GOSISDBHSA-N 329.400 1.449 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)C3(OC)CC3)CC2)cc1 843775739 DLKBZRWURUJHOO-UHFFFAOYSA-N 333.432 1.112 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCN2C[C@H](O)C[C@H]2C1 847287881 NIKQIGWVYKHTBO-ZWKOTPCHSA-N 344.459 1.247 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@]2(C)CCCCO2)cc1 929235935 FUCCBNBGQNMQNU-SFHVURJKSA-N 333.432 1.444 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(CCO)C3CCC3)C2)cc1 854298639 HMJIMNPFDXMDQE-CQSZACIVSA-N 333.432 1.830 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 926679308 SYDIVGBFMFSJRI-OSMZGAPFSA-N 326.780 1.649 10 10 EDCE Cc1ncc([N+](=O)[O-])n1CC(=O)NCc1ccc(N(C)C)c(F)c1 931145763 FHYUMTCKYVARTJ-UHFFFAOYSA-N 335.339 1.621 10 10 EDCE O=C(NCc1cc(Br)ccc1O)N[C@H]1CCOC1=O 1123607281 TZUDEZCPESZJSJ-VIFPVBQESA-N 329.150 1.269 10 10 EDCE CN(CC(=O)NCc1cccc(O)c1O)C(=O)OCc1ccccc1 1153797924 IMPVKGWMOIVMBX-UHFFFAOYSA-N 344.367 1.983 10 10 EDCE CS(=O)(=O)c1cc(NC(=O)c2cccc(O)c2O)ccc1F 1158048860 NCPSTRBJEPNFRK-UHFFFAOYSA-N 325.317 1.893 10 10 EDCE Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1cccc(C(N)=O)c1 1321867098 MZDCETLPHRWPDQ-UHFFFAOYSA-N 347.440 1.638 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1908253464 SYFYOVMZCZICAU-SRVKXCTJSA-N 339.396 1.516 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cnco2)cc1C 1507496368 XKKZTTLJQBZNFX-AWEZNQCLSA-N 333.388 1.214 10 10 EDCE O=C(CCNC(=O)c1ccc(F)cc1)NCc1ccc(O)cc1O 1469160166 PIRFGEMHWRRXSY-UHFFFAOYSA-N 332.331 1.673 10 10 EDCE CN(C)CCN(Cc1cccc(O)c1)C(=O)Cc1ccc(O)c(O)c1 1622768798 HAMOYQJJRYXSPD-UHFFFAOYSA-N 344.411 1.936 10 10 EDCE Nc1ncnc2sc3c(c12)CCN(C(=O)c1cccc(O)c1O)C3 1556142610 JDAVMSVOLNYRSI-UHFFFAOYSA-N 342.380 1.883 10 10 EDCE CCc1c(-c2ccncc2)n[nH]c1NC(=O)C1=S=CC(C(N)=O)=C1 1628016598 JSOSRCNSTDTAQB-UHFFFAOYSA-N 341.396 1.106 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H](C(N)=O)c2ccccc2)cc1 1629320243 UMWJZSTXLINZPJ-ZDUSSCGKSA-N 325.328 1.805 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@H](C)n2cncn2)cc1C 1482999608 LZKKHTULWMUUFB-XVWMLYKFSA-N 343.431 1.618 10 10 EDCE Cc1nnnn1-c1ccc(C(=O)NCc2ccc(O)c(O)c2)c(F)c1 1566359206 WFDIHAYFLUAGBA-UHFFFAOYSA-N 343.318 1.451 10 10 EDCE COC(=O)NCC(=O)N(C)[C@@H](C)CNCc1ccc(OC)c(C)c1 1732411940 XPMINULHNFCKEK-ZDUSSCGKSA-N 337.420 1.296 10 10 EDCE CC[C@H]1C(=O)NCCN1c1ccc(CN)c(Br)c1F 231840011 WSSOLUUSXCSWBV-VIFPVBQESA-N 330.201 1.762 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)Cc2n[nH]c(C)n2)cc1C 1669553631 BILCKKDXNLIAMV-LBPRGKRZSA-N 331.420 1.267 10 10 EDCE CNC(=O)C[C@H](C)NC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1681194271 RUMARMMBAMQDJR-AWEZNQCLSA-N 332.448 1.953 10 10 EDCE Cc1ccc(C[C@@H](NC(=O)c2cc(O)c(O)c(O)c2)C(=O)O)cc1 1865876095 RGQDNZUVJFDSRY-GFCCVEGCSA-N 331.324 1.538 10 10 EDCE O=C(O)[C@H]1C[C@H](NCc2c(O)cccc2Br)CCO1 1880033277 FZLZJWBTNFFWTA-PRHODGIISA-N 330.178 1.877 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@H](N(C)C)C2)cc1Br 2146148298 AKXYBGXTUOUCSC-CABCVRRESA-N 342.281 1.670 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCCN=[N+]=[N-] 1985096617 UIINXHFQHKMYCX-NSHDSACASA-N 328.417 1.648 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1987701650 IXUWBNDQHQLBBH-WDEREUQCSA-N 327.385 1.278 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CNCc2c(O)cccc2F)C1 1997945141 HKYRPJPDFDJUBJ-ABAIWWIYSA-N 340.395 1.849 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010404913 VPCDVPLSORRUBY-QJPTWQEYSA-N 341.412 1.952 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010406674 XONIKSJIUWWPSP-JQWIXIFHSA-N 341.412 1.809 10 10 EDCE CN(Cc1ccccc1)C1CN(C(=O)c2cc(O)c(O)c(O)c2)C1 2015125022 HXPMZEJDBRHLEV-UHFFFAOYSA-N 328.368 1.760 10 10 EDCE CN(CCCNC(=O)OC(C)(C)C)C(=O)c1cc(O)c(O)c(O)c1 2015126300 SVMZGGLIMPLDSY-UHFFFAOYSA-N 340.376 1.790 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)NCc1ccc(N)cc1 2022785250 VYTYPVQHTCYRLX-ZIAGYGMSSA-N 335.404 1.255 10 10 EDCE C[C@H](CO)CN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 688404692 NOHZFHYAWGQLPF-MADCSZMMSA-N 328.210 1.466 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCc3ccccc3CN(C)C)c2n1 2064243817 MEHONKPPBMTHNA-UHFFFAOYSA-N 339.399 1.735 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2199533676 XIFMLNQOXXTTIK-AWQUKHNNSA-N 342.233 1.823 10 10 EDCE CNCc1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2199528420 ZKFWKZDXCATQAE-WHLNNUNGSA-N 341.249 1.489 10 10 EDCE O=C(O)C[C@]1(O)CCN(Cc2cc(Br)ccc2O)C1 2104562663 MDISBQXWBVCJEU-CYBMUJFWSA-N 330.178 1.566 10 10 EDCE N[C@H]1CN(Cc2ccc(Br)cc2O)[C@]2(CCOC2)C1 2098287998 SSXJQAKAFKRMIY-TZMCWYRMSA-N 327.222 1.847 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@@]4(CO)C3)c(Br)cc2[C@H]1O 2200842853 ALWAGYHDFYHEBU-PYSYBHHASA-N 339.189 1.253 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OCC[C@@]2(C(=O)NCCCN=[N+]=[N-])C1 2253377274 SIPBOSGPVKTGBT-XHDPSFHLSA-N 339.396 1.829 10 10 EDCE O=C1NC[C@H]2CCCN(c3ccc(CO)cc3Br)[C@H]12 2264591334 AUTVGFIURHZCNV-MFKMUULPSA-N 325.206 1.656 10 10 EDCE O=C1NC[C@H]2CCCN(c3ccc(CO)cc3Br)[C@@H]12 2264591339 AUTVGFIURHZCNV-ZWNOBZJWSA-N 325.206 1.656 10 10 EDCE CCCNCc1ccc(N2CC[C@H]2[C@@H](O)CO)c(Br)c1 2286214824 PRIYPNXCYRGAKE-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE O=C1NN(c2ccc(C(=O)O)cc2)C(=O)C1=Cc1ccc([N+](=O)[O-])o1 2297511183 IBJLHXSMGYPHOL-UHFFFAOYSA-N 343.251 1.347 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3CS(=O)(=O)[C@H]3C2)c(Br)c1 2336465846 MLNBMXFAPSKOJP-FWDPORAESA-N 346.246 1.736 10 10 EDCE CC(C)C[C@@H](NC(N)=O)C(=O)NCc1ccc2c(c1)CCCN2C 57558801 DWFGKNLKKQNBGO-OAHLLOKOSA-N 332.448 1.768 10 10 EDCE Nc1ccc(N(CCO)CCN(CCO)c2ccc(N)cc2)cc1 33968649 FLCAOAGLACNSPB-UHFFFAOYSA-N 330.432 1.149 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(O)(CN(C)C)C2)c(Br)c1 2369668343 BFAXXOHAEPEQDY-NSHDSACASA-N 342.281 1.842 10 10 EDCE CN(C)C(=O)CN(C)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255167100 LJTQCQZIEZVKKX-TWGQIWQCSA-N 331.416 1.083 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CC[C@H](CC(N)=O)C2)cc1 376585615 CWNAYBVZKWTXIW-OAHLLOKOSA-N 332.448 1.940 10 10 EDCE Cc1ccc(CN2CC[C@H](C(=O)O)[C@@H](O)C2)c(O)c1Br 2381141729 DIHMZWVSEPHPEO-QWRGUYRKSA-N 344.205 1.731 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2[C@@H]3CCNC[C@H]32)c(O)c1Br 2381141965 HDNGCAQVMGSCHZ-IJLUTSLNSA-N 339.233 1.935 10 10 EDCE CC[C@H]1C(=O)NCC(=O)N1Cc1ccc(C)c(Br)c1O 2380811580 MYJFORXNRAQMMB-JTQLQIEISA-N 341.205 1.700 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@H](CCO)CC3)cc2N1 817129427 IZKNAPXVMFIKKO-NSHDSACASA-N 335.360 1.915 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCCC(C)C)C2)cc1 826947322 PJZIQVMBFCFQIJ-HNNXBMFYSA-N 347.459 1.943 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)CCCCN)cc2)CC1 1332155630 AWXWWVDRQHELRG-UHFFFAOYSA-N 332.448 1.100 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)nc1 837156327 GQCWOTJJYFJQPU-UHFFFAOYSA-N 343.383 1.772 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@H]1CCNC12CCCC2 903483968 NDDAZYGMGXHMCH-SFHVURJKSA-N 344.503 1.975 10 10 EDCE C[C@H](CN(C)C(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(=O)O 588592524 TYPGZEZUNJUSEV-BMWLXYDHSA-N 332.400 1.716 10 10 EDCE Nc1ccc(CCNC(=O)N2CC[C@@H](Nc3ncccn3)C2)cc1 831178815 ZJDGSLTZYSQSTK-OAHLLOKOSA-N 326.404 1.497 10 10 EDCE COc1ccc(N2CC[C@H](CN3C(=O)N[C@@H](CCF)C3=O)C2)cc1 844725279 KFNDVXKDQYBZCX-WFASDCNBSA-N 335.379 1.802 10 10 EDCE COc1ccc(N2CCN(c3nccnc3CN)CC2)c(OC)c1 1336705333 HFGMEIGWXRJGPV-UHFFFAOYSA-N 329.404 1.279 10 10 EDCE C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@@H](CC2OCCO2)C1=O 924714986 DTOROHWSBWPSTQ-FZMZJTMJSA-N 333.388 1.497 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H]([C@H](O)c3cccnc3)C2=O)cc1 924445519 OGTCCEQXXLVVSY-JKSUJKDBSA-N 340.383 1.302 10 10 EDCE CCOC(=O)NCCCC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855233652 KALWAAXZBJEBAP-AWEZNQCLSA-N 349.431 1.916 10 10 EDCE O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCc1c(O)cccc1F 928710969 YTQJDRQBQROFRU-QWRGUYRKSA-N 334.347 1.323 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)Cc3cnc[nH]3)C2)cc1 855225157 OPOUXWFAFIFXTC-KGLIPLIRSA-N 328.416 1.992 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@](C)(CO)C3CC3)C2)cc1 854300755 ZREFKNDNQGAINQ-KSSFIOAISA-N 333.432 1.734 10 10 EDCE CN1CCC[C@@H]1[C@H]1COCCN1C(=O)/C=C/c1ccc(O)c(O)c1 854642374 LEOLDMROUBRLNM-IPKOWEFYSA-N 332.400 1.433 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCO[C@@H](CCF)C1 859903542 MRKHIWUCDGRAOK-KRWDZBQOSA-N 337.439 1.771 10 10 EDCE CC1(N2CCOCC2)CCN(C(=O)NCCc2ccc(N)cc2)CC1 861640254 JPTMVZAROALXKV-UHFFFAOYSA-N 346.475 1.708 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)C[C@@]2(C)CO)cc1Br 698136286 FZGPXVUUTRIXQZ-CHIMOYNISA-N 329.238 1.791 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H]2CCC(=O)N2)c1 862209015 MRFJHGPRZHZNNX-INIZCTEOSA-N 339.395 1.915 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)COCc1ccnc(O)c1 860697208 PUYCGVBBMRAIPA-LLVKDONJSA-N 332.356 1.462 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@H]2CCCOC2)c1 862390691 BFCHGGRGMJRTPG-LLVKDONJSA-N 342.417 1.310 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)NC[C@H](C)S(N)(=O)=O)c2C)c1 768597262 WFMHLPBKUKQCKO-ZDUSSCGKSA-N 349.456 1.809 10 10 EDCE CCN(CC)c1ccc(CN2CCC[C@@H]2CS(N)(=O)=O)cc1F 769427765 MJFPMLPJGNEUFY-CQSZACIVSA-N 343.468 1.925 10 10 EDCE O=C1C[C@H](C(=O)N2Cc3cccc(O)c3C2)CN1Cc1ccco1 871198790 OWJXMCULMXMUKX-ZDUSSCGKSA-N 326.352 1.876 10 10 EDCE CCOc1ccc(CN2CCN(C(C)(C)C(=O)OC)CC2)c(O)c1 779190067 APWPAJBLBLYOMP-UHFFFAOYSA-N 336.432 1.860 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)c2cnc3n2CCC3)cc1F 772557863 HIXQQTULGILOEK-UHFFFAOYSA-N 338.408 1.513 10 10 EDCE CS(=O)(=O)N1CCCC[C@H]1CNCc1c(O)cccc1Cl 796512358 XYZDYTHSCQQFNZ-NSHDSACASA-N 332.853 1.949 10 10 EDCE COc1nsc([C@H](NCCCN=[N+]=[N-])C(N)=O)c1Br 690071155 ZEUSHDZUIHHULL-LURJTMIESA-N 349.214 1.731 10 10 EDCE CC(C)NCc1ccc(N2C[C@H](O)C[C@@H]2CO)c(Br)c1 698198337 LKGAJHWLJOYHLX-CHWSQXEVSA-N 343.265 1.879 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2(CF)CCOCC2)c1 1160043158 IAZGTLPHXBLQPR-UHFFFAOYSA-N 346.380 1.012 10 10 EDCE Cn1cc(-c2nc(C(=O)NCc3cc(O)ccc3O)cs2)cn1 1176748037 IFRVRISKCUFJES-UHFFFAOYSA-N 330.369 1.885 10 10 EDCE Oc1cc(Br)ccc1CN1CCO[C@@H]2CCNC[C@H]21 2129071691 MMEFHVXRGXIUQJ-TZMCWYRMSA-N 327.222 1.717 10 10 EDCE CO[C@H]1CC[C@@H]1N(C)C(=O)C(=O)NCCCSc1nccs1 1335598487 NNOOVNRORMGDDN-QWRGUYRKSA-N 343.474 1.377 10 10 EDCE C[C@H](NC(=O)N1C[C@H](CO)[C@@H](CCO)C1)c1ccc(N(C)C)cc1 1346411275 GQSILQRCEWQWLS-CWRNSKLLSA-N 335.448 1.446 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2COC(=O)N2)cc1C 1277810176 MEYMIGMHUXPHSV-GXTWGEPZSA-N 335.404 1.049 10 10 EDCE CN1CCN(CC2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)CC1 1292943049 ZPOFXSIDRAAAAX-UHFFFAOYSA-N 347.459 1.126 10 10 EDCE Cc1oc2ncn(C)c(=O)c2c1C(=O)N1Cc2cccc(O)c2C1 1471355743 TWCZIQWTVQCISR-UHFFFAOYSA-N 325.324 1.697 10 10 EDCE COc1cc(C=O)ccc1OCC(=O)NCc1ccc(O)cc1O 1626838355 YGIIMLFDYJRNSB-UHFFFAOYSA-N 331.324 1.614 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1713597180 UBYBYKKLDJBKIE-OAHLLOKOSA-N 333.432 1.030 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(-n2cncn2)n1 1567467585 MRSDUFWSIBXSQL-NSHDSACASA-N 339.355 1.435 10 10 EDCE CCS(=O)(=O)c1cccc(CC(=O)NCc2ccc(O)cc2O)c1 1639444425 LDTQQQGKPBMBSZ-UHFFFAOYSA-N 349.408 1.750 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)CCCS1(=O)=O 1632681238 NXJQLXMBSYLQTL-BMIGLBTASA-N 327.402 1.112 10 10 EDCE CCOCn1nc(C)c(CC(=O)NCc2cc(O)ccc2O)c1C 1651225662 SMDDCRHQCUGVPG-UHFFFAOYSA-N 333.388 1.764 10 10 EDCE CO[C@@H](C)C(=O)NC[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1678095791 IDVUMJUAIOACKH-QWRGUYRKSA-N 349.391 1.461 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)c2cn(C)nn2)cc1C 1674660282 FULNVKGWZMBXDI-OLZOCXBDSA-N 331.420 1.429 10 10 EDCE O=C(c1ccccc1)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169824403 CUVDYKJYTZXQRC-UHFFFAOYSA-N 342.351 1.402 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)[C@@H](CCO)C2)cc1Br 2149915566 VRBIFQZRKGOFMU-SRVKXCTJSA-N 343.265 1.896 10 10 EDCE CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CCCN(CCN=[N+]=[N-])C1 2006175203 NMVNCPTUBCSOTO-LBPRGKRZSA-N 340.428 1.650 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)[C@@H]1CCOC1 2010391103 MQVUYKXWKGUXSU-WOPDTQHZSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)NCc2ccccc2O)CC(O)C1 2017963127 JZUMXNWNQPMVHT-UHFFFAOYSA-N 336.388 1.427 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2[C@H](CN)CO 2018750589 CXIFEYBPYAOTSL-OAHLLOKOSA-N 335.448 1.784 10 10 EDCE C[C@@H](N)c1ccc(N2CCC(O)(C(N)=O)CC2)cc1Br 312785246 NXFXGTHYAKFPHN-SECBINFHSA-N 342.237 1.285 10 10 EDCE O[C@H]1C[C@@H](O)CN(c2ccc(CNC3CC3)cc2Br)C1 2161353859 BQSGCIDEZNSHMW-BETUJISGSA-N 341.249 1.633 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N3CC(C)(O)C3)c(Br)cc21 384030291 FXWHLBMHFWBVFE-GFCCVEGCSA-N 340.221 1.623 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC[S@@](=O)C(C)(C)CC3)c2n1 2062767893 CILXFZVPDIIHSA-HSZRJFAPSA-N 336.417 1.117 10 10 EDCE NCc1ccc(N2CC[C@@H](N3CC(O)C3)C2)cc1Br 2102528520 UMUVLJBWGKQMKC-GFCCVEGCSA-N 326.238 1.163 10 10 EDCE CC(C)NC(=O)C1CN(c2ccc(CN)c(Br)c2)C1 2111751849 BJJWQVUOYITZMA-UHFFFAOYSA-N 326.238 1.869 10 10 EDCE CN(c1ccc(CO)c(Br)c1)[C@@H]1CS(=O)(=O)C1(C)C 2097550441 XZIZMVMHBFGKHX-GFCCVEGCSA-N 348.262 1.953 10 10 EDCE CC(C)(C)OC(=O)Nc1ccccc1CCOc1nnc(=N)[nH]n1 2213780031 AFGSAFQQOSCZKA-UHFFFAOYSA-N 332.364 1.648 10 10 EDCE CNCc1ccc(N2C[C@H](CO)C[C@@H](CO)C2)cc1Br 2236634133 SVSSDJKQBCXMQU-VXGBXAGGSA-N 343.265 1.596 10 10 EDCE CCC(=O)N(C)C1CN(c2ccc(CN)c(Br)c2)C1 2352384563 ADTSSSJXDKBRHN-UHFFFAOYSA-N 326.238 1.965 10 10 EDCE Cc1ccc(CN2CC[C@H](O)C[C@@H]2CO)c(O)c1Br 2352677740 CLNYGEOKENVYMS-NEPJUHHUSA-N 330.222 1.781 10 10 EDCE COc1cccc(CNC(=O)NC[C@@H](c2cnn(C)c2)N(C)C)c1O 175054455 HBMUGZHSCYTDSO-AWEZNQCLSA-N 347.419 1.236 10 10 EDCE O=C(O)CN(C(=O)/C=C/c1ccc(N2CCOCC2)cc1)C1CC1 190724698 IIYQAYZQTWJFCK-FPYGCLRLSA-N 330.384 1.612 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3C(=O)NC(C)C)CC2)cc1 242945504 HEACIZGQMRHHCI-IAGOWNOFSA-N 345.443 1.505 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)N2CC[C@@](O)(C(N)=O)C2)c1C 276432003 DGVAMPVSSYFCOI-IBGZPJMESA-N 341.411 1.465 10 10 EDCE C[C@H]1CN(c2ccc(/C=C/C(=O)O)cc2Br)CC(=O)N1 387340825 TZWYOIOFUMLFMZ-SGRBOOSSSA-N 339.189 1.872 10 10 EDCE COCc1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCO1 812269085 PDORPJJTQKHKJG-AWEZNQCLSA-N 332.404 1.946 10 10 EDCE CCO[C@@H]1[C@@H](C)[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 906318593 ZVMXFPGJIFEXIS-AFAVFJNCSA-N 336.407 1.950 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H]1CN1CCOCC1 588405747 OQMZYTLUNBHIHV-VOKGJARPSA-N 332.400 1.434 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1cn([C@@H]2CCCNC2)nn1 829764291 IVJKGAFSXHUWMX-MRXNPFEDSA-N 342.447 1.507 10 10 EDCE NC(=O)[C@H]1C[C@@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 845450680 JAGUHIZYGMBNQO-QLFBSQMISA-N 347.415 1.347 10 10 EDCE C[C@]12CCN(Cc3cc(O)n4ncc(C(=O)O)c4n3)C[C@H]1C2(F)F 851708309 CUXYIWOHAKZXTM-YGRLFVJLSA-N 338.314 1.610 10 10 EDCE C[C@@H]1CCNC[C@@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851663971 OGSGCUFNTAYBJV-KDOFPFPSSA-N 346.475 1.445 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCCC2(CS(C)(=O)=O)CC2)c1 858599511 KDICEUFFZORQAA-UHFFFAOYSA-N 340.445 1.715 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCC(N2CCOCC2)CC1 931035910 XBIRHXRVLHICIO-UHFFFAOYSA-N 345.487 1.820 10 10 EDCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cnc[nH]1 768913739 RNUJIDFEAOSHFH-UHFFFAOYSA-N 339.443 1.872 10 10 EDCE CCOc1cccc(CN[C@@H]2CCN(C3CCOCC3)C2=O)c1O 776229706 AMZZGMXSOQISBC-OAHLLOKOSA-N 334.416 1.660 10 10 EDCE CC(=O)c1cc(Cl)cc(CNC(CO)(CO)C(F)(F)F)c1O 878977929 DLLQWDVCFDUMNT-UHFFFAOYSA-N 341.713 1.624 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Nc3cc(OC)nn3C)C2)cc1 881238821 LROZHAJVUFLGNF-LBPRGKRZSA-N 345.403 1.838 10 10 EDCE COc1cc(Cl)cc(CNCc2nnc3c(=O)n(C)ccn23)c1O 895638344 FRWOBASLSHCFBB-UHFFFAOYSA-N 349.778 1.085 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1nc(O)n[nH]1 1137240363 ZWTVFQIMBBJDDV-UHFFFAOYSA-N 339.355 1.660 10 10 EDCE C[C@H](O)CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C1CC1 691390822 JMAWMNMQRHRCKW-WPPNPWJKSA-N 340.221 1.751 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cccc(Cn2cncn2)c1 1150487298 FJWAAFPMJIKBCN-UHFFFAOYSA-N 338.367 1.710 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(O)nn1 1312754452 NKPOJXBHJZKWFG-UHFFFAOYSA-N 329.404 1.980 10 10 EDCE CC[C@@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@H]1CCCOC1 1333947555 KBIVXGXXDRIWSL-LSDHHAIUSA-N 334.416 1.672 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C2CCN(C)CC2)cc1C 1268660618 SOZKYRRJRQAAPW-OAHLLOKOSA-N 333.476 1.940 10 10 EDCE Cc1cc(C(=O)N2C[C@@H](CO)[C@@H](CCO)C2)c(C)n1-c1ccccn1 1350989287 BYLRBHYFOMVAFH-HOTGVXAUSA-N 343.427 1.552 10 10 EDCE C[C@@H](CNC(=O)CC1CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1354213091 YVSFMFPAWVEYKD-JTQLQIEISA-N 331.376 1.884 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)/C=C\c2cn(C)cn2)c2ccccc2O1 1352671112 MUCUELVPJIHKMX-LZNQSLFOSA-N 327.340 1.401 10 10 EDCE Cc1nc2n(n1)C[C@H](NC(=O)c1cc3cc(O)c(O)cc3s1)CC2 1292751143 QABILPKNNQXXKS-SNVBAGLBSA-N 344.396 1.957 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1nnc2ccc(Cl)cn12 1470344569 QXGGJNLTPGOZKA-UHFFFAOYSA-N 332.747 1.653 10 10 EDCE CN(Cc1ccccc1O)C(=O)N[C@@H]1CCN(c2cc(O)ncn2)C1 1471525037 ZIJUKNKWGPGOEH-CYBMUJFWSA-N 343.387 1.308 10 10 EDCE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CCS(=O)CC1 1611963109 HOCFTRPMWCPWLD-UHFFFAOYSA-N 347.488 1.578 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(O)CCO[C@@H]1C 1612537361 DDHFGDBBUAVOMO-PXAZEXFGSA-N 332.404 1.468 10 10 EDCE CN1CCCc2cc(CNC(=O)CN(C)[C@@H]3CCC[C@H]3O)ccc21 1544164416 IKUXNDVVZMHWCC-QZTJIDSGSA-N 331.460 1.530 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](CO)Cc2cccnc2)cc1 1626913816 VPGDBSZJXVIQDS-ZDUSSCGKSA-N 341.371 1.825 10 10 EDCE CC(=O)NCC1(CCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1489073275 ITCRDEQYWTVUII-UHFFFAOYSA-N 331.376 1.885 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)CC(C)(F)F)cc(OC)n1 1720937890 GKWWCTBOPGYNIF-VIFPVBQESA-N 345.346 1.379 10 10 EDCE COCCCOc1ccc(C(=O)NCc2ccc(O)cc2O)cn1 1638352720 VIMUXJGZAAEOFS-UHFFFAOYSA-N 332.356 1.838 10 10 EDCE Cc1nc(O)nc(O)c1CC(=O)NCc1ccc2cccnc2c1O 1643285167 SLIIHQOATQBODS-UHFFFAOYSA-N 340.339 1.309 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@]2(C)CCNC2=O)cc1C 1733014095 HNZFFONMOJWSPM-UGSOOPFHSA-N 333.432 1.124 10 10 EDCE C[C@H](CNC[C@@H]1CCOC1)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1732461940 YJHMNLWYIGNYMO-OLZOCXBDSA-N 347.419 1.936 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C[C@H]1CCOC1 1663342250 KRUXGHVUDXXQPB-GFCCVEGCSA-N 333.392 1.547 10 10 EDCE CCCn1cc(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)nn1 1662373202 QKAQDLCUSWRCEG-AWEZNQCLSA-N 345.447 1.913 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CNCc2ccc(F)cc2O)C1 1964588676 LNFCGHLUUCWGQY-KRWDZBQOSA-N 340.395 1.993 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NCCCN=[N+]=[N-] 1985096717 VUFGHAPQUYXEPS-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NCc2cc(F)ccc2O)C1 1985830840 ZMUWYOPUENCQAX-OCCSQVGLSA-N 326.368 1.601 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010404966 WBAWYSUINSHBQC-UTUOFQBUSA-N 341.412 1.809 10 10 EDCE C[C@]1(O)CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 300110999 SOFWYSVLAQLHPD-AAEUAGOBSA-N 326.194 1.362 10 10 EDCE CCCNCc1ccc(N2CC[C@@](O)(CO)C2)cc1Br 313929946 WZLXZZCTKBBPBR-HNNXBMFYSA-N 343.265 1.882 10 10 EDCE O=C(O)[C@@]12CN(Cc3c(O)cccc3Br)C[C@H]1CCO2 706628642 VYLVONQNBILYJD-YMTOWFKASA-N 342.189 1.830 10 10 EDCE O=C(Nc1ccc(O)c(O)c1)[C@H]1CCCN(C(=O)N2CCCC2)C1 2062331525 ODLOLRYNQSGJMK-LBPRGKRZSA-N 333.388 1.964 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CC(OCc2ccccc2)C1 2043144961 ACNANBJIVDANET-INIZCTEOSA-N 342.395 1.395 10 10 EDCE NCc1ccc(N2C[C@@H]3CCS(=O)(=O)[C@@H]3C2)cc1Br 2088820379 WRILRQPCXKZREF-GXFFZTMASA-N 345.262 1.531 10 10 EDCE CN(CC1(S(C)(=O)=O)CC1)c1ccc(CO)c(Br)c1 2111534263 MFQGRBVVADJKME-UHFFFAOYSA-N 348.262 1.955 10 10 EDCE NCc1ccc(N2CCC([C@H](O)CO)CC2)c(Br)c1 2096154856 LQULRGTYPCDJMI-CQSZACIVSA-N 329.238 1.477 10 10 EDCE CNCc1ccc(N(CCO)CCN(C)C)c(Br)c1 2099358073 WLGOUEAVSRZEJC-UHFFFAOYSA-N 330.270 1.529 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213590573 BJUFZSPSXFJRSM-VXGBXAGGSA-N 340.428 1.791 10 10 EDCE CCN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1ccc(OC)cc1 298319748 VRDXAKDJPRSOPI-IZZDOVSWSA-N 343.383 1.159 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2COCCO2)c(O)c1Br 2352624701 GSGDZAOJEBWNGY-JTQLQIEISA-N 330.178 1.495 10 10 EDCE Cc1ccc(CN[C@H]2COC[C@@H]2N(C)C)c(O)c1Br 2352681555 SQKSWWCURDVGLK-RYUDHWBXSA-N 329.238 1.882 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1C[C@H](N)CO1 1952481902 WVPZJDQBPDMDSF-YWPYICTPSA-N 338.404 1.650 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)Nc1cnn(CC(N)=O)c1 171166138 FJISPXBGIQPFMV-UHFFFAOYSA-N 331.376 1.518 10 10 EDCE COc1ccc(N2CCN(CC(=O)NCc3ccncc3)CC2)cc1 34685219 ONOROGMWFSHRAH-UHFFFAOYSA-N 340.427 1.529 10 10 EDCE CN1CCCN(C(=O)NCc2ccc(N3CCCC3)cc2)CC1=O 187838024 GZKCTSJJGOWPBX-UHFFFAOYSA-N 330.432 1.661 10 10 EDCE NCc1ccc(N2CCCN(CCCO)CC2)c(Br)c1 2366596433 MONVZNPVHWGURJ-UHFFFAOYSA-N 342.281 1.802 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3C[C@@H]3C(=O)NC(C)C)CC2)cc1 242945505 HEACIZGQMRHHCI-IRXDYDNUSA-N 345.443 1.505 10 10 EDCE C[C@H]1OCC[C@]12CN(c1cc3c(cc1[N+](=O)[O-])OCC(=O)N3)CCO2 366501298 AXYZGEXZAIOBIW-HWPZZCPQSA-N 349.343 1.310 10 10 EDCE NC(=O)C1CN(c2ccc(/C=C\C(=O)O)c(Br)c2)C1 381972548 SCNXCMHHRSEBDN-RQOWECAXSA-N 325.162 1.468 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2COCCN2C)c(O)c1Br 2380752239 TWQIULGAGCFPNY-NSHDSACASA-N 343.221 1.410 10 10 EDCE Cc1ccc(CNC(=O)[C@](C)(N)C(C)(C)O)c(O)c1Br 2380752637 XSGDETOUAKFXBH-AWEZNQCLSA-N 345.237 1.568 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2C[C@H](O)CN2)c(O)c1Br 2380764051 AGYYPLCMIPIBSD-WDEREUQCSA-N 343.221 1.144 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3CCOC3(C)C)nc12 295248988 QFRQDUHLWFRJLL-GFCCVEGCSA-N 334.376 1.269 10 10 EDCE CO[C@H](CS(=O)(=O)N1CCOc2cc(N(C)C)ccc21)C1CC1 567349201 BCRDCZMZYAAEPZ-MRXNPFEDSA-N 340.445 1.706 10 10 EDCE Cn1cc([C@@H](O)C(=O)NCc2cc(Br)ccc2O)cn1 804738893 IMWJAMGAFPEKKF-GFCCVEGCSA-N 340.177 1.238 10 10 EDCE CCOc1ccc(CN[C@H]2CCC[C@H]2CNS(C)(=O)=O)c(O)c1 800309414 ITLUZCLKMMCZOK-WFASDCNBSA-N 342.461 1.598 10 10 EDCE C[C@@H]1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)O1 826707723 WWCPUUPZVYIFFW-CZUORRHYSA-N 333.432 1.443 10 10 EDCE COc1ccc(N2CCN(C(=O)COC3CCC(N)CC3)CC2)cc1 825727335 CPIMGHKKWLAZAB-UHFFFAOYSA-N 347.459 1.630 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2COC(C)(C)C2)cc1 827164393 GVLZIBWIZISUTB-OAHLLOKOSA-N 347.459 1.833 10 10 EDCE COCCC1CN(C(=O)C(=O)NCCCSc2nccs2)C1 828238287 GNANXKMTPBJZJO-UHFFFAOYSA-N 343.474 1.236 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CC[C@@H]2C[C@@H]2C1 834770358 HOHKVULFUHJTRA-FVQBIDKESA-N 329.444 1.982 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3c4c(nn3C)CCC4)C2)cc1 912292062 IDZFMBSQULBOTK-CYBMUJFWSA-N 340.427 1.926 10 10 EDCE C[C@@H](NC(=O)N[C@H](CF)C(=O)O)c1ccc(N2CCOCC2)cc1 837296248 OOCYPYZFCFBEAO-BXUZGUMPSA-N 339.367 1.306 10 10 EDCE CCOc1cc(O)ccc1NS(=O)(=O)CC1(OC)CCOCC1 844665743 PMNHDPNDZHNPAS-UHFFFAOYSA-N 345.417 1.728 10 10 EDCE Oc1cc2c(cc1CN1CCn3c(CC4CC4)nnc3C1)[C@@H](O)CO2 844719180 NCRJMXZHDBVIIC-HNNXBMFYSA-N 342.399 1.378 10 10 EDCE C[C@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@H](c2ccnn2C)C1=O 843308965 VTJLKWAPRIIHHK-IAQYHMDHSA-N 327.388 1.840 10 10 EDCE Nc1ccc(NC(=O)C(=O)NC[C@H]2CCC[C@@H](C(F)(F)F)O2)cc1 927867775 PELTXZNZKKSFHB-NEPJUHHUSA-N 345.321 1.824 10 10 EDCE CCN(Cc1cc(Br)ccc1O)S(=O)(=O)C1CNC1 923622622 MVJLBPDORIGKTH-UHFFFAOYSA-N 349.250 1.278 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)C(=O)N(C)C)C2)cc1 851985254 UCFGGRGSCPLZFG-OLZOCXBDSA-N 334.420 1.050 10 10 EDCE COC(=O)[C@@H](C[C@H]1CCCOC1)NC(=O)c1ccc(C)c(O)c1O 862998170 WGOGBOFPKJIEAY-DGCLKSJQSA-N 337.372 1.494 10 10 EDCE CC(C)N1C(=O)CN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1(C)C 779526155 PDSLVSHPWHYWPG-VURMDHGXSA-N 332.400 1.969 10 10 EDCE Cc1cc(Br)cc(CNCCc2nnnn2C)c1O 776256892 SIURQLUDYNJWFL-UHFFFAOYSA-N 326.198 1.319 10 10 EDCE COC(=O)[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1cccc(O)c1 779543742 YMUOJSZFRGXESU-JKNJVXJCSA-N 343.335 1.847 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H]3CSC[C@H]3C2)c1 899382871 ZNGPBAFZUQEOQS-AOOOYVTPSA-N 342.442 1.199 10 10 EDCE O=C1NCCN(C(=O)Cc2ccc(O)c(O)c2)[C@H]1c1cccs1 1137085048 OPPSHOCRNGZMGD-HNNXBMFYSA-N 332.381 1.402 10 10 EDCE C[C@@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)N1CCN(C)CC1 896427871 MKEJYGMGQBZJJC-NSHDSACASA-N 349.456 1.678 10 10 EDCE NC(=O)C[C@@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 895412468 XCDKXXCTKQOIRO-SNVBAGLBSA-N 347.184 1.370 10 10 EDCE CC[C@H]1CCN1C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 795651443 YTJQJMIHBCIFJU-FUHWJXTLSA-N 333.476 1.662 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(C)C[C@H]2CO)cc1Br 699492118 PBVZLQNCUALYCB-YPMHNXCESA-N 342.281 1.842 10 10 EDCE C[C@@H](O)c1ccc(N2CCC[C@@H]2[C@@H](O)CO)cc1Br 2123170517 IGICYNSRGZVRFS-FZQKWOKYSA-N 330.222 1.824 10 10 EDCE CO[C@@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1333344285 YRPZUSRZNRMCIU-IAGOWNOFSA-N 343.427 1.315 10 10 EDCE O=C(C(=O)N1CC[C@@H]2OCCC[C@@H]2C1)N1Cc2cccc(O)c2C1 1331981453 PWVVTRXFVCSJDG-CJNGLKHVSA-N 330.384 1.262 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CO[C@@H](C2CC2)C1 1331277977 WWAJVMZHMOYGJI-SJLPKXTDSA-N 345.443 1.890 10 10 EDCE CNC(=O)C1(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)CC1 1266888246 NNANLCNVKDFBRP-UHFFFAOYSA-N 333.432 1.078 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2csnc2C)cc1C 1272398319 OQUSRPULPNYIKA-CQSZACIVSA-N 349.456 1.649 10 10 EDCE C[C@@H]1CC=CC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1351143866 MKSNAFPBUTZFRT-IUODEOHRSA-N 333.407 1.979 10 10 EDCE COc1ccc(N2CCCN(C(=O)/C=C\C(=O)N(C)C)CC2)cc1 1441926440 BRQVTZPGGGLUDY-KTKRTIGZSA-N 331.416 1.378 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCNC(=O)CCCF)cc1 1522940215 LMQNFAQTBXDSKL-UHFFFAOYSA-N 337.355 1.835 10 10 EDCE C=C/C(C)=C\CC(=O)NC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1526885238 CTAOOUBFLRFFFK-OTAKNEKHSA-N 347.415 1.856 10 10 EDCE O=C(c1cccc(O)c1O)N1CCC[C@@]2(CCS(=O)(=O)C2)C1 1627716958 GINHCSMZKNLELC-OAHLLOKOSA-N 325.386 1.139 10 10 EDCE C[C@H](C(=O)NCc1ccc(O)c(O)c1)N1Cc2ccccc2C1=O 1622664162 JKFIUVUAZWMZCV-LLVKDONJSA-N 326.352 1.759 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)c1cccnc1OCCO 1624321734 IGNOMLFVWZKZLJ-UHFFFAOYSA-N 341.411 1.983 10 10 EDCE CC[C@H](F)CNC[C@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1715613682 ODOSTWCJAXLUEI-AAEUAGOBSA-N 339.371 1.277 10 10 EDCE COCCN[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1C 1717293878 VOKGGFXBZJTUQN-SMDDNHRTSA-N 333.392 1.546 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)Cc2cncn2C)cc1C 1498160177 NOPCRXZHYCTROQ-AWEZNQCLSA-N 330.432 1.574 10 10 EDCE C[C@H](C(=O)NCc1cccc(O)c1O)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 1633509308 SSIWRYXPBOQLHI-WXHSDQCUSA-N 346.383 1.278 10 10 EDCE C[C@H](O)[C@H](NC(=O)C1CC1)C(=O)NCc1c(O)ccc2ccccc12 1639384433 KAXLCJXBQQZGJO-GTNSWQLSSA-N 342.395 1.437 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCNC(=O)[C@H]2CC23CC3)cc1 1742929281 CANIGAJINSJRLV-CYBMUJFWSA-N 343.387 1.885 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)Nc1nc(N)nc(C(F)(F)F)n1 1655365349 XFSPQQCZOXDMOC-LURJTMIESA-N 329.282 1.927 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCCN(C[C@@H]2CCCO2)CC1 1597697468 ACDGRWBHHZALQU-HNNXBMFYSA-N 334.416 1.354 10 10 EDCE O=C(NCc1nc([C@@H]2CCCO2)n[nH]1)NCc1c(O)cccc1F 1673954769 ISCYILZFZKZVLS-LBPRGKRZSA-N 335.339 1.500 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H]2CN3C(N)=O)cc1Br 1877074787 WIZYRBGSRRBMPZ-WDEREUQCSA-N 325.210 1.249 10 10 EDCE COC[C@H](O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951700318 UCASIEULAXMZHR-FZMZJTMJSA-N 327.377 1.541 10 10 EDCE COC[C@H](N)C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952117503 AVYXUJZCFMWINQ-CHWSQXEVSA-N 340.420 1.897 10 10 EDCE CO[C@@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C[C@H]1F 2146468804 CSMNNWKVLBSOFE-GGZOMVNGSA-N 344.184 1.574 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985101256 PTHVEMXCZVWVJY-MNOVXSKESA-N 327.385 1.563 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)c1cc2c(cc1N)OCC(=O)N2 1999526366 ZICZHFXWAJFYEM-UHFFFAOYSA-N 336.392 1.561 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@H]1CCOC1 2010389090 LGFUUQOQZDWMOI-CMPLNLGQSA-N 339.396 1.685 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CC[C@H]1NC(=O)COc1ccc(N)cc1 2012864995 FFMCWODMYWZNSQ-KGLIPLIRSA-N 335.404 1.820 10 10 EDCE CN[C@H](c1ccccc1O)c1c(CNC(=O)OC(C)(C)C)nnn1C 2032720506 ASSZBXSEANCTLX-CQSZACIVSA-N 347.419 1.854 10 10 EDCE CN(C)C(=O)[C@@H]1CNCCN1Cc1c(O)cccc1Br 706852084 NDUNBDJDFKMAKW-LBPRGKRZSA-N 342.237 1.017 10 10 EDCE CNCc1ccc(N2CC[C@@H](CC(N)=O)C2)cc1Br 690765301 XIKVULIUTBKQGL-JTQLQIEISA-N 326.238 1.870 10 10 EDCE CNCc1ccc(N(C)CCN(C)CCO)cc1Br 691240176 DCXZEXWXCBDHNA-UHFFFAOYSA-N 330.270 1.529 10 10 EDCE CCC1(O)CN(c2cc3c(cc2Br)[C@H](NC)C(=O)N3)C1 384154485 QBCLIXJTXDWBOX-LBPRGKRZSA-N 340.221 1.623 10 10 EDCE CCc1cccc(CN(C)Cc2nnc3c(=O)n(C)ccn23)c1O 2063033724 NKZYSUBICFNDSS-UHFFFAOYSA-N 327.388 1.328 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@H](O)c2nn(C)nc2Br)cc1 2167724641 SSDFOCZNIJLVRS-PWSUYJOCSA-N 340.225 1.377 10 10 EDCE C[C@@H](O)CN1CCN(c2ccc([C@@H](C)N)cc2Br)CC1 2170215250 DCINOJZGMCFODO-VXGBXAGGSA-N 342.281 1.972 10 10 EDCE NCc1ccc(N2CCN([C@@H]3CCOC3)CC2)c(Br)c1 2171292041 BXWCPTMKHALAAX-CYBMUJFWSA-N 340.265 1.819 10 10 EDCE Nc1ccc(OCc2cn(CC(=O)NCc3ccccc3)nn2)cc1 2058844776 DKXIPLHIYCJPFT-UHFFFAOYSA-N 337.383 1.756 10 10 EDCE CCS(=O)(=O)NC1CN(c2ccc(CO)c(Br)c2)C1 2109345249 WDURXMPMIODUJI-UHFFFAOYSA-N 349.250 1.069 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@@](C)(O)C2)c(Br)c1 2201495353 BQGSKIDDZKKLHI-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H](N)[C@H](OC)C2)c1O 2227741993 YHCHTMOBOQYSRO-ZYHUDNBSSA-N 331.210 1.321 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3CCN[C@H]3C2)c1O 2227742757 JLHVMNKRMLVORH-CABZTGNLSA-N 327.222 1.957 10 10 EDCE CSc1ncc(CNS(=O)(=O)C[C@H]2N[C@@H]3CC[C@H]2C3)s1 2284724432 PFWQEXBIMKZOMA-IQJOONFLSA-N 333.504 1.425 10 10 EDCE CC[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2288908399 WYDSHDYKWIDMMP-DRZSPHRISA-N 341.205 1.784 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCC(F)(F)CO 2309366394 MAQWELYCGBMQES-UHFFFAOYSA-N 326.343 1.280 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)cc1Br 2329195262 YCRCVZPOACPPDE-WDGYITBISA-N 327.222 1.665 10 10 EDCE Cc1ccc(CN2CC[C@@H](CO)[C@H](N)C2)c(O)c1Br 2352680598 RIQZPQSELPNGNZ-NWDGAFQWSA-N 329.238 1.605 10 10 EDCE COc1cc(Br)c(Br)c([C@H](N)CN)c1O 238446811 JXYWLBKSMCHRMJ-RXMQYKEDSA-N 340.015 1.884 10 10 EDCE O=C1CCCN1C[C@H](O)CN(Cc1ccccc1O)C[C@H]1CCCO1 246857149 PKLPIXIWALBCCB-IAGOWNOFSA-N 348.443 1.357 10 10 EDCE Cn1cccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1=O 264284485 ZMFDRNDVUFXPJI-UHFFFAOYSA-N 345.374 1.291 10 10 EDCE Cc1ccc(CN2CC(n3ncc(N)n3)C2)c(O)c1Br 2380793954 WHKGCSUNIHEZBW-UHFFFAOYSA-N 338.209 1.694 10 10 EDCE CC(=O)C(=O)COC(=O)CC[C@@H]1CCN(C(=O)OC(C)(C)C)C1 808530890 GEJXZSNVVHFMFT-GFCCVEGCSA-N 327.377 1.725 10 10 EDCE CC(=O)C(=O)COC(=O)c1cn(-c2ccccc2C(F)(F)F)nn1 808501704 NAQFFMMEILQWNO-UHFFFAOYSA-N 341.245 1.601 10 10 EDCE Cc1cc(O)c(CN2CCN([C@H]3CCNC(=O)CC3)CC2)cc1C 825148682 ZJSWVCSKANIHAS-QGZVFWFLSA-N 331.460 1.795 10 10 EDCE CC1(O)CC(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 822660148 LAQDRXBPEUDQQW-TZGCNFNXSA-N 345.443 1.166 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCCN1C[C@H]2CCCCN2C1=O 823263944 CWSVAPQYTWXBLA-OAHLLOKOSA-N 346.431 1.824 10 10 EDCE CCN(OC)C(=O)CNC(=O)NCc1ccc2c(c1)CCCN2C 826020067 PEWUIMCUOQEHGS-UHFFFAOYSA-N 334.420 1.278 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCN(c3cnn(C)c3)C(=O)C2)cc1 835025020 CUHPDXZWKSYLPP-SNAWJCMRSA-N 339.443 1.848 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@H](O)c2ccnn2C)cc1F 915367272 YRAGHTWLAOUEGJ-HNNXBMFYSA-N 335.383 1.158 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CSCN3C(C)=O)C2)cc1 855228964 GMAIWBOKKTUPJH-CZUORRHYSA-N 349.456 1.312 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3csc(CN)n3)C2)cc1 851639974 OIXBNHAGFQCECJ-LLVKDONJSA-N 332.429 1.619 10 10 EDCE 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C[C@@H](CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1)N1CCCCC1=O 193785713 QIQDMWPHTFJIGQ-OLZOCXBDSA-N 334.416 1.936 10 10 EDCE COC(=O)[C@@]12CCOC[C@@H]1CN(Cc1cc3c(cc1O)OCO3)C2 373485379 NOBGDPMUVDWRDB-YVEFUNNKSA-N 335.356 1.132 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2NCCO[C@@H]2C)c(O)c1Br 2381138826 YFCCXXVQSQVLEU-BXKDBHETSA-N 343.221 1.456 10 10 EDCE C[C@@H]1CC[C@@H]1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 805864056 OTJWHMHXROYVQD-KMFMINBZSA-N 344.459 1.986 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@H](NC(N)=O)C2)cc1Br 723183209 RJBZMZHHQOTKTA-ZJUUUORDSA-N 341.253 1.977 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NCC[C@H]3CCNC3)C2)cc1 818654636 DFQQHONXMVFGMJ-CVEARBPZSA-N 346.475 1.820 10 10 EDCE COC[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)C(=O)OC 831812406 QPBIVQRHMKFHMU-QGZVFWFLSA-N 344.411 1.941 10 10 EDCE COC(=O)[C@@H](O)CNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 831429001 FOCMPXHZONSWHX-INIZCTEOSA-N 330.384 1.287 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cc1c(O)ncnc1O 910559987 ZTZOMNSNJCCUHH-LBPRGKRZSA-N 344.415 1.552 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@@]1(O)CCN(Cc2ccccc2)C1 928705811 NJVCQGDAMFCJNM-LJQANCHMSA-N 344.386 1.785 10 10 EDCE COCCN1CCC[C@H]1CN[C@@H](C)c1cc(C(=O)OC)ccc1O 756535650 NVTDMVFJNAEVAY-ZFWWWQNUSA-N 336.432 1.940 10 10 EDCE CN(C)[C@@H](CCNC(=O)C(=O)Nc1ccc(N)cc1)C(F)(F)F 927866517 PBNSSDZKYSGMLN-NSHDSACASA-N 332.326 1.206 10 10 EDCE C[C@H](NC(=O)NCCC(C)(C)S(C)(=O)=O)c1ccccc1O 868706405 WOYKEBTWCNUUHE-NSHDSACASA-N 328.434 1.966 10 10 EDCE CN1CCN(c2ccc(CNc3nnc(CCO)s3)cc2)CC1 865293998 FKYBICVKGLEPSM-UHFFFAOYSA-N 333.461 1.437 10 10 EDCE CC(C)(C)OC(=O)[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 768463339 HHTNPWQEWZVJKF-ABAIWWIYSA-N 335.400 1.982 10 10 EDCE CCS(=O)(=O)C1(CNC(=O)N[C@H](C)c2ccccc2O)CC1 868785195 OHSWSNCHKNTPSV-LLVKDONJSA-N 326.418 1.720 10 10 EDCE COC(=O)[C@H]1CN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CCO1 776237756 IJFXSWPDQAIVGF-SWLSCSKDSA-N 335.404 1.397 10 10 EDCE CCOC[C@H](C)NC(=O)C(=O)NCc1ccc(N(CC)CC)cc1 1117045069 HDJQCVFGIJMFOA-AWEZNQCLSA-N 335.448 1.690 10 10 EDCE CS(=O)(=O)c1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)cn1 779495939 IDVSXRVYMQFGJY-ZZXKWVIFSA-N 334.353 1.548 10 10 EDCE Cc1ccncc1N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 799153529 DIXIMTPGONHXMO-GOSISDBHSA-N 341.411 1.844 10 10 EDCE COc1ccc(CNCCC[C@H](C)NC(=O)[C@H]2CNC(=O)N2)cc1C 1700671057 HZBSTLUAMMBGAA-DZGCQCFKSA-N 348.447 1.060 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@H]2CC23CCC3)cc1C 1700807893 IETGNKAPSMAVRU-HZPDHXFCSA-N 332.444 1.761 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)CC[C@H]2CC[C@@H](C(N)=O)O2)c1 1622779036 HJLLZVCCDBCFSY-HFAKWTLXSA-N 336.388 1.391 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)c1ccoc1 1494780471 HVLQEZPIHGGBRY-SNVBAGLBSA-N 343.343 1.990 10 10 EDCE Cc1nnnn1-c1ccc(C(=O)NCc2ccccc2O)c(F)c1 1630363233 KDPQLMKFCNKPAR-UHFFFAOYSA-N 327.319 1.745 10 10 EDCE CNC(=O)N[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 1644497565 ZLBXVVDKAVLZMH-MRXNPFEDSA-N 332.448 1.417 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1cnsn1 1662429155 DFXIFDCQNKDNOA-VIFPVBQESA-N 347.404 1.609 10 10 EDCE CC(=O)N[C@H]1CCc2cc(O)c(O)c(O)c2-c2ccc(O)c(=O)cc21 5884016 AQAJIZGCFLTZFB-LBPRGKRZSA-N 343.335 1.660 10 10 EDCE COc1cccc(CN[C@@H]2COC[C@@H]2NC(=O)OC(C)(C)C)c1O 1944917712 OWONDVKBGWVAKY-OLZOCXBDSA-N 338.404 1.783 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)CC[C@H](C)O)c(Br)cc21 135565991 ALLYNTHIBOEYTG-SDBXPKJASA-N 342.237 1.869 10 10 EDCE N[C@@H](COCc1ccccc1)C(=O)NCCc1ccc(O)c(O)c1 1946512185 YLXXLHNKTZBEEP-HNNXBMFYSA-N 330.384 1.301 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NCc1ccc(F)cc1O 1994510839 JIEWDBPCDVOKMV-QWHCGFSZSA-N 326.368 1.913 10 10 EDCE CCN(C(=O)OC(C)(C)C)[C@H]1COC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010389781 UWLXMCHXIGWMPL-NEPJUHHUSA-N 339.396 1.780 10 10 EDCE CN(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)CCCN=[N+]=[N-] 2010388834 HMPWWBAKMPJLCK-GFCCVEGCSA-N 342.444 1.990 10 10 EDCE C[C@@](NC(=O)C(F)(F)F)(C(=O)N1CC[C@H](N=[N+]=[N-])C1)C(F)(F)F 2010405999 OSNLCLHNFAGEGH-YLWLKBPMSA-N 347.219 1.897 10 10 EDCE CCOc1cccc(CN[C@@H](CO)CNC(=O)OC(C)(C)C)c1O 2011425224 VLDOIWPCKGTNDS-CYBMUJFWSA-N 340.420 1.766 10 10 EDCE C[C@H](NCCc1nnc(Br)n1C)c1ccc(O)cc1O 2185197766 JYLACXQPFTWFDN-QMMMGPOBSA-N 341.209 1.882 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](CNC(=O)Cc2ccc(N)cc2)C1 2044206167 HUBKCBFUPWPKTQ-OAHLLOKOSA-N 349.431 1.563 10 10 EDCE O=S1(=O)C[C@@H]2C(NCc3cc(Br)ccc3O)[C@H]2C1 2054278167 NHSHXWJGAXSQSC-UWVGGRQHSA-N 332.219 1.287 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)C[C@H]2CO)c(Br)c1 2089863110 HCSGPJONNQDXIF-SCVCMEIPSA-N 330.222 1.682 10 10 EDCE OCc1ccc(N2CCCCC2(CO)CO)cc1Br 2089865112 AVQDNTFMQHZFHZ-UHFFFAOYSA-N 330.222 1.655 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](N(C)C)[C@H](O)C2)c(Br)c1 2089925705 FGOQVWKSNGFUFI-QCZZGDTMSA-N 329.238 1.614 10 10 EDCE O=C1Nc2cc(N3CC4(CSC4)C3)c(Br)cc2[C@@H]1O 2090180007 LUXBHRPCQOOUHJ-NSHDSACASA-N 341.230 1.988 10 10 EDCE NCc1ccc(N2CC[C@](CO)(CCO)C2)c(Br)c1 2097025576 VMZKYWRBEGFCSL-AWEZNQCLSA-N 329.238 1.479 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])C1 2213593565 SKEPTMALXFFJTF-QJPTWQEYSA-N 339.396 1.970 10 10 EDCE OCc1ccc(N2CCc3c(O)ncnc3C2)c(Br)c1 2206103516 MBELBNTZTCSWKN-UHFFFAOYSA-N 336.189 2.000 10 10 EDCE Cc1ccc(CN2C[C@H](O)[C@@H]3COC[C@@H]32)c(O)c1Br 2352691869 XCFZEPHZBWAITI-WOPDTQHZSA-N 328.206 1.655 10 10 EDCE CC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 54035722 YXLLSGZENJVQPN-QGZVFWFLSA-N 347.484 1.867 10 10 EDCE CCC[C@H](NC(N)=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 102382249 IEQCCGIHPRECSQ-INIZCTEOSA-N 348.447 1.617 10 10 EDCE C[C@H](NCCNC(=O)C1CC1)c1ccc(N2CCC(O)CC2)cc1 178211008 UXJZQVQFPBVPTI-AWEZNQCLSA-N 331.460 1.825 10 10 EDCE CNS(=O)(=O)CCc1ccc2[nH]cc(-c3cc[n+](C)cc3)c2c1 77303143 RWMCKWBZWZBVOV-UHFFFAOYSA-O 330.433 1.751 10 10 EDCE in-vitro CN1CCc2nc(NC(=O)Nc3cc(O)c(O)c(O)c3)sc2C1 217278871 JFFSPWKZPUWNHQ-UHFFFAOYSA-N 336.373 1.892 10 10 EDCE CCOc1cccc(CN2CCN(Cc3nccn3C)CC2)c1O 93108569 DFDYUMBITOJFHU-UHFFFAOYSA-N 330.432 1.842 10 10 EDCE CC(=O)N1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)[C@H](C)C1 268750040 SHARGFXYWLCTLK-OAHLLOKOSA-N 342.443 1.825 10 10 EDCE 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CN1C(=O)CN(C(=O)NCCc2ccc(N)cc2)Cc2ccccc21 857846736 GFIKGAVRPHFPPM-UHFFFAOYSA-N 338.411 2.000 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1C[C@H]2CC[C@H]1CN2 851681811 QCBOWQYKQOXVEF-WBVHZDCISA-N 344.459 1.294 10 10 EDCE COCCC(=O)N1CCC(NC(=O)N[C@@H](C)c2ccccc2O)CC1 868418440 KOLRDMDBEYRZHN-ZDUSSCGKSA-N 349.431 1.780 10 10 EDCE CC(=O)c1cc(F)cc(CN2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c1O 879934176 YQYODIJINHWEQH-AAEUAGOBSA-N 341.404 1.600 10 10 EDCE COC(=O)c1c(CN2CCn3ncnc3C2)c2cc(F)ccc2n1C 894481908 AJPDNIWOPMMZEC-UHFFFAOYSA-N 343.362 1.711 10 10 EDCE Cc1ccc(C(=O)NCCCNC(=O)c2ccccc2)c(O)c1O 780921468 VFYBGFPJERMXDV-UHFFFAOYSA-N 328.368 1.956 10 10 EDCE O=C1Nc2cc(N3CCO[C@@H]4C[C@@H]43)c(Br)cc2[C@@H]1O 2115219385 GVUXYTWKWSYJGZ-TUAOUCFPSA-N 325.162 1.412 10 10 EDCE COC1CC(CCNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1330520126 HVDUWCLNWHATHW-TUBUQKNSSA-N 347.459 1.861 10 10 EDCE CNC(=O)C1(C(=O)NC[C@@H](C)CNCc2ccc(OC)c(C)c2)CC1 1268006747 JEVPJYOBNNASGG-ZDUSSCGKSA-N 347.459 1.372 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)/C=C\c2ccc[nH]2)cc1C 1272405729 AELFGXLFASBMDQ-BQLWYNFJSA-N 343.427 1.612 10 10 EDCE C[C@@H](CNC(=O)c1ccoc1)NC(=O)c1ccc(N=NC(N)=O)cc1 1295422569 NSNPPQJALHLWCF-JTQLQIEISA-N 343.343 1.990 10 10 EDCE CCn1cc([N+](=O)[O-])c(C(=O)NCc2ccc3cccnc3c2O)n1 1451959562 ZNUPZHIJRNCVNV-UHFFFAOYSA-N 341.327 1.995 10 10 EDCE O=C(CSc1nnc(S)s1)NCc1ccc(O)cc1O 1626838217 RYVZUSZZUOOYEA-UHFFFAOYSA-N 329.428 1.647 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CN2CC[C@H](C)C2)cc1C 1498118282 QNDATTGRUNQVQU-HOCLYGCPSA-N 333.476 1.940 10 10 EDCE COC(=O)c1ccnc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 1632681276 OOOFCJPSOAHBFO-SNVBAGLBSA-N 330.340 1.640 10 10 EDCE CCn1cc(C(=O)NC[C@H](C)CNCc2ccc(OC)c(C)c2)nn1 1568201516 LSMXTENMSXYERQ-CYBMUJFWSA-N 345.447 1.771 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)C(C)(C)NC(C)=O)cc1C 1568937298 VPLGPJMNXQWIQK-SREVYHEPSA-N 347.459 1.680 10 10 EDCE CCO[C@H](C)C(=O)NC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1737982413 ZRPCUXWQQBDPNK-SNVBAGLBSA-N 347.375 1.215 10 10 EDCE 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EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)COC1 1985100347 FTFHGFXBXWJSFY-JTQLQIEISA-N 325.369 1.534 10 10 EDCE C[C@@H](NC[C@@H](CO)NC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985854354 SDZTURMYCMNQTJ-MNOVXSKESA-N 326.393 1.634 10 10 EDCE C[C@H](C(=O)N1CC(N=[N+]=[N-])C1)N1CCN(C(=O)OC(C)(C)C)CC1 2010393720 WOEKVWHOAOACKP-LLVKDONJSA-N 338.412 1.449 10 10 EDCE C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)c1cc(O)c(O)c(O)c1 2015120942 YQIKDTYFWZNVGC-VIFPVBQESA-N 340.376 1.789 10 10 EDCE Nc1ccc(CCC(=O)NCCn2cc(Br)cn2)cc1 312243476 DALYVDCHGHKORW-UHFFFAOYSA-N 337.221 1.977 10 10 EDCE COc1ccc(N2CCN[C@H]3COC[C@@H]32)c(OC)c1Br 2189095067 QTINCJXIAOGFOR-ONGXEEELSA-N 343.221 1.643 10 10 EDCE OC[C@]1(NCc2cc(Br)ccc2O)C[C@H](O)C12CCC2 2193970447 ZDYWKUUDNYBVDY-DZGCQCFKSA-N 342.233 1.910 10 10 EDCE C[C@H](N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)c1ccc(O)cc1O 1908511066 LHBOXNMMJNPQHP-PSOPSSQASA-N 338.404 1.729 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3CCOC[C@H]3C2)cc1Br 2185896580 OJVMWDKMSKJYOZ-DGCLKSJQSA-N 340.265 1.990 10 10 EDCE NCc1ccc(N2CCO[C@H]3COCC[C@@H]32)cc1Br 2087489317 ZQOIEHAYYMOXLH-KBPBESRZSA-N 327.222 1.902 10 10 EDCE COC[C@@H]1[C@H](O)[C@H](O)CN1c1ccc([C@H](C)N)cc1Br 2234066898 LODCVMCVWFOERD-IYMWITQMSA-N 345.237 1.026 10 10 EDCE NCc1ccc(N2CC(S(=O)(=O)C(F)(F)F)C2)c(Cl)c1 2237657322 IZPMPQLKIOHORW-UHFFFAOYSA-N 328.743 1.922 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)c(Br)c1 2331967468 UVZSAKSSNQZJLM-GJQVQUKXSA-N 328.206 1.404 10 10 EDCE C[C@H]1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C[C@@H]1O 2341401951 CIWPANUZUBYHSZ-QNRPFLCFSA-N 327.178 1.252 10 10 EDCE CCNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2354483726 RKJIWZVBRAZGGQ-FBUXBERBSA-N 341.249 1.489 10 10 EDCE O=C(O)C[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccccn2)SC1=S 6816974 RLHIQOSZYUOTEZ-MOIHINDBSA-N 338.366 1.211 10 10 EDCE CCCOc1ccc(CN2CCN(CC(=O)NC(C)C)CC2)c(O)c1 119596485 ODRDTEVQRRAHNE-UHFFFAOYSA-N 349.475 1.823 10 10 EDCE Cc1ccc(C(=O)N2CCC(N(C)c3cccnn3)CC2)c(O)c1O 179502599 CKFGDWQFEZHFCR-UHFFFAOYSA-N 342.399 1.937 10 10 EDCE COc1ccc(O)c(CNC(=O)NCCc2nc(C(C)C)no2)c1 114597768 PDGXRYIWFQVFJJ-UHFFFAOYSA-N 334.376 1.949 10 10 EDCE CC[C@@H]1CN(Cc2cc(OC)c(OC)cc2O)CCN1C[C@@H](C)O 180085406 ZBNMGAOLZJWZKZ-UKRRQHHQSA-N 338.448 1.686 10 10 EDCE CN(C)C(=O)c1ccc(S(=O)(=O)NCCc2ccc(N)cc2)cc1 193338514 VXIWDEBMEMUZAW-UHFFFAOYSA-N 347.440 1.492 10 10 EDCE C[C@H](NCCNS(=O)(=O)c1cccnc1)c1ccc(N(C)C)cc1 90584038 WQMVLUJMLFJZHE-AWEZNQCLSA-N 348.472 1.777 10 10 EDCE CN[C@@H]1COC[C@@H]1C(=O)NCc1ccc(C)c(Br)c1O 2380756310 KCMDMZDKEAELEX-WDEREUQCSA-N 343.221 1.314 10 10 EDCE COc1cc(O)ccc1NS(=O)(=O)C[C@@H](OC)C1CCOCC1 901703455 FSKOKWRLVCFUMB-OAHLLOKOSA-N 345.417 1.584 10 10 EDCE COC(=O)c1cn(CCNC/C=C\c2ccc(N(C)C)cc2)nn1 835048893 CODFJMMNXYWKLH-PLNGDYQASA-N 329.404 1.434 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCCCCN1CCC[C@H]1CO 588408327 KNFJRPALKSWPRZ-LYASGUKUSA-N 334.416 1.464 10 10 EDCE CO[C@@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)[C@](C)(CO)C1 913658745 PJSSIAHGUTZGEH-QFYYESIMSA-N 337.397 1.924 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC[C@H](C)C3)CC2)cc1F 847557632 UJESHIFFMUAAET-AWEZNQCLSA-N 335.423 1.825 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1C[C@H](C)N(CCO)C[C@@H]1C 842181468 YGRVRCXWTWYBGS-HOTGVXAUSA-N 348.491 1.658 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)CCN(C)C)C2)cc1 852188083 WGBHZUGRPUYOHC-CABCVRRESA-N 334.464 1.913 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnc4n3CCC4)C2)cc1 855224543 LRUALUORVSWOCQ-CYBMUJFWSA-N 326.400 1.847 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(CCF)c3)C2)cc1 855225703 LOPVCRUCJKJUEX-CQSZACIVSA-N 332.379 1.870 10 10 EDCE CC[C@H](NC[C@]12COCCN1C(=O)COC2)c1ccc(F)cc1O 866553798 NXKVEFHSEUIEET-WMLDXEAASA-N 338.379 1.200 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CN1 861652666 JVLQCPAGKWALIW-GDBMZVCRSA-N 346.475 1.587 10 10 EDCE Oc1cccc(Br)c1CNC1CN(c2ccncn2)C1 865748078 XEXLEHUUVWYZIP-UHFFFAOYSA-N 335.205 1.923 10 10 EDCE CN1CCN(c2cccc(C(=O)N(C)Cc3ccccc3O)n2)CC1 767174564 UZXIFFLZBFFAAQ-UHFFFAOYSA-N 340.427 1.811 10 10 EDCE Cc1ccc(O)c(CNC(=O)N[C@@H]2CCCN(c3ncccn3)C2)c1 1118801878 WVGHIAJRFOGSGM-OAHLLOKOSA-N 341.415 1.959 10 10 EDCE CCN(CC)c1ccc(CN2CCn3c(CO)nnc3C2)cc1F 769517055 OFPPMYLSAOAJHM-UHFFFAOYSA-N 333.411 1.772 10 10 EDCE Cc1nc2n(n1)CCN(C(=O)c1cc3cc(O)c(O)cc3s1)C2 896827530 OLPFGOJMFPOPOC-UHFFFAOYSA-N 330.369 1.868 10 10 EDCE CC1(C)C[C@H](O)[C@H](O)CN1c1ccc(CN)c(Br)c1 2132116375 PWSXFJAMZDVPEU-QWHCGFSZSA-N 329.238 1.618 10 10 EDCE COc1ccc(CNC2(CNC(=O)CCn3cncn3)CC2)cc1C 1277001708 GVZLOZNJVKVELG-UHFFFAOYSA-N 343.431 1.424 10 10 EDCE CC[C@@H](C)CNC[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1278838191 HECGRCJSLSJRJB-IUODEOHRSA-N 349.435 1.918 10 10 EDCE CC(=O)N/C(=C\c1ccccc1)C(=O)NCc1ccc(O)cc1O 1299570983 OGSWRMQQUVQZOX-SXGWCWSVSA-N 326.352 1.891 10 10 EDCE O=C(NCc1cccc(O)c1O)c1ccnc(NC(=O)C2CC2)c1 1455315940 MCURYYYCWNVPOZ-UHFFFAOYSA-N 327.340 1.771 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H](C1CCOCC1)C1(CO)CCC1 1299978345 XQVGBSOGEQTNAA-SFHVURJKSA-N 349.427 1.714 10 10 EDCE Cc1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ncc1C(N)=O 1611430875 HULYDDUVVKSOMV-SNVBAGLBSA-N 329.356 1.261 10 10 EDCE CS(=O)(=O)CCN(C(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1545844332 AMJWXQMZYKOMHO-UHFFFAOYSA-N 338.389 1.498 10 10 EDCE CCOc1ccc(N2CCN(CC(=O)N=c3cc[nH]cc3)CC2)cc1 1559667075 KCSFLAFFDZNNSC-UHFFFAOYSA-N 340.427 1.663 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3ccn(C)n3)CC2)cc1C 1499448666 OGLGKORMSIJLTI-UHFFFAOYSA-N 328.416 1.789 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@H]2CCN(C)C2=O)cc1C 1497654647 KRQHDRQQTYWBTF-YIEVGGLXSA-N 345.443 1.244 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@H](n1cncn1)C(F)(F)F 1632049098 XHDYODABSVMNIQ-QQHVMHFCSA-N 342.277 1.622 10 10 EDCE CCNC(=O)CN(C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1498462603 AAXVMYIIEACIQV-NSHDSACASA-N 348.407 1.035 10 10 EDCE CC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CCN(CCO)CC1 1724307106 RODHFBAGUPSTEM-UHFFFAOYSA-N 347.419 1.673 10 10 EDCE NC(=O)c1nccnc1NCc1ccc(N2CCC(O)CC2)cc1 1652073281 FMFOOVLSPVNDEZ-UHFFFAOYSA-N 327.388 1.149 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CN3CCN2C[C@H]3C)cc1 1587459625 DHLGGORGMVKIRF-APWZRJJASA-N 344.503 1.880 10 10 EDCE CN(C)CCOc1ccccc1CNC(=O)Cc1ccc(O)c(O)c1 1597819085 FIRMIHBTXZPCTC-UHFFFAOYSA-N 344.411 1.897 10 10 EDCE Nc1ccc(CNc2nc[nH]c(=O)c2I)cc1 164523400 VPZMZXJTQISDPM-UHFFFAOYSA-N 342.140 1.569 10 10 EDCE CNCc1ccc(N2CCC[C@@H]3C(=O)NC[C@@H]32)cc1Br 234421730 VFSBIXKMYOJKRS-JSGCOSHPSA-N 338.249 1.883 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@H](C(=O)NCCN=[N+]=[N-])[C@@H]2C1 1895874910 DASXYSNLSXGBDM-DCAQKATOSA-N 325.369 1.295 10 10 EDCE CO[C@@H]1C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 2010394168 BAJFXMOSDZHDMV-CMPLNLGQSA-N 339.396 1.780 10 10 EDCE CNCc1ccc(N2CC(=O)N3CCC[C@H]3C2)cc1Br 2158197142 INFYRCSIVCBKRY-ZDUSSCGKSA-N 338.249 1.980 10 10 EDCE CCN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C(C)(C)CO 688322740 WLZYYYOFJYNUOD-GFCCVEGCSA-N 342.237 1.998 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@@H](O)[C@H]3C4)c(Br)cc2[C@H]1O 2177183017 FTYCVHZLBYNCJY-IKNORSCCSA-N 339.189 1.394 10 10 EDCE CNCc1ccc(N2CC[C@H](O)[C@H](CO)C2)c(Br)c1 396829985 PPBOGTNKVFFPJU-FZMZJTMJSA-N 329.238 1.348 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)cc1Br 2173320647 RJDMAUDHQFQHBI-FHOOGIDHSA-N 341.249 1.489 10 10 EDCE CCNC(=O)c1cnn(Cc2ccc(Br)cc2O)c1O 2070490805 ZPHQCVVRFDXMPE-UHFFFAOYSA-N 340.177 1.855 10 10 EDCE OCc1ccc(N2CCO[C@H]3COCC[C@H]32)c(Br)c1 2087482944 GDLFPIOSYDTGQL-KGLIPLIRSA-N 328.206 1.936 10 10 EDCE COc1ccc(Br)c(CNC(C)(C)c2nn[nH]n2)c1O 2208760558 UWVCWHSXJLQNDT-UHFFFAOYSA-N 342.197 1.701 10 10 EDCE O=C(C=Cc1ccccc1)NCCNC(=O)c1cc(O)c(O)c(O)c1 2328570084 RYYCUZBGXPLDND-UHFFFAOYSA-N 342.351 1.363 10 10 EDCE Cc1ccc(CN2C[C@@H](C(=O)O)CC2=O)c(O)c1Br 2352636412 LFIFIBZIKMCPQL-VIFPVBQESA-N 328.162 1.896 10 10 EDCE CCc1nc2n(n1)C[C@@H](NC(=O)NCc1cccc(OC)c1O)CC2 174971074 WARONPYTYFXXTK-LBPRGKRZSA-N 345.403 1.369 10 10 EDCE CC(C)(C)OC(=O)N1CC(C)(O[C@@H](N)Cc2ccc(O)c(O)c2)C1 1952910872 OPIPYDHIONIKBG-CQSZACIVSA-N 338.404 1.951 10 10 EDCE C[C@@H]1CN(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)C[C@@H](C)O1 69649735 JXOCCQDTIQLRLI-VXGBXAGGSA-N 345.440 1.335 10 10 EDCE CC(C)NC(=O)CN(CC(=O)NC(C)C)c1ccc2c(c1)CCO2 31466194 VYDIHLBUBINSGA-UHFFFAOYSA-N 333.432 1.477 10 10 EDCE Cc1cc(CNC(=O)NCc2ccc(N(C)C)cc2)nc(N(C)C)n1 189811242 FSWPWJYKBOSTHR-UHFFFAOYSA-N 342.447 1.916 10 10 EDCE COc1ccc2ccc(O)c(CN3C[C@@H](C(N)=O)O[C@H](C)C3)c2c1 120220488 IXBSASHKJAKCBH-DIFFPNOSSA-N 330.384 1.629 10 10 EDCE CCN(c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-])[C@@H]1CCNC1=O 281735033 WLXVWYYYKBLMEB-SCXUMTSISA-N 333.344 1.496 10 10 EDCE CN(CC1CC1)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 283955180 OEQHKIJJCKJVJP-UHFFFAOYSA-N 349.406 1.147 10 10 EDCE Cc1ccc(CNC(=O)C[C@@H]2CNCCO2)c(O)c1Br 2381138389 VBCJBNMRGIEIFZ-LLVKDONJSA-N 343.221 1.458 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1 808501578 LSNCPHCNXUQLRH-VIFPVBQESA-N 325.267 1.019 10 10 EDCE COc1cc(C(=O)OCC(=O)C(C)=O)cc(OC)c1OC(F)F 808523361 FOVBTCYDWZKWNF-UHFFFAOYSA-N 332.255 1.620 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)CCOCC2CCC2)c1 827199332 BSNNKICTKUYTHD-UHFFFAOYSA-N 329.418 1.637 10 10 EDCE CO[C@@H](CS(=O)(=O)NCc1ccc(N(C)C)c(F)c1)C1CC1 827072157 NZXFQTLNMVKYDQ-HNNXBMFYSA-N 330.425 1.736 10 10 EDCE COC(=O)C[C@H](CNC(=O)NCc1cccc(OC)c1O)C1CC1 822745515 NJXJPNKOEFZPGV-CYBMUJFWSA-N 336.388 1.789 10 10 EDCE O=C([C@@H]1CC[C@H](CN2CCOCC2)O1)N1Cc2cccc(O)c2C1 828325917 CAOVDVYCYHQVNK-PBHICJAKSA-N 332.400 1.114 10 10 EDCE CCOC(=O)CN(Cc1nc(C)cc(O)n1)Cc1ccccc1O 823576774 YNWXVIYMVJYGIC-UHFFFAOYSA-N 331.372 1.762 10 10 EDCE C[C@@H](NC(=O)/C=C/Cn1cncn1)c1ccc(N2CCOCC2)cc1 900386986 NDUZYHZQTRMBTN-XYBNCVKDSA-N 341.415 1.548 10 10 EDCE Cn1nccc1[C@H](CO)NC(=O)NCc1ccc(N2CCCC2)cc1 837625505 OMGPSASMANEFBM-INIZCTEOSA-N 343.431 1.553 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(c2nc(O)n[nH]2)CC1 843874530 ANMDGKRECRLMCO-RQOWECAXSA-N 330.344 1.341 10 10 EDCE COC(=O)[C@@H]1[C@H](CNC(=O)/C=C\c2ccc(O)c(O)c2)C1(F)F 918276907 OXQURUMSTUYCTQ-QSHIROIYSA-N 327.283 1.282 10 10 EDCE COc1c(C)cccc1CNC(=O)C(=O)NCCc1ccc(N)cc1 848613561 LAGJHTHMPCKNGT-UHFFFAOYSA-N 341.411 1.561 10 10 EDCE c1cc(N2CCOCC2)ccc1CNCc1noc2c1COCC2 923014926 MCAOPXLXFMRAPX-UHFFFAOYSA-N 329.400 1.874 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)c3ncn(C)n3)C2)cc1 852268133 GVSLBPXWYFQBCF-QWHCGFSZSA-N 344.419 1.463 10 10 EDCE CCN(CC)c1ccc(CNC(C)(C)CNS(C)(=O)=O)cc1 922638120 RNNSDCNQLCGNCC-UHFFFAOYSA-N 327.494 1.950 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@@]4(O)C[C@H]4C3)C2)cc1 854187595 NLUUXDWSOQIEHI-ZRGWGRIASA-N 345.443 1.688 10 10 EDCE CCOC1(CS(=O)(=O)N[C@@H](C)c2ccccc2O)CCOCC1 867836465 UIXYPMVUSXQRKH-ZDUSSCGKSA-N 343.445 1.958 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCCCC[C@H](N)C1 868357413 WYHRHODJBQAHIY-INIZCTEOSA-N 346.475 1.441 10 10 EDCE NC(=O)C[C@@H]1CN(Cc2c(O)cccc2Br)CCO1 862534385 AOIQYIWKNYAVKO-SECBINFHSA-N 329.194 1.231 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(CC[S@](C)=O)CC2)c1O 775718359 ZXINNYHMAOQLOF-NRFANRHFSA-N 330.881 1.850 10 10 EDCE COC(=O)c1cncc(NC(=O)NCCc2ccc(O)c(O)c2)c1 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KDJBLIMYBJVLCL-UHFFFAOYSA-N 345.174 1.952 10 10 EDCE C[C@]1(CCCO)CCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1348641003 WCDROKFSZXTSOL-GOSISDBHSA-N 332.400 1.388 10 10 EDCE CNC(=O)[C@H](C)N[C@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1266191902 MKPWSBSJYHFEQE-MNOVXSKESA-N 348.407 1.082 10 10 EDCE Cc1nc[nH]c1CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1542403255 PQSTVIUIBOMAIP-CYBMUJFWSA-N 328.416 1.975 10 10 EDCE CCNC(=O)CC(=O)N[C@@H](C)[C@H](C)NCc1ccc(OC)c(C)c1 1717406435 GVJSKWIZUWBCET-KBPBESRZSA-N 335.448 1.513 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2ccc(=O)n(C)n2)cc1C 1567075691 FLEUFBGGPRDWAP-ZDUSSCGKSA-N 344.415 1.005 10 10 EDCE CCNC(=O)CC(=O)N1CC[C@H](CNCc2ccc(OC)c(C)c2)C1 1567119974 VYGKYIZUEPPCGD-MRXNPFEDSA-N 347.459 1.468 10 10 EDCE O=C(N[C@H]1CN(c2ccc(F)cc2)C1=O)c1c(F)ccc(O)c1O 1648708803 YCBIQJPRBUEENR-NSHDSACASA-N 334.278 1.521 10 10 EDCE CN(CCCO)CCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1570218263 QIYWXMRWBKPVDU-UHFFFAOYSA-N 335.408 1.625 10 10 EDCE COc1ccc(CN[C@@H]2CN(C(=O)CNC(C)=O)C[C@@H]2C)cc1C 1570329577 AJKLZDWWRVGAFY-XJKSGUPXSA-N 333.432 1.076 10 10 EDCE COc1cc(NC(=O)Cc2ccc(O)c(O)c2)ccc1NC(N)=O 1595778387 NCZAHPVFXFBEDZ-UHFFFAOYSA-N 331.328 1.778 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2ccns2)cc1C 1672623254 KHUSUMXRATVDNX-UHFFFAOYSA-N 349.456 1.684 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](CO)c3ncc[nH]3)C2)cc1 1687025735 UACZLTNJIHFZGK-IUODEOHRSA-N 345.403 1.030 10 10 EDCE CO[C@H]1COCC[C@H]1Cn1c(C)nnc1N(C)Cc1ccccc1O 1697695358 DVBPNHKUHUCOIQ-RDJZCZTQSA-N 346.431 1.980 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1cn(-c2ccc(F)cc2)nn1 159099681 OAXMZWCJPGVFDW-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE Nc1ccc(OC(=O)NS(=O)(=O)c2ccc3nc(O)oc3c2)cc1 1858614506 AMFPZHSMKTUIEA-UHFFFAOYSA-N 349.324 1.593 10 10 EDCE CCCCS(=O)(=O)N1CCN(C(=O)Oc2ccc(N)cc2)CC1 1858628211 UFTXDWLFWJWVRT-UHFFFAOYSA-N 341.433 1.515 10 10 EDCE CN1C(=O)C(=Cc2ccc(OC[C@@H]3CCCO3)cc2)C(=O)N(C)C1=O 14175568 FVKFABQBHSXUOZ-AWEZNQCLSA-N 344.367 1.678 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1OCC[C@@H]1O 1952399016 CEIZLQFKRDPZNW-OSAQELSMSA-N 339.388 1.683 10 10 EDCE CO[C@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)C1CN(C(=O)OC(C)(C)C)C1 2004773047 BYCUQTOCAXURTE-WBIUFABUSA-N 340.420 1.134 10 10 EDCE Cc1cccc(O)c1CNC1(C(N)=O)CN(C(=O)OC(C)(C)C)C1 1997969518 YSKHBKCRHYFZCA-UHFFFAOYSA-N 335.404 1.265 10 10 EDCE CC(C)(C)OC(=O)NOCCC(=O)NCCc1ccc(O)c(O)c1 2010218343 RLUAPLDPIUAXOL-UHFFFAOYSA-N 340.376 1.603 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)NCCc1ccc(N)cc1 2022873477 SWXZSNGRRGBKNJ-UHFFFAOYSA-N 337.420 1.157 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3C[C@@H](O)C[C@@H]3C2)c(Br)c1 405535600 ZPVVOVKNQDMIKG-RTXFEEFZSA-N 340.265 1.724 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)[C@@H](CO)C2)c(Br)c1 316840756 ZYELELPVEMKUAW-IUODEOHRSA-N 343.265 1.738 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)cc1Br 2178085382 FDQQPSRGDVHHJF-RBZYPMLTSA-N 345.212 1.490 10 10 EDCE C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)O)c1ccccc1O 1454805458 KCBLFBFNMZHQBF-GYSYKLTISA-N 338.404 1.844 10 10 EDCE N[C@@H]1CC(C(=O)N2CCCc3c(Br)cccc32)=C[C@H]1O 2188021638 NWPFOMKYUMAKBF-TZMCWYRMSA-N 337.217 1.747 10 10 EDCE NCc1cc(F)c(N2CCn3ncnc3C2)cc1Br 2114038791 RBPYUEFBNAFHDB-UHFFFAOYSA-N 326.173 1.659 10 10 EDCE CC(C)(C)C[C@H](CNC(=O)OC(C)(C)C)COc1nnc(=N)[nH]n1 2213790005 OUGFNZHTRPVXCA-SNVBAGLBSA-N 340.428 1.635 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@@]3(CO)C2)c(Br)c1 2226164940 XDCPXRQGNWYHTB-FZMZJTMJSA-N 327.222 1.353 10 10 EDCE CSc1ncc(CNc2cc(N)cc(S(N)(=O)=O)c2)s1 2284697322 FRIZUCIDTDOVAM-UHFFFAOYSA-N 330.460 1.707 10 10 EDCE CNC[C@@]1(O)CCCN(Cc2cc(Br)cc(F)c2O)C1 2286346624 YEDHHLFKHBVAFQ-AWEZNQCLSA-N 347.228 1.840 10 10 EDCE Cc1ccc(CNC(=O)[C@H](F)C2CNC2)c(O)c1Br 2352621055 XVPIWNQRCZRHOG-LLVKDONJSA-N 331.185 1.637 10 10 EDCE Cc1ccc(CNCC2CN(C(N)=O)C2)c(O)c1Br 2352682355 WXOUCBUVIGBSOG-UHFFFAOYSA-N 328.210 1.563 10 10 EDCE CN(CC(=O)N(C)CC1CC1)Cc1ccc(N2CCOCC2)cc1 113499074 WHGSOWLSMNSBNF-UHFFFAOYSA-N 331.460 1.823 10 10 EDCE Cc1cc(O)c(O)cc1CCNC(=O)CNC(=O)c1ccccc1 170187543 VVZOFRMPORAGSF-UHFFFAOYSA-N 328.368 1.495 10 10 EDCE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@H]1c1cc(N)ccc1O 1953067067 XNJNHZWNHYCWEW-LBPRGKRZSA-N 342.417 1.681 10 10 EDCE COC[C@@H](C[C@H](N)Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952893594 LPLJOOVKSNVHOW-CHWSQXEVSA-N 340.420 1.897 10 10 EDCE NCc1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(F)c1Br 2357592650 LOLNESDBYYDTBP-JWKJARAVSA-N 345.212 1.367 10 10 EDCE CCN1CCN(CC(=O)N2CCOc3cc(N(C)C)ccc32)CC1 74191385 KHXOLDMTWPYXEE-UHFFFAOYSA-N 332.448 1.116 10 10 EDCE CN1C[C@H](NC(=O)NCc2ccc3c(c2)CCCN3C)CCC1=O 128807863 PTCODNPQMVZHQU-OAHLLOKOSA-N 330.432 1.489 10 10 EDCE C[C@@H](CO)N(C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 130462173 FPTCNVJRTOPDAI-LBPRGKRZSA-N 325.384 1.185 10 10 EDCE CC(C)S(=O)(=O)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255078790 CSKGDMCWIFJIKP-YVMONPNESA-N 338.429 1.391 10 10 EDCE CC(C)CN1C(=O)/C(=C/Nc2cccnc2Cl)C(=O)NC1=S 255508524 IQTQIIQGGWAFPS-RMKNXTFCSA-N 338.820 1.930 10 10 EDCE O=C(N1CCNCC1)N1CCN(Cc2c(O)cccc2Cl)CC1 530243454 RAWGQUUGMLSIRD-UHFFFAOYSA-N 338.839 1.188 10 10 EDCE Cc1ccc(CN=c2ccc(C(N)=O)n[nH]2)c(O)c1Br 2380738538 ZEIWTCDKUIBNSW-UHFFFAOYSA-N 337.177 1.386 10 10 EDCE COc1ccc(N(C)Cc2nccn2S(=O)(=O)N(C)C)cc1F 290781571 CISAWLWOJZWHLD-UHFFFAOYSA-N 342.396 1.322 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@H](CO)c2cccnc2)c1O 809778741 VMPCBCTUCGSTHB-CYBMUJFWSA-N 333.344 1.570 10 10 EDCE CCn1ncc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1 292930826 YXUDIASDEZDLHI-UHFFFAOYSA-N 333.367 1.204 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC34CC4)cc2)C1 817428349 JEMSLAIXKDEOQU-HOCLYGCPSA-N 327.428 1.805 10 10 EDCE CCC/C=C/[C@H](O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 918914102 QSMMAFNRAUGWDZ-QWNKOJSDSA-N 331.460 1.772 10 10 EDCE Cn1nc(O)c2c1CN(C(=O)c1cc3cc(O)c(O)cc3s1)CC2 913028420 XFKHDFLELLEUSK-UHFFFAOYSA-N 345.380 1.950 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cc1 848229071 GNHXTOMXXJFUQX-CVEARBPZSA-N 331.460 1.980 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCN(C)S1(=O)=O 843775675 BUMOWBCWSVDHTR-HNNXBMFYSA-N 339.461 1.135 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CC[C@H](C2CC2)N1C(=O)OC(C)(C)C 845428148 JCCMQTRSWZSILF-CHWSQXEVSA-N 339.388 1.866 10 10 EDCE Cn1nccc1[C@@H]1COCCN1C(=O)/C=C/c1ccc(O)c(O)c1 846611719 KCCZAGUZKNVTKK-KQIUPUNMSA-N 329.356 1.445 10 10 EDCE C[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCS1 929238037 VNHMGKKZVPDDPT-OCCSQVGLSA-N 335.473 1.769 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC(C(C)(C)O)C3)C2)cc1 854298856 IRHUIEBWOZUDOU-AWEZNQCLSA-N 333.432 1.686 10 10 EDCE CS(C)(=O)=NS(=O)(=O)CCNCc1c(O)cccc1Cl 922492327 PBHSWLAQGLIFAC-UHFFFAOYSA-N 340.854 1.193 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCC3(CN)CC3)C2)cc1 851668179 CXSIKSMGRYFTKD-CQSZACIVSA-N 332.448 1.702 10 10 EDCE Cc1cn2c(n1)C[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)CC2 860697434 WKQCHAMGJUQAEH-RISCZKNCSA-N 329.400 1.913 10 10 EDCE C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)N(C)CC(=O)NC1CC1 774483357 KAHOBMURCDPDAM-ZIAGYGMSSA-N 346.475 1.529 10 10 EDCE CCn1nccc1S(=O)(=O)Nc1ccc(O)cc1C(=O)OC 775286665 BNWIAGIYUDZYGC-UHFFFAOYSA-N 325.346 1.196 10 10 EDCE NC(=O)c1coc(CNCc2ccc(N3CCOCC3)c(F)c2)c1 778201454 IAZAQVJOWKWGSE-UHFFFAOYSA-N 333.363 1.644 10 10 EDCE C[C@H]1C[C@H](C)CN(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)C1 775289289 UDZXYMSXRYYCIN-UWVGGRQHSA-N 329.378 1.935 10 10 EDCE NC(=O)[C@@H]1CC[C@H](C(=O)NCc2cccc(Br)c2O)C1 897576032 BMWPVJMOJGWDTJ-BDAKNGLRSA-N 341.205 1.673 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CCCN(CC(F)(F)F)C1=O 1304053966 YBIYBCWFXAOOLM-VIFPVBQESA-N 346.305 1.515 10 10 EDCE CC(C)C[C@H](CNC[C@@H](C)O)NC(=O)c1ccc(N=NC(N)=O)cc1 1319644132 WKBVMGFWTDPMNO-IUODEOHRSA-N 349.435 1.964 10 10 EDCE CO[C@H]1C[C@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1333932079 SSUZYKZIJOABNG-KOMQPUFPSA-N 333.432 1.252 10 10 EDCE CCO[C@@H]1C[C@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1(C)C 1261859877 HUGKQADZDKPTAM-JKSUJKDBSA-N 346.427 1.896 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@]3(C)COC[C@@]3(C)C2)cc1 1347411289 OGKPWEYGRWBWRB-KDURUIRLSA-N 345.443 1.254 10 10 EDCE CO[C@H](C)C(=O)N[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1283347456 GSPIZRPTAXJIEZ-ZWNOBZJWSA-N 347.375 1.215 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccn(C)n1 1295591218 YBUVAVBBSIISGQ-UHFFFAOYSA-N 337.763 1.595 10 10 EDCE CC(C)(C)OC(=O)[C@@]1(C(=O)NCc2ccc(O)c(O)c2)CCCO1 1635958886 BXUWTZRKAIFRFY-KRWDZBQOSA-N 337.372 1.605 10 10 EDCE CC(C)[C@H](C(=O)NCc1c(O)cccc1O)N1C[C@H](C)O[C@H](C)C1 1635843302 LGIBOJJCMZPOKA-IIYDPXPESA-N 336.432 1.848 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCN(Cc2ccccc2)C1=O 1631707224 XORSJUULWVQKRJ-HNNXBMFYSA-N 340.379 1.558 10 10 EDCE COc1ccc(CNCC2CC(NC(=O)CCN(C)C)C2)cc1C 1733954002 XWWJSIJKRXDHPZ-UHFFFAOYSA-N 333.476 1.940 10 10 EDCE O=C(Nc1ccc([N+](=O)[O-])cc1C(=O)O)c1cc(O)c(O)c(O)c1 1865875598 AZSZAWHKHBKMCL-UHFFFAOYSA-N 334.240 1.662 10 10 EDCE CC[C@@H]1C(=O)NCCN1c1ccc(CNC)cc1Br 234127626 RPDNNGJUPNXDFE-GFCCVEGCSA-N 326.238 1.883 10 10 EDCE CCOC(=O)[C@@](C)(N)c1cc(I)ccc1O 1951728263 LDFHRQLDUFXSHO-NSHDSACASA-N 335.141 1.734 10 10 EDCE CO[C@H](CCN)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951836401 YTUWJJGKJXXXHL-IUODEOHRSA-N 340.420 1.897 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@](C)(O)CCN 1951832807 JEEGMUZFIRVUAW-RHSMWYFYSA-N 340.420 1.633 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2CC(=O)N(C)C2)c1O 1969786597 AVFCEQRWXOOQFO-VIFPVBQESA-N 343.221 1.731 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)NCc1ccccc1O 2010156506 DLVCBGOAYDNWRT-UHFFFAOYSA-N 337.420 1.465 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(NCc2ccc(O)cc2O)C1 2016028634 HAFVBIDVJNCOBG-KRWDZBQOSA-N 338.404 1.559 10 10 EDCE CCN(c1ccc([C@H](C)O)cc1Br)[C@@H]1CC(=O)NC1=O 2171207260 UPANNXOHZZVSIJ-QPUJVOFHSA-N 341.205 1.744 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@]3(CNC(=O)N3)C2)c(Br)c1 2177696945 XMGZJPXXWNPNAM-OTYXRUKQSA-N 339.237 1.731 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC4(COC4)C3)c(Br)cc21 697109564 CMYGLAZYENWTLE-LBPRGKRZSA-N 338.205 1.498 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)Cc2ccc(N)cc2)[C@@H](O)C1 2052720294 JQQPWEZVLYILMV-CABCVRRESA-N 349.431 1.298 10 10 EDCE C[C@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1C(=O)c1ccc(O)c(O)c1 2054401434 RVHFIWCJGSKVFB-WCBMZHEXSA-N 346.305 1.769 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2104412755 XNRMVXRKWXLDSE-JQBFEJRSSA-N 328.206 1.433 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@@H](CO)C2)c(Br)c1 2098210101 XBHZZOJMPGHNLR-GHMZBOCLSA-N 329.238 1.914 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)C3(C)COC3)c(Br)cc21 2208303678 BIHKHLIGBGIXDK-GFCCVEGCSA-N 340.221 1.887 10 10 EDCE COC(=O)NCCNCc1c(Br)ccc(OC)c1O 2227748259 MDSXDDYTMXUOHI-UHFFFAOYSA-N 333.182 1.609 10 10 EDCE NC(=O)[C@@H]1C[C@@H](N)CN(c2ccc(OCc3ccccc3)cc2)C1 2299504273 LZAOZSWIGLWRRI-HZPDHXFCSA-N 325.412 1.905 10 10 EDCE OCC[C@@H](COCc1ccccc1)NCc1ccc(O)c(O)c1O 2303622153 WAFSNHXXDQKDLJ-HNNXBMFYSA-N 333.384 1.861 10 10 EDCE Cc1ccc(CN2CCOC[C@@H]2C(N)=O)c(O)c1Br 2352950601 VVAZLVXIKOHYFX-SNVBAGLBSA-N 329.194 1.149 10 10 EDCE C[C@H](N)[C@@H](O)C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952403822 VCNIDRIFXDWFRU-SUHUHFCYSA-N 340.420 1.632 10 10 EDCE CC(C)(C)OC(=O)N1CC(=O)C[C@H]1[C@H](N)Cc1ccc(O)c(O)c1 1952924952 KFAGTVFYJDMEIT-OLZOCXBDSA-N 336.388 1.546 10 10 EDCE CCOc1cccc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)c1O 124460797 ZURVSLRFYBXDFQ-INIZCTEOSA-N 348.443 1.862 10 10 EDCE CCOc1ccc(O)c(CN2CCN(c3cc(OC)ncn3)CC2)c1 184437612 XXNJEEYDAATEIT-UHFFFAOYSA-N 344.415 1.912 10 10 EDCE CCC1=C(C(=O)OC)[C@@H](c2ccc(N(C)C)cc2)n2nnnc2N1 45895976 JFYWKUYBPMJESI-CQSZACIVSA-N 328.376 1.591 10 10 EDCE CCN(CC)CC(=O)N1CCN(Cc2ccc(OC)cc2O)CC1 93046272 KVZDAMAYKBVTGS-UHFFFAOYSA-N 335.448 1.387 10 10 EDCE CC1(N2CCOCC2)CCN(Cc2cc3c(cc2O)OCO3)CC1 529665302 WWOBOMSEAYNHLH-UHFFFAOYSA-N 334.416 1.808 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CNC[C@H](O)C2)c(O)c1Br 2381147065 OQYJPCRBNZWOAL-WDEREUQCSA-N 343.221 1.050 10 10 EDCE CC(C)NS(=O)(=O)NCCNCc1cc(Cl)c(F)cc1O 294794062 VKCNRPOMQLZLQA-UHFFFAOYSA-N 339.820 1.107 10 10 EDCE O=C(NCc1cc(Br)ccc1O)c1cc2n(n1)CCO2 811523537 OSLGSLIEJSNKIV-UHFFFAOYSA-N 338.161 1.674 10 10 EDCE C[C@@H](NC[C@]1(CO)COCCN1C)c1cc2c(cc1O)CCCC2 903283096 WRBGKWLFINWOPK-KUHUBIRLSA-N 334.460 1.615 10 10 EDCE O=C(CN1CCN(C2CC2)C1=O)NCCCSc1nccs1 827475384 ZPYISIBTVTUEEL-UHFFFAOYSA-N 340.474 1.642 10 10 EDCE COCCCOC1CN(Cc2ccc(N3CCOCC3)c(F)c2)C1 839132548 BWYSLQWFWLXORI-UHFFFAOYSA-N 338.423 1.900 10 10 EDCE C=CC(=O)N(CC)CC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 912291971 GHLQTUIZMYRUEG-AWEZNQCLSA-N 331.416 1.425 10 10 EDCE CN=[S@@](C)(=O)CCNC(=O)c1cc2cc(O)c(O)cc2s1 912781718 QFXRRWIQXKABPF-NRFANRHFSA-N 328.415 1.770 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)c3ccc(N)cc3)C2)cc1 849415981 JCEIRDALJJCVTE-AWEZNQCLSA-N 347.440 1.835 10 10 EDCE COCCO[C@@H]1CCN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])C1 844214409 PXNYSHYBHKLECP-HSBHDXMMSA-N 336.344 1.934 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CCCNC1 843490427 YYLXEZYARJRBRQ-LLVKDONJSA-N 340.807 1.547 10 10 EDCE COC(=O)CCNC(=O)CCN[C@@H](C)c1cc(F)cc(F)c1O 858541970 QNNWHFPUMQABHP-VIFPVBQESA-N 330.331 1.390 10 10 EDCE CC(=O)C(=O)COC(=O)C1(NC(=O)OC(C)(C)C)CC2(CCC2)C1 850236137 APGQKOXPLIWIRF-UHFFFAOYSA-N 339.388 1.915 10 10 EDCE COc1ccc(N2CCC(NC(=O)NCC34CC(CN3)C4)CC2)cc1 851656769 OUKROROHLQDCGE-UHFFFAOYSA-N 344.459 1.715 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3c([N+](=O)[O-])cnn3C)C2)cc1 855233661 KEVUINRFBPYTAO-NSHDSACASA-N 345.359 1.346 10 10 EDCE CC(C)(C)c1cc2n(n1)CCN(C(=O)C(=O)Nc1ccc(N)cc1)C2 927873530 UDCVBQOXEMZZNG-UHFFFAOYSA-N 341.415 1.744 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](C)CCCO)C2)cc1 854297019 IITZUKVZGVMGLJ-CABCVRRESA-N 335.448 1.982 10 10 EDCE Cc1cc(Br)cc(CNC[C@H]2COCCN2C)c1O 862508527 SWZVIKAOQCYHQB-ZDUSSCGKSA-N 329.238 1.883 10 10 EDCE C[C@H](NS(=O)(=O)c1cnn([C@@H]2CCOC2)c1)c1ccccc1O 867834617 RWXKFNKHGXLWMY-NWDGAFQWSA-N 337.401 1.590 10 10 EDCE C[C@@H](NC[C@@]12COCCN1C(=O)OC2)c1cc(F)cc(F)c1O 866522231 UGBSFOLAYSZMGC-PSLIRLAXSA-N 328.315 1.542 10 10 EDCE CC(=O)N1CCN(Cc2ccc(N3CCN(C)CC3)cc2)[C@@H](C)C1 775707183 FASIFBDEVNGQPR-INIZCTEOSA-N 330.476 1.491 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC(O)(C4CC4)C3)C2)cc1 1118607324 IOGQOLAGDUVVPM-AWEZNQCLSA-N 331.416 1.440 10 10 EDCE O=C(N[C@@H]1CCN(c2ccccc2)C1=O)c1c(F)ccc(O)c1O 789977176 RCFCATVHDJIBCP-GFCCVEGCSA-N 330.315 1.772 10 10 EDCE O=C(NCC[C@@H]1CCOC1)C(=O)NCc1ccc(N2CCCC2)cc1 788938549 SMFMHLICBLPOEJ-MRXNPFEDSA-N 345.443 1.446 10 10 EDCE O=C1c2ccccc2C(=O)N1COc1ccc(N2CCNCC2)cc1 392725602 LEEFABKAUGSHAX-UHFFFAOYSA-N 337.379 1.729 10 10 EDCE Cc1ccc(CNC(=O)c2ccc(N=NC(N)=O)cc2)c(=O)n1C 1156805064 ARQKALMBTYNNHI-UHFFFAOYSA-N 327.344 1.786 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC1C[C@H]2C[C@@H]2C1 1332028627 YRJCSRYWBOMRIT-HUUCEWRRSA-N 327.428 1.818 10 10 EDCE CC(C)CN1CC(CCO)(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1282545066 KHOCXPARGBULCS-UHFFFAOYSA-N 347.419 1.672 10 10 EDCE COCCC(=O)N[C@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1284440147 YGBZECQDWWATBY-LLVKDONJSA-N 349.391 1.510 10 10 EDCE CCc1[nH]ccc1C(=O)NC[C@@H](CO)NCc1ccc(OC)c(C)c1 1283745478 QLBDCRZPCROHMX-HNNXBMFYSA-N 345.443 1.775 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCN2C(=O)CCC2=O)cc1 1292871315 DZICIAHBMTVDOF-UHFFFAOYSA-N 331.332 1.118 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCC[C@@H](C(N)=O)C1 1297562399 KEZGOTVDFCAFLU-NWDGAFQWSA-N 325.405 1.786 10 10 EDCE CC[C@H](F)C(=O)NC[C@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1705230776 PBVOFDCSGSGLJD-OLZOCXBDSA-N 349.366 1.928 10 10 EDCE CC[C@H](O)Cn1cc(C(=O)NCc2c(O)ccc3c2CCCC3)nn1 1631438905 OVBSPVVJZQBIPE-ZDUSSCGKSA-N 344.415 1.563 10 10 EDCE CC(C)[C@H](O)CCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1565126680 BUTDJOGGNJMUPQ-GOSISDBHSA-N 349.475 1.854 10 10 EDCE CN1CCCc2cc(CNC(=O)CNC(=O)c3cccnc3)ccc21 156000916 XSJKFDJFWQTHRI-UHFFFAOYSA-N 338.411 1.510 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC(OCCCO)CC2)cc1 154897445 NKNJBIIAKQDPNO-UHFFFAOYSA-N 349.475 1.232 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)[C@H]2CCCNC2)c2nccn2C)cc1 1865975444 CUSCAFUPTVHGSE-DOTOQJQBSA-N 341.459 1.691 10 10 EDCE O=C1NCCN(C(=O)c2cc(O)c(O)c(O)c2)[C@H]1c1ccccc1 1866303434 WVYSUSMOHWEOPV-AWEZNQCLSA-N 328.324 1.117 10 10 EDCE CNCc1ccc(N2CCNC(=O)C2(C)C)cc1Br 234449641 PXSKFVWZGYDXCG-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE CC(=O)C(=O)[C@]1(O)CN(C(=O)OC(C)(C)C)[C@@]2(CCCOC2)C1 1939683465 HESBWLBTXMFRIK-JKSUJKDBSA-N 327.377 1.066 10 10 EDCE COC1(CNCc2ccc(O)cc2O)CN(C(=O)OC(C)(C)C)C1 1996223914 WKNUKDUTSBVLHI-UHFFFAOYSA-N 338.404 1.823 10 10 EDCE C[C@H](N)c1ccc(N(C)C2CS(=O)(=O)C2)cc1Br 2034770818 XPRBMYYQTNAZJQ-QMMMGPOBSA-N 333.251 1.702 10 10 EDCE CO[C@]1(CO)CCN(c2cc(Br)c(CN)cc2F)C1 402889658 DPACXDMKISVENF-CYBMUJFWSA-N 333.201 1.635 10 10 EDCE CNCc1ccc(N2CC[C@](CO)(OC)C2)cc1Br 402949703 UQRFXZVUPOVEOV-AWEZNQCLSA-N 329.238 1.756 10 10 EDCE Oc1cccc(Br)c1CNCc1nnc2ncccn12 2160425325 LDKICPZDEGADGC-UHFFFAOYSA-N 334.177 1.882 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)C[C@@H](O)C2)c(Br)c1 2105074854 RCNWLOYXEMVBBB-JLLWLGSASA-N 329.238 1.661 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)C[C@H]2CO)c(Br)c1 2089863109 HCSGPJONNQDXIF-NHCYSSNCSA-N 330.222 1.682 10 10 EDCE COC[C@@H]1[C@H](O)[C@H](O)CN1c1ccc([C@@H](C)O)cc1Br 2233867575 ZSKXPSZEDBDLNX-OJICRYGUSA-N 346.221 1.059 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N1CCC[C@H](N=[N+]=[N-])C1 2303236575 GXJZQOJMAJFZAU-LBPRGKRZSA-N 341.412 1.907 10 10 EDCE NCc1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)c(F)c1Br 2336544885 AIJPDDRWCRHIJC-SCZZXKLOSA-N 349.225 1.280 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2COC[C@H]2N)c(O)c1Br 2352620206 NUWCKDMSLNWFPI-VHSXEESVSA-N 329.194 1.053 10 10 EDCE Cc1ccc(CN[C@@H](C)[C@@H]2CNCCO2)c(O)c1Br 2352690653 GWXDWERYSFTGNZ-JQWIXIFHSA-N 329.238 1.930 10 10 EDCE Cc1ccc(CN2CCO[C@@H]3CNC[C@@H]32)c(O)c1Br 2352940784 IFICGUJUXKUDNF-NWDGAFQWSA-N 327.222 1.636 10 10 EDCE Cc1ccc(CNC(=O)c2cc(N)on2)c(O)c1Br 2352946845 NVQYIVHDSUURDN-UHFFFAOYSA-N 326.150 1.963 10 10 EDCE CO[C@H]1CN(c2ccc(CN)c(Br)c2F)[C@@H]2COC[C@@H]21 2354358589 JODOSNFQQSJEND-WCQGTBRESA-N 345.212 1.897 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N[C@@H]1CCCn2ncnc21 177306586 JNRYNEYSUYOHEB-MRXNPFEDSA-N 338.415 1.989 10 10 EDCE COc1cccc(CNC(=O)NCc2nnc3ccccn23)c1O 173445719 IUWAHWZWRYEAKU-UHFFFAOYSA-N 327.344 1.443 10 10 EDCE CNC(=O)c1ccc(NC2CCN(c3ccc(OC)cc3)CC2)nn1 301348422 LLYMCBWPWAEZSO-UHFFFAOYSA-N 341.415 1.926 10 10 EDCE CN(CCc1ccccn1)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 301705054 VFNJYZQBHVLCLO-UHFFFAOYSA-N 328.328 2.000 10 10 EDCE Cn1cc(CN2CCCN(Cc3cc4c(cc3O)OCO4)CC2)cn1 121593051 HIAWJVNPQGGGQK-UHFFFAOYSA-N 344.415 1.562 10 10 EDCE CS(=O)(=O)C[C@@H](N)c1ccc(I)cc1O 95782863 DLQUEOFDAREROE-MRVPVSSYSA-N 341.170 1.041 10 10 EDCE CC[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)CCN1C[C@H](C)O 245712984 GHSMJZACNAKIOD-PKOBYXMFSA-N 347.503 1.800 10 10 EDCE CC(=O)N(C(=O)N(CCN)C(=O)OC(C)(C)C)c1ccc(N)cc1 244454706 ZDVMZSWKWYSGGW-UHFFFAOYSA-N 336.392 1.938 10 10 EDCE CC[C@@H](C)NC(=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 244255462 WJMUHFJHMMZPOE-CQSZACIVSA-N 333.432 1.649 10 10 EDCE CN1C[C@H](NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)CCC1=O 255771578 MUNXXFSKSRDZTD-LWAXHKBTSA-N 343.427 1.273 10 10 EDCE Cn1cc([N+](=O)[O-])c(C(=O)NCc2c(O)ccc3c2CCCC3)n1 271377652 IVZNPXVQCCMXLO-UHFFFAOYSA-N 330.344 1.843 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NOC[C@H]1CCOC1 805331278 JOLRCYMYYPIJAL-VIFPVBQESA-N 345.193 1.922 10 10 EDCE CC(=O)C(=O)COC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 808507572 CCHNNLFQJPTASM-UHFFFAOYSA-N 331.284 1.310 10 10 EDCE CN1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)[C@@H]2C[C@H]21 2168356340 WMUOWMHVTJYIDW-UPJWGTAASA-N 337.221 1.294 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=O)c1ccc(C)c(O)c1O)C2 819790851 STECKHWYFWQJTR-UHTWSYAYSA-N 334.372 1.755 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)C1 909827053 XYYRDFSHKHMGJJ-ZYHUDNBSSA-N 327.377 1.723 10 10 EDCE Cn1ccc([C@H]2CCCN(Cc3cc4c(cc3O)OC[C@@H]4O)C2)n1 905716794 WXMSAOYJIGCDHT-SJCJKPOMSA-N 329.400 1.931 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](O)Cc1cnn(C)c1 839922451 VBEKEZZTHZGOOH-RDTXWAMCSA-N 344.459 1.445 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)c2cnccc2N(C)C)cc1 843298682 PTMUCRIWMQZDIF-INIZCTEOSA-N 327.432 1.643 10 10 EDCE Cc1cc(N(C)C)ccc1CNC[C@H]1CCCCN1S(C)(=O)=O 840947509 XBWGVQKRVGWHMP-QGZVFWFLSA-N 339.505 1.965 10 10 EDCE CCO[C@H](CNC(=O)NCc1cc(Cl)ccc1O)CN(C)C 926848282 SMQIYUGNDJYKSL-CYBMUJFWSA-N 329.828 1.812 10 10 EDCE Cc1cc(O)ncc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856211813 BZTSTSMOAZXVHJ-UHFFFAOYSA-N 341.411 1.987 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CO[C@H]3CCCNC3)C2)cc1 852900655 OOSYFYWKSCUUKH-YOEHRIQHSA-N 333.432 1.159 10 10 EDCE C[C@@H](NC(=O)NC[C@@H]1CCC(=O)N1)c1ccc(N2CCOCC2)cc1 853487873 ZMHQLGQHBXUERO-HIFRSBDPSA-N 346.431 1.162 10 10 EDCE COC(=O)c1nc(=N[C@@H]2CCN(c3ccc(OC)cc3)C2)cc[nH]1 853760336 JSTPBCRXPDWNOV-GFCCVEGCSA-N 328.372 1.385 10 10 EDCE Cc1cc(CC(=O)NCCN2CC[C@@H](O)C2)c(C)n1-c1ccccc1 863316582 PAQIWAOAGXTREO-LJQANCHMSA-N 341.455 1.819 10 10 EDCE C[C@H]1C[C@@H]1c1noc(C(=O)NCc2ccc(N3CCOCC3)cc2)n1 865910959 FPAXWIHCPPFNAL-WFASDCNBSA-N 342.399 1.960 10 10 EDCE CC(=O)N1CCO[C@@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)C1 935994207 WNCUNIGBBDOCGR-GFCCVEGCSA-N 347.198 1.563 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@H]2CCCN(C3CC3)C2=O)cc1F 931146780 JXZCVLMUNNBESN-AWEZNQCLSA-N 333.407 1.909 10 10 EDCE NCC1(NC(=O)NCc2ccc(N3CC=CC3)cc2)CCOCC1 861590358 PLODKSUDEUEEBH-UHFFFAOYSA-N 330.432 1.370 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2c[nH]nc2Cl)c1 774222314 CULLHWKJHHZPGZ-UHFFFAOYSA-N 330.753 1.393 10 10 EDCE Cn1[nH]c(CNCc2cc(Br)cc(F)c2O)cc1=O 715723191 WVWLAQXBKFYJCA-UHFFFAOYSA-N 330.157 1.610 10 10 EDCE Nc1nonc1N=NN(Cc1cccc([N+](=O)[O-])c1)c1nonc1N 1084458158 KEGSKMRKFQWTAT-UHFFFAOYSA-N 346.267 1.231 10 10 EDCE COCCN(CCF)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 1328393819 NKIHAUQYIMVPJU-UHFFFAOYSA-N 339.411 1.122 10 10 EDCE CCOc1ccc(N2CCN(C[C@@H](C)CS(C)(=O)=O)CC2)cc1 1335865293 CZBFBAUUNYXGKG-OAHLLOKOSA-N 340.489 1.888 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cnccn2)cc1C 1507461859 VBPBDYIKTCDPFX-HNNXBMFYSA-N 344.415 1.016 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cnn2c(=O)cc[nH]c12 1469248603 JOLAPMHANDFQNI-UHFFFAOYSA-N 335.323 1.206 10 10 EDCE C[C@@]1(O)CN(c2ccc(CN)c(Br)c2F)CC[C@H]1O 2136845639 KAQHPAYWUBWYIE-ZWNOBZJWSA-N 333.201 1.369 10 10 EDCE COc1cc(CNC(=O)Cc2ccc(O)c(O)c2)ccc1OCCO 1543231138 KPAXWZCFQGFWFE-UHFFFAOYSA-N 347.367 1.336 10 10 EDCE CCN(CCNC(=O)C1CC1)Cc1nnnn1-c1ccc(OC)cc1 1480957416 IWOAVZBQESBZEN-UHFFFAOYSA-N 344.419 1.019 10 10 EDCE CCc1nncn1CCNC(=O)c1cc2cc(O)c(O)cc2s1 1628457655 HPYHFSRTMZQLMT-UHFFFAOYSA-N 332.385 1.896 10 10 EDCE CCCN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@@H]1CCN(CCO)C1 1713722329 KBECWEJXYPXRDN-OAHLLOKOSA-N 347.419 1.768 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](CO)NC/C=C\Cl)cc1 1717785049 RZURYSVSCKOMIO-GOKHHHTDSA-N 339.783 1.282 10 10 EDCE COc1ccc(-n2nnnc2CNCCCN(C)C(=O)C2CC2)cc1 1569176267 AJQOTWOTSLIPNA-UHFFFAOYSA-N 344.419 1.019 10 10 EDCE C[C@H](NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)N(C)C 1732984578 BNPNJDWRFHINKP-MNOVXSKESA-N 348.407 1.034 10 10 EDCE CC(C)(C)C(=O)N1CCC[C@H](C(=O)NCc2c(O)cccc2O)C1 1645360695 FRLCEVSFBDOVDW-LBPRGKRZSA-N 334.416 1.999 10 10 EDCE CCOC(=O)[C@H](c1cccnc1)N(C)C(=O)c1cccc(O)c1O 1651757866 ASAWXPNKELMUHD-AWEZNQCLSA-N 330.340 1.869 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](CO)c1ncc[nH]1 1686826170 CGQQIINWIDOYMG-BBRMVZONSA-N 345.447 1.748 10 10 EDCE COc1cccc(S(=O)(=O)c2nnn(-c3ccc(N)cc3)c2C)c1 11730814 RMJBWYNPPIGZDT-UHFFFAOYSA-N 344.396 1.999 10 10 EDCE CCOC(=O)[C@@H]1CCCN(C(=O)CCNCc2cc(C)ccc2O)C1 1857864227 CMQGTINITVIVHG-OAHLLOKOSA-N 348.443 1.982 10 10 EDCE O=C(N[C@@H](Cc1ccc(O)c(O)c1O)C(=O)O)OCc1ccccc1 1951426088 XBOZYFJADXWVPM-LBPRGKRZSA-N 347.323 1.726 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1COCC[C@H]1NC(=O)OC(C)(C)C 1985103668 YVABTXPKPHYHCX-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1CC(=O)NCCCN=[N+]=[N-] 1987645741 FSRNDJLUMJKZHS-WDEREUQCSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1Nc1c(N)cccc1C(=O)O 2000872810 ZCGZOPZJMRJGRF-VXGBXAGGSA-N 337.376 1.671 10 10 EDCE C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010401663 GPMPAUFSVQGXTC-SRVKXCTJSA-N 339.396 1.922 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC(CN=[N+]=[N-])CC2)COC1 2010404281 QOGMETBTCZBWHB-UHFFFAOYSA-N 339.396 1.829 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H]3COC[C@@H]32)cc1Br 2158411532 UAJDQIMRZUDMIT-GXTAWKLYSA-N 341.249 1.925 10 10 EDCE CCOC(=O)[C@H]1CNCCN1Cc1ccc(Br)cc1O 691390674 ZFJJCADNAYHNNK-GFCCVEGCSA-N 343.221 1.492 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(CCCO)CC2)c(Br)c1 2169932624 XSIUIHDWKSBQOJ-GFCCVEGCSA-N 342.281 1.973 10 10 EDCE Nc1ccc(CC(=O)Nc2nc(O)nc(O)c2Br)cc1 2182287698 VOYWLSDRNRASNI-UHFFFAOYSA-N 339.149 1.414 10 10 EDCE COc1ccc(N2CCN(C)C[C@H]2CNC(=O)C(F)(F)F)c(N)c1 2044727636 CMDJHIHWPRDXIN-SNVBAGLBSA-N 346.353 1.076 10 10 EDCE CN1CC[C@@H]2OCCN(c3ccc(CN)cc3Br)[C@H]2C1 2185497270 PECLKHNHNWPTOC-GJZGRUSLSA-N 340.265 1.817 10 10 EDCE Cc1nn(C)c(Br)c1Cn1ccc2c(c1=O)CNCC2 2185797693 SYIMVTYXQKFCDW-UHFFFAOYSA-N 337.221 1.347 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)C[C@@H](O)C2)c(Br)c1 2105074855 RCNWLOYXEMVBBB-ZMLRMANQSA-N 329.238 1.661 10 10 EDCE COc1ccc(N(C)C[C@@](N)(C(N)=O)C2(Br)CC2)cc1 2206609966 XTWHLCCICUOQNZ-CQSZACIVSA-N 342.237 1.242 10 10 EDCE CSc1ncc(CNC[C@@H]2CNCC(C)(C)S2(=O)=O)s1 2284726213 RXJJMRWVEHLXEC-SNVBAGLBSA-N 335.520 1.120 10 10 EDCE O=C(CN1C(=O)C(=Cc2ccccc2F)SC1=S)NCCO 2294872005 LMFONLIZKZIPES-UHFFFAOYSA-N 340.401 1.135 10 10 EDCE Cc1ccc(CN2CCOC[C@@H](CO)C2)c(O)c1Br 2352678007 DTUMGEOHJHKKEB-LLVKDONJSA-N 330.222 1.904 10 10 EDCE CCOC(=O)c1ccccc1N/C=C1/C(=O)NC(=S)N(C)C1=O 104910193 QNXRUKVBCBQAEX-NTMALXAHSA-N 333.369 1.032 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)NCCN1CCCC1 172126742 LKXDXGUGEVZVRZ-VMPITWQZSA-N 329.444 1.748 10 10 EDCE Cc1cnn(C[C@@H]2CN(Cc3cc4c(cc3O)OCO4)CCO2)c1 112071921 PRJIWRJFWWYNKI-AWEZNQCLSA-N 331.372 1.527 10 10 EDCE COc1ccc(N2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)cc1 179176301 SXSVVICREITDCX-UHFFFAOYSA-N 331.332 1.289 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H]3[C@@H]4CO)c(Br)cc2[C@@H]1O 2358061751 VKVFVBGIRNGYLT-ISSWRMLHSA-N 339.189 1.252 10 10 EDCE COc1cc([C@@H](NCCCN=[N+]=[N-])C(N)=O)c(Br)cn1 2362126539 YHIBKLUNEWQYPC-SNVBAGLBSA-N 343.185 1.669 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)C1CN(CC(F)(F)F)C1 362373883 QQYJMIKWSPILSM-UHFFFAOYSA-N 343.349 1.972 10 10 EDCE Cc1ccc(CN=c2ccc(C(=O)O)n[nH]2)c(O)c1Br 2380727379 VLIWPOIMAOFYTM-UHFFFAOYSA-N 338.161 1.985 10 10 EDCE C[C@@H](NC(=O)C1(C(=O)N(C)C)CC1)c1ccc(N2CCOCC2)cc1 806614568 XKEPTDQHZBHXCH-CQSZACIVSA-N 345.443 1.569 10 10 EDCE CN1N=C(C(=O)NCc2cc(Br)ccc2O)CCC1=O 804734477 NCFHMBDLGAVWNY-UHFFFAOYSA-N 340.177 1.379 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3C[C@H]3c3cnc[nH]3)C2)cc1 824373209 OOZZHXNMJDNJRF-APHBMKBZSA-N 326.400 1.917 10 10 EDCE OC1CCN(c2ccc(CNCc3cn4cccnc4n3)cc2)CC1 827662754 UOMSVTYCRHFUDD-UHFFFAOYSA-N 337.427 1.980 10 10 EDCE COc1ccccc1[C@@H](O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 907272192 FUCCMCCVCNACTL-APPDUMDISA-N 331.368 1.887 10 10 EDCE C[C@H]1CN=C(NCc2ccc(N3CCN(CC4CC4)CC3)cc2)N1 849052728 SJWIKCNTZYZPBP-HNNXBMFYSA-N 327.476 1.656 10 10 EDCE COc1cc(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)c(O)cc1C 842633331 PYOQGVTYBFXTNV-INIZCTEOSA-N 341.429 1.099 10 10 EDCE NC(=O)C12CCC(CC1)N2C(=O)NCc1ccc(N2CC=CC2)cc1 919918445 MHKZXVBYKXDTJY-UHFFFAOYSA-N 340.427 1.755 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN3C[C@H](O)C[C@H]3C2)cc1 848307952 UCTROAOFUHFSEY-RBUKOAKNSA-N 339.439 1.985 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H]2CCC[C@H](C1)N2 842151891 DGNYCPHXHNDZTL-IYBDPMFKSA-N 344.459 1.030 10 10 EDCE NC[C@H]1CC(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)=NO1 852882504 JBEUDFKPJZBIRA-ZIAGYGMSSA-N 333.388 1.003 10 10 EDCE COc1cc(N2CC[C@@H](Cn3ccnn3)C2)c([N+](=O)[O-])cc1OC 853760329 JOQXLPGDAVUIFC-LLVKDONJSA-N 333.348 1.730 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2c[nH]nc2[C@@H]2CCNC2)c1 852802140 KTHGXWACPUDGME-GHMZBOCLSA-N 330.388 1.692 10 10 EDCE COCCOC1CN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 754493305 PVRHGFQEUWCAKZ-XQRVVYSFSA-N 336.344 1.633 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N3CCC[C@@H](C)C3)C2)cc1 855228241 YCVJFFUFHGOFQM-HUUCEWRRSA-N 345.443 1.649 10 10 EDCE Cn1cc(C[C@H]2CCC[C@H]2NC(=O)C(=O)Nc2ccc(N)cc2)cn1 850849858 KZMYUTHVIRHWTK-CZUORRHYSA-N 341.415 1.468 10 10 EDCE c1cn(C[C@@H]2CN(Cc3ccc(N4CCOCC4)cc3)CCO2)nn1 931059024 NHQWOMOVOFAHJD-SFHVURJKSA-N 343.431 1.016 10 10 EDCE C[C@@H]([C@H](C)C(=O)NCc1ccc2cccnc2c1O)S(C)(=O)=O 862025792 BAJYBYWYOAVFLL-QWRGUYRKSA-N 336.413 1.626 10 10 EDCE CNCCOCCN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 863541742 BICJAZGAFOHVAS-CQSZACIVSA-N 325.428 1.549 10 10 EDCE O=C1CC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)O1 866213141 MEUALGBPBOAFLZ-OAHLLOKOSA-N 336.363 1.109 10 10 EDCE Cc1cccc(=O)n1C[C@@](C)(O)C(=O)N1Cc2cccc(O)c2C1 871204643 NHNBTJCJCOLMRE-GOSISDBHSA-N 328.368 1.156 10 10 EDCE CNC(=O)[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)C(C)C 787846970 ZZCGEYNJQTVAOC-INIZCTEOSA-N 348.447 1.093 10 10 EDCE C[C@@]1(NCc2cc(Br)ccc2O)CCC(=O)NC1=O 2116208221 JRNYYRPAOWLGDU-CYBMUJFWSA-N 327.178 1.440 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C1(CO)CC1 2128182793 BNVYDYUDPNHGBZ-NSHDSACASA-N 327.178 1.396 10 10 EDCE COc1cc(NCc2ccc(N3CCN(C)CC3)c(F)c2)nn1C 1320700324 CYYZTMOARXEFPN-UHFFFAOYSA-N 333.411 1.932 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)N[C@H]1C[C@@H]2C[C@@H]2C1 1345700564 STDXBYIHQVZTRJ-JGPRNRPPSA-N 325.459 1.656 10 10 EDCE C[C@@H](O)CN(Cc1ccccc1)C[C@H](O)COc1ccc(N)cc1 1914616651 FJDYOOJLSGEFNU-QAPCUYQASA-N 330.428 1.892 10 10 EDCE COC(=O)c1cccc(OC)c1N(C)C(=O)/C=C/c1cnn(C)c1 1516713179 NLZXZNPGDDBZAW-CMDGGOBGSA-N 329.356 1.892 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](O)C[C@@H]2CO)c(Br)c1 2136084258 ZVGPQEIQFOHTKU-MVWJERBFSA-N 330.222 1.824 10 10 EDCE C[C@@H](CN(C)C(=O)C(F)F)NC(=O)c1ccc(N=NC(N)=O)cc1 1510424566 XKDPHKZBPZKKAK-QMMMGPOBSA-N 341.318 1.691 10 10 EDCE CCS(=O)(=O)NCC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1539468450 MAEPYPUREBTTPP-UHFFFAOYSA-N 339.461 1.185 10 10 EDCE COC(=O)C12CC(C(=O)N(C)CCN(C)c3ccc(OC)cc3)(C1)C2 1628468533 CJULKYGPAVHXKZ-UHFFFAOYSA-N 346.427 1.933 10 10 EDCE CC[C@H](CNC(=O)[C@H]1COC(=O)N1)NCc1ccc(OC)c(C)c1 1481808567 WSQRNZSEGDJPJZ-ZIAGYGMSSA-N 335.404 1.096 10 10 EDCE COc1cc(OC)cc([C@@H](O)CNC(=O)Cc2ccc(O)c(O)c2)c1 1622462186 NPLNGZAAFOQSSL-KRWDZBQOSA-N 347.367 1.507 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@]23COC[C@@H]2C3)cc1C 1716296463 KMIDJARIWFMBAE-YKTDSXCKSA-N 330.428 1.802 10 10 EDCE Cn1ccnc1[C@@H](NC(=O)Cc1ccc(O)c(O)c1)C(C)(C)CO 1631195111 JSFJAZKWVXNSOO-OAHLLOKOSA-N 333.388 1.250 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 1631915277 RNZWWRSXAIXNLZ-VGSQKHLPSA-N 341.363 1.762 10 10 EDCE COc1ccc(CNC2CC(N(C)C(=O)[C@H](C)NC(N)=O)C2)cc1C 1734591560 GFPSMNHAFFDWKL-GRTSSRMGSA-N 348.447 1.139 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cn2ccnc2)cc1C 1732942688 OUFWGEISYGXYGK-ARJAWSKDSA-N 328.416 1.662 10 10 EDCE O=C(NCc1cccc(Cl)c1O)NCc1nnnn1CC1CC1 1672010022 AABRIDTVKYEOAE-UHFFFAOYSA-N 336.783 1.442 10 10 EDCE O=C(O)[C@H]1C[C@@H](NCc2c(O)cccc2Br)CCO1 1880033278 FZLZJWBTNFFWTA-QPUJVOFHSA-N 330.178 1.877 10 10 EDCE NCc1ccc(N2C[C@]3(CO)CC[C@]3(CO)C2)cc1Br 2145749288 QEUVPDUSDXTTAT-GASCZTMLSA-N 341.249 1.479 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)N1CC(N=[N+]=[N-])C1 1985100763 IMCVFXMYEQTPHR-NSHDSACASA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1C(=O)NCCCCN=[N+]=[N-] 1985103232 RYOIVZNLHKFQLF-GHMZBOCLSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2010402026 LDZJFTIFNZTNMC-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010405763 LPVYZWPXVOUIML-GFCCVEGCSA-N 340.428 1.744 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2018046096 QZRLADPADSZLBB-NEPJUHHUSA-N 341.412 1.954 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](N3CC(O)C3)C2)c(Br)c1 2158744813 VVMMLNKQYCZYFS-ZYHUDNBSSA-N 340.265 1.724 10 10 EDCE C[C@H](N)c1ccc(N2CC(N(C)C3COC3)C2)cc1Br 2173101087 MTRDHWUBPASKHP-JTQLQIEISA-N 340.265 1.988 10 10 EDCE CN(C1COC1)C1CN(c2cc(Br)c(CN)cc2F)C1 2173117266 HDGBLKGFWDKSSQ-UHFFFAOYSA-N 344.228 1.566 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCCc2ccc(N)cc2)C1 2076780783 GXRVBJYBSDJSQO-GOSISDBHSA-N 349.431 1.299 10 10 EDCE CC(C)(C)OC(=O)N1CC=C[C@H]1CNC(=O)COc1ccc(N)cc1 2078290491 UVWDMRIVVMSEHY-AWEZNQCLSA-N 347.415 1.939 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(NC(N)=O)C2)cc1Br 2106928290 RRUIYBBLJLJOMP-QMMMGPOBSA-N 327.226 1.586 10 10 EDCE COC[C@@]1(O)CCCN(c2ccc(CN)cc2Br)C1 2095480195 LSADMHMBFKQVBE-CQSZACIVSA-N 329.238 1.886 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@](C)(O)C2)c(Br)c1 2201495354 BQGSKIDDZKKLHI-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2OCCC[C@@]2(C(=O)NCCN=[N+]=[N-])C1 2215602376 PXWCJOFTZZVSOI-IAQYHMDHSA-N 339.396 1.829 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)C[C@H](CO)C2)c(Br)c1 2236633669 RCHZCWDGGKWHCR-WOPDTQHZSA-N 343.265 1.896 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2303214406 IQSUFQTYBZYMQZ-NEPJUHHUSA-N 341.412 1.954 10 10 EDCE COc1ccc(C=C2C(=O)NC(=O)N(C)C2=O)cc1Br 2313549184 PGBOGQWPRDDRGB-UHFFFAOYSA-N 339.145 1.549 10 10 EDCE Cc1ccc(CNC[C@@]2(O)CCN(C)C2)c(O)c1Br 2352692726 MOWBSTHLZHOKEV-AWEZNQCLSA-N 329.238 1.619 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)NCCc1ncc[nH]1 174765275 IMDTVNLOWUYJOK-ZZXKWVIFSA-N 326.400 1.618 10 10 EDCE C[C@@H](O)CN1CCC(CN(C)Cc2cc3c(cc2O)OCO3)CC1 121146877 LYDTYINHVWCOSB-CYBMUJFWSA-N 336.432 1.646 10 10 EDCE COC(=O)Cn1ncc2c(NCCc3ccc(O)c(O)c3)ncnc21 72313918 WPGTXSSHOSHLAU-UHFFFAOYSA-N 343.343 1.065 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CO[C@H]([C@H](N)Cc2ccc(O)c(O)c2)C1 1952997545 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334.235 1.820 10 10 EDCE COC(=O)[C@@H](CNC(=O)c1cccc(O)c1O)Cc1ccncc1 1144472324 PLPRNUWUXSBAJX-GFCCVEGCSA-N 330.340 1.255 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)NCCc2nc(=O)o[nH]2)cc1 790079048 JIOUFZORQSDPRB-UHFFFAOYSA-N 326.356 1.743 10 10 EDCE COc1cccc(C(=O)NCC(=O)NCc2ccc(O)cc2O)c1 1142529696 BSFMRQSCOWWJNO-UHFFFAOYSA-N 330.340 1.153 10 10 EDCE Cc1ccc(C(=O)N2CC[C@@H](c3cc(O)nc(O)n3)C2)c(O)c1O 1300194119 JVWKHUFWTBFJLL-SECBINFHSA-N 331.328 1.237 10 10 EDCE Cc1cc(CCNC(=O)C(=O)N2CCC2)c(C)n1-c1ccccc1 1261786781 SUXDQELEZSZQAY-UHFFFAOYSA-N 325.412 1.985 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)CC2(C)CC2)cc(OC)n1 1295566946 MEHRMLRDCMDDOH-NSHDSACASA-N 335.404 1.524 10 10 EDCE CCO[C@H](C)c1noc(CN(C)C(=O)Cc2ccc(O)c(O)c2)n1 1465407645 PYVREZPARYAVGQ-SNVBAGLBSA-N 335.360 1.779 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)[C@](C)(O)C2)cc1Br 2136828193 ICLIFKPBUMNJJJ-CUOATXAZSA-N 329.238 1.791 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2nonc2C)cc1C 1714456811 FBVJDSZSFGRGNW-NSHDSACASA-N 332.404 1.851 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccccc2)cc1C 1485971410 ZPAXWLDSHOITEA-QGZVFWFLSA-N 328.412 1.884 10 10 EDCE CN1CCc2cc([C@@H](NC(=O)OC(C)(C)C)C(CO)CO)ccc21 1927285761 XTEWJNSRTDLZHR-MRXNPFEDSA-N 336.432 1.846 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cc(O)ccc1O)C2 1644753733 HIFZTSRZXVEMGM-GDLCADMTSA-N 334.372 1.581 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cc2c(cc1[N+](=O)[O-])OCO2 1652622601 APQLYFYOMRSLJP-UHFFFAOYSA-N 332.268 1.665 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)c(Br)c2F)C[C@H]1OC 231840982 FNCDJDYZNOBAHU-GHMZBOCLSA-N 333.201 1.897 10 10 EDCE O=C1/C(=C\c2ccc(O)cc2)SC(=S)N1CCOCCO 1858589466 SPTMGFGBPQMHGD-FMIVXFBMSA-N 325.411 1.602 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](C(=O)NCCN=[N+]=[N-])OCC1(C)C 1965101232 AIMVQXXRBPKJPJ-SNVBAGLBSA-N 327.385 1.827 10 10 EDCE Oc1cc(Br)ccc1CN[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@H]2O 1974156997 JUXWPDOVOXXFIA-DXDYRAJHSA-N 328.206 1.375 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C(Nc3c(N)cccc3C(N)=O)[C@@H]2C1 2000889916 VMDNZTXTEWCLIO-GHMZBOCLSA-N 332.404 1.645 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@@H](CC(=O)N2CC(N=[N+]=[N-])C2)C1 2014405328 TXJBVQOLZGASEQ-CMPLNLGQSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCc2ccc(N)cc2)C1 2020665237 FMLHUBCMPUPOCN-QGZVFWFLSA-N 335.404 1.257 10 10 EDCE O=C(C=Cc1ccco1)NCc1ccc(N2CCNC(=O)C2)cc1 2040724889 NXEKCTXLECFJII-UHFFFAOYSA-N 325.368 1.545 10 10 EDCE C[C@H](N)c1ccc(N2CCN(C)[C@H](CO)C2)c(Br)c1 687618226 HBTOMSITVWVGRR-JQWIXIFHSA-N 328.254 1.582 10 10 EDCE C[C@@H](N)c1ccc(N2CC(N(C)C3COC3)C2)cc1Br 2173101088 MTRDHWUBPASKHP-SNVBAGLBSA-N 340.265 1.988 10 10 EDCE CNCc1ccc(N(C)CCN(C)C2COC2)c(Br)c1 2173110957 CJEQZAMYGJMTSQ-UHFFFAOYSA-N 342.281 1.935 10 10 EDCE CS(=O)(=O)N1[C@H]2CC[C@H]1CC(NCc1ccc3c(c1)CCO3)C2 2062733316 ICSODHPBGOZFAC-HOTGVXAUSA-N 336.457 1.666 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)C[C@H](O)C2)cc1Br 2105075162 PZUQMMLRWHDLEL-USWWRNFRSA-N 329.238 1.661 10 10 EDCE O=C(O)[C@@H]1C[C@@H](O)CCN1Cc1cc(Br)cc(F)c1O 2201087812 BUTSGOKUDCAONI-ONGXEEELSA-N 348.168 1.704 10 10 EDCE COc1ccc(Br)c(CNCCCc2nn[nH]n2)c1O 2236048580 FGZYRLMADDAXQX-UHFFFAOYSA-N 342.197 1.399 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)CC[C@H]1C(=O)NCc1ccc(N)cc1 2253581545 KPZXQDCMECHCPV-GJZGRUSLSA-N 349.431 1.645 10 10 EDCE Cc1cccc(O)c1CNC(CO)(CO)CNC(=O)OC(C)(C)C 2247106683 LQZRZFSSRQPTFW-UHFFFAOYSA-N 340.420 1.038 10 10 EDCE CN(C)CCCN(CCN)Cc1ccc(Br)cc1O 2265847380 LHWLTEBWIASDSV-UHFFFAOYSA-N 330.270 1.867 10 10 EDCE CCCO[C@H]1CS(=O)(=O)C[C@@H]1NCc1cnc(SC)s1 2284638835 SCIDNCMKWMSRMM-QWRGUYRKSA-N 336.504 1.547 10 10 EDCE CNC(=O)[C@@H]1CN(C(=O)/C=C/c2cncc(C)c2)c2ccccc2O1 492978348 CQKSAHQTJXBUQX-OZSKJFCKSA-N 337.379 1.943 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2329332625 NDGLWLGBOQPOSX-UUGWQDNISA-N 327.222 1.399 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)c(Br)c1 2331967840 YQTNHBUFHIPRRS-PCDDKUFXSA-N 327.222 1.371 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)N1CCC(CC(N)=O)CC1 53889370 UBGVFWPXYUJUGS-UHFFFAOYSA-N 340.383 1.978 10 10 EDCE CCCN(CCC)C(=O)C(=O)N1CCN(c2ccc(OC)cc2)CC1 242877049 GJOLRVQZTZECLI-UHFFFAOYSA-N 347.459 1.992 10 10 EDCE Cc1cc(O)c(CNC[C@H]2CCC[C@]23NC(=O)N(C)C3=O)cc1C 371083679 DDNYYJLYGIYHMF-KDOFPFPSSA-N 331.416 1.819 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@@H](n3cc(CO)nn3)C2)c1 293556517 FNDDIYBVXZWYBG-OAHLLOKOSA-N 332.404 1.712 10 10 EDCE Cc1ccc(CN(C)C(=O)c2nnn(C)n2)c(O)c1Br 2381143837 VBYVKNCNMOPNPC-UHFFFAOYSA-N 340.181 1.259 10 10 EDCE CS(=O)(=O)N1CCCN(Cc2cc(Cl)c(F)cc2O)CC1 294909795 NGZXMEJZZWRYSN-UHFFFAOYSA-N 336.816 1.652 10 10 EDCE CO[C@H]1CNC[C@@H]1S(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 722220796 CIDBCLFWUWSMOE-UWVGGRQHSA-N 341.216 1.428 10 10 EDCE CC(=O)C(=O)COC(=O)c1cn2c(Br)cnc2s1 815370212 CDNNGCPHSBJMGE-UHFFFAOYSA-N 331.147 1.473 10 10 EDCE C[C@H](N[C@H]1CCC(=O)N(C)C1=O)c1ccc(Br)cc1O 818362199 RIQAIIIJTOYQAZ-KWQFWETISA-N 341.205 1.953 10 10 EDCE COc1cc(O)c(CNCCC2(CS(C)(=O)=O)CC2)cc1OC 826834551 TZHKAFHXYFDLRI-UHFFFAOYSA-N 343.445 1.714 10 10 EDCE COC1CCN(c2ccc(CN3CCN(CCO)[C@@H](C)C3)cc2)CC1 828987402 CMUFAWVPQMRGLX-KRWDZBQOSA-N 347.503 1.800 10 10 EDCE COC(=O)C1CC2(C1)CN(Cc1cc(OC)ccc1O)C[C@H]2C(=O)O 903695379 WKUAFJHKNARWII-FHBSJOOWSA-N 349.383 1.487 10 10 EDCE CN(C)c1ccc(CNC(=O)c2nnn(C)c2C(F)(F)F)cc1F 906453800 LLMOSSFAWOCKLT-UHFFFAOYSA-N 345.300 1.969 10 10 EDCE COC(=O)[C@H](CO)NC(=O)/C=C\c1cc(C)n(-c2ccccc2)c1C 588448323 WNHVQWCCELCBIS-IBSYWUHOSA-N 342.395 1.757 10 10 EDCE CCC(C)(C)[C@@H](O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 918838884 MGXGVWYUZNFRQU-KRWDZBQOSA-N 333.476 1.852 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2)cc1 841846697 SKSHLRJAGSVMCW-HPBDAGMYSA-N 330.476 1.789 10 10 EDCE COC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)C(=O)Nc1ccc(N)cc1 841114548 DERDAUMPDAKMSA-BPNCWPANSA-N 331.372 1.007 10 10 EDCE C[C@@H]1CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])CC[S@](=O)C1 844220274 YIACVTOBXWAARW-SGPPSKCMSA-N 338.385 1.897 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](CO)C3CCC3)C2)cc1 852386942 NPEWBELQAGOOKV-KSSFIOAISA-N 347.459 1.982 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3n[nH]c4c3CCC4)C2)cc1 855232766 UNIGKKMLVQQOMX-LBPRGKRZSA-N 326.400 1.916 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC2CC1(CN)C2 852916430 IIKAFZMWOXHVIX-UHFFFAOYSA-N 331.416 1.081 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNCc3cnccn3)cc2)C1 856766498 AWWMVNXCMPGDFK-OAHLLOKOSA-N 325.416 1.468 10 10 EDCE CCOCc1cc(CNCC(C)(C)CS(N)(=O)=O)ccc1OC 865813286 MZMZUIAXYMMFPS-UHFFFAOYSA-N 344.477 1.636 10 10 EDCE COCC1(C(=O)NCc2ccc3cccnc3c2O)CCOCC1 862026535 ROVGRCGTRNBIAD-UHFFFAOYSA-N 330.384 2.000 10 10 EDCE CC[C@H](NC[C@@]12COCCN1C(=O)COC2)c1ccc(F)cc1O 866553799 NXKVEFHSEUIEET-YOEHRIQHSA-N 338.379 1.200 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CC(C)(F)C3)C2)cc1 1118178821 VLZXDINQHBZTMR-ZDUSSCGKSA-N 349.406 1.208 10 10 EDCE C[C@@H](NC(=O)CNC(=O)c1cccnc1)c1ccc(N(C)C)cc1 773988050 IVMKBHSIQZDIBZ-CYBMUJFWSA-N 326.400 1.755 10 10 EDCE O=C(c1ccc(N2CCOCC2)nc1)N1Cc2cccc(O)c2C1 871198779 OQAAWDIMBSZPOF-UHFFFAOYSA-N 325.368 1.780 10 10 EDCE O=C(O)c1cc(O)ccc1NS(=O)(=O)c1cnn(CC(F)F)c1 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CC1=NN(c2ccccc2)C(=O)C1=CNNc1nnc(C)c(O)n1 2294780517 QXFKEPHBURJYFT-UHFFFAOYSA-N 325.332 1.109 10 10 EDCE CSc1ncc(CNS(=O)(=O)[C@@H]2CC[C@H](C(=O)O)C2)s1 2284499444 OXGKFTGVYHBWHN-IONNQARKSA-N 336.460 1.538 10 10 EDCE O=C(N[C@H](CCO)COCc1ccccc1)c1cccc(O)c1O 2303567783 FNJWWWLVNCDEPS-CQSZACIVSA-N 331.368 1.795 10 10 EDCE O=C1O[C@H](c2ccc(O)cc2O)[C@@H](C(=O)O)c2cc(O)c(O)cc21 33414023 UQIACFXKVDRPIL-UONOGXRCSA-N 332.264 1.589 10 10 EDCE Cc1ccc(CN2C[C@@H](CO)[C@@H](CO)C2)c(O)c1Br 2352678891 JEDMTOTZZUVBJN-TXEJJXNPSA-N 330.222 1.496 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NCc1ccc(O)c(O)c1 305504454 RKIQTEVIWLQFCA-WFASDCNBSA-N 338.404 1.822 10 10 EDCE COC(=O)[C@@H]1C[C@@H](OC)CN1Cc1cc(Br)ccc1O 125714131 IGBSASNNWPHEHO-NEPJUHHUSA-N 344.205 1.917 10 10 EDCE Nc1ccc(NC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1 217313650 UXYTYBGWRYAEID-UHFFFAOYSA-N 334.401 1.280 10 10 EDCE COCCN([C@H]1CCSC1)S(=O)(=O)Cc1ccc(N)cc1 40319197 MCTIAYBPUWWMOO-AWEZNQCLSA-N 330.475 1.553 10 10 EDCE 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CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2cc(O)c(O)c(O)c2)CO1 2015120220 QINOPBBWMJOMIW-VIFPVBQESA-N 340.332 1.084 10 10 EDCE COCCN1CCN(c2ccc(CN)c(Br)c2)CC1=O 2158785658 BFXBWBITIZKMET-UHFFFAOYSA-N 342.237 1.203 10 10 EDCE NC(=O)CN(CCCC(=O)Nc1ccc(N)cc1)Cc1ccccc1 2034755302 CNZJXIMJFBQQIA-UHFFFAOYSA-N 340.427 1.975 10 10 EDCE NS(=O)(=O)c1ccc2c(c1)N(C(=O)C=Cc1cccnc1)CC2 2042435921 SHNAQGITXXIEMV-UHFFFAOYSA-N 329.381 1.332 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@H](CO)C2)cc1Br 396816659 UERQJWLPKASNPL-BHDSKKPTSA-N 329.238 1.648 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@H]2O 2174415110 XSTITNZOLDXURF-VOAKKNSGSA-N 342.233 1.622 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CC(=O)NCc2ccc(N)cc2)[C@@H](O)C1 2080713766 JXVHAKNEOLTKRN-ZFWWWQNUSA-N 349.431 1.503 10 10 EDCE NCc1ccc(N2CC[C@@](CO)(CCO)C2)cc1Br 2097023435 BBPCPXHWKSGXAO-CQSZACIVSA-N 329.238 1.479 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1CCOc1nnc(=N)[nH]n1 2213785045 IGQCCEDZCYYEEA-QWRGUYRKSA-N 338.412 1.341 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3C[C@]3(CN)C2)c1O 2272635172 YVEGUCJXTLGANC-XPTSAGLGSA-N 327.222 1.944 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccc(O)c(N)c2)s1 2284557316 QCDFVCFHZKHIOE-UHFFFAOYSA-N 331.444 1.631 10 10 EDCE CCN1C(=O)C(=CC=Cc2ccccc2[N+](=O)[O-])C(=O)NC1=S 2296740214 LQMOGSZBRIMXNJ-UHFFFAOYSA-N 331.353 1.798 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](O)C(C)(C)N)c(O)c1Br 2352639844 CKHMCRJIOHINTN-LLVKDONJSA-N 331.210 1.178 10 10 EDCE CCN(CC(=O)NC(N)=O)Cc1cc(Br)ccc1O 76118508 WRWSZKOIYIYYQQ-UHFFFAOYSA-N 330.182 1.172 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H]3CCCCNC3=O)CC2)cc1 45669469 VRNMTHPGCGXWKY-MRXNPFEDSA-N 346.431 1.196 10 10 EDCE Nc1ccc(OCCS(=O)(=O)Nc2ccc(Cl)nn2)cc1 223864764 GLFIAGZYXKQXLY-UHFFFAOYSA-N 328.781 1.533 10 10 EDCE Cc1cc(O)c(CN2CCN(S(=O)(=O)C3CC3)CC2)c(Cl)c1 529642388 XBUWZBRRDQJMIR-UHFFFAOYSA-N 344.864 1.964 10 10 EDCE CCOc1cccc(CN2CCOC[C@@H]2c2noc(COC)n2)c1O 364095596 PERPCWITYFTGDZ-CYBMUJFWSA-N 349.387 1.894 10 10 EDCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[S@@](=O)C1 365221605 IWOCRTHUHINEBL-YGWIHHTISA-N 339.373 1.131 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC3(CCCOC3)C2)c1 377171038 ZYNXLKKOJYXZSX-UHFFFAOYSA-N 340.401 1.016 10 10 EDCE Cc1ccc(CN2C(=O)[C@H](C)NC(=O)[C@@H]2C)c(O)c1Br 2381140092 FPTSRXAFRGSQDN-IUCAKERBSA-N 341.205 1.699 10 10 EDCE CC(C)N(C[C@H](C)O)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807288251 UKYCJUIQDWPMHM-HNNXBMFYSA-N 345.443 1.297 10 10 EDCE CO[C@]1(CN[C@H](C)c2cc(Cl)ccc2O)CCS(=O)(=O)C1 903365812 QLFKMZPFWFQJTF-YGRLFVJLSA-N 333.837 1.900 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CNCC[C@@H]2C)cc1 842206434 GKKRTHPNXMRIHL-WMLDXEAASA-N 346.475 1.263 10 10 EDCE C[C@H]1CO[C@H](C(=O)N(CC(=O)O)Cc2cc(Cl)ccc2O)C1 911360829 YSIMWBZOCHVNTQ-RNCFNFMXSA-N 327.764 1.884 10 10 EDCE COC(=O)c1cc(/C=C2\SC(N3CCOCC3)=NC2=O)c(C)o1 848638849 MPIVKOWTNVRWNU-WQLSENKSSA-N 336.369 1.677 10 10 EDCE C[C@@H]1CNCC[C@H]1NC(=O)NCc1cccc(Br)c1O 841988877 NMAIREVCDBHZMI-BXKDBHETSA-N 342.237 1.952 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCC1CSC1 923337493 MTKPALUMIAPDPV-UHFFFAOYSA-N 335.473 1.810 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC34CC(CN3)C4)C2)cc1 851676344 ILSUGQPSACAHOK-TXKKKEFDSA-N 330.432 1.325 10 10 EDCE COC(=O)[C@]12C[C@H](N)C[C@H]1CN(Cc1ccc(N(C)C)c(C)c1)C2 923427810 CUDNVHSRYGHXBQ-FCEWJHQRSA-N 331.460 1.773 10 10 EDCE COc1ccc(N2CCN(CCN[C@H](C)c3nonc3C)CC2)cc1 924830821 FCYCSBPKJOJVDZ-CQSZACIVSA-N 345.447 1.859 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3csc(CN)n3)C2)cc1 851639975 OIXBNHAGFQCECJ-NSHDSACASA-N 332.429 1.619 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2c(C)cnn2C)c1 850366240 LRSUBEAJSDCFFC-JTQLQIEISA-N 332.360 1.259 10 10 EDCE Nc1ccc(Cn2cccc(OCC(=O)N3CCCC3)c2=O)cc1 57874897 UXQLTGYIVFYQIU-UHFFFAOYSA-N 327.384 1.480 10 10 EDCE CN(Cc1ccccc1O)S(=O)(=O)c1c(C(F)(F)F)cnn1C 866834536 MQYJSZVGLLAHRE-UHFFFAOYSA-N 349.334 1.965 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CC[C@@H](C)NC1 861806276 ZXMSYONIYCJCIA-ZBFHGGJFSA-N 346.475 1.358 10 10 EDCE CC(=O)NCc1ccc(C(=O)NCCc2ccc(O)c(O)c2)s1 768901070 VEEIGRNWMVYUPQ-UHFFFAOYSA-N 334.397 1.768 10 10 EDCE Cc1cc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)on1 865461899 BUIWSCWASGYUMT-UHFFFAOYSA-N 335.429 1.508 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCOC2(C)C)cc1 1118644861 FZUYFLVZNAGMIH-AWEZNQCLSA-N 333.432 1.300 10 10 EDCE CS(=O)(=O)N1CCC(CC(=O)N2Cc3cccc(O)c3C2)CC1 871205742 KPGUFBPOEFNUMG-UHFFFAOYSA-N 338.429 1.296 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1CCOC[C@@H]1C)c1ccc(N(C)C)cc1 1117508709 IXWKDIAOWTUDGB-HEHGZKQESA-N 333.432 1.471 10 10 EDCE COC(=O)[C@@H](NCc1ccc(N2CCOCC2)cc1)c1ccn(C)n1 787437830 DWSKQQVKSYKEHJ-KRWDZBQOSA-N 344.415 1.261 10 10 EDCE OCCOCC1(O)CCN(Cc2ccc3ccccc3c2O)CC1 895829994 QMELZUCZLDWPEE-UHFFFAOYSA-N 331.412 1.881 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)[C@@H](CO)C2)c(Br)c1 704796726 NFZWMRTXAGWJQT-JLLWLGSASA-N 329.238 1.506 10 10 EDCE CN(CCO)CCN(C)c1ccc(CN)c(Br)c1F 691298945 TWYORNHVXYUETQ-UHFFFAOYSA-N 334.233 1.407 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(C)[C@@H](CO)C2)cc1Br 687588635 JIJCCYIVTFJFMP-ZYHUDNBSSA-N 329.238 1.615 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@]3(CCOC3=O)C2)cc1 1308170332 KNDQZEZVUSEENP-GOSISDBHSA-N 331.416 1.008 10 10 EDCE C[C@H](NC(=O)c1c(F)ccc(O)c1O)C(=O)NCCc1ccccc1 1183460826 STYTTZVFINVCHQ-NSHDSACASA-N 346.358 1.714 10 10 EDCE O=C(C(=O)N1CCC[C@H](c2ncc[nH]2)C1)N1Cc2cccc(O)c2C1 1348586383 XRGVRWORUORHPQ-ZDUSSCGKSA-N 340.383 1.364 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CC[C@]4(CCCOC4)C3)nc12 1350354488 NVXSIRAURQXRML-MRXNPFEDSA-N 332.360 1.136 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)COCC(=O)OC(C)(C)C 1467840232 MGLOOFVOKCHZON-UHFFFAOYSA-N 344.404 1.852 10 10 EDCE Cc1cc(C(F)F)n(CC(=O)NCCc2ccc(O)c(O)c2)n1 1465981532 PFZAKFIQDFZYOW-UHFFFAOYSA-N 325.315 1.899 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccsn2)cc1C 1717770250 MUIXJLQHKRDDJB-ZDUSSCGKSA-N 335.429 1.341 10 10 EDCE CC[C@H](C)CC(=O)NC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1720906850 LQMXWRAJHAWQTM-NWDGAFQWSA-N 337.420 1.770 10 10 EDCE CCOCCN[C@H]1C[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1565877908 HWCQLQNDCFHBNB-NNUKFRKNSA-N 347.419 1.984 10 10 EDCE CC[C@@H](NCCOCC(N)=O)c1cc(Br)ccc1O 230048536 JITZRKWORRGFGE-LLVKDONJSA-N 331.210 1.697 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C2(N(C)C)CCC2)cc1C 1734369041 JTNHKHOXAUHOFG-MRXNPFEDSA-N 349.475 1.055 10 10 EDCE CCOCCN[C@@H](C)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1570655953 VBYLGMVFJPFINL-NWDGAFQWSA-N 335.408 1.982 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)Cc2cccnc2)cc1C 1734362404 BFLSLUWMLXDQOD-KRWDZBQOSA-N 343.427 1.208 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)Cc2ccco2)cc(OC)n1 1744728454 YDYWPYYPAVQMFP-NSHDSACASA-N 347.371 1.169 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CC[C@@H](C(N)=O)O1 1584094971 JLUWCQNSUFTFMS-VBNZEHGJSA-N 333.432 1.141 10 10 EDCE CC(C)C(=O)NC[C@@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1689508132 WBUVQDSUABFXAI-ZDUSSCGKSA-N 331.376 1.836 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)C(C)(C)C(N)=O)cc1C 1774117714 PWBDMSJWIJIPLL-CYBMUJFWSA-N 335.448 1.452 10 10 EDCE CC[C@@H](OC)C(=O)NC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1688597496 IZZPOIIFYAXHED-CYBMUJFWSA-N 347.375 1.215 10 10 EDCE COCCNC(=O)c1ccc(NC=C2C(=O)OC(C)(C)OC2=O)cc1 13617287 ROBOUQLYCAXXEA-UHFFFAOYSA-N 348.355 1.195 10 10 EDCE COCC1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 2010390820 JBDAGHTVKDXLPL-LLVKDONJSA-N 339.396 1.781 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)c1c(CNC(=O)OC(C)(C)C)nnn1C 2010389360 OTCVOQVYNFWAOE-UHFFFAOYSA-N 338.372 1.222 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010402243 OBVMQKXZWXCVEA-UTUOFQBUSA-N 339.396 1.516 10 10 EDCE CC(C)(C)OC(=O)NCc1n[nH]c(=NCc2ccc(O)cc2O)o1 2024264825 HAIIGBCGDMYDKU-UHFFFAOYSA-N 336.348 1.540 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H]2CS3(=O)=O)cc1Br 320712565 BFDCCSFXXFDOQI-WDEREUQCSA-N 331.235 1.284 10 10 EDCE CN(C)c1ccc([C@H](N)[C@H](O)c2c(Br)nnn2C)cc1 2163142731 DBZHPYVLTRKECZ-JQWIXIFHSA-N 340.225 1.377 10 10 EDCE C[C@@H]1COCCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 399073725 PLZYSTNKCUPMGT-SDBXPKJASA-N 340.221 1.874 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@H](C)O[C@@](C)(C(F)F)C3)c2n1 2063585176 DHUGMGKFKHCMFS-BJOHPYRUSA-N 340.330 1.628 10 10 EDCE CN1CCc2cc(CN[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O)ccc21 2062449522 AHNFHSCIAQNMIH-RDJZCZTQSA-N 347.459 1.749 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2CN3C(N)=O)cc1Br 2192286187 OZGUASQQWOOMJO-LSJOCFKGSA-N 339.237 1.810 10 10 EDCE CS(=O)(=O)[C@@H]1COC[C@H]1Nc1c(N)cccc1Br 2086312730 NARRILZEDFIQSP-NXEZZACHSA-N 335.223 1.255 10 10 EDCE CCC[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1COc1nnc(=N)[nH]n1 2213779854 YCXRYHZROCFPRV-MNOVXSKESA-N 338.412 1.341 10 10 EDCE Cc1cc(CN2CCN(C(=O)C=Cc3ccc(O)c(O)c3)CC2)no1 2307987505 MIPSDYQVCPWCJU-UHFFFAOYSA-N 343.383 1.752 10 10 EDCE Cc1ccc(CN2CC(O)(CC(=O)O)C2)c(O)c1Br 2352947668 ULSPWSOGSFDHQE-UHFFFAOYSA-N 330.178 1.485 10 10 EDCE CSc1nc2n(n1)[C@H](c1ccc(N(C)C)cc1)C(C(N)=O)=C(C)N2 20413598 SAYSZTYPMXWQIW-CYBMUJFWSA-N 344.444 1.840 10 10 EDCE COc1ccc(N2CCC(NC(=O)COC[C@@H]3CCOC3)CC2)cc1 117646448 AFPKCKSLJJNFNM-OAHLLOKOSA-N 348.443 1.833 10 10 EDCE CN(Cc1ccccc1O)C(=O)NC1CCC(S(C)(=O)=O)CC1 175493766 GURDHGYKRDSVPB-UHFFFAOYSA-N 340.445 1.889 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)N1CCCS1(=O)=O 66729243 RQDPJGIKHDTFBP-QPJJXVBHSA-N 336.413 1.099 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@H]3CCC[C@H]3O)CC2)cc1 172578434 RRQUJPNMWFKMBP-DLBZAZTESA-N 333.432 1.877 10 10 EDCE CCCS(=O)(=O)N1CCN(c2ccc3c(c2)CCC(=O)N3)CC1 62575862 DJFCNCBFLCKFQN-UHFFFAOYSA-N 337.445 1.433 10 10 EDCE Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)c(=O)nc1N1CCCCC1 66087506 UAAFTMYSSBUFMW-YNEHKIRRSA-N 334.380 1.501 10 10 EDCE CC(=O)N[C@@H]1CCCN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 127967550 CVRDCMRXWKGBGD-QGZVFWFLSA-N 342.443 1.873 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H](C)C[S@](C)=O)CC2)cc1 183632858 OKUGXQONFYCVHQ-NPMABZOXSA-N 339.461 1.294 10 10 EDCE COC[C@@H](C)N(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 193889164 QEPVOHSTWKRTCP-OAHLLOKOSA-N 335.448 1.311 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)C(=O)N1CCN(c2ncccn2)CC1 96785375 JPJKTFUZLCBWIX-CYBMUJFWSA-N 342.399 1.415 10 10 EDCE CS(=O)(=O)CC[C@H]1CCCCN1Cc1cc2c(cc1O)OCO2 366533634 IFZJWYQKVINACS-CYBMUJFWSA-N 341.429 1.910 10 10 EDCE O=C1NCCN(C(=O)c2cccc(O)c2O)[C@H]1c1ccccc1F 375916751 CFELOKDDBZJZBQ-AWEZNQCLSA-N 330.315 1.550 10 10 EDCE CNCc1ccc(N2CC=C[C@@]2(CO)COC)cc1Br 2379882832 JFQDAHHNGMIJQF-OAHLLOKOSA-N 341.249 1.922 10 10 EDCE Cn1ccc(C(=O)NCc2cc(Br)ccc2O)cc1=O 804737035 BBFXXYRURSBOBY-UHFFFAOYSA-N 337.173 1.783 10 10 EDCE Cc1ccc(CN[C@@H]2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(O)c1Br 2380794201 YFSHXHTXGJVCAG-UPYBOPHASA-N 342.233 1.683 10 10 EDCE CCOCC1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2165855185 SWCQGNWEHKJZEQ-ZDUSSCGKSA-N 340.221 1.874 10 10 EDCE CO[C@@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)[C@H]1CCOC1 819973727 BTZBFCCAWXHSRY-FUHWJXTLSA-N 348.443 1.533 10 10 EDCE CC(C)c1nc2n(n1)C[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)CC2 588407781 RLZUJRMNAYHHRC-UKOWJOKBSA-N 342.399 1.957 10 10 EDCE CCO[C@@H]1C[C@@H](NC(=O)NCc2ccccc2O)[C@@H]1n1cccn1 836495933 OZRJRZXFZXJPIJ-BMFZPTHFSA-N 330.388 1.807 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CC[C@@H](C2CC2)N1C(=O)OC(C)(C)C 845428151 JCCMQTRSWZSILF-STQMWFEESA-N 339.388 1.866 10 10 EDCE CCOC[C@H](C)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852264041 FOZDWMKZLNAKJP-AWEZNQCLSA-N 335.448 1.872 10 10 EDCE Nc1c(Cl)cc(N2C(=O)N[C@H](CC3OCCO3)C2=O)cc1Cl 927217261 UJUGSYKUXKTNSY-SECBINFHSA-N 346.170 1.763 10 10 EDCE COC(=O)C1(CS(=O)(=O)N[C@@H](C)c2ccccc2O)CCC1 867836284 MTDMCFNRWMLQSM-NSHDSACASA-N 327.402 1.716 10 10 EDCE CN1CC2(CN(Cc3c(O)cccc3Br)C2)OC1=O 862397133 KKRGXNGQMAJUOM-UHFFFAOYSA-N 327.178 1.791 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2cc(C)c(C)cc2O)C1 862552107 SVSXJMHGJBJXNN-AWEZNQCLSA-N 326.462 1.770 10 10 EDCE C[C@@H](NCCOCCCO)c1ccc(N2CCOCC2)c(F)c1 1117139836 UFMVKAJXDYENQK-CQSZACIVSA-N 326.412 1.712 10 10 EDCE COC(=O)c1cc(CN2CCN(c3ccc(OC)cc3)CC2)on1 876527739 DUOOYKLJRDIDHR-UHFFFAOYSA-N 331.372 1.792 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)[C@H](C)O)CCCC1 871141621 SHUIKKUZDPHVKG-KPZWWZAWSA-N 346.427 1.387 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)N3CC(=O)N(C)C3)c2C)cc1 777826705 SZYAWBDILIONSL-UHFFFAOYSA-N 327.384 1.974 10 10 EDCE Oc1cc2c(cc1CN1CCC(Oc3cnccn3)CC1)[C@H](O)CO2 782893216 DNEZVPGDYDEFLU-MRXNPFEDSA-N 343.383 1.651 10 10 EDCE NCc1ccc(N2CCC[C@@H](NC(N)=O)C2)cc1Br 702143548 BNFJQBAFKYRVCJ-SNVBAGLBSA-N 327.226 1.545 10 10 EDCE C[C@H](NC(=O)c1ccoc1)C(=O)NCc1ccc2cccnc2c1O 1142728509 WDLQNXIMDZLLJA-NSHDSACASA-N 339.351 1.968 10 10 EDCE COC(=O)C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccncc1 1300058903 AHOJXNLPANPNFZ-CYBMUJFWSA-N 330.340 1.456 10 10 EDCE Cc1ccc(O)c(CNC(=O)CCn2nnc3ccccc3c2=O)c1 1301047488 YQUAQCQVTLUMQX-UHFFFAOYSA-N 338.367 1.512 10 10 EDCE O=C(NCc1cc(O)ccc1O)C1CCN(C(=O)N2CCCC2)CC1 1176747861 CZTJYSQAJSTFLG-UHFFFAOYSA-N 347.415 1.642 10 10 EDCE COc1cc(-c2noc(CN(C)Cc3ccccc3O)n2)ncn1 1327985733 TXTZGIAXBRVRRO-UHFFFAOYSA-N 327.344 1.873 10 10 EDCE CS(=O)(=O)c1ccccc1CCNC(=O)NCc1ccccc1O 1255201825 CYAMGCNVELKKAT-UHFFFAOYSA-N 348.424 1.838 10 10 EDCE CN1C(=O)[C@H](N)c2ccc(N3CC(N(C)Cc4ccccc4)C3)cc21 1914200113 PPTWEERZOMQYNI-LJQANCHMSA-N 336.439 1.983 10 10 EDCE O=C(NCc1cc(O)ccc1O)C1CCN(c2cnccn2)CC1 1455357267 QMPPTTYBEWCYLE-UHFFFAOYSA-N 328.372 1.421 10 10 EDCE Cn1c(O)nc(NCc2cccc(Br)c2O)cc1=O 1472774470 CYXHONZHTZKSEP-UHFFFAOYSA-N 326.150 1.566 10 10 EDCE C[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CC[C@H]1N1CCN(C)CC1 1623046837 ZYSWTJIYBXQFTP-GOEBONIOSA-N 347.459 1.125 10 10 EDCE C[C@@H](O)CCCN1CC(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1714982679 SSKPMBLIQAVBNE-GFCCVEGCSA-N 347.419 1.672 10 10 EDCE COC(=O)[C@@H](CNC(=O)Cc1ccc(O)c(O)c1)c1ccc(F)cc1 1626883472 ICWWSKADJUKRGH-AWEZNQCLSA-N 347.342 1.852 10 10 EDCE CO[C@H](C(=O)NCc1ccc2cccnc2c1O)c1cnn(C)c1 1639621626 MXQHSPSUUSALIL-INIZCTEOSA-N 326.356 1.678 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCc3nnc(O)n3C2)c1 1631542336 HUBARQCLUMAHSQ-NXEZZACHSA-N 332.360 1.138 10 10 EDCE COc1cc(O)ncc1C(=O)NCc1ccc2cccnc2c1O 1630532672 NQYPPAFLGJMWEY-UHFFFAOYSA-N 325.324 1.980 10 10 EDCE COC(=O)CCN(CC(=O)NCc1ccc(N(C)C)cc1)CC(C)C 1641637171 INJLLNWLBXJTSZ-UHFFFAOYSA-N 349.475 1.890 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@]1(Br)CC1(F)F 2137804988 SIDRDPRCWISOKS-NSHDSACASA-N 336.132 1.929 10 10 EDCE CC(=O)NCCCN(C(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1758530290 QNTHBEJTRXKCEA-UHFFFAOYSA-N 331.376 1.980 10 10 EDCE C[C@H]1[C@@H](O)CCN1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1685682267 XDYNKZIKHFGTKH-JQFCIGGWSA-N 334.464 1.520 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)/C(=C/c2ccccc2F)SC1=S 5374121 ATLBPMVIGHDPOS-QFQXNISHSA-N 327.358 1.472 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1COC(=O)N1 1951941928 ZKMOBNAFKRBSDW-GHMZBOCLSA-N 338.360 1.642 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N(C)[C@H](C)CO)c(Br)cc21 252815864 VUOQSXIQSJSUAH-AMIZOPFISA-N 342.237 1.869 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)C3CN(C)C3)c(Br)cc21 2145484546 LKKPOTDLDUMUMI-CYBMUJFWSA-N 339.237 1.412 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985100626 IEHNHYAWPMRTHO-GMTAPVOTSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1Oc1ccc(N)cc1 1992470266 IWNPANFEWJNOEZ-OLZOCXBDSA-N 342.417 1.338 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H]1NC(=O)CCOc1ccc(N)cc1 1999127970 JIDNQQUPJFERTL-KGLIPLIRSA-N 335.404 1.820 10 10 EDCE O=C(C=Cc1ccccn1)NCc1ccc(N2CCNC(=O)C2)cc1 2041444617 BBDHZCMICTXPKG-UHFFFAOYSA-N 336.395 1.347 10 10 EDCE Cn1nc(Br)nc1N1CCN(c2ccc(N)cc2)CC1 2173169189 SIVLUBQNGCFHTE-UHFFFAOYSA-N 337.225 1.486 10 10 EDCE CN(CC(=O)N1CCNCC1)Cc1c(O)cccc1Br 706852001 HIGFJBMIOCCOFB-UHFFFAOYSA-N 342.237 1.018 10 10 EDCE C[C@@H]1C[C@H](O)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 385095304 NOAARCXUXMKTNS-KEHGIVTQSA-N 326.194 1.361 10 10 EDCE CCNCc1ccc(N2CC[C@H]2[C@@H](O)CO)c(Br)c1 2270719159 TXAXHLMUWDIDJQ-KBPBESRZSA-N 329.238 1.491 10 10 EDCE O=C(O)CN(C(=O)C=Cc1ccc(N2CCOCC2)cc1)C1CC1 2311968603 IIYQAYZQTWJFCK-UHFFFAOYSA-N 330.384 1.612 10 10 EDCE COC(=O)[C@H]1C[C@H]1C(=O)N1CCCN(c2ccc(OC)cc2)CC1 170762205 KICGDMAXQVTNED-CVEARBPZSA-N 332.400 1.543 10 10 EDCE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@@H]1c1ccc(N)cc1O 1953065073 XRQYBQZFSUFJTD-GFCCVEGCSA-N 342.417 1.681 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)N(C)CC(=O)NC(C)C 198219870 SYPRDWOVRSSZMM-UHFFFAOYSA-N 328.372 1.847 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCCCn1ccnc1 96406214 AHBNQDQVMPLEJP-DAXSKMNVSA-N 340.427 1.939 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](NC(=O)c1ccc(Cl)s1)C(C)C 808547114 HBISHTYQRLYTJC-GFCCVEGCSA-N 345.804 1.857 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)NCC[C@H]3CCOC3)ccc21 803687179 WPQCBHCLLYRJDK-AWEZNQCLSA-N 345.443 1.228 10 10 EDCE CCOc1ccc(NC=C2C(=O)N(C)C(=O)N(C)C2=O)cc1OC 299255770 HDKVZISAJBWKFN-UHFFFAOYSA-N 333.344 1.440 10 10 EDCE CC(=O)C(=O)COC(=O)c1nn(-c2ccccc2C)c2c1CCC2 808509987 YUXOVPMJFQRCMM-UHFFFAOYSA-N 326.352 1.984 10 10 EDCE CN(C)CCN(C/C=C/c1ccc(N(C)C)cc1)CC(=O)N(C)C 827158674 SWJAAZMDSIREMB-BQYQJAHWSA-N 332.492 1.718 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)C34CCN(CC3)C4)C2)cc1 911277029 RIVWMPKVLIRRLS-OAHLLOKOSA-N 329.444 1.734 10 10 EDCE CC(C)n1cnc(NC(=O)C(=O)NCc2cc(Cl)ccc2O)n1 846123087 SPADMIHMHYSKGY-UHFFFAOYSA-N 337.767 1.473 10 10 EDCE CN(C)CCN1CCN(Cc2cc(Cl)c(F)cc2O)CC1=O 846013337 LFQRIZNOTUKPFK-UHFFFAOYSA-N 329.803 1.391 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N2CCC[C@@H](OC(F)F)C2)cc1 842241915 LQPUJAMKLWDMCV-CYBMUJFWSA-N 341.358 1.158 10 10 EDCE Cc1cc(C(=O)NCC[C@]2(O)CCOC2)c(C)n1-c1ccccn1 846447366 LAWLDTAUWXZBCF-SFHVURJKSA-N 329.400 1.760 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCN(c3nncn3C)CC2)cc1 848926327 PCDHTQZCCMDWOY-PLNGDYQASA-N 326.448 1.717 10 10 EDCE CO[C@@H](COC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CCC1 849712366 LQCHLLQBVCTSAS-AWEZNQCLSA-N 343.401 1.736 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)N[C@@H]2CNCC3(CCOCC3)C2)c1 925793845 SHWDVZJSYLJOII-HIFRSBDPSA-N 348.443 1.988 10 10 EDCE CC1(C)[C@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1(F)F 856067761 GVQKDAJGLYROEW-NSHDSACASA-N 348.371 1.785 10 10 EDCE Oc1ccccc1CN1CCC[C@H](c2cc(N3CCNCC3)n[nH]2)C1 853248532 HGVCUXFEJQUJFQ-HNNXBMFYSA-N 341.459 1.905 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)C[C@@H]3COCCO3)C2)cc1 852450459 MQRZYFSBSSLUFQ-WMLDXEAASA-N 349.431 1.331 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)c3ccnn3C)C2)cc1 855226753 TZEAUZZBQUGNIG-KBPBESRZSA-N 328.416 1.927 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccnc(CN)c3)C2)cc1 851639408 GDKJGTAOVUPYGE-CQSZACIVSA-N 326.400 1.558 10 10 EDCE CCOC(=O)C1(O)CCN(Cc2cc(F)c(N(C)C)cc2F)CC1 862248028 PRTFVFWGWRXOEQ-UHFFFAOYSA-N 342.386 1.921 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3ccns3)nc12 860057388 RASUMEYEFPLKSY-SECBINFHSA-N 347.400 1.919 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCc2nnnn2CC1 862025082 MQTSXIFDMPGRRB-LBPRGKRZSA-N 338.371 1.196 10 10 EDCE C[C@@H]1CCCN1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 769859819 PMOPGOCLCXMVHO-SNVBAGLBSA-N 333.435 1.199 10 10 EDCE COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(N(C)C)cc1 770374972 PCCGLNVSUQAYTA-QBPKDAKJSA-N 346.427 1.678 10 10 EDCE CN(Cc1cc[nH]n1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788934192 UTVAHSJKGPWUFY-UHFFFAOYSA-N 341.415 1.285 10 10 EDCE Cc1cc(Br)c(O)c(CN(C)C2CS(=O)(=O)C2)c1 895397406 GRGKQQZWDCGFTK-UHFFFAOYSA-N 334.235 1.692 10 10 EDCE Cc1ncc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)s1 793845368 ZJTZGVSHLXGPFX-UHFFFAOYSA-N 346.456 1.759 10 10 EDCE O=C(NCc1ccccc1O)c1cc([N+](=O)[O-])ccc1-n1cnnn1 1150535564 DNPXMDDIOFLBKK-UHFFFAOYSA-N 340.299 1.206 10 10 EDCE O=C(CCN1CSCCSC1)NCc1ccc(O)c(O)c1 1150377350 HVCHUJUYSLJYNA-UHFFFAOYSA-N 328.459 1.801 10 10 EDCE CO[C@]1(C(=O)NCc2c(O)ccc3ccccc23)CCS(=O)(=O)C1 1304090608 KSLGORQEQYFLPT-QGZVFWFLSA-N 349.408 1.365 10 10 EDCE NC(=O)c1csc(CNC(=O)NCc2cc(Cl)ccc2O)n1 1313030677 HILQUAMXYIVULW-UHFFFAOYSA-N 340.792 1.600 10 10 EDCE NCc1cc(F)c(N2CC3(CNC(=O)C3)C2)cc1Br 2119572112 CAOACXANJHUYRI-UHFFFAOYSA-N 328.185 1.373 10 10 EDCE CCC(=O)N1CCN(c2ccc(CO)c(Br)c2)CC1 2126208997 PFWOOQORIXEZOO-UHFFFAOYSA-N 327.222 2.000 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1C[C@H](O)CC12CNC2 2130052536 DAEHSDQQUYGRPM-SNVBAGLBSA-N 347.640 1.717 10 10 EDCE C[C@@H]1C[C@H](NCCCO)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1277785101 FCFCOVFSAXSZJC-IUODEOHRSA-N 347.419 1.814 10 10 EDCE C/C=C(/C)C(=O)N(C)C1CC(NC(=O)c2cc(OC)nc(OC)c2)C1 1511928899 XIOKBCPXJSWDQQ-WDZFZDKYSA-N 347.415 1.784 10 10 EDCE CCOC(=O)[C@@H](CSC)NC(=O)c1ccc(N=NC(N)=O)cc1 1471866679 URWAZHRYXAFZRZ-LLVKDONJSA-N 338.389 1.874 10 10 EDCE COc1ccc(CNC(=O)c2cc3c(nc2O)CCC[C@H]3O)c(O)c1 1633927350 TUJDRXAVAMKWEP-OAHLLOKOSA-N 344.367 1.801 10 10 EDCE C[C@H](NC(=O)CCc1ccc(S(N)(=O)=O)cc1)c1ccccc1O 1635798828 DAKBGVXJMQANMI-LBPRGKRZSA-N 348.424 1.850 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)NCc2c(O)cccc2O)c1 1597573766 GALHHCJOPZKKDD-AATRIKPKSA-N 327.340 1.182 10 10 EDCE Cc1c(C(=O)NCc2cccc(O)c2O)nnn1Cc1ccncc1 1593739590 RNVXQGLZEMTULK-UHFFFAOYSA-N 339.355 1.371 10 10 EDCE CC[C@H](F)C(=O)NC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1689370590 WWUZXKALEILHTJ-LRWFYRMDSA-N 349.366 1.999 10 10 EDCE CNC(=O)[C@@]1(C)CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 1773026607 NDOLYSJKZAKFOE-WVRJYTFGSA-N 347.371 1.743 10 10 EDCE OCCCO[C@H]1CCN(c2ccc(CO)cc2Br)C1 2142047640 OBVSCMYMYWDFGV-LBPRGKRZSA-N 330.222 1.919 10 10 EDCE CCN(CC)c1ccc(/C=c2\sc3nc([C@@H](C)N)nn3c2=O)cc1 1857924727 PJHMIAZHMUPRHS-UXEDPAHQSA-N 343.456 1.565 10 10 EDCE C[C@]1(O)CN(c2ccc(CN)c(Br)c2)CC[C@@]1(C)O 1880698322 NJCWJGFKECSFJB-KGLIPLIRSA-N 329.238 1.620 10 10 EDCE CC(C)(C)OC(=O)NCCN(CCO)C(=O)c1ccc(O)c(O)c1 2006282413 AUGJRJBLSKLAGA-UHFFFAOYSA-N 340.376 1.057 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](N(C)C)[C@H](O)C2)cc1Br 2146130681 BVSUDTFDYXYVLS-WKPIXPDZSA-N 342.281 1.841 10 10 EDCE CO[C@H]1C[C@H](C(=O)N(C)CCN=[N+]=[N-])N(C(=O)OC(C)(C)C)C1 1985093683 CXKMCOLAQNRLGN-WDEREUQCSA-N 327.385 1.780 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985104399 IEHNHYAWPMRTHO-DCAQKATOSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CN(Cc2ccc(N)cc2)[C@@H]2COC[C@@H]12 1999483035 FKRGMXABGAOJLW-ARFHVFGLSA-N 333.432 1.993 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010401378 DRQLZDSMNHOQPW-NEPJUHHUSA-N 339.396 1.780 10 10 EDCE CNCc1ccc(N2C[C@@H](O)C[C@H]2CN(C)C)cc1Br 300494511 PUXMIFXKEXGRQA-KBPBESRZSA-N 342.281 1.670 10 10 EDCE CN(C)C[C@@H](O)CNCc1cc(Cl)cc(Br)c1O 708057324 TYSGCLACGYAMLW-JTQLQIEISA-N 337.645 1.820 10 10 EDCE CO[C@H]1C[C@@H](CO)N(c2ccc(CN)c(Br)c2F)C1 389126292 SGRMIUNELGNVSC-UWVGGRQHSA-N 333.201 1.633 10 10 EDCE CC(C)(C)OC(=O)N[C@@]12C[C@@H]1CN(CC(=O)Nc1ccc(N)cc1)C2 2044675849 CNTHVZXQOYOJQT-KZULUSFZSA-N 346.431 1.806 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H](O)CN(C(=O)Cc2ccc(N)cc2)C1 2049115582 BLMHRGXEJCMVGT-LSDHHAIUSA-N 349.431 1.298 10 10 EDCE O=C1NC[C@H]2CN(c3ccc(CO)cc3Br)CC[C@@H]12 2100940130 FOJDIWUOUBUEFE-WDEREUQCSA-N 325.206 1.514 10 10 EDCE CN(C[C@H]1CCS(=O)(=O)C1)c1ccc(CO)c(Br)c1 2092346824 SPCYNLCNAPELLW-SNVBAGLBSA-N 348.262 1.812 10 10 EDCE O=C(O)[C@H]1C[C@@H](O)CN(Cc2cc(Br)cc(F)c2O)C1 2201044923 OETCTADGXDJRAJ-WCBMZHEXSA-N 348.168 1.561 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2COC(C)(C)[C@H]2O)c1O 2236055489 QGIPWVWXQQQHKA-MFKMUULPSA-N 346.221 1.791 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H](O)C[C@@H](N)C2)c1O 2227749521 DFXGZCWTPBFWLM-BDAKNGLRSA-N 331.210 1.057 10 10 EDCE O=C1Nc2cc(N3CC[C@]4(O)C[C@@H]4C3)c(Br)cc2[C@@H]1O 2279953280 WNVXMKWXKKRIOM-UEXBWHTRSA-N 339.189 1.396 10 10 EDCE O=C(CN1C(=O)C(=Cc2ccccc2)SC1=S)N1CCOCC1 2297449420 QHAPIBUCXUSWOC-UHFFFAOYSA-N 348.449 1.747 10 10 EDCE Cc1ccc(CNS(=O)(=O)[C@@H](C)CO)c(O)c1Br 2327788634 FTAXIWZGOXVICA-QMMMGPOBSA-N 338.223 1.263 10 10 EDCE C[C@@]1(O)CCN(c2ccc(CN)c(Br)c2F)C[C@@H]1O 1893299669 HHLJMNJATVTZHB-GXFFZTMASA-N 333.201 1.369 10 10 EDCE CNCc1ccc(N2CC3(CC[C@@H](CO)O3)C2)cc1Br 2361840907 NXJMAJUICCMYGC-ZDUSSCGKSA-N 341.249 1.899 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CO[C@@H]3COC[C@@H]32)c1O 2358678254 QVWSTRRRERQONX-SUZMYJTESA-N 344.205 1.667 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cnn2c1CCCC2 127966105 GVPLOZLGNHQMOJ-UHFFFAOYSA-N 340.427 1.986 10 10 EDCE Cc1ccc(C(=O)N2CCN(c3cc(C4CC4)n[nH]3)CC2)c(O)c1O 189973236 QGWIVLPHCIBUSQ-UHFFFAOYSA-N 342.399 1.969 10 10 EDCE COc1ccc(N2CCN(C(=O)c3c(C)nc(C)[nH]c3=O)CC2)cc1 82320422 KPIGYFQSXDBWMN-UHFFFAOYSA-N 342.399 1.358 10 10 EDCE Cc1ccc(/C=C2\C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)o1 96459873 QHAXIIXRXNXAQG-XJZVJHQVSA-N 338.370 1.209 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CCC(=O)N3)ccc21 619141855 IETWIGSCRPFLJS-HNNXBMFYSA-N 343.427 1.913 10 10 EDCE COc1cccc(CNS(=O)(=O)c2ccc(N(C)C)cc2)c1O 276536131 IIMWJBMZZJTJFW-UHFFFAOYSA-N 336.413 1.945 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCO[C@@]3(CCCOC3)C2)cc1 285389930 AGDWWDYJICQKCJ-SFHVURJKSA-N 333.432 1.844 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 374188599 BPOBIBNMZLCYKU-UNEWFSDZSA-N 344.459 1.903 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2C[C@H](OC(C)(C)C)C2)cc1 826706472 JVMIWNQCCCBACS-KOMQPUFPSA-N 347.459 1.831 10 10 EDCE COc1cc(O)c(CNCC[S@](=O)CC(F)(F)F)cc1OC 826868374 RXJPYDLHCVTQLY-QFIPXVFZSA-N 341.351 1.810 10 10 EDCE CN(C)c1ccc(CN(C(=O)N[C@H]2C[C@@H](C(N)=O)C2)C2CC2)cc1 845452382 UROMMFXLRXAFHW-OKILXGFUSA-N 330.432 1.691 10 10 EDCE O=C(NCc1c(O)cccc1F)N[C@H]1CCN(CC(F)(F)F)C1=O 918085990 DAKDKUNAVQKNRZ-JTQLQIEISA-N 349.284 1.494 10 10 EDCE Cc1ccc(CC[C@@H](C)NC(=O)C(=O)NCCc2ccc(N)cc2)o1 842203805 ZACNPTNFUALJPU-CYBMUJFWSA-N 343.427 1.966 10 10 EDCE CN1CC(CN(C)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 852005710 ZEONMDKCJUCNOB-UHFFFAOYSA-N 332.448 1.226 10 10 EDCE O=C(NCc1c(O)cccc1F)c1ccc(CN2CCOCC2)o1 928709893 IEVNMPQNFLXVRE-UHFFFAOYSA-N 334.347 1.887 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCN3CCCC3=O)C2)cc1 854213526 HWBRNMCIPKJPEP-CQSZACIVSA-N 346.431 1.196 10 10 EDCE O=C1NCC[C@@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)[C@@H]12 931704759 VVNDIZDFIZPPNN-FUHWJXTLSA-N 329.444 1.624 10 10 EDCE CCN(CC(=O)O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 780479228 YAAXXLYOPFRYBE-CYBMUJFWSA-N 335.404 1.700 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C)C2CCOCC2)cc1 788967039 NXUGGDPBWZCXSR-UHFFFAOYSA-N 347.459 1.786 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccnc(O[C@@H]2CCOC2)c1 1142533141 DSJYACQVRNXVST-CQSZACIVSA-N 330.340 1.591 10 10 EDCE C[C@@H](NCCn1ncc(Br)n1)c1cc(O)ccc1O 2123092680 PXRKNIZKWXVXAA-MRVPVSSYSA-N 327.182 1.803 10 10 EDCE CCOc1ccc(N2CCN(C[C@H](O)C3(O)CCCC3)CC2)cc1 1354457645 YNJOQILSZJOTCZ-SFHVURJKSA-N 334.460 1.873 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)C[C@@H]2CO)cc1Br 2136081167 BBTBFOBAGBKRHJ-WCQGTBRESA-N 330.222 1.824 10 10 EDCE CC(C)NC(=O)CN(C)CC(=O)NCc1c(O)ccc2ccccc12 1456313499 YDQFOYRALVQGMA-UHFFFAOYSA-N 343.427 1.618 10 10 EDCE CCN1CCC[C@H]1CN(CCN(C)C)C(=O)Cc1ccc(O)c(O)c1 1545058484 KCSUUDPPYKIERL-INIZCTEOSA-N 349.475 1.515 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCOC3(CCOCC3)C2)cc1 1545707774 WAGDUBSBOKWRFT-UHFFFAOYSA-N 332.360 1.871 10 10 EDCE O=C1COc2ncc(C(=O)NCc3cccc(Cl)c3O)cc2N1 1558757311 ZIFOVSVKEMJHIQ-UHFFFAOYSA-N 333.731 1.702 10 10 EDCE Cc1ncoc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1626090568 MXLYNMWEZJCPQD-UHFFFAOYSA-N 342.399 1.615 10 10 EDCE CNC(=O)[C@@H](Cc1ccccc1)NC(=O)/C=C\c1ccc(O)c(O)c1 1632897563 UGBOWCGQOOBDQW-WKTRQSJXSA-N 340.379 1.585 10 10 EDCE NC(=O)c1cc(N(Cc2ccccc2O)C[C@@H]2CCCO2)ncn1 1639661989 ZAGBDAKOFIEETQ-ZDUSSCGKSA-N 328.372 1.467 10 10 EDCE C[C@@H](NC(=O)c1ccnc(S(N)(=O)=O)c1)c1ccc(N(C)C)cc1 1638957731 VZSGPOSHOFMQJB-LLVKDONJSA-N 348.428 1.286 10 10 EDCE CC(C)(CNC(=O)c1ccc(N=NC(N)=O)cc1)[C@@]1(O)CCOC1 1638824966 YARCTEBJZWTKNH-MRXNPFEDSA-N 334.376 1.756 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)Cn2cncc2C)cc1C 1731606774 QRYZEDZUVFNCRW-CQSZACIVSA-N 330.432 1.803 10 10 EDCE CO[C@H](C)CC(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1579747147 ALQYEGWIWDQPEC-GHMZBOCLSA-N 349.391 1.509 10 10 EDCE CNC(=O)C1(C(=O)N(C)C[C@H](C)NCc2ccc(OC)c(C)c2)CC1 1734346768 RVKNMYSBGHGJDS-AWEZNQCLSA-N 347.459 1.466 10 10 EDCE NS(=O)(=O)c1cccc(NCc2c(O)cccc2F)c1[N+](=O)[O-] 1652252398 KSHFDJPWZCIPKS-UHFFFAOYSA-N 341.320 1.699 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCn3nc(C)nc3C2)c([N+](=O)[O-])c1 1772836762 XCNQFQXMKDOFCB-XQRVVYSFSA-N 343.343 1.701 10 10 EDCE CC(=O)N[C@@H](CC(=O)NCc1ccc(O)c(O)c1)c1ccccc1 159092746 YKSWUTPHTUXXEQ-HNNXBMFYSA-N 328.368 1.982 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1NCCC1=O 1952208796 NFCJTRNBZFIWTE-ABAIWWIYSA-N 336.388 1.465 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985101610 VDBATZHFUDSCEJ-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)NCc1ccccc1O 269163247 VQNZVGXEJVUJGF-ZDUSSCGKSA-N 336.388 1.644 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010393341 QYZNBINZIDTOOR-RYUDHWBXSA-N 341.412 1.811 10 10 EDCE CCN(c1ccc([C@H](C)O)cc1Br)[C@H]1CC(=O)NC1=O 2171207267 UPANNXOHZZVSIJ-UFBFGSQYSA-N 341.205 1.744 10 10 EDCE C[C@@H]1C[C@H](N)CCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2054048998 XWRZURQWCXUODF-NVXWUHKLSA-N 329.444 1.875 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3CC(C(N)=O)C3)ccc(N)c2C1 381973982 ULGISYGTZZARMA-UHFFFAOYSA-N 346.431 1.484 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3Cc4c[nH]nc4C(C)(C)C3)c2n1 2062228338 ZWFRIZNKPYRICU-UHFFFAOYSA-N 326.360 1.400 10 10 EDCE CN(C)[C@]1(C(=O)Nc2ccc(O)c(O)c2)COc2ccccc2C1 2062537485 QMEIGBMUBMGMFV-SFHVURJKSA-N 328.368 1.972 10 10 EDCE CCn1cc(Br)c(C(=O)NCc2cc(N)ccc2O)n1 2181185192 CBVFZPJXPDTKIR-UHFFFAOYSA-N 339.193 1.883 10 10 EDCE CN1CC[C@H]2OCCN(c3ccc(CN)cc3Br)[C@@H]2C1 2185497271 PECLKHNHNWPTOC-HUUCEWRRSA-N 340.265 1.817 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2236637266 RYPBLUFJXYXNCF-UTUOFQBUSA-N 343.265 1.896 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)Nc2ccc(O)c(N)c2)n1 2227871690 VSQIVBCXUBUXOF-UHFFFAOYSA-N 347.194 1.271 10 10 EDCE CNCc1cc(S(=O)(=O)NCc2cnc(SC)s2)c[nH]1 2284687167 DPPFPYNLJGKUHE-UHFFFAOYSA-N 332.476 1.391 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(c2cccnn2)CC1 2307996521 MOAINZJZRQZITO-UHFFFAOYSA-N 326.356 1.250 10 10 EDCE CS(=O)(=O)[C@H]1CC[C@H]1NCc1ccc(Br)cc1O 2319822777 RAIJCIFQCQDNTF-PWSUYJOCSA-N 334.235 1.820 10 10 EDCE Cc1cc(Br)cc(CN2C[C@@H]3CS(=O)(=O)[C@H]3C2)c1O 2336548181 HDMLLKRRUMBHTO-PWSUYJOCSA-N 346.246 1.692 10 10 EDCE Cc1ccc(CN(C)C2(C(=O)O)COC2)c(O)c1Br 2352677711 CBCCDUVXPHKPLV-UHFFFAOYSA-N 330.178 1.749 10 10 EDCE Cc1ccc(CNC(=O)C2[C@@H]3COC[C@@H]23)c(O)c1Br 2352942054 YZPJCCLEZJQFNP-NXEZZACHSA-N 326.190 1.972 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CCc3nc(C(C)C)nn3C2)c(O)c1O 182597072 BMNQGUIVOBOAEB-NSHDSACASA-N 330.388 1.866 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@@H]4O)cc1F 249552247 LFASYIUHZVYWCO-LVSLPLRBSA-N 333.407 1.802 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2COC[C@]2(C(=O)NCCN=[N+]=[N-])C1 1895875521 KURBPOJXKUXPOM-QMTHXVAHSA-N 325.369 1.296 10 10 EDCE Cc1ccc(CN2CCN(CCCN)CC2)c(O)c1Br 2380665317 YGNZJIWFHTXOON-UHFFFAOYSA-N 342.281 1.930 10 10 EDCE CCN1CC[C@H](NC(=O)NCc2ccc3c(c2)CCCN3C)C1=O 801798168 TUZSAKWLQJKYJC-HNNXBMFYSA-N 330.432 1.489 10 10 EDCE CO[C@@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1 819973728 BTZBFCCAWXHSRY-SJLPKXTDSA-N 348.443 1.533 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Nc3cccn(C)c3=O)C2)cc1 821239612 PQXPMCDYZYJFTJ-ZDUSSCGKSA-N 342.399 1.794 10 10 EDCE CC(C)OC(=O)N1CCC(NC(=O)c2c(F)ccc(O)c2O)CC1 825822882 OPEPWHTUYQHZHX-UHFFFAOYSA-N 340.351 1.976 10 10 EDCE CO[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)[C@@](C)(C(=O)O)C1 908758482 LWVGBSOOAHMKEC-WMLDXEAASA-N 335.404 1.526 10 10 EDCE CCOC1(C)CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 837817966 WPVSLWCZDUBULS-UHFFFAOYSA-N 333.432 1.844 10 10 EDCE Cc1cc(C(=O)N2CCO[C@H]([C@H](C)O)C2)c(C)n1-c1ccccn1 839924998 JGCOBMUPAICVJA-HOCLYGCPSA-N 329.400 1.711 10 10 EDCE CN(C)S(=O)(=O)N1CCC[C@@H](N[C@H]2CCc3cccc(O)c32)C1 834803452 UBKXZLNCSPBUAQ-KGLIPLIRSA-N 339.461 1.240 10 10 EDCE CN1C(=O)[C@@H](NC(=O)NCCc2ccc(N)cc2)Cc2ccccc21 851663103 SSSUATIYTRUBMD-INIZCTEOSA-N 338.411 1.698 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnc(OC)nc3)C2)cc1 855232294 SNINFWURJBSYMR-ZDUSSCGKSA-N 328.372 1.503 10 10 EDCE COC[C@@]1(C(=O)OC)CCCN1Cc1cc(F)cc(C(C)=O)c1O 852633458 RPSUBMWETBPCER-QGZVFWFLSA-N 339.363 1.888 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2C[C@H]3C(=O)OC[C@H]3C2)cc1F 858206259 JBPSTQSPSFPDPU-ZIAGYGMSSA-N 349.406 1.986 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)c3nc[nH]n3)C2)cc1 854299841 SFMICEFTNXLCLC-NEPJUHHUSA-N 330.392 1.452 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H]([C@@H](C)O)C3)C2)cc1 854298556 FSQYGRKYYAKCAY-ILXRZTDVSA-N 333.432 1.686 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2 865315175 IREKCNUBQMWDRL-CMSWKTDVSA-N 328.368 1.580 10 10 EDCE Cn1ccc([C@H]2NC(=O)N(CCCSc3nccs3)C2=O)n1 761303350 ZKMJLQVWQKEVSS-SNVBAGLBSA-N 337.430 1.652 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@H]3C[C@H]4CC[C@H]3O4)cc2)C1 1119688898 DJJJNJMWROEDLD-NRSFXHEJSA-N 329.444 1.798 10 10 EDCE CN1CCN(c2ccc(CNC(=O)/C=C/c3cnccn3)cc2)CC1 893606931 BRLAUXABXDOYFT-QPJJXVBHSA-N 337.427 1.558 10 10 EDCE CC(=O)N/C(=C\c1cccs1)C(=O)NCCc1ccc(O)c(O)c1 1137464446 AFUAHKLEFXFTOJ-UVTDQMKNSA-N 346.408 1.995 10 10 EDCE COC(=O)c1cc(O)ccc1NS(=O)(=O)c1c(Cl)cnn1C 797432030 IPSDFAADTHDYGC-UHFFFAOYSA-N 345.764 1.367 10 10 EDCE CCOC(=O)[C@]1(CNC(=O)Cc2ccc(O)c(O)c2)CCCOC1 1301736564 IWJXYDIUKFWWFR-KRWDZBQOSA-N 337.372 1.116 10 10 EDCE Cc1oc(-c2cnn(C)c2)nc1C(=O)NCc1cc(O)ccc1O 1176756129 XVXCIVIEQMBQRK-UHFFFAOYSA-N 328.328 1.725 10 10 EDCE C[C@@H](O)c1ccc(N2CCC[C@H]2[C@@H](O)CO)c(Br)c1 2123168646 BPJNJGQJIPALFV-IIMNLJJBSA-N 330.222 1.824 10 10 EDCE COC(=O)c1c(CNCCOCCCO)c2cc(F)ccc2n1C 1332003710 HBFGSRWYYJWMCT-UHFFFAOYSA-N 338.379 1.593 10 10 EDCE C[C@H]1C(=O)NCCN1c1ccc(C=CC(=O)O)c(Br)c1 1911908449 IMYARQIJDQPOAG-VIFPVBQESA-N 339.189 1.872 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1912189475 WGRPLIFPYXQATC-SSDOTTSWSA-N 349.214 1.646 10 10 EDCE CC(C)CCNC[C@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1284477063 MIJZFSZJNCUQSA-HNNXBMFYSA-N 349.435 1.918 10 10 EDCE O=C(O)[C@@H]1C[C@H](O)CCN1Cc1ccc(Br)cc1O 2136391265 WXTAPYLCVTWPNN-MNOVXSKESA-N 330.178 1.565 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3[C@H](C(N)=O)[C@@H]3C2)c(Br)c1 2136583842 AOSRFMMIINKKGW-OIORRXCASA-N 325.206 1.670 10 10 EDCE COc1ccc(CNC(=O)Cc2ccc(-n3cnnc3)cc2)c(O)c1 1296967794 HBPSVKILIXZWFR-UHFFFAOYSA-N 338.367 1.840 10 10 EDCE CN[C@H](c1ccccc1O)[C@@]1(O)COC[C@H]1NC(=O)OC(C)(C)C 1920513110 MNNHNCFUBPRYFU-CKEIUWERSA-N 338.404 1.307 10 10 EDCE COc1ccc(-n2nnnc2CN[C@@H](C)CNC(=O)C2CCC2)cc1 1480416434 UCDKBKHNQWUSGR-LBPRGKRZSA-N 344.419 1.065 10 10 EDCE CN(c1ccc(CN)c(Br)c1)[C@H]1CCS(=O)(=O)C1 228148731 PHTUXTVCXQVHAR-NSHDSACASA-N 333.251 1.531 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@@H]2COC(=O)N2)C2CC2)cc1C 1483558020 KJPZMUJDEBIGEP-CABCVRRESA-N 347.415 1.096 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cnccc2C)cc1C 1715584543 WLXCCQXRLDOYJW-INIZCTEOSA-N 343.427 1.588 10 10 EDCE CN(C)[C@H]1COC[C@H]1CNCc1ccc(Br)cc1O 1924718931 NYYNICPWFJHJAF-YPMHNXCESA-N 329.238 1.821 10 10 EDCE CCN(CCNC(=O)C(C)C)Cc1nnnn1-c1ccc(OC)cc1 1480961387 PLZAQLGEEZZBQY-UHFFFAOYSA-N 346.435 1.265 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1cccc(CN2CCOCC2)n1 1624379419 PNNBMWCMQBMHIN-UHFFFAOYSA-N 343.383 1.506 10 10 EDCE C[C@@H](CNC(=O)Cc1ccc(O)c(O)c1)CNC(=O)OC(C)(C)C 1632378803 IBFZEJSWHSZDDF-NSHDSACASA-N 338.404 1.917 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)[C@@H]2[C@H]3COC[C@H]32)C2CC2)cc1C 1569315098 SMZPBQYKKUFZJE-MJQMVNBJSA-N 344.455 1.880 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2CCC(=O)N2C)cc1C 1568293275 GLJVZLSSXRYRTE-HOCLYGCPSA-N 347.459 1.561 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)Cc2cnn(C)c2C)cc1C 1491476769 NEKAUPWUSBOJBB-AWEZNQCLSA-N 344.459 1.883 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)CCC(=O)O)c2nccn2C)cc1 169813613 CBEOOIDOOMCBJC-INIZCTEOSA-N 330.388 1.557 10 10 EDCE COc1cc(CN2CCN(Cc3nccn3C)CC2)c(O)cc1C 160156441 STUJJBZJEWIBID-UHFFFAOYSA-N 330.432 1.761 10 10 EDCE CO[C@@H](C)[C@@H](CC(=O)N1CC(N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1985094523 QBWHIGPFRQHAIG-GXSJLCMTSA-N 327.385 1.826 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985102474 HQACDKHLXRGAAT-OUAUKWLOSA-N 327.385 1.562 10 10 EDCE COc1cccc(CNC[C@H](O)CNC(=O)OC(C)(C)C)c1O 1985772329 VCJPIYLQJIHOAA-LBPRGKRZSA-N 326.393 1.376 10 10 EDCE COc1cccc(CNC[C@@H](CO)NC(=O)OC(C)(C)C)c1O 1985855984 VODSNGQTSZKHTE-LBPRGKRZSA-N 326.393 1.376 10 10 EDCE C[C@H](C(=O)NCCCN=[N+]=[N-])N1CC(NC(=O)OC(C)(C)C)C1 1987820452 HPINSRDLYGWUBP-SNVBAGLBSA-N 326.401 1.400 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](CO)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010405552 ZTBMBPVFVRNHME-IAQYHMDHSA-N 339.396 1.517 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2012344308 YDPPOQDXTCXTQH-NEPJUHHUSA-N 341.412 1.811 10 10 EDCE CN[C@@H](c1ccc2c(c1)CCN2C)c1nc(Br)nn1C 2173163206 JIVKBHGVPZUHBD-LBPRGKRZSA-N 336.237 1.879 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H](OCC4CC4)C3)c2n1 2063424956 BCOQZEUKCVFYOI-ZDUSSCGKSA-N 330.388 1.775 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCOC[C@@H]3CF)c(Br)cc21 2182607171 XMRURYNWKQEEAW-JVXZTZIISA-N 344.184 1.576 10 10 EDCE O=C1NC[C@H]2CN(Cc3ccc(Br)cc3O)CC[C@@H]12 2100944465 NLVNNZOYWDLNQO-CMPLNLGQSA-N 325.206 1.723 10 10 EDCE C[C@H](N)c1ccc(N2CC(CS(C)(=O)=O)C2)cc1Br 2103211037 UBUHWXZJNOAHDH-VIFPVBQESA-N 347.278 1.950 10 10 EDCE NC(=O)c1coc(CNCc2cccc(Br)c2O)n1 2104342603 LCCLZTJHXNMWNY-UHFFFAOYSA-N 326.150 1.531 10 10 EDCE CC(C)NC(=O)NCCNCc1cc(Br)ccc1O 2092422474 LEYBXNNOSSQYDB-UHFFFAOYSA-N 330.226 1.952 10 10 EDCE C[C@H](N)c1ccc(N2CCN(C)C[C@H]2CCO)cc1Br 2202830160 JUUXCCZEIOEEGY-WCQYABFASA-N 342.281 1.972 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])COC1 2213594337 YKZMADCWIZLIKC-WDEREUQCSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](COc2nnc(=N)[nH]n2)C[C@@H]2CCC[C@@H]21 2213778082 BWDYUGSXVAJOQN-DCAQKATOSA-N 336.396 1.236 10 10 EDCE N[C@H]1[C@H]2C[C@@H](CN(Cc3c(O)cccc3Br)C2)[C@H]1CO 2239338546 PNJYODBWJQUOOZ-JOXOIDLHSA-N 341.249 1.542 10 10 EDCE O=C(O)[C@H]1CC[C@H](O)CN1Cc1cc(Br)ccc1O 2264533753 QPPUZNAOANZJPO-WDEREUQCSA-N 330.178 1.565 10 10 EDCE CC(=O)NN1C(=O)C(=Cc2cnc3ccccc3n2)SC1=S 2296589797 AUHFYZWGJYKOEM-UHFFFAOYSA-N 330.394 1.882 10 10 EDCE Cc1cccc(NC=C2C(=O)NC(=O)N(C[C@H]3CCCO3)C2=O)c1 2297317882 CZVNEPWJWPUOTD-CYBMUJFWSA-N 329.356 1.548 10 10 EDCE CO[C@@H](CNCc1ccc(O)c(O)c1O)CNC(=O)OC(C)(C)C 2301664959 PQVODRPCAZYWIE-NSHDSACASA-N 342.392 1.433 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)c1ccc(O)c(O)c1 2301727076 FTSZZYAYTRSTPG-LLVKDONJSA-N 340.376 1.367 10 10 EDCE NCc1ccc(N2C[C@H]3CS(=O)(=O)[C@H]3C2)c(F)c1Br 2336544887 AIJPDDRWCRHIJC-WPRPVWTQSA-N 349.225 1.280 10 10 EDCE Cc1ccc(CN2CC[C@H](O)[C@@H](O)CC2)c(O)c1Br 2352690599 SHFFLJPUVYHZDO-RYUDHWBXSA-N 330.222 1.781 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2NC[C@H]3C[C@@H]32)c(O)c1Br 2352954581 ZKZGJTDAQDEIPG-JFGNBEQYSA-N 325.206 1.687 10 10 EDCE COC[C@@H](C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 103428409 ZSIHYTCQJLHJBH-MRXNPFEDSA-N 349.475 1.606 10 10 EDCE CCCN(CCC)c1ccc(CN2CCN(CC(N)=O)CC2)cc1 179836694 RMAHHKYYEKJLFT-UHFFFAOYSA-N 332.492 1.916 10 10 EDCE COc1ccc(CNC[C@@]2(C)CCN(C(=O)CNC(C)=O)C2)cc1C 1270671120 BAOBBYWJUPCKJK-LJQANCHMSA-N 347.459 1.468 10 10 EDCE Cc1oc2c(c1C(=O)NN1CCOCC1)C(=O)c1ccccc1C2=O 39853795 RQHRKJWJNUJLDN-UHFFFAOYSA-N 340.335 1.340 10 10 EDCE COc1ccc(CN2CCN(C(=O)CN3CCCC3)CC2)c(O)c1 93047203 UMLOOXCXKDWBJC-UHFFFAOYSA-N 333.432 1.141 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2cc(Cl)cc(OC)c2O)CCO1 529645113 POVVHUDTZIUXRL-GFCCVEGCSA-N 343.811 1.184 10 10 EDCE CCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1cc(C)cc(C)c1 255639970 MMZNXTAOQIRXAO-FPLPWBNLSA-N 341.411 1.767 10 10 EDCE CO[C@H]1CNC[C@H]1C(=O)NCc1ccc(C)c(Br)c1O 2381139793 BBWFCMAXLJCESB-MNOVXSKESA-N 343.221 1.314 10 10 EDCE O=C1NC(=O)[C@@]2(CCCN(Cc3cc(Cl)c(F)cc3O)C2)N1 294250688 AJTVREGADVQNEB-AWEZNQCLSA-N 327.743 1.359 10 10 EDCE CO[C@H](C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1 823834320 ASJZRBCDAPGQHL-LESCRADOSA-N 348.443 1.752 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)[C@@H]1C 837769912 RZVJOEOKRCUAEI-IIAWOOMASA-N 344.459 1.938 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC(O)(C(C)C)C3)C2)cc1 854297060 JHMKEJUFXFNFSP-AWEZNQCLSA-N 333.432 1.686 10 10 EDCE CCN(CC1CN(S(C)(=O)=O)C1)c1ccc(OC)c(OC)c1 929897392 KWWWVDBZONFYAH-UHFFFAOYSA-N 328.434 1.422 10 10 EDCE COC1(OC)CC[C@@H]1NCc1ccc(N2CCC(C(N)=O)CC2)cc1 926873656 NGPZJIKWYZGYOS-KRWDZBQOSA-N 347.459 1.629 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H]4C[C@]4(CO)C3)C2)cc1 854299583 PSCOLYSUQMCSNV-SUNYJGFJSA-N 331.416 1.298 10 10 EDCE Cc1nnc2n1C[C@@H](C(=O)NCc1ccc3cccnc3c1O)CC2 862027194 LXAZPSBKCDPTOM-AWEZNQCLSA-N 337.383 1.719 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCO[C@@H](CC(N)=O)C1 863487434 UISMDPALDJLVOH-ZDUSSCGKSA-N 347.440 1.872 10 10 EDCE C[C@H](NC(=O)NC[C@H]1CCCN1S(C)(=O)=O)c1ccccc1O 868434952 JKOPECADTWOIPG-NWDGAFQWSA-N 341.433 1.176 10 10 EDCE Oc1cc2c(cc1CNC[C@]1(O)[C@H]3[C@H]4C[C@@H]5[C@H]6[C@@H](C[C@H]53)[C@@H]1[C@@H]64)OCO2 785546228 ROKNDWMNCXDXFW-LXONHHPUSA-N 341.407 1.719 10 10 EDCE COC(=O)[C@@H]1C[C@@H]2C[C@H](NC(=O)/C=C\c3ccc(O)c(O)c3)[C@@H]2C1 888465255 FLBSLHCNTCARQM-FXRWGHQISA-N 331.368 1.815 10 10 EDCE COC(=O)c1c(CN[C@H]2CCCNC2=O)c2cc(F)ccc2n1C 894882973 ORNRGEWSKKNTBJ-ZDUSSCGKSA-N 333.363 1.472 10 10 EDCE C[C@@H](O)COC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O 791494389 NYFGZIVLPVDETN-SECBINFHSA-N 325.320 1.582 10 10 EDCE CC[C@H](NC(=O)C(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCCOC1 1334671316 SOPRIZRKBDLDPN-HIFRSBDPSA-N 332.400 1.556 10 10 EDCE NCc1ccc(N2CCN3C(=O)NC[C@@H]3C2)c(F)c1Br 231840278 AUWDHLXEFMCOLJ-SECBINFHSA-N 343.200 1.261 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@H]2CCCO2)cc1C 1332477671 XEPODNFIXYYVJV-DOTOQJQBSA-N 336.432 1.092 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CN1CC(=O)N(C)C1=O 1264287035 HVFJDSOWIITBHM-UHFFFAOYSA-N 344.415 1.139 10 10 EDCE [N-]=[N+]=N[C@@H]1CCN([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2O)C1 1912151715 KPNUVHWTXXDLPV-ILXRZTDVSA-N 331.376 1.753 10 10 EDCE Nc1cc2c(cc1N(CCCO)Cc1ccccc1)NC(=O)CO2 1914602468 KOPMCDJPKJGXLK-UHFFFAOYSA-N 327.384 1.989 10 10 EDCE CCOC(=O)Cc1csc(CNC(=O)c2cc(O)cs2)n1 1520660172 MQPAYNXTQMVNMG-UHFFFAOYSA-N 326.399 1.946 10 10 EDCE C[C@@H](O)CCCN1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1716753973 CVAWAWRXTGGFTQ-GFCCVEGCSA-N 347.419 1.766 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)Cc2cc[nH]n2)cc1C 1482087497 OSVANZHZWWXABH-ZDUSSCGKSA-N 330.432 1.811 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1n[nH]c(C)c1O 1497370948 HHGKSLPBYPIGPJ-UHFFFAOYSA-N 346.431 1.993 10 10 EDCE C[C@H](NC(=O)CN(C)c1ncnc2[nH]cnc12)c1ccccc1O 1632249822 CQOKROXIOMPKHB-JTQLQIEISA-N 326.360 1.372 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1ccc(Br)nc1O 1635959278 HKXRPJPNYSKHKE-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE C=CC(=O)NCCNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1632649418 HPQNXFDBYOEOCM-UHFFFAOYSA-N 339.395 1.939 10 10 EDCE C[C@H]1Oc2c(cccc2C(=O)NCc2cccc(O)c2O)NC1=O 1643812555 KRKADJLCLWFITB-SECBINFHSA-N 328.324 1.747 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H](F)C(C)C)cc1C 1571438778 SZSSYQRBGRRPQV-ZBFHGGJFSA-N 326.412 1.564 10 10 EDCE Cc1ccc(O)c(CNC(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)c1 1641729796 YTANWFKJRSERCK-OAHLLOKOSA-N 347.396 1.047 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C2C=CC=CC=C2)cc1C 1667832262 SJOYSGAEMQOCRC-SFHVURJKSA-N 342.439 1.869 10 10 EDCE CCNCc1ccc(N2CC(=O)NC(=O)[C@H]2C)c(Br)c1 233516479 OYDQQSRNMHENTJ-SECBINFHSA-N 340.221 1.410 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC[C@@H](OC)C3)c(Br)cc21 234504267 UDVLNHKTLKJOPE-AMIZOPFISA-N 340.221 1.887 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1C(=O)NCCN=[N+]=[N-] 1963817513 OFJQBBFOFYLTHW-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE CCOc1cccc(CNCc2c(Br)nnn2C)c1O 1967835889 YRPSKNBTOBHWAV-UHFFFAOYSA-N 341.209 1.972 10 10 EDCE NCc1cc(F)c(N2CCC([C@H](O)CO)CC2)cc1Br 2152465402 WWFYQPYCPGJFNY-CQSZACIVSA-N 347.228 1.617 10 10 EDCE O=C(O)[C@H]1OCC[C@H]1CNCc1ccc(Br)cc1O 716293892 YZWMQHBRZMLHGC-CABZTGNLSA-N 330.178 1.734 10 10 EDCE CNCc1ccc(N2CC[C@@H](O)[C@H](CO)C2)c(Br)c1 396829989 PPBOGTNKVFFPJU-SMDDNHRTSA-N 329.238 1.348 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3CCC[C@@H](C(=O)N(C)C)C3)c2n1 2062317023 ASKJEZYWYOGCQQ-NEPJUHHUSA-N 345.403 1.120 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)cc1Br 2182542439 IZEVRFWYDMAWGG-JLUCKKNBSA-N 341.249 1.346 10 10 EDCE CC(C)(C)OC(=O)N[C@]12C[C@H]1CN(C(=O)COc1ccc(N)cc1)C2 2044622168 ZHHBBBOGHUAKHD-SGTLLEGYSA-N 347.415 1.773 10 10 EDCE C[C@H](N)c1ccc(N2CCN3CCOC[C@@H]3C2)cc1Br 2185896579 OJVMWDKMSKJYOZ-AAEUAGOBSA-N 340.265 1.990 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)C[C@@H](O)C2)cc1Br 2105075163 PZUQMMLRWHDLEL-YUSALJHKSA-N 329.238 1.661 10 10 EDCE C[C@@H](NC(=O)c1nn(C)nc1Br)c1ccccc1O 2226975853 AVBQKSKQJPJUPH-SSDOTTSWSA-N 325.166 1.774 10 10 EDCE Cc1ccccc1N1C(=O)C(=CNC[C@H]2CCCO2)C(=O)NC1=S 2297317974 UHMOUURKNMAILV-GFCCVEGCSA-N 345.424 1.395 10 10 EDCE C[C@@H]1CCNC[C@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2310309934 ZBAINZNGSGOFLY-CRAIPNDOSA-N 329.444 1.651 10 10 EDCE COC1CN(CCNCc2cc(Br)cc(F)c2O)C1 2339979866 WQUKZCPCDMABCH-UHFFFAOYSA-N 333.201 1.714 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1cc(C)ccc1N)c1ccc(N)cc1 170319136 BQPOFDDTKKNYEX-UHFFFAOYSA-N 326.356 1.678 10 10 EDCE CN1C(=O)CCc2cc(N3CCN(C(=O)[C@@H]4CCCO4)CC3)ccc21 62575702 KSMGAWFWBVGBFB-KRWDZBQOSA-N 343.427 1.423 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)[C@H](N)Cc1ccc(O)c(O)c1 1952755766 VQBMVFDTPHXLCN-NEPJUHHUSA-N 326.393 1.507 10 10 EDCE COC(=O)[C@H]1C[C@H](O)CN1Cc1cc(Br)cc(C)c1O 188613028 GCCQTWGJIAPRJZ-NWDGAFQWSA-N 344.205 1.571 10 10 EDCE COc1cccc(OC)c1C(=O)NCCN1C(=O)CSC1=S 49755585 JHFWXCDYWWBUFI-UHFFFAOYSA-N 340.426 1.294 10 10 EDCE CCN1CC(=O)N(Cc2ccc(C)c(Br)c2O)CC1=O 2380779210 ZVOQLXNLRRXFHA-UHFFFAOYSA-N 341.205 1.654 10 10 EDCE Cc1ccc(CN2CCN(C[C@@H](C)O)CC2)c(O)c1Br 2380815701 RNBHQOKZHURRPW-GFCCVEGCSA-N 343.265 1.962 10 10 EDCE CC(=O)C(=O)COC(=O)C[C@@H]1CSCCN1C(=O)OC(C)(C)C 808529738 RCJIYRXOFKKTLS-LLVKDONJSA-N 345.417 1.430 10 10 EDCE CN1C[C@@H](C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)NC1=O 819978775 GRALFAINOUJZSR-INIZCTEOSA-N 330.432 1.659 10 10 EDCE CCN(C)c1ccc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)cc1 815116160 BXXOFBVVFREXNJ-QGZVFWFLSA-N 339.505 1.999 10 10 EDCE Cc1c(C[C@H](CN)CN2CCOc3cc(N(C)C)ccc32)cnn1C 903905368 DBFJXQKCRQRVEB-OAHLLOKOSA-N 343.475 1.811 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@H]2CCCCN2CCO)cc1 836223483 BKOLAAOYZNKGFY-QGZVFWFLSA-N 334.464 1.399 10 10 EDCE COc1ccc(O)c(CNC(=O)COCC(=O)OC(C)(C)C)c1 843831213 NNBNOYBAYWSDRW-UHFFFAOYSA-N 325.361 1.375 10 10 EDCE CCC[C@H](C)C(=O)NCCNC(=O)NCc1c(O)cccc1F 922603954 PMPOQIXLYVMQNZ-NSHDSACASA-N 325.384 1.883 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H]2COC[C@H]2C1 850626134 MYHOAXIADBAYBS-HZPDHXFCSA-N 346.427 1.626 10 10 EDCE Nc1ccc(NC(=O)N[C@H]2CCN(c3ccc4nncn4n3)C2)cc1 859697565 INKYKWITEOEKCF-ZDUSSCGKSA-N 338.375 1.107 10 10 EDCE C[C@H](NC(=O)NC[C@@H](C)CN1CCN(C)CC1)c1ccccc1O 868358903 UHUFWWUYMQUNND-CABCVRRESA-N 334.464 1.636 10 10 EDCE CCOc1cccc(CN2CCN(C(C)(C)C(=O)OC)CC2)c1O 779191453 RESCQEMRQASESI-UHFFFAOYSA-N 336.432 1.860 10 10 EDCE C[C@H](NC(=O)c1cccc(O)c1O)c1ccc(S(C)(=O)=O)cc1 776319698 GXEMMQBWPYARFT-JTQLQIEISA-N 335.381 1.992 10 10 EDCE OC[C@H]1C[C@@H](O)CN1c1ccc(CNC2CC2)c(Br)c1 698202165 WLUOJYBIXVCTNK-ZIAGYGMSSA-N 341.249 1.633 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCC[C@@H]1N1CCC(O)CC1 1302835092 NYNIRVWJWXGMKV-GJZGRUSLSA-N 334.416 1.134 10 10 EDCE [N-]=[N+]=NCCCN[C@H](C(N)=O)c1cc(O)ccc1Br 1912198927 MFNLANYJBZBCMC-JTQLQIEISA-N 328.170 1.971 10 10 EDCE [N-]=[N+]=NCC1CCN(C[C@@H](O)CN2C(=O)c3ccccc3C2=O)CC1 1912210381 IULATPIGTTYRLI-CYBMUJFWSA-N 343.387 1.666 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccn(C)c2)cc1C 1278069749 DPWDWPAALNQVBD-INIZCTEOSA-N 331.416 1.223 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc2nnnn2c1 1523552697 ASKMLWRGKUZFLR-UHFFFAOYSA-N 336.399 1.997 10 10 EDCE CC(C)N1C(=O)C[C@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C1=O 1545128242 DZINAGGAYDVNAJ-VIFPVBQESA-N 348.380 1.578 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CC(=O)NCC(F)F 1707861735 UBGAWERZRZKODO-UHFFFAOYSA-N 339.346 1.310 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 1558534148 OGTHIBGOJKLGPZ-GFCCVEGCSA-N 341.367 1.158 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H]2CCC(=O)N2)cc1C 1497156979 YYSJVOVYELVBCW-UKRRQHHQSA-N 333.432 1.267 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cnn(C)c2N)cc1C 1569054058 YYBRUXOJPOGPBC-LBPRGKRZSA-N 331.420 1.227 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@]2(C)C=CCC2)cc1C 1497031372 BVJHSVKQFDLQHX-QFBILLFUSA-N 332.444 1.927 10 10 EDCE CC(=O)N/C(=C\c1ccccc1)C(=O)NCc1c(O)cccc1O 1635843038 FSSDJDQJARALLR-GDNBJRDFSA-N 326.352 1.891 10 10 EDCE CC1=NNC(=O)[C@H]1CCNC(=O)c1cc(C)n(-c2ccccn2)c1C 1585158236 QZDCNZOPHOPSTI-AWEZNQCLSA-N 339.399 1.731 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@]2(C)CCNC2=O)cc1C 1670245920 JHCYUSKHQXMORK-LJQANCHMSA-N 347.459 1.468 10 10 EDCE Cc1cc(C(=O)CN2CCNC(=O)C2)c(C)n1-c1ccc(F)cc1 15479651 FZBGFWOYRMPLDE-UHFFFAOYSA-N 329.375 1.848 10 10 EDCE CN(C)CCOc1ccccc1C(=O)NCc1ccc(O)c(O)c1 158882591 LQHHCADUNGZWPJ-UHFFFAOYSA-N 330.384 1.968 10 10 EDCE CNCc1ccc(N2CCC[C@@H]2C(=O)NC)cc1Br 234440104 YUVZUIGFFBIUPI-CYBMUJFWSA-N 326.238 1.883 10 10 EDCE CNCc1ccc(N2CCS(=O)(=O)CC2)c(Br)c1 234453820 IGIIOXNFKGRKBW-UHFFFAOYSA-N 333.251 1.403 10 10 EDCE O=C(O)[C@H](F)C1(O)CN(Cc2cc(Br)ccc2O)C1 1875538996 POJLYKQECCJTJA-JTQLQIEISA-N 334.141 1.124 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985093746 DXAJVOHMOLYXFI-QWRGUYRKSA-N 327.385 1.421 10 10 EDCE CCNC(=O)[C@H]1COCCN1c1ccc(CN)cc1Br 159308276 KOUVBMNNEZFKIC-CYBMUJFWSA-N 342.237 1.249 10 10 EDCE Oc1c(F)cccc1CN=c1[nH]ccnc1I 2008698813 AULJWPGJYBJPFA-UHFFFAOYSA-N 345.115 1.960 10 10 EDCE CN(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010390096 YUNPEWHVQOMENF-VXGBXAGGSA-N 340.428 1.743 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010389609 RVHJCONHXLISLW-NEPJUHHUSA-N 340.428 1.743 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NCc2cc(F)cc(F)c2O)C1 2011488457 WUJYLAVVAQMTPB-CHWSQXEVSA-N 344.358 1.740 10 10 EDCE CN1CCC(NCc2c(O)cccc2Br)(C(N)=O)CC1 2154483634 HMBLTFCQMOQNEV-UHFFFAOYSA-N 342.237 1.194 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)NCCc1ccc(N)cc1 2022880195 IWNAWEJOBZSVTD-SMDDNHRTSA-N 337.420 1.202 10 10 EDCE CCNCc1ccc(N(CCO)CCN(C)C)cc1Br 2155581219 UTPXUMSHRLGCEG-UHFFFAOYSA-N 344.297 1.919 10 10 EDCE CNCc1ccc(N2CCC[C@@H](CO)[C@@H]2CO)cc1Br 709823238 MPKFZDPLQTXOFV-WFASDCNBSA-N 343.265 1.738 10 10 EDCE C[C@H](CO)CN(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 688701407 VRQNAXBIFNJAHE-JVXZTZIISA-N 329.194 1.499 10 10 EDCE CCN[C@H](c1ccccc1O)[C@H](O)c1nn(C)nc1Br 2167727791 XHIASCRXYIZHBI-PWSUYJOCSA-N 341.209 1.667 10 10 EDCE CCNCc1ccc(N2CCC[C@H]2[C@@H](O)CO)c(Br)c1 2179798993 MPNIIHZEYAZRPQ-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE O=C(NCCn1cc(Br)cn1)c1cc(O)c(O)c(O)c1 2188868280 OJJIVRUDNDNKDR-UHFFFAOYSA-N 342.149 1.192 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(O)(Cc2ccccn2)CC1 1453245145 RDTBJRBGROHJFC-UHFFFAOYSA-N 342.395 1.632 10 10 EDCE CNCc1ccc(N2CC[C@@H](C)[C@H]2C(N)=O)cc1Br 2090267055 YSRGGKWOTQJSKV-RNCFNFMXSA-N 326.238 1.869 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(Cc2cccnc2)CC1 2307981872 ALJDEWVELVZPFC-UHFFFAOYSA-N 339.395 1.850 10 10 EDCE C[C@H]1CN(CC(C)(C)O)CCN1C(=O)C=Cc1ccc(O)c(O)c1 2310572300 TYCTYVYMLAFVIB-ZDUSSCGKSA-N 334.416 1.415 10 10 EDCE O=C1C(=Cc2ccc[nH]2)SC(=S)N1CCCN1CCOCC1 2323708195 PLJHVAZBTPBJHR-UHFFFAOYSA-N 337.470 1.938 10 10 EDCE Cc1ccc(CNC(=O)CS(C)(=O)=O)c(O)c1Br 2327791131 ANCCRDZQAXOOQK-UHFFFAOYSA-N 336.207 1.124 10 10 EDCE Cc1ccc(CN2CCN[C@H]3COC[C@H]32)c(O)c1Br 2352944999 PIGMZEHIEZHNJL-NWDGAFQWSA-N 327.222 1.636 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(n4cccn4)CC3)cc2N1 301700972 SOUSUYIGBRXKBY-UHFFFAOYSA-N 343.343 1.964 10 10 EDCE CC(=O)N(C(=O)N[C@H]1CC(=O)N(C(C)(C)C)C1)c1ccc(N)cc1 217285446 XDRSMOHOLPGNPR-ZDUSSCGKSA-N 332.404 1.731 10 10 EDCE CCCCN(CC(N)=O)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 255742117 XODPOZJEAFVIHK-VURMDHGXSA-N 335.360 1.873 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3ccncn3)CC2)cc1 275229412 FEETYWZWNWUPIV-UHFFFAOYSA-N 341.415 1.037 10 10 EDCE Cc1ccc(CNC[C@H]2CN(C)CCN2C)c(O)c1Br 2381137941 LBXCFMJALHQXAX-ZDUSSCGKSA-N 342.281 1.799 10 10 EDCE Cc1ccc(CN=c2ccc3nncn3[nH]2)c(O)c1Br 2380743791 GTGGRUKOBCJZQM-UHFFFAOYSA-N 334.177 1.935 10 10 EDCE CN(C)c1ccc([C@H](N)[C@@H](O)c2c(Br)nnn2C)cc1 2163142730 DBZHPYVLTRKECZ-CMPLNLGQSA-N 340.225 1.377 10 10 EDCE CN1CC[C@@]2(CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)C2)C1 292255337 YBIQNBOVTSBIDM-HXUWFJFHSA-N 344.503 1.739 10 10 EDCE CCO[C@@H]1C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1n1cccn1 819397462 KEIRMNIIRBOCQU-JCBFTDALSA-N 343.383 1.842 10 10 EDCE O=C(NCc1cc(NC(=O)[C@H]2CCOC2)ccc1O)[C@H]1CCOC1 829558006 VEIZJGPVVWDNKT-RYUDHWBXSA-N 334.372 1.020 10 10 EDCE CC[C@@H](O)CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 822660078 JUJDZLAZPZOVPW-GDBMZVCRSA-N 333.432 1.166 10 10 EDCE CCN(CCC(=O)O)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 588592256 QRZJDDGBWJPPQR-YVMONPNESA-N 332.400 1.860 10 10 EDCE COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(N(C)C)nc2)c1 734073566 RFLCTSVBCZQJMV-UHFFFAOYSA-N 344.371 1.117 10 10 EDCE Nc1ccc(CCNC(=O)CCCCCCS(N)(=O)=O)cc1 832658790 CGCUFMJOCLYLOZ-UHFFFAOYSA-N 327.450 1.167 10 10 EDCE C[C@@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@H]1CCCO1 918906554 PGRKCYJKDCAPCF-CRAIPNDOSA-N 331.460 1.870 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)NC[C@@H]1CN(C2CC2)C(=O)O1 847464945 ABVFWAMKNFIAJU-GFCCVEGCSA-N 339.779 1.828 10 10 EDCE COCCCCS(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849416192 LZXBRJBJMRJDGL-AWEZNQCLSA-N 342.461 1.620 10 10 EDCE O=C(NCCO)c1ccc(NCCCSc2nccs2)nn1 746460095 DRBDRXAZKPHPMX-UHFFFAOYSA-N 339.446 1.250 10 10 EDCE CN(C)c1ccc(CN(C[C@H](O)C2(O)CCOCC2)C2CC2)cc1 929295107 JHOMZVMOQAPSIE-SFHVURJKSA-N 334.460 1.619 10 10 EDCE CNc1nnc(CC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)s1 855227998 STZPJVXECADFMQ-NSHDSACASA-N 347.444 1.526 10 10 EDCE COC(=O)C1(CS(=O)(=O)NCc2cc(Cl)ccc2O)CC1 867462785 COBDBFGVFTXGKR-UHFFFAOYSA-N 333.793 1.418 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@H]2CCSC2)c1 869602430 PQOBYVDOWITWEC-JTQLQIEISA-N 344.458 1.637 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)c1cnn(C(C)(C)C)c1 773739519 BCQYUCOPXJFVEM-NSHDSACASA-N 345.399 1.979 10 10 EDCE C[C@H](NC(=O)CN1CCCC2(CC2)S1(=O)=O)c1ccccc1O 1123964903 XQGSDJBNIYFWBU-LBPRGKRZSA-N 338.429 1.528 10 10 EDCE C[C@@H]1CO[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 895786992 IMBQMGFLBFYWKG-YVEFUNNKSA-N 336.407 1.828 10 10 EDCE CN1CCN(CCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1(C)C 1155558484 NESWGYPVBSSNKH-UHFFFAOYSA-N 346.435 1.605 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)C[C@@H]2CN(C)C)c(Br)c1 97246516 VGEPKWLCWXHWJI-RTXFEEFZSA-N 342.281 1.970 10 10 EDCE CC(F)(F)CN1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 1157352701 JQUNCEIEQJEVKJ-HYXAFXHYSA-N 326.343 1.910 10 10 EDCE CCCC(=O)NC[C@@H](C)NCc1nnnn1-c1ccc(OC)cc1 1266918071 QEFPVWSXGZAFMR-GFCCVEGCSA-N 332.408 1.065 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCO1 1351363145 MBRAMWIDNPUGFU-UONOGXRCSA-N 333.432 1.567 10 10 EDCE CCOCC(=O)N1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1283329145 OSSUMVIKQBDKIL-CYBMUJFWSA-N 347.375 1.216 10 10 EDCE CC[C@H](CNC(=O)c1ccc[nH]1)NC(=O)c1cc(OC)nc(OC)c1 1285031848 HAJUGEPZJWPBSP-GFCCVEGCSA-N 346.387 1.365 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CSC(c2ccccc2O)=N1 1455357501 RTHQNOYBZBSADL-ZDUSSCGKSA-N 344.392 1.982 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2CCC(=O)NC2)cc1C 1714477015 ZWIZBGHCOSTGFK-GOEBONIOSA-N 347.459 1.514 10 10 EDCE Cn1c(CO)nc2cc(C(=O)NCc3c(O)cccc3O)ccc21 1558536451 YMRIXBOODFJKET-UHFFFAOYSA-N 327.340 1.407 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)N2Cc3cccc(O)c3C2)c(N)c1 1632708605 BRAFPNQJPTWECQ-UHFFFAOYSA-N 332.381 1.534 10 10 EDCE CC(C)(CS(C)(=O)=O)NC(=O)c1ccc(N=NC(N)=O)cc1 1638326878 YJUUBPGTRBWXPO-UHFFFAOYSA-N 326.378 1.402 10 10 EDCE COC(=O)[C@@](C)(Cn1cccn1)NC(=O)/C=C/c1ccc(O)c(O)c1 1637024450 AMEBCHWQZQGUNS-QQOXCAACSA-N 345.355 1.056 10 10 EDCE CCOCC(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1744687909 DDPYDPIJGHEMBU-JTQLQIEISA-N 335.364 1.120 10 10 EDCE CN(C)C[C@H]1C[C@@H](O)CN1c1ccc(CN)c(Br)c1F 231840230 FNJYBHBMNSXFFY-GHMZBOCLSA-N 346.244 1.548 10 10 EDCE CN(CCc1ccccn1)C(=O)CNC(=O)c1c(F)ccc(O)c1O 1654283466 SPISSQOXXNFGOI-UHFFFAOYSA-N 347.346 1.063 10 10 EDCE CNS(=O)(=O)c1ccc(CC(=O)N[C@@H](C)c2ccccc2O)cc1 1587450910 AASRKFSLRKPUEJ-LBPRGKRZSA-N 348.424 1.720 10 10 EDCE CCOC(=O)c1[nH]nnc1[C@H]1CCCN1C(=O)c1cccc(O)c1O 1595492610 KYQSMKCWOUHZBB-SNVBAGLBSA-N 346.343 1.370 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H]2COC(=O)N2)cc1C 1670079330 AJVCEXWMCDEUDE-CQSZACIVSA-N 335.404 1.050 10 10 EDCE C[C@@H](NC(=O)NCc1c(O)ccc2c1CCCC2)c1nnc(O)n1C 1685308313 IXMKRRYCKRKNIN-SNVBAGLBSA-N 345.403 1.666 10 10 EDCE O=C1c2cccc(NCCO)c2C(=O)c2c(NCCO)cccc21 5010477 NERFPNHSRWWSBD-UHFFFAOYSA-N 326.352 1.270 10 10 EDCE NC(=O)CC[C@H](N)C(=O)Nc1ccc(Cc2ccc(N)cc2)cc1 1866105362 HMMRNIMSGJNLBP-INIZCTEOSA-N 326.400 1.391 10 10 EDCE CC[C@@](C)(N)C(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 1866113324 PHYRKBBXKGYVTQ-CRAIPNDOSA-N 329.448 1.819 10 10 EDCE Cn1cnc(S(=O)(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)c1 1890717110 OGAQFGCCVRJBKE-HOCLYGCPSA-N 346.456 1.887 10 10 EDCE COCC(O)(CNCc1ccc(Br)cc1O)COC 1875694789 DNIDYVBVPWBOAX-UHFFFAOYSA-N 334.210 1.268 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](O)CC(=O)O 1951839538 LRJWWXPDTXSHEY-PWSUYJOCSA-N 341.360 1.369 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)Cc2ccc(N)cc2)CCO1 1999142753 FJISYCVXJCURIB-CQSZACIVSA-N 335.404 1.869 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)c1cc(CNC(=O)OC(C)(C)C)nn1C 2010388776 GSQJZIHXEYCNCS-UHFFFAOYSA-N 337.384 1.827 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010402338 PQNPCEUYAJGCQJ-RYUDHWBXSA-N 341.412 1.954 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@H](O)CNC(=O)OC(C)(C)C)c1 2011423458 SGHCEUJPNAIHOU-RYUDHWBXSA-N 340.420 1.937 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H]2CS3(=O)=O)cc1Br 321617079 MLOXYJOHVAUTJE-INTQDDNPSA-N 345.262 1.845 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCc3ccc(C(C)(C)O)cc3)c2n1 2064784071 XTLAJGBTPRKNEO-UHFFFAOYSA-N 340.383 1.901 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)cc1Br 2178086651 MQSUGAIOWARCAZ-JLBHGKSJSA-N 341.249 1.912 10 10 EDCE CC(C)NCc1ccc(N2CCC2(CO)CO)c(Br)c1 2194352543 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1.231 10 10 EDCE Cc1ccc(CN2CC(=O)N[C@H](C)C2=O)c(O)c1Br 2352693451 PSBBISCILRIDTD-MRVPVSSYSA-N 327.178 1.310 10 10 EDCE C[C@@H]1CN(S(=O)(=O)NCc2ccc(N(C)C)cc2)[C@H](C)CO1 172986832 DBKIBSKQBZHPFW-CHWSQXEVSA-N 327.450 1.196 10 10 EDCE COc1ccc(-n2nnnc2CN[C@H](C)CN(C)C(=O)C(C)C)cc1 1277759018 DDZZBWNUCRMWEY-CYBMUJFWSA-N 346.435 1.263 10 10 EDCE CCCNC(=O)CN(CC(=O)NCCC)c1ccc2c(c1)CCO2 31466099 XVQZJSDJAPGSRV-UHFFFAOYSA-N 333.432 1.480 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@@H](O)[C@H]4C3)c(Br)cc2[C@H]1O 2358429771 BAPMBWKVGOYXOA-SOJLBTSZSA-N 339.189 1.252 10 10 EDCE COC(=O)CC[C@H](N)c1cc(I)ccc1O 95769529 LPMIGSTYXQDJNK-VIFPVBQESA-N 335.141 1.950 10 10 EDCE Cc1c(/C=C\C(=O)N(CC(=O)N(C)C)c2ccccc2)cnn1C 255328360 QMMQTDPDSKLKCY-KHPPLWFESA-N 326.400 1.863 10 10 EDCE COc1cc(Cl)cc(CN2CCC[C@@]3(C2)NC(=O)NC3=O)c1O 279407832 LQXXNCOHLHFOMS-HNNXBMFYSA-N 339.779 1.228 10 10 EDCE CO[C@H](C)[C@H](N)CC(=O)NCc1ccc(C)c(Br)c1O 2380747615 WBPPXHSTGNCMRI-MWLCHTKSSA-N 345.237 1.832 10 10 EDCE CC(=O)C(=O)COC(=O)CCc1nc(-c2ccc(C)c(F)c2)no1 808507295 HAOORTSHQQDKNU-UHFFFAOYSA-N 334.303 1.818 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@@H](O)c2cnn(C)c2Br)cc1 2163136892 XUAVDWQOSUHDRS-OLZOCXBDSA-N 339.237 1.982 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CCNC[C@@H]3C)C2)cc1 818654628 DACKZHLGTXZAGC-DAYGRLMNSA-N 346.475 1.819 10 10 EDCE C[C@H](N)CCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 827469503 ZQYLSENHRMIWKT-ZFWWWQNUSA-N 332.448 1.132 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H](CO)C1CCC1 823519832 OUFHZUGBAWQOED-SFHVURJKSA-N 347.459 1.608 10 10 EDCE COC(=O)[C@@H](NCc1cc(F)cc(C(C)=O)c1O)c1ccnn1C 830383602 URTOQXFFGYLGLK-AWEZNQCLSA-N 335.335 1.471 10 10 EDCE COC(=O)CCc1nnc(NC(=O)NCc2ccccc2O)s1 737017152 JCWOOZCSBUUKQP-UHFFFAOYSA-N 336.373 1.671 10 10 EDCE O=C1C[C@@H](CCNC(=O)NCc2ccc(N3CC=CC3)cc2)CN1 919917087 CEVMOELYVUWFNO-OAHLLOKOSA-N 328.416 1.388 10 10 EDCE COC1(CS(=O)(=O)Nc2ccc(O)cc2C(C)=O)CCOCC1 844661502 TVFZOJCJNXPDMB-UHFFFAOYSA-N 343.401 1.532 10 10 EDCE CCOc1ccc(O)c(CNC[C@@H](N2CCNCC2)C(F)(F)F)c1 841069465 AQHCKMPHWQGHIY-OAHLLOKOSA-N 347.381 1.717 10 10 EDCE CC1(C)O[C@H]2C[C@H](N3C(=O)CN(Cc4ccccc4O)C3=O)C[C@H]2O1 925271026 WPWNOYMUJRAQJC-XMQYKBBCSA-N 346.383 1.839 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2CNCC3(CCOCC3)C2)c1 925793847 SHWDVZJSYLJOII-UKRRQHHQSA-N 348.443 1.988 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3n[nH]c4c3CCC4)C2)cc1 855232764 UNIGKKMLVQQOMX-GFCCVEGCSA-N 326.400 1.916 10 10 EDCE O=C(O)[C@]12COC[C@H]1CN(Cc1ccc(N3CCOCC3)cc1)C2 854241562 PFPRHUHWDBPTKG-CRAIPNDOSA-N 332.400 1.056 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)CN3CCOCC3)C2)cc1 855234151 TXOPVGCBVUYCPA-HOTGVXAUSA-N 347.459 1.358 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)C[C@@H]2CO)c(Br)c1 698198341 LKGAJHWLJOYHLX-OLZOCXBDSA-N 343.265 1.879 10 10 EDCE COC(=O)[C@]1(C)C[C@H](OC)CN1C(=O)/C=C/c1ccc(O)c(O)c1 869991334 NAGXXUMZUMYIDF-BZSXCTJTSA-N 335.356 1.290 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCNC34CCC4)C2)cc1 861658810 OBVICVMZKDRMRW-WMLDXEAASA-N 344.459 1.858 10 10 EDCE O=C1N=C(N2CCCCC2)S/C1=C/c1cn(C[C@H]2CCOC2)nn1 865219265 XMXSOYBAJFHQCU-ZBQKXELDSA-N 347.444 1.771 10 10 EDCE COC(=O)c1cc(OCC(=O)NC[C@H]2CCCO2)ccc1N(C)C 865395810 CDWQYJQKLMGEOP-CYBMUJFWSA-N 336.388 1.213 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3ccon3)CC2)c(OC)c1 870164375 UPZKJSOUDOUOEX-UHFFFAOYSA-N 331.372 1.583 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc2c1NC(=O)CO2 1138152567 KMGFTHVXHCLOGW-SNVBAGLBSA-N 342.351 1.790 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCOCC4(CC4)C3)nc12 782539075 OYYQGLJRAJFPFL-UHFFFAOYSA-N 346.387 1.224 10 10 EDCE CN1CCN(c2ccc(CNCc3cn4cccnc4n3)cc2)CC1 895606888 HJSSDTMRIAEEGA-UHFFFAOYSA-N 336.443 1.771 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(CCO)CC2)c(Br)c1 61695701 BRJFDLDKNJLTPG-GFCCVEGCSA-N 342.281 1.844 10 10 EDCE C[C@@H](O)[C@H]1CN(c2cc(Br)c(CN)cc2F)CCO1 2117526696 BAKSFOQCIWUNEF-AMIZOPFISA-N 333.201 1.633 10 10 EDCE COCCNCc1ccc(N2C[C@H](O)[C@H]2C)c(Br)c1 2126118978 HLENFMUKGLFBDV-YGRLFVJLSA-N 329.238 1.755 10 10 EDCE COC(=O)NC[C@H]1CCN1c1ccc(CN)cc1Br 2130739602 YZFKOLQDAJAXGV-SNVBAGLBSA-N 328.210 1.843 10 10 EDCE CCc1ocnc1C(=O)NC[C@@H](CO)NCc1ccc(OC)c(C)c1 1331685675 SQAXXSHUEMQOMJ-AWEZNQCLSA-N 347.415 1.435 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cc3nnc(N)s3)C2)cc1 1347107603 BZFFIDDIPDGOEF-SNVBAGLBSA-N 333.417 1.067 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC(COC)C3)c(Br)cc21 1916902118 SLRZOIVOVFOHQU-CYBMUJFWSA-N 340.221 1.744 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(-c2cccnc2)nn1 1447562677 MEBYJJWKROTMAR-NSHDSACASA-N 339.355 1.435 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1cccc(N2CCNC2=O)c1 1290989293 ZEXXHYPIZAZKHS-UHFFFAOYSA-N 327.340 1.809 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1cccc(N2C(=O)CNC2=O)c1 1540824111 IHPOSMSRCXRYCC-UHFFFAOYSA-N 341.323 1.335 10 10 EDCE COCCCN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 118590063 AEABTJZJGZHVBS-LBPRGKRZSA-N 328.210 1.874 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cccc(-n2cnnn2)c1 1627070169 XSYLDPDREMKSDI-UHFFFAOYSA-N 346.350 1.846 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC(c2nnc3n2CCC3)CC1 1558915598 UVHVUIHXSJNRFM-UHFFFAOYSA-N 346.362 1.794 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cncnc2)cc1C 1497565578 AMZLUPRKNAQTNB-ARJAWSKDSA-N 326.400 1.869 10 10 EDCE COc1cccc(CNC(=O)Cn2nc(C)c3cccnc32)c1O 1631543611 XNNWLVRPSTUBGS-UHFFFAOYSA-N 326.356 1.770 10 10 EDCE C[C@H](NC(=O)c1ccc2c(c1)NC(=O)CNC2=O)c1ccccc1O 1635803640 IMJZIWVVQXOYKE-JTQLQIEISA-N 339.351 1.565 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCOc2ccccc2[C@@H]1CO 1652536495 SEAQQAJTPGHIDQ-AWEZNQCLSA-N 329.352 1.595 10 10 EDCE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H]3COC[C@@H]3O)c2C)c1 1687286690 QEIKFBBHPLQWCM-MSOLQXFVSA-N 343.427 1.961 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@@H]1COC[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003167467 NWJFHFYGEXWHAK-ZDEQEGDKSA-N 340.420 1.134 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)c(Br)c1 2146153408 ICBFZBHGDJHTGL-HUUCEWRRSA-N 342.281 1.670 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010398553 WBAWYSUINSHBQC-GRYCIOLGSA-N 341.412 1.809 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NCc2c(O)cccc2F)C1 2011920029 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1.426 10 10 EDCE Cn1cnc2c1c(=O)n(CCCSc1nccs1)c(=O)n2C 52913965 DPJSOBCMYCENMJ-UHFFFAOYSA-N 337.430 1.073 10 10 EDCE C[C@H](O)CCCN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2361180309 CZEDYARJICROEL-ISVAXAHUSA-N 342.237 1.998 10 10 EDCE O=C(O)[C@@H]1CC[C@H](c2cc(I)ccc2O)N1 309494967 KNIMVKOUFUYVBY-BDAKNGLRSA-N 333.125 1.875 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C(C)=O)C(C)C)CC2)cc1 243849123 RFHJCNGBCZHAQL-UHFFFAOYSA-N 333.432 1.601 10 10 EDCE Cc1cc(C(=O)NCCc2nc(=O)o[nH]2)c(C)n1-c1ccccn1 280092605 LRSBPBQZTWIHDY-UHFFFAOYSA-N 327.344 1.138 10 10 EDCE CC(=O)C(=O)COC(=O)CNC(=O)CC12CC3CC(CC(C3)C1)C2 808498694 YMMYNYMIYLTCBL-UHFFFAOYSA-N 335.400 1.410 10 10 EDCE CCOC(=O)NCCC(=O)NCc1cc(Br)ccc1O 804732828 CYSASRDSPGUDAW-UHFFFAOYSA-N 345.193 1.907 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3nc(C)n(C)n3)C2)cc1 823508911 ZSDNRVTVYWNXPW-GFCCVEGCSA-N 330.392 1.533 10 10 EDCE C[C@@H](NC(=O)[C@@H]1CC[C@H](CN2CCOCC2)O1)c1ccccc1O 828539581 QWHUXBAIOKKDFV-CPUCHLNUSA-N 334.416 1.449 10 10 EDCE COC(=O)[C@]12C[C@H](N)C[C@H]1CN(Cc1ccc(N(C)C)c(F)c1)C2 903978839 NCYVGXYEOBMPNE-IYOUNJFTSA-N 335.423 1.604 10 10 EDCE CCn1cc(S(=O)(=O)Nc2ccc(O)cc2COC)nc1C 840918399 SGYDUQPWDCNRBO-UHFFFAOYSA-N 325.390 1.864 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H](CN)C(F)(F)F)cc1 848599400 ZJTVDPZFAZBFBS-CYBMUJFWSA-N 348.369 1.662 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCCCNC2)cc1 842206159 BFSLJRVDPFMKAB-MRXNPFEDSA-N 346.475 1.407 10 10 EDCE COc1cc2oc(=O)cc(C)c2cc1CCC(=O)OCC(=O)C(C)=O 924020702 DSIBZXUAQXBPSX-UHFFFAOYSA-N 346.335 1.744 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@@H]4C[C@H]3C[S@]4=O)C2)cc1 852448613 KXWLPHLIXIXYLO-PHUYUGPUSA-N 349.456 1.189 10 10 EDCE COC[C@]1(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCOC1 855225676 PRXJHJYEEQDVJH-KBXCAEBGSA-N 334.416 1.443 10 10 EDCE COCc1n[nH]c(CNC(=O)NCc2ccc(N3CC=CC3)cc2)n1 853777112 ZJBIPCDYCRSTQP-UHFFFAOYSA-N 342.403 1.327 10 10 EDCE C[C@@H](NC[C@@]12COCCN1C(=O)OC2)c1ccc(Cl)cc1O 866520495 BUBMQEBAKKOIFR-BMIGLBTASA-N 326.780 1.917 10 10 EDCE CN(C)[C@H](C(=O)NCc1ccc2cccnc2c1O)c1cncn1C 862026408 NLOMYYZBTNWUJA-INIZCTEOSA-N 339.399 1.593 10 10 EDCE O=C(C1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1)N1CCCC1 768441311 GDOICGHYBADEPM-KRWDZBQOSA-N 346.427 1.652 10 10 EDCE C[C@@H](NC(=O)C(=O)N1C[C@H]2CSC[C@H]2C1)c1ccc(N(C)C)cc1 897866069 QRHKWXSPPPZKHS-YUELXQCFSA-N 347.484 1.751 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNCc2cc(F)ccc2O)C1 702807111 AINSUHBULZCTPL-IUODEOHRSA-N 340.395 1.849 10 10 EDCE C[C@@H](O)[C@@H]1CN(c2cc(Br)c(CN)cc2F)CCO1 2117526698 BAKSFOQCIWUNEF-OQPBUACISA-N 333.201 1.633 10 10 EDCE CC(=O)C(=O)[C@]1(O)CCCN(C(=O)OC(C)(C)C)[C@@H]1C(F)(F)F 1903077734 XZXXKSWMMXFTKU-GXFFZTMASA-N 339.310 1.837 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cncnc2)cc1C 1267983104 YBZDFHCLOFWDSO-ZDUSSCGKSA-N 328.416 1.949 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 1908253511 UVZSODQXAQDLQV-MNOVXSKESA-N 339.396 1.875 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)Nc2cc(C3CC3)nn2C)cc1 1261277874 NWBGRKIKQMDSIB-UHFFFAOYSA-N 341.415 1.618 10 10 EDCE CN(C/C=C/c1ccc(N(C)C)cc1)Cc1nnc2c(=O)[nH]ccn12 1262113113 BZTWJPAHKLVFDX-SNAWJCMRSA-N 338.415 1.629 10 10 EDCE CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(CC)CC)cc2)C1 1347450055 NIDJWUVIXMGEDD-JCNLHEQBSA-N 347.459 1.833 10 10 EDCE COc1ccc(CN(Cc2ccccc2)CC2(O)CNC2)c(O)c1 1915510090 OFXQRLBSJDKGEA-UHFFFAOYSA-N 328.412 1.737 10 10 EDCE Cc1cc(CN2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)no1 1463718007 SZQOZBGHOXNMLY-UHFFFAOYSA-N 331.372 1.281 10 10 EDCE C[C@@H](N)c1ccc(N2CCCN(CCO)CC2)c(Br)c1 227351393 UMFZXOHAYCOQEJ-GFCCVEGCSA-N 342.281 1.973 10 10 EDCE C[C@]1(NC(=O)c2cc3cc(O)c(O)cc3s2)CCS(=O)(=O)C1 1540597249 OPOCDMJEIAJXHL-AWEZNQCLSA-N 341.410 1.620 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(CCO)C(C)C)c(Br)cc21 118712102 SKOHAECGLMXDRC-ZDUSSCGKSA-N 342.237 1.869 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCc1ccnc(-n2cncn2)c1 1479110288 NVRIGXXKXPEHMZ-UHFFFAOYSA-N 338.371 1.710 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1cnc2c(c1)NC(=O)CN2C 1629954796 DMDVPBDYEOOGMU-UHFFFAOYSA-N 326.356 1.448 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@H]2CCCC(=O)N2)cc1C 1497608445 NZCQEVBPWOSMDF-QDLOVBKTSA-N 345.443 1.434 10 10 EDCE CCOCC(=O)NC[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1725948726 SIAZGEVPQWNVBO-LLVKDONJSA-N 349.391 1.462 10 10 EDCE CCN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)C1CC1 1745325753 CVDUPRRHYLFACO-UHFFFAOYSA-N 331.376 1.837 10 10 EDCE COc1ccc([C@]2(C(=O)NCc3c(O)cccc3O)C[C@H](O)C2)cc1 1652629081 VXKKBOASRYGBTF-HJGJAMNPSA-N 343.379 1.815 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)C(=O)NCC2CC2)cc1C 1666640143 BWBRHHFHKQXLOJ-ZDUSSCGKSA-N 347.459 1.372 10 10 EDCE Nc1ccc(COc2nc[nH]c(=O)c2I)cc1 164179278 USDYBEMQARYVDP-UHFFFAOYSA-N 343.124 1.536 10 10 EDCE Cn1cc(C(=O)C(=O)C[C@H]2C[C@H](N)C2)c(=NC(=O)OC(C)(C)C)[nH]1 2003167413 NFTFMARQAWLHDP-MGCOHNPYSA-N 336.392 1.068 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@H]2[C@H](O)CO)cc1Br 2146335824 ZNSWPFXGXQAXPV-QCZZGDTMSA-N 345.237 1.027 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1986368579 HFOPHHXEYPDBCD-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010389610 RVHJCONHXLISLW-RYUDHWBXSA-N 340.428 1.743 10 10 EDCE CN(C)CCN(CC(=O)N(C)CCCN=[N+]=[N-])C(=O)OC(C)(C)C 2010392833 KDUSEDYXQJSCLN-UHFFFAOYSA-N 342.444 1.944 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@@H](CN=[N+]=[N-])C1)C(C)(C)O 2014484145 ZAJXFOPLKFQQTA-WDEREUQCSA-N 341.412 1.809 10 10 EDCE NCc1cc(F)c(N2CCC[C@@](O)(CO)C2)cc1Br 313638231 AEHJZEUBGLLQTI-ZDUSSCGKSA-N 333.201 1.371 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@]12CC[C@@H](C1)[C@H](O)[C@H]2O 2176916916 KTWGTMJEEMUYED-DRGUQFHNSA-N 346.196 1.658 10 10 EDCE CN(CCCC(=O)O)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2053779069 ZVDIOYDJJHGDCJ-UHFFFAOYSA-N 332.400 1.860 10 10 EDCE O=C1NC[C@@]2(CCCN(Cc3c(O)cccc3Br)C2)N1 2177679733 GVBRUCRDJCQQBB-CQSZACIVSA-N 340.221 1.802 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)c(F)c1Br 2190461608 UTEZVASQUAKTMP-AEHQLWAISA-N 345.212 1.510 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)NCc2ccccc2O)=C[C@H]1O 2067793009 QQKBEAFEXRKPEB-UKRRQHHQSA-N 348.399 1.593 10 10 EDCE CN(c1ccc(N)cc1)C(=O)[C@]1(NC(=O)OC(C)(C)C)C[C@@H](CO)C1 2073598973 RBGMYAYMJTXYBK-HEHXSTRBSA-N 349.431 1.897 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](O)[C@@H](O)CC2)c(Br)c1 2269120105 BGTCLYPJXVNJFF-IIMNLJJBSA-N 330.222 1.824 10 10 EDCE CCN1C(=O)C(=C2SC(=S)N(NC(C)=O)C2=O)c2ccccc21 2297298171 WTEQVAXGWZVTRY-UHFFFAOYSA-N 347.421 1.676 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1 2300531580 IQMVUQULRLQEQT-HNNXBMFYSA-N 341.412 1.907 10 10 EDCE Cc1nn(C)c(C)c1NC=C1C(=O)NC(=O)N(c2ccccc2)C1=O 2313547838 DFYVFFBGOLAFAI-UHFFFAOYSA-N 339.355 1.616 10 10 EDCE Cc1ccc(CN2C[C@H](O)C[C@@]2(C)CO)c(O)c1Br 2352944513 JAWWLTGHOMMMQW-RISCZKNCSA-N 330.222 1.781 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CNC[C@@H]2C)c(O)c1Br 2352948557 QUARNNUQIDGABY-GXSJLCMTSA-N 327.222 1.935 10 10 EDCE COC(=O)CN1C(=O)N/C(=C\c2ccc(N3CCCC3)cc2F)C1=O 33700005 UKKNVVIRIKNKAL-ZSOIEALJSA-N 347.346 1.492 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)O)C1(c2ccc(O)c(O)c2O)CC1 1952603246 UXCBKMDZIZMPPO-GFCCVEGCSA-N 339.344 1.813 10 10 EDCE O=C(CN1C(=O)/C(=C\c2ccccc2)SC1=S)NCCCO 210393389 LBIRFVNBNPLYKF-FMIVXFBMSA-N 336.438 1.386 10 10 EDCE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@@H]2COC(=O)N2)cc1 283065555 PGNNPIDOXVBOTP-CVEARBPZSA-N 347.415 1.369 10 10 EDCE CCn1ncc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 294859611 BWNZMMPSIQPVIO-UHFFFAOYSA-N 343.431 1.437 10 10 EDCE NC(=O)C1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1 819168720 VIOGXRXMPOQBRB-UHFFFAOYSA-N 331.372 1.201 10 10 EDCE COCC[C@@H](COC)NC(=O)N[C@@H](C)c1cc(OC)ccc1O 811956211 NEGIITMPOKUACS-RYUDHWBXSA-N 326.393 1.813 10 10 EDCE CS(=O)(=O)NCCN1C(=O)/C(=C\c2ccccc2)SC1=S 727177124 CIAGXCDQSJGJNY-PKNBQFBNSA-N 342.467 1.437 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCC=C(C)C)C2)cc1 829025999 FXPKUFHNPWXLJX-OAHLLOKOSA-N 345.443 1.863 10 10 EDCE O=C(/C=C/Cn1cncn1)NCc1ccc(N2CCC(O)CC2)cc1 912709405 KMLUEULYGIVOSS-OWOJBTEDSA-N 341.415 1.112 10 10 EDCE CCc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)no1 740495168 LPUHZOJYPHTILI-UHFFFAOYSA-N 330.388 1.866 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)NCc3cn(C)nn3)ccc21 679961852 YOTDVTUBDJTENB-UHFFFAOYSA-N 341.415 1.963 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)CC2(OC)CCOCC2)c1 845873075 AZUWFJATLOBBAK-UHFFFAOYSA-N 345.417 1.016 10 10 EDCE O=C(CC1(C(=O)O)CCOCC1)NCc1cc(Cl)ccc1O 911328807 BADWQBQNMGCENS-UHFFFAOYSA-N 327.764 1.933 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3C[C@H](N)C34CCC4)CC2)cc1 925508627 RRRINKCZRCNAKR-RBUKOAKNSA-N 344.503 1.677 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1[C@H]2COC[C@H]21 854033817 PIDCZTZSFFLKEN-FVQHAEBGSA-N 331.416 1.092 10 10 EDCE CCc1noc(C[C@@]2(O)CCCN(C(=O)c3cc(O)cs3)C2)n1 856712443 MEZMDDDJDVZSRA-HNNXBMFYSA-N 337.401 1.609 10 10 EDCE COC(=O)CCCCC(=O)NCc1ccc(N2CCC(O)CC2)cc1 856212510 LYNKXXAJRNORTO-UHFFFAOYSA-N 348.443 1.997 10 10 EDCE C[C@@H](NC(=O)c1cn(C)ccc1=O)c1ccc(N2CCOCC2)cc1 930745291 UWQHBAICWBPPPB-CQSZACIVSA-N 341.411 1.713 10 10 EDCE CN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)C[C@H]1CCS(=O)(=O)C1 769469249 VDSVTSYQEAJDMJ-SECBINFHSA-N 348.808 1.820 10 10 EDCE COc1ccc(N2CCN(C[C@H]3CCC4(COC4)O3)CC2)c(OC)c1 931531110 XFCBJJJSBQOLHO-MRXNPFEDSA-N 348.443 1.774 10 10 EDCE O=S(=O)(NCC1CC1)c1ccc(N2Cc3cccc(O)c3C2)nc1 866119453 PHTOTDQBIXARSV-UHFFFAOYSA-N 345.424 1.996 10 10 EDCE COC(=O)c1cc(OCC(=O)NCc2ccco2)ccc1N(C)C 865396539 UZVXPNGMWXXURL-UHFFFAOYSA-N 332.356 1.827 10 10 EDCE COc1ccc(N(C)CC(=O)N2CCOC[C@H]2C2CC2)cc1OC 766238930 CQZMGWPERHWMPC-HNNXBMFYSA-N 334.416 1.777 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3ccnn3C)CC2)cc1F 767947372 IYYFPAVZDIUPHZ-UHFFFAOYSA-N 332.379 1.459 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3COC[C@]3(C)C2)cc1F 1118669019 NJGWVLIDCBDSST-ACJLOTCBSA-N 349.406 1.003 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@]12C[C@@H](N)C[C@@H]1C2 870856759 OGGCQMPJQGBJMX-GJYPPUQNSA-N 329.444 1.609 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3cc(OC)nn3C)C2)cc1 881238820 LROZHAJVUFLGNF-GFCCVEGCSA-N 345.403 1.838 10 10 EDCE COc1nc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)co1 881854538 FXUWRKKPXCDOMJ-UHFFFAOYSA-N 330.388 1.365 10 10 EDCE COC[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@H](C)O1 784007254 AMQLAKRFVPPIFS-VHSXEESVSA-N 337.332 1.166 10 10 EDCE Cc1cc(S(N)(=O)=O)cc(NC(=O)c2cc(O)cs2)c1C 1135597423 RBMQXFHTXQQTRJ-UHFFFAOYSA-N 326.399 1.970 10 10 EDCE CCOC(=O)[C@@H](NCCN=[N+]=[N-])c1cnn(C)c1Br 712458584 DVVAYHYDUKUAKG-QMMMGPOBSA-N 331.174 1.687 10 10 EDCE C[C@H](O)[C@@H]1CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2125823335 OTTGYFZAIOQKCQ-IAOBUDJDSA-N 326.194 1.361 10 10 EDCE CC(C)(C)[C@@H]1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)C[C@H]1O 1327545176 MOEGWFKNCDJWTL-HZPDHXFCSA-N 347.459 1.183 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCc2cc(N)ccc21 1329858052 ZYNOANNFMMAGQO-INIZCTEOSA-N 339.395 1.737 10 10 EDCE Cn1cc(I)c(COc2cccnc2N)n1 1902304402 XOICUYNVWPHHOW-UHFFFAOYSA-N 330.129 1.581 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CC[C@H]3CC[C@H]2OC3)cc1 1332583575 ZDXDOYDMCRECIM-BHYGNILZSA-N 345.443 1.443 10 10 EDCE COCC(=O)N[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@@H]1C 1281140041 JYJDOFPFCSQLRQ-ZWNOBZJWSA-N 347.375 1.215 10 10 EDCE CCC[C@@H]1C[C@H]1C(=O)NC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1704060119 FBWGXRGWBHCDDS-YRGRVCCFSA-N 349.431 1.770 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C(C(N)=O)[C@@H]3C2)c(Br)c1 2136583839 AOSRFMMIINKKGW-FXBDTBDDSA-N 325.206 1.670 10 10 EDCE CN(C)[C@H]1COC[C@@H]1CNCc1ccc(Br)cc1O 1924718928 NYYNICPWFJHJAF-AAEUAGOBSA-N 329.238 1.821 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN(C[C@@H]2CCOC2)CC1 1544028220 RAORCHLNRRWGDP-AWEZNQCLSA-N 334.416 1.257 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cncnc2O)cc1C 1716309113 VCZCHFXEUVSDTF-ONEGZZNKSA-N 342.399 1.575 10 10 EDCE CNC(=O)C1(C(=O)NCC[C@@H](C)NCc2ccc(OC)c(C)c2)CC1 1492096936 VADOTBFCPGNFMQ-CQSZACIVSA-N 347.459 1.514 10 10 EDCE CC[C@@H](C)CC(=O)NC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1720906852 LQMXWRAJHAWQTM-VXGBXAGGSA-N 337.420 1.770 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H](C)n2cncn2)cc1C 1568988464 OOEDXPDDPXHFKM-KGLIPLIRSA-N 331.420 1.451 10 10 EDCE CC(C)(C)OC(=O)C1=NO[C@@H](C(=O)NCc2ccc(O)cc2O)C1 1570462448 UEODOHDZUXUGOG-CYBMUJFWSA-N 336.344 1.201 10 10 EDCE CNS(=O)(=O)c1cc(C(=O)NCc2cc(Cl)ccc2O)co1 1583820524 FNSAKGWFTGOMLQ-UHFFFAOYSA-N 344.776 1.477 10 10 EDCE CCC[C@H](OC)C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1758043863 CDJZYQOCJOXERC-ZDUSSCGKSA-N 349.391 1.510 10 10 EDCE O=C(Cn1cc(Br)cn1)NCc1c(O)cccc1O 1597568903 KEKDXJJQEONARP-UHFFFAOYSA-N 326.150 1.373 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2cc(C)on2)cc1C 1676498516 CETWHNHXIXGDIN-CQSZACIVSA-N 333.388 1.181 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CCN2C(=O)CCCF)cc1 1689537820 RLNFTXDGHSCDGM-ZDUSSCGKSA-N 349.366 1.929 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NC[C@@](C)(O)CN(C)C 153003766 AVSQMDMAFGYEQR-QGZVFWFLSA-N 330.388 1.293 10 10 EDCE C[C@H](O)[C@@H](C(=O)O)N1C(=O)/C(=C\c2cccc(F)c2)SC1=S 1858592288 MCNIRAFVAUGWKE-OMOYZJFYSA-N 341.385 1.861 10 10 EDCE CC(C)(C)OC(=O)NCC1(NCc2c(O)cccc2F)COC1 1976861331 UYUHQHPKIXVUEZ-UHFFFAOYSA-N 326.368 1.915 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985094839 UZRKACLAIWWIJK-NXEZZACHSA-N 329.357 1.369 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H](CC(=O)NCCN=[N+]=[N-])O1 1985103165 RDXRWDDDJJLNCA-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE C[C@H](N[C@@H](CO)CNC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985778190 XLOGUTYWZAJGGP-WDEREUQCSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1986368580 HFOPHHXEYPDBCD-MNOVXSKESA-N 327.385 1.563 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@H]2[C@@H](O)CO)c(Br)c1 2146333621 HLXQZBBCVVQLHF-IIMNLJJBSA-N 345.237 1.027 10 10 EDCE CON(CC(=O)NCCc1ccc(O)c(O)c1)C(=O)OC(C)(C)C 2010217416 KGJNOIGLVYOFKV-UHFFFAOYSA-N 340.376 1.555 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010405387 YYDFXDYANVZDQY-ZJUUUORDSA-N 340.384 1.056 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)N1CCC(N=[N+]=[N-])CC1 2010405652 KGSSNVLSKSJMFQ-NSHDSACASA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2018046098 QZRLADPADSZLBB-RYUDHWBXSA-N 341.412 1.954 10 10 EDCE CC(C)(C)OC(=O)NCc1n[nH]c(=NCc2ccc(F)cc2O)o1 2024902579 URJRZIRVMCYSOR-UHFFFAOYSA-N 338.339 1.973 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](NC(N)=O)C2)c(Br)c1 690740083 SHDAYQFTXUZUTD-PSASIEDQSA-N 328.210 1.749 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@@H](CO)C2)cc1Br 396814193 UERQJWLPKASNPL-GPCCPHFNSA-N 329.238 1.648 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCC[C@H](C(=O)N(C)C)C3)c2n1 2062317024 ASKJEZYWYOGCQQ-NWDGAFQWSA-N 345.403 1.120 10 10 EDCE Cn1c(Br)nnc1CNC(=O)CCc1ccc(N)cc1 2178009721 QGFOJSVFXGMODL-UHFFFAOYSA-N 338.209 1.409 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)cc1Br 2190452455 DWQRSCAAJRNHQH-PDRAWDMGSA-N 342.233 1.965 10 10 EDCE CCN(c1ccc(CN)c(Br)c1F)[C@H]1CCNC1=O 2114764067 KOQNHVXHEKKNJT-JTQLQIEISA-N 330.201 1.762 10 10 EDCE CC(C)(C)OC(=O)NCCOc1ccc(Nc2nnc(=N)[nH]n2)cc1 2219021007 LJGBUKPTQJUMNW-UHFFFAOYSA-N 347.379 1.326 10 10 EDCE OCc1ccc(N2C[C@@H]3CCO[C@]3(CO)C2)cc1Br 2231313536 KVMFOHYQEAZZHZ-FZMZJTMJSA-N 328.206 1.529 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2COC[C@@H]2O)c1O 2227749978 HYOQZNSUFLMTLG-KWQFWETISA-N 332.194 1.260 10 10 EDCE Cc1ccc(CNC(=O)[C@@]23CNC[C@@H]2C3)c(O)c1Br 2352623328 ASVTTZXUTIHSLQ-HZMBPMFUSA-N 325.206 1.689 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H](N)CCO)c(O)c1Br 2352651570 MRYFJLQEQOXNOE-SNVBAGLBSA-N 331.210 1.131 10 10 EDCE Cc1ccc(CN2C[C@H](CO)C[C@@H]2CO)c(O)c1Br 2352686198 JJRSKOZPJNRLHH-ZYHUDNBSSA-N 330.222 1.638 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)COc2ccc(N)cc2)CC1 310029281 DOZJHOKZJAVQKZ-UHFFFAOYSA-N 335.404 1.727 10 10 EDCE CCN(C)C[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 301637097 XABBPZOQVJWHPC-NSHDSACASA-N 334.376 1.704 10 10 EDCE CC[C@H]1Oc2ccc(N)nc2N(CCOc2ccc(N)cc2)C1=O 75259253 SQGZRGARWBAXJA-CYBMUJFWSA-N 328.372 1.829 10 10 EDCE COC(=O)c1cc2cc(/C=C3\SC(=S)N(N)C3=O)oc2n1C 38189793 GFFSHNGWPWMJKL-UITAMQMPSA-N 337.382 1.633 10 10 EDCE CC1(NC(=O)/C=C/c2ccc(N3CCOCC3)cc2)CCNCC1 193375835 OLCHNXBBKOPTRC-QPJJXVBHSA-N 329.444 1.795 10 10 EDCE COc1ccc(N2CCN(C(=O)CC(=O)NCC(C)C)CC2)cc1 244394866 YGWZXONLBRIVCX-UHFFFAOYSA-N 333.432 1.506 10 10 EDCE Cc1ccc(CNC(=O)CN[C@H]2CCOC2)c(O)c1Br 2380757214 PRVLGPMFIIDUQH-NSHDSACASA-N 343.221 1.458 10 10 EDCE O=S1(=O)CCN(Cc2cc3c(cc2O)OCO3)[C@@H]2CCC[C@@H]21 825200347 DEUCZCRSHDLZNW-ABAIWWIYSA-N 325.386 1.272 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3ccco3)C2)cc1 826594581 NIXJVXJOGHTZHZ-CYBMUJFWSA-N 343.383 1.300 10 10 EDCE C[C@H]1CCC[C@@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)O1 826707668 WWCPUUPZVYIFFW-BBRMVZONSA-N 333.432 1.443 10 10 EDCE CN1C[C@H](O)C[C@@]1(C)C(=O)NCc1cc(Br)ccc1O 908171459 YJTSELPVTVEHFF-RISCZKNCSA-N 343.221 1.226 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCC[C@H](CS(N)(=O)=O)C2)cc1 835029775 SFHWNXRZRJZJNZ-IMMZDGJCSA-N 337.489 1.766 10 10 EDCE CCc1cccc(CN2CCN(c3nccn(C)c3=O)CC2)c1O 848888068 LIHKUFKFGAKZFS-UHFFFAOYSA-N 328.416 1.371 10 10 EDCE CN=[S@](C)(=O)CCNC(=O)c1cc(C)n(-c2ccccn2)c1C 912797462 WWKKDFCCLXKUNW-HSZRJFAPSA-N 334.445 1.947 10 10 EDCE Cn1ccnc1[C@H]1C[C@H](NC(=O)NCc2c(O)cccc2F)CCO1 922797604 DIEZZMKAAICMNJ-IAQYHMDHSA-N 348.378 1.984 10 10 EDCE CO[C@]1(CO)CCCN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 854003266 GXTHXFJZOSSOJN-RDTXWAMCSA-N 335.448 1.997 10 10 EDCE COC(=O)CC1(CS(=O)(=O)N[C@@H](C)c2ccccc2O)CC1 867833985 JAVHBJOAURZQNV-NSHDSACASA-N 327.402 1.716 10 10 EDCE N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 870956897 OFRBHBHTJVDRLV-QMTMVMCOSA-N 329.444 1.391 10 10 EDCE CN(C(=O)c1cc2cc(O)c(O)cc2s1)[C@@H]1CCN2CCO[C@H]1C2 897870332 ODKLKWMSXXDRNT-RISCZKNCSA-N 348.424 1.858 10 10 EDCE COC(=O)[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)[C@@H](C)O 899265746 JPCADJDCUMZWTE-KDOFPFPSSA-N 344.411 1.675 10 10 EDCE COCCNC(=O)[C@@H](C)NCc1c(O)cccc1Br 706829107 JZAPEKKSRZFAFH-SECBINFHSA-N 331.210 1.395 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN(c3ncns3)CC2)cc1 1158868316 OIUXPMWUUOFGJU-UHFFFAOYSA-N 345.388 1.663 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@@H]1CSC(c2ccccc2O)=N1 1162278769 LSEPLTWQQIAWRN-ZDUSSCGKSA-N 344.392 1.982 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cc(OC)n(C)n2)cc1C 1317609380 XNDRSTSRQBADDY-UHFFFAOYSA-N 346.431 1.608 10 10 EDCE CCNCc1ccc(N2CC(=O)NC[C@@H]2C)c(Br)c1 2124757878 BGSGWZIGFIBWFS-JTQLQIEISA-N 326.238 1.883 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@H]1CC12CCS(=O)(=O)CC2 1333661774 XAGWGIPZHSAYDH-LLVKDONJSA-N 327.377 1.362 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)c(Br)c1 2132547630 MANIBLBTMMRITB-YABSGUDNSA-N 327.222 1.351 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](O)CNCC2CCCC2)cc1 1268335627 WJXXRUMNMYKDBB-HNNXBMFYSA-N 347.419 1.720 10 10 EDCE C[C@@H](CN(C)C(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C(F)F 1281017689 WBUOBWSFMKONBX-QMMMGPOBSA-N 341.318 1.691 10 10 EDCE C[C@H](CN(C)C(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C1CC1 1287646825 ODJIQDUCMMVHOM-SNVBAGLBSA-N 331.376 1.836 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1COc2ccc(O)cc2O1 1447561652 JPOLMDQYVNDMLC-BMLIUANNSA-N 345.351 1.691 10 10 EDCE CO[C@@H](C)CC(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1284209408 SEYHUFUSABRRCI-MNOVXSKESA-N 349.391 1.509 10 10 EDCE O=C(C[C@@H]1CCNC1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1525592979 DELGEKKMSIMXAZ-NSHDSACASA-N 348.358 1.927 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCNC(=O)CC2CC2)cc1 1703304042 WESGEJKDOYXYPX-UHFFFAOYSA-N 331.376 1.885 10 10 EDCE O=C(CSc1nnc2ccccn12)NCc1c(O)cccc1F 1471976328 WOSHCKBJFUHCBK-UHFFFAOYSA-N 332.360 1.983 10 10 EDCE CC(C)N(C)C(=O)C1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 1472488847 KRLOKRJJEVOUMZ-UHFFFAOYSA-N 338.379 1.956 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2COC(=O)N2)cc1C 1480761607 HVGOCJGMWUKROQ-OCCSQVGLSA-N 335.404 1.096 10 10 EDCE C[C@@H](O)CNCC1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1717394961 XCWJDWCPAPFFJV-CDWSIMAYSA-N 333.392 1.328 10 10 EDCE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1CC1(O)CC1 1554176238 IYMAHTNRWDMORP-OAHLLOKOSA-N 344.415 1.997 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cnns3)cc2)CC1 1634974012 FQZOJRNOVUKEBE-UHFFFAOYSA-N 345.428 1.170 10 10 EDCE C[C@H](O)CCCNC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1569041072 ZOMJPIANUVONNO-NEPJUHHUSA-N 335.408 1.718 10 10 EDCE C[C@@](O)(CO)[C@@H]1CCN(c2ccc(CN)c(Br)c2)C1 2138099264 AUIVHYNWEQGQLG-BXUZGUMPSA-N 329.238 1.477 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cccc(N2C(=O)CCC2=O)c1 1643101051 SYYADLCVJFKLJO-UHFFFAOYSA-N 340.335 1.681 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2ccnn2C)cc1C 1732406912 CWHMHABTCGIDNS-CQSZACIVSA-N 330.432 1.987 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCOc2ccccc2[C@H]1CO 1652536496 SEAQQAJTPGHIDQ-CQSZACIVSA-N 329.352 1.595 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CCC(=O)N1CCC(O)CC1 1585788824 XPOVAULUGORNOS-UHFFFAOYSA-N 347.459 1.441 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccccc1CN1CCNC1=O 1597873351 ZKFAVDJCKNFKSJ-UHFFFAOYSA-N 341.367 1.804 10 10 EDCE C[C@@H](CN(C)C[C@@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1669936410 OAMVRKZKEWUDGD-STQMWFEESA-N 347.419 1.936 10 10 EDCE O=C(CN1C(=O)/C(=C/c2ccccc2)SC1=S)NCCCO 16905419 LBIRFVNBNPLYKF-XFXZXTDPSA-N 336.438 1.386 10 10 EDCE CC(=O)N1[C@H](c2ccccc2O)SC[C@H]1C(=O)NCCN(C)C 27910595 ZTGKQJSKRCYCRF-BBRMVZONSA-N 337.445 1.033 10 10 EDCE CNCc1ccc(N(C)C[C@H](C)C(=O)NC)c(Br)c1 234405331 RBVJHEVWPKOUDA-JTQLQIEISA-N 328.254 1.987 10 10 EDCE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1CNCc1ccc(N)cc1 1944077220 CRVPKMQXEOVGDT-INIZCTEOSA-N 334.464 1.910 10 10 EDCE O=C(N[C@@H](CCc1cc(O)nc(O)c1)C(=O)O)OCc1ccccc1 1951868959 CEARGPTWTQBHRP-ZDUSSCGKSA-N 346.339 1.805 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(O)cc2O)[C@@H](O)C1 2005085520 PKHXCFHLRJKHLC-ZFWWWQNUSA-N 338.404 1.558 10 10 EDCE CC(C)(O)C1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2152282837 JKGORZLPXXVVCI-GFCCVEGCSA-N 340.221 1.608 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CCCOC1 2010393916 ZEJBEHYIEIDONB-ABAIWWIYSA-N 339.396 1.972 10 10 EDCE COc1ccc(O)c([C@H](C)N[C@@H](CO)CNC(=O)OC(C)(C)C)c1 2011424358 HRZMTXWGQUBANC-NWDGAFQWSA-N 340.420 1.937 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2cc(O)c(O)c(O)c2)CO1 2015126054 QINOPBBWMJOMIW-VIFPVBQESA-N 340.332 1.084 10 10 EDCE CCNCc1ccc(N(C)[C@@H]2COC[C@@H]2O)cc1Br 708088090 GWTIHJFGLADKLJ-KGLIPLIRSA-N 329.238 1.755 10 10 EDCE O=C(Nc1ccc(O)c(O)c1)[C@@H]1CCCN(C(=O)N2CCCC2)C1 2062331523 ODLOLRYNQSGJMK-GFCCVEGCSA-N 333.388 1.964 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C3COC3)CC2)cc1Br 2169592512 UFXGFEYTBUHNQL-LLVKDONJSA-N 340.265 1.990 10 10 EDCE CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)c1ccc(N)cc1 1910931280 FQWIRIWYQFWSCX-KBPBESRZSA-N 335.404 1.602 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2104424061 MELQUKUGBSFLIO-LMKUNIIRSA-N 327.222 1.399 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)NCc2ccc(N)cc2)=C[C@H]1O 2080947049 CQLWNBLASGSKTP-HUUCEWRRSA-N 347.415 1.469 10 10 EDCE COCC[S@](=O)CCNCc1cc(Br)ccc1O 2085938847 OZAJRHATUMLCBL-GOSISDBHSA-N 336.251 1.639 10 10 EDCE O=C1C[C@H]2CCN(Cc3ccc(Br)cc3O)C[C@@H]2N1 2088807153 YBVRPHPWOBEJID-SKDRFNHKSA-N 325.206 1.865 10 10 EDCE COCC1(O)CCN(c2ccc(CN)cc2Br)CC1 2095541422 TWILKJRPBSBSKL-UHFFFAOYSA-N 329.238 1.886 10 10 EDCE OC[C@@H]1NC[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@@H]21 2227308852 XOGOHXLMUCOHAY-WXHSDQCUSA-N 327.222 1.167 10 10 EDCE CC(C)(C)OC(=O)N[C@]12CO[C@](C(=O)NCc3ccccc3O)(C1)C2 2254761534 LFZZDFKGROTQOP-IYARVYRRSA-N 348.399 1.835 10 10 EDCE [N-]=[N+]=NC[C@@H]1CCCCN(S(=O)(=O)C2CC3(C2)OCCO3)C1 2277972141 GTYCFQZVHOOKNK-NSHDSACASA-N 330.410 1.634 10 10 EDCE CCCNCc1ccc(N2CC[C@H]2[C@H](O)CO)c(Br)c1 2286214835 PRIYPNXCYRGAKE-LSDHHAIUSA-N 343.265 1.881 10 10 EDCE CC(C)CN1CCO[C@@H](CNC(=O)C=Cc2ccc(O)c(O)c2)C1 2307987614 YOLPTDMIPMDKMK-HNNXBMFYSA-N 334.416 1.584 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@H]21 2314965712 VMXANXHPEARWGE-JOYOIKCWSA-N 332.219 1.384 10 10 EDCE CCNCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2354483727 RKJIWZVBRAZGGQ-HJPIBITLSA-N 341.249 1.489 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)c(F)c1Br 2357055341 UTEZVASQUAKTMP-ORMVGFHCSA-N 345.212 1.510 10 10 EDCE COC(=O)[C@@H]1C[C@@H](OC)CN1Cc1cccc(Br)c1O 125806925 ZEDNMIGLCRQCRM-PWSUYJOCSA-N 344.205 1.917 10 10 EDCE COC[C@@H](C)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 188122099 VASGEMCIVRCAPI-CQSZACIVSA-N 333.432 1.254 10 10 EDCE COc1ccc(CN2CCN([C@H](C)C(=O)N3CCCC3)CC2)c(O)c1 93843629 IZLDGMHJQQBASA-OAHLLOKOSA-N 347.459 1.529 10 10 EDCE CCNC(=O)N1CC[C@H](N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 90409780 DMZBNQUOQSJPPN-WBVHZDCISA-N 346.475 1.978 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(F)(F)C[C@H]2CO)c([N+](=O)[O-])c1 368717891 CNAKUSNPEOJXGQ-MZBZXASESA-N 342.298 1.987 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(CCC(=O)N(C)C)CC2)c1O 271802268 KXTANWULPHWYGD-UHFFFAOYSA-N 339.867 1.950 10 10 EDCE CC[C@H](C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(O)c(O)c1 272269113 CWHVBVKEKSSHQA-CMPLNLGQSA-N 338.429 1.662 10 10 EDCE COc1cc(Br)cc(CN2C[C@H]3COC[C@@H](C2)O3)c1O 802657240 WTUSHUDPLXASMD-TXEJJXNPSA-N 344.205 1.763 10 10 EDCE CCN1CC[C@H]2OCCN(Cc3cc(OC)c(OC)cc3O)[C@H]2C1 293665799 OGJPLGCKMCBSAI-GOEBONIOSA-N 336.432 1.704 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCOC4(CC4)C3)c(Br)cc21 2168295564 IIUYQNFQHZPNDG-GFCCVEGCSA-N 338.205 1.770 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)N3CC(C)(C(N)=O)C3)ccc21 565024011 NDARGEMCXDZTIU-UHFFFAOYSA-N 343.427 1.852 10 10 EDCE CN1CCCc2cc(/C=C3/SC(=S)N(CC(N)=O)C3=O)ccc21 727176273 OJSWCKKCFPMNFR-MDWZMJQESA-N 347.465 1.756 10 10 EDCE C[C@@H]1C(=O)N(C)CN1C(=O)NCc1ccc(N2CCSCC2)cc1 825727723 JFZGSAAYVKGEEG-CYBMUJFWSA-N 348.472 1.569 10 10 EDCE COc1cc(O)c(CN[C@@H]2CNCC3(CCOCC3)C2)cc1OC 903975329 ZXNXBWGCJYNKSO-AWEZNQCLSA-N 336.432 1.658 10 10 EDCE Cc1ccc(C(=O)NCC(=O)NCCc2ccc(N)cc2)cc1C 832652999 OGDSRJOPVPQLHN-UHFFFAOYSA-N 325.412 1.974 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)[C@H]3CCO[C@@H]3C)C2)cc1 849416334 PCYUKCQBRHLXQJ-WWGRRREGSA-N 340.445 1.371 10 10 EDCE O=C(O)CCCNC(=O)NCc1cc(Br)ccc1O 840992577 LXPKVWCEGRMCNU-UHFFFAOYSA-N 331.166 1.819 10 10 EDCE COc1cnc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)nc1 845924866 PKWOGQGFSCFYTH-NSHDSACASA-N 343.387 1.367 10 10 EDCE C[C@H]1CN([C@@H](C)CNC(=O)/C=C\c2ccc(O)c(O)c2)C[C@@H](C)O1 848295263 MDFSIYAKGZXLCS-QJUUANMTSA-N 334.416 1.725 10 10 EDCE C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)[C@@H](C)CN1CCO 841892358 XVZOBZYYENFCCB-QWRGUYRKSA-N 343.811 1.841 10 10 EDCE CC[C@H](OC)C(=O)NCc1cc(NC(=O)[C@@H](CC)OC)ccc1O 923124148 TWPRPHKIMUIUTF-LSDHHAIUSA-N 338.404 1.797 10 10 EDCE C[C@H](NC(=O)NCC12CC(CN1)C2)c1ccc(N2CCOCC2)cc1 851655764 WXJHLWQNUBTEAP-XVTSOASTSA-N 344.459 1.635 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3cscn3)nc12 852417906 OZOPTPKXNKAWDO-VIFPVBQESA-N 347.400 1.919 10 10 EDCE CN1CCN(c2ccc(CNC3CN(c4ccncn4)C3)cc2)CC1 865749824 XOIASDSNVJOPFC-UHFFFAOYSA-N 338.459 1.207 10 10 EDCE CC/C=C(\F)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 864937460 FYOMXIOOTPZRLU-CQPUUCJISA-N 340.420 1.801 10 10 EDCE CCNCc1cccc(NC(=O)C(=O)N2Cc3cccc(O)c3C2)c1 868299878 OTKFMZNUPHBPOZ-UHFFFAOYSA-N 339.395 1.983 10 10 EDCE C[C@@H](NC(=O)N[C@H](C)C1(S(C)(=O)=O)CC1)c1ccccc1O 868601294 MQVRHPGVQQYOQJ-GHMZBOCLSA-N 326.418 1.718 10 10 EDCE O=C(O)[C@H]1CO[C@@H](CNCc2ccc(Br)cc2O)C1 714014638 KIJHXHHBYSJLPE-MWLCHTKSSA-N 330.178 1.734 10 10 EDCE CC(C)(C)C(=O)Nc1nccnc1C(=O)NCc1ccc(O)cc1O 1162278931 NWSTUPVQIPISCO-UHFFFAOYSA-N 344.371 1.802 10 10 EDCE C[C@H](C(=O)NCc1ccc(O)cc1O)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 1162271652 MJNRWGMRMGWBCC-LERXQTSPSA-N 346.383 1.278 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@]3(C2)CC3(F)F)cc1 1326614955 AGOUWMWSQKTSQR-INIZCTEOSA-N 337.370 1.627 10 10 EDCE CC(C)(C)[C@]1(CN)CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1335718652 QDTVBMYKIDINOG-IBGZPJMESA-N 345.443 1.458 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)CCn3cncn3)C2)cc1C 1265528757 DZUPGBAFRFZWBD-IYBDPMFKSA-N 343.431 1.422 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C 1900607641 OUFCBJDWVASMPA-LLVKDONJSA-N 327.385 1.781 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)CCC(C)C)C2)cc(OC)n1 1525267688 NOTMYBYMRHUUTA-OKILXGFUSA-N 349.431 1.912 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CC[C@H](C(F)(F)F)NC1=O 1471661624 VQMVWSRDEQNSAY-GXSJLCMTSA-N 332.278 1.171 10 10 EDCE CN(C)[C@@H]1COC[C@H]1CNCc1ccc(Br)cc1O 1924718929 NYYNICPWFJHJAF-DGCLKSJQSA-N 329.238 1.821 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@H](CO)NC(=O)c1ccc(F)cc1 1629955199 WXSIRJPFSXXDSL-HNNXBMFYSA-N 346.358 1.281 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CCc2cn[nH]c2)cc1C 1498133168 MXBFCNDEWKAFEO-AWEZNQCLSA-N 330.432 1.954 10 10 EDCE C[C@H](O)CNC[C@@](C)(NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1714177571 JVIGUBZFQOVWGA-APPDUMDISA-N 347.419 1.718 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2CCS(=O)(=O)CC2)cc1 1556090868 OOSAIMWOUBUYQI-UHFFFAOYSA-N 338.389 1.404 10 10 EDCE O=C(CCCNC(=O)c1cccnc1)NCc1cc(O)ccc1O 1633595281 PWYGZBUNBBVWOC-UHFFFAOYSA-N 329.356 1.319 10 10 EDCE CC(C)CN1CC[C@@](O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1733492937 PBTBLCKMCYHQIO-QGZVFWFLSA-N 347.419 1.672 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)Cn2ccnc2C)cc1C 1669475054 ZWXUMPIXCZWKOV-CQSZACIVSA-N 330.432 1.803 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cccc(=O)n2C)cc1C 1669395744 OTQVOGYKHJZVRX-CQSZACIVSA-N 343.427 1.610 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1cncn1C 1662429070 BNHKEAQNLDECMF-LLVKDONJSA-N 343.391 1.491 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@H](C)[C@H](C)CO)CC2)cc1 154529567 AAWCZIKRCIIPON-ZIAGYGMSSA-N 335.448 1.980 10 10 EDCE Cc1nnnn1-c1ccc(F)c(NC(=O)Cc2ccc(N)cc2)c1 154954388 VHLWHSFLZKVCQI-UHFFFAOYSA-N 326.335 1.873 10 10 EDCE COCCNCc1ccc(N2CCNC(=O)C2)c(Br)c1 234684537 RKIDDWIGSZKKSA-UHFFFAOYSA-N 342.237 1.121 10 10 EDCE NC(=O)CN(Cc1ccccc1)c1cc2c(cc1F)[C@H](O)C(=O)N2 1946830907 IPBZATABMDDEHE-INIZCTEOSA-N 329.331 1.303 10 10 EDCE CCN[C@H](c1ccccc1O)[C@@H](O)c1c(Br)nnn1C 2148153763 PUDRIDJYJNMYKR-ZYHUDNBSSA-N 341.209 1.667 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCCN=[N+]=[N-] 1985094785 UIINXHFQHKMYCX-NSHDSACASA-N 328.417 1.648 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CC(=O)N2CC(N=[N+]=[N-])C2)C1 1985100859 JZEJRFPMVFVRQB-KOLCDFICSA-N 325.369 1.125 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC[C@H](CN=[N+]=[N-])C1)C1COC1 2010402196 NIIONGRBZROCHG-ZYHUDNBSSA-N 339.396 1.685 10 10 EDCE O=C1CCC(=O)N1CCNCc1ccc(Br)cc1O 701014880 LKAOMEKUMYCQSK-UHFFFAOYSA-N 327.178 1.393 10 10 EDCE CCn1nc(Br)c(CNCCc2ccc(O)c(O)c2)n1 2167734718 NGSZHVALNVAZNB-UHFFFAOYSA-N 341.209 1.804 10 10 EDCE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(C(=O)Cc2ccc(N)cc2)C1 2044641643 MXSQNQRNCBFMIR-MFKMUULPSA-N 343.349 1.727 10 10 EDCE CO[C@H]1CN(Cc2cc(Cl)cc(Br)c2O)C[C@@H]1N 2058768544 QSJHZMACSVWYKT-QWRGUYRKSA-N 335.629 1.966 10 10 EDCE O=S1(=O)CC[C@H]2CN(Cc3c(O)cccc3Br)C[C@@H]21 2088814288 GXUISGYAQLFGEL-ZANVPECISA-N 346.246 1.774 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(NC(=O)c2ccc(O)c(O)c2)C1 2216764441 SFWPYCNVAVIUDI-APPDUMDISA-N 334.372 1.837 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2236633838 RYPBLUFJXYXNCF-SDDRHHMPSA-N 343.265 1.896 10 10 EDCE CN(Nc1nc(Cl)c(C(N)=S)s1)S(=O)(=O)C1CCC1 2339719065 KTJSZJNALTZIIW-UHFFFAOYSA-N 340.883 1.572 10 10 EDCE CN(C)C(=O)CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 174676214 LIDKNIRKZJSDDL-QGZVFWFLSA-N 347.459 1.739 10 10 EDCE O=C(NCCN1C(=O)CSC1=S)c1cccc([N+](=O)[O-])c1 49756771 GMOQGGVMHGIJJL-UHFFFAOYSA-N 325.371 1.185 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N(CCO)Cc3ccccc3)cc2N1 384084763 XVQXYMRKIVFUOK-UHFFFAOYSA-N 343.339 1.925 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCO[C@H]([C@H]2CCCO2)C1 247240027 WSZKGECLNPNHJQ-MOPGFXCFSA-N 332.444 1.903 10 10 EDCE Cc1cc2c(cc1C)N(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)CC2 285748578 QDXLDFKLKCDYQW-AATRIKPKSA-N 339.395 1.303 10 10 EDCE CN1CCC(CO)(NCc2cc(Br)cc(F)c2O)CC1 2380619268 NIWAPIJRDCCASA-UHFFFAOYSA-N 347.228 1.840 10 10 EDCE Cc1ccc(CN=c2cc[nH]c(C(N)=O)n2)c(O)c1Br 2380753157 CSHZJYFGSYHBDX-UHFFFAOYSA-N 337.177 1.386 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3COC[C@@H](C2)C3O)c(Br)c1 2167780717 ZMZUDKQGPMEGAS-KSAAVIKPSA-N 342.233 1.946 10 10 EDCE C[C@@H](C[S@](C)=O)NC(=O)NCc1cc(Br)ccc1O 805280073 YINNLDHYUAUWSL-RLBGWGEZSA-N 349.250 1.721 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(NC(=O)c2cnoc2C)cc1O 808520020 IWYVBHVURKZVSS-UHFFFAOYSA-N 346.295 1.256 10 10 EDCE COc1ccc(N2CCCN(C(=O)C34CCN(CC3)C4)CC2)cc1 900294765 LPSBGUSQUFSWDQ-UHFFFAOYSA-N 329.444 1.830 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)CS(=O)(=O)NC(C)(C)C)c1 731810520 MWLHGKWAAQXJPD-JTQLQIEISA-N 344.433 1.296 10 10 EDCE COc1ccc(N2CC[C@@H](CNS(=O)(=O)CC3(F)CC3)C2)cc1 916482380 FTYIPKNIUUAVHX-ZDUSSCGKSA-N 342.436 1.943 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CCN(C4CC4)C(=O)C3)ccc21 748623612 KEGSHAYYQWCART-UHFFFAOYSA-N 342.443 1.585 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@H]3CC[C@@H]3C(=O)O)CC2)cc1 911335364 ZORKMODVYSXAJV-CVEARBPZSA-N 332.400 1.891 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NC2CCC(C(N)=O)CC2)c1 747585372 ZHQTVUMGRLELEA-VOMCLLRMSA-N 335.404 1.805 10 10 EDCE COC(=O)[C@@H]1C[C@H]1[C@H]1NC(=O)N([C@H](C)c2ccc(N(C)C)cc2)C1=O 924717267 LYUNOELNXFADIW-JUDXGUMMSA-N 345.399 1.543 10 10 EDCE CN1CCN(c2ccc(CNC(=O)NCC3CSC3)cc2)CC1 923836865 WBPYKCCDOOGGCE-UHFFFAOYSA-N 334.489 1.601 10 10 EDCE CN1C[C@H](N(C)c2ccc(CN)c(Br)c2)CCC1=O 2131953418 USSBGJIXGVTCKD-GFCCVEGCSA-N 326.238 1.965 10 10 EDCE O=C(O)[C@]12COC[C@H]1CN(Cc1cccc(Br)c1O)C2 854241292 LZXSPPVUSINSHN-QMTHXVAHSA-N 342.189 1.688 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4COC[C@@]4(C)C3)nc12 852534406 LVKSRASHFJAXJA-PIGZYNQJSA-N 346.387 1.080 10 10 EDCE COc1ccc(N2CC[C@@H](CN3C(=O)N[C@@H](CSC)C3=O)C2)cc1 924951080 QSWZBFSTAWWHAJ-DOMZBBRYSA-N 349.456 1.805 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3=CCOCC3)C2)cc1 852365407 VZFHTCLRXRMVPV-HNNXBMFYSA-N 331.416 1.920 10 10 EDCE CC(C)(C)[C@@H](NS(C)(=O)=O)C(=O)N1Cc2cccc(O)c2C1 871203053 LENCHCVFNXTOOA-ZDUSSCGKSA-N 326.418 1.198 10 10 EDCE COCCN(Cc1ccnn1C)C(=O)/C=C/c1ccc(O)c(O)c1 787860392 XFNNQBREVJNHLR-GQCTYLIASA-N 331.372 1.520 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@@]2(CCOC2)C1 897415642 DFTUXJPKXNIHDA-INIZCTEOSA-N 335.381 1.944 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CN3[C@@H](C)C[C@H]3C)CC2)cc1 791567313 JJPWVWLWELRDGQ-SOLBZPMBSA-N 333.476 1.661 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@@H]2CCNC2=O)cc1C 1317594614 RZOANTLRWKGPHQ-HNNXBMFYSA-N 333.432 1.078 10 10 EDCE O=C(C(=O)N1CC[C@@H](c2ccccn2)C1)N1Cc2cccc(O)c2C1 1330396461 LLCZYTPNFGFDHW-CQSZACIVSA-N 337.379 1.646 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)C3CC(O)C3)c(Br)cc21 1914590474 MRLLORVMIMBFIF-ROKYYSGWSA-N 340.221 1.621 10 10 EDCE CC1(C)OC[C@H](NCc2cc(Br)cc(F)c2O)[C@H]1O 1910984825 HUUROUPAIREGOF-CMPLNLGQSA-N 334.185 1.922 10 10 EDCE CCOCC(=O)N[C@@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1287646530 MAMMFRKEHHOAPL-NSHDSACASA-N 349.391 1.462 10 10 EDCE CO[C@H](C)C(=O)NCCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1293979944 XHQXXVMXZVZGMJ-LLVKDONJSA-N 349.391 1.462 10 10 EDCE C[C@](CO)(Cn1cnc2ccccc21)NC(=O)c1cc(O)cs1 1607270291 DMBCDZMPXRTEKM-MRXNPFEDSA-N 331.397 1.984 10 10 EDCE CC[C@H](CNC(=O)c1ccon1)NC(=O)c1cc(OC)nc(OC)c1 1704629306 VLMJIAQZGOTHNO-LLVKDONJSA-N 348.359 1.025 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cccnc1OCCO 1634387464 RDUIAIHPUSKNPZ-UHFFFAOYSA-N 343.383 1.558 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@]1(CO)C[C@@H]1c1ccccc1 1569883065 SKWSXMIYWOCEHB-BEFAXECRSA-N 327.380 1.923 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(c2cc(F)ncn2)CC1 1636070055 QZLTWLSYAOMVSM-RQOWECAXSA-N 344.346 1.389 10 10 EDCE COc1cc(C(=O)N[C@H](C)C[C@@H](C)NC(=O)C(C)C)cc(OC)n1 1735553875 CEXJDBKLHHULGT-VXGBXAGGSA-N 337.420 1.768 10 10 EDCE COc1cc(C(=O)NCc2cc(O)ccc2O)c([N+](=O)[O-])cc1OC 1644752521 JCOXRBSZTXCUHJ-UHFFFAOYSA-N 348.311 1.953 10 10 EDCE COC(=O)NCC(=O)NCC1CC(NCc2ccc(OC)c(C)c2)C1 1750976842 XLSBWEFEVIBHPB-UHFFFAOYSA-N 349.431 1.344 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H](C)n2cncn2)cc1C 1662909715 WXPCMDJMGPKTGY-CABCVRRESA-N 345.447 1.841 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@H](O)COc1cccc(F)c1 1595313230 GVHIBPWURFJHGY-ZDUSSCGKSA-N 335.331 1.336 10 10 EDCE CC1=NN(c2ccc(F)cc2)C(=O)/C1=C(\C)NCCN1CCOCC1 13519833 WFAJHNNBLZNPMC-GHRIWEEISA-N 346.406 1.744 10 10 EDCE CCC[C@H](N)C(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 1866017627 JXFMCQTZPHKLAK-JKSUJKDBSA-N 329.448 1.819 10 10 EDCE C[C@@H]1CN(Cc2cccc(Br)c2O)CCS1(=O)=O 127936377 FLFDQCJZESEETG-SECBINFHSA-N 334.235 1.774 10 10 EDCE CCOc1cccc(CNCC(=O)N2CCC(C(=O)O)CC2)c1O 1857867070 REOZOLMMNWDQSH-UHFFFAOYSA-N 336.388 1.204 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NC(=O)c1ccc(O)c(O)c1 2006283277 GJJTYLGBTKRTFD-MNOVXSKESA-N 338.360 1.120 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CNCc1ccc(F)c(F)c1O 1985777474 MXIVXFUPLHMUIU-JTQLQIEISA-N 332.347 1.646 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)[C@@H](CCO)C2)cc1Br 2149910914 BLJZTYRNVPJWGO-STQMWFEESA-N 343.265 1.596 10 10 EDCE O=C1Nc2cc(N3C[C@H]4CO[C@@H](C4)C3)c(Br)cc2[C@@H]1O 2152270651 VCVVTFGZRCCRAA-UPFKWVMWSA-N 339.189 1.660 10 10 EDCE CNCc1ccc(N2C[C@@H]3OCCN(C)[C@@H]3C2)cc1Br 2153999095 YRQYAUJFUQEWFW-CABCVRRESA-N 340.265 1.688 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2[C@H](C(=O)N3CC[C@H](N=[N+]=[N-])C3)[C@H]21 2010393161 OPNBLCXMFQENNR-IRCOFANPSA-N 337.380 1.532 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NCc2ccc(O)cc2O)C1 2011918949 XAELTXNDPAEZRN-KBPBESRZSA-N 338.404 1.558 10 10 EDCE CON(CCNC(=O)c1cc(O)c(O)c(O)c1)C(=O)OC(C)(C)C 2015126382 UPVPVHPVLRYLHB-UHFFFAOYSA-N 342.348 1.332 10 10 EDCE CCn1nnc(Br)c1[C@@H](NN)c1ccc(N(C)C)cc1 2156437993 MFUSLLOEKJPLCE-NSHDSACASA-N 339.241 1.679 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1cc2c(cc1F)[C@@H](O)C(=O)N2 2034790986 YBLMLYPXZPADKT-QGZVFWFLSA-N 343.358 1.564 10 10 EDCE O=S1(=O)C[C@@H]2C(NCc3c(O)cccc3Br)[C@H]2C1 2054275833 PGJMBELZYXBIPH-IUCAKERBSA-N 332.219 1.287 10 10 EDCE CC(C)(C)OC(=O)N(CCOc1nnc(=N)[nH]n1)Cc1ccccc1 2208940585 SYQIPYXDWOFIQJ-UHFFFAOYSA-N 346.391 1.495 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3COC[C@@]3(CO)C2)c(Br)c1 2234565795 ILQNWDVJPSZQPC-HCKVZZMMSA-N 342.233 1.948 10 10 EDCE Cc1ccccc1N1C(=O)C(=CNCCCN(C)C)C(=O)NC1=S 2296925451 FXPJSRYSXKFFGA-UHFFFAOYSA-N 346.456 1.168 10 10 EDCE Cc1ccc(CNC(=O)N2CCC(=O)C2)c(O)c1Br 2352946165 GVKKDIUXJDVGNS-UHFFFAOYSA-N 327.178 1.948 10 10 EDCE COC[C@@H](C(=O)O)N(C)Cc1ccc(C)c(Br)c1O 2352946615 BQLDEBUBWBCDAR-JTQLQIEISA-N 332.194 1.995 10 10 EDCE O=S1(=O)CCN[C@@H](c2cc(Cl)cc(Br)c2O)C1 1952594539 GBRRVILTSKFVTO-SECBINFHSA-N 340.626 1.867 10 10 EDCE CN1O[C@@H]2C(=O)N(Cc3ccccc3)C(=O)[C@@H]2[C@H]1c1ccccc1O 102544790 ILRDIUAKHZMGGH-ZACQAIPSSA-N 338.363 1.864 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)CC(=O)NC2CC2)c([N+](=O)[O-])c1 29072773 RWWYRVQSLOQCPE-XBXARRHUSA-N 333.344 1.496 10 10 EDCE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@H]1c1ccc(N)cc1O 1953065074 XRQYBQZFSUFJTD-LBPRGKRZSA-N 342.417 1.681 10 10 EDCE NS(=O)(=O)c1ccccc1N1CCN(Cc2ccccc2O)CC1 191170918 HLJOVQSYMFEVEA-UHFFFAOYSA-N 347.440 1.362 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)C1CN(CC(F)F)C1 346368125 AKKQKIYABCTNRR-UHFFFAOYSA-N 325.359 1.675 10 10 EDCE CN(C)C(=O)CCN1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 271201522 XLKGBMBGBIWMRQ-UHFFFAOYSA-N 336.455 1.488 10 10 EDCE COc1cc(N2CCN(C[C@H](O)C(C)C)CC2)cc(OC)c1OC 293036855 WUUWSPMQONDUKI-HNNXBMFYSA-N 338.448 1.851 10 10 EDCE CN(C)c1ccc(CNC(=O)N(C)[C@H]2CCN3CCO[C@H]2C3)cc1 296471385 WBSJEHAPCOFXSH-IRXDYDNUSA-N 332.448 1.367 10 10 EDCE O=C(NCCn1cccn1)NCc1cc(Br)ccc1O 805181975 AFWPQKJYEZGNRZ-UHFFFAOYSA-N 339.193 1.851 10 10 EDCE COc1cccc(CNC(=O)[C@@]23[C@@H]4[C@H]5C(=O)[C@H]2[C@@H]2[C@@H]5C[C@@H]4[C@@H]23)c1O 800518896 JOGATLLCNPBQPL-XKMARCHLSA-N 325.364 1.344 10 10 EDCE CN(C)c1ccc(CNC(=O)c2c3n(c(=O)n2C)CCCC3)cc1F 822862627 JGJUWUVMXDXBLD-UHFFFAOYSA-N 346.406 1.658 10 10 EDCE COc1ccc(O)c(CNCCS(=O)(=O)CC(F)(F)F)c1 827047926 KKOIWHIRWHBSAO-UHFFFAOYSA-N 327.324 1.468 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1C[C@H]2CC[C@H]1[C@@H]1CNC[C@@H]21 903962851 LLZRAECVRPCADG-MDNKFWRPSA-N 327.472 1.953 10 10 EDCE C[C@H](CO)C1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 845707935 SIEIBFZOUJCION-SNVBAGLBSA-N 335.360 1.771 10 10 EDCE NCC(F)(F)CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 846678312 XZVKVVGXNOWAMO-CYBMUJFWSA-N 328.359 1.884 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)CN3CC[C@@H](C)C3)C2)cc1 848229075 GNHXTOMXXJFUQX-HZPDHXFCSA-N 331.460 1.980 10 10 EDCE COC[C@H](CCCN)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 925777663 QAJXLJNORCWDFZ-KRWDZBQOSA-N 348.491 1.232 10 10 EDCE C[C@@H](NC[C@@H](O)CS(C)(=O)=O)c1ccc(Cl)c(Cl)c1O 927024466 KZAWBGDVPDNUGD-HTQZYQBOSA-N 342.244 1.755 10 10 EDCE CO[C@H](CNC(=O)NCc1cc(Cl)ccc1O)[C@H]1CCOC1 852436282 HAERTPUAWXAKHD-IINYFYTJSA-N 328.796 1.896 10 10 EDCE CCN(C)c1ccc(CN2C[C@@H]3[C@H](C2)[C@@H](OC)CS3(=O)=O)cc1 852592774 BTULQJURAFBRNQ-IXDOHACOSA-N 338.473 1.387 10 10 EDCE COc1cccc(O)c1CNC[C@@H]1CN(Cc2ccncc2)CCO1 858306682 OUFBUFQEUVPJKY-MRXNPFEDSA-N 343.427 1.786 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCn4ccnc4C3)C2)cc1 855223858 IOQRAZJPTCKOFU-HUUCEWRRSA-N 340.427 1.849 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCSC[C@@H]2CO)c([N+](=O)[O-])c1 765639651 AVZGOPOMIRYZPW-FHMRSRPSSA-N 338.385 1.695 10 10 EDCE Cc1ccn(C[C@@](C)(O)C(=O)N2Cc3cccc(O)c3C2)c(=O)c1 871204438 JGUJREQRLKFVAE-GOSISDBHSA-N 328.368 1.156 10 10 EDCE COC[C@](C)(CO)NCc1cc(Br)cc(OC)c1O 777483600 WGEOGHYEKAUFQS-ZDUSSCGKSA-N 334.210 1.650 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CN[C@@H]3C[C@H]4CC[C@H]3O4)cc2)C1 1119688897 DJJJNJMWROEDLD-DZOHQFGASA-N 329.444 1.798 10 10 EDCE C[C@@H](NC(=O)N1CCN2CCOC[C@@H]2C1)c1ccc(N(C)C)cc1 776244161 FKWVWIBSJWYOPS-PBHICJAKSA-N 332.448 1.540 10 10 EDCE COc1cccc(CNC(=O)c2cnn3c(OC)cccc23)c1O 1137473531 MGHWFLLSEGVJGP-UHFFFAOYSA-N 327.340 1.987 10 10 EDCE CN1CCO[C@@H](CNCc2cc(Br)cc(F)c2O)C1 715803208 GONVNVMLUQOLGA-NSHDSACASA-N 333.201 1.714 10 10 EDCE C[C@H](NC(=O)[C@H](C)n1cnc2c(N)ncnc21)c1ccccc1O 1151899277 BMUUWCWEWACJJT-UWVGGRQHSA-N 326.360 1.553 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)C1COC1 1900612345 HFUCJJDYMWWAER-LLVKDONJSA-N 327.385 1.685 10 10 EDCE N[C@H]1CCCC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1346103536 IWMHRYAYKPZAIC-RDJZCZTQSA-N 349.450 1.921 10 10 EDCE [N-]=[N+]=N[C@@H]1CCCN(C[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1 1912190523 FFWBMHGZYZFAQK-VXGBXAGGSA-N 329.360 1.418 10 10 EDCE O=C1Nc2cc(N3CC[C@@]34CCOC4)c(Br)cc2[C@@H]1O 1915351189 SAGXAYPLHWBRJF-JSGCOSHPSA-N 339.189 1.804 10 10 EDCE O=C(O)[C@@H]1C[C@H](O)CCN1Cc1c(O)cccc1Br 2136386163 GUVCFYCHZYQVKF-KCJUWKMLSA-N 330.178 1.565 10 10 EDCE COc1ccc(CNCC2CC(NC(=O)C3(C(N)=O)CC3)C2)cc1C 1700378576 PTVCBXANIIAEPU-UHFFFAOYSA-N 345.443 1.254 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC(N3CCOCC3)CC2)cc1 1470625328 AXUFQCYLIXIJDK-UHFFFAOYSA-N 345.403 1.786 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2CCNC2=O)cc1C 1715356777 QZBUBHGRDSMPJZ-DZGCQCFKSA-N 333.432 1.076 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2nn(C)cc2C)cc1C 1716436650 DTFKHZFKPLEVCO-AWEZNQCLSA-N 330.432 1.954 10 10 EDCE COc1ccc(CNC(=O)c2ccc3c(c2)nc(CO)n3C)c(O)c1 1556354320 FOIXXXVPPUVQMV-UHFFFAOYSA-N 341.367 1.710 10 10 EDCE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1(O)COC1 1629055949 WLJUVIFBQGSDQY-LLVKDONJSA-N 342.342 1.134 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@H](c2nn[nH]n2)C1 1632775342 KMCQYHROUIUTIR-JTQLQIEISA-N 347.356 1.039 10 10 EDCE O=C(NCc1cccc(O)c1O)c1coc(Sc2ncccn2)n1 1633515536 FJXDXOQBLJUTRL-UHFFFAOYSA-N 344.352 1.957 10 10 EDCE C[C@H](NC(=O)c1ccc(S(C)(=O)=O)cc1N)c1ccccc1O 1643745439 OSDKSCGUCOVNTN-JTQLQIEISA-N 334.397 1.869 10 10 EDCE CCOC(=O)[C@H](F)[C@@H]1CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1643842684 AJPOEDWOTSXQBZ-IAQYHMDHSA-N 325.336 1.390 10 10 EDCE COC(=O)C1(NCc2cc(F)cc(C(C)=O)c2O)CCOCC1 1653613069 SCLNYBCNOOOAGX-UHFFFAOYSA-N 325.336 1.546 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)Cc2ccn(C)n2)cc1C 1662219932 RHLZQFLNRJCXJO-AWEZNQCLSA-N 330.432 1.574 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)c2nccnc2N)cc1C 1690836028 SAKLPUYGQUQPQE-CYBMUJFWSA-N 343.431 1.674 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(C2CCC2)nn1C 155500924 BKEREKWMHRFURN-UHFFFAOYSA-N 342.399 1.990 10 10 EDCE O=C(O)[C@@H]1C[C@H](O)CN1Cc1cc(Br)cc(F)c1O 1963597604 ZOEAPSTTXULBJW-WPRPVWTQSA-N 334.141 1.314 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](OCC(N)=O)C2)c(Br)c1 2145370955 JNYOIOPDXRJZBI-MWLCHTKSSA-N 343.221 1.583 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N3CC[C@H]3CO)c(Br)cc21 2148968975 HLOMOVNXPUKPLV-SDBXPKJASA-N 340.221 1.623 10 10 EDCE NCc1cc(F)c(N2[C@H](CO)C[C@H]3OCC[C@@H]32)cc1Br 2146706375 ZQGPIAXELRMYNU-DUFXMDAXSA-N 345.212 1.775 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4[C@@H](CO)[C@@H]4C3)c(Br)cc21 2146877405 QGDQTQZLUVAAEI-MRCNFZFLSA-N 338.205 1.076 10 10 EDCE CN(C(=O)C1(CO)CN(C(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2022873611 UKMKJOPOPRPKNP-UHFFFAOYSA-N 335.404 1.461 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@](O)(CO)C2)cc1Br 314018324 RFFUFCRZCIAQSU-QMTHXVAHSA-N 329.238 1.792 10 10 EDCE CNCc1ccc(N2CC[C@@H](NC(N)=O)C2)c(Br)c1 700655435 VKCKJIWTUHPJLP-SNVBAGLBSA-N 327.226 1.416 10 10 EDCE CN1C(=O)C(=C2SC(=S)N(CCC(=O)O)C2=O)c2ccccc21 2053466618 TYQDZFOBJOYSFA-UHFFFAOYSA-N 348.405 1.709 10 10 EDCE C[C@H](NCc1cc(Br)ccc1O)[C@@H]1CN(C)CCN1C 2065093762 UJFKPSOHSJSAJB-FZMZJTMJSA-N 342.281 1.879 10 10 EDCE CCN(Cc1ccc(Br)cc1O)[C@H]1CC(=O)NC1=O 2114731495 DOMRNPDHDXVNSE-JTQLQIEISA-N 327.178 1.392 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)C[C@H](CO)C2)c(Br)c1 2236633507 AOQWGOAINJUKTC-SRVKXCTJSA-N 344.249 1.930 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cccc(CN)c2)s1 2284509115 UPDFBYADQACAFA-UHFFFAOYSA-N 329.472 1.802 10 10 EDCE CN1C(=O)NC(=O)C(=Cc2ccc(O)c(Br)c2)C1=O 2297329234 XTZDEPZCHPWGNQ-UHFFFAOYSA-N 325.118 1.246 10 10 EDCE Cc1cccc(N(CCC(N)=O)C(=O)C=Cc2cnn(C)c2C)c1 2304163079 WUPFFVBDOXGYQG-UHFFFAOYSA-N 326.400 1.959 10 10 EDCE C[C@]1(O)CCN(c2ccc(CN)c(Br)c2F)C[C@H]1O 1893299670 HHLJMNJATVTZHB-MFKMUULPSA-N 333.201 1.369 10 10 EDCE CCCC(=O)NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 57371695 UEGJNIYUFPLRMD-UHFFFAOYSA-N 337.395 1.195 10 10 EDCE CN1CCO[C@@H]2CN(c3ccc(CN)c(Br)c3F)C[C@@H]21 2153987970 BDVMRQCNEHAQBZ-NWDGAFQWSA-N 344.228 1.566 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(C(N)=O)cn1C 128505518 QGYICWVMTTVISN-UHFFFAOYSA-N 328.416 1.852 10 10 EDCE C[C@H](Nc1cnn(CC(=O)NCCO)c1)c1cc(Cl)ccc1O 186508017 FOOBTCLPBNBXNM-JTQLQIEISA-N 338.795 1.524 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1 247582043 LYQHJVPCQLOFCV-BRWVUGGUSA-N 331.416 1.847 10 10 EDCE CN1CCC[C@H]1CNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 264888482 JJGAGVSHJCBYJV-YOCVDRLZSA-N 329.444 1.747 10 10 EDCE Cc1cc(C(=O)N2CC[C@H](NC(N)=O)C2)c(C)n1-c1ccccn1 270583022 CWZHGRKHPHIMAO-ZDUSSCGKSA-N 327.388 1.372 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2OCC[C@@H]2CN)c(O)c1Br 2381140893 RFJDMURMYGWLBO-RNCFNFMXSA-N 343.221 1.443 10 10 EDCE COCC[C@H](COC)NC(=O)N[C@H](C)c1cc(OC)ccc1O 811956212 NEGIITMPOKUACS-VXGBXAGGSA-N 326.393 1.813 10 10 EDCE CN(CCC(=O)N(CC(=O)O)Cc1ccccc1O)c1ccncc1 911489962 VZGYBVUTCCBAGQ-UHFFFAOYSA-N 343.383 1.727 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CCC(CN)CC3)CC2)cc1 844217043 ACYLAXDTDIFVMY-UHFFFAOYSA-N 346.475 1.015 10 10 EDCE COc1cc(O)c(CNC[C@@H](C)N2C[C@H](C)O[C@H](C)C2)cc1OC 848924038 VGOUBTIAYUFVLJ-MCIONIFRSA-N 338.448 1.997 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCCNCC3)C2)cc1 851663774 IPFAHHOTUMGCSN-GJZGRUSLSA-N 332.448 1.715 10 10 EDCE CCC(=O)N1CC[C@@H](C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 855234030 QVHXZUMWHQDOLK-HUUCEWRRSA-N 345.443 1.649 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3C=C[C@H](CO)C3)C2)cc1 852193520 QJWNZPCONBCNFK-ZNMIVQPWSA-N 331.416 1.510 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)C1(NC2CC2)CCC1 852859060 NKKPBUMXMWPZNO-UHFFFAOYSA-N 329.444 1.814 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCOCC(F)F)C2)cc1 852275634 ZHAHCRHMZXUTPC-GFCCVEGCSA-N 343.374 1.855 10 10 EDCE Oc1n[nH]c([C@@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)n1 930498852 RADZKTJPZLBFIP-OAHLLOKOSA-N 343.431 1.727 10 10 EDCE C[C@@H]1NCC[C@H]1NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 861699295 PZFHQPJILCBXHK-CWRNSKLLSA-N 333.432 1.833 10 10 EDCE COC(=O)[C@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C1CC1 781588866 ARZCDIJPLLPVLT-DOTOQJQBSA-N 345.443 1.430 10 10 EDCE COc1ccc(O)c(CNC2(CNC(=O)OC(C)(C)C)COC2)c1 705659944 PYCPWNUASNCNGJ-UHFFFAOYSA-N 338.404 1.784 10 10 EDCE COc1nsc([C@H](NCCN=[N+]=[N-])C(N)=O)c1Br 690071203 NNKGHPBTBOQJPX-YFKPBYRVSA-N 335.187 1.341 10 10 EDCE O=C(CN1C(=O)c2ccccc2C1=O)NCc1c(O)cccc1O 1156880868 FHXQNIKLRWARPD-UHFFFAOYSA-N 326.308 1.010 10 10 EDCE Cc1ccc(C(=O)NCc2c(Br)cnn2C)c(O)c1O 1171228287 WAJKJRIOIQURGA-UHFFFAOYSA-N 340.177 1.832 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1[nH]nnc1C 1320807915 CYSSCQJPKOIZPE-UHFFFAOYSA-N 331.420 1.682 10 10 EDCE CN1C(=O)O[C@@H]2CN(c3ccc(CO)c(Br)c3)C[C@@H]21 2120405491 ZFFHGXHWGHYGDB-NWDGAFQWSA-N 327.178 1.581 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1cc2c(nc1O)CCCC2 1174763702 MOKHYRILVGYFKN-UHFFFAOYSA-N 328.368 1.936 10 10 EDCE COc1cc(NCCCNC(=O)/C=C\c2ccc(O)c(O)c2)ncn1 1469301564 AIOYGEQJUKOYNU-XQRVVYSFSA-N 344.371 1.528 10 10 EDCE COC[C@@H](C)NC[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1485706313 DDYXUIKEWDYMBE-LALPHHSUSA-N 347.419 1.982 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@H]4COC(=O)[C@H]4C3)C2)cc1 1636854129 SSJJPYFEZAXYOB-ZENOOKHLSA-N 345.399 1.088 10 10 EDCE CCOC(=O)COCCN(C)c1cc(OC)c(OC)c(OC)c1 1641779048 WQBFVJNPLPSYFH-UHFFFAOYSA-N 327.377 1.728 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CN3CCC[C@@H]3CO2)cc1 1583994132 KZWTWJJVRZPHEM-KGLIPLIRSA-N 331.376 1.442 10 10 EDCE COc1ccc2c(c1)OC[C@@H](C(=O)NCc1c(O)cccc1O)C2 1597568603 HKFCSEBMNIEJTR-LBPRGKRZSA-N 329.352 1.974 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N[C@H](C)C(=O)NC 1698623383 PRLFQYRBXHYLPL-ZYHUDNBSSA-N 348.407 1.082 10 10 EDCE C[C@@H](CCNC(=O)NCc1ccc(N(C)C)c(F)c1)[S@@](C)=O 165582383 AFYFGHNCUCSRBA-SAHAZLINSA-N 329.441 1.848 10 10 EDCE C[C@H](O)c1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)c(Br)c1 2146313409 JTBBXLIYQYTPDU-LKTVYLICSA-N 342.233 1.684 10 10 EDCE CC(C)(C)OC(=O)NC/C=C\C(=O)NCCc1ccc(O)c(O)c1 2021795897 RAHZMVFFXQWTCG-PLNGDYQASA-N 336.388 1.837 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@@](O)(C(N)=O)C2)c(Br)c1 380439618 BSTLAIVBIYWMMS-XPTSAGLGSA-N 342.237 1.285 10 10 EDCE CCNCc1ccc(N2C[C@@H]3NC(=O)O[C@@H]3C2)cc1Br 2176921561 SBMYLGSOVSFWNX-QWHCGFSZSA-N 340.221 1.856 10 10 EDCE Oc1ccc(Br)cc1CNC[C@H]1CN2CCN1CC2 394700520 PXXDCAIIUGZAKA-ZDUSSCGKSA-N 326.238 1.244 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H]3COC4(CCCCC4)O3)c2n1 2062527813 YYYYCUJYZSIFBF-GFCCVEGCSA-N 346.387 1.549 10 10 EDCE CCn1nc(Br)c([C@H](O)[C@H](NC)c2ccccc2O)n1 2167716979 MSYNDHFCOUPSIY-ZYHUDNBSSA-N 341.209 1.760 10 10 EDCE C[C@H]1CN(c2cc(Br)c(CN)cc2F)C2(CC2)C(=O)N1 2188545368 MBHUFSYFAMRWHM-QMMMGPOBSA-N 342.212 1.904 10 10 EDCE CCCNCc1ccc(N2CC[C@@H](O)[C@@H](O)C2)c(Br)c1 2188637579 VGRIJHSQOUYZNG-CABCVRRESA-N 343.265 1.881 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)cc1Br 2182558070 AQYLSLHUOHQBAB-XKSWNSKZSA-N 342.233 1.680 10 10 EDCE OC[C@@]1(NCc2ccc(Br)cc2O)C[C@H](O)C12CCC2 2193970196 NHDRUSIZDOLBPL-ZFWWWQNUSA-N 342.233 1.910 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCC/C=C/Br 2114285667 VKSZZDVFILZYMG-OKEWEERVSA-N 329.194 1.383 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CC[C@@H](C(N)=O)C2)c1O 2236031074 ITNZKJGRSOYMEU-RKDXNWHRSA-N 343.221 1.907 10 10 EDCE COc1ccc(Br)c(CN2CCOC[C@@H]2C(=O)O)c1O 2236040254 RYANOJBFHVKHBJ-SNVBAGLBSA-N 346.177 1.449 10 10 EDCE COc1ccc(Br)c(CNCc2[nH]nnc2C)c1O 2227752620 XCYRDXOINCOBSJ-UHFFFAOYSA-N 327.182 1.880 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2244707240 PSWYXEFJLNOKOD-HBNTYKKESA-N 327.385 1.610 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)CC[C@H]1C(=O)Nc1ccc(N)cc1 2246471436 TZEBLQSQBNBINJ-KBPBESRZSA-N 335.404 1.968 10 10 EDCE Cc1c(COc2nnc(=N)[nH]n2)cccc1NC(=O)OC(C)(C)C 2248222007 WVLXOQRXCPJIOR-UHFFFAOYSA-N 332.364 1.914 10 10 EDCE CC[C@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2288930419 ALSGIMXMXGZAMM-CYZMBNFOSA-N 340.221 1.751 10 10 EDCE COCC[C@](C)(O)CNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297723967 LVRMIVMJYKOOPD-IBGZPJMESA-N 348.443 1.440 10 10 EDCE CN[C@H](c1ccccc1O)[C@H](O)c1c(Br)ncn1C 2337352369 ZUNCRKVYSZXPRK-PWSUYJOCSA-N 326.194 1.882 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)Cn1cc(Br)ccc1=O 2337776517 MYTHAEVOPKCFJA-UHFFFAOYSA-N 328.170 1.770 10 10 EDCE Cc1ccc(CNC(=O)[C@H](C)NC(N)=O)c(O)c1Br 2352932541 OGDYTAVPQYSNNP-ZETCQYMHSA-N 330.182 1.136 10 10 EDCE Cc1ccc(CNC(=O)C2[C@@H]3CNC[C@@H]23)c(O)c1Br 2352949240 AWZHHDFKINPTFU-NXEZZACHSA-N 325.206 1.545 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)cc1Br 2354368735 MTUWTOBPKTYHCM-VHDGCEQUSA-N 341.249 1.755 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@](C)(O)[C@H](O)C2)cc1Br 1893324433 GOTYXHNCWZRQDJ-FZQKWOKYSA-N 329.238 1.791 10 10 EDCE CCNC(=O)CCCC(=O)N1CCN(c2ccc(OC)cc2)CC1 104134109 HBWGFOXHDPHGTF-UHFFFAOYSA-N 333.432 1.650 10 10 EDCE CN(C[C@H]1CCCC[C@@H]1O)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 302044343 MKKPDOJMMQFLJH-YGRLFVJLSA-N 335.360 1.913 10 10 EDCE N[C@]1(C(=O)O)CCOc2c(I)ccc(O)c21 309526838 BXJNMDBKIUZWGU-SNVBAGLBSA-N 335.097 1.018 10 10 EDCE CO[C@H]1C[C@H](c2nc(C)no2)N(Cc2cc([N+](=O)[O-])ccc2O)C1 189351941 VICHFCUAWKGBBA-QWHCGFSZSA-N 334.332 1.954 10 10 EDCE COc1cccc(CNC(=O)N[C@@H](C)c2nnc3n2CCCC3)c1O 121441617 OXTUCMXDTDMGJA-NSHDSACASA-N 345.403 1.889 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@H](C4CC4)C3)nc12 363777932 XFSLIDCXRHABRQ-CQSZACIVSA-N 346.387 1.222 10 10 EDCE C[C@@H]1OCC[C@]12CN(c1cc3c(cc1[N+](=O)[O-])OCC(=O)N3)CCO2 366501300 AXYZGEXZAIOBIW-QFYYESIMSA-N 349.343 1.310 10 10 EDCE NC(=O)CC1CN(c2ccc(/C=C\C(=O)O)c(Br)c2)C1 382148008 FGUDPTYTLNOJLG-RQOWECAXSA-N 339.189 1.859 10 10 EDCE C[C@@H]1C[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 706045705 UJZJBGYQGJZTJT-BFHDXFOESA-N 340.221 1.751 10 10 EDCE C[C@@H](NC(=O)C(=O)NCC[C@@H]1CCOC1)c1ccc(N(C)C)cc1 807325272 FEMOKIILJWQMJE-ZIAGYGMSSA-N 333.432 1.473 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC3(CN(C)C(=O)O3)C2)c([N+](=O)[O-])c1 817125393 QYRCMDVMDUTCIA-GQCTYLIASA-N 347.327 1.422 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)C(C)(C)O 823548696 ULIWDCUCANAOGL-CYBMUJFWSA-N 335.448 1.606 10 10 EDCE Cc1c(C[C@@H](CN)CNC[C@@H](N)c2ccc(N(C)C)cc2)cnn1C 903918231 VLLTXCLWLIHDHM-HNAYVOBHSA-N 344.507 1.202 10 10 EDCE Cn1ccnc1COCC(=O)NCCCSc1nccs1 827474750 MGXRPFPDLRVJIV-UHFFFAOYSA-N 326.447 1.692 10 10 EDCE CC1CCN(c2ccc(CNC(=O)CCNC(=O)CO)cc2)CC1 906618007 TZZSBTRTJHLKJB-UHFFFAOYSA-N 333.432 1.038 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CCc1cnn(C)n1 839922175 PIFATELOZAMZTR-AWEZNQCLSA-N 329.448 1.870 10 10 EDCE CCS(=O)(=O)NCCCNC/C=C\c1ccc(N(C)C)cc1 835038106 UOYZINJSELSFTN-ALCCZGGFSA-N 325.478 1.685 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCN(CC(=O)NC3CC3)CC2)cc1 835025756 MVHZXCSYCZGESH-ARJAWSKDSA-N 342.487 1.662 10 10 EDCE CN(C)c1ccc(CN(C2CC2)S(=O)(=O)c2cnc(N)nc2)cc1 913950967 MIUQTNYBEHLNJI-UHFFFAOYSA-N 347.444 1.478 10 10 EDCE CN(C)c1ccc(CNC(=O)NCc2noc3c2COCC3)cc1F 915365477 GGDURHCITCZLCI-UHFFFAOYSA-N 348.378 1.952 10 10 EDCE Cc1cc(O)c(CN(C)C[C@H](O)CN2CCOCC2)c(Cl)c1 840918670 XWOGLIFXKVVVKM-ZDUSSCGKSA-N 328.840 1.479 10 10 EDCE COC(=O)[C@@]12CCOC[C@@H]1CN(C(=O)NCCc1ccc(N)cc1)C2 841960252 ZITIVMWLGSUSOZ-KBXCAEBGSA-N 347.415 1.032 10 10 EDCE C[C@@H](CO)C1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 845707934 SIEIBFZOUJCION-JTQLQIEISA-N 335.360 1.771 10 10 EDCE CCOc1cnc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)cn1 855223636 BTVPBTALFKJRGY-ZDUSSCGKSA-N 342.399 1.893 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@H]3[C@@H](C)O)C2)cc1 854297522 RTYSOHYWMAMDHB-JKIFEVAISA-N 333.432 1.829 10 10 EDCE Cc1ccn(C)c(=O)c1NS(=O)(=O)c1cc(F)cc(F)c1O 753014365 GUEACAGEUUEKMO-UHFFFAOYSA-N 330.312 1.478 10 10 EDCE CC(=O)NCc1ccc(CNC(=O)NCCc2ccc(N)cc2)cc1 851663009 QRAYBMICSIQHAP-UHFFFAOYSA-N 340.427 1.947 10 10 EDCE CC[C@@H]1NCC[C@H]1NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 861670624 HTQKHVJRPKWQMO-XOKHGSTOSA-N 332.448 1.714 10 10 EDCE C[C@@H]1NCC[C@H]1NC(=O)NCc1ccc(N2CCSCC2)cc1 861558951 KPRUBERRNMOVKN-XJKSGUPXSA-N 334.489 1.789 10 10 EDCE CN(CCS(C)(=O)=O)C(=O)c1cc2cc(O)c(O)cc2s1 896140400 QPCAESZNRLIBPH-UHFFFAOYSA-N 329.399 1.429 10 10 EDCE CCN(CC(=O)NC)Cc1c(C(=O)OC)n(C)c2ccc(F)cc12 893940517 OOLYQFNRRFQWEM-UHFFFAOYSA-N 335.379 1.672 10 10 EDCE Oc1c(F)cc(Br)cc1CNCC[C@@]1(O)CCOC1 715771980 XBOAPWWFLYVMRK-CYBMUJFWSA-N 334.185 1.925 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N(CCO)CC3CC3)c(Br)cc21 688390969 RCSPIHCMCTVGIM-ZDUSSCGKSA-N 340.221 1.610 10 10 EDCE NC(=O)c1ccc(OCCC(=O)NCc2cc(O)ccc2O)cc1 1153884972 IDEQYZMYGMGFGC-UHFFFAOYSA-N 330.340 1.282 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2nccnc2N)cc1C 1319167925 RBNODFGRHNYRDF-LBPRGKRZSA-N 343.431 1.532 10 10 EDCE CC(C)(C)OC(=O)N(CCCO)CCC(=O)NCCCN=[N+]=[N-] 1902570621 DHEZCGOYMYKOIF-UHFFFAOYSA-N 329.401 1.813 10 10 EDCE C[C@@]1(CNCCCO)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1278588753 IDHJPPCBDWCXJK-KRWDZBQOSA-N 347.419 1.673 10 10 EDCE CN(CCCCCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 227074928 WHPCDKKXSLFOFV-ZDUSSCGKSA-N 342.237 2.000 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3COC(=O)N3)CCC2)cc1C 1484633059 YGFMPRMAPWDCIS-CQSZACIVSA-N 347.415 1.241 10 10 EDCE Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1556157963 NZZHTYRJEIXTHB-SECBINFHSA-N 334.332 1.258 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1ncc(C(F)(F)F)cn1 1627983050 RKEQDUPBNGVTTI-UHFFFAOYSA-N 327.262 1.766 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cc2cnc[nH]2)cc1C 1483064734 LYYGUEIKUNFWFO-ARJAWSKDSA-N 328.416 1.731 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CC(=O)N(c2cn[nH]c2)C1 1640259716 AYCAKQWCKMFVCH-LLVKDONJSA-N 349.387 1.270 10 10 EDCE Cc1sc(S(N)(=O)=O)cc1C(=O)NCc1c(O)cccc1O 1652625371 CYVGNJCEDJPSHE-UHFFFAOYSA-N 342.398 1.045 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)CC[C@H]1CCOC1 1691002340 BBCUJOCIBIEADW-ZDUSSCGKSA-N 347.419 1.937 10 10 EDCE CCCCC(=O)NC1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169870444 ZRJVYXMHDPVNRI-UHFFFAOYSA-N 336.388 1.714 10 10 EDCE CNCc1ccc(N2CCO[C@H]3COC[C@@H]32)c(Br)c1 1877661008 XNEKUFJEWVQBKP-KBPBESRZSA-N 327.222 1.773 10 10 EDCE CN1[C@@H](CNCc2c(O)cccc2Br)CCS1(=O)=O 1965950314 UBMYXYBCSULQGI-SECBINFHSA-N 349.250 1.278 10 10 EDCE CC(C)(C)OC(=O)N1CC(NCc2cccc(F)c2O)(C(N)=O)C1 715503482 YMRADCAVVAZWEL-UHFFFAOYSA-N 339.367 1.096 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@H](CO)C2)c(Br)c1 396818449 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1.220 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2COC[C@H]2OC)c1O 2236053977 CNCUOKWZBKPZND-TVQRCGJNSA-N 346.221 1.914 10 10 EDCE O=C1Nc2cc(N3CC(CCCO)C3)c(Br)cc2[C@@H]1O 2238723981 HJCOJYNDVOVVEQ-ZDUSSCGKSA-N 341.205 1.643 10 10 EDCE C[C@H]1O[C@]2(C(=O)N3CC(N=[N+]=[N-])C3)C[C@@]1(NC(=O)OC(C)(C)C)C2 2247300508 NDESMWLGXVEBAX-DFKRKDTASA-N 337.380 1.722 10 10 EDCE C[P@@]1(=O)C[C@@H](O)[C@H](NCc2c(O)cccc2Br)C1 2296660754 GVEYKMUTXARHFL-QAMHXRKUSA-N 334.150 1.980 10 10 EDCE CNCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2357586503 ZKFWKZDXCATQAE-JUTUQKRISA-N 341.249 1.489 10 10 EDCE COc1cc(I)cc([C@H](N)CCCO)c1O 309377057 HXJDONJYTCIYSA-SECBINFHSA-N 337.157 1.778 10 10 EDCE COC(=O)[C@@H]1CCN[C@@H]1c1cc(I)ccc1O 1952825553 LSZIHRXXICGJEP-KCJUWKMLSA-N 347.152 1.820 10 10 EDCE CCOc1ccc(O)c(CNCC2CN(S(=O)(=O)CC)C2)c1 190287591 PVCCMTWXICCIOV-UHFFFAOYSA-N 328.434 1.162 10 10 EDCE CCN(CC(N)=O)c1ccc(/C=C/C(=O)O)c(Br)c1 233442951 AFIPTZPPMBFLQQ-GQCTYLIASA-N 327.178 1.859 10 10 EDCE 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CNCc1ccc(N2CCN(C[C@H](C)O)CC2)cc1Br 2170220573 IGNXICLAWCPMQA-LBPRGKRZSA-N 342.281 1.671 10 10 EDCE C[C@H](O)[C@@H]1CCCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2193592495 HXJSSPGGYPJXCA-LCHGKGQCSA-N 341.205 1.784 10 10 EDCE Nc1ccc(OC[C@@H](O)CN2CC=C(Br)CC2)cc1 2092393424 QICXEBSNIHSYFA-ZDUSSCGKSA-N 327.222 1.993 10 10 EDCE OCc1ccc(N2C[C@H]3CCO[C@@]3(CO)C2)cc1Br 2231313535 KVMFOHYQEAZZHZ-BXUZGUMPSA-N 328.206 1.529 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@H]2[C@H](O)CO)cc1Br 2270701222 OVZATDQFEAFRQP-BIGNPOOSSA-N 329.238 1.661 10 10 EDCE CC[C@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)C(=O)OC 2297963734 GMJUVQDQYPVKQD-INIZCTEOSA-N 332.400 1.604 10 10 EDCE COc1ccc(N2CCN(C(=O)C=Cc3ccnn3C)CC2)cc1F 2298051575 IXZMKHPPCIFRHK-UHFFFAOYSA-N 344.390 1.930 10 10 EDCE CCOCCN1CCN(C(=O)C=Cc2ccc(O)c(O)c2)C[C@H]1C 2308001491 NBRDCUJDRJDXKL-CQSZACIVSA-N 334.416 1.680 10 10 EDCE CN1C(=O)/C(=C\c2ccc(C(=O)NCC(=O)O)cc2)SC1=S 27533030 BJAZPEKTPJYSNC-UXBLZVDNSA-N 336.394 1.332 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3nccs3)nc12 184390255 MNPKFWSTGGFGCH-VIFPVBQESA-N 347.400 1.919 10 10 EDCE Nc1cc2c(cc1N1CCN(Cc3ccccc3)CC1)NC(=O)CO2 380068134 JKGPIIQGJSFQLC-UHFFFAOYSA-N 338.411 1.922 10 10 EDCE Cc1ncc(I)c(=O)n1Cc1ccc(N)cc1 90780306 BDTKEQXQUDROFH-UHFFFAOYSA-N 341.152 1.787 10 10 EDCE CN1C2(CCC2)COC[C@@]1(CO)CN[C@@H]1CCc2cccc(O)c21 527949484 LMGWHXMKDIBXKV-BEFAXECRSA-N 332.444 1.585 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C1C[C@H]2COC[C@@H](C1)C2=O 369557834 COSIZCHBRQCQDF-MQVJKMGUSA-N 330.428 1.953 10 10 EDCE Cc1ccc(CN2CCOC[C@H]2[C@@H](O)CO)c(O)c1Br 2380813039 BSGWRCISVCGWPQ-RYUDHWBXSA-N 346.221 1.017 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccn(C)n1 805704753 VISNRSNVULTYIU-UHFFFAOYSA-N 330.388 1.181 10 10 EDCE CNC(=O)[C@H]1CCN(Cc2c(O)c(C(=O)OC)cc3ccccc23)C1 817369481 AVDXFULKNRAKCC-ZDUSSCGKSA-N 342.395 1.900 10 10 EDCE C[C@H](NC(=O)NCCCc1ncn(C)n1)c1ccc(N(C)C)cc1 826532373 UBAMTSHWSYIYGY-ZDUSSCGKSA-N 330.436 1.874 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H]3COC[C@@H]3C2)cc1F 827575714 TTWHSOZECDGZDS-KBPBESRZSA-N 349.406 1.003 10 10 EDCE COc1ccc(N2CCN(C(=O)COC(=O)C3(F)CC3)CC2)cc1 830765654 TVCFHKBGDDLYIT-UHFFFAOYSA-N 336.363 1.389 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1cc(CN2CCCC2)nn1 900603708 IENZMMYCRQOGLZ-UHFFFAOYSA-N 327.432 1.759 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CNC(=O)c1ccccn1 739731678 ARBSJVDBTKVXPJ-UHFFFAOYSA-N 326.400 1.502 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NCc1cccc(F)c1O 1898126740 SWPIIYXMVZDKOW-CHWSQXEVSA-N 326.368 1.913 10 10 EDCE CN1CCN(c2ccc(CNC(=O)c3coc(CO)c3)cc2)CC1 918838959 OJZRAKDPHCSTHV-UHFFFAOYSA-N 329.400 1.454 10 10 EDCE Cn1cnnc1N1CCN(Cc2cc3c(cc2O)CCCC3)CC1 848498062 UFSCLBZLSQABSH-UHFFFAOYSA-N 327.432 1.722 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)C[C@H]3CCCO3)C2)cc1 849416412 QWLWFMWQBNCXAL-CZUORRHYSA-N 340.445 1.372 10 10 EDCE O=C(O)CN(Cc1ccccc1O)C(=O)[C@H]1CC[C@H]2CCCCN21 911489668 VVHGWWDCOHYRIW-HUUCEWRRSA-N 332.400 1.822 10 10 EDCE CCOC(=O)[C@@H]1CCCN(CC(=O)N[C@@H](C)c2ccccc2O)C1 913763666 NJRGWOYLWPPRJT-UONOGXRCSA-N 334.416 1.845 10 10 EDCE COc1ccc(N2CC[C@H](NCc3cnc4n3CCOC4)C2)cc1 922238065 PZRKDWATEFCBOI-AWEZNQCLSA-N 328.416 1.790 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](c2cc(O)c(O)cc2O)[C@@H](CO)C1 687742600 DWOWNNLRVPUJEL-KOLCDFICSA-N 325.361 1.746 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC(C)(C)C(N)=O)C2)cc1 853450201 QSVWEJMZTYXKNO-GFCCVEGCSA-N 334.420 1.085 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc2c(cc1Br)OCO2 856966930 HHFVHKPDIDYZRJ-UHFFFAOYSA-N 329.102 1.493 10 10 EDCE C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc3cccnc3c2O)C1 862027085 IUOWKKSRZYRBBN-GFCCVEGCSA-N 327.384 1.815 10 10 EDCE CCN1C[C@@H](S(=O)(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1=O 867126345 XOAMNIDZCKLNQA-DOMZBBRYSA-N 339.461 1.354 10 10 EDCE COC(=O)c1cc(O)ccc1NS(=O)(=O)N1CCC[C@H](C)C1 775288609 YZMQNMXJPIBWOM-JTQLQIEISA-N 328.390 1.567 10 10 EDCE COc1cc(N2CCO[C@@H](C(=O)C3CC3)C2)c([N+](=O)[O-])cc1OC 779710541 HCRLGWGJGWEQGB-OAHLLOKOSA-N 336.344 1.796 10 10 EDCE COc1cc(Br)cc(CN2CC[C@H](NC(N)=O)C2)c1O 770381126 OABQNWSRPNGGAX-JTQLQIEISA-N 344.209 1.406 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cc3c(O)ncnc3cn2)c1 779002626 YWKQXVQTMBHKBG-VIFPVBQESA-N 340.339 1.936 10 10 EDCE NS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C\c1cncc(O)c1)CC2 779666923 POYDZQOATBBETM-RJRFIUFISA-N 345.380 1.037 10 10 EDCE CC(C)c1ncc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)[nH]1 776432944 HXHNNFNVJVQRSH-UHFFFAOYSA-N 325.346 1.738 10 10 EDCE C[C@H](NC(=O)c1ccccc1)C(=O)OCC(=O)c1ccc(O)c(O)c1 778061740 DUQYDOIDWKFBNE-NSHDSACASA-N 343.335 1.642 10 10 EDCE Cc1cc(C(=O)N2CCS(=O)(=O)CCO2)c(C)n1-c1ccccn1 1124110147 SNLDYYXNJVUWQR-UHFFFAOYSA-N 349.412 1.291 10 10 EDCE COC(=O)c1c(CN[C@H]2CCC(=O)N(C)C2)c2cc(F)ccc2n1C 894285204 RWSCWYIHGIXYED-LBPRGKRZSA-N 347.390 1.814 10 10 EDCE COc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1NC(N)=O 1139777853 OKHUTUILLOKJSH-UHFFFAOYSA-N 331.328 1.778 10 10 EDCE COc1ccc(/C=C2/C(=O)NC(=O)N(C)C2=O)cc1Br 1084408817 PGBOGQWPRDDRGB-YVMONPNESA-N 339.145 1.549 10 10 EDCE C[C@]1(CO)COCCN(c2ccc(CO)cc2Br)C1 2135077873 NVARNZCKBPFJLI-AWEZNQCLSA-N 330.222 1.777 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cc[nH]c2)cc1C 1279724307 GSWHCDLCSVZBOK-UHFFFAOYSA-N 331.416 1.556 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2n(n1)CCC[C@@H]2O 1447561467 IZBNCQJPURDRJG-YGRLFVJLSA-N 331.372 1.483 10 10 EDCE CCN(CCNC(=O)COC)C(=O)c1ccc(N=NC(N)=O)cc1 1284596336 WZYHVNOWENEDIW-UHFFFAOYSA-N 335.364 1.074 10 10 EDCE CN1C(=O)c2ccccc2[C@H]1CNC(=O)Cc1ccc(O)c(O)c1 1454714384 BDXJMSGXBSVHLN-CQSZACIVSA-N 326.352 1.583 10 10 EDCE O=C(O)[C@H]1C[C@@H](O)CCN1Cc1cc(Br)ccc1O 2136384930 VSTKHGAEXZEDHQ-WDEREUQCSA-N 330.178 1.565 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1cc(S(N)(=O)=O)c(Cl)o1 1294676732 DMTUGXHRVUWEKT-UHFFFAOYSA-N 344.776 1.558 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)C(C)(C)NC(C)=O)cc1C 1716573682 HUHYEZJZWMVYNV-UHFFFAOYSA-N 349.475 1.856 10 10 EDCE CN(C)c1ncnc2c1cc(C(=O)NCc1c(O)cccc1O)n2C 1558534792 XWNUOXNROYWIOT-UHFFFAOYSA-N 341.371 1.376 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1568188886 RZAMAMUNJRZDIE-ANRZDRKOSA-N 332.444 1.738 10 10 EDCE Cc1ccc(C(=O)NC[C@@H](n2cncn2)C(F)(F)F)c(O)c1O 1648765691 BCOAEFYFMACOKL-SECBINFHSA-N 330.266 1.531 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCN2CCOCC2)cc1C 1669424822 OOIPEWYFHWLYNB-MRXNPFEDSA-N 349.475 1.320 10 10 EDCE C[C@H]1[C@@H](CO)CCN1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1675579941 FAXNIQPLJCQTLW-DOTOQJQBSA-N 346.475 1.351 10 10 EDCE CN(C)c1ccc(CNC(=O)CNC(=O)c2cccnc2)cc1F 155961382 AMGJZDGZRUNPPA-UHFFFAOYSA-N 330.363 1.333 10 10 EDCE O=C(O)CN(CCO)Cc1cc(Cl)cc(Br)c1O 1963595838 VVIYNTLAYUTYJU-UHFFFAOYSA-N 338.585 1.687 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2010403883 LDZJFTIFNZTNMC-NWDGAFQWSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CNCc1cc2c(cc1O)OCO2 2011423394 RGKDJRJBPRFQHC-NSHDSACASA-N 340.376 1.096 10 10 EDCE C[C@H](NC(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)c1ccccc1O 2017963630 PRJMVLPTYWQJDF-WCQYABFASA-N 338.404 1.845 10 10 EDCE C[C@H](OCc1ccccc1)[C@H](N)C(=O)NCCc1ccc(O)c(O)c1 2031086718 LKHXGFOXXBXHGG-UGSOOPFHSA-N 344.411 1.689 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@H]2C3)cc1Br 2173320650 RJDMAUDHQFQHBI-ZAOWEBSESA-N 341.249 1.489 10 10 EDCE C[C@@H](C(=O)O)N1CCN(Cc2c(O)cccc2Br)CC1 706655614 SGIJPQDBOKOAHW-JTQLQIEISA-N 343.221 1.745 10 10 EDCE O=c1nc(CCNCc2cc(Cl)cc(Br)c2O)[nH]o1 708197421 QQXNWPRLCVNPNP-UHFFFAOYSA-N 348.584 1.817 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCN2CCOC[C@H]12 2062403780 VVJXSCAMRVWSMO-LSDHHAIUSA-N 327.384 1.277 10 10 EDCE C[C@H](N)c1ccc(N2CCN([C@@H](C)CO)CC2)cc1Br 2169364688 RYUUBWWTHVDDFI-RYUDHWBXSA-N 342.281 1.972 10 10 EDCE OC[C@@]1(NCc2c(O)cccc2Br)C[C@@H](O)C12CCC2 2193966849 MQBCQCMBFZCFSF-HIFRSBDPSA-N 342.233 1.910 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(CNC(N)=O)C2)c(Br)c1 2187292058 FZZRZDMNJAMQBQ-VIFPVBQESA-N 341.253 1.834 10 10 EDCE CN(C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)c1ccc(N)cc1 2080723484 WTXIGDUMAAJZKR-DOMZBBRYSA-N 349.431 1.850 10 10 EDCE CCN(C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1cccnn1 2080942194 IKFICYKEHWFWAV-CHWSQXEVSA-N 348.403 1.414 10 10 EDCE CN(CC1(S(C)(=O)=O)CC1)c1ccc(CN)c(Br)c1 2111528851 VGOBTESTOGNUSJ-UHFFFAOYSA-N 347.278 1.921 10 10 EDCE CCCNC(=O)C1CN(c2ccc(CN)cc2Br)C1 2111745806 VNOCAOVFVMNWGT-UHFFFAOYSA-N 326.238 1.870 10 10 EDCE Cc1ccc2c(c1)C(=C1SC(=S)N([C@@H](C)C(=O)O)C1=O)C(=O)N2 2293308679 VWBAEVPDXVDJPP-ZETCQYMHSA-N 348.405 1.992 10 10 EDCE O=C(CN1C(=O)C(=Cc2cccc(F)c2)SC1=S)NCCO 2293355628 AOPKDWZLSPLYCH-UHFFFAOYSA-N 340.401 1.135 10 10 EDCE CNS(=O)(=O)c1ccc(CNCc2cnc(SC)s2)o1 2284687405 GFCLBWXNRMAKLN-UHFFFAOYSA-N 333.460 1.656 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1CC[C@@H](O)CN1C(=O)OC(C)(C)C 2300532153 QTFJKMOKLWNAOW-VXGBXAGGSA-N 341.412 1.906 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)C(=Cc2ccc(F)cc2F)SC1=S 2323832098 JWXLDKCTWZMRLS-VIFPVBQESA-N 345.348 1.612 10 10 EDCE OCc1ccc(N2C[C@H]3OC[C@@H](CO)[C@H]3C2)cc1Br 2330879531 GILHLYUUMSISSF-MPKXVKKWSA-N 328.206 1.385 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N1C[C@@H]2CS(=O)(=O)[C@H]2C1 2336553832 MYJPKRKDNWLMOW-KKFJDGPESA-N 346.246 1.945 10 10 EDCE COc1ccc(N2CCCN(C(=O)NCC3(C)COC3)CC2)cc1 171856288 UBIMJQXOEHKYAZ-UHFFFAOYSA-N 333.432 1.953 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cccc(-n3cncn3)n2)cc1F 1358004603 WMDPROMVNAFIPQ-UHFFFAOYSA-N 340.362 1.797 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC(NC(=O)C3CCC3)C2)cc1F 188831427 QQJCVAWTRKOYCV-UHFFFAOYSA-N 348.422 1.702 10 10 EDCE O=C(O)CN1C(=O)/C(=C\c2cccc3nccnc23)SC1=S 33583401 OQAUJSHMBYTJQC-UXBLZVDNSA-N 331.378 1.916 10 10 EDCE CN(c1ccc(CN)cc1Br)[C@H]1CCS(=O)(=O)C1 212969004 HPCQOQBLHPULHL-JTQLQIEISA-N 333.251 1.531 10 10 EDCE C[C@@H]1C[C@@H](C)CN(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)C1 386926401 NGPJGUCCDHWMRF-NXEZZACHSA-N 328.390 1.725 10 10 EDCE Cc1ccc(CN(C)C(=O)NOCC(=O)O)c(O)c1Br 2381137818 QNRWPRSZJMTOGM-UHFFFAOYSA-N 347.165 1.621 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@H]3CSC(=O)N3)C2)cc1 819582600 JRJDFHDFGAHMSX-SMDDNHRTSA-N 335.429 1.463 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CNC3(C(C)C)CC3)CC2)cc1 815150634 KDAQMZZMXCGNPF-GOSISDBHSA-N 347.503 1.956 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc4nn[nH]c4n3)CC2)cc1 841375196 BHSUZCCNHALKOG-UHFFFAOYSA-N 338.371 1.324 10 10 EDCE CCC/C=C\[C@H](O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 912709652 RGUCTLTZPRYYNV-XDXAGZTOSA-N 332.444 1.981 10 10 EDCE CO[C@H]1C[C@@H](CC(=O)O)N(Cc2cc(F)cc(C(C)=O)c2O)C1 846284972 MUCOAPZWEUGAOD-STQMWFEESA-N 325.336 1.798 10 10 EDCE C[C@@H]1CN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])CC[S@@](=O)C1 844220271 YIACVTOBXWAARW-JAFDXSTKSA-N 338.385 1.897 10 10 EDCE NC(=O)C1CCN(c2ccc(CN[C@H]3CCNC34CCC4)cc2)CC1 925777658 PYWOFKQABNJBER-SFHVURJKSA-N 342.487 1.763 10 10 EDCE CO[C@@]1(CO)CCCN(C(=O)NCc2ccc(N(C)C)cc2C)C1 853749513 ULXHXJUQSMNRNR-SFHVURJKSA-N 335.448 1.744 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCNC(=O)C[C@@H]3C)C2)cc1 854299904 LWUGDIUEVFFFTP-KBPBESRZSA-N 346.431 1.194 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1nncs1 853862547 GZAMAPQRWNQOKF-UHFFFAOYSA-N 333.417 1.821 10 10 EDCE C[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[S@@]1=O 758161741 WKYQZTLMCSJYJE-KLVQOETNSA-N 339.373 1.273 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H]2COC[C@@H]2C1 850626132 MYHOAXIADBAYBS-CVEARBPZSA-N 346.427 1.626 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](CC(C)C)NC(C)=O)C2)cc1 862158692 KXZRSBKOYNNXOC-MAUKXSAKSA-N 347.459 1.941 10 10 EDCE Cn1cc([C@H]2C[S@](=O)CCN2Cc2ccc(F)c(F)c2O)cn1 895379601 MSYKAIWVMROEBF-JCQPUDPBSA-N 341.383 1.710 10 10 EDCE O=C(NCCF)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 798098983 HGKBYPFXYMLRIR-UHFFFAOYSA-N 334.439 1.987 10 10 EDCE O=C(O)[C@@H]1CNCCN1Cc1cc(Br)cc(F)c1O 715767986 AOWUZBSSJFJRSO-JTQLQIEISA-N 333.157 1.152 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)COC(C)(C)C)cc1C 1320217807 RLNJXHSQHFARPD-HNNXBMFYSA-N 338.448 1.385 10 10 EDCE Cc1csc([C@H](C)NC(=O)C(=O)N(C)Cc2ccccc2O)n1 1322722028 IPIUOXFQNXHCFD-NSHDSACASA-N 333.413 1.993 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H](CNCCCO)C2)cc1 1265636625 MBRHCYLCDABLLI-CYBMUJFWSA-N 347.419 1.673 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C[C@@H]2CCC(=O)NC2)cc1C 1266941381 DUOJXHQLHKTCNT-ZBFHGGJFSA-N 347.459 1.514 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2C[C@H]3CCC[C@@H]32)cc1F 1354438767 QNKCJGJYLMUVKT-VNHYZAJKSA-N 333.407 1.813 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)/C=C\c2cn(C)cn2)c2ccc(F)cc2O1 1530902165 SUWXTXFCBIOQIR-VOKGJARPSA-N 345.330 1.540 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CCC(=O)N1CCC(O)CC1 1463760833 GABPJEOMSSUWIX-UHFFFAOYSA-N 347.459 1.475 10 10 EDCE COC(=O)[C@H](O)C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1545993678 APVKXJVSOYFHNM-CYBMUJFWSA-N 348.359 1.235 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C2CN(C(C)=O)C2)cc1C 1715926214 MMHQLHATHOAPDQ-CYBMUJFWSA-N 333.432 1.076 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cc3n(n2)CCO3)cc1C 1714716642 SIDDMCAUGWLXOS-UHFFFAOYSA-N 344.415 1.454 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@H]2CCC(=O)N2)cc1C 1497156978 YYSJVOVYELVBCW-DZGCQCFKSA-N 333.432 1.267 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@H]2CCC(=O)N2)C2CC2)cc1C 1569296107 MDXBXPFOPHOQSN-HZPDHXFCSA-N 345.443 1.267 10 10 EDCE CN1C(=O)CN(CC(=O)NCc2c(O)ccc3ccccc23)C1=O 1652708783 MXMWXDWXEZVZAE-UHFFFAOYSA-N 327.340 1.056 10 10 EDCE O=C(NCc1nc(-c2ccccn2)n[nH]1)N1Cc2cccc(O)c2C1 1682527406 SVMBKLWIRKRKAT-UHFFFAOYSA-N 336.355 1.798 10 10 EDCE CO[C@H](C)CNC[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1698776962 LIOXCODXAWCFCZ-NWDGAFQWSA-N 335.408 1.839 10 10 EDCE O=C1/C(=C/c2cc([N+](=O)[O-])ccc2O)SC(=S)N1CCCO 16904805 QVSGGXXBWFLJAC-XFFZJAGNSA-N 340.382 1.884 10 10 EDCE CCN(CC)c1ccc(CNCC(=O)N2CCC(C(=O)O)CC2)cc1 1857866517 OBLWKPMFTHELKV-UHFFFAOYSA-N 347.459 1.946 10 10 EDCE COC(=O)[C@H]1CCC[C@H]1NCc1ccc(N2CCN(C)CC2)cc1 1320707775 GCOTXKUWEOYUCC-ZWKOTPCHSA-N 331.460 1.870 10 10 EDCE C[C@H](O)c1ccc(N2CCOC[C@@H]2[C@H](O)CO)cc1Br 2146324236 TYDZYTQNNJTNFW-CUOATXAZSA-N 346.221 1.061 10 10 EDCE Cc1cccc(CNC(=O)C2(NC(=O)OC(C)(C)C)COC2)c1O 2024802196 NPTTWEIUOKBJGP-UHFFFAOYSA-N 336.388 1.611 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)c(Br)c2F)[C@H]2COC[C@@H]12 2158361608 JODOSNFQQSJEND-ADEWGFFLSA-N 345.212 1.897 10 10 EDCE CN(Cc1ncnn1C)c1cc(Br)c(CN)cc1F 707604542 MHHBKYVCZBDAGR-UHFFFAOYSA-N 328.189 1.812 10 10 EDCE CC[C@@H]1C(=O)NC(=O)CN1c1cc(Br)c(CN)cc1F 383671335 TZRVSVVHBMJHBF-SNVBAGLBSA-N 344.184 1.288 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)[C@H](CO)C2)cc1Br 396816661 UERQJWLPKASNPL-PKFCDNJMSA-N 329.238 1.648 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)C[C@]1(Br)CC1(F)F 2202509809 QADFVEDXABMDJV-GFCCVEGCSA-N 348.191 1.729 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H](c3ccco3)N(C)C)c2n1 2062827188 SEIWJGXZQMULRH-LBPRGKRZSA-N 329.360 1.369 10 10 EDCE O=C(CN1CCN(c2ccccn2)CC1)Nc1ccc(O)c(O)c1 2063139914 WKOZKDDSIVQLSJ-UHFFFAOYSA-N 328.372 1.254 10 10 EDCE COc1ccc(Cn2nc(O)cc2I)c(O)c1 2070202523 BDVZBSCEVKQILI-UHFFFAOYSA-N 346.124 1.956 10 10 EDCE CNCc1ccc(N2CC[C@@](C)(O)[C@](C)(O)C2)cc1Br 2194611557 UJJUVQUGXMEBFO-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE O=C1C[C@H]2CCN(Cc3cc(Br)ccc3O)C[C@@H]2N1 2088805003 ASNXOLUUAKPTQA-SKDRFNHKSA-N 325.206 1.865 10 10 EDCE CNC(=O)OC1CN(c2cc(Br)c(CN)cc2F)C1 2090747136 RWCSPGXTVCEYJP-UHFFFAOYSA-N 332.173 1.592 10 10 EDCE CN(Cc1cc(Cl)cc(Br)c1O)[C@@H]1CC(=O)NC1=O 2114731191 AMMQYXGSBIKKER-SECBINFHSA-N 347.596 1.655 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])C1 2213582456 HXLLZFNGIYSHEK-FMCALUSXSA-N 339.396 1.752 10 10 EDCE COc1ccc(Br)c(CNC2(C(N)=O)CCC2)c1O 2231908972 GNAMHJXIDFMAAX-UHFFFAOYSA-N 329.194 1.661 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2244707238 PSWYXEFJLNOKOD-GMTAPVOTSA-N 327.385 1.610 10 10 EDCE CN(C)c1ccc([C@H](N)[C@](O)(CF)CNC(=O)OC(C)(C)C)cc1 2246678724 AMHSJAAOIXYTMI-YOEHRIQHSA-N 341.427 1.978 10 10 EDCE CN(C)c1ccc(C=Cc2c([N+](=O)[O-])c(=O)n(C)c(=O)n2C)cc1 2297308465 FMSNSFZRTNIQNG-UHFFFAOYSA-N 330.344 1.229 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2298023984 RMPOPYYWHSEJKM-TUAOUCFPSA-N 341.412 2.000 10 10 EDCE CN(NCc1cc(Br)ccc1O)S(=O)(=O)C1CCC1 2339770098 WUOXKQCMBNXDTR-UHFFFAOYSA-N 349.250 1.973 10 10 EDCE CC(=O)N[C@H](C)C(=O)NCc1ccc(C)c(Br)c1O 2352640598 KQYBILXTPKSGQB-MRVPVSSYSA-N 329.194 1.604 10 10 EDCE CCNCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2354483728 RKJIWZVBRAZGGQ-HPEDKQMDSA-N 341.249 1.489 10 10 EDCE COC(=O)[C@@H](C)CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 177596028 YDQIJIYKJLKPOM-AWEZNQCLSA-N 348.443 1.711 10 10 EDCE O=C(CN1C(=O)/C(=C\c2cccs2)SC1=S)NCCCO 210394014 YZJCQVFZYDXJMH-JXMROGBWSA-N 342.467 1.448 10 10 EDCE CC(C)c1nnc2n1C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)CC2 181006740 JYSWTJQZSUXRTK-FLUIGGAXSA-N 342.399 1.957 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@H](n4cccn4)C3)cc2N1 365831026 JYXUBRNJQVRHTF-SNVBAGLBSA-N 329.316 1.574 10 10 EDCE Cc1ccc(CNC(=O)CCn2ccnn2)c(O)c1Br 2380739704 NKIVVMXTNBPZCP-UHFFFAOYSA-N 339.193 1.761 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2[C@H](CN)C2(F)F)c(O)c1Br 2380739971 QFGRWGJDFQHCCU-IUCAKERBSA-N 349.175 1.919 10 10 EDCE Cn1cc(CNC(=O)NCc2cc(Br)ccc2O)cn1 804975120 FJUPMSBSCLADAY-UHFFFAOYSA-N 339.193 1.888 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCC(=O)N(c2ccc(C)c(C)c2)C1 808531374 RALKXEILVVTCAK-AWEZNQCLSA-N 331.368 1.748 10 10 EDCE CCOC(=O)CC1(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)CC1 821197283 AEGUGWYYNIAAHC-UHFFFAOYSA-N 344.345 1.528 10 10 EDCE COCCC1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 827575664 RNYAPSSMMQDLDY-UHFFFAOYSA-N 337.395 1.003 10 10 EDCE CN1CCN(C)CC(C(=O)NCc2ccc3c(c2)CCCN3C)C1 906454952 LBUWJDJDTSPSOO-UHFFFAOYSA-N 330.476 1.179 10 10 EDCE CCn1ncc(CNCCN2CCN(c3ccc(OC)cc3)CC2)n1 838919495 FPIXYOABUUQJKC-UHFFFAOYSA-N 344.463 1.218 10 10 EDCE Cc1cc(C(=O)N2CCN(CCO)C[C@H]2C)c(C)n1-c1ccccn1 837193811 ZHPKAMXACCLORD-OAHLLOKOSA-N 342.443 1.628 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@]2(C)CCC(=O)NC2)cc1 844857225 YDJHZCSEFDXDKX-GOSISDBHSA-N 333.432 1.506 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCn3ccnc3)C2)cc1 849224325 CAQZJBHXWPBDGM-CQSZACIVSA-N 329.404 1.470 10 10 EDCE Cc1cc(N(C)C)ccc1CN1CCC[C@@H](S(=O)(=O)N(C)C)C1 840948505 SZJDWAKARNAUHI-QGZVFWFLSA-N 339.505 1.917 10 10 EDCE C[C@@H]1CC[C@H](NCc2ccc(N3CCOCC3)cc2)CS1(=O)=O 850367986 GMCAZWQXQDWAAW-ZBFHGGJFSA-N 338.473 1.579 10 10 EDCE CC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 751358528 ORZMBXMNOIQOAU-INIZCTEOSA-N 349.456 1.061 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2cc(C)c(C)cc2O)C1 862552113 SVSXJMHGJBJXNN-CQSZACIVSA-N 326.462 1.770 10 10 EDCE C[C@H](NC[C@@]12COCCN1C(=O)OC2)c1cc(Cl)ccc1O 866520607 HADXDZJTTNBHTI-BONVTDFDSA-N 326.780 1.917 10 10 EDCE CC1=C(C(=O)N2Cc3cccc(O)c3C2)[C@@H](C)n2nnnc2N1C 871204558 GJFQQWOKDXZRNU-SNVBAGLBSA-N 326.360 1.206 10 10 EDCE Cc1cc(Br)c(O)c(CN2CC[C@@H](S(N)(=O)=O)C2)c1 785984519 IAODNUDUYNRRHM-SNVBAGLBSA-N 349.250 1.326 10 10 EDCE CCN(CC(=O)O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 780479230 YAAXXLYOPFRYBE-ZDUSSCGKSA-N 335.404 1.700 10 10 EDCE CN(C)c1cccc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)c1 787935268 NEQFHNCCZDNCIM-UHFFFAOYSA-N 336.369 1.957 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3COCC[C@H]3OC)C2)cc1 895650863 PIOPROQXUPRUFY-IAOVAPTHSA-N 349.431 1.377 10 10 EDCE CC(C)CNC(=O)N1CCC[C@@H](C(=O)NCc2cc(O)ccc2O)C1 1153885104 KTYOFMPCMMFQQF-CYBMUJFWSA-N 349.431 1.792 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1CCCNC1=O 1320758984 UCSOSVAAUHRVRD-MRXNPFEDSA-N 347.459 1.468 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCC3CC3)C2)cc1 1328952666 CXBTWZRPAQBOCC-CQSZACIVSA-N 331.416 1.306 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cccn2C)cc1C 1268297396 FHCNTIJBJFASCB-HNNXBMFYSA-N 331.416 1.223 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C2CN(C(C)=O)C2)cc1C 1268531341 AVCDMUIEUIHWJN-SNAWJCMRSA-N 345.443 1.244 10 10 EDCE C[C@H](NC(=O)N1C[C@@H](CO)[C@@H](CCO)C1)c1ccc(N(C)C)cc1 1346411273 GQSILQRCEWQWLS-BPUTZDHNSA-N 335.448 1.446 10 10 EDCE C[C@]1(CNCCCO)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1278588754 IDHJPPCBDWCXJK-QGZVFWFLSA-N 347.419 1.673 10 10 EDCE CCNC(=O)CC(=O)NC1CC(CNCc2ccc(OC)c(C)c2)C1 1275220504 NIENWOBHCXXHLZ-UHFFFAOYSA-N 347.459 1.514 10 10 EDCE NCc1ccc(N2CC[C@H](O)C[C@H]2CO)c(F)c1Br 2136083379 DMCRVSYDRPEMPQ-UWVGGRQHSA-N 333.201 1.369 10 10 EDCE O=C(O)[C@]1(CO)CCCN1Cc1ccc(Br)cc1O 2136360228 QPHWGGAVGBQYKR-CYBMUJFWSA-N 330.178 1.566 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)cc1Br 2136828203 ICLIFKPBUMNJJJ-FZZIBODNSA-N 329.238 1.791 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CS(=O)(=O)C1CC1 1540567650 VAGDRYRWXCAUMZ-UHFFFAOYSA-N 336.457 1.822 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@@H]2CC23CC3)cc1C 1700952244 QQEIGZGBQBTGFQ-HOTGVXAUSA-N 332.444 1.713 10 10 EDCE CC(C)(C)NC(=O)N1CCC(NC(=O)Cc2ccc(O)c(O)c2)CC1 1623330941 XWVQCFRATNJBRI-UHFFFAOYSA-N 349.431 1.729 10 10 EDCE CS(=O)(=O)CC1(C(=O)NCc2c(O)ccc3ccccc23)COC1 1558554428 JKGFLDUTJUOCOE-UHFFFAOYSA-N 349.408 1.223 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2CCNC(=O)C2)cc1C 1497565268 PWPOMIGNNFNINC-MJSXRHKHSA-N 345.443 1.292 10 10 EDCE O=C(CSc1nnnn1C1CCCC1)NCc1ccc(O)cc1O 1638352199 LPWJCEGKAUYKPH-UHFFFAOYSA-N 349.416 1.608 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@@]3(CCS(=O)(=O)C3)C2)c(O)c1O 1569161825 GBKFLBAPJBMAFC-MRXNPFEDSA-N 339.413 1.447 10 10 EDCE Cc1cc(C)nc(-n2[nH]c(C(=O)NCc3ccccc3O)cc2=O)n1 1566373915 LVWWPAJQRMXFCT-UHFFFAOYSA-N 339.355 1.208 10 10 EDCE CN(CCCNC(=O)C(F)F)C(=O)c1ccc(N=NC(N)=O)cc1 1743322112 ZLAMNBBSBKYQEI-UHFFFAOYSA-N 341.318 1.692 10 10 EDCE CN1CCCN(c2ccc(CN)c(Br)c2F)CC1=O 231840923 XIYRMTKDXYULME-UHFFFAOYSA-N 330.201 1.715 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCC[C@@H]2CNCCCO)cc1 1667778465 MDUPNQFPAJWNRH-UKRRQHHQSA-N 347.419 1.720 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)C(C)(C)NC(C)=O)cc1C 1674743245 ZQJFLVYBSJTNAN-KGLIPLIRSA-N 349.475 1.901 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(OC)CCOC1 1694638850 XODAIZXYHNSCGU-SFHVURJKSA-N 346.431 1.988 10 10 EDCE O=C(O)C[C@@H](C(=O)O)N1C(=O)/C(=C/c2cccnc2)SC1=S 16904204 DWQANUCFCDJFST-ZKUGPGMGSA-N 338.366 1.211 10 10 EDCE CC(C)c1nnc(NC(=O)CCN2C(=O)CSC2=S)s1 1865768268 OOMNPKFPDSXUQA-UHFFFAOYSA-N 330.460 1.850 10 10 EDCE CCCOc1nonc1C(=O)N1CCN(c2ccc(OC)cc2)CC1 1872676579 ZPLKMJGZLSZFMD-UHFFFAOYSA-N 346.387 1.829 10 10 EDCE CC(C)(C)OC(=O)N1CCn2ncc(C(=O)NCCN=[N+]=[N-])c2C1 1965101869 IMFKUIUALDWUFZ-UHFFFAOYSA-N 335.368 1.674 10 10 EDCE CNCc1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)cc1Br 2149910911 BLJZTYRNVPJWGO-CHWSQXEVSA-N 343.265 1.596 10 10 EDCE CC(C)(C)OC(=O)N1CCC(OCC(=O)N2CC(N=[N+]=[N-])C2)CC1 2010389645 SLTQHHGFNQPXAD-UHFFFAOYSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010405070 FYZSDGRZGZWNKZ-GRYCIOLGSA-N 339.396 1.516 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1ccccc1O 2017514751 KCBLFBFNMZHQBF-SUNKGSAMSA-N 338.404 1.844 10 10 EDCE CNCc1ccc(N2CCS(=O)(=O)[C@H](C)C2)cc1Br 707141022 GKWOTENACNYDKB-SNVBAGLBSA-N 347.278 1.792 10 10 EDCE CNC[C@@H]1C[C@H](F)CN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2058940806 NEWWOUPXBZZFAG-WMZOPIPTSA-N 347.434 1.695 10 10 EDCE CN(C)C[C@@H]1CN(Cc2ccc(Br)cc2O)CCO1 824477840 GGWIUTXWCYRTDV-CYBMUJFWSA-N 329.238 1.917 10 10 EDCE COC(=O)NC[C@H]1CCN1c1cc(Br)c(CN)cc1F 2187292955 LEEALGXFERQOKU-SECBINFHSA-N 346.200 1.982 10 10 EDCE C[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C[C@@H]1NC(=O)C(F)(F)F 2044625747 YWFZLKNZZWRZJZ-GWCFXTLKSA-N 343.349 1.727 10 10 EDCE Cc1nnc(CCNCc2c(O)cccc2Br)n1C 2104135305 GNMVTWYNNZFPRG-UHFFFAOYSA-N 325.210 1.924 10 10 EDCE NCc1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)cc1Br 2090120548 ZDVZXLUZFPUEJC-OKILXGFUSA-N 327.222 1.089 10 10 EDCE CC(C)(C)OC(=O)NCc1n[nH]cc1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2214417665 AINYTZBSQZVDCF-VIFPVBQESA-N 335.368 1.959 10 10 EDCE COC[C@@H]1[C@@H](O)[C@@H](O)CN1c1ccc([C@@H](C)N)cc1Br 2234066918 LODCVMCVWFOERD-ULTHFGNCSA-N 345.237 1.026 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@]2(C(=O)NCCN=[N+]=[N-])CO[C@H]1C2 2243126653 LEROALQFPDLFSB-BHDSKKPTSA-N 325.369 1.485 10 10 EDCE Cn1cc(C(N)=O)cc1C(=O)NCc1ccc(N2CCCC2)cc1 176429419 BIRPRQHGLOSPRW-UHFFFAOYSA-N 326.400 1.654 10 10 EDCE O=C1CC[C@H](COC(=O)/C=C/c2ccc(N3CCOCC3)cc2)N1 108909021 MCDWKHTWRDZCHX-WEJQMCOXSA-N 330.384 1.358 10 10 EDCE Cc1ccc(C(=O)N2CCN(C[C@@H]3CCCCN3C)CC2)c(O)c1O 179486747 VNNKPSLGHNJNHL-HNNXBMFYSA-N 347.459 1.648 10 10 EDCE COc1ccc(N2CCN(c3ncnc(NN(C)C)c3N)CC2)cc1 40727719 LFYATFZFAGWIST-UHFFFAOYSA-N 343.435 1.283 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(C(C)(C)C(N)=O)CC2)c1O 271897921 YQLYBFWTPFNJHO-UHFFFAOYSA-N 325.840 1.736 10 10 EDCE CCOC(=O)C1(O)CCN(Cc2cc(Cl)cc(OC)c2O)CC1 273726283 JLMJMMBNLCHUQD-UHFFFAOYSA-N 343.807 1.944 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@@H]([C@H]4CCCO4)C3)cc2N1 376192457 ZFGUVKRJXPAYEC-UKRRQHHQSA-N 349.343 1.310 10 10 EDCE COc1cccc(CNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3C)C2)c1O 374201222 IAOQBSUVMVLICI-RAIGVLPGSA-N 333.388 1.209 10 10 EDCE Cc1ccc(CN(C)C(=O)c2nonc2N)c(O)c1Br 2381129963 RXPUBQKCSSCVOA-UHFFFAOYSA-N 341.165 1.701 10 10 EDCE CCOc1ccc(CNCCCN2CCCS2(=O)=O)c(O)c1 729684350 SOLFBKWIRQCQAH-UHFFFAOYSA-N 328.434 1.306 10 10 EDCE CCc1nc2n(n1)C[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)CC2 588407953 FMDYQSVDIQCACQ-HXUAIIEXSA-N 328.372 1.396 10 10 EDCE COc1cc(Br)cc([C@@H](C)NC[C@@H]2CNC(=O)C2)c1O 848553452 SVHGCFGBLCPKIZ-RKDXNWHRSA-N 343.221 1.950 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)[C@@H]4C[C@H](F)CN4C3=O)C2)cc1 849358050 RFUMYJMJPYCZMG-LNSITVRQSA-N 333.363 1.649 10 10 EDCE C[C@H](NC(=O)C(=O)NCC[C@@H]1CCCNC1)c1ccc(N(C)C)cc1 842203851 XWXFYMNZJDYOIV-GJZGRUSLSA-N 346.475 1.436 10 10 EDCE Cc1cc(Cl)cc(CN2CCC[C@H](C(=O)NCCN)C2)c1O 843048031 JPAJVEJYTZELFO-LBPRGKRZSA-N 325.840 1.641 10 10 EDCE Cn1cnc(CCN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c1 842258470 ONCVHLQGQIJVQV-UHFFFAOYSA-N 348.790 1.786 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)CC1=O 743813789 HKMUGHMEOZNEDO-INWMFGNUSA-N 330.432 1.561 10 10 EDCE CCN1CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 854301695 CQVYJVGBIVGDPJ-HNNXBMFYSA-N 332.448 1.621 10 10 EDCE COC[C@]1(C(=O)OC)CCCN1Cc1cc(F)cc(C(C)=O)c1O 852633457 RPSUBMWETBPCER-KRWDZBQOSA-N 339.363 1.888 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3ccon3)C2)cc1 850537760 UCBKBYIFHMJTIT-LLVKDONJSA-N 330.344 1.017 10 10 EDCE N=c1cc[nH]cc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 852916343 FIVCOIWNUVQQIM-UHFFFAOYSA-N 326.400 1.385 10 10 EDCE CCN1C[C@@H](C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 855230492 DPNDFXOCYWHSTF-KBPBESRZSA-N 331.416 1.259 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1C[C@H]1OC 935241886 CRHOEXQAOPLIOO-DGCLKSJQSA-N 327.764 1.582 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CC[C@@H](C)NC3)C2)cc1 861648616 YJVMINXFGNXPKM-OAGGEKHMSA-N 346.475 1.961 10 10 EDCE Nc1ccc(CCNC(=O)N2CCC(CO[C@H]3CCNC3)CC2)cc1 861640469 LYHYNANMTPAIHP-SFHVURJKSA-N 346.475 1.611 10 10 EDCE O=C(c1cc(O)cs1)N1CC(S(=O)(=O)NC2CCCC2)C1 782127517 AMZOCIZSCIZSOV-UHFFFAOYSA-N 330.431 1.140 10 10 EDCE O=S(=O)(NCc1cc(Br)ccc1O)c1cnc[nH]1 796192293 XMPOJLXXABJORJ-UHFFFAOYSA-N 332.179 1.356 10 10 EDCE C[C@H]1OCC[C@H]1N(CCO)CC(=O)N(C)Cc1ccc(N(C)C)cc1 796580814 SWYOJBYOOPAPMG-CRAIPNDOSA-N 349.475 1.183 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(CO)cc2)c1 1143541697 OKTHUQGASYOYNL-UHFFFAOYSA-N 336.369 1.508 10 10 EDCE CCO[C@H]1C[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1347558431 FCDFICRPLRSSCT-XNRPHZJLSA-N 333.432 1.614 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)CNC(C)=O)C(C)(C)C)cc1C 1507877340 FAAXAEQYBSXHCI-QGZVFWFLSA-N 349.475 1.760 10 10 EDCE Cc1cc(C(=O)NCc2c(O)cccc2O)c2c(O)nn(C)c2n1 1456234052 HLLMJFPKWPPTQI-UHFFFAOYSA-N 328.328 1.324 10 10 EDCE C[C@H](O)[C@H](NC(=O)C1CCCC1)C(=O)NCc1ccc(N(C)C)cc1 1463728551 WABDACBRAQMHLQ-GUYCJALGSA-N 347.459 1.425 10 10 EDCE CC(C)(C)OC(=O)[C@]1(C(=O)NCc2cccc(O)c2O)CCCO1 1633515566 GNPOHSGEGJMELK-QGZVFWFLSA-N 337.372 1.605 10 10 EDCE CO[C@@H]1COC[C@@H]1NC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1635979601 FYLOFIDWXGEHBX-DLBZAZTESA-N 333.432 1.842 10 10 EDCE CC[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)C[C@@H](C)S1(=O)=O 1636136216 DQRCIIPAAKFWJC-ZYHUDNBSSA-N 327.402 1.064 10 10 EDCE O=C(NC[C@@H]1CS(=O)(=O)c2ccccc2O1)c1cccc(O)c1O 1639751886 XURLCUIOICRNHC-SNVBAGLBSA-N 349.364 1.063 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)c2nonc2C)C2CC2)cc1C 1723355838 MEMCNSXMKIIGHD-HNNXBMFYSA-N 344.415 1.993 10 10 EDCE CCn1cc(C(=O)NC[C@@H](C)CNCc2ccc(OC)c(C)c2)nn1 1568201517 LSMXTENMSXYERQ-ZDUSSCGKSA-N 345.447 1.771 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@H](C)NC(C)=O)C2)cc1C 1731469367 HDYRYWQVYCUTLD-VBNZEHGJSA-N 333.432 1.265 10 10 EDCE CCC[C@@H](CCCS(C)(=O)=O)C(=O)NCc1ccc(O)cc1O 1570462225 KAYJPBSZXNSQAP-LBPRGKRZSA-N 343.445 1.955 10 10 EDCE COCCCC(=O)NC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1745820864 DHOMLNXEHXCLNR-UHFFFAOYSA-N 347.375 1.216 10 10 EDCE C[C@@H]1OC[C@]2(CC[C@H](CNC(=O)Cc3ccc(O)c(O)c3)O2)[C@H]1C 1652141343 ZJXOQGLYMRJKRV-PZOITXESSA-N 335.400 1.729 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@]1(O)CCCc2ccccc21 1586024765 MWNYKEARIBYNKN-LJQANCHMSA-N 327.380 1.981 10 10 EDCE O=C(NCc1c(O)cccc1F)c1ccc2c(c1)C(=O)NCCO2 1596916178 BQHQJNRRZOEXNO-UHFFFAOYSA-N 330.315 1.584 10 10 EDCE COc1ccc(CNC(=O)NCc2nnc(O)n2C2CC2)c(O)c1 1683607029 UVUVAFBXBMSDNA-UHFFFAOYSA-N 333.348 1.032 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCc2nc(C)no2)cc1C 1690608420 LXVQFLASXITXAL-ZDUSSCGKSA-N 346.431 1.922 10 10 EDCE CCSc1nnc(NC(=O)CN2C(=O)[C@@H](C)SC2=S)s1 11635519 FMHRXMFXWAMMCF-RXMQYKEDSA-N 348.500 1.837 10 10 EDCE O=C(CN1C(=O)/C(=C/c2cccc(F)c2)SC1=S)NCCO 16905434 AOPKDWZLSPLYCH-XFFZJAGNSA-N 340.401 1.135 10 10 EDCE O=S(=O)(C[C@@H]1CC[C@@H](C2CC2)O1)NCc1ccc(O)cc1O 1212223345 PEACRXGBJPZBOR-ZFWWWQNUSA-N 327.402 1.475 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985100565 HQACDKHLXRGAAT-VWYCJHECSA-N 327.385 1.562 10 10 EDCE CC1(O)CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)CC1 160498227 QUCVXCWULTXLNG-LBPRGKRZSA-N 340.221 1.752 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)[C@H](CCO)C2)c(Br)c1 2149906864 BBIRGAGUJPWNIS-RTXFEEFZSA-N 344.249 1.930 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCN1C(=O)COc1ccc(N)cc1 1999446433 XJYYQSILVKXNBN-CYBMUJFWSA-N 335.404 1.773 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 2010402763 VRXWDISSNZSEBO-NEPJUHHUSA-N 341.412 1.763 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@]34C[C@H]3COC43CCC3)c2n1 2065122970 SRDFEKNZQPPTRC-MEDUHNTESA-N 328.372 1.432 10 10 EDCE O=C1Nc2cc(N3CC[C@@H]4C[C@]4(O)C3)c(Br)cc2[C@@H]1O 2171023617 DRIJETLHNCOXGP-UEXBWHTRSA-N 339.189 1.396 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H](C(=O)Nc2ccc(N)cc2)C1 1910945529 NFOKXZXRBWCLBH-FZMZJTMJSA-N 335.404 1.825 10 10 EDCE CCCn1nnnc1CN(C)c1ccc(CN)cc1Br 2196249535 BXBBSAWSDLACIS-UHFFFAOYSA-N 339.241 1.941 10 10 EDCE CNC(=O)[C@H]1[C@@H](C)CCN1c1ccc(CO)c(Br)c1 2090261516 ICJBCGBGEMGBJM-TVQRCGJNSA-N 327.222 1.902 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(NCc2ccc(O)c(O)c2O)C1 2216762201 QJLJEJWKBGNCTC-GTNSWQLSSA-N 336.388 1.902 10 10 EDCE Cc1cc(C=C2NC(=O)N(CC(=O)O)C2=O)c(C)n1-c1cccnc1 2293343973 JCHZYEUHFXNMMT-UHFFFAOYSA-N 340.339 1.466 10 10 EDCE COC(=O)C=Cc1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@H]4O)c([N+](=O)[O-])c1 2312513733 PTCIAUKHTGWFFV-HKAKVCCISA-N 344.367 1.987 10 10 EDCE C[C@@H](O)[C@@H](C(=O)O)N1C(=O)C(=Cc2ccccc2F)SC1=S 2323823875 VBKZOPISJXSHJH-HQJQHLMTSA-N 341.385 1.861 10 10 EDCE CC[C@H]1CN(Cc2cc(OC)c(OC)cc2O)CCN1C[C@@H](C)O 180085422 ZBNMGAOLZJWZKZ-HIFRSBDPSA-N 338.448 1.686 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCCNC(=O)c1ccccc1 45559734 XEVHYPBVQAHOTJ-UHFFFAOYSA-N 327.384 1.964 10 10 EDCE CCN1CCN(CC(=O)NCc2c(O)ccc3c2CCCC3)CC1 88391471 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XFYLSKUDPBSMDY-UHFFFAOYSA-N 345.399 1.605 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@](C)(CCF)C(=O)O)cc1F 849237286 UWITVTHVRPNJKF-OAHLLOKOSA-N 329.347 1.894 10 10 EDCE CO[C@H](COC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CCC1 849712367 LQCHLLQBVCTSAS-CQSZACIVSA-N 343.401 1.736 10 10 EDCE CC1CCN(c2ccc(CNC(=O)C[C@@H](C)NC(N)=O)cc2)CC1 847473868 CLIAUKFBJYZFBZ-CQSZACIVSA-N 332.448 1.986 10 10 EDCE C[C@@H]1COCC[C@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852281081 OXAHNJPULWWTCZ-RDTXWAMCSA-N 347.459 1.872 10 10 EDCE c1cc(N2CCOCC2)ccc1CN[C@H]1CCOC12CCOCC2 924749644 JXVJHURXDDQABO-SFHVURJKSA-N 332.444 1.951 10 10 EDCE O=C(NCc1c(O)cccc1F)NC[C@H](n1cncn1)C(F)(F)F 923611037 NFENIUHMPSQMEF-NSHDSACASA-N 347.272 1.726 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@H]3CC[C@H]2[C@@H]2CNC[C@@H]32)cc1 866696385 IKHIWGAXBRIZLS-LULLPPNCSA-N 342.487 1.299 10 10 EDCE O=C(NC[C@@H](CO)[C@@H]1CCOC1)c1cc2cc(O)c(O)cc2s1 897633126 ZLHDIVQKMICHPX-KOLCDFICSA-N 337.397 1.687 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@]1(CO)CCc2ccccc21 1164473682 WFOTVJMUUYLGST-IBGZPJMESA-N 327.380 1.633 10 10 EDCE O=C(Cn1nc2ccccn2c1=O)NCc1cc(Cl)ccc1O 1165499030 UKJIHQSGTAGFST-UHFFFAOYSA-N 332.747 1.171 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H]4CCN(C)[C@H]4C3)C2)cc1 1312993399 AHTUNALFINROFS-VKJFTORMSA-N 344.459 1.619 10 10 EDCE CNC(=O)[C@@H](C)N(C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1268758354 BWQIVEVJTUQCNX-WDEREUQCSA-N 348.407 1.034 10 10 EDCE Nc1ccc(OCCNC(=O)c2cc(Br)n[nH]2)cc1 2134204486 CXTJUTIZKLSUOB-UHFFFAOYSA-N 325.166 1.563 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2cn(C)c(O)n2)cc1C 1505687037 YEZLVNZNCQVOOQ-QWHCGFSZSA-N 346.431 1.739 10 10 EDCE C[C@@H](CO)N(Cc1ccccc1)C[C@H](O)COc1ccc(N)cc1 1914368739 VUWRKULALNRXSL-YJBOKZPZSA-N 330.428 1.892 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)C2(C(N)=O)CC2)cc1C 1282183466 DYUWTCKZWCQJMU-OLZOCXBDSA-N 333.432 1.252 10 10 EDCE Cn1ccnc1N1CCC(NC(=O)Cc2ccc(O)c(O)c2)CC1 1467748267 KVQXAXMRQIXLTO-UHFFFAOYSA-N 330.388 1.159 10 10 EDCE CC(C)(F)C(=O)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1705274249 PKUFPPIEEJBFGK-UHFFFAOYSA-N 349.366 1.976 10 10 EDCE Cc1cc(C(=O)N[C@@H](C(N)=O)c2ccccn2)c(C)n1-c1ccccn1 1624832193 QCLWYSRANFMQJN-QGZVFWFLSA-N 349.394 1.841 10 10 EDCE CC[C@@H](CNC(=O)[C@@H](C)NC(C)=O)NCc1ccc(OC)c(C)c1 1715050335 LTDXNGOLLBVGHE-CJNGLKHVSA-N 335.448 1.513 10 10 EDCE CCC1(NCCO)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1724891687 VKRSHXGJJTZCCV-UHFFFAOYSA-N 347.419 1.816 10 10 EDCE C[C@H](C(=O)NCc1c(O)cccc1O)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 1647177500 BLZRJRBPQBZBQJ-IJLUTSLNSA-N 346.383 1.278 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@@H]2CCN(C)C2=O)cc1C 1663999607 DOGFRAHOTKPTIB-INIZCTEOSA-N 347.459 1.420 10 10 EDCE COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1597633844 BTFVHHDFVLNWGN-STQMWFEESA-N 348.359 1.642 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccoc2C)cc1C 1699039011 IAWOKBYUXWKNQW-HNNXBMFYSA-N 332.400 1.786 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)/C=C\C(=O)O)c2nccn2C)cc1 169813564 ZOKAJDUCLOHLCF-HLRDLLSLSA-N 328.372 1.333 10 10 EDCE COC(=O)c1cccc(NC(=O)CCN2C(=O)CSC2=S)c1 1865769045 TUTIUEULFJZLTF-UHFFFAOYSA-N 338.410 1.662 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](N)CC(=O)O 1951454432 NHHKZUWYXZIRFW-GHMZBOCLSA-N 340.376 1.336 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C[C@H](O)C(=O)O 1951546579 UVTILTCOGOWCNB-GWCFXTLKSA-N 341.360 1.369 10 10 EDCE O=C1NCCCN(c2ccc(CO)cc2Br)CC1(F)F 2152792470 YPPFFYYCLBLPLY-UHFFFAOYSA-N 349.175 1.903 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1C[C@@](O)(CNC(=O)OC(C)(C)C)C1 2010402240 NZIBQYRYWPTGSI-FUKZOUPISA-N 341.412 1.811 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CC[C@H]1NC(=O)c1cc(O)c(O)c(O)c1 2015121142 AOVSQLBJDHYNFB-ZJUUUORDSA-N 338.360 1.589 10 10 EDCE CCN(CCOCCO)c1cc(Br)c(CN)cc1F 311405294 IUDBYPSWEXERLI-UHFFFAOYSA-N 335.217 1.882 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)[C@@H](CO)C2)cc1Br 316620525 XMSQLCRCFLXXBY-IUODEOHRSA-N 343.265 1.737 10 10 EDCE O=C(O)[C@H]1COCCN(Cc2c(O)cccc2Br)C1 706628720 XMKUYVMKYMWOCA-SECBINFHSA-N 330.178 1.688 10 10 EDCE COc1cccc2c1CN(C(=O)c1cnn3c(O)cc(C)nc13)CC2 2061989014 FHHCKOJZWQUGAV-UHFFFAOYSA-N 338.367 1.950 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3Cc4ccccc4N(C)C3)c2n1 2063208939 RAVBKIOQLUQWQR-CYBMUJFWSA-N 337.383 1.534 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@H](O)C[C@@H]3c3ccccc3)c2n1 2065007378 RVGPGPUIXVOMKI-UKRRQHHQSA-N 338.367 1.691 10 10 EDCE NCc1ccc(N2CC[C@H](C(CO)CO)C2)c(F)c1Br 2170642672 SILMWIBJCNFUBL-JTQLQIEISA-N 347.228 1.474 10 10 EDCE COC(=O)[C@H](NCCCN=[N+]=[N-])c1c(C)nn(C)c1Br 2197474564 RORWBPSEVOBINB-SECBINFHSA-N 345.201 1.995 10 10 EDCE CN(C)C[C@@H]1CN(c2ccc(CN)cc2Br)CCO1 2113979779 MLKVXSKKGRODGA-GFCCVEGCSA-N 328.254 1.675 10 10 EDCE CNC(=O)c1cncc(C=CC(=O)NCc2ccc(N(C)C)cc2)c1 2297520035 HQGHQIYYMQGREW-UHFFFAOYSA-N 338.411 1.837 10 10 EDCE CCc1cccc(N(C)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c1 493821517 WULQFWRXWYCENU-KTKRTIGZSA-N 327.384 1.323 10 10 EDCE CCCN(CC(=O)O)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2308743186 ZUNPWJQGUGRSGV-UHFFFAOYSA-N 332.400 1.860 10 10 EDCE CN(C)c1ccc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)cc1 179890082 FOUWUQMFDJXDNG-KRWDZBQOSA-N 331.460 1.823 10 10 EDCE CN(C)c1ccc([C@@H](O)[C@H](N)c2c(Br)ncn2C)cc1 2362541900 HJVYMILZXAHHGP-DGCLKSJQSA-N 339.237 1.982 10 10 EDCE CCN(CC)c1ccc(CNC(=O)c2cccnc2C(N)=O)cc1 278498292 VEYYGERCXOBZPC-UHFFFAOYSA-N 326.400 1.957 10 10 EDCE Cc1ccc(CNC[C@H]2CN3CCN2CC3)c(O)c1Br 2380805135 ORARLQKHRLQJHF-ZDUSSCGKSA-N 340.265 1.553 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccccc1-n1cnnn1 808095520 IEBQPVNZIXOFFP-UHFFFAOYSA-N 344.371 1.784 10 10 EDCE C[C@H](C[S@@](C)=O)NC(=O)NCc1cc(Br)ccc1O 805280072 YINNLDHYUAUWSL-LILOVNGRSA-N 349.250 1.721 10 10 EDCE COCCc1cc(N2C(=O)CN(Cc3ccccc3O)C2=O)n(C)n1 819008703 YSRCPGDXMSFHJT-UHFFFAOYSA-N 344.371 1.283 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@H](O)C3CCOCC3)C2)cc1 819584113 DIJIIKQSJNVXCO-KBXCAEBGSA-N 348.443 1.425 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(C)c(O)c1O)C2 819790850 STECKHWYFWQJTR-DRZSPHRISA-N 334.372 1.755 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3CCNC(=O)CC3)C2)cc1 819592010 ZOXXAFZPCQBSPL-GJZGRUSLSA-N 345.443 1.554 10 10 EDCE CC[C@H](CS(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1)OC 817127647 FDQIQMMRTUCFEV-OAHLLOKOSA-N 342.461 1.572 10 10 EDCE CO[C@H](C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1 823834319 ASJZRBCDAPGQHL-KYJSFNMBSA-N 348.443 1.752 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@@H]3CCC[C@H]3O)C2)cc1 824682034 UGNUMJBFCPDCJN-RLFYNMQTSA-N 347.459 1.982 10 10 EDCE C[C@@H]1CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC[C@@H]1O 588530693 OZZWVAHJNLHLPE-DYKRAQSHSA-N 330.428 1.766 10 10 EDCE CN(C)c1ccc([C@H](N)CNCc2cnnn2[C@H]2CCCNC2)cc1 903917977 PMKAGRLCIGQFGD-FUHWJXTLSA-N 343.479 1.058 10 10 EDCE CO[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@@H]1C 839219854 VDMUSQLOTFHQFX-WMLDXEAASA-N 347.459 1.594 10 10 EDCE C[C@@H]1CNCC[C@@H]1NC(=O)NCc1cccc(Br)c1O 841988887 NMAIREVCDBHZMI-SKDRFNHKSA-N 342.237 1.952 10 10 EDCE Oc1cc2c(cc1CN1CC[C@@H](Nc3ncccn3)C1)[C@@H](O)CO2 842617775 WGUZXSRCLNTAKN-DOMZBBRYSA-N 328.372 1.294 10 10 EDCE C[C@H]1CCC[C@@H](C)N1CCNC(=O)C(=O)NCCc1ccc(N)cc1 842238602 UHTHQRQRYFKUOO-GASCZTMLSA-N 346.475 1.307 10 10 EDCE COc1cc(Br)cc([C@H](C)NCC2(CO)COC2)c1O 848535885 LOYDWKLKENHZDE-VIFPVBQESA-N 346.221 1.823 10 10 EDCE Cc1cc(Cl)cc(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1O 843426328 SRMNQWSVZBOEGZ-HNNXBMFYSA-N 345.848 1.744 10 10 EDCE CO[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCOC1 856208211 AJGPYJFXOYQLHD-YJBOKZPZSA-N 348.443 1.315 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2c(C)cnn2C)c1 850366241 LRSUBEAJSDCFFC-SNVBAGLBSA-N 332.360 1.259 10 10 EDCE CO[C@@H](CNC(=O)NCc1ccc2c(c1)CCCN2C)[C@@H]1CCOC1 852438993 ARIIEXJJQQNIIX-AEFFLSMTSA-N 347.459 1.920 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])n[nH]3)C2)cc1 855224225 JBFHFYWPXVLBPP-SNVBAGLBSA-N 331.332 1.335 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)C2)cc1 858600083 SSJJPYFEZAXYOB-DVOMOZLQSA-N 345.399 1.088 10 10 EDCE NC(=O)[C@@H]1CCC[C@H](C(=O)NCc2ccc3cccnc3c2O)C1 862026010 FCIJTDXRNRPRAO-OLZOCXBDSA-N 327.384 1.848 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CN(Cc2ccccc2)CC12CCC2 860425286 CSRFBVZPIVQUHS-MRXNPFEDSA-N 329.396 1.990 10 10 EDCE CCn1nccc1S(=O)(=O)NCCCSc1nccs1 770247295 SLIBVQDIISXUEE-UHFFFAOYSA-N 332.476 1.820 10 10 EDCE C[C@H](NC(=O)N1CC[C@]2(CNC(=O)C2)C1)c1ccc(N(C)C)cc1 789213746 SCYFFBVHCIOGRA-UGSOOPFHSA-N 330.432 1.735 10 10 EDCE COc1cc(C)cc(CN[C@H]2CCC[C@H]2CNS(C)(=O)=O)c1O 894671768 CJZKDIMGIDZGSV-JSGCOSHPSA-N 342.461 1.517 10 10 EDCE COC(=O)c1c(CN(C)Cc2nc[nH]n2)c2cc(F)ccc2n1C 894035931 PBCARTITDAEAKO-UHFFFAOYSA-N 331.351 1.854 10 10 EDCE CC1(C)C[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)CCS1(=O)=O 1157724590 DRQRCKPWOSDBJZ-RNZFLTOJSA-N 339.413 1.583 10 10 EDCE OCC1(O)CN(c2ccc(CNC3CC3)c(Br)c2)C1 2115306462 ROFRAZOBINWSAC-UHFFFAOYSA-N 327.222 1.245 10 10 EDCE COCC1(CCNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 1326109265 AVUVYSYZKFRYOB-CQSZACIVSA-N 347.459 1.863 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@]2(C)CC2(F)F)cc1 1261680016 LLPUWNQNRGODSO-MRXNPFEDSA-N 339.386 1.920 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)Cn2cncn2)cc1C 1275564316 YRTZYMPNQHUKOA-KGLIPLIRSA-N 331.420 1.278 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)C(C)(C)C(N)=O 1915545966 YBCYPGMZJLPSLG-JTQLQIEISA-N 341.209 1.101 10 10 EDCE CCO/C=C/[C@@](O)(CNC(=O)Cc1ccc(O)c(O)c1)C(F)(F)F 1450334301 BYRCOEXYZSDCFM-VBROQKIQSA-N 349.305 1.600 10 10 EDCE NS(=O)(=O)c1ccc(CCCNC(=O)c2cc(O)cs2)cc1 1606745536 BJCHBVHVHYVKDD-UHFFFAOYSA-N 340.426 1.464 10 10 EDCE Cc1nnc2n1[C@](C)(C(=O)NCc1ccc(N(C)C)cc1)COC2 1548341691 IPQSPOMGZSXCNM-KRWDZBQOSA-N 329.404 1.214 10 10 EDCE COCC(=O)Nc1cccc(CNC(=O)Cc2ccc(O)c(O)c2)c1 1540781374 PJJMPKBCHQAZPX-UHFFFAOYSA-N 344.367 1.542 10 10 EDCE COc1cccc(CNC(=O)c2ccn(CCn3cccn3)n2)c1O 1545681775 BCVGWVIHDNKFCG-UHFFFAOYSA-N 341.371 1.424 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)C(C)(C)F)cc1C 1717043244 ARSUFOILJUUCRW-UHFFFAOYSA-N 326.412 1.662 10 10 EDCE CC(=O)N/C(=C\c1cccs1)C(=O)NCc1ccc(O)cc1O 1626848008 HLWVSPZJTYGWGR-ZSOIEALJSA-N 332.381 1.953 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)C(C)(C)C(N)=O)C2CC2)cc1C 1490679709 YLISBBUSXJNTSH-HNNXBMFYSA-N 347.459 1.500 10 10 EDCE COc1cc(C(N)=O)ccc1NC(=O)/C=C/c1ccc(O)c(O)c1 1637890438 JKWKKBQDTMHXAA-XVNBXDOJSA-N 328.324 1.857 10 10 EDCE CC[C@H](OC)C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1491626680 FTFUOQYMJKZNCC-ZDUSSCGKSA-N 349.391 1.510 10 10 EDCE COc1ccc(CNCC[C@H]2CCCN(C(=O)CC(N)=O)C2)cc1C 1568050928 URPOXYLBMOWOAM-OAHLLOKOSA-N 347.459 1.597 10 10 EDCE COc1cc(C=O)ccc1OCC(=O)NCc1cc(O)ccc1O 1643879306 KCODCNJITKKZMY-UHFFFAOYSA-N 331.324 1.614 10 10 EDCE CCON(C)C(=O)CNC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1674148261 SCPCSNHUFCGKDP-UHFFFAOYSA-N 348.447 1.838 10 10 EDCE COc1ccc(CN[C@H]2COC[C@H]2NC(=O)OC(C)(C)C)c(O)c1 1944917136 IGMOLTXQJSASFP-UONOGXRCSA-N 338.404 1.783 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1COC[C@@H]1NCc1cccc(O)c1O 1948520440 VDDNYRFAJCGHID-STQMWFEESA-N 338.404 1.727 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2[C@H](C(=O)NCCCCN=[N+]=[N-])[C@H]21 1964944420 PUOQIQCURGFEHG-IJLUTSLNSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CCn2cnc(C(=O)NCCN=[N+]=[N-])c2C1 1965103058 XGOGWEZGVHXTHK-UHFFFAOYSA-N 335.368 1.674 10 10 EDCE CC1([C@@H]2CCCCN2S(=O)(=O)Cc2ccc(N)cc2)OCCO1 2145810123 SUDDIAJWKNKRRE-HNNXBMFYSA-N 340.445 1.716 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C 1985102824 MHWVPGQOYUUQAC-NSHDSACASA-N 327.385 1.781 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(NCc2ccc(F)cc2O)C1 1994523830 CUFPGQKOORQRLI-UHFFFAOYSA-N 326.368 1.603 10 10 EDCE C[C@H]1CN(Cc2cc(N)ccc2O)CC[C@@H]1NC(=O)C(F)(F)F 1999437668 RNFADRAABBPOPG-CABZTGNLSA-N 331.338 1.863 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010404915 VPCDVPLSORRUBY-SRVKXCTJSA-N 341.412 1.952 10 10 EDCE O=C(NC[C@@H]1CCN1Cc1ccccc1)c1cc(O)c(O)c(O)c1 2015075885 XMSGZQLLSJZQIB-AWEZNQCLSA-N 328.368 1.808 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC(C)(N4CCC4)CC3)c2n1 2064348012 BLVNOJHMIXUBOF-UHFFFAOYSA-N 329.404 1.444 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC[C@@H](C4CCOCC4)C3)c2n1 2064859095 ASJTXYFBAPJAHQ-CYBMUJFWSA-N 330.388 1.632 10 10 EDCE CN1C(=O)N[C@@H]2CN(c3ccc(CO)cc3Br)CC[C@H]21 2171298603 XHPKBYPBDUHSOK-DGCLKSJQSA-N 340.221 1.544 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H]2CN3C(C)=O)cc1Br 2192280723 AMHGLECSPMOCMN-KGLIPLIRSA-N 338.249 1.978 10 10 EDCE CNCc1ccc(N2CC[C@@H](OCCO)C2)cc1Br 2109123099 NPBHGPLGJYWGKY-CYBMUJFWSA-N 329.238 1.756 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)NCc1ccccc1O 2089755435 YBMRPTKGPZQZGW-UHFFFAOYSA-N 346.206 1.367 10 10 EDCE COc1ccc(N2CCC(O)(CO)CC2)c(OC)c1Br 2234902096 KNJOCWFANGWBLD-UHFFFAOYSA-N 346.221 1.790 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)OC 2300526455 SQGWQYRDKJEJHK-JTQLQIEISA-N 343.384 1.602 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@@H]2C[C@@H]21 2303769549 CEYYKDZSNFNSEL-PEDHHIEDSA-N 336.432 1.898 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2329329372 UEWXVWRUKHUVPS-KEHYKAFYSA-N 328.206 1.433 10 10 EDCE Cc1ccc(CN(CC(=O)O)CC(=O)O)c(O)c1Br 2352689149 XKAMCHOEXKSLND-UHFFFAOYSA-N 332.150 1.434 10 10 EDCE Nc1ccc(CS(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 309735495 BVKWZMWIYKHPMQ-UHFFFAOYSA-N 345.468 1.916 10 10 EDCE CC[C@H](CNC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1)OC 1275046521 WFJREPLDXQCCHS-BXUZGUMPSA-N 335.408 1.982 10 10 EDCE COc1ccc(O)c(CNC[C@@]2(CO)COCC3(CCC3)N2C)c1 529645185 RIVVHGWXLBNRJM-GOSISDBHSA-N 336.432 1.106 10 10 EDCE CS(=O)(=O)NC[C@H]1CCC[C@H]1NCc1cccc(Cl)c1O 800541575 NBNHSXYQARQHDW-ZWNOBZJWSA-N 332.853 1.853 10 10 EDCE Cn1cccc1C(=O)C(=O)NCc1cc(Br)ccc1O 807740623 VJFZWEQWIDHXPN-UHFFFAOYSA-N 337.173 1.992 10 10 EDCE O=C1CC[C@H](C(=O)NCc2cccc(Br)c2O)CCN1 816496498 MCLBJWGMSNPSSC-VIFPVBQESA-N 341.205 1.687 10 10 EDCE C[C@@H]1CCN(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 816891095 IDMIDRJQHKQFJG-CQSZACIVSA-N 349.450 1.745 10 10 EDCE CCN(OC)C(=O)CNC(=O)N[C@H](C)c1cc(OC)ccc1O 827556932 YWUKIUKJNXOXTQ-SNVBAGLBSA-N 325.365 1.171 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1COC2(CCC2)C1 830080382 VBPARRKHRPAXFN-HNNXBMFYSA-N 346.427 1.959 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](O)C3CCOCC3)CC2)cc1 746093999 PUOIGELMKFTFSC-QGZVFWFLSA-N 334.416 1.131 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN1C/C=C/c1ccc(N(C)C)cc1 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IDTUAPCLEHXOEP-CYBMUJFWSA-N 348.399 1.794 10 10 EDCE NS(=O)(=O)C[C@H]1CCCN(Cc2cc(Cl)cc(F)c2O)C1 775687904 KPIANWDGSDNTGE-VIFPVBQESA-N 336.816 1.685 10 10 EDCE Cn1nccc1[C@@]1(O)C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)cs1 899777108 RIPZQOIICQOSQL-CDMJZVDBSA-N 333.413 1.842 10 10 EDCE C[C@@H](O)c1ccc(N(C)Cc2nnnn2C)cc1Br 707631412 SVKZOMFPRSRFBH-MRVPVSSYSA-N 326.198 1.662 10 10 EDCE CN(c1ccc(CN)c(Br)c1)C1CC(S(C)(=O)=O)C1 716152862 MGTYELXIZJWDNF-UHFFFAOYSA-N 347.278 1.920 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@H]2CCCCN2S(C)(=O)=O)c1 797097848 YVIDHWGIDHNLLB-QWHCGFSZSA-N 342.461 1.866 10 10 EDCE CN1CCN(c2ccc(CNCC[C@@]3(O)CCOC3)cc2F)CC1 1329658619 GCWQCXVPPNWOFJ-GOSISDBHSA-N 337.439 1.209 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 1908253516 UXVPMUURVGBDOD-NEPJUHHUSA-N 339.396 1.970 10 10 EDCE CNC(=O)[C@@H](C)N[C@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1266191901 MKPWSBSJYHFEQE-GHMZBOCLSA-N 348.407 1.082 10 10 EDCE C[C@@H]1CNc2c(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cnn2C1 1346737289 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1.267 10 10 EDCE CCC(=O)NC[C@@H](NCc1nnnn1-c1ccc(OC)cc1)C1CC1 1731386982 BPRMSRNFNCYNLU-OAHLLOKOSA-N 344.419 1.065 10 10 EDCE CCOc1ccc(N2CCN(CCN3CCOC[C@@H]3C)CC2)cc1 1642354209 KEWCSBGNISKRAB-KRWDZBQOSA-N 333.476 1.928 10 10 EDCE Cc1cc(C(=O)NCc2c(O)cccc2O)n(C2CCOCC2)n1 1652629184 ZLSXNLOOGOHMEG-UHFFFAOYSA-N 331.372 1.884 10 10 EDCE CO[C@H](C)CN(C)CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1667669021 KHCCCCWTGAQMPW-GFCCVEGCSA-N 335.408 1.888 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2cncnc2O)cc1C 1674681630 UBUOCEKMDLTXNN-QWHCGFSZSA-N 344.415 1.796 10 10 EDCE C[C@H](NCC1(C(N)=O)CCOCC1)c1ccc(N2CCOCC2)cc1 153096003 ZTRNCFVHJKOCGN-HNNXBMFYSA-N 347.459 1.456 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCN(C4CC4)C3=O)CC2)cc1 1858107989 UZKIUPGRMNRTMC-KRWDZBQOSA-N 343.427 1.355 10 10 EDCE Oc1cc(Br)ccc1CN[C@@H]1COC2(CCC2)[C@H]1O 2141555832 KPGJTPCBXMLBSZ-YPMHNXCESA-N 328.206 1.927 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1NCCC1=O 1952208797 NFCJTRNBZFIWTE-IAQYHMDHSA-N 336.388 1.465 10 10 EDCE O=C(O)CO[C@@H]1CCN(Cc2cc(Br)cc(F)c2O)C1 2153158462 BQDPKCMXBIOJTQ-SNVBAGLBSA-N 348.168 1.969 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1C(=O)NCc1ccccc1O 2010273654 WIQMEEAQTMZBDY-OLZOCXBDSA-N 336.388 1.548 10 10 EDCE NC[C@H]1CCCCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2053835277 VCRNJSOFBJMAOM-GOSISDBHSA-N 329.444 1.876 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCc3c(C4CCC4)cnn3C)c2n1 2064695331 KUTWHOPDWIRBJQ-UHFFFAOYSA-N 340.387 1.674 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)cc1Br 2182558067 AQYLSLHUOHQBAB-TUWBQHJRSA-N 342.233 1.680 10 10 EDCE CN(C)C(=O)CN(Cc1ccccc1)C(=O)c1cc(O)c(O)c(O)c1 2068618660 SKBQSYISFGKUIQ-UHFFFAOYSA-N 344.367 1.534 10 10 EDCE O=C(O)[C@@]1(CO)CCN(Cc2cc(Br)cc(F)c2O)C1 2201082852 TYJCBXLYMGFVDY-ZDUSSCGKSA-N 348.168 1.563 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(NC(=O)COc2ccc(N)cc2)C1 2223012813 ITHXJXCJIROYAN-SGTLLEGYSA-N 347.415 1.773 10 10 EDCE NCc1ccc(N2CCC[C@@H]3CNC(=O)[C@H]32)c(F)c1Br 2279273048 DTTHBNUWLNYOSN-RNCFNFMXSA-N 342.212 1.762 10 10 EDCE Cc1ccc(C=C2C(=O)NC(=O)N(c3ccc(C(=O)O)cc3)C2=O)o1 2296649674 VULXEAWBUOZGKS-UHFFFAOYSA-N 340.291 1.953 10 10 EDCE O=C(O)CNC(=O)CCN1C(=O)C(=Cc2ccco2)SC1=S 2314827938 PNJLYHNLXBKZTI-UHFFFAOYSA-N 340.382 1.072 10 10 EDCE C[C@H](O)[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(F)cc2)SC1=S 2323823839 RIFIHEFTUCZHRO-WRWORJQWSA-N 341.385 1.861 10 10 EDCE Cc1ccc(CN2C[C@H]3CS(=O)(=O)[C@H]3C2)c(O)c1Br 2352623349 KWPRSWLPGOVYCK-QWRGUYRKSA-N 346.246 1.692 10 10 EDCE O=C(O)[C@H]1CC[C@H](c2cc(I)ccc2O)N1 309494983 KNIMVKOUFUYVBY-RKDXNWHRSA-N 333.125 1.875 10 10 EDCE CN1C(=O)C(=Cc2ccc3c(c2)sc(=O)n3C)C(=O)N(C)C1=O 193121634 FQVUAISINHKEHE-UHFFFAOYSA-N 331.353 1.034 10 10 EDCE CN(C)CCCNC(=O)N1CCN(c2ccc3c(c2)OCCO3)CC1 243313337 LIZYOAFSQQFVLA-UHFFFAOYSA-N 348.447 1.241 10 10 EDCE C[C@@H]1CN(c2ccc(/C=C\C(=O)O)cc2Br)CC(=O)N1 387340821 TZWYOIOFUMLFMZ-AZVKUDOFSA-N 339.189 1.872 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2[C@@H](CN)C2(F)F)c(O)c1Br 2380739972 QFGRWGJDFQHCCU-RKDXNWHRSA-N 349.175 1.919 10 10 EDCE 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O=C(Cc1ccc(-n2cnnn2)cc1)NCc1cccc(Cl)c1O 1472315640 AWKUBKOZWDHRGO-UHFFFAOYSA-N 343.774 1.880 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCn2cccn2)cc1C 1480427332 VAMAVHANIIYWKR-HNNXBMFYSA-N 330.432 1.885 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1C=CS(=O)(=O)C1 1632681980 YUMPBIIJOGQPOE-ZYHUDNBSSA-N 325.386 1.093 10 10 EDCE CS(=O)(=O)c1ccc(N)c(C(=O)NCc2ccc(O)cc2O)c1 1630306608 HXXRBIGMPGAIRW-UHFFFAOYSA-N 336.369 1.014 10 10 EDCE CS(=O)(=O)C1(CNC(=O)c2cc3cc(O)c(O)cc3s2)CC1 1635766211 IWLMHMUNQHDLSU-UHFFFAOYSA-N 341.410 1.620 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccc(OCc2nn[nH]n2)cc1 1633820699 VHVJFGFUXKNOEZ-UHFFFAOYSA-N 341.327 1.371 10 10 EDCE C[C@H](CNC(=O)c1ccco1)NC(=O)c1ccc(N=NC(N)=O)cc1 1583785566 ZHLJKGMZIDYHCW-SNVBAGLBSA-N 343.343 1.990 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)C(C)(C)NC(C)=O)cc1C 1676446287 BCEGYHPUFJORTJ-AWEZNQCLSA-N 349.475 1.855 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CC[C@H](CO)O1 1762870646 BJFNPJGENITUJL-LSDHHAIUSA-N 346.431 1.722 10 10 EDCE 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EDCE CC(=O)C(=O)COC(=O)c1ccc(CS(=O)(=O)C(F)F)cc1 808526223 NKQPTULFXRXOCE-UHFFFAOYSA-N 334.296 1.139 10 10 EDCE Cc1cccc(CN[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)c1O 809726181 FCIZHWZCNATBIN-CQSZACIVSA-N 327.450 1.061 10 10 EDCE CC[C@H](C)N(CCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 383787933 MCTSHURLCCYKMQ-SDBXPKJASA-N 342.237 1.998 10 10 EDCE CC(=O)C(=O)COC(=O)C1CCN(C(=O)OCc2ccccc2)CC1 808504966 QPOQEUGZUJTMCF-UHFFFAOYSA-N 347.367 1.737 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(C[C@@H](C)O)C(C)C)nc12 730419223 GSSDKYOPGUTTNM-LLVKDONJSA-N 336.392 1.203 10 10 EDCE COc1cc(Br)cc(CN2CCC[C@@](O)(CO)C2)c1O 839160998 YJZFTMYVASNCAH-AWEZNQCLSA-N 346.221 1.483 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCCC[C@@]2(C)C(N)=O)cc1 839557722 YDVAVOHUNTZZCZ-SFHVURJKSA-N 332.448 1.099 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCN([C@@H]2CCNC2)CC1 843123732 OTUWXLRPYNVEBC-LJQANCHMSA-N 330.476 1.003 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NCC[C@H]2CC(=O)N(C)C2)c1 924737528 QHUPRANDMDEOMQ-NEPJUHHUSA-N 335.404 1.629 10 10 EDCE 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Cc1ccnc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 792206679 MYNZYUHLOZXJLG-UHFFFAOYSA-N 344.390 1.815 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cnc3ccccn23)c1 1165617787 IRUDOBYYKGHDHS-UHFFFAOYSA-N 346.368 1.664 10 10 EDCE CCC(=O)N[C@H](C)C(=O)NC[C@@H](C)NCc1ccc(OC)c(C)c1 1317242293 QGTBRMFWTAZNFV-ZIAGYGMSSA-N 335.448 1.513 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@]2(C)COC[C@@]2(C)C1 1327317423 YGBOMBFNLJCMGH-HDICACEKSA-N 332.400 1.236 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@]34CCOC4)C2)cc1 1347297957 MTRCFHRIEPHZJB-RDTXWAMCSA-N 331.416 1.848 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)CNC(C)=O)[C@@H]2C)cc1C 1507271417 OHNMEJVRVVOVDO-CJNGLKHVSA-N 333.432 1.219 10 10 EDCE C[C@@H](CCO)N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 1917039462 ITOHOYWGBZAYOV-MADCSZMMSA-N 328.210 1.608 10 10 EDCE CS(=O)(=O)c1cc(C(=O)NCCc2ccc(O)c(O)c2)co1 1445941448 XZUPSIYXJKTUSD-UHFFFAOYSA-N 325.342 1.067 10 10 EDCE CC(C)OCC(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1298543337 HCLHXBMOWYHIDZ-LLVKDONJSA-N 349.391 1.509 10 10 EDCE O=C(Nc1ccc(OCc2nn[nH]n2)cc1)c1cccc(O)c1O 1543810405 JGEBHKKKERYHJO-UHFFFAOYSA-N 327.300 1.442 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CC[C@H]1COCCO1 1709038623 LJHQZLFIRYKKTH-HNNXBMFYSA-N 346.431 1.988 10 10 EDCE CN(C)C(=O)/C=C\C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1623640014 BXMDWVQSAZYTGS-FJVVXJACSA-N 332.400 1.544 10 10 EDCE COC[C@@H](C)N[C@H]1C[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1488883220 QRFZOXZBKUNTQX-LALPHHSUSA-N 347.419 1.982 10 10 EDCE COC(=O)NCC(=O)NC[C@H](C)CNCc1ccc(OC)c(C)c1 1714375971 RWAVFPXGBMEBSK-GFCCVEGCSA-N 337.420 1.202 10 10 EDCE C[C@@H](NC(=O)c1ccc(-n2[nH]c(O)nc2=O)cc1)c1ccccc1O 1632246748 NHUCLVQKMUITGW-SNVBAGLBSA-N 340.339 1.463 10 10 EDCE CC(C)(C)OC(=O)Cn1cc(C(=O)NCc2ccccc2O)nn1 1631539783 DCABAMPMIURZAP-UHFFFAOYSA-N 332.360 1.255 10 10 EDCE Cc1nc2ccccc2c(=O)n1CC(=O)NCc1c(O)cccc1O 1639292443 CBHXFEFGYUOIQR-UHFFFAOYSA-N 339.351 1.433 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H]2CCCC(=O)N2)cc1C 1733000737 RQDITQKPJOMCCD-DZGCQCFKSA-N 333.432 1.267 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2nnn(C)n2)C(C)C)cc1C 1732567174 YGLBGJYPZJKPTB-CQSZACIVSA-N 346.435 1.071 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2(NCc3ccon3)CC2)cc1 1733265445 YBIQRBQLUPWTHB-UHFFFAOYSA-N 342.359 1.889 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC[C@@]2(CCS(=O)(=O)C2)C1 1651020910 ULHXWSBWBYDCOP-OAHLLOKOSA-N 343.376 1.278 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CC1(C(N)=O)CCCC1 1762515908 PAPFHFHABDLBDZ-UHFFFAOYSA-N 343.431 1.974 10 10 EDCE CC[C@]1(C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)CCNC1=O 1699367219 ZGNXPAGSFUYADT-KUHUBIRLSA-N 347.459 1.514 10 10 EDCE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2O)[C@H](C(=O)O)C1 1962838078 OEADTRGNZLDVEB-ZDUSSCGKSA-N 336.388 1.898 10 10 EDCE Cc1cc([N+](=O)[O-])cc2c1N(C)C(=O)/C2=C1/SC(=S)NC1=O 12436513 PTVHAZATTJHIIE-CSKARUKUSA-N 335.366 1.739 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)N[C@H]3CCC(=O)NC3=O)c2C)c1 153269083 OEPVPDWOJKOZRM-INIZCTEOSA-N 339.395 1.938 10 10 EDCE CC(C)(C)OC(=O)NCC1CN(CC(=O)NCc2ccccc2O)C1 1969154295 LATDONMDADSDSL-UHFFFAOYSA-N 349.431 1.465 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010396005 LTXKCGZLZVZVOO-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE CCCNCc1ccc(N2CC[C@](O)(CO)C2)cc1Br 313929947 WZLXZZCTKBBPBR-OAHLLOKOSA-N 343.265 1.882 10 10 EDCE CCNCc1ccc(N(C)[C@H]2COC[C@@H]2O)c(Br)c1 708091786 XUUNLJNBIQEQHW-KBPBESRZSA-N 329.238 1.755 10 10 EDCE CN1CCO[C@@H](CN(C)Cc2ccc(Br)cc2O)C1 709417532 BTGZUBHCSMBZAF-CYBMUJFWSA-N 329.238 1.917 10 10 EDCE CCOC1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 382741388 NPJJFJOLPULMGD-LBPRGKRZSA-N 326.194 1.626 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@H](C)[C@@H](O)C3)c(Br)cc21 388158543 SXZBFVOQDGQIKF-PAWXDDDFSA-N 340.221 1.479 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@H]([C@H](O)C(F)(F)F)C1 2064271070 WQORIVNFWICVJG-HZMBPMFUSA-N 333.306 1.802 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3CCOC[C@@H]3C2)cc1Br 2185896582 OJVMWDKMSKJYOZ-YPMHNXCESA-N 340.265 1.990 10 10 EDCE CC(C)(C)OC(=O)N1[C@H]2C[C@@H]1CN(CC(=O)Nc1ccc(N)cc1)C2 2053411866 QDIUMEABEHDAFL-GASCZTMLSA-N 346.431 1.901 10 10 EDCE Cn1[nH]c(=NC(=O)OC(C)(C)C)cc1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2060642628 ZRWUGPCOQPHQFA-JTQLQIEISA-N 349.395 1.961 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1ccc(O)cc1 2067785973 ARVAJCANSCJJMK-GJZGRUSLSA-N 348.399 1.939 10 10 EDCE Cc1cccc2c1NC(=O)C2=C1SC(=S)N([C@@H](C)C(=O)O)C1=O 2293308609 HZBANZUPRUKHMU-ZETCQYMHSA-N 348.405 1.992 10 10 EDCE CNC[C@@H]1CC[C@H](S(=O)(=O)NCc2cnc(SC)s2)C1 2284692765 WGYIRQFNPSMHRD-KOLCDFICSA-N 335.520 1.673 10 10 EDCE C[C@H](CNC(=O)C=Cc1ccc(N(C)C)cc1)CN1CCOCC1 2320615728 RYMLPKZVJKBODF-MRXNPFEDSA-N 331.460 1.850 10 10 EDCE Cc1ccc(CN(C)[C@H]2CN(C)C[C@H]2O)c(O)c1Br 2352942575 HDRIZIMUKYFRHK-NWDGAFQWSA-N 329.238 1.570 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)C(=O)NCCN1C(=O)CSC1=O 170245514 FPTRLNXCPJPABO-SECBINFHSA-N 338.385 1.088 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)c(Br)c1 2357057243 VSHVOIBIAJWZBJ-CDAHBRHOSA-N 341.249 1.932 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCOC[C@H](F)C3)c(Br)cc21 2361809513 XFFIKBNJEOEOAR-KRTXAFLBSA-N 344.184 1.576 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2357586327 XIFMLNQOXXTTIK-DPQXWDTRSA-N 342.233 1.823 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)C3=COCCC3)cc2)CC1 188121983 ZXDOJOBCUOTHKK-UHFFFAOYSA-N 343.427 1.666 10 10 EDCE C[C@H](O)CN1CCC(CN(C)C(=O)/C=C/c2ccc(O)c(O)c2)CC1 181153322 RTMFRCSYOOOJGB-YVZNUBBCSA-N 348.443 1.662 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(S(=O)(=O)C3CC3)CC2)c1O 529642441 ZBUFSOJVANAASZ-UHFFFAOYSA-N 344.864 1.964 10 10 EDCE CN(C)N=Nc1ccc(S(=O)(=O)N2CCS[C@H]2C(=O)O)cc1 254044143 BOKFUMHVBUFNFF-NSHDSACASA-N 344.418 1.395 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H]3CSC(=O)N3)CC2)cc1 363247487 PCLIMYRXRREIQX-AWEZNQCLSA-N 335.429 1.559 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H]([C@H]4CCOC4)C3)cc2N1 366709138 IEWNLSMFIQLJQH-QWRGUYRKSA-N 333.344 1.789 10 10 EDCE CC[C@H](NC(C)=O)C(=O)NCc1ccc(C)c(Br)c1O 2380723655 WEYAFYCKOHPUHV-NSHDSACASA-N 343.221 1.994 10 10 EDCE O=S(=O)(NCCNCc1c(O)cccc1Cl)C(F)(F)F 2159526695 NQNLNESYRVUTAT-UHFFFAOYSA-N 332.731 1.574 10 10 EDCE C[C@]1(CO)CCCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 722983550 XKRCMTLHKWZHIY-GXTWGEPZSA-N 340.221 1.752 10 10 EDCE CCN(CC)c1ccc(CNCC[C@H]2CNCCS2(=O)=O)cc1 903968786 ODHIIVIHXPKJHC-KRWDZBQOSA-N 339.505 1.399 10 10 EDCE COC[C@](C)(O)CCNC(=O)NCc1ccc(N(C)C)c(F)c1 836534460 TYAGEOVXVKYWBX-MRXNPFEDSA-N 327.400 1.478 10 10 EDCE CCCN(C[C@@H]1CCCCO1)C(=O)C(=O)NCCc1ccc(N)cc1 842237259 CBGOTZWXDINVPS-KRWDZBQOSA-N 347.459 1.735 10 10 EDCE Cc1cc(O)c(CN2CCN(S(C)(=O)=O)[C@@H](C)C2)c(Cl)c1 840936581 LUQZXOHINUSCPX-NSHDSACASA-N 332.853 1.820 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)NC2COCCOC2)cc1 845214994 YYDPSWGKRHUQFZ-UHFFFAOYSA-N 337.420 1.188 10 10 EDCE C[C@@H](NC[C@H](O)CS(C)(=O)=O)c1cc(Cl)c(Cl)cc1O 927024439 KNSAFQQQYRFQDN-SFYZADRCSA-N 342.244 1.755 10 10 EDCE COC(=O)/C=C/c1ccc(N2Cc3nn(C)c(N)c3C2)c([N+](=O)[O-])c1 856764493 CJGRNKYUOXYCRQ-GQCTYLIASA-N 343.343 1.617 10 10 EDCE CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)/C=C\c1ccc(O)c(O)c1 854642373 LEOLDMROUBRLNM-IORUMNFESA-N 332.400 1.433 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](OC)C3CC3)C2)cc1 852357823 IIMAETHYBJGRMI-YOEHRIQHSA-N 333.432 1.998 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)C(=O)N(C)C)C2)cc1 851985256 UCFGGRGSCPLZFG-STQMWFEESA-N 334.420 1.050 10 10 EDCE C[C@H](NC[C@]1(OCCO)CCOC1)c1cc([N+](=O)[O-])ccc1O 850508019 LMENYLZHCPZKPM-XHDPSFHLSA-N 326.349 1.119 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](OC)c3cnn(C)c3)C2)cc1 855225445 NHFYXQCONOVADP-WMLDXEAASA-N 344.415 1.511 10 10 EDCE CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855227043 SZZPPUPCDULGAK-YEWWUXTCSA-N 347.459 1.941 10 10 EDCE C[C@@H]1NCC[C@H]1NC(=O)NCc1cc(Br)ccc1O 861702436 OAZXUJDUEUUGRW-GZMMTYOYSA-N 328.210 1.704 10 10 EDCE Cc1cc(C(=O)NC[C@H](O)[C@H]2CCCO2)c(C)n1-c1ccccn1 862652372 XRFVCRALZZBOPM-JKSUJKDBSA-N 329.400 1.759 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@@H]3CCN[C@H]3C)CC2)cc1 861571352 BCKPXIRSHGQIDD-SUMWQHHRSA-N 332.448 1.714 10 10 EDCE COC1CCC(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 785422121 ISPQSIXNWVLHTB-UHFFFAOYSA-N 347.459 1.690 10 10 EDCE C[C@@H]1OC[C@]2(CC[C@H](CNC(=O)c3c(F)ccc(O)c3O)O2)[C@H]1C 899485989 XMUKHUMMANQJRV-BHGXRVDKSA-N 339.363 1.939 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cn(-c2cccnc2)nn1 1140198829 VENGNUJZPRYUIQ-UHFFFAOYSA-N 344.371 1.784 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@@H](O)C2(C)C)c(Br)c1 2124803106 UIPCYXPXAVEGMT-AQUOVQTQSA-N 330.222 1.823 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3NC(=O)O[C@@H]3C2)c(Br)c1 2120416767 QHVCXUDHCYGXNG-HNBZJPLGSA-N 327.178 1.799 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(c2cnc[nH]2)CC1 1329422030 HHODNKIAFOFHMB-UHFFFAOYSA-N 340.383 1.364 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CCOC1(C)C 1329206689 DXUFGXJYXMISCB-OAHLLOKOSA-N 347.459 1.642 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](C(=O)O)[C@H](c2ccc(O)c(O)c2O)C1 1906074511 UUNMIONWWPFCRZ-UWVGGRQHSA-N 339.344 1.839 10 10 EDCE Oc1cc(Br)ccc1CNCC1(F)COCCOC1 2130669297 MSXLLZKEAXQOEG-UHFFFAOYSA-N 334.185 1.999 10 10 EDCE COCCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@@H]1CC[C@H](C)C1 1332023600 RBPWHMRZCYCEIB-DZGCQCFKSA-N 346.427 1.898 10 10 EDCE CN[C@H](C)c1ccc(N(CCO)C2COC2)cc1Br 1915545903 PFHUUAPSZZLFNU-SNVBAGLBSA-N 329.238 1.927 10 10 EDCE C[C@]1(C(=O)O)COCCN1Cc1ccc(Br)cc1O 2136499636 DCMVRYAOHSZZQI-CYBMUJFWSA-N 330.178 1.830 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@@H](F)C(C)C)cc1C 1700948504 PXFSBJKAGXOOOA-RDJZCZTQSA-N 340.439 1.907 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC(=O)N[C@H]3CCCC[C@H]32)cc1 1622868996 LVIBZBOZDVIRIJ-QWHCGFSZSA-N 329.360 1.732 10 10 EDCE COC(=O)NCC(=O)N[C@H]1C[C@H](CNCc2ccc(OC)c(C)c2)C1 1717637127 LICQEXWQIOUEOD-SHTZXODSSA-N 349.431 1.344 10 10 EDCE COc1ccc(-n2nnnc2CN[C@@H](C)CNC(=O)C(C)(C)C)cc1 1774045340 BKSBPBRGLGKHGE-LBPRGKRZSA-N 346.435 1.311 10 10 EDCE COc1ccc(CNC[C@H]2CCN(C(=O)CNC(C)=O)C2)cc1C 1774055906 JXPMSZNKMJNUMV-MRXNPFEDSA-N 333.432 1.078 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H]2CCC(=O)NC2=O)c1C 153497043 YSLIDDODJJUMJF-OAHLLOKOSA-N 339.395 1.938 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)CCCCO)c2nccn2C)cc1 1866066810 PXBOBVZBJGYJAO-KRWDZBQOSA-N 330.432 1.854 10 10 EDCE O=C1C[C@]2(CCN(Cc3ccc(Br)cc3O)C2)CN1 825732004 NKUNLONAHWALJZ-CQSZACIVSA-N 325.206 1.867 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)NCCCCN=[N+]=[N-] 1985102179 CRBMJFGGWNMZCB-JTQLQIEISA-N 329.401 1.857 10 10 EDCE CC(C)(C)OC(=O)NC1CN(CC(=O)N2CCC(N=[N+]=[N-])CC2)C1 2010389335 OGHUWBPBKMWWQQ-UHFFFAOYSA-N 338.412 1.497 10 10 EDCE CC(C)(C)OC(=O)NCC12CC(C(=O)N3CC(N=[N+]=[N-])C3)(CO1)C2 2010395727 JWXGZIPVFJWFOC-UHFFFAOYSA-N 337.380 1.581 10 10 EDCE CC(C)(C)OC(=O)NC[C@@]1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CCCO1 2010401323 CZFMLSIHFJJXOM-IAQYHMDHSA-N 339.396 1.972 10 10 EDCE C[C@H](N[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)c1ccc(O)cc1O 2011487349 LHBOXNMMJNPQHP-VZJVUDMVSA-N 338.404 1.729 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4CCO[C@H]4C3)c(Br)cc21 2172045188 PGCMTGDVCLPVOF-RDZIJCNDSA-N 338.205 1.626 10 10 EDCE NCc1cc(F)c(N2C[C@H]3COC[C@@H](C2)C3O)cc1Br 2167787074 LRGMMGLEAYIKRB-XFLKPENQSA-N 345.212 1.490 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)Cc2ccc(N)cc2)[C@@H](O)C1 2052720295 JQQPWEZVLYILMV-GJZGRUSLSA-N 349.431 1.298 10 10 EDCE CN(C[C@H](N)COCc1ccccc1)C(=O)c1cc(O)c(O)c(O)c1 2068615795 TUEGCZHFUBGUGW-AWEZNQCLSA-N 346.383 1.420 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)C[C@H]1C(=O)NCc1ccc(N)cc1 2080905609 XBXDKHCJUUOUHC-CABCVRRESA-N 349.431 1.645 10 10 EDCE OCc1ccc(N2CC[C@H]3OCCO[C@H]3C2)c(Br)c1 2095426237 JGDARYBDPDWEEM-KGLIPLIRSA-N 328.206 1.936 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])C1 2213592366 SKEPTMALXFFJTF-TUAOUCFPSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)CC[C@@H]1C(=O)NCCCN=[N+]=[N-] 2242655261 BHDDADRLIJKOGL-WDEREUQCSA-N 327.385 1.563 10 10 EDCE O=C(O)[C@@H]1CCOCCN1Cc1cc(Br)ccc1O 2269861675 YTFSDHINOCGNFU-NSHDSACASA-N 330.178 1.830 10 10 EDCE O=C1NC(=O)N(C[C@@H]2CCCO2)C(=O)C1=CNc1ccccc1Cl 2297317994 WHMKZDCNZZHVDS-JTQLQIEISA-N 349.774 1.893 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCC(CN2CCOCC2)CC1 2307986386 SSNJDELHMUUVMW-UHFFFAOYSA-N 346.427 1.682 10 10 EDCE Cc1c(C=CC(=O)N2Cc3cnnn3Cc3ccccc32)cnn1C 2311252803 UIZJYJFXGJICLM-UHFFFAOYSA-N 334.383 1.928 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2329329701 XNRMVXRKWXLDSE-DHQAPWOJSA-N 328.206 1.433 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3C[C@@H](O)[C@H](O)C3)ccc(N)c2C1 306050513 PJVLIQCQLHSSNF-HZPDHXFCSA-N 349.431 1.104 10 10 EDCE COc1ccccc1N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 243254493 KRQHEJWJPAKDRC-UHFFFAOYSA-N 342.395 1.998 10 10 EDCE C[C@H]1CO[C@H](C)CN1S(=O)(=O)NCc1ccc(N(C)C)cc1 246057849 DBKIBSKQBZHPFW-QWHCGFSZSA-N 327.450 1.196 10 10 EDCE COc1ccc(N2CCN(C(=O)CCN(C(C)=O)C(C)C)CC2)cc1 253453715 HQIARTBNBWGOMC-UHFFFAOYSA-N 347.459 1.991 10 10 EDCE COc1ccc(N2CCN(C(=O)Nc3cc(OC)ncn3)CC2)cc1 272936995 IAPJWPUDRRRHGF-UHFFFAOYSA-N 343.387 1.848 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC(F)(F)C[C@@H]1CO 364616392 SSGNURWGJZKYAX-OAHLLOKOSA-N 341.402 1.413 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@@H](C)c3cn[nH]c3)CC2)cc1 273979195 HONGGOMJXQEGRY-AWEZNQCLSA-N 343.431 1.418 10 10 EDCE CCn1ncc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n1 293451558 SPWYPZPHOKTGJV-CQSZACIVSA-N 330.388 1.825 10 10 EDCE CC(=O)C(=O)COC(=O)C1CCN(c2nc3ccccc3o2)CC1 808493014 NWHJJVPTOSCMKW-UHFFFAOYSA-N 330.340 1.746 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCOC(C)(C)C 807099213 NYUZVMLOYJCLMI-UHFFFAOYSA-N 335.448 1.609 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@]3(C)CCC(=O)NC3)C2)cc1 819589706 GDFYOSBUOLKDNQ-KUHUBIRLSA-N 345.443 1.554 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CC[C@@H](Cn3ccnn3)C2)c1O 826846467 VETGHOHOFABFFQ-LLVKDONJSA-N 333.348 1.423 10 10 EDCE CO[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2C)[C@](C)(C(=O)O)C1 909042579 HLYVXKNXZOSSJT-QAPCUYQASA-N 349.431 1.835 10 10 EDCE CC[C@@H](NC[C@@]1(OC)CCS(=O)(=O)C1)c1ccc(F)cc1O 903363675 QPQJWLXYPAPMKA-HIFRSBDPSA-N 331.409 1.776 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@H](N)C(F)(F)F)C2)cc1 831752806 FBBOAMCPQHDQBY-MFKMUULPSA-N 331.338 1.527 10 10 EDCE C/C=C\C[C@H](CO)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588495081 PYPFQFJLNQUIQD-QQBJXRNNSA-N 330.428 1.980 10 10 EDCE C[C@@H]1C[C@@H](S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)CCO1 842785492 NXFKSOULLOYZHS-UHOFOFEASA-N 341.477 1.239 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1C[C@H]2CNC[C@@H](C1)C2=O 843488091 QDBTZOXBTXBOAB-ALOPSCKCSA-N 343.471 1.916 10 10 EDCE CN1CC[C@@H](C(=O)NCc2ccccc2O)[C@@H](c2cnn(C)c2)C1 849565298 SRUFBSLJEAETOD-HZPDHXFCSA-N 328.416 1.477 10 10 EDCE Cc1cc(Cl)cc([C@H](C)NCC[C@@H]2CNCCS2(=O)=O)c1O 925788995 NBYQFKZEKJRORG-WCQYABFASA-N 346.880 1.781 10 10 EDCE Cn1ncc(C2CCC2)c1CNC(=O)C(=O)Nc1ccc(N)cc1 850850593 AQNLYAHHOJECBM-UHFFFAOYSA-N 327.388 1.525 10 10 EDCE CCOC(=O)c1nc(=N[C@H]2CCN(c3ccc(OC)cc3)C2)cc[nH]1 853760341 JTQNIPALDSDRFC-ZDUSSCGKSA-N 342.399 1.775 10 10 EDCE CN(C)c1ccc(CN2CCOC3(CNC3)C2)c(C(F)(F)F)c1 853249115 NGBROMMMCOFDPD-UHFFFAOYSA-N 329.366 1.946 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCN(C)C(C)C)C2)cc1 852064051 JENNJPFUEQWHBG-OAHLLOKOSA-N 334.464 1.913 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@H]3CC[C@H]2[C@@H](CO)C3)cc1 852775498 WHRHEZCNJMCQDD-JZXOWHBKSA-N 331.460 1.462 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)c3ccc(C)nn3)C2)cc1 867498370 YUFRVXQTZAXSEU-CYBMUJFWSA-N 348.428 1.351 10 10 EDCE CCOC(=O)C[C@@H](O)COc1ccc(N(C)C)c(C(=O)OC)c1 865395610 YQFXHOMXDJVVRB-LLVKDONJSA-N 325.361 1.232 10 10 EDCE COC(=O)C1=CC[C@@H](NCc2ccc(N3CCN(C)CC3)cc2)C1 862465022 CMFWWKDTAZIDNZ-QGZVFWFLSA-N 329.444 1.790 10 10 EDCE COc1cccn2c(=O)n(Cc3ccc(N4CCOCC4)cc3)nc12 877886010 WYDJBBRXLQODNU-UHFFFAOYSA-N 340.383 1.390 10 10 EDCE Cc1cc(CN(C)C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)no1 774217672 OTXNXZUZAIKTQW-ZDUSSCGKSA-N 344.415 1.885 10 10 EDCE NC(=O)C[C@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 895412451 XCDKXXCTKQOIRO-JTQLQIEISA-N 347.184 1.370 10 10 EDCE Oc1cc2c(cc1CNC[C@@]1(O)[C@@H]3[C@@H]4[C@H]5[C@H]6C[C@@H]4[C@H]1[C@@H]6C[C@H]53)OCO2 785546229 ROKNDWMNCXDXFW-MITLLEGOSA-N 341.407 1.719 10 10 EDCE C[C@H](N)c1ccc(N(C)CC(C)(CO)CO)cc1Br 689675472 QENZZUWKEMPNID-JTQLQIEISA-N 331.254 1.896 10 10 EDCE CCOC(=O)C1(COC)CCN(C(=O)c2cc(O)cs2)CC1 796214076 CKNIIDINYJYVFW-UHFFFAOYSA-N 327.402 1.886 10 10 EDCE CN[C@H](C)c1ccc(N2CC(=O)NC(=O)C2)c(Br)c1 97268841 SGHJRLGXMBGHOX-MRVPVSSYSA-N 326.194 1.192 10 10 EDCE COCCNCc1ccc(N2C[C@@H](O)[C@@H]2C)cc1Br 2126123206 NXEMJGBMCKSGEW-IINYFYTJSA-N 329.238 1.755 10 10 EDCE C[C@H]1Oc2c(cccc2C(=O)NCc2cc(O)ccc2O)NC1=O 1176747956 GLUKMKZDINKNDT-SECBINFHSA-N 328.324 1.747 10 10 EDCE CCN(CCNC[C@H]1CCOC1)C(=O)c1ccc(N=NC(N)=O)cc1 1320931067 XVNDLZSVUNOGGH-CYBMUJFWSA-N 347.419 1.937 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cc(C)[nH]c2C)cc1C 1320283886 ZMGRXEFNYBUMMZ-INIZCTEOSA-N 345.443 1.829 10 10 EDCE O=C(O)c1cc(O)ccc1NC(=O)c1n[nH]cc1Br 2134189290 MHOBUNGRCHKEMM-UHFFFAOYSA-N 326.106 1.828 10 10 EDCE CNC(=O)[C@H]1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 1348633882 NMOIRTHHCUDYLQ-HNNXBMFYSA-N 334.439 1.145 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C[C@H]2CCCO2)cc1C 1268302212 VYVXTDXIPVYSEM-HZPDHXFCSA-N 336.432 1.139 10 10 EDCE NC[C@@H]1CN(C(=O)c2ccc(O)c(O)c2)CCN1Cc1ccccc1 1914862544 NHHNJJUPCFRYRB-MRXNPFEDSA-N 341.411 1.383 10 10 EDCE CN1CCN(c2ccc(CNCc3cc(N)ccn3)cc2F)CC1 1353945167 YLVNSCIVNGMPPL-UHFFFAOYSA-N 329.423 1.845 10 10 EDCE COCCOCCc1ncc(C(=O)N(C)Cc2ccccc2O)[nH]1 1445642625 AELUEPNARIQDKM-UHFFFAOYSA-N 333.388 1.593 10 10 EDCE CN1C(=O)CC[C@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C1=O 1299713253 QNJVEEUUIFRUFZ-QMMMGPOBSA-N 334.353 1.190 10 10 EDCE COCCOc1ncccc1CNC(=O)Cc1ccc(O)c(O)c1 1292141532 LFFGPQXEOWQSRC-UHFFFAOYSA-N 332.356 1.377 10 10 EDCE COC1(OC)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1O 1452119367 SFGWXQOACQQHKK-GFCCVEGCSA-N 336.348 1.045 10 10 EDCE C[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1nnc2n1CCCCC2 1540698714 XGSGWCJJGQIPSX-NSHDSACASA-N 330.388 1.836 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccccc1O[C@@H]1CC(=O)N1 1626938644 TWVKKANMFBYDLE-QGZVFWFLSA-N 328.324 1.504 10 10 EDCE Cc1ccc(C(=O)Nc2ccc(O[C@@H]3CC(=O)N3)cc2)c(O)c1O 1627428806 MBHIEKBIVXTJNE-CQSZACIVSA-N 328.324 1.883 10 10 EDCE O=C(NCCN1C(=O)CCCC1=O)c1cc2cc(O)c(O)cc2s1 1629709750 HQWFPTZLJZTQHN-UHFFFAOYSA-N 348.380 1.581 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cn3cncn3)CCC2)cc1C 1484661218 HUWVRQPDRBWQDX-UHFFFAOYSA-N 343.431 1.424 10 10 EDCE CC(C)n1cc(CNC(=O)/C=C\c2ccc(O)c(O)c2)c(O)nc1=O 1558080612 KVPGGDSWKJGKMW-XQRVVYSFSA-N 345.355 1.271 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCc1noc(C(F)(F)F)n1 1568299108 HYRFQPSXPPOLLP-RQOWECAXSA-N 329.234 1.829 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)COc1ccc(C(N)=O)cc1 1636058659 MAUKIAPANVYBGG-UHFFFAOYSA-N 349.383 1.672 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@H]3C[C@@H](C(=O)OC)C3)CC2)cc1 1636706913 LXLDFSYJZMVXEP-GASCZTMLSA-N 346.427 1.933 10 10 EDCE CC[C@H](CNC(=O)c1cnn(CC)n1)NCc1ccc(OC)c(C)c1 1732197373 IUWRLUBEHBNRQS-OAHLLOKOSA-N 345.447 1.913 10 10 EDCE CCOc1ccccc1C(=O)NCC(=O)NCc1cccc(O)c1O 1643809123 DYXAREXPZOTEPT-UHFFFAOYSA-N 344.367 1.543 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](CO)c1ncc[nH]1 1686826171 CGQQIINWIDOYMG-CJNGLKHVSA-N 345.447 1.748 10 10 EDCE C[C@@H](NC(=O)NCc1nc(C2CCOCC2)n[nH]1)c1ccccc1O 1684457237 REEKXZSTDNAPGE-LLVKDONJSA-N 345.403 1.965 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)c2nonc2C)cc1C 1690881563 WZFDGYPPVDKUGP-GFCCVEGCSA-N 332.404 1.993 10 10 EDCE CN(C)c1ccc([C@@H](O)[C@@H](N)c2nc(Br)cn2C)cc1 2160829054 VQYIFSYVJJUGCO-CHWSQXEVSA-N 339.237 1.982 10 10 EDCE CN1CCO[C@@H](CN(C)c2ccc(CN)c(Br)c2)C1 707814311 AULRNZFOPLAXNJ-CYBMUJFWSA-N 328.254 1.675 10 10 EDCE CN(C)C(=O)[C@@H]1CNCCN1Cc1ccc(Br)cc1O 691385816 INXNZGZLFYRWPN-LBPRGKRZSA-N 342.237 1.017 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H]3CCCN(C(C)C)C3)c2n1 2064984813 JKKUEJVRVATOSA-CYBMUJFWSA-N 331.420 1.594 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H]2CN3C(N)=O)c(Br)c1 2192283632 PDCCHHDTYDDICJ-DVVUODLYSA-N 340.221 1.844 10 10 EDCE CNCc1ccc(N2CC(CNC(=O)OC)C2)cc1Br 2187286168 OFAJABPHUMMAFU-UHFFFAOYSA-N 342.237 1.961 10 10 EDCE NCc1ccc(N2C[C@@H]3[C@H](CCS3(=O)=O)C2)cc1Br 2088820381 WRILRQPCXKZREF-ZWNOBZJWSA-N 345.262 1.531 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H]3C(C(N)=O)[C@@H]3C2)c(Br)c1 2201293159 JXOAAXQTCRPTSK-FBIMIBRVSA-N 338.249 1.897 10 10 EDCE CC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)NCCN1CCOCC1 2294474439 WFAJHNNBLZNPMC-UHFFFAOYSA-N 346.406 1.744 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)CC3COC3)c(Br)cc21 2285278444 KFZFXMHLZZBIQT-ZDUSSCGKSA-N 340.221 1.744 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(COC(=O)N3)C2)cc1Br 2351840851 SBYFMATYOUBOOT-MRVPVSSYSA-N 327.178 1.801 10 10 EDCE Cc1ccc(CNC(=O)N2CC[C@H](O)C2)c(O)c1Br 2352691792 GWLMMTLZFMFXDV-JTQLQIEISA-N 329.194 1.739 10 10 EDCE CC(=O)NCCC(=O)NCc1ccc(C)c(Br)c1O 2352933576 ZQVNKYJFOREIRU-UHFFFAOYSA-N 329.194 1.606 10 10 EDCE COC[C@H](NC(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CC1 178740883 FEXMDXTWDSUCPX-KRWDZBQOSA-N 333.432 1.952 10 10 EDCE Cc1cc(Cl)cc(CN(CCO)CCN2CCOCC2)c1O 305762088 FGUGEPILRQTVPA-UHFFFAOYSA-N 328.840 1.481 10 10 EDCE COc1cc(Cl)cc(CN2CCN(C[C@@H](C)O)[C@H](C)C2)c1O 184690017 JYUFPIQRIUGBFT-VXGBXAGGSA-N 328.840 1.941 10 10 EDCE O=C(NC[C@H]1CCCO1)N1CCN(c2ccc3c(c2)OCCO3)CC1 242973396 HOILHDLTFLRTAV-OAHLLOKOSA-N 347.415 1.468 10 10 EDCE COC(=O)CC(C)(C)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 254970762 TVTXQBHSNAJOPR-TWGQIWQCSA-N 346.427 1.994 10 10 EDCE CCN1C(=O)[C@H]2CN(Cc3ccc(N(C)C)c(F)c3)CCN2C1=O 378367963 FOBJDMHNVXEPSF-OAHLLOKOSA-N 334.395 1.360 10 10 EDCE COc1ccc(CNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3C)C2)c(O)c1 373398721 HYCFNJNCOWMGME-MPKXVKKWSA-N 333.388 1.209 10 10 EDCE CN=c1nncc(N(C)Cc2ccc(C)c(Br)c2O)[nH]1 2380772568 NFJUCEMTYWWIFY-UHFFFAOYSA-N 338.209 1.748 10 10 EDCE COC[C@@H]1[C@H](O)[C@@H](O)CN1Cc1ccc(C)c(Br)c1O 2381141726 DHYGOUCGEBTGJH-SUNKGSAMSA-N 346.221 1.016 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@H]2COC[C@@H](C1)O2 800999438 ZFSJBCDEXMFVRN-CALCHBBNSA-N 331.416 1.596 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1CCCN(C)C1)c1ccc(N(C)C)cc1 807678312 WFGRJAQVSHTPRE-DZGCQCFKSA-N 332.448 1.140 10 10 EDCE O=C(NCc1cc[nH]n1)NCc1cc(Br)ccc1O 805180514 KLQODILVMKDYQT-UHFFFAOYSA-N 325.166 1.877 10 10 EDCE CN(C)c1ccc([C@H](N)[C@@H](O)c2cc(Br)nn2C)cc1 2163137152 ADPPOPBSFJEQSW-KBPBESRZSA-N 339.237 1.982 10 10 EDCE COC(=O)C[C@H](C)C(=O)NCc1cc(Br)ccc1O 804734654 VJNOHNZZMDQSBF-QMMMGPOBSA-N 330.178 1.970 10 10 EDCE O=C(O)C1CN(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)C1 2164301040 CSOITEVHIJQQOV-UHFFFAOYSA-N 341.172 1.372 10 10 EDCE Cc1nocc1CNCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 815117177 MXQJTVJPWBRWTI-OAHLLOKOSA-N 328.416 1.975 10 10 EDCE C[C@H]1CCN1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 820991686 GZJYBMKHRLZEIJ-ZDUSSCGKSA-N 337.445 1.225 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)N(C)Cc2ccccc2O)CS1(=O)=O 822005297 LFAWVOCRHDKZOO-DGCLKSJQSA-N 326.418 1.499 10 10 EDCE Cc1cc(CC(=O)NCCNS(C)(=O)=O)c(C)n1-c1ccccc1 820677513 LQEGTOWBPQFJQI-UHFFFAOYSA-N 349.456 1.302 10 10 EDCE NC(=O)c1cn(C2CN(Cc3cc(Cl)cc(Cl)c3O)C2)nn1 839141937 BEVWXDOMPBHINJ-UHFFFAOYSA-N 342.186 1.446 10 10 EDCE C[C@H](NC(=O)[C@@H]1CSC(=O)N1)c1ccc(N2CCOCC2)cc1 746168361 OMPRBXPMTQBXCN-FZMZJTMJSA-N 335.429 1.525 10 10 EDCE C[C@H]1CCN(Cc2ccc(N3CCN(C)CC3)cc2)C[C@H]1C(=O)O 843041608 UICQBYSTYSKPTL-MAUKXSAKSA-N 331.460 1.981 10 10 EDCE OCC1CCN(c2ccc(CNC[C@H](O)C(F)(F)F)cc2)CC1 843065780 PNHXMOASJIHKRL-HNNXBMFYSA-N 332.366 1.908 10 10 EDCE CN1C2(CCC2)COC[C@@]1(CO)CNCc1ccc2c(c1)CCCO2 922286378 KPUVVPTXIZFLQZ-FQEVSTJZSA-N 346.471 1.717 10 10 EDCE CC[C@@H](C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@H](C)O 842230817 AGXDXLULYXCMHF-MAUKXSAKSA-N 349.475 1.340 10 10 EDCE CS(=O)(=O)C[C@@H](O)CNCc1cc(Cl)cc(Cl)c1O 922822639 NELOWYRKYSDALK-VIFPVBQESA-N 328.217 1.194 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCN[C@@H](C)C3)C2)cc1 851668800 UQQATFBRUMUGCZ-ZNMIVQPWSA-N 332.448 1.714 10 10 EDCE COC[C@]1(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCNC1 851639114 BHGLVOSQVPLCOL-KSSFIOAISA-N 333.432 1.016 10 10 EDCE Cn1nccc1[C@H](O)CNCc1c(O)cccc1Br 922970521 PMWYFZRLPUSOLL-CYBMUJFWSA-N 326.194 1.711 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H]4COC[C@H]4C3)C2)cc1 852450717 STROXYSNHHTXNI-XHSDSOJGSA-N 345.443 1.952 10 10 EDCE CCOC1(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CCOCC1 855224359 FRWAYPPOBTYFNW-OAHLLOKOSA-N 348.443 1.976 10 10 EDCE COC(=O)[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)cc2)C[C@@H](C)O1 862487658 SSPOYZSQRFAAJQ-QAPCUYQASA-N 347.459 1.201 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC(=O)N(C)C1 860607143 RNROUEJFGYLAIW-UHFFFAOYSA-N 325.368 1.778 10 10 EDCE NC(=O)[C@@H]1CCC[C@@H](C(=O)NCc2ccc3cccnc3c2O)C1 862026007 FCIJTDXRNRPRAO-CHWSQXEVSA-N 327.384 1.848 10 10 EDCE COc1cc(Cl)cc(CN(C)C[C@H]2CCS(=O)(=O)C2)c1O 761202859 QBVKJCZDOXXLFM-SNVBAGLBSA-N 333.837 1.921 10 10 EDCE COC(=O)[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1cccc(O)c1 779543744 YMUOJSZFRGXESU-QLBOMPFWSA-N 343.335 1.847 10 10 EDCE COc1cc(O)c(CN2CCC(OCCCO)CC2)cc1OC 775726532 ZNDCFCYEQKMMPG-UHFFFAOYSA-N 325.405 1.773 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(c3nccn(C)c3=O)CC2)c1O 775713982 XZZRGQCVUHQNIM-UHFFFAOYSA-N 348.834 1.770 10 10 EDCE CNS(=O)(=O)c1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1135442711 IZAUHWDLJUSEOQ-UHFFFAOYSA-N 336.369 1.187 10 10 EDCE CN1CC[C@@H](Cn2nnnc2Sc2ncc([N+](=O)[O-])s2)C1 799943151 IBHOHHIKXNZZSG-SSDOTTSWSA-N 327.395 1.141 10 10 EDCE COc1ccc(CNC(=O)C(=O)c2cnn(C(C)(C)C)c2)c(O)c1 794389130 JCXFGJCVQURLOE-UHFFFAOYSA-N 331.372 1.851 10 10 EDCE CCc1nc([C@@H]2C[C@@H](O)CN2C(=O)/C=C/c2ccc(O)c(O)c2)n[nH]1 1305717845 BGVAUOJNHVJUQT-XCOQAZTISA-N 344.371 1.126 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCc2nnc(O)n2C2CC2)c1 1313188826 GJXXEDMQQWJTRB-VIFPVBQESA-N 347.375 1.593 10 10 EDCE COC1CCC(CNC(=O)C(=O)N(C)Cc2ccccc2O)CC1 1322992190 FLMIOUGOHHLGNT-UHFFFAOYSA-N 334.416 1.672 10 10 EDCE CN1CCN(c2ccc(CN[C@@H]3CCNC34CCC4)cc2F)CC1 1329134989 MFMGPTRMSKZQPS-GOSISDBHSA-N 332.467 1.952 10 10 EDCE CCC[C@@H](C)NC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1333946949 KYFCRGSHEUJXJK-KGLIPLIRSA-N 333.432 1.695 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H](C)C(O)[C@@H](C)C1 1261610635 VZOFWEXGCKKWEO-KBPBESRZSA-N 348.443 1.606 10 10 EDCE COc1ccc(CNC(=O)[C@H]2C[C@@H]3CC[C@H](C2)S3(=O)=O)c(O)c1 1354007593 ZSUCXODQMMCHTJ-DEZZGGKRSA-N 339.413 1.373 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC(=O)N1CCCc2ccccc21 1464433548 FFTAQPUUHGTQMW-UHFFFAOYSA-N 340.379 1.736 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCS(=O)(=O)[C@@H]2CCC[C@H]21 1468069677 BPDATGPQJHCLSN-QKOWSDGPSA-N 337.397 1.289 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](C)[C@H](O)C3)C2)cc1 1470772771 MPXYVVUHQGWGLM-GRDNDAEWSA-N 333.432 1.686 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cccc(N2CCNC2=O)c1 1558159620 JKJNSMYPUNSDMA-UHFFFAOYSA-N 327.340 1.557 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC1CCN(C2CCOCC2)CC1 1632600314 NRBXBVUNCOBLLG-UHFFFAOYSA-N 348.443 1.648 10 10 EDCE CO[C@H](C)CC(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1736896482 NDKKDUCQLOKSLW-LLVKDONJSA-N 349.391 1.510 10 10 EDCE C[C@H]1CN(CCNC(=O)c2ccc(N=NC(N)=O)cc2)[C@@H](C)CO1 1640240089 OCHVLGVSJOYZQQ-RYUDHWBXSA-N 333.392 1.688 10 10 EDCE CN(c1cccc(CNC(=O)c2cc(O)cs2)c1)S(C)(=O)=O 1640305618 LAWBCQSDDHGHQF-UHFFFAOYSA-N 340.426 1.780 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCC(=O)N=c2cc[nH]cc2)cc1 1584708252 CUKBLUIFIPDEAZ-UHFFFAOYSA-N 340.343 1.425 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCNC(=O)[C@@H]2CCOC2)cc1 1758137047 MEXBNCWJYREIOK-GFCCVEGCSA-N 347.375 1.122 10 10 EDCE CC[C@H](CNC(=O)C(C)(C)NC(C)=O)NCc1ccc(OC)c(C)c1 1698614773 LCKTWDBFAHIPKR-MRXNPFEDSA-N 349.475 1.903 10 10 EDCE Cn1cc(-c2ncc(C(=O)NCCc3ccc(O)c(O)c3)s2)cn1 156603972 HGUSXUGGTMAMKK-UHFFFAOYSA-N 344.396 1.927 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C(C)(C)C(N)=O 1915545967 YBCYPGMZJLPSLG-SNVBAGLBSA-N 341.209 1.101 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H](CO)C3)c(Br)cc21 167815132 BHZZQGVOCRHUIC-SDBXPKJASA-N 340.221 1.480 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2010404477 ASTLQIHDGAZASU-MNOVXSKESA-N 341.412 1.809 10 10 EDCE CN(C)C1(C)CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2160654012 LIKUKSUTXIWQHD-GFCCVEGCSA-N 340.221 1.575 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(=O)NC(=O)[C@H]2C)cc1Br 300519957 UZONGMYWVMSGPY-DTWKUNHWSA-N 340.221 1.581 10 10 EDCE CNCc1ccc(N2C[C@H](OC)C[C@@H]2CO)c(Br)c1 311562629 SIZMUZWGFVLLKQ-VXGBXAGGSA-N 329.238 1.755 10 10 EDCE CCNCc1ccc(N2CCC(O)(CO)CC2)c(Br)c1 314237708 ULHCMMLTFDVDLX-UHFFFAOYSA-N 343.265 1.882 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNCc2ccc3c(c2)CCO3)C1 702847705 VFTBTKDPOJBKNN-HZPDHXFCSA-N 348.443 1.939 10 10 EDCE O=C1CO[C@H]2CCN(c3ccc(CO)c(Br)c3)C[C@H]2N1 2185521779 KVCIMKJBKYRSOB-OLZOCXBDSA-N 341.205 1.035 10 10 EDCE CCNCc1ccc(N2CC(CO)(OC)C2)cc1Br 2101058659 BTLAPNUTINLSKV-UHFFFAOYSA-N 329.238 1.756 10 10 EDCE CCCNCc1ccc(N2CC[C@H]2[C@H](O)CO)cc1Br 2286228776 QCWWWEOYOSQDOF-LSDHHAIUSA-N 343.265 1.881 10 10 EDCE CN1C(=O)C(=C2SC(N3CCOCC3)=NC2=O)c2ccccc21 2296727603 QLVDVAIAEXOPAU-UHFFFAOYSA-N 329.381 1.336 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(Cc2ccccn2)CC1 2307982235 UUARGLBFNICRGH-UHFFFAOYSA-N 339.395 1.850 10 10 EDCE CC[C@@H]1CN(C(=O)C=Cc2ccc(O)c(O)c2)CCN1C[C@H](C)O 2308001664 DKMFXTAGDICOQI-DZGCQCFKSA-N 334.416 1.415 10 10 EDCE Cc1ccc(CN[C@H]2C=CS(=O)(=O)C2)c(O)c1Br 2327800156 GYFQUVIWEBOPEW-JTQLQIEISA-N 332.219 1.863 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)c(Br)c1 2336465844 MLNBMXFAPSKOJP-DFAYQTQMSA-N 346.246 1.736 10 10 EDCE Cc1ccc(CN2C[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(O)c1Br 2352685757 GRAFMKXBAITUOD-NUZBWSBOSA-N 328.206 1.389 10 10 EDCE COC(=O)CN1C(=O)/C(=C2\C(=O)N(C)c3ccccc32)SC1=S 1810237 BSYCWQHVVKRWOF-VAWYXSNFSA-N 348.405 1.407 10 10 EDCE CCOc1ccc(N2C(=O)NC(=O)/C(=C\N[C@H](C)CC)C2=O)cc1 103762821 QJCKRIIEHFPPAD-ZTMOJVSCSA-N 331.372 1.940 10 10 EDCE Cc1cccc(N2C(=O)/C(=C/NC[C@H]3CCCO3)C(=O)NC2=S)c1 103843216 HJIQVVQRSWLPON-PCRWRXJSSA-N 345.424 1.395 10 10 EDCE CCOc1ccc(N2C(=O)NC(=O)/C(=C\N[C@@H](C)CC)C2=O)cc1 103762827 QJCKRIIEHFPPAD-IWQAVIMZSA-N 331.372 1.940 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc2cc[nH]c2c1 193252034 WUAGYJUWALELRR-UHFFFAOYSA-N 339.351 1.877 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](C)[C@@H](OC)C3)nc12 275890628 RZSSQCUHDRMHDG-RISCZKNCSA-N 348.403 1.468 10 10 EDCE CC(=O)C(=O)COC(=O)C[C@H](C)S(=O)(=O)c1ccc(F)cc1 808514447 CYWWNJKCNKOECK-VIFPVBQESA-N 330.333 1.079 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCCN(C)C3=O)CC2)cc1F 294782868 ASDJOAGDVFQQQS-AWEZNQCLSA-N 349.406 1.351 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@H](C(F)F)C2)cc1 801560623 RTZUCWVMNKZTHH-AWEZNQCLSA-N 327.375 1.335 10 10 EDCE O=C1Nc2cc(N3CC([C@@H](F)CO)C3)c(Br)cc2[C@@H]1O 2166893317 BDXYDHOCIWSRPT-CABZTGNLSA-N 345.168 1.201 10 10 EDCE Oc1cccc(Br)c1CN1CC[C@]2(CNCCO2)C1 719944469 DGUQXHIKRIJWKP-AWEZNQCLSA-N 327.222 1.719 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)C3CC(C(=O)O)C3)C2)cc1 819926737 JMFONGLRWCRAAZ-IYXRBSQSSA-N 332.400 1.749 10 10 EDCE CC[C@@H](NC/C=C/c1ccc(N(C)C)cc1)C(=O)N1CCOCC1 835044403 ZREYEVAOYIYVIO-DUMMIQTOSA-N 331.460 1.993 10 10 EDCE CC[C@H]1[C@H](CO)CCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 830707486 FTKZBKLNVGIWQB-WMZOPIPTSA-N 333.476 1.804 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H]([C@@H](O)c3cccnc3)C2=O)cc1 924445513 OGTCCEQXXLVVSY-HOTGVXAUSA-N 340.383 1.302 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@](C)(O)C(C)C)C2)cc1 854301840 UWRMYBGSJUODKZ-RDTXWAMCSA-N 335.448 1.980 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccnc4[nH]cnc34)C2)cc1 855227970 SJLKSRAPUROSFJ-LBPRGKRZSA-N 337.383 1.975 10 10 EDCE COc1ccc(N2CC[C@H](Nc3nc(N)c4cnn(C)c4n3)C2)cc1 853759115 PJNKEEVLLBTPGG-NSHDSACASA-N 339.403 1.645 10 10 EDCE Oc1ccccc1CN(C[C@@H]1CCCO1)C[C@@H]1CC2(CNC2)CO1 923298829 KWVVWUPTTQMYGD-IRXDYDNUSA-N 332.444 1.752 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@](F)(CO)C3)C2)cc1 854297269 LNNLULFUDCBBLI-GUYCJALGSA-N 337.395 1.390 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CC[C@@H](C)NC3)C2)cc1 861648615 YJVMINXFGNXPKM-BZUAXINKSA-N 346.475 1.961 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2Cc3cccc(O)c3C2)C1 871204353 YOLCLINITXRERK-OAHLLOKOSA-N 348.399 1.870 10 10 EDCE C[C@H](NC[C@@H](C)CS(C)(=O)=O)c1ccc(N2CCOCC2)cc1 775259039 MVUDLDOJTSWPDA-CABCVRRESA-N 340.489 1.855 10 10 EDCE CCOc1cccc(CN2CCC(OCCC(=O)NC)CC2)c1O 770287219 WHPRPWPNOSSLSD-UHFFFAOYSA-N 336.432 1.908 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1C[C@@H](CO)[C@H](C(F)(F)F)C1 870789190 VAJSZKLPZORFTK-TWLCVDABSA-N 331.290 1.740 10 10 EDCE C[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H]1F 778468272 LWPRSRRVXPAJAH-CABZTGNLSA-N 330.381 1.584 10 10 EDCE CN1CCCc2cc(CNC(=O)C3CN([C@H]4CCOC4)C3)ccc21 895979913 DPPHWHBLYJVPPM-KRWDZBQOSA-N 329.444 1.406 10 10 EDCE NC(=O)[C@@H]1CC[C@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 896271157 ZVSJSALJXKOQDD-YCPHGPKFSA-N 346.427 1.801 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1895032265 XUHFIMZXMAUKCV-KKOKHZNYSA-N 328.384 1.600 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)NCc2cccc(Cl)c2O)C[C@H]1C 890763408 VVMGPJANQIMABF-XTWCZFFVSA-N 327.764 1.628 10 10 EDCE COc1cc(NS(=O)(=O)c2cc(C(=O)O)ccc2O)ccc1O 797819740 QFIJSYZSEQKSBP-UHFFFAOYSA-N 339.325 1.605 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)[C@H](O)c2ccccn2)N(C)C)cc1 891246751 CUUUWVRBBDGGNK-ZWKOTPCHSA-N 342.443 1.600 10 10 EDCE C[C@H](O)CNC1(C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1328051534 VOPZMDPLTXZZPG-LBPRGKRZSA-N 347.419 1.814 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](O)[C@H]2C)cc1 1332812450 YEWUMEKTQARGKS-RHSMWYFYSA-N 347.459 1.521 10 10 EDCE CCN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C[C@@H]1CCOC1 1266440394 RFSGCDKRDWPKFS-ZDUSSCGKSA-N 347.419 1.937 10 10 EDCE C[C@@H]1CC2(CCNCC2)CN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1261875540 JWYVUGOTZUGJBV-CYBMUJFWSA-N 343.427 1.225 10 10 EDCE Cc1cc(Cn2c(-c3sccc3O)nnc2N2CCOCC2)no1 1347472067 DMBOYCARMBBQGH-UHFFFAOYSA-N 347.400 1.894 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccc(C)n2C)cc1C 1272362024 KRKYJSVPLIPDOA-INIZCTEOSA-N 345.443 1.531 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cc(C)[nH]n2)cc1C 1501442091 YTYHEPNERZYSFL-UHFFFAOYSA-N 346.431 1.259 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCOC[C@H]1C[C@H](O)c1ccco1 1445635979 ZZQFKNDWAHGQHA-CJNGLKHVSA-N 347.367 1.584 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)c(Br)c1 2116737200 QHNJPIXZZBHJMM-JXJLXUTGSA-N 328.206 1.262 10 10 EDCE O=C(NCC1CC1)[C@@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1544280958 OUEZBESTQQQPCC-CQSZACIVSA-N 332.400 1.405 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)[C@H]2CCC(=O)N2)cc1C 1485714466 HLLUFSGNFJATOH-GDBMZVCRSA-N 347.459 1.657 10 10 EDCE CCCc1nnc(SCC(=O)NCc2c(O)cccc2F)n1N 1558455785 YOLIKIMTGIZDLG-UHFFFAOYSA-N 339.396 1.198 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2[nH]ccc2C)cc(OC)n1 1494699099 XDQFCYCHKMGQAA-LLVKDONJSA-N 346.387 1.284 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@@H]2COC(=O)N2)cc1C 1568627118 MOLNPFCBDPGNHA-OCCSQVGLSA-N 335.404 1.096 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(c2ncccc2F)CC1 1632299799 ZJUPNBQQDLBDCF-UHFFFAOYSA-N 331.347 1.523 10 10 EDCE COC(=O)[C@H](CNC(=O)Cc1ccc(O)c(O)c1)c1ccccc1 1633915339 QAKLGAFURYIFRD-CQSZACIVSA-N 329.352 1.713 10 10 EDCE CN(CC(=O)NCc1c(O)ccc2c1CCCC2)[C@@H]1CCC[C@H]1O 1566359983 URNLZFILRFFEKS-SJLPKXTDSA-N 332.444 1.732 10 10 EDCE CNCc1ccc(N2CC[C@H](S(C)(=O)=O)C2)c(Br)c1 2123321308 RDUDISAHEVDXLJ-NSHDSACASA-N 347.278 1.792 10 10 EDCE CCC[C@@H](O)[C@H](CO)NC(=O)c1cc2cc(O)c(O)cc2s1 1642392616 ORBRVWUSWMOJTN-VHSXEESVSA-N 325.386 1.564 10 10 EDCE COCCN(C)CCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1649457704 KOHWEBZBGSHBGE-UHFFFAOYSA-N 335.408 1.889 10 10 EDCE CO[C@H](C)CNC/C=C/CNC(=O)c1ccc(N=NC(N)=O)cc1 1732938228 DBFAFQGJIYAKDJ-CUQVVGSPSA-N 333.392 1.760 10 10 EDCE CN(Cc1ccccc1O)c1nnc(C2CC2)n1C[C@@]1(O)CCOC1 1768681861 OQECWFHPGNUMOR-SFHVURJKSA-N 344.415 1.649 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCCN(C)C2=O)c1O 1964078793 YSAYNVQFFDVZIF-NSHDSACASA-N 343.221 1.874 10 10 EDCE CN(C)c1ccc([C@](C)(O)[C@H](NC(=O)OC(C)(C)C)C(=O)O)cc1 1917210307 ZWJONGDJOGIBTM-DYVFJYSZSA-N 338.404 1.938 10 10 EDCE C[C@]1(F)CN(C(=O)c2cc(O)nc(O)c2)C[C@@]1(C)Br 2140730131 GREJYUXWHDLJIU-NEPJUHHUSA-N 333.157 1.830 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1CC(=O)NCCN=[N+]=[N-] 1985093506 ALANQFKMXZWDHM-MNOVXSKESA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@]1(C)C(=O)NCCCN=[N+]=[N-] 1985099701 ATKXOAFLBSXQDX-YGRLFVJLSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N1CC(C)(C)OC[C@H]1C(=O)NCCN=[N+]=[N-] 1985094418 OLHQZRLHVACHLF-JTQLQIEISA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(C(=O)NCCCN=[N+]=[N-])C1 1985104787 LSXNMRYCPOPRTP-AWEZNQCLSA-N 327.385 1.423 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2010406050 PHIKWKWRUGVWIN-RYUDHWBXSA-N 341.412 1.811 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NCc2cccc(F)c2O)C1 2011917899 MSCLUBZENNCWAY-KGLIPLIRSA-N 340.395 1.991 10 10 EDCE NCc1ccc(N2CC[C@@H]3C(=O)NC(=O)[C@@H]3C2)cc1Br 2158786501 WMLKQSKXSZUVLV-WDEREUQCSA-N 338.205 1.007 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CCCN(c2cnccn2)C1 2064018563 HVRIUAORYRPCCX-GFCCVEGCSA-N 328.372 1.421 10 10 EDCE COC12CC(C1)N(c1cc3c(cc1Br)[C@@H](N)C(=O)N3)C2 2185472429 YNMHLKYGONUMJA-BWQPLIALSA-N 338.205 1.769 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@@H](CO)C[C@@H]32)cc1Br 2199786208 MELYCWYFVXTULB-NZVBXONLSA-N 341.249 1.884 10 10 EDCE NC(=O)CO[C@H]1CCN(c2ccc(CO)cc2Br)C1 2089140073 UAKGMQYQOUAMRG-JTQLQIEISA-N 329.194 1.022 10 10 EDCE NCc1ccc(N2CCN(CCCO)CC2)cc1Br 2113619233 DGXNMBKPWUCKDC-UHFFFAOYSA-N 328.254 1.412 10 10 EDCE CCc1ccc(N2C(=O)NC(=O)C(=CNCCCN(C)C)C2=O)cc1 2296110680 WDAOORPEWJPDBP-UHFFFAOYSA-N 344.415 1.257 10 10 EDCE COCCN1C(=O)C(=Cc2ccc3c(c2)OCO3)C(C(=O)OC)=C1C 2296659681 JUXJHFXKWPEDDK-UHFFFAOYSA-N 345.351 1.734 10 10 EDCE OC[C@]1(O)CCN(c2ccc(OCc3ccccc3)cc2)C[C@@H]1O 2299509535 AZPWYHPZUPYEDQ-RBUKOAKNSA-N 329.396 1.560 10 10 EDCE N[C@@H]1CC[C@H]2CN(C(=O)C=Cc3ccc(N4CCOCC4)cc3)C[C@H]12 2308750408 PLOPMPNXOXYWJD-YTQUADARSA-N 341.455 1.732 10 10 EDCE Cc1ccc(CN2CCNC[C@H]2C(=O)O)c(O)c1Br 2352690558 BXYJRBQTKMDDSH-JTQLQIEISA-N 329.194 1.322 10 10 EDCE Cc1ccc(CNC[C@@H]2CCS(=O)(=O)C2)c(O)c1Br 2352692213 IIESEKUXGVAMLS-JTQLQIEISA-N 348.262 1.987 10 10 EDCE COC(=O)CN1C(=O)/C(=C2\C(=O)Nc3ccccc32)SC1=S 1810235 PGSNZJAADPHQMX-ZHACJKMWSA-N 334.378 1.383 10 10 EDCE COc1c(O)cc2c(c1O)C(=O)[C@H](O)[C@@H](c1ccc(O)c(O)c1)O2 14436387 FDRYLJGFQYHFHZ-LSDHHAIUSA-N 334.280 1.195 10 10 EDCE biogenic,in-vitro CNC(=O)[C@H]1CCCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 210024822 UXSSTSWVMIPRQS-WOLRVDTOSA-N 347.371 1.743 10 10 EDCE Cc1cc(C(=O)N2CC[C@H](CO)[C@H](O)C2)c(C)n1-c1ccccc1 191981339 HXZPFIRNAFQRQT-CRAIPNDOSA-N 328.412 1.909 10 10 EDCE CN1CCN(c2ccc(/C=C/C(=O)O)cc2Br)CC1=O 234367316 SWPZVSPYWNXXEM-HWKANZROSA-N 339.189 1.825 10 10 EDCE CS(=O)(=O)N[C@@H]1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 93530969 LJSGVUNANKGUMY-SNVBAGLBSA-N 349.796 1.077 10 10 EDCE CC1(O)CCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1 255509932 GBNYFKWHBYADHQ-DAXSKMNVSA-N 330.428 1.910 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCS(=O)(=O)C(C)(C)C2)cc1 268105110 XUDXZCHOPQDDPB-UHFFFAOYSA-N 339.461 1.471 10 10 EDCE Cc1ccc(CN2CCO[C@@H]3[C@@H](C(=O)O)[C@H]32)c(O)c1Br 2380809855 CXYGGCFEOVPORZ-UFGOTCBOSA-N 342.189 1.747 10 10 EDCE C[C@@H]1C[C@@H](N(C)CC(=O)NCc2ccc(N(C)C)cc2)CCN1C 299215098 HVJUDELAWKRSHL-QAPCUYQASA-N 332.492 1.783 10 10 EDCE CCN1CC[C@H](NC(=O)NCc2c(O)ccc3c2CCCC3)C1=O 801800153 UAROCAWXLYLOGW-HNNXBMFYSA-N 331.416 1.691 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1C(=O)NCc1cc(Br)ccc1O 804734316 ASZJSQZPGBATAH-VHSXEESVSA-N 328.162 1.580 10 10 EDCE Cc1cc(CCNC(=O)[C@@H]2COC(=O)N2)c(C)n1-c1ccccc1 822273090 ARZSOQXGZSGPCX-INIZCTEOSA-N 327.384 1.861 10 10 EDCE CN1C[C@@H](O)C[C@@]1(C)C(=O)NCc1ccc(N2CCCCC2)cc1 900405590 YVINMWUJKNUTON-HKUYNNGSSA-N 331.460 1.748 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CC[C@](O)(C(F)F)C3)ccc21 838031615 LKXWPQPCLZUWHI-QGZVFWFLSA-N 339.386 1.981 10 10 EDCE Cc1cc(CC(=O)N[C@@H]2CN(C)NC2=O)c(C)n1-c1ccccc1 831686181 NEXVLIBWWBBMOO-MRXNPFEDSA-N 326.400 1.098 10 10 EDCE CN(C)C[C@@H](Cc1ccccc1)NC(=O)C(=O)Nc1ccc(N)cc1 841019469 IHKCPKRBEPSULD-QGZVFWFLSA-N 340.427 1.496 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@@H]1CC[C@H](C(F)(F)F)NC1=O 928712291 QHLFIFPMQCLGFW-WRWORJQWSA-N 334.269 1.605 10 10 EDCE C[C@]1(CO)C[C@H](O)CN1c1ccc(CN)c(Br)c1F 698201871 NBUHOMVKISCOPP-TVQRCGJNSA-N 333.201 1.369 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3C[C@@H]4COC[C@@H]4O3)CC2)c(OC)c1 931531067 WSYJOYGVQIJTFQ-ALKREAHSSA-N 348.443 1.630 10 10 EDCE CN(C)c1ccc(CN2CCN(c3nccn(C)c3=O)CC2)cc1F 769467293 SIRWSHDYCNTXMI-UHFFFAOYSA-N 345.422 1.308 10 10 EDCE CC1CC(n2nnc3c2CN(C(=O)c2cccc(O)c2O)CC3)C1 870737636 UFNMANCSJDDKTA-UHFFFAOYSA-N 328.372 1.859 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@@H](O)CC(F)(F)C1 786777864 OOIWYQHOGHXECW-HNNXBMFYSA-N 337.370 1.974 10 10 EDCE O=C1C[C@@]2(CCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)CN1 897601329 JDPVQMNGJMTVOG-INIZCTEOSA-N 332.381 1.665 10 10 EDCE CN(C[C@H](O)C1CC1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 690293214 NKNGOPQKASNARE-STQMWFEESA-N 340.221 1.608 10 10 EDCE COc1ccc(COCC(=O)NCc2ccc(N(C)C)cc2)cn1 1348099398 DXZQEQAVPVDLMQ-UHFFFAOYSA-N 329.400 1.989 10 10 EDCE C[C@@H](O)C(C)(C)CNC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1347847322 ZIPDUZNEKDQHDY-OAHLLOKOSA-N 348.491 1.645 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@H]3CC[C@@H](C(N)=O)C3)CC2)cc1 1358139979 DCQPMZSANJXOSY-CABCVRRESA-N 345.443 1.636 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCC(=O)N1 1513793096 DLTISZWIPNEMKL-CYBMUJFWSA-N 329.404 1.461 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ncccc1N 1295591191 WXHPQBSYHHZSMR-UHFFFAOYSA-N 349.774 1.838 10 10 EDCE Cn1nc(C2CCOCC2)cc1C(=O)NCc1cccc(O)c1O 1520509656 SWVILUXVCPETGK-UHFFFAOYSA-N 331.372 1.655 10 10 EDCE CCNS(=O)(=O)c1cccc(CNC(=O)c2cc(O)cs2)c1 1299136429 UXQGNDHLFKTGTK-UHFFFAOYSA-N 340.426 1.682 10 10 EDCE NC(=O)[C@H](O)CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1612339036 CVEOLSPAPILWNP-CQSZACIVSA-N 329.312 1.084 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1ccc(NS(C)(=O)=O)nc1 1545503034 KDVCVANYGRHFON-UHFFFAOYSA-N 335.385 1.431 10 10 EDCE CNCc1ccc(N2C[C@@H]3NC(=O)O[C@@H]3C2)cc1Br 2120415256 GVBLKOYSQWAZQG-NWDGAFQWSA-N 326.194 1.466 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2cn(C)nn2)cc1C 1714388129 DIZSTFCMIAKXOM-GFCCVEGCSA-N 331.420 1.288 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)c2c[nH]c(=O)cn2)cc1C 1568671041 JWKROZHPFPZXIP-ZDUSSCGKSA-N 344.415 1.385 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@@H](C)n2cncn2)cc1C 1732685445 OEALVUVMKOSNQV-HUUCEWRRSA-N 345.447 1.841 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@]2(C)CCNC2=O)cc1C 1731619469 XCCWIWNPSCPZPP-ACJLOTCBSA-N 333.432 1.124 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H]2CCCC(=O)N2)cc1C 1731730550 XZDOKRPNKRVJJY-GDBMZVCRSA-N 347.459 1.657 10 10 EDCE CCNC(=O)N1CC[C@@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C1 1587830010 CBUGCIHKFSSMFX-SNVBAGLBSA-N 349.412 1.846 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C23CCN(CC2)C3)cc1C 1774044522 JKSWDZSXLPQNIE-OAHLLOKOSA-N 331.460 1.694 10 10 EDCE COC[C@H]1CN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])CCO1 1772833492 XMJOQWLBQYLXQG-RYWCDNDXSA-N 336.344 1.633 10 10 EDCE Oc1ccc(Br)cc1CN1CCO[C@H]2CCNC[C@@H]21 2129072645 RWJFFBXEWNLYOO-JSGCOSHPSA-N 327.222 1.717 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)N1CCC(N=[N+]=[N-])CC1 1912190605 GKCGXKKHPNHMFJ-UHFFFAOYSA-N 349.214 1.646 10 10 EDCE CCN1CCO[C@@H](CNCc2cc(Br)ccc2O)C1 223332479 NJKGWXOYCQBPPO-ZDUSSCGKSA-N 329.238 1.965 10 10 EDCE CC(C)(C)OC(=O)NC1CN(CC(=O)NCCCCN=[N+]=[N-])C1 1985094499 PQPBHDYBAMZVIS-UHFFFAOYSA-N 326.401 1.402 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NCc2ccc3c(c2)CCO3)C1 1997820032 NEAFIMKZGUTIFS-GJZGRUSLSA-N 334.416 1.691 10 10 EDCE CC[C@H](N[C@@H]1CCO[C@@H]1C(N)=O)c1cc(Br)ccc1O 2174102527 GPQJKWDYYIOFNS-LOWVWBTDSA-N 343.221 1.838 10 10 EDCE CS(=O)(=O)[C@@H]1CCN(c2ccc(CN)cc2Br)C1 2059360845 YWSFRTBLMFLBOD-SNVBAGLBSA-N 333.251 1.531 10 10 EDCE Cn1nc(CNC(=O)OC(C)(C)C)cc1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2060613588 SWKLYQIALWVWOT-SNVBAGLBSA-N 349.395 1.970 10 10 EDCE OCc1ccc(N2CCO[C@H]3COCC[C@H]32)cc1Br 2087487600 SAIMLVOELJKMKF-KGLIPLIRSA-N 328.206 1.936 10 10 EDCE Oc1cc2c(cc1CN=c1[nH]nc(Br)s1)OCO2 2218853834 BFISHHXCFXRLCX-UHFFFAOYSA-N 330.163 1.769 10 10 EDCE COC(=O)N[C@H](C)CNCc1c(Br)ccc(OC)c1O 2290372778 KIDJOWDNIKPQLA-MRVPVSSYSA-N 347.209 1.997 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](C)CS(C)(=O)=O)CC2)cc1 176409928 CSTFHRWNHBVDEE-CYBMUJFWSA-N 340.445 1.025 10 10 EDCE CO[C@@H](c1cc(O)nc(O)c1)[C@@H](NC(=O)OC(C)(C)C)C(=O)O 1952776413 UMURSTAOPISXQJ-MNOVXSKESA-N 328.321 1.158 10 10 EDCE N#Cc1cccc(CS(=O)(=O)Nc2ccc(O)cc2C(=O)O)c1 321165156 QEJRGSOGNXRZPX-UHFFFAOYSA-N 332.337 1.904 10 10 EDCE CN1CCCN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)CC1=O 190623290 PDWQLCHNQKHWFB-VMPITWQZSA-N 343.427 1.227 10 10 EDCE COc1cc(N2CCN(C(=O)CSC)CC2)cc(OC)c1OC 273942016 KJKCAENCDSMVBV-UHFFFAOYSA-N 340.445 1.724 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@H]2CO)c(Br)c1 704709950 TWYPPGXCJIIKKJ-RYUDHWBXSA-N 329.238 1.491 10 10 EDCE C[C@H](C(N)=O)N(C)c1ccc(/C=C\C(=O)O)c(Br)c1 711183590 DUOAZGIVAZSWKC-RZAAKKIOSA-N 327.178 1.857 10 10 EDCE CCN1CCN(c2ccc(CNC[C@H](O)C(F)(F)F)cc2F)CC1 819033811 SNGJOFLQODURLE-HNNXBMFYSA-N 349.372 1.980 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@H](C)[C@@H]3C)CC2)cc1 815163877 RWTGYYKLLOINNH-BQFCYCMXSA-N 333.476 1.518 10 10 EDCE c1cc2c(cc1CNCC1CN(c3ccc4nncn4n3)C1)CCO2 585592251 UGWKAPCKGNJESH-UHFFFAOYSA-N 336.399 1.285 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cc(NC(C)=O)ccc2O)c1 734015253 CTHXKDNUBADOJI-UHFFFAOYSA-N 330.340 1.995 10 10 EDCE COC1CCN(c2ccc(CN3CCN(CCO)C[C@H]3C)cc2)CC1 832782021 FVQHXXHCLOZWOM-QGZVFWFLSA-N 347.503 1.800 10 10 EDCE CN1CCC[C@@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 919657625 SKEIDNRUKUQDIM-QGZVFWFLSA-N 346.475 1.759 10 10 EDCE COc1ccc(CNC(=O)NCCCNCc2cccnc2)c(O)c1 841936724 XHUUCZHAOASLBG-UHFFFAOYSA-N 344.415 1.775 10 10 EDCE NS(=O)(=O)c1ccc(CNC(=O)NCc2ccccc2O)cc1 748462816 JTBVVZVAIDOFAA-UHFFFAOYSA-N 335.385 1.039 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CSc3n[nH]c(O)n3)C2)cc1 855228152 WINUUWVWYBLOBG-SNVBAGLBSA-N 349.416 1.006 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CN1 861768064 WAMWNZSABSFJDJ-UMVBOHGHSA-N 332.448 1.187 10 10 EDCE COC(=O)C(C)(C)N1CCN(C(=O)c2ccc(C)c(O)c2O)CC1 779170609 DCBMKRQLEGNUEW-UHFFFAOYSA-N 336.388 1.116 10 10 EDCE C[C@H]1[C@@H](C)O[C@H](C)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 783814056 NQMWKAFQMIWCCK-OUAUKWLOSA-N 342.417 1.402 10 10 EDCE C[C@@H]1c2cccn2CCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1329392956 SMOHETYXVYJDCR-GFCCVEGCSA-N 325.368 1.639 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cnnn2C)cc1C 1267980763 XLWJQOQGQDQRHA-LBPRGKRZSA-N 331.420 1.288 10 10 EDCE Cc1cc(C(=O)N2C[C@@H](CO)[C@H](CCO)C2)c(C)n1-c1ccccn1 1350989286 BYLRBHYFOMVAFH-CVEARBPZSA-N 343.427 1.552 10 10 EDCE COc1ccc(CN[C@H](C(=O)O)[C@@H]2CCCO2)cc1Cn1cccn1 1352081006 IRLUKQWZFZENEV-IRXDYDNUSA-N 345.399 1.662 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)C(C)(F)F)cc1C 1501431028 OYJUMWPUGBNJSK-UHFFFAOYSA-N 330.375 1.569 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CC[C@@H](C(N)=O)C1 1440675442 RTOVLBYHQDZGTA-CVEARBPZSA-N 345.443 1.383 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)C2CN(C(C)=O)C2)cc1C 1282124844 QSIQRHFZSCYFCC-UONOGXRCSA-N 347.459 1.465 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)/C=C(\C)C2CC2)cc(OC)n1 1284202469 COGCDMRFMZEKNV-YTRUQHMWSA-N 347.415 1.690 10 10 EDCE CCN(C)C(=O)[C@H]1CSCN1C(=O)c1ccc(N=NC(N)=O)cc1 1464719434 ICQBLBVFTSWGFD-GFCCVEGCSA-N 349.416 1.842 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@]2(C)CCNC2=O)cc1C 1482870707 GIBVPKICZIYION-AUUYWEPGSA-N 347.459 1.514 10 10 EDCE O=C(CCc1nn[nH]n1)Nc1c(-c2ccccn2)nc2ccccn12 1556879376 METKAAKEAJQOGB-UHFFFAOYSA-N 334.343 1.481 10 10 EDCE O=C(Cc1nnn[nH]1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 169864871 PISIFTZPUDXYNT-UHFFFAOYSA-N 333.307 1.156 10 10 EDCE COc1ccc(N2CCCN(C[C@@H](C)CS(C)(=O)=O)CC2)cc1 163068321 OGRQPMLKSZJIEP-OAHLLOKOSA-N 340.489 1.888 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CNC(=O)c1cccnc1 159333128 ZPXZRXQWNOMDAZ-UHFFFAOYSA-N 326.400 1.536 10 10 EDCE OCc1ccc(N2C[C@H](CO)OCC23CC3)c(Br)c1 2127538485 LQTFRLBYDYDOIJ-LLVKDONJSA-N 328.206 1.672 10 10 EDCE CNCc1ccc(N2CC(CNC(N)=O)C2)cc1Br 2130733736 ZVWNRRUGZZNSEV-UHFFFAOYSA-N 327.226 1.273 10 10 EDCE Oc1ccccc1CN=c1cc(I)nc[nH]1 1981602919 LYBZBHCOSRXWBO-UHFFFAOYSA-N 327.125 1.821 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985103300 SOQZKAIWRSHDNJ-DCAQKATOSA-N 327.385 1.562 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]1(C)COC[C@@H]1NC(=O)OC(C)(C)C 1985101440 SIVKZHQATFIYKK-HZMBPMFUSA-N 327.385 1.685 10 10 EDCE CN1C(=O)N[C@H]2CN(c3ccc(CN)cc3Br)CC[C@H]21 2171304545 HKEXFDBRTTXMKP-WCQYABFASA-N 339.237 1.510 10 10 EDCE O[C@@H]1COCCN(c2ccc(CNC3CC3)c(Br)c2)C1 399944715 PHFJIXJDVFRVOC-AWEZNQCLSA-N 341.249 1.899 10 10 EDCE N[C@@H]1CC(C(=O)N2CCCc3cccc(Br)c32)=C[C@H]1O 2188025609 GVFKYPJVPLQXOQ-CHWSQXEVSA-N 337.217 1.747 10 10 EDCE Oc1c(F)cc(Br)cc1CN1C[C@H]2OCCO[C@@H]2C1 2093357699 MJKRCZKACWLFBD-VXGBXAGGSA-N 332.169 1.893 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@H](CCOc2nnc(=N)[nH]n2)CC1 2213780612 IEPXLJQMRFADTB-NSHDSACASA-N 338.412 1.485 10 10 EDCE Cc1ccc(Nc2nnc(=N)[nH]n2)cc1CNC(=O)OC(C)(C)C 2217059714 JPTWRGISZDHTRL-UHFFFAOYSA-N 331.380 1.756 10 10 EDCE CNCc1ccc(N2C[C@H]3COC[C@@]3(CO)C2)cc1Br 2234553371 XPNUXSWQRSHUHR-WFASDCNBSA-N 341.249 1.614 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2COC[C@H]2O)c1O 2227749980 HYOQZNSUFLMTLG-LDYMZIIASA-N 332.194 1.260 10 10 EDCE CC[C@H](C)NCc1ccc(N2C[C@@H](O)[C@H](O)C2)cc1Br 2240086246 RKIGJHNMKBUZPG-COLVAYQJSA-N 343.265 1.879 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@]2(C(=O)N3CC(N=[N+]=[N-])C3)CO[C@H]1C2 2247350558 ZPPJFHARKLOYFL-PGUXBMHVSA-N 337.380 1.580 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cn(C)nc1C 179108969 PFZDJHPTBAARBE-UHFFFAOYSA-N 343.431 1.782 10 10 EDCE COc1ccc(N(C)CC(=O)N2CCC[C@@H](C(N)=O)C2)cc1Cl 121856633 QOUURLFDPWXRQY-LLVKDONJSA-N 339.823 1.509 10 10 EDCE CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)/C=C/c1ccc(O)c(O)c1 372477582 HEAZCJLZPOJGCR-MPCGPATOSA-N 349.383 1.680 10 10 EDCE C[C@@H](NC(=O)C(=O)N(C)C[C@@H]1CCCO1)c1ccc(N(C)C)cc1 807670950 JVVOYHFZVHAOPC-CJNGLKHVSA-N 333.432 1.567 10 10 EDCE CC(C)N(C[C@H](C)O)C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807670735 HPUYEWAYUAFKBH-UONOGXRCSA-N 335.448 1.548 10 10 EDCE COc1ccc(N2CCCN(c3nc(C(N)=O)cs3)CC2)cc1 814361648 ZLDUTHTVKOTPPE-UHFFFAOYSA-N 332.429 1.967 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=S)NCCN2CCOCC2)c1 728791726 FAQHOSXRRGHWBE-GFCCVEGCSA-N 339.461 1.258 10 10 EDCE Cc1cc(CCNC(=S)NCC(N)=O)c(C)n1-c1ccccc1 727071029 SWRFRNGEDLVDAV-UHFFFAOYSA-N 330.457 1.586 10 10 EDCE C[C@H](NC(=O)[C@@]12C[C@H]3C[C@H](C(=O)N1)[C@H]2C3)c1ccc(N(C)C)cc1 844486672 ZVTOMLYOMZUHDB-GLJDYUSFSA-N 327.428 1.845 10 10 EDCE CN1CCN(c2ccc(CN3C(=O)N[C@H](CCF)C3=O)cc2)CC1 925079533 JWZLNVHUHDIEAU-OAHLLOKOSA-N 334.395 1.218 10 10 EDCE CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)NCc2c(O)cccc2F)C1 920031132 YOSCCDVTPUOLLU-GHMZBOCLSA-N 344.408 1.686 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1CC[C@@H](C2CC2)N1 852868293 CWHVYYVZJBOLOI-RBUKOAKNSA-N 343.471 1.795 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)C[C@H]3CCOC3)C2)cc1 852456466 YIFANTQLZLZWQZ-CABCVRRESA-N 333.432 1.952 10 10 EDCE COCC1(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCNCC1 851639945 NIWVQHRANLLFNC-HNNXBMFYSA-N 347.459 1.406 10 10 EDCE CC[S@](C)(=O)=NS(=O)(=O)NCCCSc1nccs1 866782217 QRBLMQDZTUQBRC-SFHVURJKSA-N 343.521 1.577 10 10 EDCE C[C@](O)(C[C@H](O)CNCc1ccc(N2CCOCC2)cc1)C1CC1 872200088 SXLWZWPAJZKZDF-OALUTQOASA-N 334.460 1.525 10 10 EDCE COc1ccc(N2CCC(NC(=O)CCCCC(N)=O)CC2)cc1 779620999 JOULFVHEXWXXAS-UHFFFAOYSA-N 333.432 1.826 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NCCC2CS(=O)(=O)C2)c1 786842137 MPVFAFOOYMFXEV-SNVBAGLBSA-N 342.417 1.196 10 10 EDCE CS(=O)(=O)N1CCCC[C@H]1CNCc1cc([N+](=O)[O-])ccc1O 796513058 JDIIOQOQCRPSCK-ZDUSSCGKSA-N 343.405 1.204 10 10 EDCE COC(=O)c1cc(C(=O)NCc2c(O)ccc3ccccc23)n(C)n1 1179032544 LOKRLHIWDYYNTG-UHFFFAOYSA-N 339.351 1.996 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CNCc2cccc(O)c2O)[C@@H](O)C1 705693428 BFGLFEBEYZAHPY-JSGCOSHPSA-N 338.404 1.415 10 10 EDCE COC(=O)CC1(NCc2ccc(N3CCN(C)CC3)c(F)c2)CC1 1326788895 TVZRTPLPMWXKMW-UHFFFAOYSA-N 335.423 1.763 10 10 EDCE CCOc1ccc(N2CCN(CC(=O)Nc3cccnn3)CC2)cc1 1335581775 KJNXSGKCYVYAMF-UHFFFAOYSA-N 341.415 1.636 10 10 EDCE CCC(C)(C)N1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1261867668 MYGWROONXFAWQV-UHFFFAOYSA-N 345.443 1.567 10 10 EDCE CO[C@]1(C)CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1351922046 OXLKKOUISNRMLN-GOSISDBHSA-N 332.400 1.652 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)C23CCN(CC2)C3)cc1C 1716368608 VMZWHJOXYCKWRQ-ARJAWSKDSA-N 343.471 1.861 10 10 EDCE NC(=O)c1ccc(CC(=O)NCc2ccc3cccnc3c2O)cc1 1627073458 OIPGZQRVQGXPLO-UHFFFAOYSA-N 335.363 1.898 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2CO)cc1 1637024309 DUHVIOLKRZATHG-UONOGXRCSA-N 331.376 1.130 10 10 EDCE COC(=O)[C@@H](NC(=O)c1cc(O)cs1)c1ccc(OC)c(O)c1 1633326839 FEBMZRNYOLKYDA-ZDUSSCGKSA-N 337.353 1.812 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2ccnc3[nH]c(O)nc23)c1 1630366623 SJHXJRNENWVZAC-MRVPVSSYSA-N 328.328 1.869 10 10 EDCE CC[C@H](CNC(=O)CS(C)(=O)=O)NCc1ccc(OC)c(C)c1 1732193004 CFXMEQUVSCHANZ-CQSZACIVSA-N 342.461 1.033 10 10 EDCE C[C@H](NC(=O)CNS(=O)(=O)c1ccccc1)c1ccccc1O 1587446985 FLFJRIBNGSQGAE-LBPRGKRZSA-N 334.397 1.548 10 10 EDCE COC(=O)c1cccc2c1OCCN(C(=O)c1cccc(O)c1O)C2 1598359730 NQEMVERCQGFYAX-UHFFFAOYSA-N 343.335 1.919 10 10 EDCE CC(C)(C)OC(=O)NC1CCN(CC(=O)NCCCN=[N+]=[N-])CC1 1963703504 BFMUATNDWMEVMP-UHFFFAOYSA-N 340.428 1.792 10 10 EDCE O=C(NCc1ccc(-c2nncnn2)cc1)N1Cc2cccc(O)c2C1 1682410300 QKIBDNTYBUNCMW-UHFFFAOYSA-N 348.366 1.865 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)Cn2cccn2)cc1C 1698813799 JPBHXPFSHOJLQV-OAHLLOKOSA-N 330.432 1.837 10 10 EDCE C[C@H](NCc1ccc(O)cc1O)C1(O)CN(C(=O)OC(C)(C)C)C1 1918675316 HHFLYELNKFVSTH-NSHDSACASA-N 338.404 1.558 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@H](OC)C3)c(Br)cc21 234437934 UDVLNHKTLKJOPE-OQPBUACISA-N 340.221 1.887 10 10 EDCE CC(C)(C)OC(=O)N1CC(F)(CNCc2ccc(O)c(O)c2O)C1 1942675733 IOJKWVVNBCIVPL-UHFFFAOYSA-N 342.367 1.852 10 10 EDCE C[C@H](NC[C@@H](CO)NC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985854355 SDZTURMYCMNQTJ-QWRGUYRKSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2010391310 PFKQNDNMDXRRBY-LLVKDONJSA-N 339.396 1.660 10 10 EDCE OC[C@@H]1CN(c2ccc(CNC3CC3)c(Br)c2)C[C@H]1O 316631560 ZJCRODJUNFVJHA-XHDPSFHLSA-N 341.249 1.491 10 10 EDCE [N-]=[N+]=NCCCCNC(=O)Cn1cc(Br)ccc1=O 701275228 LCOTVURYYARKFY-UHFFFAOYSA-N 328.170 1.818 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)[C@H]1CCCS(=O)(=O)C1 2063694669 FBSIBVMXRATYFK-ZDUSSCGKSA-N 333.409 1.986 10 10 EDCE COCc1cc(O)nc(=NCc2cc(Br)ccc2O)[nH]1 2192812843 IEPQMMWVBVDLCZ-UHFFFAOYSA-N 340.177 1.831 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccc(N)cc2)C[C@@H](O)C1 2044684303 NUQQSYBCOAHXPL-OAHLLOKOSA-N 349.431 1.252 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H](N)C[C@@H](O)C2)c1O 2227749525 DFXGZCWTPBFWLM-DTWKUNHWSA-N 331.210 1.057 10 10 EDCE COC(=O)[C@@H](C)CN(C)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297555324 JLZBQXZZCVRPFL-HNNXBMFYSA-N 346.427 1.804 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)COC)cc2F)CC1 106702705 AGGGCSRRDAFJMM-AWEZNQCLSA-N 337.439 1.866 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NCc1ccc(O)cc1O 301700463 XEJUIWDDBJILHO-HIFRSBDPSA-N 338.404 1.822 10 10 EDCE CC(=O)N1CC[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)C1 176040675 FIWVXFRBQDZCKZ-INIZCTEOSA-N 347.484 1.724 10 10 EDCE C[C@@H](NCCN1CCN(c2ncccn2)CC1)c1ccccc1O 183429939 PKBXKJIVFJHCDN-OAHLLOKOSA-N 327.432 1.655 10 10 EDCE O=C1CN(c2ccc(CNc3nnnn3-c3ccccc3)cc2)CCN1 42110579 YCPCJTFZXHRWQM-UHFFFAOYSA-N 349.398 1.211 10 10 EDCE O=C1CC[C@@H](COC(=O)/C=C\c2ccc(N3CCOCC3)cc2)N1 255712316 MCDWKHTWRDZCHX-VOGXCRAGSA-N 330.384 1.358 10 10 EDCE Cc1cc(Cl)cc(CN2CCC[C@H](CS(N)(=O)=O)C2)c1O 271763526 ZIVCFRRUDSQNBG-NSHDSACASA-N 332.853 1.855 10 10 EDCE CC[C@@H](C(=O)OC)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 276596117 HIQUXNXJWYTQJJ-MRXNPFEDSA-N 334.416 1.681 10 10 EDCE CC(C)C[C@H](CO)N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 283610077 VKTDSQMNFFMUMZ-MRXNPFEDSA-N 335.448 1.234 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN[C@@H](CO)C[C@@H](O)C(C)(C)C)c1O 285281793 UYJNESWSEYEDBH-DGCLKSJQSA-N 342.392 1.557 10 10 EDCE CO[C@H](C(=O)O)C1CN(Cc2ccc(C)c(Br)c2O)C1 2381136354 FAAFEPVIEXNAFN-ZDUSSCGKSA-N 344.205 1.995 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN1c1ncnc2sc(C)cc12 808529880 XHPHCDAXRDBXAA-LBPRGKRZSA-N 347.396 1.670 10 10 EDCE CNCc1ccc(N2CC[C@]3(CNC(=O)C3)C2)c(Br)c1 2163345221 WKQFQFHLQZAGDK-HNNXBMFYSA-N 338.249 1.885 10 10 EDCE CC(=O)C(=O)COC(=O)COc1ccccc1OCC(F)(F)F 808513943 QMWNZCVVQYABDM-UHFFFAOYSA-N 334.246 1.708 10 10 EDCE CN(CC1CC(O)C1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 118712643 KBBRBABOKOHJRA-ROKYYSGWSA-N 340.221 1.608 10 10 EDCE Nc1ccc(Cc2nc(C(=O)N3C[C@H]4CC[C@H]3CN4)cs2)cc1 817860637 QBGDKEYCIFVNRZ-KGLIPLIRSA-N 328.441 1.893 10 10 EDCE Cc1nc(C)c(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)o1 816621034 WPHGTWBTJXOFSJ-UHFFFAOYSA-N 339.373 1.299 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@H](O)[C@@H](O)C1 827568896 IACHNYHYVNWJSW-MSOLQXFVSA-N 342.395 1.474 10 10 EDCE CCN(OC)C(=O)CNC(=O)NCCCSc1nccs1 826693199 SBVOGVWEUPPCHW-UHFFFAOYSA-N 332.451 1.334 10 10 EDCE Fc1cc(CNC[C@@H]2CNCCC2(F)F)ccc1N1CCOCC1 903954509 CZCDKKOAOYUMEF-AWEZNQCLSA-N 343.393 1.997 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)NC[C@@H]2CCCCN2CCO)c1 834851118 UTIVUMHCFPOOSM-ZFWWWQNUSA-N 336.432 1.676 10 10 EDCE C/C(=C/C(=O)NCc1ccc(N(C)C)c(F)c1)CN1CCOCC1 900434993 VIQHNZRIXIWNNL-UVTDQMKNSA-N 335.423 1.786 10 10 EDCE COC(=O)C1CCC(S(=O)(=O)NCc2cc(C)ccc2O)CC1 918004760 UHNHXCLJRWLJPA-UHFFFAOYSA-N 341.429 1.852 10 10 EDCE O=C(NCC[C@]1(O)CCOC1)NCc1ccc(N2CCCC2)cc1 844887469 GVWVSHTXAVHTRE-SFHVURJKSA-N 333.432 1.628 10 10 EDCE COc1cccc([C@@H](C)NC[C@@H]2CCCCN2S(C)(=O)=O)c1O 846173653 UNSHBSQDLOURHY-OLZOCXBDSA-N 342.461 1.866 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3c[nH]nc3[N+](=O)[O-])C2)cc1 855226803 SGVBMOOZKVNLOU-JTQLQIEISA-N 331.332 1.335 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NCC[C@@H]2CCOC2)cc1 853006491 HADZZGZTBKMKTL-CYBMUJFWSA-N 336.388 1.129 10 10 EDCE C[C@@H](NCCCN1CCCS1(=O)=O)c1cc([N+](=O)[O-])ccc1O 756688447 OEVJCOQEWRYGEH-LLVKDONJSA-N 343.405 1.377 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1cn[nH]c1 852229256 PNFDSBAUBVOKCL-CYBMUJFWSA-N 343.431 1.931 10 10 EDCE CC(C)(C)OC(=O)[C@]1(NC(=O)/C=C\c2ccc(O)c(O)c2)CCOC1 855639094 ADKOCSGOJULBAS-YEODSOHDSA-N 349.383 1.728 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CC(=O)N(c2ccc(F)c(F)c2)C1 859915738 SAEZGZZQMDOXBT-VIFPVBQESA-N 325.267 1.019 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCO[C@H]([C@@H](C)O)C3)C2)cc1 854296624 FJOBQHPVOMKSOA-KEYYUXOJSA-N 349.431 1.065 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)N=[S@](C)(=O)CC 866442031 CBUCEQJUPLPGJI-OAQYLSRUSA-N 347.506 1.937 10 10 EDCE O=S(=O)(NCCCSc1nccs1)c1cnc(O)s1 866782268 RZBKDRXPPBITEA-UHFFFAOYSA-N 337.473 1.766 10 10 EDCE O=C1NCC2(CCOCC2)[C@H]1NCc1c(O)ccc(Cl)c1F 895768915 KUVZXLOAZFBSGR-ZDUSSCGKSA-N 328.771 1.570 10 10 EDCE COc1cccc(CNC[C@@]2(O)[C@@H]3[C@@H]4[C@H]5[C@H]6C[C@@H]4[C@H]2[C@@H]6C[C@H]53)c1O 785543672 HQJCPTJEPDXTGN-VNINZOSMSA-N 327.424 1.999 10 10 EDCE O=C(NC[C@H](CO)[C@H]1CCOC1)c1cc2cc(O)c(O)cc2s1 897633125 ZLHDIVQKMICHPX-GXSJLCMTSA-N 337.397 1.687 10 10 EDCE Cc1cc(C)c(O)c(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)c1 795654633 UQYFIJJKFNGYFQ-OAHLLOKOSA-N 326.462 1.865 10 10 EDCE COC(=O)N[C@@H]1CCN(c2ccc(CN)cc2Br)C1 133598902 RWQYCRJTAKUZMQ-SNVBAGLBSA-N 328.210 1.843 10 10 EDCE CC(C)CN(C)CCCNC(=O)C(=O)N(C)Cc1ccccc1O 1326546654 DHVRUGMVEJCMIV-UHFFFAOYSA-N 335.448 1.445 10 10 EDCE C[C@@H]1COCCN1CCNC(=O)c1cc2cc(O)c(O)cc2s1 1331580379 OIYHECIYHMUYSV-SNVBAGLBSA-N 336.413 1.763 10 10 EDCE Cn1nccc1[C@@H](NC(=O)c1cc(O)cs1)C(=O)OC(C)(C)C 1261746555 MULRBZNEYAHJQD-GFCCVEGCSA-N 337.401 2.000 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@H](c2cncn2C)N(C)C)cc1F 1464551666 XHNZFDFPOCCFRQ-MRXNPFEDSA-N 333.411 1.544 10 10 EDCE COC(=O)C[C@@](C)(NC(=O)c1cccc(O)c1O)c1ccccn1 1617289893 BXWYVIBSKMRNIP-QGZVFWFLSA-N 330.340 1.701 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2conc2C)cc1C 1700950840 ZFPDNZXWWDYLTO-HNNXBMFYSA-N 347.415 1.523 10 10 EDCE C[C@@H](CNCc1ccn(C)n1)NC(=O)c1ccc(N=NC(N)=O)cc1 1716010818 YPABWWXSVURWRU-NSHDSACASA-N 343.391 1.491 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCc2cnn(C)n2)cc1C 1483167154 DZDIPSSZPLMQKN-CQSZACIVSA-N 345.447 1.359 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C(=O)C(C)(C)C)cc1C 1496954555 IERXKSARUUIRLY-CQSZACIVSA-N 336.432 1.186 10 10 EDCE COCCn1ccc(C(=O)NCc2ccc3cccnc3c2O)n1 1630532153 ITSYQAHFILAMSM-UHFFFAOYSA-N 326.356 1.713 10 10 EDCE Cn1cc(C(=O)CNC(=O)c2cc3cc(O)c(O)cc3s2)cn1 1645905030 OFXHRVOVAXPSKQ-UHFFFAOYSA-N 331.353 1.659 10 10 EDCE COC1CCN(c2ccc(CN[C@@H](C)c3nnnn3C)cc2)CC1 1648541330 WONRHEIQPPRODN-ZDUSSCGKSA-N 330.436 1.676 10 10 EDCE CS(=O)(=O)c1ccc(/C=C/C(=O)NCc2cc(O)ccc2O)o1 1643882147 PCLWYNVRZQMGKO-ZZXKWVIFSA-N 337.353 1.424 10 10 EDCE CS(=O)(=O)CCCNC(=O)c1cc2cc(O)c(O)cc2s1 1583111984 KKZMSCNPGTUBED-UHFFFAOYSA-N 329.399 1.477 10 10 EDCE COc1nccc(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)n1 1662278192 RLIAGJRXNUJTGP-CYBMUJFWSA-N 344.415 1.710 10 10 EDCE CC(=O)NC[C@@](C)(NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1688812258 DBTBFINNPRFCIV-MRXNPFEDSA-N 331.376 1.884 10 10 EDCE Cn1nnnc1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1860769191 VIMCEJPNSYULGF-UHFFFAOYSA-N 333.307 1.238 10 10 EDCE O=C(O)[C@H]1Cc2ccccc2CN1C(=O)c1cc(O)c(O)c(O)c1 1866303382 SWASDQSFKJGFOS-GFCCVEGCSA-N 329.308 1.455 10 10 EDCE COC(=O)C1CCN(C(=O)CNCc2cc(Cl)ccc2O)CC1 1857868352 DSJIXPVPSQWTIB-UHFFFAOYSA-N 340.807 1.547 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](O)[C@](C)(O)C2)cc1Br 2136877645 JAUWKGOJWOUQNP-BIGNPOOSSA-N 330.222 1.824 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985102028 AWFFHYWPECTCTE-AXFHLTTASA-N 327.385 1.419 10 10 EDCE C[C@@]12C[C@@H](CO1)N(c1cc3c(cc1Br)[C@@H](N)C(=O)N3)C2 2144648880 PXRJEGMYDXQJIC-DSBAHLMNSA-N 338.205 1.769 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(C(=O)c3ccc(O)c(O)c3)C[C@@H]21 2006281721 QIMCQTSELODLMK-YABSGUDNSA-N 334.372 1.693 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccccc1O 2010263744 ZONVLXQXLOTCQF-BXUZGUMPSA-N 338.404 1.625 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)OC(C)(C)C1 2010403527 FNIDRVRJNLDCPN-NSHDSACASA-N 339.396 1.922 10 10 EDCE O=C(O)C[C@H](COCc1ccccc1)NC(=O)c1cccc(O)c1O 2035482085 UHTZMRNAINKJDG-CYBMUJFWSA-N 345.351 1.888 10 10 EDCE CS(=O)(=O)C1CCN(c2ccc(CN)cc2Br)CC1 394061655 ZQNTXDNWHPDJBY-UHFFFAOYSA-N 347.278 1.921 10 10 EDCE CNCc1ccc(N2CC[C@@]3(CNC(=O)N3)C2)cc1Br 2177687021 FZLUOCKDPOQEFX-CQSZACIVSA-N 339.237 1.430 10 10 EDCE C[C@H](NC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)c1ccccc1O 1587451283 OOEMZJFIOMTKBM-NWDGAFQWSA-N 338.404 1.845 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCO[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1906906393 RAMVKXPDIPBGLV-ASHKBJFXSA-N 340.420 1.182 10 10 EDCE O=C1Nc2cc(N3CC[C@@H]4COC[C@@H]43)c(Br)cc2[C@H]1O 2198557218 QSXFVUAAMUHXHH-HYJLZEBJSA-N 339.189 1.660 10 10 EDCE CCN1CCN(c2ccc(CNC)cc2Br)CC1=O 2102559663 XFZMVJYIGMHZQS-UHFFFAOYSA-N 326.238 1.837 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2104424379 NDGLWLGBOQPOSX-YXJUAWEDSA-N 327.222 1.399 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)C[C@@H]2CO)cc1Br 2089869469 CQBRGORLWMNFSS-GXFFZTMASA-N 329.238 1.348 10 10 EDCE CC1(C)CN(c2cc(Br)c(CN)cc2F)CC(=O)N1 2094068643 BIYSXNGGTKZWCL-UHFFFAOYSA-N 330.201 1.762 10 10 EDCE COc1ccc(Br)c(CN=c2nc(C)n(C)[nH]2)c1O 2208499211 VHFRHCWNHBOOKS-UHFFFAOYSA-N 327.182 1.634 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@]3(CO)C2)cc1Br 2226162596 DSWJFAUXYQHODO-SMDDNHRTSA-N 327.222 1.353 10 10 EDCE O=S(=O)(C1CN(c2ccc(CO)cc2Cl)C1)C(F)(F)F 2237658716 RYDSARFRFSEHCS-UHFFFAOYSA-N 329.727 1.956 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCC[C@@H]1CCNC1 2301687095 URBIRLZVOUXEFC-KRWDZBQOSA-N 329.444 1.652 10 10 EDCE Cc1ccc(CN(C)C(=O)C[C@@H](O)CN)c(O)c1Br 2352943665 WVAOIURMCBSMHC-SNVBAGLBSA-N 331.210 1.131 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H](O)CCN)c(O)c1Br 2352946347 JPWZYASOMPWNTH-SNVBAGLBSA-N 331.210 1.131 10 10 EDCE COC[C@](C)(NC(=O)OC(C)(C)C)[C@H](N)Cc1ccc(O)c(O)c1 1952848578 NIUGCPFMGBSBJG-PBHICJAKSA-N 340.420 1.897 10 10 EDCE COc1cc(N2CCCC2)c(OC)cc1/C=C1\NC(=S)NC1=O 33349345 VSPILHCSSFVETN-XFFZJAGNSA-N 333.413 1.649 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nn4cnnc4s3)CC2)cc1 49659862 CKUCCWBPKMYMDF-UHFFFAOYSA-N 344.400 1.157 10 10 EDCE CCCNC(=O)[C@@H]1C[C@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 244532042 ZTQAWBSEBZXERG-IAGOWNOFSA-N 345.443 1.506 10 10 EDCE CN[C@H](CO)c1cc(I)cc([N+](=O)[O-])c1O 380483337 WHDNCYGPIVWOKX-SSDOTTSWSA-N 338.101 1.158 10 10 EDCE CO[C@@H](C)[C@@H](N)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381133036 JFROTUWXEOUTLO-JOYOIKCWSA-N 345.237 1.784 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1 808532691 HQRQOCDASLWIFE-VIFPVBQESA-N 325.267 1.019 10 10 EDCE CN[C@@H](C)c1ccc(N2CCOC[C@H]2C(N)=O)cc1Br 723150709 LHKBFYVORDERER-ZANVPECISA-N 342.237 1.420 10 10 EDCE COc1ccc(-c2noc(CCCC(=O)OCC(=O)C(C)=O)n2)cc1 808504083 ZXTWPBLIFFWQSG-UHFFFAOYSA-N 346.339 1.769 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CO[C@H](C)c1nccn1C 813513273 LBEQPWGEDGCAKB-VXGBXAGGSA-N 333.388 1.656 10 10 EDCE O=C(CCOC1CNC1)NCc1ccc(N2CCSCC2)cc1 827321491 YRKAEDXECHCUGY-UHFFFAOYSA-N 335.473 1.235 10 10 EDCE Cc1cc(CC(=O)N2CC[C@H](C(N)=O)C2)c(C)n1-c1ccccc1 826139692 LNUZNPAXOUQUKM-HNNXBMFYSA-N 325.412 1.970 10 10 EDCE Cc1cc(CC(=O)N2CCN(CCO)CC2)c(C)n1-c1ccccc1 821358306 BKRUOZIDYKSLBT-UHFFFAOYSA-N 341.455 1.773 10 10 EDCE CCn1nncc1/C=C1\OCCn2c1nc(Br)c2C=O 901573973 CWFZSGQCFJOHSL-YHYXMXQVSA-N 338.165 1.598 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCN(CC[S@](C)=O)CC2)cc1 835026375 RZBUADDWFBGLHE-VMXOYPLMSA-N 335.517 1.762 10 10 EDCE CN(C)c1ccc(/C=C/CNCC[C@@H]2CNCCS2(=O)=O)cc1 903969669 IREBBUYNBQVWKE-REMYHPOOSA-N 337.489 1.132 10 10 EDCE CCCN(CCC)c1ccc(CN2CCN(CC(N)=O)C(=O)C2)cc1 839169028 DWGDFELVBHIYOV-UHFFFAOYSA-N 346.475 1.443 10 10 EDCE CCOC(=O)c1cc(NS(=O)(=O)c2cn(CC)cn2)ccc1O 830018116 FLDVILIINOUJSY-UHFFFAOYSA-N 339.373 1.586 10 10 EDCE C[C@H]1[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)CCN1C 914336502 ZMKBWMQVHIAQAZ-YOEHRIQHSA-N 332.448 1.415 10 10 EDCE C[C@H](NC(=O)N[C@@H]1CNCC[C@H]1C)c1ccc(N2CCOCC2)cc1 841739762 BZVMJLQEWZPKTL-RVKKMQEKSA-N 346.475 1.881 10 10 EDCE CC(C)(C)N1C[C@H](CNC(=O)NCc2c(O)cccc2F)CC1=O 923324156 CFOFAHRGIAIOQI-NSHDSACASA-N 337.395 1.978 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@H]1CN 926288508 MWINYJJBQWRLOT-ZBFHGGJFSA-N 346.475 1.154 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@@H]3CCCC(=O)N3)C2)cc1 855227443 WQXBBSYSVWFKDH-KBPBESRZSA-N 331.416 1.449 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)NC[C@H]1C[C@@H]2COC[C@@H]2O1 926679309 SYDIVGBFMFSJRI-QKCSRTOESA-N 326.780 1.649 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](C)[C@H](CO)C3)C2)cc1 856920275 RZLOCRJRGUXNQA-PMPSAXMXSA-N 347.459 1.934 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CNCCC3(F)F)C2)cc1 851639117 BHYFMKBPNIJLTB-DOMZBBRYSA-N 339.386 1.635 10 10 EDCE CCn1nccc1S(=O)(=O)Nc1nc(-c2cnn(C)c2)cs1 769847100 JRBIRGDZGRDVOQ-UHFFFAOYSA-N 338.418 1.561 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCc1ncccc1S(C)(=O)=O 787380530 GXDTXSCBZZUXCG-UHFFFAOYSA-N 349.412 1.532 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cnc(N(C)C)nc1 789844118 JUQSAUNHAPWBIU-JTQLQIEISA-N 331.376 1.707 10 10 EDCE CC[C@@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)C(=O)OC 881853633 DAXMZWHIIPYOCV-INIZCTEOSA-N 333.432 1.254 10 10 EDCE COC(=O)c1c(CNC[C@@]2(O)CCOC2)c2cc(F)ccc2n1C 894359783 RJAZJYTWGSIELE-KRWDZBQOSA-N 336.363 1.345 10 10 EDCE COC[C@@](C)(CO)N(C)c1cc(Br)c(CN)cc1F 689783269 XHLKQMIYNJATLA-CYBMUJFWSA-N 335.217 1.881 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@H](C(F)F)CC1 1329518472 DPIMLIRRTRXZEZ-ZDUSSCGKSA-N 342.342 1.233 10 10 EDCE NCCC1(O)CCN(Cc2cc(Br)cc(F)c2O)CC1 717955466 ITSHIFBNWFAZSU-UHFFFAOYSA-N 347.228 1.970 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2ccc(C(N)=O)[nH]2)cc1C 1265827144 NEZXFZPGLXYXBF-GFCCVEGCSA-N 344.415 1.339 10 10 EDCE O=C(O)[C@@H](NCc1c(O)cccc1Br)[C@H]1CCCO1 1351742988 USSCUYHBNBKGMF-NEPJUHHUSA-N 330.178 1.877 10 10 EDCE CN(C)c1ccc(CNC(=O)c2ccc3nc(O)[nH]c3n2)cc1F 1442474402 NJSRMIFBHYHNKW-UHFFFAOYSA-N 329.335 1.799 10 10 EDCE COc1cccc(CNC(=O)[C@@]2(C)Oc3ccccc3NC2=O)c1O 1445966732 IZQDWCXGJDXAKP-GOSISDBHSA-N 342.351 1.807 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCN(C(=O)CCCF)C2)cc1 1523052009 TWUYNNSYXMBFMC-CYBMUJFWSA-N 349.366 1.929 10 10 EDCE O=C(NCc1ccc(CN2C(=O)CNC2=O)cc1)c1cc(O)cs1 1471272478 XUYIEONEFMOMIA-UHFFFAOYSA-N 345.380 1.436 10 10 EDCE CC(C)[C@H](NC(N)=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1540458331 JMQGKTBYGCLIOL-INIZCTEOSA-N 348.447 1.175 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)C(C)(C)NC(C)=O)cc1C 1482151068 CBAWLSJBNZIDRF-CYBMUJFWSA-N 349.475 1.760 10 10 EDCE CC(C)(C[C@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1)C(N)=O 1635896770 DGIMFACCNDPSBP-CYBMUJFWSA-N 334.416 1.781 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@H]2[C@H](O)CO)cc1Br 2123209841 JUVDWNYYPMTEGR-QCZZGDTMSA-N 329.238 1.791 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@]23CCC[C@H]2OCC3)c1 1588153363 DZVYKRKJDQZJPG-HIFRSBDPSA-N 340.401 1.205 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)cc1Br 2126159280 QBLXSVLPFQEYGK-IOQCUFBNSA-N 328.206 1.119 10 10 EDCE C=CC(=O)NCCC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 160475159 SAGLMFNIHIEFCU-AWEZNQCLSA-N 331.416 1.393 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)NCCCCN=[N+]=[N-] 1912180637 DJMXJFAILLHZOF-UHFFFAOYSA-N 337.203 1.551 10 10 EDCE CN1[C@H](CNCc2cc(Cl)cc(Cl)c2O)CCS1(=O)=O 1965948719 NITGEQCSNRLNSZ-JTQLQIEISA-N 339.244 1.823 10 10 EDCE CCCNCc1ccc(N2CCNC(=O)C2)cc1Br 233109651 SJQFJKLKUJFKFC-UHFFFAOYSA-N 326.238 1.885 10 10 EDCE Nc1ccc(CN=c2cc(I)nc[nH]2)cc1 1981602304 CYTFYSFRCQKZRZ-UHFFFAOYSA-N 326.141 1.697 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@H]2OCCN(C(=O)OC(C)(C)C)[C@H]12 1985093791 FNBHSSKZICRSEZ-HBNTYKKESA-N 325.369 1.389 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(C(=O)NCCCN=[N+]=[N-])C(C)(C)O 1985104515 JANPIZZNZLBEOP-CQSZACIVSA-N 329.401 1.857 10 10 EDCE CNCc1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)c(Br)c1 2149909723 ZYCANLAMLMFIEB-CHWSQXEVSA-N 343.265 1.596 10 10 EDCE C[C@H](CC(N)=O)N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2151340608 OSMDYRVRLOJLOB-INWYIAFRSA-N 341.209 1.101 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)c1ncccc1Br 48759484 WTDLSBQOCSXNHQ-UHFFFAOYSA-N 335.205 1.918 10 10 EDCE O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cc(O)c(O)c(O)c1 2015074190 DJWOSEPRCRJEEE-AWEZNQCLSA-N 328.368 1.808 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1ccc2c(c1)N(C)C(=O)[C@H]2N 2034784359 WVDROZBRLHFPNA-SFHVURJKSA-N 338.411 1.415 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)[C@H](CO)C2)c(Br)c1 704775635 NFZWMRTXAGWJQT-DLOVCJGASA-N 329.238 1.506 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)cc1Br 2190452451 DWQRSCAAJRNHQH-AISOMTMTSA-N 342.233 1.965 10 10 EDCE CNCc1ccc(N2CCN3CCOC[C@H]3C2)c(Br)c1 2185877705 WDBVNDKLOIFTPT-CYBMUJFWSA-N 340.265 1.689 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1CO[C@@H]2COC[C@H]21 2101857803 YXEFPLGRGPHHEJ-NTZNESFSSA-N 328.206 1.906 10 10 EDCE CO[C@@H]1CN(c2ccc(CO)cc2Br)[C@@H]2COC[C@@H]12 2102132792 BWORXZHNPBZSCR-LERXQTSPSA-N 328.206 1.791 10 10 EDCE Cc1ccc(CNC[C@@H](C)S(N)(=O)=O)c(O)c1Br 2327623022 CPRBNYWPZSDIJW-MRVPVSSYSA-N 337.239 1.230 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)C[C@H]1N1CCOCC1 177233969 QRAAWZHQQJBPGZ-CRAIPNDOSA-N 346.475 1.615 10 10 EDCE [N-]=[N+]=NCCN[C@@H](C(N)=O)c1cccc(I)c1 304501792 NHISAMAAAYWGEQ-SECBINFHSA-N 345.144 1.718 10 10 EDCE C=CC(=O)NCCC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 119157663 CIZPEFBFJHCHKJ-UHFFFAOYSA-N 335.379 1.175 10 10 EDCE C[C@H]1CCN(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c2ccccc21 58457807 VKQXOPODMWPTEQ-XEHSLEBBSA-N 339.395 1.638 10 10 EDCE COc1ccc(O)c(CN2CCN(c3cc(OC)ncn3)CC2)c1 184437314 JQFATUJCQRVXBT-UHFFFAOYSA-N 330.388 1.522 10 10 EDCE CN(C)CCCNC(=O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 193425954 LZLDHNDJKGRSPH-KRWDZBQOSA-N 349.475 1.441 10 10 EDCE COc1ccc(Br)c([C@H]2N[C@H](C(=O)O)CS2)c1O 83236611 GUDWTIROFAQFIK-WKEGUHRASA-N 334.191 1.952 10 10 EDCE Cc1cc2c(=O)n(CC(=O)Oc3ccc(N)cc3)c(O)nc2s1 244220776 VZRWXDAPAOMEPG-UHFFFAOYSA-N 331.353 1.660 10 10 EDCE COC(=O)NCCCC(=O)N1CCN(c2ccc(OC)cc2)CC1 264492489 DECLXXLGVQRWOE-UHFFFAOYSA-N 335.404 1.480 10 10 EDCE COc1cc(N2CCS(=O)(=O)[C@H](C)C2)c([N+](=O)[O-])cc1OC 274224649 XNSSRJOOKOANAF-SECBINFHSA-N 330.362 1.235 10 10 EDCE O=C(c1cccc(O)c1O)N1CCOC[C@@H]1C[C@@H](O)c1ccco1 279867934 QKJJFSGYLNDGAJ-SMDDNHRTSA-N 333.340 1.656 10 10 EDCE CN1CCC[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 294562298 TWIUMMJXCXEANK-CQSZACIVSA-N 349.406 1.147 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H](Cn2ccnn2)C1 588408606 MGSOAOJMHVTPSM-SDQPKGBYSA-N 328.372 1.641 10 10 EDCE COC(=O)c1cc2ccccc2c(CN(C)[C@@H]2CCN(C)C2=O)c1O 738270383 WBQIQJLPVAOXDN-MRXNPFEDSA-N 342.395 1.995 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)CS(=O)(=O)NC(C)(C)C)c1 731810521 MWLHGKWAAQXJPD-SNVBAGLBSA-N 344.433 1.296 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCC[C@@H]1CC(=O)N(C)C1 919068642 ACMBWIGIFPUYKO-CQSZACIVSA-N 332.448 1.729 10 10 EDCE CCON(C)C(=O)CNC(=O)c1cc(C)n(-c2ccccn2)c1C 846502607 KZRSXLJYDKBGMD-UHFFFAOYSA-N 330.388 1.629 10 10 EDCE OCC1CCN(c2ccc(CNC[C@@H](O)C(F)(F)F)cc2)CC1 843065781 PNHXMOASJIHKRL-OAHLLOKOSA-N 332.366 1.908 10 10 EDCE CCOC(=O)c1cnc(NC(=O)NCc2cc(OC)ccc2O)n1C 841713021 IUQHTDXBBWLLME-UHFFFAOYSA-N 348.359 1.633 10 10 EDCE CO[C@@H](CNCc1ccc(N2CCN(C)CC2)cc1)[C@H]1CCOC1 850341451 AGIWCSOFEGMUKP-HKUYNNGSSA-N 333.476 1.580 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)Nc2nn(C)cc2C)cc1 850350625 DTHXIMAWWNRICU-UHFFFAOYSA-N 343.431 1.830 10 10 EDCE CCOC(=O)CC1(S(=O)(=O)N2Cc3cccc(O)c3C2)CC1 867691548 ZQZDAWOZBZAODY-UHFFFAOYSA-N 325.386 1.523 10 10 EDCE C[C@@H]1C[C@@H](NC[C@@]23COCCN2C(=O)OC3)c2c(O)ccc(F)c21 866520972 JDZBXRQHAIEYRS-HSOHIQCKSA-N 336.363 1.890 10 10 EDCE C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cncs1 1119795620 WSPSBPNHYGCMSG-NSHDSACASA-N 332.429 1.703 10 10 EDCE CN1CCCC[C@@H](N(C)CC(=O)NCc2ccc(N(C)C)cc2)C1=O 872263329 BQOYWXKAIFVMIK-QGZVFWFLSA-N 346.475 1.312 10 10 EDCE COC(=O)[C@]1(O)CCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 882843649 ZYCZFVUKXUEGNH-IBGZPJMESA-N 342.395 1.844 10 10 EDCE C/C(=C/C(=O)N(C[C@@H]1CCCO1)c1ccnnc1)c1cnccn1 893109517 XDJASSQBNSSRTC-CTXBLAANSA-N 325.372 1.882 10 10 EDCE COc1ccc(N2CCN(CN3C[C@@H](C(F)F)CC3=O)CC2)cc1 795401396 OYODCONQNDPIGI-ZDUSSCGKSA-N 339.386 1.888 10 10 EDCE C[C@H](C(=O)NCc1ccc(O)cc1O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1162271651 MJNRWGMRMGWBCC-HONMWMINSA-N 346.383 1.278 10 10 EDCE CCOc1ccc(N2CCN(C(=O)CCc3cn(C)nn3)CC2)cc1 1328249066 FSVUIKXWRZERII-UHFFFAOYSA-N 343.431 1.495 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)NC1C[C@@H]2C[C@H]2C1 1345700570 STDXBYIHQVZTRJ-UWVGGRQHSA-N 325.459 1.656 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1cccc(-n2ccnc2O)c1 1445898929 COUWMXJNJREXLB-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE C/C=C(\C)C(=O)N(C)C1CC(NC(=O)c2cc(OC)nc(OC)c2)C1 1511928897 XIOKBCPXJSWDQQ-IZZDOVSWSA-N 347.415 1.784 10 10 EDCE CN(C)c1ncnc2c1cc(C(=O)NCc1ccccc1O)n2C 1622772889 MUDOPAQQVOGLIY-UHFFFAOYSA-N 325.372 1.670 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](CN3CCCC3=O)C2)cc1 1633352639 XUJGWXNWNZIFPB-LBPRGKRZSA-N 343.387 1.934 10 10 EDCE COC(=O)c1cccc2c1CCN2C(=O)c1c(C)c[nH]c1CC(N)=O 1647760697 BMSZPWHDKWSKGT-UHFFFAOYSA-N 341.367 1.340 10 10 EDCE COCC(=O)N[C@@H](C)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1678595571 AGEGAONAOXCGLE-JTQLQIEISA-N 347.375 1.072 10 10 EDCE C[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(O)cc2O)SC1=S 15034569 IZGRNEMRJRSATI-DKLDRGHMSA-N 325.367 1.772 10 10 EDCE C[C@@H](CN(C)Cc1ccc(N2CCOCC2)cc1)CS(C)(=O)=O 162628153 HQPRUIRQOCUOIZ-HNNXBMFYSA-N 340.489 1.636 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1C[C@@H](O)C[C@H]1CN 2131042472 ZWARYJRLDOVZSF-GMXVVIOVSA-N 329.238 2.000 10 10 EDCE CN[C@@H](C)c1ccc(N(CCO)C2COC2)cc1Br 1915545902 PFHUUAPSZZLFNU-JTQLQIEISA-N 329.238 1.927 10 10 EDCE CNCc1ccc(N2CC[C@@H](NC(C)=O)C2)c(Br)c1 234373227 IZZBBYFRKUPPMD-GFCCVEGCSA-N 326.238 1.883 10 10 EDCE CN(C)C[C@@H]1COC[C@H]1NCc1cccc(Br)c1O 2141466761 UGMPFDJDDLNYMP-DGCLKSJQSA-N 329.238 1.821 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCNCc2ccc(N)cc2)CC1 1944066022 VLKDVPHSIMZPOT-UHFFFAOYSA-N 334.464 1.911 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@]1(C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003169471 KZYVBKNHQHHBHV-BTIUKSQHSA-N 340.420 1.182 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985101391 RNPVNYZIHFXKRZ-GHMZBOCLSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985102806 MCNNCKSEOYEXHD-MNOVXSKESA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H]1NC(=O)COc1ccc(N)cc1 2009325716 CGLLMQVFLMSRGD-SMDDNHRTSA-N 335.404 1.677 10 10 EDCE COc1ccc(CN[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)c(O)c1 2011487940 QXFGNNITQPPRBG-DZGCQCFKSA-N 338.404 1.471 10 10 EDCE CN[C@@H](C)c1ccc(N2CC[C@](O)(CO)C2)c(Br)c1 313746228 PJNRSQXHWVDZFJ-IINYFYTJSA-N 329.238 1.663 10 10 EDCE CCCCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1ccccc1 254926014 AYTGIAFJMIUBBR-QXMHVHEDSA-N 341.411 1.931 10 10 EDCE COc1ccc(N(C)CC(C)(CO)CO)c(OC)c1Br 2234892031 JEPOBNYICQKNCP-UHFFFAOYSA-N 348.237 1.893 10 10 EDCE COCCNC(=O)CNCc1c(Br)ccc(OC)c1O 2236037693 QWDHRXUMBQADNC-UHFFFAOYSA-N 347.209 1.016 10 10 EDCE CSc1ncc(CNS(=O)(=O)C[C@H](C)C(N)=S)s1 2257133215 TUPLIJNQGVBDNY-LURJTMIESA-N 325.506 1.207 10 10 EDCE C[C@H](N)c1ccc(N2CC3(CNC(=O)CO3)C2)cc1Br 2289733761 UDAONBNJNVEOGM-VIFPVBQESA-N 340.221 1.174 10 10 EDCE COc1ccc(CCC(=O)NC[C@@H](O)c2ccc(O)c(O)c2)cc1 2297724955 CEPKBWIBYGAOFJ-QGZVFWFLSA-N 331.368 1.889 10 10 EDCE Cc1ccc(CNC(=N)NC(=N)N(C)C)c(O)c1Br 2352637098 IMRNHFSOXPATBF-UHFFFAOYSA-N 328.214 1.573 10 10 EDCE CN1CCCc2cc(CNC(=O)NCC(=O)NC(C)(C)C)ccc21 58556742 ZCGTVBNBYMXVHD-UHFFFAOYSA-N 332.448 1.783 10 10 EDCE Cc1ccc(C(=O)N[C@H](C)c2nnnn2-c2ccccc2)c(O)c1O 177686306 MCSLFEDMDKGOPP-LLVKDONJSA-N 339.355 1.873 10 10 EDCE Oc1ccc(F)cc1CN1CCN(c2ccc3nncn3n2)CC1 180095991 ZQHWVISTHCXCQD-UHFFFAOYSA-N 328.351 1.291 10 10 EDCE CN1CCCc2cc(CNC(=O)c3cc4c(=O)[nH]cnc4cn3)ccc21 187277210 NZQPJARITAXGGO-UHFFFAOYSA-N 349.394 1.631 10 10 EDCE Cc1cc(Br)cc(CN2CCN3CCOC[C@@H]3C2)c1O 371887312 FKOUCMACVFDPFY-AWEZNQCLSA-N 341.249 1.980 10 10 EDCE Cc1ccc(CN2C[C@H]3COC[C@]3(CO)C2)c(O)c1Br 2380815316 POHWJUACQHCENE-SWLSCSKDSA-N 342.233 1.904 10 10 EDCE CC(=O)C(=O)COC(=O)c1cccc([N+](=O)[O-])c1Br 808535754 XQUXNMXRVFKQQN-UHFFFAOYSA-N 330.090 1.672 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CNC3(C(C)C)CC3)CC2)cc1 815150635 KDAQMZZMXCGNPF-SFHVURJKSA-N 347.503 1.956 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1ccc(N(C)C)cc1C)C1CC1 827160510 RIVBCHUSUOQKMT-MRXNPFEDSA-N 326.462 1.905 10 10 EDCE CCOc1cccc(CN2CCS(=O)(=O)[C@H]3CCC[C@@H]32)c1O 825200702 GLTAEZPWTWNNIG-ZFWWWQNUSA-N 325.430 1.942 10 10 EDCE COc1ccc(N2CCN(CCNC(=S)NC3CC3)CC2)cc1 742910315 DXOSMJLPNZNFET-UHFFFAOYSA-N 334.489 1.444 10 10 EDCE COc1cc(Br)cc([C@H](C)NCc2nnn(C)n2)c1O 848549342 NSUQNFXOPJSUEM-ZETCQYMHSA-N 342.197 1.538 10 10 EDCE Cn1cnnc1N1CCN(Cc2cc(Cl)cc(F)c2O)CC1 848924947 IDAPPLUXHJKZFA-UHFFFAOYSA-N 325.775 1.635 10 10 EDCE CO[C@@]1(CN2C(=O)CN(Cc3ccccc3O)C2=O)CCSC1 925200931 KIDAXMFCAZFCPT-MRXNPFEDSA-N 336.413 1.679 10 10 EDCE CON1CC[C@H](OC(=O)c2csc(Cc3ccc(N)cc3)n2)C1=O 922599727 KUKKYDNBBRVLSM-ZDUSSCGKSA-N 347.396 1.635 10 10 EDCE Cn1ncc(CCC(=O)NCc2ccc(N3CCC(O)CC3)cc2)n1 856208490 RSUNJKVSBQLWNY-UHFFFAOYSA-N 343.431 1.025 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@H](O)C(F)(F)C1 852413705 ZZUVITDYOKXTOL-HNNXBMFYSA-N 341.402 1.413 10 10 EDCE C[C@@]1(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCC(=O)NC1 856213489 NZSIZMJQQLZSFY-LJQANCHMSA-N 345.443 1.180 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCC[C@H](C)CO)C2)cc1 853917057 SYYSTWFTMRSNCY-LSDHHAIUSA-N 335.448 1.982 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cn3ccc([N+](=O)[O-])n3)C2)cc1 855232132 NWCRMZDBNFNFDR-LBPRGKRZSA-N 345.359 1.195 10 10 EDCE C[C@H]1CC[C@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CN1 861685370 NKAOUNVJJHPZKQ-RDJZCZTQSA-N 346.475 1.805 10 10 EDCE NS(=O)(=O)c1ccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)cc1 779491295 MUROZEFDSFDSBW-YWEYNIOJSA-N 348.380 1.075 10 10 EDCE Cc1cc(C[C@@H](C)NC(=O)C(=O)N(C)Cc2ccccc2O)n[nH]1 1117344319 SAKPEXLKANCEGW-LLVKDONJSA-N 330.388 1.130 10 10 EDCE Cn1cc(-c2c[nH]cc2C(=O)OCC(=O)c2ccc(O)c(O)c2)cn1 784831280 CHADBQOPVLRAJC-UHFFFAOYSA-N 341.323 1.866 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(=O)N(C)C[C@H]2C)c([N+](=O)[O-])c1 782399187 MAMDRPKWGYHYLO-OKPNEXGHSA-N 333.344 1.448 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCOC[C@H]1c1ccco1 1348238513 AFBNVRGVOPJOFM-AWEZNQCLSA-N 344.367 1.544 10 10 EDCE NS(=O)(=O)c1ccc(C(=O)NCc2cc(Cl)ccc2O)cn1 1165508683 SXDLFNQLTWYTLH-UHFFFAOYSA-N 341.776 1.018 10 10 EDCE O=C(O)[C@@H]1CO[C@@H](CNCc2c(O)cccc2Br)C1 714029824 OKGBHAOKZBGHSE-DTWKUNHWSA-N 330.178 1.734 10 10 EDCE C[C@H](O)[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CCO1 1326050962 OSFQLUSMUCGTHD-KSSFIOAISA-N 337.439 1.159 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C[C@@H]1F 1257535442 IOPQCXFCFXDMDC-RISCZKNCSA-N 339.386 1.714 10 10 EDCE COC(=O)c1ccc(NC(=O)/C(=C\C2=S=CC=C2)NC(C)=O)cc1 1540390518 IZKQGWXZDBQXCN-XNTDXEJSSA-N 344.392 1.709 10 10 EDCE O=C(CNS(=O)(=O)c1ccc(F)cc1)NCc1ccccc1O 1545681996 MNAJGPJNZZMOLH-UHFFFAOYSA-N 338.360 1.126 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cc2cnc[nH]2)cc1C 1483064737 LYYGUEIKUNFWFO-ONEGZZNKSA-N 328.416 1.731 10 10 EDCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(O)cn1 1626059212 UWNZUPINUOSBTP-UHFFFAOYSA-N 349.337 1.832 10 10 EDCE COC(=O)C[C@](C)(NC(=O)Cc1ccc(O)c(O)c1)c1ccncc1 1633618546 BAJBSZVHILWGNF-SFHVURJKSA-N 344.367 1.630 10 10 EDCE COc1ccc(Br)c(CNCCCNC(C)=O)c1O 1964546326 USMABIJYWGIKCH-UHFFFAOYSA-N 331.210 1.779 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCC[C@@]1(O)[C@@H](N)c1ccccc1O 1919860797 HBCGJUPXSNZVKA-KEYYUXOJSA-N 338.404 1.437 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)NCC1(CN=[N+]=[N-])CC1 1990024338 OGEXKLNXCKWTKR-JTQLQIEISA-N 327.385 1.469 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3OCCN(C)[C@@H]3C2)c(Br)c1 2153997502 YQNSBPDMBZRLGV-VQISRLSMSA-N 340.265 1.988 10 10 EDCE CNCc1ccc(N2CCC[C@@H](CO)[C@H]2CO)c(Br)c1 709822403 HDJVJXJDWAHXHN-SWLSCSKDSA-N 343.265 1.738 10 10 EDCE COc1ccc(N2CC[C@@H](CO)[C@@H](N)C2)c(OC)c1Br 2178906470 KFELKJJGTSOWKW-UWVGGRQHSA-N 345.237 1.612 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(C(=O)NCc2ccc(N)cc2)C1 2080755929 GDOYNEXDRUROSY-SFHVURJKSA-N 349.431 1.505 10 10 EDCE NCCc1n[nH]cc1C(=O)N1CCc2ccc(Br)cc21 2235313411 KODOVPMBMYLFGV-UHFFFAOYSA-N 335.205 1.876 10 10 EDCE Cn1nc(Br)c(C(=O)N2CCC(CN=[N+]=[N-])CC2)n1 2226978617 KWVAPAQMWLABEX-UHFFFAOYSA-N 328.174 1.740 10 10 EDCE O=C(O)[C@@H]1CC[C@@H](O)CN1Cc1ccc(Br)cc1O 2264528102 FTBAAZFAYFXLES-MNOVXSKESA-N 330.178 1.565 10 10 EDCE CNCc1ccc(N2C[C@@H]3OCC[C@]3(CO)C2)cc1Br 2296431022 IROJUIYEMZDNFD-LSDHHAIUSA-N 341.249 1.756 10 10 EDCE CCOC(=O)CN(CC)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297505394 SUOXWHJBCHLUDR-UHFFFAOYSA-N 346.427 1.948 10 10 EDCE CC(C)(C)C(=O)N1CCN(C(=O)C=Cc2ccc(O)c(O)c2)CC1 2307986174 DGKMLKMJOKEQRU-UHFFFAOYSA-N 332.400 1.828 10 10 EDCE Cc1ccc(Cn2cc(C[C@@H](C)N)nn2)c(O)c1Br 2352647955 HOYRUYQRBLNVIQ-SECBINFHSA-N 325.210 1.993 10 10 EDCE CC1(C)NC(=O)N(CC(=O)NCc2ccc(N3CCCC3)cc2)C1=O 63686022 DYCFSFZDEYRYLF-UHFFFAOYSA-N 344.415 1.233 10 10 EDCE Cc1ccc(N(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)cc1Cl 113192043 YTOTVUBUQQXPFU-SOFGYWHQSA-N 347.802 1.722 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CSc1nnc(CO)n1C 179112658 NMQSDUJIKNNPKW-UHFFFAOYSA-N 349.460 1.124 10 10 EDCE NCc1cc(F)c(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)cc1Br 2357052627 LVWQLBSDVLKOBE-VAYSNVFOSA-N 345.212 1.510 10 10 EDCE CNC(=O)c1cccc(CCC(=O)NCCc2ccc(O)c(O)c2)c1 122795751 ICOSFUDYSDIRPM-UHFFFAOYSA-N 342.395 1.749 10 10 EDCE Cn1nccc1CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 278408652 LNHMPBXLMCZGEW-MRXNPFEDSA-N 329.400 1.876 10 10 EDCE O=C(NCc1cc(Br)ccc1O)C(=O)Nc1ccon1 807385878 SKLLMBFJPJIHIX-UHFFFAOYSA-N 340.133 1.398 10 10 EDCE COc1ccc(N2CCC(NC(=O)N3CN(C)C(=O)[C@H]3C)CC2)cc1 826105447 WBKYOMXHNQYDNB-CYBMUJFWSA-N 346.431 1.494 10 10 EDCE CN1C[C@H](O)C[C@]1(C)C(=O)NCc1cccc(Br)c1O 907757725 JGXFHYGXAFQVSF-QMTHXVAHSA-N 343.221 1.226 10 10 EDCE C[C@@H](O)CCNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 838738409 COIMLQRERCZWCG-LLVKDONJSA-N 343.374 1.372 10 10 EDCE CN1CCCc2cc(CNC(=O)C3(C(=O)O)CCOCC3)ccc21 911302261 YNJKEJXLIDBXCV-UHFFFAOYSA-N 332.400 1.567 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCC[C@]1(O)CCOC1 845263198 ZCCUXDPVFCVQFM-KXBFYZLASA-N 349.475 1.833 10 10 EDCE C[C@@H]1CN(C(=N)NCc2cc(Br)ccc2O)CCO1 849051769 HXDYMHQHEXEMMP-SECBINFHSA-N 328.210 1.900 10 10 EDCE CC[C@H](NCC[C@@H]1CNCCS1(=O)=O)c1ccc(F)cc1O 925789244 RFAJFPSGRCUEOO-OCCSQVGLSA-N 330.425 1.349 10 10 EDCE COCCN(C[C@H](C)CS(C)(=O)=O)c1ccc(OC)c(OC)c1 757838284 BAIZABGHUIFOPI-ZDUSSCGKSA-N 345.461 1.837 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N3CC4CC3(CN)C4)C2)cc1 851665776 CSOIGYVGKYCJOT-XVTSOASTSA-N 344.459 1.654 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCc4n[nH]cc4C3)C2)cc1 855231495 ARRRHNXJQVZYFK-DZGCQCFKSA-N 340.427 1.918 10 10 EDCE OC1CCN(c2ccc(CNC(=S)NC[C@H]3CCCO3)cc2)CC1 853040741 GGZKECSLVRWAPZ-QGZVFWFLSA-N 349.500 1.791 10 10 EDCE COc1ccc(N(C)CCN(C)S(=O)(=O)[C@H]2CCCNC2)cc1 923651128 DODJLNFWXOZSGD-INIZCTEOSA-N 341.477 1.145 10 10 EDCE Cn1c(N2CC=C(c3ccc(Cl)nc3)CC2)cc(=O)n(C)c1=O 853467633 HBHIBZWFOBYCJI-UHFFFAOYSA-N 332.791 1.426 10 10 EDCE CC(C)C[C@@]1(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CCNC1=O 867302496 PWFQPOQTIURZAH-SGTLLEGYSA-N 334.416 1.697 10 10 EDCE COC(=O)c1cnc(SC[C@H](O)CC2(O)CCOCC2)s1 871980554 CKQONUYOANRGGP-SECBINFHSA-N 333.431 1.314 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1cn(C)nn1 1144858241 YZVKPRLJHFSRRJ-UHFFFAOYSA-N 337.383 1.965 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)CN(C)C(C)=O)[C@@H]2C)cc1C 1331859366 HMSJYAUGUWPSHP-PBHICJAKSA-N 347.459 1.561 10 10 EDCE CC[C@H](C)C(=O)NC1CN(Cc2nnnn2-c2ccc(OC)cc2)C1 1267636434 CTHOUZZTZMZVNP-LBPRGKRZSA-N 344.419 1.017 10 10 EDCE COC(=O)NCC(=O)N1CC[C@@H](NCc2ccc(OC)c(C)c2)[C@@H]1C 1278232414 ISZQVVXHEIITEE-DZGCQCFKSA-N 349.431 1.439 10 10 EDCE CN(C)c1nc(CCNC(=O)/C=C/c2ccc(O)c(O)c2)cs1 1546251251 KBLINNGEYKAJLB-GQCTYLIASA-N 333.413 1.992 10 10 EDCE COc1ccc(CNC2(CNC(=O)CN(C)C(C)=O)CCC2)cc1C 1724781615 GDEASCIVLIZALK-UHFFFAOYSA-N 347.459 1.610 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@@H]2CCN(C)C2=O)cc1C 1568668486 VOQCQRKBGSQOBM-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CN(C)C(=O)C2CC2)cc1C 1569061034 SISPMPIQERIPFQ-AWEZNQCLSA-N 347.459 1.466 10 10 EDCE Cc1cc(Cn2nnc(C(=O)NCc3c(O)cccc3F)c2C)no1 1596912700 QTBIACIBWWPYNX-UHFFFAOYSA-N 345.334 1.706 10 10 EDCE CC(=O)NC[C@H](C)OC(=O)/C=C/c1ccc(N2CCOCC2)cc1 157262296 XEEBIGMFKBWJID-GPAKFWEMSA-N 332.400 1.604 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@](C)(O)[C@@H](O)C2)c(Br)c1 1893326909 YQXUXHJLRJIKDM-HERUPUMHSA-N 329.238 1.791 10 10 EDCE [N-]=[N+]=NCCCN[C@@H](C(N)=O)c1cc(O)ccc1Br 1912198928 MFNLANYJBZBCMC-SNVBAGLBSA-N 328.170 1.971 10 10 EDCE O=C1Nc2cc(N3CCOCC34CC4)c(Br)cc2[C@H]1O 1915582890 DUJWWKFBBXLNRA-GFCCVEGCSA-N 339.189 1.804 10 10 EDCE NCc1ccc(N2C[C@@H](CO)[C@@H](CCO)C2)c(F)c1Br 2149900803 NBSUQIOLBQFUPS-QWRGUYRKSA-N 347.228 1.474 10 10 EDCE CNC(=O)[C@@H]1CCN(Cc2c(Br)ccc(OC)c2O)C1 1970928988 XKGRLOUKSIJHBU-SECBINFHSA-N 343.221 1.731 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)COC1CN(C(=O)OC(C)(C)C)C1 1985094394 ODXLAYFOJXOVKO-UHFFFAOYSA-N 327.385 1.781 10 10 EDCE CC(C)(C)OC(=O)NC1(CC(=O)N2CC(N=[N+]=[N-])C2)CCOCC1 2010392509 GGVJQAFFELEIFY-UHFFFAOYSA-N 339.396 1.972 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C1 2011940102 VGZYNYSTFVOYPH-XHDPSFHLSA-N 339.396 1.517 10 10 EDCE O=C1OCCN1[C@@H]1CCN(c2ccc(CO)cc2Br)C1 2171728835 ATZSDBWGTOYMJC-LLVKDONJSA-N 341.205 1.972 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H]3c3nccn3C)c2n1 2063949686 VZXZENJCIGKXCD-GFCCVEGCSA-N 326.360 1.454 10 10 EDCE C[C@@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1C(=O)c1ccc(O)c(O)c1 2054399735 VJFSJCDACPLCGO-SCZZXKLOSA-N 346.305 1.769 10 10 EDCE OCc1ccc(N2CCO[C@]3(CCOC3)C2)cc1Br 2111916403 AOYZEOMXNHJVST-CQSZACIVSA-N 328.206 1.937 10 10 EDCE CN1CCO[C@@H]2CN(c3ccc(CN)cc3Br)C[C@@H]21 2097704510 YOBWJRBGPGCJQC-UONOGXRCSA-N 326.238 1.427 10 10 EDCE C[C@H](O)c1ccc(N(C)[C@@H]2CC(=O)NC2=O)cc1Br 2114727958 UOBFVZQGMGIREQ-WRWORJQWSA-N 327.178 1.354 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ncccc2NN)s1 2284688555 KVUYIXAIIWYANE-UHFFFAOYSA-N 331.448 1.024 10 10 EDCE CN1CCC(CO)(NCc2c(O)cccc2Br)CC1 2352527028 RGXQMEARZSIOND-UHFFFAOYSA-N 329.238 1.701 10 10 EDCE COc1cc(N2CCN([C@@H]3CCC(=O)N3)CC2)cc(OC)c1OC 33610499 CIQFQRJWSVVNOX-OAHLLOKOSA-N 335.404 1.071 10 10 EDCE COc1ccc(CSCC(=O)OCC(=O)C(C)=O)cc1[N+](=O)[O-] 808502036 UXVYOPDSHSITRO-UHFFFAOYSA-N 341.341 1.538 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)CCCCC(N)=O)C2)cc1 819586769 BVOPVFKWUFJYBZ-CQSZACIVSA-N 333.432 1.683 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@](C)(O)CO)CCCC1 651961287 VVXCXGWRVCPRBY-LJQANCHMSA-N 346.427 1.388 10 10 EDCE COC[C@]1(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CCOC1 825373248 FZCSOSPNVMROJC-LJQANCHMSA-N 348.443 1.787 10 10 EDCE COc1cccc([C@@H](C)NC[C@]2(OC)CCS(=O)(=O)C2)c1O 903362479 GHBGVKZYXZAJKQ-IAQYHMDHSA-N 329.418 1.255 10 10 EDCE C[C@@H](NC(=O)N1CC(C)(CO)C1)c1ccc(N2CCOCC2)cc1 837882151 KYPINIZQHGTPBO-CQSZACIVSA-N 333.432 1.608 10 10 EDCE C[C@H]1OC(=O)N[C@H]1C(=O)NCc1cc(Br)ccc1O 841434823 OHJONQHMJGMWNF-LHLIQPBNSA-N 329.150 1.268 10 10 EDCE C[C@@H]1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1C(=O)O 842938286 QEGGMMYQJKZQSL-RHSMWYFYSA-N 347.459 1.754 10 10 EDCE CCOC(=O)N1CC[C@@H](NC(=O)NCc2c(O)cccc2F)C1 922028948 KZSKJXFTBLVFDA-SNVBAGLBSA-N 325.340 1.561 10 10 EDCE COc1ccc(N2CC[C@@H](CN3C(=O)N4CC5CC4(C5)C3=O)C2)cc1 849357636 RXMTWVDHWDPJRY-VFPJAPOESA-N 341.411 1.948 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CN3CCCCC3=O)C2)cc1 855232181 OZGVTAVPMHIIHR-AWEZNQCLSA-N 331.416 1.403 10 10 EDCE Nc1ccc(NC(=O)C(=O)NC[C@@H]2CC[C@@H](C(F)(F)F)O2)cc1 927837799 PCNMGOACOLSMNY-QWRGUYRKSA-N 331.294 1.433 10 10 EDCE C[C@H]1CC[C@H](NC(=O)NCCc2ccc(N)cc2)CS1(=O)=O 851662947 OQDZFCULKSMAJP-FZMZJTMJSA-N 325.434 1.076 10 10 EDCE O=C(NCc1ccc(N2CCSCC2)cc1)N1CC[C@@]2(O)C[C@H]2C1 853435264 IXUCZETUGDOWIF-MAUKXSAKSA-N 347.484 1.906 10 10 EDCE CC[C@@H](Cn1cncn1)NCc1ccc(N2CCC(O)CC2)cc1 850567872 LDEICAFPRHLLIS-INIZCTEOSA-N 329.448 1.808 10 10 EDCE COC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nn1 853759278 QSWPTOGANXVVTP-GFCCVEGCSA-N 328.372 1.963 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCOC[C@H]3CCCO3)C2)cc1 855230384 CTUDGZWWPMNDBT-MAUKXSAKSA-N 348.443 1.976 10 10 EDCE CCOC(=O)NCCC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855233338 XHPJXPYEQMXGFX-ZDUSSCGKSA-N 335.404 1.526 10 10 EDCE COC(=O)c1nc2nc(C)cc(N3Cc4cccc(O)c4C3)n2n1 866119410 OTCLKURPTJGRIS-UHFFFAOYSA-N 325.328 1.445 10 10 EDCE CCOC(=O)/C(=C\c1cn(C[C@@H]2CCOC2)nn1)c1nccn1C 865218481 NCAALSRJYJCCCJ-QENILXLESA-N 331.376 1.152 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCc2ccc(O)cc2C1 1118937691 KGGIJBWXFQUZAF-UHFFFAOYSA-N 338.363 1.525 10 10 EDCE C[C@]1(O)CCN(c2ccc(CO)cc2Br)C[C@@]1(C)O 1880700563 DEXRIJLRAHPZEC-UONOGXRCSA-N 330.222 1.654 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cn2cccn2)cc1C 1320970826 PEMSXHIYBQFKLZ-ARJAWSKDSA-N 328.416 1.662 10 10 EDCE O=C(C(=O)N1CCO[C@H](C(F)(F)F)C1)N1Cc2cccc(O)c2C1 1329365755 NASPFNQVPUVCTR-LBPRGKRZSA-N 344.289 1.024 10 10 EDCE C[C@H](NCc1ccc(Br)cc1O)C(=O)N1CCOCC1 691466917 ZHNDRKMNPJLRSL-JTQLQIEISA-N 343.221 1.492 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC/C=C\CNC[C@H]2CCOC2)cc1 1268631984 GJXKBZVIMVSFND-IUJMJXRYSA-N 345.403 1.761 10 10 EDCE COc1ccc(CNC[C@H]2CCN(C(=O)CCNC(N)=O)C2)cc1C 1267069317 UGIMDEIHUVOBDI-OAHLLOKOSA-N 348.447 1.000 10 10 EDCE CN1CCN(c2nnc(-c3sccc3O)n2CC2CC2)CCC1=O 1518345587 QCVBNLLCNUYIAM-UHFFFAOYSA-N 347.444 1.791 10 10 EDCE CC[C@H](CNC(=O)CC1CC1)NC(=O)c1cc(OC)nc(OC)c1 1297343697 MHTRJIUGUYCDHL-CYBMUJFWSA-N 335.404 1.524 10 10 EDCE O=C(NCCCSc1nccs1)C1=CS(=O)(=O)CCC1 1292997005 KFUNWRKVWMZXNR-UHFFFAOYSA-N 332.472 1.834 10 10 EDCE CCNC(=O)COc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1542554920 CMFBGABEAZTHCU-UHFFFAOYSA-N 344.367 1.794 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@H]2COC(=O)N2)C2CC2)cc1C 1483558022 KJPZMUJDEBIGEP-HUUCEWRRSA-N 347.415 1.096 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H](O)c1cnn(C)c1 1628954322 HCMBUADHPJXZEY-KRWDZBQOSA-N 328.416 1.712 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C2CC3(CC3)C2)cc1C 1717776806 UJTHJHBVHBJKRQ-INIZCTEOSA-N 332.444 1.761 10 10 EDCE NC(=O)[C@]1(c2ccccc2)CCN(C(=O)c2c(F)ccc(O)c2O)C1 1638800887 SSFCDSYEUHGUIP-GOSISDBHSA-N 344.342 1.506 10 10 EDCE C/C=C(/C)C(=O)NC[C@H](CC)NC(=O)c1cc(OC)nc(OC)c1 1498994929 HPVGJBQMTUCNHY-GXJZLWQJSA-N 335.404 1.690 10 10 EDCE O=C1C[C@H](C(=O)NCc2ccc(O)cc2O)c2ccc(F)cc2N1 1638353012 YWHSIQHWPIVRJX-ZDUSSCGKSA-N 330.315 1.979 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)CN(C)C(C)=O)cc1C 1732410866 ORNFCZJPHVEJPF-AWEZNQCLSA-N 335.448 1.418 10 10 EDCE Cn1nc(C(=O)OC(C)(C)C)cc1C(=O)NCc1c(O)cccc1O 1645363183 PHVMGTCCAGHJPZ-UHFFFAOYSA-N 347.371 1.717 10 10 EDCE COC(=O)/C=C/c1ccc(N2C3CCC2(C(N)=O)CC3)c([N+](=O)[O-])c1 1643259647 DRXMSNSTDFIDQB-HWKANZROSA-N 345.355 1.768 10 10 EDCE Cn1ccnc1[C@@H]1C[C@@H](NC(=O)NCc2ccccc2O)CCO1 1683084196 OGUSTULVIZPIOE-ZFWWWQNUSA-N 330.388 1.845 10 10 EDCE CC(=O)NCCNC(=O)CN(C)Cc1ccc(N2CCCCC2)cc1 11193251 MVTFPUDWHBRHNP-UHFFFAOYSA-N 346.475 1.361 10 10 EDCE COc1cc(NC(=O)c2cc(O)c(O)c(O)c2)c(C(=O)O)cc1OC 1865876120 SHCMTZHJZJUJJC-UHFFFAOYSA-N 349.295 1.771 10 10 EDCE CNCc1ccc(N2CC[C@](C)(O)[C@@H](O)C2)c(Br)c1 1893331991 NSXPEHSWSRFTDY-KBPBESRZSA-N 329.238 1.491 10 10 EDCE CC(=O)C(=O)[C@@]1(O)CN(C(=O)OC(C)(C)C)[C@@]2(CCCOC2)C1 1939683463 HESBWLBTXMFRIK-HOTGVXAUSA-N 327.377 1.066 10 10 EDCE CCOC1(C(=O)O)CN(Cc2ccc(Br)cc2O)C1 1972382558 SNQJVLVGKVUUJQ-UHFFFAOYSA-N 330.178 1.830 10 10 EDCE CN1CCCc2cc(C=CC(=O)OCC(=O)N3CCCC3=O)ccc21 2041674230 BTGXMMDKQRXXMS-UHFFFAOYSA-N 342.395 1.774 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](N3CC(O)C3)C2)c(Br)c1 2158744812 VVMMLNKQYCZYFS-PWSUYJOCSA-N 340.265 1.724 10 10 EDCE N[C@H]1C(=O)Nc2cc(N(CCCO)C3CC3)c(Br)cc21 404216239 GXLQQEVYCTXYGB-CYBMUJFWSA-N 340.221 1.752 10 10 EDCE C[C@H](COCc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)c(O)c1 390697635 AWOPQXXFKHWAGQ-CJNGLKHVSA-N 344.411 1.689 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCCn3ccc(C4CC4)n3)c2n1 2064738921 GBAJHLWUMIVTNE-UHFFFAOYSA-N 326.360 1.247 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H]4[C@H](O)C[C@H]43)c(Br)cc21 2178170613 XFUDEJQRANFMOX-SGJXIIODSA-N 338.205 1.361 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1C(=O)c1cccc(O)c1O 2054401439 RWSIRSPPHADTGH-RKDXNWHRSA-N 346.305 1.769 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCCN=[N+]=[N-])[C@H](O)C(F)(F)F 2242876550 TVHZOXXUNSGMDS-BQBZGAKWSA-N 341.290 1.229 10 10 EDCE CCCCCCN1C(=O)NC(=O)C(=CN[C@H]2CCCC[C@H]2N)C1=O 2296056454 MIKUAYLWFXGCHG-KGLIPLIRSA-N 336.436 1.389 10 10 EDCE O=C1NN(c2ccccc2)C(=O)C1=Cc1ccc(N2CCOCC2)cc1 2297327321 VLWPRULMGYTCPT-UHFFFAOYSA-N 349.390 1.985 10 10 EDCE OC[C@H](O)[C@H]1COCCN1c1ccc(OCc2ccccc2)cc1 2299515145 OSODPYQDYLPLIZ-MOPGFXCFSA-N 329.396 1.824 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)c(Br)c1 2331966006 YQTNHBUFHIPRRS-IGJVIKARSA-N 327.222 1.371 10 10 EDCE CCc1nc2n(n1)C[C@H](NC(=O)N(C)Cc1ccccc1O)CC2 114978452 CXFZRSNHZXWQQJ-CYBMUJFWSA-N 329.404 1.703 10 10 EDCE C[C@H](C(=O)NC1CCCC1)N1CCN(Cc2ccccc2O)CC1 179569957 ZFSPNZOYCDELHJ-OAHLLOKOSA-N 331.460 1.957 10 10 EDCE COc1ccc(Br)c(CNCCN2CC(OC)C2)c1O 2365498820 QOVGRPPTUAVHCO-UHFFFAOYSA-N 345.237 1.584 10 10 EDCE Cc1[nH]nc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C 265180762 FPAXSTCQJCERHL-UHFFFAOYSA-N 332.379 1.932 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2cc(C(C)C)c(C)cc2O)CCO1 530101645 AKARFOHJZOMDOV-HNNXBMFYSA-N 335.448 1.954 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2CCC(=O)N2)c(O)c1Br 2380770664 CWEBXVLGBZYIMK-JTQLQIEISA-N 341.205 1.700 10 10 EDCE Cc1ccc(CNCc2nc(C(N)=O)co2)c(O)c1Br 2380793774 UVENOCGGAXIKBW-UHFFFAOYSA-N 340.177 1.840 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H](C)O[C@H](C)[C@H]1C 807102447 ZMYSAAWBYBFKER-RRFJBIMHSA-N 347.459 1.702 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CCCN3C(C)=O)C2)cc1 824017321 KLRFGAODVXQBIG-QAPCUYQASA-N 345.443 1.649 10 10 EDCE CCC(CC)NC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 826617634 ZQHQAPYAJDSYER-CQSZACIVSA-N 333.432 1.695 10 10 EDCE Cc1cc(CC(=O)NN2CC(=O)N(C)C2=O)c(C)n1-c1ccccc1 831548164 KJMNNRSLHUQHIP-UHFFFAOYSA-N 340.383 1.562 10 10 EDCE CC1(CNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)OCCCO1 588589722 WAHWXNPOAUJIFY-YVMONPNESA-N 346.427 1.806 10 10 EDCE Cc1cc(C(=O)NCc2ccc(O)cc2O)nn1C1CCOCC1 910942548 FFOYLZUFOWYNCQ-UHFFFAOYSA-N 331.372 1.884 10 10 EDCE O=C(NCCNC1CC1)NCc1cc(Br)ccc1O 841930002 OEKRCXSNYMGAAO-UHFFFAOYSA-N 328.210 1.706 10 10 EDCE N[C@@H]1CCO[C@@H]([C@@H]2CCCCN2Cc2cc3c(cc2O)OCO3)C1 844911989 QOABTJSLQKKHGC-IJEWVQPXSA-N 334.416 1.982 10 10 EDCE CN(C)c1cc(F)c(CNC[C@@H]2CCCCN2CCO)cc1F 858170992 RPKOBYOMXKDVPV-AWEZNQCLSA-N 327.419 1.967 10 10 EDCE CN(C)c1ccc(CNC(=O)CN(C)[C@@H](CN)C(F)(F)F)cc1 852762813 XGUSBXKJYLJGHR-ZDUSSCGKSA-N 332.370 1.190 10 10 EDCE Cc1cc(CC(=O)O[C@@H](C)C(=O)NC(N)=O)c(C)n1-c1ccccc1 853935134 WXWNODDGFDFSOQ-ZDUSSCGKSA-N 343.383 1.763 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)NCC(=O)N=S(C)(C)=O 923581266 BLTGLGAJYONTQJ-UHFFFAOYSA-N 340.449 1.148 10 10 EDCE CC[C@@H](NC1CN(S(=O)(=O)N(C)C)C1)c1ccc(N(C)C)cc1 858569308 DKPXWGOALWFMBV-MRXNPFEDSA-N 340.493 1.284 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCc3ncccn3)C2)cc1 855225743 LYEFIAGGHNBSSB-AWEZNQCLSA-N 326.400 1.813 10 10 EDCE CC(C)NC(=O)[C@H]1CCCN(C(=O)NCCc2ccc(N)cc2)C1 851665229 SPBWYOKHIQPTKI-HNNXBMFYSA-N 332.448 1.758 10 10 EDCE C[C@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1ccc(F)cc1O 858488928 NWEYELNFVDBKEA-WCQYABFASA-N 342.378 1.899 10 10 EDCE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCc2nnnn2C)c1 772875020 BFLQPNCEFWLHDA-UHFFFAOYSA-N 338.415 1.899 10 10 EDCE CCNC(=O)N1CC[C@H](NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 773385894 FCFIXOFPUMZRDB-HIFRSBDPSA-N 347.463 1.917 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN(CCO)[C@@H](C)C2)c1 779215354 XJXFDVWDJYAFMP-LBPRGKRZSA-N 343.265 1.962 10 10 EDCE NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(CO)c(Br)c1 1877071761 KOHCTYNZMLEFIY-QWRGUYRKSA-N 326.194 1.283 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@H]([C@@H]3CCCO3)C2)cc1 897361917 VKFSBBLAGNQDMJ-WBVHZDCISA-N 345.443 1.396 10 10 EDCE CN(C)c1ccc(/C=C/CN[C@H]2C(=O)NCC23CCOCC3)cc1 895769112 MUKAACUQCRNYPS-IDOMTICXSA-N 329.444 1.651 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CCCS(N)(=O)=O 1136025343 GTEGOYSNVKCWPF-UHFFFAOYSA-N 339.461 1.314 10 10 EDCE C[C@]1(c2cccnc2)NC(=O)N(CCOc2ccc(N)cc2)C1=O 57849822 JDNLRWDUWQSSPP-QGZVFWFLSA-N 326.356 1.510 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2coc(C(N)=O)c2)cc1C 1317255086 LCIRKOIOCXWEIE-GFCCVEGCSA-N 345.399 1.604 10 10 EDCE COc1cc(N2CC(NC3CCOCC3)C2)c([N+](=O)[O-])cc1OC 1187607185 QMQHOROUZQONEU-UHFFFAOYSA-N 337.376 1.569 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ncccc2C)cc1C 1331697506 QHALQWICQAFDST-MRXNPFEDSA-N 343.427 1.588 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)N[C@@H]1[C@H]2CCC[C@H]21 1346327818 UECQKBHSVJQUMY-URLYPYJESA-N 325.459 1.656 10 10 EDCE C[C@]1(NC(=O)NCc2cc(Br)ccc2O)CCOC1=O 1352140862 XERQSAVEDUKPGG-ZDUSSCGKSA-N 343.177 1.660 10 10 EDCE CCC(=O)NC[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1286454837 LEKSLVPIJDXRSZ-MJHDQNEOSA-N 331.376 1.884 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)Cc2ccn(C)n2)cc1C 1282128122 HFJUUQWJAKCZEI-LSDHHAIUSA-N 344.459 1.963 10 10 EDCE CCO[C@@H](C)C(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1285660767 WVFMQRALUGHXOP-MNOVXSKESA-N 349.391 1.509 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CCc1n[nH]c(C)n1 1513792874 CHJGWXVPYIYOEB-UHFFFAOYSA-N 341.419 1.852 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cn(Cc2ccccn2)nn1 1469160768 SNWRCPZDIIXDPP-UHFFFAOYSA-N 325.328 1.063 10 10 EDCE COc1cccc(CNC(=O)c2ccc(S(C)(=O)=O)s2)c1O 1622779691 SVHFYOJMKNMPLW-UHFFFAOYSA-N 341.410 1.796 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cnc(O)n2C)cc1C 1715990048 PWGFYSMIJCOGQU-LBPRGKRZSA-N 332.404 1.351 10 10 EDCE CC[C@@H](CNS(C)(=O)=O)NC(=O)N[C@@H](C)c1ccccc1O 1564781444 HEBVGAJUUYVWEH-QWRGUYRKSA-N 329.422 1.080 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCCN(CC(F)(F)F)C1=O 1636666840 MVZYRAGQMJRZJB-SNVBAGLBSA-N 346.305 1.310 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)C(=O)NCC2CC2)cc1C 1733998424 OYDZSNKJINNFRC-ZIAGYGMSSA-N 347.459 1.513 10 10 EDCE COC(=O)CNC(=O)c1ccc(NC(=O)c2cc(O)cs2)cc1 1587555705 RSNMPFVRLXVSDL-UHFFFAOYSA-N 334.353 1.609 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@@H]2CCC(=O)N2)C(C)C)cc1C 1698978926 DEOAFXBMWQPRMU-JKSUJKDBSA-N 347.459 1.513 10 10 EDCE CCC(=O)N[C@H](CNCc1nnnn1-c1ccc(OC)cc1)C1CC1 1699571531 SXTZUQLCSHWBIP-OAHLLOKOSA-N 344.419 1.065 10 10 EDCE CCC(CC)C(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169824390 HZEGZDKHPVODQZ-UHFFFAOYSA-N 336.388 1.524 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985093747 DXAJVOHMOLYXFI-WDEREUQCSA-N 327.385 1.421 10 10 EDCE CC(C)(O)C1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2152268330 KJOBQNPMPVODCO-LBPRGKRZSA-N 341.205 1.642 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CCCOC1 2010393918 ZEJBEHYIEIDONB-NHYWBVRUSA-N 339.396 1.972 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](N[C@H]2CCc3cccc(O)c32)C1 2011486779 DZIUMTFOOJTKBX-GUTXKFCHSA-N 334.416 1.949 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@](O)(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2011938700 CKMVOPYWVPJEBY-NHYWBVRUSA-N 339.396 1.660 10 10 EDCE NCc1cc(F)c(N2CCC[C@@H](C(N)=O)C2)cc1Br 311502056 PMIHLKASEOQXGH-MRVPVSSYSA-N 330.201 1.749 10 10 EDCE CN1CCO[C@@H](CN(C)c2cc(Br)c(CN)cc2F)C1 707820899 WLDBVHRZGGDHIX-LLVKDONJSA-N 346.244 1.814 10 10 EDCE CCNCc1ccc(N2CC(O)(COC)C2)cc1Br 384096594 DJRSMVQUFDZCBK-UHFFFAOYSA-N 329.238 1.756 10 10 EDCE C[C@@H](O)C1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 719902315 NJJWBZGGPSEGSZ-SREIQFSDSA-N 327.178 1.252 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H]3CC[C@@H](C(F)(F)F)O3)c2n1 2062333010 ZJPBUYLDWGXCNN-WPRPVWTQSA-N 344.293 1.583 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)CC1(O)CN(C(=O)OC(C)(C)C)C1 2080666350 MEFQLJAEZJRAFT-UHFFFAOYSA-N 349.431 1.599 10 10 EDCE O=C1NC[C@@H]2CN(Cc3c(O)cccc3Br)CC[C@H]12 2100942982 HADHYJNLIAMEOE-ZJUUUORDSA-N 325.206 1.723 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCOC[C@H]2CO)c1O 2236045688 SGYMLJNJLXFNCO-SKDRFNHKSA-N 346.221 1.650 10 10 EDCE COc1ccc(Br)c(CN(C)[C@@H]2[C@@H]3CNC[C@@H]32)c1O 2227749164 BRXMPJSVJVWLQN-YFKFIEJBSA-N 327.222 1.813 10 10 EDCE CN(C)c1ccc(OC[C@@](N)(CO)C2(Br)CC2)cc1 2229376689 GODYGEZTFXIJKR-AWEZNQCLSA-N 329.238 1.749 10 10 EDCE NCc1ccc(N2CC[C@@H](O)[C@H](O)CC2)c(F)c1Br 2269142370 RPSQUKAWSIPHSY-GHMZBOCLSA-N 333.201 1.369 10 10 EDCE CSc1ncc(CNS(=O)(=O)CCCCNC2CC2)s1 2284687209 DURDBZONEAHCNU-UHFFFAOYSA-N 335.520 1.817 10 10 EDCE CCNCC1CC(S(=O)(=O)NCc2cnc(SC)s2)C1 2284689357 NQDAHWHECNXFPZ-UHFFFAOYSA-N 335.520 1.673 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S 2323831502 WEPWHLZSRMKRFC-SECBINFHSA-N 343.813 1.987 10 10 EDCE CC(C)S(=O)(=O)N(C)NCc1c(O)cccc1Br 2317436333 JJOMEJMFHAVEJL-UHFFFAOYSA-N 337.239 1.829 10 10 EDCE COc1cc([C@H](NCCN=[N+]=[N-])C(N)=O)c(Br)cn1 2336991111 SMFIHAMAQACIHP-VIFPVBQESA-N 329.158 1.279 10 10 EDCE CC(C)(C)OC(=O)NCCCO[C@H](N)Cc1ccc(O)c(O)c1 1952707500 DVPHRWVVQLWRHF-AWEZNQCLSA-N 326.393 1.857 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3CCNC(=O)C3)ccc(N)c2C1 302564434 ZHSCDEZTPBEMRV-UHFFFAOYSA-N 346.431 1.498 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2357585627 OMMZMMCTXLEQQK-RMROANFSSA-N 341.249 1.789 10 10 EDCE COC(=O)[C@H]1C[C@@H](OC)CN1Cc1ccc(N2CCOCC2)cc1 125781647 CUOSWAOLTHAGBW-IAGOWNOFSA-N 334.416 1.286 10 10 EDCE CN1C(=O)/C(=C\c2cn(CC(=O)O)c3ccccc23)C(O)=NC1=S 33294204 WWQWYCMMFPGIBJ-WDZFZDKYSA-N 343.364 1.823 10 10 EDCE NS(=O)(=O)c1ccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)cc1 220146204 MUROZEFDSFDSBW-XBXARRHUSA-N 348.380 1.075 10 10 EDCE C[C@H]1CC[C@H](C(N)=O)CN1c1ccc(CN)c(Br)c1 228150190 YRYTZAKKTYWHBX-ONGXEEELSA-N 326.238 1.998 10 10 EDCE COc1ccc(Br)c([C@@H]2N[C@H](C(=O)O)CS2)c1O 83236608 GUDWTIROFAQFIK-QUBYGPBYSA-N 334.191 1.952 10 10 EDCE CCN(CC)c1ccc(CN2CC[C@@H](NS(C)(=O)=O)C2)cc1F 93531018 MINPSNBXHNWPNX-CQSZACIVSA-N 343.468 1.795 10 10 EDCE NC(=O)N[C@H](CC(=O)NCCc1ccc(N)cc1)c1cccs1 262583311 RTKYJQKUYLIILH-CYBMUJFWSA-N 332.429 1.789 10 10 EDCE Cc1nc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)no1 277144627 AHRAHDLQZOGLCY-UHFFFAOYSA-N 336.735 1.701 10 10 EDCE c1nc([C@@H]2COCCN2Cc2ccc(N3CCOCC3)cc2)no1 374829430 TZHQUBOPVGUJFC-INIZCTEOSA-N 330.388 1.480 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)[C@@H]1CCC[C@H]1O 708694995 YEIWPZUYMJUHNN-RAIGVLPGSA-N 341.205 1.784 10 10 EDCE Cc1ccc(CNC(=O)CN[C@@H]2CCOC2)c(O)c1Br 2380757213 PRVLGPMFIIDUQH-LLVKDONJSA-N 343.221 1.458 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 808541884 VDQICVJBZZMTSC-SNVBAGLBSA-N 349.330 1.580 10 10 EDCE CO[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC[C@@H]1C 807098217 UFMNAFTXENIVIL-GUYCJALGSA-N 347.459 1.561 10 10 EDCE Cc1ccc([C@H](C)N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)c(O)c1 806170124 ONICNCADOAWJHG-UONOGXRCSA-N 341.477 1.622 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@](O)(C(F)F)C3)cc2N1 828751858 UQZGWILUBKPJFM-ZDUSSCGKSA-N 329.259 1.132 10 10 EDCE CC(C)C[C@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)N1CCOCC1 588403685 VNQDIIYAGZXBEM-DQOPKJQZSA-N 348.443 1.974 10 10 EDCE CN(C)S(=O)(=O)n1ccnc1CNCc1cc(Cl)ccc1O 846054725 FCCKBMNQDFVVBE-UHFFFAOYSA-N 344.824 1.186 10 10 EDCE C[C@@H](CN)NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 841867134 SGMAJXNZMJYWCJ-HNNXBMFYSA-N 345.491 1.365 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@H]1CC[C@@H](C(F)(F)F)NC1=O 928712288 QHLFIFPMQCLGFW-HQJQHLMTSA-N 334.269 1.605 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCN(C)[C@@H]2C)cc1 925348968 OUVXOKUQQCUERA-RHSMWYFYSA-N 334.464 1.865 10 10 EDCE CCc1cc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)n(C)n1 929249003 BGUAJDULXFEDIQ-UHFFFAOYSA-N 342.443 1.882 10 10 EDCE CCn1nncc1CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 858598527 FQMZFQMAKWHHDU-ZDUSSCGKSA-N 344.419 1.385 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]3CNCC[C@@H]32)cc1 866716830 RXQOFEDVXSFORH-WMZOPIPTSA-N 330.476 1.443 10 10 EDCE C[C@H](NC(=O)c1cn(C)ccc1=O)c1ccc(N2CCOCC2)cc1 930745290 UWQHBAICWBPPPB-AWEZNQCLSA-N 341.411 1.713 10 10 EDCE CC(C)(CNC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)N1CCCC1 863150342 SEJKHSLWFOLKAS-SOFGYWHQSA-N 332.400 1.876 10 10 EDCE COC[C@]1(C)CN(Cc2ccc(N3CCN(C)CC3)cc2)CCO1 862550554 FKQHRAIPJDUGAO-IBGZPJMESA-N 333.476 1.676 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@H](OC)[C@@H]3CCOC3)CC2)cc1 1118749896 NUJROERNBRADCY-CRAIPNDOSA-N 348.443 1.785 10 10 EDCE O=C(CCSc1ncnc2[nH]cnc12)NCc1ccc(O)c(O)c1 1137443658 XWWXORDJYDGHPG-UHFFFAOYSA-N 345.384 1.563 10 10 EDCE NC(=O)N[C@H](CC(=O)NCc1cc(O)ccc1O)c1ccccc1 1303223665 ZLDHCXLIWIVKMH-CQSZACIVSA-N 329.356 1.514 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCOC[C@H]1C 1323276443 FMICPNYQPMAFNP-CZUORRHYSA-N 333.432 1.218 10 10 EDCE CC(=O)C(=O)COC(=O)c1cccc(OCC(=O)OC(C)(C)C)c1 1333281739 ZTOCFVVPZOSPQQ-UHFFFAOYSA-N 336.340 1.722 10 10 EDCE COc1ccc(CN2CC[C@@H]2C(=O)NCc2cccc(O)c2O)cc1 1263895797 GWWZGHXCJDIVER-MRXNPFEDSA-N 342.395 1.997 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cc(C)on2)cc1C 1272360031 AAXOUHRLOPSMKS-CQSZACIVSA-N 333.388 1.181 10 10 EDCE C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)c1cc(O)cs1 1623387148 RHUSSZZANNQHQN-VIFPVBQESA-N 340.426 1.934 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cnnc(O)c3)CC2)cc1C 1716684093 CCLASUHULKYAFV-UHFFFAOYSA-N 342.399 1.551 10 10 EDCE CO[C@@H](C)CN(C)[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1485391533 VOMAJRABCAVVOC-NEPJUHHUSA-N 335.408 1.934 10 10 EDCE CC1(C)CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCN1CCO 1638724990 AQACRNYKKDQQIU-UHFFFAOYSA-N 333.392 1.378 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cn(CCc2ccccc2)nn1 1637046811 ZMTWOBLZMRWJPH-UHFFFAOYSA-N 338.367 1.862 10 10 EDCE CCC[C@H](C)C(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1737447617 VNDMXKNDWLCJLV-UBHSHLNASA-N 349.431 1.912 10 10 EDCE COCc1nnc2n1CCN(Cc1cc(F)cc(C(C)=O)c1O)C2 1647076838 DURSJYJEZDATSK-UHFFFAOYSA-N 334.351 1.488 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)NCCCS(N)(=O)=O 1674000804 PKCPYMDHPDKIJI-UHFFFAOYSA-N 343.449 1.383 10 10 EDCE COC[C@](C)(O)CNCc1c(Br)ccc(OC)c1O 1964564642 URUIITOWJSHYRH-CYBMUJFWSA-N 334.210 1.650 10 10 EDCE Nc1ccc(OCCCN2CCC(NC(=O)[C@H]3CCCO3)CC2)cc1 586044597 HKEYWQGYKUVRHR-GOSISDBHSA-N 347.459 1.797 10 10 EDCE [N-]=[N+]=NC[C@H]1CCCN(C[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1 1912173618 OOODYAFAYUYYIX-CHWSQXEVSA-N 343.387 1.666 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC[C@@H](CO)C3)c(Br)cc21 226454841 BHZZQGVOCRHUIC-AMIZOPFISA-N 340.221 1.480 10 10 EDCE C[C@H](CC(N)=O)N(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2151341162 WAKUEUKXOKEDSA-INWYIAFRSA-N 342.193 1.135 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1Cc1cc(N)ccc1O 2010531689 XQKNTWJCRSYAFQ-ZIAGYGMSSA-N 337.420 1.434 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CNC(=O)CCc1ccc(N)cc1 2011423304 ZZCANUWOYGDXSG-AWEZNQCLSA-N 337.420 1.203 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@@]4(CCO4)C3)c(Br)cc21 2153334937 RFHSKVZSPRQSKU-TZMCWYRMSA-N 338.205 1.770 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)C[C@H](O)C1 2018045793 KLWVDIONZVQQMF-HFAKWTLXSA-N 339.396 1.563 10 10 EDCE NCc1cc(F)c(N2CC[C@@H](N3CC(O)C3)C2)cc1Br 2158751035 KXRUPVCBTAMQBR-SNVBAGLBSA-N 344.228 1.302 10 10 EDCE CC(C)(C)OC(=O)NCC1(NCc2ccc(O)c(O)c2O)COC1 705672685 DQPQEWVZVLQYSO-UHFFFAOYSA-N 340.376 1.187 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)C[C@H]2CO)cc1Br 698194809 BBDOYBFISDNRMS-KBPBESRZSA-N 343.265 1.881 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)c(Br)c1 2189046066 ZMZUDKQGPMEGAS-ADGXKJENSA-N 342.233 1.946 10 10 EDCE CN1CCc2cc([C@@H](N)CN3CC(NC(=O)OC(C)(C)C)C3)ccc21 2050180350 QPTCJNKJVQRSIB-INIZCTEOSA-N 346.475 1.888 10 10 EDCE O=C(O)C[C@]1(O)CCN(Cc2ccc(Br)cc2O)C1 2104569706 ITAACIXHXXUZFH-CYBMUJFWSA-N 330.178 1.566 10 10 EDCE CNC(=O)[C@@H]1[C@@H](C)CCN1c1ccc(CN)cc1Br 2090258552 JHEHOXASOBIPBV-ZANVPECISA-N 326.238 1.869 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)CC1(Br)CCC1 2111884654 DFWRSXAEIYVLHQ-UHFFFAOYSA-N 326.238 1.874 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1CCn2cnnc2C1 2236576724 CIEYCHULOYCYFM-SNVBAGLBSA-N 341.184 1.990 10 10 EDCE COc1ccc(N(C)[C@@H]2COC[C@H]2O)c(OC)c1Br 2226539045 RMRVUULRYOBLAA-NXEZZACHSA-N 332.194 1.662 10 10 EDCE CC[C@@H](C)N1C(=O)C(=CNCCc2ccccc2)C(=O)NC1=S 2296938431 NXNWSJHQKTZZRU-GFCCVEGCSA-N 331.441 1.744 10 10 EDCE Oc1cc2c(cc1O)CN(Cc1nnnn1Cc1ccccc1)CC2 2318674243 ZPVDFFYGCVKLEO-UHFFFAOYSA-N 337.383 1.691 10 10 EDCE CNCc1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)c(Br)c1 2336333191 GCBCEMNRSWWIAH-ZWNOBZJWSA-N 345.262 1.402 10 10 EDCE CNC(=O)C(C)(C)CNC(=O)N1CCN(c2ccc(OC)cc2)CC1 178928287 XKHPUUFTEGHFGD-UHFFFAOYSA-N 348.447 1.299 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cc3c(=O)n(C)ccc3n2C)cc1 65118871 OUCZAYCLLUTTMY-UHFFFAOYSA-N 338.411 1.873 10 10 EDCE C[C@@H](Nc1cnn(CC(=O)NCCO)c1)c1cc(Cl)ccc1O 186508038 FOOBTCLPBNBXNM-SNVBAGLBSA-N 338.795 1.524 10 10 EDCE Cc1cn([C@H]2C[C@@H](N=[N+]=[N-])[C@@H](CO)O2)c(=O)nc1N1CCCCC1 66087508 UAAFTMYSSBUFMW-JHJVBQTASA-N 334.380 1.501 10 10 EDCE COc1ccc(N2CCN(c3nncc(N4CCCC4)n3)CC2)cc1 243671827 PELBWEIVPGBPDF-UHFFFAOYSA-N 340.431 1.807 10 10 EDCE CC(C)CN1C(=O)/C(=C/Nc2ccnn2C(C)C)C(=O)NC1=S 255131938 XKUQZJWREFYXFV-YRNVUSSQSA-N 335.433 1.659 10 10 EDCE COC(=O)[C@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(C)C 255233342 PPOUYZKVJUWYKJ-OTIVFRFGSA-N 346.427 1.850 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 808528594 IIDVMXZPXNGYNF-UHFFFAOYSA-N 344.117 1.981 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc([N+](=O)[O-])cc(Br)c1C 808548878 KXSVTWDVKIFUJU-UHFFFAOYSA-N 344.117 1.981 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@]23[C@H]4C(=O)[C@H]5[C@H]6C[C@@H]([C@@H]52)[C@H]3[C@H]64)c1 800520001 YKGZHIQMSRCRSS-ZKPWHKLRSA-N 325.364 1.344 10 10 EDCE CCn1nnc(C)c1C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 819591015 NEBJXWHUVYXBFV-AWEZNQCLSA-N 343.431 1.871 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@H](Cn4ccnn4)C3)cc2)CC1 826845273 IEXQUGPOYILDQB-SFHVURJKSA-N 340.475 1.552 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)CN1C(=O)NC(=O)C1(C)C 735856513 HPCILCWTSHPEQA-UHFFFAOYSA-N 333.388 1.461 10 10 EDCE O=C(c1cc(O)nc(O)c1)N1CCC[C@H](Oc2ncc(F)cn2)C1 585341634 ZCOVAXPEWHXQLS-NSHDSACASA-N 334.307 1.106 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@]12CNC[C@H]1COC2 846662099 KYMRSPTYKVGLOO-PXNSSMCTSA-N 343.471 1.871 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CCNC[C@@](C)(F)C3)ccc21 841760745 YOHPVSQGEREOAV-GOSISDBHSA-N 334.439 1.912 10 10 EDCE COCCN(C[C@@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(OC)c(OC)c1 929995154 BGOSQKDTENRRGL-XUWXXGDYSA-N 337.416 1.961 10 10 EDCE COc1ccc2c(n1)N(C)CCN2C(=O)/C=C/c1cnc(OC)nc1 928398285 SVTXGDRGBRTHMB-QPJJXVBHSA-N 341.371 1.385 10 10 EDCE CCNC(=O)[C@@H](C)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 851947354 ZNDOLPYXTAKFBI-OLZOCXBDSA-N 334.420 1.098 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CN(C)C(=O)C3CC3)C2)cc1 855230739 IUTMKXZABVZJRS-CQSZACIVSA-N 331.416 1.259 10 10 EDCE Cn1nc2c(c1S(=O)(=O)NCc1c(O)cccc1F)CCCC2 921451406 PEKJZBDMLYOYQP-UHFFFAOYSA-N 339.392 1.622 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@H](O)C(F)(F)C2)cc1 852413358 UIJIFDIZUNLAPI-CQSZACIVSA-N 327.375 1.071 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(N2CC[C@@H](O)C2)CC1 856254117 RPYBEVRPSIGSIK-TXTHVTMNSA-N 332.400 1.169 10 10 EDCE COc1ccc(CNS(=O)(=O)CC2(OC)CCCC2)c(O)c1 867218183 XLVNBOLCICEPMF-UHFFFAOYSA-N 329.418 1.779 10 10 EDCE O=C1OCC[C@@H]1CCCN1C(=O)CN(Cc2ccccc2O)C1=O 871908199 FXFODJBVHJCQGJ-LBPRGKRZSA-N 332.356 1.500 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 773727655 VBSLEFUOQHPGSQ-QGZVFWFLSA-N 348.443 1.949 10 10 EDCE C[C@@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)CCN1CCO 779214733 UFWIWYADHSAPJU-OAHLLOKOSA-N 337.439 1.161 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3[C@@H]4CCCO[C@H]43)CC2)cc1F 780625190 YSDHKGUCWOWYRU-IAOVAPTHSA-N 334.391 1.908 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCN=[N+]=[N-])[C@@H]2CS(=O)(=O)C[C@@H]21 1895302005 OWSOOYZFEUHNMA-MNOVXSKESA-N 345.425 1.015 10 10 EDCE CCN1CC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 897485156 DSULULFWVRTBIO-KRWDZBQOSA-N 344.459 1.113 10 10 EDCE COC(=O)c1coc(S(=O)(=O)Nc2ccc(O)c(OC)c2)c1 797820026 CIVJUCMHVYMRSH-UHFFFAOYSA-N 327.314 1.581 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC4(CCCO4)C3)c(Br)cc21 702876814 XGUSJIBFNPSUBG-GFCCVEGCSA-N 338.205 1.770 10 10 EDCE CNCc1ccc(N(C)C[C@@H](O)CN(C)C)cc1Br 690234418 RJRIABARGYFPRW-ZDUSSCGKSA-N 330.270 1.527 10 10 EDCE C[C@@H](N)c1ccc(N(C)CCN(C)CCO)cc1Br 691342342 JFYIFWHWHJFIRK-LLVKDONJSA-N 330.270 1.829 10 10 EDCE CNCc1ccc(N2C[C@H](O)C[C@]2(C)CO)cc1Br 698224516 AQPGDHQBUJMNRN-TZMCWYRMSA-N 329.238 1.491 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)N2CC(CO)(CO)C2)c1C 1471785266 RQYYYKVJXMGHCR-UHFFFAOYSA-N 328.412 1.829 10 10 EDCE CCNC(=O)CN[C@H](C)[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1717440256 BFKVPMAXMFOJHJ-MNOVXSKESA-N 348.407 1.082 10 10 EDCE Cc1ccc(C(=O)NCc2nc(C3CCOCC3)n[nH]2)c(O)c1O 1557877568 YSYLURXVUOFTGY-UHFFFAOYSA-N 332.360 1.348 10 10 EDCE CC[C@H](CNC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1)OC 1498204466 WFJREPLDXQCCHS-SMDDNHRTSA-N 335.408 1.982 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1CCN(C)C1=O 1497439473 QMCJDNFJNMLCGR-MRXNPFEDSA-N 347.459 1.420 10 10 EDCE N[C@H]1CCN(Cc2cc(Br)cc(F)c2O)C[C@H]1CO 2122373846 GDZZIZRMBAQUON-CABZTGNLSA-N 333.201 1.435 10 10 EDCE Cc1oc(S(C)(=O)=O)cc1C(=O)NCc1cc(O)ccc1O 1637125856 FFGXWQRIULLUGI-UHFFFAOYSA-N 325.342 1.333 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2ccoc2)cc(OC)n1 1494592200 DSVAAFZLDJRXOU-SNVBAGLBSA-N 333.344 1.240 10 10 EDCE COCCC(=O)N1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1738679935 HCHNZHMTRQYDFD-ZDUSSCGKSA-N 347.375 1.216 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cc2cncn2C)cc1C 1691556685 XWGXHZWAQAHWKX-UHFFFAOYSA-N 330.432 1.528 10 10 EDCE C[C@@H](O)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccccc2F)SC1=S 1858592707 VBKZOPISJXSHJH-QEXLZLQKSA-N 341.385 1.861 10 10 EDCE CN1C(=O)COc2cc(NC(=O)COc3ccc(N)cc3)ccc21 1860079393 ZXGWDYCVDPRRBM-UHFFFAOYSA-N 327.340 1.642 10 10 EDCE CCOC(=O)CCN(CC)C(=O)CCNCc1cc(C)ccc1O 1857864593 WIIQNLXCNGALPG-UHFFFAOYSA-N 336.432 1.982 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)cc1Br 2146148305 AKXYBGXTUOUCSC-HUUCEWRRSA-N 342.281 1.670 10 10 EDCE COC(C)(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC(N=[N+]=[N-])C1 1985094329 NHNICWYINVDBPQ-SNVBAGLBSA-N 327.385 1.826 10 10 EDCE CN(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)CCN=[N+]=[N-] 1985093940 HTQCUKMKRSCGJT-NSHDSACASA-N 328.417 1.600 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985093920 HHBQHKHYOKLNKF-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE CN1C[C@@H](C(=O)NCc2c(O)cc(O)cc2O)[C@H](C(F)(F)F)C1 2063152147 APFTWZMFORYOBW-NXEZZACHSA-N 334.294 1.160 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H](C)Cn3ccnc3C)c2n1 2064124055 RSDFZTJTFUTIGR-JTQLQIEISA-N 328.376 1.314 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@@H](O)[C@H]3C4)c(Br)cc2[C@@H]1O 2177183016 FTYCVHZLBYNCJY-GNNHTFIESA-N 339.189 1.394 10 10 EDCE O=C(O)CN1CCC[C@@H](NCc2cc(Br)ccc2O)C1 2169312920 KLGMGAPOTCOMTN-GFCCVEGCSA-N 343.221 1.793 10 10 EDCE COC[C@@H]1C=CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2182373225 VLOKENVYGGASQC-SDBXPKJASA-N 338.205 1.792 10 10 EDCE CN1CCO[C@@H]2CCN(c3ccc(CO)cc3Br)C[C@H]21 2185528214 GFXDMZKQGKYFMI-HUUCEWRRSA-N 341.249 1.851 10 10 EDCE Nc1ccc(CS(=O)(=O)Nc2cc(Br)ncn2)cc1 2105841267 UJJVFNGNLFZPCX-UHFFFAOYSA-N 343.206 1.763 10 10 EDCE CN(CCN=[N+]=[N-])S(=O)(=O)Cc1ncsc1Br 2213773172 VRWHKYFHJAJEHU-UHFFFAOYSA-N 340.228 1.978 10 10 EDCE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=CNN1CCCCC1 2296103260 YPCOAOMBILRSEA-UHFFFAOYSA-N 332.335 1.283 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3OCC[C@@]3(CO)C2)cc1Br 2296392924 RTIGDBDSPKBUNW-KBPBESRZSA-N 345.212 1.635 10 10 EDCE Cc1ccc(N(C)C(=O)C=Cc2cn(C)c(=O)n(C)c2=O)cc1Cl 2297562681 YTOTVUBUQQXPFU-UHFFFAOYSA-N 347.802 1.722 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCC[C@H]1CN1CCOCC1 2307987847 OQMZYTLUNBHIHV-HNNXBMFYSA-N 332.400 1.434 10 10 EDCE Cc1ccc(CN2C[C@@H](O)[C@H](O)C2(C)C)c(O)c1Br 2352687140 OEHYUQHZNVEBLX-MFKMUULPSA-N 330.222 1.779 10 10 EDCE Cc1ccccc1N1C(=O)NC(=O)/C(=C\N[C@@H]2NC=CS2)C1=O 100103995 VJSRECGPQIYZJG-PLWJUESGSA-N 330.369 1.143 10 10 EDCE CCN1CCC[C@H]1CN(C)CC(=O)NCc1ccc(N(C)C)cc1 177709477 WNFUHNGCGZVSFY-SFHVURJKSA-N 332.492 1.785 10 10 EDCE Cc1ccc(C(=O)N[C@@H](C)c2nnnn2-c2ccccc2)c(O)c1O 177686294 MCSLFEDMDKGOPP-NSHDSACASA-N 339.355 1.873 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1507083449 SGVNOOPGUXKVNU-GOEBONIOSA-N 347.459 1.418 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CN2CCN(CC3CCOCC3)CC2)c1 172424282 PRHPAFMKBHHCRH-UHFFFAOYSA-N 335.404 1.845 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCO[C@@H](c3nc(C)n[nH]3)C2)c1O 175743009 KUOFGHFZVPMVRM-CQSZACIVSA-N 334.351 1.734 10 10 EDCE CN(Cc1ccccc1O)C(=O)/C=C\c1ccc(OCC(N)=O)cc1 255842761 HWKKOIDUPVINMH-FLIBITNWSA-N 340.379 1.928 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccoc1COc1ccc(C=O)cc1 808516180 DANNQMPDYZECHB-UHFFFAOYSA-N 330.292 1.986 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1nccc(C)n1 819698574 NQBSMUOWXNXPRO-UHFFFAOYSA-N 329.356 1.696 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@H](O)CC23CCC3)cc1 817291253 NBGZXDUNDMZABD-QGZVFWFLSA-N 331.460 1.748 10 10 EDCE Cc1c(C[C@@H](CN)CN2CCOc3cc(N(C)C)ccc32)cnn1C 903905367 DBFJXQKCRQRVEB-HNNXBMFYSA-N 343.475 1.811 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CNCC[C@H]1C 842266633 WIJPHUDQVKHSIP-UKRRQHHQSA-N 333.432 1.245 10 10 EDCE CC[C@@H](NC(=O)C(=O)NCCc1ccc(N)cc1)[C@H]1CCCCO1 848613517 JULRZIUFSQMXTL-HZPDHXFCSA-N 333.432 1.391 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CCNC(=O)CC2)cc1 846444974 IHZBTKMFBFWPET-CQSZACIVSA-N 333.432 1.506 10 10 EDCE C[C@H](NC(=O)N1C[C@@H](C)N(CCO)C[C@@H]1C)c1ccc(N(C)C)cc1 842181867 CIRKVGMUGMIJRP-PMPSAXMXSA-N 348.491 1.910 10 10 EDCE COc1cc(Cl)cc(CN2CN(CCN(C)C)C(=O)[C@@H]2C)c1O 843428737 MSEUHZJWVMYTOW-NSHDSACASA-N 341.839 1.606 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)[C@@H]3CCO[C@@H]3C)C2)cc1 849416332 PCYUKCQBRHLXQJ-DVOMOZLQSA-N 340.445 1.371 10 10 EDCE C[C@H](NC[C@H](O)CC1(O)CCC1)c1ccc(N2CCOCC2)cc1 859230354 VEAFOFDRBKJDHP-MAUKXSAKSA-N 334.460 1.840 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3nc[nH]c4nccc3-4)C2)cc1 855225691 PSVRKTHLRHJWPZ-LBPRGKRZSA-N 337.383 1.927 10 10 EDCE CS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C/c1cnccn1)CCC2 751197933 SYWYCUXLBLOIOW-FNORWQNLSA-N 343.408 1.873 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCn4cncc4C3)C2)cc1 855224638 GRTZOCFWXKNBMD-CABCVRRESA-N 340.427 1.849 10 10 EDCE CC1CCN(c2ccc(CNC(=O)C3CS(=O)(=O)C3)cc2)CC1 865603219 CRKCEKOOXWRFNT-UHFFFAOYSA-N 336.457 1.584 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CC[C@@H](C)NC3)C2)cc1 861690785 TTZKMUAFJFECNA-KFWWJZLASA-N 332.448 1.714 10 10 EDCE CCOCCOCC(=O)NCc1cccc(Br)c1O 765732686 RJXXSMJXBFGKRM-UHFFFAOYSA-N 332.194 1.824 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CC(C)=NO3)C2)cc1 875954362 HHQAGZDZHUSCAG-BBRMVZONSA-N 332.404 1.738 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1Cc2cccc(O)c2C1 871207239 LCAWHQHTDIDFAJ-LBPRGKRZSA-N 336.388 1.510 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)N(C)C)cc1 891242407 GBANEDCPQRDXGK-SGYMCOKNSA-N 343.471 1.895 10 10 EDCE COc1cccc(O)c1CNC[C@@H]1CCCCN1S(C)(=O)=O 796514026 UFPJWSQEYYXCLM-LBPRGKRZSA-N 328.434 1.305 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCCC[C@@H]1N1CCOCC1 1149533145 FRXNSNZQWCXVQO-CABCVRRESA-N 334.416 1.400 10 10 EDCE CNC(=O)N[C@H]1CCCN(c2ccc(CN)c(Br)c2)C1 702151869 HADILWURXJWADM-NSHDSACASA-N 341.253 1.806 10 10 EDCE COc1ccc2c(c1)CN(C(=O)C(=O)N1Cc3cccc(O)c3C1)C2 1330502311 KURJLQAPDJCASL-UHFFFAOYSA-N 338.363 1.785 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2CCN(C)C2)cc1C 1267157281 LEGMIMJQDLKXLJ-RDJZCZTQSA-N 333.476 1.940 10 10 EDCE COC1CCN(CCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1445080909 OUJYHLGDJRSCJK-UHFFFAOYSA-N 333.392 1.690 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)NCc1c(O)cccc1F 1456026640 BQKXVYSETCJETK-SNVBAGLBSA-N 342.367 1.423 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@@H]1CCN(Cc2ccccc2)C1=O 1528779430 CRFQALISNFQXTH-HNNXBMFYSA-N 340.379 1.763 10 10 EDCE Cc1ccc(S(=O)(=O)NCC(=O)N[C@@H](C)c2ccccc2O)cc1 1471196052 RYFPJXHXUYIYJX-ZDUSSCGKSA-N 348.424 1.856 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)Cc2cncn2C)cc1C 1700423429 AHHPSQYVVMSDRZ-GJZGRUSLSA-N 344.459 1.963 10 10 EDCE Cc1ncccc1NC(=O)[C@H](C)NC(=O)c1c(F)ccc(O)c1O 1611429325 JKCREMITTYCFQR-VIFPVBQESA-N 333.319 1.697 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H]2CN2CCOCC2)cc1 1545036375 YTWSFEFRKBTEDS-OAHLLOKOSA-N 345.403 1.786 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1CCN(C)C1)NCc1ccc(OC)c(C)c1 1715078890 FGPIGBBWITXVNP-IRXDYDNUSA-N 333.476 1.940 10 10 EDCE CCNC(=O)CN[C@@H](C)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1717440258 BFKVPMAXMFOJHJ-WDEREUQCSA-N 348.407 1.082 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cnnc(O)c2)cc1C 1716400347 WLPHKBWRSHVZPR-GFCCVEGCSA-N 330.388 1.407 10 10 EDCE C[C@H](Sc1ccccc1C(=O)NCc1c(O)cccc1O)C(N)=O 1645363447 VNWOLMMWQSKBIA-JTQLQIEISA-N 346.408 1.994 10 10 EDCE CC[C@H](CNC(=O)CN1CCCC1=O)NCc1ccc(OC)c(C)c1 1665755152 WJSHTTRKCWIQCR-MRXNPFEDSA-N 347.459 1.610 10 10 EDCE COC[C@H](C)NC[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1698863725 IACWCAUHVBXHPF-NWDGAFQWSA-N 335.408 1.934 10 10 EDCE COc1ccc(/C=C2\SC(=S)N(NC(C)=O)C2=O)cc1OC 1300991 ZIKCWUWPFNYIAG-GHXNOFRVSA-N 338.410 1.956 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1CCN[C@H]2COC[C@H]21 2132578371 DIHPVDVHHFKFHU-NWDGAFQWSA-N 347.640 1.981 10 10 EDCE O=C(O)[C@H]1CCCN(C(=O)CNCc2cc(Cl)ccc2O)C1 1857868416 IHMIQFZKEMPZOR-JTQLQIEISA-N 326.780 1.458 10 10 EDCE COC(=O)c1ccccc1NC(=O)c1nnn(-c2ccc(N)cc2)n1 1857878752 LCWWFHVPJNEZHG-UHFFFAOYSA-N 338.327 1.283 10 10 EDCE CCOc1cccc(CNCCC(=O)N(C)C2CCN(C)CC2)c1O 1857863679 AGJPAAIFQWLNHL-UHFFFAOYSA-N 349.475 1.823 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N3CC[C@@H](O)C3)c(Br)cc21 221246803 HCDNFLRAFFIRMN-OQPBUACISA-N 340.221 1.623 10 10 EDCE COc1ccc(N(C)C[C@@](O)(CN)C2(Br)CC2)cc1 2141686045 ZFELSTQMGUTVSC-AWEZNQCLSA-N 329.238 1.749 10 10 EDCE CNCc1ccc(N2CC(OCCCO)C2)c(Br)c1 2141976956 BMGNQSSSJSFCKG-UHFFFAOYSA-N 329.238 1.756 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1C[C@@H](O)CO1 1952208707 MHFSEPFCMWXTCF-JMSVASOKSA-N 339.388 1.683 10 10 EDCE C[C@H](CNS(=O)(=O)Cc1ccc(N)cc1)NC(=O)OC(C)(C)C 1977694277 FGVGNPMXABGFHU-LLVKDONJSA-N 343.449 1.601 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(C(=O)N2CC(N=[N+]=[N-])C2)C1 1985104576 JRKZACHLDMCLJI-AWEZNQCLSA-N 325.369 1.127 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCO1 1985102721 KXXDBBOHTLIAAU-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CC[C@]1(O)CCN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2150760197 LCZQZHRGISRNSM-OCCSQVGLSA-N 341.205 1.786 10 10 EDCE O=C(N1CCCC[C@H]1CNCc1ccc(O)c(O)c1O)C(F)(F)F 401271005 UZAGRJPEUCABAD-JTQLQIEISA-N 348.321 1.836 10 10 EDCE C[C@@H]1C[C@H]2CN(c3ccc(CO)cc3Br)CCN2C1=O 2181181928 KFQDTLCTIVKBBT-PWSUYJOCSA-N 339.233 1.998 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCC=C[C@H]3CO)c(Br)cc21 2182332302 ODTPDROURCNVTG-SDBXPKJASA-N 338.205 1.528 10 10 EDCE NCc1ccc(N2C[C@@H]3CS(=O)(=O)C[C@H]3C2)c(Br)c1 2087857764 CPBIMBDSWRUNBP-GHMZBOCLSA-N 345.262 1.389 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@H](O)CC2)c(Br)c1 2269120360 CNERMTRAVIINOH-QCZZGDTMSA-N 329.238 1.791 10 10 EDCE C[C@@H]1CN(CCNCc2cc(Br)cc(F)c2O)C(=O)N1 2239293787 JUXGUINHUFDQBR-MRVPVSSYSA-N 346.200 1.797 10 10 EDCE COC[C@H]1CNCCN1Cc1ccc(C)c(Br)c1O 2352683328 GVNZZMISVHBAJC-GFCCVEGCSA-N 329.238 1.883 10 10 EDCE Cc1ccc(O)c(CN2CCN(C[C@H]3CN(C(C)C)CCO3)CC2)c1 121063614 ZABHDVQAGYQOSA-IBGZPJMESA-N 347.503 1.927 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CNC[C@@H]3O)c2C)cc1 262258666 MBRKKPWEWQMRJK-KDOFPFPSSA-N 343.427 1.413 10 10 EDCE CNC(=O)c1ccc(NCc2ccc(N3CCOCC3)cc2)nn1 266061415 YXWXHIYYVGPTNX-UHFFFAOYSA-N 327.388 1.285 10 10 EDCE Cc1cc(Cl)cc(CN(C)C[C@H](O)CN2CCOCC2)c1O 271747945 BGMFYKUXSNZFHR-HNNXBMFYSA-N 328.840 1.479 10 10 EDCE CSc1ncc(CN[C@]2(C(=O)O)CSC3(CNC3)C2)s1 2376929546 QBRHYJBMIZXTDQ-LBPRGKRZSA-N 331.488 1.257 10 10 EDCE Cc1ccc(CNC(=O)c2ncoc2CN)c(O)c1Br 2380739262 IFPLBCNSRVOYSZ-UHFFFAOYSA-N 340.177 1.840 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@H]1CCCN(C)C1)c1ccc(N(C)C)cc1 807678318 WFGRJAQVSHTPRE-ZFWWWQNUSA-N 332.448 1.140 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCC[C@@H]3C[C@@H]23)cc1 826706396 JKGJANRJKLLATG-HLLBOEOZSA-N 329.444 1.921 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)NCCCc1ncn(C)n1 827370016 XTEYVFMUQHBBCC-UHFFFAOYSA-N 330.436 1.655 10 10 EDCE COCCN(CCN(C)C)C(=O)c1cc2cc(O)c(O)cc2s1 900586242 AHJPIVQRUBIZIR-UHFFFAOYSA-N 338.429 1.963 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CC[C@H]2C[C@@H]2C1 834770359 HOHKVULFUHJTRA-NUEKZKHPSA-N 329.444 1.982 10 10 EDCE CN1C(=O)NC2(CCN(C/C=C/c3ccc(N(C)C)cc3)CC2)C1=O 835052465 CNBFNPPFONWZFH-SNAWJCMRSA-N 342.443 1.782 10 10 EDCE COCC1(CNC(=O)C(=O)NCCCSc2nccs2)CC1 848935086 JCPSYRPSZXCRLD-UHFFFAOYSA-N 343.474 1.284 10 10 EDCE CN1CCN(c2ccc(CNC3[C@H]4CC[C@H]3CN(C)C4)cc2)CC1 926855461 URFTWUCKRZEGAC-ROUUACIJSA-N 328.504 1.868 10 10 EDCE COCc1nc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)no1 853817229 AMBBBTFVAUSPBN-NSHDSACASA-N 332.360 1.233 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H]4C[C@]4(CO)C3)C2)cc1 854299580 PSCOLYSUQMCSNV-QWQRMKEZSA-N 331.416 1.298 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@H](O)C3(C)C)C2)cc1 852447727 DHJDKMLQXCAQTR-CJNGLKHVSA-N 333.432 1.829 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC(=O)[C@@H](C)C3)C2)cc1 923187446 YHHWQMQFMCLVIR-KBPBESRZSA-N 331.416 1.894 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cn(C4CC4)nn3)CC2)cc1 858128132 BWLGUOSHXOQWHV-UHFFFAOYSA-N 327.388 1.584 10 10 EDCE C[C@H]1CN(c2ccc(CNC(=O)CC3(N)CC3)cc2F)C[C@@H](C)O1 852860805 VHDOWRMQBMHLCR-BETUJISGSA-N 335.423 1.937 10 10 EDCE CCOc1ccc(CNC2CCN(C(=O)CCCNC)CC2)c(O)c1 853247221 HTYSXQWOQMBIJU-UHFFFAOYSA-N 349.475 1.871 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3C(=O)NCC[C@@H]3C)C2)cc1 852308596 JQBFVACXBZFRBL-HEHGZKQESA-N 346.431 1.098 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCCC4(C3)OCCO4)cc2N1 760250274 XKRZJXPXABMXOF-UHFFFAOYSA-N 335.316 1.269 10 10 EDCE CC(=O)N1CCN(Cc2ccc(N3CCOCC3)c(F)c2)[C@@H](C)C1 769448497 SQKCVQHAYDHAHM-AWEZNQCLSA-N 335.423 1.715 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H](O)[C@@H](C)O)ccc21 871131542 XWIXYMFTGAUFRN-DYVFJYSZSA-N 334.416 1.376 10 10 EDCE Oc1ccc(Br)cc1CN1CCn2c(O)nnc2C1 776520577 OOOXCIQTLQKEBH-UHFFFAOYSA-N 325.166 1.468 10 10 EDCE COC(=O)c1c(CNC[C@H]2COCCO2)c2cc(F)ccc2n1C 894197544 VNCLWRSNMVCTBT-LBPRGKRZSA-N 336.363 1.609 10 10 EDCE CCCC(=O)N[C@H]1CCN(Cc2nnnn2-c2ccc(OC)cc2)C1 1318231799 QWHYHZUJXGDNCG-ZDUSSCGKSA-N 344.419 1.162 10 10 EDCE [N-]=[N+]=N[C@@H]1CCCN(C(=O)Cn2cc(Br)ccc2=O)C1 701275177 JYPOAHUBLXNANR-SNVBAGLBSA-N 340.181 1.912 10 10 EDCE CS(=O)(=O)Cc1ccc(C(=O)NCc2cc(O)ccc2O)cc1 1176747873 DJWSIBUPIGVBRU-UHFFFAOYSA-N 335.381 1.572 10 10 EDCE Cn1cnc(CCNCc2cc(Br)cc(F)c2O)n1 715776650 BQAFNBQJGGDBJY-UHFFFAOYSA-N 329.173 1.755 10 10 EDCE C[C@H](N)c1ccc(N2CCN(C)[C@H](CO)C2)cc1Br 687619183 ALPYUSLICUEPFE-JQWIXIFHSA-N 328.254 1.582 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)[C@@H]2C[C@H]2C)cc(OC)n1 1337355835 AYBCTHXWZVSCHG-NQBHXWOUSA-N 335.404 1.332 10 10 EDCE COc1cc(C(=O)N[C@H](C)C[C@@H](C)NC(=O)C(F)F)cc(OC)n1 1288499897 AOYNPZCPWOAWQU-RKDXNWHRSA-N 345.346 1.377 10 10 EDCE NC(=O)[C@@H]1CC[C@H](CCC(=O)NCc2c(O)ccc3c2CCCC3)O1 1465955617 ZQKJNTJYGHAVRM-DYVFJYSZSA-N 346.427 1.700 10 10 EDCE COC(=O)c1cc(CNC(=O)Cc2ccc(O)c(O)c2)ccc1OC 1540602303 KZAFQHNCCLWMLN-UHFFFAOYSA-N 345.351 1.752 10 10 EDCE COC[C@H](C)NCC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1497329029 LNZXLBZSHPGKSA-NEPJUHHUSA-N 335.408 1.982 10 10 EDCE C[C@H](NC(=O)CCn1nnc2ccccc2c1=O)c1ccccc1O 1635798819 CRZUPSXCSXJYHM-LBPRGKRZSA-N 338.367 1.765 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCc2cncn2C)cc1C 1497975342 ORVGYAPEEQBLNK-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE COc1ccc(CNC2(CNC(=O)CN3CCOCC3)CC2)cc1C 1733242609 FISBXDNOQODIHC-UHFFFAOYSA-N 347.459 1.074 10 10 EDCE COC[C@@]1(C(=O)NCCN=[N+]=[N-])CCN(C(=O)OC(C)(C)C)C1 1963818432 VVCNELQEXRQUOL-CQSZACIVSA-N 327.385 1.687 10 10 EDCE O=S1(=O)CCCN1CCNCc1cc(Br)ccc1O 105473404 SULJESNSJDFCHH-UHFFFAOYSA-N 349.250 1.280 10 10 EDCE C[C@H](CNC(=O)C1(C)CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1689420195 XZMKUPLCCQDOIC-SNVBAGLBSA-N 331.376 1.884 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)C3CC(O)C3)c(Br)cc21 1914590473 MRLLORVMIMBFIF-KTRLOWJHSA-N 340.221 1.621 10 10 EDCE CN(C)[C@@H]1COC[C@@H]1CNCc1cc(Br)ccc1O 1924687188 MPPVHZICYVFINS-WCQYABFASA-N 329.238 1.821 10 10 EDCE CNCc1ccc(N2CC[C@H](O)[C@@](C)(O)C2)cc1Br 2136833220 NPOBMMYGZMMQJY-KBPBESRZSA-N 329.238 1.491 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985099031 FYKQOGQVIFMGPT-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CN(C)c1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)cc1 1997764575 BNURZHZIIFXQCS-CVEARBPZSA-N 335.448 1.822 10 10 EDCE CN(Cc1ccc(Br)cc1O)[C@]1(C(=O)O)CCOC1 691423395 MUGFGCSSROQJTC-CYBMUJFWSA-N 330.178 1.830 10 10 EDCE O=C(NCc1c(O)cc(O)cc1O)[C@@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2 2062056691 PYNYXHXAXWPFGD-FVCCEPFGSA-N 347.289 1.776 10 10 EDCE C[C@H](N)c1ccc(N2CCN3CCOC[C@H]3C2)cc1Br 2185896581 OJVMWDKMSKJYOZ-WCQYABFASA-N 340.265 1.990 10 10 EDCE O=C1C[C@H]2CCN(c3ccc(CO)cc3Br)C[C@H]2N1 2088803225 GCFWYDYLJRJAQV-ZYHUDNBSSA-N 325.206 1.656 10 10 EDCE CNC[C@@]1(O)CCCN(Cc2ccc(Br)cc2O)C1 2270829752 LEXGOYKUYPNTJU-AWEZNQCLSA-N 329.238 1.701 10 10 EDCE CSc1ncc(CNC(=O)N[C@@H](C(=O)O)C(F)(F)F)s1 2284505781 YYDPMMCDFXULAU-YFKPBYRVSA-N 329.325 1.680 10 10 EDCE CNC[C@@H]1CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2301693416 GRHFZDICNGSIJG-KRWDZBQOSA-N 329.444 1.604 10 10 EDCE CS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C\c1cnccn1)CCO2 492116554 VPYUFQXNJVIINB-DJWKRKHSSA-N 345.380 1.319 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)c(Br)c1 2336349907 NNANWOXQXLYXCX-IYYTYJHQSA-N 345.262 1.702 10 10 EDCE COc1ccc(N(CC(=O)N2CCCC2)CC(=O)N2CCCC2)cc1 73787275 PMPFFWINHDLNBL-UHFFFAOYSA-N 345.443 1.746 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)NC(=O)c1ccco1 183415829 PSJAMKQUJDQOFJ-GHMZBOCLSA-N 332.356 1.557 10 10 EDCE O=C(O)CCC(=O)Nc1cc2c(cc1O)C(=O)c1ccccc1C2=O 39899567 BRJBGRDLGBYMHN-UHFFFAOYSA-N 339.303 1.971 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC1(CO)Cc2ccccc2C1 372430283 ZIOZYTRXOOLVQU-SOFGYWHQSA-N 325.364 1.757 10 10 EDCE Cc1ccc(CNC(=O)c2cn(C)c(O)n2)c(O)c1Br 2380748089 ZCWYQXLLMBXWGA-UHFFFAOYSA-N 340.177 1.832 10 10 EDCE CC(=O)C(=O)COC(=O)C1(c2ccc3c(c2)OCCO3)CCCC1 808498464 SUCOTGQVGDBOCT-UHFFFAOYSA-N 332.352 1.971 10 10 EDCE CC(=O)C(=O)COC(=O)CCCc1nc(-c2ccc(F)cc2)no1 808503686 KONOJVIYEBCYES-UHFFFAOYSA-N 334.303 1.900 10 10 EDCE CCN1CC[C@@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)C1=O 801753191 PEVUMQDPYYJZNJ-MRXNPFEDSA-N 328.416 1.483 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CC34CC4)nc12 817234719 CACRYXFTJFVLAH-LLVKDONJSA-N 331.328 1.455 10 10 EDCE COC(=O)c1coc(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)c1 832285453 QPPHYEWZUQRTSR-CQSZACIVSA-N 331.372 1.562 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)c3cc(O)cs3)cn2)CC1 731871751 MFMOOXFTQDURAN-UHFFFAOYSA-N 346.456 1.921 10 10 EDCE COc1cccc(CNC(=O)NCC2(CF)CCOCC2)c1O 838667514 JRCFQLQQQKOENJ-UHFFFAOYSA-N 326.368 1.966 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CC(S(N)(=O)=O)C2)cc1 910513881 USNZYZXHLCNVAE-UHFFFAOYSA-N 333.413 1.207 10 10 EDCE CO[C@@H](CS(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1)C1CC1 842575570 LNRNDDMHNRXFOU-ZDUSSCGKSA-N 348.446 1.225 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1C[C@@H](N(C)C)C1 848633368 KUJFYPFSIJLRAZ-FZNQNYSPSA-N 347.459 1.587 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)N3CCC[C@@H]3C)C2)cc1 849416064 KBYJTZWAHVJNSA-UONOGXRCSA-N 339.461 1.593 10 10 EDCE C[C@@H]1C[C@@H](NCC[C@H]2CNCCS2(=O)=O)c2c(O)ccc(F)c21 925791765 GSZLYMYTCNRGFC-NTZNESFSSA-N 342.436 1.446 10 10 EDCE C[C@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@H](CC2OCCO2)C1=O 924714984 DTOROHWSBWPSTQ-BXUZGUMPSA-N 333.388 1.497 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H]([C@H](C)O)C3)C2)cc1 854298558 FSQYGRKYYAKCAY-KKUMJFAQSA-N 333.432 1.686 10 10 EDCE CN(C1CC1)S(=O)(=O)NCc1ccc(N2CCC(O)CC2)cc1 851843597 GOZMJKPYMOJWLL-UHFFFAOYSA-N 339.461 1.076 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3CCCS3(=O)=O)CC2)cc1F 929820472 FQNBHQGIZKEPHM-AWEZNQCLSA-N 342.436 1.534 10 10 EDCE C[C@@H](NC(=O)c1cn(C[C@@H]2CCOC2)nn1)c1ccc(N(C)C)cc1 860951037 XAYOXZRCQJPPOL-KGLIPLIRSA-N 343.431 1.872 10 10 EDCE COC(=O)/C=C/c1ccc(N(CC(N)=O)CC(C)C)c([N+](=O)[O-])c1 771234312 IMHBJPVANZXRDG-FNORWQNLSA-N 335.360 1.729 10 10 EDCE CNC(=O)C1(NCc2cccc(Br)c2O)CCOCC1 895885360 VUUIEIIPJDPAKU-UHFFFAOYSA-N 343.221 1.540 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)C2CN(C3CCOCC3)C2)c1 896162692 GOIRFYGNCJPKDO-GFCCVEGCSA-N 334.416 1.689 10 10 EDCE O=C1Nc2cc(N3[C@@H]4COC[C@H]3C4)c(Br)cc2[C@H]1O 1899633966 AWJRMWQJOPNSAR-KEHGIVTQSA-N 325.162 1.412 10 10 EDCE CN(C)C[C@@]1(O)CCN(c2ccc(CN)c(Br)c2)C1 713652501 AFRCXNUFIKMPHI-AWEZNQCLSA-N 328.254 1.411 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@H]3CCNC(=O)CC3)CC2)cc1 1330396685 COFGYOIBGPQSKI-OAHLLOKOSA-N 345.443 1.650 10 10 EDCE C[C@]12COC[C@@]1(C)CN(C(=O)C(=O)N1Cc3cccc(O)c3C1)C2 1348661442 GMXUWZJAKRQJMN-HDICACEKSA-N 330.384 1.119 10 10 EDCE COc1ccc(CNC(=O)Cn2ncc3cc(C)cnc32)c(O)c1 1448386142 VCKFOPBYALEMNE-UHFFFAOYSA-N 326.356 1.770 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2ccc(O)nn2)cc1C 1480422741 XARHSGIFVOEGFK-LBPRGKRZSA-N 330.388 1.407 10 10 EDCE O=C(C[C@@H]1Oc2ccccc2NC1=O)NCc1c(O)cccc1F 1558454980 JKXAWGKKNBDFGG-HNNXBMFYSA-N 330.315 1.937 10 10 EDCE Cn1c(=O)n(C)c2cc(NC(=O)Cc3ccc(O)c(O)c3)ccc21 1631297487 PEURFLTUFISQNE-UHFFFAOYSA-N 327.340 1.469 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H]2CCNC(=O)CC2)cc1C 1732965249 RWXHINDMMXLVQO-GDBMZVCRSA-N 347.459 1.514 10 10 EDCE CNC(=O)c1cccc(N(C)C(=O)c2c[nH]nc2-c2cnn(C)c2)c1 1645927330 STARMNMAGQGSOZ-UHFFFAOYSA-N 338.371 1.446 10 10 EDCE CN(C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1ccnnc1 1910967480 HWAHCSXZIGCELJ-QWHCGFSZSA-N 334.376 1.024 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(CCCO)CC3)cc2N1 400943020 TYNHSCBXACMJBR-UHFFFAOYSA-N 335.360 1.915 10 10 EDCE Cc1c(OCC(=O)c2ccc(O)c(O)c2)c(=O)ccn1CCCCN 1857917381 RHMFQRBDUXJNKD-UHFFFAOYSA-N 346.383 1.569 10 10 EDCE C[C@@H](CO)N(Cc1ccccc1)S(=O)(=O)Cc1ccc(N)cc1 1914357075 FNGCAZVKMCNTLK-AWEZNQCLSA-N 334.441 1.982 10 10 EDCE CN(C)CCN1CCN(c2ccc(CN)c(Br)c2)CC1 228151773 JPQMVGFAXNUXSG-UHFFFAOYSA-N 341.297 1.591 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2140661770 IQBHUJYZLWGZPE-GZFGJDTESA-N 333.201 1.349 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(=O)C(=O)O)Cc1ccc(O)c(O)c1 1951498130 QAGFMPLSEMSYHB-JTQLQIEISA-N 339.344 1.577 10 10 EDCE CC(C)(C)OC(=O)N1CCC(OCC(=O)NCCN=[N+]=[N-])CC1 1971515017 WUPFWIZYWPBCOD-UHFFFAOYSA-N 327.385 1.829 10 10 EDCE CO[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)C1CN(C(=O)OC(C)(C)C)C1 1985099684 ANUDLZPSLJBSRL-LLVKDONJSA-N 325.369 1.389 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985094077 JTCQZFSBGFEWCS-NSHDSACASA-N 327.385 1.375 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985100366 FYKQOGQVIFMGPT-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(N)cc2)[C@@H](CO)C1 2005085284 NYJFRLNJQDHQMN-GDBMZVCRSA-N 335.448 1.976 10 10 EDCE CC(C)(C)OC(=O)NCC=CCNC(=O)c1cc(O)c(O)c(O)c1 2015123509 SUFXALPYBXMPFI-UHFFFAOYSA-N 338.360 1.614 10 10 EDCE C[C@@H]1CN(C)C[C@@H](CNCc2cccc(Br)c2O)O1 697317543 SCIFRMXUTXSCGJ-ZYHUDNBSSA-N 329.238 1.963 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NCc2ccc(O)cc2O)C1 1908635427 XAELTXNDPAEZRN-ZIAGYGMSSA-N 338.404 1.558 10 10 EDCE C[P@]1(=O)C[C@@H](O)[C@H](NCc2cccc(Br)c2O)C1 2057720683 PIDWYIJCCLHINO-PJYBLOJUSA-N 334.150 1.980 10 10 EDCE N[C@H]1CN(Cc2cc(Br)ccc2O)[C@]2(CCOC2)C1 2098283996 BODVSWGUKRFROV-TZMCWYRMSA-N 327.222 1.847 10 10 EDCE COc1ccc(N2C[C@@H](O)[C@@H](CO)C2)c(OC)c1Br 2226549013 KIXNFWFBNJHJII-PSASIEDQSA-N 332.194 1.256 10 10 EDCE CSc1ncc(CNc2cnn(CCO)c(=O)c2Cl)s1 2284642204 XKUDFXMKYPLKJU-UHFFFAOYSA-N 332.838 1.680 10 10 EDCE CC(=O)NCCCNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297505802 NYAOWEFOTOSVSQ-UHFFFAOYSA-N 331.416 1.179 10 10 EDCE CN1C(=O)[C@H]2C[C@H]1CCN2c1ccc(CO)cc1Br 2335694877 MLKWVNAILJKQTR-ZWNOBZJWSA-N 325.206 1.751 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2355467549 XSTITNZOLDXURF-KAEXTRBYSA-N 342.233 1.622 10 10 EDCE COCCNC(=O)N1CCN(c2ccc(OC)c(Cl)c2)CC1 242929943 GYUOFNBOSMISMK-UHFFFAOYSA-N 327.812 1.827 10 10 EDCE CS(=O)(=O)NC[C@@H]1CCC[C@H]1NCc1cccc(Cl)c1O 800541573 NBNHSXYQARQHDW-GXFFZTMASA-N 332.853 1.853 10 10 EDCE COc1cc(O)c(CN(CCN(C)C)CCN(C)C)cc1OC 809740877 DVOUIJKNFOMAKY-UHFFFAOYSA-N 325.453 1.335 10 10 EDCE O=C(NCc1cc(Cl)cc(Cl)c1O)NC1COCCOC1 813818490 SJIWVBJXKPYFSU-UHFFFAOYSA-N 335.187 1.914 10 10 EDCE O=C1CC[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCN1 815860649 VIENHDAPQDXKMM-GOEBONIOSA-N 346.427 1.816 10 10 EDCE CNC(=O)N1CCN(c2ccc(CN)c(Br)c2)CC1 721787808 LYODFLPOHOYZGS-UHFFFAOYSA-N 327.226 1.369 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CO[C@H](CCC(=O)O)C1 901605309 QYUXRLGBNMPVQW-GDBMZVCRSA-N 334.416 1.981 10 10 EDCE Cc1cc(N(C)C)ccc1CN(C)CCN1CCCS1(=O)=O 840922924 PDKCHQJMWZIURZ-UHFFFAOYSA-N 325.478 1.528 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3nn(C)cc3[N+](=O)[O-])C2)cc1 855233836 NRWUHKTWQGSDFA-LLVKDONJSA-N 345.359 1.346 10 10 EDCE C[C@H]1CC[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)CS1(=O)=O 853245455 ZQIGCBWNQFIASX-GXTWGEPZSA-N 339.461 1.518 10 10 EDCE COc1cccc(CNC(=O)c2cncc(N3CCCC3=O)c2)c1O 860240171 BVBPPTVXTWFQQO-UHFFFAOYSA-N 341.367 1.853 10 10 EDCE O=C(C[C@H]1CCS(=O)(=O)C1)NCc1ccc2cccnc2c1O 862028826 LMNTVQMFKDUPQO-LLVKDONJSA-N 334.397 1.381 10 10 EDCE CCOC(=O)CN(CCOC1CCOCC1)Cc1ccccc1O 1118882725 KHIJSHQMWVUAIM-UHFFFAOYSA-N 337.416 1.953 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@@H](C(F)F)CC2)cc1 872269827 QAZFKRDYCWZRFX-OAHLLOKOSA-N 341.402 1.725 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[C@H]1CCCO1 786595291 CHOQFBYTDJRIMD-QGZVFWFLSA-N 347.459 1.786 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N3C[C@@H]4[C@@H](C3)C4(F)F)ccc21 1332774757 BSDHEZVRTMBTEO-ZIAGYGMSSA-N 349.381 1.409 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cn(CCOC)nc1C 1140198662 NFPPFULLUOYWFS-UHFFFAOYSA-N 338.404 1.959 10 10 EDCE Cc1cc(CC(=O)NN2CC(=O)NC2=O)c(C)n1-c1ccccc1 1182303659 ZTMVCVXELHJZPU-UHFFFAOYSA-N 326.356 1.220 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)CCCC(N)=O)C2)cc1C 1267026198 AQGQNRSPPPEWER-HNNXBMFYSA-N 333.432 1.350 10 10 EDCE Cc1cn2nc(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)cc2c(=O)[nH]1 1263777724 VCLGNKFUUBWUEM-LBPRGKRZSA-N 339.399 1.888 10 10 EDCE O=C1COc2cccc(C(=O)NCCc3ccc(O)c(O)c3)c2N1 1294913172 MZXAUGVJLAOPEW-UHFFFAOYSA-N 328.324 1.401 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ocnc1CC 1466674214 MLPQQPNZJXDDOJ-LBPRGKRZSA-N 348.355 1.552 10 10 EDCE CCN1CC[C@H]1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 1464537788 FUVLCFQPTGACKG-SFHVURJKSA-N 346.475 1.028 10 10 EDCE CN(C)C(=O)/C=C\C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1465394901 GDKDAGQJDPNZKK-FPLPWBNLSA-N 345.443 1.156 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2cc[nH]c2C)cc1C 1700788667 YMJQABUTQRAQAA-OAHLLOKOSA-N 331.416 1.521 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3COC(=O)N3)CCC2)cc1C 1484633058 YGFMPRMAPWDCIS-AWEZNQCLSA-N 347.415 1.241 10 10 EDCE COC[C@](C)(NC(=O)c1cc2cc(O)c(O)cc2s1)C(=O)OC 1622865357 LLHBMRQFQLZRSJ-HNNXBMFYSA-N 339.369 1.620 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cccnc1O 1557115815 WSJFPGOYZXTGCA-UHFFFAOYSA-N 330.340 1.698 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CCc2cncn2C)cc1C 1716003831 ORVGYAPEEQBLNK-HNNXBMFYSA-N 344.459 1.964 10 10 EDCE COCCN[C@H](C)[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1724565390 XADAVGXAFUGQGT-OCCSQVGLSA-N 347.419 1.936 10 10 EDCE COc1ccc(CNC2(CNC(=O)CN3CCCC3=O)CC2)cc1C 1569389526 KAWPKQUEXLZKLY-UHFFFAOYSA-N 345.443 1.364 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H]2CCN(C)[C@@H]2C)cc1C 1663941321 JXJCEYUDYHLZIZ-NVXWUHKLSA-N 333.476 1.892 10 10 EDCE COC(=O)[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc(O)c(O)c1 1597475512 VRXFTBBVRADETC-OAHLLOKOSA-N 341.363 1.767 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C2(CF)CCC2)cc1C 1699067773 YXVGYMFNSHZLCH-HNNXBMFYSA-N 338.423 1.710 10 10 EDCE CCC(=O)N[C@@H](CNCc1nnnn1-c1ccc(OC)cc1)C1CC1 1699571529 SXTZUQLCSHWBIP-HNNXBMFYSA-N 344.419 1.065 10 10 EDCE Cc1cncc(/C=C/C(=O)N2CCc3ccc(S(N)(=O)=O)cc32)c1 151731201 PRIDEWYHMOJAGR-GORDUTHDSA-N 343.408 1.640 10 10 EDCE CCOc1cccc(CNCC(=O)N2CCC[C@@H](C(=O)O)C2)c1O 1857866939 LBKLKTPYXKWEPK-CYBMUJFWSA-N 336.388 1.204 10 10 EDCE Cc1cc(=O)c(OCC(=O)c2ccc(O)c(O)c2)cn1[C@@H](C)C(=O)O 1857914517 IFCLUPHLXTXLJM-JTQLQIEISA-N 347.323 1.475 10 10 EDCE CNCc1ccc(N2CCCN(CCO)CC2)cc1Br 234434352 JXZLOXQIOOTPSH-UHFFFAOYSA-N 342.281 1.673 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003172033 FHOCSBGHOHOSFY-PAKFGRKTSA-N 336.432 1.899 10 10 EDCE COc1cccc(O)c1CN[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 2011487466 MNEPYOZPMOZVOI-JSGCOSHPSA-N 338.404 1.471 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)CC(O)C1 2018045795 KLWVDIONZVQQMF-RWWNRMGGSA-N 339.396 1.563 10 10 EDCE CN(C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1cccnn1 2022930171 RDIGCHCVRJWBNY-VXGBXAGGSA-N 334.376 1.024 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@@H](CO)C2)c(Br)c1 396818452 XJUWDUQXOKNMMY-PXWWUCIGSA-N 329.238 1.648 10 10 EDCE N[C@H]1CC(C(=O)N2CCCc3cc(Br)ccc32)=C[C@@H]1O 2188028360 YSCROLZMRIGBTP-JSGCOSHPSA-N 337.217 1.747 10 10 EDCE CC[C@]1(NCc2cc(Br)ccc2O)CCC(=O)NC1=O 2182520244 LFBVBUBAZURAIA-AWEZNQCLSA-N 341.205 1.830 10 10 EDCE CN1CCc2cc([C@H](N)[C@@H](O)C3CN(C(=O)OC(C)(C)C)C3)ccc21 2044749858 IYFHMDKHFVHGCH-IRXDYDNUSA-N 347.459 1.907 10 10 EDCE Cc1cccc(CN=c2nc(CNC(=O)OC(C)(C)C)[nH]n2C)c1O 2063130131 HHYZDUCGRPLOQK-UHFFFAOYSA-N 347.419 1.888 10 10 EDCE CSc1ncc(C=C2C(=O)NC(=O)N(c3ccccc3)C2=O)cn1 2297346438 CTCKPTKPVBVSSW-UHFFFAOYSA-N 340.364 1.865 10 10 EDCE COC[C@]1(C(=O)NCCCN=[N+]=[N-])C=CCN1C(=O)OC(C)(C)C 2299700169 LZMGQXVQGTYXQJ-HNNXBMFYSA-N 339.396 1.995 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)c(Br)c1 2331967470 UVZSAKSSNQZJLM-IGJVIKARSA-N 328.206 1.404 10 10 EDCE Cc1ccc(CN2CCOC3(CNC3)C2)c(O)c1Br 2352562582 QSDHRHFQCQSTTJ-UHFFFAOYSA-N 327.222 1.637 10 10 EDCE Cc1ccc(CNC[C@]2(O)CCN(C)C2)c(O)c1Br 2352692727 MOWBSTHLZHOKEV-CQSZACIVSA-N 329.238 1.619 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2355461059 DJPSSSOQCIFMJE-OEHKJAOLSA-N 342.233 1.622 10 10 EDCE CC(=O)N1CCN(c2ccc(OC[C@@H]3COC(C)(C)O3)cc2)CC1 28568481 OBLRHKZTHGNXFI-QGZVFWFLSA-N 334.416 1.885 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H]3CCC(=O)N(C)C3)CC2)cc1 172393829 SUIFUBDKYRZGKU-CQSZACIVSA-N 346.431 1.148 10 10 EDCE C[C@H](C(=O)NC1CC1)N1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1 170907935 FNRXRNPUHQGVBN-GFCCVEGCSA-N 348.403 1.085 10 10 EDCE COc1ccnc(N2CCN(Cc3cc(C)cc(OC)c3O)CC2)n1 178864482 ZITXIXQDIOKXMY-UHFFFAOYSA-N 344.415 1.830 10 10 EDCE COc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(OC)c1Br 2358637172 SGSHODTWALLFBL-LYDNSBFWSA-N 344.205 1.397 10 10 EDCE Cc1cc(/C=C\C(=O)NCCOCC(N)=O)c(C)n1-c1ccccc1 254991137 CDDRGUYNWWACCL-HJWRWDBZSA-N 341.411 1.725 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3cn[nH]c3)nc12 274140466 XFKYCVZKYLIPMQ-SECBINFHSA-N 330.348 1.186 10 10 EDCE COC(=O)[C@@H]1COCCN1Cc1ccc(C)c(Br)c1O 2380672487 NCTNOQSRPOVDDY-NSHDSACASA-N 344.205 1.837 10 10 EDCE Cc1ccc(CN2CC(N3CCOCC3)C2)c(O)c1Br 2380791993 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1445970820 LRUMKIMXBKGDRS-UHFFFAOYSA-N 329.385 1.857 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCCC34OCCO4)CC2)cc1 1445740456 PCMREWUOBTVMAI-KRWDZBQOSA-N 346.427 1.887 10 10 EDCE COc1ccc(CN2CC[C@H]2C(=O)NCc2c(O)cccc2O)cc1 1472063580 NLHOADOQUGCMSO-INIZCTEOSA-N 342.395 1.997 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cncnc3)cc2)CC1 1537838499 BRZORTPSFIQBNE-UHFFFAOYSA-N 339.399 1.108 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CC(=O)N(CC(F)(F)F)C1 1637123165 ZBBVZQRRWNSXSD-VIFPVBQESA-N 332.278 1.125 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@]2(C)CCNC2=O)cc1C 1568918610 QSTIJFVIHLMAQQ-HMECNJMJSA-N 345.443 1.292 10 10 EDCE C[C@H]1CCN(CC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C1 1648478112 QJNJZGGFVCIPFK-YJBOKZPZSA-N 332.492 1.813 10 10 EDCE CC[C@@H](F)CN[C@@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1734386363 UTCJUINAZJNPGO-DGCLKSJQSA-N 339.371 1.277 10 10 EDCE Cc1oc(C(=O)NCc2c(O)cccc2O)cc1S(C)(=O)=O 1652628386 BDNUAZAULFDEPI-UHFFFAOYSA-N 325.342 1.333 10 10 EDCE COC1CCN(c2ccc(CN3CC[C@@H](c4nn[nH]n4)C3)cc2)CC1 1659944362 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CHBLALBFTSXXEC-OGXIQJDLSA-N 345.212 1.225 10 10 EDCE Nc1ccc(N2CC(O)(C3CCN(C(=O)C(F)(F)F)CC3)C2)cc1 2056827330 CIZTWJVXHRLWPX-UHFFFAOYSA-N 343.349 1.621 10 10 EDCE COC1(C(N)=O)CN(c2ccc([C@H](C)O)cc2Br)C1 2104898857 RLOFHJZZPIFKJM-QMMMGPOBSA-N 329.194 1.193 10 10 EDCE CN(Cc1nn(C)nc1Br)C(=O)c1cccc(O)c1O 2235252046 POSJCNCPRBMJCP-UHFFFAOYSA-N 341.165 1.261 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccccc2CO)s1 2284501036 VIBMZRJNBZYSRI-UHFFFAOYSA-N 330.456 1.836 10 10 EDCE COC[C@@H]1C[C@@H](CN)N(Cc2cc(Br)ccc2O)C1 2273809127 HMAGRWCNWVPHJT-MFKMUULPSA-N 329.238 1.950 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCCCOCCO 2308082138 QEHXFUPTDWCAOE-UHFFFAOYSA-N 334.416 1.052 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N(C)C)cc1)C(=O)N1CCCCC1 47274903 LUZDXOMFONZPHC-CQSZACIVSA-N 332.448 1.953 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3C)C2)c1 361899053 GBOWTQCWLOWENE-ZKYQVNSYSA-N 333.388 1.209 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@H](OC(F)F)C2)cc1 801988454 BCOISSQGESTBQD-AWEZNQCLSA-N 327.375 1.682 10 10 EDCE CN1C(=O)C(=Cc2ccc(-c3cnn(C)c3)s2)C(=O)N(C)C1=O 800790297 IEOJXURULSTKPK-UHFFFAOYSA-N 330.369 1.582 10 10 EDCE Cc1cc(C(=O)CN2C[C@@H](CO)[C@@H](O)C2)c(C)n1-c1ccc(F)cc1 839171904 LYZZIRPSOKCMPH-KSSFIOAISA-N 346.402 1.701 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@H](N3CCNCC3=O)C2)c1 843063504 BSZUFGFLXUCZIT-HNNXBMFYSA-N 333.432 1.187 10 10 EDCE CN1C[C@H](CCNC(=O)NCCCSc2nccs2)CC1=O 921446526 KZVFQQZWWDWKCE-LLVKDONJSA-N 342.490 1.793 10 10 EDCE COC(=O)[C@@H]1C[C@H]1[C@H](C)NCc1ccc(N2CCC(O)CC2)cc1 850406636 NWYGEGMWTPGZJB-DOPJRALCSA-N 332.444 1.935 10 10 EDCE COc1cc(N2CCN(c3cccnn3)CC2)cc(OC)c1OC 758941589 PHWIRHJDPJNHBB-UHFFFAOYSA-N 330.388 1.829 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CN(C(C)=O)CCO1 930906007 ZZVJDCXDAHLVQE-QGZVFWFLSA-N 333.432 1.348 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCC34CCOCC4)nc12 769903661 ODMCPDKJGUJAOK-UHFFFAOYSA-N 346.387 1.367 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)NCc2cc(OC)ccc2O)c1 769540758 POFXBEGQCASTIO-UTCJRWHESA-N 341.367 1.485 10 10 EDCE CC1(C)SC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1117070190 DJWCJXAWBLZGAE-OAHLLOKOSA-N 347.484 1.913 10 10 EDCE Cc1nc([C@H]2COCCN2C(=O)/C=C\c2ccc(O)c(O)c2)no1 779692434 HUMNUISJJDUNCW-KTLBGCOUSA-N 331.328 1.403 10 10 EDCE CN1CCN(c2ccc(CNC3(CCO)CCOCC3)cc2)CC1 771843299 NSSFZFZIYGQDRA-UHFFFAOYSA-N 333.476 1.460 10 10 EDCE O=C(N[C@H](CO)CN1CCCC1)c1cc2cc(O)c(O)cc2s1 897764752 OTCUMLMIKFUNKN-NSHDSACASA-N 336.413 1.499 10 10 EDCE Nc1ncnc2c1ncn2CCC(=O)NCc1cc(Cl)ccc1O 1165508471 PERNMQIZARJPDN-UHFFFAOYSA-N 346.778 1.474 10 10 EDCE COc1ncc(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)cn1 1317649189 DRHXEIFFGFOFCH-UHFFFAOYSA-N 344.415 1.664 10 10 EDCE CC[C@H](CNC(=O)c1cnnn1C)NCc1ccc(OC)c(C)c1 1318517157 BGUUDEVZVPLDHC-CQSZACIVSA-N 331.420 1.430 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H](C)C(C)(F)F)cc1C 1320271871 FQWQOCCBQJIREB-OCCSQVGLSA-N 344.402 1.862 10 10 EDCE C[C@H]1COCC[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1323983609 KJLSLSGPSOPMQE-XJKSGUPXSA-N 333.432 1.252 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H](C)C(C)(F)F)cc1C 1320271867 FQWQOCCBQJIREB-GXTWGEPZSA-N 344.402 1.862 10 10 EDCE CC1(C)SC[C@@H]1NC(=O)C(=O)NCCCSc1nccs1 1322815130 QQSUMBLMDFFFKE-VIFPVBQESA-N 345.515 1.752 10 10 EDCE O=C1Nc2cc(N3C[C@H](F)[C@@H](F)C3)c(Br)cc2[C@H]1O 714701565 ASXBZMDKAACEMM-DKCNOQQISA-N 333.132 1.931 10 10 EDCE CCCNCc1ccc(N2C[C@H](O)C[C@H]2CO)c(Br)c1 698194800 AVVFPZQAHOBIPO-QWHCGFSZSA-N 343.265 1.881 10 10 EDCE COC[C@H](C)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1269544355 CSOHCVTXKROWTE-NSHDSACASA-N 333.392 1.736 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)c2cn(C)c(O)n2)cc1C 1505687036 YEZLVNZNCQVOOQ-OLZOCXBDSA-N 346.431 1.739 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ncccc1F 1447347383 KNRRBDXVAIXGOP-LBPRGKRZSA-N 348.330 1.536 10 10 EDCE CCO[C@@H](C)C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1293163238 SXZZLZHEEGPRQF-NSHDSACASA-N 349.391 1.510 10 10 EDCE COc1ccc(CNC(=O)[C@@H]2COc3ccc(O)cc3O2)c(O)c1 1617754100 YHSQYASYSCQYLZ-INIZCTEOSA-N 331.324 1.563 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)Cc2nc[nH]n2)cc1C 1497299476 KXLDDDAOLXOKKQ-CYBMUJFWSA-N 331.420 1.349 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@]2(C)CCC(=O)N2)cc1C 1568674155 HATDUZIKZIVGQX-KUHUBIRLSA-N 347.459 1.657 10 10 EDCE CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NCc1ccc(O)cc1O 1570462159 GVLQNJUXTZCGOX-AWEZNQCLSA-N 337.420 1.836 10 10 EDCE O=C1NC(=S)S/C1=C\c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O 13475927 PWNISSIOUAVKSG-UQCOIBPSSA-N 327.299 1.697 10 10 EDCE COC(=O)C[C@H](N)C(=O)Nc1ccc(Cc2ccc(N)cc2)cc1 1865967677 FEFYNJXSIXSPPH-INIZCTEOSA-N 327.384 1.689 10 10 EDCE C[C@@]1(O)CN(c2cc(Br)c(CN)cc2F)CC[C@@H]1O 2136847613 NRNPHVLSTGZIKN-QWHCGFSZSA-N 333.201 1.369 10 10 EDCE O=S1(=O)CC2(CC(NCc3ccc(Br)cc3O)C2)C1 1967803849 YEPMWFRVMFHTRC-UHFFFAOYSA-N 346.246 1.822 10 10 EDCE CNCc1ccc(N2CCOC[C@@H]2C(=O)NC)cc1Br 234451380 NCNPROFAQUNRCP-CYBMUJFWSA-N 342.237 1.120 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1OCC[C@@H]1NC(=O)OC(C)(C)C 1985095867 KCGGINABBAAJLT-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC(N=[N+]=[N-])CC1 1990023461 YHZIWFYWXMHQAH-LLVKDONJSA-N 327.385 1.563 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010402784 WBAWYSUINSHBQC-UTUOFQBUSA-N 341.412 1.809 10 10 EDCE CC(C)(C)OC(=O)N1CC(n2cc([C@@H](N)c3ccccc3O)nn2)C1 2029560970 WUGVRIJGKZOHOX-HNNXBMFYSA-N 345.403 1.824 10 10 EDCE O=C1CC[C@H](NCc2cc(Br)cc(F)c2O)C(=O)N1 715792978 UDUVIBGRDVUTHK-VIFPVBQESA-N 331.141 1.189 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C(=O)NC(=O)[C@H]3C2)c(Br)c1 387450930 QQUVZTCLKZKVQV-HGNGGELXSA-N 338.205 1.178 10 10 EDCE CN(C(=O)OC(C)(C)C)C1CN(c2cc3c(cc2N)OCC(=O)N3)C1 2044727168 UPTDHPVXIBOPJW-UHFFFAOYSA-N 348.403 1.655 10 10 EDCE CCN(Cc1c(O)cccc1Br)[C@H]1CC(=O)NC1=O 2114733353 VZCMDSTXPFVGNU-JTQLQIEISA-N 327.178 1.392 10 10 EDCE CSc1ncc(CNC(=O)NCCC(F)(F)C(=O)O)s1 2284507132 KKTHKMQEFBLWMB-UHFFFAOYSA-N 325.362 1.774 10 10 EDCE CCCCOc1ccc(C=C2C(=O)NC(=O)N(C)C2=O)cc1OC 2313548737 DMWREDQIUGVVHJ-UHFFFAOYSA-N 332.356 1.966 10 10 EDCE COc1ccc(N2CCC(NC(=O)COC[C@H]3CCOC3)CC2)cc1 117646449 AFPKCKSLJJNFNM-HNNXBMFYSA-N 348.443 1.833 10 10 EDCE CC(=O)[C@@]1(O)CCc2c(cc3c(c2O)C(=O)c2ccccc2C3=O)C1 39382182 MGCYXYQPFUKLTA-HXUWFJFHSA-N 336.343 1.976 10 10 EDCE COCCNC(=O)Cn1cc(N[C@@H](C)c2ccc(N(C)C)cc2)cn1 180104896 WZMCJMHAVOKMKM-AWEZNQCLSA-N 345.447 1.885 10 10 EDCE COc1ccc(N2CN=c3sc(=Cc4ccco4)c(=O)n3C2)cc1 254624970 UERNNVQEZNZMIJ-UHFFFAOYSA-N 341.392 1.395 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)[C@H]1COC(C)(C)C1 625027938 SGIZKCFFPCXOTF-CYBMUJFWSA-N 340.445 1.849 10 10 EDCE O=C(NCc1cccc(N2CCOCC2)n1)c1c(F)ccc(O)c1O 295829471 VYXFIWPKAQBGOO-UHFFFAOYSA-N 347.346 1.399 10 10 EDCE OC[C@@]1([C@@H](NCc2ccc(N3CCOCC3)cc2)C2CC2)CCCO1 816667053 BBGATKICBQLSKS-VQTJNVASSA-N 346.471 1.933 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NC[C@H](O)C(C)C)C2)cc1 824694168 PHDUBSBDWJHQDR-PBHICJAKSA-N 335.448 1.838 10 10 EDCE Cc1cc(Br)cc(CN2CCN(C(N)=O)CC2)c1O 722181615 PBOCVWRUVBRHDB-UHFFFAOYSA-N 328.210 1.659 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1C[C@@H](C(N)=O)C1 845260527 BKNHPTOWXAKZGB-YUELXQCFSA-N 332.448 1.555 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C[C@H]1CN(C2CC2)C(=O)O1 844342273 AUFCLMRNOQETGD-HNNXBMFYSA-N 348.399 1.741 10 10 EDCE COCc1cc(O)ccc1NS(=O)(=O)c1cn2c(n1)CCCC2 840918015 NZJDBEUXYYVSMD-UHFFFAOYSA-N 337.401 1.872 10 10 EDCE COC[C@]1(C)NC(=O)N([C@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849356100 CGOJEKXWQREOHF-GUYCJALGSA-N 333.388 1.231 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cn(C)ccc3=O)CC2)cc1 929250792 WCXYAFVEUWPIQD-UHFFFAOYSA-N 327.384 1.356 10 10 EDCE COC(=O)CCNC(=O)CCN[C@H](C)c1cc(F)cc(F)c1O 858541969 QNNWHFPUMQABHP-SECBINFHSA-N 330.331 1.390 10 10 EDCE C[C@@H](N[C@@H](CO)c1ccnn1C)c1ccc(N2CCOCC2)c(F)c1 858434618 LGILIRGYPSEXME-CJNGLKHVSA-N 348.422 1.780 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3C[C@H]4CC[C@@H]3O4)C2)cc1 852448151 GWCYPBSPJRGYJT-DXEWXGHRSA-N 331.416 1.893 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCn4ccnc4C3)C2)cc1 855223861 IOQRAZJPTCKOFU-LSDHHAIUSA-N 340.427 1.849 10 10 EDCE O=C(c1ccnc(N2CCOCC2)n1)N1Cc2cccc(O)c2C1 871208111 XZFZBTJLMARNLI-UHFFFAOYSA-N 326.356 1.175 10 10 EDCE CC(C)C(=O)N1CCC[C@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 783314558 BKWGODGORBANMI-LBPRGKRZSA-N 335.356 1.471 10 10 EDCE CO[C@@H]1C[C@@H](C(=O)NCCCN=[N+]=[N-])N(C(=O)OC(C)(C)C)C1 1895876667 XGFYMFKYEOYDLK-MNOVXSKESA-N 327.385 1.827 10 10 EDCE C[C@H](NC(=O)CN(C)S(=O)(=O)c1ccccc1)c1ccccc1O 1171730533 NKFNADRSTGNZQN-ZDUSSCGKSA-N 348.424 1.890 10 10 EDCE [N-]=[N+]=NCCCCNC(=O)CNC(=O)c1ccc(Br)o1 706100125 AAPXUUQTTYFGHC-UHFFFAOYSA-N 344.169 1.979 10 10 EDCE C[C@H](OCc1ccccc1)[C@@H](NC(=O)c1ccc(O)c(O)c1)C(=O)O 706110376 PMZZHQIMUNOWMR-MEDUHNTESA-N 345.351 1.886 10 10 EDCE CC(=O)C(=O)[C@]1(O)C[C@H](C(C)C)N(C(=O)OCc2ccccc2)C1 1892802283 ZIZWLJJDLAAJQQ-QAPCUYQASA-N 333.384 1.943 10 10 EDCE CC[C@@H](F)C(=O)N(C)C[C@H](O)CNCc1ccc(OC)c(C)c1 1332552852 RDPLYQCPVWLQAB-HUUCEWRRSA-N 326.412 1.661 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)c1ncncc1Br 90781949 FDMFSOLWGJEVOH-UHFFFAOYSA-N 336.193 1.313 10 10 EDCE COc1ccc(N2CC[C@H](NCC(C)(C)S(C)(=O)=O)C2)cc1 1261599762 IXNMMXZLNHXXHF-ZDUSSCGKSA-N 326.462 1.687 10 10 EDCE CN1C(=O)[C@@H](NC(=O)NCc2ccccc2O)Cc2ccccc21 1478955172 DCDFFOYDQAAKSF-AWEZNQCLSA-N 325.368 1.779 10 10 EDCE Cc1cc(C)n(CC(=O)NCc2ccc(N(C)C)cc2C)c(=O)n1 1617048415 XWMRSALBSGKXPB-UHFFFAOYSA-N 328.416 1.551 10 10 EDCE CN(CCN(C)C(=O)OC(C)(C)C)C(=O)Cc1ccc(O)c(O)c1 1545827311 IKQAFFIQUZIJOM-UHFFFAOYSA-N 338.404 1.966 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1C 1714273853 RIXRZAKXWIXHTJ-ZBFHGGJFSA-N 333.476 1.940 10 10 EDCE C[C@H](NC(=O)[C@H](CO)NC(=O)c1ccc(F)cc1)c1ccccc1O 1632256120 ZLQYUBUSZAMKOQ-NHYWBVRUSA-N 346.358 1.499 10 10 EDCE COc1cccc(CNC(=O)c2cccc(-c3nc(=O)o[nH]3)c2)c1O 1630365679 CYVDZQGSFVEZKZ-UHFFFAOYSA-N 341.323 1.674 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2(O)CN(CCC3CC3)C2)cc1 1724488350 FYMORUNFXCTRFV-UHFFFAOYSA-N 345.403 1.426 10 10 EDCE COC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)Cc1ccc(O)c(O)c1 1634897895 ZNDAIMLXCLNVFY-AWEZNQCLSA-N 347.342 1.680 10 10 EDCE O=C(c1cccc(O)c1O)N1CCO[C@H](c2noc(C3CC3)n2)C1 1644882716 XAWWJYGNIBTWQZ-LBPRGKRZSA-N 331.328 1.572 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@H]1CCCO1 1583589227 CSEDZJSSHADTPP-ZWNOBZJWSA-N 347.375 1.263 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2cnn[nH]2)C2CC2)cc1C 1661143509 XDPQOGSKNFKFGJ-AWEZNQCLSA-N 329.404 1.420 10 10 EDCE CS(C)(=O)=NC(=O)CNC(=O)NCc1cccc(Cl)c1O 1683218518 RFJVPNLCZKRKKD-UHFFFAOYSA-N 333.797 1.099 10 10 EDCE CC[C@@H](NC(C)=O)C(=O)N(C)CCNCc1ccc(OC)c(C)c1 1691483536 IQYSRMZPTMPMDI-MRXNPFEDSA-N 335.448 1.466 10 10 EDCE C[C@H](O)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1858592524 RIFIHEFTUCZHRO-OMOYZJFYSA-N 341.385 1.861 10 10 EDCE COc1ccc(NC(=O)c2nnn(-c3ccc(N)cc3)n2)c(OC)c1 1857878782 MNGWXGRFBWQNIA-UHFFFAOYSA-N 340.343 1.514 10 10 EDCE C[C@@H](C(N)=O)N(C)c1ccc(C=CC(=O)O)cc1Br 1911831931 FEVXLECESUSVPZ-QMMMGPOBSA-N 327.178 1.857 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C[C@H](N)C(=O)O 1951536936 UOXZSXPDHZARCU-MNOVXSKESA-N 340.376 1.336 10 10 EDCE CO[C@@H](CN)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951695565 IYFUXVRLAAWSQF-RISCZKNCSA-N 326.393 1.507 10 10 EDCE O=C(O)CN1CCC(NCc2c(O)cccc2Br)CC1 2150610321 CHRFXKFDOOHVBJ-UHFFFAOYSA-N 343.221 1.793 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1CC(=O)NCCN=[N+]=[N-] 1985093508 ALANQFKMXZWDHM-WDEREUQCSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H](C(=O)NCCCN=[N+]=[N-])C1 1985103270 SFICEFYOKBPPJX-GHMZBOCLSA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NCc2ccc3c(c2)CCO3)C1 1997820031 NEAFIMKZGUTIFS-CABCVRRESA-N 334.416 1.691 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010396007 LTXKCGZLZVZVOO-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE CNCc1ccc(N2CCN3C[C@H](O)C[C@H]3C2)cc1Br 405201076 CRVYXVMAMSVZFO-UONOGXRCSA-N 340.265 1.424 10 10 EDCE NCc1cc(F)c(N2CCCC[C@H]2C(N)=O)cc1Br 311407645 JPTQRUYTOOWWAB-NSHDSACASA-N 330.201 1.891 10 10 EDCE NC1CCN(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)CC1 2160180633 VWGVZBIPYHQNCQ-UHFFFAOYSA-N 340.232 1.779 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC(O)(C4CC4)C3)c(Br)cc21 384067617 SFMWEYNCPCZYDK-LBPRGKRZSA-N 338.205 1.362 10 10 EDCE C[C@@]1(NC(=O)C(F)(F)F)CCN(CC(=O)Nc2ccc(N)cc2)C1 2044611897 RZPBDBJKBXVQKU-CQSZACIVSA-N 344.337 1.350 10 10 EDCE CC(C)(C)OC(=O)NCC1CN(c2cc3c(cc2N)OCC(=O)N3)C1 2044736451 RNYQFEQHVIBFCX-UHFFFAOYSA-N 348.403 1.561 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2199533678 XIFMLNQOXXTTIK-KBZKQINZSA-N 342.233 1.823 10 10 EDCE CN(CCN1CCOC1=O)c1ccc(CN)c(Br)c1 2114623500 CFLLSDRLGMJQGV-UHFFFAOYSA-N 328.210 1.796 10 10 EDCE COc1ccc(N2CCC[C@](O)(CO)C2)c(OC)c1Br 2234904553 XWLORRIAJLZXMD-CQSZACIVSA-N 346.221 1.790 10 10 EDCE CNc1ncccc1S(=O)(=O)NCc1cnc(SC)s1 2284687168 DQEHZHNEUOKILE-UHFFFAOYSA-N 330.460 1.780 10 10 EDCE Cc1ccc2c(c1)C(=C1SC(N3CCOCC3)=NC1=O)C(=O)N2 2297317869 YAPMQLZYOXXILK-UHFFFAOYSA-N 329.381 1.620 10 10 EDCE CC(C)C(=O)N1CCCN(C(=O)C=Cc2ccc(O)c(O)c2)CC1 2308000628 CEAVSCGHCULAGP-UHFFFAOYSA-N 332.400 1.828 10 10 EDCE CCN(C)C(=O)[C@H](C)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2311489412 BZQGZZKOWNIGOS-HNNXBMFYSA-N 345.443 1.519 10 10 EDCE CO[C@H](CCNC(=O)OC(C)(C)C)[C@@H](N)Cc1ccc(O)c(O)c1 1952754357 DOVLWYYDJOOOJK-SWLSCSKDSA-N 340.420 1.897 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@H]1CC(=O)N(C)[C@H]1c1cccnc1 118775236 NJJLQVJYTNYKHM-YJBOKZPZSA-N 339.395 1.965 10 10 EDCE COc1cccc(CNC(=O)c2nc3ccccc3c(=O)[nH]2)c1O 69216908 GFLAXFYXPVAYAT-UHFFFAOYSA-N 325.324 1.567 10 10 EDCE CCOc1cccc(CN2CCN(c3nccc(OC)n3)CC2)c1O 180014418 CXDSUJMKNPLSJK-UHFFFAOYSA-N 344.415 1.912 10 10 EDCE CC[C@@H]1NC(=O)N(CCN2CCN(c3ccc(OC)cc3)CC2)C1=O 272350869 FTAYZMQZJQIKDS-INIZCTEOSA-N 346.431 1.148 10 10 EDCE COc1cc(N2CCS(=O)(=O)C(C)(C)C2)c([N+](=O)[O-])cc1OC 271924302 GCIAIMAVYOMVOA-UHFFFAOYSA-N 344.389 1.625 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H]2CCc3nc[nH]c3C2)cc1F 378072529 RTLUGSULMLJMRM-LBPRGKRZSA-N 331.395 1.972 10 10 EDCE CN(C)S(=O)(=O)[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 289584187 UDQGYACXOLTZRB-LBPRGKRZSA-N 332.853 1.901 10 10 EDCE Cc1ccc(CN(C)C[C@@H](O)CC(=N)NO)c(O)c1Br 2381126993 CVQHHNDCFWQWCF-JTQLQIEISA-N 346.225 1.602 10 10 EDCE Cc1ccc(CN2CC3(CNC(=O)CO3)C2)c(O)c1Br 2381129310 ILQMCBWXFHXMOP-UHFFFAOYSA-N 341.205 1.164 10 10 EDCE COc1cc(O)c(CN[C@@H](C)C2(S(C)(=O)=O)CC2)cc1OC 809703154 GEVFKZWIMDPWGR-JTQLQIEISA-N 329.418 1.465 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F 808550983 YCXYOLBMMRHSEE-AWEZNQCLSA-N 339.338 1.845 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)COCc1nncn1C 294819786 XKYBWJQMCJULTH-UHFFFAOYSA-N 332.404 1.866 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H](C)N(CC)CC 290382333 MTIMNLYRLGICQZ-OAHLLOKOSA-N 349.475 1.977 10 10 EDCE CCOc1ccc(CNc2ccc(C(=O)NCC(N)=O)cc2)c(O)c1 802762161 WEWLMQGCZMDRKS-UHFFFAOYSA-N 343.383 1.618 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCO[C@H](C2CC2)C1 807101292 RHVGVRLODRTZQY-KRWDZBQOSA-N 345.443 1.315 10 10 EDCE O=C1CC[C@H](C(=O)NCc2cc(Br)ccc2O)CCN1 816653959 OIPOHYOWCIHWNH-VIFPVBQESA-N 341.205 1.687 10 10 EDCE CC[C@H](NC[C@]1(OC)CCS(=O)(=O)C1)c1ccc(C)cc1O 903363390 NTMPYPYDCUGYJV-GOEBONIOSA-N 327.446 1.945 10 10 EDCE CCN(CC)c1ccc(CN2CCN(S(C)(=O)=O)[C@H](C)C2)cc1 827270744 FAOBHIQCILEOPU-OAHLLOKOSA-N 339.505 1.999 10 10 EDCE C[C@@H]1CN(C)C[C@H]1NCc1cc(F)c(N2CCOCC2)c(F)c1 839146875 YPEPNWDWLUPAES-MLGOLLRUSA-N 325.403 1.841 10 10 EDCE O=C(NCc1c(O)cccc1F)N[C@@H]1CCCN(c2ncccn2)C1 914218190 BDZQVBOOTVNRLI-GFCCVEGCSA-N 345.378 1.790 10 10 EDCE COCCN1CC(=O)N([C@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849357298 LENAVJQXNRWOCR-AWEZNQCLSA-N 333.388 1.185 10 10 EDCE C[C@@H]1CN(CCCNC(=O)NCc2c(O)cccc2F)C[C@@H](C)O1 913987841 CFHPQSGQUXZWOP-CHWSQXEVSA-N 339.411 1.830 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3nnc(C)o3)C2)cc1 852450497 NMKFRQMKTMEVTN-CYBMUJFWSA-N 345.403 1.807 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCc4c[nH]nc4C3)C2)cc1 854300382 SGMJDYLGARMWNQ-AWEZNQCLSA-N 341.415 1.765 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cc(N2CCCCC2)ncn1 857158142 GLVOZBMLEHSLHH-UHFFFAOYSA-N 342.399 1.851 10 10 EDCE COC(=O)C1(CS(=O)(=O)NCc2ccc(N(C)C)cc2)CC1 866425952 XWLYHRZKOUPINS-UHFFFAOYSA-N 326.418 1.125 10 10 EDCE CC1(C)OC[C@H]2C[C@]21NC(=O)c1cc(NS(C)(=O)=O)ccc1O 862688982 JMFHPMLTIMMXET-PSLIRLAXSA-N 340.401 1.061 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(CC[S@@](C)=O)CC2)c1O 775718360 ZXINNYHMAOQLOF-OAQYLSRUSA-N 330.881 1.850 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)CCO1 896151936 IOALYTWNSFQATF-NSHDSACASA-N 337.353 1.327 10 10 EDCE COC(=O)c1c(CNCCN2CCNC2=O)c2cc(F)ccc2n1C 895812479 RAEDFNWLXGAVOS-UHFFFAOYSA-N 348.378 1.219 10 10 EDCE CN(C)c1n[nH]c(C2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)n1 1157683283 RZOWPRPOVNWNNM-UHFFFAOYSA-N 345.403 1.231 10 10 EDCE CC(C)[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCS1 1261864001 RLYGUWOUDFDJFX-OAHLLOKOSA-N 334.441 1.834 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC3(C)CCC3)C2)cc1 1350778119 DZGWCQXYNZANCC-AWEZNQCLSA-N 345.443 1.697 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)Cc2cc[nH]n2)cc1C 1283590587 FGOOZEDBVJNIJM-AWEZNQCLSA-N 330.432 1.906 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(c2nnc3n2CCC3)CC1 1291697040 RYNVXIAQWSJKLO-UHFFFAOYSA-N 342.399 1.584 10 10 EDCE CO[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@H]1C 1298140808 WWIMJJDWLDITPZ-QMTHXVAHSA-N 342.417 1.261 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN(CC(F)(F)F)CC1 1616257212 MXPGAQVHAFMIFB-UHFFFAOYSA-N 332.322 1.783 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(NC2CCOCC2)CC1 1471445546 MLBGJYMVOKMAJK-UHFFFAOYSA-N 334.416 1.400 10 10 EDCE CN1C(=O)O[C@@H]2CN(Cc3c(O)cccc3Br)C[C@@H]21 2120402666 OTZFPERTAVHVFD-CMPLNLGQSA-N 327.178 1.790 10 10 EDCE COC(=O)c1ccc2c(c1)N(C(=O)c1c(C)c[nH]c1CC(N)=O)CC2 1558779725 TYWJPEVDXXCIQA-UHFFFAOYSA-N 341.367 1.340 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cnn(C)n2)cc1C 1482149944 PJRSWTMLXMIVLH-LBPRGKRZSA-N 331.420 1.288 10 10 EDCE CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1621215698 BBMAWSYUNLYKIN-IFMYKAFSSA-N 325.430 1.836 10 10 EDCE O=C(Nc1ccc(CN2CCOCC2)cn1)c1c(F)ccc(O)c1O 1638548721 QOLSXAXLLIZOKW-UHFFFAOYSA-N 347.346 1.716 10 10 EDCE CCOC(=O)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)[C@H]1CCCOC1 1633782068 KENJQMBUVVEAAW-LRDDRELGSA-N 337.372 1.115 10 10 EDCE Cn1nccc1[C@H]1c2[nH]cnc2CCN1C(=O)c1cccc(O)c1O 1639074389 ZHQMMHIIPWFDRP-HNNXBMFYSA-N 339.355 1.342 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(C)COCCO1 1762515568 BENXBXHVBFIDMA-QGZVFWFLSA-N 332.404 1.734 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2126153494 QBLXSVLPFQEYGK-DHPDLVEQSA-N 328.206 1.119 10 10 EDCE COc1cc2c(cc1O)[C@H](c1ccc(O)c(O)c1)[C@H](CO)[C@H](CO)C2 14435199 GQLVRVYXAHDDLB-CFZJUORYSA-N 346.379 1.717 10 10 EDCE biogenic,in-vitro CO[C@@H](CNCc1ccc(O)cc1O)CNC(=O)OC(C)(C)C 1901479120 YCYGRFPHVNKRAF-ZDUSSCGKSA-N 326.393 1.727 10 10 EDCE CCN1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)CC1 118711359 CSUCAKDHDDVXKZ-ZDUSSCGKSA-N 339.237 1.543 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@]1(C(=O)O)c1cc(O)c(O)c(O)c1 1952678682 UZTXYMPHNFGERX-BMIGLBTASA-N 325.317 1.423 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1 1986140530 FYWWNGIYZMERNA-CQSZACIVSA-N 327.385 1.517 10 10 EDCE CC(=O)C(=O)C1(O)CCC2(CC1)CN(C(=O)OC(C)(C)C)CCO2 1996446935 NQSNZLPDQLBOFX-UHFFFAOYSA-N 341.404 1.456 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C[C@H]2C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2006009004 GACMAEYOXIILGE-YHQUGGNUSA-N 336.432 1.755 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCC(N=[N+]=[N-])CC2)C1 2010404037 NTRSVMDGQWBIID-LBPRGKRZSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NCc2cc(F)ccc2O)C1 2011917141 JMNQEGPBOMPPIE-HIFRSBDPSA-N 340.395 1.991 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCC[C@H](C(=O)N2CC(N=[N+]=[N-])C2)O1 2018246035 GQABBQGQGIQXJJ-VXGBXAGGSA-N 339.396 1.970 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC(OC(F)F)C3)c(Br)cc21 398898379 PXIRGUAEIVWEMI-SNVBAGLBSA-N 348.147 1.829 10 10 EDCE CN[C@@H](C)c1ccc(N2CCOC[C@H](O)C2)cc1Br 399857155 KDALETWVIPWDEJ-CMPLNLGQSA-N 329.238 1.927 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3C[C@H](N(C)C)C34CCC4)c2n1 2063754169 MAXBIDIXSMIVIB-OLZOCXBDSA-N 329.404 1.346 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](COc1nnc(=N)[nH]n1)C(C)(C)C 2210655700 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COC(=O)[C@H](NCc1cc(Cl)cc(F)c1O)c1ccnn1C 843430244 QXBRPXXJGLRUFW-GFCCVEGCSA-N 327.743 1.922 10 10 EDCE CS(=O)(=O)N1CCCC[C@H]1CNC(=O)Nc1ccc(N)cc1 841300680 ZLRHBRNMXSJBRP-ZDUSSCGKSA-N 326.422 1.204 10 10 EDCE O=C1CN(Cc2cc3c(cc2O)OC[C@H]3O)Cc2ccccc2N1 848498991 ZXTSCACOCWWIQW-MRXNPFEDSA-N 326.352 1.772 10 10 EDCE CS(=O)(=O)C[C@H](O)CNCc1cc(Cl)cc(Cl)c1O 922822637 NELOWYRKYSDALK-SECBINFHSA-N 328.217 1.194 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCCNC3CC3)C2)cc1 851662028 RWVQHGREBCTVBW-OAHLLOKOSA-N 332.448 1.715 10 10 EDCE COCCCOCCC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855222932 DJDJRLNRVCLCQB-OAHLLOKOSA-N 336.432 1.833 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NO[C@H](CO)C(C)C)C2)cc1 854296585 DZUKHNFRWJJXDK-XJKSGUPXSA-N 337.420 1.522 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(N(C)C)cc2C)C1 862550597 FSNLNJSSLZYLFY-OAHLLOKOSA-N 339.505 1.822 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C1CCOCC1)C1CC1 1118300587 ZKCCVIZDOQVAKE-QGZVFWFLSA-N 346.427 1.672 10 10 EDCE C[C@H](NC(=O)CNC(=O)c1cccnc1)c1ccc(N(C)C)cc1 773988052 IVMKBHSIQZDIBZ-ZDUSSCGKSA-N 326.400 1.755 10 10 EDCE CCCn1nccc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785304943 ULJKLEDUFLZXOC-NSHDSACASA-N 346.387 1.390 10 10 EDCE CCc1noc(C)c1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 785295139 SDWHIZYPEFODDW-VIFPVBQESA-N 347.371 1.643 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)c2c(Cl)cnn2C)cc1F 797444608 MESRMNPVIYPDQC-UHFFFAOYSA-N 346.815 1.757 10 10 EDCE COC(=O)COc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1141641897 VHASGAGVJBVVMI-UHFFFAOYSA-N 331.324 1.831 10 10 EDCE COC(=O)C(C)(C)n1cc(NC(=O)/C=C\c2ccc(O)c(O)c2)cn1 1301510913 ZGMXUXZAVMESNU-ALCCZGGFSA-N 345.355 1.854 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)NC[C@@H]3C[C@@H]3C)CC2)cc1F 1321886466 VFGUOSWZNASCEH-STQMWFEESA-N 349.406 1.255 10 10 EDCE CC[C@H](CNCc1ccc(N2CCN(C)CC2)c(F)c1)C(=O)OC 1331547211 FXPGLFSBYQHXFN-OAHLLOKOSA-N 337.439 1.866 10 10 EDCE COc1ccc(CNC[C@H]2CCN(C(=O)[C@H](C)CC(N)=O)C2)cc1C 1267052477 DLIQLSKSRCNKRT-GDBMZVCRSA-N 347.459 1.453 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1c[nH]c(=O)cn1 1268474045 LEWPRWCAGNQYDA-UHFFFAOYSA-N 344.415 1.339 10 10 EDCE CCOCn1nc(C)c(CC(=O)NCc2cccc(O)c2O)c1C 1263894613 ODUXVUJDOYJNDQ-UHFFFAOYSA-N 333.388 1.764 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H]2CCN(C)C2)cc1C 1267157282 LEGMIMJQDLKXLJ-WBVHZDCISA-N 333.476 1.940 10 10 EDCE CCc1noc(COCC(=O)Nc2c(Cl)ccc3nonc23)n1 1271357060 SJFQCLKRHKAMMP-UHFFFAOYSA-N 337.723 1.977 10 10 EDCE CC[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1440745786 ILUNBYAVHXRTIC-PWSUYJOCSA-N 338.429 1.457 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cnn(CCO)c1 1539474721 PFJSWECCCCKXCS-UHFFFAOYSA-N 328.416 1.748 10 10 EDCE CCc1nc[nH]c1C(=O)NC[C@@H](CO)NCc1ccc(OC)c(C)c1 1700804642 FBBGCFXUISDDOC-AWEZNQCLSA-N 346.431 1.170 10 10 EDCE CS(=O)(=O)CCc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1545915985 PFROLJQHNRQLEX-UHFFFAOYSA-N 349.408 1.866 10 10 EDCE COC(=O)[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)c1ccccn1 1636456558 IKUBVSBCHHPAAY-CYBMUJFWSA-N 341.327 1.888 10 10 EDCE COC(=O)c1cnc([C@@H](C)NC(=O)c2c(F)ccc(O)c2O)s1 1638809909 ACFLZEMATBMBCO-ZCFIWIBFSA-N 340.332 1.971 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2(NC[C@@H]3CCOC3)CC2)cc1 1569433184 CNMSYYWDPZFERT-LBPRGKRZSA-N 345.403 1.738 10 10 EDCE C[C@H](O)CNC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(C)(C)C 1649473772 QLYSBHANNKBLIL-SMDDNHRTSA-N 349.435 1.964 10 10 EDCE COCCCNCC1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1733959634 GTZMBJPPSJDVLD-UHFFFAOYSA-N 347.419 1.984 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)c2cnnc(O)c2)cc1C 1733979348 LIROPSHCRPULOE-OLZOCXBDSA-N 344.415 1.796 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)NCc1c(O)cccc1O 1652625322 BKUSSPCGLJTLCH-UHFFFAOYSA-N 340.376 1.255 10 10 EDCE c1cc(N2CCOCC2)ccc1CNC[C@H]1COC2(CCOCC2)O1 1650844280 LNKWQEYGJNRXAR-SFHVURJKSA-N 348.443 1.535 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@H](C)n2cncn2)cc1C 1690566743 OAKITTFRHQTYAQ-KGLIPLIRSA-N 331.420 1.451 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@H](C)NC(C)=O)cc1C 1699227893 QZFNLVBHQOWQFW-GJBLVYBDSA-N 333.432 1.290 10 10 EDCE O=C(CCN1C(=O)CSC1=S)Nc1ccc([N+](=O)[O-])cn1 1865769058 UOJXTSMTESMLAO-UHFFFAOYSA-N 326.359 1.179 10 10 EDCE O=C(CNCc1cc(Cl)ccc1O)N1CCCC[C@@H]1CCO 1857868633 TWCDAZMDEOEYCE-CQSZACIVSA-N 326.824 1.899 10 10 EDCE CCN(CC)c1ccc(/C=c2\sc3nc(CN)nn3c2=O)cc1 1857924418 BQZNWJOPOPVXFE-LCYFTJDESA-N 329.429 1.004 10 10 EDCE CN(C[C@@H](O)COCc1ccccc1)C(=O)COc1ccc(N)cc1 1916344522 MPHDOBGWIZLHKO-QGZVFWFLSA-N 344.411 1.684 10 10 EDCE O=C1CN(c2ccc(CNC3CC3)cc2Br)CC(=O)N1 232487920 OFLRVNNFGBIBHT-UHFFFAOYSA-N 338.205 1.164 10 10 EDCE CON(C)C1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2144645657 UQCUDODHKXZKJI-LBPRGKRZSA-N 341.209 1.083 10 10 EDCE COC[C@]1(C(=O)NCCN=[N+]=[N-])CCCN1C(=O)OC(C)(C)C 1985094987 XFXFMKFFEKWOQN-AWEZNQCLSA-N 327.385 1.829 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985100560 HQACDKHLXRGAAT-GARJFASQSA-N 327.385 1.562 10 10 EDCE Nc1ccc(OC[C@H](O)CN2CC(OCc3ccccc3)C2)cc1 1998336134 JDGXQOMEKVLTHY-QGZVFWFLSA-N 328.412 1.910 10 10 EDCE COCC1(NCc2ccc(O)c(O)c2)CN(C(=O)OC(C)(C)C)C1 2016211558 UMDRGJAEKOQCHM-UHFFFAOYSA-N 338.404 1.823 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@H](O)CNC(=O)OC(C)(C)C)cc1 2022811417 GDWBGPBHMLSEGH-CQSZACIVSA-N 337.420 1.254 10 10 EDCE CN(Cc1ncno1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2160397435 NLVLZQBZUWEFLI-LLVKDONJSA-N 338.165 1.420 10 10 EDCE CNCc1ccc(N2CCN(C[C@@H](C)O)CC2)cc1Br 2170220572 IGNXICLAWCPMQA-GFCCVEGCSA-N 342.281 1.671 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CNCc2cccc(F)c2O)C1 702811889 RCZJBBFULXAYNR-OCCSQVGLSA-N 340.395 1.849 10 10 EDCE O=C(O)CN1CCN(Cc2cc(Br)cc(F)c2O)CC1 715770120 OEFSJEBTMBQVDP-UHFFFAOYSA-N 347.184 1.496 10 10 EDCE C[C@H](NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C)c1ccccc1O 1587451284 OOEMZJFIOMTKBM-RYUDHWBXSA-N 338.404 1.845 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CC(=O)NCc2ccc(N)cc2)C1 2080713764 JXVHAKNEOLTKRN-UKRRQHHQSA-N 349.431 1.503 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1CO[C@@H]2COC[C@H]21 2101846073 GBUCDRFJQAOOCW-OLUVUFQESA-N 328.206 1.906 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(CNCc2ccc3c(c2)CCO3)C1 2081944181 GDUCLEMZRXZRMA-UHFFFAOYSA-N 348.443 1.941 10 10 EDCE O=C(NC[C@@H]1CNCCN1Cc1ccccc1)c1ccc(O)c(O)c1 2084716723 FOPAVTCJCBKCII-INIZCTEOSA-N 341.411 1.302 10 10 EDCE C[C@H]1[C@H](C)S(=O)(=O)CCN1c1ccc(CO)cc1Br 2113962109 PNEVFRBAZRNXDC-UWVGGRQHSA-N 348.262 1.953 10 10 EDCE CNCc1ccc(N2CC[C@@H]([C@](C)(O)CO)C2)c(Br)c1 2202851681 CTAVENYAPMTZAL-IUODEOHRSA-N 343.265 1.738 10 10 EDCE CCC[C@@H](NCc1c(Br)ccc(OC)c1O)C(N)=O 2227751781 QHWSOASMSJBIKU-SNVBAGLBSA-N 331.210 1.907 10 10 EDCE COc1ccc(N(CCNC(=O)OC(C)(C)C)C[C@@H](C)O)c(N)c1 2249012104 RELVVKSQOFOWRE-GFCCVEGCSA-N 339.436 1.989 10 10 EDCE O=C(O)[C@@]12CCO[C@@H]1CN(Cc1c(O)cccc1Br)C2 2296418541 LDYIEQBWLGUAAC-TZMCWYRMSA-N 342.189 1.830 10 10 EDCE CN1C(=O)NC(=O)C(=Cc2ccc(-c3cccc(C(=O)O)c3)o2)C1=O 2297301749 JGOQJPVXEXBAMS-UHFFFAOYSA-N 340.291 1.736 10 10 EDCE CC(C)(C)OC(=O)N(O)CC(=O)N1CCc2cc(O)c(O)cc2C1 2302404469 YYMPLEMUAYZTSZ-UHFFFAOYSA-N 338.360 1.609 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)c2csc(C(N)=O)c2)cc1 6859597 BSCVLLBIKWGZMX-UHFFFAOYSA-N 339.442 1.392 10 10 EDCE CCCNC(=O)CN1CCC(NCc2ccc3c(c2)CCO3)CC1 54174743 NDYKZRCIPFGHID-UHFFFAOYSA-N 331.460 1.702 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CCCC(=O)N3)CC2)cc1C 1277088217 VAQPORUGDYYJNI-OAHLLOKOSA-N 345.443 1.411 10 10 EDCE CN(C)c1ccc([C@H](O)[C@H](N)c2c(Br)ncn2C)cc1 2362541902 HJVYMILZXAHHGP-YPMHNXCESA-N 339.237 1.982 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CCCN(c3cccnc3)C2=O)c(O)c1O 374974189 XJKWYUJJHWYRAX-AWEZNQCLSA-N 341.367 1.727 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cn2c(n1)COCC2 625916334 RCCBLGZPMAMBIS-UHFFFAOYSA-N 328.372 1.519 10 10 EDCE Cc1ccc(CN=c2cc(C(N)=O)cn[nH]2)c(O)c1Br 2380755225 ZIKMVDORUVQDFI-UHFFFAOYSA-N 337.177 1.386 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)N3CC[C@@H](C)C3)cc2)CC1 800123735 ORYUNLFWSFPQRL-OAHLLOKOSA-N 344.459 1.907 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@H](C3CCC3)C2)cc1 817274706 PPSFLDQVMAQENS-QGZVFWFLSA-N 345.443 1.396 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(C[C@H](C)O)C(C)C)nc12 730419225 GSSDKYOPGUTTNM-NSHDSACASA-N 336.392 1.203 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCC[C@@H](CS(N)(=O)=O)C2)cc1 835029777 SFHWNXRZRJZJNZ-OICCZTGUSA-N 337.489 1.766 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CS(=O)(=O)NC(C)(C)C 919682419 JTKOHLYAJKYLNF-UHFFFAOYSA-N 341.477 1.429 10 10 EDCE CCON(C)C(=O)CNC(=O)N[C@@H](C)c1cc(OC)ccc1O 845566483 KDDPZOFUWIDTCN-JTQLQIEISA-N 325.365 1.171 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](c2ccc(O)c(O)c2O)[C@@H](CO)C1 687737231 VYXMFVNIXFTCCX-KOLCDFICSA-N 325.361 1.746 10 10 EDCE COC(=O)[C@@]1(C)CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 840388304 WLSREDAQMJAPNU-INIZCTEOSA-N 349.343 1.705 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)[C@]12C[C@H]3C[C@H](C(=O)N1)[C@H]2C3 844396780 QVTXFQBJQOFHGC-NALNUFGESA-N 327.428 1.592 10 10 EDCE COc1cccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])s2)c1O 751309461 MFEQHQCCARKFSS-UHFFFAOYSA-N 344.370 1.849 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@@](C)(C3CC3)C2)cc1 852322114 BQOZUXYUVNIYKC-LJQANCHMSA-N 331.460 1.870 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3nccn3C)C2)cc1 852125748 WXGGWAJRBYRJGO-CYBMUJFWSA-N 329.404 1.507 10 10 EDCE O=S(=O)(CCNCc1cc2c(cc1O)OCO2)CC(F)(F)F 850364260 XATGCDIGUIRBSU-UHFFFAOYSA-N 341.307 1.188 10 10 EDCE CO[C@@H](CNC(=O)NCc1ccc(N(C)C)c(F)c1)[C@H]1CCOC1 852440583 SCEPBIVALGAQNI-BBRMVZONSA-N 339.411 1.742 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCn4cncc4C3)C2)cc1 854297615 PECKIEXLXZKXDH-CQSZACIVSA-N 341.415 1.696 10 10 EDCE COC(=O)C12CC(CN1CC(=O)NCc1ccc(N(C)C)cc1)C2 852441364 NIFCTBTUQVWCJN-UHFFFAOYSA-N 331.416 1.006 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)[C@H]3CCN(C)C3=O)C2)cc1 854296390 CDDWZQNADFMFDZ-CJNGLKHVSA-N 346.431 1.146 10 10 EDCE CCNCc1ccc(N2C[C@H](O)C[C@@H]2CO)cc1Br 698180108 KCUGCGHFYBNHFJ-CHWSQXEVSA-N 329.238 1.491 10 10 EDCE C[C@H](C(=O)N1Cc2cccc(O)c2C1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 871200226 ZWHDQVVFCSUDRX-MRVWCRGKSA-N 342.395 1.798 10 10 EDCE CCc1coc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 774242604 AKBLKDJCIDUNBA-UHFFFAOYSA-N 325.346 1.566 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@@H](O)CC(F)(F)C2)cc1F 786732249 LXWRMKINXXVFLH-NSHDSACASA-N 331.338 1.803 10 10 EDCE COC(=O)c1c(CN(C)Cc2nncn2C)c2cc(F)ccc2n1C 894780866 KVHRXUTVJPXHAA-UHFFFAOYSA-N 345.378 1.865 10 10 EDCE CN1CCN(c2ccc(CN[C@H](CO)C[C@H](O)C(C)(C)C)cc2)CC1 790618505 IJHMNAGMTHALSF-HKUYNNGSSA-N 349.519 1.686 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](c2cncn2C)N(C)C)c1 1150544185 ZKUJDDHIDWEFJR-BDJLRTHQSA-N 332.404 1.614 10 10 EDCE COc1cc(C=C2SC(=S)NC2=O)ccc1OCC(=O)O 1903865393 DVBJNSKWHSGTDK-UHFFFAOYSA-N 325.367 1.647 10 10 EDCE CCN(CC)C(=O)COc1cccn(Cc2ccc(N)cc2)c1=O 57874902 NUUGRTWBPYTYID-UHFFFAOYSA-N 329.400 1.726 10 10 EDCE O=C(Cn1[nH]cc2c(=O)ncnc1-2)NCc1c(O)ccc2ccccc12 1304089948 SCOGPBUEBXEMAT-UHFFFAOYSA-N 349.350 1.246 10 10 EDCE COC(=O)[C@H]1C[C@H]1C(=O)N(C)CCNCc1ccc(OC)c(C)c1 1317573600 JSOZOTZYQOHYSW-CABCVRRESA-N 334.416 1.361 10 10 EDCE CCOc1ccc(N2CCN(C(=O)C[C@@H](C)NC(N)=O)CC2)cc1 1327623746 XSDYILPXZXJPGO-CYBMUJFWSA-N 334.420 1.181 10 10 EDCE CC[C@H](C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1347655398 OHHZWLLUTBJFHK-LSDHHAIUSA-N 347.459 1.943 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cc(C)no2)cc1C 1272363149 VSTPAACBBNDCBW-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE COCCC(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1522816081 WHQIUALOLBQKEG-UHFFFAOYSA-N 335.364 1.122 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@@H]1CCN(c2ccc(F)cc2)C1=O 1451767188 LPTDLUWSIATRPV-HNNXBMFYSA-N 344.342 1.906 10 10 EDCE COc1ccc(CNC2(CNC(=O)C[C@@H]3CCNC3=O)CC2)cc1C 1483740794 ROTFBEVQMLAXPJ-HNNXBMFYSA-N 345.443 1.268 10 10 EDCE CNC(=O)c1cccc(CCNC(=O)c2c(F)ccc(O)c2O)c1 1558939898 VYMRVDAOLGJBDP-UHFFFAOYSA-N 332.331 1.569 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@H](N1CCOCC1)C(F)(F)F 1626992042 AIEIDXYGFPOLMH-ZDUSSCGKSA-N 348.321 1.020 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cnnn2C)cc1C 1483002713 KRRAHNMQASRFAC-SNAWJCMRSA-N 329.404 1.208 10 10 EDCE CC[C@H](CNC(=O)c1cn(C)nn1)NCc1ccc(OC)c(C)c1 1714069478 BRSGESCJBQQVMR-CQSZACIVSA-N 331.420 1.430 10 10 EDCE Cc1nc([C@H](NC(=O)c2ccc(C)c(O)c2O)c2cnn(C)c2)no1 1637763559 REBDSZOWLZBMNU-GFCCVEGCSA-N 343.343 1.351 10 10 EDCE CCO[C@H]1C[C@@H](O)C12CCN(C(=O)Cc1ccc(O)c(O)c1)CC2 1565910812 GVPLXFAMJDHKBB-CVEARBPZSA-N 335.400 1.419 10 10 EDCE CN(CCNC[C@@H]1CCCOC1)C(=O)c1ccc(N=NC(N)=O)cc1 1567615514 XJDTWZOHQDGPSF-ZDUSSCGKSA-N 347.419 1.937 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)Cc2cn(C)nc2C)cc1C 1732957894 DNFJEHAFHXNHBQ-CQSZACIVSA-N 344.459 1.883 10 10 EDCE CNS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccccc2O)cc1 1643742086 NTTYONFZGMMZSW-NSHDSACASA-N 334.397 1.791 10 10 EDCE COC(=O)[C@@H]1Cc2ccc(O)cc2CN1C(=O)c1cccc(O)c1O 1653832155 OUWPHGVICXTMQP-AWEZNQCLSA-N 343.335 1.544 10 10 EDCE COC(=O)NCC(=O)N[C@@H](CNCc1ccc(OC)c(C)c1)C1CC1 1670452085 XHDXOUCXJYLWTI-HNNXBMFYSA-N 349.431 1.344 10 10 EDCE CCn1cc(C(=O)N(C)[C@@H](C)CNCc2ccc(OC)c(C)c2)nn1 1698853322 XWBWPNUHHFWRQN-AWEZNQCLSA-N 345.447 1.865 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)/C(=C\c2cccc(O)c2)SC1=S 1858595401 BBXLPVMAFFCZJA-UMYFRRCYSA-N 325.367 1.039 10 10 EDCE NCc1ccc(N2CC[C@@H](O)C[C@@H]2CO)c(F)c1Br 2136083375 DMCRVSYDRPEMPQ-NXEZZACHSA-N 333.201 1.369 10 10 EDCE [N-]=[N+]=N[C@@H]1CCCN(C[C@H](O)CN2C(=O)c3ccccc3C2=O)CC1 1934380325 DYRHRXJMUUOLEE-OLZOCXBDSA-N 343.387 1.808 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@H](N(C)C)C2)c(Br)c1 2146133267 UKZNVLWHGAKBEX-KMUNFCNLSA-N 342.281 1.841 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@H](F)C1 2003169251 ZKSAWULPGCREOK-FDYHWXHSSA-N 342.411 1.847 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003172448 LDJHIQUIDNMDPA-JHJVBQTASA-N 340.420 1.136 10 10 EDCE CNCc1ccc(N(C)Cc2nnnn2C)cc1Br 708258091 OHFQZWISVZYOAH-UHFFFAOYSA-N 325.214 1.328 10 10 EDCE NCc1cc(F)c(N2CC(N3CCOCC3)C2)cc1Br 2169500994 SPQBXJREFPNLAS-UHFFFAOYSA-N 344.228 1.568 10 10 EDCE CN1C[C@@H]2C[C@H]1CN2c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2187610468 HNZPTLFUTDWKOP-UVPNAGLESA-N 338.205 1.327 10 10 EDCE O=C(NC[C@@H]1CCCCN1C(=O)C(F)(F)F)c1ccc(O)c(O)c1 2054399890 XJYKTBGMHXJSDM-JTQLQIEISA-N 346.305 1.771 10 10 EDCE CNC(=O)OC1CN(c2ccc(CN)c(Br)c2F)C1 2090746719 NDWSEEWTPJDUMX-UHFFFAOYSA-N 332.173 1.592 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213593609 XRLISTYTHFYEHZ-IRCOFANPSA-N 339.396 1.874 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213586276 ABSHRHKSYDFOGK-WISYIIOYSA-N 339.396 1.704 10 10 EDCE Cn1cc(NC(=O)COc2ccc(N)cc2)c(Br)n1 2230785599 LBRWQQGLIHDBNO-UHFFFAOYSA-N 325.166 1.782 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@@H]1C(=O)NCCCN=[N+]=[N-] 2242655258 BHDDADRLIJKOGL-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N1CCOCC[C@H]1C(=O)NCCCN=[N+]=[N-] 2244012582 SLCZYCZXRQVRLG-NSHDSACASA-N 327.385 1.829 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cnc(Cl)nc2)s1 2269245580 LAGKINOBKJBMOD-UHFFFAOYSA-N 336.851 1.787 10 10 EDCE Cc1ccc(CN2CC[C@H](O)[C@](C)(O)C2)c(O)c1Br 2352949486 FKJMQKXCDQAUTF-SMDDNHRTSA-N 330.222 1.781 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(c2cc(O)c(O)c(O)c2)C[C@H]1C(=O)O 1952775412 OYMYLMZIHREAML-VXJOIVPMSA-N 325.317 1.628 10 10 EDCE O=C(NCCN1C(=O)CSC1=S)c1cc2ccccc2oc1=O 49756597 PJXBDNNDEMDAPK-UHFFFAOYSA-N 348.405 1.383 10 10 EDCE CN(C[C@H](O)CN1C(=O)c2ccccc2C1=O)c1ccc(N)cc1 702130186 ZTFXUDVHCDQQLN-AWEZNQCLSA-N 325.368 1.362 10 10 EDCE COc1ccc(N(C)C[C@H]2COCCN2)c(OC)c1Br 2162641665 CHTTXUSSTUXFNS-JTQLQIEISA-N 345.237 1.891 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H]3COC[C@@H](C2)O3)c([N+](=O)[O-])c1 800886295 VYVHMQLHIFCQKQ-AYKMPCHXSA-N 334.328 1.385 10 10 EDCE OC1CCN(c2ccc(CNC[C@H](O)C(F)(F)F)cc2F)CC1 819122404 WMVNBGSYYLHGBG-AWEZNQCLSA-N 336.329 1.800 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)C1CN([C@@H]2CCOC2)C1 827771336 WFKZYBVIUSMGEU-OAHLLOKOSA-N 327.384 1.277 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1CCN 903715700 LMSHBXLWSRTMEF-GDBMZVCRSA-N 346.475 1.154 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)[C@H]4CSCCN4C3=O)C2)cc1 849356643 GGHLGSXCEYITRP-DZGCQCFKSA-N 347.440 1.654 10 10 EDCE COCC1(C)CCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)CC1 846255564 FQNUJVLNLZNKPM-UHFFFAOYSA-N 334.376 1.382 10 10 EDCE Cc1cc(Br)cc(CN2CCN3C[C@H](O)C[C@H]3C2)c1O 848926263 NOYDKZDBTZKXDF-UONOGXRCSA-N 341.249 1.714 10 10 EDCE CCOC(=O)C[C@@H](O)CN1CCCN(c2ccc(OC)cc2)CC1 859085706 BOWYLCZXUANEFL-MRXNPFEDSA-N 336.432 1.521 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCN(C3CCC3)C2=O)c1 858604011 YYTKXUSAMAHWID-NHYWBVRUSA-N 332.400 1.983 10 10 EDCE CON(C)C(=O)[C@H](C)NCc1ccc(N2CCOCC2)c(F)c1 858319653 DFXZJSIZIWPFCL-LBPRGKRZSA-N 325.384 1.160 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@]3(C)CCCO3)nc12 756549297 ASEJAPPJFJIFOE-INIZCTEOSA-N 349.343 1.224 10 10 EDCE CC(C)(C)OC(=O)C1=NO[C@H](C(=O)N2Cc3cccc(O)c3C2)C1 871204393 DGMUPXPSEMJVKC-AWEZNQCLSA-N 332.356 1.721 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 1119734669 JVOYBAAOZJZXEG-OAHLLOKOSA-N 343.427 1.316 10 10 EDCE Cc1ccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)o1 773290605 PPEGEWLMWZXTPQ-UHFFFAOYSA-N 336.413 1.903 10 10 EDCE COc1ccc(N2CCCN(C(=O)N[C@@H]3[C@H]4COC[C@H]43)CC2)cc1 793447520 OKXATACHECLSAL-FVQHAEBGSA-N 331.416 1.562 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1nnn(C(C)(C)C)n1 1140198634 LXMKVOPSRBRYTA-UHFFFAOYSA-N 338.408 1.478 10 10 EDCE CN1CCN(c2ccc(CNCc3nc(C4CC4)n[nH]3)cc2F)CC1 1344073818 BLSJWIXOQLGPIS-UHFFFAOYSA-N 344.438 1.863 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])N(C)C)cc1 1304769234 TXHGLMSTUBUJFS-CYBMUJFWSA-N 346.391 1.417 10 10 EDCE CCn1nnnc1CN(C)c1ccc(CN)c(Br)c1 1885608624 VEIDQVZLYHAPDK-UHFFFAOYSA-N 325.214 1.551 10 10 EDCE CN(C)CCN(CC(=O)O)Cc1ccc(Br)cc1O 691424208 SMOLNFKPICPTBB-UHFFFAOYSA-N 331.210 1.603 10 10 EDCE CCN(CCNC[C@@H]1CCOC1)C(=O)c1ccc(N=NC(N)=O)cc1 1320931068 XVNDLZSVUNOGGH-ZDUSSCGKSA-N 347.419 1.937 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CC(=O)N(c2cccc(F)c2)C1 1178912908 YUHUDWAVYKLWQL-NSHDSACASA-N 344.342 1.906 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H](C)NC(C)=O)cc1C 1268779980 NYKXIKKUBKGGIW-AWEZNQCLSA-N 335.448 1.466 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CCCN(C)C(=O)OC 1297562886 RBBRQJYDIZBVNJ-UHFFFAOYSA-N 329.393 1.973 10 10 EDCE Cn1nccc1[C@H]1C[C@@H](NC(=O)c2c(F)ccc(O)c2O)CCO1 1472563093 DZXCHQJIKHMVBV-TVQRCGJNSA-N 335.335 1.621 10 10 EDCE Cc1ncc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)[nH]1 1471912141 JZHRMXGTMBPJDO-UHFFFAOYSA-N 341.415 1.350 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2cnn(C)n2)cc1C 1700773697 UCLZFDPPLORISS-ZDUSSCGKSA-N 331.420 1.382 10 10 EDCE C[C@@H](O)[C@H](NC(=O)C1CCCC1)C(=O)N(C)Cc1ccccc1O 1629954719 ALPJHLLWTNQELH-WBMJQRKESA-N 334.416 1.406 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccc(C(=O)NCCO)cc1 1624382981 INPIWXBBJIMNLA-UHFFFAOYSA-N 330.340 1.001 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3OC(=O)N[C@@H]3C2)cc1Br 2120414227 ZOGPUTWRBWEXIK-KOLCDFICSA-N 330.157 1.344 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)[C@H]1C[C@H](O)C1 2122886139 KDJGBEPLZJXOND-WSFZALMZSA-N 326.194 1.361 10 10 EDCE CO[C@@H](C)C(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1737551616 KQRMPHSAPRXWCN-ZJUUUORDSA-N 335.364 1.118 10 10 EDCE C[C@H](NC(=O)c1ccnc2c(C(N)=O)cnn12)c1ccccc1O 1642830907 LFSCWBYFFQHELT-VIFPVBQESA-N 325.328 1.025 10 10 EDCE COc1ccc(Br)c(CNCCN2CCOCC2)c1O 1964018943 FOBQAOIHRUBTKT-UHFFFAOYSA-N 345.237 1.585 10 10 EDCE NC(=O)c1ccc(/N=N/N2CCN(C(=O)c3ccco3)CC2)cc1 1860481166 QZKWIWKRSDCTAV-VHEBQXMUSA-N 327.344 1.835 10 10 EDCE CCOC(=O)CCN(C)C(=O)CNCc1cc(Cl)ccc1O 1857868518 NFKPCUHSWFCQCN-UHFFFAOYSA-N 328.796 1.547 10 10 EDCE NCc1cc(F)c(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)cc1Br 2136613999 NJFBNZMMPTVOBA-JDICNCQASA-N 328.185 1.214 10 10 EDCE COC1(CNC(=O)OC(C)(C)C)CC(C(=O)NCCN=[N+]=[N-])C1 1985101815 YFKYNPMEYNRKKO-UHFFFAOYSA-N 327.385 1.733 10 10 EDCE NCc1ccc(N2CC34COCC3(COC4)C2)c(Br)c1 2150398546 JZRGXKIQCSSHLM-UHFFFAOYSA-N 339.233 1.761 10 10 EDCE CN(C(=O)OC(C)(C)C)C1CN(CC(=O)Nc2ccc(N)cc2)C1 1999474862 KWWCWYPHEBXIDN-UHFFFAOYSA-N 334.420 1.758 10 10 EDCE Nc1ccc(OCCN2C[C@H]3C[C@H]2CN3C(=O)C(F)(F)F)cc1 1999478137 QOEZESHWUUBWIG-NWDGAFQWSA-N 329.322 1.495 10 10 EDCE CON(C(=O)c1ccc(O)c(O)c1)C1CN(C(=O)OC(C)(C)C)C1 2006279704 HZGKJYJXNWPOCH-UHFFFAOYSA-N 338.360 1.721 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC[C@H]2CN=[N+]=[N-])CC(O)C1 2018045640 HHEIXWDAJGVMGG-NLTNOIMHSA-N 339.396 1.706 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H](OC)C3)c(Br)cc21 300181203 UDVLNHKTLKJOPE-SDBXPKJASA-N 340.221 1.887 10 10 EDCE COC1(C)CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 382936109 PLBUACDRPSMLCP-NSHDSACASA-N 326.194 1.626 10 10 EDCE Oc1c(F)cc(Br)cc1CNC[C@@H]1CN2CCN1CC2 715818218 NRJAJKZBWHVDIN-GFCCVEGCSA-N 344.228 1.383 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@H]2O 2174414782 ZSDARITZVXUPPP-UZGCMYEVSA-N 342.233 1.622 10 10 EDCE O=C(O)[C@H]1[C@H]2[C@@H]1OCCN2Cc1c(O)cccc1Br 2092839049 XBRKETBDGMGEOV-SDDRHHMPSA-N 328.162 1.439 10 10 EDCE CN(CC1COC1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2269774606 YWEUEYIGJGRCQY-LBPRGKRZSA-N 326.194 1.484 10 10 EDCE CC[C@]1(NCc2c(Br)ccc(OC)c2O)CCNC1=O 2288919888 YATQOAZYXLUNDV-AWEZNQCLSA-N 343.221 1.922 10 10 EDCE Cc1cccc(N2C(=O)NC(=O)C(=CNC[C@@H]3CCCO3)C2=O)c1C 2296940689 AGFJDUYYJSFBNR-ZDUSSCGKSA-N 343.383 1.539 10 10 EDCE COc1ccc(/N=N/[C@H]2C(=O)NN=C2C2CCN(C(C)=O)CC2)cc1 100238918 QMTIUIILVXEZJB-IGGDJGDASA-N 343.387 1.892 10 10 EDCE CN(C)C[C@H]1COCCN1Cc1c(O)cccc1Br 1140103695 SFJXDLPSRCCKJA-NSHDSACASA-N 329.238 1.917 10 10 EDCE O=C(c1cccc(O)c1O)N1CC[C@H]2[C@@H](CCC(=O)N2C2CC2)C1 193144821 WLEVRALSJRPUCJ-FZMZJTMJSA-N 330.384 1.713 10 10 EDCE COC[C@@H](O)CN(C)Cc1cc(Br)cc(OC)c1O 92255696 MMIMMKPKLJGFBV-NSHDSACASA-N 334.210 1.602 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@@]3(CNC(=O)C3)C2)c([N+](=O)[O-])c1 279227523 ZPXKRRDNBCWCGX-NJELEJDNSA-N 345.355 1.497 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)[C@H]1CC[C@H](O)CC1 275904176 SITKSCJYPRMSGC-IYARVYRRSA-N 333.476 1.946 10 10 EDCE CCOCc1nc([C@H](C)NC(=O)/C=C/c2ccc(O)c(O)c2)no1 291844619 HDIVTFPOAZXAJI-STUBTGCMSA-N 333.344 1.908 10 10 EDCE CCN1CC[C@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)C1=O 801753190 PEVUMQDPYYJZNJ-INIZCTEOSA-N 328.416 1.483 10 10 EDCE CNC(=O)[C@@H]1COCCN1c1ccc([C@@H](C)N)cc1Br 723184061 YQKAIYNPLHCIKM-RNCFNFMXSA-N 342.237 1.420 10 10 EDCE CC1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CO1 828496885 LLBWRPNMNJDZEW-HNNXBMFYSA-N 343.427 1.363 10 10 EDCE COc1ccc(O)c(CNC(=O)c2nnn(C)c2C(F)(F)F)c1 907059615 FZLDWJORZKQJQA-UHFFFAOYSA-N 330.266 1.478 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nn2ccnn2)C1 908831824 QNIOALAIOZYCKD-UHFFFAOYSA-N 338.415 1.770 10 10 EDCE COc1cccc(CNC(=O)c2nnn(C)c2C(F)(F)F)c1O 907061108 RFZBGFDUYAHKTG-UHFFFAOYSA-N 330.266 1.478 10 10 EDCE Cc1cc(CC(=O)N2CC[C@H](CO)[C@H](O)C2)c(C)n1-c1ccccc1 834321326 YFIAPELLBLLITO-VQIMIIECSA-N 342.439 1.838 10 10 EDCE Cc1ccc(C(=O)N2CCn3c(CC4CC4)nnc3C2)c(O)c1O 846362664 IMQKMTPYONAKKF-UHFFFAOYSA-N 328.372 1.606 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1coc(S(C)(=O)=O)c1 845929385 CEKLJIOBGGMGBW-SECBINFHSA-N 339.369 1.455 10 10 EDCE COC(=O)[C@@H]1CCCC[C@@H]1S(=O)(=O)NCc1c(O)cccc1F 921452680 WGLBZWFZDYUTQE-YGRLFVJLSA-N 345.392 1.683 10 10 EDCE CCN1CC[C@@H](NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1=O 852315546 YJVDAGJRPGWQFP-CZUORRHYSA-N 346.431 1.194 10 10 EDCE C[C@@H](NC(=O)COCC(F)F)c1ccc(N2CCOCC2)cc1 858785054 CSAFORZJNBVSNQ-GFCCVEGCSA-N 328.359 1.982 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@H]2COC[C@@H]2C1 850602669 YIEFEXJGCLWYGU-HOTGVXAUSA-N 345.443 1.206 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)C1(N2CCOCC2)CC1 864983941 AVOILMOANLZPLO-UHFFFAOYSA-N 345.443 1.004 10 10 EDCE NC(=O)C[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCO1 862534776 GQBUYUFPQJZFNL-SNVBAGLBSA-N 329.740 1.030 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H](C(=O)N2CCCC2)C1 779517347 QBCFXXAHLKBBAM-LYASGUKUSA-N 344.411 1.972 10 10 EDCE CS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccc(O)cc1 873883801 JHVBFBZIVQCKDX-UHFFFAOYSA-N 327.383 1.597 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CNC[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@@H]6[C@H]4[C@H]2[C@@H]6C[C@H]53)c1 785546877 UCNDREIOMPZOSC-QIHGSZKUSA-N 342.395 1.899 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@@H](O)CCN1C(=O)OC(C)(C)C 1895875843 NVYKECABVYXLMB-QWRGUYRKSA-N 327.385 1.516 10 10 EDCE CN(C)CCN1CCN(Cc2cccc(Br)c2O)CC1 133871070 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CNC(=O)[C@H](C)NC[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1482370977 HLIUJKDMLPRSGO-QWRGUYRKSA-N 348.407 1.034 10 10 EDCE CN(C)CCC(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1720300651 DNDHKTNVGWELEU-UHFFFAOYSA-N 348.407 1.037 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)CCNC(N)=O)cc1C 1725134007 UUDLLSJMASCTEA-OLZOCXBDSA-N 336.436 1.045 10 10 EDCE CC(C)CCNC(=O)[C@@H]1CSCN1C(=O)c1cccc(O)c1O 1632673657 HJXPTZGXYVCKLY-LBPRGKRZSA-N 338.429 1.775 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)C(C)(C)C)cc(OC)n1 1572298546 XPFHDUQDMHYODP-NSHDSACASA-N 337.420 1.722 10 10 EDCE CC[C@@H](F)CN[C@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1734386365 UTCJUINAZJNPGO-YPMHNXCESA-N 339.371 1.277 10 10 EDCE CCN(CC)CCO[C@@H]1CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1587757812 SKCBQYOTZLIJKM-OAHLLOKOSA-N 336.432 1.600 10 10 EDCE COc1ccc(CNC[C@H]2C[C@H](NC(=O)CCN(C)C)C2)cc1C 1675786758 XWWJSIJKRXDHPZ-QAQDUYKDSA-N 333.476 1.940 10 10 EDCE CN(Cc1ccccc1O)c1nnc(C2CC2)n1Cc1nnn(C)n1 1768681005 CFUPKYYNRPUMEI-UHFFFAOYSA-N 340.391 1.069 10 10 EDCE C[C@@H](NC(=O)NCc1cccc(Cl)c1O)c1nnnn1C1CC1 1687371477 NMIVEPHNYVWHGQ-MRVPVSSYSA-N 336.783 1.927 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](C(=O)NCCCN=[N+]=[N-])[C@H]1CCOC1 1964885301 YVEVXYQKHRNFLS-RYUDHWBXSA-N 341.412 1.980 10 10 EDCE COc1ccc(-n2nnnc2CN(C)CCNC(=O)C2(C)CC2)cc1 1690943418 FFDOGIGXZUFPAQ-UHFFFAOYSA-N 344.419 1.019 10 10 EDCE O=C(CCn1c2c(c3ccccc31)CCCC2)N[C@@H]1CONC1=O 1850194297 UIGPDECHTYSONH-CQSZACIVSA-N 327.384 1.456 10 10 EDCE O=C1Nc2cc(N3CCC4(COC4)C3)c(Br)cc2[C@@H]1O 1915334708 UTZJZNYRPPBDKU-LBPRGKRZSA-N 339.189 1.661 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)[C@H](O)C2)c(Br)c1 233113270 FMFHRACCRIQWSC-ZIAGYGMSSA-N 329.238 1.491 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 1985101853 YOWLKRVNOKKZDC-WDEREUQCSA-N 327.385 1.373 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)NCC1(CN=[N+]=[N-])CC1 1990024339 OGEXKLNXCKWTKR-SNVBAGLBSA-N 327.385 1.469 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC[C@H](CO)C3)c(Br)cc21 167815026 BHZZQGVOCRHUIC-ISVAXAHUSA-N 340.221 1.480 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CC(N=[N+]=[N-])C2)C1 2010404948 VWOZTTPBMRTQRH-BONVTDFDSA-N 337.380 1.391 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H](COCc1ccccc1)C(=O)O 2034495766 VCEGAFFKAZQANJ-AWEZNQCLSA-N 345.351 1.427 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)c(Br)c1 2182554627 SENBRMLAJNFQGC-YUVXLREMSA-N 341.249 1.647 10 10 EDCE C[C@@H](c1cc(Br)ccc1O)N(C)[C@@H]1CC(=O)NC1=O 2114732088 JWPGPHZFAFMOJR-OIBJUYFYSA-N 327.178 1.563 10 10 EDCE NC1CN(C2CCN(Cc3cc(Br)ccc3O)CC2)C1 2233380188 UWFZOGNYRUAUER-UHFFFAOYSA-N 340.265 1.762 10 10 EDCE NCCc1n[nH]cc1C(=O)N1CCc2cc(Br)ccc21 2235314492 RNKTWJNTZHRPJE-UHFFFAOYSA-N 335.205 1.876 10 10 EDCE CC[C@@H](C)NCc1ccc(N2C[C@H](O)[C@H](O)C2)c(Br)c1 2240050220 VDMUGIQOADDXMF-KMUNFCNLSA-N 343.265 1.879 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@@H]1C(=O)Nc1ccc(N)cc1 2246471439 TZEBLQSQBNBINJ-ZIAGYGMSSA-N 335.404 1.968 10 10 EDCE NCc1ccc(N2CC(O)(C(F)(F)CO)C2)c(Br)c1 2272883982 DOIWPZUFDFUSAD-UHFFFAOYSA-N 337.164 1.087 10 10 EDCE CSc1ncc(CNC(=O)N(C)CC(F)(F)C(=O)O)s1 2295352234 YMTGEQOIYPMHGB-UHFFFAOYSA-N 325.362 1.726 10 10 EDCE O=S1(=O)C[C@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]21 2314965713 VMXANXHPEARWGE-SKDRFNHKSA-N 332.219 1.384 10 10 EDCE O=c1c2c(ccn1Cc1nc(Br)cs1)CCNC2 2320000448 YMVXKPWVKHBYNJ-UHFFFAOYSA-N 326.219 1.761 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C=C[C@@H](N)C2)c(O)c1Br 2352624594 KZWOLUKEDFBCNI-GXSJLCMTSA-N 325.206 1.983 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@@H]2C(N)=O)c(O)c1Br 2352646701 XFNAUVJFVUASMH-DTWKUNHWSA-N 327.178 1.201 10 10 EDCE COC(=O)[C@@H](C)CC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 178299958 AZVRPNNYWQFOOU-LBPRGKRZSA-N 338.379 1.682 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H]3C[C@H]4CC[C@@H]3O4)CC2)cc1 172162590 LYQHJVPCQLOFCV-ZACQAIPSSA-N 331.416 1.847 10 10 EDCE Cc1ccc([C@H](C)NCCN2CCN(c3ncccn3)CC2)c(O)c1 185065651 ZJJQWWFEHMTIEZ-INIZCTEOSA-N 341.459 1.963 10 10 EDCE CCNc1ncnc(N2CCN(c3ccc(OC)cc3)CC2)c1N 40707234 XOMKEQVATNVCJA-UHFFFAOYSA-N 328.420 1.826 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@H](OC)C2)c(Br)c1 395967000 MTRBFUWVAYHSJE-ZIAGYGMSSA-N 329.238 1.755 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](NC(N)=O)C2)cc1Br 723173800 POZXKWLLANHMRA-BDAKNGLRSA-N 327.226 1.716 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NCC[C@@H]3CCNC3)C2)cc1 818654639 DFQQHONXMVFGMJ-JKSUJKDBSA-N 346.475 1.820 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1CCN(C2CC2)C1=O 831925013 QWRUZOVGWCLRQV-NSHDSACASA-N 333.388 1.045 10 10 EDCE Cc1cc(N2CC[C@@H](OC(=O)c3ccc(C)c(O)c3O)C2=O)n(C)n1 744911034 WIMPXFXGHFPZQT-GFCCVEGCSA-N 345.355 1.410 10 10 EDCE NCCCNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 841843401 HHSAXRJVBTZURK-GFCCVEGCSA-N 342.390 1.905 10 10 EDCE CCOC(=O)C1(S(=O)(=O)NCc2c(O)cccc2F)CCC1 921451496 QQFHCUUVGMBKGV-UHFFFAOYSA-N 331.365 1.437 10 10 EDCE O=C(NCC[C@@H]1CCCS1(=O)=O)NCc1c(O)cccc1F 924011436 GRMIRPNYTPLLNZ-JTQLQIEISA-N 330.381 1.298 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C3(C(=O)N(C)C)CC3)C2)cc1 855224858 LNDWLFYLFVOUTL-CYBMUJFWSA-N 331.416 1.259 10 10 EDCE COc1ccc(N2CCN(CCNc3ccnc(CO)c3)CC2)cc1 858366754 BAMHBGSKDWJERZ-UHFFFAOYSA-N 342.443 1.817 10 10 EDCE CC(C)OCC(=O)NCc1cc(NC(=O)COC(C)C)ccc1O 923122589 DNVCFAWVLNECQE-UHFFFAOYSA-N 338.404 1.797 10 10 EDCE Cn1ccc(CNC(=O)NCc2cccc(Br)c2O)n1 764801241 SIALVERVAUCYSH-UHFFFAOYSA-N 339.193 1.888 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C/c1ccnn1CC1CCC1 865217088 JIFLJFQFEBZQBR-GXDHUFHOSA-N 332.429 1.986 10 10 EDCE Cn1nc(CC(=O)NCc2ccc(O)c(O)c2)c2ccccc2c1=O 778919695 JZTDKOCNEKCGPK-UHFFFAOYSA-N 339.351 1.204 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCO[C@@H](Cn3ccnn3)C2)c1O 878985212 GVJCBEKAQNVRNS-CQSZACIVSA-N 334.351 1.226 10 10 EDCE O=C1CSc2ncc(C(=O)NCc3ccc(O)cc3O)cc2N1 1142533425 JQNONZULDSGYQM-UHFFFAOYSA-N 331.353 1.467 10 10 EDCE O=C1N=C(N(CCO)CCO)S/C1=C/c1ccccc1Cl 1081155566 UFCOCCUUJWBQDO-FMIVXFBMSA-N 326.805 1.597 10 10 EDCE NC(=O)[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)c1ccccn1 1159194547 JWLJAUNOCGJDKA-CQSZACIVSA-N 343.364 1.664 10 10 EDCE CCOC[C@H](C)NC(=O)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1326358212 BPLZOTUGMFCFOU-CABCVRRESA-N 349.475 1.649 10 10 EDCE CN(Cc1ncc(Cl)n1C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329845055 ZDNHEKPRTZAIKR-UHFFFAOYSA-N 348.790 1.280 10 10 EDCE CN[C@@H](C)c1ccc(N2CCC(CO)(CO)C2)c(Br)c1 694726914 INIPERZXTPULSH-NSHDSACASA-N 343.265 1.911 10 10 EDCE CCN(CCc1ccccn1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1348595220 BZCLQMJNSLRMGV-UHFFFAOYSA-N 339.395 1.721 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)C2=COCCO2)cc1C 1272628642 MKDZBMVQUPHIOC-AWEZNQCLSA-N 334.416 1.876 10 10 EDCE O=C(CNC(=O)c1ccccc1Cl)NCc1ccc(O)cc1O 1299571583 ZTGFWYQVSAKARV-UHFFFAOYSA-N 334.759 1.797 10 10 EDCE O=C(Cn1cc(C(F)(F)F)ccc1=O)NCc1c(O)cccc1O 1456235848 NFLILQYLTXMYLO-UHFFFAOYSA-N 342.273 1.595 10 10 EDCE NC(=O)c1ccc2c(n1)N(C(=O)/C=C/c1cncc(F)c1)CCC2 1531635835 GFPWYTIZPRCNRY-ZZXKWVIFSA-N 326.331 1.707 10 10 EDCE Oc1cc(Br)ccc1CN[C@@]12CC[C@@H](C1)[C@@H](O)[C@@H]2O 2120394915 OWVYKKAKHPDPCS-ISTUKMMPSA-N 328.206 1.519 10 10 EDCE NCc1ccc(N2CC[C@@]3(CNC(=O)N3)C2)cc1Br 2121210388 CLSSETBGMWVIQN-CYBMUJFWSA-N 325.210 1.170 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCc3nnc(O)n3C2)c1 1631542337 HUBARQCLUMAHSQ-UWVGGRQHSA-N 332.360 1.138 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2CCN(C)C2=O)cc1C 1733120878 PQWONPONMNLBFR-INIZCTEOSA-N 347.459 1.420 10 10 EDCE CNC(=O)CCN(C)c1nnc(C)n1Cc1ccc(N(C)C)c(F)c1 1748249327 FQELLKDDGKOICB-UHFFFAOYSA-N 348.426 1.412 10 10 EDCE NC(=O)CSc1ccccc1C(=O)NCc1cccc(O)c1O 1593738873 BDILMNYWZXPPTD-UHFFFAOYSA-N 332.381 1.605 10 10 EDCE CCN1C[C@H](NCc2c(Br)ccc(OC)c2O)CC1=O 1964038670 IYXMKCJZFNKKAQ-SECBINFHSA-N 343.221 1.874 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCn3cnnc3[C@@H]2C)c([N+](=O)[O-])c1 1772930819 CFZIGGGFEHQAKF-QZPNVGJNSA-N 343.343 1.954 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(Br)c1 2126151822 AVRXTJXJPKRRAT-DHPDLVEQSA-N 328.206 1.119 10 10 EDCE COc1ccc(N2CCN(c3nnnn3CC(F)F)CC2)cc1F 1120162600 BBHNSVVICGCDLQ-UHFFFAOYSA-N 342.325 1.413 10 10 EDCE O=C(Cn1ncccc1=O)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1889979962 CPDHOEAAVXXGIL-RDJZCZTQSA-N 338.411 1.548 10 10 EDCE CCc1c(OCc2ccc(N)cc2)c(=O)ccn1CCOCCO 1857913586 PKTMLNAHFMVYPO-UHFFFAOYSA-N 332.400 1.581 10 10 EDCE Cc1c(O[C@H](C)C(=O)O)c(=O)ccn1CCOc1ccc(N)cc1 1857919559 LTWCOQWGFUDTRD-GFCCVEGCSA-N 332.356 1.670 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@](O)([C@H](N)c2ccccc2O)C1 1920324348 JWXZXPZQXYPXRR-PBHICJAKSA-N 338.404 1.390 10 10 EDCE CN(C)CCN(CC(=O)C(=O)C[C@H]1C[C@H](N)C1)C(=O)OC(C)(C)C 2003166906 JZOABBSQLKMZPM-JOCQHMNTSA-N 341.452 1.051 10 10 EDCE Nc1ccc(NS(=O)(=O)N2CC(OCc3ccccc3)C2)cc1 1977418446 ROGLUKFDJBMEBO-UHFFFAOYSA-N 333.413 1.827 10 10 EDCE CNCc1ccc(N2CC[C@](CO)(CCO)C2)cc1Br 2153356534 SBYJOEADCSEOEN-HNNXBMFYSA-N 343.265 1.740 10 10 EDCE OC[C@@H]1CN(c2ccc(CNC3CC3)c(Br)c2)C[C@@H]1O 316631559 ZJCRODJUNFVJHA-NHYWBVRUSA-N 341.249 1.491 10 10 EDCE CN(CCCS(C)(=O)=O)c1ccc(CN)cc1Br 710649477 IAIDQIWRVSJKDG-UHFFFAOYSA-N 335.267 1.779 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](NC(N)=O)C2)c(Br)c1 690740089 SHDAYQFTXUZUTD-SCZZXKLOSA-N 328.210 1.749 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](CNCc2cccc(O)c2O)C1 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CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)[C@H]1C[C@@H](O)C1 2224218023 KDJGBEPLZJXOND-KEHGIVTQSA-N 326.194 1.361 10 10 EDCE COC[C@@H](O)CN(C)c1ccc(OC)c(Br)c1OC 2226548142 ZGFKHLYSQNUGRG-VIFPVBQESA-N 334.210 1.910 10 10 EDCE Oc1cccc(Br)c1CN1CC(CN2CCNCC2)C1 2236845709 LOOAFKFOLDUVOD-UHFFFAOYSA-N 340.265 1.492 10 10 EDCE CN(Cc1nn(C)nc1Br)c1ccc(CN)cc1F 2226984499 GJGQFFRVJVPMKN-UHFFFAOYSA-N 328.189 1.812 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-])C(C)(C)O 2250342704 YOECZYHCHIUEJZ-DCAQKATOSA-N 341.412 1.998 10 10 EDCE CCn1c(O)nnc1CNCc1ccc(Br)cc1O 2351548076 ICNSEPWBYSFFBQ-UHFFFAOYSA-N 327.182 1.762 10 10 EDCE Cc1ccc(/C=C2\C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)cc1 4971166 LCXBOSVGVRPBKX-QMWDNBGHSA-N 348.409 1.616 10 10 EDCE CC(=O)N[C@H]1CCCN(C(=O)NCc2ccc3c(c2)CCCN3C)C1 57661522 KYASFOWZZIMHJN-KRWDZBQOSA-N 344.459 1.879 10 10 EDCE CN1CCO[C@@H](CNC(=O)NCc2ccc3c(c2)CCCN3C)C1 104798804 FNPRSDQGXWIWBK-INIZCTEOSA-N 332.448 1.199 10 10 EDCE Cc1cc(O)cc(=O)n1[C@@H](C)C(=O)NCc1ccc(N(C)C)cc1 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DIEZZMKAAICMNJ-ABAIWWIYSA-N 348.378 1.984 10 10 EDCE CN1C(=O)C(=Cc2cnc(-c3ccncc3)s2)C(=O)N(C)C1=O 753136800 ZIFDGHVZNOAXDC-UHFFFAOYSA-N 328.353 1.639 10 10 EDCE C[C@@H](NC(=O)N1CC2CC1(CN)C2)c1ccc(N2CCOCC2)cc1 851654542 DRJJLDPBADTLRJ-TZGCNFNXSA-N 344.459 1.717 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cc3c(C)nn(C)c3C)C2)cc1 855232300 PHYUCSWWCRJZLW-OAHLLOKOSA-N 342.443 1.983 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)Cc3ccc(O)nc3)C2)cc1 854981461 SQZGFRHVHBPDNI-OAHLLOKOSA-N 341.411 1.981 10 10 EDCE CCN(C)c1ccc([C@H](C)NC[C@@]23COCCN2C(=O)COC3)cc1 866556019 PONBWEDVXJEUMP-KXBFYZLASA-N 347.459 1.421 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)C3(O)CCC3)CC2)c(OC)c1 931530569 JNQKBQKEDBDSIJ-QGZVFWFLSA-N 336.432 1.102 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1 872258489 LDQHLYKLVWRHEO-UHOSZYNNSA-N 345.487 1.850 10 10 EDCE CN1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 788932109 LPSJYMRTEZYHPQ-MRXNPFEDSA-N 344.459 1.113 10 10 EDCE CCn1nnnc1-c1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 1136843458 RVCVSJZRWBWGGG-UHFFFAOYSA-N 339.355 1.952 10 10 EDCE CCCC[C@@H](NC(=O)NCC)C(=O)NCc1ccc(OC)cc1O 794377456 OGCKJRYNJXBVEV-CQSZACIVSA-N 337.420 1.895 10 10 EDCE CN[C@H](C)c1ccc(N2CCC2(CO)CO)c(Br)c1 1879986636 LABKTZPHFOXBRL-SNVBAGLBSA-N 329.238 1.663 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1=COCCC1 1323860288 RUUZYNRAUXYMMO-ZDUSSCGKSA-N 335.356 1.383 10 10 EDCE CN[C@@H](C)c1ccc(N2CCN(CCO)CC2)c(Br)c1 61695700 BRJFDLDKNJLTPG-LBPRGKRZSA-N 342.281 1.844 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)NCC[C@H]1CC1(F)F 1331078134 QEFIMWWRHAFGKI-VIFPVBQESA-N 349.428 1.903 10 10 EDCE Cc1cc(CCNC(=O)c2n[nH]c(O)n2)c(C)n1-c1ccccc1 1184098439 BMOBWFMDMASLCH-UHFFFAOYSA-N 325.372 1.890 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)CN(C)C(C)=O)C(C)C)cc1C 1268203713 DHCVLQZXRAVIFX-QGZVFWFLSA-N 349.475 1.712 10 10 EDCE CC[C@@H](CNC(=O)c1cn(C)c(O)n1)NCc1ccc(OC)c(C)c1 1267818954 QRVMNMZZSVMFGH-AWEZNQCLSA-N 346.431 1.741 10 10 EDCE COC[C@H](C)C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1703333931 YQNLOENZSMRPAT-NSHDSACASA-N 349.391 1.368 10 10 EDCE CC(C)c1nnc(N(C)Cc2ccccc2O)n1Cc1nnn(C)n1 1706280878 RUHRQBGYIMTVJW-UHFFFAOYSA-N 342.407 1.315 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CC(=O)N(C2CCCCC2)C1 1558175060 ZLAGXCYLRMGXIW-ZDUSSCGKSA-N 332.400 1.895 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)CN1CCOCC1 1628691305 SBRZXLQGWBFINY-LBPRGKRZSA-N 333.392 1.547 10 10 EDCE C[C@H](NC(=O)NCC(C)(C)CS(N)(=O)=O)c1ccccc1O 1637705561 GQTMLXIYYRPAIQ-JTQLQIEISA-N 329.422 1.067 10 10 EDCE CNC(=O)COc1cccc(CC(=O)NCc2ccc(O)cc2O)c1 1638353019 ZFSFPRBYSMVUOL-UHFFFAOYSA-N 344.367 1.082 10 10 EDCE COCCOC1(CNC(=O)c2c(F)ccc(O)c2O)CCOCC1 1638709054 QONKEZRUYPDJNL-UHFFFAOYSA-N 343.351 1.179 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)c2ccsn2)cc1 1575394344 UOAVFBSQNNKRJP-UHFFFAOYSA-N 346.372 1.465 10 10 EDCE O=C(CN1C(=O)CCc2ccccc21)NCc1cc(O)ccc1O 1651222975 VALYRCBESGHQTR-UHFFFAOYSA-N 326.352 1.693 10 10 EDCE O=C(NCc1ccnc(-n2cncn2)c1)N1Cc2cccc(O)c2C1 1683354466 FHXKQSMLXMMEOD-UHFFFAOYSA-N 336.355 1.593 10 10 EDCE Cc1cc(=O)[nH]cc1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 164698167 YGHZDCBNJVEZQD-UHFFFAOYSA-N 341.411 1.792 10 10 EDCE CC(C)[C@@H](O)CNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 154178883 AQURKNSKHQLPOF-YOEHRIQHSA-N 335.448 1.900 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)cc1Br 2146130680 BVSUDTFDYXYVLS-VCTAVGKDSA-N 342.281 1.841 10 10 EDCE C[C@@](Cc1cc(O)nc(O)c1)(NC(=O)OCc1ccccc1)C(=O)O 1952374850 UOKJXZOIPNYHHQ-KRWDZBQOSA-N 346.339 1.805 10 10 EDCE CO[C@H]1C[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)C1 2010388353 AEFYVMHOJGNKNQ-GRYCIOLGSA-N 339.396 1.922 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010390598 GFETZEMKBDWKKE-NWDGAFQWSA-N 340.428 1.600 10 10 EDCE O=C(O)[C@@H]1CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2048478003 ILFBLSDZMPXDTG-OAHLLOKOSA-N 330.384 1.470 10 10 EDCE Cc1cc(Br)cc(CN2C[C@H]3[C@@H](C2)OCCN3C)c1O 365610378 DKWYGUFCOJRYLV-UONOGXRCSA-N 341.249 1.978 10 10 EDCE Cn1cc([C@@H](NC(=O)OC(C)(C)C)C(=O)N2CC[C@H](N=[N+]=[N-])C2)cn1 2060635657 NXXBSJSZMKRAMB-NWDGAFQWSA-N 349.395 1.897 10 10 EDCE NCc1ccc(N2CC[C@@H]3CS(=O)(=O)C[C@@H]32)c(Br)c1 2094931693 VAWVXERABSFYFM-MFKMUULPSA-N 345.262 1.531 10 10 EDCE COc1ccc(N2CCC[C@@H]2[C@@H](O)CO)c(OC)c1Br 2234900144 RTHHNWAMRWUQKV-KOLCDFICSA-N 346.221 1.788 10 10 EDCE Cc1cc(N2CCOCC2)ccc1C=C1C(=O)NC(=S)N(C)C1=O 2294199227 GTWKFWXDCLXGPX-UHFFFAOYSA-N 345.424 1.088 10 10 EDCE Cn1cc(N2CCN(C(=O)C=Cc3ccc(O)c(O)c3)CC2)cn1 2308001768 NVVQKTOEBKMDBH-UHFFFAOYSA-N 328.372 1.193 10 10 EDCE NC(=O)C[C@H](C(=O)O)N1C(=O)C(=Cc2cccs2)SC1=S 2314542018 RQNURVCTBASUJR-SSDOTTSWSA-N 342.423 1.278 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)c(Br)c1 2336470991 NNANWOXQXLYXCX-DFAYQTQMSA-N 345.262 1.702 10 10 EDCE Cc1ccc(C(=O)N2CCN(C[C@H]3CCCCN3C)CC2)c(O)c1O 179486757 VNNKPSLGHNJNHL-OAHLLOKOSA-N 347.459 1.648 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(c2ccc(O)c(O)c2O)C[C@@H]1C(=O)O 1952829255 JJFVUWNMFPXGKH-ANRSDYALSA-N 325.317 1.628 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)N[C@H]1CCc2ncnn2C1 175123002 LLNATMUTNLIVER-ZDUSSCGKSA-N 341.415 1.677 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)CNC(=O)c1ccccn1 172527777 LEGRKTNZOOTFGF-UHFFFAOYSA-N 340.427 1.926 10 10 EDCE O=C(Nc1cccc(S(=O)(=O)O)c1)Nc1cc(O)c(O)c(O)c1 217278618 ONUOGZINBVOMHB-UHFFFAOYSA-N 340.313 1.694 10 10 EDCE COCCNC(=O)CNC(=O)c1cc(C)n(-c2ccccc2F)c1C 74216908 SSJURRVWTNXHCF-UHFFFAOYSA-N 347.390 1.726 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[C@@H]1CCOC1 807325498 IELUIZGPHHWASG-OAHLLOKOSA-N 333.432 1.254 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CCNC(=O)CC1 819698550 NFPCOPCLQAMXEJ-CYBMUJFWSA-N 348.399 1.200 10 10 EDCE C[C@@H](NC(=O)[C@H]1CCNC(=O)CC1)c1ccc(N2CCOCC2)cc1 815114218 KUUFSAMPYFKVLH-GDBMZVCRSA-N 345.443 1.617 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3CC[C@@H]3C)CC2)cc1 819311868 PPOCYWUYMLSBIM-KVSKMBFKSA-N 333.476 1.566 10 10 EDCE COc1ccc(N2CCN(C(=O)C(C)(C)C(=O)O)CC2)c(OC)c1 902412653 MXVKCPHVYQZXET-UHFFFAOYSA-N 336.388 1.463 10 10 EDCE COc1cc(C)cc(CN2CCS(=O)(=O)[C@H]3CCC[C@@H]32)c1O 840144983 KXZDASKOEIHKTM-ZFWWWQNUSA-N 325.430 1.861 10 10 EDCE CCNC(=O)C[C@@H]1CCCCN1C(=O)C(=O)Nc1ccc(N)cc1 841128615 DWCBOIZFFXDQHI-AWEZNQCLSA-N 332.404 1.115 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)C[C@H](C)OC)C2)cc1 849416303 OLKOKIJJXWZLBL-QWHCGFSZSA-N 328.434 1.228 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN3CCOC[C@H]3C2)c([N+](=O)[O-])c1 754081733 JCVBLQCXSSFVJG-PKXJPQMGSA-N 347.371 1.302 10 10 EDCE CCOC(=O)[C@@H](CSC)NC(=O)/C=C/c1ccc(O)c(O)c1 928294105 VSBBEDOWJDRGLY-OKPNEXGHSA-N 325.386 1.522 10 10 EDCE C/C=C/CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 858889678 IEVKJNQSVNORDJ-XYBNCVKDSA-N 330.432 1.764 10 10 EDCE CC(=O)C(=O)COC(=O)/C=C\[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 869740732 QQFOPQGUZRGTAF-WSROAFLRSA-N 339.388 1.891 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)C[C@H]1C 865050179 BJQWOUDXTPFJOO-VCTAVGKDSA-N 338.379 1.475 10 10 EDCE COCc1cc(NC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ncn1 789846019 XMUSAKOCAYLASK-JTQLQIEISA-N 332.360 1.787 10 10 EDCE CN1CCN(c2ccc(CNC(=O)/C=C/[C@H]3CCCO3)cc2)CC1 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IAQKABJYXPCXMZ-QMMMGPOBSA-N 342.302 1.025 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2CN(C(=O)CCCF)C2)cc1 1704577660 XJVOBXZCQKTUGE-UHFFFAOYSA-N 349.366 1.787 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2ccc(C(N)=O)[nH]2)cc1C 1483166867 BVDJWGZHFSNOAS-GFCCVEGCSA-N 344.415 1.339 10 10 EDCE CC[C@@H](CNC(=O)c1ccc(O)nn1)NCc1ccc(OC)c(C)c1 1481786321 IPGWQTKGLATNIF-AWEZNQCLSA-N 344.415 1.797 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1cccc(CN2CC[C@H](O)C2)c1 1556738674 PEWQOBFCHPWCNM-INIZCTEOSA-N 342.395 1.846 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(O)CCN(C)C1 1498674683 HOJMNAQZWJIFST-SFHVURJKSA-N 345.447 1.249 10 10 EDCE COC(=O)NCC(=O)N[C@H]1C[C@H](NCc2ccc(OC)c(C)c2)C1 1566783239 AAIMOGUSZIQYOQ-HDJSIYSDSA-N 335.404 1.096 10 10 EDCE Cc1nc(Cn2cc(C(=O)N[C@@H](C)c3ccccc3O)nn2)no1 1587451208 LVPXWCZLVXLHBG-VIFPVBQESA-N 328.332 1.214 10 10 EDCE O=C(c1ns[nH]c1=O)N(Cc1ccco1)Cc1ccccc1O 1588146456 XWFFYZXCCFRHPE-UHFFFAOYSA-N 331.353 1.973 10 10 EDCE COc1ncc(/C=C/C(=O)N2CC(=O)Nc3cc(F)c(F)cc32)cn1 1584781605 BUHCLWIKGJQWAV-NSCUHMNNSA-N 346.293 1.762 10 10 EDCE CC1(C)[C@@H](O)[C@@H](O)CN1c1ccc(CN)c(Br)c1F 2124800331 KHOYHRYLOQGXLZ-CABZTGNLSA-N 333.201 1.367 10 10 EDCE COC(=O)N(C)CCNCc1c(Br)ccc(OC)c1O 1964074562 WHZCPCUCVNTOII-UHFFFAOYSA-N 347.209 1.951 10 10 EDCE CNC(=O)NCCCNCc1cc(Br)cc(F)c1O 1964071318 SDAOUXHLJWLOCT-UHFFFAOYSA-N 334.189 1.703 10 10 EDCE C[C@@H]1CN(Cc2cc(Br)ccc2O)[C@H](C(=O)O)CO1 1964732651 MHKDBRGHSAHJKB-KCJUWKMLSA-N 330.178 1.829 10 10 EDCE CCCC(=O)N[C@@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1699393992 GWRCTGUNUNNEGJ-LBPRGKRZSA-N 332.408 1.065 10 10 EDCE CCc1nnc(NC(=O)CCN2C(=O)[C@@H](C)SC2=S)s1 11635979 IASUNVQDYOJBPC-ZCFIWIBFSA-N 330.460 1.678 10 10 EDCE O=C(O)COCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866081718 YGEZEFDZDMAHIY-UHFFFAOYSA-N 339.303 1.502 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCN[C@@H]2COC[C@@H]21 2132580032 RTCHBITYHLVWJW-NEPJUHHUSA-N 331.185 1.466 10 10 EDCE C[C@@](O)(CO)[C@H]1CCN(c2ccc(CO)c(Br)c2)C1 2138092579 YWWXSKBGNUCGKC-SMDDNHRTSA-N 330.222 1.511 10 10 EDCE COC(=O)N[C@H]1CCN(c2ccc(CN)c(Br)c2)C1 228155374 YUJRPPNDOKPCHA-JTQLQIEISA-N 328.210 1.843 10 10 EDCE CCNCc1ccc(N2CCNC(=O)[C@H]2C)cc1Br 233530653 HTQUSRUGDBSHJW-SNVBAGLBSA-N 326.238 1.883 10 10 EDCE C[C@@H](C(=O)Nc1ccc(N)cc1)N(CC(N)=O)Cc1ccccc1 1946832816 KVDLFKWSVAJMBC-ZDUSSCGKSA-N 326.400 1.583 10 10 EDCE Oc1ccccc1CNCCn1cc(I)cn1 1947895550 GIXRRACKBYTTCU-UHFFFAOYSA-N 343.168 1.983 10 10 EDCE CO[C@@H](CN)C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951993723 QSKCJQYPMXKCNN-CHWSQXEVSA-N 340.420 1.897 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985094609 RGFLLUVIFYJHMH-MNOVXSKESA-N 327.385 1.827 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)NCC1(CN=[N+]=[N-])CC1 1985103198 RMNBIFQNZYBGMS-UWVGGRQHSA-N 327.385 1.467 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1CC(=O)NCCCN=[N+]=[N-] 1987645739 FSRNDJLUMJKZHS-MNOVXSKESA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1990024744 UWFUHWHPCTXYGR-MNOVXSKESA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1990033324 UWFUHWHPCTXYGR-MNOVXSKESA-N 327.385 1.563 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCO[C@@H]4C[C@@H]43)c(Br)cc21 2171803823 YVUGCHDNWIHRBC-XQQFMLRXSA-N 338.205 1.639 10 10 EDCE O=C1CC[C@@H](NCc2cc(Br)cc(F)c2O)C(=O)N1 715792976 UDUVIBGRDVUTHK-SECBINFHSA-N 331.141 1.189 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@@H](CO)Cc4ccccc43)c2n1 2064681684 BZAOFFOSQPXRMA-LBPRGKRZSA-N 338.367 1.555 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4COCC[C@@H]43)c(Br)cc2[C@@H]1O 2193275677 PTNJXMCTPRZXEF-RESLBDFXSA-N 339.189 1.660 10 10 EDCE COC(=O)NC[C@H]1CCN1c1ccc(CN)c(Br)c1F 2187295059 WACSDNVQOLQNML-SECBINFHSA-N 346.200 1.982 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2104412758 XNRMVXRKWXLDSE-VJWDYSCTSA-N 328.206 1.433 10 10 EDCE NCc1ccc(N2C[C@@H]3[C@H](CCS3(=O)=O)C2)c(Br)c1 2088819819 MTQLERJBDBUIKW-ZWNOBZJWSA-N 345.262 1.531 10 10 EDCE COc1ccc(N2CCC2(CO)CO)c(OC)c1Br 2226549123 LFLQGZDUBVYFQY-UHFFFAOYSA-N 332.194 1.400 10 10 EDCE C[C@@H]1O[C@]2(C(=O)N3CC(N=[N+]=[N-])C3)C[C@@]1(NC(=O)OC(C)(C)C)C2 2247300509 NDESMWLGXVEBAX-LNHVQRHZSA-N 337.380 1.722 10 10 EDCE CSc1ncc(CNS(=O)(=O)CCC(F)(F)CO)s1 2269122661 COYZXIZFTQDHMN-UHFFFAOYSA-N 332.419 1.302 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cc3cncn3C)CC2)cc1C 1277224621 KGBCIMVJGCOQLL-UHFFFAOYSA-N 342.443 1.718 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N(C)Cc2ccccc2O)c1 120282280 HZBCUOTYXSJIPN-BQYQJAHWSA-N 325.368 1.819 10 10 EDCE NC(=O)[C@H]1Cc2ccccc2CN1Cc1cc2c(cc1O)OCO2 126346246 BHYDLEACSDPMJI-CQSZACIVSA-N 326.352 1.533 10 10 EDCE NCc1ccc(-c2csc(NS(=O)(=O)c3c[nH]cn3)n2)s1 70416326 JJCPYUXZSKDECY-UHFFFAOYSA-N 341.443 1.854 10 10 EDCE COc1ccc(N2CCN(c3ccc(NC(C)=O)nn3)CC2)cc1 243358684 LZBLIEVPFNQABG-UHFFFAOYSA-N 327.388 1.770 10 10 EDCE Cn1cc([N+](=O)[O-])c(C(=O)NCc2ccc(N3CCCC3)cc2)n1 271374293 IPIBPLBRTQAJID-UHFFFAOYSA-N 329.360 1.859 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](N)[C@H]2CCCO2)c(O)c1Br 2381129985 SCBAKYHAQQPYHL-PWSUYJOCSA-N 343.221 1.586 10 10 EDCE CO[C@@H](CCN)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380764070 AKOXFZFAJLFDED-NSHDSACASA-N 345.237 1.785 10 10 EDCE CC(C)(C)C(=O)NCC(=O)NCc1cc(Br)ccc1O 804737237 GPBQCGXTPIHIOS-UHFFFAOYSA-N 343.221 1.933 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C3=COCCC3)cc2)C1 727767638 IJNWBIDTYVBGLQ-HNNXBMFYSA-N 343.427 1.699 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H](C)[C@@H](C)O1 839387274 JJSGKJXKUVCNPS-RBSFLKMASA-N 347.459 1.735 10 10 EDCE CCOC(=O)CN1C(=O)/C(=C\c2cnnn2CC)c2ccccc21 841484744 BIWGKJBAPGMBNO-ZROIWOOFSA-N 326.356 1.748 10 10 EDCE CO[C@H](CNCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCOC1 850342909 OKPKVEFUAMXDOB-MAUKXSAKSA-N 338.423 1.803 10 10 EDCE COC(=O)[C@@H]1CC[C@H](C(=O)N2CCN(c3ccc(OC)cc3)CC2)O1 858128906 FWYWFBUPQWJFDH-CVEARBPZSA-N 348.399 1.064 10 10 EDCE CCOc1cccc(CNCCS(=O)(=O)CC(F)(F)F)c1O 850364058 QODNDAKQKNJPKM-UHFFFAOYSA-N 341.351 1.858 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C[C@@H](C)O1 853862864 KRJNYPQYDVZYDI-HUUCEWRRSA-N 347.459 1.967 10 10 EDCE COC[C@H](NC(=O)NCc1cccc(OC)c1O)C1CCOCC1 854319497 MCQWEMNAOVAISN-AWEZNQCLSA-N 338.404 1.642 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cnc(NC)cn1 862039871 RWZQSKGLJGNIMC-UHFFFAOYSA-N 344.371 1.429 10 10 EDCE CCO[C@H](C(=O)N1CCOc2cc(N(C)C)ccc21)[C@@H]1CCOC1 866208875 WIVMMDCRNGFOEO-DYVFJYSZSA-N 334.416 1.920 10 10 EDCE Cc1cc(NC(=O)CSCC(=O)N2Cc3cccc(O)c3C2)no1 871198401 JDLPTQVAYKGUNY-UHFFFAOYSA-N 347.396 1.903 10 10 EDCE Nc1ccc(CS(=O)(=O)N[C@@H]2CCCCC23OCCO3)cc1 1876528683 FGPPZELJHCEKOV-CQSZACIVSA-N 326.418 1.374 10 10 EDCE CN(C)c1cc(F)c(CN[C@@H]2C(=O)NCC23CCOCC3)cc1F 895765907 PLOHSEYDHDUJFA-OAHLLOKOSA-N 339.386 1.416 10 10 EDCE CNCc1ccc(N2CCO[C@@H]3COC[C@H]32)cc1Br 1877659729 PABRAXTYBNASPL-ZIAGYGMSSA-N 327.222 1.773 10 10 EDCE CC[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)C[C@]2(CCOC2)O1 794700803 HTBVHFCEBMOPKZ-SKDZVZGDSA-N 335.400 1.588 10 10 EDCE O=C(CSc1nnnn1C1CCCC1)NCc1c(O)cccc1O 1178906208 ZAYCUFHKWOZHEQ-UHFFFAOYSA-N 349.416 1.608 10 10 EDCE Cc1cc(CC(=O)N2CC(C)(C(N)=O)C2)c(C)n1-c1ccccc1 1329338082 GYYJZQOJDGUVDI-UHFFFAOYSA-N 325.412 1.970 10 10 EDCE COC(=O)[C@H](NCCCN=[N+]=[N-])c1cn(C)nc1Br 712432171 AGZPGUXAHSRQQT-MRVPVSSYSA-N 331.174 1.687 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@]23CCC[C@@H]2C3)cc1F 1332670148 QXRNNEBJDZBHFV-ACJLOTCBSA-N 333.407 1.814 10 10 EDCE COCCN(CCF)C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1261704909 GSIDTQRCKDIYMQ-ZDUSSCGKSA-N 339.411 1.374 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc([C@H]2CCCN2C)[nH]n1 1447560060 FHZRVSUVCGEZKK-XHDPSFHLSA-N 344.415 1.949 10 10 EDCE O=C(Cc1nc(C2CCOCC2)n[nH]1)N1Cc2cccc(O)c2C1 1528650409 URVQOTYTGDMZHW-UHFFFAOYSA-N 328.372 1.489 10 10 EDCE COc1cc(OC)c(CNC(=O)Cc2ccc(O)c(O)c2)c(OC)c1 1544506593 VBKLSXGXVMDDBC-UHFFFAOYSA-N 347.367 1.983 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)Cc2occc2C)cc1C 1486032476 BVSASHRJDDNTKY-MRXNPFEDSA-N 346.427 1.714 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)CC[C@H]2CC[C@@H](C(N)=O)O2)c1 1622779037 HJLLZVCCDBCFSY-RWSFTLGLSA-N 336.388 1.391 10 10 EDCE C[C@H](NC(=O)[C@H](c1cncn1C)N(C)C)c1ccc(N(C)C)cc1 1556260743 RNXOUDJOATXAJN-GUYCJALGSA-N 329.448 1.966 10 10 EDCE CN(C)C(=O)C[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccccc1 1569425087 VWFSNAKMZNTYIH-HNNXBMFYSA-N 342.395 1.976 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@]2(F)CCOC2)cc1C 1732891559 LAQGPXMBNFWFFL-OAJJDEHYSA-N 336.407 1.894 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H](NC(=O)C2CC2)C2CC2)cc1 1737392053 HFANFGHIAHWFJD-AWEZNQCLSA-N 343.387 1.884 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2ccnn2C)cc1C 1734316148 AOMGHSUOKAPGOM-CQSZACIVSA-N 330.432 1.987 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CCCNC2=O)cc1C 1666927712 MZGJTYNOESOWAK-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H]2[C@@H]1[C@H]2C(=O)NCCCCN=[N+]=[N-] 1964944417 PUOQIQCURGFEHG-GRYCIOLGSA-N 339.396 1.827 10 10 EDCE CC(C)CC(=O)N[C@H](C(=O)NCCc1ccc(O)c(O)c1)C(C)C 154008723 MLZGMMIKAUKKGP-KRWDZBQOSA-N 336.432 1.943 10 10 EDCE COc1ccc(CN2CCCC[C@H]2CCNS(C)(=O)=O)c(O)c1 159460686 HIWFHOBHSDITLK-AWEZNQCLSA-N 342.461 1.695 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)N1CC[C@H](CN=[N+]=[N-])C1 1912193412 NXYDZUGAFMMSJQ-SSDOTTSWSA-N 349.214 1.504 10 10 EDCE O=C(O)CC1(O)CCN(Cc2ccc(Br)cc2O)CC1 1968189163 HMBMXTYVNIBVOR-UHFFFAOYSA-N 344.205 1.956 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985102029 AWFFHYWPECTCTE-DCAQKATOSA-N 327.385 1.419 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)CO1 2010388561 DAZNJQIBZMBFQE-WOPDTQHZSA-N 339.396 1.827 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCCC[C@@H]3CO)c(Br)cc21 92775386 QDRQCKLTWXXGSZ-AMIZOPFISA-N 340.221 1.752 10 10 EDCE CC[C@H]1C(=O)NCCN1c1cc(Br)c(CN)cc1F 387913474 AGJKKRRPXOLNGC-NSHDSACASA-N 330.201 1.762 10 10 EDCE CN1CCN(C2CN(c3ccc(CO)cc3Br)C2)CC1 697968598 NIUJVKJBDJKQNU-UHFFFAOYSA-N 340.265 1.377 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@]2(C)CO)cc1Br 698114380 KUYHWEAOGQCRNJ-DZGCQCFKSA-N 343.265 1.881 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC4(CCCC4)OC[C@H]3C)c2n1 2064118932 DDXVXFAJECKVMA-GFCCVEGCSA-N 330.388 1.917 10 10 EDCE C[C@@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)cc1Br 2190457642 KNLOKVZNYDKAAK-MGXFYRGHSA-N 341.249 1.932 10 10 EDCE NCc1ccc(N2CC[C@@H](C(CO)CO)C2)c(Br)c1 2114235935 OEFXATUBEOQXTA-LLVKDONJSA-N 329.238 1.335 10 10 EDCE COC(=O)C1(O)CN(c2ccc(OC)c(Br)c2OC)C1 2234901675 INMWNKGXBMDNAY-UHFFFAOYSA-N 346.177 1.190 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])n1 2225792690 PGXFVKPGALBINY-HTQZYQBOSA-N 349.214 1.692 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2236633506 AOQWGOAINJUKTC-SDDRHHMPSA-N 344.249 1.930 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]12CCO[C@H]1CN(C(=O)OC(C)(C)C)C2 2253350773 LFTXIWBPDFUZGO-XHDPSFHLSA-N 339.396 1.781 10 10 EDCE C[C@H]1CN(Cc2c(O)cccc2Br)CC2(CNC2)O1 2272932502 WYMCHELFWAPYSZ-JTQLQIEISA-N 327.222 1.717 10 10 EDCE COc1ccc(OC)c(C=C2SC(=S)N(CC(=O)O)C2=O)c1 2293031339 VHMUNLHTNCYFPB-UHFFFAOYSA-N 339.394 1.990 10 10 EDCE CC(=O)N1CC[C@H](OC(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2297815674 OENSXSYDMPWMPH-SFHVURJKSA-N 344.411 1.700 10 10 EDCE COC(=O)c1sc(NN(C)S(=O)(=O)C(C)C)nc1Cl 2339721365 RBWBBSBTTWIZGI-UHFFFAOYSA-N 327.815 1.580 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](NC(=O)CCCF)C2)cc1 1352921319 SMAVOMRXJXFPOL-CYBMUJFWSA-N 349.366 1.929 10 10 EDCE Cn1nccc1CCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 120179583 MYHBCYJWDVPPFC-UHFFFAOYSA-N 346.406 1.645 10 10 EDCE CCOC(=O)N1CCC(NC(=O)Nc2cc(O)c(O)c(O)c2)CC1 217278914 FFDCEABNTQHTAN-UHFFFAOYSA-N 339.348 1.546 10 10 EDCE O=C(O)/C=C/c1ccc(N2CCNC(=O)CC2)cc1Br 236467030 ZFBKDWPZLVKDAE-DUXPYHPUSA-N 339.189 1.873 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@@H]3CCOC[C@@H]3C)CC2)cc1 277282364 BFUFOEQUZBRLCK-MAUKXSAKSA-N 347.459 1.358 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C=C[C@@H]2C(=O)O)c(O)c1Br 2380721470 KUCBECGDDKUTTA-ZJUUUORDSA-N 340.173 1.966 10 10 EDCE Cc1ccc(CN2CCN(CCO)C(=O)C2)c(O)c1Br 2380802963 FYIHRTPDDCCCEE-UHFFFAOYSA-N 343.221 1.100 10 10 EDCE CC(=O)C(=O)COC(=O)CNC(=O)c1ccc(Cl)c(Cl)c1 808495449 QHFMJVUIFAJSHS-UHFFFAOYSA-N 332.139 1.425 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)[C@@H](CO)CC(C)C 807100934 QYCAUBXBMOQDPC-QGZVFWFLSA-N 349.475 1.543 10 10 EDCE CNS(=O)(=O)NC1CCN(Cc2cc(Cl)cc(C)c2O)CC1 811500043 SKGBOIJRBSWZMT-UHFFFAOYSA-N 347.868 1.372 10 10 EDCE CCOc1ccccc1N(C)C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 127539261 HCGHETBYJDJWAB-ZHACJKMWSA-N 343.383 1.159 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@H]2CC[C@H]1CN2 817876615 IYMHWWPFPBGAKU-WBVHZDCISA-N 330.432 1.169 10 10 EDCE CC1CCN(c2ccc(CNC(=O)CCOC3CNC3)cc2)CC1 828987700 CHFBESWORNXXRH-UHFFFAOYSA-N 331.460 1.918 10 10 EDCE CCc1nc2n(n1)CCC[C@H]2NC(=O)/C=C\c1ccc(O)c(O)c1 588407738 MDJXHGOHBWKVBW-XYLWRLHESA-N 328.372 1.916 10 10 EDCE COC[C@@H](C)CS(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849416308 OLLRGCNLSILDNV-ZIAGYGMSSA-N 342.461 1.476 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC2CCC1(CN)CC2 848601133 QRQKXPKNICACLS-UHFFFAOYSA-N 344.503 1.914 10 10 EDCE CN1CCC[C@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 852187450 OLCCAUUHBDSMAZ-INIZCTEOSA-N 346.475 1.541 10 10 EDCE COC(=O)c1cc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)on1 855224970 HAUGYHQZRCZESR-NSHDSACASA-N 345.355 1.479 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)CCc3cn(C)nn3)C2)cc1 854981462 STCHMTUDQQHCDT-AWEZNQCLSA-N 343.431 1.399 10 10 EDCE CC1(C)OC[C@@H]2C[C@]21NC(=O)c1cc(NS(C)(=O)=O)ccc1O 862688984 JMFHPMLTIMMXET-VFZGTOFNSA-N 340.401 1.061 10 10 EDCE C[C@@]1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H]2C[C@@H]2C1 863124654 ZFYRCRNWZWHECB-CDMJZVDBSA-N 338.429 1.930 10 10 EDCE C[C@H](NS(=O)(=O)c1cnn([C@H]2CCOC2)c1)c1ccccc1O 867834619 RWXKFNKHGXLWMY-RYUDHWBXSA-N 337.401 1.590 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@](O)(C4CC4)C3)C2)cc1 1118545086 IFZADAZVBQXAET-BEFAXECRSA-N 345.443 1.830 10 10 EDCE O=C1CC(C[C@H]2CCCO2)=NN1C1=NS(=O)(=O)c2ccccc21 871946955 LIPPZZAHUSFUMY-LLVKDONJSA-N 333.369 1.293 10 10 EDCE COc1ccc(CNC(=O)c2cc(Cn3cc(C)cn3)on2)c(O)c1 794388422 SQLOGSHFIZRKCM-UHFFFAOYSA-N 342.355 1.872 10 10 EDCE CS(=O)(=O)c1ccc(N)c(C(=O)NCc2ccc(O)c(O)c2)c1 1150378146 PAWVRMCVDHOQPL-UHFFFAOYSA-N 336.369 1.014 10 10 EDCE CC(C)(C)OC(=O)N1CCN([S@](C)(=O)=NCCN=[N+]=[N-])CC1 1962299346 MKNDHNXLBSEDSH-JOCHJYFZSA-N 332.430 1.862 10 10 EDCE C[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)[C@@H]1CCO 1329872284 APYDTUVHETWMJL-SWLSCSKDSA-N 332.400 1.244 10 10 EDCE CCNCc1ccc(N2CC(O)(C(=O)OC)C2)cc1Br 714464829 QLESUJMBAOMPAD-UHFFFAOYSA-N 343.221 1.283 10 10 EDCE CN1CCN(c2ccc(CNCC[C@@H]3CNC(=O)C3)cc2F)CC1 1334329260 ACDAOMOSIGAUJJ-HNNXBMFYSA-N 334.439 1.193 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCOCC[C@@H]2C)cc1 1335431866 IIDQGNJSPIFJKS-HNNXBMFYSA-N 347.459 1.786 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(C)CN(C)C1=O 1290719458 SWSJTRSEPAKMNE-QGZVFWFLSA-N 329.404 1.407 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@]2(C)CCNC2=O)cc1C 1715359530 HRDDEERXSFFGSU-LIRRHRJNSA-N 347.459 1.466 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H](C)n2cccc2)cc1C 1715583099 VTWYDUGHNYMOID-DOTOQJQBSA-N 345.443 1.633 10 10 EDCE Cc1ccc(C(=O)Nc2cccc(O[C@@H]3CC(=O)N3)c2)c(O)c1O 1639038471 GFXCETKMBLXLGC-CQSZACIVSA-N 328.324 1.883 10 10 EDCE Cc1ccc(S(=O)(=O)NCC(=O)N[C@H](C)c2ccccc2O)cc1 1635794011 RYFPJXHXUYIYJX-CYBMUJFWSA-N 348.424 1.856 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)Cn2cncn2)C2CC2)cc1C 1723352037 YLWVLMDRDSVCIF-INIZCTEOSA-N 343.431 1.280 10 10 EDCE C[C@H](NC(=O)C1CCC2(CC1)NC(=O)NC2=O)c1ccccc1O 1643741795 ALOLBXKIBGLKJJ-KCCQOBMMSA-N 331.372 1.338 10 10 EDCE CNCc1ccc(N(C)[C@H]2CCC(=O)NC2)c(Br)c1 2127086516 JXPFWUUIVQBGLI-NSHDSACASA-N 326.238 1.883 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)c2cn(C)nn2)c2nccn2C)cc1 1866162260 RMFBZPWRBPGDEL-HNNXBMFYSA-N 339.403 1.134 10 10 EDCE Nc1ccc(OCCN2CCC[C@H](NC(=O)C(F)(F)F)C2)cc1 586063436 LKVIRRMQOKQUMB-LBPRGKRZSA-N 331.338 1.791 10 10 EDCE [N-]=[N+]=NCC1CCN(C[C@H](O)CN2C(=O)c3ccccc3C2=O)CC1 1912210382 IULATPIGTTYRLI-ZDUSSCGKSA-N 343.387 1.666 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NCc1ccc(O)c(O)c1O 1944916645 BFBYDCGIPQZFPT-GHMZBOCLSA-N 340.376 1.185 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)CO1 1985094893 VPHCGZAYQFLDIA-MWLCHTKSSA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1987701647 IXUWBNDQHQLBBH-GHMZBOCLSA-N 327.385 1.278 10 10 EDCE O=C1NC(=O)[C@@H](CCCNCc2ccc(Br)cc2O)N1 2150333476 YXOVRQBUGHXBMQ-SNVBAGLBSA-N 342.193 1.233 10 10 EDCE O=C1NC(=O)[C@@H](CCCNCc2cccc(Br)c2O)N1 2150331651 VSRKWBDNOFTSSE-SNVBAGLBSA-N 342.193 1.233 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)c(Br)c1 2149906805 BBIRGAGUJPWNIS-CYZMBNFOSA-N 344.249 1.930 10 10 EDCE Cc1cccc(CNC(=O)CN(CCO)C(=O)OC(C)(C)C)c1O 2024804861 MBKVMWXVLARDKO-UHFFFAOYSA-N 338.404 1.546 10 10 EDCE O=C(O)C[C@H](COCc1ccccc1)NC(=O)c1cc(O)nc(O)c1 2035489990 XXPXYPYATCVXRM-CYBMUJFWSA-N 346.339 1.283 10 10 EDCE Cn1ncc(Br)c1C(=O)NCc1cc(N)ccc1O 693065337 NGXCSUWIWDQJPE-UHFFFAOYSA-N 325.166 1.400 10 10 EDCE CN(C)C1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 382292680 NFJQRYFIZCKWJY-LBPRGKRZSA-N 325.210 1.151 10 10 EDCE Cc1cnn([C@@H]2CCN(C(=O)c3cnn4c(O)cc(C)nc34)C2)c1 2062576730 RJBZJMMHNSBUQF-GFCCVEGCSA-N 326.360 1.335 10 10 EDCE O=C1Nc2cc(N3CC([C@H](F)CO)C3)c(Br)cc2[C@H]1O 2166893315 BDXYDHOCIWSRPT-BXKDBHETSA-N 345.168 1.201 10 10 EDCE CNCc1ccc(N2CCO[C@H](CN(C)C)C2)cc1Br 2170362876 QWVVQFCCXYBNIS-CQSZACIVSA-N 342.281 1.935 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C[C@H](O)CN2CCc2ccc(N)cc2)C1 2066539206 HXDMPFVEHDVWDK-INIZCTEOSA-N 347.459 1.867 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OCCC[C@@]2(C(=O)NCCN=[N+]=[N-])C1 2215602378 PXWCJOFTZZVSOI-XHDPSFHLSA-N 339.396 1.829 10 10 EDCE NCc1ccc(N2C[C@H]3CCO[C@@]3(CO)C2)c(Br)c1 2231371522 MFHPKCKCEIJGSN-BXUZGUMPSA-N 327.222 1.495 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3COC[C@]3(CO)C2)cc1Br 2234566789 MDNMCEHPEREWNM-ZIBATOQPSA-N 342.233 1.948 10 10 EDCE CSc1ncc(CNS(=O)(=O)C2CC3(C2)OCCO3)s1 2252832376 RIVIVLNECCVEBL-UHFFFAOYSA-N 336.460 1.190 10 10 EDCE O=C(O)C[C@H](C(=O)O)N1C(=O)C(=Cc2ccccc2)SC1=S 2293091937 ZTDKNVSCNHFUTP-SECBINFHSA-N 337.378 1.816 10 10 EDCE C[S@](=O)CCCNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297527957 ANOVKFUOZNGPNT-QHCPKHFHSA-N 336.457 1.421 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H]2CC[C@@]1(COc1nnc(=N)[nH]n1)C2 2298033834 YWHCVVCOVMLLBL-YHAQOWFVSA-N 336.396 1.141 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H](CCN(C)C)NC(=O)OC(C)(C)C 2300529656 DKCUXCSWUOQLNN-GFCCVEGCSA-N 342.444 1.990 10 10 EDCE Cc1ccc(CN[C@@H](C)CS(N)(=O)=O)c(O)c1Br 2327792796 NVVSPEKLNVBFJQ-QMMMGPOBSA-N 337.239 1.230 10 10 EDCE CN(Cc1cc(Br)ccc1O)[C@@H]1COC[C@H]1C(=O)O 300438111 QVTMPUAMZIGONX-GHMZBOCLSA-N 330.178 1.686 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NCc1ccc(O)c(O)c1 305504452 RKIQTEVIWLQFCA-DOMZBBRYSA-N 338.404 1.822 10 10 EDCE Cc1ccc([C@@H](C)NCCS(=O)(=O)N2CCSCC2)c(O)c1 185395298 QQDIAIIUVONNAB-CYBMUJFWSA-N 344.502 1.730 10 10 EDCE COc1cccc(/C=C2/SC(=S)N(CCO)C2=O)c1OC 210386433 LDINFYHSAQNRMP-DHZHZOJOSA-N 325.411 1.897 10 10 EDCE OCc1ccc(N2CC3(CCOCC3)[C@H]2CO)c(Br)c1 2381106837 VKCZWKURRZIUFQ-CQSZACIVSA-N 342.233 1.919 10 10 EDCE COC(=O)[C@H](CF)NCc1cc(Br)cc(OC)c1O 809778376 QAYUQGZHICUMIH-VIFPVBQESA-N 336.157 1.764 10 10 EDCE CCn1ncc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n1 293451552 SPWYPZPHOKTGJV-AWEZNQCLSA-N 330.388 1.825 10 10 EDCE NCC1CCC(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 817888526 HJQFGYRTALPMSO-IIIMJFFVSA-N 344.503 1.995 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@](C)(CO)C(C)C)nc12 810076036 ZFZUILMZUVNDOK-MRXNPFEDSA-N 336.392 1.108 10 10 EDCE C[C@@H](N[C@@H]1CCC(=O)N(C)C1=O)c1ccc(N2CCOCC2)c(F)c1 818360716 BRWHZSARQNIGLG-IUODEOHRSA-N 349.406 1.460 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H](O)C1CCC1 826672075 WNLTWOKYYXSEMD-QGZVFWFLSA-N 336.407 1.564 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)[C@H]1CCN(C2CC2)C1 732413428 UROUBORPBJWXCI-IBGZPJMESA-N 344.503 1.880 10 10 EDCE O=C(O)CN(Cc1ccccc1O)C(=O)[C@@H]1CC[C@@H]2CCCCN21 911489667 VVHGWWDCOHYRIW-GJZGRUSLSA-N 332.400 1.822 10 10 EDCE COCCCCS(=O)(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 842784261 DPBHLKDDDWMEIP-OAHLLOKOSA-N 329.466 1.098 10 10 EDCE C[C@H]1CCNC[C@H]1NC(=O)NCc1cc(Br)ccc1O 841978762 YMRBKMVIKKYDPJ-JOYOIKCWSA-N 342.237 1.952 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@]12C[C@H]3C[C@@H](C(=O)N1)[C@H]2C3 845113589 BILIOTRFUZENBY-PSLQGDIJSA-N 327.428 1.626 10 10 EDCE CCOCc1cc(CNC[C@@]2(CO)COCCN2C)ccc1OC 922536750 ZKWYMYZGTMGNBY-GOSISDBHSA-N 338.448 1.014 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCNC(=O)CC1 859172833 KDTPALPPCRBQCA-UHFFFAOYSA-N 339.395 1.869 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3cc(C)nn3C)C2)cc1 852315322 RKWAETDKBJDLDN-AWEZNQCLSA-N 343.431 1.815 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@]3(OC)CCOC3)C2)cc1 852256186 SUPKBHBTYVDXGX-KBXCAEBGSA-N 349.431 1.379 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3C[C@H]3c3cnn(C)c3)C2)cc1 855223992 JSFGWINHPAQMEZ-JCGIZDLHSA-N 340.427 1.927 10 10 EDCE CN(C)C(=O)N(C)[C@@H]1CCN(C(=O)NCc2ccc(N(C)C)cc2)C1 853245185 VIDPIONHOROYCP-MRXNPFEDSA-N 347.463 1.650 10 10 EDCE CCc1cccc(CN2CCC[C@@H](CS(=O)(=O)NC)C2)c1O 862550377 DUEMOQRDJAWJQD-CYBMUJFWSA-N 326.462 1.716 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H](O)c3cnc[nH]3)CC2)cc1 864949445 JONZNIFNHUOWSQ-INIZCTEOSA-N 330.388 1.191 10 10 EDCE CC[S@@](C)(=O)=NS(=O)(=O)N(C)Cc1ccc(N(C)C)cc1 866418791 UGIBTJPDHKTFBH-HXUWFJFHSA-N 333.479 1.547 10 10 EDCE CN1CCN(c2ccc(CNc3cc4n(n3)CCN(C)C4)cc2)CC1 865844928 JZFUCBZPOMSCCI-UHFFFAOYSA-N 340.475 1.692 10 10 EDCE C[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)[C@@H](C)O1 868131103 YQYUABUQVAJXRZ-CPUCHLNUSA-N 333.432 1.888 10 10 EDCE CC1CCN(c2ccc(CNC(=O)[C@@H](O)c3cnc[nH]3)cc2)CC1 865603830 NERFTWXQQZIBRP-KRWDZBQOSA-N 328.416 1.996 10 10 EDCE COC(=O)c1cc(OC[C@H]2CCS(=O)(=O)C2)ccc1N(C)C 871793336 MBARENTVHORPEU-LLVKDONJSA-N 327.402 1.353 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN(CCO)[C@H](C)C2)c1 779215353 XJXFDVWDJYAFMP-GFCCVEGCSA-N 343.265 1.962 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)NC(=O)c1ccccc1 773755561 DFPNQJSPNYSPEK-STQMWFEESA-N 342.395 1.964 10 10 EDCE NC(=O)N1CC(CNCc2cc(Br)cc(F)c2O)C1 1875454477 VUUPEUVRLWRBAX-UHFFFAOYSA-N 332.173 1.394 10 10 EDCE COC(=O)c1c(NC(=O)N2Cc3cccc(O)c3C2)nc2n1CCC2 1123436291 JHFNXFXIQAXXNW-UHFFFAOYSA-N 342.355 1.869 10 10 EDCE O=C1NC(=O)C(=CNc2ccc(Br)c(Cl)c2)C(=O)N1 1088686230 QRZDORBNYQSZHC-UHFFFAOYSA-N 344.552 1.764 10 10 EDCE 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340.343 1.263 10 10 EDCE Oc1ccc(Br)cc1CN1CCO[C@@H]2CCNC[C@@H]21 2129072644 RWJFFBXEWNLYOO-GXTWGEPZSA-N 327.222 1.717 10 10 EDCE CCOC(=O)N1CCN(C(=O)CCNCc2cc(C)ccc2O)CC1 1857864383 LQNSSDNFEVAALQ-UHFFFAOYSA-N 349.431 1.481 10 10 EDCE Cc1c(O[C@@H](C)C(N)=O)c(=O)ccn1CCCOc1ccc(N)cc1 1857919595 NZZIMISXNYJKBG-ZDUSSCGKSA-N 345.399 1.461 10 10 EDCE CN(Cc1nn(C)cc1Br)C(=O)Cc1ccc(N)cc1 1912471346 KQFDCLKTNCRKBE-UHFFFAOYSA-N 337.221 1.966 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C1CC(O)(CNC(=O)OC(C)(C)C)C1 1985103018 PDMHUUAZEQAWGF-UHFFFAOYSA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)C[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985102603 JIMNGCKXQKZALH-QWRGUYRKSA-N 325.369 1.268 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1990033890 ZEINHSVUGIVLKJ-MNOVXSKESA-N 327.385 1.563 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](OCC(N)=O)C2)c(Br)c1 2145376098 XCSRYKLXFBYGKS-ONGXEEELSA-N 342.237 1.549 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@H](O)CO 1999376230 XERQEOPYNBWYEK-HNNXBMFYSA-N 336.432 1.817 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)C[C@@H](O)COc1ccc(N)cc1 1999436913 LBCZYYJMPXRKIM-CQSZACIVSA-N 339.436 1.465 10 10 EDCE COC1(C(=O)N2CC(N=[N+]=[N-])C2)CCN(C(=O)OC(C)(C)C)CC1 2010389720 UCVTYAXGXZJCBW-UHFFFAOYSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)OCC1(C)C 2010402826 WLBOHPMFROFIAA-NSHDSACASA-N 339.396 1.922 10 10 EDCE OC[C@H]1COC[C@@H]1NCc1cc(Cl)cc(Br)c1O 2029843438 FNATXXWQWHPRNZ-KWQFWETISA-N 336.613 1.905 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@@H](CO)C2)c(Br)c1 316808925 WXNHDBNPVPQUKC-BXUZGUMPSA-N 329.238 1.348 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(CCO)C(=O)C2)c(Br)c1 2171074310 LFHBBBDKDUERHT-SNVBAGLBSA-N 342.237 1.110 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(C)[C@H](CO)C2)cc1Br 687612688 IYEHKDRUZYCVTO-YPMHNXCESA-N 342.281 1.842 10 10 EDCE CCN[C@H](C)c1ccc(N(C)C(CO)CO)c(Br)c1 382456844 WBFJEICQGWAQDW-SNVBAGLBSA-N 331.254 1.909 10 10 EDCE NC[C@@H]1CCN(C(=O)c2c[nH]nc2[C@H]2CCNC2)c2ccccc21 2062576518 LACZWVJLCTUNCM-STQMWFEESA-N 325.416 1.579 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4[C@H](CO)[C@@H]4C3)c(Br)cc21 2182050598 QGDQTQZLUVAAEI-ZZIUEJKTSA-N 338.205 1.076 10 10 EDCE CC(C)(C)OC(=O)NC1[C@H]2CN(c3cc4c(cc3N)OCCO4)C[C@H]12 2045672317 WJADOGNYHUDZPX-QWRGUYRKSA-N 347.415 1.999 10 10 EDCE Cc1cccc(CNC(=O)[C@]2(N)CCN(Cc3ccccc3)C2)c1O 2084055909 BIVLWVOIXLSNJK-FQEVSTJZSA-N 339.439 1.920 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2104416888 ZOJRWECEBDIRNK-GJQVQUKXSA-N 327.222 1.099 10 10 EDCE C[C@@H](N)c1ccc(N2CCCC2(CO)CO)cc1Br 2089867623 GOGRDFAIGSRUCM-SNVBAGLBSA-N 329.238 1.792 10 10 EDCE CCN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1cc(C)cc(C)c1 46360025 MMZNXTAOQIRXAO-BQYQJAHWSA-N 341.411 1.767 10 10 EDCE CS(=O)(=O)CCN(c1ccc(CN)c(Br)c1)C1CC1 2113818507 LKSTVGNHOYHADB-UHFFFAOYSA-N 347.278 1.921 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])COC1 2213582534 IUDQPPNJLYOUOQ-WDEREUQCSA-N 339.396 1.875 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C 2300532372 UWQHQNGOWNUYFQ-JTQLQIEISA-N 342.400 1.304 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)cc1Br 2331965942 YCGLKCYBBGONCR-CABNGKKXSA-N 327.222 1.371 10 10 EDCE Cc1ccc(CN[C@@H]2CCN(C(N)=O)C2)c(O)c1Br 2352682390 ZUBHJXHAKGRGBK-SNVBAGLBSA-N 328.210 1.706 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 171187727 JRGPXKRERMPLFM-IAGOWNOFSA-N 346.427 1.321 10 10 EDCE O=C(c1cc(O)nc(O)c1)N1CC(n2cc(Br)cn2)C1 2361510225 HCBQHKPUDSTBGW-UHFFFAOYSA-N 339.149 1.149 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)N[C@H]1C[C@H]2CC[C@H]1O2 191280090 AFSMSRGTAMNKIZ-KSJKIQDYSA-N 328.412 1.973 10 10 EDCE COc1ccnc(N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)n1 267583419 LJKQLFIDZAWCQX-UHFFFAOYSA-N 344.371 1.167 10 10 EDCE CN1C(=O)C[C@@H](C(=O)NCc2ccc(O)c(O)c2)[C@@H]1c1cccnc1 272303090 JCHLURTXUQNBHA-DYVFJYSZSA-N 341.367 1.329 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C)[C@H]3C[C@@H](OC)C3)CC2)cc1 285366638 MGXAVMUJSRAKME-MAEOIBBWSA-N 347.459 1.453 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1 808501577 LSNCPHCNXUQLRH-SECBINFHSA-N 325.267 1.019 10 10 EDCE Cn1nncc1CNC(=O)NCc1cc(Br)ccc1O 807611911 FZQZLJSSWBRDHC-UHFFFAOYSA-N 340.181 1.283 10 10 EDCE COc1ccc(C(=O)N2CCC[C@H]2C(=O)OCC(=O)C(C)=O)cc1 808547645 BORMJXRUQHIWDK-AWEZNQCLSA-N 333.340 1.001 10 10 EDCE CN(C)c1ccc(CN[C@@H]2CCC[C@H]2CNS(C)(=O)=O)cc1F 800309930 QBYKPPWMTYQXCS-DZGCQCFKSA-N 343.468 1.699 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C(N)=O)CC2)c(Br)c1 722192390 FHZSYUXJJGDWBX-SECBINFHSA-N 327.226 1.670 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@H]4O)c([N+](=O)[O-])c1 588617529 PTCIAUKHTGWFFV-FHLCWUCUSA-N 344.367 1.987 10 10 EDCE C[C@H](NC(=O)N1CN(C)C(=O)[C@@H]1C)c1ccc(N2CCOCC2)cc1 825775754 AOADCOXDEHKYNV-KBPBESRZSA-N 346.431 1.414 10 10 EDCE CCNC(=O)CN1CCN(C/C=C\c2ccc(N(C)C)cc2)CC1 835025315 HYJUCIYPYIMMRG-WAYWQWQTSA-N 330.476 1.520 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCC1=CCNCC1 588528383 MHOZSOPTUNBBAR-UTCJRWHESA-N 327.428 1.572 10 10 EDCE COC[C@@](C)(O)CCNC(=O)NCc1c(O)ccc2c1CCCC2 836531685 IXMZJLDJEZNYSF-SFHVURJKSA-N 336.432 1.858 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)c2ccccc2CCN)cc1 846664021 UXXUXDGTOAMKEK-SFHVURJKSA-N 326.444 1.684 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]12C[C@H]3C[C@H](C(=O)N1)[C@H]2C3 845929319 AEMAJNBXAQYGBS-MIESKTAFSA-N 330.384 1.060 10 10 EDCE C[C@@H]1CCNC[C@H]1NC(=O)NCc1cccc(Br)c1O 841976625 MYDTUSRWAKQKAU-BXKDBHETSA-N 342.237 1.952 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@H]1C[C@H](O)C12CCC2 852584454 NNEYNXTXJBEVHX-IRXDYDNUSA-N 331.460 1.604 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)C[S@](C)=O)C2)cc1 852250356 GZVJVNMJTONUAY-XCMOZONUSA-N 339.461 1.340 10 10 EDCE CCS(=O)(=O)C1(CNC(=O)NCc2c(O)cccc2F)CC1 923329854 QJEOGLAVEVPSET-UHFFFAOYSA-N 330.381 1.298 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C2)cc1 855232538 RSDRZVOWIZJBTC-KGLIPLIRSA-N 347.459 1.941 10 10 EDCE CC(C)c1ncc2c(n1)CCN(C(=O)C(=O)Nc1ccc(N)cc1)C2 857876838 ATWFCQIMIVJZFT-UHFFFAOYSA-N 339.399 1.706 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](CO)CC(C)C)C2)cc1 852450433 MHJXVGNBHKIYQJ-CABCVRRESA-N 335.448 1.980 10 10 EDCE Cc1ccc([C@@H](C)NC2CN(S(=O)(=O)N(C)C)C2)c(O)c1C 858570170 UNDXMATXEMHGPE-GFCCVEGCSA-N 327.450 1.150 10 10 EDCE C[C@H](N)c1ccc(N2CCN(C)C[C@@H]2CO)cc1Br 699487278 RCTIGVKCPJABDR-CMPLNLGQSA-N 328.254 1.582 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)C1C[C@H]2COC[C@@H](C1)C2=O 862028417 YTCBMHVFCQBKOK-GOOCMWNKSA-N 340.379 1.798 10 10 EDCE CS(=O)(=O)c1csc(C(=O)NCCc2ccc(O)c(O)c2)c1 767786215 MSTQZBCJEKUFQX-UHFFFAOYSA-N 341.410 1.535 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CC[C@@H]4CSC[C@@H]4C3)nc12 872163903 MSKJFOPJNKNBLU-ZJUUUORDSA-N 334.401 1.318 10 10 EDCE CC(C)(C)OC(=O)[C@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 768463345 HHTNPWQEWZVJKF-XHDPSFHLSA-N 335.400 1.982 10 10 EDCE Cc1cc(CN2CCNC(=O)CC23CCOCC3)ccc1N(C)C 872283513 DNXJNGYCZNBSPX-UHFFFAOYSA-N 331.460 1.932 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)Cc2ccc(C(N)=O)nc2)c1 1150542767 DSUGWUCIOSUSEG-JTQLQIEISA-N 329.356 1.315 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2C[C@@H](CCO)[C@@H](CO)C2)c1O 1308163442 LJXRICACKVRUBY-DGCLKSJQSA-N 327.808 1.671 10 10 EDCE O=C(NCc1nc(-c2ccncc2)n[nH]1)NCc1c(O)cccc1F 1230191821 LHKJJPVCBPTYOB-UHFFFAOYSA-N 342.334 1.711 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)[C@H](NS(C)(=O)=O)C(C)C 1293284816 YBPQWTSCFMWEMH-OAHLLOKOSA-N 341.477 1.251 10 10 EDCE Cc1ccc(O)c(CNC(=O)CN2CCCC3(CC3)S2(=O)=O)c1 1528626384 DJRBGKAUZROBDR-UHFFFAOYSA-N 338.429 1.275 10 10 EDCE CCOC1(CO)CN(c2ccc(CN)c(Br)c2F)C1 2116362768 ACJGEALNRXQMNG-UHFFFAOYSA-N 333.201 1.635 10 10 EDCE COc1ccc(N2CCCN(C(=O)c3ns[nH]c3=O)CC2)cc1 1464353521 ZXBKQPUBDDQHLD-UHFFFAOYSA-N 334.401 1.193 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)Cc2ccsc2)cc1C 1700782490 KRBBXAKCPHSELM-INIZCTEOSA-N 348.468 1.875 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@@H]2CCN(C)C2)cc1C 1713654343 AYLCQUVRFOICRN-KRWDZBQOSA-N 333.476 1.893 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)c2ccc(O)nn2)cc1C 1491979798 PLXOQZHMVBHAHS-ZDUSSCGKSA-N 344.415 1.797 10 10 EDCE O=C(CN1C(=O)CCc2ccccc21)NCc1ccc(O)cc1O 1643104462 ZQBWYFIRRYVTLM-UHFFFAOYSA-N 326.352 1.693 10 10 EDCE CN1C(=O)[C@H](NC(=O)NCc2c(O)cccc2F)Cc2ccccc21 1683940815 OSDKNGVAUSVUJN-CQSZACIVSA-N 343.358 1.918 10 10 EDCE C[C@@H](O)CCCN[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1690651722 FSHKSQUOUZLLBV-VXGBXAGGSA-N 335.408 1.718 10 10 EDCE O=C(O)c1cc(NC(=O)c2cc(O)c(O)c(O)c2)cc(C(=O)O)c1 1865876289 BAIFHCIRPQDDFZ-UHFFFAOYSA-N 333.252 1.452 10 10 EDCE CC(=O)N[C@@H]1[C@@H](N=[N+]=[N-])O[C@H]2CO[C@H](c3ccccc3)O[C@@H]2[C@H]1O 1857790283 PEVZMZIOLKXJNJ-LZXPERKUSA-N 334.332 1.001 10 10 EDCE CCN(CC)c1ccc(CNCCC(=O)N2CCC(O)CC2)cc1 1857863633 YCAGFYWDMVXNRC-UHFFFAOYSA-N 333.476 1.996 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@@H]2O 1974156350 GHLRMTWVOYFIKJ-MZUVWLFZSA-N 346.196 1.514 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@]1(C)C(=O)NCCCN=[N+]=[N-] 1985099699 ATKXOAFLBSXQDX-IINYFYTJSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N1CC(NCc2c(O)cccc2F)(C(N)=O)C1 1997950669 JQYGDAXWJZHCGP-UHFFFAOYSA-N 339.367 1.096 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]12COC[C@@H]1CN(C(=O)OC(C)(C)C)C2 2010403855 KQOLBOYRZSQWIN-XHDPSFHLSA-N 339.396 1.639 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2011939935 SJJNFLPWPDHXRG-IAQYHMDHSA-N 339.396 1.660 10 10 EDCE COC(=O)c1ccc(C=C2SC(N3CCOCC3)=NC2=O)cc1 2040386983 QFKRCCOVAKKLAY-UHFFFAOYSA-N 332.381 1.776 10 10 EDCE CN(CCOc1ccc(N)cc1)Cc1c(Br)nnn1C 2156476047 HRFFRXWJPVKIIQ-UHFFFAOYSA-N 340.225 1.671 10 10 EDCE CN(C)C[C@@H]1CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2160881884 ITMBMKHWMKTGNE-ISVAXAHUSA-N 339.237 1.541 10 10 EDCE C[C@@H](N)c1ccc(N(C)CC(C)(CO)CO)c(Br)c1 689676236 SWRJTMSQKPKVBK-SNVBAGLBSA-N 331.254 1.896 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4COCC[C@@H]43)c(Br)cc21 2193267235 CRWBUKWJCBXVLR-XDYOCTJHSA-N 338.205 1.626 10 10 EDCE O=C(O)[C@@H]1CN(Cc2c(O)cccc2Br)C2(CC2)CO1 2183983872 GOSOZASZVNSLLW-LBPRGKRZSA-N 342.189 1.973 10 10 EDCE Cc1cc(NS(=O)(=O)c2c(Br)cnn2C)ccc1O 2089754504 KMUZVVRJPVCSPT-UHFFFAOYSA-N 346.206 1.997 10 10 EDCE NCc1ccc(N2CCO[C@]3(CCOC3)C2)cc1Br 2111914539 DEDHNMWISHQYDR-CQSZACIVSA-N 327.222 1.904 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213589543 GRHXEXVOVAIDNT-OUAUKWLOSA-N 341.412 1.998 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213582290 GKJQBRQODIZHEN-SDDRHHMPSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213586431 XCNOXFXUOBQYPQ-QWRGUYRKSA-N 339.396 1.563 10 10 EDCE COc1ccc(Br)c(CN2C[C@H]3CCN[C@H]3C2)c1O 2227742759 JLHVMNKRMLVORH-SKDRFNHKSA-N 327.222 1.957 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3CNC[C@H]3C2)c1O 2227746323 KBXMFBKZUUJTOE-UWVGGRQHSA-N 327.222 1.815 10 10 EDCE CN(C(=O)[C@H]1CC[C@H](O)CN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2253625885 XVPIMDPOWNDCKJ-LSDHHAIUSA-N 349.431 1.992 10 10 EDCE CNC[C@]1(O)CCCN(Cc2ccc(Br)cc2O)C1 2270829753 LEXGOYKUYPNTJU-CQSZACIVSA-N 329.238 1.701 10 10 EDCE NCc1ccc(N2CC[C@H](O)[C@H](O)CC2)c(F)c1Br 2269142371 RPSQUKAWSIPHSY-PHIMTYICSA-N 333.201 1.369 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cc(CN)cs2)s1 2269305271 WBLKJXRSNSXEOX-UHFFFAOYSA-N 335.501 1.864 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)C[C@@H](N)Cc1ccc(O)c(O)c1 1952893436 KSXXKUMMSDFCHP-QWHCGFSZSA-N 340.420 1.897 10 10 EDCE Cc1cccc(N/C=C2\C(=O)NC(=O)N(C[C@@H]3CCCO3)C2=O)c1 103844688 CZVNEPWJWPUOTD-FYQHACEVSA-N 329.356 1.548 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCOC1 171619446 LCNDHCRNLPRKIN-MRXNPFEDSA-N 333.432 1.844 10 10 EDCE COc1cc(I)cc([C@@H]2COCCN2)c1O 309372841 FRHMNCDYUDVKQE-VIFPVBQESA-N 335.141 1.666 10 10 EDCE O=C1Nc2cc(N3CC[C@@]4(O)C[C@H]4C3)c(Br)cc2[C@@H]1O 2359026252 WNVXMKWXKKRIOM-ATMGAIRJSA-N 339.189 1.396 10 10 EDCE COCCN1CCC(CNC(=O)/C=C/c2ccc(O)c(O)c2)CC1 180743227 WJZMTLUUJFUYKP-HWKANZROSA-N 334.416 1.586 10 10 EDCE C[C@@H](NC(=O)N[C@H]1CCCN(C)C1)c1ccc(N2CCOCC2)cc1 139956162 DDTPZGHIBNERIV-WBVHZDCISA-N 346.475 1.978 10 10 EDCE O=C(CNCc1ccc(N2CCOCC2)cc1)NCc1ccccc1 48712167 ZJANUCVNJROTKE-UHFFFAOYSA-N 339.439 1.929 10 10 EDCE CNC(=O)CN(C)c1ccc(/C=C/C(=O)O)cc1Br 234362904 HAWHVASZCDOTSF-GQCTYLIASA-N 327.178 1.729 10 10 EDCE CC[C@H](C)N(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)=O 244005428 SHQXUXFHCHYBGJ-HNNXBMFYSA-N 347.459 1.991 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)N3CCC(C)CC3)CC2)cc1 242820748 FKRLJDQSXKAMMR-UHFFFAOYSA-N 345.443 1.602 10 10 EDCE CCn1nc2c(cc1=O)CN(Cc1cc3c(cc1O)OCO3)CC2 371326469 IZIQLKZMORSGHM-UHFFFAOYSA-N 329.356 1.256 10 10 EDCE CN(C)S(=O)(=O)[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 289584185 UDQGYACXOLTZRB-GFCCVEGCSA-N 332.853 1.901 10 10 EDCE CSc1ncc(CN[C@](C)(CCS(C)(=O)=O)C(=O)O)s1 2378418577 YVBXGWCWNWDVMZ-LLVKDONJSA-N 338.476 1.233 10 10 EDCE NCc1ccc(N2CC3(CCOCC3)[C@H]2CO)cc1Br 2381034372 OPSSQWYZFVKRIU-CQSZACIVSA-N 341.249 1.886 10 10 EDCE Cc1ccc(CN2CCN3C(=O)NC[C@@H]3C2)c(O)c1Br 2381136121 AYHMYNABDBKPIN-LLVKDONJSA-N 340.221 1.673 10 10 EDCE CC(C)(C)OCCNC(=O)C(=O)NCCCSc1nccs1 806278430 RDBAKGHGYONMTA-UHFFFAOYSA-N 345.490 1.673 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@H](O)c2nn(C)cc2Br)cc1 2163148567 YWCDLVALHORUAQ-OCCSQVGLSA-N 339.237 1.982 10 10 EDCE C[C@@H]1CCn2ncc(C(=O)OCC(=O)c3ccc(O)c(O)c3)c2C1 829574290 LSUBWVUBYPWZHH-SNVBAGLBSA-N 330.340 1.916 10 10 EDCE O=C(CC1(O)CCOCC1)NCc1cc(Br)ccc1O 908169861 BOMCMEWLBUVMAV-UHFFFAOYSA-N 344.205 1.703 10 10 EDCE C[C@]1(C2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)COC(=O)N1 905710275 HTIQHEVAYRNKIF-CRAIPNDOSA-N 348.399 1.529 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCOC[C@@H]2C(F)(F)F)cc1 839531864 IAXURNQKWHXMSR-CQSZACIVSA-N 345.365 1.632 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C[C@@]3(O)CCCN(C)C3)C2)cc1 912293222 WHBQHKUYLLLMEY-BEFAXECRSA-N 347.459 1.237 10 10 EDCE COc1cccc(O)c1CN[C@@H]1CCN(c2ccc3nncn3n2)C1 858244612 XUPUDPVJOAAWSF-GFCCVEGCSA-N 340.387 1.207 10 10 EDCE CO[C@H](C)CC(=O)NCc1cc(NC(=O)C[C@@H](C)OC)ccc1O 923123814 PWEVMXBSIGXCER-VXGBXAGGSA-N 338.404 1.797 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C)C[C@@H](C)O)C2)cc1 854298728 AMNCAVYMWMAZAB-ZNMIVQPWSA-N 335.448 1.980 10 10 EDCE CO[C@@]1(CNCc2ccc3c(c2)CCCO3)CCS(=O)(=O)C1 922619563 VJYGQEQQEURLII-MRXNPFEDSA-N 325.430 1.305 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H](CO)OC[C@@H]2C)c([N+](=O)[O-])c1 765537908 ZUSYXWLDWSRBPY-BNHDAMHGSA-N 336.344 1.367 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CCNC1=O 862153841 WGGRGRVZAHOOTL-HNNXBMFYSA-N 325.368 1.525 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1C[C@H]2COC[C@@H](C1)C2=O 773740382 LJDSXYZFCHMUBA-HLVVYCRESA-N 333.384 1.387 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)c2cccc(N(C)C)c2)c1 788060211 VXHZWPIPACCXOY-UHFFFAOYSA-N 336.413 1.945 10 10 EDCE CC[C@@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)C[C@@]2(CCOC2)O1 794700793 HTBVHFCEBMOPKZ-MZMPZRCHSA-N 335.400 1.588 10 10 EDCE COc1ccc(CNC(=O)Cn2cc(-c3ccccc3)nn2)c(O)c1 794378002 SILRUJDFKMAPHF-UHFFFAOYSA-N 338.367 1.976 10 10 EDCE COc1ccc2c(c1)C[C@H](C(=O)NCc1cc(O)ccc1O)CO2 1303223190 DVSYNWLIKVEQCI-ZDUSSCGKSA-N 329.352 1.974 10 10 EDCE O=C(O)CCN1CCN(Cc2ccc(Br)cc2O)CC1 691425335 XOBFRZNZPUTPKQ-UHFFFAOYSA-N 343.221 1.747 10 10 EDCE CN(c1ccc(CNC2CC2)cc1Br)[C@@H]1COC[C@H]1O 708104595 GVILKXFDFVTENS-HUUCEWRRSA-N 341.249 1.897 10 10 EDCE CN(c1ccc(CNC2CC2)cc1Br)[C@@H]1COC[C@@H]1O 708112412 GVILKXFDFVTENS-CABCVRRESA-N 341.249 1.897 10 10 EDCE CNC(=O)[C@@H](C)N(C)C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1268758347 BWQIVEVJTUQCNX-GHMZBOCLSA-N 348.407 1.034 10 10 EDCE CC(C)(C)CC(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1452991272 NFXPHWVHBYURDG-UHFFFAOYSA-N 334.416 1.747 10 10 EDCE C[C@H]1Oc2ccc(NC(=O)Cc3ccc(O)c(O)c3)cc2NC1=O 1463809963 SCSDBBDPYUYHDU-SECBINFHSA-N 328.324 1.998 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)[C@@H](C)S(C)(=O)=O 1611430493 DHZXODHPASCTSQ-OUAUKWLOSA-N 329.418 1.214 10 10 EDCE CO[C@H]1COC[C@H]1N(C)c1ccc(CN)c(Br)c1F 2120773112 CSYMUNRTQUUGDO-MNOVXSKESA-N 333.201 1.897 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc2c(nc1O)CCC[C@@H]2O 1557085519 OHLYTZXIIWNLQD-AWEZNQCLSA-N 330.340 1.498 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@@H]2CCNC2=O)cc1C 1482860752 MBURIQPVJVQDJC-UKRRQHHQSA-N 333.432 1.124 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C[C@H]2CCCC(=O)N2)cc1C 1497853852 BGQCGJIMXMIBNF-GDBMZVCRSA-N 347.459 1.657 10 10 EDCE C[C@H](NCc1nnc(Br)n1C)c1cc(O)ccc1O 2121513306 IURXLWIYFRMLHN-ZETCQYMHSA-N 327.182 1.840 10 10 EDCE Cc1nnnn1-c1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1 1566358353 AVABHKIYFNPYQX-UHFFFAOYSA-N 325.328 1.312 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@H]2CCN(C)C2=O)cc1C 1497654645 KRQHDRQQTYWBTF-DWTRPJMMSA-N 345.443 1.244 10 10 EDCE COc1ccc(CN[C@]2(CO)CCCN(C(=O)C3CC3)C2)cc1C 1724902484 XAMWORYSNXIYRD-LJQANCHMSA-N 332.444 1.857 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cn(C)nc2OC)cc1C 1498087268 OINLVRYGVOLPIE-ZDUSSCGKSA-N 346.431 1.654 10 10 EDCE Nc1nnc(C2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)o1 1639682749 BYZYKBGBVIIFDD-RQOWECAXSA-N 330.344 1.482 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)[C@@H]2CC2(C)C)cc1C 1733614552 RWKOWIJDRAFIBA-INIZCTEOSA-N 334.460 1.960 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)O1 1909806357 GQABBQGQGIQXJJ-RYUDHWBXSA-N 339.396 1.970 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)C2CC=CC2)cc1C 1677065779 PFUFZFKXXDHCBZ-KRWDZBQOSA-N 332.444 1.879 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)C2=COCCC2)cc1C 1677060439 FSGQHWMFVVZAAF-KRWDZBQOSA-N 348.443 1.607 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)Cc2ccc[nH]2)cc1C 1677137973 HOCVINANAQPQJR-KRWDZBQOSA-N 345.443 1.483 10 10 EDCE C[C@@H](CNC(=O)C(F)F)NC(=O)c1ccc(N=NC(N)=O)cc1 1688118353 BVEMGHBSIRTZFJ-ZETCQYMHSA-N 327.291 1.349 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cc(CN3CCOCC3)on2)cc1 15769557 SQNWJBCLGSSXIR-UHFFFAOYSA-N 344.415 1.503 10 10 EDCE CCCCOC(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169902581 OUEHAUBFARBASE-UHFFFAOYSA-N 338.360 1.498 10 10 EDCE O=C(O)[C@@H](Cc1cnc[nH]1)N1C(=O)/C(=C\c2ccc[nH]2)SC1=S 1858586618 DFNBQOGLVLVLSQ-QZULDAKNSA-N 348.409 1.635 10 10 EDCE COc1ccccc1[C@@H](CNC(=O)c1cc(O)c(O)c(O)c1)C(=O)O 1865876067 PMFQCEUONJXQGM-LLVKDONJSA-N 347.323 1.410 10 10 EDCE CC(C)[C@H](N)C(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1865916663 NMKUBTAKZPOBIE-HOTGVXAUSA-N 329.448 1.675 10 10 EDCE CN1CCN(c2ccc(CN)cc2Br)[C@H](CCO)C1 2138079913 AVKWVYFCPCOXGE-GFCCVEGCSA-N 328.254 1.411 10 10 EDCE COc1cccc(CN(Cc2ccccc2)CC2(O)CNC2)c1O 1915509391 MZLYYFHYJOSKHH-UHFFFAOYSA-N 328.412 1.737 10 10 EDCE CC[C@@H](c1cc(Br)ccc1O)N1CC(O)(C(=O)O)C1 2136352130 FYOJNLCPSWSGTI-JTQLQIEISA-N 330.178 1.737 10 10 EDCE O=C(N[C@H](C(=O)O)c1c(O)cc(O)cc1O)OCc1ccccc1 1951381642 OYUOIZRMMUEIQD-AWEZNQCLSA-N 333.296 1.856 10 10 EDCE COC[C@H](N)C[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952117504 AVYXUJZCFMWINQ-OLZOCXBDSA-N 340.420 1.897 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(c2c(O)cc(O)cc2O)C[C@H]1C(=O)O 1952775799 QPCSPBKJOCGEED-VXJOIVPMSA-N 325.317 1.628 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@H]1COC[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003167464 NWJFHFYGEXWHAK-CYDGBPFRSA-N 340.420 1.134 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985093922 HHBQHKHYOKLNKF-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)cc1Br 2158392681 MTUWTOBPKTYHCM-CFVMTHIKSA-N 341.249 1.755 10 10 EDCE CCCN(CC(=O)NC)c1ccc(C=CC(=O)OC)cc1[N+](=O)[O-] 2053571155 PKPRAXYEFUQLIL-UHFFFAOYSA-N 335.360 1.743 10 10 EDCE Cc1ccc(O)c(CNC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c1 715576126 PUDZJYVLUBXYEA-UHFFFAOYSA-N 335.404 1.265 10 10 EDCE CCNCc1ccc(N2CC(O)(COC)C2)c(Br)c1 384086663 AOSHOEMTIOSZSV-UHFFFAOYSA-N 329.238 1.756 10 10 EDCE CNCc1ccc(N2CCN(C3COC3)CC2)cc1Br 2169592816 HXLGUOKBTMVWNR-UHFFFAOYSA-N 340.265 1.689 10 10 EDCE CC(C)(C)OC(=O)N1CCNC(=O)CCN(c2ccc(N)cc2)CC1 2044640043 LYHBFUVJBNUBEP-UHFFFAOYSA-N 348.447 1.832 10 10 EDCE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CCN1C(=O)c1ccc(O)c(O)c1 2054417099 ITJRTKDRSBTUPB-WCBMZHEXSA-N 346.305 1.769 10 10 EDCE COc1ccc(N2CCNC[C@@H](O)C2)c(OC)c1Br 2106347436 XGMUOCVLLUSMDS-SECBINFHSA-N 331.210 1.237 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@@H](C2)C3O)c(Br)c1 2111488038 MANIBLBTMMRITB-BVUQATHDSA-N 327.222 1.351 10 10 EDCE Cc1ccc(CNC(=O)[C@]23CNC[C@@H]2C3)c(O)c1Br 2352623330 ASVTTZXUTIHSLQ-IINYFYTJSA-N 325.206 1.689 10 10 EDCE Cc1ccc(CN2CCN(C)C[C@@H]2CN)c(O)c1Br 2352933150 WTEBWJSTWLCYRM-LBPRGKRZSA-N 328.254 1.538 10 10 EDCE COC(=O)[C@H]1C[C@@H](O)CN1Cc1ccc(Br)cc1O 1327880349 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347.459 1.957 10 10 EDCE O=C1CN(CC(=O)N(Cc2ccco2)Cc2ccccc2O)C(=O)N1 743429876 BTTBHEUUZMBFQR-UHFFFAOYSA-N 343.339 1.066 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3CCC[C@@H](N)C3)CC2)cc1 848716358 BZWWNNPQMSJIOI-IAGOWNOFSA-N 332.492 1.677 10 10 EDCE C[C@H]1CN(Cc2ccc(N3CCN(C)CC3)cc2)[C@H](C)CN1CCO 841891115 IUQBHYGECJJWPK-ZWKOTPCHSA-N 346.519 1.325 10 10 EDCE Cn1cc(N2CCC[C@@H](N3CCCc4cc(CN)ccc43)C2=O)cn1 844218527 BSHWJCAPVBGIKR-GOSISDBHSA-N 339.443 1.827 10 10 EDCE CNC(=O)CCCN(C)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852453414 JAYWYPQBLYMAJT-CQSZACIVSA-N 348.447 1.442 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3CN(C)C[C@@H]3C)CC2)cc1 756108235 UXVOKLHIUONIOK-QFBILLFUSA-N 332.492 1.357 10 10 EDCE O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCc1c(O)cccc1F 928710658 VOEPPTGVLDECLE-RYUDHWBXSA-N 348.374 1.713 10 10 EDCE C[C@H](NC(=O)N[C@@H]1CCN[C@H]1C)c1ccc(N2CCOCC2)cc1 861565556 BMVZNRJHUVCVRJ-GRDNDAEWSA-N 332.448 1.634 10 10 EDCE CCOC(=O)c1ccc(S(=O)(=O)N2Cc3cccc(O)c3C2)o1 867691482 XMSOHHWDAVSXOE-UHFFFAOYSA-N 337.353 1.866 10 10 EDCE CCOc1ccc(CN2CCC[C@@H](CS(=O)(=O)NC)C2)c(O)c1 862552387 XMFLHRVZCRZHHD-CYBMUJFWSA-N 342.461 1.552 10 10 EDCE CN(Cc1cccs1)c1ccc(CN2C[C@H](O)C[C@H]2C(N)=O)cc1 895371770 XBQICHVAQNFYAX-WBVHZDCISA-N 345.468 1.805 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(=O)N(C)C[C@@H]2C)c([N+](=O)[O-])c1 782399189 MAMDRPKWGYHYLO-XOIDGJRKSA-N 333.344 1.448 10 10 EDCE O=C(NC[C@H](O)COCC1CC1)c1cc2cc(O)c(O)cc2s1 896818388 JWVUUZFBWONYID-NSHDSACASA-N 337.397 1.830 10 10 EDCE Cn1cc(/C=C\C(=O)N2CCCCc3sccc32)c(=O)n(C)c1=O 798047278 RDHKRLMJYWZALU-SREVYHEPSA-N 345.424 1.528 10 10 EDCE Cc1ccc(C(=O)Nc2cc3c(cc2O)n(C)c(=O)n3C)c(O)c1O 794218655 XPMFNTXDVQEYPE-UHFFFAOYSA-N 343.339 1.555 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2CCN(C)C2=O)cc1C 1317402823 LWIZFTAMPQHQNI-GOEBONIOSA-N 347.459 1.466 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnn(C)c3OC)CC2)cc1F 1325196124 GQWXEOVLQBSUJU-UHFFFAOYSA-N 348.378 1.539 10 10 EDCE CC(C)N(C)C[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1332675914 GVCRHABIMHBFPQ-CQSZACIVSA-N 335.408 1.622 10 10 EDCE Cn1nccc1[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCN=[N+]=[N-] 1963704834 UVOBXGSKVITLEH-NSHDSACASA-N 337.384 1.803 10 10 EDCE COC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1627190332 BQDGZTHDUFWJKB-CQSZACIVSA-N 347.289 1.594 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2n[nH]c(C)c2O)cc1C 1714224670 HOYWFBIOYHCITB-LLVKDONJSA-N 332.404 1.649 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H](CO)Cc1cccnc1 1626908397 CMOCHRJIUKXCGX-DRDHIDPGSA-N 328.368 1.473 10 10 EDCE CC(=O)N/C(=C\c1cccs1)C(=O)NCc1cc(O)ccc1O 1637126063 KSUWFCNDBAZXDW-ZSOIEALJSA-N 332.381 1.953 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C[C@@H]2CCNC2=O)cc1C 1669313283 SNSNPIYKPVDYJI-HIFRSBDPSA-N 333.432 1.124 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2ccn(C)c(=O)c2)cc1C 1669331195 KJABLWOFMNPFCD-CQSZACIVSA-N 343.427 1.610 10 10 EDCE COc1ccc(Br)c(CN[C@@H](C)C(=O)NC2CC2)c1O 1964609846 KXUPASVQGWECPD-QMMMGPOBSA-N 343.221 1.920 10 10 EDCE CC[C@@]1(C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)CCNC1=O 1699367218 ZGNXPAGSFUYADT-AUUYWEPGSA-N 347.459 1.514 10 10 EDCE CNCc1ccc(N2CC[C@@](C)(C(N)=O)C2)c(Br)c1 234373886 CYWNEWVNJPUNJO-CQSZACIVSA-N 326.238 1.870 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](COc2ccc(N)cc2)CCS1(=O)=O 1992465423 NUVHPABOCQLOBU-LBPRGKRZSA-N 342.417 1.987 10 10 EDCE COc1ccc(N2CCN(C(=O)OC(C)(C)C)C[C@H]2CO)c(N)c1 1999512197 NJMYTYUZBLADFL-LBPRGKRZSA-N 337.420 1.695 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CN(C(=O)c3ccc(O)c(O)c3)C[C@@H]21 2006293895 QIMCQTSELODLMK-GNXNZQSNSA-N 334.372 1.693 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2010402502 RFOMMQJUPPMXDA-GFCCVEGCSA-N 339.396 1.924 10 10 EDCE C[C@@H](NC(=O)[C@H](CCO)NC(=O)OC(C)(C)C)c1ccccc1O 2017963631 PRJMVLPTYWQJDF-YPMHNXCESA-N 338.404 1.845 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2018521649 IZLWGUUCSOBZEB-BYNQJWBRSA-N 340.420 1.324 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@]1(CO)C(=O)Nc1ccc(N)cc1 2022801995 PPZNWXUIXVKMHM-KRWDZBQOSA-N 335.404 1.969 10 10 EDCE NCc1cc(F)c(N2CCN3C[C@H](O)C[C@H]3C2)cc1Br 405220104 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CC(=O)N(C(=O)C(=O)NCCc1ccc(O)cc1)c1ccc(N)cc1 170318108 FNHHTHWDGRMTHX-UHFFFAOYSA-N 341.367 1.213 10 10 EDCE CCOC(=O)[C@@H]1C[C@H](N=[N+]=[N-])[C@@H](O)C[C@H]1NC(=O)OC(C)(C)C 309772738 BKORQFRBLKLSCW-ZNSHCXBVSA-N 328.369 1.893 10 10 EDCE O=C1NC(=S)NC(=O)C1=CN[C@@H](c1ccc(Cl)cc1)C1CC1 72680476 ZQUKGWYPGGRBAM-GFCCVEGCSA-N 335.816 1.796 10 10 EDCE CN(C)C[C@H]1COCCN1Cc1cc(Br)ccc1O 1203649820 HPYZVUGMFGYKQS-ZDUSSCGKSA-N 329.238 1.917 10 10 EDCE CCOC(=O)N1CCC(NC(=O)N(C(C)=O)c2ccc(N)cc2)CC1 242620251 CMPNWQIFCMVWOL-UHFFFAOYSA-N 348.403 1.952 10 10 EDCE Cc1ccc(CN2C[C@@H](C(N)=O)C[C@@H](N)C2)c(O)c1Br 2381130941 GVUAFAUYGKJTKJ-WDEREUQCSA-N 342.237 1.098 10 10 EDCE CC(C)N(C[C@@H](C)O)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803686179 YHDPGIIGHMBOAO-CQSZACIVSA-N 347.459 1.303 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CCN1C(=O)CCC1=O 808095385 DIGITYKVBDITNT-UHFFFAOYSA-N 325.361 1.033 10 10 EDCE CCN[C@@H](c1ccccc1O)[C@H](O)c1nn(C)nc1Br 2167727790 XHIASCRXYIZHBI-JQWIXIFHSA-N 341.209 1.667 10 10 EDCE COc1ccc(N2CCN(CCNCc3cc(C)n(C)n3)CC2)cc1 840885283 BEFRIHPUOAWLML-UHFFFAOYSA-N 343.475 1.649 10 10 EDCE CC[C@H](NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)C(=O)NC 852448174 HFJQIVDFCRWKQY-WFASDCNBSA-N 334.420 1.098 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc(C(C)(C)N)no3)C2)cc1 852900826 SNOCLXWVZJCCTI-GFCCVEGCSA-N 344.415 1.886 10 10 EDCE Cc1ccc([C@H](C)NCC[C@H]2CNCCS2(=O)=O)c(O)c1C 925796316 OJHLCZYQWQTRNX-KBPBESRZSA-N 326.462 1.436 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1c(O)cccc1F)C1CCOCC1 921451777 VTOGTMFELCABTI-OAHLLOKOSA-N 347.408 1.392 10 10 EDCE CS(=O)(=O)N1CCCC[C@H]1CNCc1ccc2c(c1)CCCO2 922122576 AQBTYAIRLWJMSR-INIZCTEOSA-N 338.473 1.915 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CC[C@H](O)CC3)C2)cc1 852448982 OZGAUPIRZDAACT-IIAWOOMASA-N 333.432 1.877 10 10 EDCE CN1CCN(c2ccc(CNCCO[C@@H]3CC3(F)F)cc2)CC1 850365780 OPLRFAPIYMPXTH-MRXNPFEDSA-N 325.403 1.952 10 10 EDCE CC[C@@H]1[C@@H](C(=O)NCc2ccc(N3CCOCC3)cc2)CCN1C 864984234 JZFNISUOXPVMNP-ZWKOTPCHSA-N 331.460 1.870 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)C1(C(=O)NC2CC2)CCC1 935946305 FABWJLGHXDUATJ-UHFFFAOYSA-N 337.416 1.943 10 10 EDCE C[C@@H](NC1CCN(C(N)=O)CC1)c1ccc(N2CCOCC2)cc1 765328392 FJJCJKTULOSHPJ-CQSZACIVSA-N 332.448 1.717 10 10 EDCE COc1ccc(O)c(CNC(c2ccnn2C)c2ccnn2C)c1 862538733 DLJRPIFQLXSGDE-UHFFFAOYSA-N 327.388 1.747 10 10 EDCE CNCCOCCNC(=O)N(Cc1ccco1)Cc1ccccc1O 861676996 MTHBTIGDBRISAN-UHFFFAOYSA-N 347.415 1.933 10 10 EDCE O[C@H](CNCc1ccc(N2CCOCC2)c(F)c1)c1cccnc1 771978170 JTGBBBGWWJDNRX-GOSISDBHSA-N 331.391 1.881 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H](N)CC3CC3)CC2)cc1 884234788 DHRVKGXDSQSDLM-GOSISDBHSA-N 346.475 1.061 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CC[C@H](N2CCOC2=O)C1 898673881 YWNAHSXIJLVQLX-JTQLQIEISA-N 348.380 1.979 10 10 EDCE COC(=O)[C@@H](NCc1cc(OC)c(OC)cc1O)c1ccn(C)n1 787438010 FYPPJCDFWMCVPW-HNNXBMFYSA-N 335.360 1.147 10 10 EDCE CNC(=O)[C@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 896293772 FPYLNKTWQQEKPI-VIFPVBQESA-N 334.397 1.911 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@]1(O)CCN(Cc2ccccc2)C1 1176748206 MNYNEVMAKVCOSH-LJQANCHMSA-N 342.395 1.351 10 10 EDCE COc1cnc(NCc2ccc(N3CCN(C)CC3)c(F)c2)nc1 1324001545 QNEFJZBKORTGOS-UHFFFAOYSA-N 331.395 1.988 10 10 EDCE C[C@@H](O)CCN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 135565392 FRMRSMWEURLYNP-KRTXAFLBSA-N 328.210 1.608 10 10 EDCE C[C@@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1346767623 FKXVIWNZYCNSDN-CZUORRHYSA-N 345.443 1.226 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](C)N(C(=O)CCCC(N)=O)C2)cc1C 1278430037 DBRUPIWCUJRCJK-ZBFHGGJFSA-N 347.459 1.738 10 10 EDCE CCN(CC)C(=O)N1CCC(C(=O)NCc2cc(O)ccc2O)CC1 1471661347 ODMMKGLICHWFPO-UHFFFAOYSA-N 349.431 1.888 10 10 EDCE C[C@@H](NC(=O)N[C@@H]1CCN(c2cc(O)ncn2)C1)c1ccccc1O 1471524196 SHGYTHPLPJDFOI-VXGBXAGGSA-N 343.387 1.527 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCN(c2cc(O)ncn2)C1 1472253840 CHNGWNKPIVARCU-FXMSTWTQSA-N 342.355 1.002 10 10 EDCE C[C@@H](C(=O)NCc1c(O)ccc2ccccc12)N1C(=O)CCC1=O 1472085960 GDGUVIPUMNWVGM-NSHDSACASA-N 326.352 1.699 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C[C@@H]2CCN(C)C2=O)cc1C 1480484781 VPZNAMQANRBNAG-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE COc1ccc(CNC2(CNC(=O)C[C@H]3CCNC3=O)CC2)cc1C 1483740795 ROTFBEVQMLAXPJ-OAHLLOKOSA-N 345.443 1.268 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)C[C@@H]2CCNC2=O)cc1C 1713409184 PGVMIXQJVHBQJA-ZBFHGGJFSA-N 347.459 1.514 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCC[C@H]1CCOC1 1480602030 JANJVGJYGJFUOB-OLZOCXBDSA-N 347.419 1.984 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H]2CC=CCC2)cc1C 1496935574 GBBMEQMJMJLIAF-IRXDYDNUSA-N 332.444 1.927 10 10 EDCE CS(=O)(=O)c1cc(NC(=O)Cc2ccc(O)c(O)c2)ccc1F 1556615344 CBFLTNBZQQGEBW-UHFFFAOYSA-N 339.344 1.822 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCS(=O)(=O)[C@H]2CCCC[C@@H]21 1631521170 WARLZQNQBYTQLW-WFASDCNBSA-N 339.413 1.209 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@H]2CCCC(=O)N2)cc1C 1497608444 NZCQEVBPWOSMDF-MJSXRHKHSA-N 345.443 1.434 10 10 EDCE COc1cccc(CNC(=O)[C@H]2Cc3cc(F)ccc3NC2=O)c1O 1566374303 CIAFWZCRQMHBGD-CYBMUJFWSA-N 344.342 1.967 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cn(C)c(O)n2)cc1C 1568914073 RDQDEFGPXPGKRF-SNAWJCMRSA-N 344.415 1.519 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)Nc1cccc(O[C@H]2CC(=O)N2)c1 1637903581 CNCQJMLWXKDDSJ-FZMUQLTDSA-N 340.335 1.975 10 10 EDCE CCC(CC)C(=O)NC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1737550294 ABTRIWBIJCEHAZ-NSHDSACASA-N 337.420 1.770 10 10 EDCE CC(C)N(C[C@H]1CCC(=O)N1)C(=O)c1ccc(N=NC(N)=O)cc1 1570409793 FUJQHQWIMDRAHT-CYBMUJFWSA-N 331.376 1.978 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CC(NC3COC3)C2)cc1 1648028350 YQUPPBVVUGYSPQ-UHFFFAOYSA-N 325.412 1.907 10 10 EDCE NS(=O)(=O)CCCCCC(=O)NCc1cccc(Cl)c1O 1653567089 JVTWWOHTSVYEGV-UHFFFAOYSA-N 334.825 1.511 10 10 EDCE CO[C@H](C)C(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1689406915 OTOIQZJQJXHDOC-NXEZZACHSA-N 335.364 1.118 10 10 EDCE CN[C@@H](c1ccccc1O)[C@](O)(CNC(=O)OC(C)(C)C)COC 1921803928 LXKCXLIBMHDHEF-YOEHRIQHSA-N 340.420 1.555 10 10 EDCE CN[C@H](COC)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952207388 CZQZCJZVLYYSID-CHWSQXEVSA-N 340.420 1.768 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)N2CC(N=[N+]=[N-])C2)CC(O)C1 1987681095 OJVFSQOHGJRXBF-UHFFFAOYSA-N 325.369 1.173 10 10 EDCE COCCNCc1ccc(N2C[C@H](O)[C@H](F)C2)cc1Br 2149241884 LNDFLIIMMRXWTK-KGLIPLIRSA-N 347.228 1.704 10 10 EDCE C[C@@H](O)c1ccc(N(C)CC(C)(CO)CO)cc1Br 689301439 IOVNXZQBPUTZND-SNVBAGLBSA-N 332.238 1.930 10 10 EDCE CC(F)(F)C1(C(=O)NCc2c(O)cc(O)cc2O)CCOCC1 2062006749 FUCBUDSVORBSHF-UHFFFAOYSA-N 331.315 1.872 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCO[C@H](COC(C)C)C3)c2n1 2062553792 XLUKSBUXKOTTON-LBPRGKRZSA-N 334.376 1.009 10 10 EDCE CO[C@H]1[C@@H](C(=O)NCCN=[N+]=[N-])N(C(=O)OC(C)(C)C)C[C@H]1OC 1911418903 PYUZVWFGFDSKKR-OUAUKWLOSA-N 343.384 1.062 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)c(F)c1Br 2189070705 FOTQCNKQVTZPIP-WDAIWFPHSA-N 345.212 1.490 10 10 EDCE O=C1CO[C@H]2CCN(c3ccc(CO)c(Br)c3)C[C@@H]2N1 2185521781 KVCIMKJBKYRSOB-STQMWFEESA-N 341.205 1.035 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)C[C@@H]2CO)c(Br)c1 2089863107 HCSGPJONNQDXIF-JBLDHEPKSA-N 330.222 1.682 10 10 EDCE OCc1ccc(N2CC[C@@H]3OCCO[C@@H]3C2)c(Br)c1 2095426238 JGDARYBDPDWEEM-UONOGXRCSA-N 328.206 1.936 10 10 EDCE C[C@H](CO)N1CCN(c2ccc(CN)cc2Br)CC1 2113062911 XRWNLJWYRLIITP-LLVKDONJSA-N 328.254 1.411 10 10 EDCE C[C@H]1[C@H](C)S(=O)(=O)CCN1c1ccc(CO)c(Br)c1 2113961558 KLTRYNDRPOGISF-UWVGGRQHSA-N 348.262 1.953 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@H]1CCn2cnnc2C1 2236576723 CIEYCHULOYCYFM-JTQLQIEISA-N 341.184 1.990 10 10 EDCE COCCN1C(=O)C(=C2C(=O)N(C)c3ccccc32)SC1=S 2296664614 QZPAEVMNFZLJCA-UHFFFAOYSA-N 334.422 1.881 10 10 EDCE Cc1cccc(N2C(=O)C(=CNC[C@@H]3CCCO3)C(=O)NC2=S)c1 2297317905 HJIQVVQRSWLPON-ZDUSSCGKSA-N 345.424 1.395 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 2300531660 JXUIITXOIOPAKX-NEPJUHHUSA-N 341.412 1.763 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)c(Br)c1 2355335592 DFDFXLNKVFYRGG-DPQXWDTRSA-N 341.249 1.789 10 10 EDCE C[C@H]1CN(CCCNC(=O)CSc2nccs2)C[C@@H](C)O1 52914334 KNERMPOLWMEWLK-TXEJJXNPSA-N 329.491 1.851 10 10 EDCE COc1ccc(N2CCN(Cc3nnnn3C(C)(C)C)CC2)cc1 20098601 ULMCVICNOLRGQL-UHFFFAOYSA-N 330.436 1.759 10 10 EDCE CC[C@H](C(=O)N1CCN(c2ccc(OC)cc2)CC1)N1CCCC1=O 174941380 GOZNHGWOHGHDKT-QGZVFWFLSA-N 345.443 1.745 10 10 EDCE CCN1CCC(CN)(N2CCN(c3ccc(OC)cc3)CC2)CC1 22812761 CAHHDUDBAXKZNQ-UHFFFAOYSA-N 332.492 1.630 10 10 EDCE CC(C)N(C[C@H](C)O)C(=O)NCc1ccc(N2CCOCC2)cc1 119894519 MKCNAUWMZWXRCE-HNNXBMFYSA-N 335.448 1.824 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)C[C@H]3CCO3)c(Br)cc21 2366919374 QZAMACSGSSBBTQ-OQPBUACISA-N 340.221 1.887 10 10 EDCE CN(Cc1ccccc1)C(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)O 383243615 PLTHWWPHKDXVQN-CQSZACIVSA-N 344.367 1.935 10 10 EDCE C[C@@H]1CN(C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c2ccccc21 255613026 OGRKKYNDNOBAML-JLVNDZCYSA-N 325.368 1.248 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(C)C[C@H]3CCCO3)nc12 263910741 LYXNXQJDMWLPHS-GFCCVEGCSA-N 334.376 1.222 10 10 EDCE Cc1ccc(CN(C)C(=O)C[C@H](N)C(=O)O)c(O)c1Br 2380762389 NRCPROOGPYHBCY-VIFPVBQESA-N 345.193 1.224 10 10 EDCE COc1ccc(N2CCNC[C@@]2(C)CO)c(OC)c1Br 2162847359 LHKZEFNFQAPNEQ-AWEZNQCLSA-N 345.237 1.627 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc(O)c(O)c1)C2 819396812 BYZIATSGYFPHJG-MJBXVCDLSA-N 348.399 1.623 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CCCNC3=O)C2)cc1 824284764 VYUTUKJJUOWXSO-CJNGLKHVSA-N 346.431 1.099 10 10 EDCE COCc1n[nH]c(CNC(=O)N(C)Cc2ccc(N(C)C)cc2)n1 821177630 NCBKLZKOEFTLBH-UHFFFAOYSA-N 332.408 1.359 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H](Cn2ccnn2)C1 588408605 MGSOAOJMHVTPSM-KXQLTZBTSA-N 328.372 1.641 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1n[nH]cc1F 900902747 YFOATQUICGMOBO-UHFFFAOYSA-N 336.342 1.579 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC3(C2)CC3(F)F)c1 848258961 WDWBAQOAGLYAMZ-UHFFFAOYSA-N 332.328 1.245 10 10 EDCE COC[C@H]1C(=O)N[C@@H](c2ccc(N(C)C)cc2C(F)(F)F)N1C 840834420 RCKWIUGOFBRSTL-QWHCGFSZSA-N 331.338 1.847 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)[C@@H]4C[C@H](F)CN4C3=O)C2)cc1 849358051 RFUMYJMJPYCZMG-WHOFXGATSA-N 333.363 1.649 10 10 EDCE CS(=O)(=O)NC[C@H]1CCC[C@@H]1NC(=O)Nc1ccc(N)cc1 841298346 APKRGJRRCQBPLT-MFKMUULPSA-N 326.422 1.108 10 10 EDCE CNC(=O)[C@]1(C(F)(F)F)CCN(C(=O)c2cccc(O)c2O)C1 844097625 RPCZSCHXBMTRGS-ZDUSSCGKSA-N 332.278 1.238 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)[C@@H]4[C@@H](O)CCCN4C3=O)C2)cc1 849356356 DUEIVTQHKSYJNC-BPUTZDHNSA-N 345.399 1.061 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCC[C@H](N3CCNCC3=O)C2)cc1 843063368 ABDHNHMPXMQJDY-UABKOXTMSA-N 342.487 1.662 10 10 EDCE CCO[C@H](CS(=O)(=O)NCc1ccc(N(C)C)cc1)C1CC1 858883509 PNMIYBMCRRAXNR-MRXNPFEDSA-N 326.462 1.987 10 10 EDCE CO[C@H](CNC(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CCOC1 852439920 JPTCDJLNGIJXQO-NVXWUHKLSA-N 335.448 1.946 10 10 EDCE CC[C@@H](CCO)CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 854300660 XRUIWDKWMVUCSQ-GJZGRUSLSA-N 335.448 1.982 10 10 EDCE COC(=O)[C@@H]1C[C@H]1[C@@H](C)NCc1ccc(N2CCC(O)CC2)cc1 850406638 NWYGEGMWTPGZJB-JEBQAFNWSA-N 332.444 1.935 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2cc(C)cc(C)c2O)C1 863341802 VAUVFICHNAWOPO-AWEZNQCLSA-N 326.462 1.770 10 10 EDCE O=C(CC1CS(=O)(=O)C1)NCc1cc(Br)ccc1O 868306952 JEDAMWKKSDDCPM-UHFFFAOYSA-N 348.218 1.206 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CC[C@@H](C)NC1 861804441 JHOLDXYPEXRVEA-GDBMZVCRSA-N 347.459 1.778 10 10 EDCE COc1ccc(N2CCN(C[C@@]3(O)CCCOC3)CC2)c(OC)c1 879461858 NRDJUFASWZHXQP-SFHVURJKSA-N 336.432 1.367 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ncccc3N)CC2)c(OC)c1 870165795 AGCBEUHFXIXGPB-UHFFFAOYSA-N 342.399 1.643 10 10 EDCE CC[C@H]1NC(=O)N(Cc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1=O 777609094 AURDPJHRFLBTTN-UKRRQHHQSA-N 344.415 1.219 10 10 EDCE CCc1noc(COCC(=O)N[C@H](C)c2cc(OC)ccc2O)n1 1137473670 QXSBQAVZDAGOPS-SNVBAGLBSA-N 335.360 1.740 10 10 EDCE COC(C)(C)[C@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1303921173 LNOQGYINWIYBFM-VIFPVBQESA-N 330.406 1.307 10 10 EDCE CNC(=O)N[C@@H]1CCCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 1164146690 YTDCJRLLEBDASK-SNVBAGLBSA-N 338.364 1.510 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C[C@@H]1F 1257535440 IOPQCXFCFXDMDC-FZMZJTMJSA-N 339.386 1.714 10 10 EDCE CCNC(=O)CC(=O)N1C[C@H](C)[C@H](NCc2ccc(OC)c(C)c2)C1 1281389240 DJWLLBWCCRIAFJ-GOEBONIOSA-N 347.459 1.466 10 10 EDCE C[C@H](CN1CCOCC1)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1448794942 JHUQSGUBBPISQY-GFCCVEGCSA-N 333.392 1.642 10 10 EDCE CNC(=O)COc1cccc(CC(=O)NCc2c(O)cccc2O)c1 1635847968 YFVNCXVDSJNIJI-UHFFFAOYSA-N 344.367 1.082 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCC[C@@H](c2nn[nH]n2)C1 1566693084 JIQXSXKJGHOGQI-MRVPVSSYSA-N 345.384 1.845 10 10 EDCE COc1ccc(-n2nnnc2CN[C@@H](C)CNC(=O)C2(C)CC2)cc1 1731594766 PXRNHNDCTGZRPJ-LBPRGKRZSA-N 344.419 1.065 10 10 EDCE CC[C@@H](CNC(=O)[C@@H](C)n1cncn1)NCc1ccc(OC)c(C)c1 1732198047 WYAAULRFPBPGAA-ZBFHGGJFSA-N 345.447 1.841 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CCC(=O)N2)cc1C 1732406967 DUWNNLDHVNLNJI-DZGCQCFKSA-N 333.432 1.219 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@H]2COC(=O)C2)cc1C 1731903506 QWSOEZLYMFXWAI-OAHLLOKOSA-N 334.416 1.505 10 10 EDCE CO[C@H](C)CNC[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1731683534 AKFHFWCCUOLOKD-CHWSQXEVSA-N 347.419 1.936 10 10 EDCE COc1cc(C(=O)N[C@@H](C)C[C@H](C)NC(=O)CC2CC2)cc(OC)n1 1681525536 ILXCIQDVUGXZHE-RYUDHWBXSA-N 349.431 1.912 10 10 EDCE COc1ccc(Br)c(CN2CC[C@](C)(C(N)=O)C2)c1O 1964583744 ZKJAKISBWNWLGM-AWEZNQCLSA-N 343.221 1.861 10 10 EDCE COCCNCc1ccc(N2C[C@H](O)[C@H]2C)cc1Br 2126123208 NXEMJGBMCKSGEW-YGRLFVJLSA-N 329.238 1.755 10 10 EDCE OCc1ccc(N2CCN3CCOC[C@@H]3C2)cc1Br 2129367886 DDUGUXGVYAHWPG-ZDUSSCGKSA-N 327.222 1.462 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)c(Br)c1 2133921770 YQTNHBUFHIPRRS-WTDIUWLJSA-N 327.222 1.371 10 10 EDCE CN(C)[C@@H]1COC[C@@H]1CNCc1c(O)cccc1Br 1924632411 FWGQCSQSIFQZNJ-GXFFZTMASA-N 329.238 1.821 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)[C@H](C)CO)c(Br)cc21 122535807 CMHFNTZKWREQSS-KRTXAFLBSA-N 328.210 1.479 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1COCCN(C(=O)OC(C)(C)C)C1 1985096116 NFYHJNYKZWKTQD-NSHDSACASA-N 327.385 1.639 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](CO)(NCc2cc(F)ccc2O)C1 2016029011 JRQCIPCEIZMJCT-QGZVFWFLSA-N 340.395 1.993 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)C(=O)NCc1cccc(C)c1O 2024812829 RBWSJHTUWFBYSA-ZDUSSCGKSA-N 338.404 1.857 10 10 EDCE CC(C)(C)N(CCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 689973248 YALNGBLSADAKKL-GFCCVEGCSA-N 342.237 1.998 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@H]2C3)cc1Br 2173317247 KCBSCCLWQDNUQP-REYDYLPWSA-N 341.249 1.789 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)cc1Br 2173357571 NRYWULHGYCXGKD-XSXLEWDISA-N 342.233 1.823 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)cc1Br 2182555737 KPPRLZPSHLZPNP-TUWBQHJRSA-N 341.249 1.647 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1CNC(=O)COc1ccc(N)cc1 2053958149 SQPPMFGAJCGFEZ-OLZOCXBDSA-N 349.431 1.925 10 10 EDCE O=C1Nc2cc(N3CC=C[C@H](O)C3)c(Br)cc2[C@H]1O 2108771871 BAVFMPZMGPZGRQ-JVXZTZIISA-N 325.162 1.172 10 10 EDCE Oc1c(F)cc(Br)cc1CN1C[C@@H]2OCCO[C@H]2C1 2093357698 MJKRCZKACWLFBD-RYUDHWBXSA-N 332.169 1.893 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc(COc2nnc(=N)[nH]n2)cc1 2213781047 NKEIBQSUTYAYGG-UHFFFAOYSA-N 332.364 1.283 10 10 EDCE COc1ccc(Br)c(CNCCn2cc(C)nn2)c1O 2236033306 RJMZFTOVYZQUPD-UHFFFAOYSA-N 341.209 1.853 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)NCCNC(=O)c1ccccc1 2307982139 PJVFIMJNHIUSRE-UHFFFAOYSA-N 326.352 1.657 10 10 EDCE CCN1CCN([C@H](C)CNC(=O)C=Cc2ccc(O)c(O)c2)CC1 2307987220 LCVANZKIIDITFP-CQSZACIVSA-N 333.432 1.253 10 10 EDCE CCN1C(=O)NC(=O)C(=Cc2cc(C)n(C[C@H]3CCCO3)c2C)C1=O 2313630147 OSBQWOSUJVNYJK-CQSZACIVSA-N 345.399 1.766 10 10 EDCE Cc1nc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)no1 175676794 FAOMINFAAOPASB-UHFFFAOYSA-N 347.444 1.931 10 10 EDCE COc1ccc(O)c(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)c1 179659828 TVUQCOZQYVDRRC-CQSZACIVSA-N 334.416 1.472 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C(NCc3ccc(O)c(O)c3O)[C@@H]2C1 302104965 GOPXKJJBAJXOFA-GHMZBOCLSA-N 336.388 1.758 10 10 EDCE COC(=O)N1CCC[C@@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 66269688 WCGDMBMRWXETDZ-MRXNPFEDSA-N 347.415 1.575 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1CNCc1ccc(O)cc1O 305880899 ALGNFSKCILSFCE-ZDUSSCGKSA-N 338.404 1.823 10 10 EDCE COc1ccc(N2CCN(CN3C(=O)[C@H]4CC[C@H]3C4)CC2)cc1F 132811092 UFZZHDIZPKCKEU-ZFWWWQNUSA-N 333.407 1.925 10 10 EDCE C[C@H](Cn1cncn1)NC(=O)NCc1c(O)ccc2c1CCCC2 266789354 SHJZDPVZUBBPBT-GFCCVEGCSA-N 329.404 1.750 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC(F)(F)C[C@H]2CO)cc1F 368709752 KZJKVOQIENWFIU-NSHDSACASA-N 331.338 1.803 10 10 EDCE Cc1ccc(CN2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)c(O)c1Br 2380805571 QZHIPWGCUSGWRM-ASHKBJFXSA-N 342.233 1.922 10 10 EDCE C[C@@H](CN(C)C)N(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2379903758 RWJKXYZYBFGVOO-SDBXPKJASA-N 342.237 1.821 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(C(C)C)[C@H]3CCOC3)nc12 291702162 IBDGLZCXPXYRNM-ZDUSSCGKSA-N 348.403 1.611 10 10 EDCE COCCNC(=O)CN(C)c1ccc([C@@H](C)N)cc1Br 723185310 LUVWHYNFNQVBKO-SNVBAGLBSA-N 344.253 1.668 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)COc2ccc(O)cc2)cc1 832266733 IEALZJFEINGSDW-QGZVFWFLSA-N 329.400 1.653 10 10 EDCE C[C@H](NC(=O)CN1CCN(C2CC2)C1=O)c1ccc(N(C)C)cc1 832431857 WPOLDQZXVIJGAQ-ZDUSSCGKSA-N 330.432 1.830 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)C2C[C@H]3COC[C@@H](C2)C3=O)cc1 832273463 OEEAXPHVXXRGRN-UCMJJCQDSA-N 345.443 1.110 10 10 EDCE COCCN1CCC[C@H]1CNC(=O)NCc1c(O)cccc1F 917830481 YWSQVAWINUCJRF-LBPRGKRZSA-N 325.384 1.441 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)c2nn(C)cc2[N+](=O)[O-])cc1 844853886 FRICOWFRILWCIV-UHFFFAOYSA-N 347.375 1.545 10 10 EDCE COc1ccc(CNCC[C@H]2CC(=O)N(C)C2)cc1Cn1cccn1 922484283 IXSDKYPNFALOTD-INIZCTEOSA-N 342.443 1.898 10 10 EDCE CSC[C@H]1NC(=O)N([C@H](C)c2ccc(N3CCOCC3)cc2)C1=O 924533867 NKEBLTKOORBOOQ-IUODEOHRSA-N 349.456 1.868 10 10 EDCE CN(C)C(=O)N(C)[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C1 857328806 HAOOMWIVWZABIA-SECBINFHSA-N 325.340 1.065 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3[C@H](C)O[C@H](C)[C@H]3C)nc12 859827997 VMKPJVUPPFZVBN-OZWUEAAUSA-N 348.403 1.513 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@@H](CO)C3CCC3)CC2)cc1 852321237 SHPGUERADJIDHN-SFHVURJKSA-N 347.459 1.094 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2CCN(CC(C)(C)O)C2)c1 866412473 JKKPELIWTIBNLD-OCCSQVGLSA-N 336.432 1.675 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]3CNCC[C@H]32)cc1 866716829 RXQOFEDVXSFORH-SJLPKXTDSA-N 330.476 1.443 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]3CNCC[C@@H]32)cc1 866716827 RXQOFEDVXSFORH-AEFFLSMTSA-N 330.476 1.443 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@@H]2NCC[C@@H]21 866722982 BFRJRRFFYMPLQS-ROUUACIJSA-N 330.476 1.537 10 10 EDCE CCOC(=O)c1cccc(/C=C2/SC(N3CCOCC3)=NC2=O)n1 863182083 ZIMZQSGWGMXUJN-JLHYYAGUSA-N 347.396 1.561 10 10 EDCE CC(C)(C)OC(=O)Cn1cc(C(=O)N2Cc3cccc(O)c3C2)nn1 871208114 YAYNNVVYUKLSEG-UHFFFAOYSA-N 344.371 1.481 10 10 EDCE COc1cccc(CNC(=O)c2cc3c(O)ncnc3cn2)c1O 779002463 YUSQXIOEWQBXPO-UHFFFAOYSA-N 326.312 1.375 10 10 EDCE NC(=O)N1CC(CNCc2cc(Cl)cc(Br)c2O)C1 1875454725 YYZFOQZPUFXJDN-UHFFFAOYSA-N 348.628 1.908 10 10 EDCE COc1cccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 785422930 PZYNRFPOVVQKIL-UHFFFAOYSA-N 342.399 1.089 10 10 EDCE Cc1ccc(C(=O)NC[C@@H](Cc2ccc(F)cc2)C(N)=O)c(O)c1O 780910147 XZTNNPIQELVKBC-GFCCVEGCSA-N 346.358 1.619 10 10 EDCE CNC(=O)[C@@H]1CCC[C@H]1NC(=O)c1cc2cc(O)c(O)cc2s1 897268551 MIBXKRSSIZFLQN-NXEZZACHSA-N 334.397 1.957 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@](C)(O)Cn2ccccc2=O)cc1F 790599002 QCJXDURGILGPHZ-SFHVURJKSA-N 347.390 1.121 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@H](O)CC[C@H]3C)C2)cc1 1230858000 HAMGFWKPKYOZBF-IIAWOOMASA-N 333.432 1.829 10 10 EDCE CN1CC[C@H](N(C)c2ccc(CN)c(Br)c2F)C1=O 690230836 DQYHVKGFHLHXQQ-JTQLQIEISA-N 330.201 1.714 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)[C@@H](C)C2CC2)cc(OC)n1 1337099048 CKYCEGQRVKXFRM-NEPJUHHUSA-N 349.431 1.722 10 10 EDCE COCCN[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1(C)C 1284350256 UJYKYEFNTJCONP-AWEZNQCLSA-N 347.419 1.936 10 10 EDCE CSc1ccccc1C(=O)N1CCS(=O)(=O)[C@@H]2COCC[C@@H]21 1451145175 RYTTWNMFMXFIOV-GXTWGEPZSA-N 341.454 1.437 10 10 EDCE NS(=O)(=O)c1ccc(CC(=O)N2Cc3cccc(O)c3C2)cc1 1455037868 WCROJPAXFLQJJP-UHFFFAOYSA-N 332.381 1.125 10 10 EDCE Cn1ncc(CNCc2ccc(O)c(O)c2O)c1Br 2116554257 JHPJBIAKTXOOAP-UHFFFAOYSA-N 328.166 1.589 10 10 EDCE C[C@@H](NC(=O)c1cc(S(N)(=O)=O)ccc1O)c1ccccc1O 1471195061 AETGICIUBLUQQO-SECBINFHSA-N 336.369 1.236 10 10 EDCE COc1ccc(CNC(=O)[C@]2(C)Oc3ccccc3NC2=O)c(O)c1 1626079455 FASYBZBJZFCNRB-SFHVURJKSA-N 342.351 1.807 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2[nH]c(O)nc2C)cc1C 1483026250 ZKZMODRNHGAWMU-SNAWJCMRSA-N 344.415 1.817 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CCNC(=O)C2)cc1C 1482271906 HGRYMAYZTLOHPP-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2CCC(=O)N2C)cc1C 1717738144 LOXNADZVDKVEEH-GOEBONIOSA-N 347.459 1.561 10 10 EDCE O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NCc1c(O)cccc1O 1635843352 NSNDPERLSCNHPR-UHFFFAOYSA-N 342.311 1.672 10 10 EDCE C[C@@H]1OCC[C@]12CN(C(=O)c1ccc(N=NC(N)=O)cc1)CCO2 1568618815 OAPPQYYREALMAM-ZBEGNZNMSA-N 332.360 1.869 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@]2(C)CCNC2=O)cc1C 1568918611 QSTIJFVIHLMAQQ-PHWHVTFISA-N 345.443 1.292 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)Cc2cscn2)cc1C 1568582693 DJXSTRKUDNIELJ-OAHLLOKOSA-N 349.456 1.270 10 10 EDCE COCC(C)(C)C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1736802385 NRKONKGITVHQLY-UHFFFAOYSA-N 349.391 1.368 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)C=C2CCC2)cc(OC)n1 1738804705 OBMAEFUSULKWMD-GFCCVEGCSA-N 347.415 1.786 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H]2CNC(=O)CC2CC2)cc1 1584554456 QVEPZHNRBWDIRG-AWEZNQCLSA-N 343.387 1.980 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2cnc(C)s2)cc1C 1676510189 CQUSHGZDCMJAJB-CQSZACIVSA-N 349.456 1.649 10 10 EDCE O=C(O)CNC(=O)CCN1C(=O)/C(=C/c2ccco2)SC1=S 15038319 PNJLYHNLXBKZTI-TWGQIWQCSA-N 340.382 1.072 10 10 EDCE CC1(CNCc2ccc(Br)cc2O)CS(=O)(=O)C1 1967853254 VWTFVDWXAMBMHW-UHFFFAOYSA-N 334.235 1.679 10 10 EDCE CN(C)C[C@H]1C[C@H](O)CN1c1ccc(CN)c(Br)c1 228153786 FZZPZPHONUCWMI-OLZOCXBDSA-N 328.254 1.409 10 10 EDCE Nc1ccc(CC(=O)N[C@H](COCc2ccccc2)C(=O)O)cc1 1946580155 UBZDVTWTCBKBTQ-MRXNPFEDSA-N 328.368 1.598 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H]1CCNC1=O 1952209581 VYZMGTJZIGHKSY-NEPJUHHUSA-N 336.388 1.670 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@]1(CO)C(=O)NCCCN=[N+]=[N-] 1985096157 NPXZQTHWKGQTKI-CQSZACIVSA-N 327.385 1.565 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CN(CCCN=[N+]=[N-])CCN2C1=O 2006170759 OJHBKNUTMZVBPM-RYUDHWBXSA-N 338.412 1.497 10 10 EDCE O=C(OCCOCCOCc1ccccc1)c1cc(O)nc(O)c1 2007844789 LDEBGOCAFNOXNI-UHFFFAOYSA-N 333.340 1.883 10 10 EDCE CS(=O)(=O)C1CN(c2cc(Br)c(CN)cc2F)C1 2034833968 VFRNCLUQYUHWRU-UHFFFAOYSA-N 337.214 1.280 10 10 EDCE O=C1Nc2cc(N3CC[C@@H]4COC[C@H]43)c(Br)cc2[C@@H]1O 2198557215 QSXFVUAAMUHXHH-BLBGDKDGSA-N 339.189 1.660 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1908254866 WVNSWYDSFMBNEL-GRYCIOLGSA-N 339.396 1.827 10 10 EDCE CN(Cc1ccccc1O)C(=O)CN1CC(NC(=O)OC(C)(C)C)C1 2060123744 LBUYZBAAGSAABD-UHFFFAOYSA-N 349.431 1.560 10 10 EDCE CN(CCc1nc(=NCc2ccccc2O)[nH][nH]1)C(=O)OC(C)(C)C 2065561436 QAXLGUKQRRKODS-UHFFFAOYSA-N 347.419 1.954 10 10 EDCE Nc1ccc(CS(=O)(=O)N2CCCC[C@@H]2C2OCCO2)cc1 2089563279 NYTOXHMJEZEBKL-CQSZACIVSA-N 326.418 1.326 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213584406 CXXCWAVJCIRJQV-UTUOFQBUSA-N 340.428 1.789 10 10 EDCE CNC[C@@]1(O)CCCN(Cc2cc(Br)ccc2O)C1 2270825447 VFDUUPCWWUFZTA-AWEZNQCLSA-N 329.238 1.701 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCC[C@@H](O)[C@H]2O)c1O 2236054124 FCQXMJSIBJKSRC-GYSYKLTISA-N 346.221 1.527 10 10 EDCE COc1ccc(N2C[C@@H](CO)[C@@H](O)C2)c(OC)c1Br 2226549016 KIXNFWFBNJHJII-WPRPVWTQSA-N 332.194 1.256 10 10 EDCE Cc1ccc(OCc2nn(C)cc2I)c(N)n1 2302779562 WVVKHLZHPSJUFE-UHFFFAOYSA-N 344.156 1.889 10 10 EDCE Cc1ccc(CNCC[C@@H]2COC[C@H]2O)c(O)c1Br 2352670862 KXHBBXBZISGYJZ-VXGBXAGGSA-N 330.222 1.950 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2355334683 RJDMAUDHQFQHBI-UVCAVOOOSA-N 341.249 1.489 10 10 EDCE CCC1=C(C(=O)OC)[C@H](c2ccc(N(C)C)cc2)n2nnnc2N1 45895974 JFYWKUYBPMJESI-AWEZNQCLSA-N 328.376 1.591 10 10 EDCE COc1ccc(N(C)CC(=O)NC2CCN(C3CC3)CC2)c(OC)c1 131761028 FGSQHOOEBYOWKR-UHFFFAOYSA-N 347.459 1.883 10 10 EDCE CN(C)c1ccc(/C=C/C(=O)NCCCCN2CCOCC2)cc1 41530329 KNVHZCMXLGYFPG-JXMROGBWSA-N 331.460 1.994 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3[C@H]4CC[C@@H](C4)[C@H]3N)CC2)cc1 246725453 OTGAQSDCESFFCE-DFEHZGFQSA-N 329.444 1.717 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2[C@H]3CCNC[C@@H]32)c(O)c1Br 2381141967 HDNGCAQVMGSCHZ-SDDRHHMPSA-N 339.233 1.935 10 10 EDCE CN1CC[C@H](N(C)c2ccc(CN)cc2Br)CC1=O 2131957920 KYLJHVBUQRJCPL-NSHDSACASA-N 326.238 1.965 10 10 EDCE Cc1ncsc1CN(C)Cc1cc(O)n2ncc(C(=O)O)c2n1 738373129 ASEICSCNLAEBFP-UHFFFAOYSA-N 333.373 1.530 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCNC[C@@H]1C 842265701 LZVQWNHGMMOHTI-WMLDXEAASA-N 346.475 1.215 10 10 EDCE O=C(NCC[C@@]1(O)CCOC1)NCc1c(O)ccc2c1CCCC2 845453459 RZKUIBUXOUTTNP-GOSISDBHSA-N 334.416 1.612 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C\c1ccnn1-c1ccncc1 853002841 WZPXFMWIRFHISO-KAMYIIQDSA-N 341.396 1.570 10 10 EDCE COCCN(CCF)c1cc2c(cc1Br)[C@H](O)C(=O)N2 697313698 QQIDJBDTONEJQP-LBPRGKRZSA-N 347.184 1.857 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](CO)C3CCC3)C2)cc1 852447833 FHIVPNPASCZLDR-RHSMWYFYSA-N 333.432 1.734 10 10 EDCE O=C(NCCCSc1nccs1)NC[C@]1(CCO)CCOC1 762320977 FMMUQPXPFAYCLG-AWEZNQCLSA-N 345.490 1.714 10 10 EDCE Cc1nn(C)c(C)c1-c1cc(C(=O)NCc2ccc(O)cc2O)n[nH]1 1142533464 LCGAQXVZSVVNLS-UHFFFAOYSA-N 341.371 1.768 10 10 EDCE COc1cc(NS(=O)(=O)c2ccc3c(c2)C(=O)OC3)ccc1O 797819893 VMEJIKSAKFDDEU-UHFFFAOYSA-N 335.337 1.872 10 10 EDCE Cc1cnc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(C)c1 1303424566 STBFITQXYJSMJP-UHFFFAOYSA-N 349.412 1.706 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)N[C@H]2CCC[C@@H]2O)N(C)C)cc1 899097658 DSIHMOFZIFAYHI-ULQDDVLXSA-N 334.464 1.568 10 10 EDCE COc1ccc(CNCC2(NC(=O)CC(N)=O)CCCC2)cc1C 1318624503 QDVDJKSZCMRTGH-UHFFFAOYSA-N 333.432 1.398 10 10 EDCE C[C@@]1(c2cccc(CNC(=O)c3cc(O)cs3)c2)NC(=O)NC1=O 1333804880 KTMPPYVKOJTTJF-INIZCTEOSA-N 345.380 1.438 10 10 EDCE CC[C@@H](CNC(=O)c1ccco1)NC(=O)c1cc(OC)nc(OC)c1 1285025807 SFDFWZCDTLNROL-LBPRGKRZSA-N 347.371 1.630 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@@H]2CC23CC3)cc(OC)n1 1284344560 QSKREVOLBJUULS-PWSUYJOCSA-N 333.388 1.133 10 10 EDCE COCC(=O)N(C)C1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1281337650 MOHCMCLRESNBPQ-UHFFFAOYSA-N 347.375 1.215 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cnc(O)c([N+](=O)[O-])c1 1451946198 CULIXNJBIWPFIP-UHFFFAOYSA-N 340.295 1.879 10 10 EDCE COc1cc(OC)cc(OCCNC(=O)Cc2ccc(O)c(O)c2)c1 1294558547 LXFRNMRQLAHKBQ-UHFFFAOYSA-N 347.367 1.853 10 10 EDCE O=C(O)C[C@H]1CN(Cc2c(O)cccc2Br)C[C@H]1O 2117727176 GATWIGAFOBAZKA-QPUJVOFHSA-N 330.178 1.422 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2COCCO2)cc1C 1700738321 MNRYHNYYMNFUFH-RHSMWYFYSA-N 336.432 1.356 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCc1nc(C(F)(F)F)no1 1556152241 IYGYKLRMGAREMD-RQOWECAXSA-N 329.234 1.829 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H]2C[C@]23CCOC3)cc1C 1713652114 APEHBUXZOLSOLY-LPHOPBHVSA-N 332.444 1.978 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](CNCCCO)C2)cc1 1731688783 ZEEVXCHBCFIBLO-LBPRGKRZSA-N 333.392 1.283 10 10 EDCE Cn1cc(C(=O)CCC(=O)NCc2ccc3cccnc3c2O)cn1 1643282827 AQSKKDWEFFIPTE-UHFFFAOYSA-N 338.367 1.953 10 10 EDCE O=C(CCc1nc(-c2ccncc2)no1)NCc1ccc(O)cc1O 1570462103 DMISRSSJFFIUBB-UHFFFAOYSA-N 340.339 1.792 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cc[n+]([O-])cc3)CC2)cc1C 1670741420 BWKSTXMGSHBWIX-UHFFFAOYSA-N 341.411 1.689 10 10 EDCE CNC(=O)[C@H]1CCCN1Cc1c(Br)ccc(OC)c1O 1964554534 MWCZYAYKEVXAOR-LLVKDONJSA-N 343.221 1.874 10 10 EDCE Cc1cc(Br)ccc1NC(=O)C[C@H]1C(=O)NN(C)C1=O 169996256 VCOZJFBQGZSQPE-VIFPVBQESA-N 340.177 1.206 10 10 EDCE CO[C@@H]1C[C@H](NCc2cc(Br)cc(F)c2O)C[C@H]1O 2130803956 FGHAUIAETLCTLK-YUSALJHKSA-N 334.185 1.922 10 10 EDCE CNCc1ccc(N(C)[C@H]2CCS(=O)(=O)C2)c(Br)c1 234416030 VYPNWSBCZRLGFF-NSHDSACASA-N 347.278 1.792 10 10 EDCE Nc1ccc(CNCCn2cc(I)cn2)cc1 1947902589 WRZZFMTWTMJBEG-UHFFFAOYSA-N 342.184 1.860 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOCC[C@H]1C(=O)NCCN=[N+]=[N-] 1985103520 WNZDLWOTUWZIQI-MNOVXSKESA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)CNCc1cc(F)cc(F)c1O 1985854376 SJNFPADPSSKSIX-NSHDSACASA-N 332.347 1.646 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC(CN=[N+]=[N-])CC1 2018049530 WKUPDMLLHKPQQR-LBPRGKRZSA-N 341.412 1.811 10 10 EDCE Nc1ccc(OCCNC(=O)c2ncncc2Br)cc1 312392591 OVLDRLMJQPBBAJ-UHFFFAOYSA-N 337.177 1.630 10 10 EDCE CN1CC[C@@H](C(=O)Nc2ccc(O)c(O)c2)[C@H](c2cnn(C)c2)C1 2063493941 POZSBVUHEYFUNN-KGLIPLIRSA-N 330.388 1.505 10 10 EDCE CN(Cc1cccc(Cl)c1O)Cc1nnc2c(=O)n(C)ccn12 2064828931 XJJVHALYDURMOX-UHFFFAOYSA-N 333.779 1.419 10 10 EDCE COc1cccc(Cn2ncc(I)c2O)c1O 2070498119 HVXDEKBOQFPQTN-UHFFFAOYSA-N 346.124 1.956 10 10 EDCE CCN[C@@H](c1ccccc1O)[C@@H](O)c1nn(C)nc1Br 2167727789 XHIASCRXYIZHBI-CMPLNLGQSA-N 341.209 1.667 10 10 EDCE O=C1Nc2cc(N3CC[C@@H]4[C@H](O)C[C@H]43)c(Br)cc2[C@@H]1O 2178158078 ZTVNEUXDISRCRO-SGJXIIODSA-N 339.189 1.394 10 10 EDCE C[C@@H]1[C@@H](NC(=O)C(F)(F)F)CCCN1C(=O)Cc1ccc(N)cc1 2044623785 YGQSACNMJDIRDN-MFKMUULPSA-N 343.349 1.869 10 10 EDCE O=C(O)[C@@H]1C[C@H](O)CCN1Cc1cc(Br)cc(F)c1O 2201087810 BUTSGOKUDCAONI-KOLCDFICSA-N 348.168 1.704 10 10 EDCE CCN(c1ccc(CNC)c(Br)c1)[C@H]1CCNC1=O 2114773604 XJNKZQRTBPJFCF-ZDUSSCGKSA-N 326.238 1.883 10 10 EDCE C[C@@H]1CN(Cc2ccc(Br)cc2O)CC2(CNC2)O1 2272928328 ADDMOALNAUWCCV-SNVBAGLBSA-N 327.222 1.717 10 10 EDCE Cc1ncnc(NC(=O)c2cc(O)c(O)c(O)c2)c1Br 2238419114 BJOOBVXRAFVPMX-UHFFFAOYSA-N 340.133 1.917 10 10 EDCE N[C@H]1[C@H]2C[C@@H](CN(Cc3ccc(Br)cc3O)C2)[C@@H]1CO 2239342319 WXWAGVNTQIDWEG-UHXUCMFUSA-N 341.249 1.542 10 10 EDCE O=C(c1cccc(O)c1O)N1CCC[C@@H](NC(=O)C(F)(F)F)CC1 2258226271 OBLKSERSOYLKQQ-SECBINFHSA-N 346.305 1.771 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)cc1Br 2331966548 JVRZYXPEVZSIOV-YXCITZCRSA-N 328.206 1.404 10 10 EDCE CCc1ccc(OCCCNC=C2C(=O)NC(=S)NC2=O)cc1 3176398 ZJSZUHUWEWWCRB-UHFFFAOYSA-N 333.413 1.022 10 10 EDCE Cc1cc(O)cc(=O)n1[C@H](C)C(=O)NCc1ccc(N(C)C)cc1 176169970 UVCHZDREBNEMDJ-CYBMUJFWSA-N 329.400 1.806 10 10 EDCE COc1cc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)c(O)cc1C 179435913 KQVHJSHINFOBEB-HNNXBMFYSA-N 348.443 1.780 10 10 EDCE O=C(CNCc1ccc(N2CCOCC2)c(F)c1)NCc1ccco1 66971385 JNCZICJADYEIQY-UHFFFAOYSA-N 347.390 1.661 10 10 EDCE CN1C(=O)[C@@H](N)c2ccc(N3CCN(Cc4ccccc4)CC3)cc21 301639363 DZNGJWWUZHIGAI-IBGZPJMESA-N 336.439 1.985 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)[C@H]2CCN(C)C2=O)c([N+](=O)[O-])c1 77992243 NVFFVCOJWRIAQE-IYNGYCSASA-N 333.344 1.448 10 10 EDCE CCCCS(=O)(=O)Nc1cc(N2CCN(C)CC2)ccc1OC 74587034 RLAVVFVDQJSMRV-UHFFFAOYSA-N 341.477 1.989 10 10 EDCE CCc1nc2n(n1)CCC[C@H]2NC(=O)/C=C/c1ccc(O)c(O)c1 181180375 MDJXHGOHBWKVBW-WAFBPQNNSA-N 328.372 1.916 10 10 EDCE COc1ccc(N2CCN(C(=O)NC(=O)c3ccco3)CC2)cc1 82340236 OWVYMNTUWFWLEL-UHFFFAOYSA-N 329.356 1.960 10 10 EDCE CSc1ncc(CN[C@](C)(C(=O)O)[C@@H](C)S(C)(=O)=O)s1 2372948213 LHPQGXBYXXWLSO-HQJQHLMTSA-N 338.476 1.231 10 10 EDCE CC(C)(C)N1C(=O)[C@@H]2[C@@H](c3ccccc3O)N[C@](C)(C(=O)O)[C@@H]2C1=O 248229247 KJFBWRKYRZLXEA-JWXAPSBJSA-N 346.383 1.280 10 10 EDCE COC(=O)C1=S=C(NC(=O)c2cc(C)c(C(=O)OC)o2)C=C1C 600106161 BIXYGMZVMSDSSB-UHFFFAOYSA-N 337.353 1.273 10 10 EDCE O=C(NCc1cc(Br)ccc1O)c1ccnc2[nH]nnc12 804737353 HQFLYGQLFUXCAV-UHFFFAOYSA-N 348.160 1.751 10 10 EDCE C[C@H](O)c1ccc(N2CCNC(=O)C23CC3)cc1Br 2132030015 OXQLWFNHUPFTLX-VIFPVBQESA-N 325.206 1.971 10 10 EDCE CNC(=O)[C@H]1CCCN1C(=O)c1csc(Cc2ccc(N)cc2)n1 825541687 LLKXJFZPGMBGEF-CQSZACIVSA-N 344.440 1.667 10 10 EDCE COCCOc1ncccc1NC(=O)C(=O)NCc1ccccc1O 728141527 FHNQTPQOCCXIER-UHFFFAOYSA-N 345.355 1.067 10 10 EDCE Cc1cc(O[C@H]2CCCN(C(=O)c3cc(O)nc(O)c3)C2)nc(C)n1 585345274 KQDIDBJVVZJHIT-ZDUSSCGKSA-N 344.371 1.583 10 10 EDCE CCN(CC)c1ccc(CNC(=O)Cc2c(O)ncnc2O)cc1F 900636716 MHPGJFXLYCZDJD-UHFFFAOYSA-N 348.378 1.732 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@H](C[C@@H]1COCCO1)C(F)(F)F 910942850 HFTBEOPUNHKGLD-NEPJUHHUSA-N 349.305 1.698 10 10 EDCE C[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)CC(F)F 843958952 DYYPBNOSVAYMNV-QMMMGPOBSA-N 336.360 1.785 10 10 EDCE Cc1cc(CC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccccc1 854278777 DAUFAZGLHMQUTE-INIZCTEOSA-N 346.452 1.940 10 10 EDCE CCS(=O)(=O)C[C@H](C)N[C@@H]1CCN(c2ccc(OC)cc2)C1 850487073 FEJRFWIITFVUIE-UONOGXRCSA-N 326.462 1.687 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](C)O[C@@H](CO)C3)C2)cc1 854299100 LEAYYVREBIYVDG-JKIFEVAISA-N 349.431 1.065 10 10 EDCE C[C@H]1C[C@@H](NC2CN(S(=O)(=O)N(C)C)C2)c2c(O)ccc(F)c21 858569744 NOONWPCMVBMMGK-JOYOIKCWSA-N 343.424 1.160 10 10 EDCE COc1ccc(N2CCN(c3nc(C)nc(N(C)C)n3)CC2)cc1 768520777 BJHDMOPWYGHNHS-UHFFFAOYSA-N 328.420 1.581 10 10 EDCE COc1ccc(COCC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cn1 860697271 RJGJKCXVGSMRHY-LBPRGKRZSA-N 346.383 1.765 10 10 EDCE CCCCN(Cc1ccccc1O)CC1CN(S(C)(=O)=O)C1 930352832 YNKNKLNBEKTDOR-UHFFFAOYSA-N 326.462 1.886 10 10 EDCE CO[C@H](C)c1noc(CN(C)Cc2cc3c(cc2O)OC[C@H]3O)n1 768463661 LCYXLCWUTVWQOT-NOZJJQNGSA-N 335.360 1.540 10 10 EDCE CC(C)CN1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1=O 780583473 RAZRPRFRLORXHI-UHFFFAOYSA-N 348.359 1.230 10 10 EDCE CC1(C)[C@H](O)C[C@]1(CO)NCc1c(O)cccc1Br 1879558126 GUUWDALJZQEYLS-TZMCWYRMSA-N 330.222 1.766 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1[C@H]2COC[C@H]21 792881869 OBFPUJCDSJDELX-VIKVFOODSA-N 335.379 1.106 10 10 EDCE CCS(=O)(=O)c1cnc(O)c(C(=O)N2Cc3cccc(O)c3C2)c1 1152572360 BQWTZZUGWWEFRV-UHFFFAOYSA-N 348.380 1.442 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)O)CCN(Cc2ccccc2O)C1 1962851998 BLJJLBYPGOKPQP-KRWDZBQOSA-N 336.388 1.946 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)Cc2nnc(C)o2)cc1C 1321499622 IJMSQZYUHOZFST-GFCCVEGCSA-N 332.404 1.532 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@H]2CCCO2)cc1C 1332477673 XEPODNFIXYYVJV-NVXWUHKLSA-N 336.432 1.092 10 10 EDCE CC[C@]1(CO)CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1261865328 AESLEIDTMXPTEM-SFHVURJKSA-N 332.400 1.246 10 10 EDCE C[C@@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1345504642 BECGIYYCPWCZJN-BXUZGUMPSA-N 337.395 1.049 10 10 EDCE C[C@H](NC(=O)NCc1cccc(Cl)c1O)[C@H]1CN(C)CCN1C 1346765647 BMTGESSFOHTWII-SMDDNHRTSA-N 340.855 1.479 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CNCc2ccc(O)c(O)c2)C1 1251457872 OJQRVKDALMFBDN-QGZVFWFLSA-N 338.404 1.559 10 10 EDCE Cc1cn2nnc(C(=O)NCc3ccc(N(C)C)cc3)c2c(O)n1 1463728582 WNPOBJOLPMJMRY-UHFFFAOYSA-N 326.360 1.134 10 10 EDCE Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)Cc1ccc(O)c(O)c1 1624878877 ZVICTKWRUWHPFT-GOSISDBHSA-N 340.379 1.648 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C[C@@H]2CCNC2=O)cc1C 1491476616 ARJVYQVKKIZQMZ-HIFRSBDPSA-N 333.432 1.124 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)Cc2n[nH]c(C)n2)cc1C 1567015359 MRAANYLMDPNTIH-GFCCVEGCSA-N 331.420 1.267 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1cnc(N)c([N+](=O)[O-])c1 1633341504 WFBXPRJGMQHPDH-UHFFFAOYSA-N 329.360 1.876 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C2C=CC=CC=C2)cc1C 1667832260 SJOYSGAEMQOCRC-GOSISDBHSA-N 342.439 1.869 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@H]2CC2(F)F)cc1C 1676529245 IZEHTVNLIIATBP-QWHCGFSZSA-N 328.359 1.226 10 10 EDCE CCn1cc(CNC(=O)N(C)Cc2ccccc2O)c(O)nc1=O 1685759740 UDXMBMPCSWVHLY-UHFFFAOYSA-N 332.360 1.016 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)[C@@H](C)NC(C)=O)C2)cc1C 1691764510 CMYZLAILFCFHNK-KBRIMQKVSA-N 347.459 1.513 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCOCC34CC4)c(Br)cc21 1915583808 LNOURBAUFNGYOE-LBPRGKRZSA-N 338.205 1.770 10 10 EDCE CNCc1ccc(N2CCN3C(=O)NC[C@@H]3C2)cc1Br 234430347 OUMYDLFZPJLDLJ-GFCCVEGCSA-N 339.237 1.382 10 10 EDCE C[C@H]1CN(Cc2cc(Br)ccc2O)[C@H](C(=O)O)CO1 1968205628 MHKDBRGHSAHJKB-KWQFWETISA-N 330.178 1.829 10 10 EDCE NCc1ccc(N2CCC[C@@H](C(N)=O)C2)c(F)c1Br 231838719 ANCDHMOBKYUQFQ-SECBINFHSA-N 330.201 1.749 10 10 EDCE CCOC1(C(=O)O)CN(Cc2cc(Br)ccc2O)C1 1972382593 TXOVBWAOUBBPMN-UHFFFAOYSA-N 330.178 1.830 10 10 EDCE CC1(NC(=O)OC(C)(C)C)CN(CC(=O)Nc2ccc(N)cc2)C1 2001283520 SGPIYXIBXPGHBV-UHFFFAOYSA-N 334.420 1.806 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1ccc2c(c1)N(C)C(=O)[C@@H]2O 2034790872 WKWKJIWVSDYNEK-GOSISDBHSA-N 339.395 1.449 10 10 EDCE CN(Cc1c(O)cccc1Br)[C@H]1COC[C@H]1C(=O)O 706649261 KJIQCYQOWKBKTM-KOLCDFICSA-N 330.178 1.686 10 10 EDCE C[C@H]1[C@H](NCc2cc(Br)ccc2O)CCS1(=O)=O 386552911 UDEXSFSNVIMNCK-GZMMTYOYSA-N 334.235 1.820 10 10 EDCE CC1(C)CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C[C@@H]1O 387973579 MHSFZJQOAZGUCW-RYUDHWBXSA-N 340.221 1.608 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@H](O)[C@H](CO)C2)cc1Br 396819004 WBFANLLYDNUCAX-ZETOZRRWSA-N 343.265 1.909 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3CCOC4(CCOCC4)C3)c2n1 2062985944 LZGHJASVVXXWIX-LBPRGKRZSA-N 346.387 1.201 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)cc1Br 2182552159 AQYLSLHUOHQBAB-RWDPWNMBSA-N 342.233 1.680 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1908252895 IDGYWYZDTWLQLK-SRVKXCTJSA-N 339.396 1.658 10 10 EDCE C[C@]1(CCO)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2205509205 FIBYIANWPKVGRD-TZMCWYRMSA-N 340.221 1.752 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3COC[C@]3(CO)C2)cc1Br 2234566787 MDNMCEHPEREWNM-UEKVPHQBSA-N 342.233 1.948 10 10 EDCE Nc1ccc(CC(=O)N2CCC[C@@H](NC(=O)C(F)(F)F)CC2)cc1 2258226020 MBDLGIHRXIJTCX-CYBMUJFWSA-N 343.349 1.871 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(CNC(=O)CO3)C2)cc1Br 2289660904 SDUCQOAGWYIIQZ-SECBINFHSA-N 341.205 1.208 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@@H]2C[C@@H]21 2303930866 CEYYKDZSNFNSEL-POQQGIQPSA-N 336.432 1.898 10 10 EDCE CCCNS(=O)(=O)NCc1ccc(C)c(Br)c1O 2327593761 HAGQTHOJVBRDLA-UHFFFAOYSA-N 337.239 1.797 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)cc1Br 2336392539 QKVQQCHMODZSRZ-JRKPZEMJSA-N 345.262 1.702 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CNCCO2)c(O)c1Br 2352620782 UETCRCPUBQRPCM-JTQLQIEISA-N 329.194 1.068 10 10 EDCE COc1ccc(CN[C@@H]2C[C@H](C)N(C(=O)CCCC(N)=O)C2)cc1C 1278430035 DBRUPIWCUJRCJK-GOEBONIOSA-N 347.459 1.738 10 10 EDCE CNCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2357591991 CSOFFIANRGFREZ-AQNFWKISSA-N 341.249 1.489 10 10 EDCE COc1ccc(N2CCN(c3nc(N)c4cnn(C)c4n3)CC2)cc1 278419437 ONDZEUAVFAGOHU-UHFFFAOYSA-N 339.403 1.281 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H]3C3CC3)nc12 377542221 FODITWQYFZSQFF-CQSZACIVSA-N 330.388 1.986 10 10 EDCE Cc1ccc(CN2CCC[C@@](O)(C(=O)O)C2)c(O)c1Br 2380813199 DNWYLMWODNMBPM-AWEZNQCLSA-N 344.205 1.875 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NC[C@@H]3CCC[C@H]3O)C2)cc1 824682035 UGNUMJBFCPDCJN-RVKKMQEKSA-N 347.459 1.982 10 10 EDCE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@H](CF)C(=O)O 908853062 XZIIKNDOIKWEQV-CYBMUJFWSA-N 341.408 1.462 10 10 EDCE C[C@H]1CN(C(=O)c2cc(O)cs2)CCN1C(=O)c1cscn1 839793556 WBMIIJQJXVSFJL-VIFPVBQESA-N 337.426 1.897 10 10 EDCE COc1ccc([C@]2(C(=O)NCc3ccc(O)cc3O)C[C@H](O)C2)cc1 910944586 UMSVNVVIKOGPQY-RHDGDCLCSA-N 343.379 1.815 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)CC(C)(C)OC)C2)cc1 849417580 VPPJXTWQWTYCIR-CYBMUJFWSA-N 342.461 1.618 10 10 EDCE COc1ccc(N2CC[C@@H](Nc3nc(C)nc(N(C)C)n3)C2)cc1 853759225 PTGFIYXWCINSJM-CYBMUJFWSA-N 328.420 1.945 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3C[C@@H]4COC[C@H]4O3)CC2)cc1F 929823101 RXMKHHLZWKNCPG-QIIPPGSGSA-N 336.407 1.760 10 10 EDCE COc1ccc(N2CCN(C[C@H]3CCC4(COC4)O3)CC2)cc1F 929823138 SAXWVXVQJVMAAC-OAHLLOKOSA-N 336.407 1.904 10 10 EDCE CC(C)(C)[S@](C)(=O)=NS(=O)(=O)NCc1c(O)cccc1F 921451012 IYAUBKQYXQIPHB-FQEVSTJZSA-N 338.426 1.762 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N(C)CC1CN(C)C1 850652693 FMUHMCJOLCWAHM-UHFFFAOYSA-N 347.459 1.541 10 10 EDCE CNC(=O)NC[C@H]1CN(C/C=C\c2ccc(N(C)C)cc2)CCO1 862459107 MMXOMDJUWJNRHM-CHYADLBTSA-N 332.448 1.396 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 862550637 GGHNNDVOTQYKFX-AWEZNQCLSA-N 343.468 1.653 10 10 EDCE CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1O)C(=O)N1CCOCC1 868381712 VUTSQYWMOGDGEJ-GXTWGEPZSA-N 335.404 1.390 10 10 EDCE O=C(C[C@H]1CCCS(=O)(=O)C1)NCc1ccc2cccnc2c1O 862025840 BJKKJYCWPIDNIT-GFCCVEGCSA-N 348.424 1.772 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CCN[C@H]3C)C2)cc1 861648649 ZJEHHYGGPOLLQZ-JJRVBVJISA-N 332.448 1.571 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)CNC(=O)c2ncccc2O)c1 1137473479 KRCYLFDRJNTJFB-SNVBAGLBSA-N 345.355 1.109 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H]2CC[C@@H]2C(N)=O)cc1C 1268572609 MNHCVESOJDGSEH-MEGKRXCUSA-N 345.443 1.277 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC2C[C@H]3[C@H](C2)C3(F)F)cc1 1261680265 SWLKYOKCCTWEFR-KBPBESRZSA-N 337.370 1.529 10 10 EDCE CC(C)(C)[C@@]1(CN)CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1335718653 QDTVBMYKIDINOG-LJQANCHMSA-N 345.443 1.458 10 10 EDCE CCn1ccc(CN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)c1 1261865338 ALAHWSYFVUJTRP-UHFFFAOYSA-N 327.384 1.714 10 10 EDCE O=C1NC[C@@H](C(=O)NCCc2ccc(O)c(O)c2)c2ccccc21 1294914110 WAHVTWFREFVAOA-CQSZACIVSA-N 326.352 1.284 10 10 EDCE CCN(CC)C(=O)N1CCC(C(=O)NCc2c(O)cccc2O)CC1 1456234039 HJOCMXZKCTUXTJ-UHFFFAOYSA-N 349.431 1.888 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C1(C)CC1 1295538927 MYXPOCSZESPDFT-SNVBAGLBSA-N 331.376 1.884 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCc3c(O)ncnc3C2)cc1 1625148396 WJBNDXLETSKOIX-UHFFFAOYSA-N 326.316 1.543 10 10 EDCE O=C(CNC(=O)c1cccc(Cl)c1)NCc1c(O)cccc1O 1639289449 QLUNDKJZUPLEDY-UHFFFAOYSA-N 334.759 1.797 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)CN(C)S(=O)(=O)CC 1634009833 XXCMWZOTNTZTAP-UHFFFAOYSA-N 342.461 1.802 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@H]2CCCCO2)cc1 1736718523 ZKJTUAIUVUNZNP-CYBMUJFWSA-N 347.375 1.264 10 10 EDCE COc1ccc(CN[C@H]2CN(C(=O)CCN(C)C)C[C@@H]2C)cc1C 1570354317 JTBTUEUFOQRZON-RDJZCZTQSA-N 333.476 1.892 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@H]2CCNC(=O)CC2)cc1C 1662292930 LPXQVTGBDHEWMX-GDBMZVCRSA-N 347.459 1.514 10 10 EDCE CC1(C)[C@@H](O)[C@@H](O)CN1c1cc(Br)c(CN)cc1F 2124800849 MNJUYOHCQKLIBU-RYUDHWBXSA-N 333.201 1.367 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](CO)c1ncc[nH]1 1686826173 CGQQIINWIDOYMG-XJKSGUPXSA-N 345.447 1.748 10 10 EDCE Cc1c(/C=C2\SC(N3CCN4CCC[C@H]4C3)=NC2=O)cnn1C 166631189 DNRQMJJYDIDZKA-IAOKNECISA-N 331.445 1.479 10 10 EDCE O=C1/C(=C\c2ccc[nH]2)SC(=S)N1CCCN1CCOCC1 1858587026 PLJHVAZBTPBJHR-ACCUITESSA-N 337.470 1.938 10 10 EDCE C[C@@H](CNS(=O)(=O)Cc1ccc(N)cc1)NC(=O)OC(C)(C)C 1977692478 FGVGNPMXABGFHU-NSHDSACASA-N 343.449 1.601 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@](O)(C(N)=O)C2)c(Br)c1 380439616 BSTLAIVBIYWMMS-LKFCYVNXSA-N 342.237 1.285 10 10 EDCE CN(c1ccc(CO)c(Br)c1)C1CC(S(C)(=O)=O)C1 716095505 CENHPCADUVXHBC-UHFFFAOYSA-N 348.262 1.953 10 10 EDCE CCNC(=O)c1cnn(Cc2cccc(Br)c2O)c1O 2070486701 REGLVRYBQUENOB-UHFFFAOYSA-N 340.177 1.855 10 10 EDCE CC1(C)C[C@H](O)[C@@H](O)CN1c1cc(Br)c(CN)cc1F 2188631636 DRACUBMRZRVJMK-STQMWFEESA-N 347.228 1.757 10 10 EDCE CN1CC(N(C)c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2089247227 QWYMAVQANLQVQW-GFCCVEGCSA-N 326.194 1.185 10 10 EDCE CNC(=O)[C@H]1[C@H](C)CCN1c1ccc(CO)cc1Br 2090263079 TYXCUSHZSWZKPW-NOZJJQNGSA-N 327.222 1.902 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@H](O)C3(C)C)c(Br)cc21 2201308110 HYQPACJJCFEYJV-RYUDHWBXSA-N 340.221 1.621 10 10 EDCE CCNCc1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)cc1Br 2201298706 JJAKARKRIGNJKB-IMRBUKKESA-N 338.249 1.726 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])COC1 2213582532 IUDQPPNJLYOUOQ-MNOVXSKESA-N 339.396 1.875 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)CN1CC[C@@H](NC(=O)OC(C)(C)C)C1 2300532674 ZJOLTXYFXKDYQY-GFCCVEGCSA-N 340.428 1.744 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@@H](O)[C@H]3C4)c(Br)cc21 2355620116 LRDICHARJIJKQR-FTRPCTHQSA-N 338.205 1.361 10 10 EDCE CCN(CC)c1ccc(/C=C2/C(=O)N(c3nnn[nH]3)N=C2C)cc1 56684850 YIPHBIMDCRKNQH-GXDHUFHOSA-N 325.376 1.852 10 10 EDCE CC(=O)N1CC[C@@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 175640100 KDRYLKXKDUOZNL-OAHLLOKOSA-N 349.406 1.147 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CN(C)CCO1 105283031 XXJFMAOUWAWNGG-KRWDZBQOSA-N 334.464 1.615 10 10 EDCE CN1C(=O)[C@H]2C[C@H]1CCN2c1cc(Br)c(CN)cc1F 2360819514 DFYOBXMJTDSNMO-NOZJJQNGSA-N 342.212 1.856 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC(NC(=O)C3CC3)C2)cc1F 186644819 QUVIKKTYWJONJQ-UHFFFAOYSA-N 334.395 1.312 10 10 EDCE O=C1NC(=O)[C@@]2(CCCN(Cc3ccc(N4CCCCC4)cc3)C2)N1 193465166 PJXMZOSEQLSKDD-IBGZPJMESA-N 342.443 1.851 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@H]3O 249371947 ATIZYDKLJVRSJX-ZLOLBAIHSA-N 343.471 1.412 10 10 EDCE CC[S@](=O)c1ccccc1C(=O)N1CCS(=O)(=O)C(C)(C)C1 268441222 ZWFMMHAICPCQCU-NRFANRHFSA-N 343.470 1.463 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(n3cncn3)C2)c([N+](=O)[O-])c1 367766161 WZRZZGIKKLNJLS-HWKANZROSA-N 329.316 1.434 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)c1cnc(O)n(C)c1=O 282496846 NCALWWLKNUDARN-UHFFFAOYSA-N 331.372 1.634 10 10 EDCE COC(=O)[C@H](CC(C)C)N(C)CC(=O)NCc1ccc(N(C)C)cc1 298057262 FYRSGOGGBYLTFS-KRWDZBQOSA-N 349.475 1.888 10 10 EDCE Cc1ccc(CN[C@@]23CC[C@@H](C2)[C@@H](O)[C@@H]3O)c(O)c1Br 2380801135 OYOLBLZEHIHYBD-FLCCKXIQSA-N 342.233 1.827 10 10 EDCE C[C@@H]1CCCN(c2ccc(CNC(=O)CNC(N)=O)cc2Cl)C1 800343490 SNVHPUSBZUQDBO-LLVKDONJSA-N 338.839 1.861 10 10 EDCE CCN(CC)c1ccc(CNC[C@@H](O)CN2CCN(C)CC2)cc1 818965153 QDBXTFCEPZDAAV-LJQANCHMSA-N 334.508 1.231 10 10 EDCE C[C@H](NC(=O)[C@H]1CCNC(=O)CC1)c1ccc(N2CCOCC2)cc1 815114221 KUUFSAMPYFKVLH-GOEBONIOSA-N 345.443 1.617 10 10 EDCE CN(C)C(=O)CCN(C)c1ccc(CN)c(Br)c1F 2131953284 SPCACXREXNMYRI-UHFFFAOYSA-N 332.217 1.961 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1COC2(CCC2)C1 828438500 WXIKAJNVDUUKFR-HNNXBMFYSA-N 345.443 1.505 10 10 EDCE CCc1cccc2c1N(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)CC2 491276386 GKPBHNCRYQNBTC-CMDGGOBGSA-N 339.395 1.249 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCC(NS(C)(=O)=O)CC2)cc1 835026168 RDTSMNQAIVMYRP-PLNGDYQASA-N 337.489 1.779 10 10 EDCE CN1CCCc2cc(CNC(=O)NCCc3cn(C)cn3)ccc21 838031606 LCYBTNBMHSGDIQ-UHFFFAOYSA-N 327.432 1.844 10 10 EDCE C[C@@]1(C(=O)O)CCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 588592667 YHQBLHNVUWKBDC-BQHGXPCASA-N 344.411 1.860 10 10 EDCE CCO[C@@H](CNC(=O)NCc1ccc(N(C)C)c(F)c1)CN(C)C 915365219 CDGCPVMEDQSWIX-AWEZNQCLSA-N 340.443 1.658 10 10 EDCE COCCOc1ncccc1CNC(=O)NCc1c(O)cccc1F 914109215 UKPZCERGSAUMAZ-UHFFFAOYSA-N 349.362 1.951 10 10 EDCE C[C@H]1CCC[C@H](C)N1CCNC(=O)C(=O)NCCc1ccc(N)cc1 842238603 UHTHQRQRYFKUOO-GJZGRUSLSA-N 346.475 1.307 10 10 EDCE O=C1N[C@]2(C(=O)NCc3c(O)ccc4c3CCCC4)C[C@H]3C[C@@H]1[C@H]2C3 845833485 GSUDBFDLOHQNSY-HQSDZYPVSA-N 340.423 1.802 10 10 EDCE O=C1N[C@H](CF)C(=O)N1Cc1cc(F)c(N2CCOCC2)c(F)c1 842256365 CNPIUIMZQUVWSD-GFCCVEGCSA-N 343.305 1.191 10 10 EDCE COc1ccc(CNC(=O)NCc2ncc3c(n2)CCOC3)c(O)c1 845351201 MFFNTJIEERAMNY-UHFFFAOYSA-N 344.371 1.263 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccnc4[nH]nnc34)C2)cc1 855227347 XKRWLZMBMQOQBQ-LLVKDONJSA-N 338.371 1.370 10 10 EDCE CCOC(=O)[C@@H](CC)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855224532 LMRUAQFAFXHUIZ-BBRMVZONSA-N 334.416 1.979 10 10 EDCE CC(=O)c1cc(F)cc(CN2CC[C@@H](N(C)C(=O)N(C)C)C2)c1O 852653499 VKHUKBSIJFAHPQ-CQSZACIVSA-N 337.395 1.922 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)c3ncnn3C)C2)cc1 852274833 NGMHXERFYGCLLB-STQMWFEESA-N 344.419 1.463 10 10 EDCE COc1ccc(N2CCN(C(=O)COCc3nccn3C)CC2)cc1 854198664 NLLMPGZRPHDMLB-UHFFFAOYSA-N 344.415 1.294 10 10 EDCE C[C@@H](NC[C@@]12COCCN1C(=O)COC2)c1cc(Cl)ccc1O 866551974 FAGXLXAVMZHQAG-BZNIZROVSA-N 340.807 1.324 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2CCN[C@H]2C)cc1 861812396 GSBOFBILNAGIOT-WMLDXEAASA-N 346.475 1.358 10 10 EDCE COc1cc(Cl)cc(CN(C)C[C@@H]2CCS(=O)(=O)C2)c1O 761202858 QBVKJCZDOXXLFM-JTQLQIEISA-N 333.837 1.921 10 10 EDCE NC(=O)N[C@H](CC(=O)NCc1c(O)cccc1F)c1ccccc1 1156171072 WSBFIRSAHKLQNF-CQSZACIVSA-N 331.347 1.947 10 10 EDCE C[C@]1(C2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)COC(=O)N1 1178032662 XIBSGOALIGMJMQ-QGZVFWFLSA-N 334.372 1.377 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCO[C@@H](C(F)F)CC1 1330521480 RBQIJKDLMRNROI-CYBMUJFWSA-N 340.326 1.117 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)C2CC=CC2)cc(OC)n1 1337099042 CKFSDFULSDEAOP-LBPRGKRZSA-N 347.415 1.642 10 10 EDCE C[C@H](CNCCn1cccn1)NC(=O)c1ccc(N=NC(N)=O)cc1 1268675861 IBRUYIOGNJMZMY-GFCCVEGCSA-N 343.391 1.454 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)[C@H]2C[C@@H]2C)cc(OC)n1 1281035716 AYBCTHXWZVSCHG-LOWVWBTDSA-N 335.404 1.332 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)Cc2cncn2C)cc1C 1700423430 AHHPSQYVVMSDRZ-HUUCEWRRSA-N 344.459 1.963 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cc(C(N)=O)c[nH]2)cc1C 1715951831 FCUAJSXPSXJYRP-GFCCVEGCSA-N 344.415 1.339 10 10 EDCE O=C(CSc1nnc(S)s1)NCc1cc(O)ccc1O 1558175146 FIXGYWQMECXXPP-UHFFFAOYSA-N 329.428 1.647 10 10 EDCE Cn1nnc(CNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)n1 1639865977 RYPMIZSKAYEBFK-UHFFFAOYSA-N 338.327 1.961 10 10 EDCE CCC(=O)NC1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 1560144650 JOLBMDNGZPQKED-UHFFFAOYSA-N 346.475 1.359 10 10 EDCE NC(=O)c1cccc(OCCC(=O)NCc2cc(O)ccc2O)c1 1633598896 GSDMDHCPECJGCP-UHFFFAOYSA-N 330.340 1.282 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H](C)c2nnc(O)n2C)c1 1565377374 PMCGTQKMHLKBGZ-IUCAKERBSA-N 335.364 1.356 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc(S(N)(=O)=O)s2)c1 1640796422 DGRDTEIBPTUGCH-UHFFFAOYSA-N 326.399 1.340 10 10 EDCE CC1(C)[C@@H](O)[C@H](O)CN1c1cc(Br)c(CN)cc1F 2124800846 MNJUYOHCQKLIBU-NEPJUHHUSA-N 333.201 1.367 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@H](O)C3)c(Br)c1 2133921067 UVZSAKSSNQZJLM-OLRMPSLUSA-N 328.206 1.404 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H](NCc2cccc(O)c2O)C1 1946804115 WKKXVUDHIPKIIP-ZDUSSCGKSA-N 338.404 1.823 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@H]2[C@H]1[C@@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003172935 RPJCAASPIGVXEI-FWZIUSJTSA-N 336.432 1.898 10 10 EDCE CC(C)(C)OC(=O)NCCCONC(=O)c1ccc(O)c(O)c1 1982315608 XYBBACUPRMXCRK-UHFFFAOYSA-N 326.349 1.674 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](OCC(N)=O)C2)c(Br)c1 2145376095 XCSRYKLXFBYGKS-GXSJLCMTSA-N 342.237 1.549 10 10 EDCE CC(C)(C)OC(=O)N1CC(CNC(=O)COc2ccc(N)cc2)C1 1999125109 KXGJFIMZCFBTOJ-UHFFFAOYSA-N 335.404 1.631 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@]1(C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2023012480 VCWPOBPPGBFQLP-PSTGCABASA-N 340.420 1.278 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1cc2c(cc1N)NC(=O)CC2 2034784367 XBOUSUQDDDENCF-UHFFFAOYSA-N 338.411 1.906 10 10 EDCE CNCc1ccc(N(C)[C@H]2CCN(C)C2=O)cc1Br 690312805 CIBXTPRSCOCLOX-ZDUSSCGKSA-N 326.238 1.835 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC(C)(C)[C@H]3c3nccn3C)c2n1 2063863516 ORMMOQOFGQHGNG-CYBMUJFWSA-N 340.387 1.700 10 10 EDCE CN1CC[C@H]2OCCN(c3ccc(CN)c(Br)c3)[C@H]2C1 2185498743 YRWUYSOQEXGWIM-LSDHHAIUSA-N 340.265 1.817 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3COC[C@@]3(CO)C2)c(Br)c1 2234551147 IRKCZCLKKCJTES-WBIUFABUSA-N 341.249 1.914 10 10 EDCE COc1ccc(N2CC[C@@](O)(CO)C2)c(OC)c1Br 2226550176 XFJBXJBBIDXFPA-ZDUSSCGKSA-N 332.194 1.400 10 10 EDCE CN(C)c1ccc(C=C2C(=O)NC(=O)N(c3cccnc3)C2=O)cc1 2294106415 NDPOUJXOYLUTHR-UHFFFAOYSA-N 336.351 1.814 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H]2CCCn3ncnc32)cc1F 177310680 ZAKRTVITVXGQLE-CYBMUJFWSA-N 332.383 1.818 10 10 EDCE COC(=O)[C@H](C)CC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 178299970 AZVRPNNYWQFOOU-GFCCVEGCSA-N 338.379 1.682 10 10 EDCE CC(C)(O)C(C)(C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 272124256 KQFQXWGSYYTEGF-UHFFFAOYSA-N 330.406 1.043 10 10 EDCE Cc1cc(C(=O)N2CC[C@]3(CNC(=O)C3)C2)c(C)n1-c1ccccn1 279449494 DIKQPEGRUUVTEU-IBGZPJMESA-N 338.411 1.841 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CO[C@@H](CN)C2)c(O)c1Br 2381141768 DSSVIZKFWJHYFD-WDEREUQCSA-N 343.221 1.443 10 10 EDCE COC(=O)c1cncnc1N(C)Cc1ccc(N2CCOCC2)cc1 804332848 CLVNAXHCVVESDP-UHFFFAOYSA-N 342.399 1.736 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)CC1CCOCC1 807099623 BBTJOKSOGISCNQ-UHFFFAOYSA-N 347.459 1.562 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(CC)C1=O 802534786 PKAJWRXOOCKMCO-MRXNPFEDSA-N 332.448 1.905 10 10 EDCE COCc1csc(N2C(=O)CN(Cc3ccccc3O)C2=O)n1 819008566 UOLAWUIKAKZLOG-UHFFFAOYSA-N 333.369 1.964 10 10 EDCE COC1CCN(c2ccc(Cn3nnn(C4CC4)c3=O)cc2)CC1 829606703 OBQXDDBKUVXLOZ-UHFFFAOYSA-N 329.404 1.438 10 10 EDCE Cc1ccc(C(=O)OCCc2nnnn2-c2ccccc2)c(O)c1O 727004555 XIYXTAAIVTYLIA-UHFFFAOYSA-N 340.339 1.781 10 10 EDCE COC(=O)[C@@H]1CCCC[C@@H]1NCC(=O)NCc1ccc(N(C)C)cc1 831670752 QLESWMRZNMSACS-SJORKVTESA-N 347.459 1.690 10 10 EDCE Cn1ccnc1CN1CCC(C(=O)NCCc2ccc(N)cc2)CC1 832659285 YFQNMJLHWYBGBW-UHFFFAOYSA-N 341.459 1.573 10 10 EDCE COc1cccc(O)c1CNC[C@@H]1CCC[C@]12NC(=O)N(C)C2=O 748098418 CFNZOYHIVAWCSB-GTNSWQLSSA-N 333.388 1.211 10 10 EDCE CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(N)cc1 841298344 APKRGJRRCQBPLT-GWCFXTLKSA-N 326.422 1.108 10 10 EDCE O=C(Cn1ccnc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405861 KQJRDNJVTJJCCU-UHFFFAOYSA-N 332.379 1.300 10 10 EDCE N=c1cc[nH]cc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 844173990 HRHRAXNERRQJCM-UHFFFAOYSA-N 340.427 1.633 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3C[C@H]4COC[C@@H]4O3)CC2)cc1F 929823113 RXMKHHLZWKNCPG-YEWWUXTCSA-N 336.407 1.760 10 10 EDCE CC[C@H](NCC[C@@H]1CNCCS1(=O)=O)c1ccc(C)cc1O 925787958 DNTRBFRFXOHJMJ-HIFRSBDPSA-N 326.462 1.518 10 10 EDCE CN(Cc1ccccc1O)[C@@H]1CCN(CC(=O)OC(C)(C)C)C1=O 851841321 PBCJOQHHAXNCRI-CQSZACIVSA-N 334.416 1.767 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@H](O)C1(O)CCC1 929973060 VWULROXJLSGUJB-AWEZNQCLSA-N 343.807 1.297 10 10 EDCE Cc1ccc(C(=O)NCC[S@](=O)CC(F)(F)F)c(O)c1O 855275515 KAJWXRROUVKJBC-NRFANRHFSA-N 325.308 1.447 10 10 EDCE CC[S@](=O)CCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852117915 BIGZQCOFJMULJG-NPMABZOXSA-N 339.461 1.342 10 10 EDCE Cc1nnc(COCC(=O)NCc2ccc3cccnc3c2O)s1 862026063 GCKFTIFXRDKONQ-UHFFFAOYSA-N 344.396 1.933 10 10 EDCE O=C(O)[C@@H]1C[C@H](NCc2cc(Br)ccc2O)CCO1 1880048633 ATLXMAATPKJAIA-PWSUYJOCSA-N 330.178 1.877 10 10 EDCE CC(C)CNC(=O)N1CCC[C@H](C(=O)NCc2cc(O)ccc2O)C1 1153885108 KTYOFMPCMMFQQF-ZDUSSCGKSA-N 349.431 1.792 10 10 EDCE O=C(C(=O)N1CC[C@@H](C2CCOCC2)C1)N1Cc2cccc(O)c2C1 1329478626 NFMJZTCWBHUYEN-CQSZACIVSA-N 344.411 1.510 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@@](C)(C2CC2)C1 1329630490 GHFCBXHQKZMEMA-GOSISDBHSA-N 332.400 1.378 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCO[C@@H]2CNC[C@H]21 715788291 JWFLRXVUCIMFLO-VXGBXAGGSA-N 331.185 1.466 10 10 EDCE CCN[C@H](C)c1ccc(N2CC(=O)NC(=O)C2)c(Br)c1 97268930 VQRWTLQAXYMQGK-SECBINFHSA-N 340.221 1.582 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(O)CCO[C@H]1C 1612537364 DDHFGDBBUAVOMO-SJCJKPOMSA-N 332.404 1.468 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)CNC(=O)C1CC1 1704755244 RXBBXJUWFRWGKF-SNVBAGLBSA-N 331.376 1.741 10 10 EDCE COc1ccc(-n2nnnc2CN(C)CCNC(=O)C=C(C)C)cc1 1480838022 AVPWPDUXDNYMQY-UHFFFAOYSA-N 344.419 1.185 10 10 EDCE Cc1ccc(C(=O)NCc2cn(C(C)(C)C)c(=O)nc2O)c(O)c1O 1558270437 GOCRELDOBBNJKH-UHFFFAOYSA-N 347.371 1.354 10 10 EDCE COC(=O)c1coc(/C=C\C(=O)NCCc2ccc(O)c(O)c2)c1 1622753509 ZKEBITWJTPXCND-HYXAFXHYSA-N 331.324 1.850 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H](C)[C@H]2CCC(=O)N2)cc1C 1493701769 KKXHGMZWLSSYGI-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1C=CS(=O)(=O)C1 1632681979 YUMPBIIJOGQPOE-PWSUYJOCSA-N 325.386 1.093 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)Nc1cccc(O[C@H]2CC(=O)N2)c1 1637903584 CNCQJMLWXKDDSJ-YEODSOHDSA-N 340.335 1.975 10 10 EDCE COC[C@](O)(CNC(=O)OC(C)(C)C)[C@@H](N)c1ccccc1O 1921822909 HCKVWEXNVZZBFV-XJKSGUPXSA-N 326.393 1.294 10 10 EDCE CN(C)[C@@H]1COC[C@H]1CNCc1cccc(Br)c1O 1924701049 AYAJSBKJYCQMIQ-DGCLKSJQSA-N 329.238 1.821 10 10 EDCE NC(=O)CN(Cc1ccccc1)c1cc2c(cc1Cl)[C@H](N)C(=O)N2 1946836081 SXJRWGXEGUCXMQ-INIZCTEOSA-N 344.802 1.784 10 10 EDCE O=C(N[C@@H](C(=O)O)c1ccc(O)c(O)c1O)OCc1ccccc1 1951401196 BWXKLEKUTQISGC-GFCCVEGCSA-N 333.296 1.856 10 10 EDCE CO[C@@]1(C(=O)N(C)CCN=[N+]=[N-])CCN(C(=O)OC(C)(C)C)C1 1985093935 HQRRHUDRUKDABM-AWEZNQCLSA-N 327.385 1.781 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985101612 VDBATZHFUDSCEJ-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)NCC2(CN=[N+]=[N-])CC2)COC1 1985102467 HPHOPBNONUGIFH-UHFFFAOYSA-N 325.369 1.487 10 10 EDCE NCc1cc(F)c(N2CC[C@@H]3CC(=O)N[C@@H]3C2)cc1Br 2145058400 TYFQYMKMORZSOE-PRHODGIISA-N 342.212 1.762 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N(C)Cc1ccccc1O 2010263166 UWVVFGWAPMNWGY-FZMZJTMJSA-N 338.404 1.625 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1CCc1ccc(N)cc1 2010532142 ZNMXXUQRPUGLQK-HZPDHXFCSA-N 335.448 1.771 10 10 EDCE O=C1Nc2cc(N3C[C@@H](O)C(F)(F)C3)c(Br)cc2[C@@H]1O 2152094312 LWRWFHMPDZZOAO-ZJUUUORDSA-N 349.131 1.251 10 10 EDCE Cc1cccc(CNC(=O)CN(CCN)Cc2ccccc2)c1O 2024810243 APAVEXGNSPIULY-UHFFFAOYSA-N 327.428 1.778 10 10 EDCE CO[C@@H]1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 300096314 MFNZQYKCMCITLR-KRTXAFLBSA-N 326.194 1.626 10 10 EDCE CN(Cc1nncn1C)c1cc(Br)c(CN)cc1F 311949518 JJBIZMWGWAVGCI-UHFFFAOYSA-N 328.189 1.812 10 10 EDCE O=S(=O)(NCCNCc1cc(Cl)ccc1O)C(F)(F)F 2159527979 YVLQJKYHJYYPDY-UHFFFAOYSA-N 332.731 1.574 10 10 EDCE Oc1cc(Br)ccc1CNCc1nnc2ncccn12 2160425608 QLFFGXNARRLIIL-UHFFFAOYSA-N 334.177 1.882 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)C[C@@H](O)C2)c(Br)c1 2161357846 UHMLBZZUXTWSRZ-BETUJISGSA-N 343.265 1.879 10 10 EDCE COCCNCc1ccc(N2CC(N(C)C)C2)cc1Br 382218918 VNJDLLUBHCMDDG-UHFFFAOYSA-N 342.281 1.935 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC(CC4CCOCC4)C3)c2n1 2062948924 JWHJYVQQQFNALW-UHFFFAOYSA-N 330.388 1.632 10 10 EDCE CC[C@]1(NCc2c(O)cccc2Br)CCC(=O)NC1=O 2182526945 VNSDNGONBLTNKI-AWEZNQCLSA-N 341.205 1.830 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC(CO)C3)c(Br)cc21 2092541768 JAXPDMQHDSYDMQ-LBPRGKRZSA-N 326.194 1.090 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2199528279 YFKFCLWSRRRWMZ-RKADHFOPSA-N 341.249 1.789 10 10 EDCE CC(C)(C)C[C@H](COc1nnc(=N)[nH]n1)NC(=O)OC(C)(C)C 2210649447 IDEZDGLIRIRZGO-SECBINFHSA-N 326.401 1.387 10 10 EDCE NC(=O)[C@H]1C[C@H](N)CN(c2ccc(OCc3ccccc3)cc2)C1 2299504272 LZAOZSWIGLWRRI-HOTGVXAUSA-N 325.412 1.905 10 10 EDCE Cc1nsc(N2CCN(C(=O)C=Cc3ccc(O)c(O)c3)CC2)n1 2307987742 HRBSMPMHZACWGC-UHFFFAOYSA-N 346.412 1.620 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CC[C@@H](C2CC2)N1 407348708 LXBOCESJUHUOBR-DLBZAZTESA-N 347.434 1.809 10 10 EDCE Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)c2cnn(C)c2n1 122425389 PRJRBXZUEPNFHO-UHFFFAOYSA-N 326.356 1.660 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)CSC)CC2)cc1 41981175 MEEBGOUQRUTBFY-UHFFFAOYSA-N 337.489 1.687 10 10 EDCE C[C@@H](N)c1ccc(N(C)CCS(C)(=O)=O)c(Br)c1 94298818 NJXLZHJGKOOMCE-SECBINFHSA-N 335.267 1.950 10 10 EDCE COc1cc(N2CCN(CC(F)F)CC2)c([N+](=O)[O-])cc1OC 270974514 BHMRKZXYHQIKMC-UHFFFAOYSA-N 331.319 1.999 10 10 EDCE Cn1ccnc1[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 374363403 CIHWVVFWVZYAFL-SNVBAGLBSA-N 343.343 1.653 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1c(F)ccc(Br)c1F 808547361 MTUWEGLPMZQWNG-UHFFFAOYSA-N 335.100 1.971 10 10 EDCE CC(=O)C(=O)COC(=O)Cn1c(C(F)(F)F)nc2ccccc21 808495678 VTQGHOZZFSZREJ-UHFFFAOYSA-N 328.246 1.756 10 10 EDCE CC(=O)C(=O)COC(=O)CO[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 808527371 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344.411 1.717 10 10 EDCE C[C@H](O)CNC[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1567155331 OTGBEZLGDRZVHO-RYUDHWBXSA-N 333.392 1.282 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@H](C)C(C)C)cc(OC)n1 1495101994 YAHJPBKGJHIVIN-VXGBXAGGSA-N 337.420 1.625 10 10 EDCE Cn1ccnc1[C@H](O)C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1566629390 AMHUORXGDJPRTA-QGZVFWFLSA-N 345.399 1.346 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cccc(O)n1 1639587847 ILEYICZTCIQZMU-UHFFFAOYSA-N 330.340 1.698 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccc(N2CCOC2=O)cc1 1645360787 IVIYIJDEQHYQPS-UHFFFAOYSA-N 328.324 1.984 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCn2cncn2)cc1C 1662168878 FJWZRYMNFWEICI-CQSZACIVSA-N 331.420 1.280 10 10 EDCE COCCNC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1670561118 BROWEEOFCJECIR-AWEZNQCLSA-N 333.392 1.593 10 10 EDCE Cn1ccnc1[C@H]1C[C@@H](NC(=O)NCc2ccccc2O)CCO1 1683084193 OGUSTULVIZPIOE-DZGCQCFKSA-N 330.388 1.845 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)Nc1ccc(N)cc1 1866239532 PKNRRTAYTDCMJR-LBPRGKRZSA-N 336.392 1.366 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)CCN(CCO)C(=O)OC(C)(C)C 1902591637 QUWVUAZFMHCWIZ-UHFFFAOYSA-N 329.401 1.765 10 10 EDCE Nc1snnc1-c1nc(-c2ccncc2Br)no1 1923211219 ODEORYQAUYLXOX-UHFFFAOYSA-N 325.151 1.995 10 10 EDCE C[C@H](NCc1cccc(Br)c1O)C1CS(=O)(=O)C1 1967840112 LYWLYAGRNBPHNI-QMMMGPOBSA-N 334.235 1.677 10 10 EDCE COC[C@@H](CNC(=O)OC(C)(C)C)NCCc1ccc(O)c(O)c1 1943627695 BPSJFFXQWYMKER-CYBMUJFWSA-N 340.420 1.770 10 10 EDCE O=C(NC[C@@H](C(=O)O)c1cc(O)c(O)c(O)c1)OCc1ccccc1 1951525708 WJUMTFZTBIHDJC-GFCCVEGCSA-N 347.323 1.898 10 10 EDCE COC[C@H](N)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951834171 SKJZUWAZEBCXGB-RYUDHWBXSA-N 326.393 1.507 10 10 EDCE CO[C@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010399601 ZSUPCTZNCMLVPQ-HFAKWTLXSA-N 339.396 1.970 10 10 EDCE CNC(=O)c1nn(Cc2c(O)cccc2F)c(C(F)(F)F)c1N 2079258186 VWXAEROSDPXPEG-UHFFFAOYSA-N 332.257 1.737 10 10 EDCE O=C1Nc2cc(N3CC[C@@H]4COC[C@H]43)c(Br)cc2[C@H]1O 2198557221 QSXFVUAAMUHXHH-KEMBBXRSSA-N 339.189 1.660 10 10 EDCE C[C@H](N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)c1cc(O)ccc1O 1908511358 PACGBUPNGYPWKC-ZBINZKHDSA-N 338.404 1.729 10 10 EDCE NCc1ccc(N2CC[C@@H]3OCC(=O)N[C@@H]3C2)cc1Br 2185523886 ZQMDNJKQODRXQD-OLZOCXBDSA-N 340.221 1.002 10 10 EDCE OCc1nnc(CNCc2cc(Br)ccc2O)s1 2072474983 CAKSACMAMYLNPZ-UHFFFAOYSA-N 330.207 1.788 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@@H](O)CC2(C)C)cc1Br 2188639476 ZLEHZMRSVSMGPV-KBPBESRZSA-N 343.265 1.879 10 10 EDCE CN[C@@H](c1ccccc1O)[C@@H](O)c1c(Br)nnn1C 2091867679 NOGCCNHLYGYYIN-GXSJLCMTSA-N 327.182 1.277 10 10 EDCE CCNCc1ccc(N2CC(OCCO)C2)c(Br)c1 2095969074 VAHKAMOECWUXME-UHFFFAOYSA-N 329.238 1.756 10 10 EDCE CCNCc1ccc(N2CC[C@H]2[C@H](O)CO)cc1Br 2270717901 IOTVJSMNRPYJHN-UONOGXRCSA-N 329.238 1.491 10 10 EDCE O=C1NC(=O)N(CCC2=CCCCC2)C(=O)C1=CNC[C@@H]1CCCO1 2296931280 CMKBJZFOQVSMLE-AWEZNQCLSA-N 347.415 1.608 10 10 EDCE Cc1cc(Br)c(N2C(=O)NC(=O)C(=CN)C2=O)cc1C 2297506062 NVJIERRBBXKLMQ-UHFFFAOYSA-N 338.161 1.491 10 10 EDCE COC(=O)C1CCN(N=Nc2ccc3c(c2)OCC(=O)N3C)CC1 2330246156 IIXSFEGUOYNGLD-UHFFFAOYSA-N 332.360 1.926 10 10 EDCE Cc1ccc(CNC(=O)[C@]23C[C@H](CN2)C3)c(O)c1Br 2352942665 IWAQCVAQYRHLIK-DEZZCRIOSA-N 325.206 1.831 10 10 EDCE COC[C@H](OC)C(=O)NCc1ccc(C)c(Br)c1O 2352943311 RMGLBZAWCLHOJS-JTQLQIEISA-N 332.194 1.741 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)cc1Br 2355336014 KCBSCCLWQDNUQP-TYWRASTISA-N 341.249 1.789 10 10 EDCE COc1ccc(S(=O)(=O)NCCc2cc(O)c(O)cc2C)cc1 170270062 YAAHECSJOTYUQW-UHFFFAOYSA-N 337.397 1.936 10 10 EDCE CC(C)N(C[C@@H](C)O)C(=O)NCc1ccc(N2CCOCC2)cc1 119894399 MKCNAUWMZWXRCE-OAHLLOKOSA-N 335.448 1.824 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2357593607 YFKFCLWSRRRWMZ-VWQNXBSZSA-N 341.249 1.789 10 10 EDCE NC(=O)[C@@H]1CCN(c2ccc(/C=C\C(=O)O)cc2Br)C1 312187113 AUFYSLQJVUXNGH-WUWIAWFRSA-N 339.189 1.859 10 10 EDCE O=S(=O)(CC1CC1)NCc1ccc(N2CCC(CO)CC2)cc1 269771030 HMWYKYYSBWVOOW-UHFFFAOYSA-N 338.473 1.725 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCN2CCOC[C@@H]2C1 368623162 PGTNUXQAMIVOEM-SFHVURJKSA-N 344.459 1.513 10 10 EDCE O=C(NCc1cccc(N2CCOCC2)n1)NCc1ccccc1O 274999520 YLAZLKMMEHKWGC-UHFFFAOYSA-N 342.399 1.623 10 10 EDCE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H]2COC(=O)N2)cc1 283065557 PGNNPIDOXVBOTP-HOTGVXAUSA-N 347.415 1.369 10 10 EDCE CNC(=O)N1CCN(Cc2ccc(C)c(Br)c2O)CC1 2380708127 MJUIAJBMKQSACI-UHFFFAOYSA-N 342.237 1.920 10 10 EDCE Cc1ccc(CNCC2CN(C3COC3)C2)c(O)c1Br 2381129892 QWFZKAZZESXQJG-UHFFFAOYSA-N 341.249 1.883 10 10 EDCE Cc1ccc(CNC(=O)c2cc(N)n(C)n2)c(O)c1Br 2381143807 UMFHXHJDMVGQAY-UHFFFAOYSA-N 339.193 1.709 10 10 EDCE COc1cc(Br)cc(CN2CCC(CO)(CO)C2)c1O 827475202 VEWBQWBJQILSKO-UHFFFAOYSA-N 346.221 1.340 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3ccc(N(C)C)c(F)c3)C[C@@H]12 827389253 MMLSWRMSVGPDMH-MAZHCROVSA-N 342.436 1.136 10 10 EDCE CN(C)c1ccc(CNC(=O)CNC(C)(C)CN2CCCC2)cc1 839616159 PIRDOQFZHUNJBC-UHFFFAOYSA-N 332.492 1.833 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCCCN 843489111 FCHAPWBFHDIBJX-UHFFFAOYSA-N 328.796 1.676 10 10 EDCE C[C@@H]1[C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)CCN1C 914336499 ZMKBWMQVHIAQAZ-PBHICJAKSA-N 332.448 1.415 10 10 EDCE O=S1(=O)CC[C@]2(CN(Cc3c(O)ccc4ccncc34)CCO2)C1 842634580 WUARPVTUMCLEMJ-KRWDZBQOSA-N 348.424 1.330 10 10 EDCE NC[C@H](NC(=O)NCc1ccc(N2CC=CC2)cc1)C(F)(F)F 848596241 ULMGXRUMDFIRHG-ZDUSSCGKSA-N 328.338 1.752 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NCC[C@@H]2CNC(=O)C2)cc1 914254681 QLOTZJVCTPKWDC-HNNXBMFYSA-N 332.448 1.858 10 10 EDCE COC1(CS(=O)(=O)Nc2ccc(O)c(Cl)c2)CCOCC1 844659495 GWJPOUXDTVMGKQ-UHFFFAOYSA-N 335.809 1.983 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H]4C[C@@]4(CO)C3)C2)cc1 854299572 PSCOLYSUQMCSNV-DEYYWGMASA-N 331.416 1.298 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3(CO)CCC3)C2)cc1 854299356 OSTPWAGDTPGRHF-CQSZACIVSA-N 333.432 1.736 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc(C(N)=O)cn3C)C2)cc1 855231558 CKGVLMXDNRTGKJ-ZDUSSCGKSA-N 342.399 1.141 10 10 EDCE CCOc1cnc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)cn1 855223634 BTVPBTALFKJRGY-CYBMUJFWSA-N 342.399 1.893 10 10 EDCE COC1CC(CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 855168490 DKWVVPSCILMAFW-UHFFFAOYSA-N 342.417 1.309 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@]3(C)CCOC3)C2)cc1 852108374 CUFDBTHFYCEQNM-KSSFIOAISA-N 333.432 2.000 10 10 EDCE CCS(=O)(=O)N1CCC[C@@H](C(=O)NCc2c(O)cccc2F)C1 928712043 NLKVSMPOPQINBK-LLVKDONJSA-N 344.408 1.209 10 10 EDCE Cn1c(=O)n(CCC(=O)N2Cc3cccc(O)c3C2)c2ccccc21 871198652 MALQHTPFMLGHFF-UHFFFAOYSA-N 337.379 1.978 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@@H](O)CC[C@H]3C)C2)cc1 883716305 HAMGFWKPKYOZBF-FMKPAKJESA-N 333.432 1.829 10 10 EDCE C[C@@H](CS(C)(=O)=O)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1136025414 JPMCGXOVPBAYHL-AWEZNQCLSA-N 338.473 1.926 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3[C@H]4OCCC[C@@H]43)CC2)cc1F 780625194 YSDHKGUCWOWYRU-XYPHTWIQSA-N 334.391 1.908 10 10 EDCE COC(=O)[C@H](NCc1c(O)ccc(Cl)c1F)c1ccn(C)n1 792179062 FMAPXHSCJHJZES-CYBMUJFWSA-N 327.743 1.922 10 10 EDCE NS(=O)(=O)c1cc(C(=O)NCc2cc(Cl)ccc2O)ccn1 1146233100 QKGJDEKUDFLTHD-UHFFFAOYSA-N 341.776 1.018 10 10 EDCE COC(=O)[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1ccc(O)cc1 1153804280 WPCCMOMTUHWZFO-KQEHZQRSSA-N 343.335 1.847 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@H](c2cncn2C)N(C)C)c1 1150544187 ZKUJDDHIDWEFJR-MEDUHNTESA-N 332.404 1.614 10 10 EDCE COC(=O)c1cnc(CCNC(=O)/C=C/c2ccc(O)c(O)c2)s1 1157907213 NYUPKKCTHZPOSY-HWKANZROSA-N 348.380 1.713 10 10 EDCE C[C@H](NC(=O)C(=O)N1CCC[C@@H](O)[C@H]1C)c1ccc(N(C)C)cc1 1331705594 OWTXBTZEDWVPTH-WOSRLPQWSA-N 333.432 1.302 10 10 EDCE COC[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)C(C)C 1334048347 FKUNUVKIMXSFJK-MRXNPFEDSA-N 349.475 1.712 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)CNC(C)=O)C(C)(C)C)cc1C 1507877338 FAAXAEQYBSXHCI-KRWDZBQOSA-N 349.475 1.760 10 10 EDCE CNCc1ccc(N2CCO[C@@H](CCO)C2)cc1Br 2116230073 PWPNHPLYNGRTKB-ZDUSSCGKSA-N 329.238 1.756 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1COCCO1 1709038709 OBPUPDKCZURPLQ-CQSZACIVSA-N 332.404 1.598 10 10 EDCE COc1ccc(N2CCN(c3nn(C)cc3[N+](=O)[O-])CC2)c(OC)c1 1612786107 WFLSSWUIWZQUNZ-UHFFFAOYSA-N 347.375 1.672 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)NCc2ccccc2O)n1 2121903732 WRUYPDJJSHAAPA-UHFFFAOYSA-N 346.206 1.367 10 10 EDCE CN1C(=O)CN(C(=O)Cc2ccc(O)c(O)c2)[C@@H]1c1ccccc1 1638931338 WUCXMPUFJXCFSJ-GOSISDBHSA-N 326.352 1.640 10 10 EDCE Cc1ccc2ncc(C(=O)NCc3ccc(O)cc3O)c(=O)n2c1 1630301446 AJELGHIHUVSNQT-UHFFFAOYSA-N 325.324 1.344 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H]2CC=CCC2)cc1C 1496935571 GBBMEQMJMJLIAF-DLBZAZTESA-N 332.444 1.927 10 10 EDCE COc1ccc(N2CCN(CCN3CCOC[C@H]3C)CC2)c(OC)c1 1560083593 ZWGTXKWNJVOBMU-MRXNPFEDSA-N 349.475 1.547 10 10 EDCE Cc1nc(C(=O)NCc2c(O)ccc3ccccc23)nn1-c1nc[nH]n1 1645440429 CWHRXTCRHCDJRP-UHFFFAOYSA-N 349.354 1.483 10 10 EDCE O=C(CNC(=O)c1cccc(O)c1)NCc1cc(Cl)ccc1O 1640920128 MDCDGONFEBMWMQ-UHFFFAOYSA-N 334.759 1.797 10 10 EDCE C[C@H](CC(=O)NCc1cc(O)ccc1O)NC(=O)c1ccccc1 1644752786 UYYMHQXLKIJZRG-GFCCVEGCSA-N 328.368 1.923 10 10 EDCE CN1CCN(CC2CCN(C(=O)c3cccc(O)c3O)CC2)CC1 1585097745 AKIDKPXQCFDWMI-UHFFFAOYSA-N 333.432 1.197 10 10 EDCE Cc1cc(NC(=O)C[C@H]2C(=O)NN(C)C2=O)ccc1Br 169996260 FEUDNZLQVAYTDV-VIFPVBQESA-N 340.177 1.206 10 10 EDCE N[C@H]1C(=O)Nc2cc(N(CCO)C3CC3)c(Br)cc21 118590036 SKAUBDYTQHEDBQ-GFCCVEGCSA-N 326.194 1.362 10 10 EDCE O=C(O)C[C@H](CNC(=O)OCc1ccccc1)c1cc(O)nc(O)c1 1951948868 RWKUHVQPJNWSLE-CYBMUJFWSA-N 346.339 1.978 10 10 EDCE C[C@@H]1COC[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)N1C(=O)OC(C)(C)C 2003170551 QZCMRPSISRCRQM-LPWJVIDDSA-N 340.420 1.276 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](CO)[C@@H](CCO)C2)c(Br)c1 2149906809 BBIRGAGUJPWNIS-KGYLQXTDSA-N 344.249 1.930 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC[C@H]2CN=[N+]=[N-])COC1 1985102852 MRVOOAFRXNQESL-JTQLQIEISA-N 325.369 1.581 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNCc2c(O)cccc2F)C1 1997945142 HKYRPJPDFDJUBJ-IAQYHMDHSA-N 340.395 1.849 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC1CC1 2009801806 HESVFXPESCVNOR-LBPRGKRZSA-N 336.388 1.812 10 10 EDCE CCOC1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 2010391716 ATILSGQJTPOUSJ-LLVKDONJSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010390709 HLOVJUJLZUWJOB-QJPTWQEYSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](N[C@H]2CCc3cccc(O)c32)C1 2011486782 DZIUMTFOOJTKBX-YDHLFZDLSA-N 334.416 1.949 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NCc2cc(F)ccc2O)C1 2011917140 JMNQEGPBOMPPIE-DZGCQCFKSA-N 340.395 1.991 10 10 EDCE Cn1ncc(C(=O)Nc2ccc(N)cc2)c1I 379214483 PDNCTGLSJBXEDX-UHFFFAOYSA-N 342.140 1.859 10 10 EDCE Cn1cc(COC(=O)COc2ccc(N)cc2)c(Br)n1 713817015 LIBCLCQCEWUSLP-UHFFFAOYSA-N 340.177 1.887 10 10 EDCE CN1CCCN(c2cc(Br)c(CN)cc2F)CC1=O 382286826 LQEQRAJIUZBPON-UHFFFAOYSA-N 330.201 1.715 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1 1908917237 KRVYIERDCLZNCK-NWDGAFQWSA-N 339.396 1.730 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4COCC[C@H]43)c(Br)cc21 2193267233 CRWBUKWJCBXVLR-QUUYKZCZSA-N 338.205 1.626 10 10 EDCE N[C@H]1C[C@H](CC(=O)C(=O)CCCNC(=O)OCc2ccccc2)C1 2209747876 GBOVSWJEWCDICF-SHTZXODSSA-N 332.400 1.959 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)C[C@H]3C2)cc1Br 2236998915 XADPFTOVUYOBOF-LWWSYDQCSA-N 342.233 1.509 10 10 EDCE Cc1ccc(CN(C)CC2CS(=O)(=O)C2)c(O)c1Br 2352943765 YFHGRFYUMPZCBB-UHFFFAOYSA-N 348.262 1.940 10 10 EDCE Cc1ccccc1N1C(=O)/C(=C/NC[C@@H]2CCCO2)C(=O)NC1=S 103844061 UHMOUURKNMAILV-CVCOIXHCSA-N 345.424 1.395 10 10 EDCE CCCCOCCCNC(=O)C(=O)N(C(C)=O)c1ccc(N)cc1 170318174 QEEFWJINYHLNCM-UHFFFAOYSA-N 335.404 1.471 10 10 EDCE CCCCS(=O)(=O)N1CCN(c2ccc3c(c2)CC(=O)N3)CC1 62093648 AZQGJABLZNWXLJ-UHFFFAOYSA-N 337.445 1.433 10 10 EDCE COCCNC(=O)Cn1cc(N[C@H](C)c2cc(F)ccc2O)cn1 186498485 FNDNAXKVNPNFOP-LLVKDONJSA-N 336.367 1.664 10 10 EDCE CN(Cc1cscn1)S(=O)(=O)CCOc1ccc(N)cc1 70490796 MIVBUPBLKVRMGV-UHFFFAOYSA-N 327.431 1.566 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)CN(C)Cc1nnc(C)n1C 121663416 XUSYDRXWSYWSRW-UHFFFAOYSA-N 345.447 1.700 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@](O)(C(F)(F)F)C2)cc1 81049987 CSIOXBGXPCNZTC-OAHLLOKOSA-N 345.365 1.368 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)NCC1(CCO)CCC1 134194981 XAZRJRNFXNWFIJ-UHFFFAOYSA-N 347.459 1.875 10 10 EDCE CCOc1ccc(N2CCN(C(=O)NCCCN(C)C)CC2)cc1 243125262 JJYLHLRPQKEISB-UHFFFAOYSA-N 334.464 1.869 10 10 EDCE CC1(C)SC[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 276677317 VSBFHWHYBBPRTG-LLVKDONJSA-N 330.431 1.388 10 10 EDCE CNC(=O)C1(C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCC1 729965670 AHDAMXNWEQFPCF-UHFFFAOYSA-N 331.416 1.260 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@H](Nc3ncccn3)C2)cc1 825603317 SDPQCZREBIRTAC-HNNXBMFYSA-N 340.431 1.939 10 10 EDCE COC(=O)[C@@H](CO)NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 820760279 FGBJFTJRLOKGHI-MRXNPFEDSA-N 330.384 1.287 10 10 EDCE CCOC[C@H](C(=O)O)N(C)C(=O)NCc1ccc(N2CCCC2)cc1 908846579 AEQOSABIGHCKLO-MRXNPFEDSA-N 349.431 1.918 10 10 EDCE C[C@@H]1CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CCC1=O 588532402 PBAMSTSBFIITHK-IJVDHGTGSA-N 328.412 1.974 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)Cc2ccccc21 831924454 IQZFWFCIIOFDEW-GFCCVEGCSA-N 340.379 1.734 10 10 EDCE COC1(OC)CC[C@@H]1NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 924728547 JFXBOAAAVPCEFU-RDJZCZTQSA-N 347.459 1.629 10 10 EDCE COC(=O)c1cncnc1N(C)CCN(C)c1ccc(OC)cc1 845669479 JTVFBWGUPFSTCM-UHFFFAOYSA-N 330.388 1.844 10 10 EDCE C[C@H](C(=O)NCc1c(O)cccc1F)N1C(=O)NC2(CCCC2)C1=O 928712772 ZBIIZQPJGOTJTI-SNVBAGLBSA-N 349.362 1.401 10 10 EDCE COc1ccc(N2CC[C@H](Nc3cc(NC[C@@H](C)O)ncn3)C2)cc1 853758162 ATIKCZCKOFLPIT-KGLIPLIRSA-N 343.431 1.969 10 10 EDCE COC(=O)C[C@@H](C)CC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855226690 PWYVPXWZCKLCAZ-KBPBESRZSA-N 334.416 1.979 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3CCNCC3)C2)cc1 851662505 YVCMKARARGXZFG-OAHLLOKOSA-N 332.448 1.573 10 10 EDCE NC(=O)c1cc(F)ccc1N1CCN(C(=O)c2cc(O)cs2)CC1 857406783 GOYVFHWOWDGJLV-UHFFFAOYSA-N 349.387 1.654 10 10 EDCE COC[C@H]1COCCN1C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 923188586 SCTXHDUIDMGIPK-ZBFHGGJFSA-N 349.431 1.331 10 10 EDCE OCCO[C@]1(CNCc2cc(Cl)cc(Cl)c2O)CCOC1 850358137 HUDIZGDCDGNMDS-AWEZNQCLSA-N 336.215 1.957 10 10 EDCE C[C@@H](NC1CN(S(=O)(=O)N(C)C)C1)c1ccc2ccccc2c1O 858569480 IKWMZMYAFAWUKS-GFCCVEGCSA-N 349.456 1.687 10 10 EDCE CCC[C@H](C(=O)NCc1ccc2cccnc2c1O)S(N)(=O)=O 862026319 KBXUJXKVYGTVEN-GFCCVEGCSA-N 337.401 1.014 10 10 EDCE CCCC[C@H](NC(=O)NCC)C(=O)NCc1cccc(OC)c1O 771656866 QYNCGBZYYAABNH-ZDUSSCGKSA-N 337.420 1.895 10 10 EDCE COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(OC)ccc1O 775739790 SBCOXDBHYVGYDH-RRCSTGOVSA-N 349.383 1.326 10 10 EDCE NCc1cc(F)c(N2CCO[C@@H]3COC[C@H]32)cc1Br 1877649231 WHXHPWSIGUIZAJ-CHWSQXEVSA-N 331.185 1.651 10 10 EDCE NC(=O)[C@@H]1CC[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)C1 895773304 YSMRQKLKDQROPX-CABCVRRESA-N 347.484 1.758 10 10 EDCE CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccccc2O)nn1 792974948 XJWAVKVSUGZXHM-UHFFFAOYSA-N 330.344 1.224 10 10 EDCE COC(=O)[C@@]12CCOC[C@@H]1CN(Cc1cc(C)cc(OC)c1O)C2 794679094 MRCHQCCMHJKXOY-KBXCAEBGSA-N 335.400 1.721 10 10 EDCE NC(=O)c1cccc2c1CCN(C(=O)/C=C\c1ccc(O)c(O)c1)C2 1148847635 MYAPIUBNVJPDCI-ALCCZGGFSA-N 338.363 1.795 10 10 EDCE Cc1nn(C)c(C)c1N/C=C1\C(=O)NC(=O)N(c2ccccc2)C1=O 1084394805 DFYVFFBGOLAFAI-UKTHLTGXSA-N 339.355 1.616 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1coc(Sc2ncccn2)n1 1162279188 VBFSVTXIJICYGW-UHFFFAOYSA-N 344.352 1.957 10 10 EDCE C[C@@H](O)CNCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCCC1 1318670792 NLDIOLQEBHJOFP-GFCCVEGCSA-N 347.419 1.862 10 10 EDCE Cc1nn(C)c(Br)c1[C@@H](NCCCN=[N+]=[N-])C(=O)O 1890597378 RJYACHCIMRKIEP-MRVPVSSYSA-N 331.174 1.907 10 10 EDCE CCNCc1ccc(N(C)C[C@H](O)CN(C)C)c(Br)c1 690256227 MDQLKRRFQHNUNP-CYBMUJFWSA-N 344.297 1.917 10 10 EDCE C[C@](NCCCN=[N+]=[N-])(C(N)=O)c1cncc(Br)c1 695176544 KGEDRYBUQWCFEH-LLVKDONJSA-N 327.186 1.835 10 10 EDCE O=C(Cn1nnc2ccccc2c1=O)NCc1cc(Cl)ccc1O 1452947156 QATMBYPTZUKGKL-UHFFFAOYSA-N 344.758 1.467 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N(CC2CC2)[C@H](C(N)=O)C2CC2)cc1 1454962663 QWGSFQMZDZVQAQ-AWEZNQCLSA-N 343.387 1.965 10 10 EDCE C[C@H](NC(=O)Cn1c(=O)n(C)c2ccccc21)c1ccccc1O 1454822312 ZQSADRNJBOVZCJ-LBPRGKRZSA-N 325.368 1.923 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCN(c2ccc(F)cc2)C1=O 1469038770 GJMXJQCMGCPUOX-CQSZACIVSA-N 344.342 1.701 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C2[C@H]3CCC[C@H]23)cc1C 1700788238 SFEADYGYBAJSBP-JYJNAYRXSA-N 332.444 1.616 10 10 EDCE C#CCN(C)CCOCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1707236832 YWEYQPCSWUOFDC-UHFFFAOYSA-N 345.403 1.503 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)NCc1nnc(O)n1C1CC1 1471150066 HRLFAXQNNOSDLT-UHFFFAOYSA-N 337.767 1.677 10 10 EDCE C[C@H]1C[C@@H](N2CCOCC2)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1623811170 YLLALICUFCJEBK-SWLSCSKDSA-N 345.403 1.784 10 10 EDCE C[C@H](NC(=O)CCCCCCS(N)(=O)=O)c1ccccc1O 1557967878 NIWMLKPCCZCYHC-LBPRGKRZSA-N 328.434 1.808 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)Cc2cnc[nH]2)C2CC2)cc1C 1566722733 OHOHOJIAGBIQDQ-QGZVFWFLSA-N 342.443 1.954 10 10 EDCE O=C(CN1CCc2ccccc2C1=O)NCc1cc(O)ccc1O 1633599394 ZPDARNPTSXRIPM-UHFFFAOYSA-N 326.352 1.413 10 10 EDCE CCOCC(=O)N(C)CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1738346144 QQWSDEXNMFYONK-UHFFFAOYSA-N 349.391 1.416 10 10 EDCE COc1ccc(Br)c(CN[C@]2(CO)CCOC2)c1O 1964054589 XSKSECBUYSISGX-ZDUSSCGKSA-N 332.194 1.404 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)C2CN(C(C)=O)C2)cc1C 1674185328 ABQRCZZUMCDPNE-AWEZNQCLSA-N 347.459 1.466 10 10 EDCE O=S1(=O)CCCN1CCNCc1cc(Cl)cc(Cl)c1O 105473280 FXJABHZWQDXFGK-UHFFFAOYSA-N 339.244 1.824 10 10 EDCE O=C(NCc1ccccc1O)NC[C@H]1CS(=O)(=O)c2ccccc21 1681385917 VASGOKNCAMDQIL-ZDUSSCGKSA-N 346.408 1.763 10 10 EDCE CNC(=O)[C@@H](C)CN(C)Cc1c(Br)ccc(OC)c1O 1964595196 SMQIKRCMTIRMQX-VIFPVBQESA-N 345.237 1.977 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CN2CCCNC2=O)cc1C 1699368512 KJUQKLMYTAIAGM-CQSZACIVSA-N 348.447 1.013 10 10 EDCE CC[C@@H]1SC(=S)N(CCCC(=O)NC[C@@H]2CCCO2)C1=O 11636352 IBWHGGHCYNPWEL-QWRGUYRKSA-N 330.475 1.701 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)/C=C\C(=O)O)c2nccn2C)cc1 169813566 ZOKAJDUCLOHLCF-QWGSZXSUSA-N 328.372 1.333 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NCc1ccc(O)cc1O 1948527777 CEOSQICTCXLKSV-TZMCWYRMSA-N 338.404 1.727 10 10 EDCE NCc1cc(F)c(N2C[C@@]3(CO)C[C@]3(CO)C2)cc1Br 2146318195 JWGDMAULIGJCKI-ZIAGYGMSSA-N 345.212 1.228 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COCC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985100427 GWOBUTDCLOMAJQ-QWRGUYRKSA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N1CCC(CN=[N+]=[N-])CC1 2010389346 OLYHZEOSPUUNKG-UHFFFAOYSA-N 341.412 1.765 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)Nc1ccc(O)cc1 2029275251 PCQXPNVWQPVZAH-UHFFFAOYSA-N 332.179 1.689 10 10 EDCE Cn1ncc(Br)c1C(=O)NCCOc1ccc(N)cc1 693065823 RMYZDFBMIBUUMN-UHFFFAOYSA-N 339.193 1.574 10 10 EDCE CCOC(=O)Cc1cc(O)n2nc(C3CCCC3)c(C(=O)O)c2n1 2080920777 NSXWSZZPYXIMQF-UHFFFAOYSA-N 333.344 1.896 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)c(Br)c1 2182562653 WSPDHYHJRLKELL-UJJBCWTCSA-N 342.233 1.680 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](O)CC23CNC3)c1O 2236047870 ZGAYHOQZZUZESR-SECBINFHSA-N 343.221 1.072 10 10 EDCE NCc1ccc(N2C[C@@H]3OCCC[C@@]3(CO)C2)c(Br)c1 2239149555 LWZAHSCWHJOFPG-GJZGRUSLSA-N 341.249 1.886 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(Cc2ccon2)CC1 2308001697 HJLQKTLAEWSIIM-UHFFFAOYSA-N 329.356 1.443 10 10 EDCE Cc1ccc(CNC[C@@H]2CCS2(=O)=O)c(O)c1Br 2327619175 QXZKLMXRJVAAFA-JTQLQIEISA-N 334.235 1.740 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CSCCN2)c(O)c1Br 2352619797 JTJFUDVTMLIPDQ-JTQLQIEISA-N 345.262 1.784 10 10 EDCE Cc1ccc(CNCC[C@H]2COC[C@H]2O)c(O)c1Br 2352670860 KXHBBXBZISGYJZ-NWDGAFQWSA-N 330.222 1.950 10 10 EDCE CCOc1ccc(N2C(=O)/C(=C/NC3CC3)C(=O)NC2=S)cc1 103886253 GTFVGJWDQDCNQC-UKTHLTGXSA-N 331.397 1.469 10 10 EDCE CN1CCN(C(=O)C(=O)N(c2ccccc2)c2ccc(N)cc2)CC1 170366667 MFTBJKNIACPVNM-UHFFFAOYSA-N 338.411 1.708 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1C[C@@H](O)CN1C(C)=O 188783894 UXACTPJDDRQUFS-IAGOWNOFSA-N 333.432 1.083 10 10 EDCE COc1ccc(N(C)C[C@H]2CCCN(S(C)(=O)=O)C2)cc1F 121782705 NGVDNNPYQOJPRK-GFCCVEGCSA-N 330.425 1.942 10 10 EDCE CCN(CCO)C(=O)CN1C(=O)/C(=C\c2ccco2)SC1=S 210393753 NFLUKXLMGAXYPK-DHZHZOJOSA-N 340.426 1.322 10 10 EDCE C[C@@H](NCC(=O)N1CCOCC1)c1ccc(N2CCC(O)CC2)cc1 183364025 UDRNGQPJRHZGEY-OAHLLOKOSA-N 347.459 1.157 10 10 EDCE COc1ccc(CN2CCCC[C@@H]2C(=O)N2CCOCC2)c(O)c1 93014970 JATPUGGWSNSTFY-MRXNPFEDSA-N 334.416 1.614 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C[C@@H](N)CCO2)c(O)c1Br 2380755237 ZLTPWZOFAQLOIY-WDEREUQCSA-N 343.221 1.586 10 10 EDCE CCOc1ccc(O)c(CN2CCc3c(nnn3CCOC)C2)c1 293531230 BXGMPBCIGILBBD-UHFFFAOYSA-N 332.404 1.587 10 10 EDCE CCc1c(C(=O)OCC(=O)C(C)=O)cnn1-c1ccccc1OC 808536712 DFEBVZYYLGTXEU-UHFFFAOYSA-N 330.340 1.758 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@@H]4O)c([N+](=O)[O-])c1 588617530 PTCIAUKHTGWFFV-VUUSFJOWSA-N 344.367 1.987 10 10 EDCE CO[C@@]1(CN[C@H](C)c2cc(F)cc(F)c2O)CCS(=O)(=O)C1 903365422 NECSUHZGBINNTO-YMTOWFKASA-N 335.372 1.525 10 10 EDCE O=C(Cn1cc(NC(=O)c2cc(O)cs2)cn1)NC1CCCC1 731872954 UQIQVQRZOMAVQP-UHFFFAOYSA-N 334.401 1.961 10 10 EDCE COc1ccc(CNC(=O)NCC2(C(=O)O)CCOCC2)c(O)c1 831057300 FUBKNXFAZLGEBU-UHFFFAOYSA-N 338.360 1.081 10 10 EDCE C[C@@H]1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H]1C(=O)O 842938284 QEGGMMYQJKZQSL-PBHICJAKSA-N 347.459 1.754 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cn4c(n3)CCC4)CC2)cc1 843517299 LELPTELIWHSLAZ-UHFFFAOYSA-N 326.400 1.800 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1C[C@@H](O)CC2(CCOCC2)C1 922897659 BEMMXXUTKLIVLG-XBPVQUQDSA-N 333.384 1.501 10 10 EDCE COC(=O)[C@@H]1C[C@H](O)CN1Cc1cc(OC)cc(C(C)(C)C)c1O 1328200288 HQUIKUWMVRXEFP-WFASDCNBSA-N 337.416 1.807 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(C)(C)CNC(C)=O)C2)cc1 855224487 KWOUXVLJKUDSRX-AWEZNQCLSA-N 333.432 1.552 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)C[C@@H]2CO)c(Br)c1 698118531 ZQSYCODGMUJSNR-JLLWLGSASA-N 329.238 1.661 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3nncn3C)C2)cc1 854297284 LRJDBCZNYUSKJJ-ZDUSSCGKSA-N 344.419 1.244 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CC[C@H]3CC[C@@H](C2)[S@]3=O)c1O 862527182 LWPPIVOAJFFDAN-WCBZVUCDSA-N 340.401 1.794 10 10 EDCE CCCC[C@H](NC(=O)NCC)C(=O)NCc1cc(OC)ccc1O 771656883 SCNTUQXFJGOBHE-AWEZNQCLSA-N 337.420 1.895 10 10 EDCE O=c1onc(-c2cccnc2)n1Cc1ccc(N2CCOCC2)cc1 877876075 BDUVVDQJFVLQAD-UHFFFAOYSA-N 338.367 1.783 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@H](C(=O)N2CCCC2)C1 779517349 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1.777 10 10 EDCE NCc1ccc(N2CC(N3CC(F)C3)C2)c(F)c1Br 2102844515 XTJHFDQWYLIEDN-UHFFFAOYSA-N 332.192 1.889 10 10 EDCE CC[C@H](O)CN(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2106613046 HSYGZUUWNJKYAB-JVXZTZIISA-N 329.194 1.642 10 10 EDCE O=S1(=O)C[C@H]2CCN(Cc3cc(Br)ccc3O)[C@@H]2C1 2094883748 YXCJTKKEUZCVPJ-BXKDBHETSA-N 346.246 1.774 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@H](CO)C2)cc1Br 2098209435 SBFSBFFATFNANT-MNOVXSKESA-N 329.238 1.914 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213585990 SYWAUIFSUFOQRP-RYUDHWBXSA-N 339.396 1.970 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@](C)(O)[C@@H](O)C2)c(Br)c1 1893331928 NMWMJINUJYEULT-HERUPUMHSA-N 330.222 1.824 10 10 EDCE Cc1nn(C)c(C)c1CCNC(=O)[C@@H](C)Cc1ccc(O)c(O)c1 170039218 IWZNPBGQPBRYNE-NSHDSACASA-N 331.416 1.986 10 10 EDCE CC(C)CN1C(=O)/C(=C/Nc2ccc(N(C)C)cc2)C(=O)NC1=S 120996438 LKJXWWQMZMMZLN-NTEUORMPSA-N 346.456 1.948 10 10 EDCE CN(C)c1ccc(CNC(=O)CNC(=O)c2ccccn2)cc1F 172530725 NKZXPGRKLGAUBX-UHFFFAOYSA-N 330.363 1.333 10 10 EDCE CCO[C@H]1C[C@@](NC(=O)c2cccc(O)c2O)(C(=O)OC)C1(C)C 275530205 FNNXQQLOTSRUAV-YVEFUNNKSA-N 337.372 1.574 10 10 EDCE Cc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cnn1 276600056 XRKBLODYYMBKHW-UHFFFAOYSA-N 344.390 1.815 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)N1CCCSCC1 806277183 RXQIEGLGFKCYLJ-UHFFFAOYSA-N 345.515 1.707 10 10 EDCE COC(=O)[C@@H]1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 298737376 RBQPZFIQPKPETE-OAHLLOKOSA-N 333.432 1.206 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1C[C@]12CCN(C(=O)OC(C)(C)C)C2 808539204 WAJUAXQSXGSRKG-BZNIZROVSA-N 325.361 1.335 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CC1=O 819170970 QZRWGMJGTSAFQR-BNOWGMLFSA-N 343.383 1.166 10 10 EDCE C[C@H](OCC(=O)N1CCOc2cc(N(C)C)ccc21)c1nccn1C 576189104 ZYOFUNBPDYZXTC-ZDUSSCGKSA-N 344.415 1.989 10 10 EDCE C/C=C/[C@H](O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 900268474 CWBYODJMRBUJGQ-GPPJVZRPSA-N 336.407 1.993 10 10 EDCE C/C(=C/C(=O)NCc1ccc2c(c1)CCCN2C)CN1CCOCC1 900432205 CRBXDZYHGAJOEC-VBKFSLOCSA-N 343.471 1.964 10 10 EDCE 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CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3[C@H](C)O[C@@H](C)[C@H]3C)nc12 859827996 VMKPJVUPPFZVBN-LMCGPQHNSA-N 348.403 1.513 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1[C@@H](C)NCc1ccc(N2CCC(O)CC2)cc1 850406637 NWYGEGMWTPGZJB-FSPWUOQZSA-N 332.444 1.935 10 10 EDCE O=C(NCCCSc1nccs1)NCCCN1CCCC1=O 759118976 XZWFLZZGIXOEQK-UHFFFAOYSA-N 342.490 1.937 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@H](Cn3ccnn3)C2)cc1 853245175 VBFQUFOCWZYLKN-HNNXBMFYSA-N 328.420 1.576 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](O)c3ccco3)C2)cc1 854301192 KMQFGOYSKYXRNH-XJKSGUPXSA-N 345.399 1.900 10 10 EDCE CCn1cc(S(=O)(=O)NNc2nc3cccnc3s2)nc1C 857225020 DJUVKTXTUMDDRO-UHFFFAOYSA-N 338.418 1.522 10 10 EDCE COC(=O)c1ccoc1S(=O)(=O)NCc1ccc(N(C)C)cc1 866424426 HWHBSXXEYPJZHG-UHFFFAOYSA-N 338.385 1.611 10 10 EDCE CN(C)CC1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761884773 UIWGMNMPQPKPCX-UHFFFAOYSA-N 334.376 1.704 10 10 EDCE CC1CCN(c2ccc(CNC(=O)N3CC(=O)N(C)C3)cc2)CC1 765253003 KTTSENHWGVJOCV-UHFFFAOYSA-N 330.432 1.864 10 10 EDCE 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EDCE Cc1ccc(CN2CC3(CNC(=O)N3C)C2)c(O)c1Br 2380765901 PYDITZRQORYLIL-UHFFFAOYSA-N 340.221 1.673 10 10 EDCE CO[C@@H](CCN)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380788342 AKOXFZFAJLFDED-NSHDSACASA-N 345.237 1.785 10 10 EDCE Cc1ccc(CNC(=O)[C@]2(CO)CCCN2)c(O)c1Br 2381129629 MSMWCBHVCXMFMU-CQSZACIVSA-N 343.221 1.194 10 10 EDCE CCOC(=O)C1(C(=O)NCCc2ccc(O)c(O)c2)CCOCC1 802778803 JNCOZIKVMNOJFS-UHFFFAOYSA-N 337.372 1.116 10 10 EDCE CC[C@H](NCc1cc(Cl)c(F)cc1O)C(=O)N1CCOCC1 293559708 HYPPTNFOUZBGSC-ZDUSSCGKSA-N 330.787 1.912 10 10 EDCE CC[C@H](OC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 299286220 FUWMMWDRRJUYBA-KRWDZBQOSA-N 335.448 1.358 10 10 EDCE NCc1cc(F)c(N2C[C@@H](CO)[C@H](CO)C2)cc1Br 704699117 NBILIFOGPVAAQT-UWVGGRQHSA-N 333.201 1.084 10 10 EDCE CC(=O)C(=O)COC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O 808499315 SIWCLQOTVPWEBT-LBPRGKRZSA-N 341.772 1.844 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1 817108830 NLSOKSRGTDQOFN-AWEZNQCLSA-N 347.415 1.082 10 10 EDCE CC(C)(C)OC(=O)N1CC(N[C@H]2CCc3cccc(O)c32)(C(N)=O)C1 715537617 CVHVDLQBGQXRJD-LBPRGKRZSA-N 347.415 1.444 10 10 EDCE O=C1CCCN1CCCN1C(=O)CN(Cc2ccccc2O)C1=O 819166121 MWQHVHXHIJJAKB-UHFFFAOYSA-N 331.372 1.169 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C)Cc3cc[nH]n3)CC2)cc1 733895337 VCQYTDJGUZLNJJ-UHFFFAOYSA-N 343.431 1.199 10 10 EDCE COc1cccc(CNC(=O)NCc2ncc3c(n2)CCOC3)c1O 845348051 KFOFFMOYXQETMR-UHFFFAOYSA-N 344.371 1.263 10 10 EDCE C[C@@H](O)[C@H]1CN(C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 840281458 SZMGPRFNVUOEHE-IAQYHMDHSA-N 325.384 1.183 10 10 EDCE COc1nc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)co1 859966435 WNEOVHSKKGCNFM-UHFFFAOYSA-N 335.335 1.793 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1C[C@H](O)C12CCC2 853474642 JYFROAFIWKTBFT-IRXDYDNUSA-N 345.443 1.626 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](OC)C3CC3)C2)cc1 852357821 IIMAETHYBJGRMI-RHSMWYFYSA-N 333.432 1.998 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCn2c(O)nnc2C1 853776011 JWPAZFPOVVAHTF-UHFFFAOYSA-N 340.387 1.085 10 10 EDCE NS(=O)(=O)C[C@@H]1CCCN1Cc1cccc(Br)c1O 769429375 ZOKHRPIIBYHPGH-JTQLQIEISA-N 349.250 1.408 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@H]3OCCO[C@@H]3C)CC2)cc1 931578288 PMEZZAVGHRUUOV-CXAGYDPISA-N 334.416 1.584 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](O)[C@@H](C)O 871143719 RGXBAPSCMFVWTG-DYVFJYSZSA-N 330.384 1.378 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2CCc3nc(F)ccc32)c1 1131172987 YMCIIFUVSSWODH-DJWKRKHSSA-N 326.331 1.578 10 10 EDCE CCn1nccc1CN(CCO)C(=O)NCc1ccc(N(C)C)cc1 792792277 MQDSJVDDRVPXMD-UHFFFAOYSA-N 345.447 1.673 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](N3CC[C@@H](O)C3)C2)cc1 1140117135 QDXITKCXJHUWRJ-ZIAGYGMSSA-N 331.376 1.130 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1ccc(-c2nncnn2)cc1 1144645469 XWQLPMDZOZQMAW-UHFFFAOYSA-N 337.339 1.204 10 10 EDCE C[C@@H]1CN(Cc2ccc(Br)cc2O)CCS1(=O)=O 707516053 COLHDZZMDHZTDV-SECBINFHSA-N 334.235 1.774 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2c(C)noc2C)cc1C 1331663484 GMRIBUVIRKABIK-OAHLLOKOSA-N 347.415 1.489 10 10 EDCE COC[C@@H]1CCCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332038343 TZAPTRAVYBDQMJ-CYBMUJFWSA-N 332.400 1.510 10 10 EDCE CCn1nncc1C(=O)NC[C@@H](C)NCc1ccc(OC)c(C)c1 1266935044 FVFMCUISFVSTIR-CYBMUJFWSA-N 331.420 1.523 10 10 EDCE CN1CC2(CN(Cc3cc(Br)cc(F)c3O)C2)OC1=O 1262112130 ZOBMGRZAQNPOKO-UHFFFAOYSA-N 345.168 1.930 10 10 EDCE CCN[C@H](C)c1ccc(N2CC(O)(CO)C2)c(Br)c1 2115313936 MFWHEHUZYNZBFG-SNVBAGLBSA-N 329.238 1.663 10 10 EDCE CC(C)N1CCN(CCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1479941959 CGHKIAZJJPVONW-UHFFFAOYSA-N 346.435 1.605 10 10 EDCE COc1ccc(CN[C@@H]2C[C@H](C)N(C(=O)CCNC(N)=O)C2)cc1C 1717828233 PLJXMUJMCRFNBN-DZGCQCFKSA-N 348.447 1.141 10 10 EDCE CNCc1ccc(N2C[C@@H]3OC(=O)N[C@@H]3C2)cc1Br 2120415255 GVBLKOYSQWAZQG-NEPJUHHUSA-N 326.194 1.466 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CCN(C)C3=O)CC2)cc1C 1716691047 XOLZBVOSLLJTIR-OAHLLOKOSA-N 345.443 1.220 10 10 EDCE C[C@H](C(=O)NCc1c(O)cccc1F)N1C(=O)c2ccccc2C1=O 1558454337 FABHUOGMGLEATO-SNVBAGLBSA-N 342.326 1.832 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)/C=C\C(C)(C)C)cc(OC)n1 1720901175 DMJPCOWPILLTHQ-KRZKBDHCSA-N 349.431 1.936 10 10 EDCE Cc1cc(C(=O)N2CCC[C@@H](CO)[C@H]2CO)c(C)n1-c1ccccn1 1638915595 NOFWSKWAODJBGF-DOTOQJQBSA-N 343.427 1.695 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cnn(C)c2)cc1C 1497522723 MIJWEDLYIFFBTI-PLNGDYQASA-N 328.416 1.813 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2nc[nH]n2)C2CC2)cc1C 1731410112 JMAVLJKJBVMFFD-CQSZACIVSA-N 329.404 1.420 10 10 EDCE O=C(NCCc1nnc(S)o1)c1cc2cc(O)c(O)cc2s1 1567853014 QKVZJRVEPDENAP-UHFFFAOYSA-N 337.382 1.957 10 10 EDCE COc1cccc(CNC(=O)[C@H]2CCN(c3ccncc3)C2)c1O 1641247139 PUUWLFKXUQVAPH-AWEZNQCLSA-N 327.384 1.939 10 10 EDCE CC(=O)N1CCO[C@](C)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1740256486 QJENMXAPIAWVKH-MRXNPFEDSA-N 347.375 1.216 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 5374168 LVCSLDUTOZVCKX-JRZFIGEHSA-N 327.358 1.472 10 10 EDCE COc1ccc(CCNC(=O)c2nnn(-c3ccc(N)cc3)n2)cc1 1857878440 BWKOTJSPCXGCCA-UHFFFAOYSA-N 338.371 1.226 10 10 EDCE CCN1CCN(C(=O)CNCc2ccc(N(CC)CC)cc2)CC1 1857866246 BFVHKELFXAKIMM-UHFFFAOYSA-N 332.492 1.787 10 10 EDCE CNCc1ccc(N2C[C@@H](O)C[C@@H]2CN(C)C)c(Br)c1 234378994 JYOCMGPUVBNUMV-OLZOCXBDSA-N 342.281 1.670 10 10 EDCE CNCc1ccc(N2CCN(CCO)CC2)c(Br)c1 234449152 JMRVHCMDIWORQC-UHFFFAOYSA-N 328.254 1.283 10 10 EDCE CC(=O)[C@H](N)C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952117447 AEKSDKWPFOXWOA-CHWSQXEVSA-N 338.404 1.840 10 10 EDCE CNCc1ccc(N2CCC([C@H](O)CO)CC2)c(Br)c1 2152467902 JWXYIWCPEDLMOK-OAHLLOKOSA-N 343.265 1.738 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C1(O)CCC1 2014483724 VEJIGYMEQZDDFI-MNOVXSKESA-N 339.396 1.706 10 10 EDCE NS(=O)(=O)CCCNCc1cc(Br)cc(F)c1O 715766503 SRVUVMNKFBJRRE-UHFFFAOYSA-N 341.202 1.062 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCO[C@H]4C[C@@H]43)c(Br)cc21 2171803821 YVUGCHDNWIHRBC-AVGNSLFASA-N 338.205 1.639 10 10 EDCE O=C1Nc2cc(N3CC[C@H]4[C@@H]3C[C@H]4O)c(Br)cc2[C@H]1O 2178158077 ZTVNEUXDISRCRO-JZYVUTCPSA-N 339.189 1.394 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2OCCN(Cc3cc(N)ccc3O)[C@@H]2C1 2044612172 UOJMWARZAJQCMS-GDBMZVCRSA-N 349.431 1.795 10 10 EDCE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1C(=O)c1ccc(O)c(O)c1 2054417100 ITJRTKDRSBTUPB-WPRPVWTQSA-N 346.305 1.769 10 10 EDCE CN[C@H](C)c1ccc(N(C)C2CS(=O)(=O)C2)c(Br)c1 2095903839 HKFIYMUXHIWKQL-SECBINFHSA-N 347.278 1.963 10 10 EDCE O=C(Nc1ccc(O)cc1C(=O)O)c1cnnc(Br)c1 2289812958 RGWOSULIGMOLIZ-UHFFFAOYSA-N 338.117 1.895 10 10 EDCE NC[C@]1(CO)COCCN1c1ccc(OCc2ccccc2)cc1 2299527473 IIVNXJDXNHNJMT-IBGZPJMESA-N 328.412 1.792 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@]1(NC(=O)OC(C)(C)C)C[C@@H](CO)C1 2300532635 YYCDLWWJDXOMEL-WGRBQBNCSA-N 341.412 1.811 10 10 EDCE CC(C)c1ccccc1N(C)C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 493494654 URCSAZFBTDQJAG-ZHACJKMWSA-N 341.411 1.884 10 10 EDCE CCn1[nH]c(Br)nc1=NCCc1ccc(O)c(O)c1 2353789357 YINRETDJMPROGC-UHFFFAOYSA-N 327.182 1.548 10 10 EDCE CCNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2354481800 CMBSDFZGKYEOTE-BSLXNSKLSA-N 341.249 1.489 10 10 EDCE CN(CCS(C)(=O)=O)c1cc(Br)c(CN)cc1F 310671315 IFPAXBGKTQFTKN-UHFFFAOYSA-N 339.230 1.528 10 10 EDCE CCOC(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCCCC1 36100090 CAWBFIGWQIKOAZ-KRWDZBQOSA-N 347.459 1.959 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NCCC(=O)NC(C)C 45920079 GOVMZGFXAXHPEC-UHFFFAOYSA-N 328.372 1.895 10 10 EDCE C[C@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(=O)N(C)C 255048382 DPTOBASRACWFDL-PIZKADEWSA-N 331.416 1.129 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2[C@H](CN)C2(F)F)c(O)c1Br 2380739970 QFGRWGJDFQHCCU-DTWKUNHWSA-N 349.175 1.919 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@@H](O)c2cc(Br)nn2C)cc1 2163137153 ADPPOPBSFJEQSW-KGLIPLIRSA-N 339.237 1.982 10 10 EDCE CC(=O)C(=O)COC(=O)c1cccnc1Oc1ccccc1C(N)=O 808525379 CQSWVAHPOSKIJK-UHFFFAOYSA-N 342.307 1.288 10 10 EDCE CNC(=O)[C@H]1CCN(Cc2ccc(N3CCC(OC)CC3)cc2)C1 817283245 QXIGLARCINWRNZ-INIZCTEOSA-N 331.460 1.870 10 10 EDCE COc1cc(O)c(CN2C[C@H](O)C[C@H]2[C@H]2CCCOC2)cc1OC 824654370 NPCJFGAWTIIPLM-CFVMTHIKSA-N 337.416 1.771 10 10 EDCE NS(=O)(=O)c1ccc2c(c1)CCN2Cc1cccc2c1CCNC2 662277118 NYRLMZMCLBUMNQ-UHFFFAOYSA-N 343.452 1.542 10 10 EDCE CO[C@@H](CN1C(=O)CN(Cc2ccccc2O)C1=O)[C@@H]1CCOC1 849357477 MPCAPMXHWHIKLL-HIFRSBDPSA-N 334.372 1.208 10 10 EDCE CN(C)c1ccc(CNC(=O)NC2CCC(C(N)=O)CC2)cc1F 747583342 CAJCGDWVFRBGKU-UHFFFAOYSA-N 336.411 1.735 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)CC3CN(C)C3)C2)cc1 852450745 UJZHNDBGTSEGCR-HNNXBMFYSA-N 332.448 1.477 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C(=O)O)C(C)C)C2)cc1 851651527 LZCHFFCOYKHSGY-XJKSGUPXSA-N 349.431 1.930 10 10 EDCE O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1cccc(O)c1O 855402008 COSBYBDKHRPFKJ-HNNXBMFYSA-N 342.395 1.594 10 10 EDCE O=C(NCCCSc1nccs1)N1CCN(C2CC2)C(=O)C1 759601938 QWIFZNDSQRZVDZ-UHFFFAOYSA-N 340.474 1.642 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCC2(COC2)C1 850601244 CXGVUKNSXIXUAQ-UHFFFAOYSA-N 345.443 1.350 10 10 EDCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2cnc3n2CCC3)c1 772723681 KLRCKYUDKMJRQJ-SNVBAGLBSA-N 337.401 1.583 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCC[C@H](C(N)=O)C3)CC2)cc1 786686510 FLUORQSIFXLUJL-LSDHHAIUSA-N 345.443 1.636 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3C[C@@H](C)CO3)cc2)CC1 890129158 CVWFLLJLVPUWJR-KDOFPFPSSA-N 345.443 1.396 10 10 EDCE Cn1ncnc1C1(O)CN(Cc2cc(Cl)cc(Cl)c2O)C1 895620813 MOIWCSWKXQKDQY-UHFFFAOYSA-N 329.187 1.531 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)C[C@H]1C(=O)NCCCN=[N+]=[N-] 1895875369 ISURTEZTFHSSSE-MNOVXSKESA-N 327.385 1.563 10 10 EDCE COc1ccc(N2CCN(CCC(=O)N(C)OC)CC2)cc1F 799128254 NVVUJDYBZFCFJS-UHFFFAOYSA-N 325.384 1.366 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@@H]1Cc2cc(F)ccc2NC1=O 1303194681 JBDNGCSRLOFGRC-LBPRGKRZSA-N 330.315 1.664 10 10 EDCE C[C@H](O)CCN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 135565373 FRMRSMWEURLYNP-MADCSZMMSA-N 328.210 1.608 10 10 EDCE COC(=O)[C@H](C[C@@H]1CCCO1)NC(=O)/C=C\c1ccc(O)c(O)c1 1177476390 RBVOSQFHEFRPEO-REPZICSESA-N 335.356 1.338 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C1CC1)[C@@H]1CCCCO1 1330027645 PYFMRAJNSJEKSY-IRXDYDNUSA-N 346.427 1.815 10 10 EDCE CC[C@@H](C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1347655395 OHHZWLLUTBJFHK-CABCVRRESA-N 347.459 1.943 10 10 EDCE CC(C)(O)[C@@H](Oc1ccccc1)C(=O)NCc1cccc(O)c1O 1350299770 ISSHJEGAMJLPDC-INIZCTEOSA-N 331.368 1.933 10 10 EDCE Cc1cc(=O)cc(C)n1CCCC(=O)NCc1c(O)cccc1O 1456323483 SJTSBLWPNVLIJF-UHFFFAOYSA-N 330.384 1.973 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)C1=C[S@](=O)CCC1 1625607524 IJAGEPMKFWDQQV-HSZRJFAPSA-N 334.441 1.566 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C2(C(F)F)CC2)cc1C 1717764955 BJXVTZLFFBMUNQ-ZDUSSCGKSA-N 342.386 1.616 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)Nc1cccc(O[C@@H]2CC(=O)N2)c1 1637903583 CNCQJMLWXKDDSJ-SUQGKYDKSA-N 340.335 1.975 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2cnc3nc(O)nc(O)c3c2)c1 1645800557 JOHRTRGWZYXYIV-UHFFFAOYSA-N 326.312 1.380 10 10 EDCE Cn1ccc(=O)c(C(=O)NCc2cccc(Br)c2O)c1 1640087515 HOOREZJIOXRDFG-UHFFFAOYSA-N 337.173 1.783 10 10 EDCE CC(C)(C)OC(=O)N1CC(NCc2cccc(O)c2O)(C(=O)O)C1 1913942987 DQWFVIZOWORIIL-UHFFFAOYSA-N 338.360 1.262 10 10 EDCE O=C1Nc2cc(N3C[C@H](O)C4(CC4)C3)c(Br)cc2[C@@H]1O 2149753425 FCJPYBZJVZVMLE-RYUDHWBXSA-N 339.189 1.396 10 10 EDCE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H](O)CNC(=O)OC(C)(C)C 2010263095 UFCSIGIRSAHFLJ-SMDDNHRTSA-N 338.404 1.797 10 10 EDCE CC(C)(C)OC(=O)NCC1(O)CC(C(=O)NCCCCN=[N+]=[N-])C1 2010404900 DTDIDSZWMOEBRI-UHFFFAOYSA-N 341.412 1.859 10 10 EDCE Cn1c(C(=O)N2CC(N=[N+]=[N-])C2)cnc1CNC(=O)OC(C)(C)C 2010404622 BGPBJFFQWVMVQN-UHFFFAOYSA-N 335.368 1.580 10 10 EDCE CCN(CCNC(=O)OC(C)(C)C)C(=O)c1cc(O)c(O)c(O)c1 2015125051 ICRFMCDXMUDRRV-UHFFFAOYSA-N 340.376 1.790 10 10 EDCE CCCNCc1ccc(N2C[C@H](O)[C@@H](CO)C2)cc1Br 316619697 XJHWAXAZINMJIB-DOMZBBRYSA-N 343.265 1.738 10 10 EDCE CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)c4cnn5c(O)cc(C)nc45)[C@@H]1[C@H]3C2 2063047558 STTCVLRBCDZESQ-GLRJYAJPSA-N 328.372 1.239 10 10 EDCE CCOC(=O)Cc1cc(O)n2nc(C3CC3)c(C(=O)OCC)c2n1 2080924800 YHWSIGLHYRGTDK-UHFFFAOYSA-N 333.344 1.595 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCOC[C@@H]3CF)c(Br)cc21 2182607173 XMRURYNWKQEEAW-MADCSZMMSA-N 344.184 1.576 10 10 EDCE Cn1ncc(Br)c1CNC(=O)c1cc(O)c(O)c(O)c1 2188868731 VXMIULMTLCZOMB-UHFFFAOYSA-N 342.149 1.229 10 10 EDCE COc1ccc(O)c(CNCCc2nnc(Br)n2C)c1 2185197018 AHQXTECPAHWCTG-UHFFFAOYSA-N 341.209 1.624 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)C[C@H]2CO)cc1Br 2089864588 VKONHADHOSVJKS-NHCYSSNCSA-N 330.222 1.682 10 10 EDCE CC1(C)CO[C@H](CO)CN1c1ccc(CO)cc1Br 2111218832 MYEJYRSODVDZBI-NSHDSACASA-N 330.222 1.918 10 10 EDCE C[C@@H]1CN(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c2ccccc21 122224373 OGRKKYNDNOBAML-IDVQTMNDSA-N 325.368 1.248 10 10 EDCE CC(C)[C@H]1C(=O)NCCN1c1ccc(CN)cc1Br 2113700095 QRNKEOPETPUICN-ZDUSSCGKSA-N 326.238 1.869 10 10 EDCE CC[C@@H](c1cc(Br)ccc1O)N(CC(N)=O)CC(=O)O 2201038714 SDFYQSAOUPDOIT-JTQLQIEISA-N 345.193 1.478 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OCCC[C@]2(C(=O)NCCN=[N+]=[N-])C1 2215602377 PXWCJOFTZZVSOI-NHYWBVRUSA-N 339.396 1.829 10 10 EDCE O=C1NC(=O)N(C[C@H]2CCCO2)C(=O)C1=Cc1c[nH]c2ccccc12 2296755525 IMJCKBGLICSZHH-GFCCVEGCSA-N 339.351 1.809 10 10 EDCE 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O=C(NCc1c(O)cccc1O)[C@H]1CCN(c2ccc(F)cc2)C1=O 1597568477 FAPSCKSYQWQPML-CYBMUJFWSA-N 344.342 1.906 10 10 EDCE COCCNCc1ccc(N2C[C@H](O)[C@@H]2C)cc1Br 2126123205 NXEMJGBMCKSGEW-HZMBPMFUSA-N 329.238 1.755 10 10 EDCE CCN(c1cc2c(cc1Br)[C@@H](NC)C(=O)N2)C1COC1 1915657646 SOZGSIJLOUYTFS-CYBMUJFWSA-N 340.221 1.887 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NCCc1ccc(O)c(O)c1 1944566915 RKDZUFZXAKEJRA-QWHCGFSZSA-N 338.404 1.522 10 10 EDCE NCc1cc(F)c(N2C[C@@H](CCO)[C@@H](CO)C2)cc1Br 2149899515 AJXYECBNTSHLGJ-MWLCHTKSSA-N 347.228 1.474 10 10 EDCE COC(=O)[C@@H](O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951701029 VKIYAILWRSSUJE-GWCFXTLKSA-N 341.360 1.068 10 10 EDCE Nc1ccc(CN=c2cc(I)cn[nH]2)cc1 1986301515 GAZWYISNWYNWHG-UHFFFAOYSA-N 326.141 1.697 10 10 EDCE CNCc1ccc(N2CCSC[C@@H]2S(C)(=O)=O)c(Cl)c1 164140709 FNMJILRFZFTEQP-ZDUSSCGKSA-N 334.894 1.983 10 10 EDCE COC(=O)C=Cc1ccc(N2CCN([C@@H](C)CO)CC2)c([N+](=O)[O-])c1 2053569979 AFWLLKFXOQPFOU-ZDUSSCGKSA-N 349.387 1.284 10 10 EDCE 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RHJRCZOMOOACSH-SNVBAGLBSA-N 336.413 1.451 10 10 EDCE Cn1c(=O)n(CCC(=O)NCc2ccc(O)cc2O)c2ccccc21 1142529998 KODWPHBAAOOVQY-UHFFFAOYSA-N 341.367 1.458 10 10 EDCE CC[C@H](C(=O)OC)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 790373580 FHUWEEBQTQIROI-INIZCTEOSA-N 334.416 1.933 10 10 EDCE CNC(=O)Cn1cc(NC(=O)c2cc3cc(O)c(O)cc3s2)cn1 1141896774 RLEZGOJVNSFTGF-UHFFFAOYSA-N 346.368 1.507 10 10 EDCE Cc1ccc(C(=O)NCc2cccc(S(C)(=O)=O)c2)c(O)c1O 1158058229 PCCQREBPCSTUEL-UHFFFAOYSA-N 335.381 1.740 10 10 EDCE COC(=O)c1cc(C2CCN(C(=O)c3cccc(O)c3O)CC2)no1 1152839481 RPWRQGYNFSTHCV-UHFFFAOYSA-N 346.339 1.892 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1c2ccccc2OC[C@H]1CO 1180324474 KXLFWXJYTWSPQW-CUVOFOAUSA-N 341.363 1.969 10 10 EDCE COC(OC)[C@H](C)NCc1ccc(N2CCN(C)CC2)c(F)c1 1354168985 CNRKCELNXUEYOL-ZDUSSCGKSA-N 325.428 1.675 10 10 EDCE C[C@@H]1C[C@H]1C(=O)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1506114773 MEHVXKIXPWDARR-ZWNOBZJWSA-N 343.387 1.884 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCn1cncn1 1464874685 UUWVDFGYVAHHKV-UHFFFAOYSA-N 337.383 1.928 10 10 EDCE O=S1(=O)C[C@H]2[C@H](CNCc3cccc(Br)c3O)[C@H]2C1 2117988674 QDMGWYGGFXDUMG-RTCCRHLQSA-N 346.246 1.535 10 10 EDCE Cc1cc(C)n(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(=O)n1 1556158114 RZKXTGJHJFOMDX-NSHDSACASA-N 331.372 1.019 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1485184521 ULXIAYUGIVSASL-VLGRORTASA-N 332.444 1.879 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)CCCS(N)(=O)=O 1626160636 ONPJTKOQOKUEKX-UHFFFAOYSA-N 328.434 1.590 10 10 EDCE C[C@@H](CC(=O)NCc1ccc(O)cc1O)NC(=O)c1ccccc1 1626837593 AAMSEQZELQYMIS-LBPRGKRZSA-N 328.368 1.923 10 10 EDCE CCc1cc(C(=O)NC[C@@H](O)CNCc2ccc(OC)c(C)c2)no1 1716107680 PNQGFRSYJOAIHA-AWEZNQCLSA-N 347.415 1.435 10 10 EDCE CC(C)(CNC(=O)c1cc2cc(O)c(O)cc2s1)S(C)(=O)=O 1620581089 QIHUPPUKEPTCTN-UHFFFAOYSA-N 343.426 1.866 10 10 EDCE CO[C@@H](C)C(=O)NC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1721805120 DAJGGPWZZPKAEW-QWRICNBMSA-N 347.375 1.286 10 10 EDCE COc1cnc(C(C)(C)NC(=O)c2ccc(C)c(O)c2O)nc1O 1635626109 CQHKEVKUMOZCRP-UHFFFAOYSA-N 333.344 1.576 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1CNCCO 1569855898 OXOKILDGFZXAHY-WCQYABFASA-N 333.392 1.139 10 10 EDCE NCc1cc(F)c(N2CCC[C@H]2[C@H](O)CO)cc1Br 2123239212 NQHYDZJVLXVDOU-WCQYABFASA-N 333.201 1.369 10 10 EDCE C[C@@H]1C[C@H]1CC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1742543520 KWGZSIIIMVLQQK-PWSUYJOCSA-N 331.376 1.741 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(F)ccc2O)[C@@H](O)C1 1966004413 TYNDOWSCRZCXBG-HIFRSBDPSA-N 340.395 1.991 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(Cc1ccc(O)c(O)c1O)C(=O)O 1951871251 YOLWDOWTIDLXMY-OAHLLOKOSA-N 327.333 1.714 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)NC(=O)c1cc(O)c(O)c(O)c1 2015126795 YRPKYQKYWLPIIE-RKDXNWHRSA-N 340.376 1.835 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NCc1cccc(O)c1O 382730238 AEJSHJLEPIIDTH-JSGCOSHPSA-N 338.404 1.822 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H](C)CN3CCC[C@H](C)C3)c2n1 2064763066 MDKPKLOIWZVONS-AAEUAGOBSA-N 331.420 1.594 10 10 EDCE C[C@H](NCc1cc(Br)ccc1O)[C@H]1CN(C)CCN1C 2065093764 UJFKPSOHSJSAJB-SMDDNHRTSA-N 342.281 1.879 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@H](C(=O)NCCCN=[N+]=[N-])[C@@H]2C1 1908253919 CLGMUJBGYLRVQX-SRVKXCTJSA-N 339.396 1.685 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCO[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1908252779 FWFFGNTWTSNREQ-TUAOUCFPSA-N 339.396 1.827 10 10 EDCE COCC(=O)N1CCN(c2ccc(CO)cc2Br)CC1 2182582090 RUSSCHWHNCMQOT-UHFFFAOYSA-N 343.221 1.236 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3COC[C@@]3(CO)C2)cc1Br 2234566785 MDNMCEHPEREWNM-PGUXBMHVSA-N 342.233 1.948 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2236634001 AOQWGOAINJUKTC-UTUOFQBUSA-N 344.249 1.930 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)CC[C@@H]1C(=O)NCc1ccc(N)cc1 2253581547 KPZXQDCMECHCPV-LSDHHAIUSA-N 349.431 1.645 10 10 EDCE NCc1cc(F)c(N2CCC[C@@H]3CNC(=O)[C@@H]32)cc1Br 2279274694 ILYGOOXBKCCPRZ-AMIZOPFISA-N 342.212 1.762 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@]4(O)C[C@H]4C3)c(Br)cc21 2280028205 OFESZZXLVSTCKU-ATMGAIRJSA-N 338.205 1.362 10 10 EDCE CN1CCN(C2=NC(=O)C(=Cc3cccc4c3OCO4)S2)CC1 2297328385 LOOJIFKBUPBHAB-UHFFFAOYSA-N 331.397 1.633 10 10 EDCE NC(=O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccsc2)SC1=S 2323800815 RYJVQEQNJDEDDN-ZETCQYMHSA-N 342.423 1.278 10 10 EDCE COC(=O)c1cc2ccccc2c(CN2CCn3cnnc3C2)c1O 111174712 TYFNEUAETDBZKP-UHFFFAOYSA-N 338.367 1.939 10 10 EDCE CC(=O)C(=O)COC(=O)c1oc2ccccc2c1CS(C)(=O)=O 808511907 DMCRPQHMEPAWLF-UHFFFAOYSA-N 338.337 1.292 10 10 EDCE CC[C@H](N[C@@H]1C[C@H](O)[C@H](O)[C@@H]1O)c1cc(Br)ccc1O 2165120647 HTTSBHFXIHWLLO-DKUYFVBVSA-N 346.221 1.050 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@H]3CCNC(=O)CC3)C2)cc1 819592012 ZOXXAFZPCQBSPL-LSDHHAIUSA-N 345.443 1.554 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H](C[C@@H]2CCCOC2)C(=O)O)cc1 908758383 JSIFLLCSTGLKPV-GOEBONIOSA-N 349.431 1.822 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC[C@H](C(=O)O)O2)cc1F 901943429 METVBJQPXZVHSK-LSDHHAIUSA-N 338.379 1.920 10 10 EDCE COC(=O)[C@@](C)(O)CNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 832202624 MHDFEBZAMDGPIZ-IBGZPJMESA-N 344.411 1.677 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCC[C@H](C(=O)NCCN)C2)cc1 843048088 MNFWZCQXBBWWSR-IVZVJUQRSA-N 330.476 1.553 10 10 EDCE COC[C@@](C)(CCO)NCc1ccc(N2CCOCC2)c(F)c1 749923679 XKCGVFMAPAOEFD-QGZVFWFLSA-N 326.412 1.539 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@H](C(N)=O)CC[C@@H]2C)c([N+](=O)[O-])c1 918733978 CLPNIFUBNFGDTK-UGCNIRMFSA-N 347.371 1.871 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CNCC[C@H]2C)cc1 842206432 GKKRTHPNXMRIHL-RHSMWYFYSA-N 346.475 1.263 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CCCCN3)C2)cc1 851660974 CBCDNFMNYYRWKV-GJZGRUSLSA-N 332.448 1.715 10 10 EDCE CC[C@@H]1NCC[C@H]1NC(=O)N(C)CCN(C)c1ccc(OC)cc1 861670422 FJDSAGAJTLXLEG-DLBZAZTESA-N 334.464 1.913 10 10 EDCE O=C(NCc1ccc(CN2CCOCC2)cc1)c1cccc(O)c1O 776319709 HJFZFOAXZOKMLZ-UHFFFAOYSA-N 342.395 1.860 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCO[C@@H](C2CC2)C1 776856256 LNMUXGDEGZPREY-GOSISDBHSA-N 345.443 1.844 10 10 EDCE COC(=O)c1ccn(CCCC(=O)N2Cc3cccc(O)c3C2)n1 881429214 UKBGJXWXYYELPF-UHFFFAOYSA-N 329.356 1.698 10 10 EDCE COc1nn(C)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 789590496 ZSXLDKKQQLTHQV-LLVKDONJSA-N 345.403 1.311 10 10 EDCE C[C@@H](CN1CCOCC1)NC(=O)c1cc2cc(O)c(O)cc2s1 895739618 DPCOKBRZURZBBL-JTQLQIEISA-N 336.413 1.763 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](C(=O)N2CC(N=[N+]=[N-])C2)O1 1895875882 OECKEGRDMPRZGE-WDEREUQCSA-N 325.369 1.580 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cc3c(=O)[nH]c(C)cn3n2)c1 1150543055 HVCUEVBFJOWGGB-JTQLQIEISA-N 342.355 1.536 10 10 EDCE CC1(c2ncc(C(=O)NCc3cc(O)ccc3O)s2)OCCO1 1153884684 FOTLZKPCSDTQBR-UHFFFAOYSA-N 336.369 1.704 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2CCCNC2=O)cc1C 1317400150 YNFPOJGPTUPORT-GDBMZVCRSA-N 347.459 1.514 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@H](C)C3CC3)C2)cc1 1327972653 BLZCCIZXBYZQHR-DZGCQCFKSA-N 345.443 1.552 10 10 EDCE C[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)CCN1S(C)(=O)=O 1327858452 DVAMFFVVCFYQII-OAHLLOKOSA-N 337.489 1.753 10 10 EDCE O=C1Nc2cc(N3CC4(CN(Cc5ccccc5)C4)C3)ccc2[C@H]1O 706203197 KYNZWNLOAIIYTP-GOSISDBHSA-N 335.407 1.994 10 10 EDCE CN1CCc2cc(CNC3(CO)CN(C(=O)OC(C)(C)C)C3)ccc21 1918554018 YXYSVRAZSDSRAM-UHFFFAOYSA-N 347.459 1.750 10 10 EDCE CC[C@@]1(CO)CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1261865327 AESLEIDTMXPTEM-GOSISDBHSA-N 332.400 1.246 10 10 EDCE CCCCC(=O)N1CC[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1353358176 NDKBWVNNHCLUIB-ZDUSSCGKSA-N 335.404 1.620 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)Cn2cncn2)cc1C 1275564317 YRTZYMPNQHUKOA-UONOGXRCSA-N 331.420 1.278 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 1442291901 LMOQWOYAOCSDPI-AWEZNQCLSA-N 339.355 1.675 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)Cc3ncc[nH]3)C2)cc1C 1479329759 KLFWPUJNBXMYDS-IYBDPMFKSA-N 342.443 1.954 10 10 EDCE COC(=O)[C@H](COC1CCC1)N(C)C(=O)/C=C\c1ccc(O)c(O)c1 1622942091 PFOLTARQBANQPC-LEJCZOIISA-N 349.383 1.680 10 10 EDCE NC(=O)c1cc(N(Cc2ccccc2O)C[C@H]2CCCO2)ncn1 1639661988 ZAGBDAKOFIEETQ-CYBMUJFWSA-N 328.372 1.467 10 10 EDCE COc1cc(C(=O)N[C@@H](C)C[C@@H](C)NC(=O)C(C)C)cc(OC)n1 1735553869 CEXJDBKLHHULGT-NEPJUHHUSA-N 337.420 1.768 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)N3CC(CO)(CO)C3)c2C)cc1 1645107262 GZTCJTNRZPVTHI-UHFFFAOYSA-N 344.411 1.530 10 10 EDCE CC[C@@H](CNC(=O)[C@H](C)CC)NC(=O)c1cc(OC)nc(OC)c1 1746113434 JQHTVBIPBGJABV-YPMHNXCESA-N 337.420 1.770 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cnn(C)c2C)cc1C 1662161121 GIPKXKIWMXFPHB-ZDUSSCGKSA-N 330.432 1.954 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H]2CCC(=O)N2C)cc1C 1669645138 PAVKDLJAZWBQOU-DZGCQCFKSA-N 333.432 1.219 10 10 EDCE COc1cc(CN(C)CC(=O)NCc2ccc(N(C)C)cc2)sn1 1660333306 SWXDFZFKRSPEFM-UHFFFAOYSA-N 348.472 1.966 10 10 EDCE O=C1CN(S(=O)(=O)c2cccc3nsnc23)c2ccccc2N1 19109721 XYQAPBMVSFDCGV-UHFFFAOYSA-N 346.393 1.839 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)Cc1ccc(Br)cn1 167084468 UICJKPVZVANXBL-UHFFFAOYSA-N 349.232 1.914 10 10 EDCE COCCN(C)CCN[C@H](C)c1ccc(N2CCC(O)CC2)cc1 159310182 BJCGWPWKTXXJFE-MRXNPFEDSA-N 335.492 1.877 10 10 EDCE CN(Cc1ccccc1)C1CN(C(=O)COc2ccc(N)cc2)C1 1914186495 CSFAAGNRXYESJG-UHFFFAOYSA-N 325.412 1.990 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C[C@@H](O)CN 1952314899 JSRVMEFIDZDIET-NWDGAFQWSA-N 326.393 1.243 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)NCCCCN=[N+]=[N-] 1985101967 ZXUSEZPKXYQUFS-NSHDSACASA-N 329.401 1.859 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010392662 IDGYWYZDTWLQLK-UTUOFQBUSA-N 339.396 1.658 10 10 EDCE O=C1Nc2cc(N3Cc4conc4C3)c(Br)cc2[C@H]1O 2160447705 UKOOUQWWAMNGMB-GFCCVEGCSA-N 336.145 1.943 10 10 EDCE CCCN(c1ccc(CO)cc1Br)[C@H]1CC(=O)NC1=O 2171202684 JTAIPIBXEHKXRH-LBPRGKRZSA-N 341.205 1.573 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C[C@@H]1CO 708575216 BMPFGMYPAIFJBX-OTPXZMOZSA-N 341.205 1.499 10 10 EDCE C[C@@H](N)c1ccc(N(C)C[C@H](O)CN(C)C)c(Br)c1 690171673 MYVRGSZWCPCGDD-ZYHUDNBSSA-N 330.270 1.828 10 10 EDCE C[C@]1(C(=O)O)CN(Cc2cc(Br)ccc2O)CCO1 711529012 WIMNODYTFOUPEL-CYBMUJFWSA-N 330.178 1.830 10 10 EDCE CCCNCc1ccc(N2CC[C@@H](O)[C@@H](O)C2)cc1Br 2188625797 AORBTHZEZLSANL-CABCVRRESA-N 343.265 1.881 10 10 EDCE CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1906906709 WWDBQKLJJJVYNL-DCAQKATOSA-N 346.374 1.897 10 10 EDCE Cc1cc(NS(=O)(=O)c2cc(Br)nn2C)ccc1O 2089753005 ODOKBNNCPICSJF-UHFFFAOYSA-N 346.206 1.997 10 10 EDCE CC1(C)CO[C@@H](CO)CN1c1ccc(CO)cc1Br 2111218831 MYEJYRSODVDZBI-LLVKDONJSA-N 330.222 1.918 10 10 EDCE NCCc1n[nH]cc1C(=O)N1CCc2c(Br)cccc21 2235313693 MPMSRKXPHHIQKM-UHFFFAOYSA-N 335.205 1.876 10 10 EDCE O=C(O)[C@@H]1CC[C@H](O)CN1Cc1cc(Br)ccc1O 2264533752 QPPUZNAOANZJPO-QWRGUYRKSA-N 330.178 1.565 10 10 EDCE O=C1NN(c2ccc(F)cc2)C(=O)C1=Cc1ccc(O)c([N+](=O)[O-])c1 2297302822 RACSTANOGTYUIR-UHFFFAOYSA-N 343.270 1.901 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2330369476 IXPJZKOPCGBOAU-XAGKMFGPSA-N 327.222 1.228 10 10 EDCE Cc1ccc(CN2CC(CS(C)(=O)=O)C2)c(O)c1Br 2352947194 HCPBTKZSWXHKOG-UHFFFAOYSA-N 348.262 1.940 10 10 EDCE CC(=O)N1CSC[C@H]1C(=O)NCc1ccc2c(c1)CCCN2C 132920735 YCMSVIIQLGIPCW-INIZCTEOSA-N 333.457 1.607 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)NCC(F)(F)F)c1 195285656 OADQMBBSEKJGCH-ZETCQYMHSA-N 328.312 1.448 10 10 EDCE Cc1cc(C)n(C[C@@H]2CN(C(=O)c3cccc(O)c3O)CCO2)n1 193062328 VGIOVTPWJBTPHY-ZDUSSCGKSA-N 331.372 1.452 10 10 EDCE O=C1CO[C@H]2CCN(Cc3cc(Cl)cc(Cl)c3O)C[C@@H]2N1 370706206 AZIFFARTPJRUNY-RYUDHWBXSA-N 331.199 1.788 10 10 EDCE Cc1ccc(CN2CCOC[C@H]2C(=N)NO)c(O)c1Br 2380680782 SCSBTHKQPUUMEL-JTQLQIEISA-N 344.209 1.620 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)c1nc(C(N)=O)cs1 292425686 GADLJPQBKFIYBM-UHFFFAOYSA-N 332.429 1.715 10 10 EDCE COc1cc2cc(C(=O)OCC(=O)C(C)=O)[nH]c2c(OC)c1OC 808502222 BADFJWUMXQXMCJ-UHFFFAOYSA-N 335.312 1.509 10 10 EDCE CCO[C@@H]1C[C@@H](NC(=O)c2ccc(C)c(O)c2O)[C@H]1n1cccn1 819405108 JGLOATBZABPSPI-MGPQQGTHSA-N 331.372 1.751 10 10 EDCE CN1CCN(C)CC(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 905954722 DUVNKKPTVOQZAM-UHFFFAOYSA-N 344.503 1.737 10 10 EDCE Cc1cc(C(=O)N2CCN(C(=O)c3cc(O)cs3)[C@H](C)C2)n[nH]1 839790353 ALCUWKAMURGXBV-SNVBAGLBSA-N 334.401 1.472 10 10 EDCE C[C@H](NC(=O)N[C@@H]1CCN(C)[C@H]1C)c1ccc(N2CCOCC2)cc1 914400717 RWLCZMHGQKZSLK-RLFYNMQTSA-N 346.475 1.976 10 10 EDCE CCOCCOCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 919926185 JAYQZPNXCWKCLQ-UHFFFAOYSA-N 336.432 1.535 10 10 EDCE NC[C@@H](NC(=O)c1csc(Cc2ccc(N)cc2)n1)C(F)(F)F 848437503 KMGCHCZTKUJHRA-LLVKDONJSA-N 344.362 1.936 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1cc(Cl)ccc1O)[C@H]1CCOC1 849401455 YCBJVBGGXKYLAK-IINYFYTJSA-N 349.836 1.517 10 10 EDCE CC[C@H]1CN(C(=O)NCCc2ccc(N)cc2)C[C@]2(CCOC2)O1 841959700 OXUFCFAMNLJNPX-WMZOPIPTSA-N 333.432 1.791 10 10 EDCE CCc1cccc(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1O 848920210 ZFIVKTROENQDCC-INIZCTEOSA-N 325.430 1.344 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)[C@H]4CSCN4C3=O)C2)cc1 924976528 BZBDSYYMLJODNB-GXTWGEPZSA-N 333.413 1.611 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC[C@H]2C(=O)N(C)C)c([N+](=O)[O-])c1 858738831 QWWOTGMQWGARAK-LEJCZOIISA-N 347.371 1.838 10 10 EDCE C[C@@H](NCC[C@H]1CNCCS1(=O)=O)c1cc(Cl)ccc1O 925795695 NUHPJVUSIHIELY-PWSUYJOCSA-N 332.853 1.473 10 10 EDCE CCCOC(=O)CCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852456582 ZBXDMFQBGUHBKC-CQSZACIVSA-N 349.431 1.916 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CN(C)[C@@H]3CCSC3)C2)cc1 855233693 KQWNXIXGLWHQBM-GOEBONIOSA-N 349.500 1.827 10 10 EDCE Cc1cc(CC(=O)N2CCC(O)(CO)CC2)c(C)n1-c1ccccc1 855683600 HVNSTZHVFXZRKY-UHFFFAOYSA-N 342.439 1.982 10 10 EDCE COc1cncc(CN(C)Cc2ccc(N3CCOCC3)cc2)n1 859060393 QWZRAZPCNAALAD-UHFFFAOYSA-N 328.416 1.954 10 10 EDCE CNCCOCCNC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 861676827 LIHNKNJVLNXZNZ-UHFFFAOYSA-N 334.464 1.663 10 10 EDCE CO[C@@H]1CCn2cc(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)nc2C1 867302550 RHGAGQHLJOWDGW-WCQYABFASA-N 345.399 1.617 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CC1CS(=O)(=O)C1 864950681 YXHBIZFGQRXKLH-UHFFFAOYSA-N 338.473 1.924 10 10 EDCE CN1CCN(c2ccc(CN3CCN(C4CC4)C(=O)C3)cc2)CC1 775698265 NMWWWQGHTMHSCG-UHFFFAOYSA-N 328.460 1.245 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(OC)n(C)n1 784025365 ARCQXGCSJKBHAU-UHFFFAOYSA-N 346.387 1.512 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCN2C[C@H](O)C[C@H]2C1 895187849 OAVSENUPILKTEU-NWDGAFQWSA-N 345.212 1.545 10 10 EDCE CCOC1CC(O)(CNC(=O)c2cc3cc(O)c(O)cc3s2)C1 897582789 CFCFNNBAKPNJRC-UHFFFAOYSA-N 337.397 1.972 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@@H](O)CC(F)(F)C3)ccc21 786731879 GTWUBLCJNIZIRU-AWEZNQCLSA-N 339.386 1.981 10 10 EDCE CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCCOC1 1328908957 TZQPEPNFTIWGDY-INIZCTEOSA-N 333.432 1.396 10 10 EDCE CO[C@@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 1335761098 WQLYQNWCASHEHT-HZPDHXFCSA-N 333.432 1.313 10 10 EDCE CCC(=O)NCCN(CC)Cc1nnnn1-c1ccc(OC)cc1 1267233995 AFPHCETXTKLCHY-UHFFFAOYSA-N 332.408 1.019 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)Nc3ccc[n+]([O-])c3)C2)cc1 1346593099 CZDPIJKJSKMSBX-CQSZACIVSA-N 342.399 1.977 10 10 EDCE COC(C)(C)[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1354413139 DFOSNLMRKPTQJR-AWEZNQCLSA-N 347.459 1.833 10 10 EDCE Cc1[nH]nc(C(=O)NCc2c(O)cccc2O)c1Br 1456238256 YNVBLGRJIWYFAD-UHFFFAOYSA-N 326.150 1.822 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1290375124 SCFGLRWREDYMOI-MRXNPFEDSA-N 334.416 1.559 10 10 EDCE CC(C)CNC(=O)N1CCC[C@H](C(=O)NCc2c(O)cccc2O)C1 1472063375 JCWONNFCWXRDAR-ZDUSSCGKSA-N 349.431 1.792 10 10 EDCE Cc1cc(NCCNC(=O)c2ccc(N=NC(N)=O)cc2)n(C)n1 1617753993 VTHOFIWKSXKJHL-UHFFFAOYSA-N 329.364 1.733 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)Cn2cncn2)cc1C 1496227600 SSBDHRWRRQYXTD-AWEZNQCLSA-N 331.420 1.232 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1ccn(CCn2cccn2)n1 1566358882 OYRQABAGXDLYGP-UHFFFAOYSA-N 327.344 1.121 10 10 EDCE COCC1(O)CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 1639728856 NQIWXGRAHRAWAA-UHFFFAOYSA-N 326.349 1.590 10 10 EDCE COc1ccc(CN[C@]2(CO)CCCN(C(=O)C(F)F)C2)cc1C 1570276811 OGQJSIICYJFCJT-QGZVFWFLSA-N 342.386 1.712 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CCN(Cc2ccccc2)C1=O 1644757133 VIFZNAGUVUPOGR-MRXNPFEDSA-N 340.379 1.763 10 10 EDCE CNC(=O)c1ccccc1N(C)C(=O)/C=C/c1cnc(OC)nc1 1584257699 WFRSPDMZTDOGME-CMDGGOBGSA-N 326.356 1.521 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1CC(=O)N(C)C1 1668445119 BSAHOBFHWTUIEK-MRXNPFEDSA-N 347.459 1.420 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985102528 IEHNHYAWPMRTHO-DCAQKATOSA-N 327.385 1.562 10 10 EDCE CN(C)c1ccc([C@@H](O)[C@H](N)c2c(Br)nnn2C)cc1 2148220373 QGOLXDYXXRUNRF-ZYHUDNBSSA-N 340.225 1.377 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C[C@@H]1CCCO1)C(=O)N1CC(N=[N+]=[N-])C1 2010406767 YTGQUBZWNMHJTR-NWDGAFQWSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)N2CC(N=[N+]=[N-])C2)C1 2010403642 HKDZGVWVWHWHSA-GFCCVEGCSA-N 339.396 1.924 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C2(CC2)CO1 2012211194 IGSQZEHZMORBDJ-LLVKDONJSA-N 339.396 1.924 10 10 EDCE CNC(=O)NCCNCc1cc(Cl)cc(Br)c1O 708101059 YNXMIAMWEUUQNV-UHFFFAOYSA-N 336.617 1.827 10 10 EDCE CN(C)C[C@H]1C[C@@H](O)CN1c1cc(Br)c(CN)cc1F 380293326 DVNIODDBYBPCKB-GHMZBOCLSA-N 346.244 1.548 10 10 EDCE C[C@@H](NCc1ccc(Br)cc1O)[C@H]1CN(C)CCN1C 1183919436 KFZRDDCVNQQFAG-BXUZGUMPSA-N 342.281 1.879 10 10 EDCE C[C@@H]1CCN(C(=O)c2ccc(O)c(O)c2)C[C@@H]1NC(=O)C(F)(F)F 2054398370 XGBBAKZJZAQRBD-SCZZXKLOSA-N 346.305 1.627 10 10 EDCE Cc1cccc(O)c1CN=c1nc(CCNC(=O)OC(C)(C)C)[nH][nH]1 2063193440 YCROKSZAWSFUEY-UHFFFAOYSA-N 347.419 1.920 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)C[C@@H]2CO)cc1Br 2089863703 MKNWCVXJVTXWFA-JFGNBEQYSA-N 329.238 1.648 10 10 EDCE C[C@H]1CCN(c2ccc(CN)c(Br)c2F)[C@@H]1C(N)=O 2090256051 LKCRLEPRYZOFBT-MADCSZMMSA-N 330.201 1.747 10 10 EDCE CNCc1ccc(N2CCOC[C@H](CO)C2)cc1Br 2098216480 XCLVXDDBLPJJLR-NSHDSACASA-N 329.238 1.614 10 10 EDCE CC[C@H](C)NCc1ccc(N2CC(O)(CO)C2)c(Br)c1 2240000872 VLBKBTPZSDJTHB-NSHDSACASA-N 343.265 1.881 10 10 EDCE OCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2332589689 ATUZWXHLQBEMMT-GJQVQUKXSA-N 328.206 1.262 10 10 EDCE COC[C@](C)(N)C(=O)NCc1ccc(C)c(Br)c1O 2352620086 MOMMVWKTYVJMSQ-ZDUSSCGKSA-N 331.210 1.443 10 10 EDCE Cc1ccc(CN2CC[C@H](O)[C@@H](CO)C2)c(O)c1Br 2352687728 QRIPLYABMXQMOE-NEPJUHHUSA-N 330.222 1.638 10 10 EDCE Cc1ccc(CN(C)Cc2nnn(C)n2)c(O)c1Br 2352943111 ONGRVRLETYJNFE-UHFFFAOYSA-N 326.198 1.619 10 10 EDCE CCN1CCO[C@H](C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 72796200 FNKXVWHJXVHQJX-KRWDZBQOSA-N 333.432 1.065 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CCc3nnc(C(C)C)n3C2)c(O)c1O 182279251 LWGPWQSJGQMNEV-LLVKDONJSA-N 330.388 1.866 10 10 EDCE C[C@@H]1CS(=O)(=O)CCN1c1ccc(CN)cc1Br 228724633 RMHJNYRFHAIBIP-SECBINFHSA-N 333.251 1.531 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCOC4(CCOCC4)C3)cc2N1 372022084 PVCKXVNPSPOOSF-UHFFFAOYSA-N 349.343 1.312 10 10 EDCE C[C@H]1CN(Cc2cc(Cl)c(F)cc2O)CCN1S(C)(=O)=O 293579371 JPZMCUAEZBZMHA-VIFPVBQESA-N 336.816 1.650 10 10 EDCE CC(=O)NC(C)(C)C(=O)NCc1cc(Br)ccc1O 804736323 QEPWCXZEOLSATB-UHFFFAOYSA-N 329.194 1.686 10 10 EDCE CN(C)c1ccc(CN[C@H]2CCC[C@@H]2CNS(C)(=O)=O)cc1 800309212 JKXONBSXVUVNGV-ZBFHGGJFSA-N 325.478 1.560 10 10 EDCE Cc1nocc1CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 815126086 GINVLBORICRBCE-UHFFFAOYSA-N 335.429 1.508 10 10 EDCE CCNC(=O)N1CCN(c2ccc(CN)c(Br)c2)CC1 721807880 QEXYMKBGJAFGBD-UHFFFAOYSA-N 341.253 1.759 10 10 EDCE COc1ccc(O)c(CNC(=O)Nc2ccc3c(n2)OCCO3)c1 825026817 NNVJCJFADPEMJD-UHFFFAOYSA-N 331.328 1.889 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)[C@@H]3[C@H]4COC[C@H]43)cc2F)CC1 826719154 GVMDZWBTLMKZGG-HWWDLCQESA-N 347.434 1.476 10 10 EDCE COc1ccc(N2CCN(Cn3cc(OC)c(=O)cc3C)CC2)cc1 902024971 BMVCGWAKKMUAML-UHFFFAOYSA-N 343.427 1.954 10 10 EDCE COC[C@@H]1CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823523778 JMMLJUNZGXOJBC-INIZCTEOSA-N 333.432 1.578 10 10 EDCE C[C@@H](NCCS(=O)(=O)N=S(C)(C)=O)c1cc(F)ccc1O 903225021 DGNMAUQSLQRAHQ-SECBINFHSA-N 338.426 1.239 10 10 EDCE C[C@H]1[C@H](C)CN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 837769913 RZVJOEOKRCUAEI-IJEWVQPXSA-N 344.459 1.938 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)/C=C/Cn3cncn3)C2)cc1 912291865 FFBTZHXNUGXHFF-BAABZTOOSA-N 327.388 1.238 10 10 EDCE O=C(NCc1ccccc1O)[C@@H](C[C@@H]1COCCO1)C(F)(F)F 830527356 ZMGVVRQCSQDIIR-VXGBXAGGSA-N 333.306 1.992 10 10 EDCE C[C@H]1CN(Cc2ccc(N3CCOCC3)cc2)[C@H](C)CN1CCO 841892262 WAFZTDDVVJJSLS-DLBZAZTESA-N 333.476 1.410 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)c3c[nH]nc3C)C2)cc1 849415464 ADTXYXNPCSIHSU-LBPRGKRZSA-N 336.417 1.284 10 10 EDCE COc1cc(N2CCN([C@H]3CCCNC3=O)CC2)cc(OC)c1OC 759884038 AAORJGJJJVRCEX-AWEZNQCLSA-N 349.431 1.113 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCc3ccnn3C)C2)cc1 852255939 LXXVJCACGDKGRN-CQSZACIVSA-N 343.431 1.549 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1C[C@@H]1C=C[C@H]2C[C@@H]1CO2 925233187 RGVLHNPLWFRNML-CFVMTHIKSA-N 328.368 1.748 10 10 EDCE COc1ccc(N2CCCN(C[C@@H]3CCC4(CNC4)O3)CC2)cc1 852747149 YCEGIDFAXRIAQA-SFHVURJKSA-N 331.460 1.728 10 10 EDCE COC[C@@]1(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCOC1 856209558 SIZPRXJRCMKTMN-IBGZPJMESA-N 348.443 1.317 10 10 EDCE CCCN1C[C@@H](C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 855222942 DLQIPCACWAVGEV-LSDHHAIUSA-N 345.443 1.649 10 10 EDCE OCCO[C@]1(CNCc2cccc(Br)c2O)CCOC1 850358216 KSAWITBWIIRZBS-AWEZNQCLSA-N 346.221 1.412 10 10 EDCE CN1CC(=O)N(CCN(Cc2ccc(N(C)C)cc2)C2CC2)C1=O 851732868 ZFQANDNRBMSZRG-UHFFFAOYSA-N 330.432 1.611 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)CNC(=O)c2cccnc2)c1 767957394 GOJJPXVYRNLYAU-NSHDSACASA-N 329.356 1.403 10 10 EDCE O=C([C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1)N1CCCC1 768447377 OQUFLGWLKKJRHV-DYVFJYSZSA-N 346.427 1.652 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C3CN([C@H]4CCOC4)C3)C2)cc1 898580111 BSRCJFNLSJUZQB-WBVHZDCISA-N 345.443 1.111 10 10 EDCE COc1cccc(CNC(=O)C[C@H]2NC(=O)c3ccccc32)c1O 1137473457 KAOGSPRHQNRNKR-CQSZACIVSA-N 326.352 1.892 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 1150771310 SKRJBIRBUTVYFR-HOTGVXAUSA-N 348.443 1.524 10 10 EDCE Cc1ccc(O)c(CNC(=O)N[C@H]2CCN(c3cc(O)ncn3)C2)c1 1313387204 BVSXEEAQCRQSMR-ZDUSSCGKSA-N 343.387 1.274 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CC(=O)N(C)C2)c1O 1964032862 NWBHJLQDQOEGSY-MRVPVSSYSA-N 329.194 1.484 10 10 EDCE CNCc1ccccc1CNC(=O)C(=O)N(C)Cc1ccccc1O 1261524766 JEYWFDFFYIPOFF-UHFFFAOYSA-N 341.411 1.386 10 10 EDCE CCCNC(=O)[C@H](C)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1346292113 YGMRMKLVLCVWHR-UONOGXRCSA-N 348.447 1.488 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H]2CC(=O)N(C)C2)cc1C 1268372114 VNGZNTCSKPFFHK-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C[C@@H]2CCCO2)cc1C 1283733695 JJLJGAOMWBYSRV-HOTGVXAUSA-N 336.432 1.139 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccc(O[C@H]2CC(=O)N2)cc1 1449473439 VEXOGXVVJCYHEE-KRWDZBQOSA-N 328.324 1.504 10 10 EDCE COC(=O)C1(O)CN(C(=O)c2cc(C)n(-c3cccc(C)c3)c2C)C1 1455082688 DLGUTYLIXNJOJM-UHFFFAOYSA-N 342.395 1.762 10 10 EDCE CCC[C@@H](C)C(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1525376599 VNDMXKNDWLCJLV-BNOWGMLFSA-N 349.431 1.912 10 10 EDCE CC[C@H](C)OCC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1522589283 JLRACHIEPIIPHX-NSHDSACASA-N 349.391 1.510 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)Cn2cncn2)C2CC2)cc1C 1480064012 FUFMLTGMNSCGHB-MRXNPFEDSA-N 343.431 1.280 10 10 EDCE Cn1nnc(Br)c1C(=O)NCc1c(O)cccc1F 1558454677 JDDRUHDFAPDGOC-UHFFFAOYSA-N 329.129 1.352 10 10 EDCE NC(=O)CCCC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1626055904 LSEWVIQKQBRRTE-UHFFFAOYSA-N 341.358 1.073 10 10 EDCE O=C(NCCC1CS(=O)(=O)C1)c1cc2cc(O)c(O)cc2s1 1556217402 ZPOGSEFNGCGRNS-UHFFFAOYSA-N 341.410 1.477 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1COC(=O)N1 1568738125 AWTVAFBBHCAXEC-CQSZACIVSA-N 335.404 1.050 10 10 EDCE CCC[C@H](CCCS(C)(=O)=O)C(=O)NCc1ccc(O)cc1O 1570462224 KAYJPBSZXNSQAP-GFCCVEGCSA-N 343.445 1.955 10 10 EDCE C[C@@H](NC(=O)Cn1nnnc1-c1ccsc1)c1ccccc1O 1587447488 SQWYYZVQIUGCSE-SNVBAGLBSA-N 329.385 1.985 10 10 EDCE Cc1nnc(N2CCOCC2)n1Cc1ccc2c(c1)CCCN2C 1751940997 QPEWNOZCAJHUSX-UHFFFAOYSA-N 327.432 1.854 10 10 EDCE COc1ccc(CNC2(CNC(=O)CO[C@@H]3CCOC3)CC2)cc1C 1670781997 SBRPYXKLOIRPTN-MRXNPFEDSA-N 348.443 1.548 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@@]3(CNC(=O)C3)C2)c([N+](=O)[O-])c1 1772974719 ZPXKRRDNBCWCGX-MAVJXHJTSA-N 345.355 1.497 10 10 EDCE CNCc1ccc(N2CC(OCCCO)C2)cc1Br 2141975550 FDTLKWYIUKJHAO-UHFFFAOYSA-N 329.238 1.756 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](O)C[C@@H]2CO)c(Br)c1 2136084257 ZVGPQEIQFOHTKU-JLLWLGSASA-N 330.222 1.824 10 10 EDCE CO[C@H]1CN(Cc2cc(N)ccc2O)C[C@H]1NC(=O)OC(C)(C)C 2009273805 UCKYDQWGUYWETR-HIFRSBDPSA-N 337.420 1.698 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2010405842 MOPYNHVEXRZJLY-NEPJUHHUSA-N 339.396 1.781 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010401381 DRQLZDSMNHOQPW-VXGBXAGGSA-N 339.396 1.780 10 10 EDCE CC(C)CN(CCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2154258178 DNTCOEVXJRPXAL-CYBMUJFWSA-N 342.237 1.856 10 10 EDCE CN(CC(C)(CO)CO)c1ccc(CN)c(Br)c1F 689846947 NYLARODEIVQUTF-UHFFFAOYSA-N 335.217 1.474 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H](C)C(=O)N3CCCC[C@@H]3C)c2n1 2063448483 PGONSOIEHVYRSZ-NWDGAFQWSA-N 345.403 1.263 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2C[C@@]21C(=O)C(=O)C[C@H]1C[C@H](N)C1 1907807853 QUUIVHOKQNUSQU-BDIZYMIYSA-N 336.432 1.945 10 10 EDCE NCc1ccc(N2CC[C@]3(O)CCOC[C@@H]3C2)c(Br)c1 2194550430 FQVNPOHXYRSNIQ-WFASDCNBSA-N 341.249 1.886 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1CO[C@H]2COC[C@H]12 2101884577 GJWNYXPYVOOIDW-JLLWLGSASA-N 332.169 1.797 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@H]2[C@@H](O)CO)c(Br)c1 2123209242 HCKUAYORHSPPIJ-HERUPUMHSA-N 329.238 1.791 10 10 EDCE COc1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(OC)c1Br 2234897921 SGSHODTWALLFBL-SEBFSPHVSA-N 344.205 1.397 10 10 EDCE NCc1cc(F)c(N2CC[C@H](O)[C@@H](O)CC2)cc1Br 2269146943 BPZFETSEUJONKQ-STQMWFEESA-N 333.201 1.369 10 10 EDCE O=C(O)COc1ccc(C=C2C(=O)NN(c3ccccc3)C2=O)cc1 2293677379 MTJRISQATSQCDJ-UHFFFAOYSA-N 338.319 1.611 10 10 EDCE O=C(O)[C@@]12CO[C@@H](C1)[C@@H](NCc1ccc(Br)cc1O)C2 2280795604 HKFZQDOGRWEDAQ-VHRBIJSZSA-N 342.189 1.877 10 10 EDCE Cc1cc(C)cc(N(C)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c1 491213661 ZKYZIOUFBKQXAP-SREVYHEPSA-N 327.384 1.377 10 10 EDCE Cc1ccc(CN(C)[C@@H]2CN(C)C[C@@H]2O)c(O)c1Br 2352942574 HDRIZIMUKYFRHK-NEPJUHHUSA-N 329.238 1.570 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@H]3CNC[C@@H]32)c(O)c1Br 2380758771 XTWLXWXQRYKPED-TUAOUCFPSA-N 339.233 1.935 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)CCOCC2CCC2)cc1 826922910 IXKQWHIIGQTLBG-UHFFFAOYSA-N 326.462 1.989 10 10 EDCE C[C@H](NC(=O)C1(n2cnnn2)CCOCC1)c1ccc(N(C)C)cc1 832436165 HQRYNPAFGMQUPY-ZDUSSCGKSA-N 344.419 1.122 10 10 EDCE CN(C)C(=O)CCN1CCC(N[C@H]2CCc3cccc(O)c32)CC1 834578244 HRYKRQJTEGGSKP-INIZCTEOSA-N 331.460 1.912 10 10 EDCE COC(=O)[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@H](C)O1 846060143 WZGQOGWVVPDNBA-YOEHRIQHSA-N 334.416 1.286 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)Cc3ccon3)C2)cc1 849416862 YDNVVYULDLOCJW-LBPRGKRZSA-N 337.401 1.382 10 10 EDCE C[C@H]1CCCN(S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)C1 842783914 FJXYQZQWSHPHMK-XJKSGUPXSA-N 340.493 1.319 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1C(=O)NCc1ccc(N2CC=CC2)cc1 845003895 VNJXFDMFMGWDQH-DLBZAZTESA-N 331.416 1.354 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc(=O)c(OC)co3)C2)cc1 855223006 ARXCZBLCOZXDKA-LBPRGKRZSA-N 344.367 1.666 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3C[C@@H](O)C3(C)C)C2)cc1 854298642 HOALFBZGUSHQFS-APHBMKBZSA-N 333.432 1.733 10 10 EDCE CCSCCNCc1ccc(N2CCS(=O)(=O)CC2)cc1 783625714 COJXFQUXRGECTI-UHFFFAOYSA-N 328.503 1.764 10 10 EDCE CC(C)[C@@H](C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788312537 IMPHKNREIAQERX-HNNXBMFYSA-N 347.459 1.548 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC[C@H]1CCCO1 786598729 OGVUOLBVEKPCNI-MRXNPFEDSA-N 333.432 1.363 10 10 EDCE C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(F)cc1O 797117649 MQVUGNDPHPFZHT-YPMHNXCESA-N 330.425 1.996 10 10 EDCE COC(=O)C(C)(C)n1cc(NC(=O)/C=C/c2ccc(O)c(O)c2)cn1 1301510917 ZGMXUXZAVMESNU-FNORWQNLSA-N 345.355 1.854 10 10 EDCE O=C(NCCn1cc(Br)cn1)c1c(F)ccc(O)c1O 1306838724 JZPAURBNWIBZJD-UHFFFAOYSA-N 344.140 1.626 10 10 EDCE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N[C@H](C)c1ccccc1O 1302532601 KVEYQWKBEOJWBE-LLVKDONJSA-N 349.431 1.379 10 10 EDCE Cn1cc(-n2cc(C(=O)N3Cc4cccc(O)c4C3)ccc2=O)cn1 1175037959 MYQAYJQRCCPVCA-UHFFFAOYSA-N 336.351 1.433 10 10 EDCE Cc1noc(C)c1CCCNC(=O)C(=O)N(C)Cc1ccccc1O 1328916653 KCKGKHKFMBBWAJ-UHFFFAOYSA-N 345.399 1.704 10 10 EDCE COc1cc(N(C)CCN2CCOCC2)c([N+](=O)[O-])cc1OC 1185230493 FNMMPLDHRXFNTB-UHFFFAOYSA-N 325.365 1.380 10 10 EDCE C[C@@H](O)c1ccc(N2CCC(CO)(CO)C2)cc1Br 694630753 VKROONONNORUDK-SNVBAGLBSA-N 330.222 1.684 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cncnc2O)cc1C 1267388035 DNCPCCJRMKACOT-UHFFFAOYSA-N 330.388 1.361 10 10 EDCE Cc1coc(C(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)c1 1292895153 WTNUSKLFODNYIK-UHFFFAOYSA-N 343.343 1.910 10 10 EDCE CC(=O)c1cn(CC(=O)NCc2cc(Cl)cc(Cl)c2O)nn1 1468666766 ABBGFFZVXYKNLY-UHFFFAOYSA-N 343.170 1.810 10 10 EDCE Cc1cc(C)n(CC(=O)NCc2c(O)ccc3c2CCCC3)c(=O)n1 1465954972 UKAZEPNICSNLIF-UHFFFAOYSA-N 341.411 1.761 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CCCn2ncnc21 1618593933 SFDHCZKPHFRYKF-CYBMUJFWSA-N 327.388 1.647 10 10 EDCE C[C@@H]1CC[C@H](C(N)=O)CN1c1ccc(CN)cc1Br 212867971 BBLRJEAJCLZCCY-KOLCDFICSA-N 326.238 1.998 10 10 EDCE CN1C(=O)O[C@H]2CN(Cc3c(O)cccc3Br)C[C@@H]21 2120402667 OTZFPERTAVHVFD-JQWIXIFHSA-N 327.178 1.790 10 10 EDCE COc1ccc(CNC2(CNC(=O)CCNC(N)=O)CCC2)cc1C 1484661153 FKKZCMCMWNQIKS-UHFFFAOYSA-N 348.447 1.191 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2c(C)ncn2C)cc1C 1483137440 AEWORCDKPYFHMW-CYBMUJFWSA-N 330.432 1.954 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H](C)C(C)(F)F)cc1C 1717777895 OVVXEWSDJJUZBY-TZMCWYRMSA-N 344.402 1.862 10 10 EDCE COC(=O)[C@H](C[C@@H]1CCCO1)NC(=O)c1ccc(N=NC(N)=O)cc1 1637825825 UHLWZGGDKAOIMP-STQMWFEESA-N 348.359 1.690 10 10 EDCE CCOC(=O)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1cccc(O)c1 1566358539 GKCHTCLNUKKWSI-KRWDZBQOSA-N 345.351 1.767 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CO[C@H]2CCOC2)cc1C 1669288901 MVLNRVKJWFZUHR-ZBFHGGJFSA-N 336.432 1.403 10 10 EDCE CCCCC(=O)NC1CN(Cc2nnnn2-c2ccc(OC)cc2)C1 1665094981 HUOHJDUMUVGWTB-UHFFFAOYSA-N 344.419 1.162 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCCN(C)C2=O)c1O 1964078792 YSAYNVQFFDVZIF-LLVKDONJSA-N 343.221 1.874 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@H](C)SC)cc1C 1676504754 CJSTULLVMGLIRM-JSGCOSHPSA-N 326.462 1.322 10 10 EDCE CCC(=O)N[C@H](C)CN(C)Cc1nnnn1-c1ccc(OC)cc1 1699435027 DBWUJIQLGODLMO-GFCCVEGCSA-N 332.408 1.017 10 10 EDCE Cn1ncc(NC(=O)c2cc(O)c(O)c(O)c2)c1Br 2132350629 OZQZXSGVFMPUOL-UHFFFAOYSA-N 328.122 1.552 10 10 EDCE C[C@H](N)c1ccc(N2CCCN(CCO)CC2)cc1Br 235506030 HEZKCSFWNHIOEP-LBPRGKRZSA-N 342.281 1.973 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N3CC[C@H]3CO)c(Br)cc21 2148968973 HLOMOVNXPUKPLV-ISVAXAHUSA-N 340.221 1.623 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 1985095032 YAEMEJBPBZCPIM-GHMZBOCLSA-N 327.385 1.516 10 10 EDCE COCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985101665 WBWMAKQSGPTZNC-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE O=C1Nc2cc(N3CC[C@H]4C[C@H]3CO4)c(Br)cc2[C@@H]1O 2153087619 SLOBQQHOBBCPRV-UPFKWVMWSA-N 339.189 1.802 10 10 EDCE CCNCc1ccc(N2CCC[C@](O)(CO)C2)c(Br)c1 314358489 IXEIPZKCQYDCCQ-OAHLLOKOSA-N 343.265 1.882 10 10 EDCE CC(C)(C)OC(=O)NCC1(O)CN(C(=O)CCc2ccc(N)cc2)C1 2044649001 VIULKTBEPHTEHP-UHFFFAOYSA-N 349.431 1.299 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CC(=O)NCc2ccc(N)cc2)C1 2080754317 SGEFSYKCUWNYQI-GOSISDBHSA-N 349.431 1.647 10 10 EDCE CN(Cc1ccccc1)C[C@@H](O)CN1CCc2cc(O)c(O)cc2C1 2318653446 FIXYCZRLXCROPR-GOSISDBHSA-N 342.439 1.949 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(N)CCOC2)c(O)c1Br 2352620596 RLKPAMWVHLKIKE-CYBMUJFWSA-N 329.194 1.197 10 10 EDCE Cc1ccc(CNCCN2CCOCC2)c(O)c1Br 2352692921 NQNISZPCVMCSBM-UHFFFAOYSA-N 329.238 1.885 10 10 EDCE COc1ccc(CN[C@@H]2CCCN(c3cc(C)nn3C)C2=O)c(O)c1 173854905 UBDIPOUBQIRRJU-OAHLLOKOSA-N 344.415 1.728 10 10 EDCE Cc1cc(C(=O)N2CCS(=O)(=O)[C@@H](C)C2)c(C)n1-c1ccccn1 122434576 WHMXBENDXHAHEB-ZDUSSCGKSA-N 347.440 1.748 10 10 EDCE CN(C)c1ccc(CN(C)S(=O)(=O)CCN2CCCC2)cc1 189375805 IGLWLSAESGDYRT-UHFFFAOYSA-N 325.478 1.610 10 10 EDCE O=C1CCCC[C@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)N1 194394242 FWPMBGCHUSRFFW-JKSUJKDBSA-N 346.427 1.959 10 10 EDCE COc1ccc(N2CC(O)(CN(C)C)C2)c(OC)c1Br 2369664188 GBVXEEWBRKPXKE-UHFFFAOYSA-N 345.237 1.579 10 10 EDCE CCCN1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1=O 364974982 UDUHXJPXMSPYOO-UHFFFAOYSA-N 348.359 1.374 10 10 EDCE NC(=O)CC1CN(c2ccc(/C=C\C(=O)O)cc2Br)C1 382221488 WDXYMBHSRSSMMN-RQOWECAXSA-N 339.189 1.859 10 10 EDCE CCOC(=O)c1nnnn1Cc1ccc(C)c(Br)c1O 2381139929 CQQQGMOHOYWYBL-UHFFFAOYSA-N 341.165 1.675 10 10 EDCE Cc1ccc(CNC(=O)c2cn(C)[nH]c2=N)c(O)c1Br 2380739548 LKDWOADDGWTRHX-UHFFFAOYSA-N 339.193 1.539 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CCOC[C@@H]2N)c(O)c1Br 2380756044 HWAZIVWFOJWZMJ-MNOVXSKESA-N 343.221 1.443 10 10 EDCE CCCN(Cc1ccccc1O)C[C@H]1CCN(S(C)(=O)=O)C1 801518814 VCMOHBLGEOKFSX-CQSZACIVSA-N 326.462 1.886 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)C3(O)CCC3)CC2)c(OC)c1 931530568 JNQKBQKEDBDSIJ-KRWDZBQOSA-N 336.432 1.102 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CC(=O)N(C2CC2)C1 862028934 PMLAGMOFVXCBTN-CYBMUJFWSA-N 325.368 1.568 10 10 EDCE COc1cccc([C@H]2CN(C(=O)Cc3ccc(O)c(O)c3)CCN2)c1 1454480107 YEGRYFCLHGDSEO-MRXNPFEDSA-N 342.395 1.822 10 10 EDCE COC(=O)CC[C@@H]1CC[C@H](C(=O)NCc2ccc(N(C)C)cc2)O1 873829316 MEFNENMIVQNMSN-JKSUJKDBSA-N 334.416 1.870 10 10 EDCE CN1CCN(c2ccc(CN[C@@H]3CCO[C@]4(CCOC4)C3)cc2)CC1 771873233 VEDPTADLYPSGGV-UYAOXDASSA-N 345.487 1.866 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)NCCCN=[N+]=[N-])CO1 1895876307 ULMUXPZBOXKYSX-MNOVXSKESA-N 327.385 1.827 10 10 EDCE COC(=O)[C@@]12CCOC[C@@H]1CN(Cc1cc(OC)c(C)cc1O)C2 794677434 FUMXBAXHKLXCTR-KBXCAEBGSA-N 335.400 1.721 10 10 EDCE COC(=O)c1cncc(S(=O)(=O)Nc2ccc(O)c(OC)c2)c1 797819294 DLSLAVXLDUEZFW-UHFFFAOYSA-N 338.341 1.383 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCCCCO)cc2)C1 1141996469 WERZMBPVCLGKTL-INIZCTEOSA-N 347.459 1.557 10 10 EDCE CON(C)C(=O)C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1159473622 NBRQAMBLGPPHCQ-UHFFFAOYSA-N 347.375 1.721 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CNCc2cc(F)ccc2O)[C@@H](O)C1 702807115 AINSUHBULZCTPL-WFASDCNBSA-N 340.395 1.849 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@]12CCOC2 1326308423 JRSOEZZRHVGRQJ-SFHVURJKSA-N 331.416 1.069 10 10 EDCE CN1CC[C@@H](C(=O)N2Cc3cccc(O)c3C2)[C@H](c2cnn(C)c2)C1 1330662153 JHGPZBPNISOMGY-CVEARBPZSA-N 340.427 1.703 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)NCc2cc(C)ccc2O)c1 1453654485 ZDGUSVLDLQUYOZ-GQCTYLIASA-N 325.368 1.785 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)CC2CCC2)cc1 1522568685 DUHLZHGGVGFPEF-UHFFFAOYSA-N 331.376 1.885 10 10 EDCE O=C(CSCC(=O)N1CCCCC1)NCc1cccc(O)c1O 1520502041 UHNYYBKNUKTKEY-UHFFFAOYSA-N 338.429 1.460 10 10 EDCE COC(=O)CCN(C(=O)Cc1ccc(O)c(O)c1)C1CCOCC1 1465454677 XHMRCKIRAXYHDQ-UHFFFAOYSA-N 337.372 1.211 10 10 EDCE COC(=O)c1cc(NC(=O)c2ccc(C3=S=CC=C3)o2)n(C)n1 1538375514 NDFRYEQGBUVOGZ-UHFFFAOYSA-N 331.353 1.678 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2nocc2C)cc1C 1717930931 SKXGHQTXDQPXQE-OAHLLOKOSA-N 347.415 1.523 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H]2CCC(=O)N2C)cc1C 1714269934 ZWEMJBRACANBBL-DZGCQCFKSA-N 333.432 1.219 10 10 EDCE O=C(CNC(=O)NCc1ccc(F)cc1)NCc1ccc(O)cc1O 1626838128 NZUVOCWHPJHJBH-UHFFFAOYSA-N 347.346 1.353 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@@H]2CCN(C)C2)C2CC2)cc1C 1566732537 DGLCTDMKSLQWFV-MSOLQXFVSA-N 345.487 1.940 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2CCN(C)C2)cc1C 1568964037 NBAYRLCFAJWMLS-VGOKWCNXSA-N 331.460 1.717 10 10 EDCE Cc1cc(CN2CCCN(CC(=O)N(C)C)CC2)ccc1N(C)C 1648330827 TWSOAIWLXODYRQ-UHFFFAOYSA-N 332.492 1.657 10 10 EDCE COC(=O)c1ncn(Cc2ccc(N3CCC(OC)CC3)cc2)n1 1643675759 IGAQBQCWUYXLKK-UHFFFAOYSA-N 330.388 1.728 10 10 EDCE COc1cccc(-n2cc(C(=O)NCc3c(O)cccc3O)nn2)c1 1652625771 LSEQJVLNRYCYTD-UHFFFAOYSA-N 340.339 1.617 10 10 EDCE Cn1nnnc1CCCNC(=O)NCc1c(O)ccc2c1CCCC2 1676722968 MIIPVXGNYRQQGM-UHFFFAOYSA-N 344.419 1.227 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@]3(CNC(=O)C3)C2)c([N+](=O)[O-])c1 1772974718 ZPXKRRDNBCWCGX-IVZVJUQRSA-N 345.355 1.497 10 10 EDCE C[C@@H](O)c1ccc(N2CC(CNC(N)=O)C2)c(Br)c1 2130741699 FFDSZZQPYGOEJY-MRVPVSSYSA-N 328.210 1.607 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)[C@H](C)CCO)c(Br)cc21 1917039675 LCDKUVOHDKCADB-AMIZOPFISA-N 342.237 1.869 10 10 EDCE CCNCc1ccc(N2CCNC(=O)[C@H]2C)c(Br)c1 233530593 HELYUTDRISDRNG-SNVBAGLBSA-N 326.238 1.883 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)C[C@@H]2CN(C)C)cc1Br 235222549 ZBJYAEICRWWEQE-RTXFEEFZSA-N 342.281 1.970 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@](C)(N)C(=O)O 1952122356 UEHKVZWGDAXXCD-MLGOLLRUSA-N 340.376 1.336 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985102807 MCNNCKSEOYEXHD-QWRGUYRKSA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010404184 PLLKYVTUSHSSDL-NWDGAFQWSA-N 339.396 1.924 10 10 EDCE CN(Cc1ncno1)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2160398897 HSYROOSPEJGKKM-NSHDSACASA-N 339.149 1.454 10 10 EDCE C[C@@H]1CC[C@@H](O)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 399321258 IQZHOPKURUXTJC-OTPXZMOZSA-N 340.221 1.751 10 10 EDCE CC1(C(=O)NCc2ccc3cccnc3c2O)CCS(=O)(=O)CC1 2063981488 TZABWJDTJKMHFY-UHFFFAOYSA-N 348.424 1.772 10 10 EDCE Cn1cc(/C=C\C(=O)N2CCCCc3ccccc32)c(=O)n(C)c1=O 255770831 JDTSNPWVEPIRMV-KHPPLWFESA-N 339.395 1.467 10 10 EDCE CC[C@@H](N[C@@H](COC)C(N)=O)c1cc(Br)ccc1O 2096073601 RVBKAXPKJPPCRC-MNOVXSKESA-N 331.210 1.696 10 10 EDCE CN(C)C[C@H]1COCCN1c1ccc(CN)c(Br)c1 2096927169 BHJVXQOZIDOXFU-ZDUSSCGKSA-N 328.254 1.675 10 10 EDCE OCc1ccc(N2C[C@H]3COC[C@]3(CO)C2)cc1Br 2226176843 SYMLZYDEGUVKIZ-SMDDNHRTSA-N 328.206 1.387 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CC[C@H](O)CN1C(=O)OC(C)(C)C 2242655891 HVRKZDAXIAMOGX-QWRGUYRKSA-N 327.385 1.516 10 10 EDCE Cc1ccc(N2C(=O)NC(=O)C(=CNC[C@H]3CCCO3)C2=O)cc1C 2296079317 INCPQAIZLAVDNT-CQSZACIVSA-N 343.383 1.539 10 10 EDCE CC(C)NCc1ccc(N2CC[C@@H]2[C@@H](O)CO)c(Br)c1 2286207762 GVSUTICYSMWPME-CABCVRRESA-N 343.265 1.879 10 10 EDCE O=C1O[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)c2cc(O)c(O)cc21 33414012 YDENXMXAAFEVRV-LSDHHAIUSA-N 344.275 1.906 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2333239276 MIRHUDLBPKEIJZ-XQQFMLRXSA-N 333.201 1.048 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)cc1Br 2355340219 NRYWULHGYCXGKD-TYWRASTISA-N 342.233 1.823 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)CCN1C[C@@H](C)O 173234728 SJNXOSJYGSBTEO-LSDHHAIUSA-N 334.464 1.349 10 10 EDCE CN1C(=O)/C(=C2/SC(N3CCOCC3)=NC2=O)c2ccccc21 33299858 QLVDVAIAEXOPAU-OUKQBFOZSA-N 329.381 1.336 10 10 EDCE COc1cc(O)c(CN2CCN(c3cc(C)[nH]n3)CC2)cc1OC 189020655 VSFKOXUKUWIDRA-UHFFFAOYSA-N 332.404 1.763 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCO[C@H](CN(C)C)C2)c([N+](=O)[O-])c1 255342123 ODPZMRXLVLUWMD-BRLPQQTGSA-N 349.387 1.548 10 10 EDCE CO[C@@H]1CN(Cc2ccc(C)c(Br)c2O)C[C@H]1C(=O)O 2380810163 FPYIQMWYGNOIOU-GHMZBOCLSA-N 344.205 1.995 10 10 EDCE Cc1ccc(CNC(=O)[C@]2(C)CNC(=O)C2)c(O)c1Br 2381139485 XPMBVAKRGASJAE-AWEZNQCLSA-N 341.205 1.606 10 10 EDCE CS[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@H]1N1CCCC1 294885676 GKKLDNGILPPYAZ-DGCLKSJQSA-N 340.420 1.889 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1oc(CO)cc1C 819698741 QZXCYULVYGSWEN-UHFFFAOYSA-N 347.367 1.991 10 10 EDCE C[C@H](NC[C@]1(CO)COCCN1C)c1cccc(C(F)(F)F)c1O 903281552 YHNXCJAGMUIVAQ-NHYWBVRUSA-N 348.365 1.755 10 10 EDCE C[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)C[C@H]1N1CCOCC1 588405732 NPBCHQGCZFBYDE-JLHXHDPKSA-N 332.400 1.290 10 10 EDCE CN1CCCc2cc(CNC(=O)NC3CC(CC(N)=O)C3)ccc21 915390729 OFAPUHRWPKLWRL-UHFFFAOYSA-N 330.432 1.522 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)C[C@@H](C)NC(N)=O)C2)cc1 848229186 KUVUPDANRLQAOX-CHWSQXEVSA-N 334.420 1.085 10 10 EDCE Nc1ccc(NC(=O)C(=O)N[C@H](C[C@@H]2CCCO2)C(F)(F)F)cc1 848602551 GSBNUERWNKPCCO-NWDGAFQWSA-N 345.321 1.824 10 10 EDCE CC(C)O[C@]1(CS(=O)(=O)NCc2c(O)cccc2F)CCOC1 921451032 JEBMHBDASRGYLA-OAHLLOKOSA-N 347.408 1.535 10 10 EDCE COc1ccc(N2CCCN(C(=O)N[C@H]3C[C@@H](C(N)=O)C3)CC2)cc1 845452758 YXVQYRQZGUNNDS-OKILXGFUSA-N 346.431 1.181 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](CC(N)=O)C3)C2)cc1 852448222 IEYFGELMWWBEBV-KGLIPLIRSA-N 346.431 1.181 10 10 EDCE COCCC1CN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 854297957 YKKXDCSYPHZUHC-HNNXBMFYSA-N 333.432 1.952 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@@H](O)CC[C@@H]3C)C2)cc1 852450166 HAMGFWKPKYOZBF-LZWOXQAQSA-N 333.432 1.829 10 10 EDCE Cc1cc(CC(=O)N2C[C@@H](CO)[C@H](CO)C2)c(C)n1-c1ccccc1 862579996 ORUFFUWLUZGBGI-ROUUACIJSA-N 342.439 1.696 10 10 EDCE O=C1CN(Cc2c(O)cccc2Br)CCN1C1CC1 862246189 KXCPUKCUHKLLCO-UHFFFAOYSA-N 325.206 1.961 10 10 EDCE CN1CCN(c2cc(C(=O)N3Cc4cccc(O)c4C3)ccn2)CC1 871201125 OXIPBEWRGYPQLZ-UHFFFAOYSA-N 338.411 1.695 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)NCc2ccc(O)c(O)c2)c1 778919502 GAASGCPFUKHVKF-HWKANZROSA-N 327.340 1.182 10 10 EDCE CC[C@@H]1C(=O)N(CC)CCN1Cc1ccc(N2CCOCC2)cc1 779217017 NMXJZHZQARRFGH-GOSISDBHSA-N 331.460 1.966 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1ccc(C(N)=O)o1 1138153163 ZFXCAHUFQZNNIP-QBBOHKLWSA-N 330.340 1.550 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@]3(CO)CCC[C@@H]23)cc1 897361244 CIPWNGUXBFTWJY-VQIMIIECSA-N 345.443 1.132 10 10 EDCE COC(=O)c1cc(S(=O)(=O)Nc2ccc(O)c(OC)c2)c[nH]1 797819551 MCWNAUKEEOFOBH-UHFFFAOYSA-N 326.330 1.316 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)S(=O)(=O)CC 1142411001 ZJZNULWHTZWMEV-UHFFFAOYSA-N 341.477 1.383 10 10 EDCE O=C(O)[C@H]1C[C@@H](NCc2ccc(Br)cc2O)CCO1 1880020118 IXPMYYNSZBXQCS-CMPLNLGQSA-N 330.178 1.877 10 10 EDCE C=CC(=O)NCc1ccc(C(=O)NCc2cc(O)ccc2O)cc1 1153879359 LSXYFGHJEJODRT-UHFFFAOYSA-N 326.352 1.830 10 10 EDCE CO[C@@]1(C(=O)NCc2c(O)ccc3ccccc23)CCS(=O)(=O)C1 1304090607 KSLGORQEQYFLPT-KRWDZBQOSA-N 349.408 1.365 10 10 EDCE CN1Cc2ccccc2[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C1=O 1167231158 BUVGHWBKTGPSGV-YPLUBFQTSA-N 338.363 1.941 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCc1nc2c(s1)COCC2 1179292959 LYXIFWXGMWQQMT-UHFFFAOYSA-N 334.397 1.528 10 10 EDCE C[C@]1(C(=O)O)CN(Cc2ccc(Br)cc2O)CCO1 711510885 SZVMCIIFAJUQJL-CYBMUJFWSA-N 330.178 1.830 10 10 EDCE CCNC(=O)CN[C@@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1278025372 MLSWXJRSDRJISX-NSHDSACASA-N 348.407 1.035 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H](C)NC(C)=O)cc1C 1270348118 OEXCLPUARQZPKT-JSGCOSHPSA-N 335.448 1.370 10 10 EDCE CN(C)c1ccc(CNC(=O)c2nc(-c3cnccn3)no2)cc1F 1292283692 YWGYZQSKNVSUEK-UHFFFAOYSA-N 342.334 1.662 10 10 EDCE O=C(NCCCSc1nccs1)C1CC2(C1)CS(=O)(=O)C2 1520986788 MACQFGXAIOZYIW-UHFFFAOYSA-N 346.499 1.566 10 10 EDCE C[C@H](O)[C@H]1CN(c2cc(Br)c(CN)cc2F)CCO1 2117526697 BAKSFOQCIWUNEF-ISVAXAHUSA-N 333.201 1.633 10 10 EDCE COC(=O)c1ccc2c(c1)NC(=O)CN2C(=O)/C=C/c1cnn(C)c1 1544608978 BPCMSDHHBRKIPY-ZZXKWVIFSA-N 340.339 1.205 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2ccon2)cc1C 1700930566 FMJJDSBWZLLYOP-AWEZNQCLSA-N 333.388 1.214 10 10 EDCE C[C@@](NCCCN=[N+]=[N-])(C(N)=O)c1ncccc1Br 2120048254 XNUKTJRLPIHKCZ-NSHDSACASA-N 327.186 1.835 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cc2n[nH]c(C)n2)cc1C 1715811045 BPRSDJNGGUMABV-SNAWJCMRSA-N 343.431 1.435 10 10 EDCE CCC[C@H](CCCS(C)(=O)=O)C(=O)NCc1cc(O)ccc1O 1558175486 SLZZSBRFZYHVAK-GFCCVEGCSA-N 343.445 1.955 10 10 EDCE NC(=O)[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccc(Cl)cc1 1558804787 WFLOMTMGCUPTCK-OAHLLOKOSA-N 334.759 1.637 10 10 EDCE Cc1nn[nH]c1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1637554336 JGIQWKCFIUKXSS-UHFFFAOYSA-N 337.330 1.158 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(c2ccnc(F)c2)CC1 1635794947 GOOFLWNIMPMJNM-RQOWECAXSA-N 343.358 1.994 10 10 EDCE Cn1cc(-c2n[nH]cc2C(=O)NCc2ccc3cccnc3c2O)cn1 1643283259 NFLYNIVOIBUOIU-UHFFFAOYSA-N 348.366 1.994 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CNCc2c(O)cccc2F)C1 1964589088 NMLVKFMGVLYIPC-UHFFFAOYSA-N 326.368 1.603 10 10 EDCE CCOC(=O)C1(O)CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 1772911348 LAHPMZVAUUTGKG-XQRVVYSFSA-N 335.356 1.028 10 10 EDCE COc1ccc(O)c(CNC(=O)Cn2cc(-c3ccccc3)nn2)c1 160906081 JQXQGYKKLGLOGK-UHFFFAOYSA-N 338.367 1.976 10 10 EDCE Cc1oc2ncn(C)c(=O)c2c1C(=O)NCCc1ccc(N)cc1 152510537 MDEPOOGIBHWCBN-UHFFFAOYSA-N 326.356 1.390 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N[C@H]1CCc2ncnn2C1 155355835 CIZPEWPTUFKISJ-HNNXBMFYSA-N 338.415 1.469 10 10 EDCE O=C(COc1ccc2c(c1)OCO2)NCCc1ccc(O)c(O)c1 1860322246 FXJBPKJCNLBZAU-UHFFFAOYSA-N 331.324 1.564 10 10 EDCE COc1ccc(N2CCN(C(=O)c3c(C)nc(N)nc3C)CC2)cc1 1123748347 BGBLAPZHAWNSQK-UHFFFAOYSA-N 341.415 1.647 10 10 EDCE CNCc1ccc(N2CCC[C@H](C(N)=O)C2)c(Br)c1 234442705 IPNGWUJWENWUFK-NSHDSACASA-N 326.238 1.870 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1NCc1ccc(O)c(O)c1 1943954301 FPVDOSVAUIQHCK-QWHCGFSZSA-N 338.404 1.870 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1CNC(=O)O1 1951992695 IZKLRBXUBXIRFW-MFKMUULPSA-N 338.360 1.642 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCC(=O)N[C@H]2C)c1O 1971868807 IRFVSEBITXRWKW-KWQFWETISA-N 343.221 1.920 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 1985103315 SVTMTIPUAVPCJX-NSHDSACASA-N 327.385 1.781 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)O1 1985101123 OECKEGRDMPRZGE-QWRGUYRKSA-N 325.369 1.580 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCO1 1985102719 KXXDBBOHTLIAAU-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 1986341297 VZEQYZIRTGNXBQ-NAUIOFCNSA-N 325.369 1.316 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C[C@H](O)C1 1990022303 ASRQWOXGVASZRO-RULNRJAQSA-N 325.369 1.316 10 10 EDCE NCc1ccc(N2CCC[C@H](OCC(N)=O)C2)cc1Br 2145383257 SNAXVHOEPGOYPZ-LBPRGKRZSA-N 342.237 1.379 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)([C@H](F)C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010394839 FRMYKKJKJYSJAL-VHSXEESVSA-N 343.359 1.218 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2018047561 QZRLADPADSZLBB-NWDGAFQWSA-N 341.412 1.954 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)NCc2ccc(N)cc2)C1 2022870068 FPHJCXRREUVNSQ-UHFFFAOYSA-N 335.404 1.114 10 10 EDCE OC[C@]1(O)CCN(c2ccc(CNC3CC3)c(Br)c2)C1 313862505 MJKAJFYYMSHSNM-HNNXBMFYSA-N 341.249 1.635 10 10 EDCE C[C@@H](O)CN1CCCN(c2ccc(CO)cc2Br)CC1 2176853154 CWQFVDSBPRNDKB-GFCCVEGCSA-N 343.265 1.834 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)cc1Br 2173317248 KCBSCCLWQDNUQP-WBGBGRJVSA-N 341.249 1.789 10 10 EDCE CS(=O)(=O)c1cnn(Cc2cc(Br)ccc2O)c1N 2070217387 OMWILEYNGQHSBQ-UHFFFAOYSA-N 346.206 1.385 10 10 EDCE NC(=O)[C@H]1CCN1c1ccc(C=CC(=O)O)c(Br)c1 2089362680 OXAOKEXJVNYGER-LLVKDONJSA-N 325.162 1.611 10 10 EDCE CC(=O)C(=O)[C@@H](O)c1cc(Br)c2c(c1)OCCCO2 2090947222 GWLPOQBOBQSGDP-LBPRGKRZSA-N 329.146 1.802 10 10 EDCE COC[C@]1(O)CCCN(c2ccc(CO)cc2Br)C1 2095485223 ZKSJPIRHUYKMDG-AWEZNQCLSA-N 330.222 1.919 10 10 EDCE NCc1ccc(N2CCC([C@H](O)CO)CC2)cc1Br 2096154727 KEDUBNFWCOCWSV-CQSZACIVSA-N 329.238 1.477 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2210529353 PSWYXEFJLNOKOD-AXFHLTTASA-N 327.385 1.610 10 10 EDCE CCNC1CC(CS(=O)(=O)NCc2cnc(SC)s2)C1 2284509402 VWKKVZLRNYDKIK-UHFFFAOYSA-N 335.520 1.673 10 10 EDCE O=C(O)[C@@]12CC[C@@H](CN(Cc3c(O)cccc3Br)C1)N2 2287375912 PKHHYDRPTLZBIR-LKFCYVNXSA-N 341.205 1.546 10 10 EDCE CCOC(=O)c1ccc(NC=C2C(=O)NC(=S)N(CC)C2=O)cc1 2297366602 DHGNMIBCXGGLTN-UHFFFAOYSA-N 347.396 1.422 10 10 EDCE C[C@H]1CN(C(=O)C=Cc2ccc(O)c(O)c2)C[C@@H]1N1CCOCC1 2307987828 NPBCHQGCZFBYDE-ZFWWWQNUSA-N 332.400 1.290 10 10 EDCE C[C@H](CNC(=O)C=Cc1ccc(N2CCOCC2)cc1)CC(=O)O 2311977759 HREBTRGCWKIRDF-AWEZNQCLSA-N 332.400 1.763 10 10 EDCE Cc1ccc(CN(C)[C@@H]2C[C@@H](N)C[C@H]2O)c(O)c1Br 2352643240 MTTCPLZGMZWQCZ-IJLUTSLNSA-N 329.238 1.746 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCn3cnnc3C2)c([N+](=O)[O-])c1 105793874 ZZGQSRUXCDOFDI-HWKANZROSA-N 329.316 1.393 10 10 EDCE O=C(O)[C@@H]1CC[C@@H](c2cccc(I)c2O)N1 309568335 UUBFAEOXZXWLCB-IUCAKERBSA-N 333.125 1.875 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCCNC(=O)c1ccccc1 180620495 PJVFIMJNHIUSRE-VQHVLOKHSA-N 326.352 1.657 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H]3C(=O)NCC[C@H]3C)CC2)cc1 194036199 GZAZSSDBOBFBDQ-CJNGLKHVSA-N 346.431 1.051 10 10 EDCE COc1ccc(N2CCN(CCNCc3cncn3C)CC2)cc1 263837811 DIDDLWIIUQJFIV-UHFFFAOYSA-N 329.448 1.341 10 10 EDCE Cc1ccc(CN2C[C@H](CO)C[C@@H](CO)C2)c(O)c1Br 2380813059 BXPNNBUOJAMVHX-VXGBXAGGSA-N 344.249 1.886 10 10 EDCE CO[C@H]1C[C@](N)(C(=O)NCc2ccc(C)c(Br)c2O)C1 2381147289 QRICCDPSGWWNPL-WJONMLJTSA-N 343.221 1.586 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1 808510312 NEVVCUYDCRMINC-UHFFFAOYSA-N 333.749 1.026 10 10 EDCE CC(C)N(C[C@@H](C)O)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807288252 UKYCJUIQDWPMHM-OAHLLOKOSA-N 345.443 1.297 10 10 EDCE Oc1c(F)cc(Br)cc1CNC[C@@H]1Cc2nncn2C1 2167745824 HYYZUKQNBZPEEK-QMMMGPOBSA-N 341.184 1.847 10 10 EDCE CCN(CC)CCS(=O)(=O)N[C@H](C)c1cc(OC)ccc1O 810051328 ZGPKDBCGQGBNJX-GFCCVEGCSA-N 330.450 1.723 10 10 EDCE Cc1cc(C(=O)COC(=O)[C@@H]2CNC(=O)N2)c(C)n1-c1ccccc1 732360562 MAUPVGSXKXSVOW-HNNXBMFYSA-N 341.367 1.501 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@]2(C)CCCS2(=O)=O)c1 907060504 MSWNAXVDAIJSSQ-ZUZCIYMTSA-N 327.402 1.545 10 10 EDCE COC(=O)C[C@H]1C(=O)NCCN1C/C=C\c1ccc(N(C)C)cc1 835026495 YFAPCOHQBHNZPS-AWFCHZOYSA-N 331.416 1.129 10 10 EDCE COC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)Nc2ccc(N)cc2)C1 841092683 MCOOPERAKRCARP-RYUDHWBXSA-N 348.403 1.190 10 10 EDCE CCO[C@@H]1CN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C[C@H]1CN 846694993 HMQPBOSGILAKOZ-NVXWUHKLSA-N 342.443 1.925 10 10 EDCE CCc1cccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)c1O 848889817 MUXJHIZAFKROEQ-YHUYYLMFSA-N 347.411 1.880 10 10 EDCE COC[C@](C)(CCO)NCC(=O)N(C)Cc1ccc(N(C)C)cc1 754668485 OXDIIMUOJJBBGK-SFHVURJKSA-N 337.464 1.088 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H](CN)[C@H](C)C1 926327943 KOGAVVJVXUFCTC-CABCVRRESA-N 347.459 1.574 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](C)[C@@H]3CO)C2)cc1 854298308 ABJOSFMYGBXHHE-ZQIUZPCESA-N 333.432 1.686 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCC[C@@H]3C[C@@H]23)c1 855775943 ONBNEBQQQJFWIR-NTZNESFSSA-N 338.429 1.930 10 10 EDCE NC(=O)C12CCC(CC1)N2C(=O)NCCCSc1nccs1 921447619 OBLIFTJUIZFODV-UHFFFAOYSA-N 340.474 1.817 10 10 EDCE CC1(C)CN(Cc2cc3c(cc2O)OC[C@H]3O)C[C@@]2(CCOC2)O1 794695493 QZMVAGGAAPHRBA-CRAIPNDOSA-N 335.400 1.588 10 10 EDCE Cc1cccc(OC[C@@H](O)CNC(=O)Cc2ccc(O)c(O)c2)c1 1149569180 BBJCOEJTZUABQJ-AWEZNQCLSA-N 331.368 1.505 10 10 EDCE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H]3COC[C@H]3O)c2C)c1 1234327755 QEIKFBBHPLQWCM-QZTJIDSGSA-N 343.427 1.961 10 10 EDCE CCN1CC[C@@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H]1C 1329812707 WYIWJPXKACFYAM-UKRRQHHQSA-N 345.443 1.566 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\[C@H]1CCCO1 1331970249 HXOOXMAULHEQRX-APMKWMSLSA-N 349.383 1.423 10 10 EDCE Cc1ccc(C(=O)N2CCC(CN=S(C)(C)=O)CC2)c(O)c1O 1348397413 QKGLWYWURBWWCM-UHFFFAOYSA-N 340.445 1.986 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H](C(C)(C)C)[C@@H](O)C1 1261312799 DTYOQHNYSOODAU-HOCLYGCPSA-N 348.443 1.606 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2nccs2)cc1C 1272283779 CHACCOORRNBSKL-UHFFFAOYSA-N 349.456 1.684 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@@H]2[C@H]3CCC[C@H]32)cc1C 1278743258 MMDUPQNYJLPRJW-VXNCWWDNSA-N 346.471 1.959 10 10 EDCE COC(=O)[C@@]1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCSC1 1296023404 IRNOOBLGSFLJCB-CQSZACIVSA-N 336.373 1.628 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@H]1CC12CC2 1526698900 ZPIOTRDUVQJTES-GXFFZTMASA-N 343.387 1.884 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCC[C@H]2CCCN2CCO)cc1 1713442814 UXWSMCBXXRINHA-HNNXBMFYSA-N 347.419 1.816 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1CCC(=O)N1)NCc1ccc(OC)c(C)c1 1481867233 DAJGFULXMSVIGR-GJZGRUSLSA-N 333.432 1.267 10 10 EDCE CN1CC[C@H](C(=O)NCc2cc(O)ccc2O)[C@@H](c2cnn(C)c2)C1 1633599311 WYYZYLKJCMPAIZ-JKSUJKDBSA-N 344.415 1.183 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1cccc(-c2nc(O)n[nH]2)c1 1568824654 RHDUMVAKGXJVJD-UHFFFAOYSA-N 326.312 1.770 10 10 EDCE COCCOCCc1ncc(C(=O)NCc2cccc(OC)c2O)[nH]1 1636061181 IMAPLAANJUZXSG-UHFFFAOYSA-N 349.387 1.259 10 10 EDCE O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NCc1c(O)cccc1F 1646029223 RUWJCUMQSCHDFI-UHFFFAOYSA-N 347.302 1.486 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C[C@H]2C=CCC2)cc(OC)n1 1737548518 AIQYSMUXCZUFKR-OLZOCXBDSA-N 347.415 1.690 10 10 EDCE COc1cnc([C@@H]2CCCN2C(=O)c2cccc(O)c2O)nc1O 1646488941 PSKBGMAIEBGQPP-JTQLQIEISA-N 331.328 1.579 10 10 EDCE CCOC(=O)CN(CC(=O)N=c1cc[nH]cc1)Cc1ccccc1O 1654805915 IPFSAFBSZJIJSR-UHFFFAOYSA-N 343.383 1.213 10 10 EDCE CO[C@@](C)(C(=O)NCc1c(O)cccc1O)C(=O)OC(C)(C)C 1652629149 YDAABGCHCKBTBV-INIZCTEOSA-N 325.361 1.461 10 10 EDCE COc1ccc(CNC[C@H]2C[C@H](NC(=O)C3(C(N)=O)CC3)C2)cc1C 1675786168 PTVCBXANIIAEPU-SHTZXODSSA-N 345.443 1.254 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)c2nc[nH]n2)cc1C 1675992793 SXOCCQAGXLBFHA-CYBMUJFWSA-N 331.420 1.810 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(C)CN(C)C1=O 1764723693 ZFVXUFZYLOKCHM-GOSISDBHSA-N 343.431 1.661 10 10 EDCE CC[C@@H](C)CNC[C@@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 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NCc1ccc(N2C[C@@H](CO)C[C@H]2CO)c(F)c1Br 2089907569 LPRQLRZEQMWITJ-WPRPVWTQSA-N 333.201 1.226 10 10 EDCE OCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@H]32)c(Br)c1 2090533813 IBAIITOHLWSTID-ZLKJLUDKSA-N 328.206 1.670 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1CC(CO)(C(=O)O)C1 2201042635 HRIRBVXCQJCBKT-LLVKDONJSA-N 344.205 1.985 10 10 EDCE C[C@H](N)c1ccc(N(C)[C@@H]2CC(=O)NC2=O)c(Br)c1 2114736657 CYGQIOJHANGKJS-WRWORJQWSA-N 326.194 1.320 10 10 EDCE C[C@H](O)[C@@H]1CN(c2cc(Br)c(CN)cc2F)CCO1 2117526699 BAKSFOQCIWUNEF-SDBXPKJASA-N 333.201 1.633 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)C[C@@]1(Br)CC1(F)F 2202509811 QADFVEDXABMDJV-LBPRGKRZSA-N 348.191 1.729 10 10 EDCE CC(C)(C)OC(=O)N1CCc2cc(Nc3nnc(=N)[nH]n3)ccc2C1 2219016203 ABOLWOOMNHQLPA-UHFFFAOYSA-N 343.391 1.716 10 10 EDCE OC[C@@H]1NC[C@@H]2CN(Cc3c(O)cccc3Br)C[C@@H]21 2227311450 DHQIZOQSQCJFNA-NRUUGDAUSA-N 327.222 1.167 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@]2(C(=O)NCCCN=[N+]=[N-])CO[C@H]1C2 2247348934 VFVVPAOXLPZYGH-PGUXBMHVSA-N 339.396 1.875 10 10 EDCE Cc1ccc(CNC[C@H](C)S(N)(=O)=O)c(O)c1Br 2327623023 CPRBNYWPZSDIJW-QMMMGPOBSA-N 337.239 1.230 10 10 EDCE C[C@H](O)c1ccc(N2CC3(COC(=O)N3)C2)cc1Br 2351834976 SBYFMATYOUBOOT-QMMMGPOBSA-N 327.178 1.801 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C=CCNC2)c(O)c1Br 2352637410 KKZWZBYRTIVVIA-NSHDSACASA-N 325.206 1.855 10 10 EDCE Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)C)c(O)c1O 179489333 MSTPZPCDPJJIOF-HNNXBMFYSA-N 342.395 1.836 10 10 EDCE C[C@H](NC[C@@H]1CN(C)CCO1)c1ccc(N2CCC(O)CC2)cc1 180486068 AWWHMLHAWOMESG-HNAYVOBHSA-N 333.476 1.629 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)C[C@@H]3CCO3)c(Br)cc21 2366919375 QZAMACSGSSBBTQ-SDBXPKJASA-N 340.221 1.887 10 10 EDCE NCc1ccc(N2CCCS(=O)(=O)CC2)c(Br)c1 236212915 SIYBKIGNUGUVNA-UHFFFAOYSA-N 333.251 1.533 10 10 EDCE C[C@@H](NC[C@@H]1CCCS1(=O)=O)c1ccc(N2CCOCC2)cc1 90465981 JWYXUAGOMQIOBT-PBHICJAKSA-N 338.473 1.751 10 10 EDCE CNCc1cc(F)c(N2CCSC[C@@H]2S(C)(=O)=O)c(F)c1 90923197 FARHGPVVIGDDQX-LBPRGKRZSA-N 336.429 1.608 10 10 EDCE CN(C)c1ccc(C=c2sc(=CC(=O)C(C)(C)C)[nH]c2=O)cc1 252452431 IBZVVFYXLMUXDM-UHFFFAOYSA-N 330.453 1.727 10 10 EDCE CC(=O)C(=O)COC(=O)c1nnn(-c2ccc(OC(C)C)cc2)c1C 808516127 AMOLVLGBJQGCCD-UHFFFAOYSA-N 345.355 1.678 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC34CC4)cc2)C1 817428347 JEMSLAIXKDEOQU-GDBMZVCRSA-N 327.428 1.805 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H]3CO4)c(Br)cc2[C@H]1O 718275437 HCIZFDBOYNBYCH-DJOAAKCGSA-N 325.162 1.412 10 10 EDCE CC(C)OC[C@H](O)CNCc1cc(F)c(N2CCOCC2)c(F)c1 819359344 DWBQOSYFJYZTFJ-CQSZACIVSA-N 344.402 1.677 10 10 EDCE C[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccnn1C 817523236 HWZLCNZNRRSCBB-CQSZACIVSA-N 328.416 1.677 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CN1CC(C)(C)C1 816825947 RPNLNVAZZDKHBU-UHFFFAOYSA-N 331.460 1.823 10 10 EDCE CNC(=O)[C@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1 817155465 YWYBTFMSTOZBOT-HNNXBMFYSA-N 330.432 1.564 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NCCCN2CCOC2=O)c1 729052613 PSXQOJKPJMRLQL-LLVKDONJSA-N 337.376 1.603 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@@H](O)C2)c(Br)c1 2132135724 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UTBPGSZBPOKYGV-YOEHRIQHSA-N 336.432 1.361 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@@H]2NCC[C@H]21 866722983 BFRJRRFFYMPLQS-ZWKOTPCHSA-N 330.476 1.537 10 10 EDCE O[C@@H](CNCc1ccc(N2CCCC2)cc1)CC1(O)CCOCC1 872198750 ZWXDHLGBQHLGBW-GOSISDBHSA-N 334.460 1.669 10 10 EDCE O=C(CCC12CC(CN1)C2)NCc1ccc(N2CCC(O)CC2)cc1 870956946 QHGZPFYLIWEPFH-UHFFFAOYSA-N 343.471 1.796 10 10 EDCE CCN(Cc1cc(Br)ccc1O)C(=O)c1nnn(C)n1 879024244 LKZSQJXUVSSSLY-UHFFFAOYSA-N 340.181 1.341 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(C(=O)N2CCCC2)CC1 779493788 OZZKNXAONWBYGK-XQRVVYSFSA-N 344.411 1.972 10 10 EDCE Cc1cc(Br)c(O)c(CNC[C@](C)(O)CN(C)C)c1 781635332 GCSXJOLHWATCRR-AWEZNQCLSA-N 331.254 1.865 10 10 EDCE CCN(CCN=[N+]=[N-])S(=O)(=O)N1CC(OCc2ccccc2)C1 1900613446 YHRPUTYEIUGTMF-UHFFFAOYSA-N 339.421 1.764 10 10 EDCE C[C@H](NC(=O)[C@](C)(O)Cn1ccccc1=O)c1ccc(N(C)C)cc1 790940148 JEFXPSBJOXXWSQ-IFXJQAMLSA-N 343.427 1.543 10 10 EDCE COc1cc(C(=O)NCc2ccc(O)cc2O)cc2c1OCCO2 1142530893 UUCTVVMIMARAOW-UHFFFAOYSA-N 331.324 1.808 10 10 EDCE CC(=O)N/C(=C\C1=S=CC=C1)C(=O)Nc1nc2cnccc2[nH]1 1153373686 JQCKSPAHQJVPNX-GHXNOFRVSA-N 327.369 1.194 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@@H](C)CC(N)=O)C2)cc1C 1317118342 RPNOJJKTKYWQMX-AEGPPILISA-N 333.432 1.252 10 10 EDCE CC(C)(C)CN(CCCO)C(=O)C(=O)N1Cc2cccc(O)c2C1 1335563942 REXVQSZSEJPDCH-UHFFFAOYSA-N 334.416 1.492 10 10 EDCE COc1ccc(-n2nnnc2CN(C)CCN(C(C)=O)C(C)C)cc1 1332677139 QQSQGIZBDGQYGD-UHFFFAOYSA-N 346.435 1.360 10 10 EDCE CC[C@H]1C(=O)NC(=O)CN1c1ccc([C@H](C)N)cc1Br 97319349 CAFUYZDYVIAQIP-KWQFWETISA-N 340.221 1.710 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)C2CN(C(C)=O)C2)cc1C 1268531340 AVCDMUIEUIHWJN-PLNGDYQASA-N 345.443 1.244 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cncs2)cc1C 1278738023 YCTFEQYFLVNEEN-AWEZNQCLSA-N 349.456 1.683 10 10 EDCE O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCc1cc(Cl)ccc1O 1452934484 AVRSVBSMZUHFSB-UHFFFAOYSA-N 337.719 1.432 10 10 EDCE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1C[C@@H]2OCO[C@@H]2C1 1542227045 RBGBHYFOMBWVNT-CALCHBBNSA-N 343.431 1.571 10 10 EDCE COC(=O)C1(NC(=O)Cc2ccc(O)c(O)c2)CCSCC1 1625798527 LLHARWVGWPKVGR-UHFFFAOYSA-N 325.386 1.195 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H]2[C@H]3CCC[C@H]32)cc1C 1716081842 FZAGXHUGUXHRAK-LISAXSMJSA-N 332.444 1.616 10 10 EDCE COCCOc1ccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)nn1 1637993491 HRHJKSJXAJHFOM-UTCJRWHESA-N 345.355 1.243 10 10 EDCE CCn1cc(-c2nn(C)cc2C(=O)NCc2cccc(O)c2O)cn1 1637046755 XDWKUPKFEFPPNW-UHFFFAOYSA-N 341.371 1.645 10 10 EDCE CC[C@@H](CNC(=O)C1CN(C(C)=O)C1)NCc1ccc(OC)c(C)c1 1567960329 ZKJNMGLORZSHMO-KRWDZBQOSA-N 347.459 1.466 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2oc(C)nc2C)cc1C 1568554943 SPJODDDNAJKOON-HNNXBMFYSA-N 347.415 1.489 10 10 EDCE O=C(CCN1C(=O)c2ccccc2C1=O)NCc1cc(O)ccc1O 1637122405 FSDJCXBFDFRYLE-UHFFFAOYSA-N 340.335 1.400 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C(=O)NCC2CC2)cc1C 1733017163 CAUWBUVFLPWUGW-ZDUSSCGKSA-N 333.432 1.124 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)C2[C@H]3CCC[C@H]23)cc1C 1733612346 VUYVULKDFNIZHE-IRXDYDNUSA-N 346.471 1.960 10 10 EDCE CC(C)NC(=O)CNC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1732984547 AGAIYUXTMQQWJI-LLVKDONJSA-N 348.407 1.082 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1ccc(Cn2ccccc2=O)o1 1595596409 VXSIXOHESZQXCP-UHFFFAOYSA-N 340.335 1.831 10 10 EDCE Cn1cc(CCNC(=O)NCCCSc2nccs2)cn1 152397044 FDJRHBGKWVQUIH-UHFFFAOYSA-N 325.463 1.901 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCN[C@H]2COC[C@H]21 2132580033 RTCHBITYHLVWJW-NWDGAFQWSA-N 331.185 1.466 10 10 EDCE O=C1Nc2cc(N3CC4(CCOC4)C3)c(Br)cc2[C@@H]1O 1915315225 NWZNZXDLGDMUTI-LBPRGKRZSA-N 339.189 1.661 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)C[C@H]2CO)c(Br)c1 2136087374 DHPXBKGOIBVMNE-DLOVCJGASA-N 329.238 1.791 10 10 EDCE CN(C)[C@H]1COC[C@H]1CNCc1cc(Br)ccc1O 1924687189 MPPVHZICYVFINS-YPMHNXCESA-N 329.238 1.821 10 10 EDCE CC[C@@H]1C(=O)NC(=O)CN1c1ccc(CNC)cc1Br 234127606 HZWUYVSYVAFDFM-LLVKDONJSA-N 340.221 1.410 10 10 EDCE COC(=O)[C@H]1CCN[C@@H]1c1cc(I)ccc1O 1952825554 LSZIHRXXICGJEP-KWQFWETISA-N 347.152 1.820 10 10 EDCE CC(C)(C)OC(=O)N1C[C@]2(C)C[C@]2(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003166200 DHZQSCRNAJDHRA-GNTOHDJUSA-N 336.432 1.899 10 10 EDCE CN(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)CCN=[N+]=[N-] 1985093939 HTQCUKMKRSCGJT-LLVKDONJSA-N 328.417 1.600 10 10 EDCE CN1CCO[C@H]2CN(c3cc(Br)c(CN)cc3F)C[C@H]21 2153991241 POKGKUTWZINTSD-KGLIPLIRSA-N 344.228 1.566 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3[C@@H]4CCCO[C@H]4C3(C)C)c2n1 2062518263 KIYLVULFJSJBOO-ZLKJLUDKSA-N 330.388 1.677 10 10 EDCE CC[C@H](NC(=O)c1cnn2c(O)cc(C)nc12)[C@H](O)C(F)(F)F 2064294000 ZAZANMINRSLDAH-WPRPVWTQSA-N 332.282 1.175 10 10 EDCE OCc1nnc(CNCc2cccc(Br)c2O)s1 2072477660 UOVQUAMAGLVDJD-UHFFFAOYSA-N 330.207 1.788 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(NC(=O)c2ccc(O)c(O)c2)C1 2216764443 SFWPYCNVAVIUDI-DIFFPNOSSA-N 334.372 1.837 10 10 EDCE CCCN1C(=O)C(=CN(CC)[C@H]2CCS(=O)(=O)C2)SC1=S 2296535441 FFIMSQJSMHTEDD-JTQLQIEISA-N 348.515 1.607 10 10 EDCE CNCc1ccc(N2C[C@H]3OCC[C@]3(CO)C2)cc1Br 2296431021 IROJUIYEMZDNFD-HUUCEWRRSA-N 341.249 1.756 10 10 EDCE Cc1nc(Br)c([C@@H](O)[C@@H](N)c2ccccc2O)n1C 2337358926 KYXGNRHXDARCEF-JQWIXIFHSA-N 326.194 1.930 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](N)[C@@H](C)O)c(O)c1Br 2352648742 BANKYBXKJOJRQB-KCJUWKMLSA-N 331.210 1.130 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CCS2(=O)=O)c(O)c1Br 2352944823 MXPGIAPPDZXGOT-SECBINFHSA-N 348.218 1.266 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)cc1Br 2355336016 KCBSCCLWQDNUQP-VWQNXBSZSA-N 341.249 1.789 10 10 EDCE O=C(O)[C@]12CO[C@H](C1)[C@H](NCc1c(O)cccc1Br)C2 2359164114 PQGXPQXTWQKCBI-QKCSRTOESA-N 342.189 1.877 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3C[C@H](O)[C@H](O)C3)ccc(N)c2C1 306050516 PJVLIQCQLHSSNF-IYBDPMFKSA-N 349.431 1.104 10 10 EDCE COCCN(Cc1nnnn1C(C)C)c1ccc(OC)c(OC)c1 177130992 UECAPYUZLROBHV-UHFFFAOYSA-N 335.408 1.924 10 10 EDCE CCN[C@H](C)c1ccc(N2CC([C@@H](O)CO)C2)c(Br)c1 2361914049 QREWNLDQFISJGC-BMIGLBTASA-N 343.265 1.909 10 10 EDCE O=C(CNC(=O)c1cccnc1)NCCCSc1nccs1 129567684 VZJZOYUVVSJPSJ-UHFFFAOYSA-N 336.442 1.567 10 10 EDCE C[C@H]1CN(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c2ccccc21 60599881 OGRKKYNDNOBAML-BCPZQOPPSA-N 325.368 1.248 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC[C@H](C)[C@@H]3CO)CC2)cc1 248982504 VRBDATSSQUBERK-YJBOKZPZSA-N 347.459 1.047 10 10 EDCE C[C@]1(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCC(=O)NC1 281991643 VUOJGQVQODISEE-SFHVURJKSA-N 349.406 1.195 10 10 EDCE Cc1cc(O)c(CN[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)cc1C 800309822 SBWJZHYQCGRFEX-UKRRQHHQSA-N 326.462 1.817 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)C3CC(C(=O)O)C3)C2)cc1 819926735 JMFONGLRWCRAAZ-HSBZDZAISA-N 332.400 1.749 10 10 EDCE CCN1CN(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 823725518 DFOQHWDUFFJTKM-CQSZACIVSA-N 346.431 1.353 10 10 EDCE COC[C@](C)(CCO)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588396620 TVTVWWHSSPUORS-ZXYDQQDNSA-N 348.443 1.440 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCCC[C@@H]1CN1CCOCC1 588405026 IHXPSHXRDYOZTD-GMNBZTITSA-N 346.427 1.824 10 10 EDCE C[C@@H](NCCS(=O)(=O)N=S(C)(C)=O)c1c(O)cccc1F 903225674 HELJHNAVUDFJNW-SECBINFHSA-N 338.426 1.239 10 10 EDCE CN(C)c1ccc(/C=C/CN2CC(n3cc(C(N)=O)nn3)C2)cc1 839142251 FFMKDCWEPFNGKA-ONEGZZNKSA-N 326.404 1.013 10 10 EDCE CO[C@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)[C@@](C)(CO)C1 913658746 PJSSIAHGUTZGEH-QLJPJBMISA-N 337.397 1.924 10 10 EDCE CC[C@@H](CS(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)OC 849416477 AQMLIHZLAGLFIB-HIFRSBDPSA-N 342.461 1.618 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@]2(CCCNC2)C1 844223571 CQISGFDMABMRET-HXUWFJFHSA-N 344.503 1.787 10 10 EDCE COC[C@@]1(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCNC1 851639112 BHGLVOSQVPLCOL-KBXCAEBGSA-N 333.432 1.016 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)N2Cc3cccc(O)c3C2)CO1 927342938 SOXOZYQYTLWSFN-GFCCVEGCSA-N 349.387 1.968 10 10 EDCE CC(C)O[C@@]1(CS(=O)(=O)N[C@@H](C)c2ccccc2O)CCOC1 867836122 GQDYBUAUFBXJLB-BBRMVZONSA-N 343.445 1.957 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2cc(OC)ccc2O)C1 862551762 PLAKMNOHEIKGED-GFCCVEGCSA-N 328.434 1.162 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCNCCC1(C)C 866699949 VTJRMOVPABLHMP-UHFFFAOYSA-N 332.492 1.785 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)NCc2cccc(OC)c2O)c1 769508225 TWJUIJNWPACNBE-SREVYHEPSA-N 341.367 1.485 10 10 EDCE CC(C)N(Cc1ccc(N2CCN(C)CC2)c(F)c1)C[C@@H](O)CO 1118055563 ULGCOQDTZPDYSJ-MRXNPFEDSA-N 339.455 1.141 10 10 EDCE Cc1cc(O)c(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1C 872254741 COYSQFCJWUFRHD-INMHGKMJSA-N 331.416 1.376 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cccc2ncnc(O)c12 1150487259 CMQPBMRTJVSIRF-UHFFFAOYSA-N 325.324 1.719 10 10 EDCE COc1ccc(N(CC(=O)NC(N)=O)Cc2ccccc2)cc1OC 1308174881 XMEUGXMWJMMMQX-UHFFFAOYSA-N 343.383 1.905 10 10 EDCE CCOC(=O)CC[C@@H](C)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 1323492920 TYVCLZFJZOQRIL-CYBMUJFWSA-N 349.431 1.217 10 10 EDCE O=C1Nc2cc(N3C[C@H](F)[C@H](F)C3)c(Br)cc2[C@H]1O 714602279 ASXBZMDKAACEMM-VHSKPIJISA-N 333.132 1.931 10 10 EDCE Oc1c(Br)cccc1CN1CCN2CCOC[C@@H]2C1 757928721 WOWMBZODXGTXLW-LBPRGKRZSA-N 327.222 1.671 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@@H](C)C2CC2)cc1C 1332487273 GBJVUDYYWJCRSX-WMLDXEAASA-N 334.460 1.959 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cc3ccn(C)n3)CC2)cc1C 1269411659 PBGCAIKNMYUTJV-UHFFFAOYSA-N 342.443 1.718 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H](C(C)(C)C)[C@@H](O)C1 1261312800 DTYOQHNYSOODAU-ZBFHGGJFSA-N 348.443 1.606 10 10 EDCE CN(C)c1ccc(CNC(=O)Cc2nc(C3CCOCC3)n[nH]2)cc1 1347262675 SLICJCZKRVWMKO-UHFFFAOYSA-N 343.431 1.624 10 10 EDCE O=C(C(=O)N1CC[C@H]2CSC[C@@H]2C1)N1Cc2cccc(O)c2C1 1351961306 RCDCYHLIQOHAJO-STQMWFEESA-N 332.425 1.446 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cnc(N)c([N+](=O)[O-])c2)cc1F 1442469515 FIFHTIRPNQIHRL-UHFFFAOYSA-N 333.323 1.707 10 10 EDCE CC(C)(C)N1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CC1=O 1545304991 YBJNCEVYGAUNBM-LBPRGKRZSA-N 331.376 1.978 10 10 EDCE COc1ccc(CN[C@@H]2CC[C@H](CNC(=O)CNC(C)=O)C2)cc1C 1707098146 DEGCZDOHEYOKGX-DLBZAZTESA-N 347.459 1.514 10 10 EDCE COC[C@](C)(CC(=O)OC)NC(=O)c1ccc(N=NC(N)=O)cc1 1628951807 JRDKTAKKRRLBSF-HNNXBMFYSA-N 336.348 1.547 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N1CCCCC1=O 1556256777 AHQMDDOMIQBTGO-NSHDSACASA-N 331.376 1.980 10 10 EDCE Cn1nnc2c1CC[C@H](NC(=O)c1cc3cc(O)c(O)cc3s1)C2 1557237199 WFKFBCXLMMRTLA-VIFPVBQESA-N 344.396 1.728 10 10 EDCE COc1ccc(CNCC2(NC(=O)c3cnn[nH]3)CCCC2)cc1C 1481903127 WSYFSCFGMUHKNF-UHFFFAOYSA-N 343.431 1.954 10 10 EDCE O=C(CNC(=O)c1ccc(F)cc1F)NCc1cc(O)ccc1O 1558175148 FQOXJVZURADACW-UHFFFAOYSA-N 336.294 1.422 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCc1nc(N)n[nH]1 1637751678 BWJVDVFHFHCGQM-LLVKDONJSA-N 331.424 1.192 10 10 EDCE COCC(=O)N[C@H]1C[C@@H](C)N(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1738956619 GZWXPYVNCALBIZ-MFKMUULPSA-N 347.375 1.215 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@@H](C)NC(C)=O)C(C)C)cc1C 1732554897 ODAQOZYCDCQHMS-RHSMWYFYSA-N 349.475 1.759 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CCCN(CC(F)(F)F)C1 1647270240 PAQVPZWUFKFHFE-SNVBAGLBSA-N 332.322 1.988 10 10 EDCE CC[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)COC 1746167455 VFOGFLBKEICYOA-NSHDSACASA-N 335.364 1.120 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@H]2CCCNC2=O)cc1C 1668097363 UXRYTSVGWQVFKM-HOCLYGCPSA-N 347.459 1.514 10 10 EDCE C[C@H](CO)[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 153807026 MYKRVZSVWJANTB-OLZOCXBDSA-N 339.411 1.478 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)C2(C(=O)O)CC2)c2nccn2C)cc1 1866033246 FRANUZKQYDOHQT-CQSZACIVSA-N 342.399 1.557 10 10 EDCE C[C@@H](CO)N(Cc1ccccc1)c1cc2c(cc1N)OCC(=O)N2 1914366612 VUIJBIYKYKXFRV-LBPRGKRZSA-N 327.384 1.987 10 10 EDCE CC(C)(C)OC(=O)N1CCC(NCc2ccccc2O)(C(N)=O)CC1 1922600536 FLIYSCCWDFYLBH-UHFFFAOYSA-N 349.431 1.737 10 10 EDCE C[C@@H](c1cc(Br)ccc1O)N1CCN2C(=O)NC[C@H]2C1 228178531 NKJIYOANCUTPPY-ONGXEEELSA-N 340.221 1.925 10 10 EDCE CCNCc1ccc(N2CCOC[C@@H]2CO)c(Br)c1 233531612 AXZGFVBPXAREFX-LBPRGKRZSA-N 329.238 1.756 10 10 EDCE C[C@H](O)[C@H](N)C[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952234090 MWALDXSZLGOLSU-WCFLWFBJSA-N 340.420 1.632 10 10 EDCE CC[C@](COC)(NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003169011 ILBKAIWQVQAVTE-PSTGCABASA-N 342.436 1.572 10 10 EDCE O=S(=O)(NCc1ccccc1O)N1CC(OCc2ccccc2)C1 1998738547 LVCQWEZIIWDOJB-UHFFFAOYSA-N 348.424 1.628 10 10 EDCE C[C@H](NC(=O)C1(NC(=O)OC(C)(C)C)COC1)c1ccccc1O 2017517360 UJKNAGXTZMSUOJ-NSHDSACASA-N 336.388 1.863 10 10 EDCE CN1C(=O)[C@H](O)c2ccc(N(CCC(N)=O)Cc3ccccc3)cc21 2034745160 AMNATLIMWJFCCJ-GOSISDBHSA-N 339.395 1.578 10 10 EDCE Nc1ccc(N2CCN(C[C@@H](O)COCc3ccccc3)CC2)cc1 2038121150 ZWASYPMDXISWEG-HXUWFJFHSA-N 341.455 1.969 10 10 EDCE CS(=O)(=O)CC1CN(c2ccc(CN)c(Br)c2)C1 2041503872 VAOQIZIKWWYATF-UHFFFAOYSA-N 333.251 1.389 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3[C@H]4CCCO[C@@H]4C3(C)C)c2n1 2062518261 KIYLVULFJSJBOO-HONMWMINSA-N 330.388 1.677 10 10 EDCE CNCc1ccc(N2CC(C(=O)NC3CC3)C2)cc1Br 2168055153 KPGXHAGAWDIJSF-UHFFFAOYSA-N 338.249 1.883 10 10 EDCE CNCc1ccc(N2CCN(C3CC3)C(=O)C2)c(Br)c1 2170583202 LIZNLRFZHMDLOR-UHFFFAOYSA-N 338.249 1.980 10 10 EDCE OC[C@]1(NCc2cccc(Br)c2O)C[C@H](O)C12CCC2 2193964898 CWJFCYJUMDUXLD-SWLSCSKDSA-N 342.233 1.910 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CN(CCCN=[N+]=[N-])C[C@@H]2[C@H]1CO 2211158656 QFOKUOLAESNMIS-RWMBFGLXSA-N 325.413 1.846 10 10 EDCE CS(=O)(=O)[C@@H]1CC[C@H]1NCc1c(O)cccc1Br 2319821362 APYWOKWZWHLCMI-ZYHUDNBSSA-N 334.235 1.820 10 10 EDCE Cc1ccc(CN2C[C@H](CO)C[C@H]2CO)c(O)c1Br 2352686194 JJRSKOZPJNRLHH-PWSUYJOCSA-N 330.222 1.638 10 10 EDCE CN1CCN(c2cc(C(=O)N(C)Cc3ccccc3O)ccn2)CC1 120243019 PNIZPBMESZLMKX-UHFFFAOYSA-N 340.427 1.811 10 10 EDCE O=S(=O)(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C1CC1 123941338 DUAOIXRDRFGFIJ-UHFFFAOYSA-N 349.500 1.800 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnc(C)[nH]c3=O)CC2)cc1 82322162 BNSTUTGYHVFXOR-UHFFFAOYSA-N 328.372 1.049 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@H]3C(=O)NCC[C@@H]3C)CC2)cc1 194036185 GZAZSSDBOBFBDQ-XJKSGUPXSA-N 346.431 1.051 10 10 EDCE Cc1ccc(CNC(=O)c2nn(C)cc2N)c(O)c1Br 2381131604 PZLZEFBXNSUWBQ-UHFFFAOYSA-N 339.193 1.709 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](NC(=O)c1ccco1)c1ccccc1 808494454 ZNLABUFBKUULPL-HNNXBMFYSA-N 329.308 1.452 10 10 EDCE CN(C)c1ccc(CNC(=O)N(C)[C@@H]2CCN3CCO[C@H]2C3)cc1 296471390 WBSJEHAPCOFXSH-SJORKVTESA-N 332.448 1.367 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC4(CC3)OCCCO4)cc2N1 814921255 XSDISKXLMFPGQD-UHFFFAOYSA-N 349.343 1.659 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCO[C@@H](C(=O)C3CC3)C2)c1O 811502267 OJTLSDWMRZRJOF-CYBMUJFWSA-N 336.344 1.489 10 10 EDCE CO[C@@H]1C[C@H]1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 829668413 MQJHVWRFJFBYKP-HZPDHXFCSA-N 331.416 1.039 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@]12C[C@H]3C[C@H](C(=O)N1)[C@H]2C3 845113588 BILIOTRFUZENBY-HWLIBYHHSA-N 327.428 1.626 10 10 EDCE C[C@H]1CCCc2nc(S(=O)(=O)NCCc3ccc(N)cc3)cn21 842820940 AOPWNZUSSOWITB-LBPRGKRZSA-N 334.445 1.884 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@H]1CC[C@H](C(F)(F)F)NC1=O 928712289 QHLFIFPMQCLGFW-RDDDGLTNSA-N 334.269 1.605 10 10 EDCE COc1ccc(O)c(CNC[C@@H]2CS(=O)(=O)c3ccccc3O2)c1 843417551 HWKHPSLWQFCPIG-CQSZACIVSA-N 349.408 1.725 10 10 EDCE Cc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2C2CCOCC2)c1 927631733 WIGJGPGGERWDIU-INIZCTEOSA-N 333.432 1.753 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCN(c3nccnn3)CC2)c1O 859407340 HMBLZGLYQCGUDX-UHFFFAOYSA-N 347.806 1.755 10 10 EDCE COC(=O)[C@@H]1CC[C@H](C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 855225049 NMEQAXSVPYAKIY-ZNMIVQPWSA-N 346.427 1.979 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](C)[C@H]3CO)C2)cc1 854298306 ABJOSFMYGBXHHE-JKIFEVAISA-N 333.432 1.686 10 10 EDCE CN(C)C(=O)c1cc(S(=O)(=O)Nc2ccc(O)cc2F)cn1C 758169051 LEFNMXBKOFESFC-UHFFFAOYSA-N 341.364 1.372 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC3CCC(N)CC3)C2)cc1 851666097 YJSLMCQZKVFUJL-YMAMQOFZSA-N 332.448 1.843 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(C(=O)Nc2ccc(N)cc2)C1 859698350 UNNBDWCDCTUZQP-LLVKDONJSA-N 326.422 1.062 10 10 EDCE COC[C@]1(C)CN(Cc2ccc([N+](=O)[O-])c(OC)c2O)CCO1 862551760 PIJLWCRYRXPLTO-HNNXBMFYSA-N 326.349 1.546 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)NCc2cc(Cl)ccc2O)C[C@H]1C 869147223 OSUKNEPKKGLOQX-BZHVJNSISA-N 327.764 1.628 10 10 EDCE CC[C@@H]1NCC[C@H]1NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 861670622 HTQKHVJRPKWQMO-RRQGHBQHSA-N 332.448 1.714 10 10 EDCE CCC1(N2CCOCC2)CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1454476713 GNJYDKHICFTQRD-UHFFFAOYSA-N 348.443 1.744 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1C[C@@H](OC(C)(C)C)C1 1118167840 XZSMRHPKNBPZLL-OKILXGFUSA-N 334.416 1.813 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H](N)CC3CC3)CC2)cc1 884234789 DHRVKGXDSQSDLM-SFHVURJKSA-N 346.475 1.061 10 10 EDCE CC[C@@](COC)(NC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)OC 1141836209 DTVBNXKFJIXEOQ-HNNXBMFYSA-N 336.348 1.547 10 10 EDCE CNCc1ccc(N2C[C@H](CO)[C@@H](CO)C2)cc1Br 704810157 KMLAYWLHNODFLZ-VXGBXAGGSA-N 329.238 1.206 10 10 EDCE C[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)[C@H]1CCO 1329872278 APYDTUVHETWMJL-DOMZBBRYSA-N 332.400 1.244 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H](F)[C@@H](F)C3)c(Br)cc21 714733743 IJXRFKJLCTUZKM-LAEOZQHASA-N 332.148 1.897 10 10 EDCE C[C@H](NC(=O)NCCCN1C(=O)NC(C)(C)C1=O)c1ccccc1O 1256412314 PRSDBCBIYXFELU-NSHDSACASA-N 348.403 1.473 10 10 EDCE COCCN(CCF)C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1330472856 LAABTFLLHAHERW-UHFFFAOYSA-N 339.411 1.156 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC3CC2(C)C3)cc1 1330009558 IAAVPSKRSDWXIR-UHFFFAOYSA-N 345.443 1.601 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C)C[C@@H]2CO)cc1Br 699487481 RCTIGVKCPJABDR-ZYHUDNBSSA-N 328.254 1.582 10 10 EDCE CCN(C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)[C@H]1CCCOC1 1332787907 GWQSIADZTUICCU-YOEHRIQHSA-N 347.459 1.957 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N2CC[C@H]3CC[C@@H](C2)S3)cc1 1331744713 OEAOCFQRCFHGJL-CABCVRRESA-N 333.457 1.424 10 10 EDCE CO[C@@H](CS(=O)(=O)NCc1cc(C)ccc1O)C1CCOCC1 1261797101 WVWHTCIJXKSNIW-INIZCTEOSA-N 343.445 1.562 10 10 EDCE COc1nc(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)co1 1266959821 XMJSOVKDOUWQLT-LBPRGKRZSA-N 333.388 1.908 10 10 EDCE O=C(CCCn1c(O)nnc1O)NCc1c(O)ccc2c1CCCC2 1445898921 GOXZJJWQQJYAIN-UHFFFAOYSA-N 346.387 1.370 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 1294331526 BWFODIJJIINKRB-CWRNSKLLSA-N 330.428 1.973 10 10 EDCE Cn1ccnc1COCC(=O)NCc1ccc2cccnc2c1O 1451953058 KWIFPFKZEAUTKG-UHFFFAOYSA-N 326.356 1.507 10 10 EDCE Cn1nc(C(=O)NCc2ccc(O)cc2O)cc1Br 1469160887 WDGLSQMGAKUORV-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE NCc1ccc(N2CC[C@@H](N3CCOCC3)C2)c(Br)c1 212982365 VSSBPTFSGRZBAQ-CYBMUJFWSA-N 340.265 1.819 10 10 EDCE CN(C)C(=O)COc1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 1544483356 YPZUDBGAYQIJEE-UHFFFAOYSA-N 344.367 1.746 10 10 EDCE Cc1nc(Cn2cc(C(=O)N[C@H](C)c3ccccc3O)nn2)no1 1557966651 LVPXWCZLVXLHBG-SECBINFHSA-N 328.332 1.214 10 10 EDCE CC[C@H]1CN([C@H](CC)C(=O)NCCc2ccc(O)c(O)c2)CCO1 1630335064 JYCUPNXJYHTZQJ-LSDHHAIUSA-N 336.432 1.646 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@]2(F)CCOC2)cc1C 1732356486 LOGPOZUDTAKJPP-SCLBCKFNSA-N 338.423 1.974 10 10 EDCE CC[C@H](CNC(=O)Cn1cncn1)NCc1ccc(OC)c(C)c1 1665882848 DTYRRNBAHPNPND-OAHLLOKOSA-N 331.420 1.280 10 10 EDCE COc1cccc([S@](=O)CC(=O)NCc2ccc(O)c(O)c2)c1 1595595636 IOFSYHTYMJRINZ-HSZRJFAPSA-N 335.381 1.530 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)Cc2ccc[nH]2)cc1C 1677137974 HOCVINANAQPQJR-QGZVFWFLSA-N 345.443 1.483 10 10 EDCE CCN1C(=O)/C(=C/C=C\c2ccccc2[N+](=O)[O-])C(=O)NC1=S 5926387 LQMOGSZBRIMXNJ-UKJSTWFMSA-N 331.353 1.798 10 10 EDCE COc1ccc(NC(=O)CCN2C(=O)CSC2=S)cc1OC 1865767983 GUCUPWBSDWLBSO-UHFFFAOYSA-N 340.426 1.893 10 10 EDCE CCOc1cccc(CNCCC(=O)N2CCC[C@H]2C(=O)O)c1O 1857864058 UJCUUHNYVNMOQZ-ZDUSSCGKSA-N 336.388 1.346 10 10 EDCE CCOC(=O)[C@H]1CCCN(C(=O)CCNCc2cc(C)ccc2O)C1 1857864226 CMQGTINITVIVHG-HNNXBMFYSA-N 348.443 1.982 10 10 EDCE Cc1c(OCCC(N)=O)c(=O)ccn1CCOc1ccc(N)cc1 1857919530 KXVOXKVWJAXCON-UHFFFAOYSA-N 331.372 1.072 10 10 EDCE COCc1noc(CNCc2cccc(Br)c2O)n1 1926336901 ZIWOQLWOBIOXTD-UHFFFAOYSA-N 328.166 1.974 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1C[C@@H](O)CO1 1952208708 MHFSEPFCMWXTCF-LALPHHSUSA-N 339.388 1.683 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1990031668 BTAYESPMJYXWFA-QWRGUYRKSA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1990024746 UWFUHWHPCTXYGR-WDEREUQCSA-N 327.385 1.563 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](CO)C[C@@H]2CO)cc1Br 2146084073 XHNZZRAIQUBXSX-NQBHXWOUSA-N 343.265 1.909 10 10 EDCE CC(C)(C)OC(=O)NCCCONC(=O)COc1ccc(N)cc1 1999140046 DTVXTYYFGNPNBD-UHFFFAOYSA-N 339.392 1.610 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010406618 WVNSWYDSFMBNEL-IJLUTSLNSA-N 339.396 1.827 10 10 EDCE COCCNCc1ccc(N2CC(C)(O)C2)c(Br)c1 384031666 GQDVJFCTLSMAIO-UHFFFAOYSA-N 329.238 1.756 10 10 EDCE CN1CCN(CCc2ccc(N)cc2)[C@H](CNC(=O)C(F)(F)F)C1 2044676697 GXORVSWYCZDKCD-CQSZACIVSA-N 344.381 1.106 10 10 EDCE CCOC1(C(=O)O)CN(Cc2c(O)cccc2Br)C1 2114383563 AOWJURORYHEKMU-UHFFFAOYSA-N 330.178 1.830 10 10 EDCE CN1C(=O)O[C@H]2CN(Cc3cccc(Br)c3O)C[C@H]21 2120401612 MQNLPOCDWDKDQV-MNOVXSKESA-N 327.178 1.790 10 10 EDCE Cc1cccc2c1NC(=O)C2=C1SC(=S)N([C@H](C)C(=O)O)C1=O 2293308608 HZBANZUPRUKHMU-SSDOTTSWSA-N 348.405 1.992 10 10 EDCE CCNCCCN(C)S(=O)(=O)NCc1cnc(SC)s1 2284689002 MSFYSTYXHJSJOY-UHFFFAOYSA-N 338.524 1.131 10 10 EDCE Cc1ccc(CNC(=O)C2=CCNCC2)c(O)c1Br 2352948961 WSMMQKPGVXBNFX-UHFFFAOYSA-N 325.206 1.999 10 10 EDCE COc1ccc(O)c(CNC(=O)NCCc2c(C)nn(C)c2C)c1 114589409 XPJFHYGGZXWNRL-UHFFFAOYSA-N 332.404 1.793 10 10 EDCE Cn1c(=O)c(C2=NNC(=O)/C2=C/c2ccco2)c(O)c2ccccc21 100260994 XILHIWSDODVJRU-FMIVXFBMSA-N 335.319 1.755 10 10 EDCE COC(=O)CN1C(=O)/C(=C2\C(=O)Nc3c(C)cccc32)SC1=S 102603842 IEKBZEZMFNGXLK-ZRDIBKRKSA-N 348.405 1.692 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CCCCC3=O)CC2)cc1 74695824 COAYXUWRPYNKPS-UHFFFAOYSA-N 331.416 1.356 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCCC[C@@H]1CN1CCOCC1 180769509 IHXPSHXRDYOZTD-BIENSFFJSA-N 346.427 1.824 10 10 EDCE Cn1cc(/C=C/C(=O)N(CC2CC2)c2ccccc2)c(=O)n(C)c1=O 84281629 UVZBYCSRCJUHBS-ZHACJKMWSA-N 339.395 1.540 10 10 EDCE Cc1c(CNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)cnn1C 255440647 FWPREZNNBZMHHY-YVMONPNESA-N 340.427 1.895 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@H](C2CC2)O1 366507633 VOAKFVQFPPXFAF-PSLIRLAXSA-N 333.344 1.929 10 10 EDCE CN(CC1(CO)CC1)C(=O)NCc1ccc(N2CCOCC2)cc1 275563649 BFNVSJHPRNNUHQ-UHFFFAOYSA-N 333.432 1.437 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNCCCCN2CCOCC2)c1O 278928146 VWNFSUIJAVKRQL-UHFFFAOYSA-N 339.392 1.511 10 10 EDCE CCCC[C@@H](NC(=O)NCC)C(=O)NCCc1ccc(O)c(O)c1 271266290 WFSSRSBTBYMKOP-CYBMUJFWSA-N 337.420 1.634 10 10 EDCE CNC(=O)C1(C(=O)NCc2cc(Br)ccc2O)CCC1 804739294 FDONKSOOYWTRGU-UHFFFAOYSA-N 341.205 1.687 10 10 EDCE COc1cc(CC(=O)NCc2ccc(N3CCOCC3)cc2)ccn1 816897284 CHMLGJXAQYDWJO-UHFFFAOYSA-N 341.411 1.786 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCNC(=O)CC3)CC2)cc1F 815773643 VEQJKYGDTOQNEG-ZDUSSCGKSA-N 349.406 1.399 10 10 EDCE CN1C[C@@H](O)C[C@]1(C)C(=O)NCc1ccc(N2CCSCC2)cc1 900254345 GSNMYCWTUKNJDU-FUHWJXTLSA-N 349.500 1.311 10 10 EDCE CCCN(Cc1cc(O)n2ncc(C(=O)O)c2n1)C[C@@H]1CCCCO1 737828187 JSUFASRJGXLEBA-ZDUSSCGKSA-N 348.403 1.914 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@]3(C)C[C@@H](O)CN3C)C2)cc1 911277002 QLTDDMUESKHTMY-OGWOLHLISA-N 347.459 1.093 10 10 EDCE Cc1cc(CC(=O)NC[C@@](C)(O)C(=O)O)c(C)n1-c1ccccc1 911473586 SVYAPCNPQHUUBK-GOSISDBHSA-N 330.384 1.588 10 10 EDCE Cc1cc(O)c(CN2CCS(=O)(=O)[C@H]3COCC[C@H]32)c(Cl)c1 840952532 DFFVMJBCMJJRIL-HIFRSBDPSA-N 345.848 1.742 10 10 EDCE C[C@@H]1COC[C@H]1N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 688243184 LGPBOFCAWZUQKO-BLBGDKDGSA-N 340.221 1.872 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCc2nccnc2C1 852699135 BQXSNICCXKUGFE-UHFFFAOYSA-N 339.443 1.559 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@@H]3CN4CCC[C@H]3C4)cc2)C1 924726891 RNTJEDOCIGNGNQ-YQVWRLOYSA-N 342.487 1.572 10 10 EDCE O=C(COCC(F)F)NCc1ccc(N2CCC(O)CC2)c(F)c1 859734356 QUNLPBMDBXEXRH-UHFFFAOYSA-N 346.349 1.685 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CCCCN3)C2)cc1 851660966 CBCDNFMNYYRWKV-CABCVRRESA-N 332.448 1.715 10 10 EDCE Cc1ccc(O)c(CN2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1 863642048 INGDRQAYORUSLH-WBVHZDCISA-N 331.416 1.458 10 10 EDCE COc1cc(Cl)cc(CN(C)CCN2CCCS2(=O)=O)c1O 761201691 CQSGHWXCDRUHSA-UHFFFAOYSA-N 348.852 1.522 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1OCC[C@@H]1CNC(=O)OC(C)(C)C 1895876676 XMSBIVVPYIKOMQ-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NCc1cc(O)ccc1O 1153885856 QAJNNQXBOQZGDS-AWEZNQCLSA-N 337.420 1.836 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2oc(O)nc2n1 1154026097 LKNNLAUREGPIGB-QMMMGPOBSA-N 329.312 1.701 10 10 EDCE CCN(CC(=O)N1CCCCCC1)C(=O)Cc1ccc(O)c(O)c1 1157084885 PWZMKTLKFCIONU-UHFFFAOYSA-N 334.416 1.891 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1[C@H]2CCC[C@H]21 1327496618 XROUVPXULDLUQJ-FVQHAEBGSA-N 327.428 1.818 10 10 EDCE COC[C@@](C)(CO)N(C)c1ccc(CN)c(Br)c1F 689780724 ODTBOHNREQVPPD-CYBMUJFWSA-N 335.217 1.881 10 10 EDCE COC(C)(C)[C@@H](C)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1332903065 QVKUPKFRTCPDHR-CQSZACIVSA-N 345.443 1.609 10 10 EDCE C[C@H](NC(=O)C(=O)N1C[C@@H]2COC[C@]2(C)C1)c1ccc(N(C)C)cc1 1330967338 AZRZSLHRZUMVKP-OHNRDTAOSA-N 345.443 1.425 10 10 EDCE COC(C)(C)[C@H](C)NC(=O)C(=O)NCCCSc1nccs1 1340714805 VNQOUXOAAUBPJD-JTQLQIEISA-N 345.490 1.671 10 10 EDCE C[C@@]1(NC(=O)NCc2cc(Br)ccc2O)CCOC1=O 1352140859 XERQSAVEDUKPGG-CYBMUJFWSA-N 343.177 1.660 10 10 EDCE Cc1ccc(C(=O)NCc2nn(C)cc2Br)c(O)c1O 1449842871 GFVZCOKPFODLQF-UHFFFAOYSA-N 340.177 1.832 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2nnn(Cc3cc(C)on3)c2C)c1 1453648514 JLOIOUPNSANUOV-UHFFFAOYSA-N 341.371 1.875 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCc2cn(C)nn2)cc1C 1715963199 FCGGJVJLDBREAF-CQSZACIVSA-N 345.447 1.359 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)[C@H]1C[C@H](O)C1 2122886138 KDJGBEPLZJXOND-NQYJQULFSA-N 326.194 1.361 10 10 EDCE O=C1NCCN(C(=O)Cc2ccc(O)c(O)c2)[C@@H]1CC1CCCCC1 1638273917 OTLWATPVWFNDSQ-OAHLLOKOSA-N 346.427 1.938 10 10 EDCE C[C@H](NC(=O)c1cc(S(C)(=O)=O)ccc1N)c1ccccc1O 1632255794 WACHHNXWVWFOLD-JTQLQIEISA-N 334.397 1.869 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cc(C)no1 1567306461 PFZUWRGNOJHRGU-ZDUSSCGKSA-N 348.355 1.227 10 10 EDCE COC(=O)[C@H](Cc1ccccc1O)NC(=O)c1ccc(C)c(O)c1O 1646064891 JVGHJYSRILJISO-ZDUSSCGKSA-N 345.351 1.626 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1670114406 NDSVQSSWARWVON-MRXNPFEDSA-N 347.459 1.420 10 10 EDCE CC[C@H](NC(C)=O)C(=O)N(C)CCNCc1ccc(OC)c(C)c1 1691483535 IQYSRMZPTMPMDI-INIZCTEOSA-N 335.448 1.466 10 10 EDCE CCCN1CC[C@@](O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1699908784 YJDNKMIZHIYFDK-MRXNPFEDSA-N 333.392 1.426 10 10 EDCE O=C(CN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)NCCO 16905450 MJCNLWUIOHECCD-XOHVCTMJSA-N 348.449 1.553 10 10 EDCE CC(=O)O[C@H]1[C@H](OC(C)=O)[C@H](N=[N+]=[N-])CO[C@@]12COC(C)(C)O2 165118017 YWEMWEKIXSKBDT-HNCHTBHHSA-N 329.309 1.038 10 10 EDCE CNC(=O)[C@H]1CCCN1C(=O)NCCCSc1nccs1 159834457 NIGWFZSXIRTIPV-SNVBAGLBSA-N 328.463 1.545 10 10 EDCE COC(=O)C1CCN(C(=O)CNCc2ccc(N(C)C)cc2)CC1 1857865681 ZKMSXZSXRHZGPK-UHFFFAOYSA-N 333.432 1.254 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NCC=CBr)cc1 1925913241 SGWDGRARIAKTBM-UHFFFAOYSA-N 335.223 1.476 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H](N)C1(O)CC1 1952671352 UCEGKIDSMQJNIF-FZMZJTMJSA-N 338.404 1.386 10 10 EDCE CC(C)(C)OC(=O)N1CC(F)(CNC(=O)Cc2ccc(N)cc2)C1 1999146411 KQJUWCYCAGFIRK-UHFFFAOYSA-N 337.395 1.887 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCCN(Cc2cc(N)ccc2O)C1 1999478090 QGVOPNZMLCDXSM-AWEZNQCLSA-N 337.420 1.700 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NCc2ccc(F)c(F)c2O)[C@H](O)C1 2011486489 BETFKGNVFOFVKO-NWDGAFQWSA-N 344.358 1.740 10 10 EDCE C[C@H](CNC(=O)OC(C)(C)C)N(C)C(=O)c1cc(O)c(O)c(O)c1 2015120941 YQIKDTYFWZNVGC-SECBINFHSA-N 340.376 1.789 10 10 EDCE CC(C)(C)OC(=O)NCc1n[nH]c(=NCc2cc(F)ccc2O)o1 2024248075 YMIQUJFWCZFHCP-UHFFFAOYSA-N 338.339 1.973 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3Cc4conc4C3)c(Br)cc21 2160432110 XVNZLPMFUDXIKC-GFCCVEGCSA-N 335.161 1.909 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)C1CCC(Cn2cnnn2)CC1 2068662478 DWBQQRIMBKPCAS-UHFFFAOYSA-N 345.403 1.250 10 10 EDCE COc1cccc(O)c1CNCCc1nnc(Br)n1C 2185198886 YUBRNVBMNFWQJS-UHFFFAOYSA-N 341.209 1.624 10 10 EDCE COc1ccc(N2CCC[C@H]2[C@H](O)CO)c(OC)c1Br 2234900143 RTHHNWAMRWUQKV-GXSJLCMTSA-N 346.221 1.788 10 10 EDCE COc1ccc(N2CC[C@](O)(CO)C2)c(OC)c1Br 2226550175 XFJBXJBBIDXFPA-CYBMUJFWSA-N 332.194 1.400 10 10 EDCE CN1CC2(CCN2c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2238596339 GOQDFTNGOKKZAU-LBPRGKRZSA-N 338.205 1.329 10 10 EDCE OCc1ccc(N2C[C@H]3OCCC[C@]3(CO)C2)cc1Br 2239155204 JDOZWGBZUNQMRY-HUUCEWRRSA-N 342.233 1.919 10 10 EDCE CCCCN1C(=O)NC(=O)C(=CNc2ccc(NC(C)=O)cc2)C1=O 2296125829 OQUXPYCXJMSUOE-UHFFFAOYSA-N 344.371 1.819 10 10 EDCE Cc1cc(C)c(N2C(=O)NC(=O)C(=CNCCCO)C2=O)c(C)c1 2296754928 UCCWZKZFUSSHRH-UHFFFAOYSA-N 331.372 1.051 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1CC[C@@H](O)CN1C(=O)OC(C)(C)C 2300532150 QTFJKMOKLWNAOW-NEPJUHHUSA-N 341.412 1.906 10 10 EDCE C[C@H](O)[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(F)cc2)SC1=S 2323823836 RIFIHEFTUCZHRO-CPCISQLKSA-N 341.385 1.861 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](O)CCN)c(O)c1Br 2352650743 JPWZYASOMPWNTH-JTQLQIEISA-N 331.210 1.131 10 10 EDCE Cc1ccc(CN2C[C@H](CO)[C@@H](CO)C2)c(O)c1Br 2352678892 JEDMTOTZZUVBJN-VXGBXAGGSA-N 330.222 1.496 10 10 EDCE CNS(=O)(=O)CCCN(Cc1ccccc1O)C[C@H]1CCCO1 111232871 KYFCAEFZIFXNIP-OAHLLOKOSA-N 342.461 1.313 10 10 EDCE CCN(CC)c1ccc(-c2nc3c([nH]2)c(=O)n(C)c(=O)n3C)cc1 21359601 LHUFYLPBFMWPQM-UHFFFAOYSA-N 327.388 1.474 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1c(=O)[nH]c2ccccc21 183424340 BATUKBLRPUEKLN-NSHDSACASA-N 341.367 1.488 10 10 EDCE CC[C@H](CO)N1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 93739922 VHCVFHQPDYUSJN-CYBMUJFWSA-N 343.811 1.842 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@]3(CNC(=O)C3)C2)cc1F 376084011 PPYUAMLSBFPBHU-KRWDZBQOSA-N 334.395 1.313 10 10 EDCE CO[C@@H]1C=CCN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2165061804 LWATWLYPIQHXLU-AMIZOPFISA-N 339.189 1.826 10 10 EDCE CC[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CCO1 817828641 KVGYQTYIQGCJQH-NVXWUHKLSA-N 347.459 1.751 10 10 EDCE CN1CCCC[C@@H]1CN1CCN(C(=O)Cc2ccc(N)cc2)CC1 828932227 NVEWZYLGOGEYNB-GOSISDBHSA-N 330.476 1.440 10 10 EDCE O=C(NCc1cc(Br)ccc1O)[C@H]1CCCS1(=O)=O 848068131 GQFBUJDOHRBRQT-LLVKDONJSA-N 348.218 1.348 10 10 EDCE CCON(C)C(=O)CNCc1cc(C)cc(Br)c1O 846064843 MUZYDIAMZYEFCS-UHFFFAOYSA-N 331.210 1.963 10 10 EDCE COC(=O)CCN1CCC[C@@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1=O 849319856 HEURQKSDYYFPMZ-WMLDXEAASA-N 347.459 1.957 10 10 EDCE c1cnc(N[C@@H]2CCN(Cc3ccc(N4CCOCC4)cc3)C2)nc1 843414917 GALDBUGHQJRLQP-QGZVFWFLSA-N 339.443 2.000 10 10 EDCE COC(=O)[C@H]1CN(C)CCN(C/C=C/c2ccc(N(C)C)cc2)C1 840958663 QZJQBFMDZDLWGJ-RTRPANQVSA-N 331.460 1.802 10 10 EDCE COC(=O)CCCN1C(=O)/C(=C\c2ccnc(C)n2)SC1=S 841496840 SWYXJURBEKBZER-DHZHZOJOSA-N 337.426 1.939 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@@H]3[C@@H](C)O)C2)cc1 854297519 RTYSOHYWMAMDHB-CKEIUWERSA-N 333.432 1.829 10 10 EDCE COc1cc(Br)cc(CN2CCOC3(CNC3)C2)c1O 853249157 NXCFJCOPILBQSL-UHFFFAOYSA-N 343.221 1.338 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3C[C@H](C(=O)OC)C3)C2)cc1 854298055 ZRTVCAVKQMIHBD-IHRRRGAJSA-N 347.415 1.525 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cn3ccc(C)cc3=O)C2)cc1 855223304 FEZRRZDLWTXAMD-OAHLLOKOSA-N 341.411 1.560 10 10 EDCE CCC(=O)N1CSC[C@H]1C(=O)NCc1ccc2cccnc2c1O 862027948 KREAHWQPOIUXMJ-ZDUSSCGKSA-N 345.424 1.868 10 10 EDCE C[C@@H](C(=O)NCc1cc(Br)ccc1O)[C@@H]1CCC(=O)N1 861687345 MKDCXTBBHINZBF-KCJUWKMLSA-N 341.205 1.686 10 10 EDCE CCN1CC[C@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)[C@@H](C)C1 1118946401 ZQCCHOWJPCZMMS-BBRMVZONSA-N 345.443 1.423 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@@H](C[C@H]1COCCO1)C(F)(F)F 1123890133 UIGJCSQGLFYZTP-WDEREUQCSA-N 349.305 1.698 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)NCC[C@H]1CCCO1 786595320 CKCBAZXJTGAFCC-LLVKDONJSA-N 343.474 1.427 10 10 EDCE COC(=O)[C@]1(O)CCN(Cc2ccc(N(C)C)cc2C(F)(F)F)C1 895702682 DYEHVFWVAPDCAX-HNNXBMFYSA-N 346.349 1.881 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H]1CCOC1 1317290304 QVMFRWJAHPTOIK-NEPJUHHUSA-N 333.392 1.593 10 10 EDCE Cc1cc(O)cc(=O)n1CC(=O)NCc1ccc2cccnc2c1O 1162607198 KFQJKTDKPSHHLS-UHFFFAOYSA-N 339.351 1.433 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CCC2)cc1C 1326823090 RDOFSXWUOBGVCO-HUUCEWRRSA-N 347.415 1.797 10 10 EDCE Cc1cc([C@H]2CCCN2C(=O)C(=O)N2Cc3cccc(O)c3C2)no1 1329405639 WRBRGAKQANAEOS-OAHLLOKOSA-N 341.367 1.895 10 10 EDCE C[C@@H](c1cc(Br)ccc1O)N1CC[C@H](NC(N)=O)C1 690733517 RLFZUDLFJZTCHN-WPRPVWTQSA-N 328.210 1.958 10 10 EDCE CN1CCN(c2ccc(CNCC[C@H]3CNC(=O)C3)cc2F)CC1 1334329261 ACDAOMOSIGAUJJ-OAHLLOKOSA-N 334.439 1.193 10 10 EDCE CC[C@@H](NCCc1nnnn1C)c1cc(Br)ccc1O 775519647 NBFJSZOQUGSRBL-LLVKDONJSA-N 340.225 1.962 10 10 EDCE CC(C)(C)N1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1351827806 OUZVLOHCAOMDLV-UHFFFAOYSA-N 331.416 1.177 10 10 EDCE CC1(C(=O)NC[C@@H]2CCN2C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1285863665 SYGFUZFZOKMGAT-ZDUSSCGKSA-N 343.387 1.980 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCCN1CCOCC1 1511781280 YHRWNSOMIUCHSN-UHFFFAOYSA-N 345.447 1.651 10 10 EDCE COc1cc(N2CCOC3(CCOCC3)C2)c([N+](=O)[O-])cc1OC 1458266625 OVABDCNQSJNLOM-UHFFFAOYSA-N 338.360 1.998 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2CN(C)CCO2)cc1C 1714464088 OMBGWIVJTKTPTK-QAPCUYQASA-N 349.475 1.319 10 10 EDCE O=C1CC[C@@H](c2ccc(C(=O)NCc3ccc(O)cc3O)cc2)N1 1626849972 MFPMSBLLXGCPBN-HNNXBMFYSA-N 326.352 1.979 10 10 EDCE Cc1cc(C(=O)N[C@@H](CO)[C@@H]2CCOC2)c(C)n1-c1ccccn1 1624224761 GCOJUEZUIYRAIQ-ZBFHGGJFSA-N 329.400 1.616 10 10 EDCE Cn1cc(C(=O)NCc2cccc(Br)c2O)nc1O 1568606033 WHIQJRIKWVBPKO-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE O=C(CCCc1nn[nH]n1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1632399328 QWDLFXTXBLYVQK-AWEZNQCLSA-N 345.403 1.436 10 10 EDCE COc1cc(N2CCN(c3nc[nH]n3)CC2)c([N+](=O)[O-])cc1OC 1651996268 QQBJEABISBZVJH-UHFFFAOYSA-N 334.336 1.057 10 10 EDCE C[S@@](=N)(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1594850449 YLNCQEKMBNBJQJ-QHCPKHFHSA-N 338.393 1.198 10 10 EDCE COC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(O)c(O)c1 169350300 VPCCUPNHGRCPEI-AWEZNQCLSA-N 329.352 1.541 10 10 EDCE O=C(Nc1cc(S(=O)(=O)O)ccc1O)c1cc(O)c(O)c(O)c1 1865876052 OPXMKONKROXNAM-UHFFFAOYSA-N 341.297 1.008 10 10 EDCE CCOc1cccc(CNCC(=O)Nc2ccc(C(N)=O)cc2)c1O 1857856572 CGYPUOIFDHURFT-UHFFFAOYSA-N 343.383 1.618 10 10 EDCE Cn1nnc(Br)c1C(=O)N1CCC(CN=[N+]=[N-])CC1 1912199094 OMJZFOIKZKHEBI-UHFFFAOYSA-N 328.174 1.740 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NCc1ccc(O)c(O)c1 1948517771 ILKWJXMJOLAFMK-CHWSQXEVSA-N 338.404 1.727 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H]1NCCC1=O 1952208799 NFCJTRNBZFIWTE-XHDPSFHLSA-N 336.388 1.465 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 1985102675 KLRBOOTXIOJGEA-MNOVXSKESA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)NCCN(CCO)C(=O)Cc1ccc(N)cc1 1999442488 RJFFAJDHSSZSLU-UHFFFAOYSA-N 337.420 1.157 10 10 EDCE C[C@H](N)c1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)cc1Br 2146307293 YSCRJTQUVFJYTP-NZVBXONLSA-N 341.249 1.650 10 10 EDCE CC[C@H](N[C@H]1CCO[C@H]1C(N)=O)c1cc(Br)ccc1O 2174102525 GPQJKWDYYIOFNS-GMXVVIOVSA-N 343.221 1.838 10 10 EDCE Oc1cccc(Br)c1CN1CC(O)(C2CCNCC2)C1 2176939353 SPIQTWCPPKBMKC-UHFFFAOYSA-N 341.249 1.701 10 10 EDCE CC1(C)CN(c2ccc(CO)cc2Br)CCNC1=O 2093988689 NDFFMPUSAGOHRE-UHFFFAOYSA-N 327.222 1.904 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213590565 BJUFZSPSXFJRSM-NEPJUHHUSA-N 340.428 1.791 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H](C)N1CC(NC(=O)OC(C)(C)C)C1 2300530178 MYSYCOCDBRGMDW-NSHDSACASA-N 340.428 1.743 10 10 EDCE CCN1CCN(CCCCNC(=O)C=Cc2ccc(O)c(O)c2)CC1 2307987107 DKLRMPVTZNOUDM-UHFFFAOYSA-N 347.459 1.645 10 10 EDCE Cc1ccc(CN2CCO[C@@H](C(=O)O)C2)c(O)c1Br 2352687357 PHPGRMABMMOAEW-SNVBAGLBSA-N 330.178 1.749 10 10 EDCE COC[C@@H](O)CN(C)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255919645 QKISMPHCALXDAF-AFCDSYGPSA-N 334.416 1.002 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H]4CCCC[C@H]43)nc12 377760786 AAAPEECWQVEXEP-BXUZGUMPSA-N 330.388 1.986 10 10 EDCE O=C(Cn1cc(NCc2cc(Cl)c(F)cc2O)cn1)NCCO 293662723 PSHZGQAPHOOLPS-UHFFFAOYSA-N 342.758 1.102 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@](C)(C3CC3)C2)cc1 826705994 DUMBBWQSVPAHHM-LJQANCHMSA-N 345.443 1.396 10 10 EDCE FC1(F)CCNC[C@H]1CNCc1ccc(N2CCOCC2)cc1 903955304 OUBKRBDPILJGDB-HNNXBMFYSA-N 325.403 1.858 10 10 EDCE C/C(=C\C(=O)NCc1ccc(N(C)C)c(F)c1)CN1CCOCC1 900434992 VIQHNZRIXIWNNL-GXDHUFHOSA-N 335.423 1.786 10 10 EDCE COc1ccc(CNC(=O)c2nnn(C)c2C(F)(F)F)c(O)c1 907926376 OJNOELBXIWGLLK-UHFFFAOYSA-N 330.266 1.478 10 10 EDCE NC(=O)C1CCC(NCc2ccc(N3CCOCC3)c(F)c2)CC1 733331229 AVDLITRBGIZCJY-UHFFFAOYSA-N 335.423 1.796 10 10 EDCE COc1ccc(N2CCN(C(=O)COC(=O)C3(OC)CC3)CC2)cc1 830849007 CVEVNPJMIWMRMT-UHFFFAOYSA-N 348.399 1.066 10 10 EDCE CCC/C=C/[C@@H](O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 912709650 RGUCTLTZPRYYNV-SHCNBLLESA-N 332.444 1.981 10 10 EDCE CCNS(=O)(=O)[C@H]1CCN(Cc2c(O)cc(C)cc2Cl)C1 840938206 ZATOGGXJCUATFS-NSHDSACASA-N 332.853 1.868 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCOC[C@H]2c2ccnn2C)c1O 846116899 XYXNZQSALPQMRM-AWEZNQCLSA-N 348.359 1.616 10 10 EDCE COC[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)C(C)C 929238088 VSRYVTGEJMMKLU-OAHLLOKOSA-N 335.448 1.404 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCN(C)[C@@H]3C)C2)cc1 923185919 QOKGDINDJIIZGW-JKIFEVAISA-N 332.448 1.666 10 10 EDCE Cc1cc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)ccc1N(C)C 923415475 QKHBFBFOMWHFLE-JQHSSLGASA-N 344.459 1.428 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cccnn3)cc2)C1 858669119 BDQUMRRYZOUDRM-CQSZACIVSA-N 339.399 1.108 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)N=[S@@](C)(=O)CC 866442030 CBUCEQJUPLPGJI-NRFANRHFSA-N 347.506 1.937 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2(CCO)CCC2)c1 763229932 AXOLSIZBSQICJV-UHFFFAOYSA-N 342.417 1.046 10 10 EDCE O=C(NCCCSc1nccs1)N1CCO[C@]2(CCOC2)C1 769518439 ZALAWRJXPRTKPV-CQSZACIVSA-N 343.474 1.826 10 10 EDCE CCON(CC)C(=O)CNC(=O)NCc1ccc(N2CCCC2)cc1 1118858132 CPJQAYZBBIYKJC-UHFFFAOYSA-N 348.447 1.886 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H]2CNC[C@]2(C)C1 872187905 LSFSOWOJJMIWOA-HNAYVOBHSA-N 345.443 1.199 10 10 EDCE COc1ccc(N2C[C@H](NC(=O)c3cccc(O)c3O)CC2=O)cc1 1146704448 WPUZQAYCLFQBJL-LLVKDONJSA-N 342.351 1.642 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCN1CCc2sccc2C1 1142272169 UIJDPHATDZPGAB-UHFFFAOYSA-N 332.425 1.876 10 10 EDCE CC(C)C[C@@H](CNC[C@@H](C)O)NC(=O)c1ccc(N=NC(N)=O)cc1 1319644131 WKBVMGFWTDPMNO-DOMZBBRYSA-N 349.435 1.964 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cn3nccc3C)CC2)cc1C 1323556105 SQNNBACRZZVPRB-UHFFFAOYSA-N 342.443 1.947 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1320523338 MLGVHLWOIOFSEJ-KMANFZQXSA-N 332.444 1.880 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@H]1COC(C)(C)C1)c1ccc(N(C)C)cc1 1335677258 HRSULNNFNCLPQJ-GXTWGEPZSA-N 333.432 1.614 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)C[C@@H]2CN(C)C)c(Br)c1 97246494 VGEPKWLCWXHWJI-RAIGVLPGSA-N 342.281 1.970 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CCC(=O)NC2)cc1C 1268695270 XYCMHPUEDXCZGG-DZGCQCFKSA-N 333.432 1.124 10 10 EDCE CCOC(=O)[C@@H]1c2ccoc2CCN1C(=O)Cc1ccc(O)c(O)c1 1453433705 FEBGOGLLXJXZNE-KRWDZBQOSA-N 345.351 1.922 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC(CNC(=O)C(F)F)C2)cc1 1297160266 HNNGTONDNOVWIY-UHFFFAOYSA-N 339.302 1.302 10 10 EDCE C=CCCC(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1703930692 ORZNOEQGTCFIIQ-BETUJISGSA-N 333.388 1.442 10 10 EDCE C[C@@H](CCNC(=O)c1ccc(N=NC(N)=O)cc1)NCC(=O)N(C)C 1485003386 UWGYZISVWDFMKM-NSHDSACASA-N 348.407 1.035 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2CCN(C)C2=O)cc1C 1497654643 KRQHDRQQTYWBTF-AWFCHZOYSA-N 345.443 1.244 10 10 EDCE C[C@H](NCc1nnc(Br)n1C)c1ccc(O)cc1O 2121512422 BTUBBRTWOABULL-ZETCQYMHSA-N 327.182 1.840 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)[C@H](C)NC(N)=O)C2)cc1C 1565840881 MQIWTZURIFKWAW-AEGPPILISA-N 348.447 1.045 10 10 EDCE COC(=O)[C@H](NC(=O)c1cc(O)cs1)c1ccc(OC)c(O)c1 1633326838 FEBMZRNYOLKYDA-CYBMUJFWSA-N 337.353 1.812 10 10 EDCE COc1ccc(CN2CC[C@H]2C(=O)NCc2cc(O)ccc2O)cc1 1637126181 MUZUVQRLKMLQIG-KRWDZBQOSA-N 342.395 1.997 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@H](C)[C@@H](C)S(C)(=O)=O)c1 1630366442 PYYRBPUCSWKIQY-OUAUKWLOSA-N 329.418 1.647 10 10 EDCE Cc1ccc(C(=O)Nc2nnn(C)n2)cc1-n1c(C)cc(C=O)c1C 1633294705 ALVABMJGXYKWKF-UHFFFAOYSA-N 338.371 1.991 10 10 EDCE COCCN1[C@H]2CC[C@H]1CC(N(C)C(=O)Cc1ccc(O)c(O)c1)C2 1641651485 SSHIQSKACWEONT-GJZGRUSLSA-N 348.443 1.741 10 10 EDCE C[C@H](NC(=O)c1csc(S(N)(=O)=O)c1)c1ccccc1O 1643742163 RFBWNXXJVAPKEP-QMMMGPOBSA-N 326.399 1.592 10 10 EDCE CNCc1ccc(N2CCC[C@H]2[C@H](O)CO)cc1Br 2123223621 SOIATJGCEKPVFB-UONOGXRCSA-N 329.238 1.491 10 10 EDCE CCC(=O)NCCN(C(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1759073648 WTPMNIPYVVUWQR-UHFFFAOYSA-N 331.376 1.980 10 10 EDCE O=C(CCN1C(=O)COc2ccccc21)NCc1cc(O)ccc1O 1593869397 UTHJWLCNVROLLS-UHFFFAOYSA-N 342.351 1.530 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1Cc2cc(F)ccc2NC1=O 1593880985 BDAQJTOMFNSWGO-CYBMUJFWSA-N 330.315 1.664 10 10 EDCE C[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(O)cc2O)SC1=S 15034565 IZGRNEMRJRSATI-DZTYSLMWSA-N 325.367 1.772 10 10 EDCE CC1CCN(c2ccc(CNC(=O)C[C@@H]3NC(=O)NC3=O)cc2)CC1 154001990 AQNXBVALLNAXSD-HNNXBMFYSA-N 344.415 1.137 10 10 EDCE CCOC(=O)C(C)(C)NCC(=O)N(C)Cc1ccc(N(C)C)cc1 154896416 MNASQCMDENGVQC-UHFFFAOYSA-N 335.448 1.642 10 10 EDCE CN(Cc1ccccc1)C1CN(C[C@@H](O)COc2ccc(N)cc2)C1 1914189863 DJDXXRAHAGSETF-LJQANCHMSA-N 341.455 1.825 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)CC1(O)CN(C(=O)OC(C)(C)C)C1 1900612334 GYDDQSXUTRLMOP-UHFFFAOYSA-N 327.385 1.517 10 10 EDCE CN(C)[C@@H]1COC[C@H]1CNCc1c(O)cccc1Br 1924632413 FWGQCSQSIFQZNJ-ZWNOBZJWSA-N 329.238 1.821 10 10 EDCE CC(C)(C)OC(=O)N(CCO)[C@H](C(=O)O)c1cc(F)ccc1O 1936302725 UDDYHOCOTJCBNL-LBPRGKRZSA-N 329.324 1.886 10 10 EDCE CC(C)(C)OC(=O)NOCCNCc1cc2c(cc1O)OCO2 1936938184 WENFHSKKYFYQGI-UHFFFAOYSA-N 326.349 1.667 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1NCc1ccc(O)cc1O 1943955394 QXYZVACTYPVEMF-UONOGXRCSA-N 338.404 1.870 10 10 EDCE O=C(N[C@@H](C(=O)O)c1c(O)cc(O)cc1O)OCc1ccccc1 1951381643 OYUOIZRMMUEIQD-CQSZACIVSA-N 333.296 1.856 10 10 EDCE C[C@H](O)[C@H]1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 167823195 OVADIXOZUJYCPR-UPFKWVMWSA-N 340.221 1.608 10 10 EDCE CS[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1995249509 GIUAXUGVLMAPCM-UZWSLXQKSA-N 344.477 1.897 10 10 EDCE Cn1ncc(C(=O)N2CC(N=[N+]=[N-])C2)c1CNC(=O)OC(C)(C)C 2010388434 BHMOBATZGAPMBS-UHFFFAOYSA-N 335.368 1.580 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2COCC[C@]2(C(=O)NCCN=[N+]=[N-])C1 2010393182 OYGKDQDOFFLBBM-NHYWBVRUSA-N 339.396 1.687 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](N3CC(O)C3)C2)cc1Br 2158744246 SOHWUJAAFIYFGD-PWSUYJOCSA-N 340.265 1.724 10 10 EDCE O=S(=O)(Nc1cc(Cl)c(O)c(Cl)c1)N1CCC[C@H]1CO 2161898526 CGNBHEFRHNUMHB-QMMMGPOBSA-N 341.216 1.812 10 10 EDCE Nc1ccc(N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1Br 379102630 PHLPXCSTTIBHMQ-KKOKHZNYSA-N 337.173 1.698 10 10 EDCE COC(=O)N[C@@H]1CCN(c2cc(Br)c(CN)cc2F)C1 380516737 QNEXDYSJRJFITO-SECBINFHSA-N 346.200 1.982 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)c(Br)c1 2173356257 BVUPWACLWUUMEU-IWMZPUPSSA-N 342.233 1.823 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C(=O)NC(=O)[C@H]3C2)c(Br)c1 387450932 QQUVZTCLKZKVQV-QNSHHTMESA-N 338.205 1.178 10 10 EDCE CS(=O)(=O)c1cnn(Cc2cc([N+](=O)[O-])ccc2O)c1Cl 2070247334 WZCYRQARYBSSND-UHFFFAOYSA-N 331.737 1.602 10 10 EDCE Cn1cc(CNCCc2ccc(O)c(O)c2)c(Br)n1 2091753172 HUUSJMVWFXRLAY-UHFFFAOYSA-N 326.194 1.926 10 10 EDCE CCN(c1ccc(CO)cc1Br)[C@H]1CC(=O)NC1=O 2114730088 PHBDITUPPMMFHA-NSHDSACASA-N 327.178 1.183 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H]3[C@H]4CO)c(Br)cc21 2203132141 REIXOHBKYWUFLF-UBOMVKISSA-N 338.205 1.218 10 10 EDCE COc1ccc(N2CC[C@H](O)C[C@@H]2CO)c(OC)c1Br 2234903271 PZDPCHMTPZWQSO-ZJUUUORDSA-N 346.221 1.788 10 10 EDCE COc1ccc(Br)c(CN2C[C@H]3CNC[C@@H]3C2)c1O 2227746322 KBXMFBKZUUJTOE-NXEZZACHSA-N 327.222 1.815 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CF)(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2247576554 MMPONQCTCASTPJ-PSTGCABASA-N 342.411 1.849 10 10 EDCE O=C(Nc1nccc(Br)n1)c1cc(O)c(O)c(O)c1 2271993949 QFHMLEBIJQEUAC-UHFFFAOYSA-N 326.106 1.608 10 10 EDCE C[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2273250967 LTJLYRWAMZQEJR-HQDFOZKBSA-N 327.178 1.394 10 10 EDCE O=C1C(=Cc2ccoc2)SC(=S)N1[C@H]1CCS(=O)(=O)C1 2293438613 CSGVLYSFTHEWDE-VIFPVBQESA-N 329.424 1.668 10 10 EDCE CC[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2288890921 ALSGIMXMXGZAMM-DRZSPHRISA-N 340.221 1.751 10 10 EDCE Cc1ccc(CN2C[C@@H](O)[C@@H](O)C2(C)C)c(O)c1Br 2352687141 OEHYUQHZNVEBLX-ZWNOBZJWSA-N 330.222 1.779 10 10 EDCE Cc1ccc([C@@H](C)NCCNS(=O)(=O)c2cccnc2)c(O)c1 186142246 SIPPNQCKYKVWMW-CYBMUJFWSA-N 335.429 1.725 10 10 EDCE COc1ccc(N2CCCN(C(=O)c3cncnc3N)CC2)cc1 185430156 NSCDAYNPJFCASK-UHFFFAOYSA-N 327.388 1.420 10 10 EDCE CC(C)[C@H](CO)N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2367092366 LJTQUPHZEMCOAR-QWHCGFSZSA-N 342.237 1.854 10 10 EDCE COC(=O)c1ccc(S(=O)(=O)NCCc2ccc(N)cc2)c(C)c1 193339436 HRBDQBAEIAGZDO-UHFFFAOYSA-N 348.424 1.885 10 10 EDCE CNC(=O)[C@@H]1CCCN1c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 255194302 CZTQENZJLMJENC-CFNZNRNTSA-N 333.344 1.496 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCC[C@H]1CCNC1 254950740 URBIRLZVOUXEFC-GPCFVJJQSA-N 329.444 1.652 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CC(=O)N(C)C2)c(O)c1Br 2380741465 HPFAZDGMVXOZRY-JTQLQIEISA-N 341.205 1.558 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CNCC[C@H]3C)C2)cc1 818655924 QBIMRYDTEUIHJL-RKVPGOIHSA-N 346.475 1.819 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N1CCN2CCC1CC2 588562119 STUUNHIZRVKJIL-UTCJRWHESA-N 341.455 1.843 10 10 EDCE Cc1cc(CC(=O)N2CC(CC(N)=O)C2)c(C)n1-c1ccccc1 834852338 NXQNOVWCKFUBHP-UHFFFAOYSA-N 325.412 1.970 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@H](NC(=O)NCc2ccc(N(C)C)cc2)CC1=O 743813792 HKMUGHMEOZNEDO-XPKDYRNWSA-N 330.432 1.561 10 10 EDCE CC[C@](C)(CO)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 847366974 LODWFTVVBPNRGO-DNVCBOLYSA-N 347.459 1.413 10 10 EDCE CS(=O)(=O)C1(CNC(=O)NCc2c(O)cccc2F)CCCC1 922453737 BMNVRRIXWRNALA-UHFFFAOYSA-N 344.408 1.688 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCCc4nn[nH]c43)C2)cc1 855226962 RQFUPLAVNCYXMV-DOMZBBRYSA-N 341.415 1.628 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](CO)CC3CC3)C2)cc1 854296591 KKQBVJRCMNPWSR-CVEARBPZSA-N 347.459 1.982 10 10 EDCE c1cc2c(cc1CN[C@H]1CCN(c3ccc4nncn4n3)C1)CCO2 858244842 JAJSHNJICAVWGI-HNNXBMFYSA-N 336.399 1.428 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCS[C@H](C(F)(F)F)C2)cc1 927859044 WMTAKWZYVHPBIG-JTQLQIEISA-N 333.335 1.714 10 10 EDCE CC(=O)N1CCO[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 930206249 UEOXDUKOVDZNFD-QGZVFWFLSA-N 331.416 1.150 10 10 EDCE CN1CCCc2cc(CNC(=O)c3c[nH]nc3[C@H]3CCNC3)ccc21 852798761 NIEUCIPPBOJMDG-HNNXBMFYSA-N 339.443 1.799 10 10 EDCE COC(=O)c1cc(OC[C@@H]2CCCS(=O)(=O)C2)ccc1N(C)C 865395152 LDNBUMHGTKPCBO-LBPRGKRZSA-N 341.429 1.743 10 10 EDCE COc1cc(COCC(=O)NCCc2ccc(O)c(O)c2)ccn1 860235798 ZSXVDNQGSSFIBX-UHFFFAOYSA-N 332.356 1.377 10 10 EDCE O=C(CCC(=O)Nc1nnc(C2CC2)o1)NCc1ccccc1O 769362924 MVPOJNLBEXWAPE-UHFFFAOYSA-N 330.344 1.688 10 10 EDCE CC(=O)c1cc(F)cc(Cn2cc(CN3CCCCC3=O)nn2)c1O 880996420 VMCLDGBDXMXWFB-UHFFFAOYSA-N 346.362 1.886 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CNc1ccccc1C(N)=O 1154027760 ZYRGHEMNBCVADU-LLVKDONJSA-N 343.383 1.356 10 10 EDCE CN(C)CCN1CCN(Cc2ccc(Br)cc2O)CC1 691673760 DBQISEBLOBFFBZ-UHFFFAOYSA-N 342.281 1.834 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CC[C@@H](OC)C2)cc1 1257176830 PBJGOBXHIQZVRY-DOTOQJQBSA-N 347.459 1.833 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)C2[C@H]3CCC[C@H]23)cc1C 1278743256 MMDUPQNYJLPRJW-ULQDDVLXSA-N 346.471 1.959 10 10 EDCE CCn1ncc(C(=O)N[C@H](C)[C@H](C)NCc2ccc(OC)c(C)c2)n1 1282124788 QGNDSJMABFYYPG-UONOGXRCSA-N 345.447 1.912 10 10 EDCE O=C(C[C@@H]1CCNC1=O)Nc1c(-c2ccccn2)nc2ccccn12 1524853978 VGVQHQHGDYJBMA-LBPRGKRZSA-N 335.367 1.861 10 10 EDCE NC(=O)COc1cccc2c1CCCN2C(=O)/C=C\c1cccnc1 1533720402 RJBBQDSHWGPWCB-HJWRWDBZSA-N 337.379 1.938 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)CC2CCC2)cc(OC)n1 1487741389 PSICMQKCZGADKU-GFCCVEGCSA-N 349.431 1.866 10 10 EDCE CC(=O)N/C(=C\C1=S=CC=C1)C(=O)Nc1ccc([S@](C)=O)cc1 1629045305 ADXRDKBDFGTZFV-MMIRBSHRSA-N 348.449 1.660 10 10 EDCE C[C@@H](O)CN1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@H](C)C1 1633634091 RLJMIRVBLMZASO-VXGBXAGGSA-N 333.392 1.376 10 10 EDCE CCc1cc(C(=O)NC[C@@H](CO)NCc2ccc(OC)c(C)c2)n[nH]1 1725534670 YIGHTWYLLSTFRS-HNNXBMFYSA-N 346.431 1.170 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)Nc1nc(N)nc(C(F)(F)F)n1 1655365350 XFSPQQCZOXDMOC-ZCFIWIBFSA-N 329.282 1.927 10 10 EDCE CO[C@H]1C[C@@H](C(=O)O)N(Cc2cc(Br)cc(F)c2O)C1 1964719583 WKFGGBFBFXJPAM-ONGXEEELSA-N 348.168 1.968 10 10 EDCE CC[C@@H](C)NC(=O)CN1CCN(Cc2cc(C)cc(OC)c2O)CC1 163913933 GLTXDCSVBIGGNU-OAHLLOKOSA-N 349.475 1.742 10 10 EDCE C[C@@H](O)[C@H](C(=O)O)N1C(=O)/C(=C\c2cccc(F)c2)SC1=S 1858592290 MCNIRAFVAUGWKE-TVNLMNMCSA-N 341.385 1.861 10 10 EDCE CN(CCN=[N+]=[N-])CC(=O)NC(=O)c1ccccc1Br 1912209814 CNVZHIJZHMKAIV-UHFFFAOYSA-N 340.181 1.948 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O 1900612510 JJOBNECKTPKNOJ-SNVBAGLBSA-N 329.401 1.809 10 10 EDCE OCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2134818742 ATUZWXHLQBEMMT-HBEIAFGSSA-N 328.206 1.262 10 10 EDCE CC(C)(C)OC(=O)NCCOC[C@](C)(O)[C@H](N)c1ccccc1O 1920089026 KNLDZQHRQSFONX-PBHICJAKSA-N 340.420 1.684 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@H](O)[C@H]2CF)c(Br)c1 2140662021 JVENZGIMUWSRLJ-GUQKDYTMSA-N 334.185 1.382 10 10 EDCE C[C@H](O)[C@H](N)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952122390 UMECTTMHYOZGMB-CHIMOYNISA-N 326.393 1.242 10 10 EDCE C[C@@H](N)c1ccc(N2CC(S(C)(=O)=O)C2)cc1Br 2034836803 AQZURBHRFSMMDY-MRVPVSSYSA-N 333.251 1.702 10 10 EDCE OCCN1CCC[C@@H](NCc2cccc(Br)c2O)C1 384362903 GHVVOMHNHAQESY-GFCCVEGCSA-N 329.238 1.701 10 10 EDCE COCCNCc1ccc(N2CC=C[C@H](O)C2)cc1Br 2165072795 BXLOQXFXCMPBDH-AWEZNQCLSA-N 341.249 1.922 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@H](C)OC4(CCCC4)C3)c2n1 2063711556 TVLDJDHWJPEEFZ-LBPRGKRZSA-N 330.388 1.917 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC4(CC[C@H]4O)C3)c(Br)cc21 2179703369 KZJXGIVXKOALCE-VXGBXAGGSA-N 338.205 1.362 10 10 EDCE O=C(O)[C@@]12CC[C@@H](CN(Cc3cc(Br)ccc3O)C1)N2 2287231985 DKHHOLRSXXVFSM-SMDDNHRTSA-N 341.205 1.546 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@H]1CCC[C@@H](O)[C@H]1O 2333449735 NMHJCHQDVOAEBY-LOWVWBTDSA-N 334.185 1.658 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCCN(C4CC4)CC3)cc2N1 177822140 DRXYQPHNPRFXQH-UHFFFAOYSA-N 332.360 1.600 10 10 EDCE CN(C)C(=O)C1CCN(C(=O)NCc2ccc(N(C)C)cc2)CC1 54401393 JDYHLOUOVPQKHT-UHFFFAOYSA-N 332.448 1.762 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)CN2CCOCC2)cc1C 1272728842 JRLMEBDEVROBKG-INIZCTEOSA-N 349.475 1.320 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)C[C@H]1CCOC1 1276010663 ISGWXGCBCCURNW-CHWSQXEVSA-N 347.419 1.936 10 10 EDCE O=C(NC1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1)C1CC1 187229684 PYDXRLBPZOIPOT-UHFFFAOYSA-N 340.427 1.483 10 10 EDCE C[C@H](NCC1CN(S(C)(=O)=O)C1)c1cc2c(cc1O)CCCC2 187817858 ARTQHAKDDWGBPZ-LBPRGKRZSA-N 338.473 1.813 10 10 EDCE CCn1nncc1/C=C1/CCn2c1nc1ccc([N+](=O)[O-])cc1c2=O 416395120 YPEXAWMJMZGKLI-YFHOEESVSA-N 338.327 1.860 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@@H](O)c2c(Br)ncn2C)cc1 2362530241 XYFAUHGVUYMQJV-DGCLKSJQSA-N 339.237 1.982 10 10 EDCE COc1cc(O)c(CNCc2cc(C)nc(N(C)C)n2)cc1OC 187975673 RHWCBMHKQIIKBY-UHFFFAOYSA-N 332.404 1.864 10 10 EDCE C[C@H](N[C@H]1CCc2ncnn2C1)c1ccc(N2CCOCC2)c(F)c1 180605729 MTPZMFFPUSTZKR-ZFWWWQNUSA-N 345.422 1.919 10 10 EDCE COc1ccc(N2CCN(C(=O)N3CCN(C(C)=O)CC3)CC2)cc1 244338262 XRZQBXRADKLMJP-UHFFFAOYSA-N 346.431 1.101 10 10 EDCE Cn1cc(/C=C2\SC(Nc3ccccc3)=NC2=O)c(=O)n(C)c1=O 255496003 UZCKLAONIJQCSW-WQLSENKSSA-N 342.380 1.166 10 10 EDCE Cc1ccc(C(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccco2)c(O)c1O 272770823 SHIUISONQDTSIG-GXTWGEPZSA-N 347.367 1.964 10 10 EDCE Cc1cc(C(=O)N2CC[C@](O)(C(N)=O)C2)c(C)n1-c1ccc(F)cc1 276475984 KPOKVFDVBDJSBB-GOSISDBHSA-N 345.374 1.296 10 10 EDCE CCOc1ccc(O)c(CN2CCCC[C@H]2CNS(C)(=O)=O)c1 271062541 HLZWTWRLVZSYBP-AWEZNQCLSA-N 342.461 1.695 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)OC[C@H](F)C(F)(F)F)c1 800148372 BKJKOQRHOLUEDH-VIFPVBQESA-N 345.270 1.821 10 10 EDCE Cc1ccc(CNC(=O)C2=C[C@@H](O)[C@@H](N)C2)c(O)c1Br 2380750700 FTKGYWLOMAJIDD-WDEREUQCSA-N 341.205 1.098 10 10 EDCE C[C@@H]1CCCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1C(=O)O 818331678 XMVZAJFRRXQFPB-KDOFPFPSSA-N 347.459 1.896 10 10 EDCE COc1cnc(C(=O)NCc2cc(Br)ccc2O)nc1 816654163 WDWUTRILBBIWEA-UHFFFAOYSA-N 338.161 1.883 10 10 EDCE COCCn1cc(NS(=O)(=O)c2cc(F)cc(F)c2O)cn1 821158369 ZYDHVJHGDVFNPW-UHFFFAOYSA-N 333.316 1.314 10 10 EDCE COC(=O)C1CC2(C1)CN(Cc1cc(C)ccc1O)C[C@H]2C(=O)O 903694478 XOGZFUXDUGRPTK-FVRSWCFKSA-N 333.384 1.786 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)CS(=O)(=O)NC(C)(C)C 731809515 WKGFECGGIXAQLV-UHFFFAOYSA-N 342.461 1.849 10 10 EDCE COC[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)C(=O)OC 831812405 QPBIVQRHMKFHMU-KRWDZBQOSA-N 344.411 1.941 10 10 EDCE O=C(O)c1coc(C(=O)NCc2ccc(N3CCOCC3)cc2)c1 911210829 XPPKGYPKRKQBLN-UHFFFAOYSA-N 330.340 1.744 10 10 EDCE CN1CCCc2cc(CNC(=O)NC[C@@H](O)c3ccnn3C)ccc21 915390746 OPDRWZOMSFRSSX-QGZVFWFLSA-N 343.431 1.335 10 10 EDCE COC(=O)C[C@H](CN1C(=O)CN(Cc2ccccc2O)C1=O)C1CC1 849363245 HFNBACHSNGQNID-CQSZACIVSA-N 346.383 1.746 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCCC2CCS(=O)(=O)CC2)c1 858339989 QQCNZSCGMSXJBY-UHFFFAOYSA-N 340.445 1.715 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)c3ccnn3C)C2)cc1 855226756 TZEAUZZBQUGNIG-ZIAGYGMSSA-N 328.416 1.927 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCCNC(C)C)C2)cc1 851662093 URACKWSKBHTQAL-OAHLLOKOSA-N 334.464 1.961 10 10 EDCE COC(=O)N(C)CCN(C)C(=O)NCCCSc1nccs1 853858772 OVRDOTJQYZVELD-UHFFFAOYSA-N 346.478 1.965 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCc4nccnc4C3)cc2N1 853964188 IDRPHHLEOSWAAG-UHFFFAOYSA-N 327.300 1.278 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCCOCC(=O)OC(C)(C)C)c1 868890037 WOIJZCNEUOGMFV-UHFFFAOYSA-N 338.404 1.858 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCCCC[C@@H](N)C1 868367225 HTJCBOLSCNCORO-MRXNPFEDSA-N 347.459 1.861 10 10 EDCE CC(C)N1C(=O)CN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1(C)C 768465763 KRZMUXTUPRDAGA-HNNXBMFYSA-N 334.416 1.649 10 10 EDCE COC(=O)c1c(CNCCCNC(C)=O)c2cc(F)ccc2n1C 894164070 BBUJNYZYXABBFP-UHFFFAOYSA-N 335.379 1.720 10 10 EDCE COc1ccc(CNS(=O)(=O)c2cnn(CC3CC3)c2)c(O)c1 795362377 KFRXORJXZSSZAY-UHFFFAOYSA-N 337.401 1.486 10 10 EDCE CC1(C)CN(Cc2cc3c(cc2O)OC[C@H]3O)C[C@]2(CCOC2)O1 794695496 QZMVAGGAAPHRBA-QAPCUYQASA-N 335.400 1.588 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N(CCC2CC2)CC2CC2)cc1 1329838364 RBLLCPKYCTZUGO-UHFFFAOYSA-N 329.444 1.966 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)C[C@@H](C)CO)c(Br)cc21 688402544 AJWSLZCZUIESIN-OQPBUACISA-N 342.237 1.726 10 10 EDCE CNCc1ccc(N(C)[C@H]2CCN(C)C2=O)c(Br)c1 690313639 FGLVDKVORDFWCS-ZDUSSCGKSA-N 326.238 1.835 10 10 EDCE CN(C)C1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CCOCC1 1465205326 UQHJXYKKIPFANG-UHFFFAOYSA-N 333.392 1.690 10 10 EDCE CN1C(=O)O[C@H]2CN(Cc3cc(Br)ccc3O)C[C@H]21 2120399403 FMCATPGRESTREV-PWSUYJOCSA-N 327.178 1.790 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCc2nc(C)no2)cc1C 1483155353 RSNMAMMRCPMKOJ-CYBMUJFWSA-N 346.431 1.922 10 10 EDCE O=C(CSc1nnc2ccccn12)NCc1cc(O)ccc1O 1651225242 BMGFHNVUNWNEQW-UHFFFAOYSA-N 330.369 1.549 10 10 EDCE COc1cccc(CNC(=O)C2C[C@@H]3CSC[C@H](C2)C3=O)c1O 901128029 SZKZLXJJYRFMQZ-YHWZYXNKSA-N 335.425 1.975 10 10 EDCE O=C(CN1CCCC1=O)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1889632906 YEZOXNDRWFMRQS-RDJZCZTQSA-N 327.428 1.914 10 10 EDCE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)[C@H]1CCS(=O)(=O)C1 1890271667 RZYIKRDABCXPAN-ZOBUZTSGSA-N 348.468 1.726 10 10 EDCE Cc1c(OCCOc2ccc(N)cc2)c(=O)ccn1CCOCCO 1857910942 IWPBSTJNUZPBBZ-UHFFFAOYSA-N 348.399 1.206 10 10 EDCE O=S(=O)(Nc1cc(Cl)c(O)c(Cl)c1)N1CCC(O)CC1 1914142106 LZXJBWRNVXSJSJ-UHFFFAOYSA-N 341.216 1.812 10 10 EDCE CN1[C@H](CNCc2ccc(Br)cc2O)CCS1(=O)=O 1967746176 DQOGINWXOHHQKF-NSHDSACASA-N 349.250 1.278 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](O)C[C@@H]2CO)cc1Br 2136081168 BBTBFOBAGBKRHJ-YUSALJHKSA-N 330.222 1.824 10 10 EDCE NC(=O)CCN(CC(=O)Nc1ccc(N)cc1)Cc1ccccc1 1946832771 WGUQEGFPJLDKGU-UHFFFAOYSA-N 326.400 1.585 10 10 EDCE CO[C@H]1C[C@H](C(=O)NCCCN=[N+]=[N-])N(C(=O)OC(C)(C)C)C1 1985094991 XGFYMFKYEOYDLK-WDEREUQCSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1986368582 HFOPHHXEYPDBCD-WDEREUQCSA-N 327.385 1.563 10 10 EDCE CN(C)C(=O)[C@H]1COCCN1c1ccc(CO)c(Br)c1 2155016313 DPWICDRGEGYVTK-CYBMUJFWSA-N 343.221 1.235 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3Cc4c[nH]nc4CC(C)(C)C3)c2n1 2062189372 RRLXNYYMMXRLRL-UHFFFAOYSA-N 340.387 1.691 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H]3CCCN(CC4CC4)C3)c2n1 2063554435 POIVZDSOPLKIDR-AWEZNQCLSA-N 343.431 1.595 10 10 EDCE NCc1cnn(-c2ccc(O)c(O)c2)c1I 2070420270 SVIZWFPMZWDOEX-UHFFFAOYSA-N 331.113 1.347 10 10 EDCE CNC(=O)c1cnn(Cc2cccc(Br)c2O)c1O 2070463614 WQFYEWMHKBRPHJ-UHFFFAOYSA-N 326.150 1.465 10 10 EDCE COC(=O)c1cn(Cc2c(O)cccc2Br)nc1O 2070615129 QPAVBAKXGXKJIR-UHFFFAOYSA-N 327.134 1.892 10 10 EDCE CN(C(=O)CN1CC[C@H](NC(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2044607243 XYAQNNPWSXVZRV-AWEZNQCLSA-N 348.447 1.831 10 10 EDCE CN(c1ccc(N)cc1)S(=O)(=O)c1cc(Br)nn1C 2089751042 LBFWWURREIRXBX-UHFFFAOYSA-N 345.222 1.590 10 10 EDCE C[C@H](O)CN1CCN(c2ccc(CO)c(Br)c2)CC1 2113864122 MGWHJRJGQNAUBY-NSHDSACASA-N 329.238 1.444 10 10 EDCE CN1CCc2cc([C@@H](NN)c3nn(C)nc3Br)ccc21 2235279057 HBNAEZMAJZXYNV-LLVKDONJSA-N 337.225 1.123 10 10 EDCE CC(=O)C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1 2245899364 YKXMYWFRVPQFNL-RNCFNFMXSA-N 339.310 1.837 10 10 EDCE O=C1CCC2(CN1)CN(c1ccc(CO)cc1Br)C2 2265517857 CHSKYAHJYYEXSU-UHFFFAOYSA-N 325.206 1.658 10 10 EDCE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1ccc([N+](=O)[O-])o1 2296374279 PRYWRYCMZXFHEH-UHFFFAOYSA-N 345.242 1.993 10 10 EDCE OC[C@@H](O)[C@H]1COCCN1c1ccc(OCc2ccccc2)cc1 2299515148 OSODPYQDYLPLIZ-RTBURBONSA-N 329.396 1.824 10 10 EDCE CC1(C)[C@@H](O)C[C@@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2310366435 GURKMGYFCDKGPN-IRXDYDNUSA-N 330.428 1.812 10 10 EDCE Cc1ccc(CNC(=O)N2CCNCC2)c(O)c1Br 2352644813 DDKSJZPMFFDAKR-UHFFFAOYSA-N 328.210 1.578 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2354479482 YPHVDERAVJLPHU-AWQUKHNNSA-N 341.249 1.660 10 10 EDCE Cn1c(=O)oc2cc(S(=O)(=O)NCCc3ccc(N)cc3)ccc21 171531644 CJFJZGLQCQJMQP-UHFFFAOYSA-N 347.396 1.235 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NC[C@@H](O)COCC1CC1 304625053 JJOPYFHDKMDVSR-CQSZACIVSA-N 343.383 1.768 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2357593606 YFKFCLWSRRRWMZ-UDQBKAKJSA-N 341.249 1.789 10 10 EDCE COc1ccc(O)c(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1 180755774 NGDNJIGFFDLFPT-OAHLLOKOSA-N 340.445 1.401 10 10 EDCE CC[C@@H](C)N(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)=O 244005429 SHQXUXFHCHYBGJ-OAHLLOKOSA-N 347.459 1.991 10 10 EDCE COc1ccc(CNC(=O)c2cc(S(C)(=O)=O)c(C)o2)c(O)c1 529229555 SIVOSXWISJOYQO-UHFFFAOYSA-N 339.369 1.636 10 10 EDCE NC(=O)CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 266896903 KJFJAEOROUZUFI-SNVBAGLBSA-N 327.331 1.248 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(=O)N(C)[C@@H](C)C2)c([N+](=O)[O-])c1 283525697 NJHRKQJCMZQBMS-ZRQQLDRUSA-N 333.344 1.448 10 10 EDCE Cc1ccc(CNC[C@@H]2CN3CCN2CC3)c(O)c1Br 2380805134 ORARLQKHRLQJHF-CYBMUJFWSA-N 340.265 1.553 10 10 EDCE CN(C)c1ccc([C@@H](Cc2cn(C)nc2Br)NN)cc1 713825256 GHHACCPJJVBBBN-CYBMUJFWSA-N 338.253 1.996 10 10 EDCE CC(C)[C@H](O)CN(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2167641597 DTDWAROOGGKHCR-CHWSQXEVSA-N 343.221 1.888 10 10 EDCE Cc1cc(CC(=O)NC[C@H](C)S(N)(=O)=O)c(C)n1-c1ccccc1 831543432 JDRWZZNIBKFGHV-ZDUSSCGKSA-N 349.456 1.430 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnn4c3CCC4)C2)cc1 849365640 AEQDHCFAEVPBKG-CYBMUJFWSA-N 326.400 1.847 10 10 EDCE CCc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)no1 740496764 ZGXHFCYWXZLQSJ-UHFFFAOYSA-N 334.351 1.697 10 10 EDCE Nc1nccc([C@@H]2CCCN(C(=O)c3c(F)ccc(O)c3O)C2)n1 846650907 NHERYNHBPLQIOZ-SECBINFHSA-N 332.335 1.629 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@H](CO)C3)C2)cc1 854301894 FXECEUHCFBDTAD-CABCVRRESA-N 333.432 1.688 10 10 EDCE CNC(=O)c1ccc(NS(=O)(=O)c2cc(F)cc(F)c2O)cc1 753022547 XYLFHQHNODRIEA-UHFFFAOYSA-N 342.323 1.831 10 10 EDCE C[C@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccnn1C 867302096 JATDNDJMAMRYHZ-ZDUSSCGKSA-N 343.431 1.322 10 10 EDCE C[C@@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cncnc1 764384547 ZWEHLCZBVZDKHC-CYBMUJFWSA-N 344.390 1.872 10 10 EDCE CN(C)c1ccc(CNC(=O)CN[C@H](CO)c2ccsc2)cc1 770687965 LHBFZJZNBLRGLO-MRXNPFEDSA-N 333.457 1.754 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@H](O)CC(F)(F)C2)c([N+](=O)[O-])c1 786829114 YESVPVPZZUSECF-USEMIUTHSA-N 342.298 1.987 10 10 EDCE COC(=O)c1c(CN2C[C@@H]3CNC[C@@H]3C2)c2cc(F)ccc2n1C 894097157 DAOGEGIXGYNFJX-TXEJJXNPSA-N 331.391 1.755 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCn2c(O)nnc2C1 1138618691 IXRSOASSDXHXQU-UHFFFAOYSA-N 332.341 1.266 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@H](C)CO3)CC2)cc1 896330991 QETQOUGTQOITEQ-YJBOKZPZSA-N 347.459 1.358 10 10 EDCE COC(CN(CCCO)C(=O)c1ccc(N=NC(N)=O)cc1)OC 1138432501 QKMSJUOYMQZAOJ-UHFFFAOYSA-N 338.364 1.293 10 10 EDCE COC(=O)c1cc2ccccc2c(CN2CC(=O)N(C)[C@@H](C)C2)c1O 799955385 GSDBYRVVAYSAKM-LBPRGKRZSA-N 342.395 1.995 10 10 EDCE C[C@]1(C(=O)NCc2ccc(N3CCSCC3)cc2)CCC(=O)NC1 798895504 AEACKUIKPBFPIT-SFHVURJKSA-N 347.484 1.772 10 10 EDCE COCCN(C)CCCn1c(C)nnc1N(C)Cc1ccccc1O 1316062898 MRVHEHIJFAJLTA-UHFFFAOYSA-N 347.463 1.897 10 10 EDCE [N-]=[N+]=N[C@H]1CCCN(C(=O)Cn2cc(Br)ccc2=O)C1 701275176 JYPOAHUBLXNANR-JTQLQIEISA-N 340.181 1.912 10 10 EDCE CO[C@@H]1CC[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)C1 1321778361 TZLFEEQKRYBBEL-DOTOQJQBSA-N 333.432 1.890 10 10 EDCE CCOC[C@H](C)NC(=O)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1326358425 BPLZOTUGMFCFOU-GJZGRUSLSA-N 349.475 1.649 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)C(=O)N[C@@H]2[C@H]3COC[C@H]32)cc1 1329117926 AVNNKOGWNHNMKR-FVQHAEBGSA-N 345.443 1.252 10 10 EDCE CNCc1ccc(N2CCN(C)C[C@@H]2CO)cc1Br 699451967 XZPJHAMWDUGKSO-CYBMUJFWSA-N 328.254 1.281 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccnc(F)c2)cc1C 1268299031 MBRYYBZBEJTWLH-OAHLLOKOSA-N 347.390 1.418 10 10 EDCE CC(C)(C)[C@@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H]1O 1348640899 UURUUNVNAUMRDL-GDBMZVCRSA-N 346.427 1.490 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@@H]1CN(C)CCN1C 1444416572 RPCHISSEUWNDBC-FZMZJTMJSA-N 332.408 1.213 10 10 EDCE Cc1conc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1517374516 ZDUPAGBSVRDBRO-CQSZACIVSA-N 342.399 1.615 10 10 EDCE O=C(NCc1cccc(Br)c1O)c1cccn2nnnc12 1297441339 UDFMCLCRHGQVQH-UHFFFAOYSA-N 348.160 1.522 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)cc1 1466689809 HRQJOCKNIWTWOT-CYBMUJFWSA-N 344.375 1.525 10 10 EDCE C[C@@]1(NC(=O)c2cc3cc(O)c(O)cc3s2)CCS(=O)(=O)C1 1540597250 OPOCDMJEIAJXHL-CQSZACIVSA-N 341.410 1.620 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1CCC(=O)N1)NCc1ccc(OC)c(C)c1 1481867231 DAJGFULXMSVIGR-CABCVRRESA-N 333.432 1.267 10 10 EDCE C[C@@H](O)CCCN(C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1713479453 VJAQTUKYUQJUCB-GFCCVEGCSA-N 335.408 1.672 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H]2CCCC(=O)N2)cc1C 1714404936 NHGWWCCJRLQCGZ-XJKSGUPXSA-N 347.459 1.514 10 10 EDCE COc1ccc(-n2nnnc2CN(C)CCNC(=O)C(C)(C)C)cc1 1714568845 XOXZKOVGOLDRCT-UHFFFAOYSA-N 346.435 1.265 10 10 EDCE O=C(Cc1csc(-c2nc[nH]n2)n1)NCc1cc(O)ccc1O 1558174563 OEEMJXIUTKRTCQ-UHFFFAOYSA-N 331.357 1.198 10 10 EDCE O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NCc1ccc(O)cc1O 1639441505 WMNAGOAQZHTSPS-UHFFFAOYSA-N 342.311 1.672 10 10 EDCE CN(CCNC(=O)[C@@H]1CCCO1)C(=O)c1ccc(N=NC(N)=O)cc1 1495831994 LYKFDMUJSPZHCA-ZDUSSCGKSA-N 347.375 1.216 10 10 EDCE O=C(CCCNC(=O)c1cccnc1)NCc1ccc(O)cc1O 1630302074 QNGOSGOYZLMKGI-UHFFFAOYSA-N 329.356 1.319 10 10 EDCE C[C@@H](CNCc1ccon1)NC(=O)c1ccc(N=NC(N)=O)cc1 1733024310 GADVDRSSLPFYAV-JTQLQIEISA-N 330.348 1.745 10 10 EDCE CNC(=O)[C@H](C)NCCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1733147466 FCIJLWQTKKAMQQ-NSHDSACASA-N 348.407 1.035 10 10 EDCE COC(=O)C1CC2(C1)C[C@@H](NC(=O)c1ccc(C)c(O)c1O)CCO2 1645183971 UCSATAYGKQBSPN-LASWEOPPSA-N 349.383 1.637 10 10 EDCE COC(=O)[C@@]12CCCC[C@@H]1CN(C(=O)Cc1ccc(O)c(O)c1)C2 1583098979 WEVCHJKJSIXCSP-FZKQIMNGSA-N 333.384 1.832 10 10 EDCE CN1NC(=O)[C@H](CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C1=O 169996299 MAWHIZACRNJGGY-ZETCQYMHSA-N 349.696 1.807 10 10 EDCE Cc1sc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)nc1O 1263905527 CGXNBXLQEZEMEG-UHFFFAOYSA-N 346.456 1.839 10 10 EDCE CC(=O)c1ccc2c(c1)CCN2C(=O)c1nnn(-c2ccc(N)cc2)n1 1857878790 NDQKAODFWKAEHT-UHFFFAOYSA-N 348.366 1.650 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@@H](N(C)C)C2)cc1Br 2146148303 AKXYBGXTUOUCSC-GJZGRUSLSA-N 342.281 1.670 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C1(CNC(=O)OC(C)(C)C)CC(O)C1 1987681715 RCRKTXAXARSQQF-UHFFFAOYSA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)NCCN1CCN(Cc2ccc(N)cc2)CC1 1999478776 WYAISUHXPRLAJS-UHFFFAOYSA-N 334.464 1.911 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]1NC(=O)COc1ccc(N)cc1 2012864994 FFMCWODMYWZNSQ-KBPBESRZSA-N 335.404 1.820 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(NCc2cccc(O)c2O)C1 2016029050 KJWZDWSSESTGKQ-KRWDZBQOSA-N 338.404 1.559 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)NCCc1ccc(N)cc1 2018034461 BQOGDNWFZLQHDK-CQSZACIVSA-N 337.420 1.203 10 10 EDCE O=C1OC(C2=S=CC=C2)=NC1=Cc1cc2c(cc1[N+](=O)[O-])OCO2 2053514891 YVRNNUCEXMUCML-UHFFFAOYSA-N 344.304 1.897 10 10 EDCE CCCN(Cc1cccc(Br)c1O)[C@@H]1CC(=O)NC1=O 2171199957 CBMOZQYKMZHDPM-LLVKDONJSA-N 341.205 1.782 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)c(Br)c1 2189047230 AAZJOKLLIZPUBA-ADGXKJENSA-N 341.249 1.912 10 10 EDCE NCc1cc(F)c(N2CC(O)(C(F)F)C2)cc1Br 2052066955 CBVSZOLVUMWJGR-UHFFFAOYSA-N 325.128 1.863 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)NCCc2ccc(N)cc2)CC(O)C1 2073273674 QSHQVKXCAAMXBJ-UHFFFAOYSA-N 349.431 1.346 10 10 EDCE COCC[S@@](=O)CCNCc1ccc(Br)cc1O 2085943526 ATTFQAQLXGAXIW-SFHVURJKSA-N 336.251 1.639 10 10 EDCE O=S1(=O)CC[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@@H]21 2088815202 ORDFFAFRYXRJEL-MFKMUULPSA-N 346.246 1.774 10 10 EDCE COCc1nc(CNCc2c(O)cccc2Br)no1 2089349718 FLGSCZFOCCTHCS-UHFFFAOYSA-N 328.166 1.974 10 10 EDCE CNCc1ccc(N2CC(OC(=O)NC)C2)c(Br)c1 2090749355 XNGJRUBWVYYIBR-UHFFFAOYSA-N 328.210 1.713 10 10 EDCE NCCc1n[nH]cc1C(=O)N1CCc2cccc(Br)c21 2235314704 SQPUGYACDRIOOG-UHFFFAOYSA-N 335.205 1.876 10 10 EDCE COc1ccc(Br)c(CN2CC[C@@H](CO)[C@H](N)C2)c1O 2236039760 DHITXGCJCGFTKF-JOYOIKCWSA-N 345.237 1.305 10 10 EDCE COc1cccc(NC=C2C(=O)NC(=O)N(Cc3ccco3)C2=O)c1 2297552086 YOXUSOWSCCYRSN-UHFFFAOYSA-N 341.323 1.863 10 10 EDCE CNCc1ccc(N2CC(NC(=O)OC)C2)cc1Br 2351874686 NMQKEOXFSXZYML-UHFFFAOYSA-N 328.210 1.713 10 10 EDCE C[C@@H](N)c1ccc(N2CCS(=O)(=O)CC2)c(Br)c1 61695442 XGTZZAYKMQNRBN-SECBINFHSA-N 333.251 1.704 10 10 EDCE CS(=O)(=O)Nc1ccc(NS(=O)(=O)CCC(F)(F)F)cc1 171332402 QQASUTXYLGKJQL-UHFFFAOYSA-N 346.352 1.752 10 10 EDCE NCc1cc(F)c(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2357592997 QPUVPPHNKUMKCM-AGEZSHCCSA-N 345.212 1.367 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CCCN(c3cnn(C)c3)C2)c(O)c1O 182504827 RLWRHNAWWRBMKT-LBPRGKRZSA-N 330.388 1.539 10 10 EDCE CC(=O)N(C(=S)N(C)[C@@H]1CCS(=O)(=O)C1)c1ccc(N)cc1 243817168 QTCVHCYGCBAPQA-CYBMUJFWSA-N 341.458 1.026 10 10 EDCE COC(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255715054 FONZNWIHACHZHK-SKHCZCESSA-N 344.411 1.700 10 10 EDCE Cc1ccc([C@@H](C)NC[C@]2(CO)COCC3(CCC3)N2C)c(O)c1 527956535 PYNDAXCJJSGAOS-BEFAXECRSA-N 334.460 1.967 10 10 EDCE COC(=O)[C@@]12CCOC[C@@H]1CN(Cc1ccc(N(C)C)c(F)c1)C2 373486842 UBGZSZBFIMENLU-KBXCAEBGSA-N 336.407 1.903 10 10 EDCE CO[C@@H]1CN[C@H](C(=O)NCc2ccc(C)c(Br)c2O)C1 2380747661 WLLZZWRWKBTHEM-QWRGUYRKSA-N 343.221 1.456 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2COCCN2C)c(O)c1Br 2380752238 TWQIULGAGCFPNY-LLVKDONJSA-N 343.221 1.410 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(CO)CCNC2)c(O)c1Br 2381126764 UTZDBQMQOZTBFR-AWEZNQCLSA-N 343.221 1.051 10 10 EDCE Cc1ccc(CN2CC[C@H](C(CO)CO)C2)c(O)c1Br 2381138019 RTEZWNCICQGPCL-NSHDSACASA-N 344.249 1.886 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)NCCc1nnnn1C 802275355 RHTUIKQINSEIID-UHFFFAOYSA-N 332.408 1.470 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CCC[C@H](CO)C1 298249527 MVAPPRRDDLQYKS-DLBZAZTESA-N 347.459 1.874 10 10 EDCE CO[C@@H]1COCC[C@@H]1CC(=O)N1CCOc2cc(N(C)C)ccc21 294857725 GCUFGKVWOJGFIJ-CXAGYDPISA-N 334.416 1.920 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCN(c2ccc(F)c(F)c2)C1=O 808507978 NCWBDGMCNNMAHB-JTQLQIEISA-N 325.267 1.019 10 10 EDCE CO[C@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1 819973726 BTZBFCCAWXHSRY-AEFFLSMTSA-N 348.443 1.533 10 10 EDCE O=S(=O)(C[C@@H]1CNCCO1)Nc1cc(Cl)c(O)c(Cl)c1 722221847 QINFUHBNIREMOS-QMMMGPOBSA-N 341.216 1.429 10 10 EDCE C[C@@H]1Cc2ccccc2N(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)C1 729424210 OASHIMUBPNHGEI-MMQHEFTJSA-N 339.395 1.323 10 10 EDCE COC(=O)CC[C@H](N)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 828988293 PPWMOOHONNNHTC-KRWDZBQOSA-N 347.459 1.820 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@H]3CCCNC3=O)CC2)cc1 726712306 JPHBBBHQVDVIJM-INIZCTEOSA-N 346.431 1.242 10 10 EDCE Nc1ccc(OCCCOn2c(=O)c(=O)oc3cc(N)ccc32)cc1 821296435 CMDVEHCESYAVPA-UHFFFAOYSA-N 343.339 1.017 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCCCn1ccnn1 588427168 PBFFILIDYKBYDN-DAXSKMNVSA-N 341.415 1.334 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCN([C@@H]2CCOC2)CC1 827114832 XIZZRHYWEZWAPV-LJQANCHMSA-N 331.460 1.430 10 10 EDCE Cc1cc(O)c(CNCC[C@@H]2CNCCS2(=O)=O)c(Cl)c1 903970350 VTPKEEZEDIBUJJ-LLVKDONJSA-N 332.853 1.220 10 10 EDCE Cn1ccnc1CN1CCC[C@H](N[C@@H]2CCc3cccc(O)c32)C1=O 834759795 FWTCIYFELMTBKL-CABCVRRESA-N 340.427 1.894 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)N[C@](C)(CCF)C3=O)C2)cc1 849356090 CCDKOLPGDYCBPY-SUMWQHHRSA-N 335.379 1.944 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CNCC[C@H]1C 842267276 WZVAPSOTRJJBKO-ZBFHGGJFSA-N 347.459 1.635 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](C)Cn1cncn1 840276159 AFLXSEJFHOJNMI-GJZGRUSLSA-N 344.463 1.971 10 10 EDCE COc1cccc(CNC(=O)c2cnc3c(cnn3C)c2OC)c1O 752596488 QOOWWNAPBKXANT-UHFFFAOYSA-N 342.355 1.621 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3C[C@H](N)C34CCC4)CC2)cc1 925508625 RRRINKCZRCNAKR-OALUTQOASA-N 344.503 1.677 10 10 EDCE CCOC(=O)c1cc(CS(=O)(=O)NCc2ccccc2O)on1 859002060 JRQVMCNLMZMAJG-UHFFFAOYSA-N 340.357 1.177 10 10 EDCE CC[C@H](NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)C(=O)NC 852448171 HFJQIVDFCRWKQY-DOMZBBRYSA-N 334.420 1.098 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)CS1(=O)=O 853245461 ZQIGCBWNQFIASX-TZMCWYRMSA-N 339.461 1.518 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCc3cnn(C)c3)C2)cc1 855228672 CSHWYIDRJFJLMJ-OAHLLOKOSA-N 328.416 1.756 10 10 EDCE OC1CCN(c2ccc(CNC(=S)NC[C@@H]3CCCO3)cc2)CC1 853040740 GGZKECSLVRWAPZ-KRWDZBQOSA-N 349.500 1.791 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCNC12CCC2 861792942 VFTAOMBPJLRVGL-MRXNPFEDSA-N 345.443 1.532 10 10 EDCE CC[C@H](NC[C@@]12COCCN1C(=O)COC2)c1ccc(N(C)C)cc1 866552730 BNTGYPSEIOTJBK-HKUYNNGSSA-N 347.459 1.421 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2cc(Cl)c(C)cc2O)CCO1 862460530 FITLWDVNDMEEPF-LBPRGKRZSA-N 327.812 1.484 10 10 EDCE Cc1cc(O)c(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1Cl 1118640671 NPTHHPWZDMBGOO-OAHLLOKOSA-N 345.848 1.744 10 10 EDCE CCN1CC[C@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)[C@H](C)C1 1118946402 ZQCCHOWJPCZMMS-CJNGLKHVSA-N 345.443 1.423 10 10 EDCE C[C@H](C(=O)N1Cc2cccc(O)c2C1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 871200227 ZWHDQVVFCSUDRX-XBFCOCLRSA-N 342.395 1.798 10 10 EDCE Cc1cc(CC(=O)N(C)[C@@H]2COC[C@H]2O)c(C)n1-c1ccccc1 899359147 WTHDXWAGISYETB-QZTJIDSGSA-N 328.412 1.855 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1CN([C@@H]2CCOC2)C1 895526892 TXPBBSSNTMQUJR-GOSISDBHSA-N 331.460 1.822 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/[C@@H]1CCOC1 1138055449 YQWNWXQWPUKNGA-HRLNJXSSSA-N 349.383 1.281 10 10 EDCE COC(=O)[C@@H](COC1CCC1)N(C)C(=O)c1ccc(C)c(O)c1O 1150789411 HFEHLRAMGKKNCE-CYBMUJFWSA-N 337.372 1.589 10 10 EDCE OCC1(O)CC(NCc2cc(Cl)cc(Br)c2O)C1 2256982659 MRPZMMZHPNHCJA-UHFFFAOYSA-N 336.613 1.784 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CCNC(=O)C(C)C 1306080751 QRTZLPOBDMKXQQ-UHFFFAOYSA-N 345.447 1.955 10 10 EDCE CN(C[C@@H]1CCCS1(=O)=O)c1ccc(CO)c(Br)c1 694116201 IIKGWBZZMHALJR-LBPRGKRZSA-N 348.262 1.955 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H]2CCN(C)C2=O)cc1C 1265812966 HWZCERSNZQSSOI-DZGCQCFKSA-N 333.432 1.076 10 10 EDCE C[C@@H](O)CNCC[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1272651246 CEJYZFOGYFMFKZ-CHWSQXEVSA-N 347.419 1.672 10 10 EDCE CN(C)c1ccc([C@H](NN)c2nc(Br)nn2C)cc1 2116535186 ZTORNWYDLQOZOF-JTQLQIEISA-N 325.214 1.196 10 10 EDCE CC(C)(C)[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1nc(=O)o[nH]1 1469343601 UAQVRMLNPBNKNJ-VUDGCMKMSA-N 333.344 1.691 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)Cn3ccnc3)C2)cc1C 1479418324 GIUJWFVZJDCRRQ-QAQDUYKDSA-N 342.443 1.885 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cn3ccnc3C)CC2)cc1C 1483790860 NDUIXDWNPQFZRR-UHFFFAOYSA-N 342.443 1.947 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)C(C)(F)F)cc1C 1717908806 JMMVGEMGKMASFP-CYBMUJFWSA-N 330.375 1.568 10 10 EDCE Cn1c(Br)nnc1CNCc1cc(F)cc(F)c1O 2121520247 LVOVEKMEDLYZOE-UHFFFAOYSA-N 333.136 1.851 10 10 EDCE COc1c(F)cc(C(=O)NCCc2ccc(O)c(O)c2)c(N)c1F 1631509908 GMFCPBOEXYXSNK-UHFFFAOYSA-N 338.310 1.939 10 10 EDCE O=C(CNC(=O)c1ccc(F)c(F)c1)NCc1cccc(O)c1O 1637045299 DDVWQZRGDMENRQ-UHFFFAOYSA-N 336.294 1.422 10 10 EDCE CCc1nc2c(C(=O)NCCc3ccc(O)c(O)c3)ccnc2[nH]1 1566370168 OXFNGQGTVLNSAZ-UHFFFAOYSA-N 326.356 1.904 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1ccc(-n2cnnn2)cc1 1638569951 PSODFWHPADIGOJ-UHFFFAOYSA-N 346.350 1.846 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1CCC(=O)N1 1568730991 VDXXPZOWYFQGLH-OAHLLOKOSA-N 333.432 1.220 10 10 EDCE COC(=O)c1cc(CNC(=O)/C=C\c2ccc(O)c(O)c2)n(C)c1C 1644492901 LMNKVBOXTJFHAE-ALCCZGGFSA-N 344.367 1.861 10 10 EDCE COc1ccc(CNC2CC(CNC(=O)[C@H](C)NC(C)=O)C2)cc1C 1657169965 CMYZLAILFCFHNK-IGEOTXOUSA-N 347.459 1.513 10 10 EDCE COc1ccc(CNC2CC(CNC(=O)CN(C)C(C)=O)C2)cc1C 1657174108 YFWDLCJGMYIGGH-UHFFFAOYSA-N 347.459 1.466 10 10 EDCE CC1(C)[C@H](O)[C@@H](O)CN1c1cc(Br)c(CN)cc1F 2124800847 MNJUYOHCQKLIBU-NWDGAFQWSA-N 333.201 1.367 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)[C@H](O)C2)cc1Br 233113308 YSMAWUCRSOSVMS-ZIAGYGMSSA-N 329.238 1.491 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N3CC[C@@H]3CO)c(Br)cc21 2148968972 HLOMOVNXPUKPLV-AMIZOPFISA-N 340.221 1.623 10 10 EDCE COc1ccc(Br)c(CNC[C@@]2(O)CCCOC2)c1O 1971057716 YRRNVSXSUWISSU-AWEZNQCLSA-N 346.221 1.794 10 10 EDCE CCOC1(C(=O)N2CC(N=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 1985093565 BIKLNOUGHNQHOJ-UHFFFAOYSA-N 325.369 1.534 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)C1COC1 1985099703 ATLOSWGGBIINIG-NSHDSACASA-N 327.385 1.685 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 1985101851 YOWLKRVNOKKZDC-MNOVXSKESA-N 327.385 1.373 10 10 EDCE CC(C)(C)OC(=O)N[C@@]12C[C@@H]1CN(C(=O)Cc1ccc(N)cc1)C2 1999440510 GUNCKVLJVVBNNA-FZKQIMNGSA-N 331.416 1.937 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@H](C1)OC[C@@H]2C(=O)N1CC(N=[N+]=[N-])C1 2010403009 YVSFOTANBBSFIA-WOPDTQHZSA-N 337.380 1.389 10 10 EDCE Cc1cccc(CNC(=O)[C@H](CO)CNC(=O)OC(C)(C)C)c1O 2024805970 VKKADTRNXSFKRD-ZDUSSCGKSA-N 338.404 1.450 10 10 EDCE Cc1ccc(CNC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c(O)c1 2024810536 DSISOOYGMHIFHU-UHFFFAOYSA-N 335.404 1.265 10 10 EDCE CCCNCc1ccc(N2CC[C@@H](O)[C@H](O)C2)cc1Br 2188625799 AORBTHZEZLSANL-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)O)CCN(CCc2ccc(N)cc2)C1 2044611462 OQXAPVMAJZMGKL-GOSISDBHSA-N 349.431 1.865 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C2C[C@H]3[C@@H](C2)C31C(=O)C(=O)C[C@H]1C[C@H](N)C1 2065365306 JQEPGLFBIBAYKL-CUWOYBLASA-N 348.443 1.801 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)C[C@@H]2CO)cc1Br 2089864587 VKONHADHOSVJKS-JFGNBEQYSA-N 330.222 1.682 10 10 EDCE COc1ccc(N2C[C@H](O)[C@H](N(C)C)C2)c(OC)c1Br 2234892047 JRVPLYUCSFLBMY-MNOVXSKESA-N 345.237 1.577 10 10 EDCE C[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2273221529 ASSUMBKPPAWWOY-HQDFOZKBSA-N 326.194 1.361 10 10 EDCE Cc1cccc(C=C2SC(=S)N(CC(=O)NCCO)C2=O)c1 2294871877 COYFERXHWYLLSD-UHFFFAOYSA-N 336.438 1.305 10 10 EDCE CC(C)NCc1ccc(N2CC(O)(CCO)C2)cc1Br 2286181758 LKPUTTQLLKBJCO-UHFFFAOYSA-N 343.265 1.881 10 10 EDCE COC(=O)C=Cc1ccc(N(C)CCN2CCOCC2)c([N+](=O)[O-])c1 2297444042 NIJDCWNYEIAPGO-UHFFFAOYSA-N 349.387 1.549 10 10 EDCE Cc1ccc(CNC(=O)c2cnc(O)[nH]2)c(O)c1Br 2352623426 HNJPJUAKFVJVKF-UHFFFAOYSA-N 326.150 1.822 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@]23C[C@@H]3N)c(O)c1Br 2352642517 GDPJTQKQMOOKKT-BHDSKKPTSA-N 325.206 1.817 10 10 EDCE CC1=C(C(=O)N(C)C)[C@H](c2ccc(N3CCOCC3)cc2)NC(=O)N1 6317801 ZGTZVMSWOFFBJY-INIZCTEOSA-N 344.415 1.239 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H]3CCN(C(C)=O)C3)CC2)cc1 176083348 CXHGNJORCPFOQJ-MRXNPFEDSA-N 345.443 1.602 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCCN(C)C(=O)C2)cc1 187838634 RGLVXAJIXSRKTJ-UHFFFAOYSA-N 332.448 1.907 10 10 EDCE COCCNC(=O)Cn1cc(N[C@H](C)c2cc(C)ccc2O)cn1 186498142 BWAFEBHFKKQZQS-CYBMUJFWSA-N 332.404 1.833 10 10 EDCE CC(/C=C1\SCCN1C)=C1/SC(=S)N(CC(=O)O)C1=O 31374540 LNKNWPNGZMWPFA-OUOSTHCTSA-N 330.456 1.725 10 10 EDCE CN(C)c1ccc(/C=C\C(=O)NCC(=O)Nc2nccs2)cc1 98055528 KXFSTORHNWJKAD-YVMONPNESA-N 330.413 1.977 10 10 EDCE C[C@H](O)CN1CCN(Cc2ccc(N3CCOCC3)cc2)C[C@@H]1C 245791589 WGACVTZPMINLJM-IRXDYDNUSA-N 333.476 1.410 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1nnn(C(C)(C)C)n1 611658307 SKSBOALHJIONNF-UHFFFAOYSA-N 330.392 1.533 10 10 EDCE O=C1C[C@]2(CCN(C(=O)NCc3ccc(N4CCCC4)cc3)C2)CN1 279590193 VGOVEBXKGLWGHV-LJQANCHMSA-N 342.443 1.708 10 10 EDCE CO[C@@H]1CC[C@@H]2OCCN(C(=O)/C=C/c3ccc(O)c(O)c3)[C@@H]2C1 378554922 SFICWCCNYCJJKS-IUBSDODLSA-N 333.384 1.906 10 10 EDCE NC(=O)C1CN(c2ccc(/C=C/C(=O)O)cc2Br)C1 381961033 FSAOAOUVGDQDQP-DUXPYHPUSA-N 325.162 1.468 10 10 EDCE COC[C@](C)(CCO)NC(=O)c1cc2cc(O)c(O)cc2s1 901348412 NCUKVVIRVDMIIS-HNNXBMFYSA-N 325.386 1.830 10 10 EDCE C[C@H](NC[C@@]1(CO)COCCN1C)c1cc2c(cc1O)CCCC2 903283095 WRBGKWLFINWOPK-IFXJQAMLSA-N 334.460 1.615 10 10 EDCE Cc1cc(O)c(CN2CCN(c3nccn(C)c3=O)CC2)cc1Cl 824851165 TUWRNOOSVNFVKB-UHFFFAOYSA-N 348.834 1.770 10 10 EDCE COC1CCN(c2ccc(CN3CCN(CCO)[C@H](C)C3)cc2)CC1 828987405 CMUFAWVPQMRGLX-QGZVFWFLSA-N 347.503 1.800 10 10 EDCE CN(C)c1ccc(/C=C\CNC[C@H]2CCN(S(C)(=O)=O)C2)cc1 835043071 ZZNKRGILMJEYLZ-YIEVGGLXSA-N 337.489 1.637 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCC(NS(C)(=O)=O)CC2)cc1 835026169 RDTSMNQAIVMYRP-SNAWJCMRSA-N 337.489 1.779 10 10 EDCE C[C@H](NC(=O)N1CCN(CCO)C[C@H]1C)c1ccc(N(C)C)cc1 838560043 SYMJUDCQGNXOLD-CABCVRRESA-N 334.464 1.522 10 10 EDCE Cc1c(C(=O)OCC(=O)c2ccc(O)c(O)c2)nn2c1OCCC2 837764448 JYXZKGUWRUYOGM-UHFFFAOYSA-N 332.312 1.425 10 10 EDCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C(=O)c1cc(O)cs1 749299719 YNRUYJCYTJNOJI-LSKIRQOJSA-N 339.369 1.019 10 10 EDCE O=C(NCc1ccccc1O)NC[C@@H](N1CCNCC1)C(F)(F)F 841991353 BGGYRJFBOQOKEW-CYBMUJFWSA-N 346.353 1.028 10 10 EDCE CCN(CC)c1ccc(CNS(=O)(=O)[C@H]2CCCNC2)cc1 923591435 ANVNFFVZRJJWFI-INIZCTEOSA-N 325.478 1.704 10 10 EDCE OCCO[C@@]1(CNCc2cc(Cl)cc(Cl)c2O)CCOC1 850358138 HUDIZGDCDGNMDS-CQSZACIVSA-N 336.215 1.957 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)[C@H]1CCN(CC(=O)O)C1=O 852726559 SGOXHBCPJHSBGS-KRWDZBQOSA-N 345.443 1.794 10 10 EDCE Nc1ccc(NS(=O)(=O)c2cc(F)cc(F)c2O)cc1[N+](=O)[O-] 753015283 CLOQLZXDDDVRCI-UHFFFAOYSA-N 345.283 1.962 10 10 EDCE O=S(=O)(NCc1c(O)cccc1F)c1cnn([C@H]2CCOC2)c1 921452764 YVUQNLMKCKSOOP-JTQLQIEISA-N 341.364 1.168 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(C(N)=O)[nH]3)C2)cc1 857302158 HXGBABHGFAIGBA-LLVKDONJSA-N 328.372 1.131 10 10 EDCE NC(=O)C[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 761908857 XDBRLVWWNUPGBW-SECBINFHSA-N 334.332 1.018 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC(=O)N(C)C2)cc1 860607254 VKUSAFDCDFQZNK-UHFFFAOYSA-N 339.395 1.707 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC[C@@H]3OCCNC(=O)[C@@H]32)c1O 879720871 VBNKAVFINABPOG-LSDHHAIUSA-N 336.363 1.213 10 10 EDCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C1(O)CCC1 773576052 BUXOTSPHCXYMOG-UHFFFAOYSA-N 343.471 1.750 10 10 EDCE COC(=O)[C@H]1CN(C(=O)/C=C/c2cnn(C)c2)c2ccc(F)cc2O1 1130592206 DUADEZHGVUBERA-YFCVBGDOSA-N 345.330 1.540 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(O)CCO[C@@H]1C 1306079651 CUCUEPAWXGNJCN-ACJLOTCBSA-N 346.431 1.722 10 10 EDCE COC(=O)c1cccc2nc(NC(=O)Cc3ccc(O)c(O)c3)[nH]c12 1152029250 YZLPYDFYDDERRS-UHFFFAOYSA-N 341.323 1.942 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H](CNCCO)C2)cc1 1317166584 MKODAHRSPGYSBY-LBPRGKRZSA-N 333.392 1.283 10 10 EDCE NCc1ccc(N2CC[C@H](CC(N)=O)C2)c(F)c1Br 690772648 RTKLHEZSPITLLZ-MRVPVSSYSA-N 330.201 1.749 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@](C)(O)[C@H](O)C2)c(Br)c1 1893331930 NMWMJINUJYEULT-OWYVNGRQSA-N 330.222 1.824 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@H]2CC[C@H]2OC)cc1 1333088788 NTROICJLMFPQLR-DLBZAZTESA-N 347.459 1.785 10 10 EDCE C[C@@H]1C[C@@H]1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1257235042 XYZRNWJSPFJBPV-GDBMZVCRSA-N 345.443 1.254 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)Cc2ccco2)cc1C 1332588798 SFWQGKLHUXMVOH-INIZCTEOSA-N 346.427 1.748 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)C[C@@H]2COC(=O)C2)cc1C 1277793809 VUKVBMYLHNTIQX-ZBFHGGJFSA-N 348.443 1.893 10 10 EDCE CCc1cccc(NC(=O)CNC(=O)Cc2ccc(O)c(O)c2)c1 1292350127 BJYWRHPVRJHOSV-UHFFFAOYSA-N 328.368 1.958 10 10 EDCE COC(=O)c1cc(NC(=O)c2cccc(O)c2O)c(O)c(OC)c1 1603059435 ZAWFPAPEJKLWIW-UHFFFAOYSA-N 333.296 1.851 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H]2CCCCO2)cc1C 1482722284 LAIIODXMWSAZSN-WBVHZDCISA-N 336.432 1.139 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)Cn2cccn2)cc1C 1485120798 JBQDOTATLQAGQC-CABCVRRESA-N 330.432 1.883 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H](n3ccnn3)C2)cc1 1626976952 ISEBOPIEULKFEZ-CYBMUJFWSA-N 327.348 1.918 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@]2(C)CCNC2=O)cc1C 1715948529 HNZFFONMOJWSPM-ACJLOTCBSA-N 333.432 1.124 10 10 EDCE C[C@@H]1[C@@H](NCCCO)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1725575435 QBSMOSJODREXTL-RISCZKNCSA-N 333.392 1.424 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(CCN2CCOCC2)CC1 1640818650 XXRYYVFSEUZYGN-UHFFFAOYSA-N 348.443 1.601 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cn(C)nc2C)cc1C 1662185379 ZMURBJNDHCOAAA-CYBMUJFWSA-N 330.432 1.954 10 10 EDCE CC(C)(NC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)N1CCCC1 1596510782 PFNNOOIZHIGRHB-UHFFFAOYSA-N 331.376 1.980 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2cn(C3CC3)c(=O)nc2O)c1 1684887523 KVXSVIKOTRYVQW-UHFFFAOYSA-N 344.371 1.297 10 10 EDCE COc1cccc(CNC(=O)NCc2nc(C(F)(F)F)no2)c1O 1685042308 JOYVGJCOXVHEBE-UHFFFAOYSA-N 346.265 1.802 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@@H](C)NC(N)=O)cc1C 1699403294 RJMHGVXPEVYFHU-OLZOCXBDSA-N 336.436 1.045 10 10 EDCE Cn1nnnc1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 169867025 OATZNGVQBDAKGH-UHFFFAOYSA-N 347.334 1.167 10 10 EDCE C[C@H](O)[C@@H](C(=O)O)N1C(=O)/C(=C\c2cccc(O)c2)SC1=S 1858592044 GZHHBUOCCCYKON-OMOYZJFYSA-N 339.394 1.427 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)[C@@H]2CCCCN2)c2nccn2C)cc1 1866038880 GQJVTTYHKTWZBM-DLBZAZTESA-N 341.459 1.834 10 10 EDCE C[C@H](NC(=O)c1nnn(-c2ccc(N)cc2)n1)[C@@H]1C[C@H]2CC[C@H]1C2 1857878760 LKQHCUVCWSDPLW-ASHKBJFXSA-N 326.404 1.799 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@H](O)[C@H]3C)c(Br)cc21 1914304171 UJGNXBZJQBXORL-BLBGDKDGSA-N 340.221 1.621 10 10 EDCE C[C@H](c1ccccc1O)N(C)C(=O)[C@H](CO)NC(=O)OC(C)(C)C 1968793433 XCZMLDOPQJDXJX-YPMHNXCESA-N 338.404 1.797 10 10 EDCE COCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC(N=[N+]=[N-])C1 1985103002 OSQYDIZPPPYOOZ-LLVKDONJSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CC1 2011933785 LTGABVNNINEPGW-LLVKDONJSA-N 339.396 1.660 10 10 EDCE CCN(CCN(C)C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 708427894 TZIACTZUUPNKSH-CYBMUJFWSA-N 342.237 1.823 10 10 EDCE CN(C)C[C@@]1(O)CCN(c2ccc(CO)c(Br)c2)C1 713704458 HWYYPQVGZAKJAK-AWEZNQCLSA-N 329.238 1.444 10 10 EDCE O=C(O)[C@H]1CO[C@H](CNCc2cc(Br)cc(F)c2O)C1 715788388 MJBGGTHESGEHBS-SCZZXKLOSA-N 348.168 1.873 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCCC[C@H]1[C@@H](O)C(F)(F)F 2064875374 OONICMZRDWXFIX-IINYFYTJSA-N 333.306 1.945 10 10 EDCE C[C@H](N)c1ccc(N2CCN([C@H](C)CO)CC2)cc1Br 2169364684 RYUUBWWTHVDDFI-NEPJUHHUSA-N 342.281 1.972 10 10 EDCE CC[C@@H](c1cc(Br)ccc1O)N1CC(CO)(C(=O)O)C1 2201042636 HRIRBVXCQJCBKT-NSHDSACASA-N 344.205 1.985 10 10 EDCE COc1ccc(N2CCO[C@H](CN)C2)c(OC)c1Br 2106334990 QRPGVHAZHXFTAS-SECBINFHSA-N 331.210 1.630 10 10 EDCE CO[C@@H]1C[C@@H](O)CN(c2cc(Br)c(CN)cc2F)C1 2109015060 CKCDDXMWKNMXJH-NXEZZACHSA-N 333.201 1.633 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC[C@@H]3CO)c(Br)cc21 2092555536 OBJFFBLIRYTWJT-JMCQJSRRSA-N 326.194 1.233 10 10 EDCE CSc1ncc(C=C2C(=O)NC(=O)N(Cc3ccco3)C2=O)cn1 2296649516 DLLNCBVDNCKVLS-UHFFFAOYSA-N 344.352 1.454 10 10 EDCE CCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1ccc(F)cc1 490574580 AWOSADHOZBPVTH-YHYXMXQVSA-N 331.347 1.289 10 10 EDCE CNC(=O)CCCN(C)c1ccc(C=CC(=O)OC)cc1[N+](=O)[O-] 2303657701 UGOZQRQTMFDKLY-UHFFFAOYSA-N 335.360 1.743 10 10 EDCE Oc1cc(Br)ccc1CNC[C@@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2355453033 PLZSZCKUIKHJMQ-UCTJBKIYSA-N 342.233 1.622 10 10 EDCE CCc1nnc(CN2CCN(c3ccc(OC)c(F)c3)CC2)n1C 177713051 NJPKXFBSDFCMBN-UHFFFAOYSA-N 333.411 1.847 10 10 EDCE O=C(Cc1c[nH]c2ccccc12)NCCN1C(=O)CSC1=S 49755639 YSOXRUUMMPVHLJ-UHFFFAOYSA-N 333.438 1.687 10 10 EDCE CN(C(=O)c1cccc(O)c1O)[C@@H]1CCCN(c2cccnn2)C1 193078414 YVYKYYVTAOHYLI-GFCCVEGCSA-N 328.372 1.629 10 10 EDCE CN1C2(CCC2)COC[C@@]1(CO)CNCc1c(O)cccc1Cl 527753992 NBTKMFZDDPGVPN-KRWDZBQOSA-N 340.851 1.751 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCc3ccnc(O)c3C2)c1O 278439521 VPGHDEOCIMSKBO-UHFFFAOYSA-N 331.328 1.968 10 10 EDCE COc1ccc(N2CCN(C(=O)c3coc(C(N)=O)c3)CC2)cc1 273489666 AHXZRXLRTPHVTL-UHFFFAOYSA-N 329.356 1.350 10 10 EDCE COc1ccc(N2CCO[C@@H]3CNC[C@@H]32)c(OC)c1Br 2162651094 SJRCNNLKOFIGAB-CMPLNLGQSA-N 343.221 1.643 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C[C@@H](C)O)C(C)C 807098117 TXXNUZUGUBIHNW-CQSZACIVSA-N 335.448 1.295 10 10 EDCE C[C@H](NC(=O)[C@@H](N)C(F)(F)F)c1ccc(N2CCOCC2)cc1 827726346 XOURNWJESRUPHF-GXFFZTMASA-N 331.338 1.590 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@H]3CCCN(C)C3=O)CC2)cc1 823003808 IWGJMSFSKTUWHW-QGZVFWFLSA-N 345.443 1.649 10 10 EDCE Cc1cc(CC(=O)N2CCS(=O)(=O)CC2)c(C)n1-c1ccccc1 825698262 NUKKZMXNZHQICA-UHFFFAOYSA-N 346.452 1.894 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@](O)(C(F)F)C2)cc1 831175000 BWAGLWXLJLHXOR-MRXNPFEDSA-N 327.375 1.071 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)CN3CC[C@H](C)C3)C2)cc1 848229077 GNHXTOMXXJFUQX-JKSUJKDBSA-N 331.460 1.980 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3cncc(O)c3)C2)cc1 923185241 DOUYSWNHIUWXCT-CQSZACIVSA-N 342.399 1.874 10 10 EDCE COCC(COC)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852370870 KYWQITFLFJLYDB-CYBMUJFWSA-N 337.420 1.235 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NCCC2(F)CCC2)cc1 853008804 ZNMIETNVNQKNDQ-UHFFFAOYSA-N 338.379 1.985 10 10 EDCE CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)C=C1CCNCC1)CC2 852841076 WKQSBYQXIBKAJL-UHFFFAOYSA-N 349.456 1.136 10 10 EDCE CCOc1ccc(O)c(CNC2CCN(C(=O)CCCNC)CC2)c1 853247677 XNHATRKHEVYYKN-UHFFFAOYSA-N 349.475 1.871 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCCN1C(=O)C1CC1 862024928 JXAZFJYHCABBSL-HNNXBMFYSA-N 339.395 1.958 10 10 EDCE Cc1noc([C@@H]2OCC[C@@H]2NC(=O)/C=C/c2ccc(O)c(O)c2)n1 863753483 VXBNFLSMWVIEPZ-YQRHFANHSA-N 331.328 1.449 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CC3(C)C)C2)cc1 1118683377 WOMCBLZEBZOGJE-UONOGXRCSA-N 345.443 1.552 10 10 EDCE COCCN(Cc1ccnn1C)C(=O)NCc1ccc(N(C)C)cc1 783744248 LUFXQBQIYBMCLK-UHFFFAOYSA-N 345.447 1.844 10 10 EDCE CCn1cc(-c2nn(C)cc2C(=O)N2C[C@H](C)Cn3nccc32)cn1 893888242 YCMUBYPPMURROI-LBPRGKRZSA-N 339.403 1.797 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 1301486071 JHTIEZOUUVVHEU-IAGOWNOFSA-N 346.427 1.400 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@H](CO)C2)cc1Br 396880384 OQALCXTUYCLPFZ-SWLSCSKDSA-N 343.265 1.738 10 10 EDCE O=C(O)CN1CCN(Cc2c(O)cccc2Br)CC1 706647688 PRGIMPTZBUQQFM-UHFFFAOYSA-N 329.194 1.357 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@](C)(O)[C@@H](O)C2)cc1Br 1893332428 RHGBULMBGZKFKC-IIMNLJJBSA-N 330.222 1.824 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccnc(F)c1 1335543399 VCVRPLUNEBYOQN-UHFFFAOYSA-N 344.390 1.562 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H]2CCCCN2C)cc1C 1507200318 FMMZZDAORLZFEE-SJORKVTESA-N 349.475 1.055 10 10 EDCE C[C@H](F)CCN[C@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1700808286 OLHWNVROEJJKDW-GWCFXTLKSA-N 339.371 1.277 10 10 EDCE CN(Cc1ccccc1O)C(=O)CCCn1cnc2c(N)ncnc21 1629954838 GFEXGFYISLEECC-UHFFFAOYSA-N 340.387 1.553 10 10 EDCE C[C@@H](CONC(=O)Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1631953768 IKIFSLZPYFLHRX-JTQLQIEISA-N 340.376 1.601 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2cnc[nH]2)cc1C 1567505060 IBASSVVSDFNCOX-UHFFFAOYSA-N 330.432 1.908 10 10 EDCE COCC(=O)Nc1cccc(CNC(=O)c2c(F)ccc(O)c2O)c1 1638142041 KUFNEQNMNNEFOB-UHFFFAOYSA-N 348.330 1.752 10 10 EDCE COc1ccc(CNC(=O)c2coc(S(C)(=O)=O)c2)c(O)c1 1635042138 HUPAJFYMJSORFG-UHFFFAOYSA-N 325.342 1.327 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1c(C)nc(O)nc1S 1568737974 VGVMVLNGILJATO-UHFFFAOYSA-N 340.401 1.901 10 10 EDCE O=C(N[C@H]1CS(=O)(=O)Cc2ccccc21)c1cccc(O)c1O 1646266819 ILGAQZLFDDENFV-ZDUSSCGKSA-N 333.365 1.497 10 10 EDCE CN1CCCc2cc(CNC(=O)c3cnc(N)c([N+](=O)[O-])c3)ccc21 1583628563 YTLXHJMQRLFAMK-UHFFFAOYSA-N 341.371 1.884 10 10 EDCE CC[C@H](CNC(=O)Cc1cncn1C)NCc1ccc(OC)c(C)c1 1665871209 DZJGTKMFTFGARW-MRXNPFEDSA-N 344.459 1.964 10 10 EDCE Cc1ocnc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1598009804 SDXRCFVIIYIPRO-UHFFFAOYSA-N 342.399 1.615 10 10 EDCE C[C@@H](NC(=O)NCc1cn(C2CC2)c(=O)nc1O)c1ccccc1O 1684982483 LNNQUWZOUBXGDI-SNVBAGLBSA-N 344.371 1.550 10 10 EDCE CC(=O)NCC(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCCCC1 1865948863 WCNHGUUXQWQUKY-GOSISDBHSA-N 346.475 1.532 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)CCCCN)c2nccn2C)cc1 1866097249 BVKMEPGIHDZZMM-QGZVFWFLSA-N 329.448 1.821 10 10 EDCE C[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 1914299978 ASSUMBKPPAWWOY-JPWUCKPDSA-N 326.194 1.361 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NCc2ccc(O)c(O)c2O)CCO1 1949591037 KBMSRUNXSLQXGC-LLVKDONJSA-N 340.376 1.834 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1OCC[C@@H]1N 1952548978 BLRTZPRHCLHEIA-ZOWXZIJZSA-N 338.404 1.650 10 10 EDCE C[C@@H](NC[C@H](CO)NC(=O)OC(C)(C)C)c1c(O)cccc1O 1985853817 DWEBLAZWBZGUPH-GHMZBOCLSA-N 326.393 1.634 10 10 EDCE Nc1ccc(CCN=c2ccc(I)n[nH]2)cc1 2004924664 FQNNZIKOJVOTAL-UHFFFAOYSA-N 340.168 1.740 10 10 EDCE COc1cccc(O)c1CNN1CCN(C(=O)OC(C)(C)C)CC1 1997918981 BMRKKFCWGBGUAN-UHFFFAOYSA-N 337.420 1.958 10 10 EDCE C[C@@]1(NC(=O)C(F)(F)F)CCN(C(=O)Nc2ccc(N)cc2)C1 1999442198 LIFTXAKZUOCKRE-CYBMUJFWSA-N 330.310 1.944 10 10 EDCE COC(=O)[C@@H](CC(=O)N(C)CCCN=[N+]=[N-])NC(=O)OC(C)(C)C 2010394564 DCLMGMULFCJVBK-SNVBAGLBSA-N 343.384 1.602 10 10 EDCE CNCc1ccc(N2C[C@H]3[C@@H](C2)OCCN3C)c(Br)c1 2153992673 WLWSVURPNQDEFC-LSDHHAIUSA-N 340.265 1.688 10 10 EDCE CS(=O)(=O)CC1CN(c2ccc(CO)cc2Br)C1 2041508825 JRKJHNPYGWBJED-UHFFFAOYSA-N 334.235 1.422 10 10 EDCE C[C@@H]1CS(=O)(=O)C[C@H]1NCc1cc(Br)ccc1O 711722445 PMTZAEIKNJLKBF-LDYMZIIASA-N 334.235 1.677 10 10 EDCE CN(C)C[C@@H]1CN(c2cc(Br)c(CN)cc2F)CCO1 2170355104 QDNBDWGNXMKWNX-LLVKDONJSA-N 346.244 1.814 10 10 EDCE O=C(NC[C@H]1CCCN(C(=O)C(F)(F)F)C1)c1ccc(O)c(O)c1 2054399812 WJPHMDSJNPSFSX-SECBINFHSA-N 346.305 1.629 10 10 EDCE CC1(CO)CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2101061115 UEUNLYAVWOXGSJ-NSHDSACASA-N 327.178 1.253 10 10 EDCE CN(C)C(=O)OC1CN(c2ccc(CO)cc2Br)C1 2090307363 BPYRCRGBIBXOND-UHFFFAOYSA-N 329.194 1.828 10 10 EDCE CSc1ncc(CNC(=O)N2CCSC[C@@H]2C(=O)O)s1 2284544262 NVMMDQLMBWEOTK-MRVPVSSYSA-N 333.460 1.577 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@H](O)CC2)cc1Br 2284557193 PAAPKYDYJHTCGX-GASCZTMLSA-N 343.265 1.881 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H]4COC[C@H]3C4)c(Br)cc21 2286951015 SFXAPXWPXMRKMB-HHURGBBESA-N 338.205 1.626 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@@H]2OCCN(C(=O)OC(C)(C)C)[C@H]21 2300530500 RHKADHANRHOXTA-SRVKXCTJSA-N 339.396 1.780 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCCCn1ccnn1 2308343966 PBFFILIDYKBYDN-UHFFFAOYSA-N 341.415 1.334 10 10 EDCE CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)NN1CCOCC1 2313681766 MSFOMOINXPQPRV-UHFFFAOYSA-N 345.359 1.428 10 10 EDCE Cc1ccc(CN2CCC[C@H]2[C@@H](O)CO)c(O)c1Br 2352946922 DPNIISRGFGBLMU-RYUDHWBXSA-N 330.222 1.781 10 10 EDCE COc1ccc(N2CCOCC2)cc1NC(=O)c1ccc(=O)[nH]c1 62274230 XHPLHDVVCACETQ-UHFFFAOYSA-N 329.356 1.472 10 10 EDCE O=C([C@H]1CCCN(Cc2cc3c(cc2O)CCC3)C1)N1CCOCC1 192806837 VXFSMZRKVHDDIT-KRWDZBQOSA-N 344.455 1.952 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCN3C)CC2)cc1 264810944 CCRTXLWYATZROE-SFHVURJKSA-N 346.475 1.028 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H](n4cccn4)C3)cc2N1 365831025 JYXUBRNJQVRHTF-JTQLQIEISA-N 329.316 1.574 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3C)C2)c1 361899051 GBOWTQCWLOWENE-QKCSRTOESA-N 333.388 1.209 10 10 EDCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@]2(CCOC2)O1 366491412 KPKNCHAIMBDYOH-MGPLVRAMSA-N 349.343 1.310 10 10 EDCE COC(=O)[C@H]1C[C@@H]1C(=O)NCc1ccc(C)c(Br)c1O 2380744675 LKUZTBOBLRMNEL-UWVGGRQHSA-N 342.189 1.888 10 10 EDCE CC(=O)N[C@@H](C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380763567 WGXPRFYVBLCVIA-VIFPVBQESA-N 343.221 1.946 10 10 EDCE Cc1ccc(CNC(=O)C2=NNC(=O)CC2)c(O)c1Br 2381130332 XHFROUBAFJUKHH-UHFFFAOYSA-N 340.177 1.345 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](C)Oc1cccc(Br)c1 808521636 YCGBYROPYCUURR-SECBINFHSA-N 329.146 1.918 10 10 EDCE CN1CCN(Cc2cc(C(=O)O)cc(Br)c2O)CC1 642880011 FURYSTVOYQZTGY-UHFFFAOYSA-N 329.194 1.600 10 10 EDCE CCOc1ccc(-c2noc(CCC(=O)OCC(=O)C(C)=O)n2)cc1 808501660 TXICPQCEZAXQSC-UHFFFAOYSA-N 346.339 1.769 10 10 EDCE CC[C@@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 817637807 BZCSNVNUNATSOR-ZYHUDNBSSA-N 342.417 1.451 10 10 EDCE CN(C)c1ccc2c(c1)CN(S(=O)(=O)c1cn(C)cn1)CCO2 581789642 CDJHYYVSZKQEFW-UHFFFAOYSA-N 336.417 1.069 10 10 EDCE C/C(=C/C(=O)N(CC(=O)O)Cc1ccccc1O)CN1CCOCC1 911490557 ZOQXLUXSYXRVGI-UVTDQMKNSA-N 348.399 1.084 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)[C@H]4[C@H](O)CCCN4C3=O)C2)cc1 849356363 DUEIVTQHKSYJNC-NUEKZKHPSA-N 345.399 1.061 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](CO)[C@@H](c2ccc(O)c(O)c2O)C1 687737234 VYXMFVNIXFTCCX-ONGXEEELSA-N 325.361 1.746 10 10 EDCE Fc1cc(CN2CCNC[C@H]2C(F)F)ccc1N1CCOCC1 843124970 SPYGHOINJOALSP-HNNXBMFYSA-N 329.366 1.701 10 10 EDCE O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NCc1c(O)cccc1F 928710661 VOEPPTGVLDECLE-TXEJJXNPSA-N 348.374 1.713 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)N3CC[C@H](C)C3)C2)cc1 849416166 LIMWARZTCQERHW-UONOGXRCSA-N 339.461 1.450 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc4nc[nH]c4n3)C2)cc1 855228286 YSTUDTGSHQYJMQ-LBPRGKRZSA-N 337.383 1.975 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCC3(O)CCC3)C2)cc1 852317164 DVZQJLQSCHKSRN-CQSZACIVSA-N 333.432 1.878 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCC[C@@H]3C[C@H]23)c1 855775942 ONBNEBQQQJFWIR-MDZLAQPJSA-N 338.429 1.930 10 10 EDCE CN(C)C(=O)N(C)[C@H]1CCN(C(=O)NCc2ccc(N(C)C)cc2)C1 853245183 VIDPIONHOROYCP-INIZCTEOSA-N 347.463 1.650 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2C[C@@H](O)C[C@@H](O)C2)c1 859789559 SIJSZTFCSIQEGH-HDICACEKSA-N 342.395 1.474 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)c2cc(C(C)(C)N)no2)cc1 852791758 LUIIYEDJHITKOI-CYBMUJFWSA-N 331.420 1.364 10 10 EDCE CCO[C@@H]1COCC[C@@H]1CC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 867302871 VFSJAYYSFIQTER-DXCKQFNASA-N 337.416 1.977 10 10 EDCE Cn1nnc2c1C[C@@H](C(=O)NCc1ccc3cccnc3c1O)CC2 862026094 GOOOKIMMEMFIML-LBPRGKRZSA-N 337.383 1.490 10 10 EDCE COC(=O)c1ncoc1COCC(=O)NCc1cc(C)ccc1O 862755837 ZMEHVFGJBVHPFW-UHFFFAOYSA-N 334.328 1.308 10 10 EDCE Cc1ncc(CNCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)o1 862294344 HUTMPUVUIYLJPO-OAHLLOKOSA-N 328.416 1.975 10 10 EDCE CC[S@](C)(=O)=NS(=O)(=O)N1CCOc2cc(N(C)C)ccc21 866899964 ZUZDGCVMQBGMKW-NRFANRHFSA-N 347.462 1.314 10 10 EDCE CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 867721394 UVVJIHPQOJCLQB-RHSMWYFYSA-N 347.459 1.737 10 10 EDCE COc1cc(N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)ncn1 764446763 KQASXERMRZMVHR-UHFFFAOYSA-N 344.371 1.167 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@H](C[C@H]1COCCO1)C(F)(F)F 1123890132 UIGJCSQGLFYZTP-QWRGUYRKSA-N 349.305 1.698 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H]1CCOC1 1317290308 QVMFRWJAHPTOIK-RYUDHWBXSA-N 333.392 1.593 10 10 EDCE CN(C)c1ccc(CN(Cc2ccco2)c2nc(N)nc(N)n2)cc1 1185694038 WROSJIDEIJBKTF-UHFFFAOYSA-N 339.403 1.902 10 10 EDCE C[C@@H]1CS(=O)(=O)C[C@H]1NCc1ccc(Br)cc1O 711774621 NFVOWZBFVSZPMQ-LDYMZIIASA-N 334.235 1.677 10 10 EDCE CS(=O)(=O)[C@H]1C[C@H](NCc2cccc(Br)c2O)C1 714252497 VAZGHTFBKKGQEW-MGCOHNPYSA-N 334.235 1.820 10 10 EDCE CC1(C)CO[C@H](CCNC(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1333041653 JSZFPZHQJVWPSP-CYBMUJFWSA-N 332.400 1.556 10 10 EDCE C[C@H](O)CNC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1269149961 XLRKXWPWVZWKJX-IINYFYTJSA-N 333.392 1.328 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C1CCC1 1285616185 XRNMHUMBGIZZEO-SNVBAGLBSA-N 331.376 1.884 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)C(C)(F)F)cc(OC)n1 1510426373 OGJDPPKLWSMTIT-SECBINFHSA-N 345.346 1.331 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@H]2C3)cc1Br 2116736547 KFELOEAIUPNAGD-ULTHFGNCSA-N 328.206 1.262 10 10 EDCE COc1ccc(N2CCC(NC(=O)C3(CO)CCOCC3)CC2)cc1 1292593016 AFKLVWJWKIRNCM-UHFFFAOYSA-N 348.443 1.569 10 10 EDCE CN(C)c1ccc(CNC(=O)CNC(=O)c2ncccc2O)cc1F 1464551709 XNXLJFLIOJCKJX-UHFFFAOYSA-N 346.362 1.039 10 10 EDCE COCCCOc1ccc(C(=O)NCc2cc(O)ccc2O)cn1 1471661216 JQXJBAAGSUUVES-UHFFFAOYSA-N 332.356 1.838 10 10 EDCE CC(C)CN1C[C@H]2C[C@H](O)CN2C2(C1)CN(Cc1ccccc1O)C2 1615258759 YKQDCROYABYQEE-MSOLQXFVSA-N 345.487 1.353 10 10 EDCE O=C(CCCNC(=O)c1ccccc1)NCc1cc(O)ccc1O 1558174002 BHHRMXZHFNVVEW-UHFFFAOYSA-N 328.368 1.924 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2cnn(C)n2)C2CC2)cc1C 1713120746 LQBGPWIFYWLFNB-OAHLLOKOSA-N 343.431 1.430 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2CCC(=O)N2)cc1C 1715370942 DUWNNLDHVNLNJI-ZFWWWQNUSA-N 333.432 1.219 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H](CO)Cc1cccnc1 1626908396 CMOCHRJIUKXCGX-CSPWOOARSA-N 328.368 1.473 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc(N2CCNC2=O)ccc1F 1638352608 SKHHVTJROXZMHW-UHFFFAOYSA-N 345.330 1.697 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H](C)n2cncn2)cc1C 1732685443 OEALVUVMKOSNQV-CABCVRRESA-N 345.447 1.841 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)[C@H]2CC23CC3)cc(OC)n1 1572305261 RIUCILYWVXAHCR-WCQYABFASA-N 347.415 1.476 10 10 EDCE C[C@H](NC(=O)NCCCn1ccc(O)nc1=O)c1ccccc1O 1774179437 XACIOYFTVKTZDW-NSHDSACASA-N 332.360 1.105 10 10 EDCE Oc1ccc(Br)cc1CN1CCO[C@@H]2CCNC[C@H]21 2129072647 RWJFFBXEWNLYOO-TZMCWYRMSA-N 327.222 1.717 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)[C@@H](C)CO)c(Br)cc21 228529390 CMHFNTZKWREQSS-JVXZTZIISA-N 328.210 1.479 10 10 EDCE CNC(=O)[C@]1(C)CCN(c2ccc(CN)cc2Br)C1 230893193 IBVYCUSXSXYNOW-CQSZACIVSA-N 326.238 1.870 10 10 EDCE OCc1ccc(N2CC[C@@]3(C[C@@H](O)CO3)C2)cc1Br 2137136437 VMJRWUGVVQYQTI-TZMCWYRMSA-N 328.206 1.672 10 10 EDCE C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1(NCCN=[N+]=[N-])C(N)=O 1949744191 JSTVGRYKWBNUMU-KBPBESRZSA-N 330.436 1.898 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)O1 2003171148 UYEJRORNPJVIRV-HKUMRIAESA-N 340.420 1.324 10 10 EDCE NCc1cc(F)c(N2CC[C@H]3CC(=O)N[C@@H]3C2)cc1Br 2145058402 TYFQYMKMORZSOE-QPUJVOFHSA-N 342.212 1.762 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H](C(=O)NCCCCN=[N+]=[N-])C1 2010406237 RJNFHYSCEZKKCF-NEPJUHHUSA-N 341.412 1.811 10 10 EDCE O=C(N1CCCC[C@@H]1CNCc1ccc(O)c(O)c1O)C(F)(F)F 401271009 UZAGRJPEUCABAD-SNVBAGLBSA-N 348.321 1.836 10 10 EDCE C[C@H](N)c1ccc(N2CCC(O)(C(N)=O)CC2)c(Br)c1 312262508 HIEYQOYWYQDFJK-VIFPVBQESA-N 342.237 1.285 10 10 EDCE CN[C@H](C)c1ccc(N(C)[C@@H]2CC(=O)NC2=O)c(Br)c1 2171209873 ZBPYJGBZBDTTDT-PRHODGIISA-N 340.221 1.581 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)[C@@H]1CCC[C@H]1O 709198544 UMISZWKBUMMLFW-RTXFEEFZSA-N 340.221 1.751 10 10 EDCE C[C@H]1CN(C)C[C@@H](CNCc2ccc(Br)cc2O)O1 691446756 TVXMTENNLQCIFI-GXFFZTMASA-N 329.238 1.963 10 10 EDCE CNC[C@@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 715768659 FTHWWWLULIMEFA-LLVKDONJSA-N 333.201 1.714 10 10 EDCE C[C@@H]1[C@@H](O)CCCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 384730402 JKLXDPJRENMNGJ-HYJLZEBJSA-N 340.221 1.751 10 10 EDCE O=C1Nc2cc(N3CCO[C@H](CF)C3)c(Br)cc2[C@@H]1O 2172042474 WDSVRTCTZYLMKW-KRTXAFLBSA-N 345.168 1.609 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N(C)CCCn3ccnc3C)c2n1 2064298623 MIMGSIIPVOEXOV-UHFFFAOYSA-N 328.376 1.411 10 10 EDCE COCCN(C)C1CN(c2cc(Br)c(CN)cc2F)C1 2192548727 QQNDQICSMOISTD-UHFFFAOYSA-N 346.244 1.814 10 10 EDCE COC(=O)[C@@H](NCCCN=[N+]=[N-])c1c(Br)nn(C)c1C 2188105550 ZJAPYZGCTMUSAK-VIFPVBQESA-N 345.201 1.995 10 10 EDCE NCc1ccc(N2CCO[C@]3(CCOC3)C2)c(Br)c1 2111916034 WQXSJXGHIRJXTC-CQSZACIVSA-N 327.222 1.904 10 10 EDCE CC(C)(C)OC(=O)NC[C@]12CCC[C@@]1(COc1nnc(=N)[nH]n1)C2 2213781302 QEBNGAJDCKNCQP-CABCVRRESA-N 336.396 1.143 10 10 EDCE CC(C)(C)OC(=O)N1CCOCC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 2244009921 PDYWTEUBMCLKCU-LLVKDONJSA-N 325.369 1.534 10 10 EDCE CSc1ncc(CNC(=O)N2[C@H](C)SC[C@@H]2C(=O)O)s1 2284542768 BFQJBCSIMJHESS-POYBYMJQSA-N 333.460 1.923 10 10 EDCE 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CN(C)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H]2CNC(=O)C2)cc1 126964152 OLORJVZIMCUVRD-DOTOQJQBSA-N 344.459 1.953 10 10 EDCE C[C@@H](NC[C@@]1(CCO)CCOC1)c1ccc(N2CCOCC2)cc1 125438333 AWOXUNDFJZGDHC-VQIMIIECSA-N 334.460 1.963 10 10 EDCE O=C(c1n[nH]cc1Br)N1CCc2cc(O)c(O)cc2C1 2366850762 OHRUCFCZTPXHSU-UHFFFAOYSA-N 338.161 1.782 10 10 EDCE O=C(NCCCN1CCOC1=O)NCc1c(O)ccc2c1CCCC2 266590563 YPFKLZKHIIDGNT-UHFFFAOYSA-N 347.415 1.913 10 10 EDCE Oc1cc2c(cc1CNC[C@H]1CCC3(CCOCC3)[C@H]1O)OCO2 282843844 OZDUOVJQHWXDRV-PXAZEXFGSA-N 335.400 1.778 10 10 EDCE C[C@@H](N[C@@H]1CCC(=O)N(C)C1=O)c1ccc(Br)cc1O 818362200 RIQAIIIJTOYQAZ-LDYMZIIASA-N 341.205 1.953 10 10 EDCE CCOc1ccc(CN2C[C@@H]3[C@H](C2)[C@@H](OC)CS3(=O)=O)c(O)c1 827389268 MXPCABVUZUAJTG-VNQPRFMTSA-N 341.429 1.035 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@H]3COC[C@H]3C2)cc1F 827575717 TTWHSOZECDGZDS-ZIAGYGMSSA-N 349.406 1.003 10 10 EDCE Cc1ccnc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)n1 837714384 KOLPXGVXYJOZLI-UHFFFAOYSA-N 348.353 1.830 10 10 EDCE COc1cnccc1N1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 831025455 ZOJUFRFQIRGMHR-UHFFFAOYSA-N 347.346 1.603 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(CC(F)(F)F)CC1 588405527 ZCRSJSRMLFWNCL-RQOWECAXSA-N 330.306 1.818 10 10 EDCE CCN1CCN(C[C@@H](C)CNC(=O)/C=C\c2ccc(O)c(O)c2)CC1 588404911 ZRURTJJFADRZPY-PKYBCLHXSA-N 347.459 1.501 10 10 EDCE Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)Cc1ccc(N)cc1 831505699 HSYAQIHXFPYOBF-MRXNPFEDSA-N 328.416 1.762 10 10 EDCE O=C(NCc1ccccc1O)[C@@H](C[C@H]1COCCO1)C(F)(F)F 830527354 ZMGVVRQCSQDIIR-NWDGAFQWSA-N 333.306 1.992 10 10 EDCE COc1cc(Br)cc([C@@H](C)NC[C@@]2(O)CCOC2)c1O 848535597 DWTUPGALMXHCLH-OTYXRUKQSA-N 346.221 1.965 10 10 EDCE C[C@@H]1C[C@@H](S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)CCO1 842785490 NXFKSOULLOYZHS-KCXAZCMYSA-N 341.477 1.239 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CC[C@H](C)N 843489072 CQSWEOLWJATOEJ-JTQLQIEISA-N 328.796 1.675 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)c2nc(C)c(C)s2)c1 751419498 UVBFSNOYKZKVRY-UHFFFAOYSA-N 328.415 1.953 10 10 EDCE CCOC(=O)C1(C(=O)NCc2c(O)cccc2F)CCOCC1 928707686 GQIFCAHYAJRKLG-UHFFFAOYSA-N 325.336 1.507 10 10 EDCE Cc1cn(C)nc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 850360484 JFDNKKCEAAMEHU-UHFFFAOYSA-N 333.367 1.189 10 10 EDCE CO[C@H](CNC(=O)NCc1cc(Cl)ccc1O)[C@@H]1CCOC1 852436283 HAERTPUAWXAKHD-QMTHXVAHSA-N 328.796 1.896 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3cnn(C)c3C)C2)cc1 852229220 OUIPEUHBOFHQMZ-HNNXBMFYSA-N 343.431 1.815 10 10 EDCE C[C@@H]1COCC[C@@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852281079 OXAHNJPULWWTCZ-KDOFPFPSSA-N 347.459 1.872 10 10 EDCE Oc1cccc2c1[C@@H](N[C@H]1CCN(c3ccc4nncn4n3)C1)CC2 858490200 VNGHISWVJGCGGA-KBPBESRZSA-N 336.399 1.686 10 10 EDCE CO[C@]1(CO)CCCN(C(=O)NCc2ccc(N(C)C)cc2C)C1 853749512 ULXHXJUQSMNRNR-GOSISDBHSA-N 335.448 1.744 10 10 EDCE COC(=O)Cc1ccc(NS(=O)(=O)c2cccc3nonc23)cc1 765038550 WEKRXRWFPOMGRY-UHFFFAOYSA-N 347.352 1.739 10 10 EDCE CS(=O)(=O)c1cccc2c1CCCN2C(=O)/C=C\c1cnccn1 1115934760 MTFBBAMQQXEZAR-FPLPWBNLSA-N 343.408 1.873 10 10 EDCE Cc1cccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)n1 788131259 OAACGUDKTKTYQG-UHFFFAOYSA-N 340.427 1.697 10 10 EDCE C[C@@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccccc1O 783535328 LVQURFXMJJBAGF-HIFRSBDPSA-N 328.416 1.968 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cc2cc[nH]c(=O)c2s1 1137464659 JROPHKXDGTYQLB-UHFFFAOYSA-N 330.365 1.973 10 10 EDCE O=C(N[C@@H](CO)C(=O)NCc1ccccc1O)OCc1ccccc1 1150535792 FJUJGXAZWAVGKL-HNNXBMFYSA-N 344.367 1.296 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3occc3N)cc2)C1 1349472219 HODZCIODHNOWEF-CYBMUJFWSA-N 342.399 1.494 10 10 EDCE COc1ccc(-c2nn(Cc3ccc(N)cc3)c(=O)[nH]c2=O)cc1C 82725299 CODQIJMDZRSLJU-UHFFFAOYSA-N 338.367 1.546 10 10 EDCE CC[C@H](F)C(=O)N(C)C[C@H](O)CNCc1ccc(OC)c(C)c1 1332552850 RDPLYQCPVWLQAB-CABCVRRESA-N 326.412 1.661 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@H]1COCCO1 1347839570 IEQGJUPOQZOCCP-ZDUSSCGKSA-N 329.780 1.436 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CC1CS(=O)(=O)C1 1351179427 WPXRRPILOXBKFM-UHFFFAOYSA-N 336.457 1.680 10 10 EDCE Cn1cnnc1[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1441233173 ACVNQZDJUUICLN-GFCCVEGCSA-N 341.375 1.997 10 10 EDCE NC(=O)Cc1cccc2c1CCN(C(=O)c1c(F)ccc(O)c1O)C2 1611620686 WPLATBFQKMKOMI-UHFFFAOYSA-N 344.342 1.463 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](C)N(C(=O)CCNC(N)=O)C2)cc1C 1717828236 PLJXMUJMCRFNBN-ZFWWWQNUSA-N 348.447 1.141 10 10 EDCE C[C@@H](NC(=O)[C@@H](C)n1cnc2c(N)ncnc21)c1ccccc1O 1557966446 BMUUWCWEWACJJT-NXEZZACHSA-N 326.360 1.553 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@H](C)[C@H](C)S(C)(=O)=O)c1 1630366440 PYYRBPUCSWKIQY-DCAQKATOSA-N 329.418 1.647 10 10 EDCE C[C@H](CNCc1ccon1)NC(=O)c1ccc(N=NC(N)=O)cc1 1669485424 GADVDRSSLPFYAV-SNVBAGLBSA-N 330.348 1.745 10 10 EDCE COC[C@@H](CC(=O)NCc1ccccc1O)NC(=O)OC(C)(C)C 1964889980 OSHOWHLOIQGYIJ-CYBMUJFWSA-N 338.404 1.938 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCc1nnc(O)n1C 1683611103 FYUPQLLDRMDCRJ-UHFFFAOYSA-N 344.419 1.463 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC(OCCCO)CC2)cc1 150872046 WWVAUYBTDRKPOB-UHFFFAOYSA-N 335.448 1.826 10 10 EDCE C[C@H](CCO)N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 1917039461 ITOHOYWGBZAYOV-KRTXAFLBSA-N 328.210 1.608 10 10 EDCE CC(C)(C)OC(=O)N1CC(ONC(=O)CCc2ccc(N)cc2)C1 2009380163 ZXIQEKMNJHEGBN-UHFFFAOYSA-N 335.404 1.869 10 10 EDCE COc1cccc(CNC[C@](C)(CO)NC(=O)OC(C)(C)C)c1O 2010528252 DZKAEPPBVZNYFY-QGZVFWFLSA-N 340.420 1.766 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CNC(=O)CCc1ccc(N)cc1 2011423305 ZZCANUWOYGDXSG-CQSZACIVSA-N 337.420 1.203 10 10 EDCE CN1CCc2cc(CNC[C@H](CO)NC(=O)OC(C)(C)C)ccc21 2011516768 NJVGIRGVIFQREN-OAHLLOKOSA-N 335.448 1.654 10 10 EDCE O=c1c2c(ccn1Cc1sncc1Br)CCNC2 2033367755 IBUSJFCMCJKDII-UHFFFAOYSA-N 326.219 1.761 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCOCC12CNC2 2111325189 HCUBMBGZPJMBBR-UHFFFAOYSA-N 331.185 1.468 10 10 EDCE COc1ccc(Br)c(CN(C)C[C@@H]2COCCN2)c1O 2236053601 XCPOOUDSTWHISC-SNVBAGLBSA-N 345.237 1.584 10 10 EDCE COc1ccc(N(C)Cc2c(Br)nnn2C)c(CO)c1 2236001662 ILGZXXMNVGPACJ-UHFFFAOYSA-N 341.209 1.715 10 10 EDCE COc1ccc(Br)c(CN[C@H]2COC[C@H]2N(C)C)c1O 2236029452 BDOXPEFQXHNBJZ-NWDGAFQWSA-N 345.237 1.582 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CC=CCN2)c(O)c1Br 2352640815 MVSMWBMBCNQZRE-NSHDSACASA-N 325.206 1.997 10 10 EDCE Cc1cc(C(=O)N2CC[C@@H](CO)[C@H](O)C2)c(C)n1-c1ccccc1 191981344 HXZPFIRNAFQRQT-MAUKXSAKSA-N 328.412 1.909 10 10 EDCE CC(=O)c1ccc(O)c(CN2CCSC[C@H]2S(C)(=O)=O)c1 90923026 ZPHCAYIMCRVZKU-CQSZACIVSA-N 329.443 1.514 10 10 EDCE CC(=O)N(C)c1ccc(N=N[C@H]2C(=O)N(C(N)=S)N=C2C)cc1 253961279 QZKUTISYFKZPGN-GFCCVEGCSA-N 332.389 1.583 10 10 EDCE COC(=O)CN(C(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(C)C 254966792 BZJINVCCUMJZCU-TWGQIWQCSA-N 346.427 1.946 10 10 EDCE CCNC(=O)N1CC[C@@H](N[C@H](C)c2cc(C(=O)OC)ccc2O)C1 273536125 XKZNLPXBGWHSIF-DGCLKSJQSA-N 335.404 1.633 10 10 EDCE Cn1nccc1CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 277290196 KJMQKGWCNZFYBL-UHFFFAOYSA-N 334.763 1.744 10 10 EDCE Cc1ncc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)s1 283395185 HIDWUUYNNLSOBG-UHFFFAOYSA-N 332.429 1.450 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](N)CCC(=O)O)c(O)c1Br 2380736921 IFFSJZICEUWIBV-VIFPVBQESA-N 345.193 1.271 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2C[C@@H](O)CN2)c(O)c1Br 2380764049 AGYYPLCMIPIBSD-MNOVXSKESA-N 343.221 1.144 10 10 EDCE CCC(CC)CNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 826834781 XBDYGOULVWCRCY-HNNXBMFYSA-N 347.459 1.943 10 10 EDCE NCc1ccc(N2CCNC(=O)C23CC3)c(F)c1Br 2132029292 RRAHOZSOPZZXIM-UHFFFAOYSA-N 328.185 1.516 10 10 EDCE CN(CC1(CO)CC1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823536736 HTOIDFQZGWNFCF-UHFFFAOYSA-N 347.459 1.562 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Nc3cc(OC)n(C)n3)C2)cc1 822698552 WGNXEFMAHHMLQS-LBPRGKRZSA-N 345.403 1.838 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C)[C@@H](C)CO)C2)cc1 824354786 RCKVPQJNQWHVTG-RRFJBIMHSA-N 335.448 1.838 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)Cc1cnnn1[C@H]1CCCNC1 903872768 BYPIVAQYHAFXLZ-KRWDZBQOSA-N 328.464 1.901 10 10 EDCE C/C=C/C[C@H](CO)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588495077 PYPFQFJLNQUIQD-JFJSHUGVSA-N 330.428 1.980 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@H]1CN(C2CC2)C(=O)O1 847318027 CFLYCAYXGVQECC-INIZCTEOSA-N 346.431 1.843 10 10 EDCE C[C@H](NC(=O)c1c[nH]ccc1=N)c1ccc(N2CCOCC2)cc1 844176847 VZNYUXNYNKITHZ-ZDUSSCGKSA-N 326.400 1.822 10 10 EDCE CCc1cccc(CN2CCCN(S(=O)(=O)C3CC3)CC2)c1O 848908855 FSGLNPUHAOURSO-UHFFFAOYSA-N 338.473 1.955 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 926655836 CGUVTNPEIAMURQ-GLJUWKHASA-N 346.427 1.874 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CNCC[C@@H]1C 842267272 WZVAPSOTRJJBKO-GOEBONIOSA-N 347.459 1.635 10 10 EDCE C[C@@H](NC[C@@H](O)CC1(O)CCC1)c1ccc(N2CCOCC2)cc1 859230355 VEAFOFDRBKJDHP-QAPCUYQASA-N 334.460 1.840 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCCC(C)(C)O2)cc1 929238670 RUFNGNAYEPQROJ-INIZCTEOSA-N 347.459 1.833 10 10 EDCE COc1ccc(N2CC[C@H](NCc3c(C)nn(CCO)c3C)C2)cc1 1118420611 SDZIAJPBWZAOQM-INIZCTEOSA-N 344.459 1.869 10 10 EDCE Cc1nc(C)c(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)s1 776434427 FHLQGHYLBBDTEN-UHFFFAOYSA-N 328.371 1.965 10 10 EDCE CC[C@H]1C(=O)N(CC)CCN1Cc1ccc(N2CCOCC2)cc1 779217018 NMXJZHZQARRFGH-SFHVURJKSA-N 331.460 1.966 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N3CC(C)(C)C3)CC2)cc1 788925130 HPDRUIFPMBLSBA-UHFFFAOYSA-N 346.475 1.869 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1cccc(C(=O)NC2CC2)c1 784442057 LRAFMLYQFMBHPE-UHFFFAOYSA-N 326.352 1.920 10 10 EDCE COC(=O)c1nscc1S(=O)(=O)Nc1ccc(O)c(OC)c1 797820427 XKPPUMBIQGZPIA-UHFFFAOYSA-N 344.370 1.445 10 10 EDCE Cc1ccc(-c2nnn(CC(=O)NCc3cc(C)ccc3O)n2)cc1 1147956709 IUXVWOWIIIMNAV-UHFFFAOYSA-N 337.383 1.979 10 10 EDCE C[C@H](NC(=O)c1sccc1S(N)(=O)=O)c1ccccc1O 1302538067 GKEPWRHSMMHISZ-QMMMGPOBSA-N 326.399 1.592 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H](C)C(F)(F)F)cc1C 1320256397 HIFLHIWMVSWAFC-WCQYABFASA-N 348.365 1.769 10 10 EDCE CO[C@@H](C)CNCC1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1328961717 VZSSOTUDJDSGAH-BZUNDVKYSA-N 347.419 1.982 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C4CCC3(CO)CC4)C2)cc1 1332365517 SYCPYHUBFCLZKR-ICXUMSERSA-N 345.443 1.973 10 10 EDCE CO[C@@H]1CC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1334574405 UILJJQGLEUTFGG-DLBZAZTESA-N 345.443 1.539 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)NC[C@H]2CC3CCC2CC3)cc1 1345992872 LQOIIPBURORSCY-UYSNPLJNSA-N 329.444 1.870 10 10 EDCE CCNC(=O)CC(=O)N1C[C@H](C)[C@@H](NCc2ccc(OC)c(C)c2)C1 1281389241 DJWLLBWCCRIAFJ-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1COc2ccc(O)cc2O1 1447561672 JPOLMDQYVNDMLC-QGHHPUGFSA-N 345.351 1.691 10 10 EDCE CCOC(=O)[C@@]1(CNC(=O)/C=C\c2ccc(O)c(O)c2)CCCOC1 1454294934 HORCLRUHLUHWPL-LZCIBIBXSA-N 349.383 1.587 10 10 EDCE COC1(c2nccn2C)CN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 1520480075 AXZHYSPPUKFJFY-XQRVVYSFSA-N 329.356 1.229 10 10 EDCE COC(=O)[C@@H](Cc1ccncc1)NC(=O)/C=C/c1ccc(O)c(O)c1 1450218317 WQGFJNPQSJKZFJ-LYKUJDHUSA-N 342.351 1.407 10 10 EDCE Cc1cn2nnc(C(=O)NCc3cccc(Cl)c3O)c2c(O)n1 1606869566 VZCVFSVNRIKXIK-UHFFFAOYSA-N 333.735 1.427 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C[C@H]1CCC(=O)NC1 1540536713 OWOLKVBRNPNTGJ-MRXNPFEDSA-N 345.443 1.398 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)C(C)(C)C(N)=O)cc1C 1700406285 XMARILBCFQCELP-OLZOCXBDSA-N 335.448 1.498 10 10 EDCE C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1nnc2n1CCCCC2 1540698713 XGSGWCJJGQIPSX-LLVKDONJSA-N 330.388 1.836 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2ccn(C)n2)cc1C 1482170119 ZIWQGEPPORBMLJ-CYBMUJFWSA-N 330.432 1.893 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(c2ccnc(F)c2)CC1 1635794946 GOOFLWNIMPMJNM-DUXPYHPUSA-N 343.358 1.994 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)C2=COCCO2)cc1C 1733960875 RPLUYTPQGVFKPB-KBPBESRZSA-N 334.416 1.875 10 10 EDCE CSCc1n[nH]c(CNC(=O)NCc2c(O)cccc2F)n1 1685330968 IRBKCYXZXSAHDA-UHFFFAOYSA-N 325.369 1.512 10 10 EDCE CC(=O)NCCCn1ccc(=O)c(OCc2ccc(N)cc2)c1C 1857909851 OQDKROQQBSMUDL-UHFFFAOYSA-N 329.400 1.844 10 10 EDCE O=C1Nc2cc(N3CC[C@@](F)(CO)C3)c(Br)cc2[C@H]1O 1917136832 WTDMJMNLQXYJHT-YPMHNXCESA-N 345.168 1.345 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)[C@@H](N)Cc1ccc(O)c(O)c1 1952755768 VQBMVFDTPHXLCN-RYUDHWBXSA-N 326.393 1.507 10 10 EDCE COCC1(C(=O)N(C)CCN=[N+]=[N-])CN(C(=O)OC(C)(C)C)C1 1985096583 TWLBIQYUGKYWNW-UHFFFAOYSA-N 327.385 1.639 10 10 EDCE CC(C)(C)OC(=O)NC1[C@@H]2CN(C(=O)c3cccc(O)c3O)C[C@@H]12 2006281317 KGBZNRNOCOAQKH-GHMZBOCLSA-N 334.372 1.693 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N(C)Cc1ccc(N)cc1 2022867256 IOEHACZMVMJVGV-RISCZKNCSA-N 337.420 1.501 10 10 EDCE O=C(Nc1ccc(O)c(O)c1)c1cccn1CCN1CCOCC1 2064313102 GNWIEJADXSRSHG-UHFFFAOYSA-N 331.372 1.484 10 10 EDCE Cc1nc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)nn1C 2065002340 BUUOZGDVHAJHCR-CQSZACIVSA-N 330.388 1.651 10 10 EDCE CC(C)(C)OC(=O)N1[C@H]2C[C@H]1CN(C(=O)COc1ccc(N)cc1)C2 2053409981 IFIAIBJQDJUWDU-KBPBESRZSA-N 347.415 1.868 10 10 EDCE OCCO[C@@H]1CCCN(c2ccc(CO)c(Br)c2)C1 2113857595 ZFQHIRHDSUMZIK-CYBMUJFWSA-N 330.222 1.919 10 10 EDCE NC(=O)C[C@H](C(=O)O)N1C(=O)C(=Cc2ccsc2)SC1=S 2323800814 RYJVQEQNJDEDDN-SSDOTTSWSA-N 342.423 1.278 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2336471287 QKVQQCHMODZSRZ-KKFJDGPESA-N 345.262 1.702 10 10 EDCE CCCS(=O)(=O)N1CCC[C@H]1C(=O)N(C)Cc1ccccc1O 175311562 CXZJIPZECYANDU-AWEZNQCLSA-N 340.445 1.555 10 10 EDCE O=C(C1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1)N1CCOCC1 170908345 JKKJPKYULJQELR-UHFFFAOYSA-N 349.387 1.371 10 10 EDCE CC1(C)OC(=O)C(=CN(CCC(N)=O)Cc2ccccc2)C(=O)O1 20119993 PJKMCRNGBZSPHI-UHFFFAOYSA-N 332.356 1.084 10 10 EDCE C[C@]1(c2cccc(CNCc3cc(F)ccc3O)c2)NC(=O)NC1=O 180564607 DAOHOOSDGALGPO-GOSISDBHSA-N 343.358 1.876 10 10 EDCE O=C(c1ccncc1)N1CCN(c2ccc3c(c2)OCCO3)CC1 41380143 XRFYOILFFHEOMH-UHFFFAOYSA-N 325.368 1.815 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@@H](N)CC(=O)OCc1ccccc1 380984700 FIGDDYMOXAJXQC-INIZCTEOSA-N 342.395 1.811 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2c(O)cc(C)cc2Cl)CCO1 529645678 ULQZMGOGFZUVER-LLVKDONJSA-N 327.812 1.484 10 10 EDCE COc1cc(O)c(CN[C@@H](CO)C[C@H](O)C(C)(C)C)cc1OC 284284023 ATHTUWDNLDYQLJ-WBMJQRKESA-N 327.421 1.657 10 10 EDCE COc1cccc(CNC(=O)[C@]23[C@H]4C(=O)[C@H]5[C@H]6C[C@@H]([C@@H]52)[C@H]3[C@H]64)c1O 800518891 JOGATLLCNPBQPL-FCSHEKRQSA-N 325.364 1.344 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCC[S@@](=O)CC 805618977 SONFKURYTDTQBC-QHCPKHFHSA-N 340.445 1.016 10 10 EDCE C[C@@H]1Oc2c(N)cccc2N(OCCOc2ccc(N)cc2)C1=O 821300037 QKLPSHRASKYEHS-NSHDSACASA-N 329.356 1.976 10 10 EDCE CN1C[C@@H](O)C[C@@]1(C)C(=O)NCc1cc(Cl)cc(Cl)c1O 908211878 LZYJPCCTGYIFKM-HZMBPMFUSA-N 333.215 1.770 10 10 EDCE C[C@H]1CN(C/C=C/c2ccc(N(C)C)cc2)CCN1S(C)(=O)=O 835043423 UEQAPNYCGBCBPZ-NFAHFFEMSA-N 337.489 1.732 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@@H](CN3CCOC3=O)C2)cc1 836220339 UACPDBNZSWGZCH-OAHLLOKOSA-N 346.431 1.736 10 10 EDCE C[C@H](O)c1cn(C2CN(C/C=C/c3ccc(N(C)C)cc3)C2)nn1 835045041 RKEOABIRBAJZJH-NNTXTVRGSA-N 327.432 1.968 10 10 EDCE COCC[C@H]1CCCCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 842238294 NDEJLRCAWVMDSS-MRXNPFEDSA-N 347.459 1.593 10 10 EDCE COc1cc(C)cc(CN2CCS(=O)(=O)[C@H]3CCC[C@H]32)c1O 840144980 KXZDASKOEIHKTM-HIFRSBDPSA-N 325.430 1.861 10 10 EDCE Cc1cc(O)c(CN2CN(CCN(C)C)C(=O)[C@H]2C)c(Cl)c1 843428266 GZFWZGREXWXWJJ-GFCCVEGCSA-N 325.840 1.906 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCOC2(CNC2)C1 841709155 DDOFMWAXWITBIZ-UHFFFAOYSA-N 330.432 1.171 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1CCOC1CCOCC1 925438951 GIIFCEZEXAAEHK-UHFFFAOYSA-N 334.372 1.352 10 10 EDCE CN(C)c1ccc(CNC[C@]2(CO)COCC3(CCC3)N2C)cc1 858222514 QZZSVABRDQXGPN-IBGZPJMESA-N 333.476 1.458 10 10 EDCE C[C@@H](NCC[C@@H]1CNC(=O)C1)c1ccc(N2CCOCC2)c(F)c1 926988133 QJXOYGUHPRWBGP-KGLIPLIRSA-N 335.423 1.839 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C1=NO[C@@H](CN)C1 852789389 DDWQTRZILIQQIA-MRXNPFEDSA-N 330.432 1.739 10 10 EDCE C[C@@H]1C[C@H](NC[C@]2(OCCO)CCOC2)c2c(O)ccc(F)c21 850507943 LGJNZZCDPORMJG-BTJLNZGRSA-N 325.380 1.837 10 10 EDCE COC(=O)c1cn([C@H]2CCN(Cc3cc4c(cc3O)CCC4)C2)nn1 760543128 YBTGHYGMXLUHII-HNNXBMFYSA-N 342.399 1.706 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cccc(O)c2C1 871207160 KMAWTJRMJQFVON-AWEZNQCLSA-N 349.431 1.689 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)N[C@@H]1C[C@H]1C1CC1 1117686258 HNJJUVFQSRIIFO-WDEREUQCSA-N 325.459 1.656 10 10 EDCE Cc1cn2cc(NC(=O)C(=O)N(C)Cc3ccccc3O)ccc2n1 774150756 YCAPBQOVHAZIOR-UHFFFAOYSA-N 338.367 1.945 10 10 EDCE COC[C@H](CC(=O)C(=O)C[C@H]1C[C@H](N)C1)NC(=O)OC(C)(C)C 1895031845 OXXXMTLXWKWHGY-SRVKXCTJSA-N 328.409 1.182 10 10 EDCE CN(C)CCCN(C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788910578 MEAYVFAETQMUMI-UHFFFAOYSA-N 346.475 1.313 10 10 EDCE O=C(NCCCSc1nccs1)C1CN([C@@H]2CCOC2)C1 896333314 FQQZFKMCIYLWGB-GFCCVEGCSA-N 327.475 1.462 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCc2nnc(O)n2C1 1142730827 FHRKQFNLIDRJHO-LBPRGKRZSA-N 339.355 1.116 10 10 EDCE O=C(NCc1c(O)cccc1O)c1nn(-c2ccccc2)cc1O 1304053482 LYWDQAFAEVQHDE-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE O=C(NCc1ccc(-n2cncn2)nc1)c1c(F)ccc(O)c1O 1182352831 DAAPIZJKWWVEOQ-UHFFFAOYSA-N 329.291 1.143 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N1CCC(NC)CC1 1325720868 IOKXZWGQQXZHQW-UHFFFAOYSA-N 347.459 1.731 10 10 EDCE COc1ccc(CN[C@@H]2C[C@@H](C)N(C(=O)CN(C)C(C)=O)C2)cc1C 1331953514 KCLTXLFSULRIIG-RHSMWYFYSA-N 347.459 1.561 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@H]2CN(C(C)=O)CCO2)cc1 1332949200 TWAGNJOJPWLDEX-QGZVFWFLSA-N 333.432 1.396 10 10 EDCE CO[C@H](C)CN[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1266734862 ATTHMQCSVXDMSG-HONMWMINSA-N 333.392 1.734 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc2n(n1)CCC[C@@H]2O 1444694999 BYKBETUAKBTPPS-INIZCTEOSA-N 342.399 1.816 10 10 EDCE CN1CC[C@@H](C(=O)NCc2cccc(O)c2O)[C@H](c2cnn(C)c2)C1 1520508480 CLWVVDXAJAVKMO-CABCVRRESA-N 344.415 1.183 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc(O)cn3)CC2)cc1F 1465931989 URDSMPOKPHYUKL-UHFFFAOYSA-N 331.347 1.897 10 10 EDCE Cc1nc(Cn2nnc(C(=O)N[C@H](C)c3ccccc3O)c2C)no1 1471196122 VGQIFWKQEDHLEU-SECBINFHSA-N 342.359 1.523 10 10 EDCE CN(CCNC(=O)CCCF)C(=O)c1ccc(N=NC(N)=O)cc1 1704239650 FJLGLNJUJUYZAO-UHFFFAOYSA-N 337.355 1.787 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3NC(=O)O[C@H]3C2)cc1Br 2120414229 ZOGPUTWRBWEXIK-ONGXEEELSA-N 330.157 1.344 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H](C)n2cccc2)cc1C 1715583101 VTWYDUGHNYMOID-RDJZCZTQSA-N 345.443 1.633 10 10 EDCE CCN1CC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1634424368 XKWBCFFKWCGIMY-QGZVFWFLSA-N 335.423 1.497 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)CNC(C)=O)C2CC2)cc1C 1566701920 KFPILLLLBVVUML-MRXNPFEDSA-N 333.432 1.124 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2cnn[nH]2)C(C)C)cc1C 1568456621 UFAWTZOKAHYHEY-CQSZACIVSA-N 331.420 1.666 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cnc(-c2ncccn2)s1 1633595394 UQHCNLCTCYBFLQ-UHFFFAOYSA-N 328.353 1.941 10 10 EDCE CC(=O)N/C(=C/c1cccs1)C(=O)NCc1cccc(O)c1O 1643812410 ITAPDBAKITUXAZ-MDWZMJQESA-N 332.381 1.953 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@@H]2C[C@@H]3C[C@@H]3C2)cc1C 1571586961 ARCKQYODOCJISX-VSZNYVQBSA-N 346.471 1.959 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2cnnc(O)c2)cc1C 1733125167 DWRZQIJUTARTML-UHFFFAOYSA-N 344.415 1.751 10 10 EDCE O=C(Cn1ncc2ccccc2c1=O)NCc1cc(O)ccc1O 1644752401 DMCVGULLDRTYOJ-UHFFFAOYSA-N 325.324 1.124 10 10 EDCE O=C(CCc1nc(-c2ncccn2)no1)NCc1c(O)cccc1F 1646034963 PSSLSISZTKHVEK-UHFFFAOYSA-N 343.318 1.620 10 10 EDCE Cc1cc(C(=O)N[C@@H]2CCC(=O)NC2=O)c(C)n1-c1ccccn1 152138105 QOLSPDUKNUVHKI-CYBMUJFWSA-N 326.356 1.024 10 10 EDCE O=C(NCc1sncc1Br)c1cc(O)c(O)c(O)c1 2132404501 SGPGKMFPXQGNQI-UHFFFAOYSA-N 345.174 1.952 10 10 EDCE CO[C@@H](c1cc(O)c(O)c(O)c1)[C@H](NC(=O)OC(C)(C)C)C(=O)O 1952306354 LAVDYNVUYQTULM-JQWIXIFHSA-N 343.332 1.469 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O[C@H](N)Cc2ccc(O)c(O)c2)C1 1952762022 SWHNTCCQQRPIGH-DOMZBBRYSA-N 338.404 1.951 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(F)ccc2O)[C@H](O)C1 1985830838 ZMUWYOPUENCQAX-GXTWGEPZSA-N 326.368 1.601 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCC[C@@H](C(=O)NCCN=[N+]=[N-])O1 1990167249 IPDYJWFRKOTCLX-MNOVXSKESA-N 327.385 1.875 10 10 EDCE CN1CCc2cc([C@@]3(N)COC[C@H]3NC(=O)OC(C)(C)C)ccc21 1999527806 SEYMDQMDGCGTJI-QAPCUYQASA-N 333.432 1.756 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010398994 XONIKSJIUWWPSP-ZYHUDNBSSA-N 341.412 1.809 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCC[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010398260 VQQPJQASLYDLBQ-QJPTWQEYSA-N 339.396 1.827 10 10 EDCE CO[C@]1(CNC(=O)OC(C)(C)C)C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 2010406063 PNBCYRCZDYNMNJ-AVCCJPFPSA-N 339.396 1.827 10 10 EDCE CC[C@@H](NCc1nnnn1C)c1cc(Br)ccc1O 389393948 XQRCXDPTYZHZHC-SNVBAGLBSA-N 326.198 1.919 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 2080603842 BKSJBDLMFPHOLJ-GJZGRUSLSA-N 349.431 1.598 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)c(Br)c1 2102177880 OVMUHTDCNYSKMY-HONMWMINSA-N 327.222 1.364 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2104424365 NDGLWLGBOQPOSX-NGYYELCVSA-N 327.222 1.399 10 10 EDCE CN[C@H](C)c1ccc(N(C)CC(CO)CO)c(Br)c1 2094031095 QYVZXXQFWGVTLW-SNVBAGLBSA-N 331.254 1.767 10 10 EDCE COc1ccc(N(CCN)C[C@H](C)O)c(OC)c1Br 2269954909 SNICDHIRUBIUGO-VIFPVBQESA-N 333.226 1.612 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H](O)C[C@@H](F)C3)c(Br)cc21 2234668168 DVEBTMDLUKSWRU-NQYJQULFSA-N 344.184 1.310 10 10 EDCE OC[C@@H]1NC[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@H]21 2227308847 XOGOHXLMUCOHAY-RTXFEEFZSA-N 327.222 1.167 10 10 EDCE CCN[C@@H](C)c1ccc(N2C[C@@H](O)[C@H](O)C2)c(Br)c1 2328968955 PDEPYYSVCPJBBV-CUOATXAZSA-N 329.238 1.661 10 10 EDCE NCc1cc(F)c(N2C[C@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2336551611 ANQGACYVPZEIQE-UFBFGSQYSA-N 349.225 1.280 10 10 EDCE CC(=O)NCCCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 55523037 DIDICCJWLJCBBP-UHFFFAOYSA-N 337.395 1.195 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C)C[C@@H]3CCCO3)CC2)cc1 52101839 KAPKESWIDOPOIP-SFHVURJKSA-N 347.459 1.455 10 10 EDCE CCN(C(=O)[C@H](C)Cc1ccc(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1 170245287 FGDNIKVIHQIJPU-DGCLKSJQSA-N 341.429 1.312 10 10 EDCE COc1ccc(N2CCN(C(=O)CCCS(C)(=O)=O)CC2)cc1 171806925 CCYKPLKYZDCIEK-UHFFFAOYSA-N 340.445 1.169 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)N[C@@H]1CCc2ncnn2C1 175122981 LLNATMUTNLIVER-CYBMUJFWSA-N 341.415 1.677 10 10 EDCE COC(=O)c1ccccc1S(=O)(=O)NCCc1ccc(N)cc1 171531804 LJILINMGLRFUSJ-UHFFFAOYSA-N 334.397 1.576 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)c1cncc(C(N)=O)n1 301605531 YDSYDRKZRIDEJO-UHFFFAOYSA-N 327.388 1.049 10 10 EDCE CCCCNC(=O)NC(=O)[C@H](C)N1CCOc2cc(N(C)C)ccc21 181126465 KBFUJPIPQPJCSF-ZDUSSCGKSA-N 348.447 1.966 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CSC(=O)N3)CC2)cc1F 267995350 RXAMJUYBPKWOGY-GFCCVEGCSA-N 339.392 1.308 10 10 EDCE Cc1ccc(CN2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)c(O)c1Br 2380803119 GIMJKZWMNDJHLN-NYMYIZQJSA-N 342.233 1.779 10 10 EDCE CCN(CC)CCS(=O)(=O)N[C@@H](C)c1cc(OC)ccc1O 810051329 ZGPKDBCGQGBNJX-LBPRGKRZSA-N 330.450 1.723 10 10 EDCE CC[C@@H](O)CC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 822237794 JAYQLNWGUJJMMD-QGZVFWFLSA-N 349.475 1.485 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCN(c3cnn(C)c3)C(=O)C2)cc1 835025016 CUHPDXZWKSYLPP-PLNGDYQASA-N 339.443 1.848 10 10 EDCE CCN(CCC(N)=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 922951334 VSDHUQNVVNXCLE-CQSZACIVSA-N 348.447 1.428 10 10 EDCE O=C(Nc1c(Cl)ccc2nonc12)[C@@]1(F)CCS(=O)(=O)C1 1271356697 QAWVKPULJODTBZ-LLVKDONJSA-N 333.728 1.342 10 10 EDCE CCN(CC)c1ccc(CN2C(=O)N[C@H](CC3OCCO3)C2=O)cc1 924488073 OQDXFYHSENQOCY-OAHLLOKOSA-N 347.415 1.716 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)N3CCSCC3)C2)cc1 855233666 KHKYBNSNWRDEJE-HUUCEWRRSA-N 349.500 1.827 10 10 EDCE C[C@@H]1[C@@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCN1C 925321067 OGLBSQBTBCFMDL-QAPCUYQASA-N 346.475 1.757 10 10 EDCE COC(=O)CCNC(=O)CCNCc1ccc(N(C)C)c(F)c1 858292525 KDPMGEMFEVYZQJ-UHFFFAOYSA-N 325.384 1.051 10 10 EDCE CCOC(=O)C[C@@H](O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 859230499 ZRYRISIBGLCUEX-RHSMWYFYSA-N 336.432 1.488 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CN)C(F)(F)F)C2)cc1 850754200 LFPIXQWCTBKLGV-GWCFXTLKSA-N 346.353 1.463 10 10 EDCE Cn1cc(C[C@H]2CCC[C@@H]2NC(=O)C(=O)Nc2ccc(N)cc2)cn1 850849857 KZMYUTHVIRHWTK-CJNGLKHVSA-N 341.415 1.468 10 10 EDCE CC(=O)c1cc(F)cc(CN(C)CCN2CCCS2(=O)=O)c1O 752085066 SRDPKHMDAXYNMU-UHFFFAOYSA-N 344.408 1.201 10 10 EDCE O=C1NCCO[C@@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)[C@H]12 931562502 LKLFPZWDRQQQDY-MSOLQXFVSA-N 345.443 1.003 10 10 EDCE Cc1cc(CC(=O)N(C)Cc2nc(=O)o[nH]2)c(C)n1-c1ccccc1 880392506 BFCUXFMKGSAAMQ-UHFFFAOYSA-N 340.383 1.972 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1CN([C@H]2CCOC2)C1 897984313 VJVQEBDZLFCHKC-BEFAXECRSA-N 345.487 1.829 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2CCc3nc(F)ccc32)c1 1131172989 YMCIIFUVSSWODH-GORDUTHDSA-N 326.331 1.578 10 10 EDCE CO[C@@H]1C[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)C1 1895876091 QVPMXJACJWLEJY-MNOVXSKESA-N 325.369 1.532 10 10 EDCE OC/C=C/c1ccc2c(c1)O[C@@H](c1ccc(O)c(O)c1)[C@@H](CO)O2 38297834 PPZYUSOIUGJLFB-MNSDHWDNSA-N 330.336 1.977 10 10 EDCE biogenic OCCN(Cc1ccc(Br)cc1O)C[C@@H]1CCCN1 691498440 UCKNSFSGHRZTTN-ZDUSSCGKSA-N 329.238 1.701 10 10 EDCE CN1CCN(Cc2c(O)cccc2Br)C[C@H]1C(=O)O 686102458 AMAKIEDORYFMNS-NSHDSACASA-N 329.194 1.355 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)cc1Br 1893330957 GOTYXHNCWZRQDJ-QCZZGDTMSA-N 329.238 1.791 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1c2ccccc2OC[C@H]1CO 1180329013 CQPNDQSEJKIOST-KZULUSFZSA-N 329.352 1.499 10 10 EDCE CCC[C@@]1(CO)CCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1330487365 RKKSSYSIPXVZPK-SFHVURJKSA-N 332.400 1.388 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1265781735 KLSHMFVOYALNHP-UKRRQHHQSA-N 333.432 1.076 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCn2cncn2)c1 1443406107 GHTKFHYPPFQNOO-UHFFFAOYSA-N 337.383 1.928 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2C[C@@H]3CCCCN3C2=O)cc1 1450890959 LNDPGRXBLNMDRY-STQMWFEESA-N 329.360 1.732 10 10 EDCE CCC(=O)N[C@@H](CCSC)C(=O)NCc1cccc(O)c1O 1520509674 TYGMYWJLDVJNKN-NSHDSACASA-N 326.418 1.362 10 10 EDCE O=C(NC1CC1)OC[C@H]1CCCCN1C(=O)Cc1ccc(O)c(O)c1 1468715040 JYULDAKIMXJNNX-CQSZACIVSA-N 348.399 1.910 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@@H]2CCN(C)C2=O)cc1C 1480484779 VPZNAMQANRBNAG-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2cnon2)C2CC2)cc1C 1713121222 RKFCEVIYVDLSKS-AWEZNQCLSA-N 330.388 1.685 10 10 EDCE CCCN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CCN(CCO)C1 1713722328 KBECWEJXYPXRDN-HNNXBMFYSA-N 347.419 1.768 10 10 EDCE CS(=O)(=O)c1ccc(F)c(CNC(=O)c2cc(O)cs2)c1 1633870110 CWTSYPCZUZYVKC-UHFFFAOYSA-N 329.374 1.926 10 10 EDCE CC[C@@H](F)C(=O)NCC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1495646204 GETCKIJNJBRRHV-ZYHUDNBSSA-N 341.383 1.472 10 10 EDCE CC[C@H](CNC(=O)c1nonc1C)NCc1ccc(OC)c(C)c1 1495117883 MYZCYKHJMBHLSK-CQSZACIVSA-N 332.404 1.993 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@@H]1C(=O)NCc1cc(O)ccc1O 1633599228 UFQOAWWBTXSYGR-CORIIIEPSA-N 348.399 1.969 10 10 EDCE Cc1cc(C(F)(F)F)nn1CCNC(=O)Cc1ccc(O)c(O)c1 1645495369 OJMSUFLLLNPOKN-UHFFFAOYSA-N 343.305 1.980 10 10 EDCE COC(=O)[C@H]1C[C@H]1C(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 1699646890 GMHMMVHJANERMA-CABCVRRESA-N 346.427 1.551 10 10 EDCE COC(=O)[C@H](CCNCc1ccc(N)cc1)NC(=O)OC(C)(C)C 1944077310 DOXXEYSPHLWECE-AWEZNQCLSA-N 337.420 1.815 10 10 EDCE CC(C)(C)OC(=O)N=c1cc([C@@H](N)Cc2ccc(O)c(O)c2)[nH][nH]1 1952760287 NMMLELDEFURGEU-JTQLQIEISA-N 334.376 1.832 10 10 EDCE O=C(O)[C@@H]1CCN[C@@H]1c1cc(I)ccc1O 1952825445 KCMJODIUCVVIJU-XCBNKYQSSA-N 333.125 1.732 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(O)cc2O)[C@H](O)C1 2005085518 PKHXCFHLRJKHLC-DZGCQCFKSA-N 338.404 1.558 10 10 EDCE Cn1nnc(Br)c1COC(=O)CCc1ccc(N)cc1 2145948529 UYJQWZBZYLHOTF-UHFFFAOYSA-N 339.193 1.836 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)c2ccc(O)c(O)c2)CCO1 2006283214 HKYNVJOXEVQGMQ-NSHDSACASA-N 338.360 1.769 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010392128 XMSYJXZRUNUNID-NEPJUHHUSA-N 339.396 1.781 10 10 EDCE COC1(C(=O)N2CCC[C@H]2CN=[N+]=[N-])CN(C(=O)OC(C)(C)C)C1 2010405537 ZKFHJQWWSJDFBG-NSHDSACASA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010402684 UPEXEBWNWGDVSI-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE CN1C[C@H](NCc2cc(Cl)cc(Br)c2O)[C@H](O)C1 2029868887 AWIGBZYTEYUYIE-WDEREUQCSA-N 335.629 1.573 10 10 EDCE O=C(NCc1ncc(Br)s1)c1cc(O)nc(O)c1 714708926 ZKUUSLXVWSLGBH-UHFFFAOYSA-N 330.163 1.642 10 10 EDCE CCNC(=O)c1cn(Cc2cc(Br)ccc2O)nc1O 2070640404 NCTGUALTRYRBOL-UHFFFAOYSA-N 340.177 1.855 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(CNC(=O)Cc2ccc(N)cc2)CCOC1 2044213055 QFBFWCAHLQTKQM-SFHVURJKSA-N 349.431 1.611 10 10 EDCE C[P@@]1(=O)C[C@@H](NCc2cc(Br)ccc2O)[C@@H](O)C1 2057722120 YLWLLKUFYMSLGT-GDAOTKPNSA-N 334.150 1.980 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)C[C@H]2CO)cc1Br 2089863705 MKNWCVXJVTXWFA-SCVCMEIPSA-N 329.238 1.648 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210537676 JVWMSHASTRVUHL-ZDCRXTMVSA-N 327.385 1.608 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@@H](O)C2)c(OC)c1Br 2226544142 GIFLTWNSPUIFPX-DTORHVGOSA-N 332.194 1.398 10 10 EDCE O=C(NCCc1cc(Br)no1)c1ccc(O)c(O)c1 2228872404 SBEDUDIVHYTVIR-UHFFFAOYSA-N 327.134 1.821 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](C(=O)NCCN=[N+]=[N-])CO1 2242735623 VSTJFDVVNLKPPX-GHMZBOCLSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N1CC(N2CC([C@H](N)c3ccccc3O)C2)C1 2248588661 GPBXKMXVEDLWKO-INIZCTEOSA-N 333.432 1.943 10 10 EDCE CNCc1ccc(N2CC[C@@H](O)[C@H](O)CC2)cc1Br 2269119503 SIOLSKQPVNWPBH-ZIAGYGMSSA-N 329.238 1.491 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2329329374 UEWXVWRUKHUVPS-OAVNSQIMSA-N 328.206 1.433 10 10 EDCE Cc1ccc(CN2C(=O)CN(C)CC2=O)c(O)c1Br 2352948667 SDBQODBWODAPGH-UHFFFAOYSA-N 327.178 1.264 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 177282258 MAEYUEYVVXJNIS-CHWSQXEVSA-N 336.363 1.292 10 10 EDCE Nc1ccc(OC[C@@H](O)CN2CCC=C(Br)C2)cc1 404349457 OGAINXZRDISURK-ZDUSSCGKSA-N 327.222 1.993 10 10 EDCE O=C1N[C@@H](c2cc(O)cc(Br)c2O)N2CCCC[C@H]12 124871878 LXXGFQKFIWPVAN-ZYHUDNBSSA-N 327.178 1.843 10 10 EDCE C[C@@]1(c2cccc(CNCc3cc(F)ccc3O)c2)NC(=O)NC1=O 180564589 DAOHOOSDGALGPO-SFHVURJKSA-N 343.358 1.876 10 10 EDCE Cc1noc([C@H](C)N2CCN(C(=O)c3cccc(O)c3O)CC2)n1 193062303 RHWRKBVQDNUMHM-JTQLQIEISA-N 332.360 1.308 10 10 EDCE O=C1CCCN1C[C@H](O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 246857179 PKLPIXIWALBCCB-SJORKVTESA-N 348.443 1.357 10 10 EDCE Cc1ccc(C(=O)N2CCC(C)(N3CCOCC3)CC2)c(O)c1O 529910374 CVEMYODJDWYVGD-UHFFFAOYSA-N 334.416 1.733 10 10 EDCE CN(C(=O)c1cccc(O)c1O)C1CCN(c2cnccn2)CC1 370201305 JCTLEQUSBPZYRI-UHFFFAOYSA-N 328.372 1.629 10 10 EDCE O=c1cc(/C=C\c2ccc(N3CCOCC3)c(F)c2)nc2nc[nH]n12 806571203 QXIAYCHDAAAZMA-IWQZZHSRSA-N 341.346 1.564 10 10 EDCE CC(=O)C(=O)COC(=O)C=C1CCN(C(=O)OC(C)(C)C)CC1 815329823 WPNKACURGZCURK-UHFFFAOYSA-N 325.361 1.645 10 10 EDCE Cc1ncccc1/C=C1\SC(=S)N(CCN2CCOCC2)C1=O 728982654 LYQXYRGMTKYJEI-KAMYIIQDSA-N 349.481 1.923 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)CCC[C@@H]2CCOC2)cc1 826922877 HXDDRGSEULYAPC-OAHLLOKOSA-N 326.462 1.989 10 10 EDCE CO[C@H](CS(=O)(=O)N(C)Cc1ccc(N(C)C)cc1)C1CC1 826918019 MDEDDEGTDQJRPM-MRXNPFEDSA-N 326.462 1.939 10 10 EDCE Nc1ccc(OCCCON2C(=O)COc3ccc(N)cc32)cc1 821299829 OEWFUQZKRSDEDY-UHFFFAOYSA-N 329.356 1.977 10 10 EDCE CN1C[C@@H](O)C[C@]1(C)C(=O)NCc1cc(Cl)cc(Cl)c1O 908211879 LZYJPCCTGYIFKM-IINYFYTJSA-N 333.215 1.770 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H](O)C1CCOCC1 735876591 JFIOOAZCFNQJKK-GOSISDBHSA-N 348.443 1.269 10 10 EDCE CCNC(=O)[C@@H]1CNCCN1Cc1ccc(Br)cc1O 691388519 RHDQQWVJPKUDPV-LBPRGKRZSA-N 342.237 1.065 10 10 EDCE CCN1C[C@H](CN(C)Cc2ccc(N3CCOCC3)cc2)OC1=O 846766984 ZLIRMFIZAZNSHD-KRWDZBQOSA-N 333.432 1.796 10 10 EDCE CCCC[C@](C)(CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 844021040 XJTUQEDOFVIVFU-OAHLLOKOSA-N 344.433 1.435 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)Cc3ccon3)C2)cc1 849416861 YDNVVYULDLOCJW-GFCCVEGCSA-N 337.401 1.382 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3ccc(O)nc3)CC2)cc1 854198701 PNADTFCBTNRECM-UHFFFAOYSA-N 327.384 1.687 10 10 EDCE Cc1cnn(C)c1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 850380894 PTBYJMBBBHQXLG-UHFFFAOYSA-N 339.399 1.360 10 10 EDCE Nc1ccc(CCNC(=O)NCCN2C[C@H]3CCCCN3C2=O)cc1 851662994 PZWKEJDVTHXYAF-MRXNPFEDSA-N 345.447 1.401 10 10 EDCE CCn1nnc(C)c1C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855224282 DZNUGWUHJJVWOH-CYBMUJFWSA-N 329.404 1.624 10 10 EDCE C[C@H]1C[C@H](NC2CN(S(=O)(=O)N(C)C)C2)c2c(O)ccc(F)c21 858569742 NOONWPCMVBMMGK-CABZTGNLSA-N 343.424 1.160 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@H]2CC[C@H]1[C@H](N)C2 852929445 KEQCICNEXZCWBM-UAGQMJEPSA-N 344.459 1.049 10 10 EDCE CO[C@@H](CS(=O)(=O)NNc1nc2cccnc2s1)C1CC1 857225682 QAAGFMWLOSSBED-JTQLQIEISA-N 328.419 1.363 10 10 EDCE CC[C@@H]1[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCN1C 869295346 SHDYDHQSIIYDPY-RBUKOAKNSA-N 345.487 1.994 10 10 EDCE COc1ccc(O)c([C@@H](C)NCCn2nc3ccccn3c2=O)c1 775370969 KODUPQVSNYZTBF-GFCCVEGCSA-N 328.372 1.561 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H]2CN3C(N)=O)c(Br)c1 1877073556 HUHCGHLAIJXDHL-VHSXEESVSA-N 325.210 1.249 10 10 EDCE Cc1nn(C)c([C@H](O)[C@@H](N)c2ccccc2O)c1Br 1877195189 VMGDNCMNZRIOBW-WCQYABFASA-N 326.194 1.930 10 10 EDCE C[C@@H](NCc1c(O)cccc1Br)c1nnc(O)n1C 895172133 RUJRIGYDKGPCTJ-SSDOTTSWSA-N 327.182 1.840 10 10 EDCE O=C(N[C@H]1CC(=O)N(C2CC2)C1)c1cc2cc(O)c(O)cc2s1 896838444 QLSZTPKBDJWXQV-VIFPVBQESA-N 332.381 1.806 10 10 EDCE C[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)[C@@H]1CN(C)CCO1 897077990 RERMOLWXHPKUFC-ZANVPECISA-N 336.413 1.761 10 10 EDCE COc1cc(C)cc(CN2CCC(CNS(C)(=O)=O)CC2)c1O 795669372 FUVIBSKTNJTVEP-UHFFFAOYSA-N 342.461 1.470 10 10 EDCE COc1ccc(CNC(=O)[C@@H](C)NC(=O)c2ccccc2)c(O)c1 794369713 KAOPHTWNMFNTNC-GFCCVEGCSA-N 328.368 1.836 10 10 EDCE O=C(N[C@H]1C[C@H](S(=O)(=O)c2ccccc2)C1)c1cccc(O)c1O 1152185549 YPUFYMYUAKUTQM-AULYBMBSSA-N 347.392 1.833 10 10 EDCE CN(CCN=[N+]=[N-])S(=O)(=O)N1CC(OCc2ccccc2)C1 1959212724 ZCJYYZVYDARYJG-UHFFFAOYSA-N 325.394 1.374 10 10 EDCE CCOC(=O)c1cc2n(n1)C[C@@H](C)N(C(=O)c1cccc(O)c1O)C2 1178168671 CXCWRMSOSNYLNI-SNVBAGLBSA-N 345.355 1.516 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1CC(C)(F)C1 1329004631 NZXFPNXGKAMKMW-CYBMUJFWSA-N 335.423 1.679 10 10 EDCE CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 1963714108 DAHKNHCQBMAPGX-RISCZKNCSA-N 338.404 1.937 10 10 EDCE CS(=O)(=O)[C@H]1C[C@H](NCc2cc(Br)ccc2O)C1 714252448 OYSZIYUWEQXBRQ-XYPYZODXSA-N 334.235 1.820 10 10 EDCE O=C(C(=O)N1CCCC2(CCOCC2)C1)N1Cc2cccc(O)c2C1 1332007543 VQAYIZOGXGHYDL-UHFFFAOYSA-N 344.411 1.654 10 10 EDCE CO[C@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1334574410 UILJJQGLEUTFGG-SJORKVTESA-N 345.443 1.539 10 10 EDCE CS[C@H]1CC[C@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332040950 GUOMOBKETHTKDK-STQMWFEESA-N 334.441 1.977 10 10 EDCE COCc1n[nH]c(CNC(=O)NCc2ccc3c(c2)CCCN3C)n1 1261655179 OGXHIYHBLFXWKJ-UHFFFAOYSA-N 344.419 1.333 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H]2CC(=O)N(C)C2)cc1C 1265781736 KLSHMFVOYALNHP-ZFWWWQNUSA-N 333.432 1.076 10 10 EDCE COC(=O)NCC(=O)NC[C@H]1C[C@H](NCc2ccc(OC)c(C)c2)C1 1264416402 XLSBWEFEVIBHPB-SHTZXODSSA-N 349.431 1.344 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC(C)(C)[C@H](C)O)C2)cc1 1263731873 QSOPTCYXVKBOOR-UONOGXRCSA-N 335.448 1.980 10 10 EDCE COc1c(C(=O)NCc2cccc(Br)c2O)cnn1C 1448962679 PQTNPVXAUKENTM-UHFFFAOYSA-N 340.177 1.827 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cnnn1-c1cccc(F)c1 1471662169 RECMGUAJWDNZLC-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)Cc2ccoc2)cc1C 1700936759 GZTKGVZBROVZJN-QGZVFWFLSA-N 346.427 1.748 10 10 EDCE CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)NCc1cc(O)ccc1O 1471661334 NRHQPODJNSYRNV-GFCCVEGCSA-N 338.429 1.662 10 10 EDCE CN(C)c1ccc(CN(C(=O)[C@@H](O)c2cnn(C)c2)C2CC2)cc1 1543500979 FEBSIAJYDFWWSD-KRWDZBQOSA-N 328.416 1.711 10 10 EDCE C/C=C(\C)C(=O)NC[C@@H](C)NCc1nnnn1-c1ccc(OC)cc1 1480442482 SKNNUDHEEQXRBR-YQJFHSMKSA-N 344.419 1.231 10 10 EDCE COc1cccc(CNC(=O)Cc2ccc(-n3cnnc3)cc2)c1O 1622779051 ICRHQCRJXQNIPX-UHFFFAOYSA-N 338.367 1.840 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](CN3CCOCC3)C2)cc1 1630150961 XVNJLJURZOHDRO-CYBMUJFWSA-N 345.403 1.643 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cccc(N2CCNC2=O)c1 1639289368 OUNFHAKZAPLNKU-UHFFFAOYSA-N 327.340 1.557 10 10 EDCE CCOC(=O)[C@]1(C)CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 1632495851 QQYLJAOVLWFKAT-INIZCTEOSA-N 348.359 1.643 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1COCCN1CC(F)F 1633819742 UUINPZVBXKWGJF-JQWIXIFHSA-N 344.358 1.111 10 10 EDCE Cc1ccc(C(=O)N[C@H]2C(=O)N(C)Cc3ccccc32)c(O)c1O 1641677500 JYSYGTREMPZONL-CQSZACIVSA-N 326.352 1.849 10 10 EDCE NS(=O)(=O)c1cc(NC(=O)/C=C\c2ccc(O)c(O)c2)cs1 1643036808 AWDIELGRRZYDSD-RQOWECAXSA-N 340.382 1.459 10 10 EDCE CN(CCNC(=O)[C@@H]1CC12CC2)C(=O)c1ccc(N=NC(N)=O)cc1 1581029078 IDFMALDFAVFLGW-ZDUSSCGKSA-N 343.387 1.837 10 10 EDCE COc1ccc(CNC2(CNC(=O)C[C@H](C)NC(N)=O)CC2)cc1C 1670782266 YODYIDDDJWAJSN-ZDUSSCGKSA-N 348.447 1.189 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](CO)[C@@H]1CCOC1 1683421403 OAXAXIIZOXJQKT-YXJHDRRASA-N 349.475 1.689 10 10 EDCE CC[C@H]1CN(Cc2cc(OC)c(OC)cc2O)CCN1CCOC 160212848 PXVSGOSAERMUHO-HNNXBMFYSA-N 338.448 1.952 10 10 EDCE C[C@H](N[C@H]1CCC(=O)N(C)C1)c1ccc(N2CCOCC2)c(F)c1 152491897 XRSLZWLELCGJON-ZFWWWQNUSA-N 335.423 1.934 10 10 EDCE C[C@@H](O)C[C@@H]1COCCN1c1ccc(CN)c(Br)c1 2128866374 QSLJYKDYEASTRH-ZWNOBZJWSA-N 329.238 1.884 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@H](O)C[C@H]32)cc1Br 2128875202 KTKBQSHCPVHBTL-MRVWCRGKSA-N 327.222 1.636 10 10 EDCE OCc1ccc(N2CCN3CCOC[C@H]3C2)c(Br)c1 2129370619 RJLCDLAPFJNLRD-GFCCVEGCSA-N 327.222 1.462 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)N1CC[C@@H](N=[N+]=[N-])C1 1912165138 GYMDTCHIKFSMLU-ZCFIWIBFSA-N 335.187 1.256 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CCC[C@@H](O)C3)c(Br)cc21 221242613 BWVNFYWRDCMUGZ-AMIZOPFISA-N 340.221 1.623 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(c2ccc(O)c(O)c2O)C[C@@H]1C(=O)O 1952829257 JJFVUWNMFPXGKH-GLEZIHRCSA-N 325.317 1.628 10 10 EDCE CC(C)(C)OC(=O)N1CCC12CN(C(=O)c1ccc(O)c(O)c1)C2 2006284918 QWKNSHVOPUNQIB-UHFFFAOYSA-N 334.372 1.933 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@H]1C(=O)NCc1ccccc1O 2010044319 CRHKVCLERODXJJ-GXTWGEPZSA-N 336.388 1.691 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(N)cc1 2022866078 QWVVFZXDGVZPPX-FZMZJTMJSA-N 337.420 1.501 10 10 EDCE C[C@H](O)c1ccc(N(C)C2CS(=O)(=O)C2)c(Br)c1 2034770784 XDRODQPAGPACMU-QMMMGPOBSA-N 334.235 1.736 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](C(CO)CO)C2)cc1Br 2170673710 KTVMOOVXPCOBDT-MNOVXSKESA-N 343.265 1.896 10 10 EDCE NCc1cc(F)c(N2CC[C@@]3(CNC(=O)C3)C2)cc1Br 2163345246 XNHJEJGZYSGOIS-CQSZACIVSA-N 342.212 1.763 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCc3cnn4c3CCCC4)c2n1 2063372498 WTEAALFWEDGAST-UHFFFAOYSA-N 326.360 1.206 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC(C)(C)[C@H]3[C@@H]3CCCO3)c2n1 2063647638 HPMXHKUYRAYLSO-GXTWGEPZSA-N 330.388 1.773 10 10 EDCE CCNCc1ccc(N2CCC[C@H]2[C@H](O)CO)c(Br)c1 2179798995 MPNIIHZEYAZRPQ-LSDHHAIUSA-N 343.265 1.881 10 10 EDCE C[C@@H](NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C)c1ccccc1O 1557966728 OOEMZJFIOMTKBM-NEPJUHHUSA-N 338.404 1.845 10 10 EDCE COc1cc(N)c(N2CC[C@@](C)(NC(=O)C(F)(F)F)C2)cc1OC 2044633539 PREIOGSMAAXYTK-CQSZACIVSA-N 347.337 1.933 10 10 EDCE CCNCc1ccc(N2CC(CO)(OC)C2)c(Br)c1 2101059060 ITGKXMOXGOXSKC-UHFFFAOYSA-N 329.238 1.756 10 10 EDCE CN[C@@H](c1ccccc1O)[C@@H](O)c1cc(Br)nn1C 2091864202 RWQFRWSWFIJUSD-STQMWFEESA-N 326.194 1.882 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210535738 MMPOOTNCOIQNQW-GMTAPVOTSA-N 327.385 1.610 10 10 EDCE CC(C)(C)C[C@@H](COc1nnc(=N)[nH]n1)NC(=O)OC(C)(C)C 2210649448 IDEZDGLIRIRZGO-VIFPVBQESA-N 326.401 1.387 10 10 EDCE O=C(O)[C@H]1CCOCCN1Cc1cc(Br)ccc1O 2269861674 YTFSDHINOCGNFU-LLVKDONJSA-N 330.178 1.830 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](O)[C@@H](O)C[C@H]3C2)cc1Br 2236998905 XADPFTOVUYOBOF-GVARAGBVSA-N 342.233 1.509 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@@H]1C(=O)NCCCCN=[N+]=[N-] 2246447284 OVKDXZQBADPJJU-VXGBXAGGSA-N 341.412 1.954 10 10 EDCE Cc1nn(-c2ccc(N)cc2)c(C)c1CN1CCN(CCO)CC1 2295351249 QODUHIZVNYOKLV-UHFFFAOYSA-N 329.448 1.181 10 10 EDCE OC[C@H](O)[C@H]1CCN1c1ccc(CNC2CC2)cc1Br 2286216241 SNGPBOUCWFUCCZ-CABCVRRESA-N 341.249 1.633 10 10 EDCE CN(CC(C)(C)CN1CCOCC1)C(=O)C=Cc1ccc(O)c(O)c1 2308005949 NIUVDAGIKHBAMZ-UHFFFAOYSA-N 348.443 1.928 10 10 EDCE CCNCc1ccc(N2CC([C@@H](O)CO)C2)cc1Br 2336773028 CQHGFBCFOYYNKX-AWEZNQCLSA-N 329.238 1.348 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CNC[C@@H]2F)c(O)c1Br 2352940512 FJTMJUHISZYQIG-UWVGGRQHSA-N 331.185 1.637 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C(=O)NC(C)(C)C1=O 7228974 IFKSHTHGKHUSCG-UHFFFAOYSA-N 332.404 1.041 10 10 EDCE C[C@H]1CN(C(=O)c2cc(O)c(O)c(O)c2)C[C@H](C(F)(F)F)N1C 170190641 XEEYSRJJDMBQFF-WRWORJQWSA-N 334.294 1.510 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN(C)C(=O)[C@H]2C)c([N+](=O)[O-])c1 302451553 SIEUBJKWCRFIRP-OKPNEXGHSA-N 333.344 1.448 10 10 EDCE CN(C)C[C@@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 172123020 AMJMGVNVMXOCAU-GOSISDBHSA-N 346.475 1.759 10 10 EDCE Cc1cccnc1CNC(=S)Nc1ccc(S(N)(=O)=O)cc1 244211979 VUTUYHMDTKDPCP-UHFFFAOYSA-N 336.442 1.524 10 10 EDCE Cc1n[nH]cc1CNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255010429 HHCFCEBZYNDBPG-DAXSKMNVSA-N 326.400 1.884 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)CC(C)(CO)CO)c([N+](=O)[O-])c1 269288720 OUBMYEVJNYZVSN-FNORWQNLSA-N 338.360 1.208 10 10 EDCE COC1(CS(=O)(=O)N2CCOc3cc(N(C)C)ccc32)CCC1 632051768 WUFJFPOSKGOXLQ-UHFFFAOYSA-N 340.445 1.850 10 10 EDCE COC(=O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 299109908 OTXICKKBAIGOSR-OAHLLOKOSA-N 347.415 1.228 10 10 EDCE COCC[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)C(N)=O 831727133 LYFJIMVKUGXQOV-QGZVFWFLSA-N 343.427 1.643 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@@H]3C[C@H]2C[S@]3=O)cc1F 844936225 VXJDKWVYYVZAQP-YEZLUTFDSA-N 325.409 1.307 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCC1=O 914242702 ROCLAAXDACZALK-ZDUSSCGKSA-N 349.406 1.783 10 10 EDCE COC(OC)[C@@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1 914336231 QQMMIIZGTBHWDA-CYBMUJFWSA-N 337.420 1.330 10 10 EDCE CC(C)[C@H](N)CNC(=O)NCc1cc(Br)ccc1O 841942736 AICRTFKUUNBHHS-LLVKDONJSA-N 330.226 1.937 10 10 EDCE O=C(NCc1c(O)cccc1F)NCC1CCS(=O)(=O)CC1 921658460 VNNUESFQMQLGBD-UHFFFAOYSA-N 330.381 1.155 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@H]2CC3(CCNCC3)C(=O)O2)c1 925854914 KAMTYORVIDRMRT-TZMCWYRMSA-N 334.416 1.737 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@@H]1CCC(=O)N1 854176791 NMBHDNRSGFFIBQ-ZFWWWQNUSA-N 332.448 1.570 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C(N)=O)C(C)(C)C)C2)cc1 854299601 PYPSASLEZYLPPJ-IUODEOHRSA-N 348.447 1.473 10 10 EDCE C[C@H]1C[C@@H](C)CN(S(=O)(=O)NNc2nc3cccnc3s2)C1 857225524 OJLNDKRLIQGLEL-AOOOYVTPSA-N 341.462 1.831 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)CS(C)(=O)=O)C2)cc1 855232648 WEUWPMRPYIHANS-OLZOCXBDSA-N 340.445 1.071 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCO)C(C)C)C2)cc1 854300029 ORYOTBUWIDHKTI-WMLDXEAASA-N 335.448 1.980 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N2CCC[C@@H](C3CCC3)C2)cc1 851688050 PHSNIFNJXJYAEL-MRXNPFEDSA-N 329.444 1.966 10 10 EDCE C[C@@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1cc(F)ccc1O 858489029 QESVOUWYZTXGTJ-YPMHNXCESA-N 342.378 1.899 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCN(C)C3CC3)C2)cc1 852186517 GIEFGFXHTVIJOB-CQSZACIVSA-N 332.448 1.667 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCC[C@H]2NCC[C@@H]21 868420404 VXOYSRZGAXOIAP-SJORKVTESA-N 344.459 1.064 10 10 EDCE CCN(CC)c1ccc(CN2CCC[C@@H]2CS(N)(=O)=O)cc1 769429358 YOMSLDOLNRVHJU-MRXNPFEDSA-N 325.478 1.786 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@]3(C)CCCO3)CC2)c(OC)c1 870165109 OCWVWPUHRCFYGZ-SFHVURJKSA-N 334.416 1.922 10 10 EDCE O=C1CC(C[C@@H]2CCCO2)=NN1C1=NS(=O)(=O)c2ccccc21 871946956 LIPPZZAHUSFUMY-NSHDSACASA-N 333.369 1.293 10 10 EDCE CC(=O)c1cn(C2CN(Cc3ccc(N4CCOCC4)cc3)C2)nn1 897936165 PMLUXZPIJUEGEC-UHFFFAOYSA-N 341.415 1.374 10 10 EDCE COc1ccc(O)c(CNc2ccc3c(c2)CN(CC(N)=O)CC3)c1 789767848 BMOXIFCMLCTKOX-UHFFFAOYSA-N 341.411 1.856 10 10 EDCE COC[C@@](C)(O)CNCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894251146 NDGSAOKIAYKEAY-KRWDZBQOSA-N 338.379 1.591 10 10 EDCE OC1CCN(c2ccc(CN3CCCn4nncc4C3)cc2)CC1 895756638 JMGSPAGDLDGWFW-UHFFFAOYSA-N 327.432 1.645 10 10 EDCE CC1=C(C(=O)NCc2cccc(O)c2O)[C@H](C)n2ncnc2N1C 1303195044 OULMOSXICFXNLU-JTQLQIEISA-N 329.360 1.291 10 10 EDCE COCC1(CCNC(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC1 1326895416 ODSZWMAOQKERPJ-UHFFFAOYSA-N 347.459 1.610 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@](O)(CN(C)C)C2)cc1Br 713709447 UTDQRCIFRGKSKS-NHYWBVRUSA-N 342.281 1.972 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)cc1Br 1893332423 RHGBULMBGZKFKC-BIGNPOOSSA-N 330.222 1.824 10 10 EDCE CNC(=O)[C@H](C)N(C)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1265075231 XDEAGWPWQFFNBB-NSHDSACASA-N 348.407 1.035 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2ncn(C)n2)cc1C 1277810689 OVQPAVDQLMHIAB-CYBMUJFWSA-N 331.420 1.382 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)CS(C)(=O)=O)cc1C 1505572476 ZJWXDTCFGQEBMB-CHWSQXEVSA-N 342.461 1.031 10 10 EDCE COc1cccc(CNC(=O)c2cc(Br)n[nH]2)c1O 1294925564 OSAKDCVDVRZBHT-UHFFFAOYSA-N 326.150 1.816 10 10 EDCE Cc1cccc(N(CCC(N)=O)C(=O)c2ccnc3c2CC(=O)N3)c1 1292309749 WLHWWDVSZIZUHW-UHFFFAOYSA-N 338.367 1.407 10 10 EDCE CN(Cc1ccccc1O)C(=O)N[C@H]1CCN(c2cc(O)ncn2)C1 1471525038 ZIJUKNKWGPGOEH-ZDUSSCGKSA-N 343.387 1.308 10 10 EDCE CCC[C@@H](CCCS(C)(=O)=O)C(=O)NCc1cc(O)ccc1O 1558175487 SLZZSBRFZYHVAK-LBPRGKRZSA-N 343.445 1.955 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2ccnnc2)cc1C 1495745781 BRDOERRHMYEDBE-ZDUSSCGKSA-N 328.416 1.949 10 10 EDCE COC(=O)c1ccnc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 1632681275 OOOFCJPSOAHBFO-JTQLQIEISA-N 330.340 1.640 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CC1(O)CCOCC1 1492782172 XWBNEJHSBZRXOL-UHFFFAOYSA-N 332.404 1.470 10 10 EDCE COC(=O)[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccccc1F 1566409128 WJAXDVQJVJKJNX-MRXNPFEDSA-N 333.315 1.810 10 10 EDCE CC(C)CNCCN(CCO)C(=O)c1ccc(N=NC(N)=O)cc1 1733633624 QOEKWCPGIYBKAT-UHFFFAOYSA-N 335.408 1.529 10 10 EDCE C[C@@H]1SC(=S)N(CCCCCC(=O)N2CCOCC2)C1=O 11636612 LRDNKLDJFWDYEZ-NSHDSACASA-N 330.475 1.654 10 10 EDCE COc1ccc(OC)c(/C=C2/SC(=S)N(NC(C)=O)C2=O)c1 206295338 OBYAYOSLLABCEQ-KPKJPENVSA-N 338.410 1.956 10 10 EDCE CCNCc1ccc(N2CCO[C@H](CO)C2)c(Br)c1 233532828 FNIPIHKXGSATKU-LBPRGKRZSA-N 329.238 1.756 10 10 EDCE CN1C(=O)[C@@H](O)c2ccc(N(CC(N)=O)Cc3ccccc3)cc21 1946829756 BGBLJRMKRBRVBU-KRWDZBQOSA-N 325.368 1.188 10 10 EDCE C[C@H](C(=O)NCCN=[N+]=[N-])N1CCN(C(=O)OC(C)(C)C)CC1 1985094309 NDRSVMHIYRMSBT-LLVKDONJSA-N 326.401 1.354 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCCCN=[N+]=[N-])[C@H]1CCCO1 1985101989 AGDNARPEKSFCMY-MNOVXSKESA-N 327.385 1.875 10 10 EDCE C[C@H](NC[C@H](CO)NC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985859417 SDZTURMYCMNQTJ-WDEREUQCSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1[C@H](O)[C@H](N)c1ccccc1O 2005036038 MVJXJZJHDRLRIJ-YUELXQCFSA-N 338.404 1.389 10 10 EDCE CC(C)(C)OC(=O)N=c1[nH][nH]cc1C(=O)NCC1(CN=[N+]=[N-])CC1 2010396015 LUTSZYDUFPRCQP-UHFFFAOYSA-N 335.368 1.999 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCN(CC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010393708 WIKCVQGSCKFNID-VXGBXAGGSA-N 338.412 1.497 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010402325 PLLKYVTUSHSSDL-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1CC(=O)C(=O)C[C@H]1C[C@H](N)C1 2014421768 FHBSZKXGWGUHSB-ZDEQEGDKSA-N 340.420 1.182 10 10 EDCE Cc1ccc(-n2c(C)cc(C=CC(=O)NOCC(N)=O)c2C)cc1 2053606437 XRMAVXDLDOQBDF-UHFFFAOYSA-N 327.384 1.949 10 10 EDCE CCNCc1ccc(N2CC(=O)N[C@H](C)C2)c(Br)c1 386864334 CMVVOLUPXZCGFT-SNVBAGLBSA-N 326.238 1.883 10 10 EDCE C[C@@H]1CN(C(=O)c2ccc(O)c(O)c2)CC[C@@H]1NC(=O)C(F)(F)F 2054398425 YDQFRGMNKFYNDJ-SCZZXKLOSA-N 346.305 1.627 10 10 EDCE OCc1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)c(Br)c1 2090115017 BGHVUJUYBCVCQV-KBPBESRZSA-N 328.206 1.123 10 10 EDCE CNC(=O)[C@@H]1[C@@H](C)CCN1c1ccc(CO)cc1Br 2090263082 TYXCUSHZSWZKPW-ZANVPECISA-N 327.222 1.902 10 10 EDCE Oc1c(F)cc(Br)cc1CNC[C@H]1C[C@@H](O)CCO1 2097944343 CKXHAYIZWQHHTN-WDEREUQCSA-N 334.185 1.923 10 10 EDCE CC(C)(C)OC(=O)NCc1cccc(COc2nnc(=N)[nH]n2)c1 2213781334 QPVAMJODXDXWNQ-UHFFFAOYSA-N 332.364 1.283 10 10 EDCE COc1ccc(Br)c(CN[C@H](C)c2nc(O)n[nH]2)c1O 2236049141 MOFAYWSEVXEQEH-ZCFIWIBFSA-N 343.181 1.838 10 10 EDCE CC(C)CN1C(=O)C(=CNc2ccnn2C(C)C)C(=O)NC1=S 2295113262 XKUQZJWREFYXFV-UHFFFAOYSA-N 335.433 1.659 10 10 EDCE Cc1ccc(N2C(=O)NC(=O)C(=CNCCCC(=O)O)C2=O)c(C)c1 2297534372 QIWOEIUVANNCLJ-UHFFFAOYSA-N 345.355 1.225 10 10 EDCE CNC(=O)[C@@H]1CN(C(=O)/C=C\c2cncc(C)c2)c2ccccc2O1 492978349 CQKSAHQTJXBUQX-QWPQOLDESA-N 337.379 1.943 10 10 EDCE CC(C)(C)OC(=O)N1CCN(Cc2ccc(N)cc2)[C@@H](CC(N)=O)C1 2320273004 PROCOYADJCCLEI-HNNXBMFYSA-N 348.447 1.566 10 10 EDCE CCN(Cc1cc([N+](=O)[O-])ccc1O)[C@H](C)CS(=O)(=O)CC 173394666 VUGUNMBTGHAQCX-LLVKDONJSA-N 330.406 1.946 10 10 EDCE CC(=O)N(C(=O)C(=O)N(C)c1ccc(O)cc1)c1ccc(N)cc1 170318793 OCCURAGSWRABQW-UHFFFAOYSA-N 327.340 1.517 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1nc(C)c(C)s1)c1ccc(N)cc1 170318856 GYQDAWIDXATGCT-UHFFFAOYSA-N 332.385 1.860 10 10 EDCE COc1ccc(O)c(CN[C@H]2CCCN(c3cc(C)nn3C)C2=O)c1 182482992 QLBUMDOQSYWFIU-HNNXBMFYSA-N 344.415 1.728 10 10 EDCE CN1CCN([C@@H]2CN(Cc3cc(C(C)(C)C)ccc3O)C[C@H]2O)CC1 212673980 HNHOZBHJBSTLBU-IEBWSBKVSA-N 347.503 1.482 10 10 EDCE CN(C)c1ccc(CNC(=O)CNc2ccc(C(N)=O)cc2)cc1 78503657 YRBUIFOMESOERV-UHFFFAOYSA-N 326.400 1.580 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CC(NC(C)=O)C2)cc1F 190053766 DAPWXEAKVPOZIC-UHFFFAOYSA-N 336.411 1.702 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)N3CCOC[C@@H]3C(N)=O)c2C)c1 91785961 GZVZISAIVGMTNB-QGZVFWFLSA-N 341.411 1.729 10 10 EDCE C[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C[C@@H](C(N)=O)O1 92006342 VUFLBXZDUOSVPA-HQJQHLMTSA-N 329.740 1.028 10 10 EDCE Cc1ccc(CN2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)c(O)c1Br 2380803117 GIMJKZWMNDJHLN-CGEWXTDFSA-N 342.233 1.779 10 10 EDCE Cc1ccc(CN2CC[C@@H](O)C[C@H]2C(=O)O)c(O)c1Br 2380812962 BGDMLDQZFUCOKR-MNOVXSKESA-N 344.205 1.873 10 10 EDCE Cc1ccc(CN2CCN3C[C@H](O)C[C@H]3C2)c(O)c1Br 2381132434 AVHZAVSBQBBTJV-QWHCGFSZSA-N 341.249 1.714 10 10 EDCE CN(C[C@@H](O)CN1C(=O)c2ccccc2C1=O)c1ccc(N)cc1 702130189 ZTFXUDVHCDQQLN-CQSZACIVSA-N 325.368 1.362 10 10 EDCE CCNCc1ccc(N2C[C@H](O)C[C@@H]2CO)c(Br)c1 704709953 TWYPPGXCJIIKKJ-VXGBXAGGSA-N 329.238 1.491 10 10 EDCE CO[C@H]1CCCC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)cc1C 807071956 FPLOSMFLJLFERR-IRXDYDNUSA-N 347.459 1.751 10 10 EDCE CC(=O)C(=O)COC(=O)CCc1nc(O)c2c(C)c(C)sc2n1 808509658 UHZDRJBIGVKJSN-UHFFFAOYSA-N 336.369 1.648 10 10 EDCE Cc1ccc2oc(=O)c(=O)n(OCCOc3ccc(N)cc3)c2c1 821296881 LEKLCYNTEAAZBM-UHFFFAOYSA-N 328.324 1.353 10 10 EDCE COCCn1ccc(NS(=O)(=O)c2cc(F)cc(F)c2O)n1 821168918 PGZVOJUZYYCLFZ-UHFFFAOYSA-N 333.316 1.314 10 10 EDCE Cc1cc(CCNC(=O)[C@H]2CN(C)C(=O)N2)c(C)n1-c1ccccc1 820005417 QFFOCNWGEJEWHJ-QGZVFWFLSA-N 340.427 1.776 10 10 EDCE Cc1cc(C(=O)N[C@@H](CO)c2ccnn2C)c(C)n1-c1ccccn1 838059663 KLFZAWJIVJTSMH-HNNXBMFYSA-N 339.399 1.686 10 10 EDCE Cc1cc(N2CC[C@H](OC(=O)c3ccc(C)c(O)c3O)C2=O)n(C)n1 744911038 WIMPXFXGHFPZQT-LBPRGKRZSA-N 345.355 1.410 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCN(C)[C@@H]2C)cc1 925348967 OUVXOKUQQCUERA-PBHICJAKSA-N 334.464 1.865 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1[C@H]2CN(C(=O)OC(C)(C)C)CC[C@H]21 923110442 XADJFUKXCWWWQC-NTZNESFSSA-N 325.361 1.191 10 10 EDCE C[C@@H]1COCC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856213339 ICZINIJBFUZWJO-KDOFPFPSSA-N 332.444 1.937 10 10 EDCE Cn1ccn2c(CCNCc3ccc4c(c3)CCCO4)nnc2c1=O 922338974 SHSIAZKYYWJGNC-UHFFFAOYSA-N 339.399 1.085 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC4(COC4)C3)C2)cc1 854295739 AMOADNAFGIFAIG-AWEZNQCLSA-N 331.416 1.706 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)COCc1ccnc(O)c1 859420996 HDLUQJWQYSCNBX-UHFFFAOYSA-N 329.400 1.995 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1nnc(C2CC2)o1 865910765 CRSITMMGLLZSTG-UHFFFAOYSA-N 328.372 1.714 10 10 EDCE O=C(NCCCSc1nccs1)c1ccc2c(c1)B(O)OC2 863872394 GHDHVWOEPDDDEE-UHFFFAOYSA-N 334.231 1.273 10 10 EDCE COCCN1CCC[C@@H]1CNCc1ccc([N+](=O)[O-])c(OC)c1O 775005204 QDMWYOQGLFLFCC-CYBMUJFWSA-N 339.392 1.509 10 10 EDCE CN[C@@H](C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)c1cnn(C)c1 1118569365 FYBVCUYQSGRLMJ-RHSMWYFYSA-N 343.431 1.084 10 10 EDCE CCOc1cccc(CNCC2(S(=O)(=O)N(C)C)CC2)c1O 886321898 BBRJZYWSYRAMIG-UHFFFAOYSA-N 328.434 1.305 10 10 EDCE CC(=O)C(=O)COC(=O)CC[C@@H]1CCCN1C(=O)OC(C)(C)C 796626382 RUDNBKIXTALNMF-LBPRGKRZSA-N 327.377 1.867 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ncnc(O)c3C)CC2)cc1 1084234051 WMZMQVAZXUTYGN-UHFFFAOYSA-N 328.372 1.462 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@@H](C)[C@@H](O)C3)C2)cc1 1312901767 HSOCGZFTFJGXSL-RKVPGOIHSA-N 347.459 1.934 10 10 EDCE CN1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)Cc2cccnc21 1175381297 LQSUECCTRCREPF-ALCCZGGFSA-N 325.368 1.985 10 10 EDCE C[C@H]1C[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 1325662083 ARDPAPMMIPIGQQ-ZFWWWQNUSA-N 347.484 1.628 10 10 EDCE CC1(C)SC[C@H]1NC(=O)C(=O)NCCCSc1nccs1 1322815118 QQSUMBLMDFFFKE-SECBINFHSA-N 345.515 1.752 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)/C=C/c2ccco2)cc1C 1320186117 KPCHNBZZXYBCPG-BVBGJJFLSA-N 344.411 1.877 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@](C)(O)[C@H](O)C2)cc1Br 1893332425 RHGBULMBGZKFKC-FZQKWOKYSA-N 330.222 1.824 10 10 EDCE C[C@@H]1CNC[C@H]1CCNCc1ccc(N2CCN(C)CC2)c(F)c1 1332011194 GGTBSBUUISLIBE-NVXWUHKLSA-N 334.483 1.913 10 10 EDCE COc1ccc(Br)c(CNCC(=O)NC2CCC2)c1O 1964052638 UGIUWVBFEASUGQ-UHFFFAOYSA-N 343.221 1.922 10 10 EDCE Oc1cccc(O)c1CNc1ccc2nnc(Br)n2n1 1458635724 CRZXQSNCXNCLBU-UHFFFAOYSA-N 336.149 1.910 10 10 EDCE CC[C@@H](CNC(=O)c1ccon1)NC(=O)c1cc(OC)nc(OC)c1 1704629307 VLMJIAQZGOTHNO-NSHDSACASA-N 348.359 1.025 10 10 EDCE CNCc1ccc(N2C[C@H]3NC(=O)O[C@@H]3C2)cc1Br 2120415258 GVBLKOYSQWAZQG-VXGBXAGGSA-N 326.194 1.466 10 10 EDCE CCS(=O)(=O)c1cnc(O)c(C(=O)NCc2ccccc2O)c1 1545682125 RDHFLSXPVGPGRQ-UHFFFAOYSA-N 336.369 1.216 10 10 EDCE C[C@H](CN(C)C(=O)C1CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1718519120 DVBLNFLYGPYHNC-SNVBAGLBSA-N 331.376 1.836 10 10 EDCE C[C@H]1C[C@H](N2CCOCC2)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1623811171 YLLALICUFCJEBK-WFASDCNBSA-N 345.403 1.784 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)[C@@H]2CCCO2)cc1C 1717045086 ZNTFCDOOHYBFKM-KRWDZBQOSA-N 336.432 1.093 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C(=O)OC)no1 1634940020 XAENKTOFAZVAGN-UHFFFAOYSA-N 325.317 1.583 10 10 EDCE CC(C)(C)OC(=O)[C@@]1(C(=O)NCc2cccc(O)c2O)CCCO1 1633515565 GNPOHSGEGJMELK-KRWDZBQOSA-N 337.372 1.605 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccc2c(c1)S(=O)(=O)CC2 1635560459 FLPPETYZOGMCTR-UHFFFAOYSA-N 333.365 1.609 10 10 EDCE Cc1cccc(NC(=O)NCC(=O)NCc2cccc(O)c2O)c1 1633506841 BLFIYUWJTQTUPB-UHFFFAOYSA-N 329.356 1.844 10 10 EDCE CN(CC(=O)NCc1ccc(O)cc1O)C(=O)OCc1ccccc1 1570462517 WMBDKTCWGAMHHF-UHFFFAOYSA-N 344.367 1.983 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccc(NC=O)c2)c1 1597776704 OJUNESKUSQPCLG-UHFFFAOYSA-N 349.368 1.584 10 10 EDCE CNC(=O)Cn1cc(NCc2cc(Br)ccc2O)cn1 218186318 OHAIEIFOMKTRJV-UHFFFAOYSA-N 339.193 1.709 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N(C)CCO)c(Br)cc21 118589955 BYOALFUPVNPEPU-GFCCVEGCSA-N 328.210 1.480 10 10 EDCE CC(C)NCc1ccc(N2CCNC(=O)C2)cc1Br 232711548 RSFXDOVTPBGVOT-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE COC[C@@H](C[C@@H](N)Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952893596 LPLJOOVKSNVHOW-QWHCGFSZSA-N 340.420 1.897 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985103549 XAGBUYAYDOGFRV-VWYCJHECSA-N 327.385 1.562 10 10 EDCE C[C@@H](NC[C@H](CO)NC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985858081 HBXCMEOQRKHBEC-GHMZBOCLSA-N 326.393 1.634 10 10 EDCE CO[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NCCN=[N+]=[N-] 1986262039 MOGAYAJCIIJLQU-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)[C@H]1CCCO1 2010406245 RNRLHMPXGWZHFW-TUAOUCFPSA-N 339.396 1.970 10 10 EDCE CO[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2012170476 IHAZZCISVZJEGD-NEPJUHHUSA-N 339.396 1.780 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2015120628 VIRRGTGBRSBMDK-AOOOYVTPSA-N 338.360 1.589 10 10 EDCE NCCN(Cc1ccccc1)S(=O)(=O)CCOc1ccc(N)cc1 2016890943 WCJKAXKRNZDPJW-UHFFFAOYSA-N 349.456 1.438 10 10 EDCE CCCN(c1ccc(CN)cc1Br)[C@H]1CC(=O)NC1=O 2171198235 WPRKGCJHLKDNAF-LBPRGKRZSA-N 340.221 1.539 10 10 EDCE CN1CCO[C@@H](CN(C)c2ccc(CN)cc2Br)C1 707817291 QHZCUBRVSPKBJL-GFCCVEGCSA-N 328.254 1.675 10 10 EDCE COc1ccc(N(C)[C@@H](CN)c2nn(C)nc2Br)cc1 2167734494 KOUSCWXJJRXGJF-NSHDSACASA-N 340.225 1.722 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccc(N2CCC(O)CC2)cc1 1597575006 XCQHXBHJTNUIBE-UHFFFAOYSA-N 342.395 1.989 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](CNC(=O)Cc2ccc(N)cc2)C1 2044206166 HUBKCBFUPWPKTQ-HNNXBMFYSA-N 349.431 1.563 10 10 EDCE COCCNCc1ccc(N2CC([N+](=O)[O-])C2)cc1Br 2191528784 JDJWJILGBSHFJL-UHFFFAOYSA-N 344.209 1.650 10 10 EDCE Oc1c(Br)cccc1CN[C@H]1CCN(C2COC2)C1 2113266236 NHYIWRHRMWCLJE-NSHDSACASA-N 327.222 1.717 10 10 EDCE O[C@@H]1CN(c2ccc(CNC3CCC3)c(Br)c2)C[C@H]1O 2239980981 GAFDLSQVIGWEQM-HUUCEWRRSA-N 341.249 1.633 10 10 EDCE CC[C@H](C)CNC=C1C(=O)NC(=O)N(c2ccc(OC)cc2)C1=O 2296166950 IIRKPHFESYEFHR-NSHDSACASA-N 331.372 1.798 10 10 EDCE O=C1N=C(N(CCO)CCO)SC1=Cc1ccccc1Cl 2297580150 UFCOCCUUJWBQDO-UHFFFAOYSA-N 326.805 1.597 10 10 EDCE CC(C)(C)OC(=O)NCc1c[nH][nH]c1=NC(=O)c1cccc(O)c1O 2327333535 KROMIFRKMULTSY-UHFFFAOYSA-N 348.359 1.520 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)C[C@@H]1N1CCOCC1 177233950 QRAAWZHQQJBPGZ-YJBOKZPZSA-N 346.475 1.615 10 10 EDCE COC(=O)C[C@H]1C(=O)NCCN1Cc1cc(Cl)cc(C)c1O 183508399 XCLJQINVQSLBMS-LBPRGKRZSA-N 326.780 1.218 10 10 EDCE Cn1nccc1CNC(=O)NCc1ccc(N2CCSCC2)cc1 46942193 IFCYVAHYUJVEBO-UHFFFAOYSA-N 345.472 1.973 10 10 EDCE COc1ccc(N2CCCN(c3cncc(OCCO)n3)CC2)cc1 131689435 ZTJDRCRLJKCTSO-UHFFFAOYSA-N 344.415 1.573 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N(C)c2ccc(C(N)=O)cc2)c1 96034939 MXIKIYRALLPOLW-BAQGIRSFSA-N 338.367 1.216 10 10 EDCE CCO[C@H]1C[C@](NC(=O)c2cccc(O)c2O)(C(=O)OC)C1(C)C 275530200 FNNXQQLOTSRUAV-SJCJKPOMSA-N 337.372 1.574 10 10 EDCE c1cc(N2CCOCC2)ccc1CNC[C@@H]1CN2CCC[C@H]2CO1 378903899 YDAZTDGWADXNFA-RBUKOAKNSA-N 331.460 1.476 10 10 EDCE CCOC(=O)[C@@H]1C[C@H](O)[C@@H](N=[N+]=[N-])C[C@H]1NC(=O)OC(C)(C)C 381071208 PETGZSIPWBXEIZ-ZNSHCXBVSA-N 328.369 1.893 10 10 EDCE C[C@@H](C(N)=O)N(C)c1ccc(/C=C\C(=O)O)cc1Br 711183622 FEVXLECESUSVPZ-HORMHSFOSA-N 327.178 1.857 10 10 EDCE CCc1cccc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)c1O 848910750 PLGKXSGOTIEVOT-HNNXBMFYSA-N 326.462 1.810 10 10 EDCE Cc1cc(O)c(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1C 842633066 OMEGLTNOSBIMEM-MRXNPFEDSA-N 325.430 1.399 10 10 EDCE Oc1cc2c(cc1CN1CC[C@H](Nc3ncccn3)C1)[C@@H](O)CO2 842617786 WGUZXSRCLNTAKN-WFASDCNBSA-N 328.372 1.294 10 10 EDCE COc1ccc(N(CC2CN(S(C)(=O)=O)C2)C(C)C)cc1F 929952615 XVTUAFHKSXZRRP-UHFFFAOYSA-N 330.425 1.941 10 10 EDCE CC(C)(C)OC(=O)C1=NO[C@H](C(=O)NCc2c(O)cccc2F)C1 928708758 SOIHTSODNCDCQO-ZDUSSCGKSA-N 338.335 1.634 10 10 EDCE C[C@@H]1C[C@H](NC2CN(S(=O)(=O)N(C)C)C2)c2c(O)ccc(F)c21 858569746 NOONWPCMVBMMGK-SKDRFNHKSA-N 343.424 1.160 10 10 EDCE CO[C@H](CS(=O)(=O)NNc1nc2cccnc2s1)C(C)C 857225864 VIKPKKRVYKCKNM-SNVBAGLBSA-N 330.435 1.609 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCc3cn(C)nn3)C2)cc1 855224940 IPUPKZVWKOVMSZ-CYBMUJFWSA-N 329.404 1.151 10 10 EDCE CO[C@@](C)(C(=O)NCc1c(O)cccc1F)C(=O)OC(C)(C)C 928712658 TWUWCBHIEVEJJK-INIZCTEOSA-N 327.352 1.894 10 10 EDCE NC(=O)C1CCN(c2ccc(CN[C@H]3C[C@@H](N)C34CCC4)cc2)CC1 925775817 AQSYDGRIKOZMMU-MSOLQXFVSA-N 342.487 1.748 10 10 EDCE Cc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cnn1 856213041 VHNJOTCYELFKEI-UHFFFAOYSA-N 326.400 1.676 10 10 EDCE Cc1ccncc1S(=O)(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 850586900 JZMUNCMBCYCXLM-OAHLLOKOSA-N 334.445 1.434 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNc3nccnc3F)cc2)C1 858357369 RKHWSKUTOGZVCM-ZDUSSCGKSA-N 329.379 1.930 10 10 EDCE Cc1cc(Cl)cc(CN2CCC(n3cc(C(N)=O)nn3)CC2)c1O 862483084 FDJMVHKFLQNDPY-UHFFFAOYSA-N 349.822 1.882 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C[C@@H]1F 1117163934 DLVVPFNVBAHOCK-BBRMVZONSA-N 347.434 1.892 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1[C@@H]2CCCO[C@H]21 780384366 HJIVGFMAIQTMCL-IPMKNSEASA-N 344.455 1.937 10 10 EDCE Cc1nnnn1-c1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 1136213999 KDSZTUIUPAQVJY-UHFFFAOYSA-N 325.328 1.563 10 10 EDCE CN(C)c1ccc(CN(C(=O)C2CN([C@@H]3CCOC3)C2)C2CC2)cc1 895634257 XTKFJDISKKEIPX-LJQANCHMSA-N 343.471 1.964 10 10 EDCE CCN1C(=O)/C(=C\c2ccc(N3CCOCC3)cc2)C(=O)NC1=S 1084418368 KLCRHGMVUUFXPH-KAMYIIQDSA-N 345.424 1.170 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)Cc3nc[nH]n3)C2)cc1C 1316623705 XKRFOJGKOIWEAG-GASCZTMLSA-N 343.431 1.349 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)C[C@H]2CCNC2=O)cc1C 1320448174 UCKMLHGPWRMGOV-GDBMZVCRSA-N 347.459 1.514 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N1CC(C)(F)C1 1327200875 SYPYINOQIIZWQQ-UHFFFAOYSA-N 349.406 1.052 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@H]2CC(=O)N(C)C2)cc1C 1268372112 VNGZNTCSKPFFHK-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CCO1 1351363142 MBRAMWIDNPUGFU-KBPBESRZSA-N 333.432 1.567 10 10 EDCE CCO[C@H](C)C(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1285660765 WVFMQRALUGHXOP-GHMZBOCLSA-N 349.391 1.509 10 10 EDCE CCC(=O)NCC(=O)N(C)C[C@@H](C)NCc1ccc(OC)c(C)c1 1283582962 PRIITPKRQBBYJW-CQSZACIVSA-N 335.448 1.466 10 10 EDCE Cc1nc(-c2ccnc(NC(=O)Cc3ccc(O)c(O)c3)c2)n[nH]1 1468760992 OOWNLPBVCOFHJG-UHFFFAOYSA-N 325.328 1.768 10 10 EDCE C[C@@H](O)[C@@H](O)CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1612667014 JLRRZNCTGGIKPQ-BZNIZROVSA-N 330.340 1.979 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H]2CCCNC2=O)cc1C 1700752867 APXPZXCMIGCXJF-GOEBONIOSA-N 347.459 1.466 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@H]1CCCN1C(=O)C(F)(F)F 1545636735 DYPHAEORIMMBEV-SECBINFHSA-N 332.278 1.267 10 10 EDCE CC(C)[C@@H](O)C(=O)NCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1704199749 XAOYCMZAANNFBM-CYBMUJFWSA-N 349.391 1.054 10 10 EDCE CCCC(=O)N(C)[C@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1715319199 MZIQYSOLNNOKAU-CYBMUJFWSA-N 346.435 1.408 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cc(F)c[nH]2)cc1C 1484488704 QFVKDHFGXPRMNU-UHFFFAOYSA-N 349.406 1.695 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H]3[C@@H](C2)C3(F)F)c1 1620707692 MHSFRKXBSNKZKQ-WDEREUQCSA-N 346.355 1.491 10 10 EDCE CCN1CCOC[C@@H]1C(=O)NC[C@@H](C)NCc1ccc(OC)c(C)c1 1714248753 KPQZRZMUOOEHEM-NVXWUHKLSA-N 349.475 1.319 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)c2cnnn2C)cc1C 1715642212 RYNGGLNXIQMASO-ZDUSSCGKSA-N 331.420 1.430 10 10 EDCE Cc1cc(NS(=O)(=O)c2nn(C)cc2Br)ccc1O 2121902863 QPLKIHSPHWLSMB-UHFFFAOYSA-N 346.206 1.997 10 10 EDCE COCCN[C@@H](C)[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1724565389 XADAVGXAFUGQGT-JSGCOSHPSA-N 347.419 1.936 10 10 EDCE CN(C)[C@@H](C(=O)NCCCSc1nccs1)c1cncn1C 1565620681 ZIKFTIBVYYJCHR-GFCCVEGCSA-N 339.490 1.778 10 10 EDCE C[C@H](O)c1ccc(N2CCC[C@H]2[C@@H](O)CO)c(Br)c1 2123168644 BPJNJGQJIPALFV-HERUPUMHSA-N 330.222 1.824 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cnc(C)n2C)cc1C 1731617518 RQWLNZLTIQVXOK-CYBMUJFWSA-N 330.432 1.954 10 10 EDCE CCOc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)C)CC2)cc1 1596733590 UUGOSOIXJMRLDJ-MDZDMXLPSA-N 331.416 1.378 10 10 EDCE CC(C)Cc1nc2s/c(=C\c3ccc(N(C)C)cc3)c(=O)n2n1 1860788461 KMDUTOIUXOEDKE-UVTDQMKNSA-N 328.441 1.963 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3[C@H](C(N)=O)[C@@H]3C2)cc1Br 2136613996 NJFBNZMMPTVOBA-IJBDUVHLSA-N 328.185 1.214 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1C[C@@H](N)CO1 1952481900 WVPZJDQBPDMDSF-JMSVASOKSA-N 338.404 1.650 10 10 EDCE CO[C@H](C)[C@H](CC(=O)C(=O)C[C@H]1C[C@H](N)C1)NC(=O)OC(C)(C)C 2003166549 HWSAESZGTFWGIQ-LPWJVIDDSA-N 342.436 1.570 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980378811 XUHFIMZXMAUKCV-DDHJBXDOSA-N 328.384 1.600 10 10 EDCE C[C@@H](N[C@@H](CO)CNC(=O)OC(C)(C)C)c1c(O)cccc1O 1985777079 HBVMGGKLPIUABL-GHMZBOCLSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2010403884 LDZJFTIFNZTNMC-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NC(=O)Nc2ccc(N)cc2)C1 2011488671 YPQIRDKZSFDZMY-STQMWFEESA-N 336.392 1.371 10 10 EDCE NC(=O)CCN(Cc1ccccc1)C[C@H](O)COc1ccc(N)cc1 2034751031 PXHHGGVTKQIINX-KRWDZBQOSA-N 343.427 1.386 10 10 EDCE NCc1cc(F)c(N2CCC[C@H](CO)[C@H]2CO)cc1Br 709806216 LAGMCIITHRASAT-YMTOWFKASA-N 347.228 1.617 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cc(=O)c(OC)cn2C)c1 2064368649 SDMLKXZOWIJESB-SNVBAGLBSA-N 332.356 1.599 10 10 EDCE COc1ccc([C@H](n2nc(C)c(C(N)=O)c2N)C2(C)CC2)c(O)c1 2079970160 OMJYLYAUWNNLKA-AWEZNQCLSA-N 330.388 1.976 10 10 EDCE O[C@@H]1CCN(c2ccc(CNC3CC3)cc2Br)C[C@H]1O 2188633092 NIFHJKGQGIMRNT-HUUCEWRRSA-N 341.249 1.633 10 10 EDCE CC(C)NCc1ccc(N2CC[C@H](O)[C@@H](O)C2)cc1Br 2188629628 INLMWEBTSIQWNN-GJZGRUSLSA-N 343.265 1.879 10 10 EDCE COCCOCCOCCNCc1cccc(Br)c1O 2187128585 QVVKCFFHJCZALR-UHFFFAOYSA-N 348.237 1.924 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)cc1Br 2089926824 NJKURMXCQGZJMC-CUOATXAZSA-N 329.238 1.614 10 10 EDCE CSc1ncc(CNS(=O)(=O)C[C@@H](C)C(N)=S)s1 2257133216 TUPLIJNQGVBDNY-ZCFIWIBFSA-N 325.506 1.207 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2298023982 RKCAZRPCDHZPMQ-OUAUKWLOSA-N 343.384 1.805 10 10 EDCE C[C@@](NC(=O)C=Cc1ccc(O)c(O)c1)(C(N)=O)c1ccccc1 2307989745 HWDKUURZDIXTOS-SFHVURJKSA-N 326.352 1.628 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2333236861 IQBHUJYZLWGZPE-VGYUKGMSSA-N 333.201 1.349 10 10 EDCE O=C(NC[C@@H]1N[C@H](CO)Cc2cccc(O)c21)OCc1ccccc1 309652731 AQLMNCJLAAWHDE-HOTGVXAUSA-N 342.395 1.866 10 10 EDCE CCOCCN1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@H]1C 181095968 NBRDCUJDRJDXKL-HZRUHFOJSA-N 334.416 1.680 10 10 EDCE COc1cc(N)c(N2CCSC[C@H]2S(C)(=O)=O)cc1OC 213775674 HXGMRVFZBRHURE-CYBMUJFWSA-N 332.447 1.210 10 10 EDCE COc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)cc(O)c1O 44300098 BGMCRFMBRRKSOB-VIFPVBQESA-N 327.333 1.627 10 10 EDCE CN1CCCc2cc(CNC(=O)c3nn(C)cc3[N+](=O)[O-])ccc21 270823278 RQGGFWNCEFUHSC-UHFFFAOYSA-N 329.360 1.641 10 10 EDCE CN(C)S(=O)(=O)N1CCC[C@@H](NCc2cc(Cl)ccc2O)C1 808424740 VIMCHTVYNRXVJS-CYBMUJFWSA-N 347.868 1.406 10 10 EDCE CNC(=O)c1cccc(CCC(=O)NCCc2ccc(N)cc2)c1 818544666 GMSZOOUOSALVEC-UHFFFAOYSA-N 325.412 1.920 10 10 EDCE COC(=O)C[C@@H](CNC(=O)NCc1cccc(OC)c1O)C1CC1 822745516 NJXJPNKOEFZPGV-ZDUSSCGKSA-N 336.388 1.789 10 10 EDCE CN(C1CC1)S(=O)(=O)NCc1ccc(N2CCSCC2)cc1 736326464 RLEZKPUWIZHRKI-UHFFFAOYSA-N 341.502 1.668 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCS(=O)(=O)[C@@H]3CCC[C@@H]32)c1O 832462483 GIFVDEZULHBKQA-LSDHHAIUSA-N 341.404 1.885 10 10 EDCE C[C@H](NC(=O)N(C)[C@@H]1CCN2CCO[C@H]1C2)c1ccc(N(C)C)cc1 836407439 ZFMWBFDZUVPZKV-QGTPRVQTSA-N 346.475 1.928 10 10 EDCE CCON(C)C(=O)CNC(=O)N(CC)Cc1ccc(N(C)C)cc1 845569452 KUQVOFLXRIFSAY-UHFFFAOYSA-N 336.436 1.694 10 10 EDCE COC(=O)c1cccc(NC(=O)C(=O)NCc2ccccc2O)c1C 748482388 UGPIUHWYJLIKAN-UHFFFAOYSA-N 342.351 1.742 10 10 EDCE N=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC[C@H]1CCCO1 849016902 QOQPPBJXZXRJAS-GOSISDBHSA-N 346.475 1.688 10 10 EDCE Cn1nnc2c1C[C@@H](NCc1ccc(N3CCOCC3)c(F)c1)CC2 922993490 KTATYXYSUCNAKA-AWEZNQCLSA-N 345.422 1.438 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C2(C(=O)N(C)C)CC2)cc1 846442828 ZPSYCTQZALEDFQ-UHFFFAOYSA-N 333.432 1.458 10 10 EDCE COc1ccc(N2CC[C@@H](Nc3ncnc4c3nnn4C)C2)cc1 853760600 LBLJOJZFQKOPHN-LLVKDONJSA-N 325.376 1.458 10 10 EDCE COCCN(C[C@H]1CCC2(CNC2)O1)c1ccc(OC)c(OC)c1 852746729 QWHSXUWOFBVLGC-OAHLLOKOSA-N 336.432 1.678 10 10 EDCE C[C@H](N[C@@H]1CCN(C2CCOCC2)C1=O)c1cc([N+](=O)[O-])ccc1O 756735398 BIPZVWNOICDZCQ-XHDPSFHLSA-N 349.387 1.731 10 10 EDCE O=C(NCC[S@@](=O)CC(F)(F)F)c1c(F)ccc(O)c1O 857302539 UYWRCFCGJJYHRB-OAQYLSRUSA-N 329.271 1.278 10 10 EDCE CNC(=O)CCN(C)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 854301589 QGSZHZOBIFOBAZ-ZDUSSCGKSA-N 334.420 1.051 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)Nc2cn(C)nn2)N(C)C)cc1 931510411 UZXKJVOQOVABNG-AWEZNQCLSA-N 331.424 1.306 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@]1(C)C(=O)O 863533727 XTDYGKNWQUGWIC-GOSISDBHSA-N 333.432 1.650 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)c2cnn(CC3CC3)c2)cc1 777857362 UBGQUGXULRDMGB-UHFFFAOYSA-N 334.445 1.838 10 10 EDCE C[C@@H](NC(=O)CCc1ccccc1)C(=O)NCc1cccc(O)c1O 1123977264 DILPFOMSZFUJME-CYBMUJFWSA-N 342.395 1.852 10 10 EDCE COC(=O)[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1cccc(O)c1 779543736 YMUOJSZFRGXESU-BQLWYNFJSA-N 343.335 1.847 10 10 EDCE COC(=O)COc1ccc(N(C)CCCCS(C)(=O)=O)cc1 784564105 MXEIYGJVQONRNL-UHFFFAOYSA-N 329.418 1.499 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1nncn1C 1136170936 RXZLFDFSISHSKJ-UHFFFAOYSA-N 337.383 1.965 10 10 EDCE CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CC[C@H](O)CC1 784741372 ASJBIBWZRBCSAD-HAQNSBGRSA-N 342.417 1.139 10 10 EDCE CN(C)S(=O)(=O)[C@@H]1CCCN(Cc2cc3c(cc2O)CCC3)C1 795660051 YBZKUIOOQMZLJQ-MRXNPFEDSA-N 338.473 1.737 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@](C)(O)[C@H](O)C2)cc1Br 1893332426 RHGBULMBGZKFKC-FZZIBODNSA-N 330.222 1.824 10 10 EDCE C[C@H]1CNc2c(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cnn2C1 1346737292 YFUNFKPUKHKWLT-WDEREUQCSA-N 330.388 1.717 10 10 EDCE C[C@H](CNC(=O)[C@H]1CC12CC2)NC(=O)c1ccc(N=NC(N)=O)cc1 1284345526 YYEZLXYTEOBWNS-ZWNOBZJWSA-N 343.387 1.884 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCc2ccc(O)cc2O)s1 1451763943 CWGCICMWPSMEIQ-UHFFFAOYSA-N 327.383 1.493 10 10 EDCE CNCc1ccc(N2CCO[C@H]([C@@H](C)O)C2)cc1Br 2117532799 VFGDMQNURXZBEP-YGRLFVJLSA-N 329.238 1.755 10 10 EDCE O=C(CCN1C(=O)CSC1=S)Oc1ccc2c(c1)OCO2 1865774612 RVZJCKFOXUCYMJ-UHFFFAOYSA-N 325.367 1.571 10 10 EDCE CCN(C)c1ccc(CN(C)Cc2nnc3c(=O)n(C)ccn23)cc1 1473788230 FSJZRIFIXOHROR-UHFFFAOYSA-N 340.431 1.516 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cccnc2OCCO)c1 1622778929 BIDZPOWXEKAZNU-NSHDSACASA-N 332.356 1.658 10 10 EDCE C[C@H](NCCN1CCOC[C@@H]1C)c1ccc(N2CCOCC2)cc1 1559709879 UQLBQRZRTIXXRA-IRXDYDNUSA-N 333.476 1.895 10 10 EDCE C[C@H](O)CNC[C@@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1716790969 SVUUODKVETZPIT-FZMZJTMJSA-N 333.392 1.424 10 10 EDCE CCNC(=O)CC(=O)N1CC[C@@H](NCc2ccc(OC)c(C)c2)[C@@H]1C 1717790705 LWQGKDDWSRMEQB-GOEBONIOSA-N 347.459 1.609 10 10 EDCE C[C@H](NCCn1ncc(Br)n1)c1ccc(O)cc1O 2123094785 KJJPSUUSMTYPTJ-QMMMGPOBSA-N 327.182 1.803 10 10 EDCE CC1=C(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)S(=O)(=O)CCO1 1633315796 XBNPRSCRXDCHGR-LLVKDONJSA-N 338.429 1.606 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnc2c(c1)NC(=O)CO2 1568737885 RBYPSVPCKKNMTG-UHFFFAOYSA-N 348.355 1.534 10 10 EDCE C[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CCN1CC(F)(F)F 1637848663 AEFHRCCSNCZXQM-JTQLQIEISA-N 332.322 1.735 10 10 EDCE CCn1c(S)nnc1CNC(=O)c1ccc(N=NC(N)=O)cc1 1565616044 VSXIXDSKBQMDSQ-UHFFFAOYSA-N 333.377 1.679 10 10 EDCE COc1ccc(N2CCN(CCN3CCOC[C@@H]3C)CC2)c(OC)c1 1560083592 ZWGTXKWNJVOBMU-INIZCTEOSA-N 349.475 1.547 10 10 EDCE OC/C=C/c1ccc2c(c1)O[C@H](CO)[C@@H](c1ccc(O)c(O)c1)O2 32296693 NKYXNCKZTCGVJJ-ZHEVZCJESA-N 330.336 1.977 10 10 EDCE endogenous,in-man CCC(=O)NCc1ccc(C(=O)N[C@H](CCSC)C(=O)O)cc1 33520264 LGIKPKMAWZXTGQ-CYBMUJFWSA-N 338.429 1.649 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1OC[C@@H]2COCC[C@@H]21 1120647620 HPYAKXGGUPWWPO-MQIPJXDCSA-N 326.389 1.546 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CCC[C@@H]3CO)c(Br)cc21 118711842 LDIMATJXFROJKP-AMIZOPFISA-N 340.221 1.623 10 10 EDCE O=C(O)C[C@@H](CNC(=O)OCc1ccccc1)c1cc(O)nc(O)c1 1951948869 RWKUHVQPJNWSLE-ZDUSSCGKSA-N 346.339 1.978 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)COC1 1985100348 FTFHGFXBXWJSFY-SNVBAGLBSA-N 325.369 1.534 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 2010045917 TVLWFGXMMXQLLX-CYBMUJFWSA-N 340.376 1.480 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010401380 DRQLZDSMNHOQPW-RYUDHWBXSA-N 339.396 1.780 10 10 EDCE C[C@H](NC(=O)[C@H](O)[C@@H](C)NC(=O)OC(C)(C)C)c1ccccc1O 2017514403 GNODLFYZMJMUPN-MISXGVKJSA-N 338.404 1.844 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CC(CO)C1 2018277819 GYHZRVWEGHRHDX-VTWZXRTESA-N 339.396 1.563 10 10 EDCE O=C1NCC2(CCN(c3ccc(CO)c(Br)c3)CC2)N1 2177667259 YCJMGOOPQGJZLD-UHFFFAOYSA-N 340.221 1.593 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC4(CCOCC4)CC3)c2n1 2062374005 SLMJABZCMGCMSF-UHFFFAOYSA-N 330.388 1.776 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@@H](O)C2(C)C)c(Br)c1 2181207165 OFTUBUQTASMXJS-ZIAGYGMSSA-N 343.265 1.879 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)Nc2ccc(N)cc2)n1 2058150646 MKPVZBVUKSRPKV-UHFFFAOYSA-N 331.195 1.566 10 10 EDCE NCc1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)c(F)c1Br 2102192770 YRIKYUREJWQATM-LSJOCFKGSA-N 331.185 1.243 10 10 EDCE O=S1(=O)CC[C@H]2CN(c3ccc(CO)cc3Br)C[C@H]21 2088783614 FQDITFUHMPMDBH-GXFFZTMASA-N 346.246 1.565 10 10 EDCE O=S1(=O)CC[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@H]21 2088814979 MYNBUMLLEPOVNO-NOZJJQNGSA-N 346.246 1.774 10 10 EDCE O=C(O)[C@@H]1[C@@H]2OCCN(Cc3cc(Br)ccc3O)[C@@H]21 2092840764 HYFTZFJWTNFUKA-TUAOUCFPSA-N 328.162 1.439 10 10 EDCE OCc1ccc(N2CC[C@H]3OCCO[C@H]3C2)cc1Br 2095427848 WWCBCSVHAYGOKK-KGLIPLIRSA-N 328.206 1.936 10 10 EDCE CC(C)(C)OC(=O)N1CCc2cc(Nc3nnc(=N)[nH]n3)ccc21 2213784695 FCBGAJNKXBTZSY-UHFFFAOYSA-N 329.364 1.720 10 10 EDCE COc1ccc(N2C[C@@H](CO)C[C@@H]2CO)c(OC)c1Br 2234894450 UCKYZZWOSVNVNM-VHSXEESVSA-N 346.221 1.646 10 10 EDCE CN(NCc1cccc(Br)c1O)S(=O)(=O)C1CC1 2317488968 LSNBYWDNXMHFEV-UHFFFAOYSA-N 335.223 1.583 10 10 EDCE Cc1ccc(CNC[C@@H](O)CCC(=O)O)c(O)c1Br 2352950283 QFIAYKBDSKCXFS-JTQLQIEISA-N 332.194 1.778 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CN2CCCC[C@H]2CN2CCOCC2)c1 173376967 SNVNNSREMWUXPX-INIZCTEOSA-N 335.404 1.987 10 10 EDCE COC(=O)[C@@H](C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 177903545 GTNRRIFFYLFRQC-LBPRGKRZSA-N 338.379 1.478 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C[C@H]2CCOC2)nn1 528995923 JORSXBPXMURKFF-WCQYABFASA-N 346.387 1.087 10 10 EDCE CN(C[C@H]1CCCO1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 264035699 UEAOPPKGARMEMR-LLVKDONJSA-N 328.390 1.015 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@H](C2CC2)O1 366507634 VOAKFVQFPPXFAF-RFAUZJTJSA-N 333.344 1.929 10 10 EDCE CCn1nc2c(cc1=O)CN(C(=O)/C=C/c1ccc(O)c(O)c1)CC2 368016339 HGLLXCWGKDPIAA-GQCTYLIASA-N 341.367 1.273 10 10 EDCE Cc1cc(Cl)cc(CNC2CCC3(CC2)NC(=O)NC3=O)c1O 289184084 ANADBDGHIAHDMV-UHFFFAOYSA-N 337.807 1.964 10 10 EDCE COc1cccc(CN[C@H](C(=O)OCc2ccccc2)[C@H](C)O)c1O 294087888 ZKCFXJWGJHBMEH-GUYCJALGSA-N 345.395 1.983 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCc2cscn2)cc1F 803664442 IZBYSHXLINWGBX-UHFFFAOYSA-N 336.392 1.281 10 10 EDCE CC[C@@H](O)CN(C)c1cc2c(cc1Br)[C@H](NC)C(=O)N2 2162893109 GQCQKFVEYHLFSY-OQPBUACISA-N 342.237 1.869 10 10 EDCE CN[C@@H](C)c1ccc(N(C)[C@@H]2COC[C@H]2O)cc1Br 709476108 KDAMODCYRJJQDX-CUOATXAZSA-N 329.238 1.925 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H](CC2CCOCC2)C(=O)O)cc1 908758908 SOVRCRYQNMXWQU-MRXNPFEDSA-N 349.431 1.822 10 10 EDCE Cc1ncc2c(n1)CC[C@@H](NC(=O)NCc1c(O)cccc1F)C2 914004888 VQWAABPJSMFJTK-GFCCVEGCSA-N 330.363 1.986 10 10 EDCE COc1ccc(N2CC[C@H](NC(=S)NC3CCOCC3)C2)cc1 849270847 QWLHHFCHZQMTPG-AWEZNQCLSA-N 335.473 1.917 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCO[C@H]([C@@H](C)O)C2)c([N+](=O)[O-])c1 840384880 BPBMTEMSYFPDBE-FFLLRXOZSA-N 336.344 1.367 10 10 EDCE Cc1cc(O)c(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)c(Cl)c1 843426117 NHNNTJQPWLQTES-OAHLLOKOSA-N 345.848 1.744 10 10 EDCE COc1ccc(CNCC[C@@H]2CC(=O)N(C)C2)cc1Cn1cccn1 922484284 IXSDKYPNFALOTD-MRXNPFEDSA-N 342.443 1.898 10 10 EDCE O=C(NC1C[C@@H]2CC[C@H](C1)S2(=O)=O)N1Cc2cccc(O)c2C1 927322362 HZABCKDEPWOSOH-YHWZYXNKSA-N 336.413 1.526 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC4(CC3)OCCO4)cc2N1 757508744 LHANQIULTCFCTM-UHFFFAOYSA-N 335.316 1.269 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)c3ncn(C)n3)C2)cc1 852268132 GVSLBPXWYFQBCF-OLZOCXBDSA-N 344.419 1.463 10 10 EDCE C[C@@H]1CN(C)C[C@@H]1NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 756103991 XRUFCIJKCVOCDI-KYJSFNMBSA-N 330.476 1.428 10 10 EDCE CCOC(=O)/C(=C/c1cn(C[C@@H]2CCOC2)nn1)c1nccn1C 865218479 NCAALSRJYJCCCJ-ACLQVGRQSA-N 331.376 1.152 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@H]3CCCOC3)CC2)c(OC)c1 868283172 QVFKICCVTFWJHC-AWEZNQCLSA-N 349.431 1.714 10 10 EDCE C[C@@H]1C[C@H](COC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 783151999 MCCQZDCRIQZELH-GHMZBOCLSA-N 343.401 1.736 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NCc1ccc(F)cc1O 1898128837 JIEWDBPCDVOKMV-CHWSQXEVSA-N 326.368 1.913 10 10 EDCE CCCOc1ccc(/C=C2/C(=O)NC(=O)N(C)C2=O)cc1OCC 1084579846 CJBAAJSYHOXVPS-XFXZXTDPSA-N 332.356 1.966 10 10 EDCE O=C(N[C@H](CO)C(=O)NCc1ccccc1O)OCc1ccccc1 1150535793 FJUJGXAZWAVGKL-OAHLLOKOSA-N 344.367 1.296 10 10 EDCE Cc1ccc(C(=O)NCc2cnc(Br)cn2)c(O)c1O 1157728230 FRJQZQIVUIMPQW-UHFFFAOYSA-N 338.161 1.889 10 10 EDCE O=C(NCCNC(=O)c1cc2cc(O)c(O)cc2s1)c1cc[nH]n1 1152231649 LHJQZJQVFGWIBP-UHFFFAOYSA-N 346.368 1.195 10 10 EDCE COc1ccc(N2CCN(CCNc3cc(N)ncn3)CC2)cc1 1318518685 GXHUAFDEMBPOHJ-UHFFFAOYSA-N 328.420 1.302 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N[C@H](C)C(=O)N(C)C 1317291117 VCWRVGRKWDWACZ-WDEREUQCSA-N 348.407 1.034 10 10 EDCE CCOc1ccc(N2CCN(C(=O)C[C@H](C)NC(N)=O)CC2)cc1 1327623747 XSDYILPXZXJPGO-ZDUSSCGKSA-N 334.420 1.181 10 10 EDCE CO[C@H](C)CC(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1284209406 SEYHUFUSABRRCI-GHMZBOCLSA-N 349.391 1.509 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc2n(n1)CCC[C@H]2O 1444695001 BYKBETUAKBTPPS-MRXNPFEDSA-N 342.399 1.816 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN(C(=O)CCCF)CC2)cc1 1522484908 GOGHBMZNJRTYKU-UHFFFAOYSA-N 349.366 1.883 10 10 EDCE CCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3COC[C@@H](O)[C@@H]3O)ccc21 1615128984 DVFAWZADSIFBAC-ZTFGCOKTSA-N 346.427 1.376 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cn3cc(C)cn3)CC2)cc1C 1483719989 SRBUZMJHDUZXJD-UHFFFAOYSA-N 342.443 1.947 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)[C@@H]2CNC(=O)N2)cc1C 1700671058 HZBSTLUAMMBGAA-HIFRSBDPSA-N 348.447 1.060 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H](C)NC(N)=O)cc1C 1480758595 IGWUZAMMQSQGNZ-STQMWFEESA-N 336.436 1.045 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cccnc2C)cc1C 1497052771 XWRYPJNXBFYZGI-INIZCTEOSA-N 343.427 1.588 10 10 EDCE O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCc1cc(O)ccc1O 1633595101 IGWMJWKLPBSDEB-ZIAGYGMSSA-N 346.383 1.279 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)C1CC1)C(=O)NCc1c(O)ccc2ccccc12 1639384434 KAXLCJXBQQZGJO-PIGZYNQJSA-N 342.395 1.437 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)CCn2cncn2)cc1C 1733962377 JXASBTBFIBJXNU-LSDHHAIUSA-N 345.447 1.668 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)c2nonc2C)cc1C 1570475893 WZFDGYPPVDKUGP-LBPRGKRZSA-N 332.404 1.993 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)Cn2ccnc2)cc1C 1734007108 RZMVTFMEISSFBQ-GJZGRUSLSA-N 330.432 1.883 10 10 EDCE NC(=O)N[C@@H](CC(=O)NCc1ccc(O)cc1O)c1cccs1 1570462310 NTKSKHBKNCMRJE-NSHDSACASA-N 335.385 1.575 10 10 EDCE CN(C)c1ccc(CNC(=O)CN(C)C2CCS(=O)CC2)cc1 1652708633 LJXKMWMYOQNYOB-UHFFFAOYSA-N 337.489 1.212 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NC[C@](C)(O)CN(C)C 153003655 AVSQMDMAFGYEQR-KRWDZBQOSA-N 330.388 1.293 10 10 EDCE CCCOc1ccc(CN2CCC[C@H](NS(C)(=O)=O)C2)c(O)c1 154118916 DXAKLRBHGYHRKI-AWEZNQCLSA-N 342.461 1.695 10 10 EDCE C[C@@H](NCc1ccc(N2CCN(C)CC2)c(F)c1)[C@H](O)C(F)(F)F 1118926289 HJBHUIZENVGPHU-ABAIWWIYSA-N 349.372 1.979 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)cc1Br 2132548987 ZGRDPWXJABXPLF-GNXNZQSNSA-N 327.222 1.351 10 10 EDCE COC[C@H]1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 221250370 BVVPXWQKSNLDDM-ISVAXAHUSA-N 340.221 1.874 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H](O)C4(CC4)C3)c(Br)cc21 2149753920 JBYUNMXEFXVKDT-VXGBXAGGSA-N 338.205 1.362 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010389392 PGDSEUPCSDKLQS-LBPRGKRZSA-N 341.412 1.907 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C 2010389238 NAOGIXCXBFOXRE-LBPRGKRZSA-N 340.428 1.696 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)NCCc1ccc(N)cc1 2022895890 VUQKTTAWDBLQBM-AWEZNQCLSA-N 337.420 1.203 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1ccc2c(c1)NC(=O)[C@H]2NC 2034782829 MWTWLSINRBDMNI-SFHVURJKSA-N 338.411 1.652 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)[C@H](CO)C2)c(Br)c1 316840757 ZYELELPVEMKUAW-SWLSCSKDSA-N 343.265 1.738 10 10 EDCE CN[C@H](C)c1ccc(N2CCOC[C@H](O)C2)cc1Br 399857162 KDALETWVIPWDEJ-ZYHUDNBSSA-N 329.238 1.927 10 10 EDCE C[C@@H](C(=O)O)N1CC(NCc2cc(Br)cc(F)c2O)C1 2188306802 BHAQCVJGBGBHRQ-ZETCQYMHSA-N 347.184 1.541 10 10 EDCE CN1CC[C@@H]2OCCN(c3ccc(CO)cc3Br)[C@@H]2C1 2185592335 LRRGIRUJRYPUKA-CABCVRRESA-N 341.249 1.851 10 10 EDCE CCn1nnc(Br)c1CNCc1ccc(O)cc1O 2100251798 ANWOLLCKOKQLHW-UHFFFAOYSA-N 327.182 1.762 10 10 EDCE OCc1ccc(N2C[C@H]3COC[C@@H](C2)C3O)c(Br)c1 2111477707 GWYGRBWXKOTKGA-BVUQATHDSA-N 328.206 1.385 10 10 EDCE OCC[C@@H]1CN(c2ccc(CO)cc2Br)C[C@H]1CO 2093501325 LBPPCUBUHFYCOU-NEPJUHHUSA-N 330.222 1.369 10 10 EDCE CCN(c1ccc(CO)c(Br)c1)[C@H]1CC(=O)NC1=O 2114729476 JYTNITSAHDDRKT-NSHDSACASA-N 327.178 1.183 10 10 EDCE NCc1ccc(N2C[C@@H]3CCO[C@]3(CO)C2)cc1Br 2231367624 BIHJBGGWQXGSNU-FZMZJTMJSA-N 327.222 1.495 10 10 EDCE COc1cc(C=C2SC(=S)NC2=O)ccc1OS(C)(=O)=O 2297349851 LJAWGISKFMWHCH-UHFFFAOYSA-N 345.423 1.522 10 10 EDCE C[C@H](N)c1ccc(N2CC3(COC(=O)N3)C2)c(Br)c1 2351871351 MGEDUBGNFDKIQG-QMMMGPOBSA-N 326.194 1.767 10 10 EDCE Cc1ccc(CN2CCN(C)C(=O)C2=O)c(O)c1Br 2352654055 ADADUUDWPLCCHT-UHFFFAOYSA-N 327.178 1.264 10 10 EDCE Cc1ccc(CNC(=O)C(N)(CF)CF)c(O)c1Br 2352943168 PIHMPYAYDBYNGM-UHFFFAOYSA-N 337.164 1.716 10 10 EDCE O=C(O)[C@H]1CO[C@@H]2CN(Cc3c(O)cccc3Br)C[C@@H]21 2354476828 KMYOZWOLVPSYND-DFAYQTQMSA-N 342.189 1.686 10 10 EDCE COC(=O)[C@H](C)CC(=O)NC1CCN(c2ccc(OC)cc2)CC1 178270766 RWHJYDBONLNHDW-CYBMUJFWSA-N 334.416 1.979 10 10 EDCE O=C(c1c[nH]nc1Br)N1CCc2cc(O)c(O)cc2C1 2366851140 SMVOVSPDTDSWDZ-UHFFFAOYSA-N 338.161 1.782 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCN(CC(F)F)CC2)c1O 278149304 CBGNOJQEQVERHW-UHFFFAOYSA-N 331.319 1.692 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@H]3CNC[C@H]32)c(O)c1Br 2380750796 XTWLXWXQRYKPED-QJPTWQEYSA-N 339.233 1.935 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](N)CC(=O)O)c(O)c1Br 2380768451 KNKPEFIEQHSHEC-VIFPVBQESA-N 345.193 1.224 10 10 EDCE O=C(NCc1csnc1Br)c1cc(O)c(O)c(O)c1 2132420075 ZADWDFOHOPMLDU-UHFFFAOYSA-N 345.174 1.952 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc(C)cc(I)c1 909553365 ROGTZXSHFQGVDV-UHFFFAOYSA-N 346.120 1.915 10 10 EDCE CCOC(=O)[C@H](CO)NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 831520582 WXINGVAPWHBRTE-KRWDZBQOSA-N 344.411 1.677 10 10 EDCE CO[C@]1(CN[C@@H]2C[C@@H](C)c3c(F)ccc(O)c32)CCS(=O)(=O)C1 903367130 XSXFKDXUOUXJEK-SIVJFFJCSA-N 343.420 1.873 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CC12CCNCC2 831171671 FJHXAAYSVAINGF-QGZVFWFLSA-N 344.459 1.465 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@H](C(N)=O)CC[C@H]2C)c([N+](=O)[O-])c1 918733977 CLPNIFUBNFGDTK-AXIGGGFBSA-N 347.371 1.871 10 10 EDCE COc1ccc(N2CC[C@@H](Nc3ncccc3S(N)(=O)=O)C2)cc1 853759602 XUZWQDLAKQXRDN-GFCCVEGCSA-N 348.428 1.428 10 10 EDCE CC(C)[C@H](NC(=O)c1ccccn1)C(=O)NCc1ccccc1O 769363596 VZKMDTLTWDHDRE-INIZCTEOSA-N 327.384 1.858 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC[C@@H](O)COC(C)C)cc2)CC1 1120511944 XKVDRGVQJZLHPP-LJQANCHMSA-N 349.475 1.231 10 10 EDCE COc1cccc(CNCCn2cc(Br)nn2)c1O 1878207959 QHZHLTDQZFKYOG-UHFFFAOYSA-N 327.182 1.545 10 10 EDCE CN1CCN(CCCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1135673134 XLMRRPJZTOSRNM-UHFFFAOYSA-N 332.408 1.216 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H](c1ccccc1)c1nn[nH]n1 1149501748 WFDZCVNPULAPTR-GQSKFBFOSA-N 337.339 1.530 10 10 EDCE CC1(C)CN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@@H]2COC[C@H]2O1 1144297264 AHYIMROJKSGMQN-CHWSQXEVSA-N 332.360 1.867 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@H]3C[C@H]3C(=O)OC)CC2)cc1 1151502984 GQQQHKNIXLYDCO-JKSUJKDBSA-N 332.400 1.543 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)C[C@H]2CCNC2=O)cc1C 1319471819 FRRNWQHRAJGAFW-GOEBONIOSA-N 347.459 1.466 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)C[C@@H]2CCC(=O)N2)cc1C 1331584322 KPGAVRODSFTDNZ-HOCLYGCPSA-N 347.459 1.609 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cn2nccc2C)cc1C 1268599582 QOLRPNWHTGRSAM-PLNGDYQASA-N 342.443 1.971 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CNCc2cccc(O)c2O)C1 1251463447 ZHWRFJSWGOSIGO-QGZVFWFLSA-N 338.404 1.559 10 10 EDCE C[C@H](CC(=O)Nc1c(-c2ccccn2)nc2ccccn12)NC(N)=O 1450715734 OYRHYMKEFXZDMM-LLVKDONJSA-N 338.371 1.782 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@@]2(CCS(=O)(=O)C2)C1 1468116485 MUQHRYWLTCXBLQ-MRXNPFEDSA-N 339.413 1.068 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(Cc2cccnc2)CC1 1463952236 YMHSXUSIYISQRT-UHFFFAOYSA-N 327.384 1.380 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2CCCC(=O)N2)cc1C 1700755260 JDGNSSNCXCWYTM-GDBMZVCRSA-N 347.459 1.609 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3NC(=O)O[C@@H]3C2)c(Br)c1 2120405832 NVYPCSUYCIWANM-NYRNMGCKSA-N 326.194 1.766 10 10 EDCE CS[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)C[C@@H]1N1CCCC1 1556103732 BGRKHFZWWMJUIF-BBRMVZONSA-N 336.457 1.679 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@H]1CCCO1 1721932403 CSEDZJSSHADTPP-GXFFZTMASA-N 347.375 1.263 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCc1nc(-c2ccccn2)n[nH]1 1636655987 AQIVQNVHDITJEE-ALCCZGGFSA-N 337.339 1.608 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2nnc(S)n2c1 1632681084 MRQOWEGZRXLDDD-VIFPVBQESA-N 344.396 1.790 10 10 EDCE CCS(=O)(=O)CCCNC(=O)NCc1cccc(OC)c1O 1564922178 AMBWARMTRCNSGQ-UHFFFAOYSA-N 330.406 1.025 10 10 EDCE O=C(Cc1csc(N2CCOCC2)n1)NCc1cc(O)ccc1O 1644753511 BJJAGNCYWPLSTB-UHFFFAOYSA-N 349.412 1.250 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CCN(c2ccc(F)cc2)C1=O 1593873751 ZJRRZVTUJLYDMC-HNNXBMFYSA-N 344.342 1.906 10 10 EDCE O=C(NCc1cccc(Cl)c1O)N[C@H]1CCc2nnnn2CC1 1686830217 JXXQYYLGBFYVJE-JTQLQIEISA-N 336.783 1.236 10 10 EDCE CN(C)C[C@@H]1COCCN1Cc1cc(Br)ccc1O 1203649819 HPYZVUGMFGYKQS-CYBMUJFWSA-N 329.238 1.917 10 10 EDCE O=C(O)[C@H]1C[C@H](O)CCN1Cc1ccc(Br)cc1O 2136391262 WXTAPYLCVTWPNN-GHMZBOCLSA-N 330.178 1.565 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1COC[C@@H]1N(C)C(=O)OC(C)(C)C 1985101776 XLKXTCBGLQJTCS-QWRGUYRKSA-N 327.385 1.637 10 10 EDCE CCOC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985101135 OENUOTZRKSLSFD-WDEREUQCSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)COc2ccc(N)cc2)C1 1999489902 LALGCOWCUAISHC-ZDUSSCGKSA-N 335.404 1.773 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CO1 2010393905 YYFDKPHZVYZZTD-TUAOUCFPSA-N 339.396 1.922 10 10 EDCE O=C1NC[C@]2(CCN(Cc3cc(Br)cc(F)c3O)C2)N1 2177681495 XSTJGXSBYGVLMY-ZDUSSCGKSA-N 344.184 1.551 10 10 EDCE CN(C(=O)CN1CC[C@H]1CNC(=O)OC(C)(C)C)c1ccc(N)cc1 2044656516 XXKIQQYMUHPRQS-HNNXBMFYSA-N 348.447 1.831 10 10 EDCE CC(C)(C)OC(=O)N1CC=C[C@@H](NC(=O)COc2ccc(N)cc2)C1 2046539085 OWTCRBOXHIVDCT-CQSZACIVSA-N 347.415 1.939 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)C[C@H]2CO)cc1Br 2089864589 VKONHADHOSVJKS-SCVCMEIPSA-N 330.222 1.682 10 10 EDCE CC[C@@H](N[C@@H]1CC(=O)NC1=O)c1cc(Br)ccc1O 2096090290 XGBQLMLTFYDUHP-NXEZZACHSA-N 327.178 1.611 10 10 EDCE CN1C(=O)C(=Cc2ccc(N3CCCC3)c(F)c2)C(=O)NC1=S 2293724492 JWAYCOXURSFSIZ-UHFFFAOYSA-N 333.388 1.682 10 10 EDCE Cc1ccccc1N1C(=O)C(=CNN2CCCCC2)C(=O)NC1=S 2296132728 GRIYSBQJJCIHRE-UHFFFAOYSA-N 344.440 1.617 10 10 EDCE CC[C@@H]1CN(C(=O)C=Cc2ccc(O)c(O)c2)CCN1C[C@@H](C)O 2308001666 DKMFXTAGDICOQI-UKRRQHHQSA-N 334.416 1.415 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2OCC[C@H]2N)c(O)c1Br 2352629899 ZGRSQOUBJNXTSC-BXKDBHETSA-N 329.194 1.196 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N[C@@H]2CCc3ncnn3C2)cc1 171868678 KXRZXEKOWBKONR-OAHLLOKOSA-N 342.447 1.939 10 10 EDCE Cc1ccc(C(=O)N2CCC(N3CCO[C@@H](C)C3)CC2)c(O)c1O 177676605 SWUQIQMYHUWLFD-ZDUSSCGKSA-N 334.416 1.732 10 10 EDCE Cc1ccc(/C=C2\C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)o1 20207840 GGCKEJIZUYJWPG-XJZVJHQVSA-N 338.370 1.209 10 10 EDCE NC(=O)NCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 174596845 DUNRSSRGEBCFQB-JTQLQIEISA-N 342.346 1.041 10 10 EDCE CNCc1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2357595939 ZKFWKZDXCATQAE-UVCAVOOOSA-N 341.249 1.489 10 10 EDCE COC(=O)CC[C@H](O)CNCc1ccc(C)c(Br)c1O 2380741722 KFEBJOXAFJSCAC-NSHDSACASA-N 346.221 1.867 10 10 EDCE Cc1ccc(CN(C)[C@@]2(C(=O)O)CCNC2)c(O)c1Br 2380764985 JAEYSGCXAFGVGV-AWEZNQCLSA-N 343.221 1.712 10 10 EDCE CS(=O)(=O)NC[C@@H]1CCC[C@H]1NCc1c(O)cccc1Cl 800308824 BBJDXOGGXOMSBP-GXFFZTMASA-N 332.853 1.853 10 10 EDCE COc1ccc(O)c(CN2CCC(N3[C@H]4CC[C@H]3CNC4)CC2)c1 903978393 NZSIPGKBUHQJNF-IRXDYDNUSA-N 331.460 1.801 10 10 EDCE Nc1c(C(=O)NCc2ccc(N3CCOCC3)cc2)cnn1C1CC1 906384485 IVLIGCBHZZHOEI-UHFFFAOYSA-N 341.415 1.567 10 10 EDCE CC(C)C[C@@H](C(N)=O)C(=O)NCc1cc(Br)ccc1O 839761722 KCMOMNFBWAQRHA-NSHDSACASA-N 343.221 1.919 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC(=O)Cc1ccc(N)cc1)C2 831754322 ZGFKFTZQNHCUPP-LZWOXQAQSA-N 331.416 1.794 10 10 EDCE Cn1cnc(CCNC(=O)NCCCSc2nccs2)c1 838514355 QDNUSDWVWCKBOC-UHFFFAOYSA-N 325.463 1.901 10 10 EDCE Cc1cc(N(C)C)ccc1CN1C(=O)N[C@H](c2ccnn2C)C1=O 843307516 IEXZJGFOELMQHU-OAHLLOKOSA-N 327.388 1.588 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H]2CCC[C@H](C1)N2 844226003 YOMDWFJDWUFHNK-CALCHBBNSA-N 330.476 1.537 10 10 EDCE CN(C1CC1)S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 751121524 XCNLQBVBTQAJFY-OAHLLOKOSA-N 340.445 1.712 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCC[C@@H](C(N)=O)C3)C2)cc1 855228034 UIYMIWQXJBMCNJ-KFWWJZLASA-N 345.443 1.682 10 10 EDCE O=C(NCc1c(O)cccc1F)NC[C@@H]1COC2(CCOCC2)O1 921826517 SMXYFNQFLUHGBL-LLVKDONJSA-N 340.351 1.253 10 10 EDCE COc1cc(N2CCC3=C(CCC(=O)N3)C2)c([N+](=O)[O-])cc1OC 853747026 WXVBKYKUVVWKFP-UHFFFAOYSA-N 333.344 1.986 10 10 EDCE Cn1c(O)ncc(C(=O)NCc2ccc(N3CCCCC3)cc2)c1=O 751567996 XGVPCHOKACODFE-UHFFFAOYSA-N 342.399 1.406 10 10 EDCE COc1cccc(O)c1CNCCS(=O)(=O)CC(F)(F)F 850363849 KUSAGRLFZGSGCS-UHFFFAOYSA-N 327.324 1.468 10 10 EDCE CC[C@@H](NC1CN(S(=O)(=O)N(C)C)C1)c1cccc(Cl)c1O 858571934 MRTXJTGMSLMNQZ-CYBMUJFWSA-N 347.868 1.577 10 10 EDCE NC1(CNC(=O)NCCCSc2nccs2)CCOCC1 861610283 ZXVDTRJWGAGOOJ-UHFFFAOYSA-N 330.479 1.432 10 10 EDCE O=C(Cc1cncnc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 788286913 DGZHOPVZDODKLI-UHFFFAOYSA-N 344.390 1.436 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1ccc(C(N)=O)o1 1138153162 ZFXCAHUFQZNNIP-LJJSCBMDSA-N 330.340 1.550 10 10 EDCE CN1CC[C@@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)CC1=O 898009477 QPUMVHFJKGVBQQ-SECBINFHSA-N 334.397 1.911 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2CCNC2=O)cc1C 1317403155 RRGZDPZSZDJBRD-ZFWWWQNUSA-N 333.432 1.124 10 10 EDCE Oc1ncc(NCc2ccc(N3CCC(O)CC3)c(F)c2)c(O)n1 1317881257 XKJAGRQKAVISOE-UHFFFAOYSA-N 334.351 1.600 10 10 EDCE CN1CCN(c2ccc(CN)c(Br)c2F)C[C@H]1CO 687597708 JZJIHTUFWGESLN-JTQLQIEISA-N 332.217 1.160 10 10 EDCE C[C@]1(CO)C[C@@H](O)CN1c1cc(Br)c(CN)cc1F 698199619 GVDJKVVFSCOOIO-NOZJJQNGSA-N 333.201 1.369 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@]2(CCCOC2)C1 1330151452 HFYGXSNCVQRXMS-GOSISDBHSA-N 332.400 1.380 10 10 EDCE O=S1(=O)CC[C@H]2CN(Cc3ccc(Br)cc3O)C[C@H]21 898081692 ORDFFAFRYXRJEL-GXFFZTMASA-N 346.246 1.774 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H](C)NC(C)=O)cc1C 1268048907 HPAOXWLWYYGTOP-KGLIPLIRSA-N 335.448 1.465 10 10 EDCE CC[C@H](CNC(=O)c1ccco1)NC(=O)c1cc(OC)nc(OC)c1 1285025806 SFDFWZCDTLNROL-GFCCVEGCSA-N 347.371 1.630 10 10 EDCE CC(C)CCNC[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1284477065 MIJZFSZJNCUQSA-OAHLLOKOSA-N 349.435 1.918 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H](CNC(=O)C2CC2)C2CC2)cc1 1524301080 IMBKJULJSXNEKX-CQSZACIVSA-N 343.387 1.884 10 10 EDCE Cn1cc(C[C@H](CO)NC(=O)c2cc3cc(O)c(O)cc3s2)cn1 1299615574 XTTIKINFHZNBIS-LLVKDONJSA-N 347.396 1.379 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(C(N)=O)c[nH]1 1539467479 CDLZAYOTQLYVDE-UHFFFAOYSA-N 326.400 1.986 10 10 EDCE C[C@@H](F)CCN[C@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1700808288 OLHWNVROEJJKDW-MFKMUULPSA-N 339.371 1.277 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@@H](C)SC)cc1C 1717911331 JGTBNCHAIGWONL-HIFRSBDPSA-N 340.489 1.664 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cccnc1OCCO 1627072839 FNIXTKUOXMVNJC-UHFFFAOYSA-N 339.351 1.637 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CCN(C)C2=O)cc1C 1483258484 RPAGDUQZRHNYLY-ZFWWWQNUSA-N 333.432 1.076 10 10 EDCE Cn1cnnc1[C@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1556068670 NOFWNQDFXNPHOI-GFCCVEGCSA-N 327.348 1.955 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 1624955462 ZZCCTRLJAIULHP-MGPLVRAMSA-N 346.339 1.787 10 10 EDCE COc1ccc(CN[C@@]2(CO)CCCN(C(=O)C3CC3)C2)cc1C 1724902483 XAMWORYSNXIYRD-IBGZPJMESA-N 332.444 1.857 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2csnn2)cc1C 1497644991 SCJGCBBEVKDYIJ-ARJAWSKDSA-N 332.429 1.931 10 10 EDCE CN(C(=O)Cc1ccc(O)c(O)c1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 1565975176 GAXFNDONKKVARV-DOMZBBRYSA-N 341.429 1.455 10 10 EDCE Nc1ccnn1CC(=O)Nc1c(-c2ccccn2)nc2ccccn12 1641971934 HXEMQHSTPRAKRP-UHFFFAOYSA-N 333.355 1.814 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cc(F)c[nH]2)cc1C 1734524501 ZTTISHTZNROZSW-OAHLLOKOSA-N 349.406 1.694 10 10 EDCE O=C(Nc1ccc(-c2ncco2)cc1)C1=S=c2c(cc[nH]c2=O)=C1 1654426447 GIJSTTDFMJDBTO-UHFFFAOYSA-N 337.360 1.619 10 10 EDCE O=C(O)CNC(=O)CN1C(=O)/C(=C/c2cccs2)SC1=S 15036397 MWFFUQUXEMQBBZ-YWEYNIOJSA-N 342.423 1.150 10 10 EDCE CO[C@@H](CCNC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1902029446 XTGJJBSTXRBELY-GVXVVHGQSA-N 328.409 1.182 10 10 EDCE CO[C@H]1C[C@H](C(=O)O)N(Cc2c(O)cccc2Br)C1 2136360055 OIIJXTKDLHQKSU-GZMMTYOYSA-N 330.178 1.829 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2140657774 IQBHUJYZLWGZPE-GZFGJDTESA-N 333.201 1.349 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCCCCN=[N+]=[N-])C1 1986139467 AJLQBNFNHPEDTE-CQSZACIVSA-N 327.385 1.565 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N2CCC(N=[N+]=[N-])CC2)C1 2010388867 HTFDSAQOSMLNHZ-UHFFFAOYSA-N 339.396 1.924 10 10 EDCE COC(=O)[C@H](CC(=O)NCCCCN=[N+]=[N-])NC(=O)OC(C)(C)C 2010402671 ULXGUFBPVSYGJW-JTQLQIEISA-N 343.384 1.650 10 10 EDCE CN(C(=O)CC1(O)CN(C(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2022798748 TZFWEVVBKUZJGO-UHFFFAOYSA-N 335.404 1.604 10 10 EDCE O=C(CNCc1cccc(Br)c1O)N1CCOCC1 388606836 FSTGZRWYYNAGJI-UHFFFAOYSA-N 329.194 1.103 10 10 EDCE CO[C@@H]1CN(Cc2cc(N)ccc2O)C[C@H]1NC(=O)OC(C)(C)C 1908010513 UCKYDQWGUYWETR-UKRRQHHQSA-N 337.420 1.698 10 10 EDCE C[S@](=O)CC1CN(c2ccc(CN)c(Br)c2F)C1 2047846460 FOEBMMIFOJTPTO-SFHVURJKSA-N 335.242 1.862 10 10 EDCE COC12CC(C1)N(c1cc3c(cc1Br)[C@@H](O)C(=O)N3)C2 2185462641 YTTONRIKXLMTCG-BWQPLIALSA-N 339.189 1.802 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213582294 GKJQBRQODIZHEN-WOPDTQHZSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)NCCc1n[nH]cc1C(=O)N1CC(N=[N+]=[N-])C1 2214417755 BBNVKJKKYIXBKD-UHFFFAOYSA-N 335.368 1.612 10 10 EDCE COc1ccc(Br)c(CN(C)[C@H]2CC(=O)N(C)C2)c1O 2236090758 NPNOYCVUTLOPPX-VIFPVBQESA-N 343.221 1.826 10 10 EDCE CC(C)(C)OC(=O)N1CC(N2CC([C@@H](N)c3ccccc3O)C2)C1 2248588662 GPBXKMXVEDLWKO-MRXNPFEDSA-N 333.432 1.943 10 10 EDCE CCOC(=O)CN(C(=O)/C=C\c1cnccn1)c1ccc(F)cn1 491927886 VVBGXYPQRNMBPM-XQRVVYSFSA-N 330.319 1.620 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N(C)c2ccc3c(c2)OCO3)c1 492283428 LICJVOOWNNVELR-ZZXKWVIFSA-N 339.351 1.846 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCC[C@@H](Cn2cncn2)C1 2308001493 NBSLKHBQESKUOU-CQSZACIVSA-N 328.372 1.641 10 10 EDCE CS(=O)(=O)[C@@H]1CC[C@@H]1NCc1cc(Br)ccc1O 2319818591 UUCULYAEGXMGIL-CMPLNLGQSA-N 334.235 1.820 10 10 EDCE OCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2332590012 GCMYFCKATAJJFG-DSMZTOPNSA-N 328.206 1.262 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)C[C@H]1N1CCOCC1 177233989 QRAAWZHQQJBPGZ-MAUKXSAKSA-N 346.475 1.615 10 10 EDCE COc1cccc(CN2CCCN(Cc3cnn(C)c3)CC2)c1O 121582831 VEQIZMBSGCRLLO-UHFFFAOYSA-N 330.432 1.842 10 10 EDCE COc1ccc(CN2CCN([C@@H](C)C(=O)N3CCCC3)CC2)c(O)c1 93843628 IZLDGMHJQQBASA-HNNXBMFYSA-N 347.459 1.529 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC[C@@H](C)[C@@H]3CO)CC2)cc1 248982502 VRBDATSSQUBERK-QAPCUYQASA-N 347.459 1.047 10 10 EDCE CNC(=O)[C@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(C)C 255672446 CIJYKEAVZUQRFE-OTIVFRFGSA-N 345.443 1.423 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)NCC[C@H]1CCOC1 806279468 PGZIFFGZOYONNB-NSHDSACASA-N 343.474 1.284 10 10 EDCE COc1ccc(N2CCN(CCNC3C[C@@H]4CC[C@H](C3)N4)CC2)cc1 817892435 AASKKDVNYMJPAA-JWTNVVGKSA-N 344.503 1.690 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1CCOC[C@@H]1C 819698827 TYAFJZPKJQRYCX-DZGCQCFKSA-N 335.400 1.957 10 10 EDCE COC1CCN(c2ccc(CN3CCO[C@@H]([C@H](C)O)C3)cc2)CC1 839670535 HFEDAHMHIQIIGJ-HNAYVOBHSA-N 334.460 1.883 10 10 EDCE CCN(C)c1ccc(CN2CCN([C@H]3CCNC(=O)CC3)CC2)cc1 832369069 HLWIVTWAQREXSF-LJQANCHMSA-N 344.503 1.929 10 10 EDCE COCCCOC1CN(Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 839133825 CJQBIIGPDYWLKU-UHFFFAOYSA-N 326.349 1.546 10 10 EDCE C[C@@H]1CN(Cc2cc(O)n3ncc(C(=O)O)c3n2)C2(CCC2)CO1 846291690 SYBHWICNNUYZNN-SNVBAGLBSA-N 332.360 1.277 10 10 EDCE C[C@@H](NC(=O)[C@H]1CSC(=O)N1)c1ccc(N2CCOCC2)cc1 746168360 OMPRBXPMTQBXCN-BXUZGUMPSA-N 335.429 1.525 10 10 EDCE CO[C@@H](CS(=O)(=O)Nc1ccc(O)cc1F)C1CCOCC1 842587756 HRUJMEQXRMVKAQ-AWEZNQCLSA-N 333.381 1.715 10 10 EDCE C[C@H]1CN(C(=N)NCc2ccc(N3CCSCC3)cc2)CCO1 849095846 PRCZNEWBWMHQIQ-AWEZNQCLSA-N 334.489 1.985 10 10 EDCE C[C@H]1CN(CCO)[C@H](C)CN1C(=O)NCc1ccc(N(C)C)cc1 841715870 FHMCWYNUEGTCAM-CABCVRRESA-N 334.464 1.349 10 10 EDCE O=S(=O)(C[C@@H]1CCCOC1)NNc1nc2cccnc2s1 857224973 BWVFHCQRXJKKBY-SECBINFHSA-N 328.419 1.364 10 10 EDCE Nc1ccc(CCNC(=O)c2cn([C@@H]3CCCNCC3)nn2)cc1 852795809 LJGWHPLCPMWLII-OAHLLOKOSA-N 328.420 1.147 10 10 EDCE CC[C@H](O)CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 857494516 QGQJXLDGJHTOCK-KRWDZBQOSA-N 333.432 1.132 10 10 EDCE Cc1ccc(O)c(CNC(=O)C(=O)Nc2cncc(OC(C)C)n2)c1 862025256 QITDGDKBUAISAU-UHFFFAOYSA-N 344.371 1.533 10 10 EDCE Cc1cc(C(=O)NCc2cc(O)ccc2O)ccc1N1CCNC1=O 1153879770 XVCMEGRKTJPXIA-UHFFFAOYSA-N 341.367 1.866 10 10 EDCE C[C@@H](NC(=O)CCn1cnc2c(N)ncnc21)c1ccccc1O 1302532564 JEGGTHPURWZOLZ-SNVBAGLBSA-N 326.360 1.382 10 10 EDCE O=C(Nc1nc(C2=S=CC=C2)n[nH]1)c1cccc2nsnc12 1182338357 DXPGITLHFDNFBM-UHFFFAOYSA-N 328.382 1.687 10 10 EDCE COC1=C(C(=O)O)NC(=O)N[C@H]1c1cc(Br)ccc1O 76257113 KSMDTVUCBUYRBL-QMMMGPOBSA-N 343.133 1.451 10 10 EDCE C[C@@H](O)CNC1(C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1328051532 VOPZMDPLTXZZPG-GFCCVEGCSA-N 347.419 1.814 10 10 EDCE C[C@H](NC(=O)C(=O)N1CC[C@H]2COC[C@H]2C1)c1ccc(N(C)C)cc1 1330968550 KQIDSERADVLVPP-CWRNSKLLSA-N 345.443 1.425 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2nocc2C)cc1C 1272289373 DRHZHVQBWAXOII-UHFFFAOYSA-N 347.415 1.524 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H]2CCC2(F)F)cc1C 1507199463 CGTFAGFFRIMGEY-KBPBESRZSA-N 342.386 1.616 10 10 EDCE C[C@@H]1C[C@H]1C(=O)NC/C=C/CNC(=O)c1ccc(N=NC(N)=O)cc1 1533354802 PACUKZYJJURHFK-DVYSOBJBSA-N 343.387 1.907 10 10 EDCE COC(=O)COc1cccc(C(=O)NCc2cc(O)ccc2O)c1 1471661556 SKXJOWBLWVVNLO-UHFFFAOYSA-N 331.324 1.580 10 10 EDCE Cn1c(CNC(=O)c2cccc(O)c2O)cc(=O)n1-c1ccccc1 1471978943 KULAZDVGPBMEQU-UHFFFAOYSA-N 339.351 1.517 10 10 EDCE CC[C@@H](F)CNC[C@@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1715613684 ODOSTWCJAXLUEI-DGCLKSJQSA-N 339.371 1.277 10 10 EDCE Cn1ncc(Br)c1CNC(=O)c1c(F)ccc(O)c1O 1559024016 RGZRKWLULDJYEU-UHFFFAOYSA-N 344.140 1.663 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCCC[C@H]2CS(N)(=O)=O)c1O 1620501576 IQAVYUVCJIYTNP-ZDUSSCGKSA-N 344.408 1.377 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@]2(CCOC2)O1 1634917495 LKGGIUMIRMGDRL-MEDUHNTESA-N 332.360 1.869 10 10 EDCE C[C@H](CCS(C)(=O)=O)NC(=O)c1ccc(N=NC(N)=O)cc1 1636147624 YBUSANFSLBQNJW-SECBINFHSA-N 326.378 1.402 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cc(C(N)=O)c[nH]2)cc1C 1493744911 UAOCSBJZZCAVMZ-UHFFFAOYSA-N 344.415 1.292 10 10 EDCE 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343.431 1.335 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3COCC3(C)C)nc12 832170803 VGASBZNZGYTDEM-GFCCVEGCSA-N 334.376 1.126 10 10 EDCE COC[C@H]1CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 849416399 QSZANZPCXKVIHA-LSDHHAIUSA-N 333.432 1.952 10 10 EDCE COC(=O)CCN1CCC[C@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1=O 849319857 HEURQKSDYYFPMZ-YOEHRIQHSA-N 347.459 1.957 10 10 EDCE COc1ccc(N2CCN(C[C@H]3CN(C4CC4)C(=O)O3)CC2)cc1F 844304396 COGWLOFETMRUDI-HNNXBMFYSA-N 349.406 1.940 10 10 EDCE O=S1(=O)CC[C@@]2(CN(Cc3ccc4ccccc4c3O)CCO2)C1 843425767 IJWLRWBOJJOAAD-GOSISDBHSA-N 347.436 1.935 10 10 EDCE C[C@H]1CCNC[C@@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 841731173 ZVPBKWUXMIGSFN-YOEHRIQHSA-N 332.448 1.320 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cn(C[C@@H]2CCOC2)nn1 858199760 QPNHUFODQLOEMS-HNNXBMFYSA-N 343.431 1.653 10 10 EDCE CO[C@]1(CO)CCCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 852411039 HIQWWNDDOBFOSG-LJQANCHMSA-N 349.475 1.184 10 10 EDCE NC(=O)C[C@H]1CN(Cc2c(O)cccc2Br)CCO1 862534387 AOIQYIWKNYAVKO-VIFPVBQESA-N 329.194 1.231 10 10 EDCE COC(=O)C1=CC[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1 863522596 WASVFPKRKVWZQN-ZDUSSCGKSA-N 330.340 1.418 10 10 EDCE COc1cccc(CNC(=O)[C@H](C)Oc2cccc(CO)c2)c1O 764100604 JOCVFCHYILWFQK-LBPRGKRZSA-N 331.368 1.977 10 10 EDCE CCOc1ccc(O)c(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c1 872255557 ZBBLCFIWLVXUPS-UNEWFSDZSA-N 347.415 1.158 10 10 EDCE CC(=O)c1cc(F)cc(CNC(CO)(CO)C(F)(F)F)c1O 878978015 FUABNSAQCIVYNA-UHFFFAOYSA-N 325.258 1.109 10 10 EDCE Cc1[nH]nc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c1C 881850694 CJZQKMOFGZHYAI-UHFFFAOYSA-N 327.432 1.708 10 10 EDCE C[C@H](O)[C@@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 895015681 HSSHKJRXWZSLNS-UFBFGSQYSA-N 334.185 1.875 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\[C@H]1CCOC1 1138055452 YQWNWXQWPUKNGA-QMDMKJMKSA-N 349.383 1.281 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1CNC(=O)NCc1cccc(Cl)c1O 896211382 RZSQAAHKAIOBQT-ZWNOBZJWSA-N 342.779 1.423 10 10 EDCE OC[C@]1(CNCc2cc(Br)cc(F)c2O)CCCO1 1879593291 YWHBQRSYOLNVSK-CYBMUJFWSA-N 334.185 1.925 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)[C@@H]1CCc2nnnn2CC1 1179032895 QSZZKSNGOCCTFJ-CYBMUJFWSA-N 337.383 1.801 10 10 EDCE CNC(=O)C1(C(=O)N[C@H]2C[C@H](NCc3ccc(OC)c(C)c3)C2)CC1 1266626319 FQGMVQRZBUOYCZ-SHTZXODSSA-N 345.443 1.267 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cnnc(O)c2)cc1C 1270428260 XOFSCMZTNAUWOI-LBPRGKRZSA-N 344.415 1.655 10 10 EDCE CN(C)C(=O)c1c[nH]nc1NC(=O)c1cc2cc(O)c(O)cc2s1 1455607540 SSHHFSGQOKBLJP-UHFFFAOYSA-N 346.368 1.990 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@]2(C)CCNC2=O)cc1C 1715948530 HNZFFONMOJWSPM-FZKQIMNGSA-N 333.432 1.124 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cncc(F)c2)cc1C 1482722141 NXQYQGLMPGPNIM-INIZCTEOSA-N 347.390 1.418 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@]2(C)CCNC2=O)cc1C 1725509487 XOUMAWIYZUXUEK-AUUYWEPGSA-N 347.459 1.466 10 10 EDCE CNC(=O)COc1cccc(CNC(=O)c2c(F)ccc(O)c2O)c1 1638668561 FXZSTTFVVVZBDN-UHFFFAOYSA-N 348.330 1.292 10 10 EDCE CCOC(=O)N1CSC[C@@H]1C(=O)NCc1c(O)cccc1O 1639292952 WYIWGJPGRHOZLY-SNVBAGLBSA-N 326.374 1.245 10 10 EDCE CCn1nnc(CN(C)c2ccc(CO)c(Br)c2)n1 1893002304 CQEBFWTWCCONTK-UHFFFAOYSA-N 326.198 1.584 10 10 EDCE CCO[C@@H](C)C(=O)NC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1737982412 ZRPCUXWQQBDPNK-JTQLQIEISA-N 347.375 1.215 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@@H](CNC(=O)C3(C)CC3)C2)cc(OC)n1 1736070518 OZSGKTSFSCNLDT-BJHJDKERSA-N 347.415 1.524 10 10 EDCE C[C@H](NC(=O)CCn1cnc2c(N)ncnc21)c1ccccc1O 1642830801 JEGGTHPURWZOLZ-JTQLQIEISA-N 326.360 1.382 10 10 EDCE CC[C@H](F)C(=O)NC[C@@H](CC)NC(=O)c1cc(OC)nc(OC)c1 1582525927 PUFWEIFZZKMQQH-NEPJUHHUSA-N 341.383 1.472 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)Cn2ccnc2)cc1C 1676488334 PBCSMLJMPQGNNO-HNNXBMFYSA-N 330.432 1.837 10 10 EDCE CCn1cc(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)nn1 1774042905 RWSOUQVYIRBVQI-ZDUSSCGKSA-N 331.420 1.523 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2[C@H](C(=O)NCc3ccccc3O)[C@H]21 1964890117 PYMSMIBMLRWBOY-RBSFLKMASA-N 348.399 1.643 10 10 EDCE Cc1cc(C(=O)N[C@H]2CCC(=O)NC2=O)c(C)n1-c1ccccn1 152138186 QOLSPDUKNUVHKI-ZDUSSCGKSA-N 326.356 1.024 10 10 EDCE NC(=O)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)C1 155400693 DPESZSSSTBOTPD-CVEARBPZSA-N 342.443 1.906 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)CNCC(C)C)CC2)cc1 1118283765 GCXSZYZFTNXFJM-UHFFFAOYSA-N 348.491 1.179 10 10 EDCE COCCNCc1ccc(N2CCN(C)CC2)cc1Br 234683835 GDCWZITYIVUGBP-UHFFFAOYSA-N 342.281 1.937 10 10 EDCE CC(C)(C)OC(=O)N1CC(F)(CNC(=O)c2ccc(O)c(O)c2)C1 2006282523 AVVVTIATMQHJGK-UHFFFAOYSA-N 340.351 1.787 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C)[C@H](CO)C2)c(Br)c1 687618228 HBTOMSITVWVGRR-PWSUYJOCSA-N 328.254 1.582 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@H]3C[C@@H]4O)c(Br)cc2[C@@H]1O 2172055972 NRSHVVOTOGGDEG-GETAHOEMSA-N 339.189 1.394 10 10 EDCE CNCc1ccc(N2CC[C@@H](C(=O)NC)C2)c(Br)c1 398505623 JVKPWETXOTZIKD-LLVKDONJSA-N 326.238 1.741 10 10 EDCE C[C@@H](NCc1cc(Br)ccc1O)[C@H]1CN(C)CCN1C 2065093761 UJFKPSOHSJSAJB-BXUZGUMPSA-N 342.281 1.879 10 10 EDCE CN1C[C@H]2C[C@H]1CN2c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2187595132 YRVRMHFOVODCJC-HHURGBBESA-N 337.221 1.294 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](CO)C[C@@H]2CO)cc1Br 2089863699 MKNWCVXJVTXWFA-CKYFFXLPSA-N 329.238 1.648 10 10 EDCE CNC(=O)[C@H]1[C@H](C)CCN1c1ccc(CN)cc1Br 2090258549 JHEHOXASOBIPBV-NOZJJQNGSA-N 326.238 1.869 10 10 EDCE CNCc1ccc(N2CC(OC(=O)NC)C2)cc1Br 2090749417 YKMIQWTVPJBZOO-UHFFFAOYSA-N 328.210 1.713 10 10 EDCE CN[C@H](c1ccccc1O)[C@H](O)c1nn(C)nc1Br 2111421691 BOFSXPPHWGMTBW-KOLCDFICSA-N 327.182 1.277 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213583569 TZWKPMIUBKWDBF-JRPNMDOOSA-N 339.396 1.706 10 10 EDCE CC[C@H](C)N1C(=O)C(=CNc2ccc(C(=O)O)cc2)C(=O)NC1=S 2296103136 QUAQHVLEEDCGSB-VIFPVBQESA-N 347.396 1.722 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)/C=C/c2cnccn2)c2ccccc2O1 491118199 KQMDYCGDGGQXMS-LFAOLKIESA-N 325.324 1.457 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)CNC(=O)c1cccc(O)c1O 2301662019 LROTYXYAQXCMCO-JTQLQIEISA-N 340.376 1.367 10 10 EDCE C[C@@H]1NCCC[C@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2312036080 PZZPXJPLXZVXFN-MAUKXSAKSA-N 329.444 1.793 10 10 EDCE Cc1ccc(CN2C[C@H](O)[C@@H]3COC[C@H]32)c(O)c1Br 2352691867 XCFZEPHZBWAITI-UTUOFQBUSA-N 328.206 1.655 10 10 EDCE CN(C)c1ccc([C@H]2CC(c3c(O)[nH]c(=S)n(C)c3=O)=NN2)cc1 101763381 STEXCXYLCSPPKW-LLVKDONJSA-N 345.428 1.653 10 10 EDCE COc1ccc(N2CCC(NC(=O)CCCNC(C)=O)CC2)cc1 171018285 RNMXCLWMMWDQSY-UHFFFAOYSA-N 333.432 1.697 10 10 EDCE CC(=O)N1CSC[C@@H]1C(=O)NCc1c(O)ccc2c1CCCC2 174513103 XIHPZNGKBKVOEI-OAHLLOKOSA-N 334.441 1.809 10 10 EDCE COC(=O)COc1ccc(N(C)Cc2nnc(C3CC3)n2C)cc1 183796616 ZSIKLNVOMZCFRR-UHFFFAOYSA-N 330.388 1.881 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H]4[C@H](O)C[C@H]4C3)c(Br)cc21 2358436171 MWWIPUFKYWVNDV-HZAVFWJMSA-N 338.205 1.218 10 10 EDCE C[C@H](NCCNS(=O)(=O)c1cccnc1)c1cc(F)ccc1O 186142323 RNOREALRRSNECQ-NSHDSACASA-N 339.392 1.555 10 10 EDCE CO[C@H]1O[C@H](CN=[N+]=[N-])[C@@H](OC(C)=O)[C@@H]2OC(c3ccccc3)=N[C@H]12 32107285 NJVOXEWPELYVSX-SGPHBRAGSA-N 346.343 1.814 10 10 EDCE CN1C[C@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)CCC1=O 127343641 DBUDZBMEMCBBKV-OAHLLOKOSA-N 328.416 1.483 10 10 EDCE CS(=O)(=O)[C@@H]1CSCCN1C(=O)CCc1ccc(N)cc1 90921558 ZFDMIQOFWHIAOV-CQSZACIVSA-N 328.459 1.148 10 10 EDCE COc1cccc(CN2CCCN(S(=O)(=O)C3CC3)CC2)c1O 376689287 MFCGMUSSLXCAGM-UHFFFAOYSA-N 340.445 1.401 10 10 EDCE COC(=O)[C@@]12CCOC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1)C2 370626612 KIJMPFXPKDMGHR-NKDUUGKJSA-N 347.367 1.149 10 10 EDCE CCO[C@@H]1C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]1n1cccn1 819397464 KEIRMNIIRBOCQU-URFDHNGKSA-N 343.383 1.842 10 10 EDCE Cc1cc(CC(=O)N2CCNC(=O)[C@@H]2C)c(C)n1-c1ccccc1 825591707 XTGOENHFAWAAMS-HNNXBMFYSA-N 325.412 1.984 10 10 EDCE COc1ccc(N(C)CCN(C)c2nc(N)c3cnn(C)c3n2)cc1 845671462 BIQBXBXCIDPXJB-UHFFFAOYSA-N 341.419 1.527 10 10 EDCE O=C(O)CN(Cc1ccccc1O)C(=O)Cn1ccc(C(F)F)n1 911490358 YURGNEHJYZJLIF-UHFFFAOYSA-N 339.298 1.640 10 10 EDCE CC(C)OC[C@H](CO)N(C)c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 844216186 CAHUQRZPMGJWGB-IYNGYCSASA-N 338.360 1.915 10 10 EDCE CC[C@@H](C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)O 842230816 AGXDXLULYXCMHF-CRAIPNDOSA-N 349.475 1.340 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)/C=C\C3CC3)cc2)C1 742566612 OEYPRSPIOWZILZ-BSDKJSHOSA-N 327.428 1.971 10 10 EDCE CCOC(=O)N1CC[C@H](NC(=O)NCc2c(O)cccc2F)C1 922028947 KZSKJXFTBLVFDA-JTQLQIEISA-N 325.340 1.561 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)c3nc[nH]n3)C2)cc1 854299843 SFMICEFTNXLCLC-RYUDHWBXSA-N 330.392 1.452 10 10 EDCE COC(=O)N(C)CCCC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855228509 BJOVUFQVMBOSDP-AWEZNQCLSA-N 349.431 1.869 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCC2(C3(O)CCOCC3)CC2)c1 925664311 CWQWIKRFHAFSGZ-UHFFFAOYSA-N 334.416 1.822 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)N[C@@H](C)c2cscn2)cc1 853011537 XMEWCTYSDXRKIK-NSHDSACASA-N 349.412 1.920 10 10 EDCE CCc1nnc(CNC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)o1 854296457 DJPNJRQGCQYRJU-GFCCVEGCSA-N 345.403 1.719 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)c3cn(C)c(O)n3)C2)cc1 854981633 XTJUIXGXFYNVPC-GFCCVEGCSA-N 330.388 1.391 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)C[C@H](O)C3CC3)C2)cc1 854300504 UVYMOUPYLAIDGQ-PBHICJAKSA-N 333.432 1.686 10 10 EDCE C[C@@H]1CC[C@@H](C(N)=O)[C@@H](C)N1Cc1ccc(N2CCOCC2)cc1 930906928 HQNBHJAZZJKGIA-IIDMSEBBSA-N 331.460 1.998 10 10 EDCE COC1CCN(c2ccc(CN3CCN(C)[C@H](CO)C3)cc2)CC1 931400177 UPPBRQZTFAASBQ-SFHVURJKSA-N 333.476 1.410 10 10 EDCE C[C@H](NC(=O)NCCCN1CCOC1=O)c1ccc(N(C)C)cc1 773306331 KNTBAFIRMMBKOV-ZDUSSCGKSA-N 334.420 1.955 10 10 EDCE O=C(O)c1cc(NS(=O)(=O)c2cnn(CC3CC3)c2)ccc1O 777635602 IJBRHWBTWITINH-UHFFFAOYSA-N 337.357 1.498 10 10 EDCE C[C@@H](NC(=O)C(=O)N1C2CCC1(CO)CC2)c1ccc(N(C)C)cc1 1119836962 JJFSFNLFBJHLRY-DAIYRKSASA-N 345.443 1.446 10 10 EDCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1c(O)cccc1OC 770377203 YMXQSBQRHMTNTD-MPTQWLOMSA-N 349.383 1.326 10 10 EDCE O=C(CCc1nc(-c2ccncc2)no1)NCc1ccc(O)c(O)c1 778930694 XOMXHTQVVMFXSO-UHFFFAOYSA-N 340.339 1.792 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCc2nnc3n2CCCC3)cc1 1137761178 ZNZUSEKAJDFACZ-UHFFFAOYSA-N 341.375 1.749 10 10 EDCE O=C1CC[C@@H](N2CCN(Cc3cc(F)cc(F)c3O)CC2)CCN1 894927831 GZVIEFBCIWPFKV-CQSZACIVSA-N 339.386 1.457 10 10 EDCE C[C@@H](NC(=O)[C@@]1(C)CCC(=O)NC1)c1ccc(N2CCOCC2)cc1 798409411 XQGKVMSRJZIIDG-KUHUBIRLSA-N 345.443 1.617 10 10 EDCE C[C@@H]1[C@@H](C)N(C(=O)c2ccc(N=NC(N)=O)cc2)[C@H](C)C(=O)N1C 1163829689 ZNMQYEIADAMMBU-GMTAPVOTSA-N 331.376 1.929 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)N2C[C@H]3C[C@]3(CO)C2)N(C)C)cc1 899101220 GJIXDAMOWMRTTG-HHXXYDBFSA-N 346.475 1.379 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1CNCc1ccc(O)c(O)c1 393898987 DJFUXVRWVYUQIF-ZDUSSCGKSA-N 338.404 1.823 10 10 EDCE O=C1CC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCN1 1328509502 OXPKZDABHZSGSL-OAHLLOKOSA-N 345.443 1.180 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H](C)NC(C)=O)cc1C 1268048909 HPAOXWLWYYGTOP-ZIAGYGMSSA-N 335.448 1.465 10 10 EDCE O=C1NC(=O)N(Cc2ccccc2)C(=O)/C1=C/c1ccc(O)cc1O 525038 JBLCVRXADNMMFR-RIYZIHGNSA-N 338.319 1.760 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cn(C)c(=O)n1C 1290374833 OSAIMXRXHQIMFK-UHFFFAOYSA-N 328.416 1.596 10 10 EDCE O=C(CCN1C(=O)c2ccccc2C1=O)NCc1cccc(O)c1O 1455318850 PXSLZNSDQTVTHV-UHFFFAOYSA-N 340.335 1.400 10 10 EDCE C[C@H]1CC[C@@H](C(N)=O)CN1c1ccc(CN)cc1Br 212868173 BBLRJEAJCLZCCY-GXSJLCMTSA-N 326.238 1.998 10 10 EDCE COc1ccc(CNC2(CNC(=O)C(C)(C)C(N)=O)CCC2)cc1C 1700154515 HTTQBYIVPMPUAM-UHFFFAOYSA-N 347.459 1.644 10 10 EDCE C[C@@H](c1cccnc1)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1629645364 VWQMQFJZYSBEJN-AWEZNQCLSA-N 341.411 1.941 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N2CCC(N=[N+]=[N-])CC2)n1 2121909464 DEPIOOHVXKWZHE-UHFFFAOYSA-N 349.214 1.646 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCn2ccnn2)cc1C 1713586877 XQUNHVZMHXUPOG-UHFFFAOYSA-N 331.420 1.233 10 10 EDCE COc1ccc(CN[C@H]2CC[C@H](NC(=O)CNC(C)=O)CC2)cc1C 1495439753 XKWJFLPTPISDAP-QAQDUYKDSA-N 347.459 1.657 10 10 EDCE CCO[C@@H]1C[C@H](O)C12CCN(C(=O)Cc1ccc(O)c(O)c1)CC2 1565910815 GVPLXFAMJDHKBB-JKSUJKDBSA-N 335.400 1.419 10 10 EDCE COC[C@@]1(C(=O)OC)CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1632809865 NVKJFLJHCMAYBG-MRXNPFEDSA-N 348.359 1.643 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)Cn2cncn2)cc1C 1734352846 BOEIASQPWBBUGB-AWEZNQCLSA-N 331.420 1.232 10 10 EDCE CC(C)(C)OC(=O)N1CC(n2cc(C(=O)NCCN=[N+]=[N-])nn2)C1 1965103286 ZRARXQXFCAMWIN-UHFFFAOYSA-N 336.356 1.110 10 10 EDCE CCOC(=O)c1ccc(N2NC(=O)/C(=C\c3ccco3)C2=O)cc1 6155053 JAJDPWCBFFQFOP-GXDHUFHOSA-N 326.308 1.918 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H]2CCC(=O)NC2=O)cc1 152183020 LUFFYRPACQYYIG-HNNXBMFYSA-N 325.368 1.629 10 10 EDCE O=C(N[C@H]1C[C@@]1(C(=O)O)c1cc(O)nc(O)c1)OCc1ccccc1 1952931420 QKZQPNJPNGOEGK-YVEFUNNKSA-N 344.323 1.514 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1[C@H](N)Cc1ccc(O)c(O)c1 1953010004 TXMVQKWLVILPJP-CHWSQXEVSA-N 338.404 1.604 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H](NC(=O)COc2ccc(N)cc2)C1 1999143408 MTJGOILWMAIUCE-JOCQHMNTSA-N 335.404 1.820 10 10 EDCE CN(CC(C)(C)CO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2150966866 BXOOPSSAZLOJRY-GFCCVEGCSA-N 342.237 1.856 10 10 EDCE C[C@@]1(NC(=O)C(F)(F)F)CCN(C(=O)c2ccc(O)c(O)c2)C1 2006280486 XFECLJHLQIINHV-CYBMUJFWSA-N 332.278 1.381 10 10 EDCE CC(C)(C)OC(=O)NC1CN(CC(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2010389733 UFRWKYJNSJYYPS-LBPRGKRZSA-N 338.412 1.497 10 10 EDCE COC[C@@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCCN1C(=O)OC(C)(C)C 2010393218 PJZSPYNVGNBVLM-OAHLLOKOSA-N 339.396 1.924 10 10 EDCE CCCNCc1ccc(N2C[C@H](O)C[C@@H](O)C2)c(Br)c1 2161356451 GQZQYJDCSBJGDM-CHWSQXEVSA-N 343.265 1.881 10 10 EDCE CNCc1ccc(N2CC[C@H](O)[C@@H](CO)C2)cc1Br 396821048 KEUWTKOIZALAJA-RISCZKNCSA-N 329.238 1.348 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@@H](N)C(=O)O 2044379104 WEAORJIRTLPLRZ-CQSZACIVSA-N 349.431 1.876 10 10 EDCE C[C@@H](N)c1ccc(N(C)[C@@H]2CC(=O)NC2=O)c(Br)c1 2114736656 CYGQIOJHANGKJS-RDDDGLTNSA-N 326.194 1.320 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213588200 OYCLXYNCLXYUPA-MNOVXSKESA-N 339.396 1.706 10 10 EDCE COC(=O)c1cnc(Sc2nnnn2CC(F)(F)F)s1 2234016916 PYLGITGRPOTUIS-UHFFFAOYSA-N 325.297 1.630 10 10 EDCE NCc1cc(F)c(N2CC3(CCC(=O)N3)C2)cc1Br 2229689340 KJULSWSVZRMNTA-UHFFFAOYSA-N 328.185 1.516 10 10 EDCE CCN=c1[nH]c(N)c(C(=O)NCc2cnc(SC)s2)s1 2284691852 UGECRBXUGNVPTR-UHFFFAOYSA-N 329.476 1.687 10 10 EDCE Cc1cc(=NC(=O)C=Cc2ccc(N3CCOCC3)cc2)[nH]c(O)n1 2308208178 YIMPJQWHODGKLR-UHFFFAOYSA-N 340.383 1.401 10 10 EDCE Cc1ccc(CN2CCC(CO)(CO)C2)c(O)c1Br 2352681450 VXAZUCHCKADXRC-UHFFFAOYSA-N 330.222 1.640 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@H]4[C@H]3CO)c(Br)cc2[C@@H]1O 2357563277 JTNFPYQSLXHUMM-DDKUZNHOSA-N 339.189 1.252 10 10 EDCE Cc1n[nH]c([C@@H]2CN(Cc3ccc(N4CCOCC4)cc3)CCO2)n1 180109856 JZIREPTYKQXNFI-KRWDZBQOSA-N 343.431 1.523 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@]3(C)CCC(=O)NC3)CC2)cc1 366820680 FZZIPUWVYHOCBP-LJQANCHMSA-N 345.443 1.650 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCOCC[C@@H]3C)nc12 367667571 XGUPDEUFDUSYNB-NSHDSACASA-N 334.376 1.222 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC(O)(c4ccccc4)C3)cc2N1 367817439 YIFMOJYBSOGSIE-UHFFFAOYSA-N 341.323 1.634 10 10 EDCE COc1cc(N2CCS(=O)(=O)[C@@H](C)C2)c([N+](=O)[O-])cc1OC 274224653 XNSSRJOOKOANAF-VIFPVBQESA-N 330.362 1.235 10 10 EDCE CCOC(=O)CNC(=O)NCc1ccc(C)c(Br)c1O 2380725081 HBGNDZBQPJHKFM-UHFFFAOYSA-N 345.193 1.825 10 10 EDCE Cc1ccc(CNC(=O)[C@H](N)CCN(C)C)c(O)c1Br 2380741771 KNUHAFMSEDHFGI-LLVKDONJSA-N 344.253 1.358 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc3c(c2)CCCN3C)CC(=O)N1C 282153425 IZYKYCIGGBUMQA-ZDUSSCGKSA-N 330.432 1.441 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCCCN2CCCC2=O)c1 729041687 WWOWUOQHMQEBKO-LBPRGKRZSA-N 335.404 1.774 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3C[C@H]4C[C@@]4(CO)C3)C2)cc1 824685507 FTAOJUSVDJEYGV-CLCXKQKWSA-N 345.443 1.545 10 10 EDCE CN(C/C=C/c1ccc(N(C)C)cc1)C[C@H](O)CN1CCOCC1 835026408 TUBCSVWIBGUFHW-PXPVJAHISA-N 333.476 1.391 10 10 EDCE COc1ccc2c(c1)CCCN2Cn1nc2c(OC)cccn2c1=O 841684376 XJVGTHYITFIQPW-UHFFFAOYSA-N 340.383 1.924 10 10 EDCE CN1CCCc2cc(CNC(=O)NCC[C@]3(O)CCOC3)ccc21 844934588 PCJRGQMEKXTBOL-SFHVURJKSA-N 333.432 1.410 10 10 EDCE CCC(=O)N1CC[C@H](C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 855234029 QVHXZUMWHQDOLK-GJZGRUSLSA-N 345.443 1.649 10 10 EDCE O=C(N[C@@H]1CCCN2CCSC[C@@H]12)N1Cc2cccc(O)c2C1 925173418 XTMCGRFIYJDNDU-CABCVRRESA-N 333.457 1.997 10 10 EDCE Cc1cc(C(=O)CN2C[C@@H](O)C[C@@H](O)C2)c(C)n1-c1ccc(F)cc1 752308995 FAIJXAABDNWKBA-CALCHBBNSA-N 346.402 1.843 10 10 EDCE C[C@H](N[C@H]1CCN(C2CCOCC2)C1=O)c1cc([N+](=O)[O-])ccc1O 756735397 BIPZVWNOICDZCQ-NHYWBVRUSA-N 349.387 1.731 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc(C(N)=O)[nH]3)C2)cc1 857302159 HXGBABHGFAIGBA-NSHDSACASA-N 328.372 1.131 10 10 EDCE CO[C@H](CNCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCOC1 850342908 OKPKVEFUAMXDOB-CRAIPNDOSA-N 338.423 1.803 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CC[C@H](C)NC1 861804443 JHOLDXYPEXRVEA-HOCLYGCPSA-N 347.459 1.778 10 10 EDCE CN1C(=O)C[C@H](C(=O)N2Cc3cccc(O)c3C2)[C@H]1c1cccnc1 871206834 FZDDFYVBFIMOAB-KBXCAEBGSA-N 337.379 1.849 10 10 EDCE COC(=O)c1c(CN[C@H]2C[C@H](C(N)=O)C2)c2cc(F)ccc2n1C 895393778 NWEFHQMPBNGZLY-HOMQSWHASA-N 333.363 1.458 10 10 EDCE COc1ccc(CNC(=O)c2ccc3c(O)ncnc3c2)c(O)c1 1155575843 ZHFRIUVBFMAIGK-UHFFFAOYSA-N 325.324 1.980 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2ccc(O)nn2)cc1C 1317565214 CBBLFALBHLRHHW-UHFFFAOYSA-N 330.388 1.361 10 10 EDCE CCNCc1ccc(N(C)Cc2nnnn2C)cc1Br 707677504 QFUQXYHBMYZSLW-UHFFFAOYSA-N 339.241 1.719 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@H]2CCNC2=O)C2CC2)cc1C 1323050247 GLXIMKKVLSGGMC-JKSUJKDBSA-N 345.443 1.124 10 10 EDCE CCC[C@H](C)NC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1333946948 KYFCRGSHEUJXJK-KBPBESRZSA-N 333.432 1.695 10 10 EDCE CS(=O)(=O)c1ccc(/C=C\C(=O)NCc2ccc(O)c(O)c2)o1 1445898646 BEUMAGLZJIQRIZ-UTCJRWHESA-N 337.353 1.424 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)cc1 1296520756 OXGNDEANDNXDBJ-UHTWSYAYSA-N 329.360 1.575 10 10 EDCE COC(=O)[C@H]1CN(C(=O)/C=C\c2cn(C)cn2)c2ccc(F)cc2O1 1530902166 SUWXTXFCBIOQIR-ZDTYVGOBSA-N 345.330 1.540 10 10 EDCE CCOC(=O)[C@@H](NC(=O)c1cccc(O)c1O)c1cccc(O)c1 1545637327 RCJWEHVYKNEBBJ-AWEZNQCLSA-N 331.324 1.838 10 10 EDCE CCOC(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1624107970 GZBJRAKWTNDDOZ-UHFFFAOYSA-N 333.348 1.763 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccc(F)cn2)cc1C 1717764379 PIRGHQIGTYHTTK-OAHLLOKOSA-N 347.390 1.418 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2ocnc2C)cc1C 1484478999 KBNJIFDSTFQUSY-UHFFFAOYSA-N 347.415 1.524 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@H]2CCCN2C)cc1C 1714377693 OJYJBCRCAUYAMG-PBHICJAKSA-N 333.476 1.940 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCS(=O)(=O)[C@@H]2CCCC[C@@H]21 1631521169 WARLZQNQBYTQLW-SWLSCSKDSA-N 339.413 1.209 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccns2)cc1C 1734368100 HREAUPCKBKWMSL-CYBMUJFWSA-N 335.429 1.341 10 10 EDCE CC(=O)N(CCCNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1737314276 ONTRACQBSJZPGG-UHFFFAOYSA-N 331.376 1.980 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)CNC(=O)C3CC3)C2)cc1C 1731472693 YGSGKKLFXYBJET-IYBDPMFKSA-N 345.443 1.267 10 10 EDCE O=C(CCC(=O)Nc1nnc(C2CC2)o1)NCc1ccc(O)cc1O 1643103661 DYLYIYOTKAFMNB-UHFFFAOYSA-N 346.343 1.393 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1C[C@H](O)C[C@H]1CN 2124716487 ZWARYJRLDOVZSF-DMDPSCGWSA-N 329.238 2.000 10 10 EDCE COc1ccc(-n2nnnc2CN[C@H](C)CNC(=O)C(C)(C)C)cc1 1774045339 BKSBPBRGLGKHGE-GFCCVEGCSA-N 346.435 1.311 10 10 EDCE COc1ccc(N2CCN(C[C@@H](C)CS(C)(=O)=O)CC2)cc1 162070108 PZMBHLCQWPYZGR-CQSZACIVSA-N 326.462 1.498 10 10 EDCE CN(Cc1ccccc1O)C(=O)N[C@@H]1CC(=O)N(CC(F)(F)F)C1 163626128 UNGQQURAKYSHDB-LLVKDONJSA-N 345.321 1.697 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](O)C[C@H]2CO)cc1Br 2136089144 XFYQCWKKMLWROW-ADEWGFFLSA-N 329.238 1.791 10 10 EDCE OC[C@H]1COCCN1c1ccc(CNC2CC2)c(Br)c1 236503486 DFMZLPSEPKILMJ-AWEZNQCLSA-N 341.249 1.899 10 10 EDCE C[C@H](O)[C@@H](N)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952122391 UMECTTMHYOZGMB-DRCTWCGVSA-N 326.393 1.242 10 10 EDCE CCN(C(=O)OC(C)(C)C)[C@@H]1COC[C@@H]1C(=O)NCCN=[N+]=[N-] 1985093738 DRAMRODVROUFSV-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C1(NC(=O)OC(C)(C)C)CC(CO)C1 1990177097 NWYZIQICANFKFL-UHFFFAOYSA-N 327.385 1.421 10 10 EDCE O=C(NCCNC(=O)c1cc(O)c(O)c(O)c1)OCc1ccccc1 169911902 OGOSCRPMKJPSLF-UHFFFAOYSA-N 346.339 1.460 10 10 EDCE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCCN=[N+]=[N-] 2010406259 RPHQFICELFJTBX-SNVBAGLBSA-N 343.384 1.650 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)c2n1 2064908318 WYXBKZLOWUAXRX-NILFDRSVSA-N 342.399 1.821 10 10 EDCE COc1ccc([C@@H](C2CCC2)n2nc(C)c(C(N)=O)c2N)c(O)c1 2079969477 DFLZSTBCIGPJLH-OAHLLOKOSA-N 330.388 1.976 10 10 EDCE CC1(C)CN(C2CN(c3ccc(CN)c(Br)c3)C2)C1=O 2182228027 WMENSHYSCSTFJE-UHFFFAOYSA-N 338.249 1.965 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H]1CNC(=O)c1cccc(O)c1O 1907373133 AGQJQUURUDQAHC-QWRGUYRKSA-N 336.388 1.988 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)cc1Br 2190456382 GTYRXKYPZQGHPF-MXAVVETBSA-N 341.249 1.631 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)c(Br)c1 2102178880 XJSYVIIMEXTKMQ-BQAVTBIBSA-N 328.206 1.698 10 10 EDCE CN1CCO[C@H]2CN(c3ccc(CN)cc3Br)C[C@@H]21 2097704508 YOBWJRBGPGCJQC-KBPBESRZSA-N 326.238 1.427 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)NCCN=[N+]=[N-])C1CCOCC1 2244938564 GGLLTUJRXBDYBC-UHFFFAOYSA-N 327.385 1.829 10 10 EDCE CCCCn1c(N)c(N(C)C(=O)C=Cc2cccnc2)c(O)nc1=O 2296831434 ZDKIRQQTTKHKLU-UHFFFAOYSA-N 343.387 1.402 10 10 EDCE COC[C@@H]1[C@H](O)[C@H](O)CN1c1ccc(OCc2ccccc2)cc1 2299508024 NYTPZIUDDRJSGL-QRVBRYPASA-N 329.396 1.822 10 10 EDCE CC(C(=O)NCc1ccc(C)c(Br)c1O)=C1CNC1 2352946217 HQVJYFGEGKCHQP-UHFFFAOYSA-N 325.206 1.999 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCN(c3cccnn3)CC2)cc1 171167770 YWRBNLRJIFIUSI-UHFFFAOYSA-N 340.431 1.574 10 10 EDCE CNC(=O)Cn1cc(NC(=O)NCc2ccc(N(C)C)cc2C)cn1 115854626 YAOIIGYPOMEUSO-UHFFFAOYSA-N 344.419 1.325 10 10 EDCE CCNC(=O)NC(=O)[C@@H](C)N1CCN(c2ccc(OC)cc2)CC1 39561432 BJFVWCJMLFACCT-CYBMUJFWSA-N 334.420 1.051 10 10 EDCE CC[C@@H]1Oc2ccc(N)nc2N(CCOc2ccc(N)cc2)C1=O 75259254 SQGZRGARWBAXJA-ZDUSSCGKSA-N 328.372 1.829 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CCCCC(=O)N1 193722520 BYTCGXXEYKEONQ-QGZVFWFLSA-N 345.443 1.540 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC[C@@H](CC(N)=O)C2)c([N+](=O)[O-])c1 80682788 JASNWRZYACXLON-IYNGYCSASA-N 347.371 1.873 10 10 EDCE O=C1NC(=O)[C@@]2(CCCN(Cc3c(O)ccc4ccccc34)C2)N1 193465519 CZYLZMCDGJJZEH-SFHVURJKSA-N 325.368 1.719 10 10 EDCE COc1ccc(CN2CCN(C(=O)[C@H]3CCCN3C)CC2)c(O)c1 93821405 BJRWCBHVVDMAFW-MRXNPFEDSA-N 333.432 1.139 10 10 EDCE CC(=O)NC[C@H](C)OC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255029467 XEEBIGMFKBWJID-PODYEWJSSA-N 332.400 1.604 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CCN4CCOC[C@@H]4C3)ccc21 364965783 BMIKVMXNUVXLPK-KRWDZBQOSA-N 344.459 1.295 10 10 EDCE Cc1ccc(CN(C)[C@@]2(C(=O)O)CN[C@H]2C)c(O)c1Br 2380765469 MNJLXBSSVNWCKO-XPTSAGLGSA-N 343.221 1.710 10 10 EDCE CC(=O)C(=O)COC(=O)CCCOc1ccc2c(c1)NC(=O)CC2 808545882 RVGTTYWVUGKYRW-UHFFFAOYSA-N 333.340 1.432 10 10 EDCE COc1ncc(C(=O)NCc2cc(Br)ccc2O)cn1 804736498 WFANMUUDFFREPZ-UHFFFAOYSA-N 338.161 1.883 10 10 EDCE Cc1cc(O)c(CN2CCN(CCC(=O)N(C)C)CC2)cc1Cl 824883605 MCWXABFDLXKQJX-UHFFFAOYSA-N 339.867 1.950 10 10 EDCE Cn1ccnc1CN1CCN(Cc2c(O)ccc3ccncc23)CC1 729983389 OFGPHFCLJMHSQD-UHFFFAOYSA-N 337.427 1.992 10 10 EDCE C[C@H]1C[C@H](S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 830297725 IMLDFPGBMBMROD-WCQYABFASA-N 330.425 1.879 10 10 EDCE CC[C@@H](NC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1)C(=O)O 909132635 VYQWNKHDELSOIN-IUODEOHRSA-N 335.404 1.684 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)c2ccnn2C2CCC2)c1 914161805 GXFYZIGQMYCZCN-UHFFFAOYSA-N 337.401 1.801 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCNC[C@H]1C 842265697 LZVQWNHGMMOHTI-PBHICJAKSA-N 346.475 1.215 10 10 EDCE O=S1(=O)CCN(c2ccc(CN[C@@H]3CCNC34CCC4)cc2)CC1 925485906 FAYNPCNXNQVNNQ-QGZVFWFLSA-N 349.500 1.296 10 10 EDCE COC[C@H](NC(=O)NCc1ccc(N(C)C)cc1)C1CCOCC1 852468224 MCAWRVLCNLMIEA-KRWDZBQOSA-N 335.448 1.993 10 10 EDCE CCOC(=O)C[C@@H](O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 859230500 ZRYRISIBGLCUEX-WMLDXEAASA-N 336.432 1.488 10 10 EDCE NS(=O)(=O)c1cc2c(s1)CCN(C(=O)c1cc(O)cs1)C2 856329472 NNEZXZFBHXBLIV-UHFFFAOYSA-N 344.439 1.361 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3C[C@]34CCCNC4)C2)cc1 851639093 AWGRDEYUGWFERJ-FNHZYXHNSA-N 329.444 1.780 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1cnnn1C1CCNCC1 852806327 GJGUHZQATDWIJR-UHFFFAOYSA-N 342.447 1.507 10 10 EDCE C[C@@H](C(=O)NCc1ccc2cccnc2c1O)[C@@H](C)S(C)(=O)=O 862025790 BAJYBYWYOAVFLL-GHMZBOCLSA-N 336.413 1.626 10 10 EDCE CN1CCn2nc(NCc3ccc(N4CCOCC4)cc3)cc2C1 865845053 GEQCQUYDFVMWOT-UHFFFAOYSA-N 327.432 1.777 10 10 EDCE O=C1O[C@H]2CNC[C@H]2N1[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 872254969 HEEUSICSAUYDOF-YVLXSGLVSA-N 337.807 1.413 10 10 EDCE Cn1cc(-c2c[nH]cc2C(=O)NCCc2ccc(O)c(O)c2)cn1 779000798 GJFLOIJKIKZWIP-UHFFFAOYSA-N 326.356 1.799 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CNC[C@@]2(O)[C@H]3[C@@H]4C[C@@H]5[C@@H]6C[C@@H]([C@@H]3[C@@H]64)[C@@H]52)c1 785546874 UCNDREIOMPZOSC-PBLWTQDTSA-N 342.395 1.899 10 10 EDCE CC(=O)N1CCC[C@H]1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891246809 POLIWVBZBPGCJJ-ROUUACIJSA-N 346.475 1.482 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1CN([C@H]2CCOC2)C1 897984316 VJVQEBDZLFCHKC-KXBFYZLASA-N 345.487 1.829 10 10 EDCE O=C(NCc1cccc(Br)c1O)N[C@@H]1[C@H]2COC[C@H]21 793459075 XCJWWUSKUMQRBN-JZYVYDRUSA-N 327.178 1.599 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@](O)(CC(=O)NCCCN=[N+]=[N-])C1 1963704757 TXWNIGYJZUUKSO-HNNXBMFYSA-N 341.412 1.955 10 10 EDCE CO[C@H](C)CNC[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1319591962 FTGXUEMWWBSLNQ-VXGBXAGGSA-N 335.408 1.934 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2(C3(O)CCOCC3)CC2)cc1 1178271428 XEBAAHKMZOBSGT-UHFFFAOYSA-N 346.387 1.901 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@]12CCOC2 1325807651 BELMPCUPSIDCPA-GOSISDBHSA-N 331.416 1.102 10 10 EDCE O=C(C(=O)N1CCC[C@@H]1[C@H]1CCCOC1)N1Cc2cccc(O)c2C1 1329866062 OTVZPJRTKMMNNQ-GOEBONIOSA-N 344.411 1.652 10 10 EDCE CCC(=O)NCC(=O)N1C[C@H](C)[C@@H](NCc2ccc(OC)c(C)c2)C1 1327850480 WDIMCGXFOVHSRV-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)Cc2nnc(C)o2)cc1C 1328332211 UWGPWLROKLQBAF-ZDUSSCGKSA-N 346.431 1.922 10 10 EDCE Cn1cc(NC(=O)c2cc3cc(O)c(O)cc3s2)c(C(N)=O)n1 1181130359 JIBWQDASAQQTFH-UHFFFAOYSA-N 332.341 1.397 10 10 EDCE CCOc1ccc(N2CCN(C(=O)c3cn(C)c(O)n3)CC2)cc1 1261734689 HRCFEQJQKRVEER-UHFFFAOYSA-N 330.388 1.487 10 10 EDCE O=C(O)/C=C/c1ccc(N2CCC(NCCO)CC2)c([N+](=O)[O-])c1 1349486388 IEBSDBCBPYEOLP-DUXPYHPUSA-N 335.360 1.243 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCC[C@H]3C)C2)cc1 1261694533 SMUBCFSEYYMHFN-JKIFEVAISA-N 345.443 1.695 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccccc2)cc1C 1272352987 XAZKBKLCLNSPNW-KRWDZBQOSA-N 328.412 1.884 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccnn1CCN(C)C 1449122231 OAWZGJOHDHVRDJ-UHFFFAOYSA-N 337.420 1.566 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NOc2ccccc2F)c1 1455475121 GSCYNWAJWMZWDA-UHFFFAOYSA-N 340.332 1.627 10 10 EDCE NC(=O)CCn1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)n1 1465291632 DPIWJBXJDXBJKU-UHFFFAOYSA-N 346.368 1.637 10 10 EDCE CC(C)(C)[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1nc(=O)o[nH]1 1469343594 UAQVRMLNPBNKNJ-IYNGYCSASA-N 333.344 1.691 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cc3n(n2)CCO3)cc1C 1480476797 KAASCZRBGNZHGM-ZDUSSCGKSA-N 344.415 1.501 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC([C@@H](O)C(F)(F)F)CC1 1546058526 QQLHYGQSOZPGKM-CQSZACIVSA-N 333.306 1.802 10 10 EDCE Cn1cc(-c2nn(C)cc2NC(=O)/C=C\c2ccc(O)c(O)c2)cn1 1626913205 GWQJXRVCSSGCLK-XQRVVYSFSA-N 339.355 1.884 10 10 EDCE C[C@H](O)CCCN1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1716753974 CVAWAWRXTGGFTQ-LBPRGKRZSA-N 347.419 1.766 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@H]2CCN(C)C2=O)cc1C 1480484777 VPZNAMQANRBNAG-GOEBONIOSA-N 347.459 1.466 10 10 EDCE COc1ccc(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)nn1 1713650717 JJNZSPWMXUBRNM-UHFFFAOYSA-N 344.415 1.664 10 10 EDCE N[C@H]1CCN(Cc2cc(Cl)cc(Br)c2O)C[C@@H]1CO 2122380266 YVBGCUNRPORSEE-SKDRFNHKSA-N 349.656 1.950 10 10 EDCE Cc1ncccc1/C=C/C(=O)N1CCc2ccc(S(N)(=O)=O)cc21 1633432029 YJWUMFWRTAWFKC-FNORWQNLSA-N 343.408 1.640 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1CCC(=O)N1 1732807779 VDXXPZOWYFQGLH-HNNXBMFYSA-N 333.432 1.220 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCc2cccc(Cl)c2O)cn1 1647830055 GSGHSCVSVMPWCJ-UHFFFAOYSA-N 340.788 1.774 10 10 EDCE CN1C(=O)C[C@H](C(=O)NCc2c(O)cccc2O)[C@H]1c1cccnc1 1652626273 VQEZGZSMDYHIHI-YVEFUNNKSA-N 341.367 1.329 10 10 EDCE Cc1ccc(C(=O)NCCNC(=O)c2cc(O)c(O)c(O)c2)cc1C 169839072 GOWJIOKBQPWCOH-UHFFFAOYSA-N 344.367 1.580 10 10 EDCE C[C@H](CCNC(=O)NCc1ccc(N(C)C)c(F)c1)[S@](C)=O 165582269 AFYFGHNCUCSRBA-RKFFSXRUSA-N 329.441 1.848 10 10 EDCE COc1cccc([C@H](NCCN=[N+]=[N-])C(N)=O)c1Br 1912176640 BTDVIJXNZDECKT-JTQLQIEISA-N 328.170 1.884 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cccc(F)c2O)[C@H](O)C1 1966002133 GJAIFFCRBIRDAK-ZIAGYGMSSA-N 340.395 1.991 10 10 EDCE CN[C@H](c1ccccc1O)[C@@](O)(CNC(=O)OC(C)(C)C)COC 1921803926 LXKCXLIBMHDHEF-RHSMWYFYSA-N 340.420 1.555 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@@]4(CO)C3)c(Br)cc2[C@@H]1O 2146304874 ALWAGYHDFYHEBU-FMCKTDMXSA-N 339.189 1.253 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)O1 2003171149 UYEJRORNPJVIRV-MNXVOIDGSA-N 340.420 1.324 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H](CC(=O)NCCN=[N+]=[N-])O1 1985103164 RDXRWDDDJJLNCA-MNOVXSKESA-N 327.385 1.827 10 10 EDCE CN1CCc2cc([C@H](N)C3(O)CN(C(=O)OC(C)(C)C)C3)ccc21 1999536911 QJFSFKGGJICICJ-HNNXBMFYSA-N 333.432 1.661 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2010392289 DXGPYQDXKYVLGB-VXGBXAGGSA-N 339.396 1.658 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1CCC2(CN(C(=O)OC(C)(C)C)C2)O1 2025157262 VTPRUDZERJJHST-LLVKDONJSA-N 339.396 1.924 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)C[C@H]2CN(C)C)cc1Br 300522567 ZBJYAEICRWWEQE-WXHSDQCUSA-N 342.281 1.970 10 10 EDCE NCc1ccc(N2CCC[C@@H](CO)[C@@H]2CO)c(F)c1Br 709805725 KQIMYNQIATUYKO-JQWIXIFHSA-N 347.228 1.617 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCN4CC[C@H]3C4)c(Br)cc21 381772563 JSVHIQJDJPBKNT-SDBXPKJASA-N 337.221 1.295 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)CCCO)c(Br)cc21 388634154 IQOLHGIYQRQJMF-GFCCVEGCSA-N 328.210 1.480 10 10 EDCE NCc1cc(F)c(N2CC[C@@H](O)[C@@H](CO)C2)cc1Br 396922450 KGPLQYYQFNJPRJ-NOZJJQNGSA-N 333.201 1.226 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H](c3cnn(C)c3)C(C)C)c2n1 2064750533 GYEZXJZPYYELRM-CQSZACIVSA-N 328.376 1.604 10 10 EDCE CCNCc1ccc(N2CCC[C@H]2[C@@H](O)CO)cc1Br 2179801253 ZHOMMTOVDVOHDU-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE CNC(=O)c1nn(Cc2c(C)cccc2O)c(C(F)(F)F)c1N 2079259295 ULVIQLVBXVGIQN-UHFFFAOYSA-N 328.294 1.906 10 10 EDCE C[C@@H](O)[C@@H]1CCCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2193595446 HXJSSPGGYPJXCA-BITCUVMXSA-N 341.205 1.784 10 10 EDCE C[C@@H]1[C@@H](C)S(=O)(=O)CCN1c1ccc(CO)cc1Br 2113962108 PNEVFRBAZRNXDC-NXEZZACHSA-N 348.262 1.953 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213586266 ABSHRHKSYDFOGK-FIQHERPVSA-N 339.396 1.704 10 10 EDCE CN(Cc1nn(C)nc1Br)c1c(F)cc(CN)cc1F 2235286273 URLWUBMTPOTGND-UHFFFAOYSA-N 346.179 1.951 10 10 EDCE COc1ccc(N2CC[C@H](O)[C@H](O)C2)c(OC)c1Br 2226549671 RKZJGPNAWMRDEE-VHSXEESVSA-N 332.194 1.398 10 10 EDCE Cc1ccc(COc2nnc(=N)[nH]n2)cc1NC(=O)OC(C)(C)C 2253230308 UMNMBKLQVHPKGG-UHFFFAOYSA-N 332.364 1.914 10 10 EDCE CCNc1nc2ccccn2c(=O)c1/C=C1/SC(=S)N(C)C1=O 6594558 UAOHEIYXEAYFOC-CSKARUKUSA-N 346.437 1.957 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)c(Br)c1 2357053462 WBKOJJOQHYHSTD-FSJWZZSZSA-N 342.233 1.965 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@H](N(C)C)[C@H](O)C2)cc1Br 2357333302 BVSUDTFDYXYVLS-NZVBXONLSA-N 342.281 1.841 10 10 EDCE C[C@H](CNC(=O)/C=C/c1ccc(N2CCOCC2)cc1)CC(=O)O 191215140 HREBTRGCWKIRDF-GBXSZLQWSA-N 332.400 1.763 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C2CCN(C(N)=O)CC2)cc1 193569348 BAKBXHNFDWDESW-UHFFFAOYSA-N 332.448 1.940 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2CC(=O)Nc3ccccc32)c1 255178646 MGUHTSCYSBPYMW-SREVYHEPSA-N 336.351 1.440 10 10 EDCE COC(=O)[C@](C)(O)CN(C)Cc1ccc(C)c(Br)c1O 2380750148 CGYISNBHKARVGO-CQSZACIVSA-N 346.221 1.819 10 10 EDCE Cc1ccc(CN2CCC(O)(C(N)=O)CC2)c(O)c1Br 2380815483 QEXGUJQQANQQRA-UHFFFAOYSA-N 343.221 1.275 10 10 EDCE O=C1N[C@H](C(=O)NCc2cc(Br)ccc2O)CS1 804735097 LCLKCAHWHPQGQJ-QMMMGPOBSA-N 331.191 1.596 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1c(C)cc(O)cc1=O 808094803 FCXUFUYZMDUDIE-UHFFFAOYSA-N 337.372 1.370 10 10 EDCE COCC[C@@H](COC)NCc1ccc(N2CCOCC2)c(F)c1 810173956 LPYPCCWWQYTBSR-HNNXBMFYSA-N 326.412 1.803 10 10 EDCE CN(C[C@H]1CCCO1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823542839 LTSPIPOXOROQEA-GOSISDBHSA-N 347.459 1.968 10 10 EDCE COc1cc(-c2noc(CN(C)c3ccc4c(c3)OCO4)n2)ncn1 828499028 LMEQGZDYLKUTFC-UHFFFAOYSA-N 341.327 1.900 10 10 EDCE Cc1cc(CC(=O)N[C@H]2CC(=O)N(C)C2)c(C)n1-c1ccccc1 825222911 RXDYYWCCQPZSFX-INIZCTEOSA-N 325.412 1.984 10 10 EDCE COc1ccc(N2CCC(NC(=O)/C=C\Cn3cncn3)CC2)cc1 900507424 FNXMNYVGWDMQEU-IHWYPQMZSA-N 341.415 1.628 10 10 EDCE O=C(NCC[C@H]1CCNC1)NCc1cc(Br)ccc1O 841938985 SDLXCTGBOAZXNC-SNVBAGLBSA-N 342.237 1.954 10 10 EDCE Oc1ccc2c(c1CNC(=S)NCCN1CCOCC1)CCCC2 741876234 RMNHTGDEXBEUFF-UHFFFAOYSA-N 349.500 1.567 10 10 EDCE CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)NCc2c(O)cccc2F)C1 918844444 DMBKRRGQVYVHDC-NWDGAFQWSA-N 337.395 1.978 10 10 EDCE COC(=O)[C@H]1CN(C)CCN(Cc2ccc(N3CCOCC3)cc2)C1 840958593 QOHGYRVKECUQEM-KRWDZBQOSA-N 347.459 1.060 10 10 EDCE C[C@H](NC(=O)N1CC(C(=O)O)C1)c1ccc(N2CCOCC2)cc1 857097121 LWIZNHUKXGTABV-LBPRGKRZSA-N 333.388 1.310 10 10 EDCE C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1[C@H]2CN[C@H]1C2 925486210 FWKWOPFJNFMUTH-WCZJQEMASA-N 349.500 1.007 10 10 EDCE Cn1cc(C(C)(C)C(=O)NCc2ccc(N3CCOCC3)cc2)cn1 751427941 UZKISOJVLRBFGR-UHFFFAOYSA-N 342.443 1.851 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3C[C@H]3c3cncn3C)C2)cc1 855226670 PPQCGJXPEYCQHJ-IAOVAPTHSA-N 340.427 1.927 10 10 EDCE COc1ccc(O)c(CNC[C@@H]2CN(Cc3ccncc3)CCO2)c1 862535979 BKFSKJIZHVZXFV-GOSISDBHSA-N 343.427 1.786 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@]3(C)CCCO3)CC2)c(OC)c1 870165108 OCWVWPUHRCFYGZ-GOSISDBHSA-N 334.416 1.922 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3[nH]cnc3C)CC2)cc1 874242012 BRLVXLQLJKNYEE-UHFFFAOYSA-N 343.431 1.279 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN(C[C@@H](C)O)CC2)c1 781908721 LJQSZJMOWYWEHW-GFCCVEGCSA-N 343.265 1.962 10 10 EDCE CCCOc1ccnc(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n1 1138152323 FCVQQBXGVBREBP-GFCCVEGCSA-N 345.399 1.967 10 10 EDCE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2O)[C@@H](C(=O)O)C1 1962838075 OEADTRGNZLDVEB-CYBMUJFWSA-N 336.388 1.898 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@](C)(O)[C@H](O)C2)c(Br)c1 1893326908 YQXUXHJLRJIKDM-FZZIBODNSA-N 329.238 1.791 10 10 EDCE CN(CCOc1ccccc1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1335541216 CJLOMPBPXBRPCX-UHFFFAOYSA-N 340.379 1.772 10 10 EDCE O=C(C(=O)N1CC[C@H]2CC[C@@H](C1)S2)N1Cc2cccc(O)c2C1 1261868671 SDBJLOOZCFRKGJ-OLZOCXBDSA-N 332.425 1.731 10 10 EDCE CC[C@@H](F)C(=O)N(C)C[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1510713325 QNZDRPAYEIBKTI-CMPLNLGQSA-N 341.383 1.424 10 10 EDCE C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)C1(N2CCOCC2)CCCC1 1293419750 ICSMGYGJBVYSJU-CQSZACIVSA-N 348.443 1.790 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@H]2C3)c(Br)c1 2116737202 QHNJPIXZZBHJMM-WBMYTEFPSA-N 328.206 1.262 10 10 EDCE CCn1nncc1C(=O)N[C@H](C)CNCc1ccc(OC)c(C)c1 1483126692 WNBVFVFRUAVFNV-CYBMUJFWSA-N 331.420 1.523 10 10 EDCE CCN(CCNC(=O)C1CC1)C(=O)c1ccc(N=NC(N)=O)cc1 1704259171 DVBSGOHGTOHOBW-UHFFFAOYSA-N 331.376 1.837 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@]2(C)CCC(=O)N2)cc1C 1498107073 YCDPIMLCSIFKFF-UGSOOPFHSA-N 333.432 1.267 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)Cc2cncn2C)cc1C 1569030344 NOPCRXZHYCTROQ-CQSZACIVSA-N 330.432 1.574 10 10 EDCE 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COc1ccc(N2CC[C@@H](NS(=O)(=O)CCCCF)C2)cc1 849417437 QZPKLLBKSPLJLH-CYBMUJFWSA-N 330.425 1.943 10 10 EDCE Nc1ccc(CCNC(=O)N[C@@H]2CCCN(c3ncccn3)C2)cc1 841711254 QFGSJVBPTLDVCY-MRXNPFEDSA-N 340.431 1.570 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@]4(O)C[C@H]4C3)C2)cc1 854296900 LBUORKZQPNVVIV-PMUMKWKESA-N 331.416 1.440 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H]4COC[C@]4(C)C3)C2)cc1 852450657 RBSOGRSTYUENEW-DOXZYTNZSA-N 345.443 1.952 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CNCCC3(F)F)C2)cc1 851639120 BHYFMKBPNIJLTB-SWLSCSKDSA-N 339.386 1.635 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](C)C[C@@H](C)O)C2)cc1 854298726 AMNCAVYMWMAZAB-KFWWJZLASA-N 335.448 1.980 10 10 EDCE CC[C@@H](NC[C@]12COCCN1C(=O)COC2)c1ccc(F)cc1O 866553797 NXKVEFHSEUIEET-RHSMWYFYSA-N 338.379 1.200 10 10 EDCE NS(=O)(=O)C[C@@H]1CCCN1Cc1cc(Cl)cc(Cl)c1O 769428710 RRJNNPQGVFLYGK-JTQLQIEISA-N 339.244 1.952 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2[C@H]3CC[C@]4(COC(=O)[C@H]24)O3)c1 860242457 RQLULBSLLHJWBW-SBTRFCBZSA-N 347.367 1.299 10 10 EDCE COc1cc(Cl)cc(CN2CCC[C@@H]2CS(N)(=O)=O)c1O 761197406 DMOSGMHCOSLZIB-LLVKDONJSA-N 334.825 1.307 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cccnc1C(N)=O 763249121 OWTASQHMWKCLJJ-UHFFFAOYSA-N 326.400 1.909 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCCC1CCS(=O)(=O)CC1 779546051 BALNWIUMXGZLLM-DUXPYHPUSA-N 339.413 1.442 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 885003950 LSXNZMKRXWDRPO-LLVKDONJSA-N 327.377 1.581 10 10 EDCE CNC(=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccccc2)c1C 789094402 BHJYEIUUCRYQCU-UHFFFAOYSA-N 328.368 1.956 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 1895876719 YAEMEJBPBZCPIM-MNOVXSKESA-N 327.385 1.516 10 10 EDCE COc1cc(CN2CCC(CNS(C)(=O)=O)CC2)c(O)cc1C 795670369 ITEBKIKZPQSHDY-UHFFFAOYSA-N 342.461 1.470 10 10 EDCE Cc1nnc2n1CCN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@@H]2C 1306033936 NBBRCAWVBYCLPA-SECBINFHSA-N 327.348 1.966 10 10 EDCE COC(=O)[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1ccc(O)cc1 1153804281 WPCCMOMTUHWZFO-MJERTPDMSA-N 343.335 1.847 10 10 EDCE COC(=O)[C@H]1C[C@@H](C(F)(F)F)CN(C(=O)c2cccc(O)c2O)C1 1300761828 OKIXAFLGQRVGQY-DTWKUNHWSA-N 347.289 1.911 10 10 EDCE C[C@@H](NC(=O)NCCCN1C(=O)NC(C)(C)C1=O)c1ccccc1O 1313416185 PRSDBCBIYXFELU-LLVKDONJSA-N 348.403 1.473 10 10 EDCE Cn1cc([C@H]2CN(C(=O)c3ccc(N=NC(N)=O)cc3)CCN2)cn1 1170112221 NFTFVCMILOGSOF-CQSZACIVSA-N 341.375 1.369 10 10 EDCE O=S1(=O)CCC(NCc2c(O)cccc2Br)CC1 706874945 AHSPEFVFSPMODB-UHFFFAOYSA-N 334.235 1.822 10 10 EDCE CSc1ccccc1C(=O)N1CCS(=O)(=O)[C@H]2COCC[C@@H]21 1451145181 RYTTWNMFMXFIOV-JSGCOSHPSA-N 341.454 1.437 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CCS(=O)(=O)[C@@H]2C)c1 1479095800 CTQMNJAIKPDMQY-OPQQBVKSSA-N 342.417 1.337 10 10 EDCE CC1(C)C(=O)NC(=O)CN1c1ccc(CN)cc1Br 212917418 SGTDFOTVTQRPJY-UHFFFAOYSA-N 326.194 1.149 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3NC(=O)O[C@@H]3C2)cc1Br 2120402312 GHUOBSUOHQBVJB-UPZJHPNMSA-N 326.194 1.766 10 10 EDCE CN(c1ccc(N)cc1)S(=O)(=O)c1nn(C)cc1Br 2121896540 NWQPEXUKVLOTEA-UHFFFAOYSA-N 345.222 1.590 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC(CN3CCOCC3)C2)cc1 1636426565 HQJXKVMENUSRDC-UHFFFAOYSA-N 331.376 1.253 10 10 EDCE COc1cccc([S@](=O)CC(=O)NCc2ccc(O)cc2O)c1 1638357108 OTXYAWRWUWYKAG-HSZRJFAPSA-N 335.381 1.530 10 10 EDCE CC[C@@H](CNC(=O)[C@@H](C)CC)NC(=O)c1cc(OC)nc(OC)c1 1746113429 JQHTVBIPBGJABV-AAEUAGOBSA-N 337.420 1.770 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C2(C)CC=CC2)cc1C 1667880461 CBKQXCYHEJHILG-INIZCTEOSA-N 332.444 1.927 10 10 EDCE CNC(=O)N[C@@H]1CCN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1680281279 XFVPEFRFGNOYRT-TZMCWYRMSA-N 333.436 1.527 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H](O)[C@H]3C)c(Br)cc21 1914304176 UJGNXBZJQBXORL-RDZIJCNDSA-N 340.221 1.621 10 10 EDCE O=C(O)C=Cc1ccc(N2CCCNC(=O)C2)cc1Br 1911983570 HNVZOZIBANFIEI-UHFFFAOYSA-N 339.189 1.873 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C1CC(O)C1 1914595904 KDJGBEPLZJXOND-LBVLNNNDSA-N 326.194 1.361 10 10 EDCE C[C@@H](O)c1ccc(N2CCOC[C@@H]2[C@H](O)CO)cc1Br 2146324241 TYDZYTQNNJTNFW-OWYVNGRQSA-N 346.221 1.061 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(F)cc2O)[C@H](O)C1 1972707882 ZWUAHDDYMLYSRH-UKRRQHHQSA-N 340.395 1.991 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985100628 IEHNHYAWPMRTHO-MXWKQRLJSA-N 327.385 1.562 10 10 EDCE COC(C)(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2004243310 NLWAKHLCWRNTIR-MJVIPROJSA-N 342.436 1.570 10 10 EDCE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010388619 FAGYMNRJZUXASO-VXGBXAGGSA-N 338.412 1.449 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](CO)(C(=O)Nc2ccc(N)cc2)C1 2022847083 WMOOLQJSLCPBIS-QGZVFWFLSA-N 335.404 1.827 10 10 EDCE Nc1ccc(OCC(=O)N=c2nc(Br)[nH]s2)cc1 2047600938 WRKUXAIOTIWDHS-UHFFFAOYSA-N 329.179 1.322 10 10 EDCE CN1CC[C@@H]2OCCN(c3ccc(CN)cc3Br)[C@@H]2C1 2185497269 PECLKHNHNWPTOC-CABCVRRESA-N 340.265 1.817 10 10 EDCE NCc1cc(F)c(N2C[C@H]3C[C@@]2(CO)CO3)cc1Br 2094651443 OADDIOBPAPVBJD-NOZJJQNGSA-N 331.185 1.387 10 10 EDCE COc1cc(N(C)Cc2c(Br)nnn2C)ccc1CN 2204554598 NTTZBLBIUOXRKG-UHFFFAOYSA-N 340.225 1.681 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@H](O)[C@H]2CF)c(Br)c1 2205600299 PKWAXLVCYODCSR-ULTHFGNCSA-N 347.228 1.609 10 10 EDCE CN(Cc1ccccc1)S(=O)(=O)N1CCc2cc(O)c(O)cc2C1 2302415493 QADHJZMHVJPRMI-UHFFFAOYSA-N 348.424 1.833 10 10 EDCE Cc1ccc(CN2C[C@@H]3CS(=O)(=O)[C@H]3C2)c(O)c1Br 2352623345 KWPRSWLPGOVYCK-MNOVXSKESA-N 346.246 1.692 10 10 EDCE COC(=O)[C@@H](N)CN(C)Cc1ccc(C)c(Br)c1O 2352645870 NZCOJZWWFJVWDH-JTQLQIEISA-N 331.210 1.395 10 10 EDCE CN1CCO[C@@H](CNC(=O)NCc2ccc(N3CCCC3)cc2)C1 170922738 KDKNTJLLNICZLO-KRWDZBQOSA-N 332.448 1.417 10 10 EDCE COc1cccc(CNCc2cccc(N3CCOCC3)n2)c1O 274845368 XASSUASHGBFIKG-UHFFFAOYSA-N 329.400 1.922 10 10 EDCE CC(C)CN1CCO[C@@H](CNC(=O)COc2ccc(N(C)C)cc2)C1 277694387 DRMPEBKVJMKYFZ-SFHVURJKSA-N 349.475 1.604 10 10 EDCE Cc1ccc(C(=O)N2CCN(CC(F)(F)F)C(=O)C2)c(O)c1O 286317954 FRGQTQPVPAHTQA-UHFFFAOYSA-N 332.278 1.253 10 10 EDCE Cc1ccc(CN2CCN(C3CNC3)CC2)c(O)c1Br 2381129579 MBDXBRWQHNRYEY-UHFFFAOYSA-N 340.265 1.553 10 10 EDCE COc1cc(Br)cc(CN(C[C@H](O)CO)C(C)C)c1O 817417786 PMYUBXAVMIEYMG-LBPRGKRZSA-N 348.237 1.727 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H](O)C1CCC1 826069391 WWFHWARVMQPENU-SFHVURJKSA-N 332.444 1.673 10 10 EDCE CO[C@@]1(CN[C@@H](C)c2cc(F)cc(F)c2O)CCS(=O)(=O)C1 903365419 NECSUHZGBINNTO-LKFCYVNXSA-N 335.372 1.525 10 10 EDCE C[C@]1([C@H]2CCCN(Cc3cc4c(cc3O)OC[C@H]4O)C2)COC(=O)N1 905700634 IPUPHPWZJLPFQY-WBHUJUFNSA-N 348.399 1.529 10 10 EDCE CCN(CC)c1ccc(CN(C)S(=O)(=O)c2cnc(N)nc2)cc1 913885883 KYJOCLRVXLJIDW-UHFFFAOYSA-N 349.460 1.726 10 10 EDCE COC[C@@H]1CCN1Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O 840084856 WSVKINQAMPOQTH-SFHVURJKSA-N 348.443 1.648 10 10 EDCE COc1cccc(CNS(=O)(=O)C[C@@]23CCCN(CC2)C3)c1O 914152681 HXEITZCWYOQBAS-INIZCTEOSA-N 340.445 1.306 10 10 EDCE Nc1ccc(CCNC(=O)N2CCC(Oc3cnccn3)CC2)cc1 841957343 ADWJUCZZZBZHJO-UHFFFAOYSA-N 341.415 1.854 10 10 EDCE COc1ccc(O)c(CN2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)c1 856534747 BQNVMJZJFZTLLT-JKSUJKDBSA-N 341.411 1.751 10 10 EDCE COCCN(CCF)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852450748 UMGJPMYYYLNMSJ-AWEZNQCLSA-N 339.411 1.901 10 10 EDCE Nc1cccnc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 865953023 AVMIALBGYSTKCW-UHFFFAOYSA-N 340.427 1.803 10 10 EDCE CCO[C@H](C(=O)NCc1ccc2cccnc2c1O)[C@@H]1CCOC1 868937977 PQQUFYLGDTVVLK-PBHICJAKSA-N 330.384 1.998 10 10 EDCE COCCNC(=O)C1CCN(Cc2cc3c(cc2O)CCC3)CC1 887564481 SLTZPISRMGUWJT-UHFFFAOYSA-N 332.444 1.856 10 10 EDCE Cn1ncc(Br)c1/C=C1/C(=O)NN(c2ccccc2)C1=O 782325054 KPFVVXYZBKIIIJ-YFHOEESVSA-N 347.172 1.644 10 10 EDCE C[C@@H]1C(=O)Nc2cc(C(=O)NCc3ccc(O)cc3O)ccc2N1C 1142532952 ALHHWVCVCOQGME-SNVBAGLBSA-N 341.367 1.805 10 10 EDCE CN(C)Cc1nc(C(C)(C)NC(=O)Cc2ccc(O)c(O)c2)no1 1143034465 LEXMNQXAEWQWEG-UHFFFAOYSA-N 334.376 1.136 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nnn2cc(C)nc(O)c12 1140203803 PCAMCOTYYICOMH-UHFFFAOYSA-N 348.359 1.260 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@H](O)Cc1ccc(F)cc1 1155514796 YRBLCPHILFJJKW-UFRMUOTOSA-N 331.343 1.970 10 10 EDCE COC(=O)c1c(NC(=O)c2ccc(C)c(O)c2O)nc2n1CCC2 1301521304 DPMAQSVVFSKYLO-UHFFFAOYSA-N 331.328 1.588 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CN2CCCC2=O)cc1C 1321455122 IFDOSCYXMUQSHY-CQSZACIVSA-N 333.432 1.220 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)[C@H]2CCNC2=O)C2CC2)cc1C 1323050245 GLXIMKKVLSGGMC-HOTGVXAUSA-N 345.443 1.124 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC(=O)N3CCCC3)C2)cc1 1350371956 VQYWHDXMASTZLP-CQSZACIVSA-N 346.431 1.196 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)CCc2nc[nH]n2)cc1C 1282112700 MVQBPTFFGACIDM-UONOGXRCSA-N 345.447 1.737 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCn1cnnc1 1449823304 HSJYQRCBRDGCEM-UHFFFAOYSA-N 337.383 1.928 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)Nc2nc(C3=S=CC=C3)n[nH]2)cc1 1457550522 DEHDUBRNEKPTFO-UHFFFAOYSA-N 341.356 1.845 10 10 EDCE O=C(NCc1nc(O)c2c(n1)CCOC2)N1Cc2cccc(O)c2C1 1471150353 XCTNLDWVACOWBY-UHFFFAOYSA-N 342.355 1.186 10 10 EDCE COc1ccc(CNC(=O)c2ncc(Br)cn2)c(O)c1 1617763526 YECUYKNHSRFZIW-UHFFFAOYSA-N 338.161 1.883 10 10 EDCE O=C(Nc1ccc(NC(=O)c2nsnc2O)cc1)C1=S=CC=C1 1626550163 WJFMLLDLHMZHQT-UHFFFAOYSA-N 346.393 1.712 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2cnon2)C2CC2)cc1C 1713121238 RKFCEVIYVDLSKS-CQSZACIVSA-N 330.388 1.685 10 10 EDCE CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(O)c1)[C@@H]1CCCOC1 1633782069 KENJQMBUVVEAAW-MLGOLLRUSA-N 337.372 1.115 10 10 EDCE CC1=C(C(=O)NCc2ccc(N(C)C)c(F)c2)S(=O)(=O)CCO1 1631438735 YOBHJUNTQMPAOK-UHFFFAOYSA-N 342.392 1.184 10 10 EDCE O=C(CCc1nc(-c2ncccn2)no1)N1Cc2cccc(O)c2C1 1650674512 FTFMLGWAMRFMMT-UHFFFAOYSA-N 337.339 1.707 10 10 EDCE CC(C)(O)CN1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1584199570 VRCSHDYHRJMOOD-UHFFFAOYSA-N 333.392 1.378 10 10 EDCE CN(Cc1ccccc1O)c1nnc(C2CC2)n1C[C@]1(O)CCOC1 1768681860 OQECWFHPGNUMOR-GOSISDBHSA-N 344.415 1.649 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2CN(C)C(=O)N2)cc1C 1690857111 CFCBGAICXBTZAW-HIFRSBDPSA-N 348.447 1.012 10 10 EDCE Cc1ccc(/C=C2\SC(=S)N(CC(=O)NCCCO)C2=O)o1 16905443 DKSDDFDJKIKCJD-XFFZJAGNSA-N 340.426 1.288 10 10 EDCE Oc1cc(Br)ccc1CN1CCO[C@@H]2CCNC[C@@H]21 2129071688 MMEFHVXRGXIUQJ-GXTWGEPZSA-N 327.222 1.717 10 10 EDCE [N-]=[N+]=NC[C@@H]1CCCN(C[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1 1912173620 OOODYAFAYUYYIX-QWHCGFSZSA-N 343.387 1.666 10 10 EDCE CON(CCNCc1ccc(O)c(O)c1O)C(=O)OC(C)(C)C 1936452500 MYYDTOVKCJJLFU-UHFFFAOYSA-N 328.365 1.692 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)[C@H](N)Cc1ccc(O)c(O)c1 1952710792 OIFGMXXQVOWPQP-BXUZGUMPSA-N 326.393 1.507 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CN1CC[C@H](NC(=O)OC(C)(C)C)C1 1985094434 OVXCOFJSFZBXOH-NSHDSACASA-N 326.401 1.354 10 10 EDCE CC(C)(C)OC(=O)N1CC(C)(C)OC[C@@H]1C(=O)NCCN=[N+]=[N-] 1985094419 OLHQZRLHVACHLF-SNVBAGLBSA-N 327.385 1.827 10 10 EDCE C[C@@H](CNC(=O)COc1ccc(N)cc1)CNC(=O)OC(C)(C)C 1999131736 LLXUZSLUXJEYCB-LBPRGKRZSA-N 337.420 1.925 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(C(=O)Cc3ccc(N)cc3)C[C@@H]21 2000278204 HZOHNLLBBMZQPI-FOLVSLTJSA-N 331.416 1.793 10 10 EDCE O=C1N=C(N2CCOCC2)SC1=Cc1cccc2c1OCCO2 2041734838 YYMWIXADZRKAIW-UHFFFAOYSA-N 332.381 1.760 10 10 EDCE CN(C)C[C@@H]1CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2160881886 ITMBMKHWMKTGNE-SDBXPKJASA-N 339.237 1.541 10 10 EDCE NC[C@@H]1CN(Cc2cc(Cl)cc(Br)c2O)CCO1 708090125 NMGIGTVEHZBBKG-SNVBAGLBSA-N 335.629 1.968 10 10 EDCE CC[C@H](NCCn1ncnn1)c1cc(Br)ccc1O 379904640 IPPZLDYAHKHBPI-NSHDSACASA-N 326.198 1.882 10 10 EDCE C[C@]1(NCc2ccc(Br)cc2O)CCS(=O)(=O)C1 691500111 AWLVCSNDGVMZAH-LBPRGKRZSA-N 334.235 1.822 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@]3(C)CCO[C@@H]3C3CC3)c2n1 2062658869 WPFUJVGUBPYEIP-RHSMWYFYSA-N 330.388 1.678 10 10 EDCE CN1C(=O)O[C@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@@H]21 2176933871 STPNPVJLNAOUTK-QWRGUYRKSA-N 345.168 1.929 10 10 EDCE NCc1ccc(N2C[C@H]3CS(=O)(=O)C[C@@H]3C2)c(Br)c1 2087857766 CPBIMBDSWRUNBP-QWRGUYRKSA-N 345.262 1.389 10 10 EDCE CS(=O)(=O)CCN(c1ccc(CO)c(Br)c1)C1CC1 2113814560 UYKQMQZEVLJDEY-UHFFFAOYSA-N 348.262 1.955 10 10 EDCE COc1ccc(N2CC(O)(CNC(=O)OC(C)(C)C)C2)c(OC)c1 2214254151 CEPHTHHQRLBNQV-UHFFFAOYSA-N 338.404 1.780 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3COC[C@]3(CO)C2)cc1Br 2234566784 MDNMCEHPEREWNM-JRPNMDOOSA-N 342.233 1.948 10 10 EDCE NCC[C@H](COCc1ccccc1)NC(=O)c1cc(O)c(O)c(O)c1 2320617572 XPBKQPNDLIGIAH-CQSZACIVSA-N 346.383 1.467 10 10 EDCE Cc1ccc(CNS(=O)(=O)[C@H](C)CN)c(O)c1Br 2327594405 MXWPFFOIFKBZAB-MRVPVSSYSA-N 337.239 1.230 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)cc1Br 2331967796 YCGLKCYBBGONCR-CABNGKKXSA-N 327.222 1.371 10 10 EDCE NC(=O)[C@@H]1CN(c2ccc(CO)cc2Br)CC12CC2 2344332362 KCAKXIIPTQANPX-JTQLQIEISA-N 325.206 1.643 10 10 EDCE Cc1ccc(CNC(=O)[C@H](N)C(C)(C)O)c(O)c1Br 2352643508 PJGJPTYOFONLRR-NSHDSACASA-N 331.210 1.178 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(N)cc1 170318326 SWQJXAWNHSSLSQ-UHFFFAOYSA-N 342.311 1.695 10 10 EDCE NCc1cc(F)c(N2CC3(CC[C@H](CO)O3)C2)cc1Br 2361874400 WYKMMTDOAQXWMN-SNVBAGLBSA-N 345.212 1.777 10 10 EDCE COc1ccc(CN2CCCN(CC(=O)N3CCCC3)CC2)c(O)c1 129331717 FEQJWDQDCLLQDS-UHFFFAOYSA-N 347.459 1.531 10 10 EDCE CCN(CC)c1ccc(CNC(=O)CN2C(=O)NC(C)(C)C2=O)cc1 79390057 WFJZHWCNUCNYHX-UHFFFAOYSA-N 346.431 1.479 10 10 EDCE CC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(O)c(Cl)c2)s1 228651535 ZHHGTDYEHPIYNU-UHFFFAOYSA-N 348.793 1.656 10 10 EDCE COC(=O)c1ccccc1CS(=O)(=O)NCCc1ccc(N)cc1 193338903 PYTQTPOYEGWSPA-UHFFFAOYSA-N 348.424 1.718 10 10 EDCE CCO[C@@H]1C[C@@H](NCc2cc3c(cc2O)OCO3)[C@@H]1n1cccn1 815166748 IXSHFHDIVXYELC-JLZZUVOBSA-N 331.372 1.826 10 10 EDCE CO[C@@H](CS(=O)(=O)NCc1ccc(N(C)C)cc1C)C1CC1 827160509 RIVBCHUSUOQKMT-INIZCTEOSA-N 326.462 1.905 10 10 EDCE CC(=O)[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)C 828782723 XZMRJGVHNPCBRT-ZDUSSCGKSA-N 329.374 1.534 10 10 EDCE C/C(=C/C(=O)NCc1ccc(N(C)C)cc1C)CN1CCOCC1 900733542 XGTBWTYFGVIHPC-PTNGSMBKSA-N 331.460 1.956 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCCC[C@H]2C2(O)CC2)cc1 839618516 LAYRIBFNKNGLCS-KRWDZBQOSA-N 331.460 1.748 10 10 EDCE C[C@H]1C[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)c2ncnn21 849360244 ZWQNGWXOUZEGNV-JQWIXIFHSA-N 327.344 1.454 10 10 EDCE C[C@H]1CCN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCO1 924007552 OFHRMAKGDPDXCS-INIZCTEOSA-N 346.475 1.759 10 10 EDCE CCOC(=O)C1=CC[C@@H](NC(=O)NCc2ccc(OC)cc2O)C1 858788825 ZOYLXBHKWGXAKV-CYBMUJFWSA-N 334.372 1.852 10 10 EDCE COc1cccc(CNC(=O)c2cn3c(n2)C[C@@H](OC)CC3)c1O 866765031 ZYPFITJEFVOGLB-LBPRGKRZSA-N 331.372 1.489 10 10 EDCE C[C@H](NC(=O)NCCN1CCN(C)C(C)(C)C1)c1ccccc1O 868578724 HZZQIMJOZAGLEJ-AWEZNQCLSA-N 334.464 1.778 10 10 EDCE CCn1cc(CC(=O)N2CCCN(c3ccc(OC)cc3)CC2)nn1 930310420 XPKJHPHGQRDTQL-UHFFFAOYSA-N 343.431 1.588 10 10 EDCE Cc1nnc(NNC(=S)Nc2ccc3c(c2)OC(F)(F)O3)n1C 863206423 RUBCLLDZUOBFHC-UHFFFAOYSA-N 342.331 1.759 10 10 EDCE CC[S@@](C)(=O)=NS(=O)(=O)NCc1ccc2c(c1)CCCN2C 866674213 VMGFRMQLNMURKV-OAQYLSRUSA-N 345.490 1.521 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)[C@@H](C)O)CCCC1 871141622 SHUIKKUZDPHVKG-KZULUSFZSA-N 346.427 1.387 10 10 EDCE O=C(NCC1(CO)CCOCC1)c1cc2cc(O)c(O)cc2s1 897153154 AMATZQRUWHFNDA-UHFFFAOYSA-N 337.397 1.831 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1ccnc(N2CCOCC2)c1 1136142175 TVXGFVPDURUIAR-UHFFFAOYSA-N 343.383 1.188 10 10 EDCE COc1ccc(N2CCN(c3ncccn3)CC2)c2c1CNCC2 82799622 ZYGHCJLOMFEZSS-UHFFFAOYSA-N 325.416 1.458 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cnn(C)c3N)CC2)cc1C 1323424133 PJYDBXQFVIWIMZ-UHFFFAOYSA-N 343.431 1.372 10 10 EDCE CN(OCC(F)(F)F)C(=O)CNC(=O)NCc1ccccc1O 1334655477 AFDMGKWRDVSJCI-UHFFFAOYSA-N 335.282 1.144 10 10 EDCE CC[C@@]1(C(=O)N[C@@H](C)CNCc2ccc(OC)c(C)c2)CCNC1=O 1268691034 ZGNXPAGSFUYADT-IFXJQAMLSA-N 347.459 1.514 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1C[C@H]2CCC[C@H]21 1354610951 AAMFFAFOWLKHAV-KBAYOESNSA-N 339.439 1.984 10 10 EDCE C[C@@H](NC[C@@H]1CN=C(c2cnn(C)c2)O1)c1ccc(N(C)C)cc1 1354624803 AAHXNHOHUYPYQD-CXAGYDPISA-N 327.432 1.982 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](NS(C)(=O)=O)C(C)C 1449122437 PHGYPYFCATVHRU-ZDUSSCGKSA-N 349.449 1.068 10 10 EDCE Cc1cnc2c(cnn2CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 1296245072 BRCVVGASEBSMQR-GFCCVEGCSA-N 340.383 1.898 10 10 EDCE CC(C)C(=O)NC[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1532115682 LIRQWZRDCGXCGN-NSHDSACASA-N 333.392 1.987 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc(-n2ccnn2)ccc1F 1557085546 PJZNFZDLSIDGLO-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE NC(=O)c1ccc(CC(=O)NCc2ccc3cccnc3c2O)cn1 1557123537 QAZFRRODVYYJSK-UHFFFAOYSA-N 336.351 1.293 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@H]2COCCO2)C2CC2)cc1C 1498734131 YVIYWQVDHXOTNJ-SJLPKXTDSA-N 348.443 1.403 10 10 EDCE CS(=O)(=O)c1ccccc1CNC(=O)/C=C\c1ccc(O)c(O)c1 1630013955 VJDUNJOWVMHQDT-CLFYSBASSA-N 347.392 1.831 10 10 EDCE CC(C)(C)C(=O)Nc1nccnc1C(=O)NCc1c(O)cccc1O 1647269714 KCSDIKLQAYXKIS-UHFFFAOYSA-N 344.371 1.802 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)C(N)=O)c2ccccc2)cc1C 1664587831 ILEQZNVSZBVYLJ-INIZCTEOSA-N 341.411 1.436 10 10 EDCE CO[C@H](C)C(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1689439583 OTOIQZJQJXHDOC-VHSXEESVSA-N 335.364 1.118 10 10 EDCE CO[C@H](C)CNC[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1698776964 LIOXCODXAWCFCZ-VXGBXAGGSA-N 335.408 1.839 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3ccncc3)CC2)cc1 28476311 FCHSRCPWEMMVOW-UHFFFAOYSA-N 340.427 1.642 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CCNCc2cccc(F)c2O)C1 1940385422 RNZFBJFBKIETKV-UHFFFAOYSA-N 340.395 1.993 10 10 EDCE COCCNCc1ccc(N(CC(N)=O)Cc2ccccc2)cc1 1946836780 AFLMEJSUDYWFNK-UHFFFAOYSA-N 327.428 1.915 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985103524 WOBHEIPIDHXTCS-UWVGGRQHSA-N 327.385 1.562 10 10 EDCE NCc1cc(F)c(N2C[C@]3(CO)C[C@@]3(CO)C2)cc1Br 2146318193 JWGDMAULIGJCKI-KBPBESRZSA-N 345.212 1.228 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CNCc2c(O)cccc2F)[C@@H](O)C1 1997945143 HKYRPJPDFDJUBJ-NHYWBVRUSA-N 340.395 1.849 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3OCCN(C)[C@H]3C2)cc1Br 2153995290 QEKPOECYLYAJLZ-LKTVYLICSA-N 340.265 1.988 10 10 EDCE N[C@@H]1COCCN(Cc2cc(Cl)cc(Br)c2O)C1 2034722377 HDKFYNUMDGENKP-JTQLQIEISA-N 335.629 1.968 10 10 EDCE C[C@H](N)c1ccc(N2CCN3C[C@@H](O)C[C@H]3C2)cc1Br 405388417 LRBICTBYEKCTLZ-DRZSPHRISA-N 340.265 1.724 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@](O)(CO)C2)c(Br)c1 313787827 DFIGGDWIBBJOHU-QMTHXVAHSA-N 329.238 1.792 10 10 EDCE CCNCc1ccc(N2CC(OC)(C(N)=O)C2)c(Br)c1 2161183546 LGBZMDHQRPVHJB-UHFFFAOYSA-N 342.237 1.249 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N(C)C[C@](C)(O)c3ccccc3)c2n1 2062858729 HSWIKKZYYCLYRT-SFHVURJKSA-N 340.383 1.723 10 10 EDCE CS(=O)(=O)c1cnn(Cc2c(O)cccc2Br)c1N 2070220569 XQKZGNHQTOVMHS-UHFFFAOYSA-N 346.206 1.385 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CN(C(=O)COc3ccc(N)cc3)C[C@@H]21 2045668479 REDPZAXDVCGDSK-MIFYACCESA-N 347.415 1.629 10 10 EDCE NCCN1CCN(Cc2cc(Br)cc(F)c2O)CC1 2100778695 UZKJAGHHMDSRCL-UHFFFAOYSA-N 332.217 1.370 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)c(Br)c2)[C@@H]2COC[C@@H]12 2102140502 IQHBHXNSUXOSFW-MRVWCRGKSA-N 327.222 1.758 10 10 EDCE CN(CCn1cnc(C(=O)NCCN=[N+]=[N-])c1)C(=O)OC(C)(C)C 2213271131 NVMGQYPOCVZUEJ-UHFFFAOYSA-N 337.384 1.790 10 10 EDCE C[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2273244023 LTJLYRWAMZQEJR-HQDFOZKBSA-N 327.178 1.394 10 10 EDCE C[C@H](NCCS(=O)(=O)N1CCSCC1)c1ccccc1O 183502885 KNNPQUHQOUAFON-LBPRGKRZSA-N 330.475 1.421 10 10 EDCE COc1ccc(O)c(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1 180755750 NGDNJIGFFDLFPT-HNNXBMFYSA-N 340.445 1.401 10 10 EDCE O=S(=O)(NCc1ccc(N2CCCC2)cc1)NCC(F)(F)F 195093752 HHZMGDPWEZQDLC-UHFFFAOYSA-N 337.367 1.773 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@@]4(CCCOC4)C3)cc2N1 368542826 FKUCCYACJRJFRP-INIZCTEOSA-N 349.343 1.312 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C 808500610 SIWMNUPKZVGGSI-CQSZACIVSA-N 349.383 1.824 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1CC(C)(O)C1 828519568 SWDYZAZBLMMLKA-UHFFFAOYSA-N 341.791 1.708 10 10 EDCE CCOC(=O)[C@H]1CCCN(CC(=O)N[C@@H](C)c2ccccc2O)C1 913763664 NJRGWOYLWPPRJT-KBPBESRZSA-N 334.416 1.845 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CNC(=O)N3CCCC3)C2)cc1 912292374 LVBHUTZFHGLXGK-CQSZACIVSA-N 346.431 1.196 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CNCC[C@@H]1C 842266636 WIJPHUDQVKHSIP-ZFWWWQNUSA-N 333.432 1.245 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)N[C@@H](CC(F)F)C3=O)C2)cc1 924977309 HPOJSICOSLRCKZ-YPMHNXCESA-N 339.342 1.850 10 10 EDCE CCNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nn1 853759431 UONLJJNULPFFEE-CYBMUJFWSA-N 341.415 1.926 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)c3cnn(C)c3)C2)cc1 855232415 TTWLMGSHHNMLIO-UKRRQHHQSA-N 328.416 1.927 10 10 EDCE Cc1cc(CC(=O)N[C@@H]2COCC[C@H]2O)c(C)n1-c1ccccc1 871191867 WNWIXUJRHYWPET-QZTJIDSGSA-N 328.412 1.903 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2cnc[nH]2)N(C)C)cc1 891245774 IZLOWUIFWKEIKN-NUJGCVRESA-N 341.459 1.998 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2CC[C@H]2C(N)=O)cc1C 1268572606 MNHCVESOJDGSEH-JGPFYOFESA-N 345.443 1.277 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(NC2CCOCC2)CC1 1349302020 YFGICGSKMQUSBW-RQOWECAXSA-N 346.427 1.871 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CNCc2ccc(O)cc2O)C1 1251452785 DJQKKNDNQAEDGK-QGZVFWFLSA-N 338.404 1.559 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cnn[nH]3)CCC2)cc1C 1273113271 DNFQTCXENJPHBU-UHFFFAOYSA-N 329.404 1.564 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C(=O)c1cnn(C)c1 1351162995 LNBLHZOTJBRMEE-UHFFFAOYSA-N 326.400 1.862 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1507083448 SGVNOOPGUXKVNU-GDBMZVCRSA-N 347.459 1.418 10 10 EDCE COCCCC(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1285710829 NAASBEDPCXGBRR-NSHDSACASA-N 349.391 1.510 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CC1=O 1294085436 YMLOKCRBSSTCBS-WQAKAFBOSA-N 329.360 1.588 10 10 EDCE CS(=O)(=O)c1ccc(CCC(=O)NCc2ccc(O)c(O)c2)cc1 1465954107 MRNNGJBHPYYPCR-UHFFFAOYSA-N 349.408 1.750 10 10 EDCE CC(C)(O)[C@H]1CN(c2ccc(CO)cc2Br)CCO1 2117518128 VMBLMTFIJKBJLJ-CYBMUJFWSA-N 330.222 1.918 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cn([C@@H]2CC[C@H]2O)nn1 1627028820 PIWICVXGGFUXBE-VXGBXAGGSA-N 337.376 1.095 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2(N3CCOCC3)CC2)cc1 1626677503 SJROYFISLHUCMO-UHFFFAOYSA-N 331.376 1.444 10 10 EDCE CN1C(=O)[C@@H](NC(=O)Cc2ccc(O)c(O)c2)Cc2ccccc21 1557448770 LNDPLKXVYIWWJP-ZDUSSCGKSA-N 326.352 1.344 10 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CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2012344406 ZRFITEQDLFPUIY-VXGBXAGGSA-N 341.412 1.954 10 10 EDCE CCNCc1ccc(N2CC(NC(C)=O)C2)cc1Br 387984879 RJDMJMQORPVLOK-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)C[C@]2(C)CO)c(Br)c1 698134494 AZNGAFFHKAIKCR-GLXFQSAKSA-N 329.238 1.791 10 10 EDCE CNC(=O)[C@H]1CCN(c2cc(Br)c(CN)cc2F)C1 398526592 VSHLYYJMKKVJFZ-QMMMGPOBSA-N 330.201 1.619 10 10 EDCE CN1C[C@@H](C(=O)NCc2c(O)cc(O)cc2O)[C@@H](C(F)(F)F)C1 2063152150 APFTWZMFORYOBW-ZJUUUORDSA-N 334.294 1.160 10 10 EDCE COc1ccc([C@@H](C)n2nc(C(F)(F)F)c(C(N)=O)c2N)c(O)c1 2079848161 DMPFGZVOVULZIS-ZCFIWIBFSA-N 344.293 1.907 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)c1nc(=NCc2ccc(O)cc2O)[nH][nH]1 2066590852 WDSIAWVOWJPMTG-SECBINFHSA-N 349.391 1.836 10 10 EDCE NCc1ccc(N2CC[C@]3(C[C@H](O)CO3)C2)c(F)c1Br 2201772197 NXQUZTUFLLVJRF-HZMBPMFUSA-N 345.212 1.777 10 10 EDCE O=C(O)CO[C@@H]1CCN(Cc2ccc(Br)cc2O)C1 2096821013 UFLSUUYSLIXAKJ-LLVKDONJSA-N 330.178 1.830 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CN(CCCN=[N+]=[N-])C[C@H]2[C@@H]1CO 2211158658 QFOKUOLAESNMIS-XQQFMLRXSA-N 325.413 1.846 10 10 EDCE CS(=O)(=O)[C@@H]1COC[C@@H]1NCc1cc(Cl)cc(Cl)c1O 2207470565 MJQHAYDLPCMKNC-WDEREUQCSA-N 340.228 1.601 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2225798917 IJCLBQVGKAQAQM-SFYZADRCSA-N 349.214 1.692 10 10 EDCE CC(C=C1SCCN1C)=C1SC(=S)N(CC(=O)O)C1=O 2297533043 LNKNWPNGZMWPFA-UHFFFAOYSA-N 330.456 1.725 10 10 EDCE COC(=O)[C@H](O)CNC(=O)C=Cc1cc(C)n(-c2ccccc2)c1C 2308009182 BKYBFBGKIZAIIO-QGZVFWFLSA-N 342.395 1.757 10 10 EDCE NCc1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)c(Br)c1 2314733412 KLTHYGODKGKYOP-BXKDBHETSA-N 331.235 1.141 10 10 EDCE Cc1ccc(CN2CC[C@H](CO)[C@H](N)C2)c(O)c1Br 2352680605 RIQZPQSELPNGNZ-VXGBXAGGSA-N 329.238 1.605 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@@H](O)[C@H]3C4)c(Br)cc2[C@@H]1O 2355623293 FTYCVHZLBYNCJY-FTRPCTHQSA-N 339.189 1.394 10 10 EDCE COc1ccccc1N1C(=O)[C@@H](CN2CCOCC2)SC1=S 59397368 LZXSRHUOPGWNCQ-CYBMUJFWSA-N 338.454 1.761 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)NCc2ccc(N(C)C)cc2)c1 110181835 HQGHQIYYMQGREW-RMKNXTFCSA-N 338.411 1.837 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)CN(C)S(=O)(=O)CC 175255188 GDMCLGBMWOSXOO-UHFFFAOYSA-N 328.434 1.412 10 10 EDCE NCc1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(F)c1Br 2357592653 LOLNESDBYYDTBP-XQJPUGBWSA-N 345.212 1.367 10 10 EDCE CC[C@H]1CN(Cc2ccc(N3CCOCC3)cc2)CCN1C[C@H](C)O 245712981 GHSMJZACNAKIOD-HKUYNNGSSA-N 347.503 1.800 10 10 EDCE CCCNC(=O)[C@H]1C[C@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 244532041 ZTQAWBSEBZXERG-DLBZAZTESA-N 345.443 1.506 10 10 EDCE COc1cc(N2CCN(CCCO)CC2)c([N+](=O)[O-])cc1OC 271068377 VANYMZYZPGQFPL-UHFFFAOYSA-N 325.365 1.116 10 10 EDCE Cc1ccc(CNC(=O)[C@H](C)N2CC(N)C2)c(O)c1Br 2381131710 RHANPJSBFMROMN-VIFPVBQESA-N 342.237 1.111 10 10 EDCE O[C@H](CNCc1ccc(N2CCOCC2)c(F)c1)Cn1cccn1 818967310 SOXWXWWTEQIJEV-OAHLLOKOSA-N 334.395 1.010 10 10 EDCE Cc1nn(C)c(C)c1CCN1C(=O)CN(Cc2ccccc2O)C1=O 819164367 HJTXXIOFHCGZJG-UHFFFAOYSA-N 342.399 1.749 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3C[C@@H]4C[C@]4(CO)C3)C2)cc1 824685510 FTAOJUSVDJEYGV-ZRGWGRIASA-N 345.443 1.545 10 10 EDCE CN(C)CCN1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 900007416 NBQLJPMRTQPCNZ-UHFFFAOYSA-N 349.456 1.632 10 10 EDCE CCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N(C)C)cc1C 734405084 AWGDNNGCMAQIHM-HNNXBMFYSA-N 335.473 1.989 10 10 EDCE CCOc1cccnc1C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832267395 RNCQMEJBESCXLB-HNNXBMFYSA-N 328.416 1.976 10 10 EDCE Nc1ccc(CCNC(=O)N2CC[C@H](Nc3ncccn3)C2)cc1 831178814 ZJDGSLTZYSQSTK-HNNXBMFYSA-N 326.404 1.497 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CC[C@@H]3C(=O)O)CC2)c(OC)c1 911165439 KLHJNOCACIISLL-KGLIPLIRSA-N 348.399 1.463 10 10 EDCE CO[C@@H](CN1C(=O)CN(Cc2ccccc2O)C1=O)[C@H]1CCOC1 849357479 MPCAPMXHWHIKLL-ZFWWWQNUSA-N 334.372 1.208 10 10 EDCE CC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)NCc3c(O)cccc3F)[C@H]2C1 922506627 LYSNHWCXUVLZME-DUVNUKRYSA-N 349.406 1.978 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(C=O)n(C)n1 929538023 XNUGPMWBDAPQPG-UHFFFAOYSA-N 342.399 1.341 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](OC)C3CC3)C2)cc1 852357822 IIMAETHYBJGRMI-WMLDXEAASA-N 333.432 1.998 10 10 EDCE C[C@@H](NC(=O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(N(C)C)cc1 922055995 VLRRMXUYWZPXPO-IRWJRLHMSA-N 333.432 1.917 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C[C@@H]1CCC2(CNC2)O1 852746112 IMJFIPFBDRYHLH-SFHVURJKSA-N 331.460 1.476 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CC[C@@H]3C[C@@H]3C2)c1 862374719 PSZSRGKSVAGTIJ-UTUOFQBUSA-N 338.429 1.930 10 10 EDCE COC(=O)CCNC(=O)CCNCc1cc(Cl)cc(OC)c1O 862528140 QWDGQWFLMSRHJS-UHFFFAOYSA-N 344.795 1.213 10 10 EDCE CCOc1ccc(O)c(CN[C@H]2CCN(C3CCOCC3)C2=O)c1 776230555 LBICICCRIMXYCV-INIZCTEOSA-N 334.416 1.660 10 10 EDCE O=C(OCC(=O)N1CCO[C@@H]2CCCC[C@H]21)c1cccc(O)c1O 776282127 PGIAANDXHPONKX-TZMCWYRMSA-N 335.356 1.425 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@]34CCC[C@H]3OCC4)nc12 872315255 QLAAZNMAOGJRJP-DYVFJYSZSA-N 346.387 1.413 10 10 EDCE O=C(c1cccnc1N1CCOCC1)N1Cc2cccc(O)c2C1 871199009 RBDQWPNVUHPTBT-UHFFFAOYSA-N 325.368 1.780 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3C[C@H](C)CO3)cc2)CC1 890129159 CVWFLLJLVPUWJR-KSSFIOAISA-N 345.443 1.396 10 10 EDCE Cn1c(CC(=O)NCc2ccc(O)c(O)c2)nnc1-c1ccccc1 1150378340 PUTIGYBVKIIQGJ-UHFFFAOYSA-N 338.367 1.752 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CNC(=O)C(C)(C)C)cc1C 1317291965 XQVJSXNIZNXXNB-AWEZNQCLSA-N 349.475 1.760 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2nc(-c3ccncc3)n[nH]2)c1 1312886926 WIMOQFRGADWLHI-UHFFFAOYSA-N 338.371 1.880 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1C[C@H]2CC[C@H]1C2 1323004388 LCIGMYYJVAINRG-XYJFISCASA-N 339.439 1.984 10 10 EDCE Cc1cnn(Cc2cc(C(=O)NCc3c(O)cccc3O)no2)c1 1178910390 DUAGRPCEQCFSNM-UHFFFAOYSA-N 328.328 1.569 10 10 EDCE CC[C@@H]1COC(C)(C)CN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1329497540 QMRHNYNBWUZOPH-CYBMUJFWSA-N 332.400 1.650 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)C2(C(N)=O)CC2)cc1C 1322672070 CISLUCMRBTZUFO-UHFFFAOYSA-N 333.432 1.207 10 10 EDCE COc1ccc(CN[C@@H](C(=O)O)[C@@H]2CCCO2)cc1Cn1cccn1 1352081004 IRLUKQWZFZENEV-DLBZAZTESA-N 345.399 1.662 10 10 EDCE CCC1(NCc2ccc(OC)c(C)c2)CCN(C(=O)C(N)=O)CC1 1273782540 KAPCZMNMLVWMDA-UHFFFAOYSA-N 333.432 1.350 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2C(=O)NC3)c(F)c1Br 2115748473 BSEROPMYJLKQEZ-WPRPVWTQSA-N 328.185 1.514 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCOC[C@@H]1C[C@@H](O)c1ccco1 1445635993 ZZQFKNDWAHGQHA-XJKSGUPXSA-N 347.367 1.584 10 10 EDCE CS(=O)(=O)[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1447358238 FBZZIRVDOLAYGM-LBPRGKRZSA-N 338.389 1.498 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(C)n1C 1611049084 FEWXCWPIQNTIPL-LBPRGKRZSA-N 347.371 1.044 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)c2nccnc2N)cc1C 1700393066 QJLJDWQZJRWCTD-OLZOCXBDSA-N 343.431 1.672 10 10 EDCE COc1ccc(CNC(=O)Cc2nc(C3CCOCC3)n[nH]2)c(O)c1 1556354746 SRYLXAASVZTQMR-UHFFFAOYSA-N 346.387 1.272 10 10 EDCE Cn1nc(Br)cc1C(=O)NCc1ccc(O)cc1O 1557084986 WYHKSFPHQUQZEY-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1cnn(C)n1 1624656854 XAKDPSNNLKCNBB-UHFFFAOYSA-N 337.383 1.965 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H](NC(C)=O)C(C)C)cc1C 1716460382 RKFPTINKJXGEGK-KBXCAEBGSA-N 349.475 1.759 10 10 EDCE C[C@H]1CN(c2ccc(CN)c(Br)c2)C[C@@H](CCO)O1 2122799873 NVXRMKPLTSDKOK-GXFFZTMASA-N 329.238 1.884 10 10 EDCE CC[C@@H](OC)C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1720037813 YGLOFBGRVDFGJV-GFCCVEGCSA-N 335.364 1.120 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H]2CCN(C)C2)cc1C 1568317412 OFJCQYOFOHTCAP-NVXWUHKLSA-N 333.476 1.892 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1C 1723515879 YFDNCWIKVACPIZ-ZIAGYGMSSA-N 333.388 1.407 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCN2C(=O)CCCC2=O)cc1 1565893566 WFBZCPWTWJSQAD-UHFFFAOYSA-N 331.332 1.118 10 10 EDCE C[C@H](CCNC(=O)c1ccc(N=NC(N)=O)cc1)NCC(=O)N(C)C 1731740467 UWGYZISVWDFMKM-LLVKDONJSA-N 348.407 1.035 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C(=O)NCC2CC2)cc1C 1732913426 BJVIKYYDSRDOON-ONEGZZNKSA-N 345.443 1.292 10 10 EDCE CC1=C(C(=O)NCc2cc(O)ccc2O)[C@H](C)n2ncnc2N1C 1651225329 FXNSBLRNNICVKG-JTQLQIEISA-N 329.360 1.291 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)Cc3cnc[nH]3)C2)cc1C 1656160930 YOOJWQMMXQAGRI-IYBDPMFKSA-N 342.443 1.954 10 10 EDCE O=C(Cn1ccc(O)nc1=O)NCc1c(O)ccc2ccccc12 1652705606 LAIMQICJMGIXBJ-UHFFFAOYSA-N 325.324 1.124 10 10 EDCE CSCC(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1759760788 KUICHCNYVIJFGH-SECBINFHSA-N 337.405 1.447 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)Cn2ccnc2)cc1C 1676488335 PBCSMLJMPQGNNO-OAHLLOKOSA-N 330.432 1.837 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1C[C@H]1C)NC(=O)c1cc(OC)nc(OC)c1 1688765525 IFULWDALYNETCA-KGYLQXTDSA-N 335.404 1.379 10 10 EDCE COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1C(=O)/C=C\c1ccc(O)c(O)c1 1772927807 LQYKDEREGPUPQZ-NSQDKOMVSA-N 331.368 1.911 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@@H]3OCCN(C)[C@H]3C2)c([N+](=O)[O-])c1 153165620 GAYOOTSJDUQVMI-IRJXADNDSA-N 347.371 1.300 10 10 EDCE Cc1ccc(O)c(CNCC(=O)Nc2nc3c(s2)CN(C)CC3)c1 1857876770 QGTPUMFMNUPGCR-UHFFFAOYSA-N 346.456 1.873 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@]1(CO)C(=O)N1CC(N=[N+]=[N-])C1 1985094508 PWPZXEYUQHDDQJ-CQSZACIVSA-N 325.369 1.270 10 10 EDCE CNCc1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)cc1Br 2146312601 YDQCSPXPLLUVDJ-GASCZTMLSA-N 341.249 1.350 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 2010045918 TVLWFGXMMXQLLX-ZDUSSCGKSA-N 340.376 1.480 10 10 EDCE O=C(O)C[C@H](COCc1ccccc1)NC(=O)c1ccc(O)c(O)c1 2035481578 MNKUNROBWRMUJE-CQSZACIVSA-N 345.351 1.888 10 10 EDCE O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)c1cccc(O)c1O 702598333 DPWMJUWHIGFFGS-LJQANCHMSA-N 342.395 1.465 10 10 EDCE NCc1ccc(N2CC[C@@H](O)[C@H](CO)C2)c(F)c1Br 396912545 DPGUAWPFHGETLW-GXSJLCMTSA-N 333.201 1.226 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)cc1Br 2178086654 MQSUGAIOWARCAZ-VWFAINMRSA-N 341.249 1.912 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(Br)c1 2182559130 IDMAMQROHFCBHP-AGCIHXOGSA-N 341.249 1.346 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H]2CN3C(N)=O)cc1Br 2192283656 PITKGXRZTHNNNT-DVVUODLYSA-N 340.221 1.844 10 10 EDCE NCc1ccc(N2CC3(C2)OCCC[C@H]3O)cc1Br 2103408213 IFERIXBSKVCMJZ-CYBMUJFWSA-N 327.222 1.638 10 10 EDCE N[C@H]1CN(Cc2c(O)cccc2Br)[C@]2(CCOC2)C1 2098287780 RTRVFKUIMCUZJN-QMTHXVAHSA-N 327.222 1.847 10 10 EDCE COc1ccc(Br)c(CNC2CN(CC(=O)O)C2)c1O 2208882720 MKYDXULRYKGBEH-UHFFFAOYSA-N 345.193 1.022 10 10 EDCE CC1(C)[C@H](O)C[C@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2310366434 GURKMGYFCDKGPN-IAGOWNOFSA-N 330.428 1.812 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCO[C@@H](Cn3cccn3)C2)c1O 175652074 XSMUCPAUPWHPNO-OAHLLOKOSA-N 333.363 1.831 10 10 EDCE Cc1cc(C)cc(N2C(=O)/C(=C\N3CCOCC3)C(=O)NC2=S)c1 254737764 PBVAUUOGZBWRDL-UVTDQMKNSA-N 345.424 1.267 10 10 EDCE CC(C)(C)[C@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(N)=O 255266469 CFMGYKXUWMSPHQ-UXHZXRBQSA-N 345.443 1.553 10 10 EDCE Cc1ccc(CN[C@@]23CC[C@@H](C2)[C@H](O)[C@@H]3O)c(O)c1Br 2380801134 OYOLBLZEHIHYBD-BCZWGYKPSA-N 342.233 1.827 10 10 EDCE Cn1cc(Br)c(CNCc2ccc(O)c(O)c2O)n1 393319228 CURJVHIUSPRUFU-UHFFFAOYSA-N 328.166 1.589 10 10 EDCE C[C@@H]1CN(c2ccc(/C=C\C(=O)O)c(Br)c2)CC(=O)N1 395672679 CLUBVLZOIMQFKE-AZVKUDOFSA-N 339.189 1.872 10 10 EDCE O=C(c1cc(O)nc(O)c1)N1CCC(COc2ccccn2)CC1 585532102 CLWIAOQKBHAZSH-UHFFFAOYSA-N 329.356 1.819 10 10 EDCE Cc1cc(CN2CCN([C@H]3CCNC(=O)CC3)CC2)ccc1N(C)C 832368815 FTZBMMAQCAZOBY-GOSISDBHSA-N 344.503 1.847 10 10 EDCE O=C(c1cccnc1)N1CCOc2ccc(N3CCOCC3)cc2C1 581789316 VHWJPNYMODSWAU-UHFFFAOYSA-N 339.395 1.953 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@]3(C)CCC(=O)NC3)C2)cc1 855227473 ZFTWQEVRKOIQOY-SCLBCKFNSA-N 331.416 1.306 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@]3(C(=O)O)CC3(C)C)CC2)cc1 852942264 HIZXTTAZESSAPB-GOSISDBHSA-N 332.400 1.845 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@]3(O)CCO[C@H]3C)C2)cc1 854298344 AVILWHCOHLBKOY-SUNYJGFJSA-N 349.431 1.113 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@@H](C)N(C)C)C2)cc1 854295937 FCALXDSJXUMYKE-HUUCEWRRSA-N 334.464 1.913 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2ncccc2S(C)(=O)=O)c1 858404909 YUTYKPVTDPOXBX-UHFFFAOYSA-N 349.412 1.499 10 10 EDCE COC(=O)c1cc(OC[C@H]2CCCS(=O)(=O)C2)ccc1N(C)C 865395151 LDNBUMHGTKPCBO-GFCCVEGCSA-N 341.429 1.743 10 10 EDCE CN1CCN(c2ccc(CN3C[C@@H]4[C@H]5CC[C@@H](NC5)[C@H]4C3)cc2)CC1 863653160 DIFAZXJXDOGIJW-FYZZASKESA-N 340.515 1.868 10 10 EDCE O=C(CS(=O)(=O)C1CCCC1)NCc1ccc2cccnc2c1O 862028453 ABTWHCHLLGQGQP-UHFFFAOYSA-N 348.424 1.914 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccnc2[nH]nnc12 773851316 JMTWWTRYTQRCQM-UHFFFAOYSA-N 338.371 1.120 10 10 EDCE CN[C@H](C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)c1cnn(C)c1 1118569364 FYBVCUYQSGRLMJ-PBHICJAKSA-N 343.431 1.084 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)CCO1 1119768893 JPCBMYVCIFMXLK-LLVKDONJSA-N 343.474 1.379 10 10 EDCE COc1ccc(O)c(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c1 775287515 AVZLIRADFMPNBU-UHFFFAOYSA-N 340.313 1.815 10 10 EDCE COC(=O)[C@@H](NCc1cc(Cl)cc(OC)c1O)c1ccn(C)n1 787438110 IKPVYBXQYBVZSV-ZDUSSCGKSA-N 339.779 1.792 10 10 EDCE COC(=O)CN(CCC(=O)N(C)OC)Cc1cc(Cl)ccc1O 799136477 LULDUSAVLMXKDH-UHFFFAOYSA-N 344.795 1.431 10 10 EDCE C[C@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)C[C@]2(CCO[C@H](C)C2)O1 797418376 RZZCQGYPNKNSDE-OESLAJAZSA-N 349.427 1.976 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cccn2C)cc1C 1325978966 BOWIWQAULVWFTK-UHFFFAOYSA-N 345.443 1.566 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)[C@H](C)C2CC2)cc(OC)n1 1337099050 CKYCEGQRVKXFRM-NWDGAFQWSA-N 349.431 1.722 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)Cn2cc(C)cn2)cc1C 1266926385 NPDANODUCWFXDW-OAHLLOKOSA-N 330.432 1.803 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)CCCC(N)=O)[C@@H]2C)cc1C 1507303295 WUOHYILIIVIJMR-ZBFHGGJFSA-N 347.459 1.738 10 10 EDCE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N(C)[C@H](C)CC(N)=O 1611963266 LLSXORFVLNHBNE-CYBMUJFWSA-N 344.463 1.709 10 10 EDCE COC(=O)NCC(=O)NC[C@@H](C)CNCc1ccc(OC)c(C)c1 1714375972 RWAVFPXGBMEBSK-LBPRGKRZSA-N 337.420 1.202 10 10 EDCE Cc1cc(C(=O)N[C@@H](CO)[C@H]2CCOC2)c(C)n1-c1ccccn1 1624224760 GCOJUEZUIYRAIQ-HOCLYGCPSA-N 329.400 1.616 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H]2CCN(C)C2=O)cc1C 1568668483 VOQCQRKBGSQOBM-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE C[C@H](NC(=O)NCc1cn(C)c(=O)nc1O)c1ccc(N(C)C)cc1 1681553414 YLTIXVKSZINISS-NSHDSACASA-N 345.403 1.112 10 10 EDCE O=C(O)C[C@H](C(=O)O)N1C(=O)/C(=C/c2cccnc2)SC1=S 16904206 DWQANUCFCDJFST-HMXLAXJASA-N 338.366 1.211 10 10 EDCE C[C@H](O)[C@H](C(=O)O)N1C(=O)/C(=C\c2cccc(F)c2)SC1=S 1858592287 MCNIRAFVAUGWKE-JZMJZOPTSA-N 341.385 1.861 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)CNC(=O)c1ccc(Br)o1 1912173404 MCYAOTGYWBSABA-UHFFFAOYSA-N 344.169 1.931 10 10 EDCE O=C(N[C@@H](COCc1ccccc1)C(=O)O)c1cccc(O)c1O 1946561865 NEBICOPEUNCUHD-ZDUSSCGKSA-N 331.324 1.498 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H](O)CC(=O)O 1951839537 LRJWWXPDTXSHEY-JQWIXIFHSA-N 341.360 1.369 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985103526 WOBHEIPIDHXTCS-ZJUUUORDSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 1985100483 WXVBKYCYAWQGNC-WDEREUQCSA-N 327.385 1.563 10 10 EDCE COc1cccc(O)c1CNC[C@H](CO)NC(=O)OC(C)(C)C 1985860030 ZVVIYUAWCHSPSP-LLVKDONJSA-N 326.393 1.376 10 10 EDCE CC(C)(C)OC(=O)NCC1CCN(CC(=O)NCCN=[N+]=[N-])CC1 2010399072 YDEVLGDBVLCNQB-UHFFFAOYSA-N 340.428 1.650 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1cccnc1 2022926047 HXWZGEIZVRLOFL-KBPBESRZSA-N 333.388 1.629 10 10 EDCE CCn1nnc(Br)c1[C@@H](O)[C@H](NC)c1ccccc1O 2156519836 FYKPAMDTRQOSEL-PWSUYJOCSA-N 341.209 1.760 10 10 EDCE CC(C)(C)OC(=O)N[C@]12C[C@H]1CN(C(=O)Cc1ccc(N)cc1)C2 1906129596 GUNCKVLJVVBNNA-UGSOOPFHSA-N 331.416 1.937 10 10 EDCE NCc1ccc(N2CC[C@@H]3OCC(=O)N[C@H]3C2)c(Br)c1 2185522190 NVSUUQWZJRPHLW-AAEUAGOBSA-N 340.221 1.002 10 10 EDCE CN(c1ccc(CN)c(Br)c1F)[C@H]1CCCNC1=O 2114630916 BEKYLXAZGQVRSV-JTQLQIEISA-N 330.201 1.762 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCN=[N+]=[N-])[C@@H](O)C(F)(F)F 2242876552 TVHZOXXUNSGMDS-RNFRBKRXSA-N 341.290 1.229 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(CNC(=O)CO3)C2)c(Br)c1 2289654932 HGTRGUILBAJEGX-SECBINFHSA-N 341.205 1.208 10 10 EDCE C[C@@H](C(=O)NC1CC1)N1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1 170907931 FNRXRNPUHQGVBN-LBPRGKRZSA-N 348.403 1.085 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2357585986 SVGVGHINUXPFQT-RMROANFSSA-N 342.233 1.823 10 10 EDCE CN(c1ccc(CNC(=O)Cn2cn[nH]c2=O)cc1)C1CCCCC1 180551149 IWNJAXFDFQZJHH-UHFFFAOYSA-N 343.431 1.657 10 10 EDCE COc1ccc(CN2CCN(c3ccc4nncn4n3)CC2)c(O)c1 120509171 MDYDCJLFDBYUJY-UHFFFAOYSA-N 340.387 1.161 10 10 EDCE O=C1CN(S(=O)(=O)c2cccc3nonc23)c2ccccc2N1 130950285 IGWODDAFRUQOFS-UHFFFAOYSA-N 330.325 1.370 10 10 EDCE C[C@@H]1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)C[C@H]1CO 191878386 BTHRQVJAERYDGC-XDURRLNWSA-N 330.428 1.623 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(CC(C)C)C(C)=O)CC2)cc1 242912153 GTWGYZJWBPWXGZ-UHFFFAOYSA-N 347.459 1.848 10 10 EDCE CN1CCCc2cc(CNC(=O)C3C[C@H]4COC[C@@H](C3)C4=O)ccc21 371773957 WIGGGBHDDZKZFK-ALOPSCKCSA-N 342.439 1.927 10 10 EDCE Cc1ccc(CNC(=O)[C@]2(O)CCCNC2)c(O)c1Br 2380759257 MHNKMSJZXYLKNR-AWEZNQCLSA-N 343.221 1.194 10 10 EDCE CC(=O)C(=O)CSc1nnc(COc2c(C)cccc2C)n1N 808017619 CJGSFQJSVSOZOD-UHFFFAOYSA-N 334.401 1.438 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CCNC(=O)CC3)C2)cc1 819592011 ZOXXAFZPCQBSPL-HUUCEWRRSA-N 345.443 1.554 10 10 EDCE C/C=C\[C@@H](O)C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 901327614 QSLDPFBGUBUJFH-DHCBQETCSA-N 327.764 1.484 10 10 EDCE CO[C@]1(CN[C@@H](C)c2ccc(N(C)C)cc2)CCS(=O)(=O)C1 903369618 YTWKCGDDTPHGSG-BBRMVZONSA-N 326.462 1.607 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3cc(OC)n(C)n3)C2)cc1 822698551 WGNXEFMAHHMLQS-GFCCVEGCSA-N 345.403 1.838 10 10 EDCE C=CC(=O)N(CC)CC(=O)NCc1cc(Br)ccc1O 908170450 PAXUFEAQHOUEOP-UHFFFAOYSA-N 341.205 1.805 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)/C=C(\C)CN2CCOCC2)c1 901127799 MVPIREWJJBYGOA-UELRPHRMSA-N 334.416 1.857 10 10 EDCE C[C@@H](O)CN1CCC(CN(C)C(=O)/C=C\c2ccc(O)c(O)c2)CC1 588406822 RTMFRCSYOOOJGB-KXQLTZBTSA-N 348.443 1.662 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)c3cnccc3C)C2)cc1 849416653 UNDHGEQBPXCVCJ-CQSZACIVSA-N 347.440 1.956 10 10 EDCE COc1ccc2ccc(O)c(CN3CC[C@@H]4OCC(=O)N[C@H]4C3)c2c1 840151697 FPCFBZSLLZDDND-WMZOPIPTSA-N 342.395 1.643 10 10 EDCE CO[C@@H](CS(=O)(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCOC1 849369581 YWXRBMVHIVCJFX-ZBFHGGJFSA-N 342.461 1.224 10 10 EDCE COC(=O)C1(O)CCN(Cc2ccc(N3CCOCC3)cc2)CC1 930165032 DILLGKXWFLNGGQ-UHFFFAOYSA-N 334.416 1.023 10 10 EDCE O=C1NCCO[C@@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)[C@@H]12 931562504 LKLFPZWDRQQQDY-QZTJIDSGSA-N 345.443 1.003 10 10 EDCE O=C(O)CC[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 868343147 MSYHREYUFLTJGE-LBPRGKRZSA-N 346.383 1.338 10 10 EDCE Cc1cc(CNC(=O)C2CS(=O)(=O)C2)c(C)n1-c1ccccc1 869456799 LZMPAXYPAJNXPF-UHFFFAOYSA-N 332.425 1.755 10 10 EDCE O=C1C[C@H](C(=O)N2Cc3cccc(O)c3C2)CN1CC(F)(F)F 871198258 FBQLCNYLQSPTCV-JTQLQIEISA-N 328.290 1.645 10 10 EDCE CN1CCN(c2ccc(CN3CCNC(=O)CC3(C)C)cc2)CC1 895400901 ZMZQMZFDVKQAKB-UHFFFAOYSA-N 330.476 1.539 10 10 EDCE COc1ccc(O)c(S(=O)(=O)Nc2ccc(O)c(OC)c2)c1 797820380 VBJCWSBPXWYRLR-UHFFFAOYSA-N 325.342 1.916 10 10 EDCE Cc1cc(C(=O)NCc2nc(CO)n[nH]2)c(C)n1-c1ccccn1 1148333716 JOVKKBREYQHWTM-UHFFFAOYSA-N 326.360 1.030 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCC[C@]2(C1)CC2(F)F 1326546545 CMZCFYFWNOXEKA-MRXNPFEDSA-N 338.354 1.998 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N3CC[C@H](O)C3)c(Br)cc21 92775790 HCDNFLRAFFIRMN-SDBXPKJASA-N 340.221 1.623 10 10 EDCE CCN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@@H]1CCS(=O)(=O)C1 1441007995 DLEWWKXVYBKVLI-GFCCVEGCSA-N 338.389 1.498 10 10 EDCE Cn1cc([C@H]2CSCCN2C(=O)Cc2ccc(O)c(O)c2)cn1 1449015547 POASOZFCVWWGFH-CYBMUJFWSA-N 333.413 1.691 10 10 EDCE C[C@H](O)[C@@H]1CN(c2ccc(CN)c(Br)c2F)CCO1 2117526654 AWXSJLCEZXDBFI-KWQFWETISA-N 333.201 1.633 10 10 EDCE Cc1ccc2c(c1)c(C)c(C(=O)N(C)C[C@@H]1COC[C@H](O)[C@H]1O)n2C 1615149423 QPGUFCPQZNQIJQ-SKDZVZGDSA-N 346.427 1.235 10 10 EDCE Cc1nc(N2CCOCC2)ccc1NC(=O)Cc1ccc(O)c(O)c1 1545541053 NPSQZFILLVZHDP-UHFFFAOYSA-N 343.383 1.819 10 10 EDCE Oc1cc(Br)ccc1CN[C@@]12CC[C@@H](C1)[C@@H](O)[C@H]2O 2120394916 OWVYKKAKHPDPCS-IYMWITQMSA-N 328.206 1.519 10 10 EDCE OC[C@@H]1[C@H](O)[C@H](O)[C@H](Cc2ccccc2)N1Cc1cccc(F)c1O 1615122259 XSTAAKMGAKPZQP-ISARSNTHSA-N 347.386 1.041 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@H](C)OC 1714124934 KMTYNYPNERBNGV-WCQYABFASA-N 335.408 1.982 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H](C)n3cncn3)CC2)cc1C 1483729579 XNIPVWIELAMUMA-CQSZACIVSA-N 343.431 1.595 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@](C)(O)CCOC 1727507227 ISEYGYDVEGJWNW-GOSISDBHSA-N 348.447 1.970 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C2(F)CCCC2)cc1C 1497008601 BOPREMSSTCLADE-OAHLLOKOSA-N 338.423 1.853 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N(CCO)CCOCC(F)(F)F 1566532042 WUJBXQDQMNPYJU-UHFFFAOYSA-N 337.294 1.040 10 10 EDCE O=C(NCc1nc(-c2ccncc2)n[nH]1)N1Cc2cccc(O)c2C1 1636257397 JGTRLJKSBNTCOG-UHFFFAOYSA-N 336.355 1.798 10 10 EDCE NCc1cc(F)c(N2CCC[C@@H]2[C@@H](O)CO)cc1Br 2123239213 NQHYDZJVLXVDOU-YPMHNXCESA-N 333.201 1.369 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@H]2[C@H](O)CO)c(Br)c1 2123209220 HCKUAYORHSPPIJ-BIGNPOOSSA-N 329.238 1.791 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)CN2CCOCC2)cc1C 1568268682 WYGKSQCCKSGXGL-INIZCTEOSA-N 349.475 1.272 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H]2CCN(C)C2=O)cc1C 1732356869 OZALANDJKYZMMK-XJKSGUPXSA-N 347.459 1.324 10 10 EDCE COc1ccc(CN[C@@H]2CN(C(=O)CN(C)C(C)=O)C[C@@H]2C)cc1C 1570331977 CNTNUPIPFVUCLL-WMLDXEAASA-N 347.459 1.418 10 10 EDCE COC1CCN(c2ccc(CN3CCOC[C@H]3CC(N)=O)cc2)CC1 1653920682 DAFQHSVDKBDBJM-QGZVFWFLSA-N 347.459 1.378 10 10 EDCE CCOC(=O)[C@H](C[C@H]1CCCO1)NC(=O)Cc1ccc(O)c(O)c1 1651634228 KCTHRSUCCNXCKD-OLZOCXBDSA-N 337.372 1.257 10 10 EDCE CCN1CCOC[C@H]1C(=O)N[C@@H](C)CNCc1ccc(OC)c(C)c1 1669599390 OARVUCLSWLWXOE-RDJZCZTQSA-N 349.475 1.319 10 10 EDCE CCC(=O)NCC(=O)N[C@H](C)[C@H](C)NCc1ccc(OC)c(C)c1 1674639771 ITBZQGPUMCKJSZ-UONOGXRCSA-N 335.448 1.513 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H]2CCc3ncnn3C2)c1 161149850 UVHMNRBNWMHXAV-GHMZBOCLSA-N 331.376 1.368 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CCOC[C@@H]3C)c(Br)cc21 221238635 MAPBLDJVNMSDFV-ISVAXAHUSA-N 340.221 1.887 10 10 EDCE COc1ccc(Br)c(CNC[C@](C)(CO)OC)c1O 1967780918 OWDKBCRSNPOSNC-CYBMUJFWSA-N 334.210 1.650 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](O)[C@](C)(O)C2)cc1Br 2136877646 JAUWKGOJWOUQNP-CUOATXAZSA-N 330.222 1.824 10 10 EDCE C[C@H](O)c1ccc(N2CCOC[C@H]2[C@@H](O)CO)c(Br)c1 2146324181 SPLWICDAIJUXLB-HERUPUMHSA-N 346.221 1.061 10 10 EDCE Nc1ccc(Nc2cnn(CCO)c(=O)c2Br)cc1 159315764 BHTJOYFKAXOCBE-UHFFFAOYSA-N 325.166 1.324 10 10 EDCE O=C1Nc2cc(N3CC4(COC4)C3)c(Br)cc2[C@H]1O 704455803 SUVQUIMUWYJHND-LLVKDONJSA-N 325.162 1.271 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3[C@@H]4CCCO[C@@H]4C3(C)C)c2n1 2062518260 KIYLVULFJSJBOO-GDLCADMTSA-N 330.388 1.677 10 10 EDCE O=C1NC[C@@]2(CCCN(Cc3cccc(Br)c3O)C2)N1 2177676357 LJROLLGDWJPDEM-CQSZACIVSA-N 340.221 1.802 10 10 EDCE CC(C)(C)OC(=O)N1CCn2ncc(C(=O)C(=O)C[C@H]3C[C@H](N)C3)c21 2049783338 UYUAOGIEZWEGIK-XYPYZODXSA-N 348.403 1.517 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)C[C@H]2CO)cc1Br 2089869468 CQBRGORLWMNFSS-GWCFXTLKSA-N 329.238 1.348 10 10 EDCE COCCN1CCN(c2ccc(CO)c(Br)c2)CC1 2098516532 NMAAFMHPZXGKOH-UHFFFAOYSA-N 329.238 1.710 10 10 EDCE C[C@H](N)c1ccc(N(C)[C@@H]2CC(=O)NC2=O)cc1Br 2114737841 PRBUBXVFVQBNBC-WRWORJQWSA-N 326.194 1.320 10 10 EDCE OCC1(O)CN(c2ccc(CNC3CCC3)c(Br)c2)C1 2240044094 RXFDHWPUXMTXBV-UHFFFAOYSA-N 341.249 1.635 10 10 EDCE OCCC1(O)CN(c2ccc(CNC3CC3)c(Br)c2)C1 2286175926 KZYZYPWBPCBZCE-UHFFFAOYSA-N 341.249 1.635 10 10 EDCE O=C1NC(=O)N(C[C@@H]2CCCO2)C(=O)C1=Cc1c[nH]c2ccccc12 2296755526 IMJCKBGLICSZHH-LBPRGKRZSA-N 339.351 1.809 10 10 EDCE C[C@H](O)[C@@H](C(=O)O)N1C(=O)C(=Cc2ccsc2)SC1=S 2323823471 KZNJOTIHVBKYSP-RCOVLWMOSA-N 329.424 1.783 10 10 EDCE COc1ccc(N2CCN(C=O)CC2)cc1NC(=O)[C@@H]1CCCO1 62192120 QDLCVZIKGQAGLY-INIZCTEOSA-N 333.388 1.091 10 10 EDCE COc1ccc(N2CCN(C(=O)NC[C@@H]3CCCN(C)C3)CC2)cc1 171769151 RUUZLWHCJOOKRM-INIZCTEOSA-N 346.475 1.869 10 10 EDCE CCc1cc(C(=O)NC[C@H](CO)NCc2ccc(OC)c(C)c2)no1 1507252965 MYAJYGQOIRDEII-CQSZACIVSA-N 347.415 1.435 10 10 EDCE Cc1noc([C@@H]2COCCN2Cc2ccc(N3CCOCC3)cc2)n1 188481778 WHRDTDYNMVUODU-KRWDZBQOSA-N 344.415 1.788 10 10 EDCE Cc1cc(C)n(C[C@H]2CN(C(=O)c3ccc(C)c(O)c3O)CCO2)n1 182419064 DETXQKXKLIXYME-CQSZACIVSA-N 345.399 1.761 10 10 EDCE NC(=O)c1cc(NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)c[nH]1 255073731 RSNXWQZFDDZODZ-UTCJRWHESA-N 340.383 1.602 10 10 EDCE CCOc1cccc(CN2CCOC[C@H]2c2noc(COC)n2)c1O 364095597 PERPCWITYFTGDZ-ZDUSSCGKSA-N 349.387 1.894 10 10 EDCE CC(=O)C(=O)COC(=O)CCCC(=O)c1ccc2c(c1)OCCO2 808537391 NNRXADXMXABCKF-UHFFFAOYSA-N 334.324 1.512 10 10 EDCE CC1(C)[C@H](O)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1 812878205 SIIKSZGHNYRPLQ-MRXNPFEDSA-N 333.432 1.578 10 10 EDCE CCN(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCOC1 812879155 MNTHVJQOSPEVTO-QGZVFWFLSA-N 347.459 1.455 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NCc3cnn(C)n3)C2)cc1 823623147 BGLAHGYYLQTBJR-ZDUSSCGKSA-N 344.419 1.149 10 10 EDCE Nc1ccc(OCCCOn2c(=O)c(=O)oc3cccc(N)c32)cc1 821296842 JMNDPEHCILBIGB-UHFFFAOYSA-N 343.339 1.017 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@](C)(O)c1ccc(F)c(Br)c1 909940395 UBTKHWTZTHAVOF-ZDUSSCGKSA-N 347.136 1.497 10 10 EDCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)Cc2cc(C)on2)c1 739961452 HBEKHAMCFIEHLY-SNVBAGLBSA-N 326.374 1.878 10 10 EDCE CC(C)NS(=O)(=O)CCNC/C=C/c1ccc(N(C)C)cc1 835037799 NDGMNUXBDFZYIY-AATRIKPKSA-N 325.478 1.683 10 10 EDCE CN(C)c1ccc(/C=C/CN[C@@H]2CCN(c3cnn(C)c3)C2=O)cc1 835041668 ZFGHNRBMJCNIIT-SHCNBLLESA-N 339.443 1.894 10 10 EDCE CCO[C@H]1[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)[C@H]1C 912709656 RNHSAHXYSFKGLF-JEBQAFNWSA-N 332.444 1.935 10 10 EDCE COc1ccc(N2CCN(CCNCc3cc(C)on3)CC2)cc1 838919317 CDVQRMRQNFHHNA-UHFFFAOYSA-N 330.432 1.903 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]([C@H]3CCCN3)C2)cc1 844221882 XLKIOOPEIYQGHY-PKOBYXMFSA-N 344.503 1.833 10 10 EDCE O=[N+]([O-])c1cc(Cl)cc(CN2CCN3C[C@H](O)C[C@H]3C2)c1O 848925866 GSJQVALINVFFDK-NWDGAFQWSA-N 327.768 1.205 10 10 EDCE COc1cccc(CNC[C@@H]2CS(=O)(=O)c3ccccc3O2)c1O 842721957 NCOACALKKQAIDZ-CYBMUJFWSA-N 349.408 1.725 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)c2cn(CC3CC3)nn2)cc1 844855905 DJERPIMSFUTCQR-UHFFFAOYSA-N 343.431 1.905 10 10 EDCE O=C(CN1C(=O)NC2(CCCC2)C1=O)NCc1c(O)cccc1F 928710241 QZTKINWGWKWVSH-UHFFFAOYSA-N 335.335 1.012 10 10 EDCE Cc1ccc(C(=O)NCCN2C[C@@H]3CCCCN3C2=O)c(O)c1O 856142893 IAARLJBWIQWILF-LBPRGKRZSA-N 333.388 1.426 10 10 EDCE COc1ccc(N2CCCN(c3nc(C)nc(N(C)C)n3)CC2)cc1 768521629 AVLRMOLBXOVWSN-UHFFFAOYSA-N 342.447 1.971 10 10 EDCE CC1(C)OC[C@H]2C[C@@]21NC(=O)c1cc(NS(C)(=O)=O)ccc1O 862688983 JMFHPMLTIMMXET-RFAUZJTJSA-N 340.401 1.061 10 10 EDCE CCO[C@H](C(=O)N1CCOc2cc(N(C)C)ccc21)[C@H]1CCOC1 866208876 WIVMMDCRNGFOEO-GUYCJALGSA-N 334.416 1.920 10 10 EDCE CN1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1=O 765228483 HCOWTCOKOCVYKE-UHFFFAOYSA-N 334.445 1.181 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(CO)CNCc1cc(F)ccc1O 1876122674 JKCBQDNDSKQDPF-INIZCTEOSA-N 328.384 1.897 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)NCC[C@@H]2CCOC2)cc1 788962281 CASLZQSDPJRHED-MRXNPFEDSA-N 347.459 1.692 10 10 EDCE CC1(C)COC[C@H]1NCc1ccc(N2CCC(C(N)=O)CC2)cc1 895813992 OUPCDCYHKQWTPB-QGZVFWFLSA-N 331.460 1.903 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccn(C)n2)cc1 788974112 CSBZULQZMSYGST-UHFFFAOYSA-N 343.431 1.199 10 10 EDCE Cn1ccn2c(CCNCc3cccc(Cl)c3O)nnc2c1=O 895788782 HCBCYXLEXSNHEX-UHFFFAOYSA-N 333.779 1.119 10 10 EDCE O=C(N[C@@H](CO)CN1CCCC1)c1cc2cc(O)c(O)cc2s1 897764751 OTCUMLMIKFUNKN-LLVKDONJSA-N 336.413 1.499 10 10 EDCE CNC(=O)C1(C(=O)NC/C=C/CNCc2ccc(OC)c(C)c2)CC1 1321289725 JJHBGAQWFVBKSX-SNAWJCMRSA-N 345.443 1.292 10 10 EDCE CCOc1ccc(N2CCN(C(=O)c3cccn(C)c3=O)CC2)cc1 1324626900 KXYCYMRZZVNYIE-UHFFFAOYSA-N 341.411 1.746 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1cncn1C 1320789244 WKNTUGXQPWKEGM-UHFFFAOYSA-N 330.432 1.989 10 10 EDCE COc1cc(O)c(CN[C@@H](Cc2ccncc2)C(=O)O)cc1OC 1329973283 NIXLURQXJADBEW-ZDUSSCGKSA-N 332.356 1.590 10 10 EDCE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCC[C@H]1CNCCS1(=O)=O 1340064128 NHQYXXFZCRICEE-RDBSUJKOSA-N 338.473 1.615 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1C[C@H]1CC)NC(=O)c1cc(OC)nc(OC)c1 1356927173 DCKQSFFQUVYLGE-KWCYVHTRSA-N 349.431 1.770 10 10 EDCE COCC(=O)N[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C(C)C 1357101995 GWLOJFZLSNTMDX-ZDUSSCGKSA-N 349.391 1.366 10 10 EDCE Cn1nccc1[C@@H]1C[C@@H](NC(=O)Cc2ccc(O)c(O)c2)CCO1 1297999336 IZXGFUROKBQFQI-LRDDRELGSA-N 331.372 1.410 10 10 EDCE Nc1ccc(CS(=O)(=O)Nc2cnc(Br)nc2)cc1 2118289848 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EDCE NC(=O)[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)C[C@H]1c1ccccc1 1638097251 FKNCQSCCNUINNN-LSDHHAIUSA-N 340.379 1.368 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@@H]2CCCNC2=O)cc1C 1668097362 UXRYTSVGWQVFKM-GOEBONIOSA-N 347.459 1.514 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC(CC(N)=O)CC2)c([N+](=O)[O-])c1 1772822311 VYIRYXJOZIEQCN-HYXAFXHYSA-N 347.371 1.873 10 10 EDCE COCCNCc1ccc(N2CCS(=O)(=O)CC2)c(Cl)c1 163956546 PPYQYKVFKDJAAI-UHFFFAOYSA-N 332.853 1.311 10 10 EDCE CN1CCN(c2ccc(CN)c(Br)c2)[C@@H](CCO)C1 2138082117 JKFHPJBVQSFWOQ-ZDUSSCGKSA-N 328.254 1.411 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]1(C)COC[C@H]1NC(=O)OC(C)(C)C 1985101443 SIVKZHQATFIYKK-YGRLFVJLSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 1985103219 RUIGQSQNWUYREO-QWRGUYRKSA-N 327.385 1.421 10 10 EDCE COCCn1ncc(Nc2ccc(N)cc2)c(Br)c1=O 159314511 HDUMWJZAPBQMFS-UHFFFAOYSA-N 339.193 1.978 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)C(C)(C)O 1987680908 NSMZIQKAJWXFNR-JTQLQIEISA-N 329.401 1.809 10 10 EDCE CC(C)(C)OC(=O)N1CC(n2cc([C@H](N)c3ccccc3O)nn2)C1 2029560973 WUGVRIJGKZOHOX-OAHLLOKOSA-N 345.403 1.824 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)c(Br)c1 2182554628 SENBRMLAJNFQGC-ZKOAOSJTSA-N 341.249 1.647 10 10 EDCE CCCn1nnnc1CN(C)c1ccc(CO)cc1Br 2196300046 GXBKGTYFYHOSQB-UHFFFAOYSA-N 340.225 1.974 10 10 EDCE NCc1ccc(N2CCOCCOCC2)c(F)c1Br 2103230466 AHIHWSIXGBWXDB-UHFFFAOYSA-N 333.201 1.900 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)c(Br)c1 2089925586 DNBYXGQAUAXHAV-OWYVNGRQSA-N 328.254 1.580 10 10 EDCE CCCn1nnnc1CNCc1ccc(Br)cc1O 2113073877 WIIOZQWWIPDMER-UHFFFAOYSA-N 326.198 1.841 10 10 EDCE N[C@H]1[C@H]2C[C@@H](CN(Cc3cc(Br)ccc3O)C2)[C@H]1CO 2239326119 LRWXUTPAVGKTEB-GVAXYQGFSA-N 341.249 1.542 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1C[C@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 2249687442 YHOGZDKBORMZJN-KSTCHIGDSA-N 336.432 1.898 10 10 EDCE Cc1cc(C=CC(=O)NCCOCC(N)=O)c(C)n1-c1ccccc1 2303300724 CDDRGUYNWWACCL-UHFFFAOYSA-N 341.411 1.725 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CCc2cc(O)c(O)cc2C1 2318654833 MOTPPOHHPXQRHH-ZDUSSCGKSA-N 348.399 1.992 10 10 EDCE CNCc1ccc(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)c(Br)c1 2336475235 GCBCEMNRSWWIAH-GXFFZTMASA-N 345.262 1.402 10 10 EDCE C[C@@H](NC(=O)N1CCNC(=O)CC1)c1ccc(N2CCOCC2)cc1 105194073 BVXAANPDUNQUCZ-CQSZACIVSA-N 346.431 1.116 10 10 EDCE COC(=O)c1cccc(N/C=C2/C(=O)N=C(S)N(C3CC3)C2=O)c1 103126201 ZHIKNBVMTRSUEW-WQLSENKSSA-N 345.380 1.586 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccnn1C 26395912 RILFMXLBBPBHIX-UHFFFAOYSA-N 343.431 1.598 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1CNCc1cccc(O)c1O 382737739 PWTBDJOQPHOYKS-CYBMUJFWSA-N 338.404 1.823 10 10 EDCE NCc1ccc(N2CC[C@@]3(CNC(=O)C3)C2)c(F)c1Br 2163341321 KIFKNLFYIHQZSF-CQSZACIVSA-N 342.212 1.763 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(OC)c1O)C2 819397822 GZEKSPRVKGDGMI-UBHSHLNASA-N 348.399 1.884 10 10 EDCE CN(C)c1ccc(/C=C/CN2C[C@@H](N)[C@H](c3cnn(C)c3)C2)cc1 818431944 XGBJKBOURKBGAP-WWAPKCSDSA-N 325.460 1.926 10 10 EDCE CN1CCN(c2ccc(CN3CCC4=C(CCC(=O)N4)C3)cc2)CC1 826785492 UUJHMJVDKRCTGA-UHFFFAOYSA-N 340.471 1.808 10 10 EDCE C[C@H]1CCn2ncc(C(=O)OCC(=O)c3ccc(O)c(O)c3)c2C1 829574289 LSUBWVUBYPWZHH-JTQLQIEISA-N 330.340 1.916 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCCCN1CCOC1=O 734667632 JVBMNGLOVDROKG-UHFFFAOYSA-N 334.420 1.703 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(N=c2cccn[nH]2)CC1 588404598 JXTDCQQWTPBKNM-XQRVVYSFSA-N 340.383 1.426 10 10 EDCE C[C@H]1CN(CCO)CCN1C(=O)NCCCSc1nccs1 838513164 FSODZBDAAVMJNM-LBPRGKRZSA-N 344.506 1.333 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)NCc2ccnn2C)cc1 844885899 LODZRJOGTQRDAV-UHFFFAOYSA-N 331.420 1.707 10 10 EDCE CC(C)n1ncc2cc(/C=C/C(=O)N(C)c3cn[nH]c3)c(=O)[nH]c21 754347863 ANTDMZREGPGARR-SNAWJCMRSA-N 326.360 1.705 10 10 EDCE CCN1CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 852453449 JFGVAWMSUVMKQF-CQSZACIVSA-N 346.431 1.148 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C[C@H]3CCC(=O)NC3)C2)cc1 855222863 BMKURBYQXDSNKH-ZIAGYGMSSA-N 331.416 1.306 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@@H]1CN 926288501 MWINYJJBQWRLOT-GDBMZVCRSA-N 346.475 1.154 10 10 EDCE Cc1cc(CC(=O)N2CCC[C@](O)(CO)C2)c(C)n1-c1ccccc1 854907115 HEQQPOONJAIKDB-HXUWFJFHSA-N 342.439 1.982 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H]2COC[C@@H]2C1 850602668 YIEFEXJGCLWYGU-CVEARBPZSA-N 345.443 1.206 10 10 EDCE Cn1ccnc(N2CCN(Cc3c(O)cccc3Cl)CC2)c1=O 769467616 YKFKXYKTJOAQCT-UHFFFAOYSA-N 334.807 1.462 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@@H]2CN=C(c3cnn(C)c3)O2)c1 930213992 LWXXBBNMXKAMTA-BXUZGUMPSA-N 330.388 1.631 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)OC[C@H]1OCCNC1=O 1123229112 FDKJSMDLDIHQPX-CYBMUJFWSA-N 334.397 1.827 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1coc2c1C(=O)NCCC2 1137464627 IUPNOLLUNSYFNU-UHFFFAOYSA-N 330.340 1.339 10 10 EDCE O=C(NCc1c(O)cccc1F)c1ncnc(O)c1Br 1156177600 LFSRTBWWOJFXSM-UHFFFAOYSA-N 342.124 1.719 10 10 EDCE C[C@H]1CO[C@H](C(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1349229879 XZDVGKGJWUETNB-MFKMUULPSA-N 347.375 1.120 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@H]2CCN(C)C(=O)C2)cc1C 1266948947 RUWNZJFWQXHPMP-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE CC(C)(F)C(=O)NC/C=C/CNC(=O)c1ccc(N=NC(N)=O)cc1 1285455999 WEZVBWZKVJTFJD-OPAYYZTASA-N 349.366 1.999 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc(=O)c(OC)c[nH]3)C2)cc1 1520328958 PHILHZUYLIVQOO-GFCCVEGCSA-N 343.383 1.401 10 10 EDCE COc1ccc(N2CCC(NC(=O)c3ccc(CO)nc3)CC2)cc1 1542704099 PKCNZKQSMHIMFF-UHFFFAOYSA-N 341.411 1.981 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](CCNCCO)C2)cc1 1484553605 NEYXBWOUDQLBTM-GFCCVEGCSA-N 333.392 1.283 10 10 EDCE CCOC(=O)Cn1nc(C)cc1NC(=O)/C=C/c1ccc(O)c(O)c1 1557309027 DFHJESQKEHQEAX-FNORWQNLSA-N 345.355 1.818 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2ccn(C)c(=O)c2)cc1C 1713320122 NRIUDHWCLDTUFH-CQSZACIVSA-N 343.427 1.610 10 10 EDCE COCCCCN1CC(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1714980928 FMGLQLOWPDVENQ-UHFFFAOYSA-N 347.419 1.937 10 10 EDCE COc1ccc(CNCC[C@@H]2CCCN(C(=O)CC(N)=O)C2)cc1C 1568050925 URPOXYLBMOWOAM-HNNXBMFYSA-N 347.459 1.597 10 10 EDCE Cn1cc(CC2CN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)cn1 1647916573 HADPPROFYDQUIR-UHFFFAOYSA-N 326.360 1.897 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cc(Cl)ccc1-n1cnnn1 1652626593 ZHWYQUQUNFRMPR-UHFFFAOYSA-N 345.746 1.657 10 10 EDCE CS(=O)(=O)c1ccccc1CC(=O)NCc1c(O)cccc1O 1652625356 CJRWIHBKFJTCAR-UHFFFAOYSA-N 335.381 1.360 10 10 EDCE O=C1C[C@@H](CNC(=O)NCc2cc(Cl)cc(Cl)c2O)CN1 1683160539 FAJGWQBIXDDPHT-SSDOTTSWSA-N 332.187 1.634 10 10 EDCE COCCNCc1ccc(N(C)CCS(C)(=O)=O)c(Cl)c1 164154695 AGWWVTVJNPZFRL-UHFFFAOYSA-N 334.869 1.557 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cc(N)ccc3O)CC2)cc1 1866356489 RQHSBHGSKFDSPE-UHFFFAOYSA-N 327.384 1.945 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](C(=O)O)(c2cc(O)c(O)c(O)c2)C1 1951735617 PLOWQJARQGRTKA-INIZCTEOSA-N 339.344 1.767 10 10 EDCE CO[C@H]1C[C@H](C(=O)NCCCN=[N+]=[N-])N(C(=O)OC(C)(C)C)C1 1985101752 XGFYMFKYEOYDLK-WDEREUQCSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CNCc1cc2c(cc1O)OCO2 2011423393 RGKDJRJBPRFQHC-LLVKDONJSA-N 340.376 1.096 10 10 EDCE CN(Cc1ccc(Br)cc1O)[C@@H]1COC[C@H]1C(=O)O 691422895 LMXJRJIHFQHBKS-GHMZBOCLSA-N 330.178 1.686 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H](C3)C4O)c(Br)cc21 2172930005 DAZLYAGUJLXESX-NBSNBXBNSA-N 338.205 1.218 10 10 EDCE C[C@@H]1CN(C(=O)c2ccc(O)c(O)c2)CC[C@H]1NC(=O)C(F)(F)F 2054398424 YDQFRGMNKFYNDJ-PSASIEDQSA-N 346.305 1.627 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 2080576713 BKSJBDLMFPHOLJ-LSDHHAIUSA-N 349.431 1.598 10 10 EDCE CC[C@]1(CO)COCCN1c1ccc(CN)cc1Br 2112707533 GGHUEEQQYVQYRS-AWEZNQCLSA-N 329.238 1.886 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@](C)(O)C2)cc1Br 2201511044 WERYKWAKBAFEHC-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE C[C@H]1CN(CCNCc2cccc(Br)c2O)C(=O)N1 2230848521 JBDCXFJPNMUZDI-VIFPVBQESA-N 328.210 1.658 10 10 EDCE NCc1ccc(N2C[C@H]3CCO[C@]3(CO)C2)c(Br)c1 2231371527 MFHPKCKCEIJGSN-RISCZKNCSA-N 327.222 1.495 10 10 EDCE O=C(O)COc1ccccc1C=C1SC(N2CCOCC2)=NC1=O 2297312440 LRLAYGAUUITJKN-UHFFFAOYSA-N 348.380 1.453 10 10 EDCE Cn1cc(C=CC(=O)N(CC2CC2)c2ccccc2)c(=O)n(C)c1=O 2297953046 UVZBYCSRCJUHBS-UHFFFAOYSA-N 339.395 1.540 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@]1(CO)CCCN1C(=O)OC(C)(C)C 2300526700 WDNGZMHNDBZCIG-HNNXBMFYSA-N 341.412 1.907 10 10 EDCE CCc1ccc(OCCCNC=C2C(=O)NC(=O)N(C)C2=O)cc1 2313503325 YIKCNUCXPRUQCU-UHFFFAOYSA-N 331.372 1.200 10 10 EDCE CCOC[C@@H](N)C(=O)NCc1ccc(C)c(Br)c1O 2352639119 VAXOTXZDTLFRHY-SNVBAGLBSA-N 331.210 1.443 10 10 EDCE Cc1ccc(CNC(=O)[C@@]23C[C@@H](N)[C@@H]2C3)c(O)c1Br 2352639488 YZTOZCHOGGGBEJ-RBZYPMLTSA-N 325.206 1.817 10 10 EDCE Cc1ccc(CN[C@H]2CCO[C@@H]2C(N)=O)c(O)c1Br 2352673706 YKGSBVWMXBKEKP-CABZTGNLSA-N 329.194 1.196 10 10 EDCE CCCC[C@H](NC(N)=O)C(=O)N1CCN(c2ccc(OC)cc2)CC1 65579500 AUBVUFPLDUVFMU-INIZCTEOSA-N 348.447 1.571 10 10 EDCE Cc1cnn(C[C@H]2CN(C(=O)/C=C/c3ccc(O)c(O)c3)CCO2)c1 181072308 HUTOPXIZKOOZJA-SJDLMVEWSA-N 343.383 1.544 10 10 EDCE C[C@H](NC[C@@H]1CCCS1(=O)=O)c1ccc(N2CCOCC2)cc1 90465978 JWYXUAGOMQIOBT-YOEHRIQHSA-N 338.473 1.751 10 10 EDCE Cc1ccc(CNC(=O)CN2CC[C@@H](N)C2)c(O)c1Br 2380749686 QXVGIIYHXPMAEC-LLVKDONJSA-N 342.237 1.112 10 10 EDCE CNC[C@](C)(C(=O)O)N(C)Cc1ccc(C)c(Br)c1O 2380766111 QRXUOMMBAJFNKL-CQSZACIVSA-N 345.237 1.958 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@H](O)c2cnn(C)c2Br)cc1 2163136891 XUAVDWQOSUHDRS-CHWSQXEVSA-N 339.237 1.982 10 10 EDCE C[C@H]1COCC[C@@H]1S(=O)(=O)N(C)Cc1ccc(N(C)C)cc1 809387935 HEXLIROPUUAMSB-BBRMVZONSA-N 326.462 1.939 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@@H]1CCc2nnc(C3CC3)n2C1 815836098 PXCGRHLPOKEYIL-GFCCVEGCSA-N 328.372 1.446 10 10 EDCE COc1ccc(CNC(=O)C(=O)Nc2cccc(C3CC3)n2)c(O)c1 815631484 FUVSBGUGCOGBOY-UHFFFAOYSA-N 341.367 1.928 10 10 EDCE CNCCN(C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)C(C)C 903805508 IDANRLKIXHZZDR-UHFFFAOYSA-N 334.464 1.167 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2C[C@H](C)N(CCO)C[C@@H]2C)c1O 841890391 AKFMJIQBMJRZSN-RYUDHWBXSA-N 339.392 1.196 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)N[C@@H](CC4CC4)C3=O)C2)cc1 849356969 IWMIHADVSMSLIU-HOCLYGCPSA-N 329.400 1.994 10 10 EDCE CC(C)(C)OCC(=O)NC(C)(C)C(=O)NCc1ccc(O)c(O)c1 845834685 QYJPQLJCIHJONP-UHFFFAOYSA-N 338.404 1.424 10 10 EDCE CN(C)c1ccc([C@H](N)CNS(=O)(=O)c2cscn2)cc1 842785008 KAOSXUKEJSFGEZ-GFCCVEGCSA-N 326.447 1.187 10 10 EDCE COC1(OC)CC[C@@H]1NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 924728548 JFXBOAAAVPCEFU-WBVHZDCISA-N 347.459 1.629 10 10 EDCE COC(=O)[C@H]1CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 854301156 JKPYDBVRIQDDMM-UONOGXRCSA-N 347.415 1.478 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@H]2CC[C@H]1[C@@H](N)C2 852929446 KEQCICNEXZCWBM-XIRDDKMYSA-N 344.459 1.049 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](OC)[C@H]3CCOC3)CC2)cc1 854198900 SMMIQNRTBCEUFF-WMLDXEAASA-N 334.416 1.395 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)N3CCN(C)CC3)C2)cc1 855230295 FVKGPUOLQLJOJL-HZPDHXFCSA-N 346.475 1.026 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1CC[C@H](C2CC2)N1 852868294 CWHVYYVZJBOLOI-RTBURBONSA-N 343.471 1.795 10 10 EDCE COC[C@@](C)(CC(=O)OC)NCc1ccc(N2CCOCC2)cc1 757921505 WCPCTXFVHBBCHR-GOSISDBHSA-N 336.432 1.581 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](O)[C@@H](C)O)c1 871144522 YHEDOMZNXSXUQI-DYVFJYSZSA-N 330.384 1.378 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCc4ncsc4C3)cc2N1 782418663 QNYQSSWADUQVOK-UHFFFAOYSA-N 332.341 1.945 10 10 EDCE COC[C@H](CNCc1c(C(=O)OC)n(C)c2ccc(F)cc12)OC 894433786 CBZFZCAOERJWDC-LBPRGKRZSA-N 338.379 1.855 10 10 EDCE O=S(=O)(NCc1cc(Br)ccc1O)N1CCCCC1 796191432 UDUPSYSPQZQQRQ-UHFFFAOYSA-N 349.250 1.975 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2NC(=O)Cc1ccc(O)c(O)c1 1163273766 XJRRLSLHISLIAR-WQGACYEGSA-N 348.399 1.764 10 10 EDCE O=C(NCc1ccccc1O)N[C@@H]1CS(=O)(=O)Cc2ccccc21 1313051567 OUPLDLZMFQDVCB-OAHLLOKOSA-N 346.408 1.861 10 10 EDCE Cn1c(=O)n(CC(=O)NCc2cc(O)ccc2O)c2ccccc21 1176748040 IIMLAIZYVNPKDW-UHFFFAOYSA-N 327.340 1.068 10 10 EDCE C[C@H]1OCCN(Cc2c(O)cccc2Br)[C@@H]1C(=O)O 706647156 DDYAEZWPFVCMAR-PELKAZGASA-N 330.178 1.829 10 10 EDCE CC(C)[C@H](NC(N)=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1180180038 UCPCJFXVIMPXKF-CVEARBPZSA-N 349.479 1.164 10 10 EDCE CO[C@H]1C[C@H](CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 1331635711 IPNKFBJJTHWIQU-JCNLHEQBSA-N 345.443 1.444 10 10 EDCE CC[C@H](NCCc1nnnn1C)c1cc(Br)ccc1O 775519648 NBFJSZOQUGSRBL-NSHDSACASA-N 340.225 1.962 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C1CC1)[C@H]1CCCCO1 1330027644 PYFMRAJNSJEKSY-IAGOWNOFSA-N 346.427 1.815 10 10 EDCE COc1cccc(CNC(=O)CONC(=O)OC(C)(C)C)c1O 1445968221 KWVORGHWNCGMDW-UHFFFAOYSA-N 326.349 1.473 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCN1CC[C@H](F)C1 1463773407 BKECWGHGMXVOTG-KRWDZBQOSA-N 349.450 1.916 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CCC(=O)N3)CCC2)cc1C 1700146490 WUZVXAIMZPMKCI-OAHLLOKOSA-N 345.443 1.411 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cccc(=O)n2C)cc1C 1713633209 FDSVTQDYPAOKAN-UHFFFAOYSA-N 343.427 1.564 10 10 EDCE C[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@H]1CNCCO 1482502164 XTHYMFLWEOLVDM-WFASDCNBSA-N 347.419 1.672 10 10 EDCE C[C@H](CNCc1ccnn1C)NC(=O)c1ccc(N=NC(N)=O)cc1 1716425483 UOORNTVDCNMZOJ-LLVKDONJSA-N 343.391 1.491 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H]2C(=O)NC2CC2)cc1 1624884458 LZSQXVUBPMMMIZ-ZDUSSCGKSA-N 329.360 1.732 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCn2cnnn2)c1 1635673350 NEZPWKFPUYPWRV-UHFFFAOYSA-N 338.371 1.323 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc(CO)nc3)CC2)cc1 1635784502 OEMNPHXVVUJDHO-UHFFFAOYSA-N 327.384 1.545 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1nnc(C2CC2)o1 1570514924 UWDJJKITCDBSJV-UHFFFAOYSA-N 345.355 1.858 10 10 EDCE CC1(C)OC[C@@H](NCc2cc(Br)cc(F)c2O)[C@H]1O 1910984828 HUUROUPAIREGOF-ZYHUDNBSSA-N 334.185 1.922 10 10 EDCE COc1cc2c(cc1O)CCN(C(=O)Cc1ccc(O)c(O)c1)C2 1596336702 QPXZPYBBBAVELG-UHFFFAOYSA-N 329.352 1.939 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCO[C@]3(CCOC3)C2)cc1 1597917841 QZAXVKMHDYDYGO-XJKSGUPXSA-N 332.360 1.917 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@H]2COC(=O)N2)C(C)C)cc1C 1698964675 IOIBXVGPWACLOT-HUUCEWRRSA-N 349.431 1.342 10 10 EDCE CCN(CC(N)=O)c1ccc(C=CC(=O)O)cc1Br 1912088530 XTGJLIGRWDUGST-UHFFFAOYSA-N 327.178 1.859 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CCN(CCCO)C(=O)OC(C)(C)C 1902571694 ROADBIKZLCQSCX-UHFFFAOYSA-N 329.401 1.765 10 10 EDCE CN(C[C@@H](O)COCc1ccccc1)C(=O)c1ccc(O)c(O)c1 1916384733 CXYFBGBRONPMMT-OAHLLOKOSA-N 331.368 1.748 10 10 EDCE NCc1ccc(N(CCCO)CCCO)c(F)c1Br 1922158723 PGQMWSSWJLWMNE-UHFFFAOYSA-N 335.217 1.618 10 10 EDCE C[C@H]1CN(Cc2cc(Br)ccc2O)CCS1(=O)=O 127813851 KTSBVGMLMGOGQV-VIFPVBQESA-N 334.235 1.774 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1C(=O)NCCCN=[N+]=[N-] 1985102515 IAYCEPKWQWHAPR-MNOVXSKESA-N 327.385 1.733 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)c(Br)c1 2149912509 DKSXBNDNUFDIQM-CYZMBNFOSA-N 343.265 1.896 10 10 EDCE CCOC1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 2010391718 ATILSGQJTPOUSJ-NSHDSACASA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1CCCN(CC(=O)N2CC(N=[N+]=[N-])C2)CC1 2010391432 QMPXOPQHIJEIBD-UHFFFAOYSA-N 338.412 1.450 10 10 EDCE NCc1cc(F)c(N2CCC[C@H]3C(=O)NC[C@H]32)cc1Br 312485138 UZHZJYDTHCHODD-NOZJJQNGSA-N 342.212 1.762 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2160718304 YPHVDERAVJLPHU-PTPDJHTLSA-N 341.249 1.660 10 10 EDCE CN[C@H](C)c1ccc(N(C)[C@@H]2COC[C@H]2O)cc1Br 709221734 KDAMODCYRJJQDX-OWYVNGRQSA-N 329.238 1.925 10 10 EDCE CCN(c1ccc(CN)cc1Br)[C@H]1CCS(=O)(=O)C1 387436829 YERYGRRPOZGMLX-NSHDSACASA-N 347.278 1.921 10 10 EDCE O=C1Nc2cc(N3CC4(CC[C@@H]4O)C3)c(Br)cc2[C@@H]1O 2179697156 JAOPCYSAJDYREI-RYUDHWBXSA-N 339.189 1.396 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cccc(O)c2O)[C@@H]2C[C@H]21 884842921 GZMBMTZBPCWOII-VXGBXAGGSA-N 334.372 1.932 10 10 EDCE CC(C)(C)OC(=O)NC1(CNC(=O)CCc2ccc(N)cc2)COC1 2044236307 ZUZFHXYUSHMHIX-UHFFFAOYSA-N 349.431 1.611 10 10 EDCE CN(C)c1ccc([C@H](CN)N2CC(CNC(=O)C(F)(F)F)C2)cc1 2074323578 ZZROQTAUCSPBPJ-AWEZNQCLSA-N 344.381 1.363 10 10 EDCE Nc1ccc(CC(=O)NC[C@@H]2CNCCN2Cc2ccccc2)cc1 2084731519 HIPKXNUPEVTHFH-IBGZPJMESA-N 338.455 1.402 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1CCOCC12CNC2 2111325387 IUGGJLLVISPROW-UHFFFAOYSA-N 347.640 1.982 10 10 EDCE NCc1cc(F)c(N2CC(n3cnnc3)C2)cc1Br 2113832446 PDTYLXJCOLBWJI-UHFFFAOYSA-N 326.173 1.700 10 10 EDCE NCc1ccc(N2CC[C@@H](C(CO)CO)C2)cc1Br 2114236591 WHSNWZXUEHJOAK-LLVKDONJSA-N 329.238 1.335 10 10 EDCE O=C1C(=Cc2cccs2)SC(=S)N1CCS(=O)(=O)O 2293034677 OWACYNFILNEKKP-UHFFFAOYSA-N 335.453 1.837 10 10 EDCE OC[C@@H]1CN(c2ccc(OCc3ccccc3)cc2)C[C@H](O)[C@@H]1O 2299511371 HYEIXKZDWLCSAX-ZYSHUDEJSA-N 329.396 1.416 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2303236574 GXJZQOJMAJFZAU-GFCCVEGCSA-N 341.412 1.907 10 10 EDCE NC(=O)C[C@H]1CNCCN1c1ccc(OCc2ccccc2)cc1 2303455905 ZJQLIXXJQOSGMA-KRWDZBQOSA-N 325.412 1.919 10 10 EDCE CN1CCC(CO)(NCc2cc(Br)ccc2O)CC1 2352521573 DLURNAPYBPMKQK-UHFFFAOYSA-N 329.238 1.701 10 10 EDCE COC(=O)N1CCC[C@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 66269687 WCGDMBMRWXETDZ-INIZCTEOSA-N 347.415 1.575 10 10 EDCE CN(C)C(=O)Cc1ccc(NC=C2C(=O)OC(C)(C)OC2=O)cc1 30831671 TYEJYUHDSFRPQV-UHFFFAOYSA-N 332.356 1.449 10 10 EDCE CNC(=O)C[C@@H]1CNCCN1Cc1cc(Br)ccc1O 2369315058 LLSWDQRKJLGGAO-GFCCVEGCSA-N 342.237 1.065 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N1CCCS1(=O)=O 255475318 RQDPJGIKHDTFBP-DAXSKMNVSA-N 336.413 1.099 10 10 EDCE O=C1N[C@@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CS1 269791620 JPPOJGHCFJNKDB-CHWSQXEVSA-N 336.413 1.725 10 10 EDCE CN(C)c1ccc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)cc1F 374316605 INAWNLDAJKPKBZ-INIZCTEOSA-N 349.450 1.963 10 10 EDCE Cc1ccc(CN2C[C@@H]3COC[C@@]3(CO)C2)c(O)c1Br 2380815310 POHWJUACQHCENE-DOMZBBRYSA-N 342.233 1.904 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@]2(N)CCOC2)c(O)c1Br 2381129210 GWGPQHDKRXEHNX-AWEZNQCLSA-N 343.221 1.539 10 10 EDCE CC[C@]1(C(=O)OCC(=O)C(C)=O)CCCN1C(=O)OC(C)(C)C 808532942 ARCKYQXZCDDTKC-MRXNPFEDSA-N 327.377 1.867 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NC3COCCOC3)C2)cc1 823734548 ZYKVAUUJHAMPQF-AWEZNQCLSA-N 349.431 1.236 10 10 EDCE Cc1cc(CC(=O)N2CC[C@@H](CO)[C@H](O)C2)c(C)n1-c1ccccc1 834321325 YFIAPELLBLLITO-QFBILLFUSA-N 342.439 1.838 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@@H]4C[C@H]3C[S@@]4=O)ccc21 844935759 VNOKYESJWOWIND-NPGVVQFXSA-N 333.457 1.484 10 10 EDCE NC(=O)CC1CC(NC(=O)NCc2ccc(N3CC=CC3)cc2)C1 919909248 OTQVBYRAXULBTE-UHFFFAOYSA-N 328.416 1.516 10 10 EDCE N[C@@H]1C[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C12CCC2 925489616 ZRZBFCXFJXBEQZ-IAGOWNOFSA-N 349.500 1.281 10 10 EDCE C[C@@H](NCCN1C(=O)CN(C)C1=O)c1ccc(N2CCOCC2)cc1 851898667 XAPKOSKLDIXUGM-CQSZACIVSA-N 346.431 1.068 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CNCC[C@H]3C)C2)cc1 851664357 XXNITFMFSDFAOM-JKIFEVAISA-N 332.448 1.571 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3=CCNCC3)C2)cc1 851664230 URUBZKQWDTYNMU-HNNXBMFYSA-N 330.432 1.493 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCc4nncn4C3)C2)cc1 855226142 NOAPTCFLEQISRS-UONOGXRCSA-N 341.415 1.244 10 10 EDCE C[C@H](NC[C@H](O)CS(C)(=O)=O)c1cccc(C(F)(F)F)c1O 927023734 IVWLPGZFQINFOA-IUCAKERBSA-N 341.351 1.467 10 10 EDCE COC(=O)c1cc(OCc2nnnn2C(C)(C)C)ccc1N(C)C 865395250 NOCBMSATOXOEQM-UHFFFAOYSA-N 333.392 1.860 10 10 EDCE CC(C)C[C@H](NC(=O)c1cc(O)cs1)C(=O)NCCN(C)C 760841297 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COc1ccc(CNC[C@@H](C)N(C)C(=O)Cc2ccn(C)n2)cc1C 1319453415 HWELFULBGGBHCY-OAHLLOKOSA-N 344.459 1.916 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)[C@H]2CC2(F)F)cc1C 1326023629 XZMDTHUVCVOSBH-CQSZACIVSA-N 342.386 1.569 10 10 EDCE CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCCOC1 1328908959 TZQPEPNFTIWGDY-MRXNPFEDSA-N 333.432 1.396 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC2CC(CNCCCO)C2)cc1 1328962122 YZTMJZIPBKPUPL-UHFFFAOYSA-N 333.392 1.329 10 10 EDCE OCCN[C@H]1CCCN(Cc2ccc(Br)cc2O)C1 708639576 UOBRCHNFHNCCQN-ZDUSSCGKSA-N 329.238 1.701 10 10 EDCE C[C@H](O)CNC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1269149959 XLRKXWPWVZWKJX-HZMBPMFUSA-N 333.392 1.328 10 10 EDCE C[C@@H]([C@H](C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)S(C)(=O)=O 1611430494 DHZXODHPASCTSQ-VWYCJHECSA-N 329.418 1.214 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@H]2CCCCO2)cc1C 1717763740 CMJRQWOVAGHISW-DOTOQJQBSA-N 336.432 1.139 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)C[C@H]2COC(=O)C2)cc1C 1483460845 KHVZGFCIBGCPBI-MRXNPFEDSA-N 348.443 1.895 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cccc(C(=O)N2CCCC2)n1 1626838247 SZWINAHTMWHSDL-UHFFFAOYSA-N 341.367 1.659 10 10 EDCE COc1cncc(C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)n1 1716414498 HGMQQHLOMWKADM-CYBMUJFWSA-N 344.415 1.710 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(C(N)=O)c[nH]1 1639587917 LLBIMNZYDDQZQX-UHFFFAOYSA-N 345.355 1.025 10 10 EDCE O=C(CNC(=O)Cc1cccc(F)c1)NCc1ccc(O)cc1O 1643100740 IYSNUICRIRSIIZ-UHFFFAOYSA-N 332.331 1.212 10 10 EDCE C[C@H]1C[C@@H]1CC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1742543518 KWGZSIIIMVLQQK-CMPLNLGQSA-N 331.376 1.741 10 10 EDCE CCNC(=O)N1CC[C@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C1 1587830009 CBUGCIHKFSSMFX-JTQLQIEISA-N 349.412 1.846 10 10 EDCE CC(=O)N1C[C@H](C(=O)NCc2cccc(O)c2O)Oc2ccccc21 1651173234 VCZWBVKDCHZORI-MRXNPFEDSA-N 342.351 1.528 10 10 EDCE Cn1cc(CCNCc2cc(Br)cc(F)c2O)nn1 1965926847 CLTSLKFESXBWNR-UHFFFAOYSA-N 329.173 1.755 10 10 EDCE COC(=O)C[C@@H](N)C(=O)Nc1ccc(Cc2ccc(N)cc2)cc1 1865967678 FEFYNJXSIXSPPH-MRXNPFEDSA-N 327.384 1.689 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@H](O)C[C@@H]32)c(Br)c1 2128873925 FOPXAEYEMXRXML-DDTOSNHZSA-N 327.222 1.636 10 10 EDCE CCCN[C@H]1C(=O)Nc2cc(N(C)CCO)c(Br)cc21 118711771 NQAHLCLYUUTTBO-CYBMUJFWSA-N 342.237 1.870 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1OCC[C@H]1N 1952548975 BLRTZPRHCLHEIA-JMSVASOKSA-N 338.404 1.650 10 10 EDCE COc1cc(Br)cc([C@H]2CS(=O)(=O)CCN2)c1O 1952838898 PTIGTQXFCXMRIL-SECBINFHSA-N 336.207 1.222 10 10 EDCE NCc1ccc(N2CC[C@@H]3CC(=O)N[C@@H]3C2)c(F)c1Br 2145058725 VKRGCVZQMMZGSF-PSASIEDQSA-N 342.212 1.762 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1OCC[C@@H]1CNC(=O)OC(C)(C)C 1985095001 XMSBIVVPYIKOMQ-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCOC1 1985097005 ZNEGRUDNCZLHPX-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE Nc1ccc(O)c(CN2[C@H]3CC[C@H]2CN(C(=O)C(F)(F)F)C3)c1 1999483954 MRFHZPSYRWCDJR-RYUDHWBXSA-N 329.322 1.712 10 10 EDCE CC[C@@H](CNC(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 2015121161 ARHQBMAAQXBDSQ-JTQLQIEISA-N 340.376 1.837 10 10 EDCE C[C@H]1CO[C@H](CO)CN1c1cc(Br)c(CN)cc1F 311414994 MIWRFKZVULCHAD-WPRPVWTQSA-N 333.201 1.633 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)c(Br)c1 2089925581 DNBYXGQAUAXHAV-CUOATXAZSA-N 328.254 1.580 10 10 EDCE CNCc1ccc(N2CC[C@@](O)(COC)C2)c(Br)c1 2095539902 FQRMQWVQKRIOGH-AWEZNQCLSA-N 329.238 1.756 10 10 EDCE C[C@@H](O)c1ccc(N(C)Cc2nn(C)nc2Br)cc1O 2235267998 WEDBZIMKPOSMIV-MRVPVSSYSA-N 341.209 1.973 10 10 EDCE NCc1ccc(N2C[C@@H]3CC[C@H](CO)O[C@@H]3C2)cc1Br 2289348901 IMGBPCNDXPAPNK-NJZAAPMLSA-N 341.249 1.884 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2303215611 WTEMGNRMWBHPLZ-GFCCVEGCSA-N 341.412 1.907 10 10 EDCE CN1CCCc2cc(CNC(=O)Nc3cnn(CC(N)=O)c3)ccc21 58483296 QMQBHDVBOKZJSJ-UHFFFAOYSA-N 342.403 1.073 10 10 EDCE C[C@@H](O)CCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 114824351 DZXYXAKQPXOMBD-GFCCVEGCSA-N 339.411 1.357 10 10 EDCE COc1ccc(OC)c(/C=C2/SC(=S)N(CCO)C2=O)c1 210386499 FOSAJQWUPSWTPD-XYOKQWHBSA-N 325.411 1.897 10 10 EDCE COC(=O)[C@@H]1CN(Cc2cc(Br)ccc2O)C[C@@H](C)O1 92012899 RKBSKGBRKDQVEP-RNCFNFMXSA-N 344.205 1.917 10 10 EDCE COCCCN(C)[C@@H](C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 247825268 FLQJKNSGTPGMNA-INIZCTEOSA-N 349.475 1.701 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC(c3cnc[nH]3)CC2)cc1 360024861 WLLQPMHSUMWWGB-UHFFFAOYSA-N 341.459 1.972 10 10 EDCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@]2(CCOC2)O1 366491415 KPKNCHAIMBDYOH-QFYYESIMSA-N 349.343 1.310 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc3c(c2)CCCN3C)CC(=O)N1C 282153422 IZYKYCIGGBUMQA-CYBMUJFWSA-N 330.432 1.441 10 10 EDCE CO[C@H](C)[C@@H](N)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381133034 JFROTUWXEOUTLO-BXKDBHETSA-N 345.237 1.784 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cn([C@H]3CCCNC3)nn2)cc1F 827901042 IYGRDRJIHMOZSI-ZDUSSCGKSA-N 346.410 1.338 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@]4(CCOC4)C3)cc2N1 829327481 JWMKEIWEMKQLQC-INIZCTEOSA-N 333.344 1.933 10 10 EDCE CO[C@H](CS(=O)(=O)N(C)Cc1ccccc1O)C1CCOCC1 827187496 DHXHJBFBINEJAQ-MRXNPFEDSA-N 343.445 1.595 10 10 EDCE CCO[C@@H]1CN(C(=O)NCc2ccc3c(c2)CCCN3C)C[C@H]1CN 846145153 OXSSGKCCUZHRNN-SJLPKXTDSA-N 346.475 1.574 10 10 EDCE O=S1(=O)CCN(c2ccc(CNCc3ccnc(O)c3)cc2)CC1 921739089 XDOREVFYMLJSGB-UHFFFAOYSA-N 347.440 1.312 10 10 EDCE C[C@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C)[C@@H]1O 852502014 YESFFYBBBVWLMI-QWHZDKJVSA-N 333.476 1.660 10 10 EDCE CN1CCc2ccc(S(=O)(=O)Nc3ccc(O)c(C(=O)O)c3)cc21 759165993 XTOQJEQRIUDQHC-UHFFFAOYSA-N 348.380 1.884 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)NCc2cc(OC)ccc2O)c1 769540760 POFXBEGQCASTIO-ZZXKWVIFSA-N 341.367 1.485 10 10 EDCE CCn1nc(C)cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 861694292 OBUSMRYESDKPIU-UHFFFAOYSA-N 343.431 1.875 10 10 EDCE O=C(CN1CCCCC(=O)C1=O)NCc1c(O)ccc2c1CCCC2 866771454 SZCJPHOETVFMRP-UHFFFAOYSA-N 344.411 1.469 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1895032264 XUHFIMZXMAUKCV-BJDJZHNGSA-N 328.384 1.600 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C3CN([C@@H]4CCOC4)C3)C2)cc1 898580108 BSRCJFNLSJUZQB-DOTOQJQBSA-N 345.443 1.111 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)N[C@@H]2CCC[C@H]2O)N(C)C)cc1 899097656 DSIHMOFZIFAYHI-BRWVUGGUSA-N 334.464 1.568 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](CO)Cc1ccc(O)cc1 1179689081 CHNGPZBMDDYYHY-YOIVXCQUSA-N 329.352 1.536 10 10 EDCE COCCNC(=O)CN(C)[C@@H](C)c1cc(Br)ccc1O 133126790 ZAJUSZLNDOBYRG-JTQLQIEISA-N 345.237 1.910 10 10 EDCE Cc1cc(C)n(CC(=O)NCc2ccc3cccnc3c2O)c(=O)n1 1162612079 BSUUHCRNSCKUME-UHFFFAOYSA-N 338.367 1.430 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H]2CCN(C)C2)cc1C 1319284824 XCICGDYPXYFVPE-YOEHRIQHSA-N 333.476 1.797 10 10 EDCE CO[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 1324280068 KNIUDSSKBRMTEM-DOTOQJQBSA-N 345.443 1.587 10 10 EDCE CN(CCCO)C[C@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1328798272 RCCCSBNVUGNWHO-OAHLLOKOSA-N 347.419 1.768 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)Cc2cncs2)cc1C 1320233903 JFIGCJIYVFRXNW-AWEZNQCLSA-N 349.456 1.270 10 10 EDCE CCn1cc(C(=O)NC[C@H](O)CNCc2ccc(OC)c(C)c2)cn1 1320203937 UFPZOJGETYHCOD-MRXNPFEDSA-N 346.431 1.101 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@@H](C1CC1)[C@H]1CCCCO1 1330027647 PYFMRAJNSJEKSY-SJORKVTESA-N 346.427 1.815 10 10 EDCE COc1ccc(CNC(=O)NCc2noc3c2COCC3)c(O)c1 1255776222 GJJUQPSOXISTIW-UHFFFAOYSA-N 333.344 1.461 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ncccc2C)cc1C 1331697505 QHALQWICQAFDST-INIZCTEOSA-N 343.427 1.588 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@H](C)NC(C)=O)cc1C 1270348120 OEXCLPUARQZPKT-TZMCWYRMSA-N 335.448 1.370 10 10 EDCE COc1cc(C(=O)N[C@@H](C)C[C@@H](C)NC(=O)C2CCC2)cc(OC)n1 1288501523 MVLQNOZEEOJUJJ-NEPJUHHUSA-N 349.431 1.912 10 10 EDCE CNC(=O)c1nn[nH]c1NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1460789696 USNMVNFFJCHCNR-UHFFFAOYSA-N 338.371 1.824 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)CCNC(N)=O)[C@@H]2C)cc1C 1700826648 RHHFWNUTWYCGOJ-HIFRSBDPSA-N 348.447 1.141 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 1616694919 KDMJLHHGHHIXNV-KRWDZBQOSA-N 348.443 1.853 10 10 EDCE C[C@@H](O)CNC[C@@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1716790970 SVUUODKVETZPIT-RISCZKNCSA-N 333.392 1.424 10 10 EDCE O=C(c1ccccc1)c1nc[nH]c1C(=O)NCc1c(O)cccc1O 1558533325 CHTRCFCYXQEREL-UHFFFAOYSA-N 337.335 1.982 10 10 EDCE CCc1ncoc1C(=O)NC[C@@H](CO)NCc1ccc(OC)c(C)c1 1725540913 LHVHNOIMPKUGSX-AWEZNQCLSA-N 347.415 1.435 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2nccs2)cc1C 1725707401 FPHGRMAWZULETR-CQSZACIVSA-N 349.456 1.683 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H](C)c2ccco2)cc1C 1725545629 UJVNIIJILNPJJS-GOEBONIOSA-N 346.427 1.967 10 10 EDCE COCC(=O)N(C)C[C@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1739766910 LNAXKHVVKAIWRS-CYBMUJFWSA-N 347.375 1.168 10 10 EDCE CO[C@H](C)CC(=O)NCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1580677880 AIKJYHXZTJRQOH-LLVKDONJSA-N 349.391 1.462 10 10 EDCE CC1CC(CN[C@H](CO)CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1676614380 CVFFJNMOLARXSJ-QOZQQMKHSA-N 347.419 1.575 10 10 EDCE CC[C@@H]1CN(Cc2cc(OC)c(OC)cc2O)CCN1CCOC 160212708 PXVSGOSAERMUHO-OAHLLOKOSA-N 338.448 1.952 10 10 EDCE CC[C@@H](NCCS(=O)(=O)N1CCSCC1)c1ccccc1O 155743827 ROKHAAKWKKJFLI-CQSZACIVSA-N 344.502 1.812 10 10 EDCE CN(C)c1ccc(CNC2(CO)CN(C(=O)OC(C)(C)C)C2)cc1 1918379386 ZLFGNWOQDGLWEE-UHFFFAOYSA-N 335.448 1.824 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)c(Br)c1 2136583843 AOSRFMMIINKKGW-PZWLIILKSA-N 325.206 1.670 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H](CC(=O)NCCN=[N+]=[N-])C1 1993144848 HQZIRHGVPIHXEE-LLVKDONJSA-N 327.385 1.687 10 10 EDCE CC(C)(C)OC(=O)NCC12COC(C(=O)N3CC(N=[N+]=[N-])C3)(C1)C2 2026195890 SLSGCMGYMVQXRO-UHFFFAOYSA-N 337.380 1.581 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCc2ccc(N)cc2)[C@H](C(=O)O)C1 2030001808 WYTQAMRRVUDMTO-HNNXBMFYSA-N 349.431 1.817 10 10 EDCE CN(c1cc(Br)c(CN)cc1F)C1CS(=O)(=O)C1 2034768846 KJOVAAYTNIJEGK-UHFFFAOYSA-N 337.214 1.280 10 10 EDCE CNCc1ccc(N2CC[C@@H]3C(=O)NC[C@H]3C2)cc1Br 2157170490 BCXWVEUCQYKJJC-AAEUAGOBSA-N 338.249 1.741 10 10 EDCE C[C@@H](O)CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C1CC1 691473299 WBJYDLYWMXMHHT-FUXBKTLASA-N 341.205 1.784 10 10 EDCE CN1CCN(C(=O)c2c[nH]nc2[C@H]2CCNC2)c2ccc(F)cc21 2062486725 ZAZGIVOORXIDNJ-NSHDSACASA-N 329.379 1.722 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(c3cc4c(cc3N)OCCO4)C[C@@H]21 2045666835 WJADOGNYHUDZPX-CDMJZVDBSA-N 347.415 1.999 10 10 EDCE CC[C@@]1(CO)COCCN1c1ccc(CO)cc1Br 2112721387 VEMGLYFIECGPOT-CQSZACIVSA-N 330.222 1.919 10 10 EDCE CS(=O)(=O)CCN(c1ccc(CN)cc1Br)C1CC1 2113817434 CVCCQNHYLDENEB-UHFFFAOYSA-N 347.278 1.921 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])COC1 2213594334 YKZMADCWIZLIKC-GHMZBOCLSA-N 339.396 1.970 10 10 EDCE NCc1ccc(N2C[C@@H]3OCC[C@]3(CO)C2)cc1Br 2278936321 IMSZKCHMVMAQNI-UONOGXRCSA-N 327.222 1.495 10 10 EDCE COc1ccc(C=C2SC(N3CCN(C(C)=O)CC3)=NC2=O)cc1 2293323872 ATBKNDRBCJFZSK-UHFFFAOYSA-N 345.424 1.830 10 10 EDCE Cc1ccc(CN(C)C[C@H](O)CC(=N)N)c(O)c1Br 2352638865 TWKZLXNGKRCHSJ-SNVBAGLBSA-N 330.226 1.582 10 10 EDCE Cc1ccc(CN2CCOCC23CNC3)c(O)c1Br 2352681866 XJDZHQWCSASSIJ-UHFFFAOYSA-N 327.222 1.637 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2CCNO2)c(O)c1Br 2352942343 CXFDURCLDCNLNP-JTQLQIEISA-N 329.194 1.715 10 10 EDCE Cc1ccc(O)c([C@@H](C)NCCS(=O)(=O)N2CCSCC2)c1 185395090 JQFRGVBJRULSNH-CYBMUJFWSA-N 344.502 1.730 10 10 EDCE COCCCCS(=O)(=O)NCc1ccc(N2CCOCC2)cc1 136116537 FJKRRPVAIZMLQT-UHFFFAOYSA-N 342.461 1.369 10 10 EDCE CCNCc1ccc(N2CC(O)(CN(C)C)C2)c(Br)c1 2369668412 CDRCDMKIJHKLSX-UHFFFAOYSA-N 342.281 1.671 10 10 EDCE COC[C@@H](O)CN1CCC(N[C@H](C)c2ccc(N(C)C)cc2)CC1 90915324 APTNRCBOPAMURX-BEFAXECRSA-N 335.492 1.875 10 10 EDCE COc1ccc(N2CCCN(C[C@@H](O)CN3CCCC3=O)CC2)cc1 247651754 WWWRUUJWYSWDOX-QGZVFWFLSA-N 347.459 1.191 10 10 EDCE COCCC[C@@H](N)C(=O)NCc1ccc(C)c(Br)c1O 2380736374 BNSWMKNIZMJGKU-LLVKDONJSA-N 345.237 1.833 10 10 EDCE CC(=O)C(=O)COC(=O)CCC(=O)c1ccc2c(c1)OCCCO2 808494590 PIJKZUDLLTWMDE-UHFFFAOYSA-N 334.324 1.512 10 10 EDCE Cc1cc(CC(=O)N2CCNC(=O)[C@H]2C)c(C)n1-c1ccccc1 825591708 XTGOENHFAWAAMS-OAHLLOKOSA-N 325.412 1.984 10 10 EDCE C[C@H]1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1C(=O)O 842938288 QEGGMMYQJKZQSL-WMLDXEAASA-N 347.459 1.754 10 10 EDCE C[C@@H]1OC[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[C@@H]1C 925055386 MACNYJNSLGFFDI-JKIFEVAISA-N 338.473 1.434 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](O)c3cccnc3)C2)cc1 855223436 AAOPBSSGYYDBLK-WMLDXEAASA-N 327.384 1.519 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCCCNC(N)=O)C2)cc1 855229743 PXCSNDQLLIRHMH-ZDUSSCGKSA-N 334.420 1.229 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCc4nccn4C3)C2)cc1 855223885 CMQDFCHSWOIXSH-CABCVRRESA-N 340.427 1.849 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@@H](OC)[C@H]2CCOC2)cc1 855021098 ZFXBKIDVTFHTPZ-YOEHRIQHSA-N 336.432 1.641 10 10 EDCE COC(=O)N1CC(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 853874467 AZJJCNJHUVAZAC-GFCCVEGCSA-N 348.403 1.024 10 10 EDCE O=[N+]([O-])c1cc(Cl)cc(CN2CCn3c(CO)nnc3C2)c1O 769517050 NXNZSMSSDBRYQF-UHFFFAOYSA-N 339.739 1.053 10 10 EDCE C[C@@H]1C[C@H](NCC(C)(C)CS(N)(=O)=O)c2c(O)ccc(F)c21 866573769 YKMZSLFLUXCWBD-KOLCDFICSA-N 330.425 1.984 10 10 EDCE C[C@@H]1CN(Cc2cc(F)c(N(C)C)cc2F)[C@H](C)CN1CCO 862396741 YAHKAECMMXCRLR-CHWSQXEVSA-N 327.419 1.918 10 10 EDCE Cn1nc(C(F)(F)F)cc1S(=O)(=O)N1Cc2cccc(O)c2C1 867690722 LBIRKVYLSJYPRH-UHFFFAOYSA-N 347.318 1.849 10 10 EDCE CN(C)C[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@H]1CN(C)C 870022665 WPRLAJDCINEHNG-CGMDNHBQSA-N 347.459 1.309 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCC3(CCC3)O2)cc1 1119485352 ASONDYIYLGGZEF-MRXNPFEDSA-N 345.443 1.587 10 10 EDCE CO[C@@H](C(=O)O)C1CN(Cc2cc(Br)ccc2O)C1 1875989646 WFADPQFIEAAAPX-GFCCVEGCSA-N 330.178 1.686 10 10 EDCE CC(=O)c1cc(F)cc(Cn2cc(CCn3cncn3)nn2)c1O 880996360 SPQMDDYAJZBHPC-UHFFFAOYSA-N 330.323 1.208 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2C[C@H]2c2cnc[nH]2)N(C)C)cc1 891245773 IZLOWUIFWKEIKN-JFIYKMOQSA-N 341.459 1.998 10 10 EDCE C[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(F)cc1O 797117645 MQVUGNDPHPFZHT-DGCLKSJQSA-N 330.425 1.996 10 10 EDCE C[C@@H]1CO[C@H](C(F)(F)F)CN1Cc1cc2c(cc1O)OC[C@H]2O 795688687 DMDAWJJLNNMVLQ-RGZBUGHASA-N 333.306 1.970 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCn2ccnc2)cc1C 1265807280 XIYLDFZJNVSVKZ-OAHLLOKOSA-N 330.432 1.885 10 10 EDCE CC(=O)NC[C@@]1(C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1358825328 RXNGPTYZPFDHII-MRXNPFEDSA-N 331.376 1.837 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)CC(F)(F)F)cc1C 1501441302 GFAPZCLRJMUAEM-UHFFFAOYSA-N 348.365 1.867 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H](C)NC(C)=O)cc1C 1270348117 OEXCLPUARQZPKT-GXTWGEPZSA-N 335.448 1.370 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccn(CCn2cccn2)n1 1445941675 ZSUPUXCNZNGZGA-UHFFFAOYSA-N 341.371 1.164 10 10 EDCE CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1293690608 ISLNFJNXZHGIMW-RYUDHWBXSA-N 327.402 1.112 10 10 EDCE CCC[C@H](C)C(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1525376603 VNDMXKNDWLCJLV-FPMFFAJLSA-N 349.431 1.912 10 10 EDCE COc1cccc([S@](=O)CC(=O)NCc2cc(O)ccc2O)c1 1471661850 FJFNGAWTYAPCTK-HSZRJFAPSA-N 335.381 1.530 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)C2=COCCO2)cc1C 1714537923 KMXFRQPQUOQNSY-CQSZACIVSA-N 334.416 1.828 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H]2CCN(C)C2=O)cc1C 1732356866 OZALANDJKYZMMK-BBRMVZONSA-N 347.459 1.324 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2n[nH]cc2F)cc1C 1732898395 XQEDARHNSDYHOV-ARJAWSKDSA-N 332.379 1.942 10 10 EDCE CC(C)OCC(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1575745556 DROKVFKLEPIEIP-UHFFFAOYSA-N 349.391 1.510 10 10 EDCE CC(C)[C@@H](C(=O)NCc1cc(O)ccc1O)N1C[C@H](C)O[C@H](C)C1 1643881697 BPYKILJHRKAJHO-AHIWAGSCSA-N 336.432 1.848 10 10 EDCE CCN(C)c1ccc(CN2CCCN(CC(=O)N(C)C)CC2)cc1 1655599074 IHVKDPISBWKYHR-UHFFFAOYSA-N 332.492 1.739 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1cccc(-c2nc(=O)o[nH]2)c1 1584453402 HZSNYMYJLNRGND-UHFFFAOYSA-N 327.296 1.622 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)c2cocc2C)cc(OC)n1 1688171460 RXYOKYWFCLFXDH-NSHDSACASA-N 347.371 1.549 10 10 EDCE C[C@H]1[C@@H](O)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1687155731 UVLSXGVYBJAFAP-GUYCJALGSA-N 333.432 1.312 10 10 EDCE COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1cc(O)c(O)c(O)c1 1866303411 UZEGYGVGFWIWQB-ZDUSSCGKSA-N 343.335 1.544 10 10 EDCE NCc1ccc(N2C[C@H]3C(C(N)=O)[C@@H]3C2)c(F)c1Br 2136604449 IBISIQYRDQTUCA-HTQZYQBOSA-N 328.185 1.214 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2140663740 PIEOMJKLILKFAE-KOCKLMIUSA-N 334.185 1.382 10 10 EDCE O=C(CNCc1cccc(Br)c1O)NCC(F)(F)F 238019653 BNWBVYMWILCBAR-UHFFFAOYSA-N 341.127 1.923 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@](C)(O)CN 1951699901 SIONKVFYRBKJFD-CJNGLKHVSA-N 326.393 1.243 10 10 EDCE CC(C)(C)OC(=O)NCCCO[C@@H](N)Cc1ccc(O)c(O)c1 1952707502 DVPHRWVVQLWRHF-CQSZACIVSA-N 326.393 1.857 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)[C@H](CCO)C2)c(Br)c1 2149906866 BBIRGAGUJPWNIS-UHTWSYAYSA-N 344.249 1.930 10 10 EDCE [N-]=[N+]=NCCN[C@@]1(C(N)=O)CCN(Cc2ccccc2)C2(CC2)C1 1997672294 WZEOYOCVKWWOMI-KRWDZBQOSA-N 328.420 1.939 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010404962 WBAWYSUINSHBQC-QJPTWQEYSA-N 341.412 1.809 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C 2017961422 PLCCYTXOLPXOKS-CYBMUJFWSA-N 338.404 1.626 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCCN=[N+]=[N-])C[C@@H](O)C1(C)C 2018047549 QWHVHGZKACOUSE-BMIGLBTASA-N 341.412 1.857 10 10 EDCE COC(=O)[C@H](CNC(=O)OC(C)(C)C)NCc1cccc(C)c1O 2024805497 QXDYRNKWAQBTGW-ZDUSSCGKSA-N 338.404 1.857 10 10 EDCE CCN(c1ccc([C@H](C)N)c(Br)c1)[C@H]1CC(=O)NC1=O 2171192594 KQTZDFOFMDZTBA-UFBFGSQYSA-N 340.221 1.710 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@@H](O)C[C@@H]3c3ccccc3)c2n1 2065007376 RVGPGPUIXVOMKI-DZGCQCFKSA-N 338.367 1.691 10 10 EDCE C[C@H]1C[C@@H]2CN(c3ccc(CO)cc3Br)CCN2C1=O 2181181922 KFQDTLCTIVKBBT-CMPLNLGQSA-N 339.233 1.998 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCC[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1908254795 VQQPJQASLYDLBQ-GRYCIOLGSA-N 339.396 1.827 10 10 EDCE NC1(CC(=O)C(=O)C[C@H]2C[C@H](N)C2)CCN(Cc2ccccc2)CC1 2049785862 GNCXDUWRSMJMLE-QAQDUYKDSA-N 343.471 1.636 10 10 EDCE CC1(C)[C@H](CO)OCCN1c1ccc(CN)cc1Br 2103382690 XCDCLYXTHHSGBZ-ZDUSSCGKSA-N 329.238 1.884 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)c(Br)c1 2089918699 JFJBQVQHWGCFIG-ZIAGYGMSSA-N 328.254 1.280 10 10 EDCE CO[C@H]1[C@H](CO)N(c2ccc(CO)c(Br)c2)C[C@H]1OC 2233354196 OHGKSYGLWAQJKW-MJBXVCDLSA-N 346.221 1.152 10 10 EDCE COc1ccc(N2CC[C@H](O)[C@](C)(O)C2)c(OC)c1Br 2234901966 JQXFOSJHGIWJQA-SMDDNHRTSA-N 346.221 1.788 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@@H](CN)C2)c1O 2227747913 HCJMTACRTHUUAM-VIFPVBQESA-N 331.210 1.323 10 10 EDCE OCc1ccc(N2C[C@@H]3OCC[C@]3(CO)C2)c(Br)c1 2278868101 ZCWVKTHRISNGPN-UONOGXRCSA-N 328.206 1.529 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]12CO[C@H](C1)[C@@H](NC(=O)OC(C)(C)C)C2 2298331344 FAABWIPQJXOWNB-RWSFTLGLSA-N 339.396 1.827 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCC[C@@H](Cn2ccnn2)C1 2308005935 MGSOAOJMHVTPSM-CQSZACIVSA-N 328.372 1.641 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2336466405 RMAJIXSWFZUIQL-KKFJDGPESA-N 346.246 1.736 10 10 EDCE Cc1ccc(CNC(=O)C23CC(N)(C2)C3)c(O)c1Br 2352633636 LFZVDEWTSICHTJ-UHFFFAOYSA-N 325.206 1.961 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2355459550 ZSDARITZVXUPPP-WSOUCCKQSA-N 342.233 1.622 10 10 EDCE Cc1ccc(CN=c2[nH]ccnc2C(=O)O)c(O)c1Br 2381140883 RDAVTZVISWCPPA-UHFFFAOYSA-N 338.161 1.985 10 10 EDCE CN(C)c1ccc(CN[C@H]2CCC[C@H]2CNS(C)(=O)=O)cc1F 800309933 QBYKPPWMTYQXCS-ZFWWWQNUSA-N 343.468 1.699 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(C2CC2)CC1 299366629 XFMDIKASYIGRHV-UHFFFAOYSA-N 330.476 1.491 10 10 EDCE COC[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 817275306 ZAXSLVNCLWEUTL-INIZCTEOSA-N 347.459 1.644 10 10 EDCE O=C(Nc1cnc(Br)cn1)c1cc(O)c(O)c(O)c1 2132348289 ILTFDBUIZFZSKV-UHFFFAOYSA-N 326.106 1.608 10 10 EDCE CNCc1ccc(N2CCN(C(N)=O)CC2)c(Br)c1 722175099 XYHHFLNOAVWNAB-UHFFFAOYSA-N 327.226 1.369 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC3(COC3)C2)cc1 827165407 YCIMQTRFOIYWGO-UHFFFAOYSA-N 345.443 1.398 10 10 EDCE CCc1cccc(CN2C[C@@H]3[C@H](C2)[C@@H](OC)CS3(=O)=O)c1O 827389325 NLNANSUKPKXLRX-QLFBSQMISA-N 325.430 1.198 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N[C@@H](C)c2nnc(O)n2C)cc1 914254689 QQIOPHBDVZYBLV-LBPRGKRZSA-N 346.435 1.927 10 10 EDCE CC[C@@](C)(CO)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 847860838 XMVOQSWMTNUKEV-IBGZPJMESA-N 347.459 1.380 10 10 EDCE C[C@H](NC(=O)C(=O)NCCC1(CN)CC1)c1ccc(N(C)C)cc1 846344063 NSGTZERKLKFIPQ-ZDUSSCGKSA-N 332.448 1.175 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N3CC[C@@H]3C)CC2)cc1 743362596 GCCSNDNSWAWJOD-HNNXBMFYSA-N 332.448 1.621 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@@H](C)CO 853776554 RMEYXXMQCQERGF-KBPBESRZSA-N 335.448 1.464 10 10 EDCE C[C@@H](NCc1ccc(N2CCC(C(N)=O)CC2)cc1)C(C)(C)CO 926875463 DAHNZIHCGNGEDK-CQSZACIVSA-N 333.476 1.885 10 10 EDCE COc1nc(C)cc(C)c1CN(C)C(=O)C(=O)Nc1ccc(N)cc1 857097802 VIYOROJGMMRCMM-UHFFFAOYSA-N 342.399 1.886 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnn(C)c3OC)C2)cc1 855222934 DJNXAFPCSATZJQ-LBPRGKRZSA-N 330.388 1.446 10 10 EDCE C[C@@H](NC[C@H](O)CS(C)(=O)=O)c1cccc(C(F)(F)F)c1O 927023731 IVWLPGZFQINFOA-BDAKNGLRSA-N 341.351 1.467 10 10 EDCE COc1cc(O)c(CN2CC[C@H](N(C)C(=O)N(C)C)C2)cc1OC 853585183 VXPZGIMOQHZCDO-ZDUSSCGKSA-N 337.420 1.597 10 10 EDCE NC[C@H]1CC(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)=NO1 852882503 JBEUDFKPJZBIRA-UONOGXRCSA-N 333.388 1.003 10 10 EDCE C[C@H](NC[C@@H](O)CS(C)(=O)=O)c1cccc(C(F)(F)F)c1O 927023732 IVWLPGZFQINFOA-DTWKUNHWSA-N 341.351 1.467 10 10 EDCE C[C@H](NC1CN(S(=O)(=O)N(C)C)C1)c1ccc2ccccc2c1O 858569481 IKWMZMYAFAWUKS-LBPRGKRZSA-N 349.456 1.687 10 10 EDCE COc1ccc2ccc(O)c(CN3CCO[C@@H](CC(N)=O)C3)c2c1 863325000 PRHIDWDEMYVPMQ-AWEZNQCLSA-N 330.384 1.630 10 10 EDCE C[C@H](NCC(=O)Nc1cccnn1)c1ccc(N2CCOCC2)cc1 930210917 QHIHSYCDIPJDPA-AWEZNQCLSA-N 341.415 1.603 10 10 EDCE CCOC(=O)[C@H]1CCCN1S(=O)(=O)N[C@@H](C)c1ccccc1O 867833991 JBNVOKVUIGBECX-WCQYABFASA-N 342.417 1.315 10 10 EDCE C[C@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CC(=O)N1C 1116917886 OZYLTIIHEHRUKH-AWEZNQCLSA-N 334.439 1.240 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)NCc1ccc2c(c1)CCCO2 1876257519 WDYQSMDSNQLMBN-HNNXBMFYSA-N 336.432 1.987 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)OCC3CC3)CC2)cc1 790019769 FEVOJAWGDGCXPF-UHFFFAOYSA-N 333.432 1.953 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCN2CCC(O)CC2)cc1 1147831418 PUWUHPVPZIKVRC-UHFFFAOYSA-N 333.392 1.426 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(F)cnc1O 1162539841 NELCXCPGVLWDBV-UHFFFAOYSA-N 348.330 1.837 10 10 EDCE CN(C)CC[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1cccnc1 1303874448 WOJNFECBIVXZGU-HNNXBMFYSA-N 329.400 1.845 10 10 EDCE C[C@@H](NC(=O)NCc1nc(O)c2c(n1)CCOC2)c1ccccc1O 1313187325 ACSMOHCRQZSZQO-SNVBAGLBSA-N 344.371 1.521 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)C[C@]2(C)CO)c(Br)c1 698134497 AZNGAFFHKAIKCR-NURSFMCSSA-N 329.238 1.791 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccn(C)c1C 1344549133 DJECXYFIDYDNGW-AWEZNQCLSA-N 346.383 1.649 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CCN(C)[C@@H]2C)cc1C 1268686931 RXGLBCMJXFEELB-ZMSDIMECSA-N 333.476 1.938 10 10 EDCE C[C@H]1CCOCCN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1351067558 AGQNLRFYVBANRA-AWEZNQCLSA-N 345.443 1.323 10 10 EDCE CN(C)c1ccc(CNC(=O)c2ccc(Cn3ccnn3)o2)cc1 1531321934 STCIEZGLAQWQCV-UHFFFAOYSA-N 325.372 1.915 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccnc(CO)c3)CC2)cc1F 1465930221 JSROXQQTUFQFEU-UHFFFAOYSA-N 345.374 1.684 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccnc(-c2ccccn2)n1 1545669084 JNALHGNPSPFPNN-UHFFFAOYSA-N 336.351 1.922 10 10 EDCE COc1ccc(CNC(=O)c2ccccc2Cn2ccnn2)c(O)c1 1617753583 RDOJDRRFUMWKTO-UHFFFAOYSA-N 338.367 1.971 10 10 EDCE COc1cc2c(cc1O)[C@H](c1ccc(O)c(O)c1)[C@@H](CO)[C@@H](CO)C2 14435204 GQLVRVYXAHDDLB-UHYGZKCKSA-N 346.379 1.717 10 10 EDCE biogenic CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nc(O)nc(O)c1OC 1627026379 FWRUVNGMMBFISQ-UHFFFAOYSA-N 340.332 1.018 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)Cc2cnc[nH]2)cc1C 1715684636 JNZXJRCOKGATKT-CQSZACIVSA-N 330.432 1.954 10 10 EDCE Cc1cc(C(=O)Nn2ccc(O)nc2=O)c(C)n1-c1ccc(F)cc1 1634350711 KKVJSXBABFYUDP-UHFFFAOYSA-N 342.330 1.879 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)c2cnn(C)n2)cc1C 1725117580 XCRDAAPFEFXDJX-STQMWFEESA-N 331.420 1.429 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)Cc2nonc2C)cc1C 1492105693 WVHKPIUKMYUUCU-ZDUSSCGKSA-N 346.431 1.922 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](O)CC(C)(C)C3)nc12 1648050478 WDROFRZIOZTVAD-GFCCVEGCSA-N 348.403 1.204 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cncnc2O)cc1C 1669323609 FUJFBGOLVTUYFJ-GFCCVEGCSA-N 330.388 1.407 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)C(N)=O)c2ccccc2)cc1C 1664587832 ILEQZNVSZBVYLJ-MRXNPFEDSA-N 341.411 1.436 10 10 EDCE COc1nccc(C(=O)N[C@@H](C)CNCc2ccc(OC)c(C)c2)n1 1669610838 RZOHRVSMKUWFGI-ZDUSSCGKSA-N 344.415 1.710 10 10 EDCE C[C@H]1CO[C@H](CO)CN1c1ccc(CN)c(Br)c1F 231840446 AENZMBNFPXNGAC-WPRPVWTQSA-N 333.201 1.633 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@H]1NCc1cccc(O)c1O 1943955755 UFBKMNZGEBSXME-CHWSQXEVSA-N 338.404 1.870 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC(N=[N+]=[N-])C2)C[C@H](O)C1(C)C 2018046546 BELJYXFSDQXNTM-ZUZCIYMTSA-N 339.396 1.562 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](NCc1ccc2c(c1)CCO2)C(=O)O 2022035749 YPVLCTXXZPKKOH-CYBMUJFWSA-N 336.388 1.689 10 10 EDCE NCc1ccc(N2CC(=O)N3CCC[C@H]3C2)c(F)c1Br 2158197639 USQQYTSFCALJDC-JTQLQIEISA-N 342.212 1.858 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)cc1Br 2158411533 UAJDQIMRZUDMIT-JYBASQMISA-N 341.249 1.925 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H](C)c3cc4n(n3)CCCC4)c2n1 2062257236 QGGQELITXRDEKS-LLVKDONJSA-N 340.387 1.767 10 10 EDCE COc1ccc(N2CC[C@H](N)[C@@H](CO)C2)c(OC)c1Br 2178907264 OZQPASHLZHIRIV-ZJUUUORDSA-N 345.237 1.612 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)cc1Br 2189048988 KHHDRGURKHHTMX-ZVXAKGHKSA-N 341.249 1.912 10 10 EDCE O=C(NC[C@H]1CCCCN1C(=O)C(F)(F)F)c1ccc(O)c(O)c1 2054399891 XJYKTBGMHXJSDM-SNVBAGLBSA-N 346.305 1.771 10 10 EDCE O=S1(=O)C[C@@H]2CCN(Cc3ccc(Br)cc3O)[C@H]2C1 2094882767 MWYSPFPPXMCHQJ-JQWIXIFHSA-N 346.246 1.774 10 10 EDCE COc1ccc(N2C[C@@H](CO)[C@@H](CO)C2)c(OC)c1Br 2234902697 NHMHTIZIAZWNSR-AOOOYVTPSA-N 346.221 1.503 10 10 EDCE COc1ccc(Br)c(CN2C3COCC2COC3)c1O 2236082539 MVAVEDAXZUHRMM-UHFFFAOYSA-N 344.205 1.763 10 10 EDCE COc1ccc(Br)c(CNCc2ccc(O)nn2)c1O 2236048566 FBDLAHYTBPGRRA-UHFFFAOYSA-N 340.177 1.949 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)C[C@H](CO)C2)c(Br)c1 2236637052 RCHZCWDGGKWHCR-SRVKXCTJSA-N 343.265 1.896 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@]12C[C@](NC(=O)OC(C)(C)C)(CO1)C2 2247290156 KMWPEDLBUKGURZ-SHTZXODSSA-N 339.396 1.972 10 10 EDCE CC[C@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2288930420 ALSGIMXMXGZAMM-UHTWSYAYSA-N 340.221 1.751 10 10 EDCE CN(CCn1cccn1)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297523319 UJNJTRQSULOSRG-UHFFFAOYSA-N 340.427 1.892 10 10 EDCE CNC(=O)c1cncc(C=CC(=O)N2CCSc3ccncc32)c1 2299010934 LAQXMQAOZIRKAV-UHFFFAOYSA-N 340.408 1.988 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1C 2300531787 LYGNKZZTGNZGAC-GFCCVEGCSA-N 340.428 1.696 10 10 EDCE NC(=O)CC[C@@H](C(=O)O)N1C(=O)C(=Cc2ccco2)SC1=S 2314541091 DZKZBUKRPFSYHD-QMMMGPOBSA-N 340.382 1.200 10 10 EDCE Cc1ccc(CN2C[C@@H]3[C@H](C(N)=O)[C@@H]3C2)c(O)c1Br 2352650239 SCDOAJPRMARKOK-JGPRNRPPSA-N 325.206 1.626 10 10 EDCE COc1cccc(CNC(=O)c2cnc3ccccn3c2=O)c1O 75650725 XAAJRYRIYAOSDJ-UHFFFAOYSA-N 325.324 1.339 10 10 EDCE CCCN(CCC(=O)OCC)C(=O)CCN1C(=O)CSC1=S 1865765920 PODNROXBTXPBRP-UHFFFAOYSA-N 346.474 1.429 10 10 EDCE CCOc1ccc(O)c(CN2CCC(CNS(C)(=O)=O)CC2)c1 289334907 HCBHNQBHRKWJJY-UHFFFAOYSA-N 342.461 1.552 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)Cc3ccnn3C)C2)cc1 819587673 GOZBGSTVKZPBHL-CQSZACIVSA-N 328.416 1.614 10 10 EDCE CCn1ncc(C(=O)NCc2ccc(N3CCSCC3)cc2)n1 815046276 OFVGPZBANUBJKB-UHFFFAOYSA-N 331.445 1.781 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H](C)[C@@H]3CCCN3)CC2)cc1 817892460 AEGASODEPWMWSR-LPHOPBHVSA-N 332.492 1.547 10 10 EDCE O=S1(=O)CCN(Cc2cc3c(cc2O)OCO3)[C@@H]2CCC[C@H]21 825200349 DEUCZCRSHDLZNW-IAQYHMDHSA-N 325.386 1.272 10 10 EDCE Nc1ccc(OCCCON2C(=O)COc3cccc(N)c32)cc1 821298744 DXHVCNHUODHYCZ-UHFFFAOYSA-N 329.356 1.977 10 10 EDCE Cc1cc(CC(=O)N2CCN(C)C(=O)C2)c(C)n1-c1ccccc1 828483869 UTJBAQSZNWTZNM-UHFFFAOYSA-N 325.412 1.937 10 10 EDCE CC(C)(C)OC(=O)COCC(=O)OCC(=O)c1ccc(O)c(O)c1 830418758 JRWSFTIMDYFCRV-UHFFFAOYSA-N 340.328 1.182 10 10 EDCE C[C@H](NC(=O)N1C[C@H](C)N(CCO)C[C@H]1C)c1ccc(N(C)C)cc1 842181868 CIRKVGMUGMIJRP-XHSDSOJGSA-N 348.491 1.910 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)N[C@@]4(CCSC4)C3=O)C2)cc1 849356595 FRXVLXHWWADGJX-CXAGYDPISA-N 347.440 1.701 10 10 EDCE CO[C@]1(CNCc2ccc(N(C)C)c(F)c2)CCS(=O)(=O)C1 922616811 TXEZCSHTSDTKIO-HNNXBMFYSA-N 330.425 1.185 10 10 EDCE COC[C@@]1(C(=O)OC)CCCN1C(=O)/C=C\c1ccc(O)c(O)c1 855375406 OMDDZCTVHHJYCK-XTKXOIQPSA-N 335.356 1.292 10 10 EDCE C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@@H](C)O1 850699741 XCWLKCHHDMUODK-CABCVRRESA-N 347.459 1.737 10 10 EDCE C[C@H](C(=O)N(C)CC(=O)NCc1c(O)cccc1F)n1cccn1 928711646 KJTDKCJBGCLSQK-LLVKDONJSA-N 334.351 1.064 10 10 EDCE CS(=O)(=O)CC1(CCNC(=O)c2c(F)ccc(O)c2O)CC1 857301519 UNGDJELGASNOSR-UHFFFAOYSA-N 331.365 1.182 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@]3(C)CCC(=O)NC3)C2)cc1 855227471 ZFTWQEVRKOIQOY-FZKQIMNGSA-N 331.416 1.306 10 10 EDCE CCn1nc(C)cc1NC(=O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 861739925 WFXGZRVMJGZERL-NSHDSACASA-N 346.387 1.742 10 10 EDCE CN1CC[C@H]2CN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC[C@H]21 866205416 LODBYCNPMYKYQV-CMPLNLGQSA-N 332.360 1.456 10 10 EDCE COC(=O)C1(CS(=O)(=O)N2Cc3cccc(O)c3C2)CCC1 867691465 XBJBVPBCWROTLH-UHFFFAOYSA-N 325.386 1.381 10 10 EDCE COC(=O)c1c(CN2C[C@H]3C[C@]3(CO)C2)c2cc(F)ccc2n1C 894535881 XPQKYYSKIKEORK-ADLMAVQZSA-N 332.375 1.918 10 10 EDCE CC(C)(CNC(=O)c1ccc(N=NC(N)=O)cc1)N1CCOCC1 1135627684 BOUUVUXXYKZVTM-UHFFFAOYSA-N 333.392 1.690 10 10 EDCE CN(C)C(=O)COc1ccccc1C(=O)NCc1ccc(O)cc1O 1142529809 GKPCRBGADSXOAL-UHFFFAOYSA-N 344.367 1.495 10 10 EDCE O=C(CN1C(=O)CCOc2ccccc21)NCc1cc(O)ccc1O 1303223244 HCRDSFFDRMBWTD-UHFFFAOYSA-N 342.351 1.530 10 10 EDCE CS(=O)(=O)c1ccc(Cc2n[nH]c(Cc3ccc(N)cc3)n2)cc1 82752309 JYNRRNUNCSQMJO-UHFFFAOYSA-N 342.424 1.972 10 10 EDCE CN[C@@H](C)CCNC(=O)NCc1cc(Br)ccc1O 1326131773 DEWDIXWGCHALPA-VIFPVBQESA-N 330.226 1.952 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2csnc2C)cc1C 1331699165 YIYQJEBJJAKSAN-CQSZACIVSA-N 349.456 1.649 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2cn(C)c(O)n2)cc1C 1270507505 OGSJTRPZWHINJE-GFCCVEGCSA-N 346.431 1.598 10 10 EDCE C[C@]1(NCc2ccc(Br)cc2O)CCC(=O)NC1=O 2116204797 FLXAJXAZDYBYFC-ZDUSSCGKSA-N 327.178 1.440 10 10 EDCE NC(=O)c1ccc(CN(C(=O)Cc2ccc(O)c(O)c2)C2CC2)cc1 1463544801 NENKIGSIWFJTQR-UHFFFAOYSA-N 340.379 1.930 10 10 EDCE CC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)N1CCOCC1 1465635744 QKLVCUPLZMWAOT-ZDUSSCGKSA-N 347.375 1.216 10 10 EDCE CS(=O)(=O)Nc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1540638007 CMJQXCRENSDNQQ-UHFFFAOYSA-N 336.369 1.651 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)Cc2cncs2)cc1C 1486006812 SXKROZUXRFUEQE-CQSZACIVSA-N 349.456 1.270 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CCCN2C(N)=O)cc1C 1498206266 DGLASHFQYCJEMM-ZFWWWQNUSA-N 348.447 1.141 10 10 EDCE Cc1n[nH]c(C)c1[C@H]1COCCN1C(=O)Cc1ccc(O)c(O)c1 1636545482 OYHCITXYXOYVDN-CYBMUJFWSA-N 331.372 1.580 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CS(=O)(=O)c2ccccc21 1631109350 IVOXPMKTSSVYNN-LBPRGKRZSA-N 333.365 1.285 10 10 EDCE COc1cc(OC)nc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n1 1633818732 KHANCGDNONPWEC-VIFPVBQESA-N 333.344 1.266 10 10 EDCE C[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccc(S(C)(=O)=O)cc1 1632037672 TWRSWMGYZBMTOJ-NSHDSACASA-N 349.408 1.921 10 10 EDCE CCN(CCCNC(=O)c1ccc(N=NC(N)=O)cc1)C[C@H](C)O 1731325903 XYJIDRXSGPBCMF-LBPRGKRZSA-N 335.408 1.672 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 1568575874 RCWADGFBGHCIIX-UHFFFAOYSA-N 346.343 1.609 10 10 EDCE CC[C@H](O)Cn1cc(C(=O)NCc2c(O)ccc3ccccc23)nn1 1647791000 FTBKDALLCPNFPI-ZDUSSCGKSA-N 340.383 1.838 10 10 EDCE COc1ccc(-n2nnnc2CNCC(C)(C)CN(C)C(C)=O)cc1 1674811584 FAVJUCDHMWCRJF-UHFFFAOYSA-N 346.435 1.265 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N[C@@H]1CCc2ncnn2C1 155355734 CIZPEWPTUFKISJ-OAHLLOKOSA-N 338.415 1.469 10 10 EDCE O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)c1cc(O)c(O)c(O)c1 1866303383 SWASDQSFKJGFOS-LBPRGKRZSA-N 329.308 1.455 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)cc1Br 2140664548 RHQVGWUBMMLDSR-HPXOCHMKSA-N 333.201 1.349 10 10 EDCE O=C1Nc2cc(N3CC4(CCOC4)C3)c(Br)cc2[C@H]1O 1915315224 NWZNZXDLGDMUTI-GFCCVEGCSA-N 339.189 1.661 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H]1COC(=O)N1 1951941931 ZKMOBNAFKRBSDW-WDEREUQCSA-N 338.360 1.642 10 10 EDCE Cn1ccc(-c2ncnc(I)c2N)cc1=O 1983727593 WGIRGBJPBDRLKU-UHFFFAOYSA-N 328.113 1.029 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2C[C@@]2(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003172101 GIMUGWFCGBQIKE-QMQUXMOJSA-N 336.432 1.945 10 10 EDCE O[C@@H]1C[C@@H](O)CN(c2ccc(CNC3CC3)c(Br)c2)C1 2161357931 UZOZTVZQKMLTOK-ZIAGYGMSSA-N 341.249 1.633 10 10 EDCE Oc1cc(Br)ccc1CN1CC(O)(C2CCNCC2)C1 2176939276 RQSAKRHONGMDOX-UHFFFAOYSA-N 341.249 1.701 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCO[C@@H]2CCNC[C@@H]21 2185534430 UVEDHHUMJXNIBU-QWHCGFSZSA-N 345.212 1.857 10 10 EDCE CN(C)c1ccc(CN=c2nc(CNC(=O)OC(C)(C)C)[nH][nH]2)cc1 2063196571 VDJMGXYDDLFJPZ-UHFFFAOYSA-N 346.435 1.929 10 10 EDCE CC[C@@H](NCCn1cnnn1)c1cc(Br)ccc1O 2090428904 WMYURIVOGVMAAN-LLVKDONJSA-N 326.198 1.882 10 10 EDCE O=C(O)[C@@H]1[C@@H]2OCCN(Cc3ccc(Br)cc3O)[C@@H]21 2092844072 JOXBQCYYLPLHSK-TUAOUCFPSA-N 328.162 1.439 10 10 EDCE C[C@H](O)c1ccc(N(C)[C@@H]2CC(=O)NC2=O)c(Br)c1 2114727468 PRVNBIXZDAVZGN-WRWORJQWSA-N 327.178 1.354 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCCC[C@@H]1COc1nnc(=N)[nH]n1 2213779141 PRDQEFPPTPLXIT-GHMZBOCLSA-N 338.412 1.389 10 10 EDCE NCc1ccc(N2C[C@H]3CS(=O)(=O)[C@H]3C2)c(Br)c1 2314962778 KLTHYGODKGKYOP-CABZTGNLSA-N 331.235 1.141 10 10 EDCE Cc1ccc(CN2CC[C@@H](O)C[C@H]2CO)c(O)c1Br 2352677741 CLNYGEOKENVYMS-NWDGAFQWSA-N 330.222 1.781 10 10 EDCE Cc1ccc(CN2CCN(C)[C@@H](CN)C2)c(O)c1Br 2352932279 KTLQKEYVITWOEV-LBPRGKRZSA-N 328.254 1.538 10 10 EDCE C[C@@H](O)CN1CCC(CN(C)Cc2cc([N+](=O)[O-])ccc2O)CC1 171588953 JBXMAEWXOHMNHG-CYBMUJFWSA-N 337.420 1.825 10 10 EDCE CNC(=O)Cc1nc(CN[C@H](C)c2cc(OC)ccc2O)cs1 182348430 XLGDUERKGFOTNL-SNVBAGLBSA-N 335.429 1.997 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCCN(CCO)CC2)c([N+](=O)[O-])c1 255216773 QUAFSSUCQAWJFU-XQRVVYSFSA-N 349.387 1.285 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)NC3CC(C)C3)CC2)cc1 267736301 AQRWZVOZWOYGSR-UHFFFAOYSA-N 346.475 1.915 10 10 EDCE CCN1CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])CC1=O 273279259 IUXZWUPQUFNUEV-FNORWQNLSA-N 333.344 1.450 10 10 EDCE CN(C)CCCN(C)C(=O)C(=O)NCCCSc1nccs1 806278530 SXBVVGZVGJQTFQ-UHFFFAOYSA-N 344.506 1.152 10 10 EDCE CCS(=O)(=O)c1ccc(CCC(=O)OCC(=O)C(C)=O)cc1 808531208 MFOIUOBALIQZBN-UHFFFAOYSA-N 326.370 1.114 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1CC[C@H]2C[C@H]2C1 834774568 AZEPTNHYRJFICV-YESZJQIVSA-N 339.439 1.984 10 10 EDCE CN1C[C@@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)NC1=O 830137051 GLMDWABVDYQQPE-AWEZNQCLSA-N 329.356 1.538 10 10 EDCE CN1CCN(c2ccc(CN3CC(C)(C)O[C@@H]4COC[C@H]43)cc2)CC1 846119151 XXPRLCKIPXVYNE-RTBURBONSA-N 345.487 1.817 10 10 EDCE CN(CC1(O)CCOCC1)c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 844214406 PWQCBUIYGGXCML-HWKANZROSA-N 336.344 1.670 10 10 EDCE COC[C@@H]1CC[C@H]([C@H]2COCCN2C(=O)Nc2ccc(N)cc2)O1 926141482 DNNRUOLPUZFSEH-ARFHVFGLSA-N 335.404 1.696 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@@H]2CC[C@H]3C[C@H]23)c1 927481273 CATSQPGRWAIRJG-GMXVVIOVSA-N 338.429 1.930 10 10 EDCE C[C@@H](NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1[C@H]2CN[C@H]1C2 925501330 IFOVSNXVYJJRBA-JBCDFXQESA-N 329.488 1.981 10 10 EDCE CCOC(=O)[C@H]1CN(Cc2cc(F)cc(C(C)=O)c2O)CCO1 750826886 SYGNUTOEZIWYRU-CQSZACIVSA-N 325.336 1.498 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)CC(=O)N2CCCC2)c([N+](=O)[O-])c1 931395509 UZLRIOMGTNNYBX-VURMDHGXSA-N 347.371 1.840 10 10 EDCE CO[C@@H]1CCn2cc(C(=O)NCCc3ccc(O)c(O)c3)nc2C1 866757065 IMQJSSDCFVUELC-GFCCVEGCSA-N 331.372 1.228 10 10 EDCE Cc1cc(C)c([C@@H](C)NC[C@@]23COCCN2C(=O)COC3)c(O)c1 866551525 APXQEPCHZGBLBR-KDOFPFPSSA-N 334.416 1.287 10 10 EDCE C[C@H](NC(=O)c1ccc(S(N)(=O)=O)cn1)c1ccc(N(C)C)cc1 773989011 NGNOMLJUWKFADJ-NSHDSACASA-N 348.428 1.286 10 10 EDCE Cn1cc([C@@H]2C[S@@](=O)CCN2Cc2ccc(F)c(F)c2O)cn1 895379602 MSYKAIWVMROEBF-NPMABZOXSA-N 341.383 1.710 10 10 EDCE CN(C)c1ccc(CN(C(=O)c2nnc(O)nc2O)C2CC2)cc1 1136180843 QGXIFTIRIMSPTJ-UHFFFAOYSA-N 329.360 1.154 10 10 EDCE Nc1n[nH]c(CNC(=O)N(Cc2ccco2)Cc2ccccc2O)n1 1313162680 GMMVHCXJHALYPY-UHFFFAOYSA-N 342.359 1.598 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC[C@]12CCOC2 1327863468 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CC(C)C[C@@H](CNC(=O)C(=O)N(C)Cc1ccccc1O)C(=O)O 818659095 KHRQMBQHEFOIGL-ZDUSSCGKSA-N 336.388 1.214 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@@H]3CCOC3)C2)cc1 824693177 JSIZTTYIFVPLPV-GDBMZVCRSA-N 333.432 1.952 10 10 EDCE CC[C@@H](C)N1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 829244541 YIMHAVVXNWUKDN-LLVKDONJSA-N 334.376 1.846 10 10 EDCE C[C@@H]1CO[C@H](C(=O)N(CC(=O)O)Cc2cc(Cl)ccc2O)C1 911360831 YSIMWBZOCHVNTQ-ZANVPECISA-N 327.764 1.884 10 10 EDCE O=C1O[C@@H](CNCc2ccc(N3CCOCC3)c(F)c2)CN1C1CC1 848578367 WLWKVIFXIUDDFO-HNNXBMFYSA-N 349.406 1.735 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H]2CNCCC2(F)F)c1 842003655 ODLLYNHBTWCSGO-NOZJJQNGSA-N 329.347 1.758 10 10 EDCE CCCC(=O)NCC(=O)OC[C@H]1CCN(c2ccc(OC)cc2)C1 842877445 DPQVAOPFSLQUCY-AWEZNQCLSA-N 334.416 1.981 10 10 EDCE O=C1[C@H]2[C@H]3C[C@H]4[C@@H]2[C@@]2(C(=O)NCc5cc(Cl)ccc5O)[C@@H]4[C@@H]3[C@@H]12 846477096 QAHOZHUHTNVOAH-PHXIEWMQSA-N 329.783 1.989 10 10 EDCE Cc1cc(Br)c(O)c(CNC[C@H]2COCCN2C)c1 858276425 OKOHGQKBQBOHNF-LBPRGKRZSA-N 329.238 1.883 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H](CC3OCCO3)C2=O)cc1F 924543187 QGCBHEDREVGOPV-GFCCVEGCSA-N 337.351 1.075 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)C(=O)N(C)C)C2)cc1 851985253 UCFGGRGSCPLZFG-CHWSQXEVSA-N 334.420 1.050 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)COCc2nccn2C)cc1 855019879 ATAKNXCQSHIZHO-UHFFFAOYSA-N 346.431 1.540 10 10 EDCE COc1cc(CN2CCN(S(C)(=O)=O)[C@H](C)C2)c(O)cc1C 853564536 RMGBDAMKJLOWQK-GFCCVEGCSA-N 328.434 1.175 10 10 EDCE OC[C@@H]1C[C@H](O)CN1c1ccc(CNC2CC2)c(Br)c1 698202162 WLUOJYBIXVCTNK-KBPBESRZSA-N 341.249 1.633 10 10 EDCE COc1cc(N2CC(C3CS(=O)(=O)C3)C2)c([N+](=O)[O-])cc1OC 853663233 WQXPHKNMHHGRIX-UHFFFAOYSA-N 342.373 1.093 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@H]1CNC(=O)C1 926971036 VZKHHJLZGGUZDL-OAHLLOKOSA-N 332.448 1.810 10 10 EDCE C[C@H](NC(=O)N[C@H](C)CCN1CCN(C)CC1)c1ccccc1O 868509157 BFDJSRUACKSTRD-CABCVRRESA-N 334.464 1.778 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCN3C(=O)OCC[C@@H]3C2)c1O 774914948 ORJRZTDEMUIANF-LLVKDONJSA-N 337.332 1.336 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C[C@H](NC(=O)N[C@H](C)c1ccccc1O)C1(S(C)(=O)=O)CC1 868601295 MQVRHPGVQQYOQJ-MNOVXSKESA-N 326.418 1.718 10 10 EDCE CCOc1ccc(CN2CCC[C@@H](CS(N)(=O)=O)C2)c(O)c1 769385127 SXIIQQHTNCFHKE-GFCCVEGCSA-N 328.434 1.291 10 10 EDCE C[C@@H]1OCCO[C@@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1119832367 KCGNXBCQOLHRGE-BBRMVZONSA-N 336.457 1.660 10 10 EDCE COc1cc(NC(=O)NCc2ccc(N3CCOCC3)cc2)n(C)n1 881252694 SCHNWQAUGXYWTD-UHFFFAOYSA-N 345.403 1.587 10 10 EDCE COC(=O)c1cnc(CCNC(=O)/C=C\c2ccc(O)c(O)c2)s1 1157907214 NYUPKKCTHZPOSY-HYXAFXHYSA-N 348.380 1.713 10 10 EDCE O=C(Cn1nnc2ccccc2c1=O)NCc1cccc(Cl)c1O 1159034060 QCZYODAIHLIFLG-UHFFFAOYSA-N 344.758 1.467 10 10 EDCE NS(=O)(=O)Cc1cccc(C(=O)NCc2c(O)cccc2F)c1 1303878615 PIXANJWJSCPEIR-UHFFFAOYSA-N 338.360 1.250 10 10 EDCE O=C(C(=O)N1CCC[C@]2(C1)CC2(F)F)N1Cc2cccc(O)c2C1 1329435760 ICLYQZABFGIQMC-MRXNPFEDSA-N 336.338 1.882 10 10 EDCE Cn1nc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C=O 1341324411 ZGKXNXJCNOPEMC-UHFFFAOYSA-N 346.362 1.138 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1CN(C)CCO1)NCc1ccc(OC)c(C)c1 1269384809 WXUPWCPXYNFBQZ-AEFFLSMTSA-N 349.475 1.319 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2cccnc2C)cc1C 1278139655 UQXGKRKVIGSUKI-INIZCTEOSA-N 343.427 1.588 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H](C)n2cccn2)cc1C 1272371466 MABVQMODBBOBPZ-GOEBONIOSA-N 346.431 1.028 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CN(c3ccccc3)C2=O)cc1 1447622127 UXWXITIYXRDLTR-CQSZACIVSA-N 337.339 1.994 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](NS(C)(=O)=O)C(C)C)c1 1445967053 JPVLRABMWWMSBZ-YGRLFVJLSA-N 344.433 1.152 10 10 EDCE O=C(C[C@H]1NC(=O)c2ccccc21)NCCc1ccc(O)c(O)c1 1294914115 WCJUDUAWNBZQCR-CQSZACIVSA-N 326.352 1.631 10 10 EDCE CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NCc1cccc(O)c1O 1520509698 UHGDFIUKGRBQLT-JTQLQIEISA-N 334.294 1.417 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCC=CO3)CC2)cc1 1292281381 DRBYTXUELNSMPF-SFHVURJKSA-N 345.443 1.626 10 10 EDCE C[C@H](O)c1ccc(N2CC3(CNC(=O)C3)C2)cc1Br 2119572337 DJHMLEWSLNCKCD-VIFPVBQESA-N 325.206 1.829 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)c2cnn(C)n2)cc1C 1717688460 QXJITCHXXNMHSE-CQSZACIVSA-N 345.447 1.820 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2ncn(C)n2)cc1C 1482099438 QHTFHACTIKFIAS-GFCCVEGCSA-N 331.420 1.288 10 10 EDCE CC(C)(C)C(=O)Nc1nccnc1C(=O)NCc1cc(O)ccc1O 1558174354 KFJNXSIFKZBXLM-UHFFFAOYSA-N 344.371 1.802 10 10 EDCE Cc1ccc(O)c(O)c1C[C@@H](O)[C@@H]1C(=O)C[C@@H](O)[C@]2(C)C(=O)CC[C@@H]12 31541802 YFZJGCLOFUBQST-DWTDDLGQSA-N 348.395 1.245 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1COC(=O)N1 1568738124 AWTVAFBBHCAXEC-AWEZNQCLSA-N 335.404 1.050 10 10 EDCE O=C(NCc1c(O)cccc1O)C1CCN(c2cnccn2)CC1 1645361026 UECKBPXMBLEWNE-UHFFFAOYSA-N 328.372 1.421 10 10 EDCE C=CC(=O)N(C)CC(=O)Nc1c(-c2ccccn2)nc2ccccn12 1570017193 IZQLDEGCDCTUTJ-UHFFFAOYSA-N 335.367 1.979 10 10 EDCE C[C@H](O)CNC[C@@]1(C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1671814658 BWAYKRLNNYASIR-YVEFUNNKSA-N 347.419 1.672 10 10 EDCE O=C1N[C@@]2(CNCc3cccc(Br)c3O)CC[C@H]1C2 1967816874 IPNRDDFRTBJQGB-XPTSAGLGSA-N 325.206 1.913 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NCc1ccc(O)c(O)c1O 1944916648 BFBYDCGIPQZFPT-WDEREUQCSA-N 340.376 1.185 10 10 EDCE Oc1ccc(Br)cc1CN[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@H]2O 1974124008 VEOBYEOMQDAOSS-AHLIPFBISA-N 328.206 1.375 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC(=O)c3ccc(O)c(O)c3)[C@H]2C1 2006284070 LWQHYBUZDFLLNX-YABSGUDNSA-N 334.372 1.693 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2160717521 SPKAAABURTUJKT-CNSIFVFBSA-N 341.249 1.660 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H]3C[C@H]4O)c(Br)cc21 2172091726 GLEUEKWBELRFIF-JJNRPBTQSA-N 338.205 1.361 10 10 EDCE C[C@@H](O)[C@@H]1CCCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2193587785 ZOCAZPYTPVTWIA-RESLBDFXSA-N 340.221 1.751 10 10 EDCE NCc1ccc(N2CC(O)(C(F)F)C2)c(F)c1Br 2052069103 OFXMPSFXLCGNAH-UHFFFAOYSA-N 325.128 1.863 10 10 EDCE O=C1CN(c2ccc(CO)cc2Br)CCN1C1CC1 2114174056 CXOQVBQTNLOLQK-UHFFFAOYSA-N 325.206 1.752 10 10 EDCE Cc1ccc(Cn2cc([C@@H](N)CO)nn2)c(O)c1Br 2352947764 KARDSMJGTUNWHB-VIFPVBQESA-N 327.182 1.095 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1 191745371 LYQHJVPCQLOFCV-IXDOHACOSA-N 331.416 1.847 10 10 EDCE NCc1ccc(N2C[C@H](C(N)=O)C3(CC3)C2)c(F)c1Br 2370345496 IFRHNPJZGGUVMP-SECBINFHSA-N 342.212 1.749 10 10 EDCE C[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C[C@H](C(N)=O)O1 92006340 VUFLBXZDUOSVPA-RDDDGLTNSA-N 329.740 1.028 10 10 EDCE COC(=O)C1=S=C(NC(=O)c2ccc(-c3ncon3)cc2)C=C1 609327881 NOCRJVRFGDSINR-UHFFFAOYSA-N 329.337 1.245 10 10 EDCE Cc1ccc(CNC(=O)C[C@H]2COCCN2)c(O)c1Br 2380738027 UGJACTDDBXDRFS-NSHDSACASA-N 343.221 1.458 10 10 EDCE COCCN1CN(Cc2cc(C)cc(Br)c2O)CC1=O 802658585 BSHMPXAJHMJLSB-UHFFFAOYSA-N 343.221 1.711 10 10 EDCE NCCCCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 827468861 FFXQCMJIQMJPTI-HNNXBMFYSA-N 332.448 1.134 10 10 EDCE CO[C@]1(CN[C@H](C)c2ccc(C)c(C)c2O)CCS(=O)(=O)C1 903364779 BSLVCEIWHMDIDE-CJNGLKHVSA-N 327.446 1.863 10 10 EDCE CO[C@H]1C[C@H](CC(=O)O)N(Cc2cc(F)cc(C(C)=O)c2O)C1 846284966 MUCOAPZWEUGAOD-OLZOCXBDSA-N 325.336 1.798 10 10 EDCE COc1cc(NS(=O)(=O)C[C@H](OC)C2CCOCC2)ccc1O 842586545 VGJYKKVVXWBCNA-HNNXBMFYSA-N 345.417 1.584 10 10 EDCE CC1(C)CN(Cc2ccc(N3CCOCC3)cc2)[C@@H]2COC[C@H]2O1 846117931 IHLHQALTMKQSKU-QZTJIDSGSA-N 332.444 1.901 10 10 EDCE CN1CC[C@H](C(=O)NCc2ccc(O)c(O)c2)[C@H](c2cnn(C)c2)C1 849562757 HAGGHNOAXPGMOO-GJZGRUSLSA-N 344.415 1.183 10 10 EDCE O=C1N[C@]2(C(=O)NCc3ccc(N4CCCC4)cc3)C[C@H]3C[C@H]1[C@H]2C3 845192741 QCUAQZCNCHEVBH-UJAMICLKSA-N 339.439 1.818 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3snnc3C)C2)cc1 852354071 WMPYDIDOIOFLNE-LBPRGKRZSA-N 347.444 1.933 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CC1(C)COC1 924110156 BIHHBCQVYZCPRQ-UHFFFAOYSA-N 334.416 1.681 10 10 EDCE COC(=O)c1ccn(CCCC(=O)NCc2c(O)cccc2F)n1 928711030 PGPDVLQNHONKCG-UHFFFAOYSA-N 335.335 1.611 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cn3cc(Cl)cn3)C2)cc1 855224341 FPZQOOFKTRLSCU-ZDUSSCGKSA-N 334.807 1.940 10 10 EDCE COc1ccc(N(C)CCN(C)C[C@H]2CCCS2(=O)=O)cc1 930850883 ZFOVRYZEBMYWKL-MRXNPFEDSA-N 326.462 1.640 10 10 EDCE CNC(=O)[C@@H]1CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 852449389 RUAAETORBSQKCN-KGLIPLIRSA-N 346.431 1.051 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3ccns3)nc12 860057389 RASUMEYEFPLKSY-VIFPVBQESA-N 347.400 1.919 10 10 EDCE CCOc1cc(O)ccc1NS(=O)(=O)c1cccc(C(N)=O)c1 1116760788 QDPPIDFDOYANST-UHFFFAOYSA-N 336.369 1.691 10 10 EDCE CNC(=O)C1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 895533765 BNJWLXNUBXPNCO-UHFFFAOYSA-N 334.397 1.911 10 10 EDCE CCOCCCC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCC 1153663466 LCGMSWOTXBBBEJ-ZDUSSCGKSA-N 339.388 1.505 10 10 EDCE COC(=O)[C@@H]1CCC[C@H]1NCc1ccc(N2CCN(C)CC2)cc1 1320707763 GCOTXKUWEOYUCC-QZTJIDSGSA-N 331.460 1.870 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@H]3CCCN3C(C)=O)CC2)cc1 1329379527 SSNWIBJYXXOGBJ-GOSISDBHSA-N 345.443 1.745 10 10 EDCE CNC(=O)[C@H](C)N(C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1268758352 BWQIVEVJTUQCNX-QWRGUYRKSA-N 348.407 1.034 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1274285533 FZLGXFQRUWWUQX-UYWGVUBWSA-N 330.428 1.658 10 10 EDCE CC(C)OCCN1CCC(NC(=O)Cc2ccc(O)c(O)c2)CC1 1445462870 PSYQFTSRGIKFFE-UHFFFAOYSA-N 336.432 1.646 10 10 EDCE CS(=O)(=O)c1ccc(F)c(C(=O)NCc2ccc(O)cc2O)c1 1451772513 XETBRZZIVATGAF-UHFFFAOYSA-N 339.344 1.570 10 10 EDCE C[C@@H](C(=O)NCc1cccc(O)c1O)N1CSCCSC1 1528771341 NWNMAPWEMGAOFX-JTQLQIEISA-N 328.459 1.800 10 10 EDCE CCOC(=O)COCCN(Cc1ccccc1O)C[C@@H]1CCCO1 1616179912 JKOOYQQLXHCIBC-INIZCTEOSA-N 337.416 1.953 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)Cc2cncs2)cc1C 1486006811 SXKROZUXRFUEQE-AWEZNQCLSA-N 349.456 1.270 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CN(C)C(=O)C2CC2)cc1C 1714240774 QDCJWYMSXDUZGO-CQSZACIVSA-N 347.459 1.466 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1CCN(C)C1 1715773971 QKHWLSGYLYYOBV-KRWDZBQOSA-N 333.476 1.893 10 10 EDCE Cc1c(CC(=O)NCc2ccc(O)cc2O)nnn1-c1ccccc1 1638351711 CUZOTVMNWQAHLR-UHFFFAOYSA-N 338.367 1.846 10 10 EDCE Cn1nc(CC(=O)NCCc2ccc(O)c(O)c2)c2ccccc21 1631509580 AEZQARKWYUJKCH-UHFFFAOYSA-N 325.368 1.886 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H]2CCNC(=O)C2)cc1C 1568986886 AHWNQTGJNLXWMD-HIFRSBDPSA-N 333.432 1.124 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@@H]2COCCO2)C2CC2)cc1C 1498734129 YVIYWQVDHXOTNJ-AEFFLSMTSA-N 348.443 1.403 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cnn(C)c3)CC2)cc1C 1569389335 CMMFPYHSUCZAMB-UHFFFAOYSA-N 328.416 1.789 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2ccn(C)c(=O)c2)cc1C 1567518327 AMRMCOLDOAXHEU-UHFFFAOYSA-N 343.427 1.564 10 10 EDCE COc1cnc([C@H]2CCCN2C(=O)c2cccc(O)c2O)nc1O 1646488942 PSKBGMAIEBGQPP-SNVBAGLBSA-N 331.328 1.579 10 10 EDCE O=C(CCc1nc(-c2ccncc2)no1)NCc1cc(O)ccc1O 1644752713 QWYFSBGOVFJAJX-UHFFFAOYSA-N 340.339 1.792 10 10 EDCE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCn1ncnn1 1651627409 FSROOPCBZTZTQO-UHFFFAOYSA-N 338.327 1.924 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1COCCO1 1668368046 MVRNDTNZOOVPHN-QGZVFWFLSA-N 336.432 1.357 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)C[C@@H]2CO)cc1Br 2136089147 XFYQCWKKMLWROW-MVWJERBFSA-N 329.238 1.791 10 10 EDCE C[C@H](NCc1ccc(Br)cc1O)C1CS(=O)(=O)C1 1967838469 CAWGQPRLECZAGE-QMMMGPOBSA-N 334.235 1.677 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H]1COCCN1 1952551681 NFYRBEKHMYFQEH-QWHCGFSZSA-N 338.404 1.522 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 1985103536 WXVBKYCYAWQGNC-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)N2CCC(N=[N+]=[N-])CC2)COC1 2014493940 ABEXDBBHGCLBNP-UHFFFAOYSA-N 339.396 1.829 10 10 EDCE Nc1ccc(CC(=O)N[C@@H](COCc2ccccc2)CC(=O)O)cc1 2035480964 DLSSFKKSLGZXFX-QGZVFWFLSA-N 342.395 1.988 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CC(=O)Nc2ccc(N)cc2)[C@@H]2C[C@@H]21 2044676183 QPEHAKBINQCFGK-CABCVRRESA-N 346.431 1.901 10 10 EDCE CN(C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1ccc(O)cc1 2067785975 ARVAJCANSCJJMK-LSDHHAIUSA-N 348.399 1.939 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)c(Br)c1 2102190064 RDRXOLSOWGROBM-HUJUBCJISA-N 327.222 1.665 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2104412281 UEWXVWRUKHUVPS-GURXAOECSA-N 328.206 1.433 10 10 EDCE COc1ccc(N2CC[C@](C)(O)[C@@H](O)C2)c(OC)c1Br 2234903781 SJWVFWIIEFRKEU-FZMZJTMJSA-N 346.221 1.788 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2246444087 BLWZQSBBUOFDFO-TUAOUCFPSA-N 339.396 1.658 10 10 EDCE CSc1ncc(CNCCS(=O)(=O)N2CCCCC2)s1 2284503837 HGMOTKQHMDLVMP-UHFFFAOYSA-N 335.520 1.770 10 10 EDCE CCCO[C@H]1CS(=O)(=O)C[C@H]1NCc1cnc(SC)s1 2284638834 SCIDNCMKWMSRMM-MNOVXSKESA-N 336.504 1.547 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccc(NN)nc2)s1 2284690358 QMDZZRXRTSPSGM-UHFFFAOYSA-N 331.448 1.024 10 10 EDCE CCS(=O)(=O)C1=NN2C(=N)C(=Cc3ccco3)C(=O)N=C2S1 2297346075 ASDIMGSFIAFMRG-UHFFFAOYSA-N 338.370 1.291 10 10 EDCE C[C@](CN)(NC(=O)C=Cc1ccc(N2CCOCC2)cc1)C1CC1 2301731406 XKQVOSFDKPUJGT-LJQANCHMSA-N 329.444 1.780 10 10 EDCE CN(Nc1nc(Cl)c(C(N)=S)s1)S(=O)(=O)C1CC1 2317455909 VGCPZAMGRQTTFT-UHFFFAOYSA-N 326.856 1.182 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2329195228 XJSYVIIMEXTKMQ-HHSCNIOUSA-N 328.206 1.698 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2329194988 RDRXOLSOWGROBM-UMGHXEBTSA-N 327.222 1.665 10 10 EDCE CNC(=O)[C@H]1CCCN1C(=O)c1cc(C)n(-c2ccccn2)c1C 104359148 FZLNIRGDUIMEDA-OAHLLOKOSA-N 326.400 1.840 10 10 EDCE COc1ccc(N2CCN(C(=O)CCc3ccnn3C)CC2)cc1F 128952239 NLTQYHUXYMLXLY-UHFFFAOYSA-N 346.406 1.849 10 10 EDCE C[C@H](Nc1cnn(CC(=O)NCCO)c1)c1ccc(F)c(F)c1O 187909596 QOCXFAMFLBVABW-VIFPVBQESA-N 340.330 1.149 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NCCCC(F)(F)F)cc1 130241925 JOHWSNBZXIGQCU-UHFFFAOYSA-N 326.340 1.910 10 10 EDCE CCNCc1ccc(OC)c(C[S@](=O)CCS(C)(=O)=O)c1 81992638 HZEJDLOJUOGFMU-FQEVSTJZSA-N 333.475 1.098 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@H]2CCc3nn(C)c(=O)cc3C2)cc1 238828842 FKKWSBZKYZGBAB-CQSZACIVSA-N 340.427 1.268 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2OCC[C@@H]2N)c(O)c1Br 2380792711 LLZLFNFFUCNRFP-GXFFZTMASA-N 343.221 1.538 10 10 EDCE CC(=O)C(=O)COC(=O)C1CCN(C(=O)CCc2ccccc2)CC1 808502525 LBKXVGHGLTWEGS-UHFFFAOYSA-N 345.395 1.559 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc(I)ccc1C 808527887 NLWRAIVAVMQBIS-UHFFFAOYSA-N 346.120 1.915 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NCc2ccc(O)c(O)c2O)CO1 722491669 XAQXCWRRVUMRCK-JTQLQIEISA-N 326.349 1.444 10 10 EDCE COc1cc(C)c(NC(=O)C(=O)NCc2ccccc2O)cc1OC 748482717 XUXSFDQEZULSNR-UHFFFAOYSA-N 344.367 1.973 10 10 EDCE CN1CCN(c2ccc(CNCC(C)(C)[C@@]3(O)CCOC3)cc2)CC1 842757796 BVBBQHLSRDRKAB-HXUWFJFHSA-N 347.503 1.706 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CC[C@H](C)NC3)C2)cc1 861690786 TTZKMUAFJFECNA-KKUMJFAQSA-N 332.448 1.714 10 10 EDCE Fc1cc(CN2CCO[C@@]3(CCOC3)C2)ccc1N1CCOCC1 769556464 LHNYCEYCECARMK-SFHVURJKSA-N 336.407 1.654 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(C)C(=O)[C@H]2C)c([N+](=O)[O-])c1 777821237 SIEUBJKWCRFIRP-JPVGGKMYSA-N 333.344 1.448 10 10 EDCE O=c1onc(-c2ccccn2)n1Cc1ccc(N2CCOCC2)cc1 877890311 XSWFEXFBQHFXTK-UHFFFAOYSA-N 338.367 1.783 10 10 EDCE O=C(NCc1ccnc(-n2ccnc2)c1)c1c(F)ccc(O)c1O 789974571 KCJIYLKIYANNGV-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE CN(C)c1cc(F)c(CN2CCC(O)(COCCO)CC2)cc1F 895828879 JVYYBQILTZGDFI-UHFFFAOYSA-N 344.402 1.367 10 10 EDCE C[C@H](NC(=O)N(C)Cc1ccc(N2CCCC2)cc1)c1nnnn1C 1313376689 CRPONHUJDQHKDJ-ZDUSSCGKSA-N 343.435 1.713 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@]34CCOC4)C2)cc1 1347297956 MTRCFHRIEPHZJB-KSSFIOAISA-N 331.416 1.848 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@H]1C[C@@H]1C 1358534087 RIYVTHOGDJZLCC-KWBADKCTSA-N 331.376 1.740 10 10 EDCE CCCC(=O)N[C@H](C)C[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1512188524 CZIRZSHREUTKPF-VXGBXAGGSA-N 337.420 1.912 10 10 EDCE COC(=O)[C@@H](Cc1ccncc1)NC(=O)/C=C\c1ccc(O)c(O)c1 1450218319 WQGFJNPQSJKZFJ-PKXJPQMGSA-N 342.351 1.407 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc(S(N)(=O)=O)c(C)c2)c1 1453648526 JNBDKITUHJKQPH-UHFFFAOYSA-N 334.397 1.586 10 10 EDCE O=C(NC1CC1)OC[C@@H]1CCCCN1C(=O)Cc1ccc(O)c(O)c1 1468715038 JYULDAKIMXJNNX-AWEZNQCLSA-N 348.399 1.910 10 10 EDCE O=C(O)C[C@H]1CN(Cc2ccc(Br)cc2O)C[C@@H]1O 2117729040 UDBJVQJDYGTALO-CABZTGNLSA-N 330.178 1.422 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H]2[C@H]3CCC[C@H]32)cc1C 1700788237 SFEADYGYBAJSBP-CBZIJGRNSA-N 332.444 1.616 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](CCNCCO)C2)cc1 1484553606 NEYXBWOUDQLBTM-LBPRGKRZSA-N 333.392 1.283 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H](C1CC1)C1(CO)CCOCC1 1557258690 AJFKYELGSKBNRS-QGZVFWFLSA-N 335.400 1.324 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCc2cncn2C)cc1C 1480583407 WEZQEKFDFZJNDM-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CS(=O)(=O)c2ccccc21 1631109349 IVOXPMKTSSVYNN-GFCCVEGCSA-N 333.365 1.285 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1c[nH]c(C(=O)N2CCCC2)c1 1630301682 GUCMKBCSXWMUMI-UHFFFAOYSA-N 329.356 1.592 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@H]2CCC(=O)N2C)cc1C 1732356024 ITRJOJKNFCXCPO-CZUORRHYSA-N 347.459 1.466 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)CCn2cncn2)cc1C 1733962375 JXASBTBFIBJXNU-GJZGRUSLSA-N 345.447 1.668 10 10 EDCE CC(C)(C)OC(=O)c1cc(C(=O)NCc2ccc(O)c(O)c2)[nH]n1 1595595781 KWTOXGISBKZUPL-UHFFFAOYSA-N 333.344 1.706 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(CCC(=O)NCCN=[N+]=[N-])CCOC1 1965101871 INPDVAWWNBTNDJ-AWEZNQCLSA-N 327.385 1.877 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@@H]2CN3CCC2CC3)cc1C 1690575734 ZMMPQJQMWZJIJU-MAUKXSAKSA-N 345.487 1.940 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O[C@@H](N)Cc2ccc(O)c(O)c2)C1 1952762023 SWHNTCCQQRPIGH-IUODEOHRSA-N 338.404 1.951 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(N)cc2)[C@H](CO)C1 2005085286 NYJFRLNJQDHQMN-HOCLYGCPSA-N 335.448 1.976 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)OC(C)(C)C)c(O)c1 1985776355 VXMNLDJDBRYYDJ-GFCCVEGCSA-N 326.393 1.376 10 10 EDCE CC(C)(C)OC(=O)NC1CN(CC(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C1 2010388955 JJTXQUZIYZWPOJ-NSHDSACASA-N 338.412 1.354 10 10 EDCE NCc1cc(F)c(N2CCC[C@H]3C(=O)NC[C@@H]32)cc1Br 312485139 UZHZJYDTHCHODD-RNCFNFMXSA-N 342.212 1.762 10 10 EDCE C[C@H](N)c1ccc(N2CCN([C@H](C)CO)CC2)c(Br)c1 2169361866 AFQZVQQBTKKJEB-NEPJUHHUSA-N 342.281 1.972 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](C(CO)CO)C2)cc1Br 2170673711 KTVMOOVXPCOBDT-QWRGUYRKSA-N 343.265 1.896 10 10 EDCE C[C@H](O)CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C1CC1 691473301 WBJYDLYWMXMHHT-WPPNPWJKSA-N 341.205 1.784 10 10 EDCE O=C1Nc2cc(N3CC[C@@H]4C[C@@]4(O)C3)c(Br)cc2[C@H]1O 2171023614 DRIJETLHNCOXGP-QVCNTJRGSA-N 339.189 1.396 10 10 EDCE CNCc1ccc(N2CC[C@H](C(=O)NC)C2)c(Br)c1 398505625 JVKPWETXOTZIKD-NSHDSACASA-N 326.238 1.741 10 10 EDCE CCCNCc1ccc(N2CC[C@H](O)[C@H](O)C2)c(Br)c1 2188637585 VGRIJHSQOUYZNG-LSDHHAIUSA-N 343.265 1.881 10 10 EDCE C[C@H](O)CN(C[C@H](C)O)c1ccc(CN)c(Br)c1F 2103484836 OYYSUSBAQGJOHP-IUCAKERBSA-N 335.217 1.615 10 10 EDCE COc1ccc(Br)c(CNC2([C@@H](O)CO)CC2)c1O 2227741068 KGNBKFKSKIHLNH-NSHDSACASA-N 332.194 1.139 10 10 EDCE Cc1ccc(CN2C[C@H]3NC(=O)O[C@@H]3C2)c(O)c1Br 2352601815 OQCJVTHXEIGYQP-NXEZZACHSA-N 327.178 1.756 10 10 EDCE O=C1/C(=C/c2ccccn2)SC(=S)N1CCN1CCOCC1 22024986 OOMRXDYPEWLKRA-QBFSEMIESA-N 335.454 1.615 10 10 EDCE CC(C)Cc1ccc([C@H](C)NC=C2C(=O)NC(=S)NC2=O)cc1 121028994 FPHRYZMJJSBQHZ-NSHDSACASA-N 331.441 1.951 10 10 EDCE C[C@@H](NCCNS(=O)(=O)c1cccnc1)c1cc(F)ccc1O 186142336 RNOREALRRSNECQ-LLVKDONJSA-N 339.392 1.555 10 10 EDCE COC[C@@H](O)CN1CCC(N[C@@H](C)c2cc(OC)ccc2O)CC1 186194577 UYJKWNDFWKSGTK-ZFWWWQNUSA-N 338.448 1.523 10 10 EDCE COCc1nc([C@H]2COCCN2Cc2cc(OC)ccc2O)no1 374801910 UGRHAUGJSDEBFQ-CYBMUJFWSA-N 335.360 1.504 10 10 EDCE CO[C@@]1(C(=O)NCc2ccc(C)c(Br)c2O)CCOC1 2380746989 YCKAETXPYQSVLT-AWEZNQCLSA-N 344.205 1.885 10 10 EDCE Cc1ccc(CNC(=O)c2cc(=N)[nH]n2C)c(O)c1Br 2381143429 QZINFSHOCBQZEG-UHFFFAOYSA-N 339.193 1.539 10 10 EDCE C[C@H]1CCN(C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c2ccccc21 132554257 VKQXOPODMWPTEQ-YXVBKTCISA-N 339.395 1.638 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCC2(CCN2)CC1 817910334 RHEMEWBUDXUWAF-UHFFFAOYSA-N 344.459 1.032 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@]3(C)CCC(=O)NC3)C2)cc1 819589708 GDFYOSBUOLKDNQ-LIRRHRJNSA-N 345.443 1.554 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(C(N)=O)CC2)cc1Br 721676692 BVUDGMDWVMRBPX-SECBINFHSA-N 328.210 1.703 10 10 EDCE COC(=O)CN1CCC(N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 826846577 WJLROAKGIFWNBP-MRXNPFEDSA-N 347.459 1.501 10 10 EDCE C[C@H]1CN(CCCNC(=O)/C=C\c2ccc(O)c(O)c2)C[C@@H](C)O1 588403411 MQRMIFIJTKWMJN-HMDMIVDLSA-N 334.416 1.727 10 10 EDCE O=C(CNC(=O)N1CCCC1)NCc1ccc2cccnc2c1O 911262318 PVWPPTITEHVEBU-UHFFFAOYSA-N 328.372 1.362 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H]3C[C@@H](C(N)=O)C3)C2)cc1 845269816 WCWQPHUJKUJWPO-MELADBBJSA-N 346.431 1.085 10 10 EDCE CCO[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C[C@H]1CN 844905138 IAKSJECHLLEONV-ZWNOBZJWSA-N 329.784 1.749 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@H](CN(C)C)C3)C2)cc1 854298633 HGIZYOFETQPRTG-HZPDHXFCSA-N 346.475 1.867 10 10 EDCE CNCCCC(=O)N1CCC(NCc2cccc(OC)c2O)CC1 853247418 OXILOVSIKOMJRM-UHFFFAOYSA-N 335.448 1.481 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCn4nncc4C3)C2)cc1 852448454 JGGXXBOHDHISTO-ZDUSSCGKSA-N 342.403 1.091 10 10 EDCE Cc1cn(C2CCOCC2)nc1C(=O)NCCc1ccc(O)c(O)c1 866757213 MSJGEHOOPTZIOP-UHFFFAOYSA-N 345.399 1.927 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cc(O)nc(N(C)C)n2)c1 765426346 YFLAVXGHSPHHKF-SECBINFHSA-N 332.360 1.453 10 10 EDCE O=C(CC1CS(=O)(=O)C1)NCc1ccc(N2CCCCC2)cc1 865031396 NHKPPISBPIZJKS-UHFFFAOYSA-N 336.457 1.728 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)c3ccc(C)nn3)CC2)cc1 866390097 YQMUTXRDOMZULF-UHFFFAOYSA-N 348.428 1.305 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NCCc2nnnn2C)cc1F 771973202 BOLPUUYRJPPBTG-UHFFFAOYSA-N 349.414 1.237 10 10 EDCE CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)/C=C\c1ccc(O)c(O)c1 775973471 HEAZCJLZPOJGCR-XVMAMZMSSA-N 349.383 1.680 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1[C@H]2OCCC[C@@H]21 780120149 DMGNXLYXDCPMOV-NXHRZFHOSA-N 346.427 1.679 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@H](O)CC(F)(F)C2)cc1F 786732246 LXWRMKINXXVFLH-LLVKDONJSA-N 331.338 1.803 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)Cn2c(C)cc(C)nc2=O)c1 1137473534 MINGCWAGHHXRRO-LBPRGKRZSA-N 331.372 1.452 10 10 EDCE CN1CCN(c2ccc(CN[C@@H]3CNCCC3(F)F)cc2F)CC1 1331419796 RIULPLQWPSCNPB-MRXNPFEDSA-N 342.409 1.664 10 10 EDCE COCC(=O)N[C@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1284439348 JMFXXYXRDYHFHS-SNVBAGLBSA-N 335.364 1.120 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccc(S(=O)(=O)C2CC2)cc1 1299575302 YTHBEDVERUIFRP-UHFFFAOYSA-N 347.392 1.964 10 10 EDCE C[C@@H](NC(=O)c1ccc(CS(N)(=O)=O)cc1)c1ccccc1O 1471195097 BPYROOFGSMCVDS-LLVKDONJSA-N 334.397 1.672 10 10 EDCE C[C@@H](O)CN[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1480067954 CMYOZTCEONHNCZ-QMTHXVAHSA-N 333.392 1.328 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)[S@@]3=O)cc1 1631992870 OMQBPASSAGBJFA-HEWAKGLMSA-N 334.401 1.975 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)CCNC(N)=O)cc1C 1725134011 UUDLLSJMASCTEA-STQMWFEESA-N 336.436 1.045 10 10 EDCE CC[C@H](C)C(=O)N(C)C[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1738792429 LOUNUJURQFKNFL-NWDGAFQWSA-N 337.420 1.722 10 10 EDCE COC(=O)c1cc(CNC(=O)c2ccc(N=NC(N)=O)cc2)ccn1 1642504813 LKUHZLIIQNQNDI-UHFFFAOYSA-N 341.327 1.961 10 10 EDCE O=c1[nH]cnc(Sc2nccs2)c1I 159125211 SJYNEJMFKPVXDM-UHFFFAOYSA-N 337.167 1.982 10 10 EDCE Cc1nc(C(=O)NCc2ccc(N3CCOCC3)cc2)c(=O)[nH]c1C 154857302 RNERRGBMCJCURJ-UHFFFAOYSA-N 342.399 1.153 10 10 EDCE Cn1nnc(Br)c1C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1912180766 FYZTYVLRVLZQBT-SSDOTTSWSA-N 328.174 1.740 10 10 EDCE CN1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)CC1 118589746 ANOBDWZYDUSAPS-LBPRGKRZSA-N 325.210 1.153 10 10 EDCE COCCNC(=O)[C@@H](C)NCc1cccc(Br)c1O 228996911 QICUGPBFKFYXSB-SECBINFHSA-N 331.210 1.395 10 10 EDCE CN[C@@H](C)c1ccc(N2CCS(=O)(=O)CC2)cc1Br 234453496 VLQJUIWATUSGMX-JTQLQIEISA-N 347.278 1.964 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCC[C@H]3CO)c(Br)cc21 252599878 LDIMATJXFROJKP-SDBXPKJASA-N 340.221 1.623 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@@H]2O 1974156351 GHLRMTWVOYFIKJ-QJNOJXSDSA-N 346.196 1.514 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2c(O)cccc2F)[C@H](O)C1 2005089249 ODFUDFZLJKKZMU-DZGCQCFKSA-N 340.395 1.991 10 10 EDCE CC(C)(C)OC(=O)Nc1cnn(CC(=O)C(=O)C[C@H]2C[C@H](N)C2)c1 2003167083 LLTKEIWYSAUXNL-XYPYZODXSA-N 336.392 1.496 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C[C@H]2OCC[C@@H]21 2010388491 CDHNRJWCGJBIEF-SDDRHHMPSA-N 337.380 1.674 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@]1(NC(=O)OC(C)(C)C)C[C@@H](CO)C1 2018282693 UASCPLXASZHDMA-WGRBQBNCSA-N 341.412 1.811 10 10 EDCE OCc1ccc(N2CCC[C@@H](CO)[C@H]2CO)c(Br)c1 710090439 KFGIDIDBRKRUAV-SMDDNHRTSA-N 330.222 1.511 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3C[C@H]4[C@H](N)[C@H]4C3)ccc(N)c2C1 2071575425 ZKPZPHLFZWMKPC-HALDLXJZSA-N 344.459 1.955 10 10 EDCE C[C@]1(CO)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2097238789 RUSTXUVXTDZUKP-DGCLKSJQSA-N 326.194 1.362 10 10 EDCE C[C@@H](O)c1ccc(N(C)[C@@H]2CC(=O)NC2=O)cc1Br 2114727957 UOBFVZQGMGIREQ-RDDDGLTNSA-N 327.178 1.354 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CCC(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213593367 RMPOPYYWHSEJKM-UTUOFQBUSA-N 341.412 2.000 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-])C(C)(C)O 2213584034 YOECZYHCHIUEJZ-GARJFASQSA-N 341.412 1.998 10 10 EDCE COc1ccc(Br)c(CN[C@@H](C(=O)O)C2COC2)c1O 2236045956 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CC(C)(C)OC(=O)NC[C@H](CO)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2014510385 XYDUSDRVMBPGTA-NEPJUHHUSA-N 341.412 1.811 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC(N=[N+]=[N-])CC2)CC(O)C1 2018045562 FRIDPVJCDNSFOW-UHFFFAOYSA-N 339.396 1.706 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNCc2ccc(O)c(O)c2)C1 702793882 ZCPNIDQESIXHMN-SWLSCSKDSA-N 338.404 1.415 10 10 EDCE CC(C)(C)OC(=O)NC1[C@@H]2CN(C(=O)COc3ccc(N)cc3)C[C@@H]12 2045668480 REDPZAXDVCGDSK-ZIAGYGMSSA-N 347.415 1.629 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)cc1Br 2102192520 YCRCVZPOACPPDE-DWVUBDKYSA-N 327.222 1.665 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)cc1Br 2102176382 BUMZANOQOZZGSP-RHBIEUIISA-N 328.206 1.698 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213586272 ABSHRHKSYDFOGK-QCNOEVLYSA-N 339.396 1.704 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)C2CC3(C2)OCCO3)cc1 2277966226 RCSMKAJFIIWEGL-UHFFFAOYSA-N 326.418 1.078 10 10 EDCE O=C1N=C(N2CCOCC2)SC1=Cc1ccc(O)c([N+](=O)[O-])c1 2295976545 NMRKVCXNVKXUQS-UHFFFAOYSA-N 335.341 1.603 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cnc(N)c(F)c2)s1 2284701581 BLZOTOYOAFGMRJ-UHFFFAOYSA-N 334.423 1.460 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2355334684 RJDMAUDHQFQHBI-WHLNNUNGSA-N 341.249 1.489 10 10 EDCE CN1CCC(NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1 96445225 KTPAYIFQRLYUEQ-DAXSKMNVSA-N 329.444 1.747 10 10 EDCE C[C@H]1C[C@@H](N2CCCC2)CN1c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 376206579 ZUHWYTSRNDZAKO-NWDGAFQWSA-N 346.387 1.989 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(CNC(=O)c2cccs2)cc1 808505231 VOTIXALAFMLELF-UHFFFAOYSA-N 345.376 1.993 10 10 EDCE CNC(=O)C1CN(c2ccc([C@@H](C)NC)cc2Br)C1 723159059 WKPOJXNJAZTUKB-SECBINFHSA-N 326.238 1.912 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN(CCO)[C@@H]2CCO[C@H]2C)c1O 825129820 FZWVDNJXBAXBHO-CMPLNLGQSA-N 326.349 1.281 10 10 EDCE Cc1cc(CC(=O)N2CCO[C@H](C(N)=O)C2)c(C)n1-c1ccccc1 824823811 DUGOSZXHYQBAFQ-KRWDZBQOSA-N 341.411 1.349 10 10 EDCE CCN(CC)C(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(O)c(O)c1 588406368 ARKSGJCYGOWIQA-GDAGCXPBSA-N 332.400 1.970 10 10 EDCE COC(=O)c1cc(S(=O)(=O)N(C)Cc2ccccc2O)n(C)c1 914144691 GGOJPHRFFOGKGG-UHFFFAOYSA-N 338.385 1.338 10 10 EDCE COCC[C@H](C)S(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849415667 DLRPCYJCMDARGO-UONOGXRCSA-N 342.461 1.618 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(CCCCCO)CC1 913692870 FFLOOWQMEFUNIL-ALCCZGGFSA-N 334.416 1.418 10 10 EDCE O=C(C[C@@H](O)C(Cl)(Cl)Cl)NCc1ccc(O)cc1O 910958172 XWRYGBQJJHJFAQ-SECBINFHSA-N 328.579 1.835 10 10 EDCE CS(=O)(=O)CC1(CNC(=O)NCc2c(O)cccc2F)CCC1 922911898 BLKCAWVFCVRFKV-UHFFFAOYSA-N 344.408 1.545 10 10 EDCE CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NCc1ccc2c(c1)CCCO2 922106529 QQCBHUIYOQNIMX-HOTGVXAUSA-N 338.473 1.819 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@H](CO)C3CCC3)CC2)cc1 852321236 SHPGUERADJIDHN-GOSISDBHSA-N 347.459 1.094 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc(F)c(F)c2)C1 859915737 SAEZGZZQMDOXBT-SECBINFHSA-N 325.267 1.019 10 10 EDCE C[C@H](NCC(=O)NCC(=O)NCc1ccccc1)c1ccccc1O 926967752 PKQSWFRCURRIMN-AWEZNQCLSA-N 341.411 1.475 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCCn3cccn3)C2)cc1 851973046 YCLGXXNSLCAREB-HNNXBMFYSA-N 343.431 1.860 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCn4ccnc43)C2)cc1 852360649 JOMKCORODPIPTD-BBRMVZONSA-N 341.415 1.915 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCO[C@@]2(CCOC2)C1 769509526 ISWSRMIJIMFORN-SFHVURJKSA-N 333.432 1.762 10 10 EDCE O=C(NC[C@@H]1CN(Cc2ccncc2)CCO1)c1cccc(O)c1O 863496484 DWANSZAEFYSIJL-CQSZACIVSA-N 343.383 1.124 10 10 EDCE C[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)NCc1cccc(Cl)c1O 896506611 WMBIPJYYCPJOTG-KCJUWKMLSA-N 332.809 1.278 10 10 EDCE COC(=O)c1c(CNCc2cnn(C)n2)c2cc(F)ccc2n1C 894757051 IWULGNGEXQLGGP-UHFFFAOYSA-N 331.351 1.522 10 10 EDCE CC1(C)[C@@H](O)C[C@@]1(CO)NCc1c(O)cccc1Br 1879558124 GUUWDALJZQEYLS-JSGCOSHPSA-N 330.222 1.766 10 10 EDCE Cc1cc(C(=O)N2CC(CO)(CO)C2)c(C)n1-c1ccc(F)cc1 1303467499 ZWGMFCQIVKNULS-UHFFFAOYSA-N 332.375 1.660 10 10 EDCE C[C@H]1[C@@H](CO)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1313065883 ZAQJFZPWAFLVSS-GOEBONIOSA-N 347.459 1.560 10 10 EDCE CC(C)(C)C(=O)N1CCO[C@@H](C(=O)N2Cc3cccc(O)c3C2)C1 1175029925 MTZJRWVIXHDCDL-OAHLLOKOSA-N 332.400 1.508 10 10 EDCE C/C=C(\C)C(=O)N[C@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1321490868 PTIJPNLIJKOVMA-YQJFHSMKSA-N 344.419 1.231 10 10 EDCE C[C@@H]1[C@H](O)CCCN1C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1331649857 PEZXJVDCRDWOPA-RHSMWYFYSA-N 345.443 1.275 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCC=CO3)CC2)cc1 1292281380 DRBYTXUELNSMPF-GOSISDBHSA-N 345.443 1.626 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccnc(CO)c1 1291756342 PECAPBPYJGFNOX-UHFFFAOYSA-N 345.374 1.480 10 10 EDCE Cc1nn(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c2ncccc12 1611431073 JQFZGADVBHRYBH-NSHDSACASA-N 340.383 1.898 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cccc(-n3[nH]nnc3=N)c2)cc1 1623316471 VJUNWRDOCYOYMQ-UHFFFAOYSA-N 337.387 1.071 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H]2CC23CCC3)cc1C 1482772160 DATCIBSCRXHFPE-HZPDHXFCSA-N 332.444 1.761 10 10 EDCE Cc1nc(C)n(C2CN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)n1 1627343856 CLZMSVABOSXHSF-UHFFFAOYSA-N 327.348 1.754 10 10 EDCE CC[C@@H](CNC(=O)c1nccnc1N)NCc1ccc(OC)c(C)c1 1494954535 XBJNELXPKRIXKZ-AWEZNQCLSA-N 343.431 1.674 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](C)N(C(=O)CNC(C)=O)C2)cc1C 1725573212 HMVNVTKLHVRAHS-CJNGLKHVSA-N 333.432 1.219 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C)c(C(N)=O)cn1 1634939285 MDESVMMNOAJNNP-UHFFFAOYSA-N 334.372 1.610 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C(=O)NCC2CC2)cc1C 1731626979 OTYLEYBWDGLKLV-ZDUSSCGKSA-N 333.432 1.124 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)Cc2nnc(C)o2)cc1C 1666541301 ZTMQCTBIEAETTE-GFCCVEGCSA-N 346.431 1.780 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2c[nH]c(=O)cn2)cc1C 1676407613 XFOPYIIQRJYPQB-CYBMUJFWSA-N 344.415 1.337 10 10 EDCE CC(C)(C)OC(=O)NCC12CC(C(=O)NCCCN=[N+]=[N-])(CO1)C2 1964882549 FLVUAIAUSLQVTP-UHFFFAOYSA-N 339.396 1.877 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(n4ccnn4)CC3)cc2N1 160235844 FTCMXYUNFNDCSN-UHFFFAOYSA-N 344.331 1.359 10 10 EDCE O=C(CCN1C(=O)CSC1=S)N(CCO)Cc1ccccc1 1865766231 XVCFVBWXUCWNFC-UHFFFAOYSA-N 338.454 1.258 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O 1900609088 JJOBNECKTPKNOJ-SNVBAGLBSA-N 329.401 1.809 10 10 EDCE O=C1NC(=O)[C@H](CCCNCc2cccc(Br)c2O)N1 2150331649 VSRKWBDNOFTSSE-JTQLQIEISA-N 342.193 1.233 10 10 EDCE O=C1CC2(CCN(c3ccc(CO)c(Br)c3)CC2)N1 2142865105 NUBVXIZDKMKPPP-UHFFFAOYSA-N 325.206 1.800 10 10 EDCE NCc1ccc(N2CC[C@H](OCC(N)=O)C2)c(F)c1Br 2145372720 VLVWPFHAVWUJKN-VIFPVBQESA-N 346.200 1.128 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010405225 GREGAVBSZIITIY-PWSUYJOCSA-N 341.412 1.809 10 10 EDCE Cn1ncc(COC(=O)COc2ccc(N)cc2)c1Br 2173256393 RGAIRISXNPPBOX-UHFFFAOYSA-N 340.177 1.887 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)cc1Br 2178087063 OYPBZGSEPPCXSQ-VWFLFCASSA-N 342.233 1.946 10 10 EDCE C[C@H](O)[C@H]1CCCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2193592492 HXJSSPGGYPJXCA-CQOUMUIBSA-N 341.205 1.784 10 10 EDCE C[C@H](NC(=O)c1nn(C)nc1Br)c1ccccc1O 2226975854 AVBQKSKQJPJUPH-ZETCQYMHSA-N 325.166 1.774 10 10 EDCE CSc1ncc(CNS(=O)(=O)N2CCCC[C@H]2CO)s1 2284500682 TVALOTFCRCNVMM-VIFPVBQESA-N 337.492 1.046 10 10 EDCE COc1ccc(C=C2SC(=S)N(CCO)C2=O)cc1OC 2294874639 LEOWXLVKXBGRGZ-UHFFFAOYSA-N 325.411 1.897 10 10 EDCE Cc1ccc(CN2C[C@H](O)[C@@H](O)[C@@H]2CF)c(O)c1Br 2352686041 IKHMIOLVNCZKRZ-KWBADKCTSA-N 334.185 1.339 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CCS2(=O)=O)c(O)c1Br 2352944824 MXPGIAPPDZXGOT-VIFPVBQESA-N 348.218 1.266 10 10 EDCE CCN1CCC[C@@H]1CN(C)CC(=O)NCc1ccc(N(C)C)cc1 177709462 WNFUHNGCGZVSFY-GOSISDBHSA-N 332.492 1.785 10 10 EDCE CCOCCS(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 170654367 BLGAZCFNNMXOHG-UHFFFAOYSA-N 328.434 1.184 10 10 EDCE COc1ccc(N2CCN(CC(=O)Nc3ccncc3)CC2)cc1 120645988 OIANHVGOIZCCHF-UHFFFAOYSA-N 326.400 1.851 10 10 EDCE Cc1cc(Cl)cc(CN2CCC[C@@H](CS(N)(=O)=O)C2)c1O 271763524 ZIVCFRRUDSQNBG-LLVKDONJSA-N 332.853 1.855 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H]3CO4)c(Br)cc21 387236007 AKPZDQBIXNUQDO-DAROEXNTSA-N 338.205 1.639 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2C[C@H](O)CN2)c(O)c1Br 2380764050 AGYYPLCMIPIBSD-QWRGUYRKSA-N 343.221 1.144 10 10 EDCE CCn1ncc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 293370951 HQQANAVRVWJNGD-UHFFFAOYSA-N 347.394 1.328 10 10 EDCE Cc1ccc(CN2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)c(O)c1Br 2381136435 GIMJKZWMNDJHLN-ZFVXVEAMSA-N 342.233 1.779 10 10 EDCE CC1(C)C[C@@H](O)[C@H](O)CN1c1ccc(CO)c(Br)c1 2132172310 JFGJIYGVVAEOLG-CHWSQXEVSA-N 330.222 1.652 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H]3CCSC3)C2)cc1 828083055 JYXKARDEHDZRJM-OLZOCXBDSA-N 349.456 1.012 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@@H](O)C(C)C)C2)cc1 824694179 PHDUBSBDWJHQDR-WMLDXEAASA-N 335.448 1.838 10 10 EDCE Cn1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)nc1O 830899512 GFUGOPNOERLQAL-CYBMUJFWSA-N 331.372 1.653 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1C(=O)NCc1ccc(N(C)C)c(F)c1 844932897 AIYXBZUDBNGOCN-QWHCGFSZSA-N 325.384 1.183 10 10 EDCE C[C@H]1CN(CCO)[C@H](C)CN1Cc1ccc(N2CCOCC2)cc1 841892265 WAFZTDDVVJJSLS-SJORKVTESA-N 333.476 1.410 10 10 EDCE CCNC(=O)C[C@H]1CCCCN1C(=O)NCCc1ccc(N)cc1 841957509 CICUTROFBYUVEE-MRXNPFEDSA-N 332.448 1.902 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CCCNC3)C2)cc1 851660869 BCDLPVSFRLLDJE-CABCVRRESA-N 332.448 1.573 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3C(=O)NCC[C@@H]3C)C2)cc1 852308598 JQBFVACXBZFRBL-XEZPLFJOSA-N 346.431 1.098 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCC[C@H]1CNC(=O)C1 922916473 UURUNOZURNGMBU-LSDHHAIUSA-N 346.475 1.817 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2cc(N3CCOCC3)ncn2)c1 869410238 ILBDFPQADUMQNJ-UHFFFAOYSA-N 328.372 1.257 10 10 EDCE CN(C)c1noc(CCC(=O)NCc2ccc3cccnc3c2O)n1 862027023 HAPRPOXKUATAHN-UHFFFAOYSA-N 341.371 1.638 10 10 EDCE CC1(C)SC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1117070188 DJWCJXAWBLZGAE-HNNXBMFYSA-N 347.484 1.913 10 10 EDCE CNC(=O)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 772261572 STQJMCAPWJZXQW-TXEJJXNPSA-N 337.395 1.192 10 10 EDCE C[C@H](NC(=O)c1ccc(-n2cnnn2)cn1)c1ccc(N(C)C)cc1 1128135476 DLQRKZZAJUFQBY-LBPRGKRZSA-N 337.387 1.614 10 10 EDCE COC(=O)[C@@]1(CNCc2cccc(Cl)c2O)C[C@@H]1S(C)(=O)=O 895510239 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Cc1ccc(C(=O)N[C@H]2CCCc3c2ccc(=O)n3C)c(O)c1O 855030420 LNMQRQFWLRTXGU-ZDUSSCGKSA-N 328.368 1.912 10 10 EDCE COC(=O)[C@@]1(OC)CCN(Cc2ccc(Br)cc2O)C1 862475705 UQOWFSOXWRHYQU-CQSZACIVSA-N 344.205 1.919 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1 869631617 VZJZMWWTDZXAGT-TXEJJXNPSA-N 327.377 1.771 10 10 EDCE CN(C)S(=O)(=O)N1CC(NCc2ccc3ccccc3c2O)C1 862536427 IGDLCVFDTRAAKR-UHFFFAOYSA-N 335.429 1.126 10 10 EDCE Cc1cc(CCNC(=O)CCc2nn[nH]n2)c(C)n1-c1ccccc1 864644191 FLJVGKXXRZCXTO-UHFFFAOYSA-N 338.415 1.899 10 10 EDCE CN(C)S(=O)(=O)c1cc(C(=O)N2Cc3cccc(O)c3C2)n(C)c1 871204465 KSWSKHXKLCSYMF-UHFFFAOYSA-N 349.412 1.137 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)C2)cc1 870914348 PKQFTWXTBRCNAQ-YGTYGHESSA-N 329.444 1.765 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1[C@@H]2CCCO[C@H]21 780120138 DMGNXLYXDCPMOV-CGTJXYLNSA-N 346.427 1.679 10 10 EDCE COc1cccc(CNS(=O)(=O)c2c(Cl)cnn2C)c1O 797448773 ZYCKRBOFIDFXCK-UHFFFAOYSA-N 331.781 1.266 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CCCN(CC(F)(F)F)C1 1153884969 IAWUUIMTICSNFG-SNVBAGLBSA-N 332.322 1.988 10 10 EDCE NC(=O)CSc1ccccc1C(=O)NCc1cc(O)ccc1O 1303223116 ASTQMNPGRVBEFG-UHFFFAOYSA-N 332.381 1.605 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N2CCC[C@H](N=[N+]=[N-])C2)n1 2121909960 JOKRQDGVNHDCAR-ZETCQYMHSA-N 349.214 1.646 10 10 EDCE O=C(NCCN1Cc2ccccc2OCC1=O)c1cccc(O)c1O 1558299331 AGQXMCOTOZJJLV-UHFFFAOYSA-N 342.351 1.249 10 10 EDCE CN(C(=O)c1cccc(O)c1O)[C@H]1CCCC[C@H]1S(C)(=O)=O 1629859612 JCPHGPPNOWWELD-WCQYABFASA-N 327.402 1.526 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)c2[nH]ccc2C)cc(OC)n1 1494699100 XDQFCYCHKMGQAA-NSHDSACASA-N 346.387 1.284 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCCNC(=O)c1ccc(F)cc1 1565767997 GJVVUHZLRXIZKA-UHFFFAOYSA-N 346.358 1.716 10 10 EDCE COc1ccc(CN[C@H]2CC[C@H](NC(=O)CC(N)=O)CC2)cc1C 1568103908 IREZJLCRWBZLDG-SHTZXODSSA-N 333.432 1.396 10 10 EDCE COc1cc(C(=O)N[C@@H](C)C[C@@H](C)NC(=O)C2CC2)cc(OC)n1 1572628321 MOBHUNUEBYGVHL-MNOVXSKESA-N 335.404 1.522 10 10 EDCE CNC(=O)CCn1c(CC(C)C)nnc1N(C)Cc1ccccc1O 1748275130 CQRCRIBBVOTDKH-UHFFFAOYSA-N 345.447 1.955 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(=O)N(C3CC3)C2)c([N+](=O)[O-])c1 1772981203 LWQABQWYULEBQM-CLTKARDFSA-N 331.328 1.550 10 10 EDCE CN(C)c1ccc([C@](C)(O)[C@@H](NC(=O)OC(C)(C)C)C(=O)O)cc1 1917210308 ZWJONGDJOGIBTM-GUYCJALGSA-N 338.404 1.938 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NCc1cccc(F)c1O 1937553633 SWPIIYXMVZDKOW-OLZOCXBDSA-N 326.368 1.913 10 10 EDCE COc1ccc(N(C)C[C@](O)(CN)C2(Br)CC2)cc1 2141686049 ZFELSTQMGUTVSC-CQSZACIVSA-N 329.238 1.749 10 10 EDCE COc1ccc(Br)c(CNC[C@@H](CCO)OC)c1O 1972502830 GSFYIRCYLBLUFO-SECBINFHSA-N 334.210 1.650 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)C(=O)C[C@H]1C[C@H](N)C1 1980369744 NGWPSKCMRWSYDD-SRVKXCTJSA-N 328.409 1.182 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@@H](O)CO 1999376231 XERQEOPYNBWYEK-OAHLLOKOSA-N 336.432 1.817 10 10 EDCE CC(C)(C)OC(=O)N1CCC(N(CCCN=[N+]=[N-])CC(N)=O)CC1 2006168792 GXWRGQYBJHEWAZ-UHFFFAOYSA-N 340.428 1.874 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010388724 GFETZEMKBDWKKE-RYUDHWBXSA-N 340.428 1.600 10 10 EDCE OCc1ccc(N2CCC[C@H](CO)[C@@H]2CO)c(Br)c1 710090438 KFGIDIDBRKRUAV-RISCZKNCSA-N 330.222 1.511 10 10 EDCE C[C@@H](NC(=O)Cc1ccc(N)cc1)C1(O)CN(C(=O)OC(C)(C)C)C1 2044227079 RSPIHACXMBGZNX-GFCCVEGCSA-N 349.431 1.298 10 10 EDCE OCc1ccc(N2CC[C@@H]3OCCO[C@H]3C2)c(Br)c1 2095426236 JGDARYBDPDWEEM-KBPBESRZSA-N 328.206 1.936 10 10 EDCE CN1CCO[C@H]2CN(c3ccc(CO)cc3Br)C[C@@H]21 2097691764 CGAJYRMMTGZIFG-KBPBESRZSA-N 327.222 1.461 10 10 EDCE CN1CCN(c2cc(Br)c(CN)cc2F)[C@H](CCO)C1 2202819766 CTIFAFYIXGTOOW-LLVKDONJSA-N 346.244 1.550 10 10 EDCE O=c1cc[nH]c(CNCc2cc(Br)cc(F)c2O)c1O 2239413780 IOYPMFSCNFCGIR-UHFFFAOYSA-N 343.152 1.978 10 10 EDCE CN(C)C(=O)CCCNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297505907 QYVLLZFSYATGRZ-UHFFFAOYSA-N 345.443 1.521 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(C(=O)c2ccco2)CC1 2307986382 SASIFRIIRDOTQL-UHFFFAOYSA-N 342.351 1.689 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3C[C@H]3C)CC2)cc1 170806284 HEYGEZGQIHGOAX-CRAIPNDOSA-N 346.475 1.915 10 10 EDCE CCNC(=O)CNC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 175278028 CLJJGIRAHYGCTH-UHFFFAOYSA-N 336.347 1.328 10 10 EDCE COC[C@H]1[C@@H](O)[C@@H](O)CN1c1ccc([C@@H](C)O)c(Br)c1 2358552246 VVDZOTJRIPQUNQ-DGJRKYIQSA-N 346.221 1.059 10 10 EDCE C[C@@H]1[C@@H](NCc2ccc(Br)cc2O)CCS1(=O)=O 691393240 RZZCRZOWSQKINK-KCJUWKMLSA-N 334.235 1.820 10 10 EDCE Cc1nccc(N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)n1 184933498 DTBWGMFEMUHKKG-HWKANZROSA-N 340.383 1.558 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCC([C@H](C)O)CC3)nc12 264698737 HKDJAMBIBWUYLW-NSHDSACASA-N 348.403 1.204 10 10 EDCE Cc1ccc(CN2CCCN(CCN)CC2)c(O)c1Br 2380665088 VQVOXSAGRPWLRK-UHFFFAOYSA-N 342.281 1.930 10 10 EDCE COc1cc(Br)cc(CN2CC(=O)N(C)[C@H](C)C2)c1O 800537598 BCINIDFMAJUKIK-SECBINFHSA-N 343.221 1.826 10 10 EDCE COC(=O)N(C)CC(=O)NCc1cc(Br)ccc1O 804734525 PPFIAWINDQPNGX-UHFFFAOYSA-N 331.166 1.469 10 10 EDCE O=C(NCc1cc(Br)ccc1O)[C@H]1CCS(=O)(=O)C1 804738370 NPXSCDMYAQFDAH-QMMMGPOBSA-N 348.218 1.206 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 808501123 HZNZJDNGRCQADG-CQSZACIVSA-N 329.352 1.230 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](NC(N)=O)C2)c(Br)c1 723173872 RQCSSJRHROCIDW-WPRPVWTQSA-N 327.226 1.716 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C 909827950 DLACXOHWOMVTCA-NEPJUHHUSA-N 327.377 1.771 10 10 EDCE C[C@@H]1CN(C)C[C@@H]1NCc1cc(F)c(N2CCOCC2)c(F)c1 839146876 YPEPNWDWLUPAES-WBMJQRKESA-N 325.403 1.841 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H]3C3CC3)CC2)cc1 834383508 UJXIZSOZTHGFFL-AZUAARDMSA-N 345.487 1.662 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)CCc2ccnn2C)cc1 844854706 DCSASIJRKPZYKU-UHFFFAOYSA-N 330.432 1.956 10 10 EDCE COC(=O)CCN1CCC[C@@H](N[C@H](C)c2ccc(N(C)C)cc2)C1=O 849319855 HEURQKSDYYFPMZ-RHSMWYFYSA-N 347.459 1.957 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnn4c3CCC4)C2)cc1 849365641 AEQDHCFAEVPBKG-ZDUSSCGKSA-N 326.400 1.847 10 10 EDCE CON1CC[C@H](OC(=O)c2sc3nc(C)cc(C)c3c2N)C1=O 922269259 SYUJDDBWMIFCHF-VIFPVBQESA-N 335.385 1.814 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2c(C)nn(C)c2C)c1 754489566 AROPOGBNTGQZLR-SECBINFHSA-N 346.387 1.567 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCOC[C@@H](C)C3)C2)cc1 854300493 UQKZATOKOAUAND-GJZGRUSLSA-N 333.432 1.952 10 10 EDCE C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(C)(C)CO 925054460 GMPCXCQQQYNAKJ-AWEZNQCLSA-N 340.489 1.418 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@H](O)C(F)(F)C2)cc1 852413357 UIJIFDIZUNLAPI-AWEZNQCLSA-N 327.375 1.071 10 10 EDCE COC(=O)[C@H]1C[C@@H]2C[C@H](NC(=O)NCc3cccc(OC)c3O)[C@@H]2C1 897722735 ICIIVEGJKBBEIK-RQJABVFESA-N 348.399 1.788 10 10 EDCE COC(=O)C[C@@H]1CC[C@H](NC(=O)NCc2ccc(OC)cc2O)C1 899111220 XCOILFLJLMECPK-YPMHNXCESA-N 336.388 1.932 10 10 EDCE CS(=O)(=O)C[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccccc1 1137128435 LZAQOKIOVDDUFA-AWEZNQCLSA-N 349.408 1.542 10 10 EDCE CO[C@H](C)CS(=O)(=O)NCc1cc(Br)ccc1O 796190256 DVEJIGMWRUEHTH-MRVPVSSYSA-N 338.223 1.609 10 10 EDCE Cc1nnnn1-c1ccc(C(=O)NCc2ccc(O)cc2O)c(F)c1 1142533887 VFCLCZOVGMRQOL-UHFFFAOYSA-N 343.318 1.451 10 10 EDCE CC[C@H](C)C(=O)N(C)CCNCc1nnnn1-c1ccc(OC)cc1 1317571726 VPWXBFSDNXJHGO-ZDUSSCGKSA-N 346.435 1.265 10 10 EDCE NCc1cc(F)c(N2CCOC[C@@H]2CCO)cc1Br 694924205 SMCBWYRZHULKIZ-JTQLQIEISA-N 333.201 1.635 10 10 EDCE COCCN1CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 1184673180 IVKCFLWJJQDBOD-UHFFFAOYSA-N 325.365 1.380 10 10 EDCE CC[C@H](N[C@H]1CC(=O)N(C)C1=O)c1cc(Br)ccc1O 88774588 MEBXEQNKIIPJJY-QWRGUYRKSA-N 341.205 1.953 10 10 EDCE CC[C@@H]1C(=O)NC(=O)CN1c1ccc([C@@H](C)N)cc1Br 97319310 CAFUYZDYVIAQIP-LDYMZIIASA-N 340.221 1.710 10 10 EDCE CN1CCN(c2ccc(CNCCCc3ncn(C)n3)cc2F)CC1 1261480953 GDTGNMBQIJAQFB-UHFFFAOYSA-N 346.454 1.428 10 10 EDCE COc1cc(C(=O)N[C@@H]2CC[C@H](CNC(=O)C(C)C)C2)cc(OC)n1 1290091453 RWZAKLDANTYHPV-GXTWGEPZSA-N 349.431 1.770 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H](C)O1 1469778167 GUVDZXXAESSTNS-CABZTGNLSA-N 334.332 1.252 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](C)[C@@H](O)C3)C2)cc1 1470772774 MPXYVVUHQGWGLM-KEYYUXOJSA-N 333.432 1.686 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)CCn3ccnn3)C2)cc1C 1480137439 ZQHKKLIBGPRKDT-WKILWMFISA-N 343.431 1.422 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H](CO)NC/C=C/Cl)cc1 1717785047 RZURYSVSCKOMIO-AUMQLWHNSA-N 339.783 1.282 10 10 EDCE Cc1nc2ccccc2c(=O)n1CC(=O)NCc1ccc(O)cc1O 1626849099 KAUHNALWCQFZMW-UHFFFAOYSA-N 339.351 1.433 10 10 EDCE C[C@H](CNC(=O)[C@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1494628896 VQHFZJXYASHKRU-PWSUYJOCSA-N 347.375 1.120 10 10 EDCE CCCC(=O)NC[C@@H](C)N(C)Cc1nnnn1-c1ccc(OC)cc1 1725157716 RTGXXJUSZLKBFX-CYBMUJFWSA-N 346.435 1.408 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H]4CC[C@@H](O)[C@H]4C3)C2)cc1 1636853479 BOWHCFTVZRKTPN-IDCJVQTKSA-N 345.443 1.686 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)Cc2cnn(C)c2C)cc1C 1491476770 NEKAUPWUSBOJBB-CQSZACIVSA-N 344.459 1.883 10 10 EDCE COc1cc(C(N)=O)ccc1NC(=O)/C=C\c1ccc(O)c(O)c1 1637890437 JKWKKBQDTMHXAA-CLTKARDFSA-N 328.324 1.857 10 10 EDCE Cc1nc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)nn1-c1nc[nH]n1 1567776875 BDRUYWYYLAKXHI-JTQLQIEISA-N 340.391 1.251 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCCN(CC(F)(F)F)C1=O 1636666839 MVZYRAGQMJRZJB-JTQLQIEISA-N 346.305 1.310 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2ccn(C)n2)cc1C 1669188644 HEBDDVREDUQUEB-SNAWJCMRSA-N 328.416 1.813 10 10 EDCE O=C1C[C@H](CNC(=O)NCc2cc(Cl)cc(Cl)c2O)CN1 1683160540 FAJGWQBIXDDPHT-ZETCQYMHSA-N 332.187 1.634 10 10 EDCE COC(=O)NCC(=O)N1CC[C@H](CNCc2ccc(OC)c(C)c2)C1 1774057943 ONYSASVXNBAXMQ-OAHLLOKOSA-N 349.431 1.298 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2CCC(=O)N2C)cc1C 1690857744 MNJNALHJXDATIG-ZBFHGGJFSA-N 347.459 1.609 10 10 EDCE CCNC(=O)[C@H]1COCCN1c1ccc(CN)c(Br)c1 228155031 YNBXBGTVJAHVRY-CYBMUJFWSA-N 342.237 1.249 10 10 EDCE CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CC(N=[N+]=[N-])C2)CC1 1986144775 RMGNRAINUCIHGW-UHFFFAOYSA-N 325.369 1.270 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2[C@H](C(=O)N3CC[C@@H](N=[N+]=[N-])C3)[C@H]21 2010393160 OPNBLCXMFQENNR-DDHJBXDOSA-N 337.380 1.532 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010396689 OYARFKRUSJLIPH-XHDPSFHLSA-N 339.396 1.660 10 10 EDCE CC(C)CN(CCO)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2154248368 MEYIOBNTKUDEPF-CYBMUJFWSA-N 343.221 1.889 10 10 EDCE C[C@H]1OCCN(Cc2cc(Br)ccc2O)[C@H]1C(=O)O 328139543 QEXCKBYSJPXNQM-PRHODGIISA-N 330.178 1.829 10 10 EDCE C[C@H](OCc1ccccc1)[C@H](NC(=O)c1cc(O)nc(O)c1)C(=O)O 706713949 INVJWHNNNVBVJD-BONVTDFDSA-N 346.339 1.281 10 10 EDCE NCc1cc(F)c(N2CCC[C@H](CO)[C@@H]2CO)cc1Br 709806212 LAGMCIITHRASAT-OTYXRUKQSA-N 347.228 1.617 10 10 EDCE Cn1cc(C(=O)Nc2ccc(O)cc2C(=O)O)nc1Br 698446272 OGCXQRFVUCCGGJ-UHFFFAOYSA-N 340.133 1.839 10 10 EDCE CCN[C@H](c1ccccc1O)[C@@H](O)c1nn(C)nc1Br 2167727792 XHIASCRXYIZHBI-ZYHUDNBSSA-N 341.209 1.667 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])n1 2225792691 PGXFVKPGALBINY-JGVFFNPUSA-N 349.214 1.692 10 10 EDCE CCSC[C@@H](NC(=O)NCc1cnc(SC)s1)C(=O)O 2284506124 BXDAAZZPFCVJSB-MRVPVSSYSA-N 335.476 1.871 10 10 EDCE C[C@@H]1CN(C(=O)C=Cc2ccc(O)c(O)c2)C[C@H]1N1CCOCC1 2307987827 NPBCHQGCZFBYDE-UKRRQHHQSA-N 332.400 1.290 10 10 EDCE C[C@@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C[C@@H](CO)O1 2311236422 UPGZNNYRGPUYQI-QAPCUYQASA-N 346.427 1.145 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H]2CCC[C@H](C(N)=O)C2)cc1F 172571744 KARQASKNHLLCGB-STQMWFEESA-N 336.411 1.735 10 10 EDCE NCc1cc(F)c(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2357592999 QPUVPPHNKUMKCM-DUDQEUOJSA-N 345.212 1.367 10 10 EDCE COc1ccc(N2CCN(c3ncnc(NN)c3[N+](=O)[O-])CC2)cc1 40611216 QABHZTZHLJOONM-UHFFFAOYSA-N 345.363 1.006 10 10 EDCE C[C@@H](NC[C@H]1CCCS1(=O)=O)c1ccc(N2CCOCC2)cc1 90465985 JWYXUAGOMQIOBT-RHSMWYFYSA-N 338.473 1.751 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CC3(C)C)CC2)cc1 269691585 FMDQOWQVTOWYNT-QGZVFWFLSA-N 331.460 1.980 10 10 EDCE COc1cc(N2CCN(C(=O)N[C@@H]3C[C@H]3C)CC2)cc(OC)c1OC 273635351 GPNWDCCCHYTHSU-TZMCWYRMSA-N 349.431 1.952 10 10 EDCE Cc1ccc(CN2C[C@@H](N)C[C@H](C(N)=O)C2)c(O)c1Br 2381130940 GVUAFAUYGKJTKJ-QWRGUYRKSA-N 342.237 1.098 10 10 EDCE COc1cccc(O)c1CN[C@H]1CCC[C@H]1CNS(C)(=O)=O 800309924 QAQDKOGBFQIKRZ-AAEUAGOBSA-N 328.434 1.208 10 10 EDCE COc1cccc(CN[C@H]2CCC[C@H]2CNS(C)(=O)=O)c1O 800309526 KNHZBCRLLZFUMH-AAEUAGOBSA-N 328.434 1.208 10 10 EDCE NCCOCCS(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 722222464 YKEOXVMJMLUMGR-UHFFFAOYSA-N 329.205 1.416 10 10 EDCE Cc1cc(CC(=O)NCCC(=O)NC(N)=O)c(C)n1-c1ccccc1 829841658 PGLCPTGHFNPVFR-UHFFFAOYSA-N 342.399 1.338 10 10 EDCE COC[C@@H]1CCN1C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 823733861 ULHMSLMFYFZOIR-HOCLYGCPSA-N 333.432 1.952 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N[C@@H]1CCCC[C@H]1O 588513477 MPPRGBCZGHAVBZ-HJPCAMOWSA-N 330.428 1.956 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CC12CCNCC2 831171670 FJHXAAYSVAINGF-KRWDZBQOSA-N 344.459 1.465 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(n1)OCCO2 847696646 SLYGDRFVQASGKN-SNVBAGLBSA-N 330.340 1.625 10 10 EDCE CNC(=O)NCCNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 910888978 RWWKVFCMVFNQCC-UHFFFAOYSA-N 328.416 1.682 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCCN(C)CCCN(C)C 853749562 VZVSAFWSBMMWKE-UHFFFAOYSA-N 349.523 1.744 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CC[C@H](C(=O)O)C3)C2)cc1 851651009 ICTCPIPBFKJRKE-BFHYXJOUSA-N 347.415 1.826 10 10 EDCE CO[C@H](CNC(=O)NCc1ccc(N2CC=CC2)cc1)[C@@H]1CCOC1 852138044 FDROZPDDAKABRT-SJLPKXTDSA-N 345.443 1.914 10 10 EDCE Cc1cc(S(N)(=O)=O)sc1C(=O)N(C)Cc1ccccc1O 769282577 NLXPXOWSHXUOIW-UHFFFAOYSA-N 340.426 1.682 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@@H](CS(=O)(=O)NC)C2)c1 862552285 VIFHZLBEWPYOJI-CYBMUJFWSA-N 342.461 1.552 10 10 EDCE O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1cc2cc(O)c(O)cc2s1 895989341 ADNJRFXLTUIECM-NEPJUHHUSA-N 348.424 1.906 10 10 EDCE COC(=O)[C@]1(O)CCN(Cc2cc(Br)ccc2O)C1 895706577 HDUBDAVSLKVTLI-ZDUSSCGKSA-N 330.178 1.265 10 10 EDCE Cc1nc([C@H]2CCN(Cc3ccc(N4CCOCC4)cc3)C2)n[nH]1 895007269 AUGMRUHTZBFKAE-INIZCTEOSA-N 327.432 1.939 10 10 EDCE CC(=O)c1cn(C2CN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)nn1 1158905527 LDRVBXXTHDQUSY-UHFFFAOYSA-N 341.331 1.340 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)O)CCN(Cc2ccccc2O)C1 1962851999 BLJJLBYPGOKPQP-QGZVFWFLSA-N 336.388 1.946 10 10 EDCE CCN1C[C@H](C)N(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H]1C 1329437591 OCEYEKBBPNZSBP-OLZOCXBDSA-N 331.416 1.176 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](CO)[C@@H](CO)C2)c(Br)c1 704451146 JDQAIDOBBRKCLH-MVWJERBFSA-N 330.222 1.539 10 10 EDCE CC[C@@H](CNC(=O)c1ccoc1)NC(=O)c1cc(OC)nc(OC)c1 1356868085 FCBXUMDHIRBTSX-ZDUSSCGKSA-N 347.371 1.630 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCC[C@@H](C(N)=O)C1 1297562401 KEZGOTVDFCAFLU-VXGBXAGGSA-N 325.405 1.786 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)CCC2(C)CC2)cc(OC)n1 1295631694 DBMKURNRGYFXMW-LBPRGKRZSA-N 349.431 1.914 10 10 EDCE CN1CCO[C@H](C(=O)N(C)Cc2ccc(N3CCCC3)cc2)C1=O 1539469317 XUPOLDMPIOCCLV-INIZCTEOSA-N 331.416 1.102 10 10 EDCE CCC(=O)NC[C@H]1CCCN1Cc1nnnn1-c1ccc(OC)cc1 1481021292 IANULIRTGIEVBB-CQSZACIVSA-N 344.419 1.162 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cc2nonc2C)cc1C 1716359824 NFNFIWYBYLSGPG-PLNGDYQASA-N 344.415 1.700 10 10 EDCE COC(=O)c1ccc(/C=C\C(=O)NCCc2ccc(O)c(O)c2)o1 1631509711 FGUOJXMPWRDCKK-DAXSKMNVSA-N 331.324 1.850 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CCNC3=O)CCC2)cc1C 1724795823 ZIBGTDDPKIDJBM-HNNXBMFYSA-N 345.443 1.268 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@@H](c2ncon2)C1 1567518499 GAMQBXRSEOWYLT-LLVKDONJSA-N 347.352 1.909 10 10 EDCE CNC(=O)C1CCC(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1567423349 WXOCXMLJDVYXPT-UHFFFAOYSA-N 331.376 1.884 10 10 EDCE Cc1nn(C)c(Br)c1C(=O)NCc1cccc(O)c1O 1644711365 ZHAPEMMOVIPDHW-UHFFFAOYSA-N 340.177 1.832 10 10 EDCE COc1c(O)cccc1/C=C1\SC(=S)N(CC(=O)O)C1=O 11291188 NWRVMAQRNHFGJM-UITAMQMPSA-N 325.367 1.687 10 10 EDCE NC(=O)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)C1 155400581 DPESZSSSTBOTPD-HZPDHXFCSA-N 342.443 1.906 10 10 EDCE O=C1N[C@@]2(CNCc3ccc(Br)cc3O)CC[C@H]1C2 1967816625 FZFQJJIWFHIOAH-XPTSAGLGSA-N 325.206 1.913 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C[C@@H](N)CO 1952205583 YYHYYKKWQAOUMA-NEPJUHHUSA-N 326.393 1.243 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)O)C(C)(C)c1cc(O)nc(O)c1 1952887233 FFCYNWVMFFAVKW-LLVKDONJSA-N 326.349 1.748 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](CO)(C(=O)NCCCN=[N+]=[N-])C1 1985104789 LSXNMRYCPOPRTP-CQSZACIVSA-N 327.385 1.423 10 10 EDCE NCc1ccc(N2CC[C@H]3CC(=O)N[C@H]3C2)c(F)c1Br 2145058728 VKRGCVZQMMZGSF-WPRPVWTQSA-N 342.212 1.762 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H]1NC(=O)CCOc1ccc(N)cc1 1999127969 JIDNQQUPJFERTL-KBPBESRZSA-N 335.404 1.820 10 10 EDCE CCO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010392719 ISWUINQYNNLHPJ-VXGBXAGGSA-N 339.396 1.780 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)c1ccnn1C 2010390938 KLNXRXTUXMPQBK-LLVKDONJSA-N 337.384 1.755 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@H](O)C(C)(C)C 2017669841 RFQUDDAVKMWWQZ-MNOVXSKESA-N 341.412 1.808 10 10 EDCE CNCc1ccc(N2CCS(=O)(=O)[C@@H](C)C2)c(Br)c1 706914861 WFFNRFJXGADMHN-JTQLQIEISA-N 347.278 1.792 10 10 EDCE OCCNC1CCN(Cc2ccc(Br)cc2O)CC1 686275020 FBKUWPVVAGDLRF-UHFFFAOYSA-N 329.238 1.701 10 10 EDCE CC(C)NCc1ccc(N(C)C(CO)CO)cc1Br 388368203 PAVDYTFRSNFEHT-UHFFFAOYSA-N 331.254 1.737 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)C[C@@]2(C)CO)c(Br)c1 698134512 AZNGAFFHKAIKCR-UDZFHETQSA-N 329.238 1.791 10 10 EDCE CCn1nnnc1CN(C)c1cc(Br)c(CN)cc1F 2196299511 YFEWVUZZMQSXQN-UHFFFAOYSA-N 343.204 1.690 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CO[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21 1908254108 HKIMBCBEELCCKM-IJLUTSLNSA-N 339.396 1.637 10 10 EDCE NCc1cc(F)c(N2CCOCCOCC2)cc1Br 2103230750 FNMVJHAIDIGHFC-UHFFFAOYSA-N 333.201 1.900 10 10 EDCE CN1CCO[C@H]2CN(c3ccc(CN)c(Br)c3)C[C@@H]21 2097702560 IJESCCFZHJSEOU-KBPBESRZSA-N 326.238 1.427 10 10 EDCE Oc1c(Br)cccc1CNC1CN([C@H]2CCOC2)C1 2113048226 WDAOSZHRBXOSQJ-LBPRGKRZSA-N 327.222 1.717 10 10 EDCE CN(CCN1CCOC1=O)c1ccc(CN)cc1Br 2114625111 URVLZGCTQWYIDG-UHFFFAOYSA-N 328.210 1.796 10 10 EDCE C[C@@H](N)c1ccc(N2CC3(CNC(=O)CO3)C2)c(Br)c1 2289732186 BPZOIPWAIHXBGD-SECBINFHSA-N 340.221 1.174 10 10 EDCE CN(C[C@H]1CCCN(S(C)(=O)=O)C1)c1ccc2c(c1)OCO2 121296092 UKBCGDAHQPBVKM-GFCCVEGCSA-N 326.418 1.523 10 10 EDCE O=C1c2ccccc2CCN1CCNCc1cc2c(cc1O)OCO2 189032838 DKLCTHRWFJCMIY-UHFFFAOYSA-N 340.379 1.909 10 10 EDCE Cc1ccc(CN2CCC(O)(C(=N)N)CC2)c(O)c1Br 2381126320 QDEPOUFITMEUHM-UHFFFAOYSA-N 342.237 1.726 10 10 EDCE CNC(=O)[C@H]1CCN(Cc2cc(Br)cc(OC)c2O)C1 817415687 WSSRXUYKVPFXNJ-VIFPVBQESA-N 343.221 1.731 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC[C@H]1CCC[C@@H]1O 823524693 WTDLTZCRNVTHCP-QAPCUYQASA-N 347.459 1.608 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1COC(C)(C)C1 828438228 UZISRNQKZUSHOJ-CQSZACIVSA-N 333.432 1.361 10 10 EDCE CN(CCCCO)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823538404 XRAPAMMZLJWEQF-UHFFFAOYSA-N 335.448 1.562 10 10 EDCE COc1ccc(O)c(CNC(=O)CCCCCCS(N)(=O)=O)c1 830544488 QJNUOWRBEGEBFK-UHFFFAOYSA-N 344.433 1.256 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCC1CSC1 914242735 SHSITRQAPOIJSD-UHFFFAOYSA-N 339.436 1.825 10 10 EDCE C[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@H]1C(=O)O 843035187 HMKZMKDLZQVTBQ-DTWKUNHWSA-N 335.316 1.473 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CNCC[C@@H]2C)cc1 842206436 GKKRTHPNXMRIHL-YOEHRIQHSA-N 346.475 1.263 10 10 EDCE CN1C[C@H](CCNC(=O)c2cc3cc(O)c(O)cc3s2)CC1=O 927738354 UGBBHKNLXFRHCS-SECBINFHSA-N 334.397 1.911 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cccnn3)cc2)C1 858669118 BDQUMRRYZOUDRM-AWEZNQCLSA-N 339.399 1.108 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)N[C@@H](CC(F)F)C3=O)C2)cc1 924977274 HPOJSICOSLRCKZ-AAEUAGOBSA-N 339.342 1.850 10 10 EDCE Cc1ccc(O)c(CNC(=O)NC[C@@H](C)N2C[C@H](C)O[C@H](C)C2)c1 858590830 RWHQALVXGGKTHP-KFWWJZLASA-N 335.448 1.998 10 10 EDCE CNCc1ccc(N2CCN(C)C[C@@H]2CO)c(Br)c1 699447106 DDBLTPZNNNJXBW-GFCCVEGCSA-N 328.254 1.281 10 10 EDCE CCN(CC(F)(F)F)C(=O)COC(=O)c1ccc(C)c(O)c1O 869374093 GHHARSPZWSBCIO-UHFFFAOYSA-N 335.278 1.974 10 10 EDCE Oc1nnc([C@@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)o1 930305441 DBQPSQGMBUNKJT-OAHLLOKOSA-N 344.415 1.991 10 10 EDCE CN(C)c1ccc(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1 872254420 COPOGBCUAHNQJK-ZACQAIPSSA-N 330.432 1.120 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@H](C)S(N)(=O)=O)c1C 768594611 MMHYGMHEXWRMNW-ZDUSSCGKSA-N 349.456 1.809 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1C(=O)N1Cc2cccc(O)c2C1 871207722 RKLFERGQVHJIGR-HIFRSBDPSA-N 348.399 1.917 10 10 EDCE CCOc1ccc(O)c(CN2CCN(C(C)(C)C(=O)OC)CC2)c1 779190066 AIPFARSAYIOHQH-UHFFFAOYSA-N 336.432 1.860 10 10 EDCE C[C@@H]1C[C@@]2(CC[C@@H](CNC(=O)c3c(F)ccc(O)c3O)O2)CO1 899476897 AOHZYRMKCSLMFE-LSYCYVAJSA-N 325.336 1.693 10 10 EDCE COC(=O)c1c(CNCc2cnnn2C)c2cc(F)ccc2n1C 894785708 ZZMMDWILFYEFHM-UHFFFAOYSA-N 331.351 1.522 10 10 EDCE C[C@@H]1C[C@@H]1[C@H]1C[C@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 897361982 XPJKQTUGJFQRMM-QCPWZWHMSA-N 329.444 1.777 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1nc(Cc2ccccc2)no1 1142507202 PTWNNXQPJGBUMH-UHFFFAOYSA-N 339.351 1.931 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@]2(C(=O)O)CCSC2)cc1F 797715222 KSFFQEGMLBMRHJ-OAHLLOKOSA-N 341.408 1.651 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCOC[C@@H]1c1ccco1 1348238516 AFBNVRGVOPJOFM-CQSZACIVSA-N 344.367 1.544 10 10 EDCE CN(C)[C@@H]1CC[C@H]2[C@@H](C1)OCCN2C(=O)Cc1ccc(O)c(O)c1 1151552984 ZJPLQRQICDAFFP-JKIFEVAISA-N 334.416 1.350 10 10 EDCE C[C@@]1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCCCO1 1304240200 BSFSFJDWHWKMMX-HNNXBMFYSA-N 342.417 1.453 10 10 EDCE CCN1C[C@@H](NCc2c(Br)ccc(OC)c2O)CC1=O 1964038671 IYXMKCJZFNKKAQ-VIFPVBQESA-N 343.221 1.874 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)[C@@H](CO)C2)cc1Br 704810156 KMLAYWLHNODFLZ-TXEJJXNPSA-N 329.238 1.206 10 10 EDCE C[C@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC[C@@H](C)O1 1261704982 IBBKGKOGRCIISC-QLFBSQMISA-N 347.459 1.956 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C[C@@H]1CCCOC1 1266365249 SZJLQFJWJFZIMT-ZDUSSCGKSA-N 347.419 1.937 10 10 EDCE CCN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@H](C)CNC(=O)COC 1288598232 CVNZVZVTNYYKIG-LLVKDONJSA-N 349.391 1.462 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NCc2cccc(O)c2O)C1 1520509175 RJRSDMUQNVSWDU-LBPRGKRZSA-N 348.399 1.971 10 10 EDCE Cc1cc(C(=O)NCc2ccc(O)cc2O)c2c(C)nn(C)c2n1 1626838302 VULKCEXUGRZTGM-UHFFFAOYSA-N 326.356 1.926 10 10 EDCE COc1c(O)nc(O)nc1C(=O)NCCCSc1nccs1 1627198886 MWKZQBZZSJVAOX-UHFFFAOYSA-N 342.402 1.265 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)C[C@@H](C)NC(N)=O)C2)cc1C 1713922682 NLCYTSLLNIXHSJ-HIFRSBDPSA-N 348.447 1.141 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCC1CCOCC1 1491690757 CWJRFINJKMCVOB-GFCCVEGCSA-N 347.419 1.984 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C2(N(C)C)CCC2)cc1C 1667836703 GCRXMKFHMQEVLO-MRXNPFEDSA-N 349.475 1.055 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)c(Br)c1 2126153888 AVRXTJXJPKRRAT-IOQCUFBNSA-N 328.206 1.119 10 10 EDCE CN1C[C@H](C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 1874180719 MNUOTLUONYCLHA-LLVKDONJSA-N 348.358 1.879 10 10 EDCE Nc1ccc(-n2nnc(C(=O)NC34CC5CC(CC(C5)C3)C4)n2)cc1 1857878419 AYCRLFCWGLIAJC-UHFFFAOYSA-N 338.415 1.943 10 10 EDCE CC(=O)NCCCn1c(C)cc(OCc2ccc(N)cc2)cc1=O 1857923047 KVMKLBRSUQYYOO-UHFFFAOYSA-N 329.400 1.844 10 10 EDCE C[C@H](C(N)=O)N(C)c1ccc(C=CC(=O)O)cc1Br 1911980997 FEVXLECESUSVPZ-MRVPVSSYSA-N 327.178 1.857 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H](O)[C@H]2CF)c(Br)c1 2140657773 IQBHUJYZLWGZPE-GUQKDYTMSA-N 333.201 1.349 10 10 EDCE C[C@@]1(CNCc2cc(Br)cc(F)c2O)CCNC1=O 2136063318 WBAPVVGPAVIJDN-ZDUSSCGKSA-N 331.185 1.910 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)[C@@](C)(O)C2)c(Br)c1 2136877658 JBGVXQPVNFMDBS-HERUPUMHSA-N 330.222 1.824 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O[C@H](N)Cc2ccc(O)c(O)c2)C1 1952762025 SWHNTCCQQRPIGH-WFASDCNBSA-N 338.404 1.951 10 10 EDCE CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)NCCN=[N+]=[N-])c2C1 1971515188 ZIWLZDMSMRWIHY-UHFFFAOYSA-N 335.368 1.743 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985101374 RGFLLUVIFYJHMH-WDEREUQCSA-N 327.385 1.827 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985103544 XAGBUYAYDOGFRV-GARJFASQSA-N 327.385 1.562 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010393695 WCNIOAYCUZPKJG-NWDGAFQWSA-N 340.428 1.743 10 10 EDCE NCc1cc(F)c(N2CCC[C@@H]3C(=O)NC[C@H]32)cc1Br 312485140 UZHZJYDTHCHODD-TVQRCGJNSA-N 342.212 1.762 10 10 EDCE COc1ccc(N2[C@H](C(=O)O)CC[C@H]2C(=O)O)cc1Br 703438880 LLDICGPXXUZUKD-UWVGGRQHSA-N 344.161 1.964 10 10 EDCE CCN[C@@H](C)c1ccc(N(C)C(CO)CO)c(Br)c1 382456841 WBFJEICQGWAQDW-JTQLQIEISA-N 331.254 1.909 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(CNC(=O)N3C)C2)c(Br)c1 2177688745 DMOKSLMAIJARFA-SECBINFHSA-N 340.221 1.716 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCCC4(CCOCC4)C3)c2n1 2062936695 JAWAMVLFIAOZCM-UHFFFAOYSA-N 330.388 1.776 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC3CCC4(CC3)OCCO4)c2n1 2063411905 ZPMGJXPWFPGABN-UHFFFAOYSA-N 332.360 1.159 10 10 EDCE CC(C)(O)[C@@H]1CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2191157891 VGPJHDNPMCDNIX-RYUDHWBXSA-N 341.205 1.784 10 10 EDCE CCS(=O)(=O)NC1CN(c2ccc(CO)cc2Br)C1 2109343689 KXCJMFUMUDZXHF-UHFFFAOYSA-N 349.250 1.069 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@@]2(CO)CO3)c(Br)c1 2094642871 HESXHOHPRNKNEI-GLXFQSAKSA-N 328.206 1.842 10 10 EDCE CN[C@@H](C)c1ccc(N(C)C2CS(=O)(=O)C2)c(Br)c1 2095903840 HKFIYMUXHIWKQL-VIFPVBQESA-N 347.278 1.963 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213589356 VZYSBULYVRQLCD-BBBLOLIVSA-N 340.384 1.103 10 10 EDCE O=C1NC(=O)N(Cc2ccccc2)C(=O)C1=CNCc1ccco1 2293042924 RRVOPAHSJBXQOG-UHFFFAOYSA-N 325.324 1.532 10 10 EDCE NCC1(NC(=O)C=Cc2ccc(N3CCOCC3)cc2)CCCC1 2301721742 JNYFMVWLVKBUNN-UHFFFAOYSA-N 329.444 1.924 10 10 EDCE NC(=O)c1cccc(N)c1N[C@@H](CCO)COCc1ccccc1 2303656469 NWXHJDWZCVBPKY-AWEZNQCLSA-N 329.400 1.747 10 10 EDCE CN[C@H](c1ccccc1O)[C@@H](O)[C@H](CNC(=O)OC(C)(C)C)OC 2307259264 JNOLKHLJBZKLIF-ZNMIVQPWSA-N 340.420 1.553 10 10 EDCE Cc1cc(C=CC(=O)NC(C)(CO)CO)c(C)n1-c1ccccc1 2309814621 RNDSZFSMUGYDGU-UHFFFAOYSA-N 328.412 1.967 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cnc3c(cnn3C)c2O)cc1F 179462462 QVCAFRHMBQYWOU-UHFFFAOYSA-N 343.362 1.809 10 10 EDCE Cc1cc(N(C)C)ccc1CNS(=O)(=O)N1C[C@H](C)O[C@H](C)C1 115592844 WMSSZPMEFAJULH-OKILXGFUSA-N 341.477 1.505 10 10 EDCE Cc1cccn2c(=O)c(C(=O)NCc3ccc(N(C)C)cc3)cnc12 90996328 NJLPXOHKWLRVFS-UHFFFAOYSA-N 336.395 1.999 10 10 EDCE C[C@H](CN1CCOCC1)CN1Cc2ccc(N(C)C)cc2[C@H]1CN 244419302 YSPXTHIHSRUVFR-DNVCBOLYSA-N 332.492 1.536 10 10 EDCE CC(C)c1ccc(N(C)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)cc1 255358411 FRJADRGUHCWQNB-FLIBITNWSA-N 341.411 1.884 10 10 EDCE CNCc1ccc(N2CC=C[C@]2(CO)COC)c(Br)c1 2379804459 CRKTYTSTVSACRN-HNNXBMFYSA-N 341.249 1.922 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1ccc(O)nc1 819974231 KMCVOKKYPRYCPX-UHFFFAOYSA-N 341.411 1.825 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCc1cn(C)nn1 819974267 LUNWNNFNJMAARK-UHFFFAOYSA-N 343.431 1.243 10 10 EDCE N[C@@H]1CC[C@@H]2CN(C(=O)/C=C\c3ccc(N4CCOCC4)cc3)C[C@H]21 588450520 PLOPMPNXOXYWJD-STPNDWQWSA-N 341.455 1.732 10 10 EDCE Cc1cc(CC(=O)NCc2nc(CO)n[nH]2)c(C)n1-c1ccccc1 912944481 BBZGMEVFLRSSGC-UHFFFAOYSA-N 339.399 1.563 10 10 EDCE COCCN1CCCN(C/C=C/c2ccc(N(C)C)cc2)CC1=O 835051018 WFAACPVGKULBOE-GQCTYLIASA-N 331.460 1.947 10 10 EDCE COc1cccc(CNC(=O)c2ccnn2C2CCOCC2)c1O 830540914 PTMQHKOFUBPLBZ-UHFFFAOYSA-N 331.372 1.879 10 10 EDCE COc1cc(Br)cc([C@@H](C)NC[C@]2(O)CCOC2)c1O 848535599 DWTUPGALMXHCLH-YMTOWFKASA-N 346.221 1.965 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)NCC[C@@H](N)C(C)C)cc1 851686966 VPQGUAYSBXUCJC-QGZVFWFLSA-N 348.491 1.639 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCc3nc(C)no3)C2)cc1 852036992 FSRJRMGBNBKNJZ-CYBMUJFWSA-N 345.403 1.507 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3=CCOCC3)C2)cc1 852365408 VZFHTCLRXRMVPV-OAHLLOKOSA-N 331.416 1.920 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCc4c[nH]nc4C3)C2)cc1 855232493 UWUHTJAZXJAIKN-DZGCQCFKSA-N 340.427 1.918 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CO)CCF)C2)cc1 852449651 VMFMLRXQJLGQEY-STQMWFEESA-N 325.384 1.294 10 10 EDCE CNc1cnc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cn1 858787165 ZRRWQADZGBERMT-ZDUSSCGKSA-N 341.415 1.846 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1[C@H]2OCCC[C@@H]21 856212014 FEUOUFADSZHKMC-KURKYZTESA-N 330.428 1.689 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N(C)CC1CN(C)C1 850626467 WOIGHAMHARCROP-UHFFFAOYSA-N 333.432 1.151 10 10 EDCE COc1ncnc(N(C)C)c1NC(=O)N1Cc2cccc(O)c2C1 930415011 QMOZCFUSWKUDMK-UHFFFAOYSA-N 329.360 1.805 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@H](C(F)F)CC3)cc2N1 866064496 RQJNVLGFCCOGAA-NSHDSACASA-N 343.286 1.786 10 10 EDCE Cn1cccc(C(=O)NCc2cccc(Br)c2O)c1=O 765750404 FYRNTYVHQNBFFQ-UHFFFAOYSA-N 337.173 1.783 10 10 EDCE COC[C@@H](NC(=O)C(=O)N(C)Cc1ccccc1O)c1ccccc1 1117173521 KDTMCFZYUQGFAY-MRXNPFEDSA-N 342.395 1.855 10 10 EDCE COc1cc(C)cc(CNCCS(=O)(=O)CC(F)(F)F)c1O 895250516 DUMMVMZKWDZBGI-UHFFFAOYSA-N 341.351 1.776 10 10 EDCE C[C@H](N[C@H](C)C1(S(C)(=O)=O)CC1)c1cc([N+](=O)[O-])ccc1O 797070883 NJVVTUWKROOLKY-VHSXEESVSA-N 328.390 1.917 10 10 EDCE CC1(C)[C@H](O)C[C@]1(CO)NCc1cc(Br)ccc1O 1879559769 QSIPFLXGNSCGRY-TZMCWYRMSA-N 330.222 1.766 10 10 EDCE CC1(F)CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 792037918 GGQQSFDQGDQGMM-UHFFFAOYSA-N 325.359 1.916 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@H](C)S1=O 790798907 FAOFQMXGGSWFKW-RKDXNWHRSA-N 339.373 1.271 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NCCCN=[N+]=[N-] 1963697843 FWDOMAZRMLXKBV-NSHDSACASA-N 327.385 1.829 10 10 EDCE CN1Cc2ccccc2[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C1=O 1167231152 BUVGHWBKTGPSGV-CNRGFGOASA-N 338.363 1.941 10 10 EDCE C[C@@H](N)c1ccc(N(C)C[C@@H](O)CN(C)C)cc1Br 690174040 XLVMRWJMHPAIAT-PWSUYJOCSA-N 330.270 1.828 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3ncn(C)n3)CCC2)cc1C 1326818007 YBUGSAICUFJHTE-UHFFFAOYSA-N 343.431 1.574 10 10 EDCE Cn1ncc(NC(=O)Cc2ccc(O)c(O)c2)c1Br 1892812802 SJZILELYROXOAX-UHFFFAOYSA-N 326.150 1.775 10 10 EDCE CCC(=O)N(C)C[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1338628120 ACWFXIJIKCQFJN-CYBMUJFWSA-N 349.391 1.150 10 10 EDCE C[C@@H]1C[C@H]1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1257235005 XQXBLGAFMAJCNR-VNQPRFMTSA-N 346.427 1.672 10 10 EDCE CCOC(=O)CN(Cc1cncc(OC)n1)Cc1ccccc1O 1261798441 LUKOXMOLOKPPGH-UHFFFAOYSA-N 331.372 1.756 10 10 EDCE COc1cccc([S@](=O)CC(=O)NCc2cccc(OC)c2O)c1 1294925941 VJJITHNHASVVMR-XMMPIXPASA-N 349.408 1.833 10 10 EDCE O=C(CNC(=O)c1cc2ccccc2[nH]1)NCc1ccc(O)cc1O 1469158811 FXMFHIFKQLVSPN-UHFFFAOYSA-N 339.351 1.625 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)N2CC=C(N)N2)CCCC1 1617199086 AQZTVHZMOQGTIH-UHFFFAOYSA-N 326.400 1.676 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC[C@@H](c2nnc3n2CCC3)C1 1558929683 OMYNADZLPSAKJU-SNVBAGLBSA-N 346.362 1.794 10 10 EDCE COc1ccc(-n2nnnc2CNCCN(C)C(=O)C2(C)CC2)cc1 1713593862 AWTBTVQJYJRFSK-UHFFFAOYSA-N 344.419 1.019 10 10 EDCE COCCN[C@H](C)[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1724565391 XADAVGXAFUGQGT-TZMCWYRMSA-N 347.419 1.936 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1cc(C(=O)OC)cn1 1634944449 UFIKYEDNCTWKFN-UHFFFAOYSA-N 338.360 1.177 10 10 EDCE CCOCC(=O)N[C@H](C)[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1725913563 ZPAZOIUFFPEOMQ-MNOVXSKESA-N 349.391 1.509 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2CCC(=O)N2)cc1C 1497727375 WZHUGVWUNPBJQH-JZIMQPMSSA-N 331.416 1.044 10 10 EDCE CONC(=O)CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1636482481 MQAKQVBUPREOPS-UHFFFAOYSA-N 329.356 1.314 10 10 EDCE CCOC(=O)COCCN(C)c1ccc(OCC(=O)OC)cc1 1645254358 IOEXDMZLIWYTFS-UHFFFAOYSA-N 325.361 1.254 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@]2(C)CCNC2=O)cc1C 1731735802 YETZSRNJWQGZPQ-AUUYWEPGSA-N 347.459 1.514 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1csc(-c2cnccn2)n1 1644754442 XADBFCFCUZVETJ-UHFFFAOYSA-N 328.353 1.941 10 10 EDCE Cc1cc(C(=O)NCc2nc(C(N)=O)co2)c(C)n1-c1ccccn1 1584231147 ZWWCLFSYGQGHIX-UHFFFAOYSA-N 339.355 1.506 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2[C@@H](C(=O)NCCCN=[N+]=[N-])[C@@H]21 1964884949 VBLDXOFKEKQLCH-GARJFASQSA-N 325.369 1.437 10 10 EDCE N[C@@H](CC(=O)O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1865998260 AQEVOAHRTSHUDD-LBPRGKRZSA-N 338.319 1.203 10 10 EDCE CC(C)(C)OC(=O)NC1CN(S(=O)(=O)Cc2ccc(N)cc2)C1 1977907457 RZZDEUGGWSZQPQ-UHFFFAOYSA-N 341.433 1.308 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(NC(=O)Nc2ccc(N)cc2)C1 1999159046 VBQQONVFTNOGPG-UHFFFAOYSA-N 336.392 1.372 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CN(Cc2ccc(N)cc2)[C@H]2COC[C@@H]12 1999483042 FKRGMXABGAOJLW-XHSDSOJGSA-N 333.432 1.993 10 10 EDCE C[C@H](c1ccccc1O)N(C)C(=O)[C@H](O)CNC(=O)OC(C)(C)C 2010263094 UFCSIGIRSAHFLJ-BXUZGUMPSA-N 338.404 1.797 10 10 EDCE O=C1Nc2cc(N3CC[C@@]4(CCO4)C3)c(Br)cc2[C@H]1O 2153334101 PDEWGTOUFSLBCT-TZMCWYRMSA-N 339.189 1.804 10 10 EDCE C[C@@H]1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C[C@H]1O 300006473 MESRSFMXDOFXHS-KEMBBXRSSA-N 340.221 1.608 10 10 EDCE CNCc1ccc(N2C[C@@H](O)C[C@]2(C)CO)c(Br)c1 698226796 HLNMWDSUCAHSRT-SMDDNHRTSA-N 329.238 1.491 10 10 EDCE CNCc1ccc(N2CC[C@@H](O)[C@@H](CO)C2)cc1Br 396821046 KEUWTKOIZALAJA-BXUZGUMPSA-N 329.238 1.348 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2199533019 SVGVGHINUXPFQT-MOLYSANOSA-N 342.233 1.823 10 10 EDCE CN1CCCN(c2ccc(CO)cc2Br)CCC1=O 2096280137 VCHNFJZVSOQVNA-UHFFFAOYSA-N 327.222 2.000 10 10 EDCE CN(C)c1ccc(C=C2NC(=S)NC2=O)cc1Br 2313466137 ZMARITAPQDZVFM-UHFFFAOYSA-N 326.219 1.860 10 10 EDCE Cc1ccc(CN[C@@H](C)[C@H]2CNCCO2)c(O)c1Br 2352690652 GWXDWERYSFTGNZ-CMPLNLGQSA-N 329.238 1.930 10 10 EDCE COC(=O)c1ccc(C)c(S(=O)(=O)NCCc2ccc(N)cc2)c1 171531780 OTEDZLSXGOAASK-UHFFFAOYSA-N 348.424 1.885 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN2CCC[C@@H]2C1 171637947 KREXGVVOYKTZBX-GOSISDBHSA-N 330.476 1.491 10 10 EDCE Oc1ccc(Br)cc1CN1CCN2CCOC[C@@H]2C1 368814477 SHXQLVGYXLYVNL-ZDUSSCGKSA-N 327.222 1.671 10 10 EDCE O=C(CN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCCO 210393719 WWKNMWQCOBKPOH-YRNVUSSQSA-N 340.401 1.135 10 10 EDCE C[C@H](NCCCn1ccnn1)c1ccc(N2CCOCC2)c(F)c1 184264968 YZUBBKCTUWDMJT-AWEZNQCLSA-N 333.411 1.995 10 10 EDCE Cc1ccc(O)c(CNCc2ccc(S(=O)(=O)CCO)cc2)c1 191841130 ONYYKEGXYQSHQY-UHFFFAOYSA-N 335.425 1.756 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)[C@H]1CCOC1 228384074 HQCGZSBZSOZLGN-JVXZTZIISA-N 326.194 1.626 10 10 EDCE Cc1cc(N2CCCC2)ccc1/C=C1\NC(=O)N(CC(=O)O)C1=O 96504840 AELCRCIFRTYDCD-ZROIWOOFSA-N 329.356 1.573 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2C[C@H]3CC[C@H]2C3)c1 245204037 VAQLHWNNRZGXGS-SRVKXCTJSA-N 338.429 1.930 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC4(CCOCC4)C3)cc2N1 368556482 XRHHEEKEHGKZKP-UHFFFAOYSA-N 333.344 1.933 10 10 EDCE COC(=O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1 298883167 LHGNBLCZRIRRKK-OAHLLOKOSA-N 331.416 1.991 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2COC[C@H](C)N2)c(O)c1Br 2380748488 FJDODQXMHHBUQX-ONGXEEELSA-N 343.221 1.456 10 10 EDCE O=C(NCCc1cn[nH]c1)NCc1ccc(N2CCOCC2)cc1 290921881 XPDGPDOAWKXKCL-UHFFFAOYSA-N 329.404 1.288 10 10 EDCE CN1CC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 729522971 BEEJDXLUTDDICO-CQSZACIVSA-N 335.423 1.355 10 10 EDCE CNC(=O)N1CCN(c2ccc([C@@H](C)O)cc2Br)CC1 721696561 KJQWDFWYPNNXHQ-SNVBAGLBSA-N 342.237 1.964 10 10 EDCE COc1ccc(OC)c(/C=C2/SC(=S)N(CC(N)=O)C2=O)c1 727177064 VUZUYSNFDNIHIH-IZZDOVSWSA-N 338.410 1.390 10 10 EDCE C/C(=C/C(=O)N(C)Cc1ccc(N(C)C)cc1)CN1CCOCC1 900026952 QCFJYRQWIRKZKB-SSZFMOIBSA-N 331.460 1.990 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCS(=O)(=O)[C@@H]3CCC[C@H]32)c1O 832462482 GIFVDEZULHBKQA-HUUCEWRRSA-N 341.404 1.885 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CNCC[C@H]2C)cc1 846173858 UQDFRYSBYQGHGA-RHSMWYFYSA-N 334.464 1.771 10 10 EDCE COc1ccc(N2CCN(C(=O)COCc3n[nH]cc3C)CC2)cc1 844771695 SXVKITJYBZELMI-UHFFFAOYSA-N 344.415 1.592 10 10 EDCE C[C@H](CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)NC(N)=O 847393918 RHWIKTOHMKBVGY-CHWSQXEVSA-N 334.420 1.147 10 10 EDCE COCc1cc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)no1 855232213 RDAKQYQAGDQADB-GFCCVEGCSA-N 331.372 1.838 10 10 EDCE O=C(NCC1=CCOCC1)NCc1ccc(N2CCC(O)CC2)cc1 852365554 ZNMAEDNFRGNKCH-UHFFFAOYSA-N 345.443 1.794 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@@H](OC)[C@@H]2CCOC2)cc1 855021095 ZFXBKIDVTFHTPZ-PBHICJAKSA-N 336.432 1.641 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC3CCN(OC)CC3)C2)cc1 852385176 LSANUACZTNIODD-HNNXBMFYSA-N 348.447 1.599 10 10 EDCE CNC(=O)NCC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 761136201 BXJJYFZVRODGSF-UHFFFAOYSA-N 328.416 1.682 10 10 EDCE CS(=O)(=O)NCc1ccc(C(=O)N2Cc3cccc(O)c3C2)o1 871202664 DIWPVXOLQXGRNO-UHFFFAOYSA-N 336.369 1.190 10 10 EDCE C[C@@H](CN[C@@H](C)c1ccc(N2CCOCC2)cc1)CS(C)(=O)=O 775259040 MVUDLDOJTSWPDA-GJZGRUSLSA-N 340.489 1.855 10 10 EDCE NC(=O)CCCCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 779608949 XWPIUZFUIXMEQN-UHFFFAOYSA-N 337.395 1.324 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C1(N2CCOCC2)CCC1 782712171 QGBNNZWRXLCIET-UHFFFAOYSA-N 331.460 1.932 10 10 EDCE CN(Cc1cc(Br)cc(F)c1O)C1CS(=O)(=O)C1 895399572 QUBCUEKSJDCPPA-UHFFFAOYSA-N 338.198 1.523 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)c2ccc(N(C)C)cc2)c1 790027637 YVKAEOZQRNXICD-UHFFFAOYSA-N 336.413 1.945 10 10 EDCE CN(Cc1cnn(-c2ccccc2)n1)C(=O)Cc1ccc(O)c(O)c1 1147668397 VPEGKOSQAOAXCX-UHFFFAOYSA-N 338.367 1.880 10 10 EDCE CCCCNC(=O)COc1cccn(Cc2ccc(N)cc2)c1=O 57874905 FIPXNMIRIYSGPQ-UHFFFAOYSA-N 329.400 1.774 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N3CC(CC4CC4)C3)ccc21 1328933788 FSCUOQHOIWGURM-UHFFFAOYSA-N 341.455 1.944 10 10 EDCE CC[C@@H](OC)C(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1502392918 DJUCOOVAQLUMRF-ZWNOBZJWSA-N 349.391 1.509 10 10 EDCE Cc1conc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1288915568 MTAINHKJGFGXBH-UHFFFAOYSA-N 342.399 1.615 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccc3nonc23)c1 1467922758 RQOOSMMTEHJIPG-UHFFFAOYSA-N 348.340 1.552 10 10 EDCE COc1cccc(CNC(=O)NCc2nnc(O)n2C2CC2)c1O 1479161364 DAVLIJQYEDJPOE-UHFFFAOYSA-N 333.348 1.032 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@@H]2C[C@@H]12 1906905318 WYXKAODXRNRKRJ-UCKQBZRPSA-N 336.432 1.801 10 10 EDCE Cc1ccc(C(=O)NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)c(O)c1O 1471718582 ZXJIASJTUUTAGB-YOGCLGLASA-N 339.413 1.492 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1nnc(O)nc1O 1625240288 LAQYGQYHXIDXMR-UHFFFAOYSA-N 331.376 1.400 10 10 EDCE CCC(=O)[C@@H]1CCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1624112650 SWSIOSVXXAGJJL-LBPRGKRZSA-N 340.401 1.347 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)C)CC2)cc1F 1630202050 KCLPILFVRDMLLP-SREVYHEPSA-N 335.379 1.127 10 10 EDCE CS(=O)(=O)c1cc(C(=O)NCc2c(O)cccc2O)cs1 1639292835 SHYIBYJUFIPXEI-UHFFFAOYSA-N 327.383 1.493 10 10 EDCE C[C@H](NC(=O)c1cccc(O)c1O)C(=O)NCCc1ccccc1 1635594401 CNZPRSRDNJFLQG-LBPRGKRZSA-N 328.368 1.575 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cnnn3C)CC2)cc1C 1733242962 JNRDDFSILQSKNG-UHFFFAOYSA-N 329.404 1.184 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)Cn2cccn2)cc1C 1571377451 LRCIQWRFGMCGCN-HNNXBMFYSA-N 330.432 1.837 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](C)[C@H]3CO)nc12 1654391075 RPPNLJFQNNWBLU-BXUZGUMPSA-N 348.403 1.204 10 10 EDCE COC(=O)[C@H]1C[C@H]1C(=O)N(C)CCCNCc1ccc(OC)c(C)c1 1699498230 OREHVXZRXLYFPZ-CVEARBPZSA-N 348.443 1.751 10 10 EDCE C[C@H]1C(=O)NCCN1c1ccc(C=CC(=O)O)cc1Br 1911890107 HHTHEVHCCZKBSX-VIFPVBQESA-N 339.189 1.872 10 10 EDCE CNCc1ccc(N2CC[C@H](O)C[C@H]2CO)cc1Br 2136084173 YRLCCAVJZRIPCW-STQMWFEESA-N 329.238 1.491 10 10 EDCE C[C@H](O)c1ccc(N2CCOC[C@@H]2[C@@H](O)CO)cc1Br 2146324238 TYDZYTQNNJTNFW-FZZIBODNSA-N 346.221 1.061 10 10 EDCE NC(=O)CN(Cc1ccccc1)c1cc2c(cc1Cl)[C@@H](N)C(=O)N2 1946836082 SXJRWGXEGUCXMQ-MRXNPFEDSA-N 344.802 1.784 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(c2ccc(O)c(O)c2O)C[C@H]1C(=O)O 1952829258 JJFVUWNMFPXGKH-VXJOIVPMSA-N 325.317 1.628 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NCc2ccc3c(c2)CCO3)C1 1997820033 NEAFIMKZGUTIFS-HUUCEWRRSA-N 334.416 1.691 10 10 EDCE C[C@@H](O)c1ccc(N2CCOC[C@H]2[C@H](O)CO)cc1Br 2146324235 TYDZYTQNNJTNFW-BIGNPOOSSA-N 346.221 1.061 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)N(C)c1ccc(N)cc1 1999437346 OIRMSCBHTDIYDX-UHFFFAOYSA-N 336.436 1.688 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@]2(C(=O)C(=O)C[C@H]3C[C@H](N)C3)C[C@H]2C1 2003171707 ZZPOLBNJNYPWIV-RSLFNQERSA-N 336.432 1.899 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CCCOC1 2010393919 ZEJBEHYIEIDONB-XHDPSFHLSA-N 339.396 1.972 10 10 EDCE NCc1ccc(N2CC[C@H]3C(=O)NC(=O)[C@@H]3C2)cc1Br 2158786498 WMLKQSKXSZUVLV-GHMZBOCLSA-N 338.205 1.007 10 10 EDCE CN(C)C(=O)N1CCN(c2ccc(CN)cc2Br)CC1 401561894 XWTNCBUVKSJKFE-UHFFFAOYSA-N 341.253 1.711 10 10 EDCE Nc1ccc(N2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c(Br)c1 380907358 OMAIVJDKEOGUBP-WYUUTHIRSA-N 337.173 1.698 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4COC[C@@H]4C3)c(Br)cc21 718257220 MFPKHUTYMNGLLA-UPFKWVMWSA-N 338.205 1.484 10 10 EDCE OCC[C@H](COCc1ccccc1)NCc1ccc(O)c(O)c1O 2303541230 WAFSNHXXDQKDLJ-OAHLLOKOSA-N 333.384 1.861 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@@H](C(=O)N3CC(N=[N+]=[N-])C3)[C@@H]2C1 1908254994 YVSFOTANBBSFIA-TUAOUCFPSA-N 337.380 1.389 10 10 EDCE C[P@]1(=O)C[C@H](O)[C@@H](NCc2cc(Br)ccc2O)C1 2057722122 YLWLLKUFYMSLGT-KWFDTGPKSA-N 334.150 1.980 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3C[C@H]4[C@H](N)[C@H]4C3)ccc(N)c2C1 2071578580 ZKPZPHLFZWMKPC-HALDLXJZSA-N 344.459 1.955 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2104424361 NDGLWLGBOQPOSX-BCHGOWJXSA-N 327.222 1.399 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])COC1 2210540156 QCLDOVSKOLOKAP-VHSXEESVSA-N 325.369 1.628 10 10 EDCE CC[C@@]1(CO)COCCN1c1ccc(CN)cc1Br 2112707534 GGHUEEQQYVQYRS-CQSZACIVSA-N 329.238 1.886 10 10 EDCE C[C@@](O)(CO)[C@@H]1CCN(c2cc(Br)c(CN)cc2F)C1 2202841338 SUMAWKFOVTWPFG-QMTHXVAHSA-N 347.228 1.617 10 10 EDCE COC[C@@H]1[C@@H](O)[C@H](O)CN1c1ccc([C@@H](C)N)cc1Br 2234066889 LODCVMCVWFOERD-HKSFMPNISA-N 345.237 1.026 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3COC[C@]3(CO)C2)c(Br)c1 2234551143 IRKCZCLKKCJTES-ITDIGPHOSA-N 341.249 1.914 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](O)C[C@H]2C(=O)O)c1O 2236037597 KGZILEOEGMVBFG-XCBNKYQSSA-N 346.177 1.183 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](CCC(=O)N2CC(N=[N+]=[N-])C2)C1 2252702845 GMOIENLQUDZMAC-LBPRGKRZSA-N 339.396 1.924 10 10 EDCE CSc1ncc(CNS(=O)(=O)N2CCCC[C@H]2CN)s1 2284693076 WZYNQFALJLQMQO-VIFPVBQESA-N 336.508 1.013 10 10 EDCE CN(C)c1ccc(C=C2C(=O)NC(=S)N2C(=O)[C@@H]2CCCO2)cc1 2313517957 XJIUNSQJLHZFRN-AWEZNQCLSA-N 345.424 1.516 10 10 EDCE COc1ccc(OC)c([C@@H](C)NC=C2C(=O)N(C)C(=O)N(C)C2=O)c1 52529208 RLZSQIKCAOWITB-SNVBAGLBSA-N 347.371 1.289 10 10 EDCE CC(=O)N1CCN(c2ccc(OC[C@H]3COC(C)(C)O3)cc2)CC1 28568482 OBLRHKZTHGNXFI-KRWDZBQOSA-N 334.416 1.885 10 10 EDCE CCCCNC(=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 244313815 XEYWOWFECMVQJV-UHFFFAOYSA-N 333.432 1.650 10 10 EDCE COCCCNC(=O)N1CCN(c2ccc3c(c2)OCCO3)CC1 243090875 IWHLYKKUXUIXSN-UHFFFAOYSA-N 335.404 1.326 10 10 EDCE Cc1oc(C(=O)NCCc2ccc(O)c(O)c2)cc1S(C)(=O)=O 528856743 FODCIVQYDUUWAL-UHFFFAOYSA-N 339.369 1.375 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(CO)CCCN2)c(O)c1Br 2381129628 MSMWCBHVCXMFMU-AWEZNQCLSA-N 343.221 1.194 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3CC[C@H]3C)CC2)cc1 819311871 PPOCYWUYMLSBIM-SZVBFZGTSA-N 333.476 1.566 10 10 EDCE CCNCc1ccc(N2CCN(C(N)=O)CC2)c(Br)c1 722177226 PFVNBZHCBSSQPL-UHFFFAOYSA-N 341.253 1.759 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCN(C3CC3)C2=O)cc1F 824669098 FCVJRKFRHJVMLJ-UHFFFAOYSA-N 334.395 1.408 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@@H](N)CCC(=O)OC)cc1 826020350 RTIGTGMBIULCBE-INIZCTEOSA-N 335.448 1.772 10 10 EDCE Nc1ccc(CNC(=O)CN2CCN(Cc3ccccc3)CC2)cc1 837303325 HBYYYCBXQGDMGY-UHFFFAOYSA-N 338.455 1.703 10 10 EDCE O=C1C[C@@H](CCNC(=O)NCc2ccc(N3CCCC3)cc2)CN1 914180523 PJFGNARGVORVSP-OAHLLOKOSA-N 330.432 1.612 10 10 EDCE C[C@H](C1CC1)n1[nH]ccc1=NC(=O)COC(=O)c1cc(O)cs1 745003094 XAXSUQOHONXHBB-SECBINFHSA-N 335.385 1.839 10 10 EDCE COC(=O)c1cc2ccccc2c(CN2CN(C)C(=O)[C@@H]2C)c1O 842642382 UFBSHBQJJVSVKC-NSHDSACASA-N 328.368 1.952 10 10 EDCE CNC(=O)CCOC1CCN(Cc2cc(C)cc(OC)c2O)CC1 754741214 YDRDDWBQMCQBPI-UHFFFAOYSA-N 336.432 1.826 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NCCOC2CCOCC2)c1 927500208 KVXVXKPDFQABMK-GFCCVEGCSA-N 338.404 1.957 10 10 EDCE C[C@H]1C[C@@H](NC(=O)NCc2ccc(N(C)C)c(F)c2)c2ncnn21 852475966 JQJVCQLWZNHYTA-GXFFZTMASA-N 332.383 1.988 10 10 EDCE C[C@@H]1CC[C@H](C(N)=O)[C@@H](C)N1CC(=O)NCc1ccc(N(C)C)cc1 930918428 YTTIQGZREOVTFR-CPUCHLNUSA-N 346.475 1.343 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2C[C@H]3CS(=O)(=O)C[C@H]3C2)c1O 933729571 XVEYPNMFCCRHRG-TXEJJXNPSA-N 343.832 1.725 10 10 EDCE C[C@@H]1C[C@H]1c1noc(C(=O)NCc2ccc(N3CCOCC3)cc2)n1 865910957 FPAXWIHCPPFNAL-IUODEOHRSA-N 342.399 1.960 10 10 EDCE O=C(CN1C(=O)CSc2ccccc21)NCc1ccc(O)c(O)c1 768920144 UNSGZWMGDRZBHY-UHFFFAOYSA-N 344.392 1.853 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C[C@@H](C)O1 875508108 UAQAXLDDUBFWMO-WWGRRREGSA-N 349.431 1.786 10 10 EDCE O=C(NC[C@@]1(O)[C@H]2[C@@H]3C[C@@H]4[C@@H]5C[C@@H]([C@@H]2[C@@H]53)[C@@H]41)c1cccc(O)c1O 787680217 BBPKBDLWUNNSBV-FFMMWZBESA-N 327.380 1.337 10 10 EDCE CN1CCN(c2ccc(CNC(=O)C[C@@H]3CCN(C)C3)cc2)CC1 899212638 XPBXUHRJQNQSTJ-KRWDZBQOSA-N 330.476 1.396 10 10 EDCE CC(=O)c1cc(O)ccc1NS(=O)(=O)c1c(Cl)cnn1C 797432121 MYRWCBNKBFCOGE-UHFFFAOYSA-N 329.765 1.783 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)c1nnnn1CC(F)F 1334881747 FQQNPCZBEBOPIV-UHFFFAOYSA-N 338.362 1.411 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H](CO)CN2CCCCC2)cc1 1157549198 NXJMXGVKSYEBIC-CQSZACIVSA-N 333.392 1.426 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)NCCN=[N+]=[N-])C[C@H]1CCCO1 1963818847 ZFUMVASEESHPMV-LLVKDONJSA-N 327.385 1.829 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CC(=O)N(C)C2)c1O 1964032865 NWBHJLQDQOEGSY-QMMMGPOBSA-N 329.194 1.484 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)Cc2nonc2C)cc1C 1320596616 LMNIJTQNUKAJHY-CYBMUJFWSA-N 346.431 1.922 10 10 EDCE CC[C@@H](NC(=O)C(=O)N1Cc2cccc(O)c2C1)[C@H]1CCCOC1 1334671315 SOPRIZRKBDLDPN-DZGCQCFKSA-N 332.400 1.556 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1CCN1C(C)(C)C 1333367094 ZRDQMEIECPYSLJ-AWEZNQCLSA-N 333.432 1.340 10 10 EDCE CC[C@H](CNC(=O)C1(C(=O)NC)CC1)NCc1ccc(OC)c(C)c1 1267821901 IWRAEVOODGMFMU-OAHLLOKOSA-N 347.459 1.514 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ncc(Br)cc1O 1455355862 UNVNNHRJROONIA-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE NC(=O)NC[C@@H]1CCCCN1C(=O)c1cc2cc(O)c(O)cc2s1 1542767356 XFXDCZIJBSFBQL-JTQLQIEISA-N 349.412 1.976 10 10 EDCE O=C1NC[C@@]2(CCN(Cc3c(O)cccc3Br)C2)N1 2121193912 BUNZNLKPZADKRK-CYBMUJFWSA-N 326.194 1.412 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H]2CCCCN2C)cc1C 1716091717 RNWUVPGVUZWYDE-IAGOWNOFSA-N 349.475 1.055 10 10 EDCE Cn1nc(C2CCOCC2)cc1C(=O)NCc1c(O)cccc1O 1558535005 BKGDBGMFBHVONF-UHFFFAOYSA-N 331.372 1.655 10 10 EDCE CN1CCN(CCC(C)(C)NC(=O)Cc2ccc(O)c(O)c2)CC1 1638844933 RUHCCXSFUNTAOG-UHFFFAOYSA-N 335.448 1.173 10 10 EDCE CCC(=O)NCC(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 1569393196 IOLHGWYMZDFNIP-UHFFFAOYSA-N 333.432 1.268 10 10 EDCE CCn1cc(C(=O)N(C)CCCNCc2ccc(OC)c(C)c2)nn1 1723162570 CQRMOYAZDVDAHN-UHFFFAOYSA-N 345.447 1.867 10 10 EDCE CO[C@H](C)CNCC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1668326615 SWJYNGDPXGNBOV-VXGBXAGGSA-N 335.408 1.982 10 10 EDCE CN1CCCc2cc(CNC(=O)C3=C4CCCN=C4NN3)ccc21 1597854704 IOJJODKJDOPYQI-UHFFFAOYSA-N 325.416 1.239 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)Cc2nncn2C)c([N+](=O)[O-])c1 1772931877 HYKFQTCEVMTVHY-ALCCZGGFSA-N 331.332 1.546 10 10 EDCE C[C@H](O)CN(CCCNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1690016387 UOQCIUZYSVRZSK-LBPRGKRZSA-N 347.419 1.814 10 10 EDCE CC(C)(C)OC(=O)NC[C@@]1(CO)COCCN1CCCN=[N+]=[N-] 1982242464 NTWFTKPVQWJBSN-CQSZACIVSA-N 329.401 1.275 10 10 EDCE NCc1ccc(N2CCC[C@@H](OCC(N)=O)C2)cc1Br 2145383256 SNAXVHOEPGOYPZ-GFCCVEGCSA-N 342.237 1.379 10 10 EDCE CN1CCc2cc([C@]3(N)COC[C@@H]3NC(=O)OC(C)(C)C)ccc21 1999527805 SEYMDQMDGCGTJI-MAUKXSAKSA-N 333.432 1.756 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CC(N=[N+]=[N-])C1 2010389462 QHQBJJLUWZUSPW-NSHDSACASA-N 335.368 1.367 10 10 EDCE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@H](CN)CC(N)=O 2018789507 OXADNIOEOWVCDR-AWEZNQCLSA-N 336.436 1.350 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C(=O)NC(=O)[C@H]3C2)cc1Br 387428271 NWWLKOWTNCOWDH-SWPVVBRQSA-N 338.205 1.178 10 10 EDCE O[C@H]1CCN(c2ccc(CNC3CC3)cc2Br)C[C@@H]1O 2188633091 NIFHJKGQGIMRNT-GJZGRUSLSA-N 341.249 1.633 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)C1CC(CO)C1 2193578664 LXUWTUMQFCGFKK-ROKYYSGWSA-N 340.221 1.608 10 10 EDCE COc1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)c(O)c1 1908511543 QXFGNNITQPPRBG-UKRRQHHQSA-N 338.404 1.471 10 10 EDCE NCc1ccc(N2CC[C@@]3(O)CCOC[C@H]3C2)cc1Br 2194549537 CVLPLIYQUZGTQH-IUODEOHRSA-N 341.249 1.886 10 10 EDCE NC(=O)CO[C@H]1CCN(c2ccc(CO)c(Br)c2)C1 2089139769 PFWNAKOTCFUHTB-NSHDSACASA-N 329.194 1.022 10 10 EDCE O=C(O)[C@@H]1[C@H]2OCCN(Cc3c(O)cccc3Br)[C@H]12 2092839048 XBRKETBDGMGEOV-QJPTWQEYSA-N 328.162 1.439 10 10 EDCE COC[C@@]1(O)CCN(c2cc(Br)c(CN)cc2F)C1 2095540349 JJXLAAHYJCGVDZ-CYBMUJFWSA-N 333.201 1.635 10 10 EDCE CCNCc1ccc(N2C[C@@H]3C(C(N)=O)[C@H]3C2)c(Br)c1 2201292395 FQIROOSATCSOAG-QWRGUYRKSA-N 338.249 1.726 10 10 EDCE N[C@@H]1[C@H]2C[C@@H](CN(Cc3c(O)cccc3Br)C2)[C@H]1CO 2239338547 PNJYODBWJQUOOZ-LFIJZLDSSA-N 341.249 1.542 10 10 EDCE CC(=O)C(=O)[C@]1(O)[C@H]2CCC[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C2 2244178333 XHEJEFJABZUXHY-AAYAQQKKSA-N 325.405 1.979 10 10 EDCE CC[C@@H](C(N)=S)S(=O)(=O)NCc1cnc(SC)s1 2257134076 WZGMPCVDZMOKAK-ZETCQYMHSA-N 325.506 1.349 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)C[C@@H]21 2249687443 YHOGZDKBORMZJN-POQQGIQPSA-N 336.432 1.898 10 10 EDCE Cn1cccc1C=C1C(=O)NC(=O)N(Cc2ccc(F)cc2)C1=O 2296761490 SEDVDJJYSXHYLU-UHFFFAOYSA-N 327.315 1.826 10 10 EDCE Cc1cc(N2CCN(C(=O)C=Cc3ccc(O)c(O)c3)CC2)n[nH]1 2310805657 RWDQXFLILDNCTE-UHFFFAOYSA-N 328.372 1.491 10 10 EDCE CCn1cc([C@H]2CN(C(=O)C=Cc3ccc(O)c(O)c3)CCO2)cn1 2311666247 REOZCRBTPNEIKW-QGZVFWFLSA-N 343.383 1.928 10 10 EDCE C[C@H](O)[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(O)cc2)SC1=S 2323823722 IDDYOOIRZARJAI-CPCISQLKSA-N 339.394 1.427 10 10 EDCE Cc1ccc(CN(C)S(=O)(=O)N2CCC2)c(O)c1Br 2352623728 CHEQMGJPYYIZPS-UHFFFAOYSA-N 349.250 1.845 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CSC(=O)N2)c(O)c1Br 2352932375 MAQNGHAJHLSQLI-QMMMGPOBSA-N 345.218 1.904 10 10 EDCE CN(C)c1ccc(CNC(=O)Cn2c(=O)[nH]c3ccccc32)cc1F 123462990 OHIUTHGQZHPYDA-UHFFFAOYSA-N 342.374 1.851 10 10 EDCE COc1cc(Cl)cc(CN2CC[C@H](N3CCOCC3)C2)c1O 184682111 MNMVYWUSOLMSGS-AWEZNQCLSA-N 326.824 1.961 10 10 EDCE COc1cc(N2CCN(Cc3cc(OC)c(C)cc3O)CC2)ncn1 185610856 IWJKEXVZJVMJLM-UHFFFAOYSA-N 344.415 1.830 10 10 EDCE CN[C@@H]1COC[C@H]1C(=O)NCc1ccc(C)c(Br)c1O 2380756307 KCMDMZDKEAELEX-GHMZBOCLSA-N 343.221 1.314 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@H]4COC[C@@H](C3)O4)ccc21 802060445 BLZJRFLHAYRBBI-IYBDPMFKSA-N 331.416 1.378 10 10 EDCE CNC(=O)[C@@H]1CCN(Cc2cc(Br)cc(OC)c2O)C1 817415686 WSSRXUYKVPFXNJ-SECBINFHSA-N 343.221 1.731 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cn4c(n3)CCC4)CC2)cc1F 843819069 ROKAUWWHLGQVBA-UHFFFAOYSA-N 344.390 1.939 10 10 EDCE COC[C@@H](CO)N[C@H](C)c1cc(Br)cc(OC)c1O 848548851 GQELSLUPAIDYJA-PSASIEDQSA-N 334.210 1.821 10 10 EDCE CCc1cccc(CN[C@H]2CCC[C@H]2CNS(C)(=O)=O)c1O 848909516 VPKOPMLOLBOYNJ-ZFWWWQNUSA-N 326.462 1.762 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CO)[C@H](c2cc(O)c(O)cc2O)C1 687742603 DWOWNNLRVPUJEL-MWLCHTKSSA-N 325.361 1.746 10 10 EDCE CC(=O)N[C@H]1CCCN(C(=O)CN2CCCc3cc(CN)ccc32)C1 843349752 AFKJHVIFBORQTR-KRWDZBQOSA-N 344.459 1.025 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CCN(C)[C@@H]3C)C2)cc1 922950294 HEOXYNJQEOFYAT-RKVPGOIHSA-N 346.475 1.913 10 10 EDCE C/C=C\C[C@H](CO)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852451349 INROCJAEUSHACT-VUBDOFJKSA-N 333.432 1.900 10 10 EDCE C[C@@H]1C[C@H](NCC[C@@H]2CNCCS2(=O)=O)c2c(O)ccc(F)c21 925791768 GSZLYMYTCNRGFC-WZRBSPASSA-N 342.436 1.446 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](C)[C@](C)(CO)C3)C2)cc1 854296986 MGQNBZPAXZVJNN-VCBZYWHSSA-N 347.459 1.934 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CSCN3C(C)=O)C2)cc1 855228966 GMAIWBOKKTUPJH-XJKSGUPXSA-N 349.456 1.312 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)Cn3cccn3)C2)cc1 851978621 NSGRILKFCFJBQS-GJZGRUSLSA-N 343.431 1.858 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCC12CC(CN1)C2 851677004 RHSOTKXLXNWJIT-UHFFFAOYSA-N 344.459 1.199 10 10 EDCE COCCOC1CN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 854298867 IXLASWVNKJZLGL-CQSZACIVSA-N 349.431 1.331 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(O)nc(N(C)C)n1 766004514 HIOUWEOOUUJXHY-UHFFFAOYSA-N 343.431 1.977 10 10 EDCE COC(=O)c1c(CNC[C@]2(C)CCC(=O)N2)c2cc(F)ccc2n1C 894967730 QSPPDZWPTCKGKT-SFHVURJKSA-N 347.390 1.862 10 10 EDCE CCOC(=O)[C@@H](Cc1ccncc1)NC(=O)Cc1ccc(O)c(O)c1 1149043103 KJULSPULCZBHRY-CQSZACIVSA-N 344.367 1.326 10 10 EDCE Cc1ccc2c(c1)C(=O)N(CC(=O)NCc1ccc(O)cc1O)C2=O 1142529773 FDFCMZWKDBPEFM-UHFFFAOYSA-N 340.335 1.319 10 10 EDCE CN1Cc2ccccc2[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1=O 1167231156 BUVGHWBKTGPSGV-PDFOZTTASA-N 338.363 1.941 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1Cc1cc(Br)cc(F)c1O 1332717726 NBMAFLXMLKYPNT-WDEREUQCSA-N 334.185 1.875 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CC(=O)N(C)C2)cc1C 1270988975 WCUXBBXGCZRLJY-HOCLYGCPSA-N 347.459 1.418 10 10 EDCE CCCN[C@@]1(CO)CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1273935729 IPKBFXXBOLWQHT-KRWDZBQOSA-N 347.419 1.816 10 10 EDCE O=S1(=O)C[C@H]2[C@@H](CNCc3cc(Br)ccc3O)[C@H]2C1 2117983883 ZHPNTEWEVVHRLI-ZSBIGDGJSA-N 346.246 1.535 10 10 EDCE COC(=O)[C@@H]1CC[C@H](C(=O)NCc2c(O)ccc3ccccc23)O1 1472085384 RPXQWZBCFNXZOK-CVEARBPZSA-N 329.352 1.882 10 10 EDCE C[C@H](O)CCCNC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1716466809 ZOMJPIANUVONNO-RYUDHWBXSA-N 335.408 1.718 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CC(=O)N(c2ccccc2F)C1 1636536997 BMFDGLIABOOWIQ-GFCCVEGCSA-N 344.342 1.701 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCS(=O)(=O)[C@H]2CCCC[C@H]21 1631521159 WARLZQNQBYTQLW-DOMZBBRYSA-N 339.413 1.209 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)c2ccncc2)cc(OC)n1 1720893853 DZBAYKULIIOZJC-NSHDSACASA-N 344.371 1.042 10 10 EDCE CS(=O)(=O)[C@H]1C[C@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C1 1588470916 GWAHHNIVJLFKNA-KYZUINATSA-N 341.410 1.618 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)CN2CCCC2=O)cc1C 1667970013 PXFNFLJPSDTYDD-HNNXBMFYSA-N 347.459 1.610 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCCn1cccn1 1774050368 PMHLKCDFFDQZBX-GFCCVEGCSA-N 343.391 1.454 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)Cn2cccn2)C2CC2)cc1C 1690142571 IDPSWBWOOSLLQS-QGZVFWFLSA-N 342.443 1.885 10 10 EDCE N[C@@H](COCc1ccccc1)C(=O)NCCc1ccc(O)c(O)c1 1946523054 YLXXLHNKTZBEEP-HNNXBMFYSA-N 330.384 1.301 10 10 EDCE CO[C@H](c1cccc(O)c1O)[C@H](NC(=O)OC(C)(C)C)C(=O)O 1952308270 JSZLPQXQSIFKCU-CMPLNLGQSA-N 327.333 1.763 10 10 EDCE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010388617 FAGYMNRJZUXASO-NWDGAFQWSA-N 338.412 1.449 10 10 EDCE CN1CCC(NCc2cc(Br)ccc2O)(C(N)=O)CC1 2154498998 YANACHIGIXRGIY-UHFFFAOYSA-N 342.237 1.194 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)OCC12CC2 2012209025 AYTUBAFBAIBVCJ-NSHDSACASA-N 337.380 1.676 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)CN(CCO)C(=O)OC(C)(C)C 2022874802 DDGRRGWQHVTGQD-UHFFFAOYSA-N 337.420 1.457 10 10 EDCE Cc1cccc(CNC(=O)[C@@H](CO)CNC(=O)OC(C)(C)C)c1O 2024805943 VKKADTRNXSFKRD-CYBMUJFWSA-N 338.404 1.450 10 10 EDCE O=C(O)C[C@@H]1COCCN1Cc1ccc(Br)cc1O 691422344 IDARSRWLGAHQGC-LLVKDONJSA-N 330.178 1.830 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCc3nnn(C)c32)c1 2062455461 HYLVKTHLLWVQQI-CMPLNLGQSA-N 330.388 1.827 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCCC[C@@H]1[C@H](O)C(F)(F)F 2064875376 OONICMZRDWXFIX-YGRLFVJLSA-N 333.306 1.945 10 10 EDCE CN1C(=O)O[C@H]2CN(c3ccc(CN)c(Br)c3F)C[C@H]21 2176923769 JHQWLLIHXYOOTQ-ZJUUUORDSA-N 344.184 1.686 10 10 EDCE OCc1ccc(N2C[C@@H](O)[C@@H](O)CC23CCC3)c(Br)c1 2169919756 DCILVHYTMCFHTD-UONOGXRCSA-N 342.233 1.796 10 10 EDCE C[C@@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)c(Br)c1 2190462179 VSHVOIBIAJWZBJ-MOLYSANOSA-N 341.249 1.932 10 10 EDCE Nc1ccc(OCCC(=O)N2CC(CNC(=O)C(F)(F)F)C2)cc1 2044623819 YSKMABOSNSQSBP-UHFFFAOYSA-N 345.321 1.175 10 10 EDCE OCc1ccc(N2CCO[C@@H]3COCC[C@H]32)cc1Br 2087487605 SAIMLVOELJKMKF-ZIAGYGMSSA-N 328.206 1.936 10 10 EDCE CN[C@H](c1ccccc1O)[C@H](O)c1nn(C)cc1Br 2093828208 AFVZNFPZGMDUBC-YPMHNXCESA-N 326.194 1.882 10 10 EDCE CCN(CC)CCNC=C1C(=O)NC(=O)N(c2ccc(C)cc2)C1=O 2296926898 BYEIAFSOLOTPJA-UHFFFAOYSA-N 344.415 1.393 10 10 EDCE CS(=O)(=O)[C@@H]1CC[C@@H]1NCc1ccc(Br)cc1O 2319822775 RAIJCIFQCQDNTF-CMPLNLGQSA-N 334.235 1.820 10 10 EDCE Cc1ccc(CN(C)C[C@@H](O)CC(=O)O)c(O)c1Br 2352947362 HVJNPFHIFNDKJX-JTQLQIEISA-N 332.194 1.731 10 10 EDCE O=C1Nc2cc(N3C[C@@H](F)[C@H](CO)C3)c(Br)cc2[C@@H]1O 2355617389 HTRAUENDQLJOCN-RMUHFYJVSA-N 345.168 1.201 10 10 EDCE COc1cc(/C=C2\C(=O)N(C)C(=S)N=C2O)cc(OC)c1OC 56700970 LXHHAOQZEJOQEF-UITAMQMPSA-N 336.369 1.809 10 10 EDCE COC(=O)[C@@H]1C[C@H](O)CN1Cc1ccc(Br)cc1O 1327880353 FTOWAYNLEIBAIC-QWRGUYRKSA-N 330.178 1.263 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CN1C(=O)NC(C)(C)C1=O 115281957 VSDAGRNQYGXSBA-UHFFFAOYSA-N 332.404 1.008 10 10 EDCE CN1C(=O)[C@@H]2[C@@H](ON(Cc3ccccc3)[C@H]2c2ccccc2O)C1=O 248038579 NOEZTLRTUYTPAB-YESZJQIVSA-N 338.363 1.864 10 10 EDCE CCOC(=O)CN(CC)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255494586 SUOXWHJBCHLUDR-YFHOEESVSA-N 346.427 1.948 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN(C(C)=O)C[C@@H]2C)c([N+](=O)[O-])c1 268659123 HZGQQACIZKEZER-PZBABLGHSA-N 347.371 1.838 10 10 EDCE CSc1ncc(CN[C@@](C)(CCS(C)(=O)=O)C(=O)O)s1 2378418583 YVBXGWCWNWDVMZ-NSHDSACASA-N 338.476 1.233 10 10 EDCE CN1CCC[C@@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1=O 295287677 PXOJLYMQPKXMMV-JKSUJKDBSA-N 346.427 1.768 10 10 EDCE C[C@@H](O)C[C@@H]1COCCN1C(=O)c1cc2cc(O)c(O)cc2s1 907416059 GAKZXTPUVDJZMR-MWLCHTKSSA-N 337.397 1.924 10 10 EDCE CN(c1ccc(CNC(=O)C(=O)NCCCN)cc1)C1CCCCC1 842150477 SOZGIODPYCAYIV-UHFFFAOYSA-N 346.475 1.537 10 10 EDCE COc1cc(Br)cc(CN2C[C@@H]3C[C@H]2C[S@]3=O)c1O 846103761 XELUTVSCMODVHU-ZHYXMNDGSA-N 346.246 1.869 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCO[C@H]([C@@H](C)O)C2)c([N+](=O)[O-])c1 840384885 BPBMTEMSYFPDBE-XGHHZIIFSA-N 336.344 1.367 10 10 EDCE C[C@H](NC(=O)N(C)Cc1ccc(N(C)C)cc1)c1nnc(O)n1C 926134403 ZBMREOKJRPBLEZ-NSHDSACASA-N 332.408 1.489 10 10 EDCE O=C(NCc1c(O)cccc1F)NC[C@@H](n1cncn1)C(F)(F)F 923611036 NFENIUHMPSQMEF-LLVKDONJSA-N 347.272 1.726 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1nnc(O)n1C1CC1 923861957 OEAJINSYKNEIOR-UHFFFAOYSA-N 344.419 1.726 10 10 EDCE C[C@@H](NC[C@H](O)CS(C)(=O)=O)c1ccc(Cl)c(Cl)c1O 927024469 KZAWBGDVPDNUGD-SFYZADRCSA-N 342.244 1.755 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](CC(N)=O)C3)C2)cc1 852448221 IEYFGELMWWBEBV-KBPBESRZSA-N 346.431 1.181 10 10 EDCE CN1CCN(c2ccc(CN3C[C@H]4[C@H]5CC[C@@H](NC5)[C@H]4C3)cc2)CC1 863653163 DIFAZXJXDOGIJW-ZIBCJSCZSA-N 340.515 1.868 10 10 EDCE CNc1cnc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)cn1 862158196 DBKGCGQHJNEOME-GFCCVEGCSA-N 327.388 1.536 10 10 EDCE COC(=O)[C@@]1(OC)CCN(Cc2ccc(N3CCOCC3)cc2)C1 862473638 CTKYVHSFRRPTAF-GOSISDBHSA-N 334.416 1.287 10 10 EDCE CN(CCN1CCCS1(=O)=O)Cc1cc(Cl)cc(F)c1O 775735285 KJBRHXPMOCEYFN-UHFFFAOYSA-N 336.816 1.652 10 10 EDCE O=S1(=O)CC(CCNCc2cccc(Br)c2O)C1 786824080 HJKNJKKHFUQLIN-UHFFFAOYSA-N 334.235 1.679 10 10 EDCE COc1ccc(CNS(=O)(=O)c2c(Cl)cnn2C)c(O)c1 797457745 ZXEHCGCDTQQBGX-UHFFFAOYSA-N 331.781 1.266 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@H](c1ccccc1)c1nn[nH]n1 1149501747 WFDZCVNPULAPTR-DZFYGRHCSA-N 337.339 1.530 10 10 EDCE Cc1nn(C)c(Br)c1C(=O)NCc1c(O)cccc1O 1156885313 DDVJKSGCOHBFJS-UHFFFAOYSA-N 340.177 1.832 10 10 EDCE O=C(Cn1c(=O)nc(O)c2ccccc21)NCc1c(O)cccc1F 1306898800 QVGFMYRYTKJUTF-UHFFFAOYSA-N 343.314 1.263 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCCc1nc(C)no1 1322597938 MCAQNJCORQZZMZ-UHFFFAOYSA-N 346.387 1.181 10 10 EDCE CCN(C)C[C@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332014595 UQPRAJCIAQXQAN-CYBMUJFWSA-N 331.416 1.035 10 10 EDCE C[C@H]1CCOCCN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1332565171 QJXRIHPLZICIIS-LBPRGKRZSA-N 337.395 1.145 10 10 EDCE CCn1cc(CC(=O)NCc2ccc(N3CCSCC3)cc2)nn1 1262268225 NZPZLHHSDLVGHU-UHFFFAOYSA-N 345.472 1.710 10 10 EDCE CCO[C@@H]1C[C@@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1(C)C 1261859876 HUGKQADZDKPTAM-HZPDHXFCSA-N 346.427 1.896 10 10 EDCE COc1ccc(CNC2(CNC(=O)C[C@H]3COC(=O)C3)CC2)cc1C 1277036751 OCUNPCSWRNEVHL-OAHLLOKOSA-N 346.427 1.695 10 10 EDCE COC[C@H](C)NC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1276712481 VEZKNQMPJIDKKL-XHDPSFHLSA-N 347.419 1.982 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)C[C@H]2CCNC2=O)cc1C 1283619662 BAAKHQGJUYNTCH-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCN(c2ccccc2)C1=O 1292912145 GIWHHTMIQLACAW-CQSZACIVSA-N 326.352 1.562 10 10 EDCE O=C(NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)c1c(F)ccc(O)c1O 1472615394 WNFHOZNZJQCZPK-PBINXNQUSA-N 343.376 1.323 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN(c3ncc[nH]3)CC2)cc1 1618433152 PFAOUZUDBDQSBH-UHFFFAOYSA-N 327.348 1.535 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc(O)c(O)c1 1557858322 UBZMFSVMSUMQAI-STQMWFEESA-N 348.399 1.861 10 10 EDCE O=C(CNC(=O)C1CC1)Nc1c(-c2ccccn2)nc2ccccn12 1629108430 YRAXUIGARKGFDG-UHFFFAOYSA-N 335.367 1.861 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C[C@@H]2C=CCC2)cc1C 1496938462 LJVJUAVJNXARMX-WBVHZDCISA-N 332.444 1.927 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN(c2nc[nH]n2)CC1 1640301183 VSZDJMVRDHPKDP-UHFFFAOYSA-N 345.384 1.393 10 10 EDCE C[C@H](C(=O)NCc1ccc(O)cc1O)n1nnc(-c2ccccc2)n1 1643103788 FTLLZRSBNBXBHY-LLVKDONJSA-N 339.355 1.629 10 10 EDCE COc1cc(C(=O)NCc2c(O)cccc2O)c([N+](=O)[O-])cc1OC 1645360983 RRYAKPUTJIJXGI-UHFFFAOYSA-N 348.311 1.953 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1ncnc(O)c1Br 1588156362 WTWLSOFDVVEHGP-UHFFFAOYSA-N 338.161 1.923 10 10 EDCE CO[C@@H]1C[C@@H](C(=O)O)N(Cc2ccc(Br)cc2O)C1 1964722108 ZKHXAUNWGQPORU-MNOVXSKESA-N 330.178 1.829 10 10 EDCE Cc1c(OCC(N)=O)c(=O)ccn1CCCOc1ccc(N)cc1 1857919636 QEFRWHFTCUMXIJ-UHFFFAOYSA-N 331.372 1.072 10 10 EDCE CC(C)(C)OC(=O)N1CCC(=O)[C@@H]1[C@@H](N)Cc1ccc(O)c(O)c1 1952911337 RIBVWZFVHPHNGM-NHYWBVRUSA-N 336.388 1.546 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@](C)(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003172295 IZYHJCGTCIVBFY-PRXAMGSTSA-N 340.420 1.278 10 10 EDCE CN1CCO[C@H](CN(C)Cc2c(O)cccc2Br)C1 709429577 ZAXAGIAQKLCWKH-NSHDSACASA-N 329.238 1.917 10 10 EDCE CCN(CCOCCO)c1ccc(CN)c(Br)c1F 388368422 IIZJGSLFJUQXLV-UHFFFAOYSA-N 335.217 1.882 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCO[C@H](C(F)(F)F)[C@H]3C)c2n1 2064779590 NZOLPNFBZQBHTG-KCJUWKMLSA-N 344.293 1.535 10 10 EDCE CC1(C)C[C@H](O)[C@H](O)CN1c1cc(Br)c(CN)cc1F 2188631635 DRACUBMRZRVJMK-QWHCGFSZSA-N 347.228 1.757 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCC[C@H]2CN=[N+]=[N-])C[C@H](O)C1 1909748005 HHEIXWDAJGVMGG-ZIBATOQPSA-N 339.396 1.706 10 10 EDCE COCCN(C[C@H](C)O)c1cc(Br)c(CN)cc1F 2272395417 OMGICYXRSSWJFN-VIFPVBQESA-N 335.217 1.881 10 10 EDCE CNCc1ccc(N2C[C@H]3COC[C@]3(CO)C2)c(Br)c1 2234553198 WQKUPGKQJOCZFY-SWLSCSKDSA-N 341.249 1.614 10 10 EDCE OC[C@@H]1NC[C@@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@H]21 2235576900 UZLLEXZVMVEEBV-XWIASGKRSA-N 345.212 1.306 10 10 EDCE NCc1ccc(N2CC[C@H](O)[C@@H](O)CC2)c(F)c1Br 2269142372 RPSQUKAWSIPHSY-QWRGUYRKSA-N 333.201 1.369 10 10 EDCE COC(=O)C=C1SC(CCN2C(=O)c3ccccc3C2=O)=NC1=O 2314968753 UQXFSGXGMKETDD-UHFFFAOYSA-N 344.348 1.402 10 10 EDCE Cc1ccc(CN[C@H]2CO[C@@H]3COC[C@@H]32)c(O)c1Br 2352949785 JFJCETUDRSAWDD-GRYCIOLGSA-N 328.206 1.967 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)Cn2c(=O)[nH]c3ccccc32)c1 103529613 JLDUJHSVAHNLER-LLVKDONJSA-N 341.367 1.921 10 10 EDCE CCOC(=O)c1ccccc1N/C=C1/C(=O)NC(=S)N(CC)C1=O 104923119 IJBUSXYXWPHECU-LUAWRHEFSA-N 347.396 1.422 10 10 EDCE COCCN1CCC[C@@H]1CNC(=O)NCc1ccc(N(C)C)cc1C 115825995 XSWMNLVICLIXCO-GOSISDBHSA-N 348.491 1.971 10 10 EDCE CN1C[C@@H](NC(=O)NCc2c(O)ccc3c2CCCC3)CCC1=O 173246824 BPVYJTVNKWAVIR-ZDUSSCGKSA-N 331.416 1.691 10 10 EDCE CCCNCc1ccc(N2CC([C@H](O)CO)C2)cc1Br 2361905480 GEHIVXHUUIQYDC-OAHLLOKOSA-N 343.265 1.738 10 10 EDCE COc1ccc(CN2CCCN(Cc3noc(C)n3)CC2)c(O)c1 127929578 DVUVGWXERMXAEX-UHFFFAOYSA-N 332.404 1.800 10 10 EDCE NC(=O)C[C@H](N)c1cc(Br)cc(Br)c1O 44250393 PVAHTRXSKIANOC-ZETCQYMHSA-N 337.999 1.792 10 10 EDCE CN1CCCc2cc(CNS(=O)(=O)NCC(F)(F)F)ccc21 195195202 WYRYYOCJYUVFJA-UHFFFAOYSA-N 337.367 1.555 10 10 EDCE CN1C2(CCC2)COC[C@]1(CO)CN[C@H]1CCc2cccc(O)c21 527949492 LMGWHXMKDIBXKV-HNAYVOBHSA-N 332.444 1.585 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@]3(C)CCCO3)CC2)cc1 267943589 DHIDRCPUHGAORQ-LJQANCHMSA-N 347.459 1.503 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@]3(CCCOC3)C2)cc1 367446439 FACBXHVEACVROK-IBGZPJMESA-N 331.460 1.871 10 10 EDCE CN1CCC[C@@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1=O 295287672 PXOJLYMQPKXMMV-HZPDHXFCSA-N 346.427 1.768 10 10 EDCE Cn1cc(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)nn1 805275708 NNQWXEKWCTXDQT-UHFFFAOYSA-N 330.175 1.827 10 10 EDCE CS(=O)(=O)CC[C@@H]1CCCCN1C(=O)c1cccc(O)c1O 816805375 VOYUQOJQVKPENR-NSHDSACASA-N 327.402 1.527 10 10 EDCE O=C1CC[C@H](N2CCN(Cc3cc(Cl)ccc3O)CC2)CCN1 825148145 QWZKHQXOUUIOCB-HNNXBMFYSA-N 337.851 1.832 10 10 EDCE Cc1nc(C(=O)NCc2cc(Br)ccc2O)n(C)n1 836211648 IUIJREPUOZRVLJ-UHFFFAOYSA-N 325.166 1.522 10 10 EDCE COc1ccc(C(=O)NCC(=O)NCCc2ccc(O)c(O)c2)cc1 917356435 RITDYAZKXPMIED-UHFFFAOYSA-N 344.367 1.195 10 10 EDCE C[C@H]1CN(c2ccc(CNC(=O)NCCCN)cc2F)C[C@@H](C)O1 841718992 YCXBWSFLFGOTDU-BETUJISGSA-N 338.427 1.587 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1C(=O)NCc1ccc2c(c1)CCCN2C 844935753 VMXAUVRGPFRQER-JKSUJKDBSA-N 333.432 1.360 10 10 EDCE Cn1nnc2c1C[C@H](NCc1ccc(N3CCC(O)CC3)cc1)CC2 922992567 RJELDAKTTPYMNS-OAHLLOKOSA-N 341.459 1.423 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C)C(O)[C@H](C)C3)nc12 852503460 OTFAULOAYUMNRP-GHMZBOCLSA-N 348.403 1.060 10 10 EDCE CN1CCCc2cc(CNC(=O)NC3(CN)CCOCC3)ccc21 861568228 QRAYHIKSRBKOCI-UHFFFAOYSA-N 332.448 1.376 10 10 EDCE COC(=O)[C@@H](C[C@@H]1CCCOC1)NC(=O)c1ccc(C)c(O)c1O 862998171 WGOGBOFPKJIEAY-WCQYABFASA-N 337.372 1.494 10 10 EDCE C[C@@H]1C[C@@H](NCC(C)(C)CS(N)(=O)=O)c2c(O)ccc(F)c21 866573770 YKMZSLFLUXCWBD-MWLCHTKSSA-N 330.425 1.984 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCO[C@@H]3C)CC2)cc1 770721823 AMAPTGGXLMLDQE-CRAIPNDOSA-N 347.459 1.358 10 10 EDCE COc1ccc(O)c([C@H](C)N[C@@H](C)C(=O)N(C)CC(=O)NC2CC2)c1 775369794 QWONHPMBSGKMIN-RYUDHWBXSA-N 349.431 1.177 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNCc1cccc(F)c1O 1876122023 CNIWVEJUSRIWJB-MRXNPFEDSA-N 328.384 1.897 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H](O)CC(F)(F)C2)c([N+](=O)[O-])c1 786829110 YESVPVPZZUSECF-JOAKQRRISA-N 342.298 1.987 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1C[C@H]1C(N)=O)NCc1ccc(OC)c(C)c1 1318577253 QEPQXHRNDHYASJ-ZNMIVQPWSA-N 333.432 1.109 10 10 EDCE O=C(O)C1=C[C@@H](c2ccc(N3CCC(O)CC3)cc2)NC(=S)N1 76260980 SVAITIHVWXJGKY-ZDUSSCGKSA-N 333.413 1.135 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCCC[C@@H]2F)c1 1261881875 NHPRJZKWMFYQKS-NWDGAFQWSA-N 330.381 1.774 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)C(N)=O)C2CCCCC2)cc1C 1268120156 NBCXLNDUYWZUGR-MRXNPFEDSA-N 347.459 1.644 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cocc2C)cc1C 1268321712 VASNSGLVWMJPRQ-HNNXBMFYSA-N 332.400 1.786 10 10 EDCE C[C@@H](O)CN(C)C[C@@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1505466316 WKMRCTAFCXXERH-DOMZBBRYSA-N 347.419 1.766 10 10 EDCE Cc1ccc(CN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)nc1 1351845690 PPDMCXBRRBLIRA-UHFFFAOYSA-N 325.368 1.596 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)NCc2c(O)cccc2O)C1 1472064251 YNUAHJXMLPCAKT-GFCCVEGCSA-N 348.399 1.971 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@H]2CCN(C)C2)cc1C 1713654344 AYLCQUVRFOICRN-QGZVFWFLSA-N 333.476 1.893 10 10 EDCE CC(C)Cn1[nH]c(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1=O 1556158184 UHZRWEWDLDMMDC-GFCCVEGCSA-N 347.415 1.534 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@H]1C[C@@H]2CC[C@H](C1)S2(=O)=O 1630273071 IZUUSSKBUQBEHS-CNDDSTCGSA-N 325.386 1.070 10 10 EDCE Cc1cc(CC(=O)NC[C@@H](O)CO)c(C)n1-c1ccc(Cl)cc1 1639974348 CTHFSNZDTZAFLX-MRXNPFEDSA-N 336.819 1.759 10 10 EDCE COC[C@@H](C)NC[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1567155452 PXTOXIMLFQXZIV-OLZOCXBDSA-N 347.419 1.936 10 10 EDCE C[C@H](CNC(=O)Cc1ccc(O)c(O)c1)CNC(=O)OC(C)(C)C 1632378802 IBFZEJSWHSZDDF-LLVKDONJSA-N 338.404 1.917 10 10 EDCE CC[C@H](CNC(=O)C1CCCC1)NC(=O)c1cc(OC)nc(OC)c1 1582371901 KDRJYBXMTITORA-CQSZACIVSA-N 349.431 1.914 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@H]2CCN(C)C2=O)cc1C 1669588127 SSAYTENBMGGQMN-GOEBONIOSA-N 347.459 1.466 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H]2CCCNC2=O)cc1C 1666927709 MZGJTYNOESOWAK-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1nccn1C 1774050393 WWXQJEWEWOWAQV-NSHDSACASA-N 343.391 1.491 10 10 EDCE CC(C)(C)CC(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169902562 RZRACFYOYONKBG-UHFFFAOYSA-N 336.388 1.524 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@H]2CCCN2C2CCOCC2)c1 155367138 AKFHMTAXKRWRQW-MRXNPFEDSA-N 334.416 1.660 10 10 EDCE Nc1ccc(OC(=O)NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 1858615909 LXRODRJLDDGWLY-UHFFFAOYSA-N 337.313 1.654 10 10 EDCE C[C@@H](O)CN(Cc1ccccc1)C(=O)[C@@H](N)Cc1ccc(O)c(O)c1 1914622503 HZLHZDMAPJBPOZ-CJNGLKHVSA-N 344.411 1.377 10 10 EDCE CN(C)[C@@H]1COC[C@H]1CNCc1cc(Br)cc(F)c1O 1924641113 PCSXVZHENBGIBW-ZWNOBZJWSA-N 347.228 1.960 10 10 EDCE Nc1ccc(OCC(=O)NC[C@]2(Br)CC2(F)F)cc1 2137781331 TXJUYOWUEBLXNK-LLVKDONJSA-N 335.148 1.937 10 10 EDCE COCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985101666 WBWMAKQSGPTZNC-WDEREUQCSA-N 327.385 1.827 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985102473 HQACDKHLXRGAAT-MXWKQRLJSA-N 327.385 1.562 10 10 EDCE CN(C)C(=O)[C@@H]1COCCN1c1ccc(CO)cc1Br 2155016701 JBJACYGVYLLYEE-ZDUSSCGKSA-N 343.221 1.235 10 10 EDCE CN1CCN(CCNCc2ccc(Br)cc2O)CC1 691502526 UWHLQRBNMBNBFR-UHFFFAOYSA-N 328.254 1.492 10 10 EDCE CCNC(=O)NCCNCc1cc(Br)cc(F)c1O 715810732 CQFZABPZPUGZED-UHFFFAOYSA-N 334.189 1.703 10 10 EDCE NCc1cc(F)c(N2CC[C@H](O)[C@@H](CO)C2)cc1Br 396922451 KGPLQYYQFNJPRJ-RNCFNFMXSA-N 333.201 1.226 10 10 EDCE NCc1ccc(N2C[C@@H](O)C3(CCOCC3)C2)cc1Br 2174365525 SZUHOZNLHBGHBC-CQSZACIVSA-N 341.249 1.886 10 10 EDCE CCN(c1ccc(CNC)c(Br)c1)[C@@H]1CC(=O)NC1=O 2171193682 VZSJEGAKZOTDJX-GFCCVEGCSA-N 340.221 1.410 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H]1CNC(=O)c1ccc(O)c(O)c1 1907374829 YWABXVDYDGRXRA-RYUDHWBXSA-N 336.388 1.988 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2CCC(=O)NC2)c1O 2208739627 URJHGDGTTYPZMQ-VIFPVBQESA-N 343.221 1.779 10 10 EDCE COc1ccc(Br)c(CN2CC(OC)(C(=O)O)C2)c1O 2236046576 VIUGISWGQVWPRM-UHFFFAOYSA-N 346.177 1.449 10 10 EDCE OCc1ccc(N2C[C@@H]3COC[C@]3(CO)C2)cc1Br 2226176840 SYMLZYDEGUVKIZ-BXUZGUMPSA-N 328.206 1.387 10 10 EDCE CN(C)c1ccc(OC[C@@](O)(CN)C2(Br)CC2)cc1 2229381673 PUMPSVJOGJMYKB-AWEZNQCLSA-N 329.238 1.749 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)NCC(=O)N1CCc2ccccc21 2307986771 AIDVTGFCAREPJF-UHFFFAOYSA-N 338.363 1.817 10 10 EDCE O=C1N=C(O)/C(=C/NC[C@@H]2CCCO2)C(=O)N1Cc1ccc(F)cc1 103105464 XWCRTORVLPZOGD-GFAPJHNFSA-N 347.346 1.897 10 10 EDCE C[C@H](Cn1cncn1)NC(=O)NCc1ccc(N2CC=CC2)cc1 126678803 WQMQKLMHXAGVPF-CQSZACIVSA-N 326.404 1.542 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCc2[nH]ncc2C1 125837366 AHJNNCCGIVBDEO-UHFFFAOYSA-N 327.432 1.492 10 10 EDCE c1ncn(C2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)n1 92647821 SMTDSVVRUYKUAM-UHFFFAOYSA-N 327.432 1.952 10 10 EDCE CCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2)CC1 243313744 LJGINPOHQLPFIB-UHFFFAOYSA-N 333.432 1.650 10 10 EDCE COC(=O)c1cc(C(=O)NCc2ccc3c(c2)CCCN3C)no1 280768470 MGJJNDFZASHSEV-UHFFFAOYSA-N 329.356 1.774 10 10 EDCE COc1cc(N2CCO[C@@]3(CCCOC3)C2)c([N+](=O)[O-])cc1OC 286583724 NKWXNNLOTQCHEP-INIZCTEOSA-N 338.360 1.998 10 10 EDCE C[C@@H]1COC2(CCC2)CN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 826707129 QEZNYMFNWIBWFN-CQSZACIVSA-N 345.443 1.539 10 10 EDCE Cc1cc(Cl)cc([C@@H](C)NC[C@]2(CO)COCCN2C)c1O 903281295 XLMGIZUYAVIJMP-WBMJQRKESA-N 328.840 1.698 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC3=CCCC3)C2)cc1 830482305 RGJDJXSPFCVVPS-OAHLLOKOSA-N 343.427 1.617 10 10 EDCE COC[C@@H]1CN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])C[C@H](C)O1 844212036 OVNPZIUTFCLHQU-IKHFIWMDSA-N 336.344 1.933 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)c2ccnc3[nH]nnc23)cc1 846442567 SWBPSKQZGGSTNA-UHFFFAOYSA-N 340.387 1.570 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N2CCC[C@H](OC(F)F)C2)cc1 842241917 LQPUJAMKLWDMCV-ZDUSSCGKSA-N 341.358 1.158 10 10 EDCE CN1CCOC[C@@H]1CNC(=O)NCc1cc(Cl)cc(Cl)c1O 858838908 PWDVZJFQMATSOW-NSHDSACASA-N 348.230 1.829 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCCS(C)(=O)=O)C2)cc1 855232292 SNFHYDQXFMRUEY-ZDUSSCGKSA-N 340.445 1.215 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@H]2COC[C@@H]2C1 852669124 MMWJPEZVWKGCSI-SJORKVTESA-N 331.460 1.679 10 10 EDCE CC(C)(C)c1cc(O)c(O)c(CN2CCN(c3nccnn3)CC2)c1 863273286 AKHXMYYLDAOHTI-UHFFFAOYSA-N 343.431 1.903 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)CC2CS(=O)(=O)C2)cc1 864636442 KCIQQXKHKQPWBG-UHFFFAOYSA-N 338.473 1.926 10 10 EDCE CCOc1ccc(CN2CCC[C@H](CS(N)(=O)=O)C2)c(O)c1 769385128 SXIIQQHTNCFHKE-LBPRGKRZSA-N 328.434 1.291 10 10 EDCE CC[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)C[C@@]2(CCOC2)O1 794305325 WCVKVTWSTQLXCR-WDBGYZBYSA-N 333.384 1.908 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1coc(C)n1 1138054148 YNCMQRMBZOQTII-NSHDSACASA-N 334.328 1.298 10 10 EDCE O=C(NCc1nnc2n1CCC2)c1cc2cc(O)c(O)cc2s1 1141334390 JZOQVVRCMQEYRU-UHFFFAOYSA-N 330.369 1.780 10 10 EDCE NC(=O)c1csc(CNC(=O)c2cc3cc(O)c(O)cc3s2)n1 1167196326 GRZKPGYQIKWDAW-UHFFFAOYSA-N 349.393 1.798 10 10 EDCE C[C@H](C(=O)NCc1ccc(O)cc1O)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 1162271654 MJNRWGMRMGWBCC-SWHYSGLUSA-N 346.383 1.278 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2ccc(O)nn2)cc1C 1319154606 PBGNKXWMZYIAJT-GFCCVEGCSA-N 344.415 1.655 10 10 EDCE O=S1(=O)CCCN1CCCNCc1ccc(N2CCCC2)cc1 1329718066 XPKAKEFOPAPKRE-UHFFFAOYSA-N 337.489 1.802 10 10 EDCE [N-]=[N+]=NCCN[C@@]1(C(N)=O)C[C@@H]2C[C@@H](CN2Cc2ccccc2)C1 716700741 PGIBKESGFRYEJO-HLLBOEOZSA-N 328.420 1.795 10 10 EDCE COC(=O)COc1ccc(N(C)C(=O)/C=C/c2cn(C)cn2)cc1 1268948875 RPIDMMCWWPNGRK-RUDMXATFSA-N 329.356 1.648 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCC[C@]12CCCO2 1262147428 YQGMHMYYWPXCSN-QAPCUYQASA-N 332.400 1.569 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCc1nnc2n1CCCCC2 1440894243 DAVKDBNRQFHYDV-UHFFFAOYSA-N 330.388 1.317 10 10 EDCE CC(=O)NCCC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1288749606 CHLIAASLFYWUKN-UHFFFAOYSA-N 331.376 1.885 10 10 EDCE NC(=O)[C@]1(c2ccccc2)CCN(C(=O)c2cccc(O)c2O)C1 1451486596 CQEPIKQKGAOFGN-GOSISDBHSA-N 326.352 1.367 10 10 EDCE O=C(O)[C@@H](F)C1(O)CN(Cc2c(O)cccc2Br)C1 2115657797 KRVLGXKYJXLWJM-SNVBAGLBSA-N 334.141 1.124 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)CNC(=O)c1ncccc1O 1294681899 YGEHOGDQQKEGIZ-UHFFFAOYSA-N 343.383 1.661 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCc1nnc(C)o1 1469230027 FHDJJJHRNBCWNR-UHFFFAOYSA-N 347.371 1.608 10 10 EDCE COC(=O)c1cc(C(=O)N[C@H](C)c2cc(OC)ccc2O)n(C)n1 1465992702 KZIXQKXOQZHCCX-SECBINFHSA-N 333.344 1.412 10 10 EDCE CNS(=O)(=O)c1ccc(C(=O)N[C@H](C)c2ccccc2O)cn1 1471196042 ROMJUYNDWCCBMH-SNVBAGLBSA-N 335.385 1.186 10 10 EDCE CN(C)CCOc1cccc(CNC(=O)Cc2ccc(O)c(O)c2)c1 1615461525 OOMMMWFZBDQACN-UHFFFAOYSA-N 344.411 1.897 10 10 EDCE CC[C@H](CNC(=O)[C@H]1CCCNC1=O)NCc1ccc(OC)c(C)c1 1481821431 OBHCWJKQUKYWLS-CVEARBPZSA-N 347.459 1.514 10 10 EDCE COc1ccc(CNC2(CNC(=O)CNC(C)=O)CCC2)cc1C 1717146339 CAOBIXCQFVRMLX-UHFFFAOYSA-N 333.432 1.268 10 10 EDCE CC(C)[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N1CCOCC1 1624811251 LOQUSXQTKCAOIX-OAHLLOKOSA-N 347.419 1.936 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCc2nnc(S)n2C2CC2)cc1 1628143163 HPKBDRHGFIWMKD-UHFFFAOYSA-N 345.388 1.994 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2ccns2)cc1C 1734519505 SAANYNYVFPNLKD-CQSZACIVSA-N 349.456 1.683 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)Cc2[nH]cnc2C)cc1C 1569033270 QQBPJZPZZFGPAF-CYBMUJFWSA-N 330.432 1.872 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cc(C)nn2C)cc1C 1731581029 HMPKWROSKJEKSH-AWEZNQCLSA-N 330.432 1.954 10 10 EDCE Cn1c(S)nnc1C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1585332087 JVAUHIIFIWYGFW-UHFFFAOYSA-N 348.428 1.464 10 10 EDCE CC(=O)N1CCN(CCNCc2cc(Cl)cc(F)c2O)CC1 1660927743 APWKSXJPGPANNS-UHFFFAOYSA-N 329.803 1.438 10 10 EDCE O=C(O)[C@@H](c1ccc(O)c(O)c1)[C@@H](C(=O)O)c1ccc(O)c(O)c1 13587792 UMAASMUXEBOCLH-KBPBESRZSA-N 334.280 1.546 10 10 EDCE O=C(CCc1nnc2ccccn12)NCCc1ccc(O)c(O)c1 1860390704 VLBVIFWCHVCJJG-UHFFFAOYSA-N 326.356 1.432 10 10 EDCE CN1CCN(c2ccc(NN=NCCN3CCOCC3)cc2)CC1 1860492889 NWWQZWPNXAQTEV-UHFFFAOYSA-N 332.452 1.550 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 1900612649 LSBQMJGICZCBET-GHMZBOCLSA-N 327.385 1.516 10 10 EDCE CC[C@H]1C(=O)NC(=O)CN1c1ccc(CN)c(Br)c1F 231840254 VQOBKWZHBOMVRQ-QMMMGPOBSA-N 344.184 1.288 10 10 EDCE CN(C)C(=O)[C@H]1CNCCN1Cc1cc(Br)ccc1O 234253644 DLBNNYQVLVEEHP-GFCCVEGCSA-N 342.237 1.017 10 10 EDCE O=S1(=O)C[C@H](c2ccc(OCc3ccccc3)cc2O)NCCN1 1952553685 AODFTLJPFOHJPA-MRXNPFEDSA-N 348.424 1.535 10 10 EDCE CN1CCc2cc([C@H](N)[C@H](O)CCNC(=O)OC(C)(C)C)ccc21 1999527060 IRHXMQLWAVHOCB-CVEARBPZSA-N 335.448 1.954 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](N3CC(O)C3)C2)cc1Br 2158747402 XQPZWSXIUJXELK-ZYHUDNBSSA-N 341.249 1.758 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NC(=O)c1cccc(O)c1O 2006284438 OEXOVXXQZILTEV-GHMZBOCLSA-N 338.360 1.120 10 10 EDCE CC(C)(C)OC(=O)N1CC(C[C@@H](F)C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2008892911 QDCAZHAZBRWLED-RAIGVLPGSA-N 342.411 1.847 10 10 EDCE CCNCc1ccc(N2C[C@H](O)C[C@@]2(C)CO)cc1Br 698114401 KUYHWEAOGQCRNJ-HIFRSBDPSA-N 343.265 1.881 10 10 EDCE Cc1nnc2n1CCN(c1ccc(CN)c(Br)c1F)C2 2170355350 SYMLEFHLKLDEDX-UHFFFAOYSA-N 340.200 1.967 10 10 EDCE O=C1Nc2cc(N3CC4(C=CCO4)C3)c(Br)cc2[C@@H]1O 2183724811 LVXGJTZOLZIXDD-LBPRGKRZSA-N 337.173 1.580 10 10 EDCE C[C@H](N=c1nc(CNC(=O)OC(C)(C)C)[nH][nH]1)c1ccc(O)cc1O 2063196336 QSBYJPADGABDPY-VIFPVBQESA-N 349.391 1.836 10 10 EDCE CNCc1ccc(N2CCCC2(CO)CO)cc1Br 2089865404 FKAALJCMDSUHMJ-UHFFFAOYSA-N 329.238 1.492 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213593563 SKEPTMALXFFJTF-GRYCIOLGSA-N 339.396 1.970 10 10 EDCE CN(Cc1nn(C)nc1Br)C(=O)Cc1ccc(N)cc1 2235257061 VHENKKMKHMMMOP-UHFFFAOYSA-N 338.209 1.361 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@@H]3COC[C@H]32)c1O 2236089377 DAMVOMIYRPDCND-DGCLKSJQSA-N 344.205 1.763 10 10 EDCE CNCc1ccc(N2C[C@H](CO)C[C@@H](CO)C2)c(Br)c1 2236634446 VHZMQZACYHYJDQ-CHWSQXEVSA-N 343.265 1.596 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3C[C@@]3(CN)C2)c1O 2272635170 YVEGUCJXTLGANC-LKFCYVNXSA-N 327.222 1.944 10 10 EDCE O=C(O)CNC(=O)CN1C(=O)C(=Cc2ccccc2)SC1=S 2293438610 CLQXHYFYCMUISA-UHFFFAOYSA-N 336.394 1.089 10 10 EDCE CSc1ncc(CNS(=O)(=O)C[C@@H](C)CNC(C)C)s1 2284688761 LTPFJUBPEWKISM-JTQLQIEISA-N 337.536 1.919 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2[C@H]3COC[C@H]32)c(O)c1Br 2352644302 YZPJCCLEZJQFNP-JGPRNRPPSA-N 326.190 1.972 10 10 EDCE Cc1ccc(CN2CC[C@@](C)(O)[C@@H](O)C2)c(O)c1Br 2352677632 BJLQERHIVTWSJD-SMDDNHRTSA-N 330.222 1.781 10 10 EDCE Cc1ccc(CN2CCO[C@@H]3CNC[C@@H]32)c(O)c1Br 2352942636 IFICGUJUXKUDNF-NWDGAFQWSA-N 327.222 1.636 10 10 EDCE CO[C@H]1C[C@H](CO)N(c2cc(Br)c(CN)cc2F)C1 311647021 LUUDXKZSLONXEU-ZJUUUORDSA-N 333.201 1.633 10 10 EDCE C[C@@H](O)CN(CCNCc1cccc(O)c1O)C(=O)OC(C)(C)C 382722702 TYUSTJQRDCUTFB-GFCCVEGCSA-N 340.420 1.805 10 10 EDCE O=C(/C=C\c1ccco1)NCc1ccc(N2CCNC(=O)C2)cc1 97073394 NXEKCTXLECFJII-FPLPWBNLSA-N 325.368 1.545 10 10 EDCE Cc1c(/C=C\C(=O)N(C)c2cccc(S(C)(=O)=O)c2)cnn1C 254975932 VSQVHWZXDXGKKD-HJWRWDBZSA-N 333.413 1.808 10 10 EDCE OCc1ccc(N2CC3(CCOCC3)[C@H]2CO)cc1Br 2381116867 HDSQMQAUILXEPE-CQSZACIVSA-N 342.233 1.919 10 10 EDCE CCN1CC[C@@H](NC(=O)c2cc(C)n(-c3ccccn3)c2C)C1=O 802366941 MDBWTHBOQJZXEY-OAHLLOKOSA-N 326.400 1.840 10 10 EDCE COC(=O)C[C@H]1CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CCO1 392052774 KHDLQDILFKWISQ-JTQLQIEISA-N 340.332 1.380 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)NC[C@@H]2CCCCN2CCO)c1 834851115 UTIVUMHCFPOOSM-HIFRSBDPSA-N 336.432 1.676 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)cc1 841137163 FKOSXZFRSPZNQR-BZUAXINKSA-N 331.416 1.749 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCNC(=O)CC1 840478781 IOEAFMZARADJEK-CQSZACIVSA-N 332.448 1.524 10 10 EDCE CN(C)c1ccc(CNC(=O)Cn2nnc(-c3cscn3)n2)cc1 920392508 ZKDDSIHOVRHZMK-UHFFFAOYSA-N 343.416 1.179 10 10 EDCE O=C(NC[C@@]1(CO)CCc2ccccc21)c1c(F)ccc(O)c1O 846659300 LTQDLYJJXPTZAU-GOSISDBHSA-N 331.343 1.843 10 10 EDCE COC(=O)c1cnc(CNC(=O)N(C)Cc2ccccc2O)s1 924963527 KIDKFWGOMBLIRL-UHFFFAOYSA-N 335.385 1.977 10 10 EDCE CCOC(=O)[C@H]1[C@H]2CN(C(=O)/C=C/c3ccc(O)c(O)c3)CC[C@H]21 928118729 JCNDOTKLERDTKH-PMPWPTMUSA-N 331.368 1.769 10 10 EDCE CON(C)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 753616101 DZFWCKHWEHOWPK-UHFFFAOYSA-N 332.448 1.921 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)CC(C)(C)CO)C2)cc1 854298182 XURUDINXEGFCKV-AWEZNQCLSA-N 335.448 1.934 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@](F)(CO)C3)C2)cc1 854297267 LNNLULFUDCBBLI-CXAGYDPISA-N 337.395 1.390 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C3(OC)CCOCC3)C2)cc1 855226548 QNIDGFVDAJTSCT-CQSZACIVSA-N 334.416 1.586 10 10 EDCE COc1cccc(CNC[C@H]2CN(Cc3ccncc3)CCO2)c1O 858306964 XFGIGRIKXROMRR-KRWDZBQOSA-N 343.427 1.786 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@H]2COC[C@H]2C1 850602671 YIEFEXJGCLWYGU-JKSUJKDBSA-N 345.443 1.206 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)NCc2c(O)ccc3c2CCCC3)C[C@H]1C 866770376 WBVRHHLVBDUNAB-SSKCKEOISA-N 347.411 1.854 10 10 EDCE CO[C@@H](CS(=O)(=O)NCc1cc(C)ccc1O)[C@H]1CCOC1 1118821521 HLPFZEBGZSIKIX-WFASDCNBSA-N 329.418 1.172 10 10 EDCE Cc1cc(O)c(CNC[C@@]23COCCN2C(=O)OC3)cc1Cl 872261372 NVBFDHYKUMVNBQ-HNNXBMFYSA-N 326.780 1.665 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCO[C@@H](C(N)=O)C2)c1 781904007 DSPRTXHOXNGRDH-LLVKDONJSA-N 329.194 1.149 10 10 EDCE O=C(NCc1ccccc1O)C(=O)Nc1c[nH]nc1-c1ccccn1 782795613 JSKILLQYWINJRI-UHFFFAOYSA-N 337.339 1.432 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1895875689 MCNNCKSEOYEXHD-WDEREUQCSA-N 325.369 1.437 10 10 EDCE COC(=O)[C@]1(O)CCN(Cc2cc(Br)cc(C)c2O)C1 895703726 OGVRGKNKIJTMAF-AWEZNQCLSA-N 344.205 1.573 10 10 EDCE O=C(CN(C[C@@H]1CCCO1)C(=O)c1cccc(O)c1O)N1CCCC1 790901055 CVCKAVNPVNZHSR-ZDUSSCGKSA-N 348.399 1.341 10 10 EDCE C[C@]1(CO)CN(c2ccc(CN)cc2Br)C[C@]1(C)CO 704789163 QRZACWJZXXBZIZ-HUUCEWRRSA-N 343.265 1.725 10 10 EDCE CN(C[C@H](O)CNCCCF)C(=O)c1ccc(N=NC(N)=O)cc1 1332605160 HRKDTFUGLQKLLQ-CYBMUJFWSA-N 339.371 1.231 10 10 EDCE CCOC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 1964093425 WQXCATOLIASDDS-ZDUSSCGKSA-N 338.404 1.938 10 10 EDCE CN1CCN(c2ccc(CNC[C@H](O)[C@H]3CCCO3)cc2F)CC1 1331521533 QQLRGFJESVUZIX-ZWKOTPCHSA-N 337.439 1.207 10 10 EDCE CCn1cc(C(=O)NC[C@H](CO)NCc2ccc(OC)c(C)c2)cn1 1278053949 MHVPHKUDNDHITR-MRXNPFEDSA-N 346.431 1.101 10 10 EDCE CN(Cc1ccccc1O)C(=O)NC1C[C@@H]2CC[C@H](C1)S2(=O)=O 1350988177 RAPOUYNTMPEESU-AGUYFDCRSA-N 338.429 1.642 10 10 EDCE C[C@@H](NC[C@H]1CN=C(c2cnn(C)c2)O1)c1ccc(N(C)C)cc1 1354624804 AAHXNHOHUYPYQD-DYVFJYSZSA-N 327.432 1.982 10 10 EDCE Cc1nc(O)nc(O)c1CC(=O)NCc1c(O)ccc2c1CCCC2 1294870522 VPISNQARCPVHNT-UHFFFAOYSA-N 343.383 1.640 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)c3ccc(O)cc3)CC2)cc1 1294756395 WVZLXVCCIXYBPG-UHFFFAOYSA-N 340.379 1.932 10 10 EDCE C[C@H](CN(C)C(=O)c1cc2cc(O)c(O)cc2s1)c1nn[nH]n1 1466677411 JGZIGCZRQRSMIG-SSDOTTSWSA-N 333.373 1.701 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)CN1CCN(C)CC1 1627135259 ULZOAFODYSVKAH-CYBMUJFWSA-N 346.435 1.462 10 10 EDCE CC(=O)Nc1cccc(CC(=O)NCCc2ccc(O)c(O)c2)c1 1622753499 YNBNKJVRLATJQU-UHFFFAOYSA-N 328.368 1.958 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N1CCN(C)CC1 1628264778 GUBMSACCCVSPGM-LBPRGKRZSA-N 332.408 1.215 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@H](C)NC(=O)CC(C)C)cc1 1732986303 KAJYSUUHLZHTSB-ZDUSSCGKSA-N 346.435 1.311 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1C(=O)NCc1cc(O)ccc1O 1643885805 ZHVAUIKFXVAGOQ-GWCFXTLKSA-N 336.388 1.875 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccncc2)cc1C 1734356530 BXGQXTWFVGKXML-INIZCTEOSA-N 329.400 1.279 10 10 EDCE CN1CC[C@@H]2CN(CC(=O)NCc3ccc(N(C)C)cc3)C[C@@H]2C1 1659716974 ZQCYUWLGUBAYAD-SJORKVTESA-N 330.476 1.252 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC3(CC2)CNC(=O)O3)cc1 1652991949 PIPVTQWZQKBKOG-UHFFFAOYSA-N 331.332 1.564 10 10 EDCE Cn1nc(CNC(=O)OC(C)(C)C)cc1C(=O)NCCCN=[N+]=[N-] 1964880533 QSQXFCFNBAOHDZ-UHFFFAOYSA-N 337.384 1.875 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985099717 AWFFHYWPECTCTE-GMTAPVOTSA-N 327.385 1.419 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](CO)[C@H](NCc2ccc(N)cc2)C1 2005088540 JYSACSHFAFOBLY-GOEBONIOSA-N 335.448 1.976 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](OCC(N)=O)C2)cc1Br 2145374767 GVJAQKFIMKPNIJ-ONGXEEELSA-N 342.237 1.549 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(CNCc2ccc(O)c(O)c2)C1 1999835835 JLXJITAJKDQKFY-UHFFFAOYSA-N 338.404 1.606 10 10 EDCE C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)c1cc(O)c(O)c(O)c1 2015119349 ITQFNHGQPAGWGL-SECBINFHSA-N 340.376 1.837 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCC34COC4)c(Br)cc21 2171802113 ILFIYCNQUUWDAR-LBPRGKRZSA-N 338.205 1.641 10 10 EDCE CCNCc1ccc(N2CCC[C@@H]2[C@@H](O)CO)c(Br)c1 2179798992 MPNIIHZEYAZRPQ-CABCVRRESA-N 343.265 1.881 10 10 EDCE O=C(NC1[C@H]2CN(Cc3ccccc3)C[C@H]12)c1cc(O)c(O)c(O)c1 1148589954 RSUQQHHYHJBORL-KBPBESRZSA-N 340.379 1.664 10 10 EDCE C[C@@H]1COC[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)N1C(=O)OC(C)(C)C 1908252741 DTEUJVBKEJRUPM-IJLUTSLNSA-N 339.396 1.922 10 10 EDCE C[C@@H](O)c1ccc(N2CCCC2(CO)CO)cc1Br 2089867404 DBUCYVQPSOWZCJ-SNVBAGLBSA-N 330.222 1.826 10 10 EDCE CCc1ncnc(NC(=O)c2cc(O)nc(O)c2)c1Br 2238434308 HDDPEUFFWSNGFZ-UHFFFAOYSA-N 339.149 1.860 10 10 EDCE [N-]=[N+]=NS(=O)(=O)C[C@@H](NC(=O)OCc1ccccc1)C(=O)O 2241758530 WCECNGFRJWDJHJ-SECBINFHSA-N 328.306 1.006 10 10 EDCE CNC(=O)[C@H](C)CN(C)c1ccc(C=CC(=O)OC)cc1[N+](=O)[O-] 2297778678 HHQFZLMLFZSRPC-LLVKDONJSA-N 335.360 1.599 10 10 EDCE COc1ncc(/C=C\C(=O)N2CC[C@@H](C(N)=O)c3ccccc32)cn1 492684089 UDNBMEHVALHGLJ-LMVHVUTASA-N 338.367 1.504 10 10 EDCE CN(C(=O)CCN(CCO)C(=O)OC(C)(C)C)c1ccc(N)cc1 2303208375 UUKXEOYTEULOCL-UHFFFAOYSA-N 337.420 1.851 10 10 EDCE CC(C)[C@H](CNC(=O)C=Cc1ccc(O)c(O)c1)N1CCOCC1 2307982009 JQUTWPMCTPFWBX-HNNXBMFYSA-N 334.416 1.584 10 10 EDCE Cc1ccc(CN(C)CC(C)(CO)CO)c(O)c1Br 2352678255 GFRSQKQRIBDBQM-UHFFFAOYSA-N 332.238 1.886 10 10 EDCE C[C@H](NC(=O)N1CCNC(=O)CC1)c1ccc(N2CCOCC2)cc1 105194067 BVXAANPDUNQUCZ-AWEZNQCLSA-N 346.431 1.116 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@@H](NC(N)=O)C(C)C)cc1F 66931692 VBHKCACXJBDMEA-HNNXBMFYSA-N 338.427 1.981 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3[C@@H](C)COC[C@H]3C)CC2)cc1 77365668 WZEBKWYRFQNXEP-IYBDPMFKSA-N 347.459 1.453 10 10 EDCE CCS(=O)(=O)N1CC(CN[C@@H](C)c2ccc(N(C)C)cc2)C1 190683098 QLKPDLQDMOXUPF-ZDUSSCGKSA-N 325.478 1.685 10 10 EDCE Cc1cc(C(=O)NCCCO)c(C)n1-c1ccc2c(c1)OCCO2 97175983 LVBNFHGLCBQKKP-UHFFFAOYSA-N 330.384 1.978 10 10 EDCE C[C@H]1CN(c2ccc(CO)c(Br)c2)C2(CC2)C(=O)N1 2132026796 YUQLEDXAVRBXIP-VIFPVBQESA-N 325.206 1.799 10 10 EDCE COC[C@@H]1CN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])CCO1 266295971 XMJOQWLBQYLXQG-BPJJOFIESA-N 336.344 1.633 10 10 EDCE CC(=O)C(=O)COC(=O)CSc1nc(-c2ccc(C)cc2)n[nH]1 808527401 FQBOFNPFEFQJFP-UHFFFAOYSA-N 333.369 1.574 10 10 EDCE CC1(C)OC[C@@H]2C[C@@]21C(=O)NCc1ccc(N2CCOCC2)cc1 823291274 DWPWRNJGBVDEDM-KXBFYZLASA-N 330.428 1.955 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCN=C3C2=NNN3C)cc1 822608484 VVBBFHRCALXWQC-OAHLLOKOSA-N 342.447 1.373 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1cc(C[C@@H]2CCCNC2)nn1 900602851 CPLCXYVEIFAHIU-KRWDZBQOSA-N 341.459 1.705 10 10 EDCE O=C(COCc1cn[nH]c1)NCc1ccc(N2CCOCC2)c(F)c1 902588296 KUSBCNOHBUXPBK-UHFFFAOYSA-N 348.378 1.218 10 10 EDCE O=C(NC[C@@]1(O)[C@@H]2[C@@H]3[C@H]4[C@H]5C[C@@H]3[C@H]1[C@@H]5C[C@H]42)c1c(F)ccc(O)c1O 830689801 BTIJOYILVISPOP-NQFTVLRASA-N 345.370 1.476 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cn2c(n1)CCC2 843775143 OZZJTODIUYOQJT-UHFFFAOYSA-N 326.400 1.596 10 10 EDCE COc1ccc(N2CCCN(C[C@@H]3CC4(CNC4)CO3)CC2)cc1 923321313 CAZHYZXDDOHSIX-SFHVURJKSA-N 331.460 1.586 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cccc(C(N)=O)c3)C2)cc1 855232872 VKNJZLSFIGCSIY-HNNXBMFYSA-N 339.395 1.803 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)Cn3cncn3)C2)cc1 852061369 RMTIOQGBPWZDFQ-ZIAGYGMSSA-N 344.419 1.253 10 10 EDCE CO[C@@H](CS(=O)(=O)N1Cc2cccc(O)c2C1)[C@H]1CCOC1 867691208 RQLSZBOTQHGTDZ-WFASDCNBSA-N 327.402 1.089 10 10 EDCE O=C(C(=O)N1CCOCC2(CCC2)C1)N1Cc2cccc(O)c2C1 1118955497 NLVWHFGCJQVPIO-UHFFFAOYSA-N 330.384 1.264 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)C3=CC[C@@H](N)C3)cc2)CC1 876910186 VIKJUJZYXLXXIZ-QGZVFWFLSA-N 342.443 1.019 10 10 EDCE C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1cc(F)ccc1O 797121500 ZWJFMNOEQISJMW-WCQYABFASA-N 330.425 1.996 10 10 EDCE O=C(NCc1nc(C(F)(F)F)n[nH]1)NCc1c(O)cccc1F 1226901659 JCZDRQVTJXNQBW-UHFFFAOYSA-N 333.245 1.668 10 10 EDCE C[C@@H](CO)C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329497752 STURMTHVDFZXCO-LBPRGKRZSA-N 332.400 1.101 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1OCCO[C@@H]1c1ccccc1 1176755045 LFWHOBXPVNSEGW-IAGOWNOFSA-N 329.352 1.871 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)Cc2cc[nH]n2)cc1C 1283590589 FGOOZEDBVJNIJM-CQSZACIVSA-N 330.432 1.906 10 10 EDCE CCOCC(=O)N1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1294998777 OSSUMVIKQBDKIL-ZDUSSCGKSA-N 347.375 1.216 10 10 EDCE CCOCc1nnc(N(C)Cc2ccccc2O)n1CC(C)(C)O 1297061955 WGFHEKHOEMHUER-UHFFFAOYSA-N 334.420 1.928 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)CNC(=O)C1CC1 1704755243 RXBBXJUWFRWGKF-JTQLQIEISA-N 331.376 1.741 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2ncn(C)n2)cc1C 1700393983 HMLQREYRKGMOAE-QWHCGFSZSA-N 331.420 1.429 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(CN2CCOCC2)CC1 1544208237 IUPYZEHNOYFEGU-UHFFFAOYSA-N 334.416 1.211 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2ccnn2C)cc1C 1715787568 BSAFPVJFAXASRF-SNAWJCMRSA-N 328.416 1.813 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)c2c[nH]c(=O)cn2)cc1C 1714487367 SXSKYVDYUBCJQS-CYBMUJFWSA-N 344.415 1.385 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2cn(C)c(O)n2)cc1C 1482868535 VIZLLMNFYKDQHP-CYBMUJFWSA-N 346.431 1.741 10 10 EDCE CCCN1CCN(CCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1490516929 UNOKWTUVURZPLE-UHFFFAOYSA-N 346.435 1.606 10 10 EDCE C[C@H](NC(=O)c1ccnc(S(N)(=O)=O)c1)c1ccc(N(C)C)cc1 1638957732 VZSGPOSHOFMQJB-NSHDSACASA-N 348.428 1.286 10 10 EDCE CC(C)CNC[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1725765096 DUNVPTYJGYXTOH-CQSZACIVSA-N 335.408 1.528 10 10 EDCE CNC(=O)[C@H](C)N[C@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1734357111 OCCPSFHKBYSWDE-MNOVXSKESA-N 348.407 1.034 10 10 EDCE Cc1ncc(Br)c(C(=O)NCc2cccc(O)c2O)n1 1644711038 PHEJMBVNTBZUQJ-UHFFFAOYSA-N 338.161 1.889 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN[C@@H](c2ccc(F)cc2)C1 1644066374 CXYLYZBNOAIEMO-OAHLLOKOSA-N 330.359 1.953 10 10 EDCE CC(C)C(=O)NCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1747758455 UUKILKXZQGJRTK-UHFFFAOYSA-N 331.376 1.884 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(C(C)=O)CC2)c([N+](=O)[O-])c1 1772821451 VHJKQYURKVEEDI-XQRVVYSFSA-N 333.344 1.450 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)[C@H]2CCCNC2)c2nccn2C)cc1 1865975446 CUSCAFUPTVHGSE-RDJZCZTQSA-N 341.459 1.691 10 10 EDCE Nc1ccc(-n2nnc(C(=O)Nc3ccc(C(F)(F)F)cn3)n2)cc1 1857878756 LGBWOCOVXAMVIZ-UHFFFAOYSA-N 349.276 1.911 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)N1CCC[C@H](N=[N+]=[N-])C1 1912156004 MYXRBUIACCXPOI-ZETCQYMHSA-N 349.214 1.646 10 10 EDCE C[C@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)CCO1 221236446 JUVUEZDCKRLCBM-JVXZTZIISA-N 326.194 1.626 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)C[C@@H]2CO)c(Br)c1 2136087378 DHPXBKGOIBVMNE-WCQGTBRESA-N 329.238 1.791 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1CNC(=O)O1 1951992693 IZKLRBXUBXIRFW-GWCFXTLKSA-N 338.360 1.642 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCN=[N+]=[N-])[C@H]2CS(=O)(=O)C[C@@H]21 1982246001 OWSOOYZFEUHNMA-QWRGUYRKSA-N 345.425 1.015 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985094205 LGWWJLVKOBCCQK-NSHDSACASA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])COC1 1985102853 MRVOOAFRXNQESL-SNVBAGLBSA-N 325.369 1.581 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)CO1 2003168081 DZNMVFMNEWIERZ-ZDEQEGDKSA-N 340.420 1.182 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003172919 RMIPGOWKVFIFKJ-BYNQJWBRSA-N 340.420 1.134 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)c1cc(=NC(=O)OC(C)(C)C)[nH]n1C 2010403976 MOVDZPKHQWDCNH-UHFFFAOYSA-N 337.384 1.961 10 10 EDCE Nc1ccc(N2C(=O)[C@@H]3[C@H]4CC[C@H](O4)[C@@H]3C2=O)cc1Br 2153256002 PHLPXCSTTIBHMQ-BKUVIOGVSA-N 337.173 1.698 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](CO)[C@H](CO)C2)cc1Br 704783489 LAFMLTALUOKZEH-WOPDTQHZSA-N 343.265 1.767 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCOC[C@H]3CF)c(Br)cc21 2182607170 XMRURYNWKQEEAW-JMCQJSRRSA-N 344.184 1.576 10 10 EDCE CCNCc1ccc(N2CC[C@](C)(O)[C@H](O)C2)cc1Br 2197957259 ABIXFVKQVRHIBP-CABCVRRESA-N 343.265 1.881 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(S(C)(=O)=O)C2)cc1Br 2095965164 SJXAXILQQWJJSO-VIFPVBQESA-N 347.278 1.963 10 10 EDCE CNCc1ccc(N2CCOC[C@@H](CO)C2)c(Br)c1 2098207653 NLPGFXVECJZKQD-GFCCVEGCSA-N 329.238 1.614 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2199527166 OMMZMMCTXLEQQK-AISOMTMTSA-N 341.249 1.789 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213590571 BJUFZSPSXFJRSM-RYUDHWBXSA-N 340.428 1.791 10 10 EDCE CC(C)(C)OC(=O)N(CCOc1nnc(=N)[nH]n1)c1ccccc1 2213778112 CEORODJBFXTKPQ-UHFFFAOYSA-N 332.364 1.500 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@@H](C(=O)O)C2)c1O 2236035838 BMPSTZBATJLZSF-LLVKDONJSA-N 346.177 1.449 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2csc(CN)c2)s1 2269279812 LHSUMYOLVSIFTD-UHFFFAOYSA-N 335.501 1.864 10 10 EDCE COC(=O)N[C@@H](C)CNCc1c(Br)ccc(OC)c1O 2290401312 KIDJOWDNIKPQLA-QMMMGPOBSA-N 347.209 1.997 10 10 EDCE Cc1ccc(C=C2SC(=S)N(CC(=O)NCCCO)C2=O)o1 2294871892 DKSDDFDJKIKCJD-UHFFFAOYSA-N 340.426 1.288 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@H](O)CCN1C(=O)OC(C)(C)C 2300526394 RXMGSIDPHAWXPD-VXGBXAGGSA-N 341.412 1.906 10 10 EDCE COCCN1[C@@H](C)CN(C(=O)C=Cc2ccc(O)c(O)c2)C[C@@H]1C 2308005719 BJQPOOMQPXHRLF-KBPBESRZSA-N 334.416 1.679 10 10 EDCE Cc1ccc(CN(CCN)CCN(C)C)c(O)c1Br 2352680992 STFKROQESSQWDJ-UHFFFAOYSA-N 330.270 1.785 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2355336010 KCBSCCLWQDNUQP-FWYKCERLSA-N 341.249 1.789 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@@H]3CCC[C@@H]3O)CC2)cc1 172578428 RRQUJPNMWFKMBP-SJORKVTESA-N 333.432 1.877 10 10 EDCE NS(=O)(=O)c1cccc(CNCc2cc(Cl)ccc2O)c1 37649926 KTVPQSVBWOLYGW-UHFFFAOYSA-N 326.805 1.983 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(S(C)(=O)=O)[C@@H](C)C2)c1O 181929235 JQMBIIPYRHMCQR-NSHDSACASA-N 332.853 1.820 10 10 EDCE Cn1cc(CCNC(=O)NCc2ccc(N3CC=CC3)cc2)cn1 125954840 CYASYCXIFUEJTK-UHFFFAOYSA-N 325.416 1.838 10 10 EDCE C[C@H](NCCS(=O)(=O)N1CCSCC1)c1cc(F)ccc1O 185395390 JFLIKVJPUXTENX-NSHDSACASA-N 348.465 1.561 10 10 EDCE CC(C)[C@@H](CO)N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2367092364 LJTQUPHZEMCOAR-OLZOCXBDSA-N 342.237 1.854 10 10 EDCE CN1C2(CCC2)COC[C@@]1(CO)CNCc1ccc2c(c1)CCO2 527753640 MISWNMKXTXRGGR-IBGZPJMESA-N 332.444 1.327 10 10 EDCE Cn1nccc1CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 278647242 QYVQZELIMQDNMC-UHFFFAOYSA-N 346.406 1.379 10 10 EDCE Cc1ccc(CN2C(=O)CNC(=O)C[C@@H]2C)c(O)c1Br 2381139909 CLWTWZNDMDWERR-VIFPVBQESA-N 341.205 1.700 10 10 EDCE CC(=O)NCCNC(=O)NCc1cc(Br)ccc1O 804858707 FCEXJQSNHWJDMJ-UHFFFAOYSA-N 330.182 1.090 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@@]23[C@@H]4[C@H]5C(=O)[C@H]2[C@@H]2[C@@H]5C[C@@H]4[C@@H]23)c1 800519998 YKGZHIQMSRCRSS-CJHYQQOXSA-N 325.364 1.344 10 10 EDCE Cc1ccc([C@H](C)NC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c(O)c1 715550978 RHVJDUXJDCUXSQ-LBPRGKRZSA-N 349.431 1.826 10 10 EDCE COC[C@@H](NCc1cc(OC)c(OC)cc1O)C1CCOCC1 826872537 OCWIJNCLADQQLA-CQSZACIVSA-N 325.405 1.941 10 10 EDCE N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 830663935 DWHDBQOHLKUZEK-LEWSCRJBSA-N 325.359 1.720 10 10 EDCE O=C1N[C@@]2(C(=O)NCc3ccc(N4CCCC4)cc3)C[C@H]3C[C@H]1[C@H]2C3 845192739 QCUAQZCNCHEVBH-REGYPHIPSA-N 339.439 1.818 10 10 EDCE COC(=O)CNC(=O)[C@H]1CCCN1Cc1c(O)cc(C)cc1Cl 841892363 HFHWVFWFQFTOOE-CYBMUJFWSA-N 340.807 1.608 10 10 EDCE Nc1ccc(CCNC(=O)N2CCC[C@H](C(=O)N3CCCC3)C2)cc1 841953649 BDWCNTMKNFTTDX-INIZCTEOSA-N 344.459 1.855 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnc(OC)nc3)C2)cc1 855232293 SNINFWURJBSYMR-CYBMUJFWSA-N 328.372 1.503 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCCN(C)CC3)C2)cc1 854303564 YAUYHLSIXNVVQN-HNNXBMFYSA-N 332.448 1.621 10 10 EDCE C[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccnn1C 856209583 TUHLFIZWWQBKHM-CQSZACIVSA-N 342.443 1.801 10 10 EDCE CC(=O)N1CCO[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 930206248 UEOXDUKOVDZNFD-KRWDZBQOSA-N 331.416 1.150 10 10 EDCE CC1(C)C(=O)NC(=O)N1CC(=O)NCc1c(O)ccc2c1CCCC2 769563842 MRBKODPUVRTZDF-UHFFFAOYSA-N 345.399 1.218 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCCCS1(=O)=O 862027605 YPWHEPZTPYMDAA-CYBMUJFWSA-N 334.397 1.524 10 10 EDCE Cc1nc2cc(O)nn2c(C)c1CC(=O)N1Cc2cccc(O)c2C1 871202437 HHWZGZFGJQNUDD-UHFFFAOYSA-N 338.367 1.842 10 10 EDCE CCN(C)c1ccc(CN2CCN(Cc3n[nH]c(C)n3)CC2)cc1 773783469 CVXAUUGCRQNGSP-UHFFFAOYSA-N 328.464 1.887 10 10 EDCE Cc1ccc(C(=O)N[C@@H](C)[C@H](O)c2ccc3c(c2)OCO3)c(O)c1O 787725901 CGFHRZURYPOHGG-QFYYESIMSA-N 345.351 1.987 10 10 EDCE CNC(=O)C[C@@H](C)NCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894918524 WMBXPVWYNLAZIJ-SNVBAGLBSA-N 335.379 1.718 10 10 EDCE COc1cccc(O)c1CNC[C@@]1(O)[C@@H]2[C@@H]3[C@H]4[C@H]5C[C@@H]3[C@H]1[C@@H]5C[C@H]42 785543272 GRAATZROPDVWDZ-MITLLEGOSA-N 327.424 1.999 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC3(C)CC3)C2)cc1 1328408368 RQWKNEQTBJRJRI-ZDUSSCGKSA-N 331.416 1.306 10 10 EDCE O=C(O)[C@@H]1OCC[C@@H]1CNCc1cc(Br)cc(F)c1O 715786492 GBOAMRTVJLRRMT-JMCQJSRRSA-N 348.168 1.873 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)Cn2cncn2)cc1C 1275564319 YRTZYMPNQHUKOA-ZIAGYGMSSA-N 331.420 1.278 10 10 EDCE CN(CCNC(=O)C(C)(F)F)C(=O)c1ccc(N=NC(N)=O)cc1 1284491250 QFPUUARAIBHKOR-UHFFFAOYSA-N 341.318 1.692 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CCNS(C)(=O)=O 1440711268 AFGHPJXXDYNFAE-UHFFFAOYSA-N 339.461 1.185 10 10 EDCE CCCNCc1ccc(N2CC(O)(CO)C2)c(Br)c1 2115303192 KTDOUNXNCGRRJM-UHFFFAOYSA-N 329.238 1.492 10 10 EDCE CCCCN(C(=O)Cc1ccc(O)c(O)c1)[C@H]1CCS(=O)(=O)C1 1464386876 QYJAYUMHANJFJI-ZDUSSCGKSA-N 341.429 1.456 10 10 EDCE COc1ccc2c(c1)OC[C@@H](NC(=O)Cc1ccc(O)c(O)c1)C2 1466650278 OYMDXCAVXGGLKI-ZDUSSCGKSA-N 329.352 1.769 10 10 EDCE CN(C(=O)[C@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1)C1CC1 1540496524 XISVEJHBCMYMRI-GFCCVEGCSA-N 336.413 1.163 10 10 EDCE Oc1cc(Br)ccc1CN[C@@]12CC[C@@H](C1)[C@H](O)[C@H]2O 2120394914 OWVYKKAKHPDPCS-IOEYQFCTSA-N 328.206 1.519 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1cc(S(C)(=O)=O)ccc1N 1629954902 JKTVXYGWDLLCTA-UHFFFAOYSA-N 334.397 1.650 10 10 EDCE COCCN[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1C 1717293877 VOKGGFXBZJTUQN-RISCZKNCSA-N 333.392 1.546 10 10 EDCE CC1=C(C(=O)NCc2cc(O)ccc2O)[C@@H](C)n2ncnc2N1C 1651225330 FXNSBLRNNICVKG-SNVBAGLBSA-N 329.360 1.291 10 10 EDCE COc1ccc(CNCCN(C)C(=O)COc2cc(C)on2)cc1C 1691352009 LETGUNJAUAYCBL-UHFFFAOYSA-N 347.415 1.927 10 10 EDCE 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1.623 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CNCc2ccc3c(c2)CCO3)C1 702847700 VFTBTKDPOJBKNN-CVEARBPZSA-N 348.443 1.939 10 10 EDCE NCc1ccc(N2C[C@@H](O)C3(CCOCC3)C2)c(Br)c1 2174367225 ZGGDBTFPXWWFJX-CQSZACIVSA-N 341.249 1.886 10 10 EDCE CC(C)(C)OC(=O)N1Cc2[nH]cnc2C[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 2060616406 AFTFSTZQJDXAJF-GFCCVEGCSA-N 347.379 1.593 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@@H](N(C)C)C2)cc1Br 2089922011 FRWUMZXKVMXWMG-KBPBESRZSA-N 328.254 1.280 10 10 EDCE COCCNCc1ccc(N2CC[C@@H]2CO)cc1Br 2092549180 RZXCVMBRFPIROQ-CYBMUJFWSA-N 329.238 1.756 10 10 EDCE O=C(O)CN1CC(NCc2cc(Cl)cc(Br)c2O)C1 2113028186 WPBKXKKIOQDCGZ-UHFFFAOYSA-N 349.612 1.667 10 10 EDCE O=C1Nc2cc(N3CC[C@H]4[C@@H](O)C[C@H]43)c(Br)cc2[C@@H]1O 2355697859 ZTVNEUXDISRCRO-VEKGRWIFSA-N 339.189 1.394 10 10 EDCE CN(Cc1cc(Br)ccc1O)[C@H]1COC[C@H]1C(=O)O 300438114 QVTMPUAMZIGONX-MNOVXSKESA-N 330.178 1.686 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@@H]4COC[C@H]43)c(Br)cc21 2357548352 XDCYMMBYZNJXOH-KEMBBXRSSA-N 338.205 1.626 10 10 EDCE C[C@H]1CN(c2ccc(CN)cc2Br)C[C@H](C)S1(=O)=O 400845130 NHJSVKSVPDBEDM-UWVGGRQHSA-N 347.278 1.920 10 10 EDCE N[C@H](c1cc(I)ccc1O)C(F)(F)CO 95769550 ZCMDFVQVPZAOHK-MRVPVSSYSA-N 329.084 1.624 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cnc(O)n(C)c1=O 267723223 VPPZBYQMWFUSIE-UHFFFAOYSA-N 330.388 1.214 10 10 EDCE O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NCc1ccccc1O 269125122 GXBDKTLJALJWJN-IVMMDQJWSA-N 349.456 1.734 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCS3)CC2)cc1 266419512 FFGHNKROZPKPIV-QGZVFWFLSA-N 349.500 1.829 10 10 EDCE CC[C@H](C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1)C(=O)OC 819586955 BWMLDDVSWDZNST-CZUORRHYSA-N 334.416 1.837 10 10 EDCE CNC(=O)[C@H]1COCCN1c1ccc([C@H](C)N)c(Br)c1 723181881 RUGAQECICJUCBU-TVQRCGJNSA-N 342.237 1.420 10 10 EDCE C[C@H]1CC[C@@H](NC(=O)NCc2cc(Cl)ccc2O)CS1(=O)=O 821968523 GYAQXBGDAXANSE-JOYOIKCWSA-N 346.836 1.811 10 10 EDCE C/C(=C/C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)CN1CCOCC1 907271635 BQLNKHBQXXMXKQ-XXYUJHKVSA-N 334.416 1.424 10 10 EDCE CCOC(=O)c1cnc(NC(=O)NCc2ccc(N(C)C)cc2)n1C 841713798 NHAFARPXACBKKB-UHFFFAOYSA-N 345.403 1.985 10 10 EDCE COC(=O)[C@@H]1CSCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 840185945 JIHOWJVRXCOPSP-FZMZJTMJSA-N 339.413 1.156 10 10 EDCE CCN(OC)C(=O)CNCc1cc(Br)cc(C)c1O 843431260 YQHUGFGAHJGYAN-UHFFFAOYSA-N 331.210 1.963 10 10 EDCE C[C@H](NCC[C@H]1CNC(=O)C1)c1ccc(N2CCOCC2)c(F)c1 926988135 QJXOYGUHPRWBGP-UONOGXRCSA-N 335.423 1.839 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCCS(=O)(=O)C[C@H]2C)c1O 933318353 WENBYMGBIJHCHK-SNVBAGLBSA-N 329.393 1.743 10 10 EDCE CC[C@@H](CO)N1CCN(Cc2ccc(N3CCN(C)CC3)cc2)CC1 775723541 BFYCNLRTDNPPBN-IBGZPJMESA-N 346.519 1.327 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN2CC)cc1 897489078 SOOZUAOWPLPQDN-QGZVFWFLSA-N 346.475 1.359 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)C[C@@H]1C(=O)NCCCN=[N+]=[N-] 1895875366 ISURTEZTFHSSSE-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE NCc1nccnc1NCc1ccc(N2CCC(O)CC2)c(F)c1 1337789220 CQLNSQWHHDYTAZ-UHFFFAOYSA-N 331.395 1.648 10 10 EDCE Cc1cc(C(=O)NCc2cccc(O)c2O)c2c(C)nn(C)c2n1 1153793175 YVWULFNEOPXGFT-UHFFFAOYSA-N 326.356 1.926 10 10 EDCE CCS(=O)(=O)c1ccccc1CC(=O)NCc1c(O)cccc1O 1156885548 JFAGDBNNAFIFSD-UHFFFAOYSA-N 349.408 1.750 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(O)CCO[C@H]1C 1306079653 CUCUEPAWXGNJCN-SCLBCKFNSA-N 346.431 1.722 10 10 EDCE CC(C)CNC(=O)COc1cccn(Cc2ccc(N)cc2)c1=O 57874910 WCTNNSGHSAIGBU-UHFFFAOYSA-N 329.400 1.630 10 10 EDCE CN(C)c1ccc(/C=C/CN[C@H](Cc2ccncn2)C(=O)O)cc1 1334842749 ZRHYPLLIUBBGRE-REMYHPOOSA-N 326.400 1.841 10 10 EDCE Cc1nnc(N2C[C@@H]3OCO[C@@H]3C2)n1Cc1ccc(N(C)C)c(F)c1 1511912776 NEEIKZOECFCSKF-IYBDPMFKSA-N 347.394 1.401 10 10 EDCE CCOC(=O)[C@@H]1C[C@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 1445734301 KXWOQAGHFZJPDS-HZPDHXFCSA-N 332.400 1.543 10 10 EDCE O=C(NCC1CC1)[C@@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1440726462 XZMDBZGVQLHGFE-LBPRGKRZSA-N 336.413 1.068 10 10 EDCE O=C(CCN1C(=O)CSC1=S)Oc1cc(F)ccc1[N+](=O)[O-] 1865774700 XLNPKPDSSDIPOM-UHFFFAOYSA-N 344.345 1.890 10 10 EDCE CC(C)[C@H](C)C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1292893729 BNOQLMASOYDTFP-NSHDSACASA-N 333.392 1.987 10 10 EDCE C[C@@H](NC(=O)CC[C@H]1CC[C@@H](C(N)=O)O1)c1ccc(N(C)C)cc1 1537680396 WMQAASXRKGRZHI-WQVCFCJDSA-N 333.432 1.743 10 10 EDCE CN(CCCO)[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1713400765 KYBYEGHRZYQDRL-HNNXBMFYSA-N 347.419 1.768 10 10 EDCE C[C@H](CNC[C@@H]1CCOC1)CNC(=O)c1ccc(N=NC(N)=O)cc1 1715271123 GZRSVQHBJBPUSD-OLZOCXBDSA-N 347.419 1.841 10 10 EDCE CNS(=O)(=O)c1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1 1632703324 HKCJFPXTEAYVMA-UHFFFAOYSA-N 332.381 1.456 10 10 EDCE Cc1onc(CO)c1C(=O)NCc1cccc(Br)c1O 1640084271 PTKLNZLWPLHGMX-UHFFFAOYSA-N 341.161 1.873 10 10 EDCE O=C(CNC(=O)c1cc(F)cc(F)c1)NCc1c(O)cccc1O 1597574159 IXVLYUVWRBGJKJ-UHFFFAOYSA-N 336.294 1.422 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cnc(O)n2C)cc1C 1690610988 YGQSCRAXOQOZOO-GFCCVEGCSA-N 332.404 1.351 10 10 EDCE Nc1ccc(Cc2ccc(NC(=O)[C@@H](N)CCC(=O)O)cc2)cc1 1866015980 FSRFYKMJNQOWSJ-INIZCTEOSA-N 327.384 1.990 10 10 EDCE [N-]=[N+]=N[C@H]1CCCN(C[C@H](O)CN2C(=O)c3ccccc3C2=O)C1 1912190522 FFWBMHGZYZFAQK-RYUDHWBXSA-N 329.360 1.418 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H]([C@@H](N)Cc2ccc(O)c(O)c2)C1 1952914705 UUBROPPLTFFHTE-WFASDCNBSA-N 338.404 1.604 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1COCCN(C(=O)OC(C)(C)C)C1 1985096115 NFYHJNYKZWKTQD-LLVKDONJSA-N 327.385 1.639 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCCCN=[N+]=[N-])C(C)(C)O 1987682397 VFWVAZJAKOZVTK-JTQLQIEISA-N 329.401 1.857 10 10 EDCE O=C(O)C[C@@H](COCc1ccccc1)NC(=O)c1ccc(O)c(O)c1 2035481577 MNKUNROBWRMUJE-AWEZNQCLSA-N 345.351 1.888 10 10 EDCE NCc1ccc(N2CCC[C@H]3C(=O)NC[C@H]32)c(F)c1Br 300427431 ICKGEHLAHQOXHT-MWLCHTKSSA-N 342.212 1.762 10 10 EDCE CNCc1ccc(N2C3COCC2COC3)cc1Br 399769428 LKUGYHHTRDKIBV-UHFFFAOYSA-N 327.222 1.773 10 10 EDCE CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)c4cnn5c(O)cc(C)nc45)[C@H]1[C@H]3C2 2063047560 STTCVLRBCDZESQ-NCSKVMEWSA-N 328.372 1.239 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC=C[C@@H](O)C3)c(Br)cc21 2165067363 FZGXGWGVBOXVKV-OQPBUACISA-N 338.205 1.399 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2CCN(C)c3ccccc32)c1 254943159 WLSLKRZKIXRADI-FPLPWBNLSA-N 336.395 1.937 10 10 EDCE O[C@H]1CCN(c2ccc(CN=c3[nH]ncn3-c3cccnc3)cc2)C1 2080430137 RTBMYUFTLKPLNV-KRWDZBQOSA-N 336.399 1.267 10 10 EDCE CO[C@@H]1C[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)N(C(=O)OC(C)(C)C)C1 1906905797 FZUSDZVWTDMOCA-LPWJVIDDSA-N 340.420 1.276 10 10 EDCE CC(C)(C)OC(=O)N1CC(N(Cc2cc(N)ccc2O)C2COC2)C1 2044652573 LOORJFGQRKQPOT-UHFFFAOYSA-N 349.431 1.795 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)cc1Br 2190452453 DWQRSCAAJRNHQH-MGXFYRGHSA-N 342.233 1.965 10 10 EDCE COCC[S@](=O)CCNCc1ccc(Br)cc1O 2085943525 ATTFQAQLXGAXIW-GOSISDBHSA-N 336.251 1.639 10 10 EDCE COc1ccc(N2CCC[C@H]2[C@@H](O)CO)c(OC)c1Br 2234900146 RTHHNWAMRWUQKV-ONGXEEELSA-N 346.221 1.788 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@H](O)CC2)c(Br)c1 2269136885 CNERMTRAVIINOH-QCZZGDTMSA-N 329.238 1.791 10 10 EDCE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=CNc1ccc(O)cc1 2297620288 WEEPMNUFPVMWRC-UHFFFAOYSA-N 327.296 1.560 10 10 EDCE Cc1ccc(CNS(=O)(=O)[C@H](C)CO)c(O)c1Br 2327788630 FTAXIWZGOXVICA-MRVPVSSYSA-N 338.223 1.263 10 10 EDCE O=C(NCC(F)(F)CO)c1cccc2c1C(=O)c1ccccc1C2=O 183854691 XVIUMQYUHDHZTK-UHFFFAOYSA-N 345.301 1.819 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CC(=O)N(CC(F)(F)F)C1 180801010 MQHHMQBZVJDPEL-XCRNYIDWSA-N 344.289 1.390 10 10 EDCE O=C1CCCC[C@@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)N1 194394213 FWPMBGCHUSRFFW-HOTGVXAUSA-N 346.427 1.959 10 10 EDCE O=C(N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cccc(O)c1O 364666789 RWFHUQIXJURXMH-AWEZNQCLSA-N 344.342 1.768 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CC[C@@H](NC(N)=O)C3)ccc21 270787163 UYIBTNOLBZLKOY-CQSZACIVSA-N 331.420 1.021 10 10 EDCE Cc1ccc(CNC(=O)c2c(N)cnn2C)c(O)c1Br 2381131747 RTAOOUQMRUVQGV-UHFFFAOYSA-N 339.193 1.709 10 10 EDCE Cc1ccc(CN2C(=O)[C@@H](C)NC(=O)[C@H]2C)c(O)c1Br 2381140093 FPTSRXAFRGSQDN-RKDXNWHRSA-N 341.205 1.699 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3C[C@@H]4C[C@@]4(CO)C3)C2)cc1 824685509 FTAOJUSVDJEYGV-VCBZYWHSSA-N 345.443 1.545 10 10 EDCE Cn1cnc(CCCNC(=O)NCCCSc2nccs2)n1 826693074 QSZMHJRIEYGBKC-UHFFFAOYSA-N 340.478 1.686 10 10 EDCE CCO[C@H](CNC(=O)NCc1ccc(N2CC=CC2)cc1)CN(C)C 919918618 PCVIFOIOVGXRHD-GOSISDBHSA-N 346.475 1.829 10 10 EDCE COCC[C@@H](C)S(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849415668 DLRPCYJCMDARGO-ZIAGYGMSSA-N 342.461 1.618 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC(c3nc(O)n[nH]3)CC2)cc1 843306769 XVZKXNCVYLJDHZ-UHFFFAOYSA-N 344.419 1.666 10 10 EDCE CC(C)[C@H](NC(=O)c1ccccn1)C(=O)NCCc1ccc(N)cc1 844164386 DPNNDSAFVRSUCX-KRWDZBQOSA-N 340.427 1.777 10 10 EDCE COC(=O)c1cc(O)c(F)cc1NS(=O)(=O)C[C@H](OC)C1CC1 842586958 SFAVCUJHKNIWDN-ZDUSSCGKSA-N 347.364 1.485 10 10 EDCE COc1ccc(N2CCN(C(=O)CCc3cn(C)nn3)CC2)cc1 854197956 AOGPHUXFYAPARM-UHFFFAOYSA-N 329.404 1.105 10 10 EDCE C[C@@H]1[C@H](C(F)(F)F)OCCN1Cc1cc2c(cc1O)OC[C@H]2O 853571473 CFCMUTKPXGHFPN-IHPUGEDLSA-N 333.306 1.970 10 10 EDCE COc1ccc(N2CC[C@@H](Nc3nnc(Cl)cc3C(N)=O)C2)cc1 853758931 NJRYSKGFWJEPCQ-SNVBAGLBSA-N 347.806 1.928 10 10 EDCE 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O=C(Cn1nc2n(c1=O)CCCCC2)N1Cc2cccc(O)c2C1 1329668655 XHDDUENREYLEEO-UHFFFAOYSA-N 328.372 1.019 10 10 EDCE CCN(CCS(C)(=O)=O)c1ccc(CO)c(Br)c1 688493079 MHNUMUXHURMCLC-UHFFFAOYSA-N 336.251 1.812 10 10 EDCE CC[C@@H](N[C@H]1CC(=O)N(C)C1=O)c1cc(Br)ccc1O 88774590 MEBXEQNKIIPJJY-MNOVXSKESA-N 341.205 1.953 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H](C(C)(C)C)[C@H](O)C1 1261312797 DTYOQHNYSOODAU-GDBMZVCRSA-N 348.443 1.606 10 10 EDCE CSc1ncc(CN=c2[nH]c(Br)cc(=N)[nH]2)s1 2248601562 OVJULRFVZTYYBT-UHFFFAOYSA-N 332.252 1.864 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@H]2CCCCN2C)cc1C 1507200316 FMMZZDAORLZFEE-IAGOWNOFSA-N 349.475 1.055 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)/C=C/c2ccc[nH]2)cc1C 1272405732 AELFGXLFASBMDQ-JKNJVXJCSA-N 343.427 1.612 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)CCC3CC3)C2)cc(OC)n1 1353744652 RVHZJIPEPCJNGL-OKILXGFUSA-N 347.415 1.666 10 10 EDCE C[S@@](=O)Cc1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1 1449217255 RYPTVALAIOTNNL-HSZRJFAPSA-N 333.409 1.835 10 10 EDCE CC(=O)N(C)[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1287494994 JTUGTECDOGAXLU-AWEZNQCLSA-N 331.376 1.836 10 10 EDCE C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Cc1ccc(O)c(O)c1 1467559548 ORRWOUVGBCAKRM-CYBMUJFWSA-N 334.416 1.352 10 10 EDCE O=C(CNC(=O)NCc1ccc(F)cc1)NCc1c(O)cccc1F 1471974406 CCBZANLKNPFUNN-UHFFFAOYSA-N 349.337 1.786 10 10 EDCE CN1C(=O)O[C@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]21 2120399402 FMCATPGRESTREV-JQWIXIFHSA-N 327.178 1.790 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2nn(C)cc2C)cc1C 1715927177 DTFKHZFKPLEVCO-CQSZACIVSA-N 330.432 1.954 10 10 EDCE O=C(Cc1ccc(-n2cnnc2)cc1)NCCc1ccc(O)c(O)c1 1630334618 CYJCYLSNVUHVAW-UHFFFAOYSA-N 338.367 1.580 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cn(C)cn3)CC2)cc1C 1569396998 YWRSPZFHSWZCRA-UHFFFAOYSA-N 328.416 1.789 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CCN(C)C3)CC2)cc1C 1499448535 MJFLRPZMYPJXLU-INIZCTEOSA-N 331.460 1.694 10 10 EDCE CN(CCNCc1ccon1)C(=O)c1ccc(N=NC(N)=O)cc1 1493808833 BWNXTTXZWIDVBI-UHFFFAOYSA-N 330.348 1.699 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc3cncn3c2)c1 1645632020 INEMBALIWGICOH-UHFFFAOYSA-N 346.368 1.664 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)[C@@H]2CC2(C)C)cc(OC)n1 1572248931 FECGUNJWUGOOEQ-AAEUAGOBSA-N 349.431 1.722 10 10 EDCE COCCC(=O)N[C@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1572269713 MHBYKTPQBVFCKG-LLVKDONJSA-N 349.391 1.462 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCO[C@@H]([C@@H]3CCCO3)C2)cc1 1595938206 RBDQXQGKQZESOS-UONOGXRCSA-N 332.360 1.869 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CNCc2c(O)cccc2F)C1 1964590973 ZQQFKEJREHMTMX-KRWDZBQOSA-N 340.395 1.993 10 10 EDCE Cc1cc(=O)c(OCC(=O)c2ccc(O)c(O)c2)cn1[C@H](C)C(=O)O 1857914518 IFCLUPHLXTXLJM-SNVBAGLBSA-N 347.323 1.475 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)c(Br)c1 2133921768 YQTNHBUFHIPRRS-NZPIUUIZSA-N 327.222 1.371 10 10 EDCE CN(C[C@@H](N)COCc1ccccc1)C(=O)c1cccc(O)c1O 1916339822 KYRGGNNMFXCCQL-CQSZACIVSA-N 330.384 1.714 10 10 EDCE COCCNCc1ccc(N(C)CC(N)=O)cc1Br 234647226 JXBBSASHJISNRC-UHFFFAOYSA-N 330.226 1.107 10 10 EDCE CNC(=O)CN(Cc1ccccc1)S(=O)(=O)Cc1ccc(N)cc1 1946873980 XOBYSYHHHVINOC-UHFFFAOYSA-N 347.440 1.347 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(Cc1ccc(O)c(O)c1O)C(=O)O 1951871249 YOLWDOWTIDLXMY-HNNXBMFYSA-N 327.333 1.714 10 10 EDCE Oc1c(Br)cccc1CN[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@H]2O 1974158977 WFTXMCCOTOYPFO-JPPCMQRSSA-N 328.206 1.375 10 10 EDCE C[C@@H](CNC(=O)OC(C)(C)C)[C@H](F)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980369246 IWRVZOJCOMVVNC-ZPFDUUQYSA-N 330.400 1.751 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1986368581 HFOPHHXEYPDBCD-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CCCN(CCN=[N+]=[N-])C1 2006175202 NMVNCPTUBCSOTO-GFCCVEGCSA-N 340.428 1.650 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@@H](O)[C@H](CO)C2)c(Br)c1 316500845 YYWFUGZHCMJEIO-IFUGULHKSA-N 343.265 1.909 10 10 EDCE NCc1ccc(N2CCC[C@@H](NC(N)=O)C2)c(Br)c1 702150522 PZXQWDLZUVOCTH-SNVBAGLBSA-N 327.226 1.545 10 10 EDCE Cc1ccc(Br)c(CNC(=O)c2cc(O)nc(O)c2)n1 2169023554 IXGNUHOYRVFUPU-UHFFFAOYSA-N 338.161 1.889 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)cc1Br 2182553212 KPPRLZPSHLZPNP-TUWBQHJRSA-N 341.249 1.647 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)O1 1908254752 UWZKBIBNBGNWHX-SDDRHHMPSA-N 339.396 1.970 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2104423959 MELQUKUGBSFLIO-CDNYRADESA-N 327.222 1.399 10 10 EDCE CCN(Cc1c(O)cccc1Br)[C@@H]1CC(=O)NC1=O 2114733354 VZCMDSTXPFVGNU-SNVBAGLBSA-N 327.178 1.392 10 10 EDCE C[C@H](N)c1ccc(N2CCN(C)C[C@@H]2CCO)c(Br)c1 2202830089 JHCBJIIPTFJGES-AAEUAGOBSA-N 342.281 1.972 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(COc1nnc(=N)[nH]n1)c1ccccc1 2219017953 AIPQVUCHEMUHMI-INIZCTEOSA-N 346.391 1.498 10 10 EDCE NCc1ccc(N2C[C@@H]3COC[C@@]3(CO)C2)c(F)c1Br 2234560170 UQKLSJAYBMBSOX-YGRLFVJLSA-N 345.212 1.492 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2C[C@H](O)C[C@@H]2O)c1O 2227748445 AJNOJWXDUWJFJE-XROYCOCOSA-N 332.194 1.137 10 10 EDCE CCOC(=O)CN1C(=O)CSC1=C1SC(=S)N(CC)C1=O 2295033481 HSTGIAIKRAGWIE-UHFFFAOYSA-N 346.455 1.174 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C=C[C@@H](N)C2)c(O)c1Br 2352624598 KZWOLUKEDFBCNI-MWLCHTKSSA-N 325.206 1.983 10 10 EDCE Cc1ccc(CN2C[C@H](O)[C@@H](N(C)C)C2)c(O)c1Br 2352944884 NSLJLZAODQAIKP-RYUDHWBXSA-N 329.238 1.570 10 10 EDCE Cc1ccc(CNC(=O)C23CC(CN2)C3)c(O)c1Br 2352949750 IWAQCVAQYRHLIK-UHFFFAOYSA-N 325.206 1.831 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)cc1Br 2357051982 DWQRSCAAJRNHQH-MAMIUBEXSA-N 342.233 1.965 10 10 EDCE COCCNC(=O)Cn1cc(N[C@@H](C)c2ccc(C)cc2O)cn1 186498361 MNZFKOIQAURXEY-ZDUSSCGKSA-N 332.404 1.833 10 10 EDCE COc1cc(O)c(CN2C[C@H](C)[C@H](N3CCOCC3)C2)cc1OC 246010748 YGMRQKWPRURRRM-DZGCQCFKSA-N 336.432 1.562 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1 808498451 OQVQURHWMVPHGV-ZDUSSCGKSA-N 332.356 1.632 10 10 EDCE CCCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)C(C)=O 808506816 RZMNTJASBPTBFJ-UHFFFAOYSA-N 327.358 1.153 10 10 EDCE CN(CCF)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 820986143 LPPGWBODJDHAEX-UHFFFAOYSA-N 343.424 1.032 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C\c1ccc(O)c(F)c1F 901441629 CBFZCANPTGNSOX-YFHOEESVSA-N 326.324 1.973 10 10 EDCE O=C(c1cc(O)nc(O)c1)N1CCC[C@@H](Oc2ncc(F)cn2)C1 585341633 ZCOVAXPEWHXQLS-LLVKDONJSA-N 334.307 1.106 10 10 EDCE COC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)Nc2ccc(N)cc2)C1 841092682 MCOOPERAKRCARP-NWDGAFQWSA-N 348.403 1.190 10 10 EDCE CN1CCN(c2ccc(CNC[C@H]3CN(C4CC4)C(=O)O3)cc2)CC1 848577747 QGDVYXBNHTXKKL-SFHVURJKSA-N 344.459 1.511 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 840554331 GBHVQYRTUVKHQS-CJNGLKHVSA-N 336.432 1.422 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3C[C@H](O)C3(C)C)C2)cc1 854298644 HOALFBZGUSHQFS-RCBQFDQVSA-N 333.432 1.733 10 10 EDCE O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCc1c(O)cccc1F 928710664 VOEPPTGVLDECLE-VXGBXAGGSA-N 348.374 1.713 10 10 EDCE C[C@]1(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCC(=O)NC1 856213488 NZSIZMJQQLZSFY-IBGZPJMESA-N 345.443 1.180 10 10 EDCE COC[C@H](CCNC(=O)NCc1ccc(N2CC=CC2)cc1)OC 852138256 LLMSJZJPPQUDMD-KRWDZBQOSA-N 333.432 1.914 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3cc[nH]n3)C2)cc1 852456575 ZAECGLTWAYFWCO-CYBMUJFWSA-N 329.404 1.839 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCNC(=O)CC(C)C)C2)cc1 855231437 MQKSXSWQSNEPRI-HNNXBMFYSA-N 347.459 1.943 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCCC34OCCO4)C2)cc1 855224391 KISLXMYEEFVTSZ-PBHICJAKSA-N 346.427 1.933 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCN(c3ncns3)CC2)c1O 852127113 MPPFUZSAMOGVGO-UHFFFAOYSA-N 336.392 1.908 10 10 EDCE O=C(O[C@H]1CCCNC1=O)c1cccc2c1C(=O)c1ccccc1C2=O 767245458 DGMWTBYRHIFOTF-HNNXBMFYSA-N 349.342 1.897 10 10 EDCE Cc1nn(C)c(C)c1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773849293 YLBAFYHXKAPZQO-LLVKDONJSA-N 343.431 1.919 10 10 EDCE O=S1(=O)CCCN1CCCNCc1cc(Cl)cc(F)c1O 776173634 AYYMDYSIJAYHRV-UHFFFAOYSA-N 336.816 1.700 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@H](O)COC[C@@H]2CCCO2)c1 775373523 SXJMDCIFYZVYMP-YDHLFZDLSA-N 325.405 1.608 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCc2ccc(C(N)=O)cc2)cc1 1135275908 OCRUKKZGEGFWOP-UHFFFAOYSA-N 325.328 1.878 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)NC3=NCC(=O)N3C)ccc21 898777781 RDXQLQKPNDBYSP-UHFFFAOYSA-N 342.399 1.462 10 10 EDCE COC(=O)N1CCC(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1139042256 MAXSXUYCWWDWSK-UHFFFAOYSA-N 333.348 1.810 10 10 EDCE CN(C[C@H](O)CN1C(=O)c2ccccc2C1=O)c1ccc(CN)cc1 1958924565 BTMFCECISYBDBZ-HNNXBMFYSA-N 339.395 1.239 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H]3COC(=O)[C@H]3C2)c([N+](=O)[O-])c1 1307179641 ILXFJWKGJPJDJR-SCBUBVSKSA-N 332.312 1.390 10 10 EDCE CCO[C@H]1C[C@H](NC(=O)C(=O)NCCCSc2nccs2)C1 1334082891 MQQRNFLVCWJMCM-XYPYZODXSA-N 343.474 1.425 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2CNC(=O)O2)c1O 1964062940 JIJYGUJQGKARAP-SSDOTTSWSA-N 331.166 1.361 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1=NN(C)C(=O)CC1 1352614987 JPKONDOPWJWQJX-UHFFFAOYSA-N 328.416 1.853 10 10 EDCE Cc1nc2cc(O)nn2c(C)c1CC(=O)NCc1ccc(O)cc1O 1469160790 SYNJRNYGRIVILP-UHFFFAOYSA-N 342.355 1.322 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 1471661130 RKKKBZFJJRRNCV-OAHLLOKOSA-N 340.379 1.763 10 10 EDCE C[C@@H](CCN(C)C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1544677324 RSCVXFFHDVUJJV-AWEZNQCLSA-N 337.439 1.866 10 10 EDCE O=C(NCc1cccc(Cl)c1O)c1ccc(-n2cnnn2)cn1 1558757524 IIWBFLBWDWPAND-UHFFFAOYSA-N 330.735 1.346 10 10 EDCE COC(=O)[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)c1ccccn1 1636456559 IKUBVSBCHHPAAY-ZDUSSCGKSA-N 341.327 1.888 10 10 EDCE Cc1ccc(C(=O)NC[C@H]2c3ccccc3C(=O)N2C)c(O)c1O 1632091724 QSVFAUJBPXHHNP-AWEZNQCLSA-N 326.352 1.963 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C2=COCCC2)cc(OC)n1 1579367970 PVMRCAIWHJFLST-NSHDSACASA-N 349.387 1.028 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H](C)S1(=O)=O 1641951943 XGBGKIIMXLOQNF-UWVGGRQHSA-N 338.389 1.497 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccc(O[C@@H]2CC(=O)N2)cc1 1640603273 UMNAZGACOHJBHN-VWDQUCSISA-N 340.335 1.975 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@H]2CC(C(=O)OC(C)(C)C)=NO2)cc1 1587316571 KDUKXHNKDQOUAQ-OAHLLOKOSA-N 347.415 1.855 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H]2CCCNC2=O)cc1C 1668097364 UXRYTSVGWQVFKM-ZBFHGGJFSA-N 347.459 1.514 10 10 EDCE O=S(=O)(C[C@@H]1CC[C@H](C2CC2)O1)NCc1ccc(O)cc1O 1212223331 PEACRXGBJPZBOR-DZGCQCFKSA-N 327.402 1.475 10 10 EDCE Cc1cc(=O)c(OCCCC(N)=O)cn1CCOc1ccc(N)cc1 1857916982 WIBSAFPNZWOBJJ-UHFFFAOYSA-N 345.399 1.462 10 10 EDCE CCOC(=O)[C@@H]1C[C@]1(N)c1cc(I)ccc1O 1952774465 HSFLWYJSHHQEIQ-CABZTGNLSA-N 347.152 1.734 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)COC1 1985102005 ALINNJAVZWZKIL-SNVBAGLBSA-N 325.369 1.439 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985103542 XAGBUYAYDOGFRV-AXFHLTTASA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1CC(=O)NCCCN=[N+]=[N-] 1987645738 FSRNDJLUMJKZHS-GHMZBOCLSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NC(=O)Nc1ccc(N)cc1 1999154456 YPHINZAYCPFBGK-OLZOCXBDSA-N 336.392 1.682 10 10 EDCE COC(=O)[C@H](O)CN(C)c1ccc(CNC(=O)OC(C)(C)C)cc1 1999353095 FYYJPPWQACQZLY-CQSZACIVSA-N 338.404 1.681 10 10 EDCE C[C@@H](NC(=O)[C@@H](CO)CNC(=O)OC(C)(C)C)c1ccccc1O 2017519245 QMJQRVJAZHCYIK-VXGBXAGGSA-N 338.404 1.703 10 10 EDCE CC(C)(C)OC(=O)NCC12COC(C(=O)NCCCN=[N+]=[N-])(C1)C2 2026192354 KAMPIRWDUKEPAZ-UHFFFAOYSA-N 339.396 1.877 10 10 EDCE NCc1cc(F)c(N2CC[C@H](N3CC(O)C3)C2)cc1Br 2158751034 KXRUPVCBTAMQBR-JTQLQIEISA-N 344.228 1.302 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](CNCc2ccc(O)cc2O)C1 397473433 LVYABKKNAHVRQN-AWEZNQCLSA-N 338.404 1.823 10 10 EDCE CNC(=O)[C@@H]1CCN(c2ccc(CN)c(Br)c2F)C1 398456539 BKOONHUXWDIMJR-SECBINFHSA-N 330.201 1.619 10 10 EDCE CN(Cc1cn(C)nc1Br)C(=O)c1cccc(O)c1O 2173259949 RFCOUUVYNPIECW-UHFFFAOYSA-N 340.177 1.866 10 10 EDCE CCN(C)C1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2169449245 PQMOJQHNXFZSIO-CYBMUJFWSA-N 339.237 1.541 10 10 EDCE CN1C[C@@H]2C[C@H](C1)N2c1cc2c(cc1Br)[C@H](O)C(=O)N2 2187624730 LSKWBUYZPXHWIS-DAROEXNTSA-N 338.205 1.327 10 10 EDCE Cc1nn(C)c(CNC(=O)c2cc(O)nc(O)c2)c1Br 2192413454 WOUULCSDGOIDDO-UHFFFAOYSA-N 341.165 1.227 10 10 EDCE COC[C@H]1C=CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2182334184 XCDSBHYDVINVQF-AMIZOPFISA-N 339.189 1.826 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1C[C@H](O)CCN1C(=O)OC(C)(C)C 1908254397 MKPVYZLZPNMOJS-NEPJUHHUSA-N 341.412 1.906 10 10 EDCE CN(C(=O)CN1CC(CNC(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2044679931 AKOMMDLDUSYFDT-UHFFFAOYSA-N 348.447 1.688 10 10 EDCE COc1ccc(N2C[C@@H](O)CC23CN(C(=O)OC(C)(C)C)C3)c(N)c1 2066534892 REDHCKFSXKRTMX-LBPRGKRZSA-N 349.431 1.838 10 10 EDCE C[C@H]1CN(Cc2c(O)cccc2Br)[C@@H](C(=O)O)CO1 2109527058 USVPXJIMVPEDIP-GZMMTYOYSA-N 330.178 1.829 10 10 EDCE C[C@H]1CN(Cc2ccc(Br)cc2O)[C@@H](C(=O)O)CO1 2109523112 INZNXVDFBRTNSM-GZMMTYOYSA-N 330.178 1.829 10 10 EDCE Cn1cc(NS(=O)(=O)Cc2ccc(N)cc2)c(Br)n1 2230774482 NDYCFWIJEDLDCN-UHFFFAOYSA-N 345.222 1.707 10 10 EDCE COc1ccc(Br)c(CNC2CN(C3COC3)C2)c1O 2236052775 LQGXIGYVKLVFKM-UHFFFAOYSA-N 343.221 1.336 10 10 EDCE CN(C)CC=CC(=O)NCc1ccc(N2CCN3CCC[C@@H]3C2)cc1 2297716421 WJHALOSEUMRSHO-LJQANCHMSA-N 342.487 1.705 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CCO[C@@]4(CCOC4)C3)ccc21 187238452 REHUDIRAJQWMDE-IBGZPJMESA-N 345.443 1.770 10 10 EDCE COc1ccc(N2CCN([C@H](C)C(=O)N3CCOCC3)CC2)cc1 34684274 ZKVOLQBWOLDRHC-OAHLLOKOSA-N 333.432 1.065 10 10 EDCE CC(=O)c1cc(F)cc(CN2CC[C@H]3CC[C@@H](C2)S3(=O)=O)c1O 528777621 OWXBINRJPNWILD-KGLIPLIRSA-N 341.404 1.885 10 10 EDCE CN(C)c1ccc(CNC(=O)C2C[C@H]3CNC[C@@H](C2)C3=O)cc1F 373347159 TXZFDZNZUZTBOY-AGUYFDCRSA-N 333.407 1.323 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H](CO)C[C@H](O)C(C)(C)C)cc1 284693385 HCCNOOLUYOSYEI-HOCLYGCPSA-N 337.464 1.710 10 10 EDCE CC(=O)C(=O)CSc1nnc(-c2cc(-c3ccccc3)[nH]n2)n1N 808026354 XPRFBNVRPMMKLW-UHFFFAOYSA-N 342.384 1.299 10 10 EDCE Cn1ncc(C(F)(F)F)c1C(=O)NCCc1ccc(O)c(O)c1 830531614 LIZWTKCEAGZXSJ-UHFFFAOYSA-N 329.278 1.823 10 10 EDCE COc1cc(O)c(CN2CCC(Cn3cnnc3)CC2)cc1OC 844736059 UFUZFEXTDPLKLK-UHFFFAOYSA-N 332.404 1.913 10 10 EDCE COc1cc(C)cc(CN2CCS(=O)(=O)[C@@H]3CCC[C@H]32)c1O 840144981 KXZDASKOEIHKTM-UKRRQHHQSA-N 325.430 1.861 10 10 EDCE CC(C)C(=O)Nc1ccc(NC=C2C(=O)N(C)C(=O)N(C)C2=O)cc1 920978892 MKVVGOVKIBHDAS-UHFFFAOYSA-N 344.371 1.627 10 10 EDCE Cc1cc(CC(=O)NC[C@@H]2CNC(=O)C2)c(C)n1-c1ccccc1 854932117 YUFHMTAUQSWMRH-HNNXBMFYSA-N 325.412 1.889 10 10 EDCE Cn1nncc1CC(=O)NCc1cc(Br)ccc1O 854442150 IIZXINUBGWXRRH-UHFFFAOYSA-N 325.166 1.142 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCc3cnccn3)C2)cc1 855223260 FAHRTOKLIXUVOK-OAHLLOKOSA-N 326.400 1.813 10 10 EDCE CN1C[C@@]2(C)CN(CC(=O)NCc3ccc(N(C)C)cc3)C[C@@]2(C)C1 931306142 CVFHVBVHCGZHQO-BGYRXZFFSA-N 344.503 1.642 10 10 EDCE C[C@H](NC[C@H](O)C1(O)CCCC1)c1ccc(N2CCOCC2)cc1 930211342 SXIJBTYQVUINKJ-YJBOKZPZSA-N 334.460 1.840 10 10 EDCE CC1(C)NC(=O)N(CC(=O)NCc2c(O)ccc3c2CCCC3)C1=O 769563282 ZQDLOFWFUQWSRH-UHFFFAOYSA-N 345.399 1.218 10 10 EDCE Cc1cc(C)cc(-n2ncc(C=C3C(=O)N(C)C(=O)N(C)C3=O)n2)c1 781101558 WGVHGHQRNFLOGY-UHFFFAOYSA-N 339.355 1.318 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)N2CC[C@@]3(O)C[C@H]3C2)N(C)C)cc1 899097681 DZQSQVXNZTYILF-KVSKMBFKSA-N 346.475 1.522 10 10 EDCE O=C1NCC2(CCOCC2)[C@H]1NCc1cc(Cl)c(F)cc1O 895768193 FZBSGPWATNJBKN-ZDUSSCGKSA-N 328.771 1.570 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(C(=O)c2ccccc2)CC1 1135470425 XVOCPDYPURQFKS-UHFFFAOYSA-N 340.379 1.625 10 10 EDCE O=C(CCCNC(=O)c1ccccc1)NCc1ccc(O)cc1O 1142531201 XYSYFSAJIXPTML-UHFFFAOYSA-N 328.368 1.924 10 10 EDCE C[C@@H]1COCC[C@@H]1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1323983605 KJLSLSGPSOPMQE-CJNGLKHVSA-N 333.432 1.252 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)c2cc[n+]([O-])cc2)cc1C 1328978789 UQKBCBTWAAXGBL-HUUCEWRRSA-N 343.427 1.934 10 10 EDCE C[C@@H](CNCc1cc(Br)cc(F)c1O)c1nn[nH]n1 715721682 PJMDXZHCZKNEKJ-LURJTMIESA-N 330.161 1.700 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@@H](CCO)[C@@H](CO)C1 1348463998 YEUWSFWEBCTQJS-IAGOWNOFSA-N 347.459 1.419 10 10 EDCE COc1cccc(CNC(=O)c2ccc3c(c2)N(C)C(=O)CO3)c1O 1445971245 UWUAZYVSYBTZLN-UHFFFAOYSA-N 342.351 1.686 10 10 EDCE COC(=O)c1cc(NC(=O)Cc2ccc(O)c(O)c2)cc([N+](=O)[O-])c1 1618532333 UVUDIXNMOJBICV-UHFFFAOYSA-N 346.295 1.974 10 10 EDCE CN(C)S(=O)(=O)CCC(=O)NCc1ccc(N2CCCC2)cc1 1543585655 QUWARLRLIXQMNV-UHFFFAOYSA-N 339.461 1.185 10 10 EDCE CC(C)(NC(=O)Cc1ccc(O)c(O)c1)C(=O)NCC1CCCC1 1623361407 PUWQXMQCIFIIPT-UHFFFAOYSA-N 334.416 1.842 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)CNC(C)=O)C[C@@H]2C)cc1C 1715408703 YEWDIGRXJLLMAZ-YOEHRIQHSA-N 347.459 1.466 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2nc(OC)cc(OC)n2)c1 1622779780 WBOGBEBSTDHPRC-SECBINFHSA-N 333.344 1.699 10 10 EDCE CC(=O)N/C(=C/c1cccs1)C(=O)NCc1ccc(O)cc1O 1626848007 HLWVSPZJTYGWGR-RIYZIHGNSA-N 332.381 1.953 10 10 EDCE O=C(CCNC(=O)Cc1ccc(O)c(O)c1)NCc1ccccc1 1627068239 XTOHLAMQGLEMND-UHFFFAOYSA-N 328.368 1.463 10 10 EDCE COC[C@@H](C)NC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1715916973 WEMAPHZBMSFWOL-MOYBGKDOSA-N 333.392 1.760 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCOC[C@@H]2[C@H]2CCCO2)cc1 1556550165 LGEPJFVNSIXBLY-ZIAGYGMSSA-N 332.360 1.869 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2nocc2C)cc1C 1717930930 SKXGHQTXDQPXQE-HNNXBMFYSA-N 347.415 1.523 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C2CC=CC2)cc(OC)n1 1720903480 IXKJVYJTZYEZBY-NSHDSACASA-N 333.388 1.300 10 10 EDCE CCN1CCO[C@H](C(=O)N(C)CCNCc2ccc(OC)c(C)c2)C1 1493801750 SGUZCWWPVACSDJ-SFHVURJKSA-N 349.475 1.272 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)C[C@@H]2CCNC2=O)cc1C 1568863573 XDVDMWQCQUCGBK-QGZUEGPWSA-N 345.443 1.292 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@@H](C)NC(C)=O)C2CC2)cc1C 1569293950 KYQZMSLCAGFRSP-CXAGYDPISA-N 347.459 1.513 10 10 EDCE COC(=O)C1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CCOCC1 1633765311 WNKWOULCBXFOLS-UHFFFAOYSA-N 348.359 1.549 10 10 EDCE COC(=O)CNC(=O)Cc1ccc(NC(=O)c2cc(O)cs2)cc1 1630201443 LATZPUFOCCRJOH-UHFFFAOYSA-N 348.380 1.538 10 10 EDCE CCCC(=O)N[C@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1732941265 GWRCTGUNUNNEGJ-GFCCVEGCSA-N 332.408 1.065 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cnc(O)n2C)cc1C 1732966671 PWGFYSMIJCOGQU-GFCCVEGCSA-N 332.404 1.351 10 10 EDCE CCC[C@H](CCCS(C)(=O)=O)C(=O)NCc1c(O)cccc1O 1647268799 CTDSAYBSIKJNQV-GFCCVEGCSA-N 343.445 1.955 10 10 EDCE CN(C[C@H](O)COCc1ccccc1)c1ccc2c(c1)NC(=O)[C@H]2O 1916383247 GFGJKTQNSREFIY-YJBOKZPZSA-N 342.395 1.686 10 10 EDCE NCc1ccc(N2CC[C@@H](O)C[C@H]2CO)c(F)c1Br 2136083382 DMCRVSYDRPEMPQ-VHSXEESVSA-N 333.201 1.369 10 10 EDCE C[C@@]1(C(=O)O)COCCN1Cc1ccc(Br)cc1O 2136499638 DCMVRYAOHSZZQI-ZDUSSCGKSA-N 330.178 1.830 10 10 EDCE CCNCc1ccc(N2CCO[C@@H](CO)C2)c(Br)c1 233532514 FNIPIHKXGSATKU-GFCCVEGCSA-N 329.238 1.756 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](N)C1(O)CC1 1952671351 UCEGKIDSMQJNIF-BXUZGUMPSA-N 338.404 1.386 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NCc2ccc(F)cc2O)C1 1994520957 QVFKVAQDWFRAOQ-TZMCWYRMSA-N 326.368 1.601 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)C1 2011940100 VGZYNYSTFVOYPH-IAQYHMDHSA-N 339.396 1.517 10 10 EDCE [N-]=[N+]=NCCNC(=O)CNC(=O)c1cccc(Br)c1 701323724 YRKGHCRFZUDMAF-UHFFFAOYSA-N 326.154 1.605 10 10 EDCE CNCc1ccc(N2CCC[C@H](CO)[C@H]2CO)cc1Br 709823234 MPKFZDPLQTXOFV-IUODEOHRSA-N 343.265 1.738 10 10 EDCE COCc1cc(O)nc(=NCc2cccc(Br)c2O)[nH]1 2192812147 BRULQVTYOYZYJO-UHFFFAOYSA-N 340.177 1.831 10 10 EDCE O=C1Nc2cc(N3CC=C[C@@H](O)C3)c(Br)cc2[C@@H]1O 2108771872 BAVFMPZMGPZGRQ-KRTXAFLBSA-N 325.162 1.172 10 10 EDCE Cn1cc(N2CCC[C@@H](NC(=O)C=Cc3ccc(O)c(O)c3)C2)cn1 2308001585 VSYGIYIHNCJDIF-CQSZACIVSA-N 342.399 1.630 10 10 EDCE CN[C@H](c1ccccc1O)[C@H](O)[C@H](CNC(=O)OC(C)(C)C)OC 2307259263 JNOLKHLJBZKLIF-RRFJBIMHSA-N 340.420 1.553 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CSCN2)c(O)c1Br 2327586505 NYNYSZCNXSQFMC-SECBINFHSA-N 331.235 1.742 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2COC[C@@H]2N)c(O)c1Br 2352633834 NUWCKDMSLNWFPI-ZJUUUORDSA-N 329.194 1.053 10 10 EDCE Cc1ccc(CN[C@@H]2COC[C@H]2N(C)C)c(O)c1Br 2352681556 SQKSWWCURDVGLK-VXGBXAGGSA-N 329.238 1.882 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)cc1Br 2353966307 BVSUDTFDYXYVLS-COLVAYQJSA-N 342.281 1.841 10 10 EDCE Nc1nonc1/N=N/N(Cc1cccc([N+](=O)[O-])c1)c1nonc1N 59498589 KEGSKMRKFQWTAT-XMHGGMMESA-N 346.267 1.231 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(CC(=O)NC3CC3)CC2)c1O 179610554 VLJFDRGLAMFJLO-UHFFFAOYSA-N 337.851 1.750 10 10 EDCE CCN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1cc(C)ccc1C 65859142 GUSKPARTMIPHAD-MDZDMXLPSA-N 341.411 1.767 10 10 EDCE CCN(c1ccc(N)cc1)S(=O)(=O)C1CCS(=O)(=O)CC1 63114379 CLYNZVXKYMCPPV-UHFFFAOYSA-N 332.447 1.002 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CC[C@H](C4CC4)N3)CC2)cc1 407310073 NIEFWGONRLTWEP-QZTJIDSGSA-N 329.444 1.874 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)cc1 325835577 BAMSNJAAPKHATC-TXPKVOOTSA-N 331.460 1.901 10 10 EDCE COC1CCN(c2ccc(CN3CC(=O)N(C)[C@H](C)C3)cc2)CC1 295441152 VOISCWRXDOXTRH-OAHLLOKOSA-N 331.460 1.964 10 10 EDCE CC(=O)C(=O)COC(=O)c1nn(CC(C)C)c(=O)c2ccccc12 808495928 UDIXIGSELVLDHH-UHFFFAOYSA-N 330.340 1.367 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)Nc2cn(C)nc2C2CC2)cc1 291366650 RDLXLIHPYADWEJ-UHFFFAOYSA-N 341.415 1.618 10 10 EDCE CN1CCC[C@](O)(CC(=O)NCc2c(O)ccc3c2CCCC3)C1 901130558 CZJQEYQHMQFODU-IBGZPJMESA-N 332.444 1.734 10 10 EDCE NC(=O)CC1CC(NC(=O)NCc2ccc(N3CCCC3)cc2)C1 914180341 LQVIXBYAUAITKF-UHFFFAOYSA-N 330.432 1.740 10 10 EDCE COC1(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC1 843606073 ZMRFTLBYMBERMJ-UHFFFAOYSA-N 326.343 1.597 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCOC[C@@H]2c2ccnn2C)c1O 846116900 XYXNZQSALPQMRM-CQSZACIVSA-N 348.359 1.616 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3CCC[C@H](N)C3)CC2)cc1 848716359 BZWWNNPQMSJIOI-IRXDYDNUSA-N 332.492 1.677 10 10 EDCE C[C@H]1CCN(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 847506365 AMVNCXGEWYUVBG-INIZCTEOSA-N 345.487 1.853 10 10 EDCE CN1CCCc2cc(CNC(=O)NC3CCC(C(N)=O)CC3)ccc21 747585909 VGWXJHMRMXGJEE-UHFFFAOYSA-N 344.459 1.912 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCC(C)(C)CO)C2)cc1 854298169 XKCXJMLXJPRGFO-CQSZACIVSA-N 335.448 1.982 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCCC(=O)N(C)C)C2)cc1 855232557 UZEUXIBFCGWWDB-CQSZACIVSA-N 333.432 1.649 10 10 EDCE C[C@@H](NCCc1nnnn1C)c1cc(Br)cc(F)c1O 756678690 XHVKMDSDJPFODJ-SSDOTTSWSA-N 344.188 1.711 10 10 EDCE CNCc1ccc(N2C[C@@H](O)C[C@]2(C)CO)cc1Br 698224502 AQPGDHQBUJMNRN-GXTWGEPZSA-N 329.238 1.491 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(CC(=O)N(C)C)CC2)c1O 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10 10 EDCE O=C(CC1(N2CCOCC2)CCCC1)NCc1c(O)cccc1O 1635846971 FGJIRVLKGFUULN-UHFFFAOYSA-N 334.416 1.749 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H](n1cncn1)C(F)(F)F 1632049096 XHDYODABSVMNIQ-FXMSTWTQSA-N 342.277 1.622 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CCS(=O)(=O)C3(CCC3)C2)c(O)c1O 1645143706 LEUSPTLLFLEIGS-NSHDSACASA-N 339.413 1.636 10 10 EDCE CCO[C@@H](C)C(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1744688097 KFSVTLSCJNESKA-QWRGUYRKSA-N 349.391 1.509 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@@H]2CC23CCC3)cc1 1757998099 REXQYSYJJVYIBX-ZDUSSCGKSA-N 343.387 1.885 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H](O)C2(C)C)c(Br)c1 2124799970 JGHGNYOVVNNBEM-AQUOVQTQSA-N 329.238 1.789 10 10 EDCE O=C(Cn1nc(-c2ccccc2)oc1=O)NCc1c(O)cccc1F 1596906601 HBWUYMJYETUPJQ-UHFFFAOYSA-N 343.314 1.664 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCCN(C(N)=O)CC2)c([N+](=O)[O-])c1 1772825491 BAEVGWNJJHVMLB-XQRVVYSFSA-N 348.359 1.372 10 10 EDCE O=C(O)[C@H](c1ccc(O)c(O)c1)[C@H](C(=O)O)c1ccc(O)c(O)c1 13587793 UMAASMUXEBOCLH-ZIAGYGMSSA-N 334.280 1.546 10 10 EDCE NCc1ccc(N2C[C@H](CO)OCC23CC3)c(Br)c1 2127546557 YNSNQOPIVYVPEV-LLVKDONJSA-N 327.222 1.638 10 10 EDCE CNC(=O)[C@@H]1CCCN1C(=O)NCc1ccc2c(c1)CCCN2C 157549331 OIMZZZBOKHBHNP-INIZCTEOSA-N 330.432 1.489 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)C2(C(=O)O)CC2)c2nccn2C)cc1 1866033245 FRANUZKQYDOHQT-AWEZNQCLSA-N 342.399 1.557 10 10 EDCE CCN(CC(C)(C)O)c1cc2c(cc1Br)[C@H](N)C(=O)N2 118775283 DYSGQDDNTWEZAF-LBPRGKRZSA-N 342.237 1.998 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)OCCCN 1951698536 PBPAFYKYSJSANH-AWEZNQCLSA-N 326.393 1.857 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@](C)(N)C(=O)O 1952122357 UEHKVZWGDAXXCD-WBMJQRKESA-N 340.376 1.336 10 10 EDCE CO[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980371802 XJAUGOIPGWYDEO-PRULPYPASA-N 328.409 1.180 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 1990359370 ZIBUOZVGOUSHLZ-MWLCHTKSSA-N 325.369 1.580 10 10 EDCE CC(C)(C)OC(=O)NC[C@@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CCCO1 2003171221 VMQVJMVPAHCWNS-PSTGCABASA-N 340.420 1.326 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)Nc2ccc(N)cc2)C[C@H](CO)C1 2018274840 PZOXLWSIANDWFT-OYHSWFHJSA-N 335.404 1.873 10 10 EDCE O=C(O)[C@@]12COC[C@H]1CN(Cc1c(O)cccc1Br)C2 2161010331 MQADTYPUVJXULM-OTYXRUKQSA-N 342.189 1.688 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3CCC[C@H](C(=O)N(C)C)C3)c2n1 2062317025 ASKJEZYWYOGCQQ-RYUDHWBXSA-N 345.403 1.120 10 10 EDCE NCc1ccc(N2CC[C@@]3(O)CCOC[C@@H]3C2)cc1Br 2194549540 CVLPLIYQUZGTQH-SWLSCSKDSA-N 341.249 1.886 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)C[C@H]2CO)c(Br)c1 2200834784 YOOAYUWDYZWITG-QWHCGFSZSA-N 343.265 1.881 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2104412753 XNRMVXRKWXLDSE-ALPOKKBCSA-N 328.206 1.433 10 10 EDCE NCc1ccc(N2C[C@@H](CO)[C@H](CCO)C2)c(Br)c1 2093495604 KNTKNHMTYAKXHG-NEPJUHHUSA-N 329.238 1.335 10 10 EDCE O=C1Nc2cc(N3C[C@@H](F)C[C@@H](O)C3)c(Br)cc2[C@@H]1O 2234666343 VCWCNUUFELRVTG-KJNMHVQDSA-N 345.168 1.344 10 10 EDCE Cc1ccc(CNS(=O)(=O)[C@H]2C[C@H](N)C2)c(O)c1Br 2352944957 OYEPWFHDSSCZPS-MGCOHNPYSA-N 349.250 1.372 10 10 EDCE CC[C@@H](C)[C@@H](NC(N)=O)C(=O)NCc1ccc2c(c1)CCCN2C 57558776 IKASLCGGSYTVSV-MLGOLLRUSA-N 332.448 1.768 10 10 EDCE COc1ccc(O)c(CNC(=O)CNC(=O)c2ccccc2C)c1 114541727 YLZLDZLSPZTLFV-UHFFFAOYSA-N 328.368 1.755 10 10 EDCE COc1cc(CC(=O)NCc2cccc(O)c2O)cc(OC)c1OC 1352657828 MMAMBXJLZCHCJD-UHFFFAOYSA-N 347.367 1.983 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1CC(=O)N(CC(F)(F)F)C1 180801018 MQHHMQBZVJDPEL-YWNRKNDBSA-N 344.289 1.390 10 10 EDCE COc1ccc(CN2CCN(CC(=O)N3CCCCC3)CC2)c(O)c1 121861625 BZYSSAQUANRLAC-UHFFFAOYSA-N 347.459 1.531 10 10 EDCE CC[C@H](C)[C@H](NC(N)=O)C(=O)N1CCN(c2ccc(OC)cc2)CC1 70719010 ADEZDWWAPUGKIT-BBRMVZONSA-N 348.447 1.427 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(Cc2ccccc2)CC1 33646049 HQDFPFSYMDUHJT-UHFFFAOYSA-N 326.396 1.985 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)NC(=O)C2 188845191 VWDAHEWPKSZZMQ-JTQLQIEISA-N 326.352 1.953 10 10 EDCE CNS(=O)(=O)c1ccc2c(c1)CCN2Cc1cccc(OC)c1O 191550683 UHIBIPFLCFCBRR-UHFFFAOYSA-N 348.424 1.872 10 10 EDCE CC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCCC2)cc1 195078819 XQQLOXBLTDQYPF-INIZCTEOSA-N 333.457 1.824 10 10 EDCE CCN(CC)c1ccc(CN2CC[C@@H](NS(C)(=O)=O)C2)cc1 93531474 RSGQBLOQWAGVFB-OAHLLOKOSA-N 325.478 1.656 10 10 EDCE CN(C)C(=O)CCN1CCN(Cc2cccc(Cl)c2O)CC1 271894270 XSHJABPAILWYEB-UHFFFAOYSA-N 325.840 1.642 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](C)[C@H](OC)C3)nc12 275890629 RZSSQCUHDRMHDG-SMDDNHRTSA-N 348.403 1.468 10 10 EDCE CCOC(=O)c1csc(CCNC(=O)c2cccc(O)c2O)n1 276184093 LKYXQXKILNXQSW-UHFFFAOYSA-N 336.369 1.704 10 10 EDCE COCc1nc([C@@H]2COCCN2Cc2cc(OC)ccc2O)no1 374801911 UGRHAUGJSDEBFQ-ZDUSSCGKSA-N 335.360 1.504 10 10 EDCE C[C@H]1C[C@@H](N(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)CCN1C 283564620 RLEPBNFVTALSGS-YOEHRIQHSA-N 346.475 1.310 10 10 EDCE CCOC(=O)[C@@H](N)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 392433118 CWXPIPVFXLHLHC-INIZCTEOSA-N 333.432 1.526 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCN[C@H]2COC[C@@H]21 2132580034 RTCHBITYHLVWJW-RYUDHWBXSA-N 331.185 1.466 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@H]3CCNC[C@@H]3C)CC2)cc1 841779189 NBFSPGRVMFNPOU-KSSFIOAISA-N 346.475 1.961 10 10 EDCE COC(=O)c1cc(COc2ccc(N(C)C)c(C(=O)OC)c2)on1 918649606 CLSFAXAQLOJOSZ-UHFFFAOYSA-N 334.328 1.893 10 10 EDCE C[C@@H](NC(=O)[C@H](O)C1CCOCC1)c1ccc(N2CCOCC2)cc1 746169284 XTFKIJRXIBELTB-RDTXWAMCSA-N 348.443 1.488 10 10 EDCE O=S1(=O)CC[C@]2(CN(Cc3cccc(Cl)c3O)CCO2)C1 843426502 XKUKWJCUIIBCSB-AWEZNQCLSA-N 331.821 1.435 10 10 EDCE CCN(CC)c1ccc(CNC[C@@]2(CO)COCCN2C)cc1F 922535613 JVQMTMQRANUFHQ-GOSISDBHSA-N 339.455 1.455 10 10 EDCE CC1(C)OCC[C@@H]1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 856261883 JTVXACNLWNIKJZ-SNVBAGLBSA-N 342.417 1.309 10 10 EDCE C[C@@H](NC(=O)N[C@@H]1CCc2nnn(C)c2C1)c1ccc(N(C)C)cc1 922054854 MGERIEPQCONPCX-TZMCWYRMSA-N 342.447 1.799 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CC[C@@]3(C)CCC(=O)N3)C2)cc1 855234115 SKOSGABZTJVBJP-LIRRHRJNSA-N 345.443 1.839 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNCc3ccnc(O)c3)cc2)C1 921573127 IIDXJDPMXFVBJQ-INIZCTEOSA-N 340.427 1.779 10 10 EDCE C[C@@H](NC[C@@H](O)C1(O)CCCC1)c1ccc(N2CCOCC2)cc1 930211336 SXIJBTYQVUINKJ-CRAIPNDOSA-N 334.460 1.840 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCCS(=O)(=O)C1 862026351 LPHXUHMDEHEHIC-CYBMUJFWSA-N 334.397 1.381 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1ccnc(O)c1Br 772404363 IJCNPEXBNHEXGJ-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)c2cnc3n2CCC3)c1 772723675 KLRCKYUDKMJRQJ-JTQLQIEISA-N 337.401 1.583 10 10 EDCE CN(C)c1ncnc2c1cc(C(=O)NCc1ccc(O)cc1O)n2C 1142533680 QBWDISLMVOHING-UHFFFAOYSA-N 341.371 1.376 10 10 EDCE C[C@H]1CS(=O)(=O)C[C@@H]1NCc1ccc(Br)cc1O 711774619 NFVOWZBFVSZPMQ-KWQFWETISA-N 334.235 1.677 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1n[nH]c(C)c1C 1325761209 CKVQSUMDGALRGT-LBPRGKRZSA-N 347.371 1.342 10 10 EDCE COc1ccc(CNC[C@@H]2CCO[C@@H]2C(=O)O)cc1Cn1cccn1 1334793486 KPJZORXMMXEOBB-YOEHRIQHSA-N 345.399 1.519 10 10 EDCE CCN1CCOC[C@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1349118176 NQSKRHPVVPZCRR-SFHVURJKSA-N 331.460 1.966 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@]2(C)CCC(=O)N2)cc1C 1507121673 GHPFORFNZCBLGU-KUHUBIRLSA-N 347.459 1.609 10 10 EDCE COCC(=O)N1CCC(O)(CNCc2ccc(OC)c(C)c2)CC1 1281586930 PBZJJLFBCXSIES-UHFFFAOYSA-N 336.432 1.093 10 10 EDCE Nc1c(C(=O)NCc2cc(O)ccc2O)cnn1Cc1ccccc1 1455350659 CFPPOGOOQLTBCW-UHFFFAOYSA-N 338.367 1.855 10 10 EDCE COc1ccc2c(c1)OC[C@H](NC(=O)Cc1ccc(O)c(O)c1)C2 1466650277 OYMDXCAVXGGLKI-CYBMUJFWSA-N 329.352 1.769 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1=C[S@@](=O)CCC1 1540536589 KGWQFTBAAJQZDS-DEOSSOPVSA-N 348.468 1.908 10 10 EDCE C[C@](CO)(NC(=O)/C=C/c1ccc(O)c(O)c1)c1ccc(O)cc1 1627650264 AINMORNXPLHGLA-KDEAJPOZSA-N 329.352 1.841 10 10 EDCE CN(C)C(=O)/C=C\C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1624537104 HDXWEBLALOXTHW-HJWRWDBZSA-N 331.416 1.126 10 10 EDCE CC(C)=CCNC[C@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1716111654 AGKWRZVERPBPLI-AWEZNQCLSA-N 333.392 1.496 10 10 EDCE NC(=O)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccc(Cl)cc1 1558804786 WFLOMTMGCUPTCK-HNNXBMFYSA-N 334.759 1.637 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2nnn(C)n2)c1 1634565377 PEJPKKOWRPIDIV-UHFFFAOYSA-N 338.371 1.360 10 10 EDCE O=C(Cn1ccc([N+](=O)[O-])n1)NCc1c(O)ccc2ccccc12 1635965355 WZHDTGSEMOSQIA-UHFFFAOYSA-N 326.312 1.967 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)CNC(C)=O)C(C)C)cc1C 1568441718 GZWGTJXKDQOKJJ-INIZCTEOSA-N 335.448 1.370 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)C(=O)NCC2CC2)cc1C 1733998422 OYDZSNKJINNFRC-KGLIPLIRSA-N 347.459 1.513 10 10 EDCE O=C(Cc1csc(N2CCCC2=O)n1)NCc1cccc(O)c1O 1651172765 FICFSHQDOVTXID-UHFFFAOYSA-N 347.396 1.540 10 10 EDCE COc1ccc(CNC[C@H]2CCCC[C@@H]2NC(=O)CC(N)=O)cc1C 1669950624 WOHWMAPQIBOEIA-CVEARBPZSA-N 347.459 1.644 10 10 EDCE C[C@@H](CO)N(Cc1ccccc1)C[C@@H](O)COc1ccc(N)cc1 1914368737 VUWRKULALNRXSL-MAUKXSAKSA-N 330.428 1.892 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1CCNC[C@H]1C(N)=O 251090791 OMTZQGQWVTUQEY-NEPJUHHUSA-N 342.237 1.365 10 10 EDCE Cc1ccc(CNCCc2nnc(Br)n2C)c(O)c1 2139772996 XSIPTBSFVWXRAL-UHFFFAOYSA-N 325.210 1.924 10 10 EDCE COc1cc([C@@]2(C(=O)O)C[C@@H]2NC(=O)OC(C)(C)C)cc(O)c1O 1952829111 HXPMWLZVANAVHX-ZBEGNZNMSA-N 339.344 1.726 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)[C@@H]21 2003172936 RPJCAASPIGVXEI-MYYUVRNCSA-N 336.432 1.898 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010406686 XUGGWDWSODQNEG-SRVKXCTJSA-N 341.412 1.952 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010406777 YWIXGMCGXSSOLF-SDDRHHMPSA-N 341.412 1.809 10 10 EDCE C[C@H](CNC(=O)OC(C)(C)C)CNC(=O)c1cc(O)c(O)c(O)c1 2015121103 AESGKUAEDZQNHB-VIFPVBQESA-N 340.376 1.694 10 10 EDCE C[C@@H]1C[C@@H](CO)CN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2156550986 KIBAMGGAOFFHCD-RBDZCENOSA-N 341.205 1.642 10 10 EDCE O=C1Nc2cc(N3CC4(COC4)C3)c(Br)cc2[C@@H]1O 704455805 SUVQUIMUWYJHND-NSHDSACASA-N 325.162 1.271 10 10 EDCE CS(=O)(=O)[C@H]1CCCN(c2ccc(CN)cc2Br)C1 389045312 GRMMITFURRKPKV-NSHDSACASA-N 347.278 1.921 10 10 EDCE NCc1ccc(N2CCN(C3COC3)CC2)c(F)c1Br 2169592980 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C[C@@H](Sc1nnnn1C1CC1)C(=O)NCc1cc(O)ccc1O 1558174281 IYCFOCYVFCSEDP-MRVPVSSYSA-N 335.389 1.216 10 10 EDCE CN(CCNCC[C@H]1CCOC1)C(=O)c1ccc(N=NC(N)=O)cc1 1714807611 XAVRUKNLXRILQL-ZDUSSCGKSA-N 347.419 1.937 10 10 EDCE CC[C@H](NC(C)=O)C(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 1499357098 NWTBOGDDUZRHIJ-INIZCTEOSA-N 347.459 1.657 10 10 EDCE C[C@H](NC(=O)Cc1ccc(O)c(O)c1)C(=O)NCCc1ccccc1 1636720465 RORXBIJTGWWSHO-ZDUSSCGKSA-N 342.395 1.504 10 10 EDCE Cc1sc(S(N)(=O)=O)cc1C(=O)NCc1cccc(O)c1O 1644708420 KIPPNTNYHNMPCL-UHFFFAOYSA-N 342.398 1.045 10 10 EDCE Cc1nc(CN2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)cs1 1588044621 WPURDMANNKEGNG-UHFFFAOYSA-N 347.440 1.750 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)c2ccoc2)cc(OC)n1 1679903290 VSUJBWLLPKUCFI-LLVKDONJSA-N 347.371 1.582 10 10 EDCE COCC(=O)N(C)CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1689054006 WSANCUMBTCMKTF-UHFFFAOYSA-N 335.364 1.026 10 10 EDCE C[C@@H](CN1CCN(C)CC1)N[C@H](C)c1ccc(N2CCOCC2)cc1 154883837 VOUDBDZJMARFSJ-ZWKOTPCHSA-N 346.519 1.810 10 10 EDCE C[C@H](O)[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 1858592161 IDDYOOIRZARJAI-JZMJZOPTSA-N 339.394 1.427 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NCc1cc(F)ccc1O 1937553751 TVXYHRLGLZVMCP-OLZOCXBDSA-N 326.368 1.913 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)C[C@@H]2CN(C)C)cc1Br 235223657 ZBJYAEICRWWEQE-RAIGVLPGSA-N 342.281 1.970 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)CC1(O)CNC1 1952206721 OMBOXNNDGLIVAM-LBPRGKRZSA-N 338.404 1.258 10 10 EDCE NCc1ccc(N2C[C@H]3CCC[C@@]3(C(N)=O)C2)cc1Br 2144089991 FETBOVVBLJYUOT-IAQYHMDHSA-N 338.249 2.000 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985102471 HQACDKHLXRGAAT-GMTAPVOTSA-N 327.385 1.562 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 1985101852 YOWLKRVNOKKZDC-QWRGUYRKSA-N 327.385 1.373 10 10 EDCE CNCc1ccc(N2CC[C@@H]3CC(=O)N[C@@H]3C2)c(Br)c1 2145075115 ZNHSGFUPGSJFML-DGCLKSJQSA-N 338.249 1.883 10 10 EDCE COCCNCc1ccc(N2CC[C@@H]2C(N)=O)c(Br)c1 2145598283 FFCUEDOPUJHRJD-CYBMUJFWSA-N 342.237 1.249 10 10 EDCE NCc1ccc(N2CC[C@@](CO)(CCO)C2)c(F)c1Br 2153343969 CUPRWFQNLYNDAP-CQSZACIVSA-N 347.228 1.618 10 10 EDCE Nc1ccc(OCCC(=O)NCCNOCc2ccccc2)cc1 2016997478 QTRKLCJAWFBNOQ-UHFFFAOYSA-N 329.400 1.875 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N(C)Cc1ccc(N)cc1 2022867255 IOEHACZMVMJVGV-FZMZJTMJSA-N 337.420 1.501 10 10 EDCE NCc1ccc(N2CCN3C[C@@H](O)C[C@H]3C2)c(F)c1Br 405226669 DKVYWTDSTNZSMO-QWRGUYRKSA-N 344.228 1.302 10 10 EDCE CNCc1ccc(N2CCC[C@](O)(CO)C2)cc1Br 313754767 RTCYJFKURWLEGY-CQSZACIVSA-N 329.238 1.492 10 10 EDCE C[C@H](OCc1ccccc1)[C@@H](NC(=O)c1cc(O)nc(O)c1)C(=O)O 706048727 INVJWHNNNVBVJD-ZUZCIYMTSA-N 346.339 1.281 10 10 EDCE CO[C@@H]1CN(c2cc(Br)c(CN)cc2F)C[C@H]1OC 382241114 BYNLZZQDHITFDT-CHWSQXEVSA-N 333.201 1.897 10 10 EDCE CN(C)C(=O)c1cnn(Cc2cc(Br)ccc2O)c1O 2070584143 WARHOMDSBZZBII-UHFFFAOYSA-N 340.177 1.807 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CNCc2cccc(F)c2O)C1 897692206 PNSAKZLOPRSWJS-QGZVFWFLSA-N 340.395 1.993 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 1908252665 CFQGUZXLBSDGFE-WDEREUQCSA-N 339.396 1.563 10 10 EDCE OC[C@@]1(NCc2cc(Br)ccc2O)C[C@@H](O)C12CCC2 2193970448 ZDYWKUUDNYBVDY-HIFRSBDPSA-N 342.233 1.910 10 10 EDCE COc1ccc(CNCCc2nnc(Br)n2C)c(O)c1 2185197922 LXOWFHACVNIRMJ-UHFFFAOYSA-N 341.209 1.624 10 10 EDCE C[P@@]1(=O)C[C@@H](NCc2cccc(Br)c2O)[C@@H](O)C1 2057720682 PIDWYIJCCLHINO-LIBAHTEVSA-N 334.150 1.980 10 10 EDCE Cn1cc(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)c(CNC(=O)OC(C)(C)C)n1 2060640136 QCTDBDXAIGQPSU-SNVBAGLBSA-N 349.395 1.970 10 10 EDCE CO[C@@H]1[C@H](OC)CN(c2ccc(CO)c(Br)c2)[C@@H]1CO 2233354194 OHGKSYGLWAQJKW-MCIONIFRSA-N 346.221 1.152 10 10 EDCE COc1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(OC)c1Br 2234897920 SGSHODTWALLFBL-RUNRMZSQSA-N 344.205 1.397 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2CCNC2=O)c1O 2227750527 YWDXIBKQGDPANS-QMMMGPOBSA-N 329.194 1.389 10 10 EDCE NCc1ccc(N2C[C@H]3OCC[C@]3(CO)C2)c(Br)c1 2278920991 GXZKSNWJTHTHMU-ZIAGYGMSSA-N 327.222 1.495 10 10 EDCE CC[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2288913280 WYDSHDYKWIDMMP-RTXFEEFZSA-N 341.205 1.784 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N(C)c2ccc([N+](=O)[O-])nc2)c1 493863879 XSMIYXPRVIRYEX-ZZXKWVIFSA-N 341.327 1.421 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2C=CCN2)c(O)c1Br 2352944318 GGOKZEKXIZCSTA-NSHDSACASA-N 325.206 1.950 10 10 EDCE Cc1ccccc1C(=O)NCC(=O)NCCc1ccc(O)c(O)c1 9513740 VBQNIEQSDCUHCX-UHFFFAOYSA-N 328.368 1.495 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CN2CCN(CCN3CCCC3)CC2)c1 127484822 FNPJBVIRIBJBII-UHFFFAOYSA-N 334.420 1.514 10 10 EDCE C[C@@H](NCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1O 185065808 MBALRSJFVAWJLN-CQSZACIVSA-N 345.422 1.794 10 10 EDCE C[C@@H](CNC(=O)NCc1ccc(N2CCCC2)cc1)N1CCOCC1 49131052 AJJOUDYMDXGJFC-INIZCTEOSA-N 346.475 1.807 10 10 EDCE Cc1ccc2c(c1)CCCN2C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 48302660 MYYCTJRFIPYTNY-VQHVLOKHSA-N 339.395 1.385 10 10 EDCE O=C(c1cccc(O)c1O)N1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1 193144776 WLEVRALSJRPUCJ-BXUZGUMPSA-N 330.384 1.713 10 10 EDCE CO[C@@H]1CN[C@@H](C(=O)NCc2ccc(C)c(Br)c2O)C1 2380747662 WLLZZWRWKBTHEM-WDEREUQCSA-N 343.221 1.456 10 10 EDCE Cc1ccc(CN[C@@]23CC[C@@H](C2)[C@H](O)[C@H]3O)c(O)c1Br 2380801136 OYOLBLZEHIHYBD-JVOAXRGISA-N 342.233 1.827 10 10 EDCE Cn1cc([C@H](O)C(=O)NCc2cc(Br)ccc2O)cn1 804738894 IMWJAMGAFPEKKF-LBPRGKRZSA-N 340.177 1.238 10 10 EDCE CC(=O)C(=O)COC(=O)[C@]1(C)CCCN(C(=O)c2ccccc2)C1 808521304 NRKOLLYZBCZTFA-GOSISDBHSA-N 331.368 1.630 10 10 EDCE C[C@@H](NC(=O)C(=O)N1CCO[C@@H](C2CC2)C1)c1ccc(N(C)C)cc1 807677691 RTRQSCUSLFRWOU-CXAGYDPISA-N 345.443 1.567 10 10 EDCE Cn1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)nc1O 822687394 AYJYHAXTRFMVPB-UHFFFAOYSA-N 334.351 1.031 10 10 EDCE CC1(O)CC(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 837716035 YHKSSLWKGRATNA-UHFFFAOYSA-N 340.370 1.579 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)NCc2nc(CO)n[nH]2)c1C 912941058 GWSFIIOVLZQOSC-UHFFFAOYSA-N 339.399 1.943 10 10 EDCE CS[C@H]1CCCCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)C1 846254677 GRCREBQECPCBJK-NSHDSACASA-N 336.417 1.851 10 10 EDCE O=S1(=O)CC[C@@]2(CN(Cc3c(O)ccc4ccccc34)CCO2)C1 842634380 UWUJCSDBDBQAOL-GOSISDBHSA-N 347.436 1.935 10 10 EDCE CCOC(=O)c1cnc(NC(=O)NCCc2ccc(O)c(O)c2)n1C 841711053 KFJWIZIDMZLAQH-UHFFFAOYSA-N 348.359 1.372 10 10 EDCE CCOC(=O)C1(CC(=O)NCc2c(O)cccc2F)CCOCC1 928709785 LKQGMQHYJOOTKL-UHFFFAOYSA-N 339.363 1.898 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CC[C@H](O)CC3)C2)cc1 852448981 OZGAUPIRZDAACT-DZKIICNBSA-N 333.432 1.877 10 10 EDCE Cc1cc(CC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccccc1 854278778 DAUFAZGLHMQUTE-MRXNPFEDSA-N 346.452 1.940 10 10 EDCE Nc1ccc(Cc2nc(C(=O)NC[C@@H]3CCC(=O)N3)cs2)cc1 852862875 LTBHAJMEKZSQLZ-LBPRGKRZSA-N 330.413 1.325 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1 860230482 MDPDKJJBXBLGRZ-JQWIXIFHSA-N 331.340 1.283 10 10 EDCE CC(C)(O)C[C@H](O)CNCc1ccc(N2CCC(O)CC2)c(F)c1 872203205 DBVCRYSAQXKYNI-HNNXBMFYSA-N 340.439 1.398 10 10 EDCE Cc1nnc2cc(NCc3ccc(N4CCN(C)CC4)cc3)ncn12 882880215 HYFFDRCEOLWALO-UHFFFAOYSA-N 337.431 1.797 10 10 EDCE Cc1nc([C@@H]2CCN(Cc3ccc(N4CCOCC4)cc3)C2)n[nH]1 895007270 AUGMRUHTZBFKAE-MRXNPFEDSA-N 327.432 1.939 10 10 EDCE COCc1nc([C@H]2COCCN2C(=O)c2cc(O)cs2)no1 780751075 RWLKOOPXLICMSJ-SECBINFHSA-N 325.346 1.197 10 10 EDCE COCC[C@@H](CO)NCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894654379 YBRCWVAEHYKXCU-LBPRGKRZSA-N 338.379 1.591 10 10 EDCE COC[C@@H](C)S(=O)(=O)NCc1cc(Br)ccc1O 796190972 OHKQIOCFIGNZFY-MRVPVSSYSA-N 338.223 1.609 10 10 EDCE C[C@H](C(=O)N(C)Cc1ccc(N2CCCC2)cc1)N1CCN(C)CC1 1136025259 CZRZHUJSVHQOLO-QGZVFWFLSA-N 344.503 1.881 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1nc(CN2CCCCC2)no1 1140594121 MNZXYJNUFFXWJY-UHFFFAOYSA-N 346.387 1.326 10 10 EDCE O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1C[C@@H]2CC[C@H]1N2 1357366252 GNWLVYJBEHPMLP-USXIJHARSA-N 331.485 1.997 10 10 EDCE COC(=O)[C@H](C[C@H]1CCCO1)NC(=O)/C=C/c1ccc(O)c(O)c1 1177476389 RBVOSQFHEFRPEO-JOVKLMRISA-N 335.356 1.338 10 10 EDCE O=C(CSCC(=O)N1CCCCC1)NCc1c(O)cccc1O 1178906008 WCAJMBHKQPFVQL-UHFFFAOYSA-N 338.429 1.460 10 10 EDCE CCC(=O)N(C)C[C@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1338628122 ACWFXIJIKCQFJN-ZDUSSCGKSA-N 349.391 1.150 10 10 EDCE CN1CCN(c2ccc(CN3C[C@@H]4C[C@H]3C[S@@]4=O)cc2F)CC1 1332609620 BRRYIZGXGYPYRF-NPGVVQFXSA-N 337.464 1.283 10 10 EDCE Cc1cc(CCN2C(=O)N[C@H](CO)C2=O)c(C)n1-c1ccccc1 1334371640 QTEDOXJYICSWEG-MRXNPFEDSA-N 327.384 1.549 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@]2(O)C[C@H]2C1 1330405702 WPIDVMRWJNHHOA-HNAYVOBHSA-N 346.427 1.504 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(C)C[C@@H]2CO)cc1Br 699492110 PBVZLQNCUALYCB-DGCLKSJQSA-N 342.281 1.842 10 10 EDCE C[C@@H](NS(=O)(=O)c1cccc(C(N)=O)c1)c1ccc(N(C)C)cc1 1255123245 GIXUSSSVYGQRED-GFCCVEGCSA-N 347.440 1.891 10 10 EDCE C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C)[C@@H]1O 1330333036 HRFTUCYCEKCCFR-HALDLXJZSA-N 347.459 1.186 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)CCC(F)(F)F)cc1C 1272389234 LPPULKMRWRSRCJ-ZDUSSCGKSA-N 348.365 1.913 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)C[C@H]2CCNC2=O)cc1C 1283619663 BAAKHQGJUYNTCH-GOEBONIOSA-N 347.459 1.466 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(S(C)(=O)=O)o1 1467841089 RXTYZDZDLFTCRT-UHFFFAOYSA-N 344.385 1.804 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)C(C)(C)C(N)=O)C(C)C)cc1C 1482535936 IGIYDYIAXAKCDG-HNNXBMFYSA-N 349.475 1.746 10 10 EDCE CN1C(=O)NCC12CN(c1ccc(CO)c(Br)c1)C2 2121182071 SSMKDIHKIYPWQA-UHFFFAOYSA-N 326.194 1.155 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@@H](C)n2cncn2)cc1C 1690566744 OAKITTFRHQTYAQ-UONOGXRCSA-N 331.420 1.451 10 10 EDCE COCCN1C(=O)/C(=C\c2ccc(N(C)C)cc2)C(=O)NC1=S 14136113 KRSMJXDGGDNKQN-RAXLEYEMSA-N 333.413 1.026 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCc2ncnn2C1 161340087 YLFDAOITTDLUNN-OAHLLOKOSA-N 342.447 1.891 10 10 EDCE COC(=O)NC[C@@H]1CCN1c1ccc(CO)cc1Br 2130740471 PPLRBLUSZMPCHR-JTQLQIEISA-N 329.194 1.876 10 10 EDCE O=C(O)[C@@H]1CCCN(C(=O)CNCc2cc(Cl)ccc2O)C1 1857868417 IHMIQFZKEMPZOR-SNVBAGLBSA-N 326.780 1.458 10 10 EDCE O=C(O)C=Cc1ccc(N2CCNC(=O)CC2)c(Br)c1 1911951259 OCLTXCYFJYIDFT-UHFFFAOYSA-N 339.189 1.873 10 10 EDCE O=C(c1ccc(O)c(O)c1)N(Cc1ccccc1)CC1(O)CNC1 1915493417 IEOJDIICNWEOMN-UHFFFAOYSA-N 328.368 1.075 10 10 EDCE CN(CC(=O)N1CCCC1)c1ccc(CN)c(Br)c1 228149500 HYESKHMVDHBGOT-UHFFFAOYSA-N 326.238 1.966 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)c(Br)c1 2149906811 BBIRGAGUJPWNIS-RAIGVLPGSA-N 344.249 1.930 10 10 EDCE Nc1ccc(CN=c2[nH]cnc(I)c2N)cc1 2008296801 JZFWFBCXIUXQLL-UHFFFAOYSA-N 341.156 1.280 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](OCC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010405671 KOPRRLRTLJQYTA-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE O=C1Nc2cc(N3CC[C@@H]4C[C@]4(O)C3)c(Br)cc2[C@H]1O 2171023610 DRIJETLHNCOXGP-PYSYBHHASA-N 339.189 1.396 10 10 EDCE O=C(O)[C@@]12COC[C@H]1CN(Cc1ccc(Br)cc1O)C2 2160994967 JXWNRUWPBWXPIV-YGRLFVJLSA-N 342.189 1.688 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)cc1Br 2178085381 FDQQPSRGDVHHJF-BHDSKKPTSA-N 345.212 1.490 10 10 EDCE COc1ccc([C@@H](C)n2nc(C(F)F)c(C(N)=O)c2N)c(O)c1 2079855197 LDNVJRKIVPKLPM-ZCFIWIBFSA-N 326.303 1.825 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)CO1 1908252708 DAZNJQIBZMBFQE-SRVKXCTJSA-N 339.396 1.827 10 10 EDCE Nc1ccc(OCCC(=O)N=c2nc(Br)[nH]s2)cc1 2110080159 GTMLLKZUFGHCHM-UHFFFAOYSA-N 343.206 1.712 10 10 EDCE CNCc1ccc(N(C)[C@@H]2CCCNC2=O)c(Br)c1 2114631789 MJJSRDXORZPAOF-CYBMUJFWSA-N 326.238 1.883 10 10 EDCE CC[C@H](C)N1C(=O)C(=CNCCc2ccccc2)C(=O)NC1=S 2296938432 NXNWSJHQKTZZRU-LBPRGKRZSA-N 331.441 1.744 10 10 EDCE COC(=O)CN1C(=O)C(=C2C(=O)Nc3ccc(C)cc32)SC1=S 2297465527 UJZVACMEDQNODP-UHFFFAOYSA-N 348.405 1.692 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2329326245 NDGLWLGBOQPOSX-QLHATJFASA-N 327.222 1.399 10 10 EDCE Cc1ccc(CN=c2[nH]nc(C(=O)O)o2)c(O)c1Br 2352619693 IGHAYWSBVPBUKL-UHFFFAOYSA-N 328.122 1.578 10 10 EDCE O=C([C@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2O)C1)N1CCOCC1 170908048 ZUVJQBQPFSKNKZ-ZDUSSCGKSA-N 349.387 1.371 10 10 EDCE COc1ccc(N2CCN(C(=O)c3c[nH]c(C)cc3=O)CC2)cc1 82320408 IFKJAXMMODKTNO-UHFFFAOYSA-N 327.384 1.654 10 10 EDCE C[C@@H](NC[C@H]1CCN(S(C)(=O)=O)C1)c1ccc(N(C)C)cc1 90796987 UYCPSUJSPGEJPK-ZIAGYGMSSA-N 325.478 1.685 10 10 EDCE Cc1ccc(CNCC2(C(=O)O)CN(C)C2)c(O)c1Br 2380742744 UZFDXGHDIZVHAT-UHFFFAOYSA-N 343.221 1.569 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H]1CCC2(CCOCC2)[C@@H]1O 283719092 UYMPXWUSVWHGDR-OMJDURBCSA-N 347.411 1.795 10 10 EDCE Cc1ccc(CN(C)c2nnc(O)nc2O)c(O)c1Br 2380778813 WTBDLRIEYXLMCP-UHFFFAOYSA-N 341.165 1.696 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H](F)C2CNC2)c(O)c1Br 2381129685 NLRHCVPJRMKKCT-GFCCVEGCSA-N 345.212 1.979 10 10 EDCE CCOc1cccc(CN[C@H]2CCC[C@@H]2CNS(C)(=O)=O)c1O 800309045 BVEPTMGIQIXFEB-OCCSQVGLSA-N 342.461 1.598 10 10 EDCE COc1ccc(CNC(=O)N[C@H](C)C2(S(C)(=O)=O)CC2)c(O)c1 805789874 MTBZAXIZGVZGRK-SNVBAGLBSA-N 342.417 1.166 10 10 EDCE COc1ccc(N2CC[C@](N)(C(=O)O)C2)c(OC)c1Br 2162623275 PEBXRPNGJXISGI-CYBMUJFWSA-N 345.193 1.459 10 10 EDCE COc1ccc(N2CC[C@@H](CNc3cncc(C(N)=O)n3)C2)cc1 819934918 ILIILLKSAQCEFL-LBPRGKRZSA-N 327.388 1.523 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@H](C)C(C)C)C2)cc1 828490299 BBHQFCIKQXTGNS-CABCVRRESA-N 347.459 1.798 10 10 EDCE C[C@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)CN1CCN(C)CC1 588406453 AEMMZAQOLXBHPK-KXQLTZBTSA-N 333.432 1.111 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3C[C@H]3CC)nc12 837979152 MOASYHAEUILLJG-MWLCHTKSSA-N 333.344 1.701 10 10 EDCE CCCn1nccc1NC(=O)C(=O)NCc1cc(OC)ccc1O 746404806 FNRGKQLWGYTHGY-UHFFFAOYSA-N 332.360 1.262 10 10 EDCE COc1cnc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)nc1 845814121 HIIOXHQJDAMTMM-UHFFFAOYSA-N 343.387 1.148 10 10 EDCE O=C(NCCC1(CO)CCC1)NCc1ccc(N2CCOCC2)cc1 844912695 JCHNQSBWXLXLHO-UHFFFAOYSA-N 347.459 1.875 10 10 EDCE C[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@H]1CN 923496410 IAGDYXOKFQHRGR-WBVHZDCISA-N 332.492 1.628 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NCC34CC(CN3)C4)C2)cc1 851667559 QGROFVUDLVYBPU-XVTSOASTSA-N 344.459 1.573 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCN[C@H](C)C3)C2)cc1 851668795 UQQATFBRUMUGCZ-KFWWJZLASA-N 332.448 1.714 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](O)C3CCOCC3)C2)cc1 855230709 IHAHFOSDHDBNNH-WMLDXEAASA-N 334.416 1.178 10 10 EDCE CCS(=O)(=O)C1(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)CC1 850555007 GMLOMNVBRCNQMS-SNVBAGLBSA-N 328.390 1.918 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC3CC2(C(=O)OC)C3)c([N+](=O)[O-])c1 853808769 IXIIZXYMUQRYKM-GQCTYLIASA-N 346.339 1.923 10 10 EDCE CO[C@H]1CC[C@H](C)N(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 867721396 UVVJIHPQOJCLQB-YOEHRIQHSA-N 347.459 1.737 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2C[C@H]3[C@H]4CC[C@@H](CN4)[C@H]3C2)c1O 863650896 BOGOOWPUXSWCIW-IGHBBLSQSA-N 333.388 1.739 10 10 EDCE C[C@@H](NC[C@]12COCCN1C(=O)OC2)c1ccc(Cl)cc1O 866520501 BUBMQEBAKKOIFR-MEBBXXQBSA-N 326.780 1.917 10 10 EDCE O=C(NCc1cccc(O)c1O)c1ccc(CN2CCOCC2)o1 1123977641 KQHIOTQGBOUFNG-UHFFFAOYSA-N 332.356 1.453 10 10 EDCE CCN1CC[C@H]1C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1152407576 RQMUXWNRFRKNFE-ZDUSSCGKSA-N 340.807 1.641 10 10 EDCE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cnn(CCO)c1 1160599514 LIVKQQCXRFPDDB-UHFFFAOYSA-N 330.171 1.818 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1C(C)(C)C1(F)F 1329630904 IQHPPZIEPBTYPN-LBPRGKRZSA-N 326.343 1.758 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)[C@@H](CO)C2)cc1Br 704792545 AIMUGLQIYVAPMM-MXWKQRLJSA-N 329.238 1.506 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)[C@H]2C[C@@H]2C)cc(OC)n1 1281035714 AYBCTHXWZVSCHG-GVXVVHGQSA-N 335.404 1.332 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C[C@H]2CCCO2)cc1C 1283733696 JJLJGAOMWBYSRV-HZPDHXFCSA-N 336.432 1.139 10 10 EDCE CCS(=O)(=O)N(C)CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1538975553 JBAAPZVRIHLNJC-LBPRGKRZSA-N 327.450 1.211 10 10 EDCE C[C@](NC(=O)Cc1ccc(O)c(O)c1)(C(N)=O)c1cccc(Cl)c1 1544940496 NGJOXMKNWKKDFP-QGZVFWFLSA-N 348.786 1.811 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccnnc3)cc2)CC1 1471912364 NTJQOYQVRNXAQP-UHFFFAOYSA-N 339.399 1.108 10 10 EDCE C[C@H](O)CNC[C@](C)(NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1714177573 JVIGUBZFQOVWGA-GTNSWQLSSA-N 347.419 1.718 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CCn2cncn2)cc1C 1715967318 IIKLQOICMXQKIP-AWEZNQCLSA-N 331.420 1.280 10 10 EDCE CC[C@H](NC(C)=O)C(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)C1 1480117121 IRSFRIBOBURXAA-IRXDYDNUSA-N 347.459 1.609 10 10 EDCE CCOCC(=O)N[C@H](C)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1725913562 ZPAZOIUFFPEOMQ-GHMZBOCLSA-N 349.391 1.509 10 10 EDCE COc1ccc(CN[C@H]2CN(C(=O)CN(C)C(C)=O)C[C@H]2C)cc1C 1570331976 CNTNUPIPFVUCLL-PBHICJAKSA-N 347.459 1.418 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)Cn2ccccc2=O)cc1C 1662415117 ONDBBNRLZRFPGK-OAHLLOKOSA-N 343.427 1.460 10 10 EDCE O=C1NC(=O)C(=CNc2ccc3nc4ccccc4nc3c2)C(=O)N1 15412101 CUZPPWIIYVOTTE-UHFFFAOYSA-N 333.307 1.445 10 10 EDCE Oc1cc2c(cc1CN1CCCN(c3cccnn3)CC1)OCO2 156324190 HNZGORIMVZTWEM-UHFFFAOYSA-N 328.372 1.623 10 10 EDCE Cc1ccc(C)n1[C@H](CC(=O)N[C@H]1CONC1=O)c1ccc(F)cc1 1851356974 AULQXRFOYQEPKG-JKSUJKDBSA-N 345.374 1.770 10 10 EDCE CN(C)[C@H]1COC[C@@H]1CNCc1cc(Br)cc(F)c1O 1924641110 PCSXVZHENBGIBW-GWCFXTLKSA-N 347.228 1.960 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1CC(=O)NCCN=[N+]=[N-] 1985093507 ALANQFKMXZWDHM-QWRGUYRKSA-N 327.385 1.733 10 10 EDCE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(Cc2cc(N)ccc2O)C1 1999475061 MPCRRHPUMMSVLX-SKDRFNHKSA-N 331.338 1.863 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H](O)[C@H]4C3)c(Br)cc2[C@@H]1O 2151389567 BAPMBWKVGOYXOA-UWMJUKQCSA-N 339.189 1.252 10 10 EDCE CN1CCO[C@H]2CN(c3cc(Br)c(CN)cc3F)C[C@@H]21 2153991240 POKGKUTWZINTSD-KBPBESRZSA-N 344.228 1.566 10 10 EDCE Cc1no[n+]([O-])c1COc1cccc(C=C2SC(=S)NC2=O)c1 2040386987 JWBCXISGXAVUMX-UHFFFAOYSA-N 349.393 1.684 10 10 EDCE C[C@@H]1C[C@H](CO)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2156547921 HPSFIRMHQXIUHM-UJVNDKKSSA-N 340.221 1.608 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@@H](C)O[C@](C)(C(F)F)C3)c2n1 2063585177 DHUGMGKFKHCMFS-PSLIRLAXSA-N 340.330 1.628 10 10 EDCE O=C(N[C@@]12C[C@@H]1CN(Cc1ccccc1)C2)c1cc(O)c(O)c(O)c1 2068618312 PISYNUICUQHCIX-AUUYWEPGSA-N 340.379 1.808 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2104424063 MELQUKUGBSFLIO-VJWDYSCTSA-N 327.222 1.399 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)[C@H]3C[C@@H](O)C3)c(Br)cc21 2232433902 MRLLORVMIMBFIF-BFHDXFOESA-N 340.221 1.621 10 10 EDCE N[C@@H]1[C@H]2C[C@@H](CN(Cc3cc(Br)ccc3O)C2)[C@@H]1CO 2239326136 LRWXUTPAVGKTEB-YARBFKLUSA-N 341.249 1.542 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)c(Br)c1 2355334490 OWCRJFDWJUDZFB-AQNFWKISSA-N 341.249 1.489 10 10 EDCE C[C@H]1C[C@H](NCCCO)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1277785102 FCFCOVFSAXSZJC-SWLSCSKDSA-N 347.419 1.814 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@H](O)[C@H]4C3)c(Br)cc2[C@H]1O 2358429769 BAPMBWKVGOYXOA-BKVLGDARSA-N 339.189 1.252 10 10 EDCE Cc1nccc(N2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)n1 183798204 UYPYIGHJWJEHMA-UHFFFAOYSA-N 329.360 1.721 10 10 EDCE O=C(O)/C=C/c1ccc(N2CC(=O)NC(=O)C2)c(Br)c1 236466329 YXSBLJPNNDRLTC-DUXPYHPUSA-N 339.145 1.010 10 10 EDCE CCN(CC)C(=O)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 240820588 BCYXGUGSTCSNED-UHFFFAOYSA-N 333.432 1.602 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C[C@@H]2CCOC2)nn1 528995921 JORSXBPXMURKFF-AAEUAGOBSA-N 346.387 1.087 10 10 EDCE Nc1ccc(N(C(=S)N(CCO)CCO)c2ccccc2)cc1 243429466 MYIXLPFQOKNXIA-UHFFFAOYSA-N 331.441 1.978 10 10 EDCE CCn1ncc(CNC(=O)NCc2c(O)ccc3c2CCCC3)n1 528086267 MDORTWWXYPLLDT-UHFFFAOYSA-N 329.404 1.882 10 10 EDCE COc1cc(N2CCC(c3nc(=O)[nH][nH]3)CC2)c([N+](=O)[O-])cc1OC 280957397 KMNSZFAMJLWIHV-UHFFFAOYSA-N 349.347 1.407 10 10 EDCE Cc1ccc(CN=c2cc[nH]cc2C(N)=O)c(O)c1Br 2380754151 NMONMPDAOBYJLO-UHFFFAOYSA-N 336.189 1.991 10 10 EDCE COC[C@@H](N)CC(=O)N(C)Cc1ccc(C)c(Br)c1O 2380759832 RRHPYMNOBNIEPX-NSHDSACASA-N 345.237 1.785 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3ccoc3)CC2)cc1 299301806 BYGUGERYVWBZOJ-UHFFFAOYSA-N 329.400 1.840 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCN1c1ncnc2sc(C)cc12 808529879 XHPHCDAXRDBXAA-GFCCVEGCSA-N 347.396 1.670 10 10 EDCE CC(=O)C(=O)COC(=O)C1(NC(=O)OC(C)(C)C)CCCCC1 808510477 VDBZRVRNINXCLP-UHFFFAOYSA-N 327.377 1.915 10 10 EDCE C[C@@H](NC(=O)c1cccn(C)c1=O)c1ccc(N2CCOCC2)cc1 729527521 OXTWWYDGOIGJDZ-CQSZACIVSA-N 341.411 1.713 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NC[C@H]3CCC[C@@H]3O)C2)cc1 824682033 UGNUMJBFCPDCJN-RKVPGOIHSA-N 347.459 1.982 10 10 EDCE Cc1cc(CC(=O)N(C)[C@@H]2CCNC2=O)c(C)n1-c1ccccc1 831345753 BFUDRSGSRBRZKB-QGZVFWFLSA-N 325.412 1.984 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc2c(c1)COB2O 584953513 DLLZTQLFZYGOIK-UHFFFAOYSA-N 338.172 1.010 10 10 EDCE CNc1cnc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 858625884 FQMIXPNQVOQBJJ-UHFFFAOYSA-N 345.378 1.424 10 10 EDCE CCOCc1cc(CNC(C)(C)CNS(C)(=O)=O)ccc1OC 922637401 CATXLVOWJZFUJQ-UHFFFAOYSA-N 344.477 1.649 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)C[C@H]3COCCO3)C2)cc1 852450457 MQRZYFSBSSLUFQ-PBHICJAKSA-N 349.431 1.331 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCN(Cc3nccn3C)CC2)c1O 750825783 KRVVKARCJGRQEO-UHFFFAOYSA-N 346.406 1.785 10 10 EDCE CO[C@H]1CS(=O)(=O)C[C@@H]1Nc1c(N)cccc1Br 697459558 DVSRWUPPHGSNEK-UWVGGRQHSA-N 335.223 1.255 10 10 EDCE CNCCCC(=O)N1CCC(N[C@@H]2CCc3cccc(O)c32)CC1 854231270 IISUVUZDQZRZRJ-MRXNPFEDSA-N 331.460 1.960 10 10 EDCE Cc1cc(Br)cc(CNC[C@@H]2COCCN2C)c1O 862508526 SWZVIKAOQCYHQB-CYBMUJFWSA-N 329.238 1.883 10 10 EDCE COC(=O)[C@@H]1CC[C@H](C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)O1 862001963 IAWGUWGARDADLY-XYPHTWIQSA-N 348.443 1.829 10 10 EDCE C[C@H]1C[C@H](NCC(C)(C)CS(N)(=O)=O)c2c(O)ccc(F)c21 866573771 YKMZSLFLUXCWBD-ONGXEEELSA-N 330.425 1.984 10 10 EDCE CC(=O)c1cc(F)cc(CN2C[C@]3(C)C(=O)NC(=O)[C@@]3(C)C2)c1O 879158175 OGFUTPSMTKSOGH-IAGOWNOFSA-N 334.347 1.219 10 10 EDCE CCOc1ccc(O)c(CN[C@@H]2CCN(C3CCOCC3)C2=O)c1 776230557 LBICICCRIMXYCV-MRXNPFEDSA-N 334.416 1.660 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cn1cnc([N+](=O)[O-])n1 1124549530 LWMPGSLMLLVLRZ-UHFFFAOYSA-N 344.375 1.445 10 10 EDCE OCc1nnn2c1CN(Cc1ccc(Br)cc1O)CC2 894809392 NIHZVZJCYRAABQ-UHFFFAOYSA-N 339.193 1.254 10 10 EDCE CNC(=O)C1(NCc2cc(Br)ccc2O)CCOCC1 895883063 AIZNMMWHLZVUPS-UHFFFAOYSA-N 343.221 1.540 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cccc(-c2nc(=O)o[nH]2)c1 1150487928 KUNXBXHBQVFWFL-UHFFFAOYSA-N 341.323 1.414 10 10 EDCE Oc1c(Br)cc(Cl)cc1CNCCc1nn[nH]n1 708057929 ZSUUWRSYCGNBSW-UHFFFAOYSA-N 332.589 1.654 10 10 EDCE CC[C@H](NC(C)=O)C(=O)N(C)[C@@H](C)CNCc1ccc(OC)c(C)c1 1271113041 KSFPCSBXMAMIQT-YOEHRIQHSA-N 349.475 1.855 10 10 EDCE O=C(Cn1ncnn1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1357323618 NAQWGFWJPQABED-UHFFFAOYSA-N 333.307 1.087 10 10 EDCE CN1C(=O)c2cccnc2O[C@@H]2CN(Cc3ccccc3O)C[C@H]21 1615259723 JUFGSRLKNSLIHK-GDBMZVCRSA-N 325.368 1.505 10 10 EDCE CC(C)(C)c1cn(C[C@@H]2OC[C@@H](O)[C@@H]2NCc2ccccc2O)nn1 1615716299 UOLYYZWXGXNOAV-VYDXJSESSA-N 346.431 1.199 10 10 EDCE CC(C)NCCOCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1718013195 VYIOOLDQFXCZTD-UHFFFAOYSA-N 335.408 1.936 10 10 EDCE COc1ccc(CNC[C@@]2(C)CCN(C(=O)CC(N)=O)C2)cc1C 1716860733 QIDAFMFXKGWTRA-GOSISDBHSA-N 333.432 1.207 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cn2nccc2C)cc1C 1567568248 DKBVLBSUYDTFKK-UHFFFAOYSA-N 330.432 1.757 10 10 EDCE COCCn1cc(CNC(=O)c2ccc(N=NC(N)=O)cc2)cn1 1633674613 ILCAKNKREATMEM-UHFFFAOYSA-N 330.348 1.622 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2c(C)cnn2C)cc1C 1567046138 PQLJTIJWUSBNLH-CQSZACIVSA-N 330.432 1.954 10 10 EDCE CSCC[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1nn[nH]n1 1646036703 CJXHZAWLJRJEMG-ATPLWMGHSA-N 335.389 1.235 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)CN2CCOCC2)cc1C 1570597821 CXZVXTXJCAQVDD-HZPDHXFCSA-N 349.475 1.319 10 10 EDCE C[C@@H](C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1740513482 FZVXMRPPQOCYES-SNVBAGLBSA-N 331.376 1.741 10 10 EDCE Cc1nc[nH]c1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1652068365 MQMITOOQRZILHO-UHFFFAOYSA-N 341.415 1.350 10 10 EDCE O=C(CC1(N2CCOCC2)CCCC1)NCc1cc(O)ccc1O 1593872953 IALPDJWZNALMQX-UHFFFAOYSA-N 334.416 1.749 10 10 EDCE C[C@H](O)CNC[C@]1(C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1671814656 BWAYKRLNNYASIR-SJCJKPOMSA-N 347.419 1.672 10 10 EDCE Nc1ccc(CS(=O)(=O)N(CCCO)Cc2ccccc2)cc1 1914638977 QBOSWRNMXMYRBC-UHFFFAOYSA-N 334.441 1.983 10 10 EDCE Cc1ccnc(CNC(=O)c2cc(O)nc(O)c2)c1Br 1927031318 SIDLZMLKTZAEBT-UHFFFAOYSA-N 338.161 1.889 10 10 EDCE CN(Cc1cc(N)ccc1O)C[C@H](O)CNC(=O)OC(C)(C)C 1977887360 CANAPKSYBNPPDV-CYBMUJFWSA-N 325.409 1.292 10 10 EDCE CN(c1ccc(N)cc1)S(=O)(=O)N1CC(OCc2ccccc2)C1 1998752542 OMPOAKLDURDMEU-UHFFFAOYSA-N 347.440 1.851 10 10 EDCE COc1ccc(N(C)C[C@@H](O)CN(C)C(=O)OC(C)(C)C)c(N)c1 1999533953 XYUBOTFMILKKTB-GFCCVEGCSA-N 339.436 1.941 10 10 EDCE CC(C)(C)OC(=O)NC1[C@H]2CN(C(=O)Cc3ccc(N)cc3)C[C@H]12 2000278205 HZOHNLLBBMZQPI-KBPBESRZSA-N 331.416 1.793 10 10 EDCE CCN(CCCO)c1cc2c(cc1Br)[C@H](NC)C(=O)N2 165210885 QNZZSCSDZFIPLA-ZDUSSCGKSA-N 342.237 1.870 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H](CN=[N+]=[N-])C1)C1COC1 2010402195 NIIONGRBZROCHG-PWSUYJOCSA-N 339.396 1.685 10 10 EDCE CN[C@H](C)c1ccc(N2CCO[C@H](CO)C2)cc1Br 300517903 REOGYKRUPDGWKG-PWSUYJOCSA-N 329.238 1.927 10 10 EDCE CCNCc1ccc(N2C[C@@H]3NC(=O)O[C@H]3C2)c(Br)c1 2176922223 WUOJGWRVBDUHQR-AAEUAGOBSA-N 340.221 1.856 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3COc4cccc(C)c4C3)c2n1 2062199760 ZGIRQYAHWSGZFQ-LBPRGKRZSA-N 338.367 1.785 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H](c3ccco3)N(C)C)c2n1 2062827187 SEIWJGXZQMULRH-GFCCVEGCSA-N 329.360 1.369 10 10 EDCE CC(C)(C)OC(=O)N1CC2(COCCN2Cc2cc(N)ccc2O)C1 2048703379 XOMJQEYDADBBML-UHFFFAOYSA-N 349.431 1.796 10 10 EDCE C[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1C(=O)c1ccc(O)c(O)c1 2054417098 ITJRTKDRSBTUPB-SCZZXKLOSA-N 346.305 1.769 10 10 EDCE CC(C)(C)OC(=O)NCCn1cnc(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)c1 2060635032 HCEWXVPPHGUJKM-LLVKDONJSA-N 349.395 1.933 10 10 EDCE CN(C)C(=O)[C@@H]1CCN(c2ccc(CN)c(Br)c2)C1 2087395650 JEHHCLKMOYYNOZ-LLVKDONJSA-N 326.238 1.822 10 10 EDCE CSc1cccc(N(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c1 101870313 JDEPLZZDVATHPO-CMDGGOBGSA-N 345.424 1.482 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](CO)C[C@@H]2CO)cc1Br 2089864583 VKONHADHOSVJKS-CKYFFXLPSA-N 330.222 1.682 10 10 EDCE CN(C)C(=O)OC1CN(c2ccc(CN)c(Br)c2)C1 2090304138 AACJMSHWPKESJT-UHFFFAOYSA-N 328.210 1.795 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H](C3)[C@H]4O)c(Br)cc2[C@H]1O 2286215615 WJUUKMPILAKNPK-NDHFTHCPSA-N 339.189 1.252 10 10 EDCE CSc1ccc(N(C)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)cc1 491882348 CPUWGXZKJVWQCO-YHYXMXQVSA-N 345.424 1.482 10 10 EDCE NCc1cc(F)c(N2CC3(COC(=O)N3)C2)cc1Br 2351822011 SAZXNANXGCSLDE-UHFFFAOYSA-N 330.157 1.346 10 10 EDCE Cc1ccc(CN(C)c2nc(=N)[nH]n2C)c(O)c1Br 2352663684 DMQXUMADWXCYJE-UHFFFAOYSA-N 326.198 1.641 10 10 EDCE Cc1ccc(CN2C[C@H](O)C[C@@H]2C(=O)O)c(O)c1Br 2352678042 FAXJJDMWFRTNGM-NXEZZACHSA-N 330.178 1.483 10 10 EDCE Nc1ccc(N(C(=O)C(=O)N2CCOCC2)c2ccccc2)cc1 170347804 OAPRDIMVBOEADV-UHFFFAOYSA-N 325.368 1.792 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H]4OCCC[C@H]4C3)cc2N1 301694625 ALSDWARYGBMAIH-IINYFYTJSA-N 333.344 1.931 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCC[C@@]1(C)C(N)=O 185885360 RZNIAGMQPPPJEP-IBGZPJMESA-N 346.475 1.441 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@H]3O 249359943 AEYJZMODNUBIRZ-AEIBSFOJSA-N 339.439 1.974 10 10 EDCE Cc1ccc(O)c([C@H](C)NC[C@]2(CO)COCC3(CCC3)N2C)c1 527956668 QXYYDWIXTQSXAX-KXBFYZLASA-N 334.460 1.967 10 10 EDCE CCn1nccc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)cc1 274482321 XUKRRMMPNXJMKH-UHFFFAOYSA-N 344.418 1.075 10 10 EDCE CC1CCN(c2ccc(CNC(=O)C(=O)N(C)[C@@H](C)CO)cc2)CC1 288010559 GXIAYNHODCYVBZ-HNNXBMFYSA-N 347.459 1.378 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2CCC(=O)N2)c(O)c1Br 2380770665 CWEBXVLGBZYIMK-SNVBAGLBSA-N 341.205 1.700 10 10 EDCE CCCC(=O)NCC(=O)NCc1cc(Br)ccc1O 804739658 NRZRLVLHFKKOIS-UHFFFAOYSA-N 329.194 1.687 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC=C[C@H](O)C3)c(Br)cc21 2165067362 FZGXGWGVBOXVKV-ISVAXAHUSA-N 338.205 1.399 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@@H](c3nc[nH]n3)C2)c([N+](=O)[O-])c1 819948471 FUYWEQNEHYYDRZ-KTLBGCOUSA-N 343.343 1.893 10 10 EDCE Cc1cc(CC(=O)N[C@@H]2CCN(C(N)=O)C2)c(C)n1-c1ccccc1 827470751 IFUZHHZLYFCROL-MRXNPFEDSA-N 340.427 1.906 10 10 EDCE CN(Cc1cc[nH]n1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 732673781 DWLOTPDHXZUBBM-UHFFFAOYSA-N 347.394 1.727 10 10 EDCE CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)NCc2c(O)cccc2F)C1 918844443 DMBKRRGQVYVHDC-NEPJUHHUSA-N 337.395 1.978 10 10 EDCE CN(C[C@@H](O)CN1CCOCC1)c1ccc(-c2nccs2)cc1 846994352 VNRJJSIYBZXURI-MRXNPFEDSA-N 333.457 1.939 10 10 EDCE COCC[C@H]1CCCCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)C1 846259670 SSJLXOYDPZYXCW-GFCCVEGCSA-N 348.403 1.772 10 10 EDCE Cc1cc(C(=O)Cn2nc(C)n(C)c2=O)c(C)n1-c1ccc(F)cn1 844772200 PATDTDZFDXCRTH-UHFFFAOYSA-N 343.362 1.715 10 10 EDCE CCN(CC)c1ccc(CN(C)C[C@@H](O)C2(O)CCOCC2)cc1 929185185 PGBVXAAOMJYVTR-GOSISDBHSA-N 336.476 1.867 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3C[C@H](O)C34CCC4)C2)cc1 854297157 NTHSFVKMVZYOQX-JQFCIGGWSA-N 345.443 1.877 10 10 EDCE COc1ccc(N2CCN(C(=O)C(C)(C)n3cccn3)CC2)cc1 854198303 HOYMCQACKPFZBI-UHFFFAOYSA-N 328.416 1.976 10 10 EDCE CCN(C[C@@H](C)O)c1cc2c(cc1Br)[C@@H](NC)C(=O)N2 691437288 WYVNUCNNVKNWIT-AMIZOPFISA-N 342.237 1.869 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCC(=O)N(C)C3)C2)cc1 852134344 YAWJDYPWODZFMZ-KGLIPLIRSA-N 346.431 1.194 10 10 EDCE COC(=O)[C@H](C[C@@H]1CCCOC1)NC(=O)/C=C\c1ccc(O)c(O)c1 862995995 GHIXBJPHDFOTCC-XVMAMZMSSA-N 349.383 1.586 10 10 EDCE NS(=O)(=O)C[C@@H]1CCCN1Cc1cc(Br)ccc1O 769427195 INQLDKXBUFDXPU-NSHDSACASA-N 349.250 1.408 10 10 EDCE CN(C)c1ccc(CNC(=O)C2CN(C3CCOCC3)C2)cc1F 895981041 PMARWVQTRRGZAD-UHFFFAOYSA-N 335.423 1.619 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCc2ccccc2O)CCOC1 1963718228 YTOJSOVSFUJXMI-QGZVFWFLSA-N 336.388 1.692 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C 1963341433 JDGDPJGTABZCKW-AWEZNQCLSA-N 338.404 1.626 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H](CNCCO)C2)cc1 1317166582 MKODAHRSPGYSBY-GFCCVEGCSA-N 333.392 1.283 10 10 EDCE CCc1cccc(CN2CCN([C@]3(C(=O)OC)CCOC3)CC2)c1O 1329067326 OINZYFHECRRPPC-LJQANCHMSA-N 348.443 1.404 10 10 EDCE Oc1cccc(Br)c1CN1CCO[C@@]2(CCNC2)C1 717499757 ZRINVHBDUVJNMC-CQSZACIVSA-N 327.222 1.719 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)C[C@H]2CCC(=O)N2)cc1C 1331584316 KPGAVRODSFTDNZ-GDBMZVCRSA-N 347.459 1.609 10 10 EDCE [N-]=[N+]=NCCN[C@H](C(N)=O)c1cc(Br)c2c(c1)OCO2 90258114 OOQLRGBGJGMUNL-VIFPVBQESA-N 342.153 1.604 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3C=CCC3)C2)cc1 1330652827 HRQMDPGZHDOPJK-ZIAGYGMSSA-N 329.400 1.225 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H](CO)Cc2ccc(O)cc2)cc1 1546107919 FMGMSFCFUSGARI-CQSZACIVSA-N 342.355 1.888 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2CCNC(=O)C2)cc1C 1485868096 RNOCTHRNZAEQLJ-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE Cn1cc([C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)c2ncon2)cn1 1625165058 DCIUGZWUSMFOOA-UYWPIULCSA-N 341.327 1.133 10 10 EDCE C[C@@H](NCc1cc(Br)cc(F)c1O)c1nc(=O)o[nH]1 2121353115 KUVXNNHQZUSSNN-RXMQYKEDSA-N 332.129 1.821 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1cccnc1OCCO 1627689620 OTVJAIFXQTYBLS-UHFFFAOYSA-N 329.400 1.757 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCn1ncnn1 1635673536 QRJITPRYMBJKDG-UHFFFAOYSA-N 338.371 1.323 10 10 EDCE C[C@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C[C@H]1O 1565126918 GGVBVFLGNSNNTI-KBXCAEBGSA-N 347.459 1.560 10 10 EDCE Cc1cn2c(=O)c(C(=O)NCc3cc(O)ccc3O)cnc2s1 1651225805 YXZLFSDJZWEYMD-UHFFFAOYSA-N 331.353 1.406 10 10 EDCE CC(C)[C@@H]1C[C@H]1C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1742543641 LRIFNSZQPOJYHS-UONOGXRCSA-N 345.403 1.987 10 10 EDCE COc1cc(CC(=O)NCc2cc(O)ccc2O)cc(OC)c1OC 1593872966 IOECDKFNDMRMKW-UHFFFAOYSA-N 347.367 1.983 10 10 EDCE NCc1ccc(N2CCC(OCCO)CC2)cc1Br 228154828 SCZGFQVKDUIDCP-UHFFFAOYSA-N 329.238 1.886 10 10 EDCE CO[C@@H](CCNC(=O)OC(C)(C)C)[C@@H](N)Cc1ccc(O)c(O)c1 1952754358 DOVLWYYDJOOOJK-WFASDCNBSA-N 340.420 1.897 10 10 EDCE N[C@H](Cc1ccc(O)c(O)c1)C(=O)OCCOCc1ccccc1 2007820533 GCPHFWLBMNDNFZ-OAHLLOKOSA-N 331.368 1.728 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010406053 PLLKYVTUSHSSDL-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE Oc1ccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)c(O)c1O 702566570 JTDNBGMHUDVBHE-IBGZPJMESA-N 344.411 1.530 10 10 EDCE CN1CCO[C@H](CN(C)c2ccc(CO)c(Br)c2)C1 707869528 SMURWBWWMIINON-ZDUSSCGKSA-N 329.238 1.708 10 10 EDCE C[C@@H](O)CN1CCN(c2cc(Br)c(CN)cc2F)CC1 2170220814 KMWCCVBDWQWRPQ-SNVBAGLBSA-N 346.244 1.550 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CNC(=O)Cc2ccc(N)cc2)[C@@H](O)C1 2044205550 ACGGMIDHESMTLW-ZFWWWQNUSA-N 349.431 1.155 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CC(C(=O)N2CCc3cccnc32)=C[C@H]1O 2080945649 HIBIYHRRNKNHEZ-UONOGXRCSA-N 345.399 1.555 10 10 EDCE CN(C)C[C@@H]1COCCN1c1ccc(CN)cc1Br 2096927561 GRBIEDVZVGKATQ-GFCCVEGCSA-N 328.254 1.675 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2CCC(=O)NC2)c1O 2208739626 URJHGDGTTYPZMQ-SECBINFHSA-N 343.221 1.779 10 10 EDCE COc1ccc(N2CC[C@@H]2[C@@H](O)CO)c(OC)c1Br 2270692702 BVGJECRNCFFYQT-SCZZXKLOSA-N 332.194 1.398 10 10 EDCE CO[C@@H](CNC(=O)Nc1ccc(N)cc1)CNC(=O)OC(C)(C)C 2301725360 NLDVWXBXHPYUTL-ZDUSSCGKSA-N 338.408 1.930 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2COCCN2)c(O)c1Br 2352645374 JAGYIJTZWWZSFU-SNVBAGLBSA-N 329.194 1.068 10 10 EDCE COC1(C(N)=O)CN(Cc2ccc(C)c(Br)c2O)C1 2352950226 PKNPXZDWFQXXSB-UHFFFAOYSA-N 329.194 1.149 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cnc3c(cnn3C)c2O)cc1 179393966 CQLSRQIZKXAWJP-UHFFFAOYSA-N 325.372 1.670 10 10 EDCE CNC(=O)c1cccnc1N(C)Cc1ccc(N2CCOCC2)cc1 301376933 WIKOQRUDQDGTPD-UHFFFAOYSA-N 340.427 1.914 10 10 EDCE O=C(N1CCOCC1)N1CCN(c2ccc3c(c2)OCCO3)CC1 41380206 NTZBGESRQBBIGJ-UHFFFAOYSA-N 333.388 1.032 10 10 EDCE CCNC(=O)C1CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 254953815 CPWGCUZZXNHZSM-YVMONPNESA-N 343.427 1.131 10 10 EDCE COC(=O)c1cn(CCNCc2cc(Cl)c(F)cc2O)nn1 294483771 AQLCEDDRGPFCMD-UHFFFAOYSA-N 328.731 1.353 10 10 EDCE CN1CCc2cc([C@H](NN)c3c(Br)nnn3C)ccc21 2163150549 XDMAVVVGBSPIHH-NSHDSACASA-N 337.225 1.123 10 10 EDCE C[C@H](NC(=O)[C@H](N)C(F)(F)F)c1ccc(N2CCOCC2)cc1 827726345 XOURNWJESRUPHF-GWCFXTLKSA-N 331.338 1.590 10 10 EDCE C[C@@H](O)C[C@H]1COCCN1C(=O)c1cc2cc(O)c(O)cc2s1 907416058 GAKZXTPUVDJZMR-KOLCDFICSA-N 337.397 1.924 10 10 EDCE N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 830663933 DWHDBQOHLKUZEK-DDTOSNHZSA-N 325.359 1.720 10 10 EDCE CC[C@@H](CNS(C)(=O)=O)NC/C=C\c1ccc(N(C)C)cc1 835053568 DHYSEDGFEGUPRQ-XHPSBEMXSA-N 325.478 1.683 10 10 EDCE COc1ccc(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)c(O)c1 832178672 VTTHLNXLDNBMMA-QIIPPGSGSA-N 334.416 1.550 10 10 EDCE COCc1nc(C(=O)N(C)CCN(C)c2ccc(OC)cc2)n(C)n1 853809126 OFAKVLMKKVNRAC-UHFFFAOYSA-N 347.419 1.179 10 10 EDCE CO[C@]1(CN2C(=O)CN(Cc3ccccc3O)C2=O)CCSC1 925200927 KIDAXMFCAZFCPT-INIZCTEOSA-N 336.413 1.679 10 10 EDCE CCOC[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 858762727 LUCGQWAIYWSWKZ-JTQLQIEISA-N 337.332 1.167 10 10 EDCE COc1cccc(CNC(=O)c2cc(S(C)(=O)=O)oc2C)c1O 860241721 SSULHBOLUQGGSS-UHFFFAOYSA-N 339.369 1.636 10 10 EDCE CCO[C@@H]1COCC[C@H]1CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 867302872 VFSJAYYSFIQTER-HACGYAERSA-N 337.416 1.977 10 10 EDCE COc1cccc(CNCCn2ncc(Br)n2)c1O 1875993499 ACEVPSSDFDGRNX-UHFFFAOYSA-N 327.182 1.545 10 10 EDCE C[C@H](NC(=O)N1CC[C@@]2(CNC(=O)C2)C1)c1ccc(N(C)C)cc1 789213743 SCYFFBVHCIOGRA-SCLBCKFNSA-N 330.432 1.735 10 10 EDCE OC[C@H]1CC(F)(F)CN1Cc1ccc(N2CCOCC2)c(F)c1 783703265 WWRWPBVPXUFCBT-CYBMUJFWSA-N 330.350 1.864 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H](C)n2cncn2)cc1C 1328329406 WXPCMDJMGPKTGY-GJZGRUSLSA-N 345.447 1.841 10 10 EDCE O=C(O)[C@]12CN(Cc3ccc(Br)cc3O)C[C@H]1CCO2 707652288 SMUQAEFBYLAZOM-YGRLFVJLSA-N 342.189 1.830 10 10 EDCE COC(C)(C)[C@@H](C)NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1333430902 YIBFVXTTYYIDMN-CHWSQXEVSA-N 335.448 1.860 10 10 EDCE CS(=O)(=O)N[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2O)C1 93531137 MSIHPWYLUYXVQO-SNVBAGLBSA-N 339.244 1.823 10 10 EDCE O=C(C(=O)N1CC(Cc2ccco2)C1)N1Cc2cccc(O)c2C1 1332074583 MVMBROPVZPFYDJ-UHFFFAOYSA-N 326.352 1.529 10 10 EDCE COc1ccc(CNC[C@@H]2CCN(C(=O)[C@H](C)CC(N)=O)C2)cc1C 1267052480 DLIQLSKSRCNKRT-ZBFHGGJFSA-N 347.459 1.453 10 10 EDCE Cn1ncc(CNCc2ccc(N3CCOCC3)c(F)c2)c1C(=O)O 1350668080 OUFZUPHTYOGROF-UHFFFAOYSA-N 348.378 1.384 10 10 EDCE C[S@@](=O)C1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2115310633 ONWOPKAJEXLJNM-JEOXALJRSA-N 345.218 1.002 10 10 EDCE COC1CCN(c2ccc(CN3CCC(NC(N)=O)CC3)cc2)CC1 1459606561 UHMJFXPIHHBSIX-UHFFFAOYSA-N 346.475 1.935 10 10 EDCE CC[C@@H](C)OCC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1522589282 JLRACHIEPIIPHX-LLVKDONJSA-N 349.391 1.510 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(C(=O)N2CCCC2)CC1 1539718537 GDUPPMJFJKQZTA-UHFFFAOYSA-N 332.400 1.501 10 10 EDCE COC(=O)c1cc2n(n1)CCC[C@H]2NC(=O)NCc1ccccc1O 1471530432 NXUIZGMMJYQUDS-GFCCVEGCSA-N 344.371 1.710 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2ccnn2C)cc1C 1715787562 BSAFPVJFAXASRF-PLNGDYQASA-N 328.416 1.813 10 10 EDCE CS(=O)(=O)c1ccccc1CC(=O)NCc1c(O)cccc1F 1635367031 WLODMODFPRPQQK-UHFFFAOYSA-N 337.372 1.794 10 10 EDCE C[C@H]1CN(C[C@@H](C)O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1633634089 RLJMIRVBLMZASO-NWDGAFQWSA-N 333.392 1.376 10 10 EDCE CNC(=O)C1(C(=O)N[C@@H](C)[C@@H](C)NCc2ccc(OC)c(C)c2)CC1 1733994524 SQASBICMZILUDZ-KGLIPLIRSA-N 347.459 1.513 10 10 EDCE CCn1cc(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)nn1 1731968800 VTYASRNGTOHXKZ-UHFFFAOYSA-N 331.420 1.477 10 10 EDCE C[C@@H](CN(C)C[C@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1669936409 OAMVRKZKEWUDGD-QWHCGFSZSA-N 347.419 1.936 10 10 EDCE Cc1nc(CCNC(=O)c2cc(O)c(O)c(O)c2)sc1C(=O)O 1865875633 CXGUNFMJLDMGRJ-UHFFFAOYSA-N 338.341 1.239 10 10 EDCE CC(=O)C(=O)[C@@]1(O)CCCN(C(=O)OC(C)(C)C)[C@H]1C(F)(F)F 1903077735 XZXXKSWMMXFTKU-MFKMUULPSA-N 339.310 1.837 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)[C@H](CCO)C2)c(Br)c1 2149912519 DKSXBNDNUFDIQM-RTXFEEFZSA-N 343.265 1.896 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)[C@H](CCO)C2)cc1Br 2149908173 QMAGTSUZZBIECF-UTUOFQBUSA-N 344.249 1.930 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(N)cc2)[C@H](CO)C1 2005085285 NYJFRLNJQDHQMN-GOEBONIOSA-N 335.448 1.976 10 10 EDCE C[C@H](O)c1ccc(N2CCOC[C@@H]2[C@@H](O)CO)c(Br)c1 2146324180 SPLWICDAIJUXLB-FZZIBODNSA-N 346.221 1.061 10 10 EDCE CN(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003166511 HJKZJFQWKITTKM-AVGNSLFASA-N 341.452 1.097 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2010395829 LDZJFTIFNZTNMC-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE CC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)c1cc(O)c(O)c(O)c1 2015123236 QYJCCZQPTHBPLB-JTQLQIEISA-N 340.376 1.837 10 10 EDCE C[C@H](C(=O)Nc1ccc(N)cc1)N1CC(CNC(=O)C(F)(F)F)C1 2044608605 PQZVMYQQEATHJL-SECBINFHSA-N 344.337 1.206 10 10 EDCE CN(C(=O)[C@H]1C[C@H](O)CN(C(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2080778903 PZEWHNUBIKRLNE-WFASDCNBSA-N 349.431 1.850 10 10 EDCE O=C1C[C@@H]2CCN(Cc3ccc(Br)cc3O)C[C@@H]2N1 2088807151 YBVRPHPWOBEJID-CABZTGNLSA-N 325.206 1.865 10 10 EDCE NCc1ccc(N2CC(=O)N[C@H]3CC[C@H]32)c(F)c1Br 2112067708 WFWYMDGTVYIYJV-DTWKUNHWSA-N 328.185 1.514 10 10 EDCE CS(=O)(=O)C[C@H]1CCCN1c1ccc(CN)cc1Br 2094926672 JNXXCGJYSGEKSC-LLVKDONJSA-N 347.278 1.921 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@H](CO)C2)c(Br)c1 2098210103 XBHZZOJMPGHNLR-QWRGUYRKSA-N 329.238 1.914 10 10 EDCE CC(C)N1CCN(c2ccc(CO)cc2Br)CC1=O 2114173016 NJVXRXPDZCRQOR-UHFFFAOYSA-N 327.222 1.998 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@@H]1C(=O)NCc1ccc(N)cc1 2253581546 KPZXQDCMECHCPV-HUUCEWRRSA-N 349.431 1.645 10 10 EDCE NC(=O)[C@H]1C[C@@H](N)CN(c2ccc(OCc3ccccc3)cc2)C1 2299504274 LZAOZSWIGLWRRI-JKSUJKDBSA-N 325.412 1.905 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCN(C(C)=O)C3)CC2)cc1 175261651 BYUAEILZZUBYJX-OAHLLOKOSA-N 331.416 1.212 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)N[C@@H]3C[C@@H]3C)CC2)cc1 170806286 HEYGEZGQIHGOAX-MAUKXSAKSA-N 346.475 1.915 10 10 EDCE CCCCN1C(=O)/C(=C\NNCCN(CC)CC)C(O)=NC1=S 38162099 XHKGPQVMGBTNJZ-QXMHVHEDSA-N 341.481 1.190 10 10 EDCE COc1ccc(N2CCN(C(=O)C3CCOCC3)CC2)cc1OC 242956742 HIDWYLNXUYVOIX-UHFFFAOYSA-N 334.416 1.779 10 10 EDCE Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)c1cccc(O)c1O 365755944 BNPVWEHCZVVSJY-CYBMUJFWSA-N 331.372 1.662 10 10 EDCE CO[C@@H](C)[C@@H](C)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 290939549 ZWFFTQOQWVLONK-OLZOCXBDSA-N 339.411 1.885 10 10 EDCE CO[C@H]1COCC[C@@H]1CC(=O)N1CCOc2cc(N(C)C)ccc21 294857726 GCUFGKVWOJGFIJ-DYVFJYSZSA-N 334.416 1.920 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]12[C@H]3C(=O)[C@H]4[C@H]5C[C@@H]([C@@H]41)[C@H]2[C@H]53 800532512 QQPSOKPJUJRHHX-LRMZVENNSA-N 339.391 1.472 10 10 EDCE OC[C@H]1CCCN(c2cc(NCCc3ccc(O)c(O)c3)ncn2)C1 811810855 GIPIGJIPWFOCRM-AWEZNQCLSA-N 344.415 1.751 10 10 EDCE Cc1cc(C(=O)N2CCN(CCO)C[C@@H]2C)c(C)n1-c1ccccn1 837193810 ZHPKAMXACCLORD-HNNXBMFYSA-N 342.443 1.628 10 10 EDCE CN1C[C@@H](O)C[C@]1(C)C(=O)NCc1ccc(N2CCCCC2)cc1 900405593 YVINMWUJKNUTON-PKOBYXMFSA-N 331.460 1.748 10 10 EDCE NC(=O)C1CCC(NC(=O)NCc2cc(Cl)ccc2O)CC1 845020096 OOAJUKJVCOIMDK-UHFFFAOYSA-N 325.796 1.889 10 10 EDCE O=C1N[C@@]2(C(=O)NCc3ccc(N4CCCC4)cc3)C[C@H]3C[C@@H]1[C@H]2C3 845192737 QCUAQZCNCHEVBH-MCNSXXNHSA-N 339.439 1.818 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCN2C[C@H](O)C[C@H]2C1 847318397 IKXIGTPUTQAFOH-DLBZAZTESA-N 332.448 1.021 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@H]1CN(C2CC2)C(=O)O1 847318028 CFLYCAYXGVQECC-MRXNPFEDSA-N 346.431 1.843 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)c3n[nH]c(C)n3)C2)cc1 854296025 ACVWTVCBXVTESE-WCQYABFASA-N 344.419 1.761 10 10 EDCE CC[S@](=O)CCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852117917 BIGZQCOFJMULJG-ZLOXQWCVSA-N 339.461 1.342 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCC1=O 923336521 FMSVECYJEOUZPP-CQSZACIVSA-N 345.443 1.768 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)[C@@H]3CCOC3)C2)cc1 852146824 IWZWBGMGAUYUHV-ZNMIVQPWSA-N 333.432 1.998 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)c3cncnc3)C2)cc1 855227078 WDQQBSLQYPGSNN-HIFRSBDPSA-N 326.400 1.984 10 10 EDCE COc1ccc(N2CC[C@H](N[C@H](C3CC3)[C@@H]3CNCCO3)C2)cc1 854216936 HLXXEIZFYGLBNT-ZYSHUDEJSA-N 331.460 1.631 10 10 EDCE C[C@@H]1CCC[C@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)O1 850602265 SREVGVADZSTUQF-RHSMWYFYSA-N 347.459 1.785 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3csc(CO)n3)C2)cc1 869227917 CZUPIMTXFJGZBL-LLVKDONJSA-N 333.413 1.653 10 10 EDCE COc1cc(O)c(CN2C[C@@H](O)CC3(CCOCC3)C2)cc1OC 1119450949 QKCVIYDGLOLVKT-AWEZNQCLSA-N 337.416 1.773 10 10 EDCE COc1cccc(CNC(=O)C(=O)Nc2ccc3nccn3c2)c1O 774261016 DXSBIMAFKQZIBP-UHFFFAOYSA-N 340.339 1.303 10 10 EDCE COCCN(Cc1ccnn1C)C(=O)/C=C\c1ccc(O)c(O)c1 787860393 XFNNQBREVJNHLR-XQRVVYSFSA-N 331.372 1.520 10 10 EDCE CCN(CC)c1ccc(CN2CCn3nnc(CO)c3C2)cc1F 894804362 CBSSGQJIWIAXLD-UHFFFAOYSA-N 333.411 1.772 10 10 EDCE CC1(C)[C@@H](O)C[C@]1(CO)NCc1ccc(Br)cc1O 1879557808 DTBSGHIJYGUVEU-GXTWGEPZSA-N 330.222 1.766 10 10 EDCE CN1CCN(C)CC(C(=O)NCc2c(O)ccc3ccccc23)C1 1157051034 OHWMLGXYUVHCNM-UHFFFAOYSA-N 327.428 1.655 10 10 EDCE CCN1CCO[C@@H](CNCc2ccc(Br)cc2O)C1 691500226 DVDLMBRYUICKGU-ZDUSSCGKSA-N 329.238 1.965 10 10 EDCE COC[C@H]1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 92776011 BVVPXWQKSNLDDM-SDBXPKJASA-N 340.221 1.874 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2nnn(C)c2C)cc1C 1270380072 WNPIBWCSHFDZJN-GFCCVEGCSA-N 345.447 1.596 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccnc(O)c1Br 1299572957 HWCUBDNUSRSTLV-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE O=C(CSc1nnc2ccccn12)NCc1cccc(O)c1O 1455316746 QOAOMQSTSINZMU-UHFFFAOYSA-N 330.369 1.549 10 10 EDCE Cn1nnc2cc(C(=O)NCc3ccc4cccnc4c3O)cnc21 1299721346 HPSQLTXEZCKYLO-UHFFFAOYSA-N 334.339 1.547 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nc(OC)cc(OC)n1 1297562273 FMWAKDURCAGRPY-UHFFFAOYSA-N 338.360 1.615 10 10 EDCE Cc1nccn1CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1544538873 VGHVKGCHUJSENI-UHFFFAOYSA-N 342.443 1.717 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CCCN1C(=O)CCC1=O 1623573431 ARULXQYBGVTREN-UHFFFAOYSA-N 339.388 1.423 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H]2CCNC(=O)C2)cc1C 1482271904 HGRYMAYZTLOHPP-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE NS(=O)(=O)c1ccc(C(=O)NCc2cc(Cl)ccc2O)s1 1639966144 WAWSMHULVROAEF-UHFFFAOYSA-N 346.817 1.685 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2n(n1)CCCC2=O 1567467426 JCWFPJUOBKRMBP-SNVBAGLBSA-N 329.356 1.632 10 10 EDCE O=C(NCc1ccc(CN2CCNC2=O)cc1)c1cccc(O)c1O 1635774811 SNEGURODIAYIMT-UHFFFAOYSA-N 341.367 1.553 10 10 EDCE Cc1ccc(S(N)(=O)=O)cc1C(=O)NCc1c(O)cccc1F 1646029366 WQIZGADMDNPHIL-UHFFFAOYSA-N 338.360 1.417 10 10 EDCE CC[C@@H]1C[C@H]1C(=O)N(C)C[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1572305969 VNLGMQMSWUYZOR-OUCADQQQSA-N 349.431 1.722 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@H]2CCCC(=O)N2)cc1C 1690600113 OPBYMRIORQYPMT-GOEBONIOSA-N 347.459 1.657 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)C(C)(C)C(=O)O)c2nccn2C)cc1 1865994986 SYTYQOMOZHXHNT-AWEZNQCLSA-N 344.415 1.803 10 10 EDCE NCc1cc(F)c(N2C[C@]3(CO)C[C@]3(CO)C2)cc1Br 2146313425 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NHMJQSWGPDOSBL-BXUZGUMPSA-N 327.222 1.704 10 10 EDCE COC(=O)CC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)NCCCO 2294474389 NXLPHJFYRFLNLK-UHFFFAOYSA-N 349.362 1.337 10 10 EDCE CCOC(=O)[C@H](Cc1ccccc1)N1C(=O)C(=CN)SC1=S 2294778336 URMANJNMAUYYOL-NSHDSACASA-N 336.438 1.821 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)C1(O)CCC1 2300530291 ODNIAQWKWMMTJK-LLVKDONJSA-N 341.412 1.954 10 10 EDCE [N-]=[N+]=NCCCNc1cccc2c1CN([C@@H]1CCC(=O)NC1=O)C2=O 2325739663 BUOALKMQQKQMCO-CYBMUJFWSA-N 342.359 1.560 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2COC[C@@H]2N)c(O)c1Br 2352620207 NUWCKDMSLNWFPI-ZJUUUORDSA-N 329.194 1.053 10 10 EDCE O=C([C@H]1CCCO1)N1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1 170905806 IGYBISKIQBWPSD-OAHLLOKOSA-N 335.360 1.124 10 10 EDCE COc1cccc(CNC(=O)NCCc2c(C)nn(C)c2C)c1O 174036552 MYZURGMATOTVJC-UHFFFAOYSA-N 332.404 1.793 10 10 EDCE O=C(O)/C=C/c1ccc(N2CC(=O)NC(=O)C2)cc1Br 236466358 QYGPEEDZENSARH-DUXPYHPUSA-N 339.145 1.010 10 10 EDCE CCOC(=O)C[C@@H]1C[C@@H](OC)CN1Cc1cc2c(cc1O)OCO2 376949299 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862026186 IAOMFUMFQJFYQU-RKQHPOSBSA-N 346.386 1.884 10 10 EDCE Fc1cc(CN2CCO[C@]3(CCOC3)C2)ccc1N1CCOCC1 769556462 LHNYCEYCECARMK-GOSISDBHSA-N 336.407 1.654 10 10 EDCE C[C@@H](NCc1ccc(N2CCOCC2)c(F)c1)c1nnc(O)n1C 895182304 WEOTZPJPCXPNBR-LLVKDONJSA-N 335.383 1.347 10 10 EDCE C[C@H](NC(=O)CCc1nc(O)c2cnn(C)c2n1)c1ccccc1O 1151892619 UGWMPARRBAQCNU-JTQLQIEISA-N 341.371 1.585 10 10 EDCE C[C@@]1(O)CCN(c2ccc(CN)c(Br)c2F)C[C@H]1O 1893299671 HHLJMNJATVTZHB-ZWNOBZJWSA-N 333.201 1.369 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@@H](O)C(F)(F)C2)cc1F 1330045483 LCTSPDGBHDKVEY-CYBMUJFWSA-N 331.338 1.803 10 10 EDCE CCN(CC)CCCN(CC)C(=O)C(=O)N1Cc2cccc(O)c2C1 1351846187 SWBMJQXZAISFPR-UHFFFAOYSA-N 347.459 1.815 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C(C)=C2CCC2)cc(OC)n1 1284229637 BDOBCIUSVHLNRX-LLVKDONJSA-N 347.415 1.834 10 10 EDCE Cc1ccc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2=O)cc1 1449332555 QOELINPKOFVPSL-UHFFFAOYSA-N 340.379 1.824 10 10 EDCE CCOC(=O)CN(CCOC[C@H]1CCCO1)Cc1ccccc1O 1618720321 CNRIBMCEVPJVJY-MRXNPFEDSA-N 337.416 1.953 10 10 EDCE CCNC1CCN(CCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1717018620 SBZUOSOBBWWBHU-UHFFFAOYSA-N 346.435 1.653 10 10 EDCE CC(C)CN1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1=O 1556281866 SXILIOYMNDWTAF-UHFFFAOYSA-N 331.376 1.789 10 10 EDCE CCN1CCC[C@](CO)(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1569902354 VYVSQQGFBNHKML-INIZCTEOSA-N 333.392 1.426 10 10 EDCE CCS(=O)(=O)C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1639882415 ZCHSGFWORDHDTD-UHFFFAOYSA-N 327.402 1.066 10 10 EDCE C/C=C(/C)C(=O)NC[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1736065313 IDCORIIHSHKOAB-VYVKEVPHSA-N 347.415 1.690 10 10 EDCE COc1ccc(CNCC2CC(NC(=O)CN(C)C(C)=O)C2)cc1C 1733944390 IMCVMSPTSJDJNN-UHFFFAOYSA-N 347.459 1.466 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)Cc2ccoc2)cc1C 1571426908 GNQRBFDXAHLZDN-MRXNPFEDSA-N 332.400 1.406 10 10 EDCE Cc1cccc([C@@H]2C(=O)NCCN2C(=O)Cc2ccc(O)c(O)c2)c1 1585509759 WWGZVVOWDNOLFN-GOSISDBHSA-N 340.379 1.648 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@@H]1CCCO1 1583589226 CSEDZJSSHADTPP-MFKMUULPSA-N 347.375 1.263 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)Cc2cc[nH]n2)cc1C 1674648578 VIGVSVRROWVXHV-ZIAGYGMSSA-N 330.432 1.952 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCn2cncn2)cc1C 1691260264 CUQXHAVRCLBXKE-UHFFFAOYSA-N 331.420 1.233 10 10 EDCE COCCNC(=O)[C@@H](C)N1CCN(c2ccc(OC)c(F)c2)CC1 151361084 YMLLFIYQCPGQGJ-CYBMUJFWSA-N 339.411 1.107 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)[C@H]2CCCCN2)c2nccn2C)cc1 1866038881 GQJVTTYHKTWZBM-IAGOWNOFSA-N 341.459 1.834 10 10 EDCE C[C@H](NC(=O)c1c(Br)nnn1C)c1ccccc1O 827964033 GHVLRLNDGZLOPF-ZETCQYMHSA-N 325.166 1.774 10 10 EDCE Cc1ccc(O)c(CNC2(C(=O)O)CN(C(=O)OC(C)(C)C)C2)c1 1913943979 KBBMIYDHZIUBJJ-UHFFFAOYSA-N 336.388 1.864 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)[C@@H](C)CCO)c(Br)cc21 1917039676 LCDKUVOHDKCADB-ISVAXAHUSA-N 342.237 1.869 10 10 EDCE C[C@@H]1CN(c2cc(Br)c(CN)cc2F)CC(=O)N1C 1925970584 NVKRZEZIUTYEMN-MRVPVSSYSA-N 330.201 1.714 10 10 EDCE Cn1ncc([C@@H](NN)c2ccccc2O)c1I 1942401539 ULIJWUQCOSVSPH-JTQLQIEISA-N 344.156 1.283 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](CN)CO 1952116554 ZSMKZQYWHILHNF-VXGBXAGGSA-N 326.393 1.101 10 10 EDCE O=C1Nc2cc(N3CC[C@H](O)[C@H](F)C3)c(Br)cc2[C@@H]1O 2144566454 LJNWEDCEEHWNSV-ZHAHWJHGSA-N 345.168 1.344 10 10 EDCE NCc1cc(F)c(N2CC[C@@H]3CC(=O)N[C@H]3C2)cc1Br 2145058398 TYFQYMKMORZSOE-PELKAZGASA-N 342.212 1.762 10 10 EDCE NCc1ccc(N2CCC[C@H](OCC(N)=O)C2)c(Br)c1 2145380655 BJSPPJNCBXFSSS-NSHDSACASA-N 342.237 1.379 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H](O)C4(CC4)C3)c(Br)cc21 2149753919 JBYUNMXEFXVKDT-RYUDHWBXSA-N 338.205 1.362 10 10 EDCE CN(CCc1ccc(N)cc1)C[C@H](O)CN(C)C(=O)OC(C)(C)C 1999441927 RNUYQVOGPFQHAQ-INIZCTEOSA-N 337.464 1.971 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H]1CN=[N+]=[N-])C1COC1 2010401390 DUXGQXGPAPWLIX-NWDGAFQWSA-N 339.396 1.827 10 10 EDCE NCc1ccc(N2C[C@H](O)C(F)(F)C2)c(F)c1Br 2034594611 AYIKYJHEMVRDMY-QMMMGPOBSA-N 325.128 1.863 10 10 EDCE NCc1cc(F)c(N2CCC(C(N)=O)CC2)cc1Br 388109398 GZVCELHDNRQILR-UHFFFAOYSA-N 330.201 1.749 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(F)c1Br 2182541574 CHBLALBFTSXXEC-LPQAMYBRSA-N 345.212 1.225 10 10 EDCE CO[C@H]1C[C@@H](CN)N(Cc2cc(Br)cc(F)c2O)C1 2090738337 CLNDYAGMMPCREX-QWRGUYRKSA-N 333.201 1.842 10 10 EDCE CO[C@@H]1[C@H](OC)CN(c2ccc(CN)cc2Br)[C@@H]1CO 2233354836 KOOHWDXALDNCDN-MCIONIFRSA-N 345.237 1.119 10 10 EDCE COc1ccc(N2CCC(CO)(CO)C2)c(OC)c1Br 2234880405 HBZRXCICBOQCJR-UHFFFAOYSA-N 346.221 1.647 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H](CCN(C)C)NC(=O)OC(C)(C)C 2300529657 DKCUXCSWUOQLNN-LBPRGKRZSA-N 342.444 1.990 10 10 EDCE Cc1ccc(CN(C)CCOC2CNC2)c(O)c1Br 2352646900 YWLKVEXJWOEWAL-UHFFFAOYSA-N 329.238 1.883 10 10 EDCE Cc1ccc(CN2CCOC[C@H](CO)C2)c(O)c1Br 2352678009 DTUMGEOHJHKKEB-NSHDSACASA-N 330.222 1.904 10 10 EDCE O=C1N[C@H](c2cc(O)cc(Br)c2O)N2CCCC[C@@H]12 124872573 LXXGFQKFIWPVAN-JQWIXIFHSA-N 327.178 1.843 10 10 EDCE Cc1ccc(CN2C[C@@H](CO)C[C@@H](CO)C2)c(O)c1Br 2380813058 BXPNNBUOJAMVHX-TXEJJXNPSA-N 344.249 1.886 10 10 EDCE CN(C)C(=O)[C@@H]1CC[C@@H](CNC/C=C/c2ccc(N(C)C)cc2)O1 835043746 YLVRPBILUJBGBI-ZBKUBXTQSA-N 331.460 1.991 10 10 EDCE COc1ccc(O)c(CNC(=O)NCc2ncc3c(n2)CCOC3)c1 844972274 FBGNHFJYOHCDOW-UHFFFAOYSA-N 344.371 1.263 10 10 EDCE Cn1nccc1[C@H]1COCCN1C(=O)NCCc1ccc(N)cc1 846171440 GQQXTJIHSOBSAX-MRXNPFEDSA-N 329.404 1.328 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCn3cnccc3=O)C2)cc1 855225303 JOSMZVUXZVHPTH-CQSZACIVSA-N 342.399 1.037 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@]2(CCCCN2)C1 923536605 QEESCGZSQANGMI-FQEVSTJZSA-N 344.503 1.929 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CS1(=O)=O 855699962 DLLRFQNTWXHNLL-UHLPNAGUSA-N 325.386 1.193 10 10 EDCE CO[C@]1(CO)CCCN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 854003263 GXTHXFJZOSSOJN-KBXCAEBGSA-N 335.448 1.997 10 10 EDCE Cn1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)cc1C=O 930522208 DFUQULCZVHUUEP-UHFFFAOYSA-N 327.384 1.604 10 10 EDCE Cc1ccc(O)c(CNC(=O)C(=O)Nc2cn(C)nc2C2CC2)c1 862025153 NVQDPBCZWFKNBB-UHFFFAOYSA-N 328.372 1.566 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@H](O)C[C@H]2C(N)=O)cc1 862683287 XYSMVVRKUGKPMI-CVEARBPZSA-N 327.384 1.155 10 10 EDCE C[C@H](NS(=O)(=O)CCOCC(F)(F)F)c1ccccc1O 867834980 YEVVBBJQQWNGIX-VIFPVBQESA-N 327.324 1.952 10 10 EDCE CCCn1nccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 769752827 KUNVUDIQKZASOI-UHFFFAOYSA-N 338.389 1.623 10 10 EDCE COc1cccc(CN2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)c1O 863642280 NPLRVQGTILBSPH-ZBFHGGJFSA-N 347.415 1.158 10 10 EDCE COC(C)(C)CCOC(=O)c1cc(NS(C)(=O)=O)ccc1O 787674268 JSLQWDFSEBKDTF-UHFFFAOYSA-N 331.390 1.736 10 10 EDCE CC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCCOC1 897361493 JYQPCCVBMFSTBJ-RDJZCZTQSA-N 347.459 1.690 10 10 EDCE CCC[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CCN1CCOC 1151376522 WBKQLEYQOZLHAU-OAHLLOKOSA-N 336.432 1.600 10 10 EDCE CCNS(=O)(=O)c1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1 1152564167 DRQXUDNGOVKZII-UHFFFAOYSA-N 346.408 1.846 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@H]4CN(C)C[C@@H]43)cc2F)CC1 1324821596 DNKWDDVTYZZMDA-LPHOPBHVSA-N 332.467 1.713 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)CN2CCOCC2)cc1C 1321030950 WIMUPSIKBPFLGE-ARJAWSKDSA-N 347.459 1.098 10 10 EDCE CCOC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1326840685 GRSVOXXVZCLCJO-AWEZNQCLSA-N 331.416 1.220 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)C[C@H]2COC(=O)C2)cc1C 1277793807 VUKVBMYLHNTIQX-GOEBONIOSA-N 348.443 1.893 10 10 EDCE Oc1c(Br)cccc1CN[C@@]12CC[C@@H](C1)[C@H](O)[C@@H]2O 2120387798 BZGHEFAYOJHCES-GZBPVQSJSA-N 328.206 1.519 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Cn1c(O)nnc1O 1540464865 VTVDLDJNYFECBC-UHFFFAOYSA-N 345.403 1.338 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCC[C@H]1CCOC1 1480602033 JANJVGJYGJFUOB-STQMWFEESA-N 347.419 1.984 10 10 EDCE CC[C@@H](F)C(=O)NCC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1721409015 LLRLHOVYBNEQOZ-CYBMUJFWSA-N 349.366 1.785 10 10 EDCE COc1ccc(CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)c(O)c1 1568098110 VAAQLVOHQJTYMA-HNNXBMFYSA-N 332.312 1.659 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@]2(F)CCOC2)cc1C 1732356484 LOGPOZUDTAKJPP-ACJLOTCBSA-N 338.423 1.974 10 10 EDCE C[C@@]1(C(=O)NCc2cc(O)ccc2O)Cc2ccccc2C(=O)O1 1644752797 VHMYROSXJLAZLB-SFHVURJKSA-N 327.336 1.886 10 10 EDCE CN(C)c1ccc([C@@]2(O)OC(=O)c3ccc([N+](=O)[O-])cc32)c(O)c1 1848441693 UIEQIDIYMVZOJF-MRXNPFEDSA-N 330.296 1.730 10 10 EDCE C[C@@H](CCO)N(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 1917089917 DZVDZOFLPQNMKY-MADCSZMMSA-N 329.194 1.642 10 10 EDCE Nc1ccc(CC(=O)N[C@H](COCc2ccccc2)C(=O)O)cc1 1946580093 UBZDVTWTCBKBTQ-MRXNPFEDSA-N 328.368 1.598 10 10 EDCE COC[C@](C)(N)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951993116 MFISJYMOEJZTNG-YOEHRIQHSA-N 340.420 1.897 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)Nc2ccc(N)cc2)CC(O)C1 2022891800 VBQMYZCGZMAMSH-UHFFFAOYSA-N 335.404 1.873 10 10 EDCE NCc1cc(F)c(N2CCN3C[C@@H](O)C[C@@H]3C2)cc1Br 405220099 ACDLZPVXHXVTIX-MNOVXSKESA-N 344.228 1.302 10 10 EDCE CC(C)CNCc1ccc(N(C)C(CO)CO)cc1Br 313462935 DQRFHAMLFPQWSE-UHFFFAOYSA-N 345.281 1.984 10 10 EDCE O=C1NCC2(CCN(c3ccc(CO)cc3Br)CC2)N1 2177667213 XSLYLRRHJYVVRQ-UHFFFAOYSA-N 340.221 1.593 10 10 EDCE CN1CCCc2cc(C=CC(=O)NCCN=c3cncc[nH]3)ccc21 2053592492 KOWYOSPQWGKXFG-UHFFFAOYSA-N 337.427 1.522 10 10 EDCE CN(C)c1ccc([C@H](O)[C@H](N)c2nc(Br)nn2C)cc1 2173169104 RTDCGUICVIIMGN-QWRGUYRKSA-N 340.225 1.377 10 10 EDCE CN(C(=O)[C@@H]1C[C@H](O)CCN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2080895581 CCVRBHQKSOGKPV-CABCVRRESA-N 349.431 1.992 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])COC1 2213582533 IUDQPPNJLYOUOQ-QWRGUYRKSA-N 339.396 1.875 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2COC(C)(C)[C@@H]2O)c1O 2236055490 QGIPWVWXQQQHKA-ZWNOBZJWSA-N 346.221 1.791 10 10 EDCE COc1ccc(Br)c(CN2CCC(O)(CN)CC2)c1O 2236030933 FCIVDDWWNUROEC-UHFFFAOYSA-N 345.237 1.449 10 10 EDCE COCCOCCNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297505875 KDEIWOKNAVLJTO-UHFFFAOYSA-N 334.416 1.316 10 10 EDCE CN1CC[C@@H](NC(=O)C=Cc2ccc(N3CCOCC3)cc2)CC1=O 2311265388 DZVHZYZOTLDIFR-MRXNPFEDSA-N 343.427 1.273 10 10 EDCE C[C@H](O)[C@@H](C(=O)O)N1C(=O)C(=Cc2cccc(F)c2)SC1=S 2323823486 MCNIRAFVAUGWKE-CPCISQLKSA-N 341.385 1.861 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)cc1Br 2336480718 RMAJIXSWFZUIQL-MWODSPESSA-N 346.246 1.736 10 10 EDCE CC[C@H](CO)N1CCN(Cc2cc(Cl)cc(OC)c2O)CC1 184699809 UDQOJMXEZCUGOF-CQSZACIVSA-N 328.840 1.943 10 10 EDCE Cc1ccc(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)o1 283680065 ZPRWBDHEKDGCFC-UHFFFAOYSA-N 329.400 1.929 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)OC[C@@H](F)C(F)(F)F)c1 800148371 BKJKOQRHOLUEDH-SECBINFHSA-N 345.270 1.821 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H](O)[C@@H](O)C2)c1 827568335 AKNQLVPCOFMCMM-MSOLQXFVSA-N 342.395 1.474 10 10 EDCE CN(C)c1ccc(/C=C/CNCC[C@H]2CNCCS2(=O)=O)cc1 903969667 IREBBUYNBQVWKE-IDOMTICXSA-N 337.489 1.132 10 10 EDCE COC[C@@](C)(O)CCNC(=O)NCCCSc1nccs1 838514142 OTBGZCMZYGVWPN-ZDUSSCGKSA-N 333.479 1.712 10 10 EDCE C[C@@H](NC(=O)NC[C@H]1CCCCN1CCO)c1ccc(N(C)C)cc1 838560441 XDWYYMWLMLTYFU-CRAIPNDOSA-N 348.491 1.960 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN1C/C=C/c1ccc(N(C)C)cc1 835028670 ORHVNQIBEYPCGE-YXMMZVCTSA-N 337.489 1.779 10 10 EDCE C[C@H](C[S@](C)=O)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588432055 MGMHKIWUGILBMZ-JWCCZQCTSA-N 336.457 1.420 10 10 EDCE CC(C)(C)C1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 837270990 SCZOOQKVSCOJAG-UHFFFAOYSA-N 326.418 1.882 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@]23C[C@H]4C[C@@H](C(=O)N2)[C@H]3C4)cc1F 844357702 OWCGICRBWCSPPI-NVAPZFDKSA-N 331.391 1.423 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1C2CCC1(C(N)=O)CC2 919082271 YNQJDEKRFMUUPT-UHFFFAOYSA-N 330.432 1.753 10 10 EDCE CC1(C)CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])CCN1CCO 844214914 LFCVFGKIMIFZOA-XQRVVYSFSA-N 349.387 1.586 10 10 EDCE CC[C@@H](C(=O)O)N(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 844839209 KDLNYKDAMBAPBL-INIZCTEOSA-N 349.431 1.139 10 10 EDCE Oc1cc2c(cc1CN1CC[C@@H](Nc3ncccn3)C1)[C@H](O)CO2 842617779 WGUZXSRCLNTAKN-IUODEOHRSA-N 328.372 1.294 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@@]2(O)C[C@H]2C1 853474739 NGSGVNYQNKTFKD-MAUKXSAKSA-N 331.416 1.190 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3COC(C)(C)O3)C2)cc1 853977778 RRFWZYIHXFFJSH-BBRMVZONSA-N 349.431 1.725 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3nc[nH]c4nccc3-4)C2)cc1 855225688 PSVRKTHLRHJWPZ-GFCCVEGCSA-N 337.383 1.927 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CNCC[C@H]3C)C2)cc1 851664358 XXNITFMFSDFAOM-KEYYUXOJSA-N 332.448 1.571 10 10 EDCE CN1C(=O)CC[C@H]1CC(=O)NCc1cc(Br)ccc1O 854442341 OTGJQJBIEICGPS-NSHDSACASA-N 341.205 1.782 10 10 EDCE COc1ccc(O)c([C@H](C)NCCCN2CCCS2(=O)=O)c1 756686631 JHVSFAFBPKUFJF-LBPRGKRZSA-N 328.434 1.477 10 10 EDCE COC[C@@]1(C)CN(Cc2ccc([N+](=O)[O-])c(OC)c2O)CCO1 862551761 PIJLWCRYRXPLTO-OAHLLOKOSA-N 326.349 1.546 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)NCC(=O)N2CCCO2)cc1 862081653 GPMWSODCPBXZNX-UHFFFAOYSA-N 327.384 1.988 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1(C)C 873463559 ICVIAOBKKBPEQJ-ZYHUDNBSSA-N 327.377 1.627 10 10 EDCE O=C(NCC[C@H]1CCCO1)C(=O)NCc1ccc(N2CCCC2)cc1 786599681 SQRIHRNJIZMNGL-QGZVFWFLSA-N 345.443 1.588 10 10 EDCE CC(=O)N1C[C@H]2C[C@H]1CN2Cc1cc(Br)ccc1O 1877019105 DWOUOMLBWFTNQD-OLZOCXBDSA-N 325.206 1.960 10 10 EDCE CN(C)C(=O)CNC(=S)NCc1cc(Br)ccc1O 795154391 OFBWRLVLRGNPNL-UHFFFAOYSA-N 346.250 1.207 10 10 EDCE COc1cnc([C@H]2CCCN2C(=O)Cc2ccc(O)c(O)c2)nc1O 1304659116 ADSCCLFWGCBOTL-LLVKDONJSA-N 345.355 1.508 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CCS(=O)(=O)c2ccccc21 1304053591 OXEZMZYTEOGPDN-GFCCVEGCSA-N 347.392 1.675 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C2CCN(C)CC2)cc1C 1317622604 ADPKLILJJVRFGB-UHFFFAOYSA-N 333.476 1.893 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cnsn3)CC2)cc1C 1323397603 RSJVFPLGGXLQQS-UHFFFAOYSA-N 332.429 1.907 10 10 EDCE CO[C@@H]1CC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1326205406 WRVPNAGNRLFYPL-GXSJLCMTSA-N 328.390 1.061 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1C 1276002547 VFEHYPFDPVDRKF-HUUCEWRRSA-N 335.404 1.607 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@H]3CCCN(C)C3=O)CC2)cc1 1353884150 WGAIWAMDLLDMRM-KRWDZBQOSA-N 345.443 1.602 10 10 EDCE C[C@@H](NC(=O)C(=O)NCc1cncc(O)c1)c1ccc(N(C)C)cc1 1354674523 IOMVFKSQVPHZRM-GFCCVEGCSA-N 342.399 1.347 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cnc(N)c([N+](=O)[O-])c1 1440662806 GVJSPFQROSAYJE-UHFFFAOYSA-N 329.360 1.910 10 10 EDCE CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)Cc3ccc(O)c(O)c3)[C@H]2C1 1298839096 HRGUBWVEIVHLIH-KKUMJFAQSA-N 332.400 1.404 10 10 EDCE Cc1cccc2c(=O)n(CC(=O)N3Cc4cccc(O)c4C3)cnc12 1455036680 IVSLKYJDXHMAQE-UHFFFAOYSA-N 335.363 1.953 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@@H]1CSC(c2ccccc2O)=N1 1465954277 OIUANOYWMBQBLW-LBPRGKRZSA-N 344.392 1.982 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2cc[nH]c2C)cc1C 1700788666 YMJQABUTQRAQAA-HNNXBMFYSA-N 331.416 1.521 10 10 EDCE CCS(=O)(=O)c1ccccc1CCNC(=O)c1cccc(O)c1O 1471762459 CFMMRMBGZFWROP-UHFFFAOYSA-N 349.408 1.864 10 10 EDCE CCNC(=O)CNCC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1715710362 BHDLYSJCIVVLSD-LLVKDONJSA-N 348.407 1.083 10 10 EDCE NC(=O)NC[C@@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 1625715982 YNOBFZLKECEPGT-VIFPVBQESA-N 349.412 1.833 10 10 EDCE COC[C@@](C)(CC(=O)OC)NC(=O)c1ccc(N=NC(N)=O)cc1 1628951808 JRDKTAKKRRLBSF-OAHLLOKOSA-N 336.348 1.547 10 10 EDCE COC(=O)N1CCC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1627714209 XVRLOIZDJOWLEE-LBPRGKRZSA-N 333.348 1.810 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccc(N2CCCC2=O)cn1 1631011136 CGNPXMMMEGAHDX-UHFFFAOYSA-N 327.340 1.801 10 10 EDCE NC(=O)c1ccc(CC(=O)NCc2c(O)ccc3ccccc23)cn1 1635969263 NRWSMUVAWNWQAW-UHFFFAOYSA-N 335.363 1.898 10 10 EDCE CS(=O)(=O)c1ccc(CNC(=O)Cc2ccc(O)c(O)c2)s1 1638530823 OOZYEPXFSFNACE-UHFFFAOYSA-N 341.410 1.422 10 10 EDCE COC(=O)c1c(NC(=O)Cc2ccc(O)c(O)c2)nc2n1CCC2 1642389998 YPVYWSFJQOPWQC-UHFFFAOYSA-N 331.328 1.208 10 10 EDCE COc1ccc(CN[C@@H]2CCC[C@H](NC(=O)CNC(C)=O)C2)cc1C 1567157127 JBNMUHGFHRKWCP-SJORKVTESA-N 347.459 1.657 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2coc(C(N)=O)c2)cc1C 1733006774 KFHOUQSPCYUVQJ-LBPRGKRZSA-N 345.399 1.604 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)c2ccsc2)cc(OC)n1 1579309213 UTFWUDZEEVFBPA-JTQLQIEISA-N 349.412 1.709 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)/C=C\c1ccncn1 1772910442 DJSJHFJKHRCAMC-DAXSKMNVSA-N 338.411 1.985 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@]2(C)CCC(=O)N2)cc1C 1690618599 CUOAFYNUKQMMKH-ACJLOTCBSA-N 333.432 1.267 10 10 EDCE COc1ccc(N/C=C2\C(=O)N([C@@H]3CCS(=O)(=O)C3)N=C2C)cc1 13654859 CLZRMUPGLRLKAJ-MLJKTZRHSA-N 349.412 1.396 10 10 EDCE Cc1ccc(/C=C2\SC(=S)N(CC(=O)NCCO)C2=O)cc1 16905430 OWQZCRYYFIWCTP-WQLSENKSSA-N 336.438 1.305 10 10 EDCE C[C@H](O)[C@H](C(=O)O)N1C(=O)/C(=C\c2ccccc2F)SC1=S 1858592705 VBKZOPISJXSHJH-JZMJZOPTSA-N 341.385 1.861 10 10 EDCE O=C(c1cc(O)c(O)c(O)c1)N1CCC[C@H](C(=O)N2CCCC2)C1 1866303401 UNVMRONAXOSWPR-NSHDSACASA-N 334.372 1.278 10 10 EDCE CN(C)C(=O)CCN(C)c1cc(Br)c(CN)cc1F 2131952615 MUNGKTSJYTZSGV-UHFFFAOYSA-N 332.217 1.961 10 10 EDCE NCc1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)c(F)c1Br 2136604450 IBISIQYRDQTUCA-MBTKJCJQSA-N 328.185 1.214 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@H](O)[C@H](F)C3)c(Br)cc21 2144574207 SSJYQINCARAMCG-ZHAHWJHGSA-N 344.184 1.310 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)C1(O)CCC1 2014483248 QLIZUGCQHNTHPO-LLVKDONJSA-N 341.412 1.954 10 10 EDCE [N-]=[N+]=NCCCNC(=O)CNC(=O)c1ccccc1Br 701297693 XVUUQHUNIPCYRG-UHFFFAOYSA-N 340.181 1.996 10 10 EDCE CN1C(=O)O[C@@H]2CN(c3ccc(CN)c(Br)c3F)C[C@@H]21 2176923768 JHQWLLIHXYOOTQ-VHSXEESVSA-N 344.184 1.686 10 10 EDCE CC=C[C@@H](O)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 2053284646 IEVXRSMSQNYVAO-QGZVFWFLSA-N 335.423 1.521 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)[C@H]1CCC[C@@H]1O 709198540 UMISZWKBUMMLFW-DRZSPHRISA-N 340.221 1.751 10 10 EDCE CN1C(=O)NCC12CN(c1cc(Br)c(CN)cc1F)C2 2177688239 WNBOKCVBCWCWKZ-UHFFFAOYSA-N 343.200 1.261 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1908253599 WVNSWYDSFMBNEL-SDDRHHMPSA-N 339.396 1.827 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2190456381 GTYRXKYPZQGHPF-MHEUCROKSA-N 341.249 1.631 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)COc1ccc(N)cc1 2067320855 ADYTUGPWHSKUAN-KBPBESRZSA-N 347.415 1.868 10 10 EDCE OCc1ccc(N2CC3(C2)OCCC[C@@H]3O)c(Br)c1 2103414665 SNCSDLYNSTVHOF-ZDUSSCGKSA-N 328.206 1.672 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](COc2nnc(=N)[nH]n2)C2(CCC2)C1 2213790248 RMNAWCQRLXEKRV-SNVBAGLBSA-N 336.396 1.095 10 10 EDCE COc1ccc(Br)c(CN(CCO)CC(=O)O)c1O 2227744182 FPQHZWYANIBWJR-UHFFFAOYSA-N 334.166 1.042 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@H](O)CC2)c(Br)c1 2269120358 CNERMTRAVIINOH-FZQKWOKYSA-N 329.238 1.791 10 10 EDCE O=C(O)CNC(=O)CN1C(=O)C(=Cc2cccs2)SC1=S 2293379561 MWFFUQUXEMQBBZ-UHFFFAOYSA-N 342.423 1.150 10 10 EDCE O=C1NC(=O)N(Cc2ccccc2)C(=O)C1=CNN1CCCCC1 2297056812 ZFAWUIAJTOAOBL-UHFFFAOYSA-N 328.372 1.139 10 10 EDCE CC(C)(C)OC(=O)CNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297583837 UGSWPVMCPQJDFX-UHFFFAOYSA-N 346.427 1.994 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)cc1Br 2330369473 IXPJZKOPCGBOAU-DSMZTOPNSA-N 327.222 1.228 10 10 EDCE CN[C@@H](c1ccccc1O)[C@H](O)c1nc(Br)nn1C 2353741211 ZHGIOGYCGKZNBJ-UWVGGRQHSA-N 327.182 1.277 10 10 EDCE CCCNC(=O)CNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255194806 MVJTUUQHDRNMFC-YVMONPNESA-N 331.416 1.179 10 10 EDCE CN=c1[nH]c(=NCc2ccc(C)c(Br)c2O)[nH]cc1N 2381134926 JYZDWLWZKRISAG-UHFFFAOYSA-N 338.209 1.333 10 10 EDCE COC[C@@H]1[C@H](O)[C@H](O)CN1Cc1ccc(C)c(Br)c1O 2381141724 DHYGOUCGEBTGJH-GYSYKLTISA-N 346.221 1.016 10 10 EDCE CS(=O)(=O)NC[C@@H]1CCC[C@H]1NCc1cc(Cl)ccc1O 800310105 SBTYUQXGAPRKDS-GXFFZTMASA-N 332.853 1.853 10 10 EDCE CC/C(C)=C\C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 822620978 GJQNMMGVZZMCKI-OWBHPGMISA-N 336.457 1.894 10 10 EDCE COc1cccc(CNC(=O)N[C@@H]2CC[C@@H](C)S(=O)(=O)C2)c1O 822001272 SDDZUAQVXPRAGX-ZYHUDNBSSA-N 342.417 1.166 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CNC[C@@H]2CS(=O)(=O)c3ccccc32)c1 824514766 CFAHCLJLVWVHMC-GFCCVEGCSA-N 348.380 1.961 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)Nc1ccc2c(n1)OCCO2 825018699 BVQNXNQFGONDMF-UHFFFAOYSA-N 331.328 1.628 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCC1(CO)CCC1 588432233 LEOIYKZJDGDGCG-DAXSKMNVSA-N 330.428 1.815 10 10 EDCE COC(=O)c1cc(O)c(F)cc1NS(=O)(=O)N1CCC[C@@H](C)C1 830156416 SSZJGKAWJZLUIU-SECBINFHSA-N 346.380 1.707 10 10 EDCE CN1CCN(C(=O)CCNC/C=C\c2ccc(N(C)C)cc2)CC1 835038238 PHYPRZNFXSCFGC-PLNGDYQASA-N 330.476 1.520 10 10 EDCE CNS(=O)(=O)[C@H]1CCCN(C/C=C\c2ccc(N(C)C)cc2)C1 835028131 JSGZCLLLFJDTLB-AATOQMJSSA-N 337.489 1.779 10 10 EDCE CC[C@](C)(CO)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 847539114 LVSKLQQYELAPLG-GOSISDBHSA-N 338.423 1.812 10 10 EDCE Cc1cnc(CCN(C)Cc2cc(O)n3ncc(C(=O)O)c3n2)s1 846259303 WZFDNJALYPADQP-UHFFFAOYSA-N 347.400 1.573 10 10 EDCE Cn1cnnc1N1CCN(Cc2cc(C(C)(C)C)cc(O)c2O)CC1 848497760 PXHLDTYPMJXGFW-UHFFFAOYSA-N 345.447 1.846 10 10 EDCE O=C(NCCCSc1nccs1)NCC[C@]1(O)CCOC1 845047431 TZLDGNPOKDJBNJ-ZDUSSCGKSA-N 331.463 1.466 10 10 EDCE CCCn1nccc1NC(=O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 746395693 MVYCXSPBXKEYKK-NSHDSACASA-N 346.387 1.823 10 10 EDCE COc1cc(Br)cc(CNC[C@H]2COCCN2C)c1O 858275851 GCKKGVLTVOYNKE-LBPRGKRZSA-N 345.237 1.584 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCOC3CCOCC3)C2)cc1 855233968 QBSWRJDVHQZKMZ-HNNXBMFYSA-N 348.443 1.976 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)C[C@H](CC(F)(F)F)O1 850864283 CYSGGTHVSGXNSW-SKDRFNHKSA-N 345.321 1.776 10 10 EDCE CON1CC[C@@H](OC(=O)c2sc3nc(C)cc(C)c3c2N)C1=O 922269254 SYUJDDBWMIFCHF-SECBINFHSA-N 335.385 1.814 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCO[C@H]3CCOC3)C2)cc1 923185315 FFQJEBQWXXAMKT-YOEHRIQHSA-N 349.431 1.379 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@@H]3CCC(=O)N3C)C2)cc1 855227731 ZLYPJDSCGAMWOJ-ZFWWWQNUSA-N 331.416 1.401 10 10 EDCE CS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C\c1cnccn1)CCC2 751197932 SYWYCUXLBLOIOW-ALCCZGGFSA-N 343.408 1.873 10 10 EDCE CC(C)[C@H](NC=O)C(=O)NCc1cc(Br)ccc1O 861687318 LSDMYDIHXYMIJT-LBPRGKRZSA-N 329.194 1.542 10 10 EDCE COC[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C(C)C 1119756378 KARVGPMJSZWRNJ-GDBMZVCRSA-N 349.475 1.965 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@]3(C)CCC(=O)NC3)CC2)cc1 798424803 WMYNJMOXENNMOK-IBGZPJMESA-N 345.443 1.697 10 10 EDCE NC(=O)NC1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1148176461 SLHHJWOCYCIRJP-UHFFFAOYSA-N 335.385 1.585 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H](C3)O4)c(Br)cc2[C@@H]1O 1899716684 VCJQQWPXJJGVPU-KJNMHVQDSA-N 325.162 1.412 10 10 EDCE COCCN1C[C@H](C(=O)NCc2c(O)ccc3ccccc23)CC1=O 1179029144 KKWLTDKSCBNLDY-CQSZACIVSA-N 342.395 1.657 10 10 EDCE Cc1c(CC(=O)NCc2cc(O)ccc2O)nnn1-c1ccccc1 1176748179 LUKATRHDGJIMDW-UHFFFAOYSA-N 338.367 1.846 10 10 EDCE CN[C@@H](C)c1ccc(N2CCOC[C@@H](O)C2)c(Br)c1 399840766 BXROAMXUBDXPBY-JQWIXIFHSA-N 329.238 1.927 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CCC(C)(C)O1 1325767667 PZZNVEIAWXPWLJ-MRXNPFEDSA-N 347.459 1.785 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC(C)(F)C2)cc1F 1324404103 RMKNTVQGVNNYJY-UHFFFAOYSA-N 339.386 1.859 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1CO[C@H](C2CC2)C1 1331277975 WWAJVMZHMOYGJI-AEFFLSMTSA-N 345.443 1.890 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1CCCC(=O)N1)NCc1ccc(OC)c(C)c1 1267809886 VKXQFSVTKUUGGH-JKSUJKDBSA-N 347.459 1.657 10 10 EDCE COc1ccc(N2CCN(C(=O)C34CCCN3CCC4)CC2)cc1 1266269239 YDFNHUZESBFFEX-UHFFFAOYSA-N 329.444 1.972 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)Cc2ccc(C)o2)cc1C 1507193483 NEAZJKNHXGZRAU-MRXNPFEDSA-N 346.427 1.714 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(OC[C@H]2CCOC2)CC1 1295464916 IIJCFVLHISPSKX-AWEZNQCLSA-N 335.400 1.684 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)NCC1(CN=[N+]=[N-])CC1 2117728843 RZTGCASGKXBNDK-UHFFFAOYSA-N 349.214 1.551 10 10 EDCE CC[C@@H](CNC(=O)C1(C)CCC1)NC(=O)c1cc(OC)nc(OC)c1 1704667052 FOCUAQNUYZSQHB-ZDUSSCGKSA-N 349.431 1.914 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc(C(N)=O)[nH]1 1540488352 NYKYZHVCFRSJOP-UHFFFAOYSA-N 326.400 1.986 10 10 EDCE COc1ccc(CNC(=O)c2ccc(-n3nnnc3C)cc2)c(O)c1 1556354883 XRWNRCSMAQHOHB-UHFFFAOYSA-N 339.355 1.615 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C2[C@@H]3CCC[C@@H]23)cc1C 1716081839 FZAGXHUGUXHRAK-ARFHVFGLSA-N 332.444 1.616 10 10 EDCE CS(=O)(=O)c1ccc(F)c(CNC(=O)c2cccc(O)c2O)c1 1639417707 DQRIMXSPLXNFER-UHFFFAOYSA-N 339.344 1.570 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CCCCS2(=O)=O)cc1 1637126719 IESZPUUPLXWLKE-LBPRGKRZSA-N 338.389 1.546 10 10 EDCE CCN1CCO[C@@H](C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)C1 1732984218 ZCGJLUHBCASZNN-CRAIPNDOSA-N 349.475 1.319 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H]2CCNC(=O)C2)cc1C 1731903642 SWIQZJZCSGDHNF-HNNXBMFYSA-N 333.432 1.078 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc2c(cc1[N+](=O)[O-])OCCO2 1644752846 XAMZYRTYSJUKIV-UHFFFAOYSA-N 346.295 1.707 10 10 EDCE CO[C@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NCCCN=[N+]=[N-])C1 1964884032 NPKUYCMXYFEBCR-WJONMLJTSA-N 327.385 1.875 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)c(Br)c1 1893326905 YQXUXHJLRJIKDM-BIGNPOOSSA-N 329.238 1.791 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C 1900607642 OUFCBJDWVASMPA-NSHDSACASA-N 327.385 1.781 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 1900613477 YUKSUNYQQDZMBV-NSHDSACASA-N 327.385 1.781 10 10 EDCE COCCNCc1ccc(N2CC[C@@H](O)C2)cc1Br 234691109 QRMIDSRXEFSHNC-CYBMUJFWSA-N 329.238 1.756 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC1(c2cc(O)nc(O)c2)CC1)C(=O)O 1952640895 VCGHCHFMYHHPHQ-JTQLQIEISA-N 338.360 1.892 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985101613 VDBATZHFUDSCEJ-WDEREUQCSA-N 327.385 1.827 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)c(Br)c1 2146313408 JTBBXLIYQYTPDU-KMUNFCNLSA-N 342.233 1.684 10 10 EDCE CC(C)(C)OC(=O)NC1[C@H]2CN(C(=O)c3ccc(O)c(O)c3)C[C@H]12 2006281720 QIMCQTSELODLMK-QWRGUYRKSA-N 334.372 1.693 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H]1CN=[N+]=[N-])C(C)(C)O 2014478747 HXPYTMSPPQGFBV-QWRGUYRKSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCCF 2022908572 SISGFOHPGYAARP-NSHDSACASA-N 342.367 1.619 10 10 EDCE C[C@H](CS(C)(=O)=O)N(C)c1ccc(CN)cc1Br 688566862 NUYOSTUDFDEWGP-SECBINFHSA-N 335.267 1.777 10 10 EDCE CCC(C)(C)N1CCN(C(=O)c2cnn3c(O)cc(C)nc23)CC1 2064886085 QQXQDWBWQHRFFQ-UHFFFAOYSA-N 331.420 1.690 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)cc1Br 2182552160 AQYLSLHUOHQBAB-TUWBQHJRSA-N 342.233 1.680 10 10 EDCE CN1CCc2cc([C@H](CN)N3CC(NC(=O)OC(C)(C)C)C3)ccc21 2074411104 OVHGQDJIVZVROL-KRWDZBQOSA-N 346.475 1.888 10 10 EDCE CN(C(=O)[C@]1(CO)CCN(C(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2080754337 SJDQYBQIXODAEQ-GOSISDBHSA-N 349.431 1.851 10 10 EDCE OCc1ccc(N2C[C@@H](CO)C[C@H](CO)C2)cc1Br 2228399934 NRZDRZSFAZBRKE-QWRGUYRKSA-N 330.222 1.369 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCN=[N+]=[N-])C[C@@H]2OCCC[C@@H]21 2250762362 LUTRSIFQOQKSCS-ZIBATOQPSA-N 339.396 1.875 10 10 EDCE CC[C@@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2288894661 ALSGIMXMXGZAMM-WXHSDQCUSA-N 340.221 1.751 10 10 EDCE OCc1ccc(N2C[C@@H]3CC[C@@H](CO)O[C@H]3C2)cc1Br 2289170906 ZIRSEQXFBSRCEL-XEGUGMAKSA-N 342.233 1.918 10 10 EDCE COc1ccc(Br)c(CN(C)[C@H]2CNC[C@H]2F)c1O 2343638331 BDRPEPZAILUFNB-MNOVXSKESA-N 333.201 1.905 10 10 EDCE Cc1ccc(CN2CC(=O)N[C@@H](C)C2=O)c(O)c1Br 2352693452 PSBBISCILRIDTD-QMMMGPOBSA-N 327.178 1.310 10 10 EDCE Cc1cc(Br)c(N2C(=O)NC(=O)/C(=C\N)C2=O)cc1C 101512793 NVJIERRBBXKLMQ-VMPITWQZSA-N 338.161 1.491 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1 29069766 GOUGKRBIYJUDPO-HOSRBBHYSA-N 333.344 1.483 10 10 EDCE CSCC[C@H](NC(C)=O)C(=O)NCCc1ccc(O)c(O)c1 33753228 QCDZESBHHYRZDC-LBPRGKRZSA-N 326.418 1.014 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCCN(c2cccnn2)CC1 180792056 KGRXSTPGSADEPJ-FNORWQNLSA-N 340.383 1.640 10 10 EDCE Cc1ccc(N2CCCN(C(=O)c3cccc(O)c3O)CC2)nn1 188481996 YDYPDMFIQOXZQR-UHFFFAOYSA-N 328.372 1.549 10 10 EDCE N[C@@H]1CCCC[C@H]1N/C=C1\C(=O)N(Cc2ccco2)C(=O)N=C1O 254737319 NQMLYQHGLIYKKQ-FUTHCOOYSA-N 332.360 1.442 10 10 EDCE Cc1ccc(CN(C)C(=O)CCNCCO)c(O)c1Br 2381139526 XZXBUIIGUOKDSP-UHFFFAOYSA-N 345.237 1.394 10 10 EDCE CC[C@@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1ccccc1O 806169885 LNNRNNCNPWGABI-UKRRQHHQSA-N 341.477 1.704 10 10 EDCE COc1ccc(N2CCCN(C(=O)NC3COCCOC3)CC2)cc1 813817874 KITYHQMWAMLXGB-UHFFFAOYSA-N 349.431 1.332 10 10 EDCE C[C@H]1OCC[C@H]1N(CCO)Cc1cc(Cl)cc([N+](=O)[O-])c1O 825130034 KUBRIXLDDRLKPB-BXKDBHETSA-N 330.768 1.926 10 10 EDCE Cn1nccc1[C@@H](O)CNC(=O)NCc1ccc(N2CC=CC2)cc1 919918548 OMXNPVIERUUENL-KRWDZBQOSA-N 341.415 1.329 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)N[C@@H](CC4CC4)C3=O)C2)cc1 849356970 IWMIHADVSMSLIU-ZBFHGGJFSA-N 329.400 1.994 10 10 EDCE O=C(NCCN1C[C@H]2CCCCN2C1=O)c1c(F)ccc(O)c1O 857331291 CQFGKCSZBUMTCE-SNVBAGLBSA-N 337.351 1.257 10 10 EDCE c1cc(N2CCOCC2)ccc1CN[C@@H]1CCOC12CCOCC2 924749641 JXVJHURXDDQABO-GOSISDBHSA-N 332.444 1.951 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](O)c3ccccn3)CC2)cc1F 857464339 CGIVZGSLKPYNMN-QGZVFWFLSA-N 345.374 1.612 10 10 EDCE CN1C(=O)[C@H](NCc2cc3c(cc2O)OCO3)Cc2ccccc21 850352824 JGRNTBGITWKEQA-CYBMUJFWSA-N 326.352 1.798 10 10 EDCE CNc1cnc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cn1 858787163 ZRRWQADZGBERMT-CYBMUJFWSA-N 341.415 1.846 10 10 EDCE CC[C@@](COC)(NCc1ccc(N2CCOCC2)cc1)C(=O)OC 930682940 DCOAYYJJHLIQGO-SFHVURJKSA-N 336.432 1.581 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2ccc3ccccc3c2O)CCO1 862459564 VVDSWPYSYBPCKQ-OAHLLOKOSA-N 329.400 1.675 10 10 EDCE CCN1CC[C@@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)[C@H](C)C1 1118946403 ZQCCHOWJPCZMMS-CZUORRHYSA-N 345.443 1.423 10 10 EDCE CC(C)N[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 761887735 SNRDNFUGVGFARQ-NSHDSACASA-N 334.376 1.893 10 10 EDCE COC(COCCNC(=O)c1cc2cc(O)c(O)cc2s1)OC 897499355 GURREJVFFMWACJ-UHFFFAOYSA-N 341.385 1.678 10 10 EDCE COC(=O)c1c(CN(C)[C@@H]2CCNC2=O)c2cc(F)ccc2n1C 894093470 DTDWCJRBAIZQCZ-CQSZACIVSA-N 333.363 1.424 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2C(=O)OCC[C@@H]2C1 897262550 OSKSHZIUPMRCOE-SNVBAGLBSA-N 348.380 1.979 10 10 EDCE CCN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCOC1 794682331 BYTXRSNDEMERRC-LLVKDONJSA-N 328.390 1.015 10 10 EDCE Cc1ccc(C(=O)NOC[C@H](C)NC(=O)OC(C)(C)C)c(O)c1O 1151184138 DNPJCJHAVRWQQN-JTQLQIEISA-N 340.376 1.981 10 10 EDCE CCOC(=O)[C@@H](CC1CC1)NCC(=O)NCc1ccc(N(C)C)cc1 1175918929 VNNOENBFABQLEC-QGZVFWFLSA-N 347.459 1.690 10 10 EDCE COCCOCCc1ncc(C(=O)N[C@H](C)c2ccccc2O)[nH]1 1171723028 KCPXPJAOJNMJKZ-GFCCVEGCSA-N 333.388 1.812 10 10 EDCE CN(CCN1CCCCC1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1330505514 XGPOERJWFHXKBK-UHFFFAOYSA-N 331.416 1.179 10 10 EDCE C[C@H]1C[C@@H]1CNC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1257235044 XYZRNWJSPFJBPV-GOEBONIOSA-N 345.443 1.254 10 10 EDCE C[C@H](O)C[C@H]1CCCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1330418645 QIDKFKZHYLRNAN-GXTWGEPZSA-N 332.400 1.386 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1CCC(=O)N1)NCc1ccc(OC)c(C)c1 1269377312 DAJGFULXMSVIGR-LSDHHAIUSA-N 333.432 1.267 10 10 EDCE O=C(NCCNC(=O)c1cccs1)NCc1c(O)cccc1F 1469572297 TUXSZSYGQCGQAN-UHFFFAOYSA-N 337.376 1.822 10 10 EDCE COc1c(C)[nH]cc(CN(C)C(=O)/C=C/c2ccc(O)c(O)c2)c1=O 1470681638 NWTAPONIJWAICV-FNORWQNLSA-N 344.367 1.775 10 10 EDCE CCO[C@@H]1C[C@H]1C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1623928451 NFNQCMMKWHYCGL-TZMCWYRMSA-N 341.791 1.972 10 10 EDCE O=C1C[C@H](C(F)(F)F)[C@H](C(=O)NCc2c(O)cccc2O)CN1 1558536165 VIWDRSFTELRTOW-APPZFPTMSA-N 332.278 1.029 10 10 EDCE CC(C)n1cc(CNC(=O)/C=C/c2ccc(O)c(O)c2)c(O)nc1=O 1558080611 KVPGGDSWKJGKMW-GQCTYLIASA-N 345.355 1.271 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1[C@H](C)[C@H]1OCC 1557114203 KSNJNRAHBMPASA-JCURWCKSSA-N 335.400 1.955 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@H](O)C(C)C)C2)cc1 1636854134 SXOREIDXORTYDX-PBHICJAKSA-N 335.448 1.980 10 10 EDCE CC(C)N1CCC(O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1636160483 UGNBUGDWFPAPDL-UHFFFAOYSA-N 347.419 1.814 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)COCC1CC1 1631530956 CADFYNLOKMVRKK-UHFFFAOYSA-N 341.791 1.974 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)cc1 1567100795 FMGMSFCFUSGARI-AWEZNQCLSA-N 342.355 1.888 10 10 EDCE O=C(NCc1c(O)cccc1F)c1cccc(Nc2nn[nH]n2)c1 1646034020 FFDFRVSLTHEMQJ-UHFFFAOYSA-N 328.307 1.718 10 10 EDCE CCCCN1C(=O)/C(=C/c2nc3ccccc3[nH]2)C(=O)NC1=S 2282522 HEYWPQQOXFQVQF-MDZDMXLPSA-N 328.397 1.990 10 10 EDCE CO[C@H](C)C(=O)N(C)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1687515236 DCEXQKAOBMNXMK-LLVKDONJSA-N 349.391 1.462 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H]2CCCNC2=O)cc1C 1699514681 TXIUOYSGNMGFME-INIZCTEOSA-N 347.459 1.468 10 10 EDCE COc1cccc(CNS(=O)(=O)c2c(C)nn(C)c2Cl)c1O 161110213 QSPGGNDKTZOULU-UHFFFAOYSA-N 345.808 1.575 10 10 EDCE COc1cc(NC(=O)c2cccc(O)c2O)c(C(N)=O)cc1OC 1142461449 VLLBSZSIPVCSEU-UHFFFAOYSA-N 332.312 1.466 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCC[C@@]1(O)[C@H](N)c1ccccc1O 1919860795 HBCGJUPXSNZVKA-CPUCHLNUSA-N 338.404 1.437 10 10 EDCE C[C@]1(c2cc(I)ccc2O)COCC(=O)N1 1951665726 IDVBFCQOMYCAQM-LLVKDONJSA-N 333.125 1.358 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCOC1 1985097003 ZNEGRUDNCZLHPX-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE C[C@@](NC(=O)C(F)(F)F)(C(=O)N1CC(N=[N+]=[N-])C1)C(F)(F)F 1985102984 OOVJTSNMXGQIGW-SSDOTTSWSA-N 333.192 1.507 10 10 EDCE CC1(C)CN(c2ccc(CN)cc2Br)C[C@@H](CO)O1 162924843 JGMOLIPLAJVDQM-NSHDSACASA-N 329.238 1.884 10 10 EDCE CC(C)(C)OC(=O)NCCOCCNC(=O)c1cccc(O)c1O 2006283147 GAUKRXARPUZEJS-UHFFFAOYSA-N 340.376 1.369 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2010396952 QERMTCIAGNHJKV-VXGBXAGGSA-N 341.412 1.811 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CC(C(=O)Nc2ccc(N)cc2)=C[C@@H]1O 2022935886 RDZYYMYLIQLFIV-KBPBESRZSA-N 333.388 1.792 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@](O)(C(N)=O)C2)c(Br)c1 312780812 NFJJDWPAPFIGFA-YMTOWFKASA-N 342.237 1.156 10 10 EDCE CC(CO)(CO)CNCc1cc(Cl)cc(Br)c1O 708134242 QAAOJNMEYBFDEC-UHFFFAOYSA-N 338.629 1.889 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@H](C)O[C@](C)(C(F)F)C3)c2n1 2063585179 DHUGMGKFKHCMFS-VFZGTOFNSA-N 340.330 1.628 10 10 EDCE NCc1ccc(N2CC(c3nc(O)[nH]c3O)C2)c(Br)c1 2184942499 YMFYJYFRCFXWST-UHFFFAOYSA-N 339.193 1.646 10 10 EDCE O=C1NC[C@H]2CN(c3ccc(CO)c(Br)c3)CC[C@H]12 2100940831 NFWKWRFGRJPURU-JQWIXIFHSA-N 325.206 1.514 10 10 EDCE O=C(O)[C@@H]1[C@@H]2OCCN(Cc3c(O)cccc3Br)[C@@H]21 2092839051 XBRKETBDGMGEOV-TUAOUCFPSA-N 328.162 1.439 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3COC[C@@]3(CO)C2)cc1Br 2234566783 MDNMCEHPEREWNM-HFAKWTLXSA-N 342.233 1.948 10 10 EDCE COc1cccc(N2C(=O)C(=Cc3cccn3C)C(=O)NC2=S)c1 2297060023 XVTMRJHCBVHOCE-UHFFFAOYSA-N 341.392 1.865 10 10 EDCE COc1cccc(CNC(=O)C=Cc2ccc(C(N)=O)cc2)c1O 2301549693 YNAWQHSJTXLECC-UHFFFAOYSA-N 326.352 1.829 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1ccc2cn[nH]c2c1)c1ccc(N)cc1 170318863 LWFVKTSUZUFKMS-UHFFFAOYSA-N 337.339 1.663 10 10 EDCE COc1cccc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)c1O 124498151 JAFRMIVFLPWZMJ-HNNXBMFYSA-N 334.416 1.472 10 10 EDCE COC(=O)[C@H]1C[C@H](OC)CN1Cc1cc(Br)ccc1O 125713908 IGBSASNNWPHEHO-NWDGAFQWSA-N 344.205 1.917 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3C[C@H]4CC[C@H]3C4)CC2)cc1 249747049 DHMFWUQIOVYYJP-RDJZCZTQSA-N 329.444 1.828 10 10 EDCE CCOc1ccccc1N(C)C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 255907374 HCGHETBYJDJWAB-KHPPLWFESA-N 343.383 1.159 10 10 EDCE COc1cc(O)c(CN2CCCC[C@H]2[C@H]2CNC(=O)C2)cc1OC 373218812 VDRKTGHWDIKESV-OCCSQVGLSA-N 334.416 1.900 10 10 EDCE CC[C@H](N[C@@H]1C[C@H](O)[C@H](O)[C@H]1O)c1cc(Br)ccc1O 2165120652 HTTSBHFXIHWLLO-XASJZRDYSA-N 346.221 1.050 10 10 EDCE COc1cc(Br)cc(CNC2COCCOC2)c1O 813789749 YOSAXMJGSDWMLM-UHFFFAOYSA-N 332.194 1.668 10 10 EDCE CN1CCC[C@](O)(CC(=O)NCCCSc2nccs2)C1 900683707 PEKQAYXONLDLFY-AWEZNQCLSA-N 329.491 1.588 10 10 EDCE COC(=O)N1CCC[C@H]([C@H](C)NC(=O)c2c(F)ccc(O)c2O)C1 828857434 CBSQAECYCCMMSV-UWVGGRQHSA-N 340.351 1.834 10 10 EDCE C[C@@H]1OC[C@H](NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)[C@H]1C 924728565 JKDLNNRZVLSLAP-DNUAJFIVSA-N 331.460 1.901 10 10 EDCE CN1CCC[C@H](N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)C1 925290956 GELCDHISELOPJK-ZDUSSCGKSA-N 337.807 1.904 10 10 EDCE CCn1cncc1S(=O)(=O)NCCCSc1nccs1 748675271 PWNRSWVGHNCVTM-UHFFFAOYSA-N 332.476 1.820 10 10 EDCE CCO/C=C\C(=O)OCc1cc(O)n2ncc(C(=O)OCC)c2n1 840592116 XHODGWGWTXFRHI-WAYWQWQTSA-N 335.316 1.205 10 10 EDCE COCCCn1nc(C(=O)NCc2ccc(N(C)C)cc2)ccc1=O 854271857 SSCDQKXMNMOYOF-UHFFFAOYSA-N 344.415 1.276 10 10 EDCE CCCN1C[C@@H](C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 855222940 DLQIPCACWAVGEV-GJZGRUSLSA-N 345.443 1.649 10 10 EDCE COC(=O)N(C)CCN(C)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 853865796 BLDMLWJLDQZOIZ-UHFFFAOYSA-N 338.320 1.060 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C3(CO)CCOCC3)C2)cc1 855223104 DYTRYFHSQDVSGM-CQSZACIVSA-N 334.416 1.179 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCNC(=O)C[C@H]3C)C2)cc1 854299905 LWUGDIUEVFFFTP-KGLIPLIRSA-N 346.431 1.194 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CSc3n[nH]c(O)n3)C2)cc1 855228151 WINUUWVWYBLOBG-JTQLQIEISA-N 349.416 1.006 10 10 EDCE COC(=O)c1cncc(N[C@H]2CCN(c3ccc(OC)cc3)C2)n1 853758838 LDAHQUYSPOPGAR-LBPRGKRZSA-N 328.372 1.963 10 10 EDCE COCC1(C)CN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 854296476 DQTUUPVJTGKQMV-CQSZACIVSA-N 333.432 1.952 10 10 EDCE CN(C)c1cc(F)c(CN2CCN(c3nncn3C)CC2)cc1F 862402261 KTZGHLPTUHCQOB-UHFFFAOYSA-N 336.390 1.482 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CN1 861765328 AGKUZFFHZBEAQS-ZBFHGGJFSA-N 344.459 1.160 10 10 EDCE NC(=O)CCCCC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1118775313 RFNCVJJLLDLIMC-UHFFFAOYSA-N 333.432 1.310 10 10 EDCE COC(=O)c1c(CN2CCCNC(=O)C2)c2cc(F)ccc2n1C 1119508032 UNKBPDZDGSGVCA-UHFFFAOYSA-N 333.363 1.426 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCSC[C@H]2CCO)cc1F 775423505 NWWXVNMROGCQMX-CYBMUJFWSA-N 341.452 1.901 10 10 EDCE CC(C)N(Cc1cc(Br)cc(F)c1O)C[C@H](O)CO 895036673 OGHYIRZOTOWTOV-NSHDSACASA-N 336.201 1.857 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CCS(=O)(=O)c2ccccc21 1303225311 FXFRFHYPJAWWGJ-AWEZNQCLSA-N 347.392 1.675 10 10 EDCE C[C@H](NCc1c(O)cccc1Br)[C@@H]1CN(C)CCN1C 1462587047 DRWBLPZQQMHEMA-FZMZJTMJSA-N 342.281 1.879 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@@H](NC3CCOCC3)C2)c(O)c1O 1176467136 NMSHEPLKQKTLMA-CQSZACIVSA-N 334.416 1.779 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC2(CCNCC2)CC1 1335718827 ZUXUQLYMLXOWIY-UHFFFAOYSA-N 343.427 1.227 10 10 EDCE CC[C@H](CNC(=O)C1CC1)NCc1nnnn1-c1ccc(OC)cc1 1269361408 WSLQXDZVOKQHJJ-CYBMUJFWSA-N 344.419 1.065 10 10 EDCE C[C@@H]1CCOCCN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1351067560 AGQNLRFYVBANRA-CQSZACIVSA-N 345.443 1.323 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)CC2(C)CC2)cc(OC)n1 1295566945 MEHRMLRDCMDDOH-LLVKDONJSA-N 335.404 1.524 10 10 EDCE C[C@@H]1CN=C(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)S1 1293435454 MJCISSFSVMLXDI-LLVKDONJSA-N 335.429 1.276 10 10 EDCE Oc1c(Br)cccc1CN[C@@]12CC[C@@H](C1)[C@@H](O)[C@H]2O 2120387801 BZGHEFAYOJHCES-IYMWITQMSA-N 328.206 1.519 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)C[C@@H]2COC(=O)C2)cc1C 1482089445 JZHJEDMWYPPXDS-CJNGLKHVSA-N 348.443 1.799 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@H]2[C@H](O)CO)cc1Br 2123209816 JUVDWNYYPMTEGR-BIGNPOOSSA-N 329.238 1.791 10 10 EDCE COc1ccc(-n2nnnc2CN[C@H](C)CCNC(=O)C(C)C)cc1 1567210074 ZQIUJCFPHDMLTH-CYBMUJFWSA-N 346.435 1.311 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cnsn2)cc1C 1568818893 BCTIDBZAFQSARB-ONEGZZNKSA-N 332.429 1.931 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cnc(C)o1 1633472878 IJRGOAMVRDCHPW-ZDUSSCGKSA-N 348.355 1.227 10 10 EDCE COCCC(=O)NC[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1734737631 PYIHSINCQMLHSM-NSHDSACASA-N 349.391 1.462 10 10 EDCE Cc1cccc2c(=O)n(CC(=O)NCc3ccc(O)cc3O)cnc12 1643100741 IZMIHGSTHZWQTN-UHFFFAOYSA-N 339.351 1.433 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@]1(O)CCCc2ccccc21 1586024764 MWNYKEARIBYNKN-IBGZPJMESA-N 327.380 1.981 10 10 EDCE COCCC(=O)N(C)[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1678218872 JBQBCMKHSJGGTL-NSHDSACASA-N 349.391 1.462 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)cc1Br 2126159281 QBLXSVLPFQEYGK-RDBQEKCUSA-N 328.206 1.119 10 10 EDCE COc1cc(C)cc(CN2CCN(Cc3nccn3C)CC2)c1O 164300617 CEMSTENBLRLUEM-UHFFFAOYSA-N 330.432 1.761 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2140662023 JVENZGIMUWSRLJ-HPXOCHMKSA-N 334.185 1.382 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1[C@H](O)[C@@H](N)c1ccccc1O 2005036036 MVJXJZJHDRLRIJ-SNPRPXQTSA-N 338.404 1.389 10 10 EDCE CN1CCc2cc([C@@H](N)[C@@H](O)CCNC(=O)OC(C)(C)C)ccc21 1999527063 IRHXMQLWAVHOCB-JKSUJKDBSA-N 335.448 1.954 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010404912 VPCDVPLSORRUBY-IJLUTSLNSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NCc2cc(F)cc(F)c2O)C1 2011488458 WUJYLAVVAQMTPB-OLZOCXBDSA-N 344.358 1.740 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)COC1 2014494715 IQEUWERJUHEEBY-LLVKDONJSA-N 339.396 1.687 10 10 EDCE CCCn1nnc(Br)c1[C@H](O)[C@H](N)c1ccccc1O 2156513559 FMUADFKQPXZXHD-ZYHUDNBSSA-N 341.209 1.890 10 10 EDCE NCc1ccc(N2CC[C@@H]3C(=O)NC[C@@H]3C2)c(F)c1Br 2157192973 ZIOCAAXONRWLCW-ZJUUUORDSA-N 342.212 1.619 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC(C)(O)C3)c(Br)cc21 384030742 GDUAGMPFGXWNPW-LLVKDONJSA-N 326.194 1.233 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCC(C)(C)N3CCCCC3)c2n1 2065177203 LAQJGLIZCUZGOJ-UHFFFAOYSA-N 331.420 1.738 10 10 EDCE COc1ccc(Br)c(CN2CC[C@@H](C(N)=O)C2)c1O 1231554608 ZKXHLRPARZRCLN-MRVPVSSYSA-N 329.194 1.471 10 10 EDCE COc1ccc(Br)c(CN2CC[C@@H](NC(C)=O)C2)c1O 1231558232 YTBKWGZXFKPZAM-SNVBAGLBSA-N 343.221 1.874 10 10 EDCE C[C@H](O)CN1CCN(c2ccc([C@@H](C)N)cc2Br)CC1 2170215248 DCINOJZGMCFODO-NWDGAFQWSA-N 342.281 1.972 10 10 EDCE O=C1C[C@H]2CCN(Cc3cc(Br)ccc3O)C[C@H]2N1 2088805000 ASNXOLUUAKPTQA-BXKDBHETSA-N 325.206 1.865 10 10 EDCE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2COc1nnc(=N)[nH]n1 2213791573 FZOUQHCNLYEWNJ-JTQLQIEISA-N 336.396 1.095 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@H](O)CC2)cc1Br 2269120762 HALXVVGKTXCJIX-FZQKWOKYSA-N 329.238 1.791 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2336471292 QKVQQCHMODZSRZ-ZDMBXUJBSA-N 345.262 1.702 10 10 EDCE C[C@@H](NC(=O)/C=C/c1ccc(N2CCOCC2)cc1)C(=O)N(C)C 171981417 DPTOBASRACWFDL-VIIAAUOXSA-N 331.416 1.129 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(Cc2ccon2)CC1 181129627 HJLQKTLAEWSIIM-DUXPYHPUSA-N 329.356 1.443 10 10 EDCE CC(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(N)cc2)cc1 194414107 GMWYMGBGTWHBPG-UHFFFAOYSA-N 333.413 1.748 10 10 EDCE O=C1NC(=O)[C@@]2(CCCN(Cc3cc(Cl)cc(Cl)c3O)C2)N1 193471737 WLGCZEDFTJIMFG-AWEZNQCLSA-N 344.198 1.873 10 10 EDCE C[C@H]1C(=O)NCCN1c1ccc(/C=C/C(=O)O)c(Br)c1 235351501 IMYARQIJDQPOAG-SGRBOOSSSA-N 339.189 1.872 10 10 EDCE COc1ccc(CNC[C@]2(CO)COCC3(CCC3)N2C)cc1C 527752405 GHHJJNJSXQWMLC-IBGZPJMESA-N 334.460 1.709 10 10 EDCE O=C(O)[C@H]1COCCN(Cc2cc(Br)ccc2O)C1 700452518 UFQGODKDUNKBKY-SNVBAGLBSA-N 330.178 1.688 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@]3(C)CCCO3)CC2)cc1 267943585 DHIDRCPUHGAORQ-IBGZPJMESA-N 347.459 1.503 10 10 EDCE Cc1cc(Cl)cc(CNCCNS(=O)(=O)NC(C)C)c1O 277395182 GQHXPEXRSBUBAL-UHFFFAOYSA-N 335.857 1.276 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)NCCCC3CC3)ccc21 803688251 NSIDVIYPXYQGER-UHFFFAOYSA-N 329.444 1.992 10 10 EDCE CO[C@H](CS(=O)(=O)NCCCSc1nccs1)C1CC1 827149508 LCTRDUNDLUFPAL-LLVKDONJSA-N 336.504 1.970 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1C[C@@H](C)CO1 901326010 CZKANEFKHBMUAI-YGRLFVJLSA-N 341.791 1.972 10 10 EDCE C/C=C/[C@@H](O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 900014282 HWVBXWUCMCIDBJ-YWPBOTNQSA-N 347.459 1.261 10 10 EDCE CCNC(=O)N1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 900031310 GTWHQPDYELDSPR-UHFFFAOYSA-N 349.412 1.800 10 10 EDCE Cn1nccc1[C@H]1NC(=O)N(CCCSc2nccs2)C1=O 843310822 NANKKMMMXVYTII-SNVBAGLBSA-N 337.430 1.652 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)C1C[C@@H]2CC[C@H](C1)N2 844221448 MXHZMFGVOVLXJF-JJTKIYQPSA-N 344.503 1.926 10 10 EDCE CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)NCCc1ccc(N)cc1 841960121 VHDOOGQRAXHYQK-JKSUJKDBSA-N 349.431 1.563 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NC[C@@H]1COCO1 923845287 XBWYAAFBGHQEHV-SNVBAGLBSA-N 331.166 1.327 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3cccnc3)C2)cc1 850537322 SZSCAOBKBRSVBR-CQSZACIVSA-N 340.383 1.424 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)CC2(OC)CCC2)c1 866842642 YBDGJKJCQBNHBD-NSHDSACASA-N 329.418 1.950 10 10 EDCE CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 875141221 NODAIQBOGWMKCO-UHFFFAOYSA-N 349.406 1.336 10 10 EDCE C[C@H](C(=O)N(C)CC(=O)N1Cc2cccc(O)c2C1)n1cccn1 871201665 YCDHNECQSAWRHC-GFCCVEGCSA-N 328.372 1.151 10 10 EDCE CNC(=O)c1cccc(OCC(=O)NCc2ccc(O)c(O)c2)c1 778914729 KSFPTJWDZWEPNV-UHFFFAOYSA-N 330.340 1.153 10 10 EDCE COCCn1cc(C(=O)N2Cc3cccc(O)c3C2)c(=O)cc1C 871205191 QVCSDYQORUCSMD-UHFFFAOYSA-N 328.368 1.665 10 10 EDCE C[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@H]1F 778468271 LWPRSRRVXPAJAH-BXKDBHETSA-N 330.381 1.584 10 10 EDCE COCc1nc(C(=O)NCc2ccc(N3CCOCC3)cc2)co1 775812893 GPIGBPNVQXBKRV-UHFFFAOYSA-N 331.372 1.588 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)NCc1ccc(N(CC)CC)c(F)c1 773960946 YWDRYEDFPBSULE-HNNXBMFYSA-N 340.395 1.602 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C(=O)N(C)CCN=[N+]=[N-])CO1 1895876051 PYOZOXRLDKUELV-GHMZBOCLSA-N 327.385 1.780 10 10 EDCE CN1C(=O)C(=Cc2ccc(Cl)cc2-n2cncn2)C(=O)N(C)C1=O 794925659 BYUYOTPJEUUMQD-UHFFFAOYSA-N 345.746 1.355 10 10 EDCE COC(=O)c1cccc(S(=O)(=O)Nc2ccc(O)c(OC)c2)c1 797820480 ZTRMDGXFVQCTNJ-UHFFFAOYSA-N 337.353 1.988 10 10 EDCE COc1cc(C)cc(CN2CCN(CC(F)(F)F)C(=O)C2)c1O 795727776 UOJNMDVSGHYSJO-UHFFFAOYSA-N 332.322 1.916 10 10 EDCE C[C@@]1(O)CCN(c2ccc(CO)cc2Br)C[C@@]1(C)O 1880700564 DEXRIJLRAHPZEC-ZIAGYGMSSA-N 330.222 1.654 10 10 EDCE COC(=O)[C@H]1C[C@H]2Cc3c(Cl)ccc(OC)c3C(=O)[C-]2C(=O)C1=O 1088680876 ANSNNXMNISCOJB-APPZFPTMSA-N 349.746 1.609 10 10 EDCE NC(=O)CCN(Cc1ccccc1)S(=O)(=O)Cc1ccc(N)cc1 393931300 NASWCURDMMVWBG-UHFFFAOYSA-N 347.440 1.476 10 10 EDCE OCC1CCN(c2ccc(CNc3cnc(O)nc3O)cc2)CC1 1248728301 GTMSCTRVKKEDPR-UHFFFAOYSA-N 330.388 1.709 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@](C)(O)[C@H](O)C2)cc1Br 1893332424 RHGBULMBGZKFKC-CUOATXAZSA-N 330.222 1.824 10 10 EDCE CN(C)C[C@]1(O)CCN(c2ccc(CN)c(Br)c2)C1 713652502 AFRCXNUFIKMPHI-CQSZACIVSA-N 328.254 1.411 10 10 EDCE CC[C@H](CNC(=O)[C@H]1CCNC(=O)C1)NCc1ccc(OC)c(C)c1 1269390325 LHGAULDKLPELLQ-JKSUJKDBSA-N 347.459 1.514 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccn2nnnc2c1 1351674619 WVOOATLTCWQKFH-UHFFFAOYSA-N 336.399 1.997 10 10 EDCE O=C1NCCN(C(=O)Cc2ccc(O)c(O)c2)[C@H]1c1ccccc1 1443015535 JETSBXSVRUDPCQ-KRWDZBQOSA-N 326.352 1.340 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCn2cccn2)cc1C 1480427333 VAMAVHANIIYWKR-OAHLLOKOSA-N 330.432 1.885 10 10 EDCE Cc1nn(C)c(-n2cccn2)c1C(=O)NCc1c(O)cccc1O 1558533361 DKUVOVKQOIBLBW-UHFFFAOYSA-N 327.344 1.255 10 10 EDCE COc1ccc(CN[C@@H]2CCN(C(=O)CNC(C)=O)C[C@H]2C)cc1C 1715408661 YEWDIGRXJLLMAZ-RHSMWYFYSA-N 347.459 1.466 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC[C@@H]1C(=O)Nc2ccccc21 1624727660 JXFXXNFYESWYAL-ZDUSSCGKSA-N 326.352 1.883 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1 1626346403 VPGNNTZGYSERPC-CABCVRRESA-N 345.403 1.520 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@H](C)NC(N)=O)C2CC2)cc1C 1566708608 SMYDVPXBLIAYAM-WFASDCNBSA-N 348.447 1.045 10 10 EDCE CC[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)C[C@@H](C)S1(=O)=O 1636136214 DQRCIIPAAKFWJC-PWSUYJOCSA-N 327.402 1.064 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC2(CCO)CN(CC3CC3)C2)cc1 1734076248 YGZQDKQZRUBIOV-UHFFFAOYSA-N 345.403 1.426 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)C[C@H]2CCC(=O)N2)cc1C 1732913156 VSPNESBOYSTFIZ-MJSXRHKHSA-N 345.443 1.434 10 10 EDCE CN(C)C(=O)Cn1c(C2CC2)nnc1N(C)Cc1ccccc1O 1747541806 YRYMHMODRJDNMA-UHFFFAOYSA-N 329.404 1.586 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCc2cc(Cl)ccc2O)o1 1583816031 AUXIMEPKVRMNCE-UHFFFAOYSA-N 329.761 1.972 10 10 EDCE C[C@@H](CNCc1ccon1)CNC(=O)c1ccc(N=NC(N)=O)cc1 1666673184 NMBAMDSKNPJYGL-NSHDSACASA-N 344.375 1.993 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)Cn2ccnc2C)cc1C 1690649450 XYHWNBYXDJGSDF-AWEZNQCLSA-N 330.432 1.803 10 10 EDCE COCCNC[C@H]1CCC[C@@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1699037441 VAYFZACXXIWBNG-HIFRSBDPSA-N 347.419 1.984 10 10 EDCE CNC(=O)[C@@]1(C)CCN(c2ccc(CN)c(Br)c2)C1 230893136 GETXREULPUXTOZ-AWEZNQCLSA-N 326.238 1.870 10 10 EDCE Oc1ccccc1CN=c1ccc(I)n[nH]1 1981423511 FLXXYYFOZQZPHP-UHFFFAOYSA-N 327.125 1.821 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985094890 VNZAHWUIAHQCKR-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@](O)(C(=O)NCCCN=[N+]=[N-])C1 1986145671 XCKULALAFDLSIP-AWEZNQCLSA-N 327.385 1.565 10 10 EDCE C[C@H](N)c1ccc(N(C)C2CS(=O)(=O)C2)c(Br)c1 2034767596 DCNMKQMBWZGUEZ-QMMMGPOBSA-N 333.251 1.702 10 10 EDCE O=C(O)CC1(O)CCN(Cc2c(O)cccc2Br)CC1 2160863038 WMNVAAWNNCEXGH-UHFFFAOYSA-N 344.205 1.956 10 10 EDCE COC(=O)C1(O)CN(c2ccc([C@H](C)N)cc2Br)C1 714428416 XHOGMSQYSCJWIR-QMMMGPOBSA-N 329.194 1.193 10 10 EDCE CC(C)(C)OC(=O)N1CC(NCc2ccc3c(c2)CCO3)(C(N)=O)C1 715547109 YAFQIGJUECMOGG-UHFFFAOYSA-N 347.415 1.186 10 10 EDCE CN[C@H](C)c1ccc(N2CC(O)(COC)C2)c(Br)c1 394926580 JREFCOJWMZSMFO-SNVBAGLBSA-N 329.238 1.927 10 10 EDCE CN1CC[C@H]2OCCN(c3ccc(CO)c(Br)c3)[C@@H]2C1 2185588181 HJHAKUFJZSWMKI-HUUCEWRRSA-N 341.249 1.851 10 10 EDCE NCc1ccc(N2CC[C@]3(O)CCOC[C@H]3C2)cc1Br 2194549527 CVLPLIYQUZGTQH-DOMZBBRYSA-N 341.249 1.886 10 10 EDCE O=S1(=O)C[C@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]2C1 2087858666 PQAAUAFIXUYTQY-GHMZBOCLSA-N 346.246 1.631 10 10 EDCE C[C@H]1CN(C(=O)C=Cc2cn(C)c(=O)n(C)c2=O)c2ccccc21 2297310896 OGRKKYNDNOBAML-LBPRGKRZSA-N 325.368 1.248 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1(NC(=O)OC(C)(C)C)CC(CO)C1 2300530964 YYCDLWWJDXOMEL-UHFFFAOYSA-N 341.412 1.811 10 10 EDCE Cc1ccc(CNS(=O)(=O)C[C@@H](C)N)c(O)c1Br 2327595336 RXXUOQVVQJCKDL-MRVPVSSYSA-N 337.239 1.230 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2329194987 RDRXOLSOWGROBM-HHSCNIOUSA-N 327.222 1.665 10 10 EDCE Cc1ccc(CN(C)CC2(CO)COC2)c(O)c1Br 2352656470 OWVZMIMEFHFRQH-UHFFFAOYSA-N 330.222 1.904 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(Br)c1 2355338506 BVUPWACLWUUMEU-ZAJSEHCFSA-N 342.233 1.823 10 10 EDCE C[C@H](Cn1cncn1)NC(=O)NCc1ccc2c(c1)CCCN2C 102010919 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COc1ccc(N2CC[C@@H](N3C(=O)[C@H]4CSCCN4C3=O)C2)cc1 849356645 GGHLGSXCEYITRP-UKRRQHHQSA-N 347.440 1.654 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)CC3(N)CC3)CC2)cc1 852872570 HXTHTZLSGFTVMQ-UHFFFAOYSA-N 346.475 1.205 10 10 EDCE C[C@H](NCCCN1CCCS1(=O)=O)c1cc(F)cc(F)c1O 756689195 SZNXYMDRMWMOIA-JTQLQIEISA-N 334.388 1.747 10 10 EDCE COc1ccc(N2CCN(CCNCc3ncc(C)[nH]3)CC2)cc1 850089690 DIDQEGPNUBLAII-UHFFFAOYSA-N 329.448 1.639 10 10 EDCE COC(=O)C[C@H](O)CNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 863012947 GIPMDOAVNLWVKE-KRWDZBQOSA-N 344.411 1.677 10 10 EDCE C[C@H](NC(=O)Cc1ccnn1C)c1ccc(N2CCOCC2)cc1 766483945 IJDGULDBISBXIG-AWEZNQCLSA-N 328.416 1.677 10 10 EDCE COCCN(CCO)Cc1c(C(=O)OC)n(C)c2ccc(F)cc12 893995789 PWDJZKYVMVUOOK-UHFFFAOYSA-N 338.379 1.545 10 10 EDCE COC(=O)c1ccc(S(=O)(=O)Nc2ccc(O)c(OC)c2)o1 797819369 HIZZWBIZYJQRLX-UHFFFAOYSA-N 327.314 1.581 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CCCS(=O)(=O)C2)cc1 1141687486 PAZLSYXSISQHEW-SNVBAGLBSA-N 338.389 1.404 10 10 EDCE O=C(CNC(=O)Cc1ccc(O)cc1)NCc1cc(Cl)ccc1O 1300395813 DVTQUGJCDKVFGD-UHFFFAOYSA-N 348.786 1.726 10 10 EDCE COC(=O)[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(O)c(O)c1 1164161001 VPCCUPNHGRCPEI-CQSZACIVSA-N 329.352 1.541 10 10 EDCE CO[C@@H](C)CN(C)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1316866807 CZNWYZPSZOJVCR-LBPRGKRZSA-N 335.408 1.936 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@@]4(CNC(=O)C4)C3)cc2F)CC1 1320962094 BEGWSIRAULQZBH-LJQANCHMSA-N 346.450 1.290 10 10 EDCE COC(=O)C1(O)CN(c2ccc([C@H](C)O)cc2Br)C1 714489545 YOWKELGZUHHVFX-QMMMGPOBSA-N 330.178 1.227 10 10 EDCE CCOC(=O)[C@]1(CNC(=O)/C=C/c2ccc(O)c(O)c2)CCCOC1 1454294930 HORCLRUHLUHWPL-FZMUQLTDSA-N 349.383 1.587 10 10 EDCE NC[C@]12CN(Cc3cc(Br)ccc3O)C[C@H]1CCO2 2118561202 IFIJHKCPJKDFIG-RISCZKNCSA-N 327.222 1.704 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)c2ccccc2O1 1540608599 GCHRYMFGGXUAEN-INIZCTEOSA-N 343.335 1.608 10 10 EDCE CCS(=O)(=O)C1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 1558973659 AURPCYFVASVPEE-UHFFFAOYSA-N 331.365 1.276 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2cn(C)nn2)cc1C 1714597999 SUWPIHSVHRCMMA-ZDUSSCGKSA-N 331.420 1.382 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2cnn(C)n2)cc1C 1725117578 XCRDAAPFEFXDJX-QWHCGFSZSA-N 331.420 1.429 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)Cc2ccn(C)n2)cc1C 1569056934 VKNSZAKFVORACB-AWEZNQCLSA-N 330.432 1.574 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2CCN(C)C2)cc1C 1734353733 CNFTXWRMDBFBTM-WBVHZDCISA-N 333.476 1.892 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)CC(F)(F)F)cc1C 1677060856 KXSWYMRRXTWGKF-ZDUSSCGKSA-N 348.365 1.865 10 10 EDCE O=C(Cn1cnnn1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874179811 QOXAPNMRDSBCBJ-UHFFFAOYSA-N 333.307 1.087 10 10 EDCE [N-]=[N+]=NC1CN(Cc2cc(=O)n3cc(Br)ccc3n2)C1 1912159660 KSYXEMQTHJQULS-UHFFFAOYSA-N 335.165 1.952 10 10 EDCE CNCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1Br 234437197 DLHRGRSYTOLUJU-LLVKDONJSA-N 326.238 1.870 10 10 EDCE COc1ccc(Br)c(CN[C@]2(C)CCNC2=O)c1O 1969998564 RZFPPEGDZDEDGB-CYBMUJFWSA-N 329.194 1.532 10 10 EDCE Cc1cc(Br)cc(CN2CC[C@H](NC(N)=O)C2)c1O 271758074 AYHATQIXYJDNPU-NSHDSACASA-N 328.210 1.706 10 10 EDCE CC(C)(C)OC(=O)N1CCCN1S(=O)(=O)Cc1ccc(N)cc1 1977887674 GTCCYHAQJYKNCZ-UHFFFAOYSA-N 341.433 1.956 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@@H]1COC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985101557 UOQABOZKKBAJIT-GHMZBOCLSA-N 325.369 1.389 10 10 EDCE CC(C)(C)OC(=O)N1CC(NCc2c(O)cccc2F)(C(=O)O)C1 1997943691 AWMAJBUFGOCQLB-UHFFFAOYSA-N 340.351 1.695 10 10 EDCE CN(CC1(O)CC(NC(=O)OC(C)(C)C)C1)c1ccc(CN)cc1 1999371248 MNGRAVXINIMJFV-UHFFFAOYSA-N 335.448 2.000 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COCC[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003168943 YALVMDJVWVHBDK-LPWJVIDDSA-N 340.420 1.182 10 10 EDCE CN(C)C(=O)CN(Cc1ccccc1)c1ccc2c(c1)NC(=O)[C@H]2N 2034783833 UEDBTVDLKGWVCW-SFHVURJKSA-N 338.411 1.733 10 10 EDCE COC(=O)[C@H]1C[C@H](OC)CN1C(=O)C=Cc1ccc(N(C)C)cc1 2053622077 KROJOKOTJBECFK-JKSUJKDBSA-N 332.400 1.555 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@@]4(C)CN(C)C[C@]4(C)C3)c2n1 2062005658 CAVTVWWXUCITNW-IAGOWNOFSA-N 329.404 1.157 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H]3CCCO[C@@H]3C(C)C)c2n1 2063383871 LZTNTTSGJVKAQD-IUODEOHRSA-N 332.404 1.924 10 10 EDCE CCS(=O)(=O)CCN(C)c1ccc(CO)cc1Br 2050987649 CKVQXLYYRDQIMG-UHFFFAOYSA-N 336.251 1.812 10 10 EDCE CN1CCO[C@H]2CCN(c3ccc(CN)cc3Br)C[C@H]21 2185491719 HDGRHVJMXDNTNN-CABCVRRESA-N 340.265 1.817 10 10 EDCE C[P@]1(=O)C[C@@H](O)[C@@H](NCc2ccc(Br)cc2O)C1 2057717505 FSAZETFEEOTBFP-GLUANWCPSA-N 334.150 1.980 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CC(C(=O)NCc2ccccc2O)=C[C@H]1O 2067793007 QQKBEAFEXRKPEB-DZGCQCFKSA-N 348.399 1.593 10 10 EDCE N[C@@H]1CN(Cc2cc(Br)cc(F)c2O)[C@H]2COC[C@@H]12 2102138793 XLHVQBSMTDMYCC-WCQGTBRESA-N 331.185 1.452 10 10 EDCE COc1ccc(N2CCNC[C@@H]2CO)c(OC)c1Br 2106377724 QUZRDJDUPVGHBE-SECBINFHSA-N 331.210 1.237 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCN(C)C2=O)c1O 2227746749 QABXBDMYULRNFT-JTQLQIEISA-N 329.194 1.484 10 10 EDCE COc1ccc(Br)c(CN[C@H]2COC[C@H]2CO)c1O 2227748197 LHRAKCRXPIBTAZ-KCJUWKMLSA-N 332.194 1.260 10 10 EDCE CCN[C@@H]1CC[C@H]1CS(=O)(=O)NCc1cnc(SC)s1 2284693841 ZCMKKBQVHLLNHO-GXSJLCMTSA-N 335.520 1.673 10 10 EDCE CNCc1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)cc1Br 2336395876 WLVRSOLZMSSVOJ-ZWNOBZJWSA-N 345.262 1.402 10 10 EDCE CN1CCC[C@@H](CN(C)c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 301696661 PZRIXSPJVWSJHM-LLVKDONJSA-N 334.376 1.704 10 10 EDCE C[C@H](NC[C@@H](C)N1CCOCC1)c1ccc(N2CCOCC2)cc1 123213579 FKJGYCQFAMDKLV-SJORKVTESA-N 333.476 1.895 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)Cc1nc(N(C)C)no1 192693058 BQMMEYDSWULDRI-UHFFFAOYSA-N 331.420 1.604 10 10 EDCE COC(=O)c1cccc(S(=O)(=O)N(C(C)=O)c2ccc(N)cc2)c1 244217347 VXTNATPEGJPDHC-UHFFFAOYSA-N 348.380 1.797 10 10 EDCE CCOc1cccc(CN2CC[C@H]3CC[C@@H](C2)S3(=O)=O)c1O 529671337 HCXBYXCMDYSUBZ-KGLIPLIRSA-N 325.430 1.942 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2NCCO[C@@H]2C)c(O)c1Br 2380747873 YFCCXXVQSQVLEU-SKDRFNHKSA-N 343.221 1.456 10 10 EDCE C[C@H](NC(=O)C(=O)NCCOC(C)(C)C)c1ccc(N(C)C)cc1 807673785 ZBMKIKFOBNDCJW-ZDUSSCGKSA-N 335.448 1.861 10 10 EDCE NCc1cc(F)c(N2CCN(C(N)=O)CC2)cc1Br 721769154 ODDQOHIIVVNDJF-UHFFFAOYSA-N 331.189 1.248 10 10 EDCE C[C@H](NC(=O)[C@@]1(C)C[C@@H](O)CN1C)c1ccc(N2CCOCC2)cc1 900386820 HUCCZCXVKSYQHE-POZUXBRTSA-N 347.459 1.156 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NC[C@@H]1CC[C@@H](O)C1 588576132 QCVWPAYWELRDNA-QDBVJCLKSA-N 330.428 1.814 10 10 EDCE COc1ccc(N2CCC(NC(=O)CC(F)(F)CN)CC2)cc1 846674004 VATMHXVZJAJGEW-UHFFFAOYSA-N 327.375 1.764 10 10 EDCE C[C@H]1[C@@H](NC(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCN1C 924009674 YFPOLBQASUQTCP-YJBOKZPZSA-N 345.491 1.330 10 10 EDCE CN(C)CCC[C@@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)CCO1 853625649 UTBPGSZBPOKYGV-RHSMWYFYSA-N 336.432 1.361 10 10 EDCE NC(=O)c1ccc(NS(=O)(=O)c2cc(F)cc(F)c2O)cc1 753019006 PLMRXPWEPIXUBM-UHFFFAOYSA-N 328.296 1.570 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H]([C@H](O)c3cccnc3)C2=O)cc1 924445516 OGTCCEQXXLVVSY-HZPDHXFCSA-N 340.383 1.302 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC[C@@H](C)N(C)C)C2)cc1 854295933 FCALXDSJXUMYKE-CABCVRRESA-N 334.464 1.913 10 10 EDCE CCN(CC)c1ccc(CNC[C@]2(CO)COCCN2C)cc1F 922535614 JVQMTMQRANUFHQ-SFHVURJKSA-N 339.455 1.455 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@H]2CC2(F)F)c1 857351025 XFFHWDLPKMTPCZ-QMMMGPOBSA-N 334.344 1.539 10 10 EDCE NC1(C(=O)NCc2ccc(N3CCOCC3)cc2)CC2(CCC2)C1 852859293 RASHNVOPIHSGBF-UHFFFAOYSA-N 329.444 1.801 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@](F)(CO)C3)C2)cc1 854297270 LNNLULFUDCBBLI-SUMWQHHRSA-N 337.395 1.390 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCOC[C@H]1CCO 758360993 IOKOZWBJMQTDHB-QGZVFWFLSA-N 333.432 1.580 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCCN3C(C)=O)C2)cc1 857634590 JSJQODZDSQHRRG-YOEHRIQHSA-N 331.416 1.401 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1OCCO[C@@H]1C(F)(F)F 866757193 LYGXZZCCBPCFQO-NEPJUHHUSA-N 335.278 1.103 10 10 EDCE CCOc1ccc(CN2CCN(c3cc(OC)ncn3)CC2)c(O)c1 764676032 DJSRVZWRLUJMTF-UHFFFAOYSA-N 344.415 1.912 10 10 EDCE CCCN(C)C[C@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1119015171 LGJSFOWDVXUUJY-CQSZACIVSA-N 345.443 1.425 10 10 EDCE COCC(O)(CNCc1cccc(Br)c1O)COC 1875695743 WEYRMJDWQPBNEO-UHFFFAOYSA-N 334.210 1.268 10 10 EDCE C[C@H]1[C@@H](O)CCCN1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 889662303 BZVWJKGLXUIFDW-YJBOKZPZSA-N 346.475 1.493 10 10 EDCE CC(C)(C)NS(=O)(=O)C1(CNC(=O)c2cc(O)cs2)CC1 881874139 YUHHXOYNMYJBOL-UHFFFAOYSA-N 332.447 1.434 10 10 EDCE O=C(NC[C@@]1(O)[C@@H]2[C@@H]3[C@H]4[C@H]5C[C@@H]3[C@H]1[C@@H]5C[C@H]42)c1cccc(O)c1O 787680220 BBPKBDLWUNNSBV-HDSPRERQSA-N 327.380 1.337 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCc1cnn(C)n1 1135946048 CDZZPVWDXROHNS-UHFFFAOYSA-N 343.431 1.243 10 10 EDCE COC(=O)COc1ccc(N(C)C[C@@H]2[C@H](C(=O)OC)C2(F)F)cc1 894446343 SKEJYQYETRBQGN-TZMCWYRMSA-N 343.326 1.729 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)NCCCCN=[N+]=[N-] 1895876209 RYOIVZNLHKFQLF-WDEREUQCSA-N 327.385 1.733 10 10 EDCE Cc1cc(C(=O)NCCc2nc(=O)o[nH]2)c(C)n1-c1ccc(F)cc1 790076637 JEDJPHMBJBIECO-UHFFFAOYSA-N 344.346 1.882 10 10 EDCE COc1ccc(N2CCN(CCNCC3CCN(C)CC3)CC2)cc1 892702483 BTCVPGCHKLLRQR-UHFFFAOYSA-N 346.519 1.749 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2CNC(=O)C2)c1O 1964035557 RSIULTWBFZRQDA-MRVPVSSYSA-N 329.194 1.389 10 10 EDCE O=C(C(=O)N1CCC[C@@H]1[C@@H]1CCCOC1)N1Cc2cccc(O)c2C1 1329866060 OTVZPJRTKMMNNQ-GDBMZVCRSA-N 344.411 1.652 10 10 EDCE CCC1(CO)CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329437923 RATXAYUIMYDNSY-UHFFFAOYSA-N 332.400 1.246 10 10 EDCE COC(=O)C[C@H](Cc1ccccc1)NC(=O)Cc1ccc(O)c(O)c1 1180040296 IVCZBVGJZZAZKI-HNNXBMFYSA-N 343.379 1.931 10 10 EDCE O=Cc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)nc1 1332965368 QQGYUJOWVCFBMA-UHFFFAOYSA-N 343.358 1.800 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2[nH]c(O)nc2C)cc1C 1277854910 OXQHKNQZDVKDKU-LBPRGKRZSA-N 346.431 1.991 10 10 EDCE Cn1ncc2c(O)nc(NC(=O)c3ccc(C4=S=CC=C4)o3)nc21 1461867429 NFMAYTYSGLOMJK-UHFFFAOYSA-N 341.352 1.540 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@H](C)NC(=O)C1CC1 1701115888 NEDRSFMXXMEMAH-UWVGGRQHSA-N 331.376 1.882 10 10 EDCE Cc1ccc2ncc(C(=O)NCc3c(O)cccc3F)c(=O)n2c1 1471974368 ATXUQGCVBGMEFQ-UHFFFAOYSA-N 327.315 1.778 10 10 EDCE C[C@H](O)c1ccc(N2CC3(CNC(=O)N3)C2)c(Br)c1 2121183046 ZOEXZVBLQCGSCC-QMMMGPOBSA-N 326.194 1.374 10 10 EDCE CCOC(=O)C[C@@H](CO)NC(=O)c1cc2cc(O)c(O)cc2s1 1625388294 WSULENUQFQTOOK-VIFPVBQESA-N 339.369 1.356 10 10 EDCE CO[C@H](C)CN(C)[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1485391534 VOMAJRABCAVVOC-NWDGAFQWSA-N 335.408 1.934 10 10 EDCE COC[C@H](C)N[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1731493173 PUHGNOCTOKJZEU-LEWSCRJBSA-N 333.392 1.734 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)[C@@H]2CC23CC3)cc(OC)n1 1572305257 RIUCILYWVXAHCR-AAEUAGOBSA-N 347.415 1.476 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2ccnn2C)cc1C 1734316147 AOMGHSUOKAPGOM-AWEZNQCLSA-N 330.432 1.987 10 10 EDCE CC[C@@H](NC(C)=O)C(=O)NC[C@@H](C)NCc1ccc(OC)c(C)c1 1731626060 YUEOEDSMTKQHLJ-CZUORRHYSA-N 335.448 1.513 10 10 EDCE COC(=O)c1cc(C(=O)NCc2cccc(O)c2O)cc([N+](=O)[O-])c1 1651172967 MKGUMHVSUVCMEJ-UHFFFAOYSA-N 346.295 1.723 10 10 EDCE C[C@@H]1C[C@H](NCCCO)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1676784605 XWIKWDCQQDFMRI-RISCZKNCSA-N 333.392 1.424 10 10 EDCE COc1ccc(CCNC(=O)CCN2C(=O)CSC2=S)cc1 1865764924 HFXJJBNAAFFIOR-UHFFFAOYSA-N 338.454 1.604 10 10 EDCE Oc1cc(Br)ccc1CN[C@H]1COC2(CCC2)[C@H]1O 2141555827 KPGJTPCBXMLBSZ-AAEUAGOBSA-N 328.206 1.927 10 10 EDCE NCc1ccc(N2C[C@@H]3CCC[C@@]3(C(N)=O)C2)cc1Br 2144089993 FETBOVVBLJYUOT-XHDPSFHLSA-N 338.249 2.000 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)C(C)(C)O 1987681090 OHLKKXVVUKZXNN-UWVGGRQHSA-N 327.385 1.562 10 10 EDCE N=C(N)c1cccc(S(=O)(=O)CCSc2nccs2)c1 163316043 WBDKEKUNGDXNFJ-UHFFFAOYSA-N 327.456 1.993 10 10 EDCE C[C@@H](O)c1ccc(N2CCOC[C@@H]2[C@@H](O)CO)cc1Br 2146324237 TYDZYTQNNJTNFW-FZQKWOKYSA-N 346.221 1.061 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010404963 WBAWYSUINSHBQC-SDDRHHMPSA-N 341.412 1.809 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)N2CCC(N=[N+]=[N-])CC2)C1 2012305034 AJMOUKQTYBMVSU-UHFFFAOYSA-N 339.396 1.706 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H](C(=O)Nc2ccc(N)cc2)C1 2022857834 NFOKXZXRBWCLBH-BXUZGUMPSA-N 335.404 1.825 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NCc2ccc(F)cc2O)C1 2024891747 BICTYMIGNIWUDC-KBPBESRZSA-N 340.395 1.991 10 10 EDCE O=C1CCCC(=O)N1CCNCc1cccc(Br)c1O 405382433 KSMDJIFKJPHLEN-UHFFFAOYSA-N 341.205 1.783 10 10 EDCE CC[C@H](CO)N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 379127559 ZHKBFXFBKNQZQR-JMCQJSRRSA-N 328.210 1.608 10 10 EDCE CN(C[C@H](O)C1CC1)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 690240316 KUTHGXABRBLEPJ-QWHCGFSZSA-N 341.205 1.642 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H](C3)C4O)c(Br)cc21 2172930006 DAZLYAGUJLXESX-PWBZTIPZSA-N 338.205 1.218 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1CNC(=O)c1cc(O)c(O)c(O)c1 1909117946 NWAKPYWHEJDGCV-NXEZZACHSA-N 338.360 1.446 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CN(C(=O)Cc2ccc(N)cc2)CCO1 2044692829 DXLMUCUWWXOKRG-OAHLLOKOSA-N 349.431 1.563 10 10 EDCE C[C@H](N)c1ccc(N2CC(OCC(N)=O)C2)cc1Br 2089135141 JMWAYVJYMVXQDX-QMMMGPOBSA-N 328.210 1.159 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCCN(CC(F)F)CC1 2308009277 LDUSWQLCJTWBEB-UHFFFAOYSA-N 326.343 1.910 10 10 EDCE CC(C)(C)OC(=O)N1CCN(Cc2ccc(N)cc2)[C@H](CC(N)=O)C1 2320273005 PROCOYADJCCLEI-OAHLLOKOSA-N 348.447 1.566 10 10 EDCE CNCc1ccc(N2CC(N(C)C(C)=O)C2)cc1Br 2353562109 UUYGITPDXDDMBN-UHFFFAOYSA-N 326.238 1.835 10 10 EDCE COC(=O)[C@H](C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 177903558 GTNRRIFFYLFRQC-GFCCVEGCSA-N 338.379 1.478 10 10 EDCE O=C(O)C[C@@H]1CS(=O)(=O)CCN1Cc1cc(Cl)ccc1O 126365217 YCDYRERXWODGML-LLVKDONJSA-N 333.793 1.119 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2357585626 OMMZMMCTXLEQQK-IDNCBAHPSA-N 341.249 1.789 10 10 EDCE C[C@@H]1C(=O)NCCCN1C(=O)/C=C/c1ccc(N2CCOCC2)cc1 188102658 LSGOPWIMPIWSIN-SBJJXXPASA-N 343.427 1.273 10 10 EDCE COc1ccc(N2CCN(C(=O)CNc3nccs3)CC2)cc1 74714363 UQAUBRDOUODWDV-UHFFFAOYSA-N 332.429 1.912 10 10 EDCE COc1ccc(N2CCN(C(=O)CC(=O)NC3CCCC3)CC2)cc1 243865510 RJVGSHCRQBCAAK-UHFFFAOYSA-N 345.443 1.793 10 10 EDCE CSc1cccc(N(C)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c1 255030637 JDEPLZZDVATHPO-HJWRWDBZSA-N 345.424 1.482 10 10 EDCE C[C@@]1(O)CCCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255615938 OZSXTQHRSVLEIJ-NVAPOSRTSA-N 330.428 1.910 10 10 EDCE Cc1nn(C)c(Cl)c1S(=O)(=O)N(C)Cc1ccccc1O 269770216 HDPFMXNDJSJRMV-UHFFFAOYSA-N 329.809 1.908 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CCCC(=O)N2)c(O)c1Br 2380745873 KZMQRPLWNFEYAO-JTQLQIEISA-N 341.205 1.748 10 10 EDCE Cn1ncc(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)n1 806001050 MBCKWPTWPHAZSB-UHFFFAOYSA-N 330.175 1.827 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(C(C)(C)N)no1 662753185 PFGVBJNMEBIONB-UHFFFAOYSA-N 330.388 1.974 10 10 EDCE COc1ccc(N2CCCN(C(=O)COC3(C)CNC3)CC2)cc1 844176208 ZRTWCMBBJUBWCL-UHFFFAOYSA-N 333.432 1.112 10 10 EDCE Cc1cc(CC(=O)N2CC(S(N)(=O)=O)C2)c(C)n1-c1ccccc1 910533348 HBMIGLNGIGPIGI-UHFFFAOYSA-N 347.440 1.136 10 10 EDCE COc1ccc(N(C)CCN(C)CC(=O)N=c2cc[nH]cc2)cc1 844400670 FZLTUVIPDPWKNI-UHFFFAOYSA-N 328.416 1.519 10 10 EDCE CCCC[C@@](C)(CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 844021039 XJTUQEDOFVIVFU-HNNXBMFYSA-N 344.433 1.435 10 10 EDCE CCOC(=O)[C@@H](CC1(OC)CCC1)NC(=O)c1cccc(O)c1O 846510582 LEYGNUSZCSWTJL-GFCCVEGCSA-N 337.372 1.719 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)C[C@@H](O)C3CC3)C2)cc1 854300506 UVYMOUPYLAIDGQ-WMLDXEAASA-N 333.432 1.686 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(c2ncns2)CC1 854814429 CZTHQMLZSLUFTC-DUXPYHPUSA-N 332.385 1.311 10 10 EDCE COCCn1cc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)cn1 869227691 BQWLWYUVDGUYNJ-OAHLLOKOSA-N 344.415 1.547 10 10 EDCE COc1cccc(O)c1CNCc1cccc(N2CCOCC2)n1 775362514 VLVIYGMKTNHGBH-UHFFFAOYSA-N 329.400 1.922 10 10 EDCE O=S1(=O)CC(C2CN(Cc3cc(Br)ccc3O)C2)C1 895427252 ICEYEXOOJXTJAS-UHFFFAOYSA-N 346.246 1.631 10 10 EDCE NC(=O)CN1CCc2ccc(NC(=O)c3cccc(O)c3O)cc2C1 790159104 RRBSDWYZWKRGBX-UHFFFAOYSA-N 341.367 1.194 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)C1=CS(=O)(=O)CCC1 1142730894 HEWPMTJZWVXIDR-UHFFFAOYSA-N 332.381 1.649 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1cccc(O[C@@H]2CC(=O)N2)c1 1161659753 UPNKKGQZYBKFGV-QGZVFWFLSA-N 328.324 1.504 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@@H](N2CCCCC2=O)C1 1170335399 LPPKEQNETJSUFY-CQSZACIVSA-N 332.400 1.644 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)Cc1cc[nH]n1 1320703411 VLNKIHYXOCXHNC-UHFFFAOYSA-N 330.432 1.908 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)C[C@@H]2COC(=O)C2)cc1C 1321024904 OXIOWYZJFMTYCR-QGZUEGPWSA-N 346.427 1.719 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)CN(C)C(C)=O)cc1C 1328310751 LWPILCSJWJNODA-AWEZNQCLSA-N 335.448 1.466 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)C[C@@H]2CCC(=O)N2)cc1C 1331584325 KPGAVRODSFTDNZ-ZBFHGGJFSA-N 347.459 1.609 10 10 EDCE CC[C@H](C)CN[C@@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1507266762 IADHTXCDTDLMEI-SMDDNHRTSA-N 335.408 1.575 10 10 EDCE Cn1cc([C@@H]2CSCCN2C(=O)Cc2ccc(O)c(O)c2)cn1 1449015550 POASOZFCVWWGFH-ZDUSSCGKSA-N 333.413 1.691 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C1(C)CC1 1295538926 MYXPOCSZESPDFT-JTQLQIEISA-N 331.376 1.884 10 10 EDCE C[C@@H](O)[C@H]1CN(c2ccc(CN)c(Br)c2F)CCO1 2117526655 AWXSJLCEZXDBFI-LDYMZIIASA-N 333.201 1.633 10 10 EDCE CC(C)(C)[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1nc(=O)o[nH]1 1469343598 UAQVRMLNPBNKNJ-VGVVRCBHSA-N 333.344 1.691 10 10 EDCE Nc1ccc(CS(=O)(=O)N=c2[nH]ccnc2Br)cc1 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HJBHUIZENVGPHU-XHDPSFHLSA-N 349.372 1.979 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N(C)C3COC3)c(Br)cc21 1915666701 IGNXQCGGOCCMLG-CYBMUJFWSA-N 340.221 1.887 10 10 EDCE CNCc1ccc(N2CCCN(CCO)CC2)c(Br)c1 234434229 ZTIAMDKFLCSXMU-UHFFFAOYSA-N 342.281 1.673 10 10 EDCE COc1ccc(O)c(CN[C@H]2COC[C@@H]2NC(=O)OC(C)(C)C)c1 1944916676 CABYMNWQXMMVEN-KBPBESRZSA-N 338.404 1.783 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C1(C)COC1 2143193368 IOICALSGNUWVLX-LLVKDONJSA-N 327.178 1.660 10 10 EDCE CCNCc1ccc(N2C[C@@H](CO)C[C@@H]2CO)c(Br)c1 2146080180 URQOUAMIGAAPLE-QWHCGFSZSA-N 343.265 1.738 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1C(=O)NCc1ccccc1O 2010273652 WIQMEEAQTMZBDY-CHWSQXEVSA-N 336.388 1.548 10 10 EDCE C[C@H]1OCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010405217 GPMPAUFSVQGXTC-UTUOFQBUSA-N 339.396 1.922 10 10 EDCE C[C@@]1(CO)CN(c2ccc(CO)c(Br)c2)C[C@]1(C)CO 704235534 LZQLRYYZADBHOA-GASCZTMLSA-N 344.249 1.759 10 10 EDCE CN1CCc2cc([C@@H](NN)c3ncncc3Br)ccc21 2163150218 SIXFHGBACOXYBA-CYBMUJFWSA-N 334.221 1.784 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCCC[C@@H](O)C3)c(Br)cc21 2169207511 YGDJVABDCKBUMQ-OQPBUACISA-N 340.221 1.752 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 1908254440 NDXMCIHYMPDDAJ-WDEREUQCSA-N 339.396 1.733 10 10 EDCE Nc1ccc(CS(=O)(=O)Nc2ncc(Br)cn2)cc1 2102378864 TYLQZNLCOJRYMX-UHFFFAOYSA-N 343.206 1.763 10 10 EDCE O=C(c1ccc(O)c(O)c1)N1[C@H]2CC[C@H]1CN(C(=O)C(F)(F)F)C2 2054411175 VTAGVJMOGUVKJB-UWVGGRQHSA-N 344.289 1.476 10 10 EDCE CC[C@@]1(CO)COCCN1c1ccc(CO)c(Br)c1 2112721817 ZHBRQQBXSVXWOS-CQSZACIVSA-N 330.222 1.919 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CCC(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213593366 RMPOPYYWHSEJKM-IJLUTSLNSA-N 341.412 2.000 10 10 EDCE CO[C@@H]1CN(c2ccc(CO)c(Br)c2)[C@H](CO)[C@H]1OC 2233354195 OHGKSYGLWAQJKW-MGPQQGTHSA-N 346.221 1.152 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](O)[C@@H](O)C[C@H]3C2)c(Br)c1 2236999664 ZMHNFNCUPGYZSH-GVARAGBVSA-N 342.233 1.509 10 10 EDCE Cc1ccc(NC=C2C(=O)NC(=O)N(C[C@@H]3CCCO3)C2=O)cc1 2297317990 VZPOWFYXILELHY-ZDUSSCGKSA-N 329.356 1.548 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(C(=O)NCCCN=[N+]=[N-])CO[C@@H]1C2 2298336361 VFVVPAOXLPZYGH-HFAKWTLXSA-N 339.396 1.875 10 10 EDCE COC(=O)[C@H]1C[C@@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 171383624 JYHYAEHJWXJITF-GJZGRUSLSA-N 334.441 1.665 10 10 EDCE CSc1ncc(CNS(=O)(=O)C[C@@H]2N[C@@H]3CC[C@H]2C3)s1 2359414841 PFWQEXBIMKZOMA-NGZCFLSTSA-N 333.504 1.425 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)cc1Br 2357057956 GTYRXKYPZQGHPF-UNQGMJICSA-N 341.249 1.631 10 10 EDCE COC(=O)C1(NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1 255323673 LTAOKRRFFUWTFF-DAXSKMNVSA-N 330.384 1.358 10 10 EDCE COC1CC(N)(C(=O)NCc2ccc(C)c(Br)c2O)C1 2380742340 QRICCDPSGWWNPL-UHFFFAOYSA-N 343.221 1.586 10 10 EDCE CC(=O)C(=O)COC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] 808519076 WSMLGFVUQKLXNT-UHFFFAOYSA-N 329.692 1.718 10 10 EDCE COc1ccc(N(C)C[C@@H]2CCN(S(C)(=O)=O)C2)cc1OC 801512682 YAIUGBVHAQEPJS-LBPRGKRZSA-N 328.434 1.422 10 10 EDCE O=C(OCc1ccccc1)N1C[C@H](O)[C@@H](NCc2ccccc2O)C1 713840854 SOVACMIBIIUINZ-WMZOPIPTSA-N 342.395 1.864 10 10 EDCE CN1CCN(Cc2cc(Br)cc(C(N)=O)c2O)CC1 642879832 BPVGNCDPTYJOJG-UHFFFAOYSA-N 328.210 1.001 10 10 EDCE COc1ccc(N2CCN(C(=O)CCc3cn(C)nn3)CC2)cc1F 829869166 KCSDPIFNXCPTHG-UHFFFAOYSA-N 347.394 1.244 10 10 EDCE C[C@@H]1CN(CCO)CCN1C(=O)NCc1ccc(N(C)C)c(F)c1 838030425 ZIBXKEGWURKDTG-CYBMUJFWSA-N 338.427 1.100 10 10 EDCE CO[C@@]1(CN[C@@H](C)c2ccc(Cl)cc2O)CCS(=O)(=O)C1 903362307 DFWGUEPGWKESOR-IINYFYTJSA-N 333.837 1.900 10 10 EDCE C[C@H](CNC(=O)/C=C\c1ccc(N2CCOCC2)cc1)CC(=O)O 588593237 HREBTRGCWKIRDF-ZBKLQPJUSA-N 332.400 1.763 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@]3(OC)CCOC3)C2)cc1 852256188 SUPKBHBTYVDXGX-KSSFIOAISA-N 349.431 1.379 10 10 EDCE CNC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nn1 853956587 WXWFVHKQBGZEIB-UHFFFAOYSA-N 341.415 1.409 10 10 EDCE C[C@@H]1OC[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)[C@H]1C 925055384 MACNYJNSLGFFDI-GRDNDAEWSA-N 338.473 1.434 10 10 EDCE COC(=O)c1cnc(COc2ccc(N(C)C)c(C(=O)OC)c2)cn1 865395582 XOTNEDZUSIWAQU-UHFFFAOYSA-N 345.355 1.695 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN3C(=O)CC[C@H]3C2)c([N+](=O)[O-])c1 765658536 WQULHPDOINLPMW-MXPWBENCSA-N 345.355 1.592 10 10 EDCE C[C@@H]1NCC[C@H]1NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 861698808 IVLJVVJHPQRDNS-WMLDXEAASA-N 332.448 1.415 10 10 EDCE CC1(C)NC(=O)N(CCCC(=O)N2Cc3cccc(O)c3C2)C1=O 871199598 ZHWPLRSUIDTKGX-UHFFFAOYSA-N 331.372 1.345 10 10 EDCE COC(=O)[C@@H](C[C@H]1CCCO1)NCc1ccc(N2CCOCC2)cc1 895865584 SZUFYVQZTXWGFY-QZTJIDSGSA-N 348.443 1.724 10 10 EDCE Cc1ccc(C(=O)NC[C@@H]2CS(=O)(=O)c3ccccc32)c(O)c1O 1141338083 WWZFMIXXGYMHNI-LLVKDONJSA-N 347.392 1.707 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc(-n2ccnc2)ccc1O 1162279012 QPZCNGISBPJXCM-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc2c(cc1[N+](=O)[O-])OCO2 1176747802 BFEWIYNRFKCSDY-UHFFFAOYSA-N 332.268 1.665 10 10 EDCE CCN(C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)[C@@H]1CCCOC1 1332787903 GWQSIADZTUICCU-WMLDXEAASA-N 347.459 1.957 10 10 EDCE CC[C@@]1(C(=O)O)CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332447947 ZRFTULQUMZRYAR-GOSISDBHSA-N 346.383 1.338 10 10 EDCE O=C(C(=O)N1CCC[C@H]1c1ccccn1)N1Cc2cccc(O)c2C1 1331998628 BJKPHZVKDNCNPN-INIZCTEOSA-N 337.379 1.993 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCN(C)C(C)(C)CC1 1332100404 WYOIUZSKSAGIGH-UHFFFAOYSA-N 333.432 1.293 10 10 EDCE C[C@@H](CNCc1ncccn1)NC(=O)c1ccc(N=NC(N)=O)cc1 1275467723 NLOWKASVSCRBKP-NSHDSACASA-N 341.375 1.547 10 10 EDCE COc1cccc(CNC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)c1O 1545683821 BIEAYRYNAPMLBA-UHFFFAOYSA-N 326.696 1.616 10 10 EDCE CN1C(=O)O[C@@H]2CN(c3ccc(CN)cc3Br)C[C@@H]21 2120412831 UNFRELKEFQWGKI-NWDGAFQWSA-N 326.194 1.547 10 10 EDCE CN1CCC(=O)Nc2cc(C(=O)NCc3ccc(O)cc3O)ccc21 1557084458 AAFVQJXZXQBTKI-UHFFFAOYSA-N 341.367 1.806 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H](CO)NCC2CCCC2)cc1 1725551161 GUFKUWZFORASFA-OAHLLOKOSA-N 347.419 1.720 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H]2CCC(=O)N2C)cc1C 1568293276 GLJVZLSSXRYRTE-ZBFHGGJFSA-N 347.459 1.561 10 10 EDCE O=C(Cn1nnnc1-c1ccccc1)NCc1ccc(O)c(O)c1 1635960060 VPXLWMRVNJEPRI-UHFFFAOYSA-N 325.328 1.068 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2ccc(=O)n(C)n2)cc1C 1567075690 FLEUFBGGPRDWAP-CYBMUJFWSA-N 344.415 1.005 10 10 EDCE O=C(Cn1nnnc1-c1ccccc1)NCc1cc(O)ccc1O 1593881032 CLMGVTZLMITPET-UHFFFAOYSA-N 325.328 1.068 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)CCNC(=O)C(C)C)c([N+](=O)[O-])c1 161958007 DNSJCTBNJYBBNC-SOFGYWHQSA-N 349.387 1.989 10 10 EDCE NC(=O)C[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccccc2)SC1=S 2545849 CSMABVWWLOCHGO-LKJZUNMESA-N 336.394 1.216 10 10 EDCE CC[C@@H]1CN(S(=O)(=O)CCOc2ccc(N)cc2)CCS1 157241537 RAMYBCZYHMVPHO-CQSZACIVSA-N 330.475 1.805 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@@H](O)C[C@@H]32)c(Br)c1 2128873929 FOPXAEYEMXRXML-LEWSCRJBSA-N 327.222 1.636 10 10 EDCE Cc1nc(S(=O)(=O)N2CC[C@H](N=[N+]=[N-])C2)c(Br)n1C 1912208789 WAPNZYBUGNCXLB-ZETCQYMHSA-N 349.214 1.564 10 10 EDCE NCc1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2134821297 SHACYTULFLPQGC-NZPIUUIZSA-N 327.222 1.228 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCC(O)CC3)c(Br)cc21 118589790 ANOORZQNRCZYGT-GFCCVEGCSA-N 326.194 1.362 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H]([C@H](N)Cc2ccc(O)c(O)c2)C1 1952914702 UUBROPPLTFFHTE-DOMZBBRYSA-N 338.404 1.604 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985100257 DKDRHQDTKOOTKQ-MNOVXSKESA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NCCCN=[N+]=[N-] 2010389027 KKEPEBGZRBOGKJ-LLVKDONJSA-N 337.384 1.662 10 10 EDCE C[C@@H]1CC[C@@H]([C@H](NC(=O)OC(C)(C)C)C(=O)N2CC(N=[N+]=[N-])C2)O1 2010401065 ANEWESQPEGINJH-USWWRNFRSA-N 339.396 1.968 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)CNCc1cc2c(cc1O)OCO2 2011516862 PFIGAFUTFCMBMI-LLVKDONJSA-N 340.376 1.096 10 10 EDCE O[C@@]1(c2cnn[nH]2)CCN(Cc2ccc(N3CCCCC3)cc2)C1 2059817586 ZJTSXEVVFKNCDQ-SFHVURJKSA-N 327.432 1.889 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCO[C@@H](C(F)(F)F)[C@@H]3C)c2n1 2064779589 NZOLPNFBZQBHTG-GZMMTYOYSA-N 344.293 1.535 10 10 EDCE O=C(NC1[C@@H]2CN(Cc3ccccc3)C[C@@H]12)c1cc(O)c(O)c(O)c1 1148589955 RSUQQHHYHJBORL-ZIAGYGMSSA-N 340.379 1.664 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H]4COC[C@@H]43)c(Br)cc21 2186370562 JKZSAVYEIRCVJC-RDZIJCNDSA-N 338.205 1.497 10 10 EDCE CNCc1ccoc1S(=O)(=O)NCc1cnc(SC)s1 2284688543 KSENDGIAHBESTJ-UHFFFAOYSA-N 333.460 1.656 10 10 EDCE Cc1nsc(N2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)n1 174995716 BSKLFGYXQZZGLO-UHFFFAOYSA-N 335.389 1.783 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)cc1Br 2357056513 KNLOKVZNYDKAAK-CDAHBRHOSA-N 341.249 1.932 10 10 EDCE COC[C@H]1[C@@H](O)[C@@H](O)CN1c1ccc([C@@H](C)O)cc1Br 2358552490 ZSKXPSZEDBDLNX-DGJRKYIQSA-N 346.221 1.059 10 10 EDCE C[C@@H]1C(=O)NCCN1c1ccc(/C=C\C(=O)O)c(Br)c1 312185301 IMYARQIJDQPOAG-AZVKUDOFSA-N 339.189 1.872 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)NC(=O)C2 188845212 VWDAHEWPKSZZMQ-SNVBAGLBSA-N 326.352 1.953 10 10 EDCE C[C@@H](NC(=O)N[C@@H]1CCCN(C)C1)c1ccc(N2CCOCC2)cc1 139955853 DDTPZGHIBNERIV-NVXWUHKLSA-N 346.475 1.978 10 10 EDCE C[C@@H]1SCCN(S(=O)(=O)CCOc2ccc(N)cc2)[C@@H]1C 132038497 VSOPSDIQAREGLL-NEPJUHHUSA-N 330.475 1.803 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CCN(c2ncccn2)CC1 96785374 JPJKTFUZLCBWIX-ZDUSSCGKSA-N 342.399 1.415 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3CCOC[C@H]3C)CC2)cc1 279801979 DWUANLRHCJYBHL-VQIMIIECSA-N 333.476 1.832 10 10 EDCE COCc1nc([C@H]2COCCN2Cc2ccc(N(C)C)cc2)no1 374787553 IATVMMYPUFRUNX-OAHLLOKOSA-N 332.404 1.856 10 10 EDCE Cc1ccc(CN2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)c(O)c1Br 2380815524 QHZJQJXHSUVLAV-BAESOJJISA-N 342.233 1.637 10 10 EDCE Cn1c(O)ncc(C(=O)NCc2cc(Cl)cc(Cl)c2O)c1=O 807836899 TYWRHHLIDZCPHU-UHFFFAOYSA-N 344.154 1.428 10 10 EDCE CN(C)c1ccc(CNC(=O)C[C@@H]2CCCS(=O)(=O)C2)cc1F 293199154 XNWMKUTXLICJTO-ZDUSSCGKSA-N 342.436 1.723 10 10 EDCE Cc1ccc([C@@H](C)NC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c(O)c1 715550969 RHVJDUXJDCUXSQ-GFCCVEGCSA-N 349.431 1.826 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCCO3)cc2)C1 812009102 BLAXPUIUQDQELU-CQSZACIVSA-N 332.404 1.235 10 10 EDCE CN1CCN(c2cc(C(=O)NCc3ccc(O)cc3O)ccn2)CC1 823795754 OSUKJTVCIGSSNV-UHFFFAOYSA-N 342.399 1.175 10 10 EDCE C[C@@H]1CN(CCO)CCN1Cc1cc(Br)ccc1O 825338590 QTOWICIZKDBQFN-LLVKDONJSA-N 329.238 1.653 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCNC3)cc2)C1 827468610 BCYQMWROMWITDL-CVEARBPZSA-N 344.459 1.004 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(S(C)(=O)=O)[C@H](C)C2)c1O 827271138 JQMBIIPYRHMCQR-LLVKDONJSA-N 332.853 1.820 10 10 EDCE COc1cc(O)c(CN2CCc3sc(CN)nc3C2)cc1OC 903942751 VGOICLIJFLNGDK-UHFFFAOYSA-N 335.429 1.883 10 10 EDCE COc1ccc(N(C)CCN(C)S(=O)(=O)CC2(F)CC2)cc1 916689336 AURJAUJXJOHDPY-UHFFFAOYSA-N 330.425 1.895 10 10 EDCE Nc1ccc(CCNC(=O)NC2CCC(N3CCNCC3)CC2)cc1 841956223 YZOFUQUUGNADJW-UHFFFAOYSA-N 345.491 1.327 10 10 EDCE CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2cc(OC)ccc2O)C1 843433213 XIKJYPUGZJLCMX-AWEZNQCLSA-N 332.322 1.901 10 10 EDCE COC(=O)[C@@H]1C[C@H]1[C@H]1NC(=O)N(Cc2ccc(N(C)C)cc2C)C1=O 924669432 APDPDMOQXBHEPE-RBSFLKMASA-N 345.399 1.291 10 10 EDCE CSC[C@H]1NC(=O)N(Cc2ccc(N3CCC(O)CC3)cc2)C1=O 925002993 MBFGUIAWGBWPBD-OAHLLOKOSA-N 349.456 1.431 10 10 EDCE CCN(CC)c1ccc(CNC[C@]2(OCCO)CCOC2)cc1F 850358597 SJRQAELTKZYAGE-GOSISDBHSA-N 340.439 1.930 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C3(O)CCSCC3)C2)cc1 855234296 WUFGQOGRNPTDKA-ZDUSSCGKSA-N 336.457 1.648 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](O)[C@H](C)C3)C2)cc1 854297216 KQLMTOBCXWAEKQ-JKIFEVAISA-N 333.432 1.686 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)[C@@H]3CCC(=O)N3)C2)cc1 862158614 IWSDKRLVBPSCPN-XEZPLFJOSA-N 331.416 1.305 10 10 EDCE CCOC(=O)/C(=C\c1cn(C[C@H]2CCOC2)nn1)c1nccn1C 865218482 NCAALSRJYJCCCJ-UGMNDJHYSA-N 331.376 1.152 10 10 EDCE O=S(=O)(c1cnn(CC(F)(F)F)c1)N1Cc2cccc(O)c2C1 867691204 RPFUKXNVZPLCSD-UHFFFAOYSA-N 347.318 1.856 10 10 EDCE O=C1CC2(CCOCC2)N(C(=O)/C=C\c2ccc(O)c(O)c2)CCN1 871365897 GNVNJSUTGREGPK-RQOWECAXSA-N 346.383 1.009 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@H]3C=CCC3)C2)cc1 1119569928 CWWNDWSDPUSPGP-CABCVRRESA-N 343.427 1.473 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C1(C)C 873463557 ICVIAOBKKBPEQJ-JQWIXIFHSA-N 327.377 1.627 10 10 EDCE CCOc1ccc(O)c(CN2CC(n3cc(C(=O)OC)nn3)C2)c1 779612876 DRUOSXKIMFVHDI-UHFFFAOYSA-N 332.360 1.226 10 10 EDCE Cc1nocc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1125257028 FTVOVCYMADHBQZ-CQSZACIVSA-N 342.399 1.615 10 10 EDCE COc1ccc(O)c(CNC[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@@H]6[C@H]4[C@H]2[C@@H]6C[C@H]53)c1 787304095 QFZCINWSMOPFEG-RWCIJUMHSA-N 327.424 1.999 10 10 EDCE CCn1nccc1CN(CCO)Cc1cc(OC)c(OC)cc1O 793308124 UEWBHBIOXRDMDH-UHFFFAOYSA-N 335.404 1.620 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)C2(C(N)=O)CC2)cc1C 1319522754 KWAQWRNROZHXHD-ZDUSSCGKSA-N 333.432 1.206 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccc(Cn2ccccc2=O)o1 1176748124 KVTWCELMNPHTKM-UHFFFAOYSA-N 340.335 1.831 10 10 EDCE C[C@@H]1COCC[C@@H]1NC(=O)C(=O)NCCCSc1nccs1 1323025994 LASDRLQAVNJJSO-MNOVXSKESA-N 343.474 1.283 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCOC[C@H]1C 1323276441 FMICPNYQPMAFNP-CJNGLKHVSA-N 333.432 1.218 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)Cc2cc[nH]n2)cc1C 1320375379 HJFVBTVZSQXMST-AWEZNQCLSA-N 330.432 1.954 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCC[C@H](O)C3)c(Br)cc21 92775477 FCMQBIWDWGKJOC-JVXZTZIISA-N 326.194 1.362 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H]2CCC(=O)NC2)cc1C 1268695271 XYCMHPUEDXCZGG-ZFWWWQNUSA-N 333.432 1.124 10 10 EDCE CNC(=O)[C@H](C)N[C@@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1266191903 MKPWSBSJYHFEQE-QWRGUYRKSA-N 348.407 1.082 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cn(C(F)(F)CO)nn2)c1 1294936607 IAQKABJYXPCXMZ-MRVPVSSYSA-N 342.302 1.025 10 10 EDCE CCOC(=O)c1[nH]nnc1[C@@H]1CCCN1C(=O)c1cc(O)cs1 1471799215 HFBJBDBOGJYVSU-VIFPVBQESA-N 336.373 1.726 10 10 EDCE COC(=O)CN(CCC(F)(F)F)C(=O)c1ccc(C)c(O)c1O 1545375135 HUBWQZYCZHUWPS-UHFFFAOYSA-N 335.278 1.974 10 10 EDCE Cn1cc(C[C@H]2CCC[C@H]2NC(=O)Cc2ccc(O)c(O)c2)cn1 1629623392 IMCDEUVSBUVCDS-HUUCEWRRSA-N 329.400 1.901 10 10 EDCE Cc1nc2c(cc1C(=O)NCc1c(O)cccc1O)c(C)nn2C 1558534168 OPLCLUKMANYLIV-UHFFFAOYSA-N 326.356 1.926 10 10 EDCE C[C@H](C(=O)NCc1ccc(O)cc1O)c1ccc(S(C)(=O)=O)cc1 1626838182 PVWGJJVCBVQRBY-NSHDSACASA-N 349.408 1.921 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)NCc1cccc(O)c1O 1644710684 JHJIESXMFJMFAW-UHFFFAOYSA-N 340.376 1.255 10 10 EDCE COC(=O)c1cc(CNC(=O)/C=C/c2ccc(O)c(O)c2)n(C)c1C 1644492902 LMNKVBOXTJFHAE-FNORWQNLSA-N 344.367 1.861 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cnn(-c2ccc(F)cc2)n1 1570462305 NNULBRMNWCUWPJ-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE C[C@@H]1CN(C[C@H]2CCCN2C(=O)Cc2ccc(O)c(O)c2)C[C@@H](C)O1 1583525787 IMCHFKUHCCIDGD-IIAWOOMASA-N 348.443 1.741 10 10 EDCE C[C@@H](CNC[C@@H]1CCCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1669753160 DCDZSXYXZGXZGX-STQMWFEESA-N 347.419 1.984 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2[nH]c(O)nc2C)cc1C 1699407887 KZELGORPNMEVTM-NSHDSACASA-N 332.404 1.649 10 10 EDCE CS(=O)(=O)NC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1858603935 BHULKBSUBPBBBZ-UHFFFAOYSA-N 344.348 1.543 10 10 EDCE O=S1(=O)CC(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)C1 1917941380 DSSXNKWWFLXDGL-UHFFFAOYSA-N 346.213 1.238 10 10 EDCE O=C(N=c1[nH]c(Cl)ncc1Br)c1cccc(O)c1O 2136035659 SJRVGVMPMFWIBS-UHFFFAOYSA-N 344.552 1.978 10 10 EDCE CC(C)(C)OC(=O)NCC1(O)CC(C(=O)N2CC(N=[N+]=[N-])C2)C1 1985102010 APVQGZGHGFPVRH-UHFFFAOYSA-N 325.369 1.173 10 10 EDCE COc1cccc(O)c1CN[C@@H](CO)CNC(=O)OC(C)(C)C 1985777456 MOVXALVAKGELPN-LLVKDONJSA-N 326.393 1.376 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C1=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C1 1987692517 LRVYXEHSBPRJQA-MNOVXSKESA-N 325.369 1.339 10 10 EDCE NCc1cc(F)c(N2CC[C@](CO)(CCO)C2)cc1Br 2153345463 LECFQHNQLMZEOH-AWEZNQCLSA-N 347.228 1.618 10 10 EDCE COC(=O)[C@@H](CC(=O)N(C)CCCN=[N+]=[N-])NC(=O)OC(C)(C)C 2010401338 DCLMGMULFCJVBK-SNVBAGLBSA-N 343.384 1.602 10 10 EDCE O=C(O)[C@@H]1CO[C@@H](CNCc2cc(Br)cc(F)c2O)C1 715788389 MJBGGTHESGEHBS-WCBMZHEXSA-N 348.168 1.873 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCC[C@@H](O)CC3)c(Br)cc21 393232697 XUXDGNOFTZYKHV-OQPBUACISA-N 340.221 1.752 10 10 EDCE C[C@@H](CO)N1CCN(c2ccc(CN)c(Br)c2F)CC1 2169363082 IIBKRHAHDLRSBD-JTQLQIEISA-N 346.244 1.550 10 10 EDCE O[C@H]1CCN(c2ccc(CNC3CC3)c(Br)c2)C[C@@H]1O 2188637375 UVJHUWMPXKOWFQ-GJZGRUSLSA-N 341.249 1.633 10 10 EDCE C[C@@]1(O)CCN(c2cc(Br)c(CN)cc2F)C[C@@]1(C)O 2194602102 ZYRVKVQBXOCMNC-ZIAGYGMSSA-N 347.228 1.759 10 10 EDCE C[C@H]1[C@@H](C)S(=O)(=O)CCN1c1ccc(CO)c(Br)c1 2113961559 KLTRYNDRPOGISF-VHSXEESVSA-N 348.262 1.953 10 10 EDCE C[C@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2273221531 ASSUMBKPPAWWOY-ZYDDLXRUSA-N 326.194 1.361 10 10 EDCE CCN1C(=O)NC(=O)C(=CNCCc2c[nH]c3ccccc23)C1=O 2297366713 ZLDAFEUDMFCJDQ-UHFFFAOYSA-N 326.356 1.282 10 10 EDCE CC(C)[C@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)C(=O)O 2301537037 MTLXEFDLBGAXAN-KRWDZBQOSA-N 332.400 1.762 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)c(Br)c1 2336342892 MLNBMXFAPSKOJP-IYYTYJHQSA-N 346.246 1.736 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)cc1Br 2336471288 QKVQQCHMODZSRZ-MWODSPESSA-N 345.262 1.702 10 10 EDCE Nc1ccc(CCNS(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1 171531641 MBHGAPGVPOCVEP-UHFFFAOYSA-N 344.392 1.896 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H](C)n2cncn2)cc1C 1270386315 RRHNLOQBJRZMKD-DZGCQCFKSA-N 345.447 1.698 10 10 EDCE COC(=O)[C@@H](NCCN=[N+]=[N-])c1cc(OC)ncc1Br 2362189379 FJVLYSXMUHMQGU-JTQLQIEISA-N 344.169 1.967 10 10 EDCE CC[C@@H](C)N1C(=O)/C(=C\NNCCN(CC)CC)C(O)=NC1=S 38168697 JPVIHZOGKHRJOQ-JPQYHBGPSA-N 341.481 1.188 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cnc(O)n(C)c1=O 267698161 ZHKOMYNEQIPFDY-UHFFFAOYSA-N 344.415 1.603 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2COCC[C@H]2N)c(O)c1Br 2380749500 PFFJRKBLDIFUNB-WDEREUQCSA-N 343.221 1.443 10 10 EDCE Cc1ccc(CN2C[C@@H]3CN[C@H](CO)[C@H]3C2)c(O)c1Br 2380800712 KTYDITCHNFSTHI-RWMBFGLXSA-N 341.249 1.475 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@@H](CCO)CC3)cc2N1 817129423 IZKNAPXVMFIKKO-LLVKDONJSA-N 335.360 1.915 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3[C@H]4CCC[C@H]43)CC2)cc1 819270930 LYWQNORMFJBJNG-LMCOJAPRSA-N 345.487 1.566 10 10 EDCE CCN(CCC(N)=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 914400543 NVTIHSNRKASOGF-AWEZNQCLSA-N 348.447 1.491 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)O[C@@H](C)C(=O)O)C2)cc1 849183425 RAVYZWCNXAGAQE-AGIUHOORSA-N 336.388 1.268 10 10 EDCE COc1cc(Br)cc([C@@H](C)NCCOCCO)c1O 848519655 OHLDZNANOHWLSM-SECBINFHSA-N 334.210 1.823 10 10 EDCE C[C@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)[C@@H]1[C@H]2CN[C@H]1C2 925485500 NTJCKQRPJFAKCY-GGLGGFLESA-N 342.487 1.474 10 10 EDCE COc1ccc(N2CC[C@H](Nc3ccc(C(=O)N(C)C)nn3)C2)cc1 853758546 GMXWKACMHKEPNO-ZDUSSCGKSA-N 341.415 1.878 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@H]1CCNC12CCC2)c1ccc(N(C)C)cc1 861767597 OIRKZZFEMPZZLI-BBRMVZONSA-N 344.459 1.331 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 1119734668 JVOYBAAOZJZXEG-HNNXBMFYSA-N 343.427 1.316 10 10 EDCE COC(=O)[C@]1(O)CCN(Cc2ccc(Br)cc2O)C1 895702495 PCHJNEDOVWUJND-ZDUSSCGKSA-N 330.178 1.265 10 10 EDCE COC(=O)[C@@H]1CC[C@@H]1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891245917 KELXPODTCCVXQB-GVDBMIGSSA-N 347.459 1.671 10 10 EDCE COC(=O)[C@@H](C[C@@H]1CCCO1)NCc1ccc(N2CCOCC2)cc1 895865587 SZUFYVQZTXWGFY-ZWKOTPCHSA-N 348.443 1.724 10 10 EDCE Cn1nccc1[C@@H](O)C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1301302077 SKVWRYYMMYZDIC-SFHVURJKSA-N 345.399 1.346 10 10 EDCE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NCCCCN=[N+]=[N-] 1963732108 HHHZSARKRXBOFA-GFCCVEGCSA-N 340.428 1.744 10 10 EDCE COC(=O)[C@@H](CNC(=O)OC(C)(C)C)N(C)Cc1ccccc1O 1963398574 DFPOMIWZNRJGIA-CYBMUJFWSA-N 338.404 1.890 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccccc1N1CCOCC1 1176748184 LZGOYIUHUNKIRS-UHFFFAOYSA-N 328.368 1.864 10 10 EDCE CN[C@@H](C)c1ccc(N2CCS(=O)(=O)CC2)c(Br)c1 61695444 JZAZCEJMBUHMIC-JTQLQIEISA-N 347.278 1.964 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccsc2)cc1F 1257519352 AQSFARQTGOHPFU-UHFFFAOYSA-N 349.431 1.928 10 10 EDCE COC(C)(C)[C@@H](C)NC(=O)C(=O)NCCCSc1nccs1 1340714806 VNQOUXOAAUBPJD-SNVBAGLBSA-N 345.490 1.671 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1CCNC1=O)NCc1ccc(OC)c(C)c1 1269448538 LWGMVBHBDDXLBO-HUUCEWRRSA-N 333.432 1.124 10 10 EDCE COCC(=O)NC1CC(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1285168311 XOYHAGHMJWKDEP-UHFFFAOYSA-N 347.375 1.120 10 10 EDCE CCN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CCS(=O)(=O)C1 1441008002 DLEWWKXVYBKVLI-LBPRGKRZSA-N 338.389 1.498 10 10 EDCE C=CC(=O)NCc1ccc(C(=O)NCc2ccc(O)cc2O)cc1 1299571039 POSZIMWMILMVSO-UHFFFAOYSA-N 326.352 1.830 10 10 EDCE O=C(Cn1cnc2sccc2c1=O)NCc1ccc(O)cc1O 1299569497 CXRMSUNLMYOGDU-UHFFFAOYSA-N 331.353 1.186 10 10 EDCE Cc1ccc2c(c1)C(=O)N(CC(=O)NCc1cc(O)ccc1O)C2=O 1471661505 ZKRSSELPPKDEBH-UHFFFAOYSA-N 340.335 1.319 10 10 EDCE O=C(NCc1c(O)cccc1F)c1cccc(N2CCNC2=O)c1 1471975213 UHQADYYHXRQYLR-UHFFFAOYSA-N 329.331 1.991 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)CCn2ccnn2)cc1C 1717406850 LKWCYGONIGEGJP-LSDHHAIUSA-N 345.447 1.668 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@H]2CCC(=O)NC2)cc1C 1715237696 BJOLRYMGISQJQM-CZUORRHYSA-N 347.459 1.372 10 10 EDCE COc1ccc(CNCC2(NC(=O)CNC(C)=O)CCCC2)cc1C 1495125631 ZYDSQAXOUHNYGY-UHFFFAOYSA-N 347.459 1.658 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H]2CCC(=O)N2C)cc1C 1497650539 LUEVNROBTGXCFP-APHBUQMISA-N 345.443 1.386 10 10 EDCE COC(=O)CN(C(=O)c1ccnc2c1CC(=O)N2)c1ccccc1 1634037714 VAOZUFVFZSUPPQ-UHFFFAOYSA-N 325.324 1.396 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)[C@@H]2CC23CC3)cc(OC)n1 1572305263 RIUCILYWVXAHCR-YPMHNXCESA-N 347.415 1.476 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2ncoc2C)cc1C 1571575177 RCWYXUCFNGMNOQ-OAHLLOKOSA-N 347.415 1.523 10 10 EDCE COc1ccc(N2C[C@H](O)C[C@@H]2CN)c(OC)c1Br 2124714373 RZGIJHBASZDZTI-RKDXNWHRSA-N 331.210 1.365 10 10 EDCE Cn1nccc1C1(O)CN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 1650877427 PRDPTGQNLNUVCH-UHFFFAOYSA-N 345.380 1.390 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@@H](C)SC)cc(OC)n1 1758771296 BMJQKBJICKFEBX-VHSXEESVSA-N 341.433 1.085 10 10 EDCE CC[C@@H](C)CC(=O)N1CC[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1758659326 RLRVMKJKFXVDCO-OCCSQVGLSA-N 349.431 1.866 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H](CC(=O)NCCN=[N+]=[N-])C1 1965101638 GCNYESHBGVPADV-MNOVXSKESA-N 327.385 1.875 10 10 EDCE CCN(CC)CCNC(=O)c1ccc(NN=NCCNC(C)=O)cc1 1860488997 UDIJWLXKTWHLPT-UHFFFAOYSA-N 348.451 1.673 10 10 EDCE CCOC(=O)Cc1c(O)cc(O)cc1OC(=O)c1ccc(O)c(O)c1 206852086 QBHCALSNLQCVBQ-UHFFFAOYSA-N 348.307 1.834 10 10 EDCE Cc1c([C@H](NCCCN=[N+]=[N-])C(=O)O)c(Br)nn1C 2131552174 PAIIQWPMTHEYHX-QMMMGPOBSA-N 331.174 1.907 10 10 EDCE Oc1cc(Br)ccc1CNCCN1CC2(COC2)C1 1967702901 JNENJLYBWLEVSP-UHFFFAOYSA-N 327.222 1.577 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)c(Br)c1 2140661767 IQBHUJYZLWGZPE-FFAVSVRISA-N 333.201 1.349 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2CN(C)CCO2)c1O 1969130915 LAGDRYOSDOVUFQ-JTQLQIEISA-N 345.237 1.584 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC(N=[N+]=[N-])CC2)COC1 1985103400 UXRPJXGGPUYJTF-UHFFFAOYSA-N 325.369 1.581 10 10 EDCE CN(CC(CO)CO)c1ccc(CNC2CC2)c(Br)c1 2150415803 OSMJZLPTQREMSK-UHFFFAOYSA-N 343.265 1.738 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)C(=O)N2CC(N=[N+]=[N-])C2)C1 2010393301 QLUCXRPREUTZOH-UHFFFAOYSA-N 347.322 1.125 10 10 EDCE CN1CCO[C@@H]2CN(c3ccc(CN)c(Br)c3F)C[C@H]21 2153987975 BDVMRQCNEHAQBZ-VXGBXAGGSA-N 344.228 1.566 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C[C@H](O)CN2Cc2ccc(N)cc2)C1 2013645835 SXDFTWMNPCAJTD-HNNXBMFYSA-N 333.432 1.825 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2C[C@H](C(=O)NCCN=[N+]=[N-])C[C@@H]21 2022253695 MWDHXKZYCSPNHG-GRYCIOLGSA-N 339.396 1.827 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCOC[C@@H]3C)c(Br)cc21 92775188 MAPBLDJVNMSDFV-SDBXPKJASA-N 340.221 1.887 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CNCc2ccc3c(c2)CCO3)[C@@H](O)C1 702847703 VFTBTKDPOJBKNN-HOTGVXAUSA-N 348.443 1.939 10 10 EDCE CN1C(=O)N[C@H]2CN(c3ccc(CN)c(Br)c3)CC[C@@H]21 2171305826 WSVFPJNMMGLIPL-STQMWFEESA-N 339.237 1.510 10 10 EDCE C[C@@]1(NCc2ccc(Br)cc2O)CCS(=O)(=O)C1 691500109 AWLVCSNDGVMZAH-GFCCVEGCSA-N 334.235 1.822 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@]4(CCCO4)[C@H]3C3CC3)c2n1 2062490404 VUFOVYWGJPMKLC-RHSMWYFYSA-N 328.372 1.527 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCN(C)c4ccccc4C3)c2n1 2064369489 WQKPYHCQJRRTSS-UHFFFAOYSA-N 337.383 1.836 10 10 EDCE Nc1ccc(OCCCN2C[C@H]3C[C@H]2CN3C(=O)C(F)(F)F)cc1 2044677390 IWBFOOXGQGQKMT-QWHCGFSZSA-N 343.349 1.885 10 10 EDCE C[P@]1(=O)C[C@@H](O)[C@H](NCc2cc(Br)ccc2O)C1 2057722119 YLWLLKUFYMSLGT-AJLCLMPTSA-N 334.150 1.980 10 10 EDCE C[C@]1(CCO)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2205509202 FIBYIANWPKVGRD-GXTWGEPZSA-N 340.221 1.752 10 10 EDCE COc1ccc(OC)c(C=C2SC(=S)N(NC(C)=O)C2=O)c1 2314736008 OBYAYOSLLABCEQ-UHFFFAOYSA-N 338.410 1.956 10 10 EDCE CCCS(=O)(=O)N(C)NCc1cc(Br)ccc1O 2317494235 SRPYJMLBJJGEAJ-UHFFFAOYSA-N 337.239 1.831 10 10 EDCE O=C1N=C(O)/C(=C/NC[C@H]2CCCO2)C(=O)N1Cc1ccc(F)cc1 103105468 XWCRTORVLPZOGD-CKXDQPNJSA-N 347.346 1.897 10 10 EDCE CN(C)C[C@@H]1CN(C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 117040776 VMLYKYMEHHZCOT-CQSZACIVSA-N 338.427 1.364 10 10 EDCE COc1cc([C@H](NCCCN=[N+]=[N-])C(N)=O)c(Br)cn1 2362126538 YHIBKLUNEWQYPC-JTQLQIEISA-N 343.185 1.669 10 10 EDCE Cc1ncc(CN2CCN(C(=O)c3cccc(O)c3O)CC2)s1 193062400 VMPZHUJZDYEXAB-UHFFFAOYSA-N 333.413 1.821 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)CCN2CCOCC2)c([N+](=O)[O-])c1 255916235 NIJDCWNYEIAPGO-XQRVVYSFSA-N 349.387 1.549 10 10 EDCE COCC[C@@](C)(O)CNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255090839 LVRMIVMJYKOOPD-NVAPOSRTSA-N 348.443 1.440 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCC([C@H](C)O)CC1 298560300 DJNRCTVVQCSZMC-AWEZNQCLSA-N 348.443 1.750 10 10 EDCE COc1nccnc1CNCc1ccc(N2CCC(CO)CC2)cc1 295216846 BDJMPYUFKKZISA-UHFFFAOYSA-N 342.443 1.984 10 10 EDCE O[C@@H](CNCc1ccc(N2CCOCC2)cc1)c1ccc(F)cn1 818972045 CAVMVQBWWYCBBU-SFHVURJKSA-N 331.391 1.881 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1ccnn1C 819698530 MYOGFPSQDNUXLW-UHFFFAOYSA-N 331.372 1.260 10 10 EDCE COc1cc(O)c(CN[C@H]2CC[C@H](C)S(=O)(=O)C2)cc1OC 827173147 VSBMBZZXNCCZNL-JQWIXIFHSA-N 329.418 1.465 10 10 EDCE CO[C@@]1(CO)CCCN(Cc2ccc(N3CCN(C)CC3)cc2)C1 826952114 GRPAGPLSODTHGV-IBGZPJMESA-N 333.476 1.412 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)c2ccc3nnn(C)c3c2)cc1 832284568 KSMPWUVKGRCATH-OAHLLOKOSA-N 338.415 1.464 10 10 EDCE Cc1cc(CC(=O)NC2CC(CO)(CO)C2)c(C)n1-c1ccccc1 913319114 VNHDEWBQFHXDBR-UHFFFAOYSA-N 342.439 1.886 10 10 EDCE C[C@]1(C(=O)NCc2ccc3cccnc3c2O)CCCS1(=O)=O 911263328 YNRGJJUVJHQDDU-MRXNPFEDSA-N 334.397 1.524 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)[C@H](C)CN1CCO 841715872 FHMCWYNUEGTCAM-HUUCEWRRSA-N 334.464 1.349 10 10 EDCE Cc1cc(O)c(CN2CCS(=O)(=O)[C@H]3COCC[C@@H]32)c(Cl)c1 840952534 DFFVMJBCMJJRIL-ZFWWWQNUSA-N 345.848 1.742 10 10 EDCE CCC(=O)N[C@H](CCSC)C(=O)NCc1c(O)cccc1F 928712861 ZPBDHBATQTZQOG-GFCCVEGCSA-N 328.409 1.795 10 10 EDCE Nc1ccc(CCNC(=O)N2CCNC[C@H]2c2cccnc2)cc1 841955671 JOAOQCZMGVJGCG-KRWDZBQOSA-N 325.416 1.562 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 845663079 GTADBANZSPZCKP-NMTKSXOJSA-N 336.344 1.367 10 10 EDCE COc1ccc(N2CCN(C(=O)CONC(=N)[C@@H]3C[C@@H]3C)CC2)cc1 848521226 SOWMFJJDSDHYTJ-XJKSGUPXSA-N 346.431 1.498 10 10 EDCE CC(C)(N)c1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)on1 852859187 OGPWKWZWYGLYEC-UHFFFAOYSA-N 344.415 1.635 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc4n(n3)CCO4)C2)cc1 855226244 OOEWQAMRWSUPRQ-LBPRGKRZSA-N 328.372 1.293 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCn4cnnc4C3)C2)cc1 854302034 WWTUVMSLBNWKFI-ZDUSSCGKSA-N 342.403 1.091 10 10 EDCE CCn1cnc(S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)c1 751319416 WDPYROLLYXSPGF-SNVBAGLBSA-N 325.390 1.657 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@@H]4CCN(C)[C@@H]4C3)C2)cc1 852447380 AHTUNALFINROFS-HDMKZQKVSA-N 344.459 1.619 10 10 EDCE COc1cc(COCC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccn1 860696688 CUIWXNNNYFKQPD-LBPRGKRZSA-N 346.383 1.765 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)N[C@H](C)c2cc(OC)ccc2O)C[C@H]1C 866764773 OVIPHOKKCKIDEZ-XEQNPHJVSA-N 337.372 1.545 10 10 EDCE CN(C)c1ccc(CN(C)S(=O)(=O)c2cnc(O)s2)cc1 866418784 UBMGEDQVDBABMJ-UHFFFAOYSA-N 327.431 1.735 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1[C@@H]1C[C@H]1C1CCOCC1 865337209 KTMFKNBGBVNZDT-LSDHHAIUSA-N 330.384 1.972 10 10 EDCE O=C(CS[C@@H]1CCS(=O)(=O)C1)N1Cc2cccc(O)c2C1 871198707 NKXJDFCEVUJCSB-LLVKDONJSA-N 327.427 1.155 10 10 EDCE COc1cccc(C(=O)NCCNC(=O)Cc2ccc(O)c(O)c2)c1 1136500777 ARAFFGNPLKFEKR-UHFFFAOYSA-N 344.367 1.195 10 10 EDCE COc1cc(CN2CCn3nnc(CO)c3C2)c(O)c(C(C)(C)C)c1 894808535 DMUZFVMMRMKIPH-UHFFFAOYSA-N 346.431 1.798 10 10 EDCE OCCN[C@@H]1CCCN(Cc2ccc(Br)cc2O)C1 708639575 UOBRCHNFHNCCQN-CYBMUJFWSA-N 329.238 1.701 10 10 EDCE CNCc1ccc(N2CC[C@@](C)(O)[C@H](O)C2)c(Br)c1 1893331994 NSXPEHSWSRFTDY-ZIAGYGMSSA-N 329.238 1.491 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3C[C@H]3C3CC3)C2)cc1 1328179625 XGRPFUCQZVYFLM-XOKHGSTOSA-N 343.427 1.305 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3NC(=O)O[C@@H]3C2)cc1Br 2120414658 CJQGGSAWZONQOH-UPZJHPNMSA-N 327.178 1.799 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@H]1C=CS(=O)(=O)C1 1627028427 HAEMZKMRHXGTSF-LLVKDONJSA-N 330.402 1.443 10 10 EDCE CCn1ncc(C(=O)NCC[C@@H](C)NCc2ccc(OC)c(C)c2)n1 1714464745 BFXXXFMIYZHSAL-CQSZACIVSA-N 345.447 1.913 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CC(=O)N(c2ccccc2)C1 1567563647 ARGDTOIAOLNVOC-CYBMUJFWSA-N 326.352 1.562 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2cnn(C)c2N)cc1C 1495649284 JEYUAVJHHFMYNU-GFCCVEGCSA-N 345.447 1.475 10 10 EDCE O=C(CN1CCCCC(=O)C1=O)NCc1c(O)ccc2ccccc12 1652708754 LLEVQRJPPRPUEX-UHFFFAOYSA-N 340.379 1.743 10 10 EDCE C[C@@H](CNCc1csnn1)NC(=O)c1ccc(N=NC(N)=O)cc1 1699434101 VIBDEEHRNPBSML-VIFPVBQESA-N 347.404 1.609 10 10 EDCE C[C@H](Cn1cncn1)N[C@H](C)c1ccc(N2CCOCC2)c(F)c1 164220396 WEASJEAEJFYXLY-ZIAGYGMSSA-N 333.411 1.993 10 10 EDCE CN[C@@H](C)c1ccc(N2CCO[C@@H](CO)C2)c(Br)c1 221132872 LUVJWJMTTMMROW-CMPLNLGQSA-N 329.238 1.927 10 10 EDCE CN(C[C@@H](O)COCc1ccccc1)C(=O)c1cc(O)nc(O)c1 1916383154 DKYDIOCMIZLBRB-CQSZACIVSA-N 332.356 1.143 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)C[C@@H]2CN(C)C)cc1Br 235514498 ZBJYAEICRWWEQE-UHTWSYAYSA-N 342.281 1.970 10 10 EDCE CON(CCNC(=O)c1ccc(O)c(O)c1)C(=O)OC(C)(C)C 1982310761 ZVFCHBVTKDPMBQ-UHFFFAOYSA-N 326.349 1.626 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)C1COC1 1985102841 MMTIHMPWJPDMKY-WDEREUQCSA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCN=[N+]=[N-])[C@@H](O)C(C)(C)C 1989789963 LFWKTVISXHSLFG-NXEZZACHSA-N 329.401 1.713 10 10 EDCE NCc1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)c(F)c1Br 2149900801 NBSUQIOLBQFUPS-GHMZBOCLSA-N 347.228 1.474 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CN(Cc2cc(N)ccc2O)CCO1 1999482994 JJCDANZCOKDYLY-CQSZACIVSA-N 337.420 1.700 10 10 EDCE C[C@H](O)c1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)cc1Br 2146311285 QYWHJJIBZJZETI-NZVBXONLSA-N 342.233 1.684 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CCC1 2009802113 KSKOYQDKFNBSKV-LBPRGKRZSA-N 336.388 1.766 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010392660 IDGYWYZDTWLQLK-QJPTWQEYSA-N 339.396 1.658 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010394512 CRHCRXLUUVAPBA-UWVGGRQHSA-N 340.384 1.056 10 10 EDCE NCc1cc(F)c(N2CC(=O)N[C@H]3CC[C@H]32)cc1Br 2112067714 WHBVUFUXLWBBTD-WDEREUQCSA-N 328.185 1.514 10 10 EDCE COc1ccc(Br)c(CN2CC[C@@H](CO)[C@@H](N)C2)c1O 2236039757 DHITXGCJCGFTKF-CABZTGNLSA-N 345.237 1.305 10 10 EDCE COc1ccc(Br)c(CN2CCOC[C@H]2C(=O)O)c1O 2236040253 RYANOJBFHVKHBJ-JTQLQIEISA-N 346.177 1.449 10 10 EDCE COc1cccc(O)c1CNCc1nn(C)nc1Br 2226958244 YSMYSAQIONLZGG-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE COc1ccc(Br)c(CNCc2cnc(O)[nH]2)c1O 2227751945 STIXTUULBFWTHQ-UHFFFAOYSA-N 328.166 1.882 10 10 EDCE Oc1ccc(CNCCc2cc(Br)no2)c(O)c1O 2228859684 AVPZSZKIXPGWDR-UHFFFAOYSA-N 329.150 1.886 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)N1CC[C@H](N=[N+]=[N-])C1)[C@H]1CCOC1 2250661826 AUPCIJWOSLZLSU-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]2C[C@@H]1COc1nnc(=N)[nH]n1 2298032814 BWDYUGSXVAJOQN-AXFHLTTASA-N 336.396 1.236 10 10 EDCE O=C1NCCN(c2ccc(OCc3ccccc3)cc2)[C@@H]1C1CNC1 2326758233 QSNKZWPTNDWZNL-LJQANCHMSA-N 337.423 1.790 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)Nc3nccs3)CC2)cc1 9859908 FZADYWMFTXAARF-UHFFFAOYSA-N 346.412 1.439 10 10 EDCE c1ncn([C@@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)n1 119504564 RZQHPVFJLVGACF-GOSISDBHSA-N 327.432 1.952 10 10 EDCE CS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCCCCC2)cc1 69845404 WLHGJKBCBPPCLJ-UHFFFAOYSA-N 347.462 1.591 10 10 EDCE CC[C@@H](C)NC(=O)CN1CCN(Cc2ccc(OC)cc2O)CC1 129136496 HDKZSUWXAFQRPP-CQSZACIVSA-N 335.448 1.433 10 10 EDCE CC(C)NCc1ccc(N2CC([C@@H](O)CO)C2)cc1Br 2361909379 VVPCIKZWPHQZFK-HNNXBMFYSA-N 343.265 1.737 10 10 EDCE COc1ccc([C@H](NCCN=[N+]=[N-])C(N)=O)cc1Br 90258224 ZEVPMEPEVOJIEZ-JTQLQIEISA-N 328.170 1.884 10 10 EDCE CCNCc1ccc(N2CCSC[C@H]2S(C)(=O)=O)c(F)c1 90923196 LDUNPQFRVYXMSI-CQSZACIVSA-N 332.466 1.859 10 10 EDCE CC(=O)C(=O)COC(=O)c1nn(-c2cccc(F)c2)c2c1CCC2 817195078 QKXYRUMFNVRPRT-UHFFFAOYSA-N 330.315 1.815 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CCC[C@@H](C)O1 828438671 ZIGIILRDWIAEBJ-RHSMWYFYSA-N 347.459 1.751 10 10 EDCE C[C@H](NCCS(=O)(=O)N=S(C)(C)=O)c1cc(F)ccc1O 903225023 DGNMAUQSLQRAHQ-VIFPVBQESA-N 338.426 1.239 10 10 EDCE Cc1cc(C(=O)N2CCN(Cc3cc(F)ccc3O)[C@H](C)C2)n[nH]1 835072450 AOSVLRLHXUXOSE-GFCCVEGCSA-N 332.379 1.909 10 10 EDCE C[C@H](NC(=O)N(C)[C@H]1CCN2CCO[C@H]1C2)c1ccc(N(C)C)cc1 836407440 ZFMWBFDZUVPZKV-WBAXXEDZSA-N 346.475 1.928 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]([C@@H]3CCCN3)C2)cc1 844221879 XLKIOOPEIYQGHY-HKUYNNGSSA-N 344.503 1.833 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)c3cccnc3)C2)cc1 849416248 NHRCZHCANQYDFE-ZDUSSCGKSA-N 333.413 1.647 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CNCCC1(F)F 842006135 VNHPPXOCDGOJCC-AWEZNQCLSA-N 326.391 1.891 10 10 EDCE CC(=O)N[C@@H]1CCCN(C(=O)CN2CCCc3cc(CN)ccc32)C1 843349753 AFKJHVIFBORQTR-QGZVFWFLSA-N 344.459 1.025 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCc1cnn(C)n1 840372949 GLHVZWWKOHWWJQ-ZDUSSCGKSA-N 330.436 1.620 10 10 EDCE NCC1(CCNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 851669101 LJZJCVIRXAMCPP-UHFFFAOYSA-N 346.475 1.576 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](CO)[C@@H](c2cc(O)c(O)c(O)c2)C1 687734655 ZCWIUOKVLPQJSJ-WDEREUQCSA-N 325.361 1.746 10 10 EDCE CC(C)[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 856124219 FMBYCDQASFYFJO-AWEZNQCLSA-N 326.418 1.928 10 10 EDCE O=C(NCCCSc1nccs1)NC[C@@]1(CCO)CCOC1 762320982 FMMUQPXPFAYCLG-CQSZACIVSA-N 345.490 1.714 10 10 EDCE Cc1ccncc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 787920526 IOKHYONAMTWIOP-UHFFFAOYSA-N 347.440 1.705 10 10 EDCE CCCCC(=O)N1CSC[C@H]1C(=O)NCc1cccc(O)c1O 1123977925 MQINVJSUFHIDRA-LBPRGKRZSA-N 338.429 1.806 10 10 EDCE COC(=O)[C@@H](NC(=O)c1ccc(C)c(O)c1O)c1ccc(O)cc1 1138091944 TXILFPVUWCDBGA-ZDUSSCGKSA-N 331.324 1.756 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)CCC(F)F)CC2)cc1 793247405 NWLQHSNBBGPOEJ-UHFFFAOYSA-N 341.402 1.979 10 10 EDCE CC(=O)N(CC(=O)NCCc1ccc(O)c(O)c1)c1ccccc1 1150487918 KCBGOSLJGPHWTJ-UHFFFAOYSA-N 328.368 1.810 10 10 EDCE COc1ccc(Br)c(CNC2(C(=O)N(C)C)CC2)c1O 1964060234 ALRNPFLCKPOPFF-UHFFFAOYSA-N 343.221 1.874 10 10 EDCE Cn1nccc1[C@H]1C[C@H](NC(=O)NCc2ccccc2O)CCO1 1228458815 LTVBKTQHIKTPIY-CZUORRHYSA-N 330.388 1.845 10 10 EDCE CN1CCO[C@@H](CN(C)Cc2cc(Br)ccc2O)C1 709417672 QEZYOBNJBBMWJC-CYBMUJFWSA-N 329.238 1.917 10 10 EDCE COc1ccc(-n2nnnc2CNC/C=C\CNC(=O)C(C)C)cc1 1273862200 UTCDFYDGYGGVLF-PLNGDYQASA-N 344.419 1.089 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@H]2C(=O)NC3)c(Br)c1 2115749744 YRYXQXHGTARCAW-DVYJOKAKSA-N 325.206 1.970 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)CCC2CCC2)cc(OC)n1 1526479700 XGJNTVLAPXMRHQ-LBPRGKRZSA-N 349.431 1.914 10 10 EDCE CC(=O)c1cc(F)cc(CN(C)Cc2nnc3c(=O)[nH]ccn23)c1O 1620547696 WECVMZPPARZMRZ-UHFFFAOYSA-N 345.334 1.097 10 10 EDCE COc1c(C(=O)NCc2ccc3cccnc3c2O)c(C)nn1C 1630532117 HUFOPJFUMYDJLA-UHFFFAOYSA-N 326.356 1.921 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cc2nonc2C)cc1C 1493746108 JRRAEXFSUIMNSF-UHFFFAOYSA-N 332.404 1.486 10 10 EDCE C[C@@H](O)CN1CC[C@@H](CCNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1732060069 AUOBLBBCBCLOIL-CHWSQXEVSA-N 347.419 1.672 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)[C@H](C)CC(N)=O)C2)cc1C 1731451127 RPNOJJKTKYWQMX-BPLDGKMQSA-N 333.432 1.252 10 10 EDCE O=C(NCCN=c1cc[nH]cc1)c1cc2cc(O)c(O)cc2s1 1648479107 LQCSZTBUVUCRNC-UHFFFAOYSA-N 329.381 1.971 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cnn(C)c2C)cc1C 1662161120 GIPKXKIWMXFPHB-CYBMUJFWSA-N 330.432 1.954 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccncc2F)cc1C 1667802287 FVZHTZQSCLWPFE-AWEZNQCLSA-N 347.390 1.418 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cnn(C)c2-n2cnnc2)c1 1595800156 QSXQTJRUXLSKMZ-SNVBAGLBSA-N 342.359 1.206 10 10 EDCE CC(C)[C@@H]1CNC(=O)CN1c1ccc(CN)c(Br)c1 2124750928 UUJYQHFDDHYQKH-ZDUSSCGKSA-N 326.238 1.869 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@H]1C[C@@H]2CC[C@H](C1)S2(=O)=O 1593743743 AOEASVAEGBNYED-CNDDSTCGSA-N 325.386 1.070 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)c2cn(C)nn2)cc1C 1674660281 FULNVKGWZMBXDI-CHWSQXEVSA-N 331.420 1.429 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@H](C)SC)cc1C 1676504753 CJSTULLVMGLIRM-GXTWGEPZSA-N 326.462 1.322 10 10 EDCE COC(=O)NCC(=O)N[C@H](C)CCNCc1ccc(OC)c(C)c1 1699086911 STWGUSVOSHWCTA-CYBMUJFWSA-N 337.420 1.344 10 10 EDCE [N-]=[N+]=NCCNS(=O)(=O)Cc1ncsc1Br 1965784474 AVLNQQSWCYWHGR-UHFFFAOYSA-N 326.201 1.635 10 10 EDCE NC(=O)C[C@H](C(=O)O)N1C(=O)/C(=C/c2ccccc2)SC1=S 2545851 CSMABVWWLOCHGO-WPVMNKCKSA-N 336.394 1.216 10 10 EDCE COC(=O)[C@H](O)CNC(=O)c1cc(C)n(-c2ccccc2C)c1C 154309983 WYFYZHDLWHAZMD-MRXNPFEDSA-N 330.384 1.666 10 10 EDCE Nc1ccc(OCCN2CCC(NC(=O)c3cccnc3)CC2)cc1 586046290 CYPQMLSFPHCDPZ-UHFFFAOYSA-N 340.427 1.937 10 10 EDCE CO[C@@H]1C[C@H](C(=O)O)N(Cc2c(O)cccc2Br)C1 2136350526 OIIJXTKDLHQKSU-LDYMZIIASA-N 330.178 1.829 10 10 EDCE CC(C)(C)OC(=O)N1CC(C)(OCC(=O)NCCCN=[N+]=[N-])C1 1985101720 WRWRUDGRECKBSQ-UHFFFAOYSA-N 327.385 1.829 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985103837 AWFFHYWPECTCTE-GMTAPVOTSA-N 327.385 1.419 10 10 EDCE CC(C)(C)OC(=O)NCC1CN(C(=O)COc2ccc(N)cc2)C1 1999457375 BWAVJOICGDQCOB-UHFFFAOYSA-N 335.404 1.631 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C(C)(C)O 2010404155 PAUKFCLOORMTEP-MEBBXXQBSA-N 341.412 1.952 10 10 EDCE CN(Cc1ncon1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2160445495 HUNXLRNCCVOUFT-LLVKDONJSA-N 338.165 1.420 10 10 EDCE NCc1cc(F)c(N2CCS[C@H](CO)C2)cc1Br 720069237 UWDPNOPJHQEVAK-VIFPVBQESA-N 335.242 1.961 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@H](O)C2(C)C)cc1Br 2181215222 QQZIDNVORKOLMU-KGLIPLIRSA-N 343.265 1.879 10 10 EDCE CC(C)(C)OC(=O)N1CCn2ncc(C(=O)N3CC(N=[N+]=[N-])C3)c2C1 2060613833 VZPARXXCWQWPAP-UHFFFAOYSA-N 347.379 1.769 10 10 EDCE CNCc1ccc(N2C[C@H](O)C[C@@H](OC)C2)c(Br)c1 2109018290 NPFYSKUXRFIVRF-VXGBXAGGSA-N 329.238 1.755 10 10 EDCE C[C@H](O)c1ccc(N2CC(OCC(N)=O)C2)cc1Br 2089139175 HWUQRETXTMOFLA-QMMMGPOBSA-N 329.194 1.193 10 10 EDCE COc1ccc(N2C[C@H](CO)C[C@@H]2CO)c(OC)c1Br 2234894444 UCKYZZWOSVNVNM-NXEZZACHSA-N 346.221 1.646 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@H]1C(=O)Nc1ccc(N)cc1 2246471437 TZEBLQSQBNBINJ-KGLIPLIRSA-N 335.404 1.968 10 10 EDCE CCCCN1C(=O)NC(=O)C(=Cc2cc(OC)c(O)c(OC)c2)C1=O 2296132769 JGHVGYRYXIMEEC-UHFFFAOYSA-N 348.355 1.671 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCCCN=[N+]=[N-])[C@@H](CC(N)=O)C1 2303474605 GWBVRKCOAVTBEQ-LBPRGKRZSA-N 340.428 1.874 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@@H]21 2314955702 JVZXQUJABNTFIM-CABZTGNLSA-N 332.219 1.384 10 10 EDCE CCOCCOCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 56984613 JQZUJZXILMUCTE-UHFFFAOYSA-N 340.395 1.332 10 10 EDCE COc1ccc(N2CCN(C(=O)COCC(F)(F)F)CC2)cc1 60601901 DBRVKURBHZGPTA-UHFFFAOYSA-N 332.322 1.923 10 10 EDCE CN(C)c1noc([C@@H]2CCCN(Cc3cc4c(cc3O)OCO4)C2)n1 194932007 LVXDPYXYIJKZSY-LLVKDONJSA-N 346.387 1.950 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1 808532690 HQRQOCDASLWIFE-SECBINFHSA-N 325.267 1.019 10 10 EDCE CC(=O)C(=O)COC(=O)CN(C[C@H]1CCCO1)C(=O)OC(C)(C)C 808522011 LHKUTFGQKHYRNC-GFCCVEGCSA-N 343.376 1.104 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1[C@H]2CC[C@H]1[C@@H](CO)C2 290880903 CWVQJBFKBAROAB-NJAFHUGGSA-N 345.443 1.578 10 10 EDCE Cc1ccc([C@@H](C)N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)c(O)c1 806170125 ONICNCADOAWJHG-ZIAGYGMSSA-N 341.477 1.622 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCCO3)cc2)C1 812009101 BLAXPUIUQDQELU-AWEZNQCLSA-N 332.404 1.235 10 10 EDCE O=C1CC[C@H](N2CCN(Cc3c(O)cccc3Cl)CC2)CCN1 825147696 JTJDPKBUBFSSIS-ZDUSSCGKSA-N 337.851 1.832 10 10 EDCE Cc1cc(C(=O)Cn2nnnc2CN)c(C)n1-c1ccc(F)cc1 830455085 HRDRQTQXTCNJHE-UHFFFAOYSA-N 328.351 1.561 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3C[C@@H]4C[C@H]3CS4)CC2)cc1 839201172 DVEHXQRRLRFBHG-RDJZCZTQSA-N 347.484 1.534 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@@](O)(C(F)F)C2)cc1F 838028805 DBKPRRIGDDFMNF-HNNXBMFYSA-N 331.338 1.803 10 10 EDCE CSCCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918339689 FWEHPNYZPPIYMW-UHFFFAOYSA-N 342.486 1.291 10 10 EDCE COCC1(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 848629484 BOGWJLPAUTXLDO-UHFFFAOYSA-N 333.432 1.254 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCCC[C@@H]2[C@H]2CCNC2)cc1 844223710 AEWSWHGHCSIODP-PKOBYXMFSA-N 344.503 1.833 10 10 EDCE C[C@]1(CCNC(=O)C(=O)NCCc2ccc(N)cc2)C[C@@]1(F)Cl 846345525 YHTDQRQIIANYQW-HOTGVXAUSA-N 341.814 1.748 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCCNC(C)=O)C2)cc1 851935982 HTWHUUJCUKTJCR-AWEZNQCLSA-N 334.420 1.099 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCCN1C[C@H]2CCCCN2C1=O 856143562 NJCHERFOQTZASO-BRLPQQTGSA-N 345.399 1.517 10 10 EDCE CC(C)C[C@]1(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)CCNC1=O 867302495 PWFQPOQTIURZAH-KZULUSFZSA-N 334.416 1.697 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]3CNCC[C@H]32)cc1 866716828 RXQOFEDVXSFORH-FUHWJXTLSA-N 330.476 1.443 10 10 EDCE O=C([C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1)N1CCOCC1 893917547 AVSSRNAKPVCOJD-GFCCVEGCSA-N 340.370 1.741 10 10 EDCE COC(=O)c1c(CNCCNC(=O)C2CC2)c2cc(F)ccc2n1C 894148049 RERGVTMUPHKXNN-UHFFFAOYSA-N 347.390 1.720 10 10 EDCE CC(C)(C)C(=O)Cn1cc(C(=O)NCc2ccc(O)cc2O)nn1 1142532948 AHZBIGHYSQFVCC-UHFFFAOYSA-N 332.360 1.235 10 10 EDCE Nc1c(C(=O)NCc2ccc(O)cc2O)cnn1Cc1ccccc1 1162278745 LAWSYCAMKGKDPA-UHFFFAOYSA-N 338.367 1.855 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3COCCO3)CCC2)cc1C 1326787352 ZLFRXWQUZOODHA-QGZVFWFLSA-N 348.443 1.548 10 10 EDCE O=C(Nc1c(Cl)ccc2nonc12)c1cn(C[C@H]2CCOC2)nn1 1436138309 NXYRXGYHIYUBFQ-MRVPVSSYSA-N 348.750 1.757 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2C[C@@H]3CCC[C@H]32)cc1F 1354438753 QNKCJGJYLMUVKT-GZBFAFLISA-N 333.407 1.813 10 10 EDCE CC1(C)OCC(CO)(NC(=O)c2ccc(N=NC(N)=O)cc2)CO1 1467629327 OHIAGLAABXTSFA-UHFFFAOYSA-N 336.348 1.093 10 10 EDCE COC(=O)[C@@H](Cc1cncs1)NC(=O)/C=C\c1ccc(O)c(O)c1 1471710439 BIOYVWMDWXMSIR-KTLBGCOUSA-N 348.380 1.468 10 10 EDCE CN1C(=O)O[C@H]2CN(Cc3cccc(Br)c3O)C[C@@H]21 2120401615 MQNLPOCDWDKDQV-QWRGUYRKSA-N 327.178 1.790 10 10 EDCE O=C1C[C@H](c2cccc(NC(=O)Cc3ccc(O)c(O)c3)c2)CN1 1545986051 WXCNZZWALIPWBR-ZDUSSCGKSA-N 326.352 1.883 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nn(CC)cc1[N+](=O)[O-] 1556515488 AFNQWHQCJWWTIW-UHFFFAOYSA-N 339.348 1.933 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCc2nnc(O)n2C1 1634943877 GLLNTPUVRKOMFF-JTQLQIEISA-N 337.376 1.054 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C23CCN(CC2)C3)cc1C 1498161165 SRSRWRDFXLNNQX-HNNXBMFYSA-N 331.460 1.694 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(c2cccc(F)n2)CC1 1641174261 OZDZCUTZGQHSEU-UHFFFAOYSA-N 331.347 1.523 10 10 EDCE O=C(CNC(=O)Cc1ccc(O)cc1)NCc1cccc(Cl)c1O 1640404821 HTLMEJLOEAVFSV-UHFFFAOYSA-N 348.786 1.726 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@H](O)C2(C)C)c(Br)c1 2124803110 UIPCYXPXAVEGMT-JCOFBHIZSA-N 330.222 1.823 10 10 EDCE CC(C)[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@H](C)O 1667525097 QDEOGAZLAHRCFV-FZMZJTMJSA-N 335.408 1.574 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCCCN=[N+]=[N-])[C@H]1CCOC1 1964880593 RNOCTMHDFHFNLR-QWRGUYRKSA-N 327.385 1.733 10 10 EDCE CC(C)(C)n1cc(CNC(=O)NCc2ccccc2O)c(O)nc1=O 1685125163 MSXZNAQXCYXLQM-UHFFFAOYSA-N 346.387 1.409 10 10 EDCE COC(=O)c1ccccc1NC(=O)CN1C(=O)[C@@H](C)SC1=S 11635422 AEPQEFPTZJXLFO-MRVPVSSYSA-N 338.410 1.661 10 10 EDCE COc1cc(O)c2c(=O)c(O)c(-c3cc(O)c(O)c(O)c3)oc2c1 13838621 BDZXSHDKBKYQKJ-UHFFFAOYSA-N 332.264 1.997 10 10 EDCE biogenic CC[C@@H]1C(=O)NC(=O)CN1c1ccc(CN)c(Br)c1 228153862 FYVFIIDJBQPOBK-LLVKDONJSA-N 326.194 1.149 10 10 EDCE CC(C)(C)OC(=O)NCc1cn(C[C@@H](N)c2ccccc2O)nn1 1942393421 ZQMLXXHYRBYPSM-CYBMUJFWSA-N 333.392 1.708 10 10 EDCE C[C@H](NC[C@H](CO)NC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985858083 HBXCMEOQRKHBEC-WDEREUQCSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2011939237 JLROCZFOCMZSJA-XHDPSFHLSA-N 339.396 1.660 10 10 EDCE C[C@@H](NC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)c1ccccc1O 2017518540 IOSNIFOELJBMQU-RISCZKNCSA-N 338.404 1.845 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C 2018035277 GAURMHKJSXGDPS-CQSZACIVSA-N 337.420 1.503 10 10 EDCE [N-]=[N+]=NCCN[C@]1(C(N)=O)CN(Cc2ccccc2)[C@@]2(CCOC2)C1 2038665963 NSNZLVWGVWHRRI-IRXDYDNUSA-N 344.419 1.175 10 10 EDCE O=C1NC(=O)[C@@H]2CN(c3ccc(CO)cc3Br)CC[C@H]12 2158789544 MOFIYHBFLZLDHB-VHSXEESVSA-N 339.189 1.040 10 10 EDCE C[C@@H](N)c1ccc(N2CC(NS(C)(=O)=O)C2)cc1Br 703155585 GRKGTPCTENVEDW-MRVPVSSYSA-N 348.266 1.207 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3C[C@@H](N(C)C)C34CCC4)c2n1 2063754170 MAXBIDIXSMIVIB-QWHCGFSZSA-N 329.404 1.346 10 10 EDCE CN1C[C@@H]2C[C@H](C1)N2c1cc2c(cc1Br)[C@H](N)C(=O)N2 2187623589 QIWANPFMTZWDHF-DAROEXNTSA-N 337.221 1.294 10 10 EDCE CC1(C)C[C@@H](O)[C@H](O)CN1c1cc(Br)c(CN)cc1F 2188631633 DRACUBMRZRVJMK-CHWSQXEVSA-N 347.228 1.757 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1908253462 SYFYOVMZCZICAU-GRYCIOLGSA-N 339.396 1.516 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)cc1Br 2182543944 VIZPGOOEQALJKI-WAYYCVMKSA-N 345.212 1.225 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2104412282 UEWXVWRUKHUVPS-NGYYELCVSA-N 328.206 1.433 10 10 EDCE OCc1ccc(N2CCO[C@H]3COCC[C@@H]32)c(Br)c1 2087482940 GDLFPIOSYDTGQL-KBPBESRZSA-N 328.206 1.936 10 10 EDCE OCc1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)cc1Br 2090117379 WCHXTNPXUGUHBU-OKILXGFUSA-N 328.206 1.123 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)c(Br)c1 2205614829 SGKFDEFGWYDMJV-MELADBBJSA-N 347.228 1.439 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2COC[C@@H]2N(C)C)c1O 2236029450 BDOXPEFQXHNBJZ-NEPJUHHUSA-N 345.237 1.582 10 10 EDCE CN(Cc1cc(N)ccc1O)CC1(O)CN(C(=O)OC(C)(C)C)C1 2250097120 MWSHZXSWOYNJHT-UHFFFAOYSA-N 337.420 1.388 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2sc(O)nc2C)s1 2269269669 FPSMESUVVVUFAQ-UHFFFAOYSA-N 337.473 1.814 10 10 EDCE CCCCCCN1C(=O)NC(=O)C(=CN[C@H]2CCCC[C@@H]2N)C1=O 2296056453 MIKUAYLWFXGCHG-KBPBESRZSA-N 336.436 1.389 10 10 EDCE COc1ccc(N2CC[C@H](O)[C@H](O)CC2)c(OC)c1Br 2284570628 JFTOTCPWVXAEEH-PHIMTYICSA-N 346.221 1.788 10 10 EDCE CNC(=O)c1cncc(C=CC(=O)N2CC(=O)Nc3ccccc32)c1 2297520202 MGUHTSCYSBPYMW-UHFFFAOYSA-N 336.351 1.440 10 10 EDCE O=C1NC(=O)C(=CC=Cc2coc3ccc(Cl)cc3c2=O)C(=O)N1 2297730909 PHYHFYLKCDMKRQ-UHFFFAOYSA-N 344.710 1.752 10 10 EDCE CN1C(=O)/C(=C/Nc2ccccc2Br)C(=O)NC1=S 103079301 FJXJBDJNTYUSCX-VOTSOKGWSA-N 340.202 1.618 10 10 EDCE OCCNCc1cc(Br)c(O)c(Br)c1O 76276365 DTDGZCKWFVBNTE-UHFFFAOYSA-N 340.999 1.705 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@H]4[C@@H]3CO)c(Br)cc2[C@H]1O 2357563278 JTNFPYQSLXHUMM-LWSPUOQWSA-N 339.189 1.252 10 10 EDCE O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cccc(O)c1 182221657 YGBWMXUNSMQNAS-UHFFFAOYSA-N 346.408 1.879 10 10 EDCE Cc1cc(C(=O)N[C@@H]2CCC(=O)N(C)C2)c(C)n1-c1ccccn1 131159422 NVXQQDMFRLZTOC-CQSZACIVSA-N 326.400 1.840 10 10 EDCE CC[S@](=O)c1ccccc1C(=O)N1CCS(=O)(=O)[C@H](C)C1 265663378 FHTIZKWCWSHKHE-GIPWTMENSA-N 329.443 1.073 10 10 EDCE O=C(N[C@H]1CCCN(c2ncccn2)C1)c1c(F)ccc(O)c1O 279220586 OWNUBFKDPZJJDJ-JTQLQIEISA-N 332.335 1.426 10 10 EDCE COc1ccc(N2CCN(C(=O)C[C@H]3CCOC[C@@H]3OC)CC2)cc1 294251301 FRXKHFKCIYIWIN-QAPCUYQASA-N 348.443 1.785 10 10 EDCE C[C@@H](OCC(=O)OCC(=O)c1ccc(O)c(O)c1)c1nccn1C 805689531 YPFBQKJSNHXKDG-SNVBAGLBSA-N 334.328 1.335 10 10 EDCE NCCCNC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 841868911 JCLKXMZSRQGOFA-UHFFFAOYSA-N 345.491 1.367 10 10 EDCE C[C@H](NCC[C@@H]1CNCCS1(=O)=O)c1ccc(N(C)C)cc1 925801259 XKNDUVIHIQCBSR-XJKSGUPXSA-N 325.478 1.180 10 10 EDCE O=S(=O)(NCc1c(O)cccc1F)c1cnn([C@@H]2CCOC2)c1 921452765 YVUQNLMKCKSOOP-SNVBAGLBSA-N 341.364 1.168 10 10 EDCE CCN(C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CCN(C)C1 850685889 JGZDMUOYCJVXFS-QGZVFWFLSA-N 346.475 1.264 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3noc4c3COCC4)C2)cc1 857869436 OCYRLVMSZYCANM-LBPRGKRZSA-N 343.383 1.765 10 10 EDCE Cn1cc([C@H](NC(=O)c2c(F)ccc(O)c2O)C2(CO)CCC2)cn1 857264293 UXUSDDULMAZYBY-HNNXBMFYSA-N 349.362 1.604 10 10 EDCE O=C(COCC(F)F)NCc1ccc(N2CCC(O)CC2)cc1 862225771 GIVUNSOGBIJKHD-UHFFFAOYSA-N 328.359 1.546 10 10 EDCE CC(=O)c1cc(F)cc(CN2CC[C@H]3[C@H]2CCCN3CCO)c1O 934258206 DKCSCTPBZDYXBK-SJORKVTESA-N 336.407 1.765 10 10 EDCE CC(C)(C)OCC(=O)NC(C)(C)C(=O)N1Cc2cccc(O)c2C1 871205883 MXAZHQPUSQMHHU-UHFFFAOYSA-N 334.416 1.944 10 10 EDCE COc1ccsc1S(=O)(=O)Nc1ccc(O)cc1C(=O)O 776432933 HWJHNUGKPZWPAY-UHFFFAOYSA-N 329.355 1.961 10 10 EDCE C[C@H]1CCn2cc(C(=O)NC[C@@H](N)c3ccc(N(C)C)cc3)nc2C1 870932457 FQYDBOVNKROFNP-XJKSGUPXSA-N 341.459 1.961 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@H]1CCOC1 1317290306 QVMFRWJAHPTOIK-NWDGAFQWSA-N 333.392 1.593 10 10 EDCE COC[C@H](C)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1317069444 MXBQBTZGKZUBFK-FZMZJTMJSA-N 333.392 1.688 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC3CCC3)C2)cc1 1327892650 NGNWOPGGPOOWOS-AWEZNQCLSA-N 331.416 1.306 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCC(NC)CC1 1327838439 HLLSAHALOOPXPD-UHFFFAOYSA-N 346.475 1.312 10 10 EDCE CO[C@@H]1CC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1326205408 WRVPNAGNRLFYPL-MWLCHTKSSA-N 328.390 1.061 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H]2COC[C@]2(C)C1 1327330231 PRYRADNBABQQMQ-BEFAXECRSA-N 346.427 1.626 10 10 EDCE CC(=O)C(=O)COC(=O)C1(CC(=O)OC(C)(C)C)CCOCC1 1330232088 IUIGFZPVAIRLBB-UHFFFAOYSA-N 328.361 1.216 10 10 EDCE O=C(CC1CS(=O)(=O)C1)NCc1cccc(Br)c1O 1330552429 QBINWPMFTIREFW-UHFFFAOYSA-N 348.218 1.206 10 10 EDCE CN(C)c1nc(CCNC(=O)c2c(F)ccc(O)c2O)cs1 1182560985 YUNGBQLKIXGPAL-UHFFFAOYSA-N 325.365 1.732 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc2c(nc1O)CCCC2=O 1299571068 PXJMVYARYHDEDR-UHFFFAOYSA-N 328.324 1.647 10 10 EDCE Cc1nnc(N(C)[C@@H](C)CC(N)=O)n1Cc1ccc(N(C)C)c(F)c1 1290704012 ANRMAEFEZFRTEF-NSHDSACASA-N 348.426 1.540 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)CCn2ccnn2)cc1C 1482274829 CRFQFHOSILJCSO-HNNXBMFYSA-N 345.447 1.622 10 10 EDCE Cc1nc(O)c2ccc(C(=O)NCc3c(O)cccc3O)cc2n1 1558535559 JYVUULPAHVFFQL-UHFFFAOYSA-N 325.324 1.985 10 10 EDCE O=C1CC[C@@H](c2ccc(C(=O)NCc3cccc(O)c3O)cc2)N1 1637046261 NMNOZMCCPMZYIZ-AWEZNQCLSA-N 326.352 1.979 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)CC2CCCC2)cc(OC)n1 1737547707 BCIRVNQVACABNH-GFCCVEGCSA-N 349.431 1.914 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)Cn2cccn2)cc1C 1571377452 LRCIQWRFGMCGCN-OAHLLOKOSA-N 330.432 1.837 10 10 EDCE O=C(CN1CCCCS1(=O)=O)NCc1c(O)ccc2ccccc12 1645443050 GAEAKBRUAJJDPM-UHFFFAOYSA-N 348.424 1.587 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2cc(S(N)(=O)=O)oc2Cl)c1 1645805195 WIBRFKKHQKEBDN-UHFFFAOYSA-N 344.776 1.524 10 10 EDCE CC[C@@H](OC)C(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1584049311 CCHZYBOEEFTEGU-GXFFZTMASA-N 349.391 1.509 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)CN2CCCC2=O)cc1C 1666510904 UGEBUCSECYXRBO-AWEZNQCLSA-N 347.459 1.468 10 10 EDCE O=C(Cc1nc(C2CCOCC2)n[nH]1)NCc1c(O)cccc1F 1596917161 XBIPJJRTZCOVBU-UHFFFAOYSA-N 334.351 1.402 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCc2cnc[nH]2)cc1C 1699365242 FWDOWJUYUCJEDI-CQSZACIVSA-N 330.432 1.954 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)/C(=C\c2ccc(F)c(F)c2)SC1=S 1858596017 MIRACACIIDDGMM-YNYSXPKMSA-N 345.348 1.612 10 10 EDCE 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CN(C)c1ccc(CNC(=O)[C@H](CO)NC(=O)OC(C)(C)C)cc1 753783813 WNYNASGNVJMLSL-AWEZNQCLSA-N 337.420 1.254 10 10 EDCE Oc1ccc(Cl)c(F)c1CNCCN1CCC2(C1)OCCO2 1203759632 MGWYHAXBOJMTAB-UHFFFAOYSA-N 330.787 1.723 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)NCCc1ccc(N)cc1 2080578685 JDSWEHSPPIYTPL-LSDHHAIUSA-N 349.431 1.298 10 10 EDCE O=S1(=O)C[C@@H]2CCN(c3ccc(CO)cc3Br)[C@H]2C1 2094927401 OLBFKUSUPYWQPW-GWCFXTLKSA-N 346.246 1.565 10 10 EDCE CN(Cc1nn(C)nc1Br)C(=O)c1ccc(O)c(O)c1 2235252784 UDVYDJNYFYXDHP-UHFFFAOYSA-N 341.165 1.261 10 10 EDCE CN(c1ccc(CO)c(Br)c1)[C@@H]1COC2(COC2)C1 2270765062 ADLFVYWEBFASOT-LBPRGKRZSA-N 328.206 1.936 10 10 EDCE O=C1NC(=O)N(c2ccc([N+](=O)[O-])cc2)C(=O)C1=Cc1ccco1 2297350931 WMBQPAVLDXHRBM-UHFFFAOYSA-N 327.252 1.854 10 10 EDCE COc1ccc(NC=C2C(=O)N([C@H]3CCS(=O)(=O)C3)N=C2C)cc1 2297471729 CLZRMUPGLRLKAJ-ZDUSSCGKSA-N 349.412 1.396 10 10 EDCE CC1(C)CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CCN1 2297776963 QLTKKRSZQSEMLD-UHFFFAOYSA-N 329.444 1.747 10 10 EDCE CS(=O)(=O)[C@@H]1CC[C@H]1NCc1cc(Br)ccc1O 2319818594 UUCULYAEGXMGIL-ZYHUDNBSSA-N 334.235 1.820 10 10 EDCE Cc1c(C=C2SC(N3CCN4CCC[C@H]4C3)=NC2=O)cnn1C 2328652409 DNRQMJJYDIDZKA-ZDUSSCGKSA-N 331.445 1.479 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2329329377 UEWXVWRUKHUVPS-UUGWQDNISA-N 328.206 1.433 10 10 EDCE COc1ccc(N2CCC(NC(=O)NCc3ncnn3C)CC2)cc1 174291396 KQTJLZSCJMDLJW-UHFFFAOYSA-N 344.419 1.292 10 10 EDCE COc1ccc(N2CCN(C(=O)CSC(=N)N(C)C)CC2)cc1 29581648 SJMHNBHBZFHLCY-UHFFFAOYSA-N 336.461 1.573 10 10 EDCE O=C(Cn1ccnn1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 128920732 WJHOFRBCNUPSHR-UHFFFAOYSA-N 332.319 1.692 10 10 EDCE Cc1cc(C(=O)CN2C[C@@H](O)C[C@@H]2CO)c(C)n1-c1ccc(F)cc1 184734916 XNDSVYXQCNUIQY-SJORKVTESA-N 346.402 1.843 10 10 EDCE COc1cc(N2CCO[C@]3(CCCOC3)C2)c([N+](=O)[O-])cc1OC 286583729 NKWXNNLOTQCHEP-MRXNPFEDSA-N 338.360 1.998 10 10 EDCE Cc1ccc(CNC(=O)c2cc(O)nn2C)c(O)c1Br 2380750693 FSTLTNRMTDESMR-UHFFFAOYSA-N 340.177 1.832 10 10 EDCE CC(=O)C(=O)COC(=O)c1cnc2c(cnn2Cc2ccccc2)c1 808499542 CABRVKUBMWIXQE-UHFFFAOYSA-N 337.335 1.795 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CNCC[C@H]3C)C2)cc1 818655923 QBIMRYDTEUIHJL-IIDMSEBBSA-N 346.475 1.819 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)C1CN(C2CCOCC2)C1 900895507 QDTUUJUVLVAHRT-UHFFFAOYSA-N 345.443 1.589 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(CCO)C[C@H]2C)c([N+](=O)[O-])c1 829577019 IFIQDLJUPREYBQ-RYWCDNDXSA-N 349.387 1.284 10 10 EDCE Cc1cc(CC(=O)NC[C@]2(O)CCN(C)C2)c(C)n1-c1ccccc1 832207659 QUKHLZQAZFSEDE-HXUWFJFHSA-N 341.455 1.819 10 10 EDCE C[C@@H](O)[C@@H]1CN(C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 840274327 DRAXFHZQOVIIFU-DYVFJYSZSA-N 333.432 1.360 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C[C@@H]1CN(C2CC2)C(=O)O1 844268751 AGDARPWRAYXTIQ-GOSISDBHSA-N 345.443 1.938 10 10 EDCE CCn1cnnc1CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849225390 SVBICSNXBDQTAF-ZDUSSCGKSA-N 344.419 1.385 10 10 EDCE CCc1cnc(CCNC(=O)C(=O)NCCc2ccc(N)cc2)s1 842217013 HYPPDLIAPMBYJR-UHFFFAOYSA-N 346.456 1.305 10 10 EDCE Cn1ncc(C(F)(F)F)c1/C=C1/SC(N2CCOCC2)=NC1=O 849243382 JCIIZQUJKGINRO-UXBLZVDNSA-N 346.334 1.741 10 10 EDCE COc1cc(Br)cc([C@@H](C)NC[C@H](O)CN(C)C)c1O 848527358 AFZJKPQKNMNITB-KOLCDFICSA-N 347.253 1.736 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@@H]3C[C@@H](N)C34CCC4)cc2)C1 925484223 CSQUFGDPRMLPBR-KBAYOESNSA-N 342.487 1.748 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@]3(O)CCO[C@H]3C)C2)cc1 854298341 AVILWHCOHLBKOY-DEYYWGMASA-N 349.431 1.113 10 10 EDCE O=C(C[C@H]1CCC(=O)N1)NCc1cc(Br)ccc1O 854442767 XACXVHFVGCVJMO-SNVBAGLBSA-N 327.178 1.440 10 10 EDCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)[C@@H]2COC(C)(C)C2)c1 859007183 VCUDGODSZJONRZ-PWSUYJOCSA-N 329.418 1.949 10 10 EDCE CNCCCC(=O)N1CCC(NC(=O)NCc2ccccc2O)CC1 851679006 RCCUCOMQSRNRGN-UHFFFAOYSA-N 348.447 1.182 10 10 EDCE COC(=O)NC(C)(C)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855229595 KJHTUZHZKVCEGU-GFCCVEGCSA-N 335.404 1.525 10 10 EDCE Cn1ccnc(N2CCN(Cc3cc(Cl)ccc3O)CC2)c1=O 769466959 QRGMTPBYOFKUGS-UHFFFAOYSA-N 334.807 1.462 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)c3ncccc3N)C2)cc1 868956370 PLCOFGFEINUDNV-ZDUSSCGKSA-N 326.400 1.929 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1C[C@@H]2[C@@H](C1)[C@H]1CC[C@H]2CN1 863653017 XYHUCTXNILCZOS-IJXRJRJASA-N 327.472 1.953 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cncc2nc[nH]c12 1119452561 MCYXKPQSOBMUJA-UHFFFAOYSA-N 337.383 1.725 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CC[C@H]4CSC[C@@H]4C3)nc12 872163832 MSKJFOPJNKNBLU-UWVGGRQHSA-N 334.401 1.318 10 10 EDCE CN1CCN(c2ccc(CNCC(=O)NCc3ccco3)cc2)CC1 771824181 TZZDNQAZZWTDFU-UHFFFAOYSA-N 342.443 1.437 10 10 EDCE CCc1ccc(OCCCN/C=C2\C(=O)NC(=O)N(C)C2=O)cc1 1084245723 YIKCNUCXPRUQCU-SDNWHVSQSA-N 331.372 1.200 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(c2ccnc(F)c2)CC1 1158429621 RUUAGMLXEPMHOC-UHFFFAOYSA-N 331.347 1.523 10 10 EDCE O=C(O)C1=C[C@H](c2cc(Br)ccc2O)NC(=S)N1 76260967 FHUWSQDADJMEAX-SSDOTTSWSA-N 329.175 1.642 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)C[C@@H]2CCNC2=O)cc1C 1319471820 FRRNWQHRAJGAFW-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE CO[C@@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 1324280069 KNIUDSSKBRMTEM-NVXWUHKLSA-N 345.443 1.587 10 10 EDCE Cc1nn(C)c(Br)c1[C@@H](O)[C@@H](N)c1ccccc1O 1890613622 XIEWNDKXJAPZEY-NWDGAFQWSA-N 326.194 1.930 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H]1C[C@@H]2C[C@@H]2C1 1329204935 NASXIQCQZYFULT-MUJYYYPQSA-N 325.412 1.594 10 10 EDCE CNCc1ccc(N(C)Cc2nnn(C)n2)c(Br)c1 1892992412 MIAASRJDPHQBDQ-UHFFFAOYSA-N 325.214 1.328 10 10 EDCE CN1CCOC[C@@H]1CNCc1cc(Br)cc(F)c1O 715719108 AYZMECXGVZNXIY-NSHDSACASA-N 333.201 1.714 10 10 EDCE CN(C[C@@H](O)C1CC1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 690293202 NKNGOPQKASNARE-CHWSQXEVSA-N 340.221 1.608 10 10 EDCE CO[C@H]1C[C@H](CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1338537688 HMVFPXQBAADLMX-JCNLHEQBSA-N 343.427 1.220 10 10 EDCE CC[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H](CC)O1 1348651532 IDBKUFRWUBOTAT-KBPBESRZSA-N 332.400 1.650 10 10 EDCE O=C(C(=O)N1CCC2(CCOCC2)C1)N1Cc2cccc(O)c2C1 1348640788 VIIHVPPXXWSMJD-UHFFFAOYSA-N 330.384 1.264 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2coc(C)c2)cc1C 1507190161 CGTZKMMGGGPTNX-INIZCTEOSA-N 332.400 1.786 10 10 EDCE COc1cccc(CNC(=O)[C@@H]2CNC(=O)c3ccccc32)c1O 1294924445 DWDBOAARQKEJFN-CQSZACIVSA-N 326.352 1.544 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@H]2CN3CCN2C[C@@H]3C)cc1F 1293225638 ZXQZVBCPYIXNEY-KBXCAEBGSA-N 348.466 1.676 10 10 EDCE C[C@@H](CNC(=O)[C@@H]1CCCO1)NC(=O)c1ccc(N=NC(N)=O)cc1 1526372029 GSHPSYLRXDBUBC-GWCFXTLKSA-N 347.375 1.263 10 10 EDCE O=C(NC[C@@H]1CCCC[C@@H]1N1CCOCC1)c1cccc(O)c1O 1520653807 WNVZIMPLWMOALC-ZFWWWQNUSA-N 334.416 1.719 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 1616694920 KDMJLHHGHHIXNV-QGZVFWFLSA-N 348.443 1.853 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)c2cccs2)cc(OC)n1 1704006240 OXYSKBCNBRJIAM-JTQLQIEISA-N 349.412 1.709 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccncc2C)cc1C 1482730091 ZFRVNBKDFBKDMM-MRXNPFEDSA-N 343.427 1.588 10 10 EDCE CC(=O)N/C(=C/C1=S=CC=C1)C(=O)Nc1ccc([S@](C)=O)cc1 1629045306 ADXRDKBDFGTZFV-VOCPSOEZSA-N 348.449 1.660 10 10 EDCE CCOC(=O)Cc1csc(NC(=O)Cc2ccc(O)c(O)c2)n1 1626144380 RKLPQYQBWGQMDR-UHFFFAOYSA-N 336.369 1.841 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@H]2CCC(=O)NC2)cc1C 1482847868 JLUZOJSILCDIJV-HOCLYGCPSA-N 347.459 1.514 10 10 EDCE C/C=C(/C)C(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1494015711 NURTVCVQNCKXPI-LUAYMIARSA-N 333.388 1.442 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)C(=O)NCC2CC2)cc1C 1497299094 HEYBDFREXWSNMS-CQSZACIVSA-N 347.459 1.514 10 10 EDCE CS(C)(=O)=NC(=O)CNC(=O)c1cc2cc(O)c(O)cc2s1 1639648364 BXADBXWPBRIORV-UHFFFAOYSA-N 342.398 1.297 10 10 EDCE NS(=O)(=O)CCCCCCC(=O)NCc1cccc(Cl)c1O 1637227205 RJMVWXNJLPWGEF-UHFFFAOYSA-N 348.852 1.901 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2cnnc(O)c2)cc1C 1732703330 YHEGYFYKAVODIV-CYBMUJFWSA-N 344.415 1.797 10 10 EDCE Cc1cc(=O)c(OCCN2CCOCC2)cn1Cc1ccc(N)cc1 1857915323 QQOPWWBZZCHHAE-UHFFFAOYSA-N 343.427 1.498 10 10 EDCE CN(C)C[C@H]1COC[C@@H]1NCc1cc(Br)ccc1O 2141467204 XEFNJFAZQMVBKC-AAEUAGOBSA-N 329.238 1.821 10 10 EDCE C[C@@H]1CC[C@@H]([C@@H](NC(=O)OC(C)(C)C)C(=O)NCCN=[N+]=[N-])O1 1985101565 UQTHWMLDSMKOQP-OUAUKWLOSA-N 327.385 1.874 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COCCN(Cc2cc(N)ccc2O)C1 1999478091 QGVOPNZMLCDXSM-CQSZACIVSA-N 337.420 1.700 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010402700 UTRUTKKPSHIVST-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE O=C1Nc2cc(N3C[C@@H](CO)[C@@H](F)C3)c(Br)cc2[C@H]1O 2177137297 HTRAUENDQLJOCN-ZKQGETEISA-N 345.168 1.201 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(F)c1Br 2182549440 CHBLALBFTSXXEC-LPQAMYBRSA-N 345.212 1.225 10 10 EDCE O=C(O)[C@@H]1CN(Cc2ccc(Br)cc2O)C2(CC2)CO1 2183985176 XCURDQRCMLLBSA-LBPRGKRZSA-N 342.189 1.973 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)NCCCCN=[N+]=[N-])n1 2058158766 NYJWOBPUWOPXQB-UHFFFAOYSA-N 337.203 1.551 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1ccc(O)cc1 2067785972 ARVAJCANSCJJMK-CABCVRRESA-N 348.399 1.939 10 10 EDCE OCc1ccc(N2CCO[C@@]3(CCOC3)C2)c(Br)c1 2111919249 NGHCDEMPYVLSQD-AWEZNQCLSA-N 328.206 1.937 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@@]2(CO)CO3)cc1Br 2094645027 RCIDHPQXLOCNBX-DRCTWCGVSA-N 328.206 1.842 10 10 EDCE N[C@H](Cc1ccccc1Br)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2237432057 QMLVKZUIIWCDDB-IRUJWGPZSA-N 339.233 1.585 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@@](O)(CF)CNC(=O)OC(C)(C)C)cc1 2246678722 AMHSJAAOIXYTMI-RHSMWYFYSA-N 341.427 1.978 10 10 EDCE CSc1ncc(CNC(=O)N[C@@H](CC(=O)O)C(F)F)s1 2284503446 CFWHTNOZYNEZMA-LURJTMIESA-N 325.362 1.773 10 10 EDCE COCC[C@@](C)(O)CNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297723968 LVRMIVMJYKOOPD-LJQANCHMSA-N 348.443 1.440 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCCNCc2ccc(O)c(O)c2)C1 2300149546 ZUMNTIOJQFRMIF-UHFFFAOYSA-N 338.404 1.823 10 10 EDCE CC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)NN1CCN(C)CC1 2313682008 SNMLZFZQJAAVEU-UHFFFAOYSA-N 331.395 1.574 10 10 EDCE Cc1ccc(CN2CCNC(=O)C23CC3)c(O)c1Br 2352652942 WAUSZJNIPMETKH-UHFFFAOYSA-N 325.206 1.928 10 10 EDCE Cc1nn(C)cc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 179102859 CDYHYVMBBFTHHP-UHFFFAOYSA-N 341.415 1.584 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C2CCCCC2)cc(OC)n1 1354223112 IQYRZUJLNRGLFE-LBPRGKRZSA-N 349.431 1.914 10 10 EDCE COC(=O)COc1ccc(N(C)Cc2c(C)nn(C)c2OC)cc1 183228115 YJVQPZAVJYNRSN-UHFFFAOYSA-N 333.388 1.925 10 10 EDCE CCCOc1ccc(CNCC2CN(S(C)(=O)=O)C2)c(O)c1 189704044 ZCIFZUTVYSDVCY-UHFFFAOYSA-N 328.434 1.162 10 10 EDCE CN(C)c1ccc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1 92044637 MKVZCMQBQROXQC-KRWDZBQOSA-N 337.489 1.753 10 10 EDCE CN1CCCc2cc(CNC(=O)N[C@H]3CCC[C@@H](C(N)=O)C3)ccc21 247378573 OONQVEIWKPAHDG-CVEARBPZSA-N 344.459 1.912 10 10 EDCE C[C@@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1ccccc1O 806170742 BCXKQWMROFHUJX-CHWSQXEVSA-N 327.450 1.314 10 10 EDCE CC(C)N(C[C@H](C)O)C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 807670733 HPUYEWAYUAFKBH-KBPBESRZSA-N 335.448 1.548 10 10 EDCE CC(=O)C(=O)COC(=O)c1occc1CN1C(=O)Cc2ccccc21 808514453 DBNYPEOYRDKYKR-UHFFFAOYSA-N 341.319 1.684 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2c(cn1)OCCO2 819485309 SILZOOSSMPDYSZ-SNVBAGLBSA-N 330.340 1.625 10 10 EDCE CO[C@@]1(CO)CCCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 826952827 UPEYZMRUFBJYDZ-SFHVURJKSA-N 338.423 1.636 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@@H]2CCCCN2CCO)c1O 824583502 NOWJEXHVGKPGJY-ZDUSSCGKSA-N 339.392 1.245 10 10 EDCE Cn1nccc1CCNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588458561 IAWNFFLNASDRGD-DAXSKMNVSA-N 340.427 1.629 10 10 EDCE Cc1cc(CC(=O)NCCCS(N)(=O)=O)c(C)n1-c1ccccc1 823187012 YMWBTPSFRLNBJS-UHFFFAOYSA-N 349.456 1.431 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H](Cn2cncn2)C1 588407185 NBSLKHBQESKUOU-KXQLTZBTSA-N 328.372 1.641 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@H]2CNC[C@@H]2CC1 844224222 DLWFWUXGKDJJBL-HDICACEKSA-N 344.503 1.642 10 10 EDCE O=C(Cc1ccon1)NCc1ccc(N2CCC(O)CC2)c(F)c1 749406346 OMBOJZXXRSNNSW-UHFFFAOYSA-N 333.363 1.634 10 10 EDCE CC(=O)C(=O)COC(=O)Cn1nc(C(F)(F)F)c2c1CCCC2 923755343 QAAKNFKKNLAZTK-UHFFFAOYSA-N 332.278 1.482 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)COCc3ccnn3C)C2)cc1 855225507 NYXDPMCEKFBCBF-AWEZNQCLSA-N 344.415 1.340 10 10 EDCE COC(=O)CCNC(=O)CCN[C@H](C)c1cc(Cl)ccc1O 858540752 ABUFYERMEFHXQN-SNVBAGLBSA-N 328.796 1.766 10 10 EDCE CN1CCN(c2ccc(CNCCO[C@H]3CC3(F)F)cc2)CC1 850365779 OPLRFAPIYMPXTH-INIZCTEOSA-N 325.403 1.952 10 10 EDCE O=[S@](CCNCc1cc2c(cc1O)OCO2)CC(F)(F)F 850348642 QGOQCVVSDFNBGI-OAQYLSRUSA-N 325.308 1.522 10 10 EDCE C[C@@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCCO1 755213154 SFDVWTFNXSLBRG-BEFAXECRSA-N 345.443 1.574 10 10 EDCE O=C1OC[C@]2(CNCc3c(O)ccc(Cl)c3F)COCCN12 865770915 VWKWZQAJJMJXPD-AWEZNQCLSA-N 330.743 1.496 10 10 EDCE COC(=O)[C@@]1(OC)CCN(Cc2ccc(N3CCN(C)CC3)cc2)C1 862475674 SQGACFMEZYLKJH-LJQANCHMSA-N 347.459 1.202 10 10 EDCE COc1ccc(N2CCN(CCNCc3cnc(C)o3)CC2)cc1 862274962 IDCANJYKISKWGH-UHFFFAOYSA-N 330.432 1.903 10 10 EDCE CC(C)CN1CCO[C@@H](CNC(=O)CN(C)c2ccc(N)cc2)C1 863558475 KGYZJQBJBWJYOG-KRWDZBQOSA-N 334.464 1.178 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNc2cnn(CCN(C)C)c2)c1O 775003531 LYZZDNPOQODPOX-UHFFFAOYSA-N 335.364 1.679 10 10 EDCE COc1ccc(O)c([C@H](C)NCCn2nc3ccccn3c2=O)c1 775370972 KODUPQVSNYZTBF-LBPRGKRZSA-N 328.372 1.561 10 10 EDCE CC(=O)c1cc(Cl)cc(Cn2cc(CCn3cncn3)nn2)c1O 880999333 LCEIKFXJCBJNDA-UHFFFAOYSA-N 346.778 1.722 10 10 EDCE CC1(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)COC1 782395738 VTIIAXOUOCRABK-UHFFFAOYSA-N 343.471 1.871 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)/C=C/c2cnn(C)c2)c2ccc(F)cc2O1 1130592205 DUADEZHGVUBERA-VFQAQYNWSA-N 345.330 1.540 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)c1nnc2n1CCC2 1136357847 UUIZUJZHTUOGGD-VIFPVBQESA-N 327.348 1.878 10 10 EDCE NC(=O)CN1C(=O)/C(=C\c2cccc3cnccc23)SC1=S 782880870 PYMRILGEDXNQSO-WUXMJOGZSA-N 329.406 1.921 10 10 EDCE O=C1N[C@H]2CCN(C(=O)c3cc4cc(O)c(O)cc4s3)C[C@@H]2CO1 897651236 WCBAKQKONFQADN-ZJUUUORDSA-N 348.380 1.883 10 10 EDCE O=C(O)[C@@H]1C[C@@H](NCc2cc(Br)ccc2O)CCO1 1880048632 ATLXMAATPKJAIA-JQWIXIFHSA-N 330.178 1.877 10 10 EDCE CC(C)Oc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)nn1 792967148 RWYIXJCGIUMUJH-UHFFFAOYSA-N 344.371 1.567 10 10 EDCE Cc1cc(Cn2nnc(C(=O)NCc3cccc(O)c3O)c2C)no1 1153798902 XRKLXMHAQKVPLV-UHFFFAOYSA-N 343.343 1.272 10 10 EDCE O=C(C(=O)N1CC[C@@H](c2cccnc2)C1)N1Cc2cccc(O)c2C1 1332073713 JHJDNVRMDXICPV-CQSZACIVSA-N 337.379 1.646 10 10 EDCE CN(C[C@H](N)COCc1ccccc1)C(=O)c1cccc(O)c1O 1916339821 KYRGGNNMFXCCQL-AWEZNQCLSA-N 330.384 1.714 10 10 EDCE C[C@H](O)CNCC[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1272651248 CEJYZFOGYFMFKZ-QWHCGFSZSA-N 347.419 1.672 10 10 EDCE CO[C@H](C)C(=O)N[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1284040717 CKUADVJCXNXIIS-OASPWFOLSA-N 347.375 1.261 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)Cc2nnc(C)o2)cc1C 1700390964 CWNCDDCTLOUALG-QWHCGFSZSA-N 346.431 1.921 10 10 EDCE COc1cccc(CNC(=O)NCc2noc3c2COCC3)c1O 1479411391 ANSOSPMTQBMMDF-UHFFFAOYSA-N 333.344 1.461 10 10 EDCE Oc1ccccc1CN[C@@H]1CO[C@@H](CN2CCC(F)(F)CC2)[C@@H]1O 1615259243 CVPMMTGUTIEZQH-VNQPRFMTSA-N 342.386 1.341 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@H]2CCN(C)[C@@H]2C)cc1C 1483129074 RXGLBCMJXFEELB-BFYDXBDKSA-N 333.476 1.938 10 10 EDCE Cc1nc2ccccc2c(=O)n1CC(=O)NCc1ccc(O)c(O)c1 1622643817 XMNSGVSQOPECBJ-UHFFFAOYSA-N 339.351 1.433 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@@H](CNC(=O)CC(C)C)C2)cc(OC)n1 1719408511 VJGUHTYYYADETO-XBXGTLAGSA-N 349.431 1.770 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)C(C)(C)NC(C)=O)C2)cc1C 1713962937 OOZWNPNFXBHFPE-WKILWMFISA-N 347.459 1.655 10 10 EDCE COc1ccc(CNCC[C@@H]2CCN(C(=O)CNC(C)=O)C2)cc1C 1484506678 XIYGKQOGVBBSHA-MRXNPFEDSA-N 347.459 1.468 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2CCC(=O)N2C)cc1C 1497650540 LUEVNROBTGXCFP-AWFCHZOYSA-N 345.443 1.386 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc2c(cc1[N+](=O)[O-])OCO2 1630302368 ZHQMOUHCRJSZNO-UHFFFAOYSA-N 332.268 1.665 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2nonc2C)C2CC2)cc1C 1566731919 KNZVVVSNXGCCAW-HNNXBMFYSA-N 344.415 1.993 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@@H]2CCN(C)C2)C2CC2)cc1C 1566732538 DGLCTDMKSLQWFV-QZTJIDSGSA-N 345.487 1.940 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@H](O)C2(C)C)cc1Br 2124803262 UQYPIBXBGAZKHV-JCOFBHIZSA-N 330.222 1.823 10 10 EDCE Cn1nc(C(=O)NCCc2ccc(O)c(O)c2)cc1Br 1636022903 SZBYFMCSTXQEOQ-UHFFFAOYSA-N 340.177 1.566 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CNCc2c(O)cccc2F)C1 1964590974 ZQQFKEJREHMTMX-QGZVFWFLSA-N 340.395 1.993 10 10 EDCE COC(=O)NCC(=O)N[C@H](CNCc1ccc(OC)c(C)c1)C1CC1 1670452087 XHDXOUCXJYLWTI-OAHLLOKOSA-N 349.431 1.344 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCn3cnnc3C2)c([N+](=O)[O-])c1 1772826776 ZZGQSRUXCDOFDI-HYXAFXHYSA-N 329.316 1.393 10 10 EDCE Nc1ccc(NC(=O)CNS(=O)(=O)c2ccc(Cl)s2)cc1 160419635 RVMROIGSLSFCKA-UHFFFAOYSA-N 345.833 1.901 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NCC1(CO)CCOCC1 151526422 JVYHGTTUZQDMPG-UHFFFAOYSA-N 343.383 1.769 10 10 EDCE CNC(=O)COc1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1 1871337131 CFHBUVMMIRZHLW-UHFFFAOYSA-N 336.369 1.318 10 10 EDCE Oc1c(Br)cccc1CN[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@@H]2O 1974158978 WFTXMCCOTOYPFO-KAPQCBECSA-N 328.206 1.375 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCCCN=[N+]=[N-] 1985096715 VUFGHAPQUYXEPS-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE Nc1ccc(O)c(CN2CCC(CNC(=O)C(F)(F)F)CC2)c1 1999440149 NNEWDFHLSIZBOX-UHFFFAOYSA-N 331.338 1.865 10 10 EDCE CO[C@H]1CN(c2cc(Br)c(CN)cc2F)C[C@@H]1OC 382241116 BYNLZZQDHITFDT-STQMWFEESA-N 333.201 1.897 10 10 EDCE C[C@@H](NCc1cc(Br)ccc1O)[C@@H]1CN(C)CCN1C 2065093763 UJFKPSOHSJSAJB-RISCZKNCSA-N 342.281 1.879 10 10 EDCE C[P@]1(=O)C[C@@H](O)[C@@H](NCc2cccc(Br)c2O)C1 2057720680 PIDWYIJCCLHINO-CSJMPQKXSA-N 334.150 1.980 10 10 EDCE OCc1ccc(N2CCN(C3COC3)CC2)c(Br)c1 2113269044 PPXSPCSYPYLGPM-UHFFFAOYSA-N 327.222 1.462 10 10 EDCE O=c1cc[nH]c(CNCc2cc(Br)ccc2O)c1O 2230963187 YUCAMFMOBACYQV-UHFFFAOYSA-N 325.162 1.838 10 10 EDCE COc1ccc(Br)c(CNCc2nc(C)n(C)n2)c1O 2236045002 QERYMJDWOLSDHP-UHFFFAOYSA-N 341.209 1.890 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)C[C@H](CO)C2)cc1Br 2236634131 SVSSDJKQBCXMQU-RYUDHWBXSA-N 343.265 1.596 10 10 EDCE COc1cc(C=C2SC(=S)N(CC(=O)O)C2=O)cc(OC)c1 2293128235 HGOHSFZPPZSCSV-UHFFFAOYSA-N 339.394 1.990 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)c(Br)c1 2331966004 YQTNHBUFHIPRRS-HYNSBDGHSA-N 327.222 1.371 10 10 EDCE COc1ccc(CN[C@H]2CCCN(c3cc(C)nn3C)C2=O)c(O)c1 173854892 UBDIPOUBQIRRJU-HNNXBMFYSA-N 344.415 1.728 10 10 EDCE CN(C(=O)c1cccc(O)c1O)[C@@H]1CCN(c2ccccc2)C1=O 188461657 YBTKSRBNCZXRQO-CQSZACIVSA-N 326.352 1.975 10 10 EDCE COc1c(C(=O)N(C)Cc2ccccc2O)cnc2c1cnn2C 183550464 QXBRKTGDJDPQMS-UHFFFAOYSA-N 326.356 1.955 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cc(Cl)c[nH]c3=O)CC2)cc1 82320374 JEBAZCVYCWVNNF-UHFFFAOYSA-N 347.802 1.999 10 10 EDCE CCOC(=O)/C(=C/c1cnc(N2CCOCC2)s1)c1nccn1C 263932543 BARGWKCSIAGJIN-JLHYYAGUSA-N 348.428 1.817 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCN3CCOC[C@H]3C2)cc1 368293998 MXPPBFFLBYGZJW-GOSISDBHSA-N 346.475 1.759 10 10 EDCE Cc1ccc(CNC(=O)C2=C[C@H](O)[C@@H](N)C2)c(O)c1Br 2380750699 FTKGYWLOMAJIDD-QWRGUYRKSA-N 341.205 1.098 10 10 EDCE Cc1ccc(CNCCN2C[C@H](C)NC2=O)c(O)c1Br 2380800301 HHQKKPMILWAHJG-JTQLQIEISA-N 342.237 1.966 10 10 EDCE COc1ccc(C(=O)N2CCC[C@@H]2C(=O)OCC(=O)C(C)=O)cc1 808547647 BORMJXRUQHIWDK-CQSZACIVSA-N 333.340 1.001 10 10 EDCE CC(=O)C(=O)COC(=O)c1nc(C(C)C)n(-c2cccc(F)c2)n1 808518429 BPKXCHUACJCNIL-UHFFFAOYSA-N 333.319 1.845 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)N[C@H](CN)C(F)(F)F 655924960 UEZLLNLWITZXFM-GFCCVEGCSA-N 332.326 1.551 10 10 EDCE COc1cc(Cl)cc(CNC[C@@]2(OCCO)CCOC2)c1O 826943699 YNUPDSSJBZMGRX-HNNXBMFYSA-N 331.796 1.312 10 10 EDCE COC[C@@]1(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCOC1 825421012 ASHNNPCSKWNDOD-KXBFYZLASA-N 348.443 1.754 10 10 EDCE Oc1cc2c(cc1CN1C[C@@H]3CC[C@H](C1)N3C1CCNCC1)OCO2 903980027 CSGGOTSGKRNGAD-IYBDPMFKSA-N 345.443 1.522 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c2c(nn1C)CCSC2 907275600 WNTGCMSDKCIJRW-SNVBAGLBSA-N 347.440 1.982 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(CCO)[C@H](C)C2)c([N+](=O)[O-])c1 588524569 HUYRTQICBYXZEX-RYWCDNDXSA-N 349.387 1.284 10 10 EDCE CCN(OC)C(=O)CNCc1cc(C)cc(Br)c1O 842769129 JISNMKAMZNXPRH-UHFFFAOYSA-N 331.210 1.963 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)c3nncn3C)C2)cc1 849224938 MJKZWRJYKYTWTC-OLZOCXBDSA-N 344.419 1.463 10 10 EDCE Cc1cc(N(C)C)ccc1CN1CCN(CCC(=O)N(C)C)CC1 840916353 IZTJQQMICUWMPY-UHFFFAOYSA-N 332.492 1.657 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCc1ncc2c(n1)CCOC2 845344915 YDGVINRIRHSVLK-UHFFFAOYSA-N 328.372 1.597 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)c3ccnn3C)C2)cc1 855226755 TZEAUZZBQUGNIG-UONOGXRCSA-N 328.416 1.927 10 10 EDCE CN(C)C(=O)N(C)[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 853585215 WNVVNCWWHVKZAP-IUODEOHRSA-N 335.404 1.006 10 10 EDCE Cc1ccc([C@H](C)NCC[C@@H]2CNCCS2(=O)=O)c(O)c1C 925796385 OJHLCZYQWQTRNX-UONOGXRCSA-N 326.462 1.436 10 10 EDCE CO[C@@H](CNCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCOC1 850342910 OKPKVEFUAMXDOB-QAPCUYQASA-N 338.423 1.803 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCN(C(C)=O)C3)C2)cc1 856871602 SYTLMWRTSHPZEH-CABCVRRESA-N 346.431 1.194 10 10 EDCE CC1(N2CCOCC2)CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 862958143 AKNRPWGWWALOTK-HYXAFXHYSA-N 346.427 1.824 10 10 EDCE CNS(=O)(=O)CCCN[C@H](C)c1ccc(N2CCOCC2)cc1 775258991 DIGXRNOSKZGZFG-CQSZACIVSA-N 341.477 1.113 10 10 EDCE CN(C)c1cc(F)c(CNCC2(S(=O)(=O)N(C)C)CC2)cc1F 886319639 KEHRVEMFPFRGSV-UHFFFAOYSA-N 347.431 1.544 10 10 EDCE COC(=O)c1c(CNC[C@](C)(CO)OC)c2cc(F)ccc2n1C 895183146 IQDUFCUKPFOLCY-QGZVFWFLSA-N 338.379 1.591 10 10 EDCE O=C(CC[C@@H]1CC[C@@H](C2OCCO2)O1)N1Cc2cccc(O)c2C1 899173032 JTJRPQGGSUTGBF-BBRMVZONSA-N 333.384 1.935 10 10 EDCE O=C1Nc2cc(N3[C@H]4COC[C@H]3C4)c(Br)cc2[C@@H]1O 1899612598 AWJRMWQJOPNSAR-QHMRUWFYSA-N 325.162 1.412 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@H]2C[C@H]2C(N)=O)C(C)C)cc1C 1319942949 FYBOOASNMDAXHI-PMPSAXMXSA-N 347.459 1.355 10 10 EDCE COCc1n[nH]c(CNC(=O)c2cc3cc(O)c(O)cc3s2)n1 1165515544 UFYMROXWFZUSST-UHFFFAOYSA-N 334.357 1.507 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)COCC(F)F 1328976674 FBUQOHLWBJIWFG-UHFFFAOYSA-N 344.358 1.536 10 10 EDCE CN(C)c1ccc(/C=C/CN[C@@H](Cc2ccncn2)C(=O)O)cc1 1334842747 ZRHYPLLIUBBGRE-IDOMTICXSA-N 326.400 1.841 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCc2ccccc2CC1 1331973507 MLSGTFKXPDWKHU-UHFFFAOYSA-N 336.391 1.862 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)NCc1cccc(Br)c1O 1448966223 UBJHBBDLPISSHO-JTQLQIEISA-N 346.177 1.085 10 10 EDCE NC(=O)[C@@H]1c2ccccc2CCN1C(=O)Cc1ccc(O)c(O)c1 1293544300 AWRBGSHXAJQNOC-KRWDZBQOSA-N 326.352 1.252 10 10 EDCE COC(=O)c1n[nH]c2ccc(NC(=O)Cc3ccc(O)c(O)c3)cc12 1629584007 KHEZNTAWFODKST-UHFFFAOYSA-N 341.323 1.942 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@H]2CCCNC2=O)cc1C 1716307779 XJHRYUUORPRHIE-MJSXRHKHSA-N 345.443 1.292 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC(=O)NCC(F)(F)F)cc1 1626050975 YGQFDAXIOKWDBP-UHFFFAOYSA-N 331.254 1.257 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CC[C@@H](Nc2ncccn2)C1 1639943421 QHYANTYIPKRRPK-HSBHDXMMSA-N 326.356 1.614 10 10 EDCE CCS(=O)(=O)C[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1633698947 YSEPVHCRXBAHCQ-SNVBAGLBSA-N 340.405 1.744 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2cnn(C)c2)cc1C 1732332253 BTQYQPKFIXMLLO-CYBMUJFWSA-N 330.432 1.893 10 10 EDCE C[C@@H]1C[C@@H]1CC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1742543521 KWGZSIIIMVLQQK-ZYHUDNBSSA-N 331.376 1.741 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC(NC(=O)CCCF)C2)cc1 1759216060 BHPNLMDKPYQFNN-UHFFFAOYSA-N 335.339 1.539 10 10 EDCE COC[C@@H](C)N(C)CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1699010849 HWDZKYKIVBUVEN-GFCCVEGCSA-N 335.408 1.888 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 5374165 LVCSLDUTOZVCKX-QFQXNISHSA-N 327.358 1.472 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)CNC(=O)c1cccnc1 152318197 UBWYDSVTYBMVPB-UHFFFAOYSA-N 340.427 1.926 10 10 EDCE Cn1ncc(C(=O)N2CC[C@H](N=[N+]=[N-])C2)c1I 1912171239 IESLPYNFIPYEEV-LURJTMIESA-N 346.132 1.550 10 10 EDCE O=C(c1cc(O)nc(O)c1)N(Cc1ccccc1)[C@@H](CO)C1CC1 1915262883 QCRMBTYNPCRVPO-HNNXBMFYSA-N 328.368 1.906 10 10 EDCE CN(C)C[C@@H]1C[C@@H](O)CN1c1ccc(CN)c(Br)c1 228153755 FZZPZPHONUCWMI-QWHCGFSZSA-N 328.254 1.409 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)O[C@@H]1CCNC1 1951831632 AQEVLODWYSXSBP-IUODEOHRSA-N 338.404 1.870 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C 1985101053 NFHMJYFKAQKXQH-NSHDSACASA-N 327.385 1.781 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NC(=O)Cc1ccc(N)cc1 1999142739 FIGQVAJGARXYRB-KGLIPLIRSA-N 335.404 1.220 10 10 EDCE NCc1cc(F)c(N2CCC([C@@H](O)CO)CC2)cc1Br 2152465401 WWFYQPYCPGJFNY-AWEZNQCLSA-N 347.228 1.617 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2NC(=O)c1ccc(O)c(O)c1 2006278919 SZZOABKVJFPWDO-UHIISALHSA-N 334.372 1.835 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3OCCN(C)[C@H]3C2)c(Br)c1 2153997500 YQNSBPDMBZRLGV-ONERCXAPSA-N 340.265 1.988 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccccc1O 2010263745 ZONVLXQXLOTCQF-FZMZJTMJSA-N 338.404 1.625 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010390114 ZGTOIVPRVQJSNI-GFCCVEGCSA-N 341.412 1.765 10 10 EDCE C[C@H](NC(=O)[C@H](O)[C@H](C)NC(=O)OC(C)(C)C)c1ccccc1O 2017514402 GNODLFYZMJMUPN-COPLHBTASA-N 338.404 1.844 10 10 EDCE Cc1cccc(CNC(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)c1O 2024810163 AAUHDBZSGUKBKJ-CYBMUJFWSA-N 338.404 1.593 10 10 EDCE CNCc1ccc(N2C[C@H](CO)[C@@H](CO)C2)c(Br)c1 704807558 BVLWDCJHUZRXNB-VXGBXAGGSA-N 329.238 1.206 10 10 EDCE CCNCc1ccc(N2C[C@H](O)C[C@]2(C)CO)c(Br)c1 698117169 UHCMZXJYOHKRQL-IUODEOHRSA-N 343.265 1.881 10 10 EDCE C[C@@H]1COCCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 399073723 PLZYSTNKCUPMGT-ISVAXAHUSA-N 340.221 1.874 10 10 EDCE COc1ccc(N2CC(CO)(OC)C2)c(OC)c1Br 2226545034 OJGNZQOXPBNYKF-UHFFFAOYSA-N 332.194 1.664 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccc(N)cc2)[C@H](CO)C1 2044627791 WZZBQMHJKIPRGD-HNNXBMFYSA-N 349.431 1.252 10 10 EDCE NCc1ccc(N2CCCCC2(CO)CO)c(Br)c1 2089867618 GLIPKCCVJWZAKB-UHFFFAOYSA-N 329.238 1.622 10 10 EDCE COC[C@@H]1[C@H](O)[C@H](O)CN1c1ccc([C@H](C)N)c(Br)c1 2234068672 PVLJDVFDKLTYOB-IYMWITQMSA-N 345.237 1.026 10 10 EDCE COc1ccc(Br)c(CN2CCOC[C@@H]2C(=O)O)c1O 2236041976 RYANOJBFHVKHBJ-SNVBAGLBSA-N 346.177 1.449 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C=Cc1ccc(C(N)=O)cc1 2308464823 WVLQZUQXBBTDHW-LBPRGKRZSA-N 340.379 1.957 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C=CCNC2)c(O)c1Br 2352637409 KKZWZBYRTIVVIA-LLVKDONJSA-N 325.206 1.855 10 10 EDCE Cc1ccc(CN(C)[C@@H]2CNCCOC2)c(O)c1Br 2352644318 ZBVLUODCDPNVBC-GFCCVEGCSA-N 329.238 1.883 10 10 EDCE CN(C)c1ccc([C@@H](O)[C@@H](N)c2c(Br)ncn2C)cc1 2362541901 HJVYMILZXAHHGP-WCQYABFASA-N 339.237 1.982 10 10 EDCE COc1ccc(CN2CCN([C@@H](C)C(=O)NC3CC3)CC2)c(O)c1 123367417 XRWRFMFGQFJMOH-ZDUSSCGKSA-N 333.432 1.186 10 10 EDCE COc1ccc(N2CCN(C(=O)CNCc3ccccn3)CC2)cc1 243425408 MWAUDHIBQQWZJI-UHFFFAOYSA-N 340.427 1.529 10 10 EDCE CC[C@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(=O)OC 255767864 GMJUVQDQYPVKQD-HWYHOQROSA-N 332.400 1.604 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN2CCC1CC2 376627573 OMLSHJLFLZTJFI-UHFFFAOYSA-N 344.459 1.513 10 10 EDCE CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)/C=C/c1ccc(O)c(O)c1 372477581 HEAZCJLZPOJGCR-CXSYMGSUSA-N 349.383 1.680 10 10 EDCE CCCC1(O)CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 384010562 VMGYJFSJENKDFH-LBPRGKRZSA-N 340.221 1.752 10 10 EDCE CCc1nc(C(=O)OCC(=O)C(C)=O)nn1-c1ccccc1Cl 808511236 XTFNVQCQAZGOHB-UHFFFAOYSA-N 335.747 1.798 10 10 EDCE Cc1ccc(C(=O)N2CCCC[C@@H]2CCS(C)(=O)=O)c(O)c1O 816808474 PCVXDMQBXWVGDT-GFCCVEGCSA-N 341.429 1.836 10 10 EDCE CC1(C)[C@@H](O)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1 812878204 SIIKSZGHNYRPLQ-INIZCTEOSA-N 333.432 1.578 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC[C@@H](C(=O)N2CCCC2)C1 825811174 ZQDJPOTXXYXCLC-LLVKDONJSA-N 336.363 1.712 10 10 EDCE C[C@H](NC(=O)N[C@H](CF)C(=O)O)c1ccc(N2CCOCC2)cc1 837296388 OOCYPYZFCFBEAO-SMDDNHRTSA-N 339.367 1.306 10 10 EDCE CCN(CC)c1ccc(CN2CC(n3cc(C(N)=O)nn3)C2)cc1 839142133 CMEXXEBDWQJCBG-UHFFFAOYSA-N 328.420 1.280 10 10 EDCE Cc1cc(N(C)C)ccc1CNc1ccc(C(=O)NCC(N)=O)cc1 840885586 XOJIGKLHXBRBRV-UHFFFAOYSA-N 340.427 1.888 10 10 EDCE Cc1ccc(CC[C@H](C)NC(=O)C(=O)NCCc2ccc(N)cc2)o1 842203806 ZACNPTNFUALJPU-ZDUSSCGKSA-N 343.427 1.966 10 10 EDCE CN1CCC2(CC1)CN(Cc1ccc(N3CCOCC3)cc1)CCO2 843432317 WEUJFFQFLOHCNK-UHFFFAOYSA-N 345.487 1.820 10 10 EDCE Cn1ncc(C2CCC2)c1/C=C1/SC(N2CCOCC2)=NC1=O 849242852 CFGKSROCZQWZRH-NTEUORMPSA-N 332.429 1.990 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@H](NC(=O)NCc2cc(Cl)ccc2O)CC1=O 845025780 ISWBCZBLDRQRGQ-WQAKAFBOSA-N 337.807 1.854 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCN[C@H](C)C3)C2)cc1 851668793 UQQATFBRUMUGCZ-ILXRZTDVSA-N 332.448 1.714 10 10 EDCE C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@H](CC2OCCO2)C1=O 924714992 DTOROHWSBWPSTQ-SMDDNHRTSA-N 333.388 1.497 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](C)c1nnc(O)n1C 926134686 QPJUXDVBNNLHJR-LBPRGKRZSA-N 346.435 1.879 10 10 EDCE C[C@@H](NCC[C@@H]1CNCCS1(=O)=O)c1cc(F)cc(F)c1O 925800599 VTYSOOAQPGJSKT-MWLCHTKSSA-N 334.388 1.098 10 10 EDCE O=C1NCC[C@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)[C@@H]12 931704762 VVNDIZDFIZPPNN-SJLPKXTDSA-N 329.444 1.624 10 10 EDCE CC[S@@](C)(=O)=NS(=O)(=O)NCc1ccc(N2CCCC2)cc1 866485055 KSRCZGYEXCGFPJ-OAQYLSRUSA-N 345.490 1.739 10 10 EDCE COC(=O)c1c(CN2CC[C@@](C)(C(N)=O)C2)c2cc(F)ccc2n1C 894637717 PKUDJZCKEWGPTA-GOSISDBHSA-N 347.390 1.801 10 10 EDCE C[C@@H](NCc1cccc(Br)c1O)c1nnc(O)n1C 895179312 GJFPDXUQUNLWRH-SSDOTTSWSA-N 327.182 1.840 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC(n3cnnc3O)CC2)cc1 1156470101 CQLUNDYLCPDNOR-UHFFFAOYSA-N 343.347 1.623 10 10 EDCE CC[C@@H](c1cc(Br)ccc1O)N1CCNC[C@@H]1C(=O)O 88658372 VKJPNGROEUBSDH-NWDGAFQWSA-N 343.221 1.964 10 10 EDCE CC[C@@H](CNC(=O)C1=COCCO1)NCc1ccc(OC)c(C)c1 1267794498 WPDJMIGCOGMVLO-HNNXBMFYSA-N 334.416 1.876 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(NCC2CC2)CC1 1351983460 QXJQAYLCFBEGJY-UHFFFAOYSA-N 343.427 1.225 10 10 EDCE CCOCCC(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1284266431 NEMVYVNPFFIPNW-LLVKDONJSA-N 349.391 1.510 10 10 EDCE C[C@H](NC(=O)c1ccc(CNS(C)(=O)=O)o1)c1ccccc1O 1454820983 URVFEEADFKXURM-JTQLQIEISA-N 338.385 1.525 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)c2coc(C)c2)cc(OC)n1 1526520519 ZHLVDSRCBGRDHW-JTQLQIEISA-N 347.371 1.549 10 10 EDCE C/C(=C\C(=O)N(C)c1ccc(S(C)(=O)=O)cc1)c1cnccn1 1535260153 ZKXBSFZZSNUQCM-ZRDIBKRKSA-N 331.397 1.946 10 10 EDCE O=C1N[C@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@H]2O1 2120406607 RTJULZHMGGQFOT-VHSXEESVSA-N 331.141 1.586 10 10 EDCE C[C@H](C#N)C(=O)N(C)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1705351189 UDVJWHAOGMJTJT-SNVBAGLBSA-N 342.359 1.291 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H]3[C@@H]2CCCN3CCO)cc1 1558701796 GFPDEHJIUITJOC-CABCVRRESA-N 345.403 1.520 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C(=O)OC)nn1C 1634943597 BEASFJISPFZBTA-UHFFFAOYSA-N 338.360 1.328 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H]2CCCC(=O)N2)cc1C 1568646722 GRYMKFFCBDFBJP-GDBMZVCRSA-N 347.459 1.657 10 10 EDCE O=C(CN1CCCS1(=O)=O)NCc1c(O)ccc2ccccc12 1647789056 ZOAAOAYZERSJTK-UHFFFAOYSA-N 334.397 1.197 10 10 EDCE CCOC(=O)[C@@H](NC(=O)c1cc(O)cs1)[C@H](O)c1cccnc1 1587187489 WVIMLLPOWWFQRF-QWHCGFSZSA-N 336.369 1.244 10 10 EDCE Nc1ccnn1CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1597088912 CJMUXMAEQNOGBD-AWEZNQCLSA-N 330.388 1.379 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H]2CC[C@H]2C(N)=O)cc1C 1670205342 WZUKIZHGIBCHRI-CVEARBPZSA-N 347.459 1.453 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cccn(C)c2=O)cc1C 1699427438 IQNDDFZRVLGTEY-AWEZNQCLSA-N 343.427 1.610 10 10 EDCE CC[C@@H]1SC(=S)N(CCCC(=O)NC[C@H]2CCCO2)C1=O 11636354 IBWHGGHCYNPWEL-MNOVXSKESA-N 330.475 1.701 10 10 EDCE C=CC(=O)NCCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 154013765 XNWLVAOABJBSDJ-HNNXBMFYSA-N 332.400 1.592 10 10 EDCE C[C@H](C(=O)O)N1CC(NCc2c(O)cccc2Br)C1 2131762282 AKLKRAIWNYAWGM-MRVPVSSYSA-N 329.194 1.402 10 10 EDCE CNCc1ccc(N2C[C@@H](C)O[C@@H](CO)C2)c(Br)c1 234378336 GPIHNYMGMGWWDH-ZYHUDNBSSA-N 329.238 1.755 10 10 EDCE COc1ccc(O)c(CN[C@H]2COC[C@H]2NC(=O)OC(C)(C)C)c1 1944916678 CABYMNWQXMMVEN-UONOGXRCSA-N 338.404 1.783 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]([C@@H](N)Cc2ccc(O)c(O)c2)C1 1952914704 UUBROPPLTFFHTE-SWLSCSKDSA-N 338.404 1.604 10 10 EDCE Oc1cc(Br)ccc1CN[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@@H]2O 1974157000 JUXWPDOVOXXFIA-QGOIZSIMSA-N 328.206 1.375 10 10 EDCE Cc1cc(O)ccc1NS(=O)(=O)c1c(C2OCCO2)cnn1C 2144008651 FFRPVERTDNOHOV-UHFFFAOYSA-N 339.373 1.280 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1[C@H]2[C@@H]1OCCN2C(=O)OC(C)(C)C 1985093790 FNBHSSKZICRSEZ-GARJFASQSA-N 325.369 1.389 10 10 EDCE COc1cccc(O)c1[C@H](C(=O)O)N(CCO)C(=O)OC(C)(C)C 1997940955 KUAQVXPSLWOKCS-CYBMUJFWSA-N 341.360 1.756 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CCCO1 2003171220 VMQVJMVPAHCWNS-PRXAMGSTSA-N 340.420 1.326 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@]12COCCN(CCN=[N+]=[N-])C2 2006176668 KDTRFUSYSNOVQQ-HNNXBMFYSA-N 341.412 1.635 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010406512 VPCDVPLSORRUBY-SRVKXCTJSA-N 341.412 1.952 10 10 EDCE CN(C(=O)CC[C@H](O)CNC(=O)OC(C)(C)C)c1ccc(N)cc1 2022944398 XJPISWZFTHZSLE-AWEZNQCLSA-N 337.420 1.897 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3CCNCC3)ccc(N)c2C1 310252802 YULAMDYDHWALDJ-UHFFFAOYSA-N 332.448 1.972 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)CC[C@H]3O)c(Br)c1 2161354907 PGZFVKXBMXNEGC-BYNSBNAKSA-N 341.249 1.761 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCOCC3)c(Br)cc21 92774750 KYKOXVZZDCKYMG-LBPRGKRZSA-N 326.194 1.498 10 10 EDCE CC[C@H]1C(=O)NC(=O)CN1c1cc(Br)c(CN)cc1F 383671334 TZRVSVVHBMJHBF-JTQLQIEISA-N 344.184 1.288 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)c(Br)c1 2178087514 RMTNZZXWORIHPG-NFOTXUCKSA-N 342.233 1.946 10 10 EDCE C[C@@H](CO)N1CCN(c2cc(Br)c(CN)cc2F)CC1 2169364341 QGEMWAQTXVIKEZ-JTQLQIEISA-N 346.244 1.550 10 10 EDCE O=S1(=O)C[C@H]2[C@@H](C1)[C@@H]2NCc1cc(Br)ccc1O 2054278165 NHSHXWJGAXSQSC-IAZYJMLFSA-N 332.219 1.287 10 10 EDCE CN1C[C@H]2C[C@H]1CN2c1cc2c(cc1Br)[C@H](N)C(=O)N2 2187595131 YRVRMHFOVODCJC-DAROEXNTSA-N 337.221 1.294 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(NC(=O)Cc2ccc(N)cc2)C1 2070017713 BQEVBIQOQZCNLG-SFHVURJKSA-N 349.431 1.299 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]12CO[C@@H](C1)[C@H](NC(=O)OC(C)(C)C)C2 2247343908 FAABWIPQJXOWNB-JRPNMDOOSA-N 339.396 1.827 10 10 EDCE COc1ccccc1C=C1SC(=S)N(CCOCCO)C1=O 2323767922 MZHZYSGFECSYTK-UHFFFAOYSA-N 339.438 1.905 10 10 EDCE Cc1ccc(CNC(=O)C(C)(CO)CO)c(O)c1Br 2352642692 HXNQHOLGQNPASE-UHFFFAOYSA-N 332.194 1.070 10 10 EDCE COCCNC[C@@H]1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1278618051 GKYALTHANAOSBY-DOMZBBRYSA-N 347.419 1.984 10 10 EDCE O=C1CC[C@H](COC(=O)/C=C\c2ccc(N3CCOCC3)cc2)N1 255712315 MCDWKHTWRDZCHX-JBGNVSFKSA-N 330.384 1.358 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@H](CO)C[C@@H](O)C(C)(C)C)c1 284543164 XOKGPLJEWJTKQP-DETPVDSQSA-N 339.432 1.987 10 10 EDCE Cc1ccc(CNC(=O)CN2CCCC2=O)c(O)c1Br 2381129511 LBTULYDCNRIFML-UHFFFAOYSA-N 341.205 1.702 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N3C[C@H]4CC[C@H]3CN4)C2)cc1 818654481 BNNGEMKJRLPHNW-UXLLHSPISA-N 344.459 1.667 10 10 EDCE CO[C@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)[C@H]1CCOC1 819973729 BTZBFCCAWXHSRY-WMZOPIPTSA-N 348.443 1.533 10 10 EDCE CCOc1ccc(O)c(CN2CCN([C@H]3CCNC(=O)CC3)CC2)c1 825148272 RYCWTXQDDKPJEZ-MRXNPFEDSA-N 347.459 1.577 10 10 EDCE COC[C@]1(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCOC1 825421011 ASHNNPCSKWNDOD-HNAYVOBHSA-N 348.443 1.754 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3c(C(=O)O)cnn3C)C2)cc1 902045526 GGEMLQUDCGZORH-LLVKDONJSA-N 344.371 1.136 10 10 EDCE CC[C@@H](NC[C@]1(OC)CCS(=O)(=O)C1)c1ccc(C)cc1O 903363389 NTMPYPYDCUGYJV-GDBMZVCRSA-N 327.446 1.945 10 10 EDCE CCOC(=O)N1CCC(NC(=O)NCc2c(O)cccc2F)CC1 913824418 PAIZMYGIBBLUCC-UHFFFAOYSA-N 339.367 1.951 10 10 EDCE CCON(C)C(=O)CNC(=O)N[C@H](C)c1cc(OC)ccc1O 845566484 KDDPZOFUWIDTCN-SNVBAGLBSA-N 325.365 1.171 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@]3(C2)CC3(F)F)c1 846618909 BAAJJTNZSMAYMW-ZDUSSCGKSA-N 346.355 1.635 10 10 EDCE CCCn1nccc1NC(=O)C(=O)NCc1cc(Cl)ccc1O 846121945 PNNMMMCUOAIJJI-UHFFFAOYSA-N 336.779 1.907 10 10 EDCE C[C@@H]1C[C@@H](NC[C@]2(OCCO)CCOC2)c2c(O)ccc(F)c21 850507947 LGJNZZCDPORMJG-CJBNDPTMSA-N 325.380 1.837 10 10 EDCE COC1(OC)CCN(Cc2cc(F)cc(C(C)=O)c2O)C[C@@H]1O 931638603 GXMHQFVRSNWSOB-AWEZNQCLSA-N 327.352 1.290 10 10 EDCE O=S(=O)(c1cnn(CC(F)F)c1)N1Cc2cccc(O)c2C1 867690807 NLVKJYPKKJDREM-UHFFFAOYSA-N 329.328 1.558 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)Nc2cnn(C)c2C2CC2)cc1 770712051 OKEYUSZJHSEVFN-UHFFFAOYSA-N 341.415 1.618 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1CNC(=O)NCc1c(O)ccc2c1CCCC2 891238025 SUBQFMKNLOKGDO-TZMCWYRMSA-N 332.400 1.879 10 10 EDCE CC(C)(C)OC(=O)NCCS(=O)(=O)CCOc1ccc(N)cc1 1899702921 DXKPETRPHNZVOU-UHFFFAOYSA-N 344.433 1.587 10 10 EDCE CC[C@@H](NC(C)=O)C(=O)N[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1317122898 LRGVNEOGENQSGB-IXDOHACOSA-N 347.459 1.655 10 10 EDCE COC(=O)N(C)CCN(C)C(=O)NCc1ccc2c(c1)CCCN2C 1327659846 FIWIRGPHFLBSGF-UHFFFAOYSA-N 348.447 1.909 10 10 EDCE O=C(O)[C@H]1CNCCN1Cc1cc(Br)cc(F)c1O 715767989 AOWUZBSSJFJRSO-SNVBAGLBSA-N 333.157 1.152 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H](C)NC(C)=O 1268434028 WZKGXMKBYXIUAH-AWEZNQCLSA-N 335.448 1.466 10 10 EDCE C[C@H]1CO[C@@H](C(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1349229880 XZDVGKGJWUETNB-ZWNOBZJWSA-N 347.375 1.120 10 10 EDCE Cc1ccc2c(c1)C(=O)N(CC(=O)N1Cc3cccc(O)c3C1)C2=O 1455037337 PSEUCRQTUIUIAW-UHFFFAOYSA-N 336.347 1.839 10 10 EDCE COc1ncc(/C=C\C(=O)N2CCN(C)c3ncc(C)cc32)cn1 1463392348 PDQWMRHTUHDBRS-PLNGDYQASA-N 325.372 1.685 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(C(=O)c2ccccn2)CC1 1542360986 RQVKTXLBEGNQSM-UHFFFAOYSA-N 341.367 1.020 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)c3ccnc(CO)c3)C2)cc1 1638649930 PKHHBICDYUNQRK-CQSZACIVSA-N 341.411 1.839 10 10 EDCE Cc1cc(C(=O)NCc2cc(O)ccc2O)c2c(O)nn(C)c2n1 1637122903 RIUZENWDRMOICQ-UHFFFAOYSA-N 328.328 1.324 10 10 EDCE Cc1ccn2c(=O)c(C(=O)NCc3cc(O)ccc3O)cnc2c1 1643879164 CZHWVOKERVWKCV-UHFFFAOYSA-N 325.324 1.344 10 10 EDCE CNC(=O)CCOc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1585550945 XTSVCCCNPNJRIU-UHFFFAOYSA-N 344.367 1.794 10 10 EDCE Cn1cc([C@@H](O)C(=O)N(Cc2ccco2)Cc2ccccc2O)cn1 1588145590 KJAAVEHRUSWPEJ-QGZVFWFLSA-N 341.367 1.981 10 10 EDCE CC/C=C(/C)C(=O)N1CC[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1687141992 FYFIOMGNMFCDJL-NFEOESJKSA-N 347.415 1.786 10 10 EDCE COc1ccc(CNC2CCC(NC(=O)CNC(C)=O)CC2)cc1C 1690526564 XKWJFLPTPISDAP-UHFFFAOYSA-N 347.459 1.657 10 10 EDCE Nc1ccc(OCCN2CCC[C@H](NC(=O)c3ccncc3)C2)cc1 586058687 FPHYEJIZFARGAJ-KRWDZBQOSA-N 340.427 1.937 10 10 EDCE C[C@@H](NC(=O)c1nnn(-c2ccc(N)cc2)n1)[C@H]1C[C@H]2CC[C@H]1C2 1857878762 LKQHCUVCWSDPLW-OXJKWZBOSA-N 326.404 1.799 10 10 EDCE O=C(O)C1(CO)CN(Cc2cc(Br)cc(F)c2O)C1 2136355344 OPJYSVYZHOYXBT-UHFFFAOYSA-N 334.141 1.173 10 10 EDCE CNCc1ccc(N(C)[C@@H]2CCS(=O)(=O)C2)cc1Br 234413889 WUAXGIBSKXFAJK-GFCCVEGCSA-N 347.278 1.792 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)O)C1(c2cc(O)c(O)c(O)c2)CC1 1952542824 KMCXYDVPTARQNW-GFCCVEGCSA-N 339.344 1.813 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCN(CC(=O)Nc2ccc(N)cc2)C1 1999435750 ZMQGGNDVWANOOE-AWEZNQCLSA-N 334.420 1.806 10 10 EDCE COC(=O)[C@@H](CC(=O)N1CC[C@@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 2010394120 AJRALRPZNLBLGY-NXEZZACHSA-N 341.368 1.354 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2010406741 YJJGWYFDYMQPAR-IJLUTSLNSA-N 339.396 1.685 10 10 EDCE Oc1c(Br)cccc1CNCc1nnc2ncccn12 2160423043 GWIOBQCTFRHNKG-UHFFFAOYSA-N 334.177 1.882 10 10 EDCE CCCn1nnnc1CNCc1cc(Br)cc(F)c1O 2169373364 QTMZURINTMQRFD-UHFFFAOYSA-N 344.188 1.980 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3C[C@H]2CN3C(N)=O)cc1Br 2192284246 XOVBKHQXZMYREG-IUCAKERBSA-N 343.200 1.389 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1Nc1c(N)cccc1C(=O)O 1906317606 ZCGZOPZJMRJGRF-NWDGAFQWSA-N 337.376 1.671 10 10 EDCE NC[C@H]1C[C@@H](O)CN1Cc1cc(Cl)cc(Br)c1O 2060807843 RQWPUCQLWRJSCJ-NXEZZACHSA-N 335.629 1.702 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2210536661 HWQWDABXWCNVRP-NAKRPEOUSA-N 327.385 1.608 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2199527168 OMMZMMCTXLEQQK-MGXFYRGHSA-N 341.249 1.789 10 10 EDCE CC1(C)[C@@H](CO)OCCN1c1ccc(CO)c(Br)c1 2103401918 YAYFDZGYGKPHEX-CYBMUJFWSA-N 330.222 1.918 10 10 EDCE NCc1ccc(N2C[C@H](CO)[C@@H](CCO)C2)c(Br)c1 2093495605 KNTKNHMTYAKXHG-NWDGAFQWSA-N 329.238 1.335 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)cc1Br 2201511040 WERYKWAKBAFEHC-CABCVRRESA-N 343.265 1.881 10 10 EDCE C[C@@H](COc1nnc(=N)[nH]n1)[C@@H]1CCCCN1C(=O)OC(C)(C)C 2213789475 ITCBACPJYGEYGL-QWRGUYRKSA-N 338.412 1.484 10 10 EDCE COc1ccc(N2N=C(C)C(=C(C)NN3CCOCC3)C2=O)cc1 2297471355 MXLZMMKFWMSAEW-UHFFFAOYSA-N 330.388 1.529 10 10 EDCE CNC(=O)[C@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)C(C)C 2302416521 CIJYKEAVZUQRFE-GOSISDBHSA-N 345.443 1.423 10 10 EDCE Cc1ccc(CN(C)S(=O)(=O)N(C)C)c(O)c1Br 2327797296 UDSWUGXWIXPNDR-UHFFFAOYSA-N 337.239 1.701 10 10 EDCE CNCc1ccc(N2CC(O)(CN(C)C)C2)cc1Br 2343638888 KUIQYMUWPQQLQA-UHFFFAOYSA-N 328.254 1.281 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)OCCn1cccn1 66656276 GRQZSXSKUVFFGM-QPJJXVBHSA-N 327.384 1.976 10 10 EDCE Cc1ccc(C(=O)N2CCCN(Cc3cnn(C)c3)CC2)c(O)c1O 179484053 HLKIICSNEXTRJE-UHFFFAOYSA-N 344.415 1.488 10 10 EDCE CC(=O)N1CCN(CCNCc2ccc(N3CCCCC3)cc2)CC1 67699182 SWASSRHENMHMPD-UHFFFAOYSA-N 344.503 1.931 10 10 EDCE CC(C)c1nnc2n1C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)CC2 181006755 JYSWTJQZSUXRTK-GBVBUYCNSA-N 342.399 1.957 10 10 EDCE NC(=O)C[C@@H](N)c1cc(Br)cc(Br)c1O 44250391 PVAHTRXSKIANOC-SSDOTTSWSA-N 337.999 1.792 10 10 EDCE CO[C@H]1C=CCN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2165061807 LWATWLYPIQHXLU-SDBXPKJASA-N 339.189 1.826 10 10 EDCE CCOc1cccc(CN[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)c1O 800309046 BVEPTMGIQIXFEB-TZMCWYRMSA-N 342.461 1.598 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C)Oc1cccc(Br)c1 808521637 YCGBYROPYCUURR-VIFPVBQESA-N 329.146 1.918 10 10 EDCE Nc1ccc(OCCCON2C(=O)COc3c(N)cccc32)cc1 821300293 UDJDZZKUTFFEBD-UHFFFAOYSA-N 329.356 1.977 10 10 EDCE C[C@@H]1OCC[C@H]1N(CCO)Cc1cc(Cl)cc([N+](=O)[O-])c1O 825130036 KUBRIXLDDRLKPB-JOYOIKCWSA-N 330.768 1.926 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=O)c1c(F)ccc(O)c1O)C2 822485229 IPDSOSWBNGGQDV-LSJOCFKGSA-N 338.335 1.586 10 10 EDCE NC(=O)CN1C(=O)/C(=C\c2nccc3c2CCCC3)SC1=S 905002106 LNUHOPSJIUWYMZ-KPKJPENVSA-N 333.438 1.647 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1CCNC[C@@H]1C)c1ccc(N(C)C)cc1 842201778 BZKYJOXPRKIRJU-HEHGZKQESA-N 332.448 1.044 10 10 EDCE C[C@]1(C2CC2)CN(Cc2cc(O)n3ncc(C(=O)O)c3n2)CCO1 849344043 AIXBQZFIWFDODN-MRXNPFEDSA-N 332.360 1.134 10 10 EDCE NC(=O)c1cncc(NCc2cc(F)c(N3CCOCC3)c(F)c2)n1 840327195 MWXVRRRRZOBHRL-UHFFFAOYSA-N 349.341 1.302 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N[C@H]2C[C@@H](C(N)=O)C2)cc1F 844962338 BRHPZWOAFHAZMJ-BETUJISGSA-N 336.411 1.735 10 10 EDCE COc1cc(N2CCN(C(=O)C3(F)CC3)CC2)cc(OC)c1OC 843580411 UUMJGFYKPJCXPH-UHFFFAOYSA-N 338.379 1.863 10 10 EDCE Cc1cncn1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 858626355 ZXTGGPZAJALRKX-UHFFFAOYSA-N 332.379 1.484 10 10 EDCE CCS(=O)(=O)C1(CNC(=O)/C=C\c2ccc(O)c(O)c2)CC1 856126091 YVHLCKIZYBPDFU-XQRVVYSFSA-N 325.386 1.195 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCCC(C)(C)O2)cc1 929238671 RUFNGNAYEPQROJ-MRXNPFEDSA-N 347.459 1.833 10 10 EDCE C[C@H]1CCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 920043364 HCPCPGWDQGQYKI-DZGCQCFKSA-N 330.432 1.692 10 10 EDCE Cn1ccc([C@@H]2CCCN(C(=O)C(=O)Nc3ccc(N)cc3)C2)n1 927858048 JRKNQAXQBQUNAW-GFCCVEGCSA-N 327.388 1.347 10 10 EDCE COC(=O)[C@@]1(OC)CCN(Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 862475460 LKQLXBYUMRHGAS-OAHLLOKOSA-N 340.332 1.073 10 10 EDCE C[C@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)Cc2c[nH]nc21 931458367 RPEDQRAAXIBHFR-ZDUSSCGKSA-N 327.432 1.711 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 862551005 JCZNFCZUXWSYDL-NSHDSACASA-N 332.853 1.807 10 10 EDCE NC(=O)CCCCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 779652165 LTALCJLIMFBBAU-OAHLLOKOSA-N 334.416 1.946 10 10 EDCE CC(=O)c1cn(C2CN(Cc3cc(F)c(N(C)C)cc3F)C2)nn1 897941292 VRANLDJPHWIEBV-UHFFFAOYSA-N 335.358 1.882 10 10 EDCE CCOC(=O)c1ccc(S(=O)(=O)Nc2ccc(O)c(OC)c2)o1 797820311 QRSMUZUJBFZUKC-UHFFFAOYSA-N 341.341 1.971 10 10 EDCE Cc1cnn(Cc2cc(C(=O)NCc3ccc(O)cc3O)no2)c1 1162277811 BVLQIAYOGYOBFL-UHFFFAOYSA-N 328.328 1.569 10 10 EDCE C[C@@H](C(=O)NCc1c(O)cccc1F)n1cnc2c(N)ncnc21 1178412793 FQKMKEXISBKVAR-QMMMGPOBSA-N 330.323 1.131 10 10 EDCE COCCNCC[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1326438192 QQNLAZBBICSSOR-CYBMUJFWSA-N 347.419 1.937 10 10 EDCE CCc1nc(CN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)cs1 1329788873 XEFXAVDPWACTHT-UHFFFAOYSA-N 345.424 1.912 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)CC(C)(C)O)c(Br)cc21 92968334 XBDAXPVVTRMUMH-GFCCVEGCSA-N 342.237 1.869 10 10 EDCE C[C@H](NCC1(O)CN(C(=O)OC(C)(C)C)C1)c1cc(O)ccc1O 1918696680 JPMWYWLIFWPYEP-NSHDSACASA-N 338.404 1.730 10 10 EDCE CC[C@H](OC)C(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1502392917 DJUCOOVAQLUMRF-MFKMUULPSA-N 349.391 1.509 10 10 EDCE Cn1cc(C2=NO[C@@H](C(=O)Nc3c(Cl)ccc4nonc34)C2)cn1 1525322177 JLPYJMQOJFFZJY-LLVKDONJSA-N 346.734 1.741 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3nc(C4CC4)n[nH]3)CC2)cc1 1465889875 OPJSXRDDMZGAAU-UHFFFAOYSA-N 341.415 1.582 10 10 EDCE C[C@H](NC(=O)C1CC1)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1701115889 NEDRSFMXXMEMAH-VHSXEESVSA-N 331.376 1.882 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C[C@H]2CCC(=O)N2)cc1C 1714284973 RFRVFWQWPAQNKO-UKRRQHHQSA-N 333.432 1.267 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2COCCO2)cc1C 1491984930 JGNDQBOZCHCHJO-YOEHRIQHSA-N 336.432 1.403 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccncc2)cc1C 1734356531 BXGQXTWFVGKXML-MRXNPFEDSA-N 329.400 1.279 10 10 EDCE CCOC(=O)c1cnc(C)c(C(=O)NCc2ccc(O)cc2O)c1 1643104188 PEUOYCSWZIBXTG-UHFFFAOYSA-N 330.340 1.908 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@H](CC(C)C)NC(C)=O)cc1 1732459057 MFKLVMXEQAZUTO-AWEZNQCLSA-N 346.435 1.311 10 10 EDCE COC(=O)c1ccn(CC(=O)Nc2c(Cl)ccc3nonc23)n1 1586682703 CVEKBMLGONGFPK-UHFFFAOYSA-N 335.707 1.498 10 10 EDCE O=C(Cc1csc(-c2nc[nH]n2)n1)NCc1c(O)cccc1F 1652295189 CMKRCXWNTZZMOW-UHFFFAOYSA-N 333.348 1.632 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)CC2CC2)cc(OC)n1 1679882574 VYRDXCULCMYBIT-NSHDSACASA-N 335.404 1.476 10 10 EDCE CN(C)c1ccc(/C=C2/C(=O)N=C(SCC(N)=O)N=C2O)cc1 5393669 LXORSCNNZHEYSE-UHFFFAOYSA-N 332.385 1.207 10 10 EDCE C[C@@H](NCC1(C(N)=O)CCOCC1)c1ccc(N2CCOCC2)cc1 153096134 ZTRNCFVHJKOCGN-OAHLLOKOSA-N 347.459 1.456 10 10 EDCE CNCc1ccc(N2CCC[C@H]3C(=O)NC[C@@H]32)cc1Br 234421445 VFSBIXKMYOJKRS-OCCSQVGLSA-N 338.249 1.883 10 10 EDCE CC(C)(C)OC(=O)N1CCC(C(=O)O)(c2cc(O)nc(O)c2)CC1 1952606074 BGYVVSHANPFGNG-UHFFFAOYSA-N 338.360 1.846 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCN(CC(=O)NCCCN=[N+]=[N-])C1 1985094686 SECYHWGPNNKXOR-NSHDSACASA-N 326.401 1.402 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 1985100896 KLRBOOTXIOJGEA-WDEREUQCSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC(N=[N+]=[N-])C1 2010393287 QHQBJJLUWZUSPW-LLVKDONJSA-N 335.368 1.367 10 10 EDCE CCNCc1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2160713387 CMBSDFZGKYEOTE-KJEVXHAQSA-N 341.249 1.489 10 10 EDCE CC(C)N(CC(N)=O)c1cc2c(cc1Br)[C@H](N)C(=O)N2 705751120 PKQIAVQUOLEGMI-LBPRGKRZSA-N 341.209 1.101 10 10 EDCE CNCc1ccc(N2CCS(=O)(=O)[C@H](C)C2)c(Br)c1 706914865 WFFNRFJXGADMHN-SNVBAGLBSA-N 347.278 1.792 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H](C3)C4O)c(Br)cc2[C@H]1O 2172929493 WJUUKMPILAKNPK-PNDROWJDSA-N 339.189 1.252 10 10 EDCE CN(C1COC1)C1CN(c2ccc(CN)c(Br)c2F)C1 2173118873 SGANNQFOXBSFAG-UHFFFAOYSA-N 344.228 1.566 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCCc3nc(C)c(C)s3)c2n1 2064737065 CSZRLXJWAKINGN-UHFFFAOYSA-N 331.401 1.789 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC2(CN(Cc3ccccc3)C2)C1 1642638199 CUTMKDQBIMQZGW-UHFFFAOYSA-N 338.407 1.985 10 10 EDCE CC[C@@]1(NCc2ccc(Br)cc2O)CCC(=O)NC1=O 2182525386 BRUXGQGZPONFBR-CQSZACIVSA-N 341.205 1.830 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)c(F)c1Br 2182541572 CHBLALBFTSXXEC-HZZFPTLFSA-N 345.212 1.225 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1908252659 CDEHXWFUZCOQOR-UTUOFQBUSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNC(=O)Cc2ccc(N)cc2)C1 2044205549 ACGGMIDHESMTLW-UKRRQHHQSA-N 349.431 1.155 10 10 EDCE O=C1CN(c2ccc(CO)c(Br)c2)C[C@H]2CCCN12 2102000817 QSNZJNRODKIOQO-GFCCVEGCSA-N 325.206 1.752 10 10 EDCE NCc1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)c(F)c1Br 2102192769 YRIKYUREJWQATM-IEBDPFPHSA-N 331.185 1.243 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@@H](O)C2)c(Br)c1 2105072640 GZQXKDBDKXBDIP-TXEJJXNPSA-N 329.238 1.491 10 10 EDCE OCc1ccc(N2CCO[C@]3(CCOC3)C2)c(Br)c1 2111919250 NGHCDEMPYVLSQD-CQSZACIVSA-N 328.206 1.937 10 10 EDCE CC(C)(C)OC(=O)N1CCC(C)(C)[C@H](COc2nnc(=N)[nH]n2)C1 2213792231 LUAAGTNLCQFXEE-JTQLQIEISA-N 338.412 1.341 10 10 EDCE OC[C@@H]1NC[C@H]2CN(Cc3c(O)cccc3Br)C[C@H]21 2227311445 DHQIZOQSQCJFNA-CWSCBRNRSA-N 327.222 1.167 10 10 EDCE Cc1ccc(C=C2SC(=S)N(CC(=O)NCCO)C2=O)cc1 2294872043 OWQZCRYYFIWCTP-UHFFFAOYSA-N 336.438 1.305 10 10 EDCE OCc1ccc(N2C[C@@H]3CC[C@H](CO)O[C@@H]3C2)cc1Br 2289170904 ZIRSEQXFBSRCEL-PSOPSSQASA-N 342.233 1.918 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(CC2CCOCC2)CC1 2308001617 ZJXLUPBJIQQDJB-UHFFFAOYSA-N 346.427 1.682 10 10 EDCE C[C@@H](N)c1ccc(N2CC(O)(CN(C)C)C2)cc1Br 2343639815 YHWQENFGPUSPNU-SNVBAGLBSA-N 328.254 1.582 10 10 EDCE Cc1ccc(CN2CC(C(=O)N(C)C)C2)c(O)c1Br 2352666538 MFPVANGFGNWIJV-UHFFFAOYSA-N 327.222 1.983 10 10 EDCE Oc1ccc(Br)cc1CNC[C@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2355463334 DJPSSSOQCIFMJE-ZBDYHWHTSA-N 342.233 1.622 10 10 EDCE Cc1cc(N2CCN(Cc3cccc(C)c3O)CC2)n2ncnc2n1 179684363 PQSABKRGOBXTGS-UHFFFAOYSA-N 338.415 1.769 10 10 EDCE CC(=O)NC1CCN(C(=O)c2c(C)oc(-n3cccc3)c2C#N)CC1 50417429 ZIUORMSFEGHASN-UHFFFAOYSA-N 340.383 1.991 10 10 EDCE CC1(C)C[C@H](O)[C@@H](O)CN1c1ccc(CN)cc1Br 2132114638 FOFBRADIKFWSBI-STQMWFEESA-N 329.238 1.618 10 10 EDCE CNC(=O)[C@H](NC(=O)NCc1ccc2c(c1)CCCN2C)C(C)C 178455511 UNFCWAPSDFEBLA-MRXNPFEDSA-N 332.448 1.639 10 10 EDCE NC(=O)CN1CCC(NCc2cc(Cl)cc(Cl)c2O)CC1 37140543 CJURRRAWNDLKRX-UHFFFAOYSA-N 332.231 1.738 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)c3ccccc3O)CC2)cc1 325258844 CXTGNBCGHZHQGH-UHFFFAOYSA-N 348.424 1.912 10 10 EDCE CC(C)CN1C(=O)/C(=C/NCCc2ccc(F)cc2)C(=O)NC1=S 255562803 ZXPAFESTMYYFFV-NTEUORMPSA-N 349.431 1.741 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@H](c3ccnc(N)n3)C2)c(O)c1O 370579064 GNZXPZUVDQEDMO-NSHDSACASA-N 328.372 1.798 10 10 EDCE C/C(=C\C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)CN1CCOCC1 907271631 BQLNKHBQXXMXKQ-SSUFTNFISA-N 334.416 1.424 10 10 EDCE CN(C)C(=O)[C@@H]1CC[C@H](CNC/C=C\c2ccc(N(C)C)cc2)O1 835043744 YLVRPBILUJBGBI-WIJVFFIESA-N 331.460 1.991 10 10 EDCE O=C(O)/C=C/c1ccc(N2CCO[C@H](C(=O)C3CC3)C2)c([N+](=O)[O-])c1 844212794 BEADYTSNLUIJGC-XCWSRWAASA-N 346.339 1.877 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCOC3(CNC3)C2)cc1 841717967 OVDQCOXMYVEOJJ-UHFFFAOYSA-N 332.448 1.417 10 10 EDCE COc1cc(Br)cc([C@@H](C)NCC2(CO)COC2)c1O 848535884 LOYDWKLKENHZDE-SECBINFHSA-N 346.221 1.823 10 10 EDCE Nc1ccc(CCNC(=O)N2CC[C@@H](CN3CCOC3=O)C2)cc1 841955698 KFYGKYVLWYCJAJ-CQSZACIVSA-N 332.404 1.295 10 10 EDCE CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2c(O)cccc2OC)C1 843432602 NZVPQBMVNXUPQU-CQSZACIVSA-N 332.322 1.901 10 10 EDCE CC(C)N1C(=O)CN(C(=O)NCCc2ccc(N)cc2)CC1(C)C 841954923 RSAWVCBOIPZMNJ-UHFFFAOYSA-N 332.448 1.852 10 10 EDCE CCN(CCC(N)=O)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 922912646 JGFTUFLDYRKZOT-AWEZNQCLSA-N 334.464 1.899 10 10 EDCE COc1ccc(CNC(=O)NC[C@]2(OC)CCSC2)c(O)c1 925376949 HKLCYSBAXZYZRX-OAHLLOKOSA-N 326.418 1.722 10 10 EDCE O=C(NCc1ccccc1O)C(=O)Nc1cncc2c1CCCC2 850362446 OKRVWPJMQZYLEP-UHFFFAOYSA-N 325.368 1.921 10 10 EDCE COc1ccc(CNC[C@@H]2C[C@@H]3COC[C@@H]3O2)cc1Cn1cccn1 922725309 KJIRRDWXJLXKJM-AOIWGVFYSA-N 343.427 1.834 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](O)CC(C)C)C2)cc1 854299786 LOFOUEQUTFFQSG-ZBFHGGJFSA-N 335.448 1.980 10 10 EDCE O=C(Cn1nnc2c1CCCC2)NCc1ccc2cccnc2c1O 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DNDWVTWZMSALSY-CHWSQXEVSA-N 334.416 1.908 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@H](C)n2cncn2)cc1C 1270386317 RRHNLOQBJRZMKD-UKRRQHHQSA-N 345.447 1.698 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)[C@H]2CC2(C)C)cc1C 1501450852 RWKOWIJDRAFIBA-MRXNPFEDSA-N 334.460 1.960 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@@H]1CCOC1 1502053070 HNLINCGMKIURLN-ZYHUDNBSSA-N 347.375 1.120 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CN(c3ccccc3)C2=O)cc1 1447622124 UXWXITIYXRDLTR-AWEZNQCLSA-N 337.339 1.994 10 10 EDCE NCc1ccc(N2CCC(CC(N)=O)CC2)c(Br)c1 212879173 UJQSKYDDKGQPQQ-UHFFFAOYSA-N 326.238 2.000 10 10 EDCE O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)c1c(F)ccc(O)c1O 1610204802 GHNKMQHGKSSKCC-CYBMUJFWSA-N 344.342 1.768 10 10 EDCE Cn1cc(C[C@@H]2CCC[C@@H]2NC(=O)Cc2ccc(O)c(O)c2)cn1 1629623391 IMCDEUVSBUVCDS-GJZGRUSLSA-N 329.400 1.901 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccc(Cc2nc[nH]n2)cc1 1631510700 WXTXHLHQHYEALI-UHFFFAOYSA-N 338.367 1.779 10 10 EDCE COC(=O)CC[C@@H]1CC[C@H](C(=O)NCCc2ccc(O)c(O)c2)O1 1636022029 DNHJGFUUJAUHCO-SWLSCSKDSA-N 337.372 1.257 10 10 EDCE C[C@H](NC(=O)CNC(=O)c1ccc2c(c1)OCO2)c1ccccc1O 1643741889 DMWPBPMKUUOUTI-NSHDSACASA-N 342.351 1.728 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@@H](C)NC(C)=O)cc1C 1699080032 UKKJGLRZXSIADS-ZIAGYGMSSA-N 335.448 1.513 10 10 EDCE CCOc1cccc(CNCCC(=O)NCCN(CC)CC)c1O 1857859914 MXUIHTVWPXPIMU-UHFFFAOYSA-N 337.464 1.729 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(C(=O)N1CC(N=[N+]=[N-])C1)C(C)(C)O 1985104665 LAIDPAFAKKZGRB-CQSZACIVSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)NCCOCCC(=O)N1CC[C@H](N=[N+]=[N-])C1 1985100916 KYWGOEMCRVPWMF-NSHDSACASA-N 327.385 1.829 10 10 EDCE O=C1Nc2cc(N3CCOC(F)(F)C3)c(Br)cc2[C@@H]1O 2152274093 OQGLUSHQRCTKES-JTQLQIEISA-N 349.131 1.864 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)NCC2(CN=[N+]=[N-])CC2)C1 2010388600 DTTLOMAIUSFYFM-UHFFFAOYSA-N 339.396 1.829 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010405551 ZTBMBPVFVRNHME-ABAIWWIYSA-N 339.396 1.517 10 10 EDCE CC(C)(C)OC(=O)NC1CC(NC(=O)c2cc(O)c(O)c(O)c2)C1 2015123681 VIRRGTGBRSBMDK-UHFFFAOYSA-N 338.360 1.589 10 10 EDCE CC(=O)N1CCN(CCNC(=O)C=Cc2ccc(N(C)C)cc2)CC1 2041614832 CJCKCWOAKDMASS-UHFFFAOYSA-N 344.459 1.046 10 10 EDCE O=S(=O)(Nc1cc(Cl)c(O)c(Cl)c1)c1n[nH]cc1CO 2157801322 YXZNORNMNMUFEY-UHFFFAOYSA-N 338.172 1.715 10 10 EDCE Cc1nnc2n1CCN(c1cc(Br)c(CN)cc1F)C2 2170355508 VJUYOYFNJHYGDX-UHFFFAOYSA-N 340.200 1.967 10 10 EDCE COC(=O)c1c(-c2ccccc2)nn2c(O)cc(CC(=O)O)nc12 2080935813 YJLNXJZNSGAFOB-UHFFFAOYSA-N 327.296 1.516 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2199528273 YFKFCLWSRRRWMZ-FUJOKSKWSA-N 341.249 1.789 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)N2CCc3cccnc32)=C[C@@H]1O 2080945648 HIBIYHRRNKNHEZ-KGLIPLIRSA-N 345.399 1.555 10 10 EDCE O=C(NC[C@@H]1CNCCN1Cc1ccccc1)c1cccc(O)c1O 2084716760 YBCKHEIPDXNLCG-HNNXBMFYSA-N 341.411 1.302 10 10 EDCE CNCc1ccc(N2C[C@@H](O)C[C@H](OC)C2)c(Br)c1 2109018289 NPFYSKUXRFIVRF-RYUDHWBXSA-N 329.238 1.755 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@@H](CO)C2)cc1Br 2098209437 SBFSBFFATFNANT-WDEREUQCSA-N 329.238 1.914 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)C[C@H]3C2)c(Br)c1 2236991982 ZMHNFNCUPGYZSH-AGCIHXOGSA-N 342.233 1.509 10 10 EDCE O=C1N=C(N2CCN(CCO)CC2)SC1=Cc1ccc(F)cc1 2293128238 IEPQDTHCSQEWPY-UHFFFAOYSA-N 335.404 1.406 10 10 EDCE COc1ccc(Br)c(CN[C@H]2COC3(COC3)C2)c1O 2286280361 VIVIHKVEKPJVGR-SECBINFHSA-N 344.205 1.811 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)c(Br)c1 2331966008 YQTNHBUFHIPRRS-PCDDKUFXSA-N 327.222 1.371 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CC[C@H](C4CC4)N3)CC2)cc1 407310070 NIEFWGONRLTWEP-MSOLQXFVSA-N 329.444 1.874 10 10 EDCE COC(=O)C[C@@](C)(N)c1ccc(I)cc1O 309378419 INZHGPLXEZHLOP-LLVKDONJSA-N 335.141 1.734 10 10 EDCE O=C1NC(=O)[C@]2(CCCN(Cc3c(O)ccc(Cl)c3F)C2)N1 193470229 CVHLYFOBYRMHOR-CQSZACIVSA-N 327.743 1.359 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2cc3c(cc2O)CCCC3)CCO1 530102096 DMIZQSWGIZSVMS-INIZCTEOSA-N 333.432 1.401 10 10 EDCE CN(C)c1ccc(CN(C(=O)c2cnc(O)n(C)c2=O)C2CC2)cc1 267607696 OJHSOJWVTQEKSU-UHFFFAOYSA-N 342.399 1.357 10 10 EDCE CNC(=O)[C@H]1CCCN1c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 264882156 CZTQENZJLMJENC-FWPCIQOSSA-N 333.344 1.496 10 10 EDCE CN1CCC(CNC(=O)Cc2ccc(N)cc2)(N2CCCCC2)CC1 262627493 CGBAJMGCWQFZEM-UHFFFAOYSA-N 344.503 1.878 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCC[C@@H](CO)C2)c1 298125654 AFQNAIBEXAXIBG-MNOVXSKESA-N 342.417 1.045 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NCC[C@@H]3CCNC3)C2)cc1 818654637 DFQQHONXMVFGMJ-HOTGVXAUSA-N 346.475 1.820 10 10 EDCE CCn1ncc(C(=O)NCc2cc(Br)ccc2O)n1 816653651 CCKFZNXYQMKUAH-UHFFFAOYSA-N 325.166 1.696 10 10 EDCE CCOCCOCC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 819582599 NVHPKIQPPGTQOL-HNNXBMFYSA-N 336.432 1.691 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CC[C@H](C(=O)NC)C2)cc1 817155160 VHZGZHMKJSZVTE-HNNXBMFYSA-N 332.448 1.810 10 10 EDCE Cc1ccc(C(=O)OCC(=O)N2CCO[C@H]3CCCC[C@@H]32)c(O)c1O 727004366 UKKPYTUSNNJHFR-KBPBESRZSA-N 349.383 1.733 10 10 EDCE CC1(O)CC(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 825498843 RECHBYZUHMABQV-UHFFFAOYSA-N 336.407 1.564 10 10 EDCE CC[C@@H](NC[C@@]1(OC)CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 903368287 MPQZFIYPJDGHSZ-SJORKVTESA-N 340.489 1.997 10 10 EDCE CCOc1ccc(O)c(CN2C[C@@H]3C[C@@H](N)C[C@]3(C(=O)OC)C2)c1 903979256 ZRFVCVPZOXHIBW-IYOUNJFTSA-N 334.416 1.503 10 10 EDCE CN(C)c1ccc(/C=C/CNC[C@@H]2CCN(S(C)(=O)=O)C2)cc1 835043064 ZZNKRGILMJEYLZ-APHBUQMISA-N 337.489 1.637 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCO[C@H]([C@H](C)O)C2)cc1 840263423 QLIBOAOXJKWKRS-YOEHRIQHSA-N 335.448 1.824 10 10 EDCE CN(C)c1ccc(CNC(=O)CS(=O)(=O)NC(C)(C)C)cc1F 746866486 PBRHCGVWOXMSJY-UHFFFAOYSA-N 345.440 1.226 10 10 EDCE COc1ccc(N2CC[C@H](N[C@@H](Cc3ccccc3)C(N)=O)C2)cc1 849321716 KTWRRMHEGJLMSP-LPHOPBHVSA-N 339.439 1.960 10 10 EDCE NCC(F)(F)CNC(=O)NCc1cc(Br)ccc1O 841971122 LFKYSUUDAKZLDS-UHFFFAOYSA-N 338.152 1.548 10 10 EDCE Fc1cc(CNCCCN2CCNCC2)ccc1N1CCOCC1 841028128 AXVOMUJQMZLEKO-UHFFFAOYSA-N 336.455 1.047 10 10 EDCE CC[C@H](NCC[C@H]1CNCCS1(=O)=O)c1ccc(N(C)C)cc1 925796524 OVHBBBQSVXFAAM-IRXDYDNUSA-N 339.505 1.570 10 10 EDCE O=C(O)CN1CC[C@@H](N2CCCc3cc(OC(F)F)ccc32)C1=O 852726227 XRZOUPQZTNSTDL-CYBMUJFWSA-N 340.326 1.726 10 10 EDCE CN(C)c1ccc(CNC(=O)CN(C)[C@H](CN)C(F)(F)F)cc1 852762812 XGUSBXKJYLJGHR-CYBMUJFWSA-N 332.370 1.190 10 10 EDCE CNCc1ccc(N2C[C@H](O)C[C@@]2(C)CO)cc1Br 698224512 AQPGDHQBUJMNRN-OCCSQVGLSA-N 329.238 1.491 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CC[C@]3(C)CCC(=O)N3)C2)cc1 855234112 SKOSGABZTJVBJP-AUUYWEPGSA-N 345.443 1.839 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2cccc(OC)c2O)C1 862550993 IYOJQLKXHLRWLQ-LBPRGKRZSA-N 328.434 1.162 10 10 EDCE CCN1CCN(CCC(=O)NCc2ccc3cccnc3c2O)CC1 862028367 WRYCXQDQOZAIBP-UHFFFAOYSA-N 342.443 1.584 10 10 EDCE CC(=O)C(=O)COC(=O)/C=C\[C@H]1CCCN(C(=O)OC(C)(C)C)C1 869740730 QQFOPQGUZRGTAF-MEJMFZKBSA-N 339.388 1.891 10 10 EDCE CN(C)C[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)C[C@H]1CN(C)C 870022664 WPRLAJDCINEHNG-AJKQWTFCSA-N 347.459 1.309 10 10 EDCE CO[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1C 785424859 VZKWSEHUCZAIAC-XJKSGUPXSA-N 333.432 1.252 10 10 EDCE Cc1ccnc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 792035575 LBIMAJQEVVFYQX-UHFFFAOYSA-N 326.400 1.894 10 10 EDCE Cc1ccc(C(=O)N[C@@H](c2cnn(C)c2)c2ncon2)c(O)c1O 1141498345 SADLFDJEMGZWBH-NSHDSACASA-N 329.316 1.042 10 10 EDCE O=C(CCc1nn[nH]n1)N(Cc1ccco1)Cc1ccccc1O 1149858335 WSWXGSNDPXNHSL-UHFFFAOYSA-N 327.344 1.660 10 10 EDCE Cc1csc2ncc(C(=O)NCc3c(O)cccc3O)c(=O)n12 1156880878 FYRVMPTYLFOUQV-UHFFFAOYSA-N 331.353 1.406 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCOC[C@@H]1CC1CCOCC1 1304631146 DADAXBUHGASPII-HNNXBMFYSA-N 335.400 1.684 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@@H]2CO)cc1Br 698180110 KCUGCGHFYBNHFJ-OLZOCXBDSA-N 329.238 1.491 10 10 EDCE C[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1nc(C(F)(F)F)no1 1299734643 CWBBPFIXOKXGKX-LURJTMIESA-N 331.250 1.920 10 10 EDCE CCN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@@H](C)CS(C)(=O)=O 1465146605 SSBMTDUFQPDWNS-JTQLQIEISA-N 340.405 1.744 10 10 EDCE Cc1cc(Cn2nnc(C(=O)NCc3ccc(O)cc3O)c2C)no1 1469159062 JWJTYVNBGWYOFK-UHFFFAOYSA-N 343.343 1.272 10 10 EDCE CCN(CC)[C@@H]1[C@H]2OC[C@@H](O2)[C@H](NCc2ccc(N(C)C)cc2)[C@H]1O 1616153594 XOVRJOQYGFQUEF-SPOLIRPYSA-N 349.475 1.037 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(CO)nc1 1470447024 CTUQRLAKRFQAQG-UHFFFAOYSA-N 341.411 1.465 10 10 EDCE Cc1ccc(C(=O)Nc2ccccc2O[C@H]2CC(=O)N2)c(O)c1O 1557105698 ZIWQHAIQLYSCOX-AWEZNQCLSA-N 328.324 1.883 10 10 EDCE C[C@@H](NCCn1ncc(Br)n1)c1c(O)cccc1O 2123092258 GJIDAYAUVGXLJV-MRVPVSSYSA-N 327.182 1.803 10 10 EDCE COC(=O)c1ccccc1CCNC(=O)Cc1ccc(O)c(O)c1 1635889495 NNTGXYOYOAKGQB-UHFFFAOYSA-N 329.352 1.786 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1666558296 MPHPRESAZJCMHO-XJKSGUPXSA-N 347.459 1.324 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CC[S@](=O)CC 1762870607 ABHNWWVSYNZDGT-HSZRJFAPSA-N 336.461 1.951 10 10 EDCE COC1CC(NC(=O)OC(C)(C)C)(C(=O)NCCCN=[N+]=[N-])C1 1964884031 NPKUYCMXYFEBCR-UHFFFAOYSA-N 327.385 1.875 10 10 EDCE O=C(c1cc(O)c(O)c(O)c1)N1CCN(C(=O)c2cccs2)CC1 169824400 PWMAWWCZXBNPBR-UHFFFAOYSA-N 348.380 1.463 10 10 EDCE O=C(Cc1ccc(F)cc1)NCCNC(=O)c1cc(O)c(O)c(O)c1 169834887 QKAICRITSVRALJ-UHFFFAOYSA-N 348.330 1.031 10 10 EDCE CNCc1ccc(N(C)[C@@H]2CC(=O)N(C)C2)c(Br)c1 2131960670 MXSVZRXGKZBDOH-LLVKDONJSA-N 326.238 1.835 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985103548 XAGBUYAYDOGFRV-OUAUKWLOSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1CC(=O)N1CC(N=[N+]=[N-])C1 1987647458 SJILEYJAJRDCQU-GXSJLCMTSA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NCc2ccc(F)cc2O)C1 1994520955 QVFKVAQDWFRAOQ-JSGCOSHPSA-N 326.368 1.601 10 10 EDCE CN[C@@H](c1ccc2c(c1)CCN2C)[C@@H](O)CNC(=O)OC(C)(C)C 1999527433 NOULVKCSNPXGHR-HOTGVXAUSA-N 335.448 1.825 10 10 EDCE CC1(C)C[C@H](O)CN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2154827029 BZJOELYCSKBINO-MADCSZMMSA-N 341.205 1.784 10 10 EDCE CNCc1ccc(N2CCC[C@H]3C(=O)NC[C@H]32)cc1Br 300496100 VFSBIXKMYOJKRS-TZMCWYRMSA-N 338.249 1.883 10 10 EDCE NCc1ccc(N2CCC(C(CO)CO)CC2)c(Br)c1 2170674534 SQROWJPYMJALRT-UHFFFAOYSA-N 343.265 1.725 10 10 EDCE CCCN(c1ccc(CN)c(Br)c1)[C@@H]1CC(=O)NC1=O 2171198595 XJCBPADSTLYFCM-GFCCVEGCSA-N 340.221 1.539 10 10 EDCE C[C@@H]1CN(C)C[C@H](CNCc2c(O)cccc2Br)O1 706835098 QHOZVSANCHOCJD-MNOVXSKESA-N 329.238 1.963 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H](C)CN3CCC[C@@H](C)C3)c2n1 2064763069 MDKPKLOIWZVONS-YPMHNXCESA-N 331.420 1.594 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1CNC(=O)COc1ccc(N)cc1 1906134574 BIGOFWKLZGBJSV-BXUZGUMPSA-N 335.404 1.677 10 10 EDCE CN1CCc2cc([C@@H](N)[C@@H](O)C3CN(C(=O)OC(C)(C)C)C3)ccc21 2044749859 IYFHMDKHFVHGCH-SJORKVTESA-N 347.459 1.907 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210535392 LSSBBCVUIZHQSQ-MXWKQRLJSA-N 327.385 1.610 10 10 EDCE NCc1ccc(N2CCC[C@@H](OCCO)C2)c(Br)c1 2113856359 MGXVJZISWUSVEZ-GFCCVEGCSA-N 329.238 1.886 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)cc1Br 2201284780 PBNQKVUUUXNRMZ-XFOOOJQKSA-N 338.249 1.897 10 10 EDCE CC(C)(C)OC(=O)NC12CCC(COc3nnc(=N)[nH]n3)(CC1)C2 2213783930 WEBUPEYEYVUJKU-UHFFFAOYSA-N 336.396 1.286 10 10 EDCE CNCc1ccc(N2CCC[C@H]3CNC(=O)[C@H]32)cc1Br 2279266287 CRYLICSGRDNSQT-FZMZJTMJSA-N 338.249 1.883 10 10 EDCE Cc1nn(C)cc1NC(=O)C(=O)NCCCSc1nccs1 179157177 OVXRJNBRJVICIK-UHFFFAOYSA-N 339.446 1.422 10 10 EDCE O=C(NC[C@H](O)c1ccc2c(c1)OCCO2)c1cc(O)c(O)c(O)c1 170190467 OEKMORVVGKBJDR-ZDUSSCGKSA-N 347.323 1.038 10 10 EDCE COc1cc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)c(O)cc1C 179435921 KQVHJSHINFOBEB-OAHLLOKOSA-N 348.443 1.780 10 10 EDCE CCN1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1=O 189772980 XCLNLCVZNJJKRP-UHFFFAOYSA-N 348.472 1.571 10 10 EDCE COC(=O)c1ccc(CNC(=O)Nc2cc(O)c(O)c(O)c2)cc1 217278974 JYVWOVITFMAGNT-UHFFFAOYSA-N 332.312 1.912 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CC[C@]3(CNC(=O)C3)C2)cc1 279456832 KXVLLXLGHLTHFL-IBGZPJMESA-N 344.459 1.954 10 10 EDCE CCCn1[nH]c(Br)nc1=NCCOc1ccc(N)cc1 2381923638 QKFXQAWIHVPTTP-UHFFFAOYSA-N 340.225 1.946 10 10 EDCE COc1ccc(N2CCCN(C(=O)C3(C(=O)N(C)C)CC3)CC2)cc1 806538463 IGXPNBNOKDOCQU-UHFFFAOYSA-N 345.443 1.602 10 10 EDCE O=C(C[C@H]1COC(=O)C1)NCc1cc(Br)ccc1O 804737359 PTMYYLXGYMUXEQ-MRVPVSSYSA-N 328.162 1.724 10 10 EDCE COC[C@@H](CCCN)NCc1ccc(N2CCOCC2)c(F)c1 817888007 IKCZCCNQQMXNJQ-OAHLLOKOSA-N 325.428 1.506 10 10 EDCE COC[C@H](CCCN)NCc1cc(F)c(N2CCOCC2)c(F)c1 817934170 BYNDMLNVEDXEQO-AWEZNQCLSA-N 343.418 1.645 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCN(CCO)C[C@@H]2C)c1O 832783143 NWDQGBVOJMRQQM-NSHDSACASA-N 326.824 1.747 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@@H](N3CCNCC3=O)C2)c1 843063505 BSZUFGFLXUCZIT-OAHLLOKOSA-N 333.432 1.187 10 10 EDCE CN(CCN)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 841867046 PLSOEKYGCUVVDE-UHFFFAOYSA-N 345.491 1.319 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=S)NCCCN(C)C)C2)cc1 849270857 RBKGRQIXWZHCNQ-CQSZACIVSA-N 336.505 1.690 10 10 EDCE COc1ccc(O)c(CNC[C@H]2CS(=O)(=O)c3ccccc3O2)c1 843417550 HWKHPSLWQFCPIG-AWEZNQCLSA-N 349.408 1.725 10 10 EDCE O=C1N[C@@]2(C(=O)NCCCSc3nccs3)C[C@H]3C[C@@H]1[C@H]2C3 845505729 KEFMWUHQXIGHAG-SQYUCLKFSA-N 337.470 1.656 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCn4ccnc43)C2)cc1 852360650 JOMKCORODPIPTD-CJNGLKHVSA-N 341.415 1.915 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCOC[C@@H]1CCO 758519898 ZDPZGGBDFZFIPW-KRWDZBQOSA-N 331.416 1.356 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2CCN(C3CCC3)C2=O)c1 858603989 YYTKXUSAMAHWID-ABAIWWIYSA-N 332.400 1.983 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCc4cncn4C3)C2)cc1 855224461 GMCOSBRNAZWOIC-HUUCEWRRSA-N 340.427 1.849 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CN(C(C)=O)CCO1 930906006 ZZVJDCXDAHLVQE-KRWDZBQOSA-N 333.432 1.348 10 10 EDCE CCOC(=O)[C@H]1CN(Cc2ccc(N3CCOCC3)cc2)CCO1 769467185 MZEMJIGQTZSMFC-QGZVFWFLSA-N 334.416 1.287 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@@H](O)CC(F)(F)C2)c([N+](=O)[O-])c1 786829112 YESVPVPZZUSECF-MZBZXASESA-N 342.298 1.987 10 10 EDCE CN(C[C@H](O)COCc1ccccc1)C(=O)NCc1ccc(N)cc1 1337077823 BGOCBTGGSJXEMG-SFHVURJKSA-N 343.427 1.988 10 10 EDCE 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104799770 LMPLPGAFCZLRJD-FMIVXFBMSA-N 331.328 1.257 10 10 EDCE CC(C)(C)NC(=O)CNC(=O)NCc1c(O)ccc2c1CCCC2 174640577 SFKLJMLLOUWEBG-UHFFFAOYSA-N 333.432 1.985 10 10 EDCE O=C1NC(=O)[C@@]2(CCCN(Cc3c(O)ccc(Cl)c3F)C2)N1 193470249 CVHLYFOBYRMHOR-AWEZNQCLSA-N 327.743 1.359 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)N[C@@H]1C[C@H]2CC[C@H]1O2 246824432 AFSMSRGTAMNKIZ-IETLOQFOSA-N 328.412 1.973 10 10 EDCE C[C@@H](C(=O)N1C[C@@H](C)O[C@H](C)C1)N1CCOc2cc(N(C)C)ccc21 246085765 NFWHKZBGZQOOHZ-KFWWJZLASA-N 347.459 1.976 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(=O)N(C)[C@H](C)C2)c([N+](=O)[O-])c1 283525695 NJHRKQJCMZQBMS-OKPNEXGHSA-N 333.344 1.448 10 10 EDCE CO[C@@H]1CN(Cc2ccc(C)c(Br)c2O)C[C@@H]1C(=O)O 2380810166 FPYIQMWYGNOIOU-WDEREUQCSA-N 344.205 1.995 10 10 EDCE O=C(O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1(Br)CC1 2168170385 WNRYXSNIRAGNBP-MRVPVSSYSA-N 344.161 1.137 10 10 EDCE CN1CC[C@@H](C(=O)NCc2cc(Br)ccc2O)CC1=O 804735349 VRXHXYXEHCNMNU-SECBINFHSA-N 341.205 1.639 10 10 EDCE C[C@@H](N[C@@H]1CCC(=O)N(C)C1=O)c1cc(Br)ccc1O 818362247 SMYORFKEAOMTOZ-LDYMZIIASA-N 341.205 1.953 10 10 EDCE COc1ccc(N2CCCN(C(=O)CC3(O)CCOCC3)CC2)cc1 906352435 KYUHJSLYLBPLDX-UHFFFAOYSA-N 348.443 1.666 10 10 EDCE CC(=O)N1CCO[C@@H](C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C1 822832134 JZPVMLGQBWTZMA-RDTXWAMCSA-N 347.459 1.356 10 10 EDCE Cc1cc(C(=O)CN(C)CCN)c(C)n1-c1ccc2c(c1)OCO2 842479773 YGYGRPCHIJOOSU-UHFFFAOYSA-N 329.400 1.896 10 10 EDCE CC1CCN(c2ccc(CNC(=O)N(CCN)CCO)cc2)CC1 841792965 HRFXYTFJMIPQGY-UHFFFAOYSA-N 334.464 1.386 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N2CC=CC2)cc1)c1nnc(O)n1C 919909767 YFOCRNDOWMHTGN-LBPRGKRZSA-N 342.403 1.457 10 10 EDCE CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC(=O)Nc1ccc(N)cc1 841298345 APKRGJRRCQBPLT-GXFFZTMASA-N 326.422 1.108 10 10 EDCE CC(C)OC[C@@H](CO)N(C)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 844216187 CAHUQRZPMGJWGB-SCXUMTSISA-N 338.360 1.915 10 10 EDCE C[C@@H]1CO[C@H](C(F)(F)F)CN1C(=O)C(=O)Nc1ccc(N)cc1 841127630 OEYMFMZRKRAXMR-KCJUWKMLSA-N 331.294 1.386 10 10 EDCE CCN1C[C@H](C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 855230500 DPNDFXOCYWHSTF-ZIAGYGMSSA-N 331.416 1.259 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cc3c(C)n[nH]c3C)C2)cc1 855229749 QBEVFQYCYYRYJM-AWEZNQCLSA-N 328.416 1.973 10 10 EDCE CN(C)c1ccc(/C=C/CNC(C)(C)CNS(C)(=O)=O)cc1 922636897 LJEYHBYTENSAHF-VOTSOKGWSA-N 325.478 1.683 10 10 EDCE C[C@@H]1NCC[C@H]1NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 861811923 APVSOIQAQXEIMO-SUMWQHHRSA-N 344.459 1.110 10 10 EDCE Cc1cc(C(=O)NC2CN(c3ccncn3)C2)c(C)n1-c1ccccn1 871183816 RJBLGWBBZDLWFK-UHFFFAOYSA-N 348.410 1.898 10 10 EDCE CC1(C)[C@@H](O)C[C@@]1(CO)NCc1cccc(Br)c1O 1879557867 FEMSJMFYIQLNDX-FZMZJTMJSA-N 330.222 1.766 10 10 EDCE CC1(C)[C@@H](O)C[C@]1(CO)NCc1cc(Br)ccc1O 1879559766 QSIPFLXGNSCGRY-GXTWGEPZSA-N 330.222 1.766 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)C1CN(CC(F)F)C1 791336279 NUYMTNCPDFRKJC-UHFFFAOYSA-N 339.386 1.336 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCCNC2=O)c1O 1964042812 JWYPNHYULZZOAI-SNVBAGLBSA-N 329.194 1.532 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@H]2CCC(=O)N2)C(C)C)cc1C 1319902348 DEOAFXBMWQPRMU-HZPDHXFCSA-N 347.459 1.513 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CC[C@H]3C(N)=O)CC2)cc1C 1323515784 FFBSLLZTZJJAQB-CABCVRRESA-N 345.443 1.254 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2c1nnnn1C[C@H]1CCCO1 1332958456 PJOFSKITKJJZLG-CYBMUJFWSA-N 330.392 1.449 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CCC[C@@]1(C)NC(=O)NC1=O 1443807825 CKLHFQVXJSIZPR-GOSISDBHSA-N 346.431 1.446 10 10 EDCE Cc1nc[nH]c1CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1542403256 PQSTVIUIBOMAIP-ZDUSSCGKSA-N 328.416 1.975 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2oc(C)nc2C)cc1C 1485982171 JCTKGXIMPDRNDS-HNNXBMFYSA-N 347.415 1.489 10 10 EDCE Cc1cc(C(=O)N[C@H](C(N)=O)c2ccccn2)c(C)n1-c1ccccn1 1624832192 QCLWYSRANFMQJN-KRWDZBQOSA-N 349.394 1.841 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)C1=CS(=O)(=O)CCC1 1628726763 CVTHOZKLDNYLNG-UHFFFAOYSA-N 336.413 1.571 10 10 EDCE CN(C(=O)Cc1ccc(O)c(O)c1)[C@@H]1CCN(c2ccccc2)C1=O 1628575604 YZJIUPSWWCKIKQ-OAHLLOKOSA-N 340.379 1.904 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1C(=O)NC/C=C\CNCc1ccc(OC)c(C)c1 1732829079 DFURRAXYVWJHTH-XETQRACLSA-N 346.427 1.575 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CCC[C@@]1(C)NC(=O)NC1=O 1587405812 ZTSMYQVBACVUQK-GOSISDBHSA-N 346.431 1.479 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H]2CC(=O)N(C)C2)cc1C 1666558293 MPHPRESAZJCMHO-BBRMVZONSA-N 347.459 1.324 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cc(F)c[nH]2)cc1C 1699051770 MTMNWSWBXLDCHI-CQSZACIVSA-N 335.379 1.351 10 10 EDCE CNCc1ccc(N(C)[C@@H]2CCC(=O)NC2)c(Br)c1 2127086515 JXPFWUUIVQBGLI-LLVKDONJSA-N 326.238 1.883 10 10 EDCE CCS(=O)(=O)CCN[C@H](C)c1ccc(N2CCC(O)CC2)cc1 163464940 BXVKHINJRGNGRT-CQSZACIVSA-N 340.489 1.733 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1csc(-c2ncccn2)n1 156642860 AGSPJJXGOCSPGZ-UHFFFAOYSA-N 342.380 1.984 10 10 EDCE C[C@@H](O)[C@H](C(=O)O)N1C(=O)/C(=C\c2ccccc2F)SC1=S 1858592708 VBKZOPISJXSHJH-TVNLMNMCSA-N 341.385 1.861 10 10 EDCE COc1cc(-c2nnnn2-c2ccc(N)cc2)cc(OC)c1OC 1857876674 MNAKAIIFZCZHMK-UHFFFAOYSA-N 327.344 1.937 10 10 EDCE CN(CC1(CO)CC1)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 1915531177 JMRDXWDJOGQJOS-GFCCVEGCSA-N 341.205 1.643 10 10 EDCE CNCc1ccc(N2C[C@H](O)C[C@@H]2CN(C)C)c(Br)c1 234381284 JYOCMGPUVBNUMV-CHWSQXEVSA-N 342.281 1.670 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@@H](NC(=O)OC(C)(C)C)C2)c(N)c1 2002706776 CXCARRDHNXFVOL-NEPJUHHUSA-N 337.420 1.742 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H]([C@@H](O)[C@@H](N)c2ccccc2O)C1 2022706688 JIPIMLVEHCYVOG-SOUVJXGZSA-N 338.404 1.389 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNCc2ccc(O)cc2O)C1 702786713 GDEPAVWCCYRAKP-IUODEOHRSA-N 338.404 1.415 10 10 EDCE O=C1Nc2cc(N3C[C@H](F)[C@@H](CO)C3)c(Br)cc2[C@H]1O 2177137295 HTRAUENDQLJOCN-PUQNFTFYSA-N 345.168 1.201 10 10 EDCE C[C@@H]1CN(c2ccc(CN)c(Br)c2F)C2(CC2)C(=O)N1 2188545609 PBKMYYGTQSRZCG-MRVPVSSYSA-N 342.212 1.904 10 10 EDCE O=S1(=O)C[C@H]2[C@@H](C1)[C@@H]2NCc1cccc(Br)c1O 2054279429 ZSDBAXPPXQENGK-JZYVYDRUSA-N 332.219 1.287 10 10 EDCE CN(C(=O)C1(NC(=O)OC(C)(C)C)CC(CO)C1)c1ccc(N)cc1 2073690142 RBGMYAYMJTXYBK-UHFFFAOYSA-N 349.431 1.897 10 10 EDCE NCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@H]32)cc1Br 2090543713 ZDNVYLNMSBXTKM-IACUBPJLSA-N 327.222 1.636 10 10 EDCE CN1CCCN(c2ccc(CN)c(Br)c2)CCC1=O 2096284904 HSGGKRMQNSUSCS-UHFFFAOYSA-N 326.238 1.966 10 10 EDCE N[C@H]1[C@H]2C[C@@H](CN(Cc3ccc(Br)cc3O)C2)[C@H]1CO 2239342317 WXWAGVNTQIDWEG-MEDZGJRSSA-N 341.249 1.542 10 10 EDCE NCc1cc(F)c(N2CCC[C@H]3CNC(=O)[C@H]32)cc1Br 2279274697 ILYGOOXBKCCPRZ-SDBXPKJASA-N 342.212 1.762 10 10 EDCE CN(CCc1ccc(N)cc1)CC1(O)CN(C(=O)OC(C)(C)C)C1 2250102334 YEMRFJPNOGNOTA-UHFFFAOYSA-N 335.448 1.725 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(Cc2ccncc2)CC1 2307981949 GKDAEQXFBDUTEQ-UHFFFAOYSA-N 339.395 1.850 10 10 EDCE CC(C)S(=O)(=O)N(C)NCc1ccc(Br)cc1O 2317496895 PIUPTHKAKFNXCM-UHFFFAOYSA-N 337.239 1.829 10 10 EDCE CS(=O)(=O)[C@@H]1CC[C@@H]1NCc1c(O)cccc1Br 2319821359 APYWOKWZWHLCMI-CMPLNLGQSA-N 334.235 1.820 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)cc1Br 2329193470 NLBQEDUDWLPGEV-KWCYVHTRSA-N 327.222 1.364 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CNCCO2)c(O)c1Br 2352620783 UETCRCPUBQRPCM-SNVBAGLBSA-N 329.194 1.068 10 10 EDCE Cc1ccc(Cn2cc(CCCN)nn2)c(O)c1Br 2352948958 WSAPOJKSATYTJW-UHFFFAOYSA-N 325.210 1.994 10 10 EDCE CC(=O)N[C@@H]1C(=O)c2ccccc2C(=O)[C@@H]1N1CCc2ccccc2C1 1459050 RGZYRNVATCVQPV-RBUKOAKNSA-N 348.402 1.997 10 10 EDCE Cc1nc(CN(C)CC(=O)N(C)Cc2ccc(N(C)C)cc2)no1 181710859 YHEOHAUSTUZNTO-UHFFFAOYSA-N 331.420 1.534 10 10 EDCE CCOCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 92126423 LEOJVGOMLIHMSF-UHFFFAOYSA-N 331.460 1.871 10 10 EDCE CC(C)(C)OC(=O)CNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 254998942 UGSWPVMCPQJDFX-TWGQIWQCSA-N 346.427 1.994 10 10 EDCE C[C@H]1CN(C[C@H]2CCCN2C(=O)c2cccc(O)c2O)C[C@@H](C)O1 251952333 XYUNKRGPYFHADS-HZSPNIEDSA-N 334.416 1.812 10 10 EDCE CO[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@@H]1C 276260336 MQOOCBUECGYMHO-HZMBPMFUSA-N 342.417 1.261 10 10 EDCE Cc1ccc(CNC(=O)c2c(C)[nH][nH]c2=N)c(O)c1Br 2380749087 LGGRGYFBWKDSLC-UHFFFAOYSA-N 339.193 1.837 10 10 EDCE COC[C@](C)(N)CC(=O)NCc1ccc(C)c(Br)c1O 2381127344 XAFKZOQHKBEHCJ-CQSZACIVSA-N 345.237 1.833 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)CS(=O)(=O)N(C)C 801548294 RJPOLYLPVIGLGM-UHFFFAOYSA-N 328.434 1.412 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CC34CC4)CC2)cc1 817525252 ZMTFBNRWDBCUAH-QGZVFWFLSA-N 329.444 1.734 10 10 EDCE CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)NCCc1ccc(N)cc1 841960114 VHDOOGQRAXHYQK-CVEARBPZSA-N 349.431 1.563 10 10 EDCE C[C@@H](O)[C@@H]1CN(C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 840281455 SZMGPRFNVUOEHE-ABAIWWIYSA-N 325.384 1.183 10 10 EDCE CC(=O)C(=O)COC(=O)C[C@@H]1CCC[C@H]1NC(=O)OC(C)(C)C 845380323 QEFQFAAQLLJUHQ-NWDGAFQWSA-N 327.377 1.771 10 10 EDCE COCCNCCNC(=O)NCc1cc(Br)ccc1O 841967706 GDLAGZKFFSEPMU-UHFFFAOYSA-N 346.225 1.190 10 10 EDCE C[C@@H](NC[C@H](O)CS(C)(=O)=O)c1cc2c(cc1O)CCCC2 927023864 JDQFVUVJFPCFKH-RISCZKNCSA-N 327.446 1.327 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@](C)(CO)C3CC3)C2)cc1 854300753 ZREFKNDNQGAINQ-KBXCAEBGSA-N 333.432 1.734 10 10 EDCE COCC1(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CCOCC1 855227517 XGBGLMVKMHSOCR-OAHLLOKOSA-N 348.443 1.833 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)c2cnc(O)n(C)c2=O)cc1 751570242 GAIGAPWHYVYTQW-UHFFFAOYSA-N 344.415 1.604 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCc3ccn(C)n3)C2)cc1 852254570 YSFWLPNKIDCURV-OAHLLOKOSA-N 343.431 1.549 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)NCCCSc2nccs2)CCO1 759601179 KPMOIZAMQNHOFR-JTQLQIEISA-N 345.446 1.209 10 10 EDCE COCCN(CC1CCN(C)CC1)C(=O)/C=C/c1ccc(O)c(O)c1 869762306 NCOIJENFAYDJTD-GQCTYLIASA-N 348.443 1.928 10 10 EDCE CNCCOCCN(C)C(=O)NCc1ccc(N2CCCC2)cc1 861556501 CODDCIXBFLZOPJ-UHFFFAOYSA-N 334.464 1.664 10 10 EDCE CCn1nccc1S(=O)(=O)N[C@H](C)c1cc(OC)ccc1O 770254013 PKRPPPQVQFEVSP-SNVBAGLBSA-N 325.390 1.657 10 10 EDCE Cc1cc(Br)c(O)c(CN2CC[C@H](S(N)(=O)=O)C2)c1 785984518 IAODNUDUYNRRHM-JTQLQIEISA-N 349.250 1.326 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@H](O)CCN1C(=O)OC(C)(C)C 1895875841 NVYKECABVYXLMB-MNOVXSKESA-N 327.385 1.516 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)CCC(F)F)nc12 796021905 XRZCPPMNAYHQFA-UHFFFAOYSA-N 343.286 1.700 10 10 EDCE C[C@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)C[C@]2(CCO[C@H](C)C2)O1 797418378 RZZCQGYPNKNSDE-PBXUPMNYSA-N 349.427 1.976 10 10 EDCE CCOc1ccc(N2CCN(c3nnnn3[C@H](C)COC)CC2)cc1 1340251867 IBLSKSFBPVCEKA-CQSZACIVSA-N 346.435 1.606 10 10 EDCE CC1=C(C(=O)NCc2c(O)cccc2O)[C@H](C)n2ncnc2N1C 1156885268 BPDSWDLWXAFJGE-JTQLQIEISA-N 329.360 1.291 10 10 EDCE [N-]=[N+]=NC[C@H]1CCCN1C[C@@H](O)CN1C(=O)c2ccccc2C1=O 1885288130 TWFDRNQAJKBYIS-VXGBXAGGSA-N 329.360 1.418 10 10 EDCE CC[C@@H](C)C(=O)N(C)CCNCc1nnnn1-c1ccc(OC)cc1 1317571724 VPWXBFSDNXJHGO-CYBMUJFWSA-N 346.435 1.265 10 10 EDCE CN(Cc1cncc(Br)c1)C(=O)c1cc(O)nc(O)c1 703042562 XTZOJHLZYCKKBG-UHFFFAOYSA-N 338.161 1.923 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CCc2ccn(C)n2)cc1C 1321868780 ZNLGDNJRNUMXBO-HNNXBMFYSA-N 344.459 1.964 10 10 EDCE CC[C@@H](NC(=O)C(=O)N(C)Cc1ccccc1O)[C@H]1CCCCO1 1261565488 FINRJEZZQVVNJR-GDBMZVCRSA-N 334.416 1.815 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCC[C@H]2CNCCO)cc1 1268293426 BVZSODLNBXKPJE-GXTWGEPZSA-N 333.392 1.329 10 10 EDCE C[C@@H](CNC(=O)[C@@H]1C[C@H]1C)NC(=O)c1ccc(N=NC(N)=O)cc1 1503206753 LOAZGWQGNNLZAA-GBIKHYSHSA-N 331.376 1.740 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C/c1cc([N+](=O)[O-])ccc1O 115880 OQHWEIDRXNFABU-XYOKQWHBSA-N 335.341 1.603 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@@H]1CCOC1 1526697886 HNLINCGMKIURLN-CMPLNLGQSA-N 347.375 1.120 10 10 EDCE CC[C@@H](F)C(=O)N(C)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1705346866 MWCNRIBEOQGSIL-CYBMUJFWSA-N 349.366 1.880 10 10 EDCE CCCOCC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1703124427 QNGXGGRKNUDQNA-UHFFFAOYSA-N 335.364 1.122 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1ccc2c(c1)C(=O)NCC2 1556138260 UXRHDOSFVKFIBI-UHFFFAOYSA-N 326.352 1.243 10 10 EDCE CN(C)CCn1nccc1NC(=O)c1ccc(N=NC(N)=O)cc1 1556812536 JLNAMRDRUFNBHR-UHFFFAOYSA-N 329.364 1.859 10 10 EDCE C=CC(=O)Nc1ccc(O)c(C(=O)NCc2c(O)cccc2O)c1 1652629021 SZLGQTXIEFVQMF-UHFFFAOYSA-N 328.324 1.858 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H](C)n2cncn2)cc1C 1662909716 WXPCMDJMGPKTGY-HUUCEWRRSA-N 345.447 1.841 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(Br)c1 2126153886 AVRXTJXJPKRRAT-DHPDLVEQSA-N 328.206 1.119 10 10 EDCE COc1ccc(N2CCN(CCCN[C@@H]3CCCOC3)CC2)cc1 162828433 CSBCQRBUJLXBJX-QGZVFWFLSA-N 333.476 1.976 10 10 EDCE C[C@H](O)CN(Cc1ccccc1)S(=O)(=O)Cc1ccc(N)cc1 1914629765 KKFGKURCGWEAEM-AWEZNQCLSA-N 334.441 1.982 10 10 EDCE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H](CO)NC(=O)OC(C)(C)C 1968793431 XCZMLDOPQJDXJX-DGCLKSJQSA-N 338.404 1.797 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)C[C@H]2CO)cc1Br 2136089145 XFYQCWKKMLWROW-DLOVCJGASA-N 329.238 1.791 10 10 EDCE CCNCc1ccc(N2CCNC(=O)CC2)cc1Br 233530318 SCIWHPSFROJNSX-UHFFFAOYSA-N 326.238 1.885 10 10 EDCE CCN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C1CN(C)C1 2146886741 RODOUDVVOQCKQG-ZDUSSCGKSA-N 340.221 1.575 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985103302 SOQZKAIWRSHDNJ-HBNTYKKESA-N 327.385 1.562 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@@H]1COC[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003167465 NWJFHFYGEXWHAK-FDYHWXHSSA-N 340.420 1.134 10 10 EDCE CCOc1cccc(CNC[C@@H](O)CNC(=O)OC(C)(C)C)c1O 2011422592 KDTZEPDHVPDLFQ-CYBMUJFWSA-N 340.420 1.766 10 10 EDCE C[C@H](N)c1ccc(N2CCN3C[C@@H](O)C[C@@H]3C2)c(Br)c1 405535604 ZPVVOVKNQDMIKG-UHTWSYAYSA-N 340.265 1.724 10 10 EDCE CN1C(=O)O[C@@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@H]21 2176933869 STPNPVJLNAOUTK-GHMZBOCLSA-N 345.168 1.929 10 10 EDCE CCOC(=O)Cc1cc(O)n2nc(C(C)C)c(C(=O)OCC)c2n1 2080924408 SSLMROVJGFYDTF-UHFFFAOYSA-N 335.360 1.841 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)cc1Br 2189048986 KHHDRGURKHHTMX-OZWUEAAUSA-N 341.249 1.912 10 10 EDCE C[C@H]1[C@H](NC(=O)C(F)(F)F)CCCN1C(=O)Cc1ccc(N)cc1 2044623784 YGQSACNMJDIRDN-GXFFZTMASA-N 343.349 1.869 10 10 EDCE Cn1ncc(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)c1CNC(=O)OC(C)(C)C 2060609201 SALUYEZTWOLZHQ-SNVBAGLBSA-N 349.395 1.970 10 10 EDCE Cn1cnc(CCNCc2cccc(O)c2O)c1Br 2088310229 DHSRWRITKOOUHB-UHFFFAOYSA-N 326.194 1.926 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](CO)C[C@H]2CO)c(Br)c1 2089862712 CEBRDCZIVFIULX-UMNHJUIQSA-N 329.238 1.648 10 10 EDCE O=S1(=O)C[C@H]2CCN(Cc3cc(Br)ccc3O)[C@H]2C1 2094883751 YXCJTKKEUZCVPJ-SKDRFNHKSA-N 346.246 1.774 10 10 EDCE NCc1ccc(N2CCC([C@@H](O)CO)CC2)c(Br)c1 2096154855 LQULRGTYPCDJMI-AWEZNQCLSA-N 329.238 1.477 10 10 EDCE CC(C)(C)OC(=O)N[C@H](COc1nnc(=N)[nH]n1)[C@H]1CC=CCC1 2213789464 IRNBUYKTXHJCMF-WDEREUQCSA-N 336.396 1.308 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CCOc2nnc(=N)[nH]n2)C(C)(C)C1 2216461110 DTAVBYSOOBQQRA-JTQLQIEISA-N 338.412 1.341 10 10 EDCE COc1ccc(N2C[C@H](N(C)C)[C@H](O)C2)c(OC)c1Br 2234892049 JRVPLYUCSFLBMY-WDEREUQCSA-N 345.237 1.577 10 10 EDCE Cn1cccc1C=C1SC(=S)N(NC(=O)c2ccncc2)C1=O 2296212876 GPZFYDHDUKLJCW-UHFFFAOYSA-N 344.421 1.966 10 10 EDCE CC(C)(C)OC(=O)Nc1ccc(COc2nnc(=N)[nH]n2)c(F)c1 2303210495 PZDXSFQUCPMSJR-UHFFFAOYSA-N 336.327 1.744 10 10 EDCE O=C1C(=Cc2cccc(O)c2)SC(=S)N1CCOCCO 2318684000 MBBQVYALKPIXBU-UHFFFAOYSA-N 325.411 1.602 10 10 EDCE COc1ccc(Br)c(CN(C)[C@@H]2CNC[C@H]2F)c1O 2343638330 BDRPEPZAILUFNB-GHMZBOCLSA-N 333.201 1.905 10 10 EDCE COc1ccc(N/C=C2\C(=O)NC(=O)N(C[C@H]3CCCO3)C2=O)cc1 103844486 KRFQNBVPPAIKLX-OZYJXZHSSA-N 345.355 1.248 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C[C@@H](O)COC[C@@H]1CCCO1 119427601 UIFOONYCICTPIF-CVEARBPZSA-N 336.432 1.508 10 10 EDCE Cc1ccc(O)c([C@H](C)NCCNS(=O)(=O)c2cccnc2)c1 186142116 ZRACLZSXXZHLHG-ZDUSSCGKSA-N 335.429 1.725 10 10 EDCE Cc1cc(CNC(=O)N(C)Cc2ccccc2O)nc(N(C)C)n1 191641540 OSLIKNASVAVIGV-UHFFFAOYSA-N 329.404 1.898 10 10 EDCE CNCc1ccc(N2C[C@H](C(N)=O)C3(CC3)C2)c(Br)c1 2370479918 MDBMXJIXFOUQIU-LLVKDONJSA-N 338.249 1.870 10 10 EDCE CCN(C(=O)N(C(C)=O)c1ccc(N)cc1)[C@H]1CCS(=O)(=O)C1 243385401 MJBVLOORRAMHOW-AWEZNQCLSA-N 339.417 1.251 10 10 EDCE Cc1noc(CCNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)n1 255005655 MBYLDTYGHUNUNI-DAXSKMNVSA-N 342.399 1.587 10 10 EDCE CN(Cc1ccccc1O)C(=O)N[C@@H]1CCN(C2CCOCC2)C1=O 365851105 HKVLSMSXSAMYGD-OAHLLOKOSA-N 347.415 1.314 10 10 EDCE c1nc([C@H]2COCCN2Cc2ccc(N3CCOCC3)cc2)no1 374829431 TZHQUBOPVGUJFC-MRXNPFEDSA-N 330.388 1.480 10 10 EDCE COC(=O)c1cc2ccccc2c(CN2C[C@H]3COC[C@@H](C2)O3)c1O 800864725 ZEHMNFTYZRONON-OKILXGFUSA-N 343.379 1.932 10 10 EDCE COCCOCCN(C)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 808145373 PSENECHUDGBWSJ-UHFFFAOYSA-N 325.321 1.025 10 10 EDCE COc1ccc(N2C[C@H](N)[C@H]3COC[C@H]32)c(OC)c1Br 2162633860 BZPJQMGOENOYNL-WCABBAIRSA-N 343.221 1.629 10 10 EDCE Cc1cc(C(=O)N2C[C@H]3COC[C@@H](C2)O3)c(C)n1-c1ccccn1 801142245 DFKLWNJQJPZQGI-GASCZTMLSA-N 327.384 1.729 10 10 EDCE CCN1CCN(c2ccc(CNC[C@@H](O)C(F)(F)F)cc2F)CC1 819033816 SNGJOFLQODURLE-OAHLLOKOSA-N 349.372 1.980 10 10 EDCE CCN(OC)C(=O)CNC(=O)NCc1ccc(N(C)C)c(F)c1 826020038 OLPFFFCPNOFMAD-UHFFFAOYSA-N 326.372 1.101 10 10 EDCE C[C@]1([C@H]2CCCN(Cc3cc4c(cc3O)OCO4)C2)COC(=O)N1 905708040 MPJWLMNYXUDCSE-YVEFUNNKSA-N 334.372 1.831 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](C)[C@H](CCN)C1 903736375 WKIGLLVZGGURSM-HUUCEWRRSA-N 347.459 1.574 10 10 EDCE COc1ccc(CN2CC[C@@H]2C(=O)NCc2ccc(O)cc2O)cc1 910944870 XWGDXEPGNQCRRT-QGZVFWFLSA-N 342.395 1.997 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@H]1CCCCNC1)c1ccc(N(C)C)cc1 842203917 YNRWVCGSNNMESE-ZFWWWQNUSA-N 332.448 1.188 10 10 EDCE S=C(NCCN1CCOCC1)NCc1ccc(N2CC=CC2)cc1 740633649 YIIIKZARWUUXMO-UHFFFAOYSA-N 346.500 1.359 10 10 EDCE C[C@H](NC(=O)N[C@H]1CCNC[C@H]1C)c1ccc(N2CCOCC2)cc1 841739976 CUIYTEZNUCYYOI-VKJFTORMSA-N 346.475 1.881 10 10 EDCE COC[C@@]1(C(=O)N(C)CCN(C)c2ccc(OC)cc2)CCOC1 844856385 IZGGWEVOHHDTHN-SFHVURJKSA-N 336.432 1.643 10 10 EDCE Cn1cnc(CCCNCc2ccc(N3CCOCC3)c(F)c2)n1 842737269 MDYFWICAVBJSPF-UHFFFAOYSA-N 333.411 1.513 10 10 EDCE COc1cccc(CN[C@@H]2CCN(c3ccc4nncn4n3)C2)c1O 858244641 YEKNBTYWXOONTO-CYBMUJFWSA-N 340.387 1.207 10 10 EDCE COC[C@]1(C)CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CCO1 858865670 LSTLJUYVRHKQRL-HNNXBMFYSA-N 326.349 1.854 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(c2ncns2)CC1 854814430 CZTHQMLZSLUFTC-RQOWECAXSA-N 332.385 1.311 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](N)COC(C)C)C2)cc1 851641506 NZLNUDBKSBFIPG-PBHICJAKSA-N 335.448 1.390 10 10 EDCE CC(C)NCc1ccc(N2C[C@H](O)C[C@H]2CO)cc1Br 698196422 GQIGVGPRRXGUBV-UONOGXRCSA-N 343.265 1.879 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCO[C@@H](CC(N)=O)C2)c1O 860016427 JUOACHSFDGWQGJ-LBPRGKRZSA-N 326.780 1.324 10 10 EDCE CN(C)c1ccc(CN2CCN(c3nccn(C)c3=O)CC2)cc1 769466605 NDBKHAOVSSINEY-UHFFFAOYSA-N 327.432 1.169 10 10 EDCE CC(=O)N1C[C@H]2C[C@H]1CN2Cc1c(O)cccc1Br 1877018899 POYHJTATYZPAFY-MNOVXSKESA-N 325.206 1.960 10 10 EDCE NC(=O)N1C[C@@H]2C[C@H]1CN2Cc1ccc(Br)cc1O 1877017822 UYXZKPWCQYRHNG-QWRGUYRKSA-N 326.194 1.492 10 10 EDCE CC(=O)N(C)c1ccc(NC(=O)NCCc2ccc(O)c(O)c2)cn1 1206628968 AWARMTSCWXQMPT-UHFFFAOYSA-N 344.371 1.840 10 10 EDCE CCOc1cccc(CNC[C@H]2CCCCN2S(C)(=O)=O)c1O 796514285 XLTQFQAPAASQNP-CQSZACIVSA-N 342.461 1.695 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@H](C)CC(N)=O)C2)cc1C 1317118343 RPNOJJKTKYWQMX-YUELXQCFSA-N 333.432 1.252 10 10 EDCE O=C(CCc1nc(-c2ncccn2)no1)NCc1c(O)cccc1O 1178910963 JDWDXAMZWPOUDJ-UHFFFAOYSA-N 341.327 1.187 10 10 EDCE Cn1cc(Br)c(C(=O)NCCOc2ccc(N)cc2)n1 693084639 QPGWYAWHBYLHFX-UHFFFAOYSA-N 339.193 1.574 10 10 EDCE C[C@@H]1[C@H](O)CCCN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1331667649 WRUKSXTVZWKVHJ-RHSMWYFYSA-N 343.427 1.051 10 10 EDCE CN(C(=O)c1ccc(N=NC(N)=O)cc1)C1CN(C(=O)CCCF)C1 1358736464 BOCAUKJBJYNFFS-UHFFFAOYSA-N 349.366 1.882 10 10 EDCE CCOC(=O)c1cnc(C)c(C(=O)NCc2cc(O)ccc2O)c1 1455356535 JBKNJTGUYITQTP-UHFFFAOYSA-N 330.340 1.908 10 10 EDCE Cc1ccc(O)c(CNC(=O)Cn2c(=O)nc(O)c3ccccc32)c1 1472599807 JTGIKZKAPJEGLF-UHFFFAOYSA-N 339.351 1.433 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NCc2nc(N)n[nH]2)cc1F 1471100841 JDVIXFSBZWYUEB-UHFFFAOYSA-N 335.387 1.372 10 10 EDCE OCc1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)c(Br)c1 2121593422 QACIMTBRRUHZEC-WDMOLILDSA-N 328.206 1.385 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)[C@H](c1cncn1C)N(C)C 1627689140 JYXPTMNNHHNGFO-KRWDZBQOSA-N 329.448 1.714 10 10 EDCE CS(=O)(=O)C[C@H]1CCCCN1C(=O)Cc1ccc(O)c(O)c1 1637085985 YEPQJYPJOHCDJR-GFCCVEGCSA-N 327.402 1.066 10 10 EDCE C[C@H]1OCC[C@]12CN(C(=O)c1ccc(N=NC(N)=O)cc1)CCO2 1568618810 OAPPQYYREALMAM-BZNIZROVSA-N 332.360 1.869 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H]2CN(C)CCO2)cc1C 1732834477 XHURGCYHSIMPMU-WRFKIARRSA-N 347.459 1.096 10 10 EDCE O=C(CNC(=O)c1cccc(Cl)c1)NCc1ccc(O)cc1O 1570462270 LYKNPCNPGBUPNI-UHFFFAOYSA-N 334.759 1.797 10 10 EDCE O=C(CNC(=O)c1c(F)ccc(O)c1O)NCCc1ccccc1 1650717626 WPRTZPBSZWUWOT-UHFFFAOYSA-N 332.331 1.326 10 10 EDCE Cc1nc(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)n[nH]1 1682987066 WHHJOJRMFXSWBO-UHFFFAOYSA-N 344.419 1.074 10 10 EDCE CCOC(OCC)[C@@H](C)NC(=O)NCc1ccc(OC)cc1O 1684869173 IQCYYGBNUOLXDA-LLVKDONJSA-N 326.393 1.988 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2CCC(=O)N2C)cc1C 1690857743 MNJNALHJXDATIG-HOCLYGCPSA-N 347.459 1.609 10 10 EDCE COc1ccc(OC)c(/C=C2\SC(=S)N(CCO)C2=O)c1 16904858 FOSAJQWUPSWTPD-WQLSENKSSA-N 325.411 1.897 10 10 EDCE C[C@@H](O)[C@@H](C(=O)O)N1C(=O)/C(=C\c2cccc(F)c2)SC1=S 1858592289 MCNIRAFVAUGWKE-QEXLZLQKSA-N 341.385 1.861 10 10 EDCE CCC[C@@H](N)C(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 1866017623 JXFMCQTZPHKLAK-HZPDHXFCSA-N 329.448 1.819 10 10 EDCE Cc1cc(=O)c(O[C@@H](C)C(N)=O)cn1CCCOc1ccc(N)cc1 1857916851 PNIOUPIABCVVHQ-ZDUSSCGKSA-N 345.399 1.461 10 10 EDCE Cc1c(OCC(=O)c2ccc(O)c(O)c2)c(=O)ccn1[C@H](C)C(=O)O 1857918679 CRJDLUYZMNCPSZ-SNVBAGLBSA-N 347.323 1.475 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1912189655 VXJIKFCGPLOIGS-SSDOTTSWSA-N 349.214 1.646 10 10 EDCE CN(C)CCN(CC(=O)NCCCN=[N+]=[N-])C(=O)OC(C)(C)C 1985094834 UZACFTAXVUMFJD-UHFFFAOYSA-N 328.417 1.602 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@]1(C)C(=O)NCCCN=[N+]=[N-] 1993373053 SOPIFXMEZPXSPL-CQSZACIVSA-N 327.385 1.829 10 10 EDCE Cn1cc([C@H](NC(=O)OC(C)(C)C)[C@H](N)c2ccccc2O)nn1 2001804801 TZJWRVUGSVXHBY-KGLIPLIRSA-N 333.392 1.787 10 10 EDCE CC(C)N(CC(N)=O)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 705751119 PKQIAVQUOLEGMI-GFCCVEGCSA-N 341.209 1.101 10 10 EDCE CCNCc1ccc(N2CCN(C)[C@H](CO)C2)c(Br)c1 687619081 YANCWXJCKDNYGF-ZDUSSCGKSA-N 342.281 1.671 10 10 EDCE CCNCc1ccc(N2CCC[C@@H]2[C@H](O)CO)c(Br)c1 2179798994 MPNIIHZEYAZRPQ-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE C[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C[C@H]1NC(=O)C(F)(F)F 2044625750 YWFZLKNZZWRZJZ-ZWNOBZJWSA-N 343.349 1.727 10 10 EDCE O=S1(=O)C[C@H]2C(NCc3ccc(Br)cc3O)[C@@H]2C1 2054272648 JHVFUAUUQXQOEX-NXEZZACHSA-N 332.219 1.287 10 10 EDCE Cc1ccc(CNCC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c(O)c1 2084071508 FSWONQVYQBCCKW-UHFFFAOYSA-N 349.431 1.513 10 10 EDCE NCc1ccc(N2CCOCCC23COC3)cc1Br 2109836794 QCTFRFXBNRYAMG-UHFFFAOYSA-N 327.222 1.904 10 10 EDCE CN(C)C[C@H]1CN(c2ccc(CN)c(Br)c2)CCO1 2113978850 ARODJACLKLCEFP-ZDUSSCGKSA-N 328.254 1.675 10 10 EDCE O=C(O)CC[C@@H](C(=O)O)N1C(=O)C(=Cc2ccco2)SC1=S 2293223793 PYTVVQHHLPUAGB-QMMMGPOBSA-N 341.366 1.799 10 10 EDCE CCCNCc1ccc(N2CC[C@@H]2[C@H](O)CO)c(Br)c1 2286214828 PRIYPNXCYRGAKE-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE C[C@@H](C(=O)O)N(Cc1ccccc1)C(=O)c1cc(O)c(O)c(O)c1 2302874504 XOKDDPCZHIXEKG-JTQLQIEISA-N 331.324 1.919 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 2300529485 AUGTWELSQSXGID-JTQLQIEISA-N 345.375 1.465 10 10 EDCE O=C1NC(=S)NC(=O)C1=CN[C@H](c1ccccc1)c1ccco1 52528989 XGIBASOMEXXXEN-CYBMUJFWSA-N 327.365 1.373 10 10 EDCE C[C@H]1CC[C@@H](C(N)=O)CN1c1ccc(CN)c(Br)c1 228150171 YRYTZAKKTYWHBX-GXSJLCMTSA-N 326.238 1.998 10 10 EDCE CNCc1ccc(N2C[C@@H](C(N)=O)C3(CC3)C2)cc1Br 2370421728 WSQHTYGWYWYWOZ-LBPRGKRZSA-N 338.249 1.870 10 10 EDCE CCOCCN1CCN(Cc2cc(OC)c(OC)cc2O)C[C@H]1C 245512515 ACKVMDBBXMFOSO-CQSZACIVSA-N 338.448 1.952 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@@H]4C[C@H]5C[C@H]4[C@H]3[C@H]5O)ccc21 249546551 KGAFLKUVSBOEEQ-KWWJQKEASA-N 341.455 1.980 10 10 EDCE CCOC(=O)C[C@H](O)CNCc1ccc(C)c(Br)c1O 2380738867 CMFYMASRXGVPQN-NSHDSACASA-N 346.221 1.867 10 10 EDCE Cn1ncc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)n1 804969466 QFEOEWHXIFUCHY-UHFFFAOYSA-N 346.460 1.368 10 10 EDCE COc1ccc(N2CCN(CCNCc3conc3C)CC2)cc1 293462373 DFKRUOWYKABXJO-UHFFFAOYSA-N 330.432 1.903 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)[C@H](OC)C2)cc1Br 396076765 YCQTXWLGIZIGPS-CUOATXAZSA-N 329.238 1.925 10 10 EDCE CCO[C@@H]1C[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)[C@@H]1n1cccn1 819397463 KEIRMNIIRBOCQU-KCVFFKOLSA-N 343.383 1.842 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)Nn3c(O)nnc3O)c2C)c1 820287610 ABIOZKHIHIBTNW-UHFFFAOYSA-N 327.344 1.789 10 10 EDCE C[C@H]1COC2(CCC2)CN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 826707128 QEZNYMFNWIBWFN-AWEZNQCLSA-N 345.443 1.539 10 10 EDCE CC(=O)N(C)c1ccccc1NC(=O)C(=O)NCc1ccccc1O 737168501 UOBBZLHDIYRALG-UHFFFAOYSA-N 341.367 1.630 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1CC(=O)N(CC(F)(F)F)C1 588407032 MQHHMQBZVJDPEL-GQPNGRKGSA-N 344.289 1.390 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1cc(C[C@H]2CCNC2)nn1 900605644 URALRNZGIWXCBF-MRXNPFEDSA-N 327.432 1.315 10 10 EDCE COCC(=O)NC1CCN(C/C=C\c2ccc(N(C)C)cc2)CC1 835026685 ZQLMIQKSSCFPJY-PLNGDYQASA-N 331.460 1.993 10 10 EDCE Cc1cc(CC(=O)N(C)C2CS(=O)(=O)C2)c(C)n1-c1ccccc1 913134290 KJTZVBNZPMLEKL-UHFFFAOYSA-N 346.452 1.892 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C\c1ccnn1-c1ccccn1 843269092 NEWSESQUWHOZQN-QBFSEMIESA-N 341.396 1.570 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3C[C@@]34CCCNC4)C2)cc1 851639095 AWGRDEYUGWFERJ-UCLAIMLFSA-N 329.444 1.780 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc(C(C)(C)N)no3)C2)cc1 852900827 SNOCLXWVZJCCTI-LBPRGKRZSA-N 344.415 1.886 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(C)(C)S(C)(=O)=O)C2)cc1 855231155 KXDMRZDZEYMIDD-GFCCVEGCSA-N 340.445 1.213 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@](C)(C3CC3)C2)cc1 852322113 BQOZUXYUVNIYKC-IBGZPJMESA-N 331.460 1.870 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cc(S(C)(=O)=O)oc2C)c1 860242226 RLBXUSVVDFAFPA-UHFFFAOYSA-N 339.369 1.636 10 10 EDCE C[C@@H]1CN(Cc2cc(F)c(N(C)C)cc2F)CCN1S(C)(=O)=O 862415170 ATMULHRDRPEPIE-LLVKDONJSA-N 347.431 1.497 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F 867301865 GZLYJVGILNAVHJ-CKLFPEKLSA-N 349.305 1.491 10 10 EDCE Cc1cc(Br)c(O)c(CNC[C@@]2(O)CCN(C)C2)c1 762567138 AUGBZYOVMVGWDS-AWEZNQCLSA-N 329.238 1.619 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)NCc1ccc2c(c1)CCCO2 1876257520 WDYQSMDSNQLMBN-OAHLLOKOSA-N 336.432 1.987 10 10 EDCE CN1CCN(c2ccc(CN3CC(F)(F)C[C@@H]3CO)cc2)CC1 783703354 XZUUXXFCUDWQTQ-MRXNPFEDSA-N 325.403 1.640 10 10 EDCE C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1895876591 WNSVNQYHRFIRSO-GXSJLCMTSA-N 325.369 1.532 10 10 EDCE COCCNC(=O)CN(C)Cc1cc(Br)ccc1O 133128068 VAHQSDQPVVVFDY-UHFFFAOYSA-N 331.210 1.349 10 10 EDCE Cn1nc(Br)cc1C(=O)NCc1c(O)cccc1O 1304053751 ROQRYIHNDFHYOR-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2c[nH]c(C)cc2=O)cc1C 1317278282 ZMMNZSABFQMJOW-AWEZNQCLSA-N 343.427 1.908 10 10 EDCE CCS(=O)(=O)Nc1ccc(NS(=O)(=O)CC(F)F)cc1 695092494 ILNBQUFGUSLJDU-UHFFFAOYSA-N 328.362 1.455 10 10 EDCE CCNCc1ccc(N2CCN(C)C[C@@H]2CO)c(Br)c1 699460432 YJZBWIDILFLAGY-CYBMUJFWSA-N 342.281 1.671 10 10 EDCE Cn1nccc1[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 1558599933 LKMKHKGJSGVUSX-AWEZNQCLSA-N 342.359 1.796 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)CCc3nc[nH]n3)C2)cc1C 1713156689 KDBZPGDFXCLYIQ-SHTZXODSSA-N 343.431 1.491 10 10 EDCE CCCC1=NN(c2ccc(F)cc2)C(=O)/C1=C\NN1CCN(C)CC1 12410876 DMOYRGUHRVNDEO-SSZFMOIBSA-N 345.422 1.964 10 10 EDCE COC(=O)CN1C(=S)N(C)C(=O)/C1=C\c1ccc(N(C)C)cc1 18155246 HTIZEHSKRFAOFL-UKTHLTGXSA-N 333.413 1.325 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@@](F)(CO)C3)c(Br)cc21 1917073746 JCWCODFZCIZMEV-YPMHNXCESA-N 344.184 1.312 10 10 EDCE CC(=O)N1CCN(c2ccc(CN)c(Br)c2F)CC1 231838793 LSUGAZWGPWLUNL-UHFFFAOYSA-N 330.201 1.715 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NCc2c(O)cccc2F)[C@H](O)C1 1985827617 NKYRPSGXSJPTRN-GXTWGEPZSA-N 326.368 1.601 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CC(N=[N+]=[N-])C3)O2)C1 2025156077 LCWOSKGQJDUENL-NSHDSACASA-N 337.380 1.676 10 10 EDCE CCN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)C(C)(C)CO 688322741 WLZYYYOFJYNUOD-LBPRGKRZSA-N 342.237 1.998 10 10 EDCE CN(C)C[C@H]1CN(Cc2c(O)cccc2Br)CCO1 862211378 HBFFEIIWJXNPAK-NSHDSACASA-N 329.238 1.917 10 10 EDCE CC1(C)NC(=O)N(CC(=O)NCc2c(O)ccc3ccccc23)C1=O 1652706332 ZYLCPXCONFGDHH-UHFFFAOYSA-N 341.367 1.492 10 10 EDCE CN(c1ccc(N)cc1)C(=O)[C@H]1C[C@@](O)(CNC(=O)OC(C)(C)C)C1 2080903497 GMAYKXBRNRSTBB-KSMLVUNXSA-N 349.431 1.897 10 10 EDCE O=S1(=O)C[C@@H]2CN(c3ccc(CO)c(Br)c3)C[C@H]2C1 2087855647 FDHKDMCQJGQOCR-QWRGUYRKSA-N 346.246 1.422 10 10 EDCE Nc1ccc(CS(=O)(=O)N2CCCC[C@H]2C2OCCO2)cc1 2089563278 NYTOXHMJEZEBKL-AWEZNQCLSA-N 326.418 1.326 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@@]1(COc1nnc(=N)[nH]n1)C2 2213784174 YWHCVVCOVMLLBL-FTGAXOIBSA-N 336.396 1.141 10 10 EDCE C[C@H](NCc1nn(C)nc1Br)c1cc(O)ccc1O 2226970785 UUVBOVXLBMEVPD-ZETCQYMHSA-N 327.182 1.840 10 10 EDCE CO[C@H]1CCN(CCNCc2ccc(Br)cc2O)C1 2267900729 QOVIUYWKOVRGBC-ZDUSSCGKSA-N 329.238 1.965 10 10 EDCE Cc1c(C=C2SC(=S)NC2=O)c(=O)n(-c2ccccc2)n1C 2293091941 IJVPHSPNEPWLQS-UHFFFAOYSA-N 331.422 1.973 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2298023629 CXXCWAVJCIRJQV-GRYCIOLGSA-N 340.428 1.789 10 10 EDCE NCC[C@@H](COCc1ccccc1)NC(=O)c1ccc(O)c(O)c1 2303741858 KJBFBERUQCHMBX-HNNXBMFYSA-N 330.384 1.762 10 10 EDCE COC(=O)C=Cc1ccc(N(C)C[C@H](C)c2nn[nH]n2)c([N+](=O)[O-])c1 2308960874 SWZUKVBFKIVYPF-JTQLQIEISA-N 346.347 1.534 10 10 EDCE O=C1NC(=S)N(c2ccccc2)C(=O)C1=Cc1ccc([N+](=O)[O-])[nH]1 2313577416 RHFSXVINAAKCJK-UHFFFAOYSA-N 342.336 1.754 10 10 EDCE CCOc1cccc(/C=C2\SC(NCCC(=O)O)=NC2=O)c1O 6539378 NVBZKMSWWLTMMM-FLIBITNWSA-N 336.369 1.826 10 10 EDCE CCCCN/C=C1\C(=O)NC(=O)N(c2ccc(OCC)cc2)C1=O 103773602 UELVVGGZXGFUHN-SDNWHVSQSA-N 331.372 1.942 10 10 EDCE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](C)NC(N)=O 175841480 KYQQMMNMNAOTLD-MRVPVSSYSA-N 344.209 1.560 10 10 EDCE CC(C)N1C[C@H](C(=O)NCc2ccc3c(c2)CCCN3C)CC1=O 69950717 QSQNGYIINWCPQW-MRXNPFEDSA-N 329.444 1.942 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)cc1Br 2357057957 GTYRXKYPZQGHPF-UQOMUDLDSA-N 341.249 1.631 10 10 EDCE C[C@@H](O)CNCC(C)(C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1275750636 JXHRJZVNSQTSMH-GFCCVEGCSA-N 349.435 1.918 10 10 EDCE COCCN1[C@H](C)CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@H]1C 181253067 BJQPOOMQPXHRLF-VTGPQGOBSA-N 334.416 1.679 10 10 EDCE CN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1ccc(F)c(F)c1 56226871 RIKPWGRSZWFSCO-DAXSKMNVSA-N 335.310 1.038 10 10 EDCE Cc1cc(C)cc(N(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c1 65861309 ZKYZIOUFBKQXAP-VOTSOKGWSA-N 327.384 1.377 10 10 EDCE Cc1ccc(CN(C)CCN2CCNCC2)c(O)c1Br 2380798508 PUMBNAPTZFDUAZ-UHFFFAOYSA-N 342.281 1.800 10 10 EDCE CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)OCC(=O)C(C)=O 808502656 NUIHIJBABVJNML-AWEZNQCLSA-N 347.367 1.391 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 808495139 HYIXOUDIFCJFEE-UHFFFAOYSA-N 334.328 1.900 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1CCN[C@H]2COC[C@@H]21 2132578372 DIHPVDVHHFKFHU-RYUDHWBXSA-N 347.640 1.981 10 10 EDCE Cn1cccc(C(=O)NCc2ccc(N3CCSCC3)cc2)c1=O 729285764 MEHPCKJVIIVAIZ-UHFFFAOYSA-N 343.452 1.869 10 10 EDCE CS[C@H]1CC[C@@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 822455348 DLJXVVAMABXUOC-HOTGVXAUSA-N 340.514 1.905 10 10 EDCE CO[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@H]1C 839219852 VDMUSQLOTFHQFX-PBHICJAKSA-N 347.459 1.594 10 10 EDCE CN(C)c1ccc(/C=C\CN(C)[C@@H]2CCN(S(C)(=O)=O)C2)cc1 835055482 KSLDFSWOSYWELQ-KEGWNNHHSA-N 337.489 1.732 10 10 EDCE NCCc1ccccc1C(=O)NCc1ccc(N2CCOCC2)cc1 846673942 YDDZXLWHFKASJM-UHFFFAOYSA-N 339.439 1.954 10 10 EDCE COC(=O)c1cncnc1N[C@@H]1CCN(c2ccc(OC)cc2)C1 853761734 VSCMHVJDSCOGMT-GFCCVEGCSA-N 328.372 1.963 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCC3CCNCC3)C2)cc1 851668586 GXONNKHHTMGFCZ-MRXNPFEDSA-N 346.475 1.963 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3=CCN(C)CC3)C2)cc1 854298613 GTGDSOHDXSHZCG-MRXNPFEDSA-N 344.459 1.835 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCS(=O)(=O)C1 935945581 CTFGSKJOZWEZFN-LLVKDONJSA-N 332.418 1.319 10 10 EDCE CC(=O)N1CCC[C@@H]1C(=O)NCc1cc(Br)ccc1O 868306986 KLWQJILELDAYEE-GFCCVEGCSA-N 341.205 1.782 10 10 EDCE Cc1oc(S(C)(=O)=O)cc1C(=O)NCCc1ccc(O)c(O)c1 860234761 IUDAJHYUTCHWSA-UHFFFAOYSA-N 339.369 1.375 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(-c2nc(-c3cscn3)no2)c1 788475349 GXPVOQGHGOTJOL-UHFFFAOYSA-N 338.370 1.937 10 10 EDCE CCOCCOCCN(C)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 786816023 AGHLATBGNSZRAQ-UHFFFAOYSA-N 339.348 1.415 10 10 EDCE CS(=O)(=O)N1CCCC[C@@H]1CNCc1cc2c(cc1O)OCO2 796514051 UUTBZYADRSKSFY-GFCCVEGCSA-N 342.417 1.025 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)/C=C\c2ccco2)cc1C 1320186126 KPCHNBZZXYBCPG-QKIRZYONSA-N 344.411 1.877 10 10 EDCE COC(=O)C1(O)CN(c2ccc([C@H](C)O)c(Br)c2)C1 714487869 LAJADIYVMZEUCW-QMMMGPOBSA-N 330.178 1.227 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@]12CCC[C@@H]1C2 1333314700 SPUJFQNWOPQPCU-BEFAXECRSA-N 329.444 1.984 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(O)(CN2CCCCC2)CC1 1606961419 SAMBUQJBDJBIPI-UHFFFAOYSA-N 348.443 1.480 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccc(N2CCOCC2)nc1 1472064463 XTTNSKDQQXDODI-UHFFFAOYSA-N 329.356 1.259 10 10 EDCE Oc1ccc(Br)cc1CN[C@@]12CC[C@@H](C1)[C@H](O)[C@@H]2O 2120389880 XGGWOFUYXCWYJK-GZBPVQSJSA-N 328.206 1.519 10 10 EDCE CN1C(=O)O[C@@H]2CN(Cc3cccc(Br)c3O)C[C@@H]21 2120401619 MQNLPOCDWDKDQV-WDEREUQCSA-N 327.178 1.790 10 10 EDCE COCC[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)C(=O)OC 1629193463 HHNMNWGZDXQHJU-SECBINFHSA-N 339.369 1.620 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cnn(C)c2-n2cnnc2)cc1F 1625952382 ZRMBOTPLMDJROJ-UHFFFAOYSA-N 343.366 1.136 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)c2cnn(C)n2)cc1C 1725117577 XCRDAAPFEFXDJX-OLZOCXBDSA-N 331.420 1.429 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCN2CCCC2=O)cc1C 1731641702 VCYBKQKHJMJHHR-HNNXBMFYSA-N 347.459 1.610 10 10 EDCE CO[C@H](C)CC(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1579747152 ALQYEGWIWDQPEC-WDEREUQCSA-N 349.391 1.509 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@H]2CCC(=O)NC2)cc1C 1734332406 UGKQLWDPRUVTPU-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE NS(=O)(=O)c1cccc2c1CCN(C(=O)c1cc(O)cs1)C2 1588137887 SNEROBHIPFNMHC-UHFFFAOYSA-N 338.410 1.300 10 10 EDCE CCOc1ccccc1C(=O)NCC(=O)NCc1cc(O)ccc1O 1651222746 OMAJLIXYMCGACG-UHFFFAOYSA-N 344.367 1.543 10 10 EDCE COCCCN1CC(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1665363381 YAQILCNMVGTMLG-UHFFFAOYSA-N 333.392 1.547 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2CC(=O)N(C)C2)cc1C 1662924254 FVRARFCUGWTSSG-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE COc1cccc(CNC(=O)NCCC(C)(C)S(C)(=O)=O)c1O 1686819104 WCZDFLFIQVQUEM-UHFFFAOYSA-N 344.433 1.413 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@]23COC[C@@H]2C3)cc1C 1699512015 IALOFCPFJLJVHA-LPHOPBHVSA-N 332.444 1.978 10 10 EDCE O=C1C(=O)c2c(ccc3c2CCC[C@@]3(O)CO)-c2occ(CO)c21 110135655 YTHYRTDSBSMJLI-GOSISDBHSA-N 328.320 1.334 10 10 EDCE biogenic COCCNC(=O)[C@H](C)NCc1cccc(Br)c1O 228996921 QICUGPBFKFYXSB-VIFPVBQESA-N 331.210 1.395 10 10 EDCE NCc1ccc(N2CC[C@]3(C[C@H](O)CO3)C2)cc1Br 2137138899 UNBGOJXXVTZSNL-JSGCOSHPSA-N 327.222 1.638 10 10 EDCE CCOC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985101133 OENUOTZRKSLSFD-MNOVXSKESA-N 327.385 1.827 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N3CC(CO)C3)c(Br)cc21 2148953603 OGJVPSUAQKRZAI-CYBMUJFWSA-N 340.221 1.480 10 10 EDCE COc1cccc(O)c1CNC1(CNC(=O)OC(C)(C)C)COC1 1997932118 HRFSTAUFZPPAMK-UHFFFAOYSA-N 338.404 1.784 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCN1CC(=O)Nc1ccc(N)cc1 1999465627 WRMFCAQUVYGOTB-AWEZNQCLSA-N 334.420 1.806 10 10 EDCE C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003168960 YENLLBFTHDLUPE-MNXVOIDGSA-N 340.420 1.276 10 10 EDCE CC[C@@H](NCC(CO)(CO)CO)c1cc(Br)ccc1O 2179802173 DIYZOXWRJPXVRV-GFCCVEGCSA-N 348.237 1.159 10 10 EDCE COC(=O)c1cnn(Cc2cc(Br)ccc2O)c1N 2070449452 XMVJIBNKRJDIER-UHFFFAOYSA-N 326.150 1.768 10 10 EDCE NCc1cc(F)c(N2CCN3C(=O)OC[C@H]3C2)cc1Br 2170716489 HKRBFCFLIDCUFV-SECBINFHSA-N 344.184 1.688 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)c(Br)c1 2190456235 GBLSXPWNIMXTCR-HPEDKQMDSA-N 341.249 1.631 10 10 EDCE C[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(C(=O)Cc2ccc(N)cc2)C1 2044641641 MXSQNQRNCBFMIR-GWCFXTLKSA-N 343.349 1.727 10 10 EDCE NCc1cc(F)c(N2C[C@H](CO)C[C@@H](CO)C2)cc1Br 2236646097 TYMIOJVGSAHYGI-NXEZZACHSA-N 347.228 1.474 10 10 EDCE CC[C@H](C)NCc1ccc(N2C[C@H](O)[C@@H](O)C2)c(Br)c1 2240040832 VDMUGIQOADDXMF-LKTVYLICSA-N 343.265 1.879 10 10 EDCE O=C(N[C@@H](CCO)COCc1ccccc1)c1cc(O)nc(O)c1 2303555827 UYCWLNAECZPNHP-AWEZNQCLSA-N 332.356 1.190 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CNS(C)(=O)=O 57042221 GSOYFNGZFBJGDD-UHFFFAOYSA-N 339.461 1.185 10 10 EDCE CSc1ncc(CNC(=O)N2CC(SC)(C(=O)O)C2)s1 2362139845 ZBOOLPRLXDXXQY-UHFFFAOYSA-N 333.460 1.577 10 10 EDCE O=[N+]([O-])c1cc(Cl)cc(CN2CCO[C@]3(CCOC3)C2)c1O 187537815 XYYGKIGGZVJIGI-CQSZACIVSA-N 328.752 1.945 10 10 EDCE CCn1cc([N+](=O)[O-])c(C(=O)NCc2ccc(N(C)C)c(F)c2)n1 191581478 FYXHFUJPJQDFTD-UHFFFAOYSA-N 335.339 1.946 10 10 EDCE CCNC(=O)N1CCN(c2ccc(CO)cc2Br)CC1 721632809 NFVUTFNGPBYBGM-UHFFFAOYSA-N 342.237 1.793 10 10 EDCE CCn1ncc(/C=C2\OCCn3c2nc(Br)c3C=O)n1 901573816 BYAAXAQPJZIOKG-YHYXMXQVSA-N 338.165 1.598 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@H](N)C(F)(F)F)C2)cc1 831752804 FBBOAMCPQHDQBY-GWCFXTLKSA-N 331.338 1.527 10 10 EDCE C[C@@H](O)[C@@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 840259868 SWBOHGCSHVYHKI-PBHICJAKSA-N 333.432 1.578 10 10 EDCE CCON(C)C(=O)CNC(=O)NCc1ccc(N2CC=CC2)cc1 845001817 DXBDZRGIKDUVFE-UHFFFAOYSA-N 332.404 1.272 10 10 EDCE Cc1cc(Cl)cc([C@@H](C)NCC[C@H]2CNCCS2(=O)=O)c1O 925788996 NBYQFKZEKJRORG-YPMHNXCESA-N 346.880 1.781 10 10 EDCE C[C@H](NC(=O)NCc1c(O)cccc1F)C1(S(C)(=O)=O)CC1 922438765 XJQDCUIPROLMQM-VIFPVBQESA-N 330.381 1.296 10 10 EDCE C[C@@H](NC(=O)NC[C@H](O)c1ccnn1C)c1ccc(N(C)C)cc1 922053986 HWAKCBHFHPNZLC-WBMJQRKESA-N 331.420 1.580 10 10 EDCE Cn1nnnc1CCNCc1ccc(OCc2ccccc2)cc1O 753570198 IPJLIBITAYEFRT-UHFFFAOYSA-N 339.399 1.827 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCC[C@@H](N2CCOCC2)C1 930602141 YUIRNJRLIBWSNL-HXUWFJFHSA-N 345.487 1.820 10 10 EDCE O=C1OC[C@]2(CNCc3ccc4ccccc4c3O)COCCN12 872261135 JKULCVPVZQUNBE-SFHVURJKSA-N 328.368 1.856 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@H](O)Cc2cnn(C)c2)cc1 786708435 OXCISIDJIBHBMY-GOSISDBHSA-N 344.459 1.828 10 10 EDCE C[C@@H]1COC[C@H](C(=O)N(C)CCN=[N+]=[N-])N1C(=O)OC(C)(C)C 1895874714 BQWJCUZJCVRMSH-GHMZBOCLSA-N 327.385 1.780 10 10 EDCE COc1ccc(CNC(=O)[C@@H](C)Oc2cccc(CO)c2)c(O)c1 794380303 XQHHKJRYQHTLKW-GFCCVEGCSA-N 331.368 1.977 10 10 EDCE C[C@@H]1CO[C@@H](C(F)(F)F)CN1Cc1cc2c(cc1O)OC[C@@H]2O 795688685 DMDAWJJLNNMVLQ-CWONEXCFSA-N 333.306 1.970 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccc(C(=O)NC2CC2)cc1 1142533834 SIIJYWMKHJTXTO-UHFFFAOYSA-N 326.352 1.920 10 10 EDCE COc1ccc(N2CCN(C(=O)COc3ccsn3)CC2)cc1 1150068554 FGTRPMGZPAXVJQ-UHFFFAOYSA-N 333.413 1.879 10 10 EDCE CCS(=O)(=O)CCCNC(=O)NCc1ccc(OC)cc1O 1230079698 AYDNJXQYAZAVOO-UHFFFAOYSA-N 330.406 1.025 10 10 EDCE COc1ccc(-n2nnnc2CN[C@@H](C)CNC(=O)CC(C)C)cc1 1317224009 JGLJLYJLGXSICU-ZDUSSCGKSA-N 346.435 1.311 10 10 EDCE Cn1nnnc1CCNCc1cc(Cl)cc(Br)c1O 2119299029 QUMCMXDJGJKBPE-UHFFFAOYSA-N 346.616 1.664 10 10 EDCE Cc1nc(O)nc(O)c1CCC(=O)NCc1cccc(Cl)c1O 1472316324 NBHPUZTZZUFYLB-UHFFFAOYSA-N 337.763 1.804 10 10 EDCE Cc1ccc2ncc(C(=O)NCc3cccc(O)c3O)c(=O)n2c1 1471644571 VKKIDWCKUGAEBY-UHFFFAOYSA-N 325.324 1.344 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cn2cncn2)cc1C 1715901292 GPGUDLDTAYHDCL-ONEGZZNKSA-N 329.404 1.057 10 10 EDCE Cc1nnnn1-c1cc(NC(=O)Cc2ccc(O)c(O)c2)ccc1F 1626696172 WBZRWMAYFVOJJL-UHFFFAOYSA-N 343.318 1.702 10 10 EDCE COc1ccc(-n2nnnc2CNCC[C@H]2CCN(C(C)=O)C2)cc1 1484504316 ZBLLPGRTOGRORF-AWEZNQCLSA-N 344.419 1.019 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)OCC 1624658729 JOGRLBRITBWCBK-LBPRGKRZSA-N 339.388 1.503 10 10 EDCE Cn1nc(C(=O)NCc2cccc(Br)c2O)cc1O 1556480338 MSSTZDBEEIGZAQ-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](O)CNC/C=C/Cl)cc1 1715610393 DYGDRTDBSZVLMR-IJAVWUSQSA-N 339.783 1.282 10 10 EDCE COc1cc(C(=O)N[C@@H](C)c2ccccc2O)ccc1OCC(N)=O 1557968224 UUODTWYRLLTYHO-NSHDSACASA-N 344.367 1.756 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)c2nccs2)cc1 1491393412 OBQHSDKOSUYWSH-UHFFFAOYSA-N 346.372 1.465 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](c3cc(O)n[nH]3)C2)cc1 1644261404 SYFDRXZJNMVVNM-JTQLQIEISA-N 328.332 1.907 10 10 EDCE CC(C)C(=O)NC[C@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1689508131 WBUVQDSUABFXAI-CYBMUJFWSA-N 331.376 1.836 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2ccc(O)nn2)cc1C 1699226715 HPQORHQNXDYJPI-ONEGZZNKSA-N 342.399 1.575 10 10 EDCE C[C@H](Oc1ccc(N)cc1)C(=O)N1CCN(c2ncccn2)CC1 1860081879 GQMBDGJYSUWYLU-ZDUSSCGKSA-N 327.388 1.175 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)[C@H](C)CCO)c(Br)cc21 1917039677 LCDKUVOHDKCADB-OQPBUACISA-N 342.237 1.869 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](O)[C@@](C)(O)C2)c(Br)c1 2136877659 JBGVXQPVNFMDBS-IIMNLJJBSA-N 330.222 1.824 10 10 EDCE CC(C)CNCc1ccc(N2C[C@@H](O)[C@H](O)C2)cc1Br 232636630 IYEABXZZKTYINY-HUUCEWRRSA-N 343.265 1.737 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](CO)[C@@H](CCO)C2)cc1Br 2149915562 VRBIFQZRKGOFMU-GRYCIOLGSA-N 343.265 1.896 10 10 EDCE C[C@@H](NC[C@H](O)CNC(=O)OC(C)(C)C)c1c(O)cccc1O 1985772572 YKQNICVUWGONOY-MNOVXSKESA-N 326.393 1.634 10 10 EDCE COc1ccc(O)c(CNC[C@@H](O)CNC(=O)OC(C)(C)C)c1 1985776230 UCQRZGDHUQLDFA-GFCCVEGCSA-N 326.393 1.376 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](OCC(N)=O)C2)cc1Br 2145369453 CCJXKNZQLGCPJX-GXSJLCMTSA-N 343.221 1.583 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@H](N(C)C)C2)cc1Br 2146130678 BVSUDTFDYXYVLS-KMUNFCNLSA-N 342.281 1.841 10 10 EDCE CC(C)(C)OC(=O)NC1CN(CC(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2010390119 ZKBQEVMYLVVNJC-LLVKDONJSA-N 338.412 1.497 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)NCc1ccccc1O 2010322300 KDVLTNNPTULNKK-ZDUSSCGKSA-N 338.404 1.673 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCC(CN=[N+]=[N-])CC1 2010393317 QRYLPEVTNYIWLS-GFCCVEGCSA-N 341.412 1.811 10 10 EDCE C[C@@H](C(=O)N(C)CCN=[N+]=[N-])N1CCN(C(=O)OC(C)(C)C)CC1 2010393307 QOBCIZQTHWMQON-LBPRGKRZSA-N 340.428 1.696 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC[C@H]1CN=[N+]=[N-])C1COC1 2010401391 DUXGQXGPAPWLIX-RYUDHWBXSA-N 339.396 1.827 10 10 EDCE O=S1(=O)C[C@H]2C[C@H]1CN2Cc1ccc(Br)cc1O 691677552 NUKLPBJUHHQEJL-MNOVXSKESA-N 332.219 1.526 10 10 EDCE COc1ccc(CNC(=O)C2(C)CCS(=O)(=O)CC2)c(O)c1 2063048875 KMSZENSKARXVSL-UHFFFAOYSA-N 327.402 1.232 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](C(CO)CO)C2)cc1Br 2170661995 KTVMOOVXPCOBDT-WDEREUQCSA-N 343.265 1.896 10 10 EDCE C[C@@]1(NC(=O)C(F)(F)F)CCN(C(=O)CCc2ccc(N)cc2)C1 2044621534 RLRULDANGYRWGO-OAHLLOKOSA-N 343.349 1.871 10 10 EDCE NC(=O)c1cnc(CNCc2c(O)cccc2Br)s1 2112190167 PHKUSBVXCQDBRL-UHFFFAOYSA-N 342.218 2.000 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@H](O)[C@H]2CF)cc1Br 2205602386 UEOTVNLBCAGXMR-ULTHFGNCSA-N 347.228 1.609 10 10 EDCE COc1ccc(Br)c(CN2CC[C@@H](OCCN)C2)c1O 2236038464 AIRAUVMQACIBPP-SNVBAGLBSA-N 345.237 1.713 10 10 EDCE COc1ccc(Br)c(CN2C[C@H]3C[C@]3(CN)C2)c1O 2272635171 YVEGUCJXTLGANC-OTYXRUKQSA-N 327.222 1.944 10 10 EDCE CN[C@H]1CCCC[C@@H]1S(=O)(=O)NCc1cnc(SC)s1 2284502413 WWHMFKYDBBELMF-QWRGUYRKSA-N 335.520 1.815 10 10 EDCE O=C1NC(=O)N(C2CCCCC2)C(=O)C1=CNCCCn1ccnc1 2296347545 RNTLWPQILRERMV-UHFFFAOYSA-N 345.403 1.158 10 10 EDCE CC(C)(CC(N)=O)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2308623104 IIENHGYWBMCGST-UHFFFAOYSA-N 331.416 1.307 10 10 EDCE COCCN1CCC[C@@H]1CNC(=O)NCc1ccc(N(C)C)cc1 111413439 VHVDCVXHOXVLHO-QGZVFWFLSA-N 334.464 1.663 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc(OC)nn3)CC2)cc1 61977835 GFGLROCUPRYSAB-UHFFFAOYSA-N 328.372 1.456 10 10 EDCE CC(C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCN(C)CC1 22589293 GRLADROGYKHTIV-SFHVURJKSA-N 332.492 1.813 10 10 EDCE CCO[C@@H]1CN(Cc2cc(Br)ccc2O)C[C@H]1CN 405290864 HFKUJVPJUXUFOT-BXUZGUMPSA-N 329.238 1.950 10 10 EDCE C[C@@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)cc1Br 2357056517 KNLOKVZNYDKAAK-RMROANFSSA-N 341.249 1.932 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)C[C@@H](C)OC)CC2)cc1 195041584 FDUKHVOXUOMMAP-CYBMUJFWSA-N 328.434 1.182 10 10 EDCE CC(=O)N(C(=S)NCCCN1CCOCC1)c1ccc(N)cc1 242771472 DSDONXFXHCOISK-UHFFFAOYSA-N 336.461 1.219 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cccn(C)c1=O 264210443 VPMJTMQAUORTBP-UHFFFAOYSA-N 341.411 1.494 10 10 EDCE CO[C@H]1CN(Cc2ccc(C)c(Br)c2O)C[C@@H]1C(=O)O 2380810165 FPYIQMWYGNOIOU-QWRGUYRKSA-N 344.205 1.995 10 10 EDCE O=C(NCc1cc(Br)ccc1O)c1n[nH]cc1[N+](=O)[O-] 804737580 TVPPYNBUXYNAGB-UHFFFAOYSA-N 341.121 1.716 10 10 EDCE 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C[C@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1O 1454822295 ZDOIRAHUVXHIQX-NSHDSACASA-N 343.339 1.908 10 10 EDCE Cn1nccc1[C@@H]1C[C@@H](NC(=O)c2c(F)ccc(O)c2O)CCO1 1472563094 DZXCHQJIKHMVBV-ZANVPECISA-N 335.335 1.621 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1=COCC1 1597567867 ZWEMOQJCVNQRDP-UHFFFAOYSA-N 325.748 1.851 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3ccnn3C)CC2)cc1C 1670754815 BLFFXYIFQNOUTM-UHFFFAOYSA-N 328.416 1.789 10 10 EDCE O=C(O)C=Cc1ccc(N2CCNC(=O)CC2)cc1Br 1912006882 ZFBKDWPZLVKDAE-UHFFFAOYSA-N 339.189 1.873 10 10 EDCE NCc1ccc(N2CCCC[C@H]2C(N)=O)c(F)c1Br 231839479 KCLQHUYICIYBLX-JTQLQIEISA-N 330.201 1.891 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H](O)C(C)(C)N 1951507016 LGPKJMBPMLNOCZ-FZMZJTMJSA-N 340.420 1.632 10 10 EDCE COCC(COC)(COC)NCc1cccc(Br)c1O 1970260127 YNKOUZPRAADXPR-UHFFFAOYSA-N 348.237 1.922 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985106337 YNENYFXJKFRURK-KOLCDFICSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010392953 LTWNBSXRMXPRTJ-TUAOUCFPSA-N 339.396 1.658 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2012305779 KVTKTXPXXQSGFP-VTWZXRTESA-N 339.396 1.706 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@](O)(C(=O)Nc2ccc(N)cc2)C1 2020773579 DWIGAWLCTTVMFL-QGZVFWFLSA-N 335.404 1.969 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@]1(C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2023001632 AQZBYZBNGLKYJL-IAQYHMDHSA-N 339.396 1.924 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@@]1(N)CCN(Cc2ccccc2)C1 693964260 MGDLWIKVKXEBHN-HXUWFJFHSA-N 339.439 1.954 10 10 EDCE CN1CCc2cc(CNCCn3ncc(Br)n3)ccc21 2179692187 FMVMUQUXYSFDDF-UHFFFAOYSA-N 336.237 1.823 10 10 EDCE CC(C)CNCc1ccc(N2CC(O)(CO)C2)c(Br)c1 2171950107 BWQRSHCCFPSSNH-UHFFFAOYSA-N 343.265 1.738 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)C[C@H]1C(=O)Nc1ccc(N)cc1 1910957736 JVYBHFDRXFOGGO-KGLIPLIRSA-N 335.404 1.968 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CN(c3cc4c(cc3N)OCCO4)C[C@@H]21 2045666836 WJADOGNYHUDZPX-CULMDFNYSA-N 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CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cscn1 804019768 GJVJRUCMYFILKS-UHFFFAOYSA-N 346.456 1.874 10 10 EDCE C[C@H](O)[C@H](NC(=O)c1cccc(O)c1O)C(=O)OCc1ccccc1 817228301 MQLAZQXBIZFMFW-NHYWBVRUSA-N 345.351 1.320 10 10 EDCE CCOC[C@H](C(=O)O)N(C)C(=O)NCc1ccc(N(C)C)cc1C 909042595 HXRDWQWJXBHQFE-OAHLLOKOSA-N 337.420 1.692 10 10 EDCE CCCN(Cc1cc(O)n2ncc(C(=O)O)c2n1)CC(F)(F)F 737828468 WBSPJOPSYWNDII-UHFFFAOYSA-N 332.282 1.907 10 10 EDCE C[C@H](NC(=O)c1ccnc(S(C)(=O)=O)n1)c1ccc(N(C)C)cc1 839333523 OCSNRENWWUGJLK-NSHDSACASA-N 348.428 1.437 10 10 EDCE CO[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)[C@@](C)(C(=O)O)C1 908758481 LWVGBSOOAHMKEC-RHSMWYFYSA-N 335.404 1.526 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](CO)[C@H]3CC)nc12 830715125 VTRYBRHDARAUTN-BXUZGUMPSA-N 348.403 1.204 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)N3CC[C@H](C)C3)C2)cc1 849416164 LIMWARZTCQERHW-KBPBESRZSA-N 339.461 1.450 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CC[C@@H](C2CC2)N1 846673783 WUUINZVWAHMTCT-ROUUACIJSA-N 329.444 1.670 10 10 EDCE CCN1CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 854301696 CQVYJVGBIVGDPJ-OAHLLOKOSA-N 332.448 1.621 10 10 EDCE COc1cc(CN2CCO[C@@H](CC(N)=O)C2)c(O)c(C(C)(C)C)c1 862535593 SKWAYXVNUUTTHP-AWEZNQCLSA-N 336.432 1.775 10 10 EDCE Cn1[nH]c([C@H]2CCCN2Cc2ccc(N3CCOCC3)cc2)nc1=N 930318105 ZUCDGOHOMBYJPI-MRXNPFEDSA-N 342.447 1.401 10 10 EDCE Cc1nc(N)nc(NCc2cc(F)c(N3CCOCC3)c(F)c2)n1 865868841 ZGHWRXCULHALLU-UHFFFAOYSA-N 336.346 1.489 10 10 EDCE CCN1C[C@@H](S(=O)(=O)NCc2cc(Cl)ccc2O)CC1=O 867463902 UIJMMOCAUPUZIM-NSHDSACASA-N 332.809 1.086 10 10 EDCE Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1cnc2n1CCC2 772685866 JZBTWAPSGKJDKY-UHFFFAOYSA-N 334.445 1.682 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C)[C@H](CO)C2)cc1 1151358956 KRLNYVZAJFFURM-SFHVURJKSA-N 327.428 1.843 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@]2(C)CCC(=O)N2)cc1C 1319530345 ZDHRZYZSOXMZPD-LIRRHRJNSA-N 347.459 1.609 10 10 EDCE CC(C)NC(=O)CNC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1322092969 AGAIYUXTMQQWJI-NSHDSACASA-N 348.407 1.082 10 10 EDCE 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COC[C@@H](C)CC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1736803005 XZFHYBGCXDWLGQ-NSHDSACASA-N 349.391 1.368 10 10 EDCE Cn1nc([C@H]2CCCOC2)cc1NC(=O)Cc1ccc(O)c(O)c1 1640115283 DQNGTUZTLFSQPN-LBPRGKRZSA-N 331.372 1.907 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(O)c1O 1651175847 PWBRCQGEABTGOL-NSHDSACASA-N 340.376 1.254 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cc(N2CCNC2=O)ccc1F 1597574514 OHEPBFSJMXMVOB-UHFFFAOYSA-N 345.330 1.697 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CCCn1cnnn1 1762870941 JGNUGCIDRCTARH-UHFFFAOYSA-N 342.407 1.259 10 10 EDCE CC(=O)Nc1cccc(OCCNC(=O)Cc2ccc(N)cc2)c1 156302075 YHEZHCNTHFSJDM-UHFFFAOYSA-N 327.384 1.965 10 10 EDCE CC[C@@H](c1cc(Br)ccc1O)N1CCNC[C@H]1C(N)=O 251090794 OMTZQGQWVTUQEY-RYUDHWBXSA-N 342.237 1.365 10 10 EDCE CCNCc1ccc(N2CCOC[C@@H]2C(N)=O)cc1Br 233531295 IHCAAEYOUPHMQO-CYBMUJFWSA-N 342.237 1.249 10 10 EDCE C[C@@](O)(CO)[C@H]1CCN(c2ccc(CN)cc2Br)C1 2138099712 BXEXAKGVAHXJEH-SMDDNHRTSA-N 329.238 1.477 10 10 EDCE CC(C)(C)OC(=O)N1CCOCCN1C(=O)c1cccc(O)c1O 2006285989 ZOBFDXZUJLIJTI-UHFFFAOYSA-N 338.360 1.722 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)CNC(=O)CCc1ccc(N)cc1 2011517366 YQCHJOSIUXGEQX-AWEZNQCLSA-N 337.420 1.203 10 10 EDCE CC[C@H](CNC(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 2015118435 ARHQBMAAQXBDSQ-SNVBAGLBSA-N 340.376 1.837 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC(CN=[N+]=[N-])CC1 2018047854 WKUPDMLLHKPQQR-LBPRGKRZSA-N 341.412 1.811 10 10 EDCE C[C@@H]1C[C@@H](CO)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2156547920 HPSFIRMHQXIUHM-RBDZCENOSA-N 340.221 1.608 10 10 EDCE [N-]=[N+]=NCCN[C@@]1(C(=O)O)CN(Cc2ccccc2)[C@@]2(CCOC2)C1 2038666305 PUUYEFRVIMJTIE-DLBZAZTESA-N 345.403 1.775 10 10 EDCE CN(CCN1CCOCC1)c1cc(Br)c(CN)cc1F 2170080817 HDLBJQVVKCSLOZ-UHFFFAOYSA-N 346.244 1.815 10 10 EDCE Cc1nn(C)c(C(=O)NCc2cc(N)ccc2O)c1Br 2192386618 HLWNYJHRVBDRDM-UHFFFAOYSA-N 339.193 1.709 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCC[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1906906770 YALVMDJVWVHBDK-ZDEQEGDKSA-N 340.420 1.182 10 10 EDCE CN1CCc2cc(CN[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)ccc21 2062449521 AHNFHSCIAQNMIH-NVXWUHKLSA-N 347.459 1.749 10 10 EDCE CN[C@H](c1ccccc1O)[C@H](O)c1cn(C)nc1Br 2091863020 KQGSHIJJIWMMGX-VXGBXAGGSA-N 326.194 1.882 10 10 EDCE CN[C@@H](c1ccccc1O)[C@@H](O)c1nn(C)cc1Br 2093828207 AFVZNFPZGMDUBC-WCQYABFASA-N 326.194 1.882 10 10 EDCE C[C@]1(CO)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2097238791 RUSTXUVXTDZUKP-WCQYABFASA-N 326.194 1.362 10 10 EDCE O=C(O)CN1CC[C@H](NCc2ccc(Br)cc2O)C1 2113025230 BLSKLMNQEDAHLN-NSHDSACASA-N 329.194 1.403 10 10 EDCE Cc1ccc(NC=C2C(=O)NC(=O)N(C[C@H]3CCCO3)C2=O)cc1 2297317989 VZPOWFYXILELHY-CYBMUJFWSA-N 329.356 1.548 10 10 EDCE CCOc1ccc(N2C(=O)C(=CNC3CC3)C(=O)NC2=S)cc1 2297451683 GTFVGJWDQDCNQC-UHFFFAOYSA-N 331.397 1.469 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2355334681 RJDMAUDHQFQHBI-JUTUQKRISA-N 341.249 1.489 10 10 EDCE CC(=O)N1CCC(CNCc2ccc(N3CCOCC3)cc2)CC1 105506190 YZLWSFCVEUJDDX-UHFFFAOYSA-N 331.460 1.871 10 10 EDCE NCc1ccc(N2CC3(CC[C@@H](CO)O3)C2)c(F)c1Br 2361871443 IDXHHBIHOYCQLM-JTQLQIEISA-N 345.212 1.777 10 10 EDCE CN1CCCc2cc(CNC(=O)c3cc(C(N)=O)cn3C)ccc21 130067134 PJKAISKPYDZSRR-UHFFFAOYSA-N 326.400 1.436 10 10 EDCE NCc1ccc(N2CC3(CCOCC3)[C@H]2CO)c(Br)c1 2381067998 UGTAYAKMURZQDS-CQSZACIVSA-N 341.249 1.886 10 10 EDCE CC1(C)CN(C(=O)c2c(F)ccc(O)c2O)C[C@]2(CCOC2)O1 295184900 QGEYEOMHCJQOEJ-INIZCTEOSA-N 325.336 1.647 10 10 EDCE Cc1c(Br)cc(C(=O)O)c(O)c1CN1CCN(C)CC1 642880068 IIPYFZDDIUGRPY-UHFFFAOYSA-N 343.221 1.909 10 10 EDCE COC[C@H](CNC(=O)NCc1cc(Br)ccc1O)OC 807092627 DVLWOVJQRTUJQE-NSHDSACASA-N 347.209 1.615 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)CCOC3CNC3)C2)cc1 818613005 AXEAWYKFQPVTCG-CQSZACIVSA-N 333.432 1.016 10 10 EDCE COCC[C@H](COC)NCc1ccc(N2CCOCC2)c(F)c1 810173958 LPYPCCWWQYTBSR-OAHLLOKOSA-N 326.412 1.803 10 10 EDCE CCOc1cccc(CN2CCN([C@H]3CCNC(=O)CC3)CC2)c1O 825148111 PVDDGPNWQJDILW-MRXNPFEDSA-N 347.459 1.577 10 10 EDCE COc1cc([N+](=O)[O-])cc([C@@H](N2CCNCC2)C(F)(F)F)c1O 575266996 MCWFRYDFEZGMIL-GFCCVEGCSA-N 335.282 1.818 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)CCC[C@H]2CCOC2)cc1 826922876 HXDDRGSEULYAPC-HNNXBMFYSA-N 326.462 1.989 10 10 EDCE O=C(C[C@H](O)C(Cl)(Cl)Cl)NCCc1ccc(O)c(O)c1 907057104 NJUNKKVOMDDMOA-JTQLQIEISA-N 342.606 1.878 10 10 EDCE COC(=O)CCCN1C(=O)/C(=C/c2ccnc(C)n2)SC1=S 841496848 SWYXJURBEKBZER-FLIBITNWSA-N 337.426 1.939 10 10 EDCE COC(=O)CN(CCN1CCOCC1)Cc1cc2c(cc1O)CCC2 746380242 NSWXIHYSCKFVEQ-UHFFFAOYSA-N 348.443 1.188 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C(C)C)[C@@H](C)NC(=O)OC(C)(C)C 842135772 RHJGLUVBGQYJFB-ZWNOBZJWSA-N 329.393 1.873 10 10 EDCE COc1ccc(N2CCN(CCNCc3nc(C)c(C)[nH]3)CC2)cc1 850089758 GJVOVWROMDKZDD-UHFFFAOYSA-N 343.475 1.947 10 10 EDCE C[C@]1(CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1(F)F 855807087 QOEKDSJQYKNYMW-ZDUSSCGKSA-N 348.371 1.929 10 10 EDCE CCN(C)c1ccc([C@@H](C)NC2CN(S(=O)(=O)N(C)C)C2)cc1 858569836 OCUXHAZBAGTQLL-CYBMUJFWSA-N 340.493 1.284 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCC[S@](=O)CC(F)(F)F)c1 858599444 MYDAPRRWAZMPRK-QFIPXVFZSA-N 338.351 1.811 10 10 EDCE CCOCCO[C@@H](C)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855231917 YPPJJHZVERBJEK-GJZGRUSLSA-N 336.432 1.832 10 10 EDCE CN(C)CCN(CCN(C)C)Cc1cc(F)c(N(C)C)cc1F 862367351 GAMBOIHLWOZKFE-UHFFFAOYSA-N 328.451 1.956 10 10 EDCE COc1cccc(CNS(=O)(=O)c2cnn(CC3CC3)c2)c1O 777965692 VJNIAYNNASWTPD-UHFFFAOYSA-N 337.401 1.486 10 10 EDCE CCn1nc(C(=O)NCc2ccc(O)c(O)c2)c(=O)c2ccccc21 778922339 IPZSXJJSKFQYGK-UHFFFAOYSA-N 339.351 1.758 10 10 EDCE CCNC(=O)C[C@@H]1CCCCN1Cc1cc2c(cc1O)OC[C@H]2O 789521905 UVDJHVKCFOPFSF-XJKSGUPXSA-N 334.416 1.699 10 10 EDCE O=C(Nc1cccnc1N1CCC(CO)CC1)c1cccc(O)c1O 790705242 LYXMQPOSJSWBMI-UHFFFAOYSA-N 343.383 1.954 10 10 EDCE O=C(NCc1ccc(O)cc1O)C1(S(=O)(=O)c2ccccc2)CC1 1142533624 OBBDGYLHGGJPIK-UHFFFAOYSA-N 347.392 1.721 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(CC(N)=O)cc1)c1ccccc1O 1229460325 MJPXNPICWQFBLJ-GFCCVEGCSA-N 327.384 1.980 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CN(C)CCO2)cc1C 1268057230 LQKBVSVCNTXAAA-CRAIPNDOSA-N 349.475 1.271 10 10 EDCE Cc1nnc(N2CCNC(=O)C2)n1CCCSc1nccs1 1290881016 MXHMAOULBCLZIC-UHFFFAOYSA-N 338.462 1.162 10 10 EDCE Cc1ccc(C(=O)N2CCC(NC3CCOCC3)CC2)c(O)c1O 1522035438 MOENEOSAVWWJIT-UHFFFAOYSA-N 334.416 1.779 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2ncn(C)n2)cc1C 1715812094 SAQBQOCRGNKQOS-PLNGDYQASA-N 329.404 1.208 10 10 EDCE O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCc1c(O)cccc1O 1558534760 XRWFSPJIUCFANG-VXGBXAGGSA-N 346.383 1.279 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@H](C)[C@@H](C)S(C)(=O)=O)c1 1630366441 PYYRBPUCSWKIQY-GARJFASQSA-N 329.418 1.647 10 10 EDCE C[C@H](O)CNC[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1566913849 VPVSDDBTGOUQRX-QWHCGFSZSA-N 347.419 1.672 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)CN2CCCC2=O)cc1C 1732407375 MINCBIGFLZMJHX-OAHLLOKOSA-N 347.459 1.563 10 10 EDCE Cn1cc(Br)c(C(=O)NCc2cc(O)ccc2O)n1 1593881401 KKIJTISZTMQNMY-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE O=C(NCc1cccc(O)c1O)C1=NN(c2ccccc2)C(=O)CC1 1593733699 FKENENRPMPQFCO-UHFFFAOYSA-N 339.351 1.897 10 10 EDCE CCn1cc(C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)nn1 1669434311 KGYUKFDTPHLQJY-CYBMUJFWSA-N 331.420 1.523 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CCS(C)(=O)=O 1764722123 COQYIDBVKPNFMG-UHFFFAOYSA-N 338.433 1.227 10 10 EDCE CO[C@H](C)c1noc(CN(C)C(=O)/C=C\c2ccc(O)c(O)c2)n1 1772911370 RMCMIQICBQERPV-ONRRBMGISA-N 333.344 1.860 10 10 EDCE CCNC(=O)C1(NCc2c(Br)ccc(OC)c2O)CC1 1965970880 PRRXGNKBAPRXQC-UHFFFAOYSA-N 343.221 1.922 10 10 EDCE COc1ccc(N2NC(=O)/C(=C/c3ccc(O)c(OC)c3)C2=O)cc1 207842350 JEQRNAXGVJCWQV-ZROIWOOFSA-N 340.335 1.871 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1OCC[C@@H]1NC(=O)OC(C)(C)C 1900609301 MBVOMLXOPAHEDO-WDEREUQCSA-N 327.385 1.827 10 10 EDCE [N-]=[N+]=N[C@H]1CCCN(C[C@H](O)CN2C(=O)c3ccccc3C2=O)CC1 1934380327 DYRHRXJMUUOLEE-STQMWFEESA-N 343.387 1.808 10 10 EDCE COCCNCc1ccc(N2CCN(C)CC2)c(Br)c1 234683744 FQOYZXLTJOKEMB-UHFFFAOYSA-N 342.281 1.937 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@@H](F)C1 1983546037 FZXSHENYAIPTRA-KKOKHZNYSA-N 328.384 1.457 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1990022361 BTAYESPMJYXWFA-GHMZBOCLSA-N 327.385 1.421 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCOC(F)(F)C3)c(Br)cc21 2152293154 GDPPUPSJQMFKRU-SNVBAGLBSA-N 348.147 1.830 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010405384 YYDFXDYANVZDQY-NXEZZACHSA-N 340.384 1.056 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010402336 PQNPCEUYAJGCQJ-NEPJUHHUSA-N 341.412 1.954 10 10 EDCE O[C@@H]1COCCN(c2ccc(CNC3CC3)cc2Br)C1 399918567 DTCSFPOVVUVJDN-ZDUSSCGKSA-N 341.249 1.899 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC4(CCOCC4)C[C@@H]3C)c2n1 2063790124 BKFOPKCDSYFHQP-LBPRGKRZSA-N 330.388 1.775 10 10 EDCE Oc1cc(Br)ccc1CN[C@@H]1CCN(C2COC2)C1 2113267589 AQVBAHAJGNEFBY-GFCCVEGCSA-N 327.222 1.717 10 10 EDCE CN(C)C[C@H]1CN(c2ccc(CO)cc2Br)CCO1 2113971942 UWGHBWGSTFJYJT-LBPRGKRZSA-N 329.238 1.708 10 10 EDCE CNCc1ccc(N2C[C@@H]3CCO[C@]3(CO)C2)cc1Br 2239802440 YMBKIDYUELADCP-WFASDCNBSA-N 341.249 1.756 10 10 EDCE COC(=O)[C@@H](CS(=O)(=O)N=[N+]=[N-])NC(=O)OCc1ccccc1 2241756750 LJZIGGULAVGRBV-SNVBAGLBSA-N 342.333 1.095 10 10 EDCE COc1ccc(Br)c(CN2C[C@H]3C[C@@]3(CN)C2)c1O 2272635173 YVEGUCJXTLGANC-YMTOWFKASA-N 327.222 1.944 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cccc(CO)c2)s1 2284501900 YABURTNOWVODNU-UHFFFAOYSA-N 330.456 1.836 10 10 EDCE CCc1cccc2c1N(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)CC2 491276387 GKPBHNCRYQNBTC-HJWRWDBZSA-N 339.395 1.249 10 10 EDCE Cc1ccc(CN=c2nnc(Cl)n[nH]2)c(O)c1Br 2327796293 FHIKWIXVGSCHJV-UHFFFAOYSA-N 330.573 1.731 10 10 EDCE Cc1ccc(CN2CC(CNC(N)=O)C2)c(O)c1Br 2352941872 WUNCTLSUTLQCLA-UHFFFAOYSA-N 328.210 1.563 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)Nc3cccnc3)CC2)cc1 9858765 RLSPLPDLDDGOSL-UHFFFAOYSA-N 340.383 1.378 10 10 EDCE C[S@@](=O)CCCNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 110861896 ANOVKFUOZNGPNT-GPVJQRHHSA-N 336.457 1.421 10 10 EDCE C[C@@H](CNC(=O)NCc1c(O)ccc2c1CCCC2)N1CCOCC1 175010094 WQATYRRTBDTCQE-AWEZNQCLSA-N 347.459 1.791 10 10 EDCE COc1ccc(N2CCN(C(=O)COC[C@H]3CCOC3)CC2)cc1 172030988 CRQIZRPDYJPDAZ-HNNXBMFYSA-N 334.416 1.397 10 10 EDCE CC(=O)N(C(=O)C(=O)NCc1ccc(C)cc1)c1ccc(N)cc1 170318430 GELAFZALGTUBSJ-UHFFFAOYSA-N 325.368 1.773 10 10 EDCE C[C@@H](NCCNS(=O)(=O)c1cccnc1)c1ccc(F)cc1O 186142149 UCQRNAWRKQNTSF-LLVKDONJSA-N 339.392 1.555 10 10 EDCE Cc1nc2n(n1)CCC[C@@H]2NC(=O)NCc1ccc(N(C)C)cc1 81163621 NZWKDTGMVXLEMD-HNNXBMFYSA-N 328.420 1.987 10 10 EDCE COC[C@H](C)N(C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 193377434 IJVIANIOIZGESU-ZDUSSCGKSA-N 339.411 1.839 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@]23[C@@H]4[C@H]5C(=O)[C@H]2[C@@H]2[C@@H]5C[C@@H]4[C@@H]23)cc1F 800471131 PGLCMPBFRMYYQX-CPFXPNHXSA-N 340.398 1.835 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@H]3CCNC(=O)CC3)CC2)cc1 815258965 OTPGCYSTEIGMDA-AWEZNQCLSA-N 345.443 1.697 10 10 EDCE CC(C)C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)C(=O)O 818658571 VHGCLJAYVDPOCC-AWEZNQCLSA-N 349.431 1.232 10 10 EDCE CCO[C@@H]1C[C@@H](NC(=O)c2ccc(C)c(O)c2O)[C@@H]1n1cccn1 819405103 JGLOATBZABPSPI-MCIONIFRSA-N 331.372 1.751 10 10 EDCE CC[C@@H](CNS(C)(=O)=O)NC/C=C/c1ccc(N(C)C)cc1 835053563 DHYSEDGFEGUPRQ-LFAOLKIESA-N 325.478 1.683 10 10 EDCE O=C(C1CC1)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 732576696 MQKLCYURVUFQHY-UHFFFAOYSA-N 329.444 1.577 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC(NC(C)=O)CC2)c([N+](=O)[O-])c1 747809153 WQEWDGAGWXSFLK-XQRVVYSFSA-N 347.371 1.886 10 10 EDCE C[C@@H](C(=O)O)N1CCN(Cc2ccc(Br)cc2O)CC1 691422287 HEDLQNUJZKBTSZ-JTQLQIEISA-N 343.221 1.745 10 10 EDCE Cn1nccc1[C@H]1NC(=O)N(Cc2ccc(N3CC=CC3)cc2)C1=O 843307227 DITZITAVXKRUNX-MRXNPFEDSA-N 337.383 1.589 10 10 EDCE COc1ccc(N2CCC(NC(=O)C[C@@H](C)NC(N)=O)CC2)cc1 847425568 NCQBCFBIEVLKFF-GFCCVEGCSA-N 334.420 1.227 10 10 EDCE CO[C@@H](CNC(=O)NCc1cc(Cl)ccc1O)[C@@H]1CCOC1 852436284 HAERTPUAWXAKHD-YGRLFVJLSA-N 328.796 1.896 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCC(=O)OC(C)C)C2)cc1 851910429 OZTJNKKDULXQES-CQSZACIVSA-N 349.431 1.915 10 10 EDCE CC(C)[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 755864338 SIMQQSREHNGHPA-NSHDSACASA-N 326.418 1.882 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@]4(O)C[C@H]4C3)C2)cc1 854296902 LBUORKZQPNVVIV-SUNYJGFJSA-N 331.416 1.440 10 10 EDCE CCN1C[C@H](S(=O)(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1=O 867126347 XOAMNIDZCKLNQA-IUODEOHRSA-N 339.461 1.354 10 10 EDCE C=CC(=O)NCCC(=O)NCc1cccc(Br)c1O 765725999 BOUUFUKHCPNESH-UHFFFAOYSA-N 327.178 1.463 10 10 EDCE CCO[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)[C@H]1CCOC1 864984676 ZGRKGGUAMDFDAE-WMZOPIPTSA-N 348.443 1.581 10 10 EDCE O=C(O)c1conc1CNCc1ccc(N2CCOCC2)c(F)c1 1118368345 KDGVZAHNXVZYIJ-UHFFFAOYSA-N 335.335 1.638 10 10 EDCE O=c1onc(-c2ccncc2)n1Cc1ccc(N2CCOCC2)cc1 877889170 GLSGKYSBMGKIHO-UHFFFAOYSA-N 338.367 1.783 10 10 EDCE COCCN(Cc1ccc([N+](=O)[O-])c(OC)c1O)[C@@H]1CCOC1 787334389 LBPGRUCZOKRCAS-GFCCVEGCSA-N 326.349 1.546 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 895416511 WRGLIQRCSAYHCM-SNVBAGLBSA-N 334.388 1.432 10 10 EDCE COC(=O)c1c(CNCCN2CC[C@H](O)C2)c2cc(F)ccc2n1C 895414897 IBFYPNRKVXMXSB-ZDUSSCGKSA-N 349.406 1.260 10 10 EDCE C[C@@]1(c2cccnc2)NC(=O)N(CCOc2ccc(N)cc2)C1=O 57849819 JDNLRWDUWQSSPP-KRWDZBQOSA-N 326.356 1.510 10 10 EDCE COc1ccc(N2CCN(C(=O)c3n[nH]cc3F)CC2)c(OC)c1 1302001476 ZSKRSJOCIUHQGL-UHFFFAOYSA-N 334.351 1.528 10 10 EDCE CC(C)(C)[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCO1 1329496051 XLZXMJXJVDWOME-HNNXBMFYSA-N 332.400 1.508 10 10 EDCE CCOC(=O)CC[C@H](C)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 1323492921 TYVCLZFJZOQRIL-ZDUSSCGKSA-N 349.431 1.217 10 10 EDCE C[C@@H](O)c1ccc(N(C)C[C@H](O)CN(C)C)c(Br)c1 690318636 WGRLLXLNSYNQHS-ZYHUDNBSSA-N 331.254 1.861 10 10 EDCE COCCN(C(=O)OC(C)(C)C)[C@@H](C(N)=O)c1ccc(O)c(O)c1 698423518 PYJJTQAOFPFXSP-CYBMUJFWSA-N 340.376 1.508 10 10 EDCE CC[C@@H](c1cc(Br)ccc1O)N1CCNC[C@@H]1C(N)=O 88659036 OMTZQGQWVTUQEY-NWDGAFQWSA-N 342.237 1.365 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)C[C@@H]2CCC(=O)N2)cc1C 1268409575 ZVBMSQHFJIUQHS-ZBFHGGJFSA-N 347.459 1.657 10 10 EDCE Cc1nn(CC(=O)N(C)Cc2ccc(N3CCCC3)cc2)c(=O)n1C 1525113383 DHODTRGIWQVZHP-UHFFFAOYSA-N 343.431 1.149 10 10 EDCE O=C(/C=C\c1ccc2c(c1)NC(=O)CO2)NCc1cc(O)ccc1O 1471662254 VTSSAIJIYVVTFI-KXFIGUGUSA-N 340.335 1.758 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](O)c1cnn(C)c1 1543356924 WRVDDOISBPLBTN-KRWDZBQOSA-N 330.432 1.957 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccccc1OCC(N)=O 1627026853 ZQYJVIHFUZYTDA-UHFFFAOYSA-N 349.383 1.672 10 10 EDCE COc1ccccc1C(=O)NCC(=O)NCc1ccc(O)cc1O 1557084872 QWLGZOKOMZWNII-UHFFFAOYSA-N 330.340 1.153 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cccc(C)n2)cc1C 1715574200 GJBYBHRRJKJZGF-MRXNPFEDSA-N 343.427 1.588 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](N3CCOC3=O)C2)cc1 1557386285 FLRLFLTVFKRZDU-LBPRGKRZSA-N 331.332 1.516 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCS(=O)(=O)c1ccccc1 1631018545 WFLSSLYFXODBJP-UHFFFAOYSA-N 335.381 1.230 10 10 EDCE COc1ccc(CNC2(CNC(=O)CN3CCCC3)CC2)cc1C 1670900716 XIADHIDUKDJAPY-UHFFFAOYSA-N 331.460 1.838 10 10 EDCE OCc1ccc(N2C[C@@H](CO)OCC23CC3)cc1Br 2127540250 XSBJXQUFNVGAKN-LBPRGKRZSA-N 328.206 1.672 10 10 EDCE COC(=O)NC[C@@H]1CCN1c1ccc(CN)cc1Br 2130739599 YZFKOLQDAJAXGV-JTQLQIEISA-N 328.210 1.843 10 10 EDCE COCCNC(=O)CN(C)c1ccc(CN)c(Br)c1F 231839524 IHGINFXWNARRPB-UHFFFAOYSA-N 348.216 1.246 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC(N=[N+]=[N-])C2)C[C@H](CO)C1 1990176260 DWQLNTDHDRSEJD-DEZZCRIOSA-N 325.369 1.173 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H]1CNC(=O)c1cc(O)c(O)c(O)c1 2015120643 VMASTYDDXNYBJY-SNVBAGLBSA-N 338.360 1.543 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@@H](CO)[C@@H](O)C2)c(Br)c1 316500839 YYWFUGZHCMJEIO-GMXABZIVSA-N 343.265 1.909 10 10 EDCE CCNCc1ccc(N2C[C@@H](CO)[C@H](CO)C2)c(Br)c1 704764450 LISFRABMKURYPE-STQMWFEESA-N 343.265 1.596 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@](O)(C(N)=O)C2)cc1Br 380450878 DZUVXINIIPCPMI-YMTOWFKASA-N 342.237 1.285 10 10 EDCE CC(C)C1(O)CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 384111367 HJGGSHOTERRFMP-GFCCVEGCSA-N 340.221 1.608 10 10 EDCE CNCc1ccc(N2CCc3c(nnn3C)C2)c(Br)c1 2170363887 DPXUETCULXXKNF-UHFFFAOYSA-N 336.237 1.860 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)cc1Br 2182558069 AQYLSLHUOHQBAB-UZGCMYEVSA-N 342.233 1.680 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H]2CN3C(N)=O)c(F)c1Br 2192282350 MHPXMFQVJKSALK-DTWKUNHWSA-N 343.200 1.389 10 10 EDCE COc1ccc(Br)c(CN2CCN[C@@H]3COC[C@@H]32)c1O 2236043475 LJEAHKRTTJVKOV-NEPJUHHUSA-N 343.221 1.336 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1CCOCCN1C(=O)OC(C)(C)C 2244008695 BBXIJDFWLCNHEZ-LLVKDONJSA-N 327.385 1.781 10 10 EDCE C[C@@H]1OC2(C(=O)N(C)CCN=[N+]=[N-])CC1(NC(=O)OC(C)(C)C)C2 2247287598 PNVADDMIPBEXSA-ISAOAKOHSA-N 339.396 1.970 10 10 EDCE O=C1Nc2cc(N3CC[C@]4(O)C[C@@H]4C3)c(Br)cc2[C@H]1O 2279953279 WNVXMKWXKKRIOM-PYSYBHHASA-N 339.189 1.396 10 10 EDCE CN1C(=O)C(=Cc2ccc(N3CCCCCC3)o2)C(=O)NC1=S 2294216468 HURVNUBCCDEKRW-UHFFFAOYSA-N 333.413 1.917 10 10 EDCE O=C1NC(=O)N(c2ccccc2)C(=O)C1=CNCCCn1ccnc1 2295923791 ZLINESVSLKCBFH-UHFFFAOYSA-N 339.355 1.030 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C 2300530684 UWQHQNGOWNUYFQ-JTQLQIEISA-N 342.400 1.304 10 10 EDCE CCC[C@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)C(=O)O 2308495324 JDGYNDHRUUZNCA-INIZCTEOSA-N 332.400 1.906 10 10 EDCE O=C(O)CCN(CCCO)Cc1c(O)cccc1Br 2342677113 LZOBANADHWJBLU-UHFFFAOYSA-N 332.194 1.814 10 10 EDCE Cc1ccc(CN[C@@H](C)C2CS(=O)(=O)C2)c(O)c1Br 2352681691 UDEMCWUQLWDZDX-VIFPVBQESA-N 348.262 1.986 10 10 EDCE O=S(=O)([C@H]1CCN(Cc2cc(F)ccc2O)C1)N1CCCC1 180281357 XTEGFMVPGBBQLW-AWEZNQCLSA-N 328.409 1.531 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H]2CNC(=O)C2)cc1 126963662 OLORJVZIMCUVRD-NVXWUHKLSA-N 344.459 1.953 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@@H]2CCCN(S(C)(=O)=O)C2)c1 182414319 ZZLXZHYXEGJBQH-OLZOCXBDSA-N 342.461 1.723 10 10 EDCE CCCNC(=O)CCNC(=O)c1c(C)oc(-n2cccc2)c1C#N 132640271 YRCMSRBGXBPSLS-UHFFFAOYSA-N 328.372 1.897 10 10 EDCE Cn1nccc1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 278147423 BNIMOWFOJVIRGF-UHFFFAOYSA-N 332.379 1.255 10 10 EDCE COCc1nc([C@@H]2COCCN2C(=O)c2ccc(C)c(O)c2O)no1 371678101 YAFZHKZZPGQONY-NSHDSACASA-N 349.343 1.149 10 10 EDCE Cc1ccc(CN2CCN3C[C@@H](O)C[C@H]3C2)c(O)c1Br 2381132435 AVHZAVSBQBBTJV-STQMWFEESA-N 341.249 1.714 10 10 EDCE CCN(CC)S(=O)(=O)c1ccc(SCC(=O)C(C)=O)nc1 808017142 LOZHWLFHSAZGCF-UHFFFAOYSA-N 330.431 1.362 10 10 EDCE O=C(C1CC1)[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)CCO1 811502255 OAEGPPWXEMVHPK-SFHVURJKSA-N 330.428 1.703 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@@H](Nc3ncccn3)C2)cc1 825603320 SDPQCZREBIRTAC-OAHLLOKOSA-N 340.431 1.939 10 10 EDCE Cc1cc(C(=O)N2CCO[C@@H]([C@@H](C)O)C2)c(C)n1-c1ccccn1 839924988 JGCOBMUPAICVJA-GDBMZVCRSA-N 329.400 1.711 10 10 EDCE Cc1cc(C(=O)N[C@@H]2CCO[C@@H]2C(=O)O)c(C)n1-c1ccccn1 909940863 DWYFMIJIOUXIKJ-HIFRSBDPSA-N 329.356 1.461 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CN1CC[C@H](C)C1 848232175 YRHGOCFMNKLROL-AWEZNQCLSA-N 334.416 1.626 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=S)NC[C@@H]3CCCO3)C2)cc1 849271099 AEOYAHRVTMDPPE-CJNGLKHVSA-N 335.473 1.917 10 10 EDCE Cc1cc(CCNC(=O)NCc2ccc(N(C)C)c(F)c2)nn1C 915365697 HGOUXALWZPNHDW-UHFFFAOYSA-N 333.411 1.976 10 10 EDCE CS(=O)(=O)CCCCCNC(=O)NCc1c(O)cccc1F 922059918 AVVQCKJVEAKMOY-UHFFFAOYSA-N 332.397 1.545 10 10 EDCE COc1ccc(CNC[C@H]2C[C@@H]3COC[C@@H]3O2)cc1Cn1cccn1 922725312 KJIRRDWXJLXKJM-LMMKCTJWSA-N 343.427 1.834 10 10 EDCE CN1C[C@@H](CCN2C(=O)CN(Cc3ccccc3O)C2=O)CC1=O 925182893 ILVXTBHKQWEQBR-LBPRGKRZSA-N 331.372 1.025 10 10 EDCE C[C@@H]1OC[C@H](NCc2ccc(N3CCC(C(N)=O)CC3)cc2)[C@H]1C 926872242 BXLSXYJAAAIWJF-DEYYWGMASA-N 331.460 1.901 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCn3cccn3)C2)cc1 852185527 YZEGOOFLOFFCAP-AWEZNQCLSA-N 329.404 1.470 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC([C@H]4CCOC4)C3)C2)cc1 854296914 HPBFALDXHQLVGX-HOCLYGCPSA-N 345.443 1.952 10 10 EDCE C[C@@H](NC(=O)NC[C@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(N(C)C)cc1 922055997 VLRRMXUYWZPXPO-WNOSKKOXSA-N 333.432 1.917 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC([C@@H]4CCOC4)C3)C2)cc1 854296915 HPBFALDXHQLVGX-ZBFHGGJFSA-N 345.443 1.952 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@H]1CCCN1C(=O)C(F)(F)F 928707778 HXJGPRRPJLYEAG-SNVBAGLBSA-N 334.269 1.701 10 10 EDCE C/C=C/CNC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 858606843 NCVFCVWZMFBKRQ-NSCUHMNNSA-N 337.445 1.297 10 10 EDCE CCN(CC)c1ccc(CNC[C@@]23COCCN2C(=O)COC3)cc1 865799479 AWTATDCYNFJUNH-IBGZPJMESA-N 347.459 1.250 10 10 EDCE CN(C)c1ccc(CN2CCO[C@H](CC(N)=O)C2)c(C(F)(F)F)c1 862535775 YRRHKFSOMUKECQ-CYBMUJFWSA-N 345.365 1.848 10 10 EDCE Cc1cc(N(C)C)ccc1CN1C(=O)N[C@@H](c2ccn(C)n2)C1=O 761354446 IPNIVZKGKDGCIR-HNNXBMFYSA-N 327.388 1.588 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)c1ccc2c(c1)B(O)OC2 863869364 LLXSZTCXOFSLBR-UHFFFAOYSA-N 336.200 1.435 10 10 EDCE C[C@H](NC(=O)[C@H]1CC[C@@H](C(N)=O)C1)c1ccc(N2CCOCC2)cc1 1125518664 JPDCMKLFSICPJP-IMJJTQAJSA-N 345.443 1.602 10 10 EDCE O=C1C[C@H]2CC[C@@H](CN1)N2C(=O)c1cc2cc(O)c(O)cc2s1 896836097 LWHINSMJWACEGA-ZJUUUORDSA-N 332.381 1.806 10 10 EDCE COc1ccc(CNC(=O)C(=O)Nc2ccc(N(C)C)nc2)c(O)c1 797390839 VIOSDHSIAIFNTE-UHFFFAOYSA-N 344.371 1.117 10 10 EDCE CC[C@H]1CCN1C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 795651450 YTJQJMIHBCIFJU-WMZOPIPTSA-N 333.476 1.662 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3c(O)cccc3Br)C[C@@H]2C1 897617919 ICKSYCVNMZZJJD-AOOOYVTPSA-N 346.246 1.631 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNCc2cccc(O)c2O)C1 705693426 BFGLFEBEYZAHPY-GXTWGEPZSA-N 338.404 1.415 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(CO)nc1 1451926052 ZFHFHOPAVIQDLK-UHFFFAOYSA-N 344.367 1.485 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cc(OC)n(C)n2)cc1C 1713326220 VDULCFWYFRNHLY-CYBMUJFWSA-N 346.431 1.654 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1ncccn1 1714308246 CNYWDSZBDKVYHX-LLVKDONJSA-N 341.375 1.547 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)c2cnon2)C2CC2)cc1C 1498847833 VUUCKROAAOAHDU-CQSZACIVSA-N 330.388 1.685 10 10 EDCE CC[C@@H](CNS(C)(=O)=O)NC(=O)N[C@H](C)c1ccccc1O 1635393925 HEBVGAJUUYVWEH-MNOVXSKESA-N 329.422 1.080 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1631095749 CTZCFZBYKXXTPZ-GFCCVEGCSA-N 336.388 1.766 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C1(CF)CC1 1737568211 YCUZXFUCEKJJAK-JTQLQIEISA-N 349.366 1.833 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C1(CF)CC1 1737568212 YCUZXFUCEKJJAK-SNVBAGLBSA-N 349.366 1.833 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cnn(C)c2N)cc1C 1663895058 DEARQCYJRJUFBI-UHFFFAOYSA-N 331.420 1.181 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2nc([C@@H]3CCCO3)n[nH]2)c1 1683440661 FSSXHLYZZXZMDQ-ZDUSSCGKSA-N 331.376 1.670 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1CC(O)(C(=O)O)C1 2136352131 FYOJNLCPSWSGTI-SNVBAGLBSA-N 330.178 1.737 10 10 EDCE O=C1C[C@@H](CNCc2cc(Br)cc(F)c2O)CCN1 1969109862 MEJPREMIJWJTOW-QMMMGPOBSA-N 331.185 1.910 10 10 EDCE C[C@@H]1CO[C@H](CO)CN1c1ccc(CN)c(Br)c1F 231840443 AENZMBNFPXNGAC-SCZZXKLOSA-N 333.201 1.633 10 10 EDCE C[C@@]1(O)CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 235428746 SOFWYSVLAQLHPD-DGCLKSJQSA-N 326.194 1.362 10 10 EDCE COCCNCc1ccc(N2C[C@H](O)[C@@H](F)C2)cc1Br 2149241881 LNDFLIIMMRXWTK-KBPBESRZSA-N 347.228 1.704 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)C1COC1 1985099702 ATLOSWGGBIINIG-LLVKDONJSA-N 327.385 1.685 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1 1985104126 FWHFAVOZIHQQBM-UHFFFAOYSA-N 326.401 1.308 10 10 EDCE COC(=O)[C@H](CC(=O)N1CC[C@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 2010394121 AJRALRPZNLBLGY-UWVGGRQHSA-N 341.368 1.354 10 10 EDCE C[C@@H]1CN(c2ccc(CN)c(Br)c2F)C[C@H](CO)O1 300427266 GOPNBXQDQRSNMA-PSASIEDQSA-N 333.201 1.633 10 10 EDCE CCNCc1ccc(N(C)[C@H]2COC[C@@H]2O)cc1Br 708088086 GWTIHJFGLADKLJ-KBPBESRZSA-N 329.238 1.755 10 10 EDCE CC1(C)[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 380770028 QBUWLPMEVFGTNQ-RYUDHWBXSA-N 340.221 1.751 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@H](O)C3)c(Br)c1 2190456232 GBLSXPWNIMXTCR-BSLXNSKLSA-N 341.249 1.631 10 10 EDCE CCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1cccc(OC)c1 490575580 JQWPKDHHSNQPMS-KTKRTIGZSA-N 343.383 1.159 10 10 EDCE Cc1ccc(CNS(=O)(=O)C2CC(=O)C2)c(O)c1Br 2352620701 SRLOGGSSWBEDGU-UHFFFAOYSA-N 348.218 1.614 10 10 EDCE COC(=O)C1=C(C)N(Cc2ccc3c(c2)OCO3)C(=O)/C1=C/N(C)C 33337339 KJLUJUODUYDSCX-UKTHLTGXSA-N 344.367 1.650 10 10 EDCE CCCN1CCCN(Cc2ccc(N3CCOCC3)cc2)CC1=O 189213365 JBWYLDJAJUXPRY-UHFFFAOYSA-N 331.460 1.968 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1nccs1 48001595 WOVHVHVYZFQGDN-UHFFFAOYSA-N 330.413 1.998 10 10 EDCE C[C@@H](NC1CCN(S(C)(=O)=O)CC1)c1ccc(F)c(F)c1O 191196149 CBQXKYWRCCQGHB-SECBINFHSA-N 334.388 1.745 10 10 EDCE COc1ccc(Br)c([C@@H](NCCN=[N+]=[N-])C(N)=O)c1 234833631 VTOATIUXLWGEHT-SNVBAGLBSA-N 328.170 1.884 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(C)CNCCO2)c(O)c1Br 2381139850 BSJCJOJNXXMXQU-CQSZACIVSA-N 343.221 1.458 10 10 EDCE C[C@]1(C(=O)O)CCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 588592668 YHQBLHNVUWKBDC-OCTSTCLRSA-N 344.411 1.860 10 10 EDCE CC[C@@H](NC[C@]1(CO)COCCN1C)c1cccc(Cl)c1O 903277419 GZZVNVYCYCZHAC-ZBFHGGJFSA-N 328.840 1.779 10 10 EDCE Cc1ccn2ncc(C(=O)NC[C@@H](N)c3ccc(N(C)C)cc3)c2n1 832280290 ORHRDFPELLGNSG-MRXNPFEDSA-N 338.415 1.534 10 10 EDCE CCOC(=O)[C@H]1NC(=O)N([C@H](C)Cc2ccc(N(C)C)cc2C)C1=O 842263958 BPTZXHGYPRUDNG-DOMZBBRYSA-N 347.415 1.476 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(CCF)CCOC)nc12 852482833 QIFSOXYXVZUQKL-UHFFFAOYSA-N 340.355 1.030 10 10 EDCE CCN(C)c1ccc([C@H](C)NCC[C@H]2CNCCS2(=O)=O)cc1 925798752 RKRAVLQFXCTZMQ-YOEHRIQHSA-N 339.505 1.570 10 10 EDCE COC[C@@](C)(CCO)NCC(=O)N(C)Cc1ccc(N(C)C)cc1 754668480 OXDIIMUOJJBBGK-GOSISDBHSA-N 337.464 1.088 10 10 EDCE CN1CCOC[C@]1(CO)CNCc1cc(Cl)cc(Cl)c1O 922535640 KKMXMFQWXGNVME-CQSZACIVSA-N 335.231 1.482 10 10 EDCE CN1CCN(c2ccc(CNC[C@@]3(O)C[C@H]4C=C[C@H]3C4)cc2)CC1 850373669 CDYQRQKGGRIUGM-BJLQDIEVSA-N 327.472 1.855 10 10 EDCE NC(=O)C[C@H]1CN(Cc2cccc(Br)c2O)CCO1 862535605 SPQADRLRRDIPAE-JTQLQIEISA-N 329.194 1.231 10 10 EDCE CN1C(=O)COc2ccc(NC(=O)Cc3ccc(O)c(O)c3)cc21 1147508963 YAOJMKAOXFVQEW-UHFFFAOYSA-N 328.324 1.634 10 10 EDCE CCOC(=O)[C@@H](c1cccnc1)N(C)C(=O)Cc1ccc(O)c(O)c1 1177685026 DNJHAHAUVRVCFZ-QGZVFWFLSA-N 344.367 1.798 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@](C)(O)[C@@H](O)C2)cc1Br 1893324434 GOTYXHNCWZRQDJ-IIMNLJJBSA-N 329.238 1.791 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)NCC[C@H]2CC2(Cl)Cl)cc1 1328561489 NMKIXKYTLZYLKO-NSHDSACASA-N 344.242 1.628 10 10 EDCE O=C(C[C@H]1COCCN1C(=O)Cc1ccc(O)c(O)c1)c1ccco1 1294655007 JQCXTHSZOZUXIU-ZDUSSCGKSA-N 345.351 1.734 10 10 EDCE C[C@H](CNC(=O)c1ccoc1)NC(=O)c1ccc(N=NC(N)=O)cc1 1295422570 NSNPPQJALHLWCF-SNVBAGLBSA-N 343.343 1.990 10 10 EDCE C[C@@H](NC(=O)c1ccc(CNS(C)(=O)=O)o1)c1ccccc1O 1471196096 URVFEEADFKXURM-SNVBAGLBSA-N 338.385 1.525 10 10 EDCE CN1C(=O)O[C@@H]2CN(c3ccc(CN)c(Br)c3)C[C@H]21 2120409971 MQVRRJICYJZJAP-VXGBXAGGSA-N 326.194 1.547 10 10 EDCE C[C@@H](CNC(=O)C(F)F)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1486780795 DIJMNCZOXZXUON-QMMMGPOBSA-N 341.318 1.691 10 10 EDCE COc1cccc(O)c1CNCc1nnc(Br)n1C 2121512409 BOALVTSIWXHFSD-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE Cc1cc(O)ccc1NS(=O)(=O)c1nn(C)cc1Br 2121902180 MHJQJMCTDJPNBY-UHFFFAOYSA-N 346.206 1.997 10 10 EDCE Cc1oc2ncn(C)c(=O)c2c1C(=O)NCc1ccc(O)cc1O 1643100761 JREVLEMGWUBIRZ-UHFFFAOYSA-N 329.312 1.176 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)C(C)(C)NC(C)=O)cc1C 1731736929 CPAZEGYDHLBXHS-CQSZACIVSA-N 349.475 1.903 10 10 EDCE CC1(C)C[C@@H](NC(=O)c2c(F)ccc(O)c2O)CCS1(=O)=O 1654836622 CAKOLYGNTVLPIX-QMMMGPOBSA-N 331.365 1.323 10 10 EDCE CNC(=O)CN(C)c1ccc(C=CC(=O)O)cc1Br 1911962894 HAWHVASZCDOTSF-UHFFFAOYSA-N 327.178 1.729 10 10 EDCE CNC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccccc2O)cc1 159631676 LRTPHYBLQDCBPT-UHFFFAOYSA-N 334.397 1.573 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1912156601 NFBWXUNEMFXGBJ-ZETCQYMHSA-N 349.214 1.504 10 10 EDCE NCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2134821296 SHACYTULFLPQGC-HBEIAFGSSA-N 327.222 1.228 10 10 EDCE CO[C@H](CNCc1cccc(O)c1O)CNC(=O)OC(C)(C)C 1901546961 REVPMMNPNQYFOG-GFCCVEGCSA-N 326.393 1.727 10 10 EDCE CC(=O)C(=O)[C@]1(O)CN(C(=O)OC(C)(C)C)C[C@]2(CCCO2)C1 1924244664 DDYKUIXNMGOQBF-JKSUJKDBSA-N 327.377 1.066 10 10 EDCE C[C@@]1(C(=O)O)COCCN1Cc1cc(Br)ccc1O 2136512631 TUOPFVKOOHHLNY-ZDUSSCGKSA-N 330.178 1.830 10 10 EDCE O=S1(=O)CCN[C@H](c2cc(Cl)cc(Br)c2O)C1 1952594540 GBRRVILTSKFVTO-VIFPVBQESA-N 340.626 1.867 10 10 EDCE CO[C@@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCN(C(=O)OC(C)(C)C)C1 1985094770 UEOXVDVQTNNWIM-AWEZNQCLSA-N 325.369 1.534 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@@H](O)CNC(=O)OC(C)(C)C)c1 2011423459 SGHCEUJPNAIHOU-VXGBXAGGSA-N 340.420 1.937 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)NCC2(CN=[N+]=[N-])CC2)C1 2012308677 BODXRMCZPJFXCW-UHFFFAOYSA-N 339.396 1.611 10 10 EDCE C[C@H](NCc1ccc(F)cc1O)C1(O)CN(C(=O)OC(C)(C)C)C1 2024902138 OWSCXUCOMUHXKR-NSHDSACASA-N 340.395 1.991 10 10 EDCE CCNCc1ccc(N2CC[C@@H](NC(N)=O)C2)c(Br)c1 690812661 KGQFBIYBFDVKIW-LLVKDONJSA-N 341.253 1.806 10 10 EDCE NCc1cc(F)c(N2CCSC[C@H]2CO)cc1Br 387813329 SXNQKGRJEDQZGQ-SECBINFHSA-N 335.242 1.961 10 10 EDCE CNC(=O)[C@H]1[C@@H](C)CCN1c1ccc(CN)cc1Br 2090258551 JHEHOXASOBIPBV-TVQRCGJNSA-N 326.238 1.869 10 10 EDCE CCN(c1ccc(CO)c(Br)c1)[C@@H]1CC(=O)NC1=O 2114729475 JYTNITSAHDDRKT-LLVKDONJSA-N 327.178 1.183 10 10 EDCE COc1ccc(N(C)C[C@@](N)(C(=O)O)C2(Br)CC2)cc1 2206636375 GDBRWGQHDITVBJ-CQSZACIVSA-N 343.221 1.841 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)C[C@H](CO)C2)cc1Br 2236633839 RYPBLUFJXYXNCF-SRVKXCTJSA-N 343.265 1.896 10 10 EDCE COc1ccc(Br)c(CN2CC(F)(C(=O)O)C2)c1O 2227742763 JMNHGUXOWAVHDX-UHFFFAOYSA-N 334.141 1.772 10 10 EDCE CNC[C@H]1CC[C@H](S(=O)(=O)NCc2cnc(SC)s2)C1 2284692767 WGYIRQFNPSMHRD-ONGXEEELSA-N 335.520 1.673 10 10 EDCE CO[C@H](C)[C@H](N)C(=O)NCc1ccc(C)c(Br)c1O 2352634060 QCAJBRGPDNUSJM-KCJUWKMLSA-N 331.210 1.442 10 10 EDCE CC(C)S(=O)(=O)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 170998999 CSKGDMCWIFJIKP-VMPITWQZSA-N 338.429 1.391 10 10 EDCE COc1ccc(N2CCN(C(=O)CC[C@@H]3CN(C)C(=O)O3)CC2)cc1 74683300 AQTSUNXYJATQOV-MRXNPFEDSA-N 347.415 1.575 10 10 EDCE CCCN(CCC(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)=O 243530859 ODHHJFPDGJAIKS-UHFFFAOYSA-N 347.459 1.992 10 10 EDCE Cc1ccc(N(C)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)cc1Cl 254983394 YTOTVUBUQQXPFU-VURMDHGXSA-N 347.802 1.722 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2CCOc3ncc(C)cc32)c1 255108225 LOZHSLLFSHTAHD-ARJAWSKDSA-N 338.367 1.583 10 10 EDCE CCC(=O)N[C@H](CCSC)C(=O)NCc1cccc(OC)c1O 264237333 BDQBIBQYVHOHPW-GFCCVEGCSA-N 340.445 1.665 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCn3cnnc3[C@@H]2C)c([N+](=O)[O-])c1 276596073 CFZIGGGFEHQAKF-MALLOTDXSA-N 343.343 1.954 10 10 EDCE C[C@@H]1C[C@@H](N2CCCC2)CN1c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 376206581 ZUHWYTSRNDZAKO-VXGBXAGGSA-N 346.387 1.989 10 10 EDCE C[C@@H](NC(=O)C(=O)NCc1cscn1)c1ccc(N(C)C)cc1 804019585 CFFFCHGUKQZDJY-LLVKDONJSA-N 332.429 1.703 10 10 EDCE C[C@@]1(C(=O)NCc2cc(Br)ccc2O)CCC(=O)NC1 804741202 UWMASKRKTRWTAI-CQSZACIVSA-N 341.205 1.687 10 10 EDCE Nc1nccc([C@H]2CCCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)n1 803234951 UFSHZBOWDZYINJ-AGLBCWCQSA-N 340.383 1.889 10 10 EDCE CC1(C)OCCN(c2ccc(CO)cc2Br)[C@H]1CO 2267740055 ULHAHJLMVWULQS-ZDUSSCGKSA-N 330.222 1.918 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](N)C(C)(C)C1 903750873 WAPIFOOXQJQDIV-MRXNPFEDSA-N 347.459 1.717 10 10 EDCE CC[C@H](NC[C@@]1(OC)CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 903368286 MPQZFIYPJDGHSZ-IRXDYDNUSA-N 340.489 1.997 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1COC2(CCC2)C1 830091333 VOYSUACGBVKKGU-HNNXBMFYSA-N 345.443 1.539 10 10 EDCE C[C@@H](c1ccc(N2CCOCC2)cc1)N1C(=O)N[C@@H](CCF)C1=O 844723273 WFXTWTPWNYWXGG-WFASDCNBSA-N 335.379 1.864 10 10 EDCE O=S1(=O)CC[C@]2(CN(Cc3ccc4ccccc4c3O)CCO2)C1 843425768 IJWLRWBOJJOAAD-SFHVURJKSA-N 347.436 1.935 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)N(C)C(C)C)C2)cc1 849416290 OEBWIOIDOAHMLP-CYBMUJFWSA-N 327.450 1.449 10 10 EDCE Cc1cc(O)c(CN(C)[C@H]2CCN(S(C)(=O)=O)C2)c(Cl)c1 840950084 JNIZCLGFVFWUIU-NSHDSACASA-N 332.853 1.820 10 10 EDCE COC(=O)[C@@H]1CCN(C(=O)NCCCSc2nccs2)C1 759591095 UZKSSDBRZGOJKV-SNVBAGLBSA-N 329.447 1.830 10 10 EDCE CCn1cc([N+](=O)[O-])c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n1 757594833 SLXCRDQTKMHGMN-SECBINFHSA-N 334.332 1.583 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3CO[C@@H](C)[C@H]3C)CC2)cc1 924832180 PRBAVQIBMOFJMP-JTDSTZFVSA-N 333.476 1.830 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)COCC(F)(F)F)C2)cc1 855224990 HFXNJEDQGMGFPL-NSHDSACASA-N 332.322 1.969 10 10 EDCE CN1CCCC[C@@H](N(C)Cc2ccc(N3CCOCC3)cc2)C1=O 931470895 GGKKCOHBSLEDBT-GOSISDBHSA-N 331.460 1.966 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cc3cnn(C)c3C)C2)cc1 855227021 SOMCSIHIEVAVSE-OAHLLOKOSA-N 328.416 1.675 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2Cc1coc(S(N)(=O)=O)c1 851881932 QVOOBWZRFYDKSZ-UHFFFAOYSA-N 337.401 1.392 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@H]1CC[C@@H](C)NC1)c1ccc(N(C)C)cc1 861768062 WAMWNZSABSFJDJ-IPYPFGDCSA-N 332.448 1.187 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@H]3CC3(C)C)C2)cc1 1118683376 WOMCBLZEBZOGJE-KGLIPLIRSA-N 345.443 1.552 10 10 EDCE COC[C@H](NCc1cc(OC)c(OC)cc1O)[C@H]1CCCOC1 895854951 OGIWWSYJWKDWIY-JSGCOSHPSA-N 325.405 1.941 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3COCC[C@H]3OC)C2)cc1 895650864 PIOPROQXUPRUFY-KBRIMQKVSA-N 349.431 1.377 10 10 EDCE Cc1cc(N(C)C)ccc1CNCCc1nnc2c(=O)n(C)ccn12 895789841 QEVQZHWXSSHXBW-UHFFFAOYSA-N 340.431 1.135 10 10 EDCE COCCN(c1cc(Br)c(CN)cc1F)C1COC1 1879160057 VISVALHZLGIWMD-UHFFFAOYSA-N 333.201 1.899 10 10 EDCE C[C@@H](NC(=O)CCNS(=O)(=O)c1cccnc1)c1ccccc1O 1302530731 XUEHHSMRVCKYNG-GFCCVEGCSA-N 349.412 1.333 10 10 EDCE COc1ccc(CNCCC2CCN(C(=O)C(N)=O)CC2)cc1C 1318907150 MWMNIKYMLFPUQR-UHFFFAOYSA-N 333.432 1.207 10 10 EDCE COc1ccc(Br)c(CNCCC(=O)N(C)C)c1O 1964034951 IDRLRJHOJXKGSX-UHFFFAOYSA-N 331.210 1.731 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](NC(N)=O)C2)cc1Br 690738163 NEZFMODVBQFJAG-IUCAKERBSA-N 328.210 1.749 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@H]2CN(C)CCO2)cc1C 1267984618 QODKMIWWPAAGOU-RDTXWAMCSA-N 349.475 1.176 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C(C)(C)F 1526697885 HKXVUCRBIVPWCA-VIFPVBQESA-N 337.355 1.832 10 10 EDCE CCOC(=O)[C@]1(CNC(=O)/C=C\c2ccc(O)c(O)c2)CCCOC1 1454294942 HORCLRUHLUHWPL-YEODSOHDSA-N 349.383 1.587 10 10 EDCE O=C1N[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)CCO1 1450709873 HVUQYXIUJCLHPT-GFCCVEGCSA-N 337.339 1.833 10 10 EDCE CC(C)[C@@H](F)C(=O)NC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1530589860 BHGACDKHOPMHLJ-CYBMUJFWSA-N 349.366 1.784 10 10 EDCE Oc1cc(Br)ccc1CN[C@@]12CC[C@@H](C1)[C@H](O)[C@@H]2O 2120394913 OWVYKKAKHPDPCS-GZBPVQSJSA-N 328.206 1.519 10 10 EDCE CC[C@H](CNC(=O)c1cn(CC)nn1)NCc1ccc(OC)c(C)c1 1481864528 PLTBQQNOEUEKCD-OAHLLOKOSA-N 345.447 1.913 10 10 EDCE CCCC(=O)N[C@H]1C[C@@H](NCc2nnnn2-c2ccc(OC)cc2)C1 1713977599 HKRIXRWJWFNYCK-BETUJISGSA-N 344.419 1.208 10 10 EDCE COCCCN[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1C 1484909173 IPCYJVNQYVTRSS-DOMZBBRYSA-N 347.419 1.936 10 10 EDCE NC(=O)N[C@H](CC(=O)NCc1ccc(O)cc1O)c1ccccc1 1557085044 ZRKQPSCZJYJPLJ-CQSZACIVSA-N 329.356 1.514 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(CN(C)C)nc1 1624955226 VFQKRGWNIRLYCL-LBPRGKRZSA-N 329.400 1.915 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C[C@@H]2CCCC(=O)N2)cc1C 1497853853 BGQCGJIMXMIBNF-ZBFHGGJFSA-N 347.459 1.657 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2COCCO2)cc1C 1491984928 JGNDQBOZCHCHJO-WMLDXEAASA-N 336.432 1.403 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1723097666 ZXHHPUXFIHCVSU-VQFNDLOPSA-N 332.444 1.834 10 10 EDCE CC[C@@H](O)Cn1cc(C(=O)N[C@H](C)c2cc(OC)ccc2O)nn1 1631541851 BIPMSECINYYIDR-GHMZBOCLSA-N 334.376 1.254 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCn2cccnc2=O)cc1 1640201314 AZBGBGDOXBMZFD-UHFFFAOYSA-N 328.332 1.226 10 10 EDCE CCC(CC)C(=O)NC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1737550292 ABTRIWBIJCEHAZ-LLVKDONJSA-N 337.420 1.770 10 10 EDCE C[C@@H](NC(=O)CCCn1cnc2c(N)ncnc21)c1ccccc1O 1587446986 FLISESXNMPVBDY-LLVKDONJSA-N 340.387 1.772 10 10 EDCE Cn1ncc(Br)c1C(=O)NCc1cc(O)ccc1O 1651225620 QSRQKRGJJUIABZ-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@@H](C)SC)cc(OC)n1 1758771294 BMJQKBJICKFEBX-NXEZZACHSA-N 341.433 1.085 10 10 EDCE C[C@@H](NC[C@H](CO)NC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985854353 SDZTURMYCMNQTJ-GHMZBOCLSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@](O)(C(=O)NCCCN=[N+]=[N-])C1 1986145672 XCKULALAFDLSIP-CQSZACIVSA-N 327.385 1.565 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4C(CO)[C@@H]4C3)c(Br)cc21 2146877407 QGDQTQZLUVAAEI-RBDZCENOSA-N 338.205 1.076 10 10 EDCE CNCc1ccc(N2C[C@H]3[C@@H](C2)OCCN3C)cc1Br 2153999098 YRQYAUJFUQEWFW-LSDHHAIUSA-N 340.265 1.688 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010393499 SYFYOVMZCZICAU-QJPTWQEYSA-N 339.396 1.516 10 10 EDCE CN(C)C(=O)CN(CC(=O)c1ccc(O)c(O)c1)Cc1ccccc1 2034784042 VOZULLFDJCOUMD-UHFFFAOYSA-N 342.395 1.871 10 10 EDCE O=C(O)[C@H]1OCC[C@H]1CNCc1c(O)cccc1Br 716260333 CHXWJKRTKKKNKW-UFBFGSQYSA-N 330.178 1.734 10 10 EDCE CN1C[C@@H](CNCc2cc(Br)cc(F)c2O)CC1=O 723590734 XRHLZTBKZYDIGV-MRVPVSSYSA-N 331.185 1.862 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCc3nnn(C)c32)c1 2062455462 HYLVKTHLLWVQQI-JQWIXIFHSA-N 330.388 1.827 10 10 EDCE NCc1ccc(N2CCC[C@]3(CNC(=O)N3)C2)c(Br)c1 2177692183 SRPBZMUXWJKICF-AWEZNQCLSA-N 339.237 1.560 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(CO)(OC)C2)cc1Br 2101061918 IQWCEQBELZBBCG-JTQLQIEISA-N 329.238 1.927 10 10 EDCE CNCc1ccc(N2CC[C@H](OCCO)C2)c(Br)c1 2109109781 MOQBSSJSNZPUIS-LBPRGKRZSA-N 329.238 1.756 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@@H](N(C)C)C2)cc1Br 2089926827 NJKURMXCQGZJMC-HERUPUMHSA-N 329.238 1.614 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)cc1Br 2336343265 QKVQQCHMODZSRZ-IGJMFERPSA-N 345.262 1.702 10 10 EDCE Cc1ccc(CN2CC(NS(C)(=O)=O)C2)c(O)c1Br 2352668583 WZYMCXWZQKVDSR-UHFFFAOYSA-N 349.250 1.197 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2[C@H]3CN[C@H]2C3)c(O)c1Br 2352947156 GLEPIYWYEKPXCL-OUAUKWLOSA-N 325.206 1.687 10 10 EDCE CN1C(=O)CCc2cc(N3CCN(C(=O)[C@H]4CCCO4)CC3)ccc21 62575704 KSMGAWFWBVGBFB-QGZVFWFLSA-N 343.427 1.423 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](N=[N+]=[N-])[C@H](O)[C@@H]2OC(C)(C)OC[C@@H]21 616582328 BGHCGGRUDRVRAI-XWLWVQCSSA-N 328.369 1.797 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3cncnc3)CC2)cc1 273692526 IBOBVZWVSIBXEM-UHFFFAOYSA-N 341.415 1.037 10 10 EDCE COc1cc(N2CCCN(CCO)CC2)c([N+](=O)[O-])cc1OC 391195019 VNPPKXGPKGQRND-UHFFFAOYSA-N 325.365 1.116 10 10 EDCE CN(C)CC1(O)CCN(c2ccc(CO)cc2Br)CC1 710611983 TTWTXGNSEZNXCZ-UHFFFAOYSA-N 343.265 1.834 10 10 EDCE COC[C@H](CCCN)NCc1ccc(N2CCC(CO)CC2)cc1 817894986 PWPOTTBRZQIGCE-SFHVURJKSA-N 335.492 1.739 10 10 EDCE CNC(=O)[C@@H]1CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])C1 817124503 HAXBIQTYEVDAPR-FVOPLDGLSA-N 333.344 1.353 10 10 EDCE Cn1cnc(CCCNC(=O)NCc2ccc(N3CCCC3)cc2)n1 825721155 KJIWPCZYXVNLGA-UHFFFAOYSA-N 342.447 1.847 10 10 EDCE N[C@@H](c1ccccc1O)C1(O)CN(C(=O)OCc2ccccc2)C1 1955021296 SKDFTEJHXMEUQZ-INIZCTEOSA-N 328.368 1.776 10 10 EDCE C[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1CCN 903497428 WIWFFQSLEGLRLB-NVXWUHKLSA-N 332.492 1.628 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCOC1 849369579 YWXRBMVHIVCJFX-GOEBONIOSA-N 342.461 1.224 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@H](O)c1ccnn1C 919082167 WHRGYBGBMJHIOB-MRXNPFEDSA-N 331.420 1.327 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)C[C@@H]3CCOC3)C2)cc1 849415546 BRULXENUYZGCCP-KGLIPLIRSA-N 340.445 1.230 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3cncc(O)c3)C2)cc1 923185239 DOUYSWNHIUWXCT-AWEZNQCLSA-N 342.399 1.874 10 10 EDCE Cc1cnc(N)c(S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)c1 842783723 BWNSTJWZSRRKHD-AWEZNQCLSA-N 349.460 1.017 10 10 EDCE NC/C=C\CNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 841915483 QLMHNNKXHKTGRY-UPHRSURJSA-N 340.374 1.116 10 10 EDCE CC(C)C(=O)Nc1ccc(NC=C2C(=O)NC(=S)NC2=O)cc1 920978898 MYLYAWUWJXQXCZ-UHFFFAOYSA-N 332.385 1.108 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@@H](C)[C@@H]1O 853474921 SXJGRRZEEYPMQU-HWWDLCQESA-N 347.459 1.682 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@H]3CCO)C2)cc1 854297882 SPILEUDIQTXDKT-ZBFHGGJFSA-N 333.432 1.830 10 10 EDCE CC(=O)C(=O)COC(=O)COc1ccc(Br)c(C)c1 923387206 WECXXIQXRPNPFH-UHFFFAOYSA-N 329.146 1.838 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCc3cncnc3)C2)cc1 855226655 PKNQFPPIXQPOOA-OAHLLOKOSA-N 326.400 1.813 10 10 EDCE C[C@@H]1OC[C@H](NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)[C@H]1C 924728567 JKDLNNRZVLSLAP-KMCQBPLKSA-N 331.460 1.901 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccoc3CC(N)=O)C2)cc1 855224378 FUZJZGJJCBVOKS-GFCCVEGCSA-N 343.383 1.325 10 10 EDCE COc1ccc(N(C)Cc2coc(S(N)(=O)=O)c2)c(OC)c1 851864708 IOWUTVBEFLBBNU-UHFFFAOYSA-N 326.374 1.581 10 10 EDCE CC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 751358529 ORZMBXMNOIQOAU-MRXNPFEDSA-N 349.456 1.061 10 10 EDCE Oc1cc2c(cc1CN1CCO[C@H](CC(F)(F)F)C1)[C@H](O)CO2 853614253 SKSQXQZUSKPMPV-ZWNOBZJWSA-N 333.306 1.971 10 10 EDCE NC(=O)c1cccc2c1CCN(Cc1cc3c(cc1O)OC[C@@H]3O)C2 853621732 GSNDCSYHNMHSTR-KRWDZBQOSA-N 340.379 1.475 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCC[C@H]2c2ccc(O)nn2)cc1 861526390 QEXWCEZZAZGRCQ-ZDUSSCGKSA-N 327.344 1.067 10 10 EDCE CCOC1(CS(=O)(=O)N[C@H](C)c2ccccc2O)CCOCC1 867835117 UIXYPMVUSXQRKH-CYBMUJFWSA-N 343.445 1.958 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@H]2CNCC[C@@H]21 866717088 VNEGXBZWKSUDEN-HKUYNNGSSA-N 344.503 1.785 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C3CCN(OC)CC3)C2)cc1 869229377 VNXWUMNNFIHSKR-HNNXBMFYSA-N 333.432 1.664 10 10 EDCE CN1CCN(C)[C@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)C1 1119457188 YNUTWKUHSXSNHW-LLVKDONJSA-N 335.429 1.288 10 10 EDCE C[C@@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccccc1O 783535331 LVQURFXMJJBAGF-UKRRQHHQSA-N 328.416 1.968 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN(C(=O)CO)CC2)c1 793594908 URPHWVDYVIBLQS-UHFFFAOYSA-N 343.221 1.100 10 10 EDCE Cn1nccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCN=[N+]=[N-] 1963704833 UVOBXGSKVITLEH-LLVKDONJSA-N 337.384 1.803 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@H](Cn3ccnn3)C2)cc1F 1333722787 RVCHJYDVGZTWRI-AWEZNQCLSA-N 346.410 1.715 10 10 EDCE [N-]=[N+]=NCCN[C@@H](C(N)=O)c1cc(Br)c2c(c1)OCO2 90258115 OOQLRGBGJGMUNL-SECBINFHSA-N 342.153 1.604 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N(CCO)C3CC3)c(Br)cc21 92775596 SKAUBDYTQHEDBQ-LBPRGKRZSA-N 326.194 1.362 10 10 EDCE CCCC(=O)NC[C@H](C)NCc1nnnn1-c1ccc(OC)cc1 1266918072 QEFPVWSXGZAFMR-LBPRGKRZSA-N 332.408 1.065 10 10 EDCE C[C@H](NCCO)[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1501091662 POCNBZVAXCMBLF-WCQYABFASA-N 333.392 1.282 10 10 EDCE COCC(=O)N[C@@H](C)[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1285270612 XTGLDUKNLJNQSN-UWVGGRQHSA-N 335.364 1.118 10 10 EDCE CC(C)C(=O)NC[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1532115680 LIRQWZRDCGXCGN-LLVKDONJSA-N 333.392 1.987 10 10 EDCE O=S1(=O)C[C@H]2C(CNCc3cc(Br)ccc3O)[C@@H]2C1 2117990093 ZHPNTEWEVVHRLI-RYUDHWBXSA-N 346.246 1.535 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CC(=O)N(c2cccc(F)c2)C1 1471660863 BWYMRJMYVNNGBT-LBPRGKRZSA-N 344.342 1.906 10 10 EDCE CCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3COC[C@H](O)[C@@H]3O)ccc21 1615128980 DVFAWZADSIFBAC-FHLIZLRMSA-N 346.427 1.376 10 10 EDCE CN(C(=O)c1cccc(O)c1O)[C@@H]1CCCC[C@H]1S(C)(=O)=O 1629859611 JCPHGPPNOWWELD-DGCLKSJQSA-N 327.402 1.526 10 10 EDCE CONC(=O)CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1559293472 CTZMMIOWLMOWKR-UHFFFAOYSA-N 329.312 1.915 10 10 EDCE CC(C)CNC(=O)[C@@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1623610906 HNYSHIOZEPSSLL-LBPRGKRZSA-N 338.429 1.314 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]([C@@H]1CCCO1)C1(CO)CCC1 1639166777 FPJONNMJYPXUBR-DOTOQJQBSA-N 335.400 1.467 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ncnc(O)c2Br)c1 1640800691 ULXLOFUMDVOGDV-UHFFFAOYSA-N 338.161 1.889 10 10 EDCE Cc1cc(S(N)(=O)=O)oc1C(=O)NCc1cc(Cl)ccc1O 1640923981 CZTITUWOWWGBDK-UHFFFAOYSA-N 344.776 1.524 10 10 EDCE COC[C@H](C)NC[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1732371544 BUWJQEXCKLRRIV-RYUDHWBXSA-N 335.408 1.839 10 10 EDCE CO[C@@H](C)CNCC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1668326612 SWJYNGDPXGNBOV-NEPJUHHUSA-N 335.408 1.982 10 10 EDCE CC(C)OCCNC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1669486245 ZRUUBFREZVDRSE-GFCCVEGCSA-N 335.408 1.982 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)CS(C)(=O)=O)cc1C 1690833387 FGUNSRTUCAYOCU-CYBMUJFWSA-N 342.461 1.033 10 10 EDCE CC(C)[C@@H](O)CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 153806324 CZIPTCGXHPLCNS-INIZCTEOSA-N 339.411 1.478 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)CCCCN)c2nccn2C)cc1 1866097248 BVKMEPGIHDZZMM-KRWDZBQOSA-N 329.448 1.821 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CC(=O)NC3(C)C)CC2)cc1 1889845168 LWMMVGMHJLLRAW-HNNXBMFYSA-N 331.416 1.259 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CCC[C@H](O)C3)c(Br)cc21 118711939 BWVNFYWRDCMUGZ-ISVAXAHUSA-N 340.221 1.623 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985095066 YIPFGQOXENMIDY-MXWKQRLJSA-N 325.369 1.268 10 10 EDCE CC(C)(C)OC(=O)N1CC(CNCc2ccc(N)cc2)(C(N)=O)C1 1997072379 SIBBRWKKPVKSHP-UHFFFAOYSA-N 334.420 1.081 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3C[C@H](O)C[C@@H]3C2)cc1Br 405475100 LRBICTBYEKCTLZ-RAIGVLPGSA-N 340.265 1.724 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCOC4(CCOCC4)C3)c2n1 2062985943 LZGHJASVVXXWIX-GFCCVEGCSA-N 346.387 1.201 10 10 EDCE CNCc1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)cc1Br 2178088232 WMZFLPZDNGGWFX-WHOFXGATSA-N 341.249 1.612 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1COC[C@@H]1NC(=O)Cc1ccc(N)cc1 2044235991 WFLVOYRRBFOUHO-HIFRSBDPSA-N 349.431 1.467 10 10 EDCE CN(Cc1cnnn1C)c1cc(Br)c(CN)cc1F 2100240600 LYMPNHMJZNVRNR-UHFFFAOYSA-N 328.189 1.812 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H](N(C)C)C2)cc1Br 2089926807 NCAPQIIAOFDPEH-HERUPUMHSA-N 328.254 1.580 10 10 EDCE Oc1c(F)cc(Br)cc1CNCC[C@H]1COC[C@H]1O 2111325791 LUQKGVCMAAOKPQ-QPUJVOFHSA-N 334.185 1.781 10 10 EDCE N=c1[nH]cc(Br)c(=NCCc2ccc(O)c(O)c2)[nH]1 2091749334 XHPNSGKZBMWTTB-UHFFFAOYSA-N 325.166 1.139 10 10 EDCE CC(C)(C)OC(=O)N1CC(F)(F)C[C@@]1(C)COc1nnc(=N)[nH]n1 2213782408 DUUZDXPVVQMZKO-LBPRGKRZSA-N 346.338 1.093 10 10 EDCE COc1ccc(Br)c(CNCc2cc(CO)n[nH]2)c1O 2236052970 NTVQLHZOQFDXJE-UHFFFAOYSA-N 342.193 1.669 10 10 EDCE NCc1ccc(N2C[C@H]3OCC[C@]3(CO)C2)cc1Br 2278936323 IMSZKCHMVMAQNI-ZIAGYGMSSA-N 327.222 1.495 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@H](O)CC2)c(Br)c1 2269136884 CNERMTRAVIINOH-OWYVNGRQSA-N 329.238 1.791 10 10 EDCE CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C\c1c(O)[nH]c(=O)[nH]c1=O 101123849 TZURWIRYILGQHL-POHAHGRESA-N 346.730 1.228 10 10 EDCE COCCN1CCN(CC(=O)NCc2ccc(N(C)C)cc2)C[C@H]1C 105832716 BXYVRTKTUWIZNR-MRXNPFEDSA-N 348.491 1.021 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@@H]2CCCN(S(C)(=O)=O)C2)c1 182414299 ZZLXZHYXEGJBQH-STQMWFEESA-N 342.461 1.723 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnoc1-c1cnn(C)c1 194377480 HOWFVHAJPIESQE-JTQLQIEISA-N 342.355 1.847 10 10 EDCE COc1ccc(N2CCN(C(=O)N3CCOCC3)CC2)cc1OC 41379784 MAHQYJIKSPUMGL-UHFFFAOYSA-N 335.404 1.278 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)Cc2ccccc2C(N)=O)c1 190923563 ZPIDIQZLJBPZJP-NSHDSACASA-N 328.368 1.920 10 10 EDCE Cc1ccc(CNC(=O)c2cnn(C)c2N)c(O)c1Br 2380739593 LWLFSHBYAIRZJO-UHFFFAOYSA-N 339.193 1.709 10 10 EDCE Cc1ccc(CNC(=O)CO[C@H]2CCNC2)c(O)c1Br 2380746775 WVSARXLEEKMBCX-NSHDSACASA-N 343.221 1.458 10 10 EDCE C[C@H]1C(=O)N(C)CN1C(=O)NCc1ccc(N2CCSCC2)cc1 825727724 JFZGSAAYVKGEEG-ZDUSSCGKSA-N 348.472 1.569 10 10 EDCE COc1ccccc1[C@@H](O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 907272195 FUCCMCCVCNACTL-PIGZYNQJSA-N 331.368 1.887 10 10 EDCE Cn1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nc1O 830899513 GFUGOPNOERLQAL-ZDUSSCGKSA-N 331.372 1.653 10 10 EDCE CCOc1ccc(O)c(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1 843425698 FJVHUQCWJPKDBV-INIZCTEOSA-N 341.429 1.180 10 10 EDCE CCN(CC)c1ccc(CN(C)CC2CN(S(C)(=O)=O)C2)cc1 929183539 BFRANWDTEOESSO-UHFFFAOYSA-N 339.505 1.856 10 10 EDCE COCc1nc(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)n(C)n1 853808274 GAEVPQGQSHVLSD-ZDUSSCGKSA-N 345.447 1.697 10 10 EDCE CN(C)CCC[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)CCO1 853625647 UTBPGSZBPOKYGV-PBHICJAKSA-N 336.432 1.361 10 10 EDCE Cc1ccc(C(=O)NCCNC(N)=O)cc1-n1c(C)cc(C=O)c1C 859422840 BNHAHNGGYGBZSU-UHFFFAOYSA-N 342.399 1.613 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC[C@H]3CCOC3)C2)cc1 852250827 FDQRZOAAAWYTGP-GJZGRUSLSA-N 333.432 2.000 10 10 EDCE COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc3nccn3c2)c1 774248912 UKQVZJRMXCIJCT-UHFFFAOYSA-N 340.339 1.303 10 10 EDCE CCN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)Cc1cn(C)nn1 782098261 CQGCZMAUZKBVOF-UHFFFAOYSA-N 344.463 1.362 10 10 EDCE Cc1cc(C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)cnn1 786393738 NMKKGHQVLLVJJO-UHFFFAOYSA-N 342.399 1.666 10 10 EDCE COc1cccc(O)c1CNC[C@]1(O)[C@H]2[C@H]3C[C@@H]4[C@@H]5[C@H]3[C@H]1[C@@H]5C[C@H]42 785543273 GRAATZROPDVWDZ-SOALCXOCSA-N 327.424 1.999 10 10 EDCE Cc1nnc(Cn2nnc(C(=O)N[C@@H](C)c3ccccc3O)c2C)o1 1151891897 DHNHRTSKFQKDQY-VIFPVBQESA-N 342.359 1.523 10 10 EDCE COC(=O)NCC(=O)N1C[C@@H](C)[C@@H](NCc2ccc(OC)c(C)c2)C1 1502703527 MVYMBVVPBVKOAM-HIFRSBDPSA-N 349.431 1.296 10 10 EDCE COCC(=O)NC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(C)C 1357083047 YUGAUOZROWHSDL-ZDUSSCGKSA-N 349.391 1.366 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2CN(C)C(=O)N2)cc1C 1503413952 CFCBGAICXBTZAW-ZFWWWQNUSA-N 348.447 1.012 10 10 EDCE NC(=O)Cc1cccc2c1CCN(C(=O)Cc1ccc(O)c(O)c1)C2 1454680800 YRVWEKZGBYQOMP-UHFFFAOYSA-N 340.379 1.253 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)NCc2cc(C)ccc2O)c1 1453654488 ZDGUSVLDLQUYOZ-XQRVVYSFSA-N 325.368 1.785 10 10 EDCE O=C(NCc1ccccc1O)c1cccc(C(=O)N2CCCC2)n1 1294925058 MBJXKKOIPNFKDH-UHFFFAOYSA-N 325.368 1.953 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H](Cc1nc[nH]n1)c1ccccc1 1616723778 MOSUWJVDDBPSCS-CQSZACIVSA-N 338.367 1.859 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)CCC2CC2)cc(OC)n1 1704015979 PJHRGVNDQZBUQX-LLVKDONJSA-N 335.404 1.524 10 10 EDCE CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1cccc(O)c1O 1546271484 DHTLUUMQBMXZGJ-GFCCVEGCSA-N 339.388 1.965 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2ccc(=O)n(C)c2)cc1C 1483244230 ZRJBAXKRQYTJLT-AWEZNQCLSA-N 343.427 1.610 10 10 EDCE O=C(NCc1ccc(O)cc1O)C1=NN(c2ccccc2)C(=O)CC1 1626838184 PXVOAHLMAFETDM-UHFFFAOYSA-N 339.351 1.897 10 10 EDCE O=C(c1cccc(O)c1O)N1CCC2(CCC2)S(=O)(=O)CC1 1557042971 JEDVDESPEUKMPH-UHFFFAOYSA-N 325.386 1.281 10 10 EDCE Cc1ccc(C(=O)NC[C@@H]2c3ccccc3C(=O)N2C)c(O)c1O 1632091725 QSVFAUJBPXHHNP-CQSZACIVSA-N 326.352 1.963 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2cnn(C)c2)cc1C 1666848972 CAROQYAEPKBGSM-CQSZACIVSA-N 330.432 1.987 10 10 EDCE C[C@H](O)CNC[C@H]1CCCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1673136525 YTQNYJUPSFIJMZ-SWLSCSKDSA-N 347.419 1.814 10 10 EDCE COCCCNC(=O)c1c(NS(C)(=O)=O)sc2c1CCCC2 1871343605 YEHUTLWLSXJBAS-UHFFFAOYSA-N 346.474 1.765 10 10 EDCE Cc1c(OCC(=O)c2ccc(O)c(O)c2)c(=O)ccn1CCCN 1857917017 XYRJJXLMZDNXRL-UHFFFAOYSA-N 332.356 1.178 10 10 EDCE CN(C)[C@H]1COC[C@@H]1NCc1cc(Br)cc(F)c1O 1921989616 CROTXZFRQMUVID-RYUDHWBXSA-N 333.201 1.712 10 10 EDCE CC1(C)[C@@H](O)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2136627679 BGOMPNULTPCNES-WDEREUQCSA-N 326.194 1.361 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 1985102545 IHNWBGPMEOVLDZ-WDEREUQCSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1CC(=O)NCCCN=[N+]=[N-] 1987645740 FSRNDJLUMJKZHS-QWRGUYRKSA-N 327.385 1.733 10 10 EDCE COC[C@](C)(NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 2010266108 ZIFJHWPIXHWWJP-KRWDZBQOSA-N 338.404 1.938 10 10 EDCE COc1cccc(CN=c2nc(CNC(=O)OC(C)(C)C)[nH][nH]2)c1O 2063194373 AGWJUEDINWSSGE-UHFFFAOYSA-N 349.391 1.578 10 10 EDCE CC(C)[C@@H]1C(=O)NCCN1c1ccc(CN)c(Br)c1 2113699524 MDYIPLHREZETEL-CYBMUJFWSA-N 326.238 1.869 10 10 EDCE CCN(c1ccc(CNC)cc1Br)[C@@H]1CCNC1=O 2114768085 VKZRMQBQJYIZAF-CYBMUJFWSA-N 326.238 1.883 10 10 EDCE Cn1nc(Br)c(CN2CCCc3cc(CN)ccc32)n1 2235283422 HCHQWZGNQLUXSO-UHFFFAOYSA-N 336.237 1.989 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2236635951 LISXGMPLLIRXTB-UTUOFQBUSA-N 344.249 1.930 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)C[C@H]3C2)c(Br)c1 2236979105 MBYJIUARNAPVMJ-LWWSYDQCSA-N 341.249 1.476 10 10 EDCE CCCCCCN1C(=O)NC(=O)C(=CNN2CCCCCC2)C1=O 2296056378 QTCGPTRUTSQVPS-UHFFFAOYSA-N 336.436 1.910 10 10 EDCE O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)C1=CNN1CCCCC1 2296088529 CXQDCUNPSCFYGG-UHFFFAOYSA-N 348.790 1.797 10 10 EDCE CC(=O)O[C@H]1C(=O)c2c(O)cc(O)cc2O[C@@H]1c1ccc(O)c(O)c1 4098455 NPWRSXJQDKRXOR-SJORKVTESA-N 346.291 1.757 10 10 EDCE biogenic,in-vitro C[C@H]1CN(CCCNC(=O)CN(C)Cc2ccccc2O)C[C@@H](C)O1 171936602 CMZLROYESAMYGT-IYBDPMFKSA-N 349.475 1.440 10 10 EDCE COC(=O)[C@H](NCCN=[N+]=[N-])c1cc(OC)ncc1Br 2362189380 FJVLYSXMUHMQGU-SNVBAGLBSA-N 344.169 1.967 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3csc(N)n3)CC2)cc1 49663919 NEMHPBREQYTHBL-UHFFFAOYSA-N 332.429 1.625 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc2c(cn1)OCCO2 515833653 JMNCSIKUDNXOKZ-UHFFFAOYSA-N 341.367 1.958 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C)[C@@H](C)CO)cc1F 286428313 NNFYJUPLSJTREL-LBPRGKRZSA-N 339.411 1.127 10 10 EDCE CSCC1(N)CC(NCc2cnc(SC)s2)(C(=O)O)C1 2378421301 WNGOSNMSPHPCBE-UHFFFAOYSA-N 333.504 1.632 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@H]3CCOC3(C)C)CC2)cc1 295330997 XDBNNPHOQVYUFD-KRWDZBQOSA-N 347.459 1.501 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@H](C(=O)C3CC3)C2)cc1 801542995 NXOCQODXPKYOSK-KRWDZBQOSA-N 345.443 1.049 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)c3cnn(C)c3OC)C2)cc1 819588501 WLUYBMVRGPBFHT-ZDUSSCGKSA-N 344.415 1.694 10 10 EDCE Cc1c(Cl)c(/C=C2\SC(=S)N(CC(=O)O)C2=O)nn1C 817706576 COABASCBCPSGKS-CLTKARDFSA-N 331.806 1.668 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)NCc2cc(Cl)ccc2O)CS1(=O)=O 821968425 GYAQXBGDAXANSE-BXKDBHETSA-N 346.836 1.811 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H](C[C@H]2CCCO2)C(=O)O)cc1 908759102 YUUBZYMCFAGNNH-CABCVRRESA-N 335.404 1.574 10 10 EDCE CCN1CCN(C[C@H](C)CNC(=O)/C=C\c2ccc(O)c(O)c2)CC1 588404912 ZRURTJJFADRZPY-ZQMJAJRESA-N 347.459 1.501 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)[C@H]2CCO[C@@H](C)C2)c1 830623334 KSBMZXWJPFUCRX-GVXVVHGQSA-N 329.418 1.949 10 10 EDCE COC(=O)c1cnc(SC2CCN(S(C)(=O)=O)CC2)s1 917779047 WMTPQPZPSQQWAR-UHFFFAOYSA-N 336.460 1.446 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)CC(F)(F)CN)C2)cc1 846681994 CUGTWSLCXBJYHV-GFCCVEGCSA-N 327.375 1.622 10 10 EDCE COc1ccc2c(c1)CCCN2CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C1=O 840033015 UIIXCVOHVHGLMA-VQHPVUNQSA-N 340.379 1.344 10 10 EDCE CC(C)(C)OC(=O)CN1CC[C@@H](OC(=O)c2cc(O)cs2)C1=O 849728048 LPWDMNMOEYWRDW-SNVBAGLBSA-N 341.385 1.553 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)NCCCN)cc2F)CC1 841793018 NCDUISHOQAEYRL-UHFFFAOYSA-N 337.443 1.116 10 10 EDCE O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1cc(O)cs1 855404501 WAXXGJWMMDDKIX-CQSZACIVSA-N 332.425 1.950 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCc4c[nH]nc4C3)C2)cc1 855232496 UWUHTJAZXJAIKN-ZFWWWQNUSA-N 340.427 1.918 10 10 EDCE CC[C@H](C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)N1CCCC1=O 855230010 DNIDHDSNMGFFGJ-RHSMWYFYSA-N 345.443 1.791 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C[C@H]3CSCCN3)C2)cc1 851640557 YBKUIHYKFYMKLH-KGLIPLIRSA-N 335.473 1.485 10 10 EDCE Cc1ccc(O)c(CNC(=O)N[C@H](C)C2(S(C)(=O)=O)CC2)c1 858450102 YZXMQFZIKPGDTA-LLVKDONJSA-N 326.418 1.466 10 10 EDCE COC(=O)c1ccc2c(n1)CCCN2C(=O)/C=C/c1cnn(C)c1 857661465 GTWNBFVWGRLLPW-VMPITWQZSA-N 326.356 1.594 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)c3cnn(C)c3)C2)cc1 855232416 TTWLMGSHHNMLIO-ZFWWWQNUSA-N 328.416 1.927 10 10 EDCE COC[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@H](C)O1 784007252 AMQLAKRFVPPIFS-NXEZZACHSA-N 337.332 1.166 10 10 EDCE COc1ccc(CNC(=O)c2nc(=O)c3ccccc3[nH]2)c(O)c1 794762749 ZATCBXPWHZKFKF-UHFFFAOYSA-N 325.324 1.567 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CCCNC3=O)CC2)cc1C 1323469794 XXEXVLSHHJVGCU-HNNXBMFYSA-N 345.443 1.268 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)C[C@@]2(C)CO)c(Br)c1 698159132 XDQLDBRQFQNASB-CHIMOYNISA-N 330.222 1.824 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCC(O)CC3)c(Br)cc21 92774915 ANOORZQNRCZYGT-LBPRGKRZSA-N 326.194 1.362 10 10 EDCE C[C@@H](O)CNC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1269149964 XLRKXWPWVZWKJX-YGRLFVJLSA-N 333.392 1.328 10 10 EDCE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC[C@]12COCCN1C(=O)COC2 1351794314 MIEHLNCZQKQKKC-PJIJBLCYSA-N 346.427 1.466 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1COc2ccc(O)cc2O1 1447561658 JPOLMDQYVNDMLC-BTDLBPIBSA-N 345.351 1.691 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN(C[C@@H]3CCCO3)CC2)cc1 1623919515 YSBHDFCNGXCKQZ-HNNXBMFYSA-N 345.403 1.786 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CC[C@H]1CC[C@@H](C(N)=O)O1 1623386773 KHXBXVXTMMJRNV-CVEARBPZSA-N 333.432 1.524 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)Cc2ccc[nH]2)cc1C 1486063643 ROPAUSUYIKKKAE-INIZCTEOSA-N 331.416 1.141 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H]3NC(=O)OC[C@H]3C2)cc1 1568186306 PTEHFNIZKCMBLC-PWSUYJOCSA-N 331.332 1.420 10 10 EDCE CO[C@@H](C)CNCCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1723206008 RBUGMUJJVPEDBM-LBPRGKRZSA-N 335.408 1.936 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1OCCO[C@@H]1c1ccccc1 1647289905 LTCRNADJILGJHH-IAGOWNOFSA-N 329.352 1.871 10 10 EDCE Cn1cncc1[C@@H](CO)NC(=O)c1cc2cc(O)c(O)cc2s1 1647841569 YRHPAAOQIZHXER-SECBINFHSA-N 333.369 1.509 10 10 EDCE C[C@H]1CN(CCCCNC(=O)Cc2ccc(O)c(O)c2)C[C@@H](C)O1 1587590791 HUHFDLDMHZYZCY-OKILXGFUSA-N 336.432 1.646 10 10 EDCE O=C(N[C@@H]1CS(=O)(=O)c2ccccc21)c1c(F)ccc(O)c1O 1654435924 QTOLJSAFSHPVTH-SNVBAGLBSA-N 337.328 1.495 10 10 EDCE O=C(CCNC(=O)Cc1ccccc1)NCc1c(O)cccc1F 1596910901 APDLVXPBPWIMQZ-UHFFFAOYSA-N 330.359 1.897 10 10 EDCE COc1cc(O)c(CN2CCN(Cc3ccon3)CC2)cc1OC 160298369 YUSGUYYKBDDCND-UHFFFAOYSA-N 333.388 1.715 10 10 EDCE CN[C@H](C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1cccnc1 1858158990 IMVIVFRWBPDEAZ-SFHVURJKSA-N 340.427 1.700 10 10 EDCE C[C@@H](N)c1ccc(N2CC(CNC(N)=O)C2)cc1Br 2130744151 OPAPVFGARNOHMJ-MRVPVSSYSA-N 327.226 1.573 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)c1cnn(C)c1I 1912194008 IGELLXIGRPFOMK-UHFFFAOYSA-N 334.121 1.407 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)[C@@H](O)[C@H](N)c1ccccc1O 1904964617 UUSJPOIVNJWDSQ-MGPQQGTHSA-N 326.393 1.293 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1987701241 DIXAVMGRIZTTQJ-MNOVXSKESA-N 327.385 1.421 10 10 EDCE COc1cccc(O)c1CN[C@H]1COC[C@H]1NC(=O)OC(C)(C)C 1997933684 XHQZUDIQMFIONY-QWHCGFSZSA-N 338.404 1.783 10 10 EDCE CNC(=O)Cn1cc(NCc2cccc(Br)c2O)cn1 48797503 UOPVBHAZNNROLR-UHFFFAOYSA-N 339.193 1.709 10 10 EDCE CCN(Cc1ccc(N)cc1)C(=O)c1c(Br)nnn1C 312792707 JFDSGCBZQINILL-UHFFFAOYSA-N 338.209 1.822 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CNCc2ccc(O)c(O)c2)[C@@H](O)C1 702793884 ZCPNIDQESIXHMN-WFASDCNBSA-N 338.404 1.415 10 10 EDCE COc1cc(N)c(N2C[C@H]3C[C@H]2CN3C(=O)C(F)(F)F)cc1OC 2044726344 UAOIWXSCOKFWQB-DTWKUNHWSA-N 345.321 1.638 10 10 EDCE CN1CC[C@@H]2OCCN(c3ccc(CO)c(Br)c3)[C@H]2C1 2185588177 HJHAKUFJZSWMKI-GJZGRUSLSA-N 341.249 1.851 10 10 EDCE COCC1(NC(=O)Cc2ccc(N)cc2)CN(C(=O)OC(C)(C)C)C1 2070572369 CHDPBWMOXZAXMN-UHFFFAOYSA-N 349.431 1.563 10 10 EDCE O=S1(=O)CC[C@@H]2CN(c3ccc(CO)c(Br)c3)C[C@H]21 2088785088 UUUIGVKREZLWTB-NOZJJQNGSA-N 346.246 1.565 10 10 EDCE CC1(C)CO[C@H](CO)CN1c1ccc(CN)cc1Br 2111238576 JNLDTMCGGFZYIV-NSHDSACASA-N 329.238 1.884 10 10 EDCE CC(C)(C)OC(=O)N(CCCOc1nnc(=N)[nH]n1)C(C)(C)C 2210650070 QBKJIENVMIUOBL-UHFFFAOYSA-N 326.401 1.484 10 10 EDCE Nc1cc2c(cc1N1CCC(NC(=O)C(F)(F)F)CC1)OCCO2 2258233639 QCFFANNASMBVCQ-UHFFFAOYSA-N 345.321 1.687 10 10 EDCE COC[C@@H]1[C@H](O)[C@@H](O)CN1c1ccc(OCc2ccccc2)cc1 2299508027 NYTPZIUDDRJSGL-QYZOEREBSA-N 329.396 1.822 10 10 EDCE COC[C@]1(CO)C=CCN1c1ccc(CN)c(Br)c1 2351697952 XZWXKBZAMLCCSG-CQSZACIVSA-N 327.222 1.662 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@H]2C(=O)O)c(O)c1Br 2352633738 MLJMSSOSSADFMM-RKDXNWHRSA-N 328.162 1.800 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@@H](C)NC(=O)c2ccccc2)c1 114541338 YEUNRGUYGLYJMT-GFCCVEGCSA-N 328.368 1.836 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H]3[C@H]4CO)c(Br)cc21 2358071358 REIXOHBKYWUFLF-KWMOTYPYSA-N 338.205 1.218 10 10 EDCE CC(=O)N(C(=O)N1CCN(c2ccccn2)CC1)c1ccc(N)cc1 242951894 HFLALSKUPKKWLL-UHFFFAOYSA-N 339.399 1.959 10 10 EDCE Cc1cc(N2CCC[C@@H](NC(=O)NCc3ccccc3O)C2)n(C)n1 277670343 HNVSEINJMRCQTL-OAHLLOKOSA-N 343.431 1.902 10 10 EDCE COc1cc(O)c(CN2CCCC[C@@H]2[C@H]2CNC(=O)C2)cc1OC 373218813 VDRKTGHWDIKESV-TZMCWYRMSA-N 334.416 1.900 10 10 EDCE COc1cccc(CNC(=O)C(=O)Nc2cn(C)nc2C(C)C)c1O 280335704 LSGMNCMXQGILOJ-UHFFFAOYSA-N 346.387 1.513 10 10 EDCE CC(=O)C(=O)COC(=O)[C@]1(C)CCN(C(=O)OCc2ccccc2)C1 808546736 YXVSHEPVCPRUNH-GOSISDBHSA-N 347.367 1.737 10 10 EDCE CCOC(=O)c1cccnc1SCC(=O)OCC(=O)C(C)=O 808506745 QOEKGOZQPYSMRW-UHFFFAOYSA-N 325.342 1.052 10 10 EDCE CO[C@@H]1CN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC[C@@H]1C 807675334 WNIGYLVNTALNDY-GRDNDAEWSA-N 347.459 1.813 10 10 EDCE O=C([C@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1)N1CCCC1 732192448 YVNZXCLNSAHRBZ-ZDUSSCGKSA-N 332.400 1.955 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CCC1(C)C 837751581 FYLAEUMISDQMOQ-LBPRGKRZSA-N 327.377 1.723 10 10 EDCE Cc1cc(Cl)cc(CN2CCS(=O)(=O)[C@@H]3COCC[C@H]32)c1O 839187977 ZTEYRATULCAIGO-ZIAGYGMSSA-N 345.848 1.742 10 10 EDCE Cn1cnc(CCNC(=O)NCc2ccc(N3CC=CC3)cc2)c1 838486134 MSQORXGYAXMIRN-UHFFFAOYSA-N 325.416 1.838 10 10 EDCE CC[C@@](C)(CO)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 847399381 CKFJEFDBNKKADW-IBGZPJMESA-N 349.475 1.342 10 10 EDCE Nc1ccc(CCNC(=O)N2CC[C@H]([C@H](O)C(F)(F)F)C2)cc1 841955580 HIZALXHXJRRIBA-AAEUAGOBSA-N 331.338 1.766 10 10 EDCE Cc1ccn([C@@H](C)CC(=O)N(CC(=O)O)Cc2ccccc2O)n1 911488675 MDVVJVUPGUBTEH-ZDUSSCGKSA-N 331.372 1.962 10 10 EDCE CCOC(=O)[C@]1(F)CN(C(=O)c2cccc(O)c2O)CC12CCC2 855240236 ADTICUFMNBBMLK-QGZVFWFLSA-N 337.347 1.995 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@H]1COCCN1C 858544177 QWCPAZMCCBQCDI-YJBOKZPZSA-N 348.491 1.622 10 10 EDCE CCn1cc(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)nn1 929536713 CYDHNTUOAJEAMP-UHFFFAOYSA-N 343.431 1.336 10 10 EDCE CO[C@]1(CNCc2c(O)ccc(Cl)c2F)CCS(=O)(=O)C1 922619085 NMTUXLFBXHMIDZ-ZDUSSCGKSA-N 337.800 1.478 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CC[C@@H](O)C(F)(F)C1 853748347 BZVCLIQMZGDEDO-CQSZACIVSA-N 327.375 1.973 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)C[C@H]1C 864864319 XOSNJFOBGJWKLC-KBRIMQKVSA-N 346.427 1.870 10 10 EDCE CNc1cnc(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cn1 862035236 NKFPNCRRDKDGFL-CYBMUJFWSA-N 341.415 1.783 10 10 EDCE O=C(C1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1)N1CCCC1 768441315 GDOICGHYBADEPM-QGZVFWFLSA-N 346.427 1.652 10 10 EDCE O=C1OCC[C@@H]2CN(Cc3ccc(N4CCOCC4)cc3)CCN12 770388499 BQACPFRAWWRFMW-QGZVFWFLSA-N 331.416 1.550 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@H](O)COC[C@H]2CCCO2)c1 775373519 SXJMDCIFYZVYMP-KCQAQPDRSA-N 325.405 1.608 10 10 EDCE O=C(NCCCC(=O)N1Cc2cccc(O)c2C1)c1cccnc1 871203462 MBTPPVXNGOPGNG-UHFFFAOYSA-N 325.368 1.840 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3cccc(OC)n3)CC2)cc1 1137386583 IDTGWMBVIFXEBA-UHFFFAOYSA-N 341.411 1.990 10 10 EDCE COC[C@]1(C(=O)NCCN=[N+]=[N-])CCN(C(=O)OC(C)(C)C)C1 1963818430 VVCNELQEXRQUOL-AWEZNQCLSA-N 327.385 1.687 10 10 EDCE C[C@H]1C(=O)N(C)[C@H](C)[C@@H](C)N1C(=O)c1ccc(N=NC(N)=O)cc1 1163829690 ZNMQYEIADAMMBU-MXWKQRLJSA-N 331.376 1.929 10 10 EDCE CN(C[C@H]1CCCC[C@@H]1O)C(=O)C(=O)N1Cc2cccc(O)c2C1 1332019523 QTKZOPSIVKAHKT-HIFRSBDPSA-N 332.400 1.244 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cn(C)c(O)n2)cc1C 1266827341 SSFJTGAKTZVRQW-UHFFFAOYSA-N 332.404 1.305 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H]2CN(C)CCO2)cc1C 1267984609 QODKMIWWPAAGOU-KBXCAEBGSA-N 349.475 1.176 10 10 EDCE CCO[C@H]1C[C@@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1(C)C 1261859874 HUGKQADZDKPTAM-CVEARBPZSA-N 346.427 1.896 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C2(C)CC=CC2)cc(OC)n1 1354695778 RCHXWHZFASGDAU-GFCCVEGCSA-N 347.415 1.690 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)CCC2CCC2)cc(OC)n1 1526479699 XGJNTVLAPXMRHQ-GFCCVEGCSA-N 349.431 1.914 10 10 EDCE COc1ccc(C=O)c(OCC(=O)NCc2ccc(O)cc2O)c1 1469159793 NSDIKVHFPJXKLC-UHFFFAOYSA-N 331.324 1.614 10 10 EDCE Cc1oc(S(N)(=O)=O)cc1C(=O)NCc1cccc(Cl)c1O 1606868302 MYWFRGVAONYDIG-UHFFFAOYSA-N 344.776 1.524 10 10 EDCE O=C(NCCCc1nc(O)n[nH]1)c1cc2cc(O)c(O)cc2s1 1472519087 MRCCGIUKPWFYBI-UHFFFAOYSA-N 334.357 1.499 10 10 EDCE CCOC(=O)[C@@H]1C[C@H]1C(=O)N1CCN(c2ccc(OCC)cc2)CC1 1545931474 JTUSNSWJBWZHHP-IAGOWNOFSA-N 346.427 1.933 10 10 EDCE O=C1CC[C@@H](CC(=O)NCc2ccc(N3CCOCC3)cc2)CN1 1626693627 QIIANWIGTMJADF-HNNXBMFYSA-N 331.416 1.056 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)Cn2cccn2)cc1C 1485120805 JBQDOTATLQAGQC-LSDHHAIUSA-N 330.432 1.883 10 10 EDCE CCOC(=O)[C@H]1CSCCN1C(=O)Cc1ccc(O)c(O)c1 1623839518 PNDOYUZVZBVXNP-LLVKDONJSA-N 325.386 1.147 10 10 EDCE CN(CCCO)C[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1494178451 KBRIKHFTKIZSEL-CYBMUJFWSA-N 347.419 1.625 10 10 EDCE COCCN[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1731412390 ARDYJLNTHGDEDN-CQSZACIVSA-N 333.392 1.593 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@]2(C)CCNC2=O)cc1C 1674233601 YETZSRNJWQGZPQ-LIRRHRJNSA-N 347.459 1.514 10 10 EDCE CCCOc1ccc(CN2CCC[C@@H](NS(C)(=O)=O)C2)c(O)c1 154119047 DXAKLRBHGYHRKI-CQSZACIVSA-N 342.461 1.695 10 10 EDCE NCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2134818004 WAZJBIYQYVWNLI-IOEYQFCTSA-N 327.222 1.228 10 10 EDCE CNCc1ccc(N2CCCN(C)C(=O)C2)c(Br)c1 234432639 NSOQTKPMRNUJLF-UHFFFAOYSA-N 326.238 1.837 10 10 EDCE C[C@@]12C[C@@H](CO1)N(c1cc3c(cc1Br)[C@H](O)C(=O)N3)C2 2144574053 RAIRZMNOIAQVGX-FMCKTDMXSA-N 339.189 1.802 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CN(CCCN=[N+]=[N-])CCN2C1=O 2006170756 OJHBKNUTMZVBPM-NWDGAFQWSA-N 338.412 1.497 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC(N4CCC4)C3)c(Br)cc21 2152252319 YKLVZWMFWCIPLK-CYBMUJFWSA-N 337.221 1.295 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC[C@H](N=[N+]=[N-])C1)C1COC1 2010401222 BNIRGXFFQJMACZ-RYUDHWBXSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(F)cc2O)[C@@H](O)C1 2024891635 ZWUAHDDYMLYSRH-ZFWWWQNUSA-N 340.395 1.991 10 10 EDCE CN(CCc1nc(=NCc2ccc(N)cc2)[nH][nH]1)C(=O)OC(C)(C)C 2065561179 ORFUFCDORSPTDJ-UHFFFAOYSA-N 346.435 1.830 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213586277 ABSHRHKSYDFOGK-WRWGMCAJSA-N 339.396 1.704 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccc(NN)cc2)s1 2284700021 QZBOVOITUQROAL-UHFFFAOYSA-N 330.460 1.629 10 10 EDCE CC[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2288894660 ALSGIMXMXGZAMM-RTXFEEFZSA-N 340.221 1.751 10 10 EDCE CC1C[C@H](C)N(C[C@H]2SC(=S)N(C3=NCCN3)C2=O)[C@@H](C)C1 33878114 GBGCKHIHKBAUFI-SDDRHHMPSA-N 340.518 1.683 10 10 EDCE O=C([C@@H]1CCCN(Cc2cc3c(cc2O)CCC3)C1)N1CCOCC1 192806856 VXFSMZRKVHDDIT-QGZVFWFLSA-N 344.455 1.952 10 10 EDCE CN(Cc1c(O)ccc2ccccc12)C[C@@H](O)CN1CCOCC1 93583270 IGTUJVPCVZRVPK-MRXNPFEDSA-N 330.428 1.670 10 10 EDCE NCC1(NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)CCCC1 254959726 JNYFMVWLVKBUNN-YVMONPNESA-N 329.444 1.924 10 10 EDCE CC(C)C[C@@H](CO)N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 274755774 PMUBIHZGWDOCDA-LBPRGKRZSA-N 344.433 1.243 10 10 EDCE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1COC(=O)N1 283365059 JDEAHNFTWSOXIX-SNVBAGLBSA-N 343.177 1.612 10 10 EDCE Cc1ccc(CN2C[C@]3(CO)C[C@]3(CO)C2)c(O)c1Br 2380813105 CGQPJWHGJNKYCN-GASCZTMLSA-N 342.233 1.640 10 10 EDCE CCN1CC[C@H](NC(=O)c2cc(C)n(-c3ccccn3)c2C)C1=O 802366940 MDBWTHBOQJZXEY-HNNXBMFYSA-N 326.400 1.840 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@H]2C(N)=O)c(Br)c1 723202874 XQYSNJRQMMFUDY-UFBFGSQYSA-N 328.210 1.159 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCC[C@H]3C[C@H]32)cc1 826706400 JKGJANRJKLLATG-YQQAZPJKSA-N 329.444 1.921 10 10 EDCE CC[C@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCN1CCOC 588407943 CFNUBAYAWQZMBR-PKYBCLHXSA-N 334.416 1.680 10 10 EDCE COc1cccc(CNC(=O)NCC2(C(=O)O)CCOCC2)c1O 831062282 GPJJRLTUUHCJEF-UHFFFAOYSA-N 338.360 1.081 10 10 EDCE Cn1c2c(ccc1=O)[C@@H](NC(=O)C(=O)Nc1ccc(N)cc1)CCC2 846328907 LFFGMHAPOSJTRH-AWEZNQCLSA-N 340.383 1.100 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3C[C@@H](C(=O)OC)C3)C2)cc1 854174042 ZRTVCAVKQMIHBD-MCIONIFRSA-N 347.415 1.525 10 10 EDCE COC(=O)[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@H]1C 853914165 LQBDZSBEWNNYGD-VHSXEESVSA-N 349.343 1.561 10 10 EDCE Cc1cnn(C)c1NC(=O)C(=O)NCCCSc1nccs1 850390852 VOQICJBBISOYSW-UHFFFAOYSA-N 339.446 1.422 10 10 EDCE C/C=C/C[C@H]1NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 761068659 ISPJDUOOTGRGNK-WOMSROEHSA-N 329.400 1.910 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC(C)(N(C)C)CC2)cc1 931353826 PXJDTWIBCPWMBO-UHFFFAOYSA-N 332.492 1.785 10 10 EDCE C[C@H](NC(=O)C(=O)Nc1cccc2c1CCNC2)c1ccccc1O 868310718 WAYUTKLHUIJABX-LBPRGKRZSA-N 339.395 1.854 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN[C@H]1CC 861798671 WYCIZMWSBFHZRY-LSDHHAIUSA-N 333.432 1.388 10 10 EDCE Cc1cc(Br)cc([C@H](C)NCCc2nnnn2C)c1O 779030232 OUFDBBQOEIUUHV-VIFPVBQESA-N 340.225 1.880 10 10 EDCE CC(=O)Nc1ccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)nc1 773756624 KXPYYRBWJBWNTC-SNVBAGLBSA-N 329.356 1.812 10 10 EDCE Cc1cccc2c(=O)n(CC(=O)NCc3c(O)cccc3F)cnc12 1156170527 OXDAKUZLZRTADE-UHFFFAOYSA-N 341.342 1.866 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N(CCO)Cc1ccccc1 1329392308 CUAXRWSPHLQTMP-UHFFFAOYSA-N 340.379 1.256 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC[C@@H]1CC1(F)F 1328601684 PUCZFNJIGYAPRW-CYBMUJFWSA-N 339.386 1.839 10 10 EDCE C[C@H](O)C1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 719867491 NJJWBZGGPSEGSZ-PWCHPLFNSA-N 327.178 1.252 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)C[C@@]2(C)CO)cc1Br 698159107 WUBIMIPSVXEAHH-PXWWUCIGSA-N 330.222 1.824 10 10 EDCE C[C@@H]1COC2(CCCC2)CN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1332053044 GUGIWYIGABIBDA-CYBMUJFWSA-N 344.411 1.795 10 10 EDCE C[C@H](O)CCCNCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1267137128 MBNKTPNDBSNPOQ-LBPRGKRZSA-N 335.408 1.672 10 10 EDCE C[C@H](NC(=O)/C=C\C(=O)N(C)C)c1ccc(N2CCOCC2)cc1 1544214567 AUCBBKNLXQPRNY-CKXPSTMWSA-N 331.416 1.345 10 10 EDCE CCOC(=O)COCCN(Cc1ccccc1O)C[C@H]1CCCO1 1616179913 JKOOYQQLXHCIBC-MRXNPFEDSA-N 337.416 1.953 10 10 EDCE C[C@@H](O)c1ccc(N2CCC[C@@H]2[C@@H](O)CO)c(Br)c1 2123168633 BPJNJGQJIPALFV-FZQKWOKYSA-N 330.222 1.824 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@H]2CCC(=O)N2)C2CC2)cc1C 1490642389 QPPDHRPUWNNRFB-CVEARBPZSA-N 345.443 1.267 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(C2CC2)nc1O 1633817691 AANLLUTWIXQYIA-SECBINFHSA-N 329.356 1.832 10 10 EDCE C[C@H](C(=O)NCc1c(O)cccc1O)N1CSCCSC1 1652628698 JRDFBXICFYPOLZ-SNVBAGLBSA-N 328.459 1.800 10 10 EDCE Cc1c(C(=O)NCCc2ccc(O)c(O)c2)sc2[nH]cnc(=O)c12 1860243748 JTZRILXXWQPFJB-UHFFFAOYSA-N 345.380 1.677 10 10 EDCE Cn1ncc(C(=O)N2CC(N=[N+]=[N-])C2)c1I 1912143894 LUHWYLZAHVEMEE-UHFFFAOYSA-N 332.105 1.159 10 10 EDCE CN(C)c1ccc([C@@](C)(O)[C@H](NC(=O)OC(C)(C)C)C(=O)O)cc1 1917210306 ZWJONGDJOGIBTM-CXAGYDPISA-N 338.404 1.938 10 10 EDCE C[C@H](N)c1ccc(N2CCCN(CCO)CC2)c(Br)c1 227350539 UMFZXOHAYCOQEJ-LBPRGKRZSA-N 342.281 1.973 10 10 EDCE CCNCc1ccc(N2CCO[C@H](CO)C2)cc1Br 233532881 AEWUJTVSBKQOCL-ZDUSSCGKSA-N 329.238 1.756 10 10 EDCE CNC(=O)CN(C)c1ccc(CNCCOC)cc1Br 234364453 DEPDVZVXDKWIPA-UHFFFAOYSA-N 344.253 1.367 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CN1CC(CNC(=O)OC(C)(C)C)C1 1985094937 WKSOWWZKNTWAJY-UHFFFAOYSA-N 326.401 1.212 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985103841 AWFFHYWPECTCTE-VWYCJHECSA-N 327.385 1.419 10 10 EDCE Nc1ccc(OCC(=O)N(OCc2ccccc2)C2CNC2)cc1 2016984937 LUVPIBXNBYEGJY-UHFFFAOYSA-N 327.384 1.580 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1 2014504807 KRVYIERDCLZNCK-VXGBXAGGSA-N 339.396 1.730 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(CNCc2cccc(F)c2O)C1 2023459429 HMSJVWTUNQSTGP-UHFFFAOYSA-N 340.395 1.850 10 10 EDCE Oc1cc(Br)ccc1CN1CC(N2CCNCC2)C1 691490742 NCYIUCYUFBSZPG-UHFFFAOYSA-N 326.238 1.244 10 10 EDCE CO[C@@H](C)CN(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 387954167 NEOMXADIUWJUHS-MADCSZMMSA-N 328.210 1.872 10 10 EDCE CNCc1ccc(N2CC[C@H](O)[C@@H](CO)C2)c(Br)c1 396829987 PPBOGTNKVFFPJU-RISCZKNCSA-N 329.238 1.348 10 10 EDCE CN(C[C@@H]1CCOC1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 398992686 PQQSCQLEZJVPNS-SDBXPKJASA-N 340.221 1.874 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCc3ccnc(N(C)C)c3)c2n1 2062242246 LQTTWBAGEKIKMO-UHFFFAOYSA-N 326.360 1.134 10 10 EDCE CN1C[C@@H](C(F)(F)F)[C@@H](C(=O)NCc2c(O)cc(O)cc2O)C1 2063152149 APFTWZMFORYOBW-VHSXEESVSA-N 334.294 1.160 10 10 EDCE CN1CCN(c2ncc(C(=O)Nc3ccc(O)c(O)c3)s2)CC1 2064357715 DSXGWTNXJASTGK-UHFFFAOYSA-N 334.401 1.558 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)c(Br)c1 2178085180 CXGPSLOCZFIQAO-NFOTXUCKSA-N 341.249 1.912 10 10 EDCE CCNCc1ccc(N2CCC[C@H]2[C@H](O)CO)cc1Br 2179801255 ZHOMMTOVDVOHDU-LSDHHAIUSA-N 343.265 1.881 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H]1CNC(=O)COc1ccc(N)cc1 2053958155 SQPPMFGAJCGFEZ-STQMWFEESA-N 349.431 1.925 10 10 EDCE C[C@H](N=c1nc(CNC(=O)OC(C)(C)C)[nH][nH]1)c1cc(O)ccc1O 2063196784 XYWYDBRPTJUHAZ-VIFPVBQESA-N 349.391 1.836 10 10 EDCE C[C@H]1CN(Cc2c(O)cccc2Br)[C@H](C(=O)O)CO1 2109527060 USVPXJIMVPEDIP-KWQFWETISA-N 330.178 1.829 10 10 EDCE COc1ccc(N(C)Cc2nn(C)nc2Br)c(CO)c1 2235969315 CIHFYMJZUHTYCH-UHFFFAOYSA-N 341.209 1.715 10 10 EDCE O=C1C(=Cc2ccccc2F)SC(=S)N1CCS(=O)(=O)O 2293104121 CYXYRPVFKDBIBI-UHFFFAOYSA-N 347.414 1.915 10 10 EDCE CN1CCCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CC1 2297575632 HNQQQHZSDWYBHM-UHFFFAOYSA-N 329.444 1.701 10 10 EDCE COCCN1[C@H](C)CN(C(=O)C=Cc2ccc(O)c(O)c2)C[C@H]1C 2308005726 BJQPOOMQPXHRLF-ZIAGYGMSSA-N 334.416 1.679 10 10 EDCE Cc1ccc(Cn2cncc2[C@@H](N)CO)c(O)c1Br 2352947046 PCZVAKBANIMZTJ-JTQLQIEISA-N 326.194 1.700 10 10 EDCE OCCN(c1ccc(CO)c(Br)c1)C1CCOCC1 2353590897 HMPYYAOSXNHSEN-UHFFFAOYSA-N 330.222 1.919 10 10 EDCE CC(=O)N(C(=O)C(=O)NCCc1ccc(F)cc1)c1ccc(N)cc1 170318989 LFWJERWSOPLRJB-UHFFFAOYSA-N 343.358 1.646 10 10 EDCE COc1cc(N2CCC[C@](CO)(OC)C2)c([N+](=O)[O-])cc1OC 401913797 VGUGTOVYYQJYDI-HNNXBMFYSA-N 326.349 1.590 10 10 EDCE Cc1ccc(C(=O)N(C)[C@H]2CCCN(c3cccnn3)C2)c(O)c1O 182471634 YVFDUFBFNCKSLB-ZDUSSCGKSA-N 342.399 1.937 10 10 EDCE Cc1nc(C(=O)NCc2c(O)ccc3c2CCCC3)c(=O)[nH]c1C 121144435 IBGWMTPBGYXDIZ-UHFFFAOYSA-N 327.384 1.901 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NC1C[C@@H]2CC[C@H](C1)N2 254975381 PFGDJJADSXIUIN-LLFCPKTBSA-N 341.455 1.936 10 10 EDCE COCCN1CCCN(Cc2cc(OC)c(OC)cc2O)CC1=O 376957508 KQVCXXYBZCVFDQ-UHFFFAOYSA-N 338.404 1.090 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2C[C@@H]2C(N)=O)c(O)c1Br 2381138035 RXIQJEDDXCUCSL-UWVGGRQHSA-N 341.205 1.543 10 10 EDCE Cc1ccc(CNC(=O)C2=C[C@@H](O)[C@H](N)C2)c(O)c1Br 2380750697 FTKGYWLOMAJIDD-GHMZBOCLSA-N 341.205 1.098 10 10 EDCE O=C(O)[C@H]1CCCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 588471279 IAWURJBAYNLQLL-SBSDFTTDSA-N 344.411 1.860 10 10 EDCE CC(C)C(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 732576473 DLQCLSJADZFVJX-UHFFFAOYSA-N 331.460 1.823 10 10 EDCE Cc1cc(Cl)cc(CN2CCS(=O)(=O)[C@H]3COCC[C@H]32)c1O 839187973 ZTEYRATULCAIGO-KGLIPLIRSA-N 345.848 1.742 10 10 EDCE O=C(NCC[C@@H]1CCCNC1)NCc1ccc(N2CCOCC2)cc1 841729149 CKDLRCXNMNCHTB-INIZCTEOSA-N 346.475 1.712 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2C[C@@H](N3CCOCC3)C2(C)C)c(O)c1O 911843363 LUNIBNBOPVHJJC-ZIAGYGMSSA-N 334.416 1.635 10 10 EDCE COC(=O)C1(CS(=O)(=O)NCc2c(O)cccc2F)CCCC1 921452668 VYAXAXRMTRHNDK-UHFFFAOYSA-N 345.392 1.684 10 10 EDCE C/C=C/CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 858889672 IEVKJNQSVNORDJ-FAAWYNLUSA-N 330.432 1.764 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](N)COC(C)C)C2)cc1 851641508 NZLNUDBKSBFIPG-YOEHRIQHSA-N 335.448 1.390 10 10 EDCE C/C=C/CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 863120872 UQDYLVJGHTVWOA-SCPMJEMWSA-N 343.427 1.592 10 10 EDCE CC(C)[C@@H](NC(=O)c1ccccn1)C(=O)NCc1ccccc1O 769363598 VZKMDTLTWDHDRE-MRXNPFEDSA-N 327.384 1.858 10 10 EDCE O=C(/C=C\CN1CCOCC1)NCc1ccc2cccnc2c1O 868938079 PVQWPDULVGCXAC-RQOWECAXSA-N 327.384 1.445 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2cc(C)cc(OC)c2O)C1 863340119 IDHRCDSKSJUPRU-CYBMUJFWSA-N 342.461 1.470 10 10 EDCE Cn1cc(-c2noc(-c3ccc(-n4cccc4)cc3)n2)c(O)nc1=O 771191338 YKRHPWYRRYESOK-UHFFFAOYSA-N 335.323 1.994 10 10 EDCE COc1ccc(O)c(CNCCn2cc(Br)nn2)c1 1878209897 RKCNRKGTOIZKDP-UHFFFAOYSA-N 327.182 1.545 10 10 EDCE O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1C1COCCOC1 794132161 SNZHWOYTMQCWHC-UHFFFAOYSA-N 340.763 1.225 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1nnnc1N1CCCCCC1 1339345848 HWYANZOKBDFBFD-UHFFFAOYSA-N 342.447 1.938 10 10 EDCE NC(=O)N[C@@H](CC(=O)NCc1cc(O)ccc1O)c1ccccc1 1303223664 ZLDHCXLIWIVKMH-AWEZNQCLSA-N 329.356 1.514 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)C34CC(C3)C4)cc2)CC1 1331739813 YAMCNLAENLHWSN-UHFFFAOYSA-N 327.428 1.805 10 10 EDCE COc1ccc(CNC[C@H]2CCC[C@H]2NC(=O)CC(N)=O)cc1C 1272253449 PFGIECYPLYNMRE-HUUCEWRRSA-N 333.432 1.254 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H](C)NC(C)=O)cc1C 1277750885 DGWQNJKBAUJBLF-KBPBESRZSA-N 335.448 1.465 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2coc(C)n2)cc1C 1279695732 SZUKELNKQXJMHM-UHFFFAOYSA-N 347.415 1.524 10 10 EDCE C[C@@]1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CCCN(CCO)C1 1500553511 ZNPZCQRBXGJPGY-KRWDZBQOSA-N 347.419 1.673 10 10 EDCE CC[C@@H](OC)C(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1298806445 DJUCOOVAQLUMRF-GXFFZTMASA-N 349.391 1.509 10 10 EDCE CN1C(=O)c2ccccc2[C@@H]1CNC(=O)Cc1ccc(O)c(O)c1 1454714380 BDXJMSGXBSVHLN-AWEZNQCLSA-N 326.352 1.583 10 10 EDCE CCn1ncc(C(=O)N(C)CCCNCc2ccc(OC)c(C)c2)n1 1498542142 VTFGCMYSUXYSFZ-UHFFFAOYSA-N 345.447 1.867 10 10 EDCE COC(=O)CN1C(=O)/C(=C2\C(=O)Nc3ccc(C)cc32)SC1=S 1281904 UJZVACMEDQNODP-VAWYXSNFSA-N 348.405 1.692 10 10 EDCE COc1cc(C(=O)N[C@H](C)CCNC(=O)CC2CC2)cc(OC)n1 1495420930 JUQUKZQUULKDLP-LLVKDONJSA-N 335.404 1.524 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(C(N)=O)o1 1643245214 LWHRXSUQNQLYQK-UHFFFAOYSA-N 346.339 1.290 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)c2cncnc2O)cc1C 1674681628 UBUOCEKMDLTXNN-CHWSQXEVSA-N 344.415 1.796 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)Cc2ccon2)cc1C 1677066697 WQBGRWONHIKBPY-MRXNPFEDSA-N 347.415 1.143 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NCCCS(N)(=O)=O)cc1 1683652241 FHBUPFGKIDITEK-UHFFFAOYSA-N 342.465 1.011 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)C[C@@H]1CCNC1=O 1699185085 VTSKVGBOFUNYFD-INIZCTEOSA-N 347.459 1.468 10 10 EDCE CCc1nnc(NC(=O)CCN2C(=O)[C@H](C)SC2=S)s1 11635978 IASUNVQDYOJBPC-LURJTMIESA-N 330.460 1.678 10 10 EDCE CN(C)C[C@@H]1CN(C(=O)NCCCSc2nccs2)CCO1 154596146 FPCOELRHHGRBCB-GFCCVEGCSA-N 344.506 1.597 10 10 EDCE Cc1c([C@H](O)[C@@H](N)c2ccccc2O)c(Br)nn1C 2131551838 LZIUDCYNUOYHPX-RYUDHWBXSA-N 326.194 1.930 10 10 EDCE O=C(O)[C@@H]1C[C@@H](O)CCN1Cc1c(O)cccc1Br 2136386164 GUVCFYCHZYQVKF-KWQFWETISA-N 330.178 1.565 10 10 EDCE CN1CCN(c2ccc(CO)c(Br)c2)[C@@H](CCO)C1 2138067971 USSQAYPWZZVINF-ZDUSSCGKSA-N 329.238 1.444 10 10 EDCE C[C@H](N)c1ccc(N2CCN(CCO)CC2)cc1Br 235510611 FQCLVMLESNSXIP-NSHDSACASA-N 328.254 1.583 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(C(=O)C(=O)C[C@H]1C[C@H](N)C1)C(F)F 1980377015 KTEXGRIOOMOSBT-KEMUVXCRSA-N 334.363 1.801 10 10 EDCE C[C@H]1COC[C@H](C(=O)NCCCN=[N+]=[N-])N1C(=O)OC(C)(C)C 1985096878 XNABPGSWVIFAOF-WDEREUQCSA-N 327.385 1.827 10 10 EDCE COc1ccc([C@@H](C)NC[C@@H](O)CNC(=O)OC(C)(C)C)c(O)c1 2011423665 VYXCHWUUBQDBKE-VXGBXAGGSA-N 340.420 1.937 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C1(O)CCC1 2014483723 VEJIGYMEQZDDFI-GHMZBOCLSA-N 339.396 1.706 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@H]1NC(=O)c1cc(O)c(O)c(O)c1 2015124135 ZKECBXRXKGPCAP-NXEZZACHSA-N 338.360 1.446 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)NCCCN=[N+]=[N-])O2)C1 2025154863 AQWHPXYWMMZEFD-LLVKDONJSA-N 339.396 1.972 10 10 EDCE OC[C@@H]1COC[C@H]1NCc1cc(Cl)cc(Br)c1O 2029843439 FNATXXWQWHPRNZ-LDYMZIIASA-N 336.613 1.905 10 10 EDCE C[C@H]1CN(c2ccc(CN)c(Br)c2)C[C@H](C)S1(=O)=O 400860725 XMYUYPRFWJKYNM-UWVGGRQHSA-N 347.278 1.920 10 10 EDCE O=C1CCCC(=O)N1CCNCc1cc(Br)ccc1O 405395718 SWTGXUCMYJSTOD-UHFFFAOYSA-N 341.205 1.783 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CC(=O)Nc2ccc(N)cc2)CC1 310028765 XTWWJHXOEBARCU-UHFFFAOYSA-N 334.420 1.760 10 10 EDCE C[C@@H]1C[C@@H](N)CCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2054049000 XWRZURQWCXUODF-WBVHZDCISA-N 329.444 1.875 10 10 EDCE C[C@H]1CN(c2ccc(CN)c(Br)c2)CCS1(=O)=O 706923470 RYCIPXLOEPOVOJ-VIFPVBQESA-N 333.251 1.531 10 10 EDCE CNCc1ccc(N(C)Cc2nnnn2C)c(Br)c1 707676739 MTPRPXUAYJEJNE-UHFFFAOYSA-N 325.214 1.328 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@]3(C)CCO[C@H]3C3CC3)c2n1 2062658870 WPFUJVGUBPYEIP-WMLDXEAASA-N 330.388 1.678 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 1908254214 JIGRERHYNPAJIN-NWDGAFQWSA-N 339.396 1.827 10 10 EDCE COc1ccc(O)c(CN=c2nc(CNC(=O)OC(C)(C)C)[nH][nH]2)c1 2063194378 AJIXHLGUEFJIHS-UHFFFAOYSA-N 349.391 1.578 10 10 EDCE OCC(CO)CCNCc1cc(Cl)cc(Br)c1O 2064520661 NRHQPQNOBONHIA-UHFFFAOYSA-N 338.629 1.889 10 10 EDCE CC(C)(C)OC(=O)N1CCOCC[C@@H]1C(=O)NCCCN=[N+]=[N-] 2244012581 SLCZYCZXRQVRLG-LLVKDONJSA-N 327.385 1.829 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cc(CO)cs2)s1 2269125828 VWCHVTFUPOAQRG-UHFFFAOYSA-N 336.485 1.897 10 10 EDCE O=C1NC(=O)N(CCC2=CCCCC2)C(=O)C1=CNC[C@H]1CCCO1 2296931281 CMKBJZFOQVSMLE-CQSZACIVSA-N 347.415 1.608 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N1CCC[C@@H](CO)C1 2301374575 RPDFUPJFZCXFEW-QGZVFWFLSA-N 330.428 1.767 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCCNCc2ccc(O)cc2O)C1 2300257496 YNUWKTCEKDCGGO-UHFFFAOYSA-N 338.404 1.823 10 10 EDCE NCc1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2332599878 WAZJBIYQYVWNLI-XAGKMFGPSA-N 327.222 1.228 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(Br)c1 2355335595 DFDFXLNKVFYRGG-LHVMMRPKSA-N 341.249 1.789 10 10 EDCE O=C(NCCCN1CCOC1=O)NCc1ccc(N2CC=CC2)cc1 172702786 MTBNSTJROCVOJB-UHFFFAOYSA-N 344.415 1.704 10 10 EDCE NS(=O)(=O)c1cccc(CNCc2c(O)cccc2Cl)c1 127302732 QQYUUVJEPMBSNU-UHFFFAOYSA-N 326.805 1.983 10 10 EDCE COc1ccc(N2CCN(C(=O)NCC3(C)COC3)CC2)cc1F 125808226 ZFXDXDATZVVPOB-UHFFFAOYSA-N 337.395 1.702 10 10 EDCE NC(=O)CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 266896899 KJFJAEOROUZUFI-JTQLQIEISA-N 327.331 1.248 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C)CC2(CO)CC2)cc1 284326344 WTERQWJBYAUOSA-UHFFFAOYSA-N 347.459 1.380 10 10 EDCE CN1CCN(c2ccc(CN[C@@H]3CCC(=O)NC3(C)C)cc2)CC1 801734625 INOHPIPZFKAHGC-QGZVFWFLSA-N 330.476 1.585 10 10 EDCE NC(=O)CCCCC(=O)NCc1cc(Br)ccc1O 804739623 MHHIBUHRVQGOFI-UHFFFAOYSA-N 329.194 1.817 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@H](O)CC23CCC3)cc1 817291250 NBGZXDUNDMZABD-KRWDZBQOSA-N 331.460 1.748 10 10 EDCE CC1(C)NC(=O)CC[C@H]1NCc1ccc(N2CCC(O)CC2)c(F)c1 813854663 CVXADYIKIIOZEN-QGZVFWFLSA-N 349.450 1.934 10 10 EDCE COC(=O)[C@H]1CN(C(=O)/C=C\c2cnccn2)c2ccccc2O1 491118193 KQMDYCGDGGQXMS-IDTUSYRASA-N 325.324 1.457 10 10 EDCE CN(C)c1ccc(CNC(=O)CN(C)[C@@H]2CCN(C3CC3)C2)cc1 839490000 ABWDRIQLTXVKCT-GOSISDBHSA-N 330.476 1.537 10 10 EDCE O=C(NCCCOC[C@H]1CCCO1)NCc1c(O)cccc1F 913944233 IRQVDJRPBHJVND-GFCCVEGCSA-N 326.368 1.916 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC([C@H]3COC(=O)N3)CC2)cc1 913927191 XBDAPUPJPWAANE-MRXNPFEDSA-N 346.431 1.783 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(C2CC2)C(=O)C1 748830294 HXJGXCLTZQCYPB-UHFFFAOYSA-N 344.459 1.018 10 10 EDCE C[C@H](O)[C@H]1CN(C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 840281464 SZMGPRFNVUOEHE-XHDPSFHLSA-N 325.384 1.183 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)NC/C=C/CN)cc2F)CC1 841792031 DSMJLNMLDLGQNK-ONEGZZNKSA-N 349.454 1.282 10 10 EDCE CC1(OCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CNC1 843483971 GISISSJMEFECKC-HNNXBMFYSA-N 334.416 1.278 10 10 EDCE Cc1nnc(CN(C)CC(=O)NCc2cc(Cl)ccc2O)n1C 846471809 BBBMKZVEGOWVHG-UHFFFAOYSA-N 337.811 1.231 10 10 EDCE CCN(CC)c1ccc(CN(C)CC(=O)N2CCNCC2)cc1F 843046893 HUSBUDIIDONWOM-UHFFFAOYSA-N 336.455 1.536 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3C[C@H]4COC[C@H]4O3)CC2)cc1F 929823099 RXMKHHLZWKNCPG-DHSIGJKJSA-N 336.407 1.760 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3CCC4(COC4)O3)CC2)cc1F 929823128 SAXWVXVQJVMAAC-HNNXBMFYSA-N 336.407 1.904 10 10 EDCE CCN(C)c1ccc(CN2CCN(S(C)(=O)=O)[C@H](C)C2)cc1 852530259 XZPYVIBZWLZDSV-CQSZACIVSA-N 325.478 1.608 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1[C@H]2CC[C@@H](C2)[C@H]1NC(=O)OC(C)(C)C 923151990 CMYUUZYTCLOZAG-AUZPSNTRSA-N 339.388 1.627 10 10 EDCE COc1cc(CS(=O)(=O)NCc2c(O)cccc2F)sn1 921451857 XGRWUTKJOOZTRL-UHFFFAOYSA-N 332.378 1.616 10 10 EDCE COC[C@H](NC(=O)NCc1c(O)cccc1F)[C@@H]1CCCOC1 924050560 BQGWHSVSWQGSDQ-RISCZKNCSA-N 326.368 1.772 10 10 EDCE CN1C(=O)C[C@H](C(=O)NCc2c(O)cccc2F)[C@H]1c1cccnc1 928709664 KQRMGEBUWKRVNG-YVEFUNNKSA-N 343.358 1.762 10 10 EDCE O=C(NCCCSc1nccs1)NCCN=c1cc[nH]cc1 759591952 USJLWISDRDIQLH-UHFFFAOYSA-N 337.474 1.854 10 10 EDCE CC1(C)SC[C@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1117407207 MCCDCZDTSRNFSR-OAHLLOKOSA-N 345.468 1.689 10 10 EDCE COC(=O)c1c(CNC2CN(C(=O)OC)C2)c2cc(F)ccc2n1C 894346714 WTPQGHPLRUDDMG-UHFFFAOYSA-N 349.362 1.644 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2coc(C(N)=O)c2)cc1C 1317255093 LCIRKOIOCXWEIE-LBPRGKRZSA-N 345.399 1.604 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)Cc1cnon1 1329628461 RMOHITXBEDBPSP-SNVBAGLBSA-N 345.363 1.482 10 10 EDCE O=C1Nc2cc(N3[C@H]4CC[C@H]3COC4)c(Br)cc2[C@@H]1O 695051284 KWGXUTDXBIPRQY-UPFKWVMWSA-N 339.189 1.802 10 10 EDCE C[C@H](O)c1ccc(N2CCN(C)C[C@H]2CO)cc1Br 699437764 ZDDFXMULPJSDCV-JQWIXIFHSA-N 329.238 1.615 10 10 EDCE Cn1cc(N2CC[C@H](NC(=O)NCc3c(O)cccc3F)C2)cn1 1334309915 TVWZZQVWQCNZMU-NSHDSACASA-N 333.367 1.343 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2nn(C)cc2C)cc1C 1265773049 NZZOBCAWOXRNNI-AWEZNQCLSA-N 330.432 1.954 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)CNC(=O)C3CC3)C2)cc1C 1265888884 YCODALCZVNWSQQ-INIZCTEOSA-N 345.443 1.220 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)Cc2ccc(C)o2)cc1C 1507193480 NEAZJKNHXGZRAU-INIZCTEOSA-N 346.427 1.714 10 10 EDCE COc1cc(C(=O)N[C@@H](C)C[C@@H](C)NC(=O)C2(C)CC2)cc(OC)n1 1512259857 MHEDHFXGABZSST-NWDGAFQWSA-N 349.431 1.912 10 10 EDCE O=C(NCc1ccc2c(c1)C(=O)NCC2)NCc1c(O)cccc1F 1469735753 GVCUVFYUNNWKMA-UHFFFAOYSA-N 343.358 1.817 10 10 EDCE CCN(CCNC(=O)[C@H](C)OC)C(=O)c1ccc(N=NC(N)=O)cc1 1704266897 JLAZPMOUVQYIMO-NSHDSACASA-N 349.391 1.462 10 10 EDCE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCn1cnnn1 1472821496 MDPNMOPJRVNKST-UHFFFAOYSA-N 338.327 1.924 10 10 EDCE O=C(CCCn1c(O)nnc1O)NCCCSc1nccs1 1628325444 IIXXDGBGIPJIBK-UHFFFAOYSA-N 343.434 1.225 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1CCCS1(=O)=O 1624954314 HNEQVDSCNXQXIE-ZYHUDNBSSA-N 327.402 1.112 10 10 EDCE CN1C[C@H](C(=O)NCc2ccc(O)cc2O)c2ccccc2C1=O 1626837716 DICSRWJBLMDGLK-HNNXBMFYSA-N 326.352 1.583 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCC[C@@H](NCCCO)C2)cc1 1491897577 XQKSDHIFJRZUQK-CABCVRRESA-N 347.419 1.862 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1nn(-c2ccccc2)cc1O 1638352153 KACVLBXNMKNEEN-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE COc1ccc(CNC[C@H]2CC[C@@H](NC(=O)CNC(C)=O)C2)cc1C 1571527786 DZQOWQOPYIJLIV-DLBZAZTESA-N 347.459 1.514 10 10 EDCE CCOCC(=O)N1CC(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1745998895 TYWDNIRMXPCOGQ-UHFFFAOYSA-N 347.375 1.074 10 10 EDCE Cc1nn(C)c(-n2ccnc2C)c1C(=O)NCc1cccc(O)c1O 1593738942 CFIVYGCQNZJSFU-UHFFFAOYSA-N 341.371 1.564 10 10 EDCE [N-]=[N+]=N[C@H]1CCN([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2O)C1 1912192836 KPNUVHWTXXDLPV-RRFJBIMHSA-N 331.376 1.753 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](C(=O)NCCCN=[N+]=[N-])O1 1985099750 RDOXVTKWDRDWJR-MNOVXSKESA-N 327.385 1.875 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)N1CCC(N=[N+]=[N-])CC1 1985101011 MMTMXENFNDFJFB-UHFFFAOYSA-N 327.385 1.829 10 10 EDCE CNCc1ccc(N2C[C@@H]3OCCN(C)[C@H]3C2)cc1Br 2153999096 YRQYAUJFUQEWFW-GJZGRUSLSA-N 340.265 1.688 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)[C@@H]1CCCO1 2010406247 RNRLHMPXGWZHFW-WOPDTQHZSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCC1(CN=[N+]=[N-])CC1)C(C)(C)O 2014483444 SHCCUUIXRPWDOP-JTQLQIEISA-N 341.412 1.857 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@@H](CO)[C@@H](O)C2)cc1Br 316445480 RPVCKBRZGCELBD-ZETOZRRWSA-N 343.265 1.909 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](N3CC(O)C3)C2)c(Br)c1 2158747521 YQXVDLBHQYNXCY-JQWIXIFHSA-N 341.249 1.758 10 10 EDCE Oc1cc(Br)ccc1CNC[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@@H]2O 2174413699 PLZSZCKUIKHJMQ-KJMJJSJTSA-N 342.233 1.622 10 10 EDCE CNC(=O)c1cnn(Cc2cc(Br)ccc2O)c1O 2070462134 OWXUHRDLBFKMRJ-UHFFFAOYSA-N 326.150 1.465 10 10 EDCE N[C@@H]1CC[C@@H](C(=O)O)N(Cc2cc(Br)cc(F)c2O)C1 2188782153 PETILTJGBLGLAZ-KOLCDFICSA-N 347.184 1.670 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)c(Br)c1 2182562651 WSPDHYHJRLKELL-IYTZEYEFSA-N 342.233 1.680 10 10 EDCE CNCc1ccc(N2CCN3CCOC[C@H]3C2)cc1Br 2185883208 WKVZTQPZPKPDNB-CQSZACIVSA-N 340.265 1.689 10 10 EDCE COc1ccc(Br)c(CN[C@@H](CO)CN(C)C)c1O 2227749883 VZHLCNHLKKKQCO-SECBINFHSA-N 333.226 1.175 10 10 EDCE Cc1ccc(N2C(=O)NC(=O)C(=CNN3CCCCC3)C2=O)cc1C 2296928130 SACDEIIESXEMIM-UHFFFAOYSA-N 342.399 1.761 10 10 EDCE Cc1ccc(CN2CCN(C)C[C@H]2CO)c(O)c1Br 2352678484 HEBIMEVDBZPGIQ-LBPRGKRZSA-N 329.238 1.571 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)c(F)c1Br 2355335291 ZACMVFHHEMOBKY-HGEXNKOUSA-N 345.212 1.367 10 10 EDCE CNC(=O)c1cccc(OCC(=O)N(C)Cc2ccccc2O)c1 129603372 QWGAWCMIIMJVON-UHFFFAOYSA-N 328.368 1.789 10 10 EDCE CSCCC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 190586117 YYMBXCYQISVVMB-UHFFFAOYSA-N 335.473 1.724 10 10 EDCE CC(=O)N(C(=O)N1CCN(c2ncccn2)CC1)c1ccc(N)cc1 243794194 QMNHGCJTWIYPJO-UHFFFAOYSA-N 340.387 1.354 10 10 EDCE CC1(N2CCOCC2)CCN(C(=O)c2c(F)ccc(O)c2O)CC1 530272816 CYNZGYWCAPHPEX-UHFFFAOYSA-N 338.379 1.564 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H]1CCC2(CCOCC2)[C@H]1O 283719091 UYMPXWUSVWHGDR-MEGZMVCVSA-N 347.411 1.795 10 10 EDCE CC(C)N(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCOC1 292985618 XVZVPCUXHFZRJU-LBPRGKRZSA-N 342.417 1.403 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(CC)C1=O 802534785 PKAJWRXOOCKMCO-INIZCTEOSA-N 332.448 1.905 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3COC[C@@H](C2)C3O)cc1Br 2167791912 KHHDRGURKHHTMX-NEJNLMRRSA-N 341.249 1.912 10 10 EDCE CC(=O)N1CCN(CCNC/C=C/c2ccc(N(C)C)cc2)CC1 835037895 YTNKXUVUXPYECG-SNAWJCMRSA-N 330.476 1.520 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)[C@H](CN)c2ccc(F)cc2)cc1 841845794 DTLKJEZUJKLGIJ-QZTJIDSGSA-N 344.434 1.750 10 10 EDCE Cc1ccc([C@@H](C)NCC[C@@H]2CNCCS2(=O)=O)c(O)c1C 925796403 OJHLCZYQWQTRNX-ZIAGYGMSSA-N 326.462 1.436 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1nccn1C 852005733 ZSYDTPAZRLSTQI-CQSZACIVSA-N 343.431 1.817 10 10 EDCE CC(C)NC(=O)[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 853603369 QRCRYEXAIDNPQO-WBMJQRKESA-N 334.416 1.555 10 10 EDCE CC(C)NS(=O)(=O)c1cccnc1N1Cc2cccc(O)c2C1 866117313 KOMJJMOLLZNPOK-UHFFFAOYSA-N 333.413 1.994 10 10 EDCE CCO[C@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)C1CCOCC1 867302898 WDNSBGTVJWYNNR-PXAZEXFGSA-N 337.416 1.977 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)CCCCCO)cc2)CC1 1138230052 DEOBIRATNRGADW-UHFFFAOYSA-N 347.459 1.524 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1COc2ccc(O)cc2O1 1137464464 AUZKXNVHBCOPJT-INIZCTEOSA-N 331.324 1.302 10 10 EDCE C[C@@H](NC(=O)CNS(=O)(=O)c1ccccc1N)c1ccccc1O 1302532382 ADBANVUGIIFLAP-LLVKDONJSA-N 349.412 1.130 10 10 EDCE O=C(O)C1=C[C@@H](c2cc(Br)ccc2O)NC(=S)N1 76260966 FHUWSQDADJMEAX-ZETCQYMHSA-N 329.175 1.642 10 10 EDCE O=C(CNC(=O)Cc1ccc(O)cc1)NCc1c(O)cccc1F 1178412627 BZRKEVZXQCHURX-UHFFFAOYSA-N 332.331 1.212 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](CO)[C@@H](CO)C2)cc1Br 704451513 KBTVKGGIWVEDSC-GMTAPVOTSA-N 330.222 1.539 10 10 EDCE NS(=O)(=O)CCCCNCc1c(O)cccc1Br 706883643 SXDBCFXCINTEOW-UHFFFAOYSA-N 337.239 1.313 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccn(C)c2C)cc1C 1268322349 JKFGBLFIZVTPAN-MRXNPFEDSA-N 345.443 1.531 10 10 EDCE COCC1(CCNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 1349270823 LQDOYCWMMIUPFD-UHFFFAOYSA-N 347.459 1.644 10 10 EDCE CN(CCCC(=O)NCc1cccc(O)c1O)C(=O)c1ccncc1 1455317613 WBMLUDOUHBKFNQ-UHFFFAOYSA-N 343.383 1.661 10 10 EDCE CCOC[C@@H](C(=O)OC)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1295064300 JEDHIQSRIXVAOT-LBPRGKRZSA-N 336.348 1.499 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CNC(=O)C1 1470514963 MBPUYEBLDCZIOT-HNNXBMFYSA-N 332.448 1.809 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H]2CCN(C(=O)CNC(C)=O)C2)cc1C 1484326505 KVSZPAMXLFLIMB-WMLDXEAASA-N 347.459 1.466 10 10 EDCE COc1cccc(CNC(=O)c2cccc(Nc3nn[nH]n3)c2)c1O 1622779248 LTDUGASOTGNAID-UHFFFAOYSA-N 340.343 1.588 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)CNC(=O)OC 1716206664 FZJXZONFXKLFPB-UHFFFAOYSA-N 337.420 1.298 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)C[C@H]2CCNC2=O)cc1C 1713409183 PGVMIXQJVHBQJA-GDBMZVCRSA-N 347.459 1.514 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2scnc2C)cc1C 1568550424 WOWWAHFHDHLYKJ-AWEZNQCLSA-N 349.456 1.649 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2[nH]c(O)nc2C)cc1C 1568175937 ADKQHDFTSQZMPU-LLVKDONJSA-N 346.431 1.896 10 10 EDCE COC1CCN(c2ccc(CN[C@@H](CO)c3cnn(C)c3)cc2)CC1 1642646636 SORAFVBABVQMQO-IBGZPJMESA-N 344.459 1.859 10 10 EDCE Cn1c(=O)n(CC(=O)NCc2cccc(O)c2O)c2ccccc21 1651173029 NWHMEYYYFMGTPP-UHFFFAOYSA-N 327.340 1.068 10 10 EDCE C[C@]1(CO)COCCN(c2ccc(CN)c(Br)c2)C1 2135102801 BYLRVHRCEWBTSY-AWEZNQCLSA-N 329.238 1.743 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@](F)(CO)C3)c(Br)cc21 1917073745 JCWCODFZCIZMEV-WCQYABFASA-N 344.184 1.312 10 10 EDCE CO[C@H]1C[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)C1 2010391608 AEFYVMHOJGNKNQ-WOPDTQHZSA-N 339.396 1.922 10 10 EDCE Oc1c(Br)cc(Cl)cc1CNC[C@H]1COC[C@H]1O 2036575492 FIDLNJNBJDZIFK-GZMMTYOYSA-N 336.613 1.905 10 10 EDCE Cn1nnc(Br)c1C(=O)Nc1ccc(O)cc1C(=O)O 381183547 QLBLADJRAHYXRR-UHFFFAOYSA-N 341.121 1.234 10 10 EDCE CC(C)CNCc1ccc(N(C)C(CO)CO)c(Br)c1 383776909 QAUYTQKNNQXRHK-UHFFFAOYSA-N 345.281 1.984 10 10 EDCE O=C1Nc2cc(N3CCCC[C@H](O)C3)c(Br)cc2[C@@H]1O 2169201068 DGPISXOJEVNHNX-SDBXPKJASA-N 341.205 1.786 10 10 EDCE C[C@H](O)CN1CCN(c2ccc([C@H](C)N)cc2Br)CC1 2170215249 DCINOJZGMCFODO-RYUDHWBXSA-N 342.281 1.972 10 10 EDCE CN[C@H](C)c1ccc(N(C)CC(CO)CO)cc1Br 2094031197 SPYUUCBWIGJHKN-SNVBAGLBSA-N 331.254 1.767 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCCCN=[N+]=[N-])[C@H](CC(N)=O)C1 2303474602 GWBVRKCOAVTBEQ-GFCCVEGCSA-N 340.428 1.874 10 10 EDCE N=c1ccnc(CNC(=O)C=Cc2ccc(N3CCOCC3)cc2)[nH]1 2307534406 PLTWNMLDOPQTTH-UHFFFAOYSA-N 339.399 1.055 10 10 EDCE CC[C@H]1CN(C(=O)C=Cc2ccc(O)c(O)c2)CCN1C[C@H](C)O 2308001667 DKMFXTAGDICOQI-ZFWWWQNUSA-N 334.416 1.415 10 10 EDCE C[C@H](N)c1ccc(N2CC(O)(CN(C)C)C2)cc1Br 2343639814 YHWQENFGPUSPNU-JTQLQIEISA-N 328.254 1.582 10 10 EDCE C[C@@]1(O)Cc2ccc3c(c2C(=O)[C@H]1O)C(=O)c1cccc(O)c1C3=O 104579457 ZGIMJLWQWQRQNJ-RTBURBONSA-N 338.315 1.018 10 10 EDCE COC[C@@H](O)CN(C)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 178076826 QKISMPHCALXDAF-JZLODUJNSA-N 334.416 1.002 10 10 EDCE CN1CCCc2cc(CNC(=O)NCCCN3CCOC3=O)ccc21 77522089 JJNJINQRXFUQGU-UHFFFAOYSA-N 346.431 1.711 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CCCN(c3ncccn3)C2)c(O)c1O 182119947 HFTGZBATSMALRU-GFCCVEGCSA-N 328.372 1.595 10 10 EDCE CN1CCC[C@H]2CN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC[C@@H]21 133487249 ZDMKJCLVFSTZCQ-AAEUAGOBSA-N 346.387 1.846 10 10 EDCE COC[C@@H](O)CCNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255397222 VFTGKBCQESOVOQ-IMXKFXGHSA-N 334.416 1.050 10 10 EDCE COC(=O)CC1(CS(=O)(=O)Nc2ccc(O)cc2C(=O)O)CC1 274977753 XJFZPRIULHQNKJ-UHFFFAOYSA-N 343.357 1.175 10 10 EDCE COc1cccc(CNC(=O)N[C@H]2CCC(=O)NC23CCC3)c1O 282789026 FVWYYBXPVVPYFG-ZDUSSCGKSA-N 333.388 1.401 10 10 EDCE COc1cccc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)c1O 289095716 BUNYSASVXXXASZ-CYBMUJFWSA-N 328.434 1.257 10 10 EDCE Cc1ccc(CNCCN2CCN(C)CC2)c(O)c1Br 2381136977 DHSZKVQBXZVZDS-UHFFFAOYSA-N 342.281 1.800 10 10 EDCE CCOCCOCC(=O)NCc1cc(Br)ccc1O 804737121 IPQSSVDVBARCEG-UHFFFAOYSA-N 332.194 1.824 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 808531992 FKDBOSZRZBXNDC-SECBINFHSA-N 341.722 1.533 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H](OC(F)F)C3)cc2N1 801681233 ZSBVEWTYIYPDIT-ZETCQYMHSA-N 329.259 1.744 10 10 EDCE O=C(O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(Br)CC1 2168170386 WNRYXSNIRAGNBP-QMMMGPOBSA-N 344.161 1.137 10 10 EDCE CC[C@H](COCC1CC1)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 826707642 WLYRHYBPONDPPZ-MRXNPFEDSA-N 347.459 1.690 10 10 EDCE CSC[C@H](NC(=O)NCc1ccc(N(C)C)cc1C)C(=O)O 909042722 INJMDOHTAVORTL-ZDUSSCGKSA-N 325.434 1.676 10 10 EDCE C[C@H]1CNCC[C@H]1NC(=O)NCc1cccc(Br)c1O 841988884 NMAIREVCDBHZMI-JOYOIKCWSA-N 342.237 1.952 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](c2cc(O)c(O)c(O)c2)[C@@H](CO)C1 687734652 ZCWIUOKVLPQJSJ-GHMZBOCLSA-N 325.361 1.746 10 10 EDCE CCn1nc(C)c(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)n1 855224758 GZGFSEIUSOZNEA-ZDUSSCGKSA-N 329.404 1.624 10 10 EDCE CO[C@@H](CNC(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CCOC1 852138045 FDROZPDDAKABRT-WMZOPIPTSA-N 345.443 1.914 10 10 EDCE CC[C@@H](O)CC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 857494517 QGQJXLDGJHTOCK-QGZVFWFLSA-N 333.432 1.132 10 10 EDCE CC1(C)[C@@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1(F)F 856067758 GVQKDAJGLYROEW-LLVKDONJSA-N 348.371 1.785 10 10 EDCE CNS(=O)(=O)[C@@H]1CCCN(Cc2cc(C)cc(OC)c2O)C1 754726856 XCGQHSKDUYIZMQ-CYBMUJFWSA-N 328.434 1.223 10 10 EDCE CN1CCCc2cc(CNC(=O)C3(N4CCOCC4)CC3)ccc21 865053610 JYOCHELKQRPNDS-UHFFFAOYSA-N 329.444 1.550 10 10 EDCE COc1ccnc(N2CCN(Cc3c(O)cccc3OC)CC2)n1 768264427 OZOKPIHTIJPTSB-UHFFFAOYSA-N 330.388 1.522 10 10 EDCE Cn1cc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)nn1 761631064 UWQUAXONVWUALI-UHFFFAOYSA-N 335.751 1.139 10 10 EDCE CCN1C[C@H](S(=O)(=O)N[C@@H](C)c2cc(OC)ccc2O)CC1=O 866842163 SKOHPRBONOQZJN-CMPLNLGQSA-N 342.417 1.002 10 10 EDCE C[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cncs1 1119795619 WSPSBPNHYGCMSG-LLVKDONJSA-N 332.429 1.703 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCC[C@H]1CCCO1 786600108 UMELDFNRZYMXSM-OAHLLOKOSA-N 334.416 1.816 10 10 EDCE COC(=O)[C@@]1(O)CCN(Cc2cccc(Br)c2O)C1 895708180 QHOQVUOQBSPJOO-CYBMUJFWSA-N 330.178 1.265 10 10 EDCE COC(=O)[C@H]1C[C@@H]2C[C@H](NC(=O)NCc3ccc(OC)cc3O)[C@@H]2C1 897728563 IKLQMBMPMWGWIA-OSRDXIQISA-N 348.399 1.788 10 10 EDCE CS(=O)(=O)Cc1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1 1136336131 CEZSQTUFRHTGBP-UHFFFAOYSA-N 349.408 1.501 10 10 EDCE COc1cccc(CNC(=O)[C@H]2C[C@H]2NC(=O)OC(C)(C)C)c1O 1137473690 RTKMYVUHCMFFMF-NWDGAFQWSA-N 336.388 1.930 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)[C@H](N)c1ccccc1O 1899562367 SCZPUMNDOVTQAN-DGCLKSJQSA-N 344.433 1.330 10 10 EDCE CN(C(=O)C(=O)N1Cc2cccc(O)c2C1)C1Cc2ccccc2C1 1348585788 SWQDYZDCRNGCMK-UHFFFAOYSA-N 336.391 1.860 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CC[C@H]3C[C@H]2CO3)cc1 1262223157 LUSKNHBGBQONDF-ZOBUZTSGSA-N 345.443 1.300 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC/C=C/CNC[C@@H]2CCOC2)cc1 1268631987 GJXKBZVIMVSFND-XAWKZDTMSA-N 345.403 1.761 10 10 EDCE O=C(NC[C@@H](c1ccccc1)c1nc[nH]n1)c1c(F)ccc(O)c1O 1457802604 FKAVGKKKWFPEAH-NSHDSACASA-N 342.330 1.917 10 10 EDCE C[C@H](C(=O)NCc1cc(O)ccc1O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1455350793 VEVGAUHSSPRTAP-HONMWMINSA-N 346.383 1.278 10 10 EDCE COc1ccc(CNC(=O)c2ccc(Cn3ccnn3)cc2)c(O)c1 1296967744 FNTSLPYPUYTSQA-UHFFFAOYSA-N 338.367 1.971 10 10 EDCE CN1CCC(N2CC[C@H](N(C)C(=O)Cc3ccc(O)c(O)c3)C2)CC1 1628813634 FBJMTBVTTLHQJH-INIZCTEOSA-N 347.459 1.267 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@H]2CC(=O)N(C)C2)cc1C 1715823486 JPLCVZLFDZNIDQ-APHBUQMISA-N 345.443 1.244 10 10 EDCE Cn1cc(C(=O)NCc2cc(Cl)ccc2O)c(=O)c2cnn(C)c21 1557386781 YOMGWRCZAIOCLN-UHFFFAOYSA-N 346.774 1.561 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C2(CN(C)C)CC2)cc1C 1480523756 DSHPZRJONZGXFC-HNNXBMFYSA-N 333.476 1.940 10 10 EDCE CN1C(=O)[C@H](NC(=O)Cc2ccc(O)c(O)c2)Cc2ccccc21 1557448769 LNDPLKXVYIWWJP-CYBMUJFWSA-N 326.352 1.344 10 10 EDCE CCn1cc(-c2nn(C)cc2C(=O)NCc2ccc(O)cc2O)cn1 1639444767 YUVOKVBAKMOMND-UHFFFAOYSA-N 341.371 1.645 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)c2ccnc3c2CC(=O)N3)c2ccccc21 1634660652 ZCIQXYJFXHMFTF-CYBMUJFWSA-N 337.335 1.493 10 10 EDCE COc1ccc(CNC2CC(CNC(=O)CNC(C)=O)C2)cc1C 1566139700 SGXMJKAZXQPEPT-UHFFFAOYSA-N 333.432 1.124 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H]2CCC(=O)NC2)cc1C 1731927842 LNOMDIDMRHYRSO-HNNXBMFYSA-N 333.432 1.078 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](c3cc(O)n[nH]3)C2)cc1 1644261405 SYFDRXZJNMVVNM-SNVBAGLBSA-N 328.332 1.907 10 10 EDCE CNC(=O)c1cccc(N(C)C(=O)/C=C/c2cnc(OC)nc2)c1 1584789519 LTAFJSWYGBZUSP-BQYQJAHWSA-N 326.356 1.521 10 10 EDCE COc1ccc(Br)c(CNC2CN(C(N)=O)C2)c1O 1964615235 OVMRBGDVMBQYGV-UHFFFAOYSA-N 330.182 1.016 10 10 EDCE COc1ccc(N2CCN(CCCN[C@H]3CCCOC3)CC2)cc1 162828559 CSBCQRBUJLXBJX-KRWDZBQOSA-N 333.476 1.976 10 10 EDCE CNCc1ccc(N(C)CC(=O)NC2CC2)cc1Br 234399351 UBVZIOCAMWGXOX-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE CO[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980371801 XJAUGOIPGWYDEO-MRBYEJRBSA-N 328.409 1.180 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)N1CC[C@H](N=[N+]=[N-])C1 1985102257 DNPIKFGPASMJJU-NSHDSACASA-N 326.401 1.354 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@H](NCc3ccc(N)cc3)[C@H]2C1 2008714223 USXSFZHBWNKBRY-PMPSAXMXSA-N 333.432 1.993 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)C[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010404706 BYVWXZCVHHCTBW-SRVKXCTJSA-N 339.396 1.658 10 10 EDCE O=C(O)CN(CCNC(=O)c1ccc(O)c(O)c1)Cc1ccccc1 2035463664 UAOLUQCLNOHOJV-UHFFFAOYSA-N 344.367 1.414 10 10 EDCE O=C1Nc2cc(N3CCO[C@H](CF)C3)c(Br)cc2[C@H]1O 2172042472 WDSVRTCTZYLMKW-JMCQJSRRSA-N 345.168 1.609 10 10 EDCE Cc1cccc(O)c1CN=c1nc(CNC(=O)OC(C)(C)C)[nH]n1C 2063205192 YNWPHMARBMGVFN-UHFFFAOYSA-N 347.419 1.888 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2199533683 XIFMLNQOXXTTIK-RKADHFOPSA-N 342.233 1.823 10 10 EDCE OCC[C@H]1CN(c2ccc(CO)cc2Br)C[C@H]1CO 2093501327 LBPPCUBUHFYCOU-RYUDHWBXSA-N 330.222 1.369 10 10 EDCE O=S1(=O)C[C@H]2CCN(c3ccc(CO)c(Br)c3)[C@@H]2C1 2094927053 MGVNUPHIHPUDPB-ZWNOBZJWSA-N 346.246 1.565 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@@]4(CO)C3)c(Br)cc2[C@H]1O 2200842538 ALWAGYHDFYHEBU-PYSYBHHASA-N 339.189 1.253 10 10 EDCE COc1ccc(Br)c(CN2CC(CCN)(OC)C2)c1O 2236043049 LCZJIWXWEPAZSW-UHFFFAOYSA-N 345.237 1.713 10 10 EDCE COc1ccc(Br)c(CN[C@@H](C)C(=O)N(C)C)c1O 2227747864 GKKZROOIGYIIPA-QMMMGPOBSA-N 331.210 1.730 10 10 EDCE CCc1nc(C(N)=S)cc(=NCc2cnc(SC)s2)[nH]1 2284674658 VBFLGPPHNLCBIJ-UHFFFAOYSA-N 325.488 1.886 10 10 EDCE O=C1NC(=O)N(C2CCCCC2)C(=O)C1=CNCCN1CCCCC1 2296566863 UQNZHMTXXVCVHC-UHFFFAOYSA-N 348.447 1.357 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(c2ccccn2)CC1 2307978570 KWBIYHURSGPOAP-UHFFFAOYSA-N 325.368 1.855 10 10 EDCE Cc1ccc(CN2C[C@H](C(=O)O)CC2=O)c(O)c1Br 2352636409 LFIFIBZIKMCPQL-SECBINFHSA-N 328.162 1.896 10 10 EDCE CCNC(=O)C1CN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])C1 178212178 RXELHJLRPKHESS-FNORWQNLSA-N 333.344 1.353 10 10 EDCE COC[C@H]1[C@@H](O)[C@@H](O)CN1c1ccc([C@H](C)O)c(Br)c1 2358552247 VVDZOTJRIPQUNQ-PWURMNTRSA-N 346.221 1.059 10 10 EDCE Cc1ccc(O)c([C@@H](C)NC[C@]2(CO)COCC3(CCC3)N2C)c1 527956665 QXYYDWIXTQSXAX-BEFAXECRSA-N 334.460 1.967 10 10 EDCE COC[C@@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)C[C@H](C)O1 251514684 CHHYNYBXLCQQQX-YOEHRIQHSA-N 335.448 1.105 10 10 EDCE NC1=C(C(=O)N=NC(=O)CC23CC4CC(CC(C4)C2)C3)NC=CN1 606348234 BNXRLKKPKZLYFG-UHFFFAOYSA-N 329.404 1.890 10 10 EDCE C[C@@H]1OCC[C@H]1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 274945033 NYBCHEDZXZTOEI-XJKSGUPXSA-N 340.445 1.120 10 10 EDCE CN(C)c1ccc(CNCc2ncccc2S(C)(=O)=O)cc1F 278718158 KSSFULYVMDIDSN-UHFFFAOYSA-N 337.420 1.980 10 10 EDCE Cc1ccc(CN2C[C@H]3C(=O)NC(=O)[C@H]3C2)c(O)c1Br 2380765219 KQULHKHWSAGIFZ-AOOOYVTPSA-N 339.189 1.168 10 10 EDCE Cc1ccc(CN(C)C(=O)c2c[nH][nH]c2=N)c(O)c1Br 2380766100 QLHLXOLKOWBBFV-UHFFFAOYSA-N 339.193 1.871 10 10 EDCE Cc1ccc(CN2C[C@H]3COC[C@@H](C2)[C@@H]3O)c(O)c1Br 2380803737 IVSBXYWHCGEEAJ-IMRBUKKESA-N 342.233 1.902 10 10 EDCE CC(C)NCc1ccc(N2CC(NC(N)=O)C2)cc1Br 2163217284 RMYMDGMJVAJMPE-UHFFFAOYSA-N 341.253 1.804 10 10 EDCE COC[C@@H](C(N)=O)N(C)C(=O)c1cc(C)n(-c2cccc(C)c2)c1C 817936199 MAIYEOONFMCCQU-KRWDZBQOSA-N 343.427 1.975 10 10 EDCE COC[C@@H](CCCN)NCc1cc(F)c(N2CCOCC2)c(F)c1 817934171 BYNDMLNVEDXEQO-CQSZACIVSA-N 343.418 1.645 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@]3(C)CCC(=O)NC3)C2)cc1 819589705 GDFYOSBUOLKDNQ-IFXJQAMLSA-N 345.443 1.554 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H](O)C3CCC3)cc2)C1 825373111 CTURETQQBAQMKG-DOTOQJQBSA-N 345.443 1.166 10 10 EDCE C[C@H](NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H](C)N 841915654 SPNPKSPMVQSAOG-MNOVXSKESA-N 342.390 1.336 10 10 EDCE COC(=O)C[C@@H](CNC(=O)NCc1ccc(OC)cc1O)C1CC1 852602893 JMNFQHMGLWPJAS-ZDUSSCGKSA-N 336.388 1.789 10 10 EDCE CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)NCc2c(O)cccc2F)C1 920031134 YOSCCDVTPUOLLU-QWRGUYRKSA-N 344.408 1.686 10 10 EDCE Oc1ccccc1CN(C[C@@H]1CCCO1)C[C@H]1CCC2(CNC2)O1 852742532 JPSLKCRYZWWRJZ-DLBZAZTESA-N 332.444 1.894 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C[C@@H](OC)[C@H]1CCOC1 852192533 SHIPUBDZLAAUPQ-DOTOQJQBSA-N 337.416 1.809 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CC34CCNCC4)C2)cc1 852843566 BFNUXDXDAQSYJS-WMLDXEAASA-N 329.444 1.780 10 10 EDCE CN1CCc2cc([C@@H](CN)N(CCO)C(=O)OC(C)(C)C)ccc21 698191799 XJIHFBNRSVJHLU-MRXNPFEDSA-N 335.448 1.908 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@H]2CNCC[C@H]21 866717091 VNEGXBZWKSUDEN-PKOBYXMFSA-N 344.503 1.785 10 10 EDCE CCC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N=NC(N)=O)cc1 936115667 XYHIYRUZFMOJHZ-STQMWFEESA-N 329.360 1.684 10 10 EDCE COC(=O)[C@H]1CCCC[C@H]1S(=O)(=O)N1Cc2cccc(O)c2C1 867691299 VEXFJWJWAXBHCK-SWLSCSKDSA-N 339.413 1.769 10 10 EDCE CNc1cnc(C(=O)N(C)CCN(C)c2ccc(OC)cc2)cn1 862130008 ZTSHNKGJLWMZHJ-UHFFFAOYSA-N 329.404 1.735 10 10 EDCE COC(=O)CCNC(=O)CCNCc1ccc2ccccc2c1O 862528089 PNICEMGFDIREDE-UHFFFAOYSA-N 330.384 1.704 10 10 EDCE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@H](C)S(N)(=O)=O)c1 770449420 FHVLMASHBFMPFY-AWEZNQCLSA-N 349.456 1.809 10 10 EDCE OCc1nnc(CNCc2cc(Br)cc(F)c2O)s1 1877559088 VFGAJNWLEWYHKS-UHFFFAOYSA-N 348.197 1.927 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)[C@@H](O)c2ccccn2)N(C)C)cc1 891246748 CUUUWVRBBDGGNK-MSOLQXFVSA-N 342.443 1.600 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1895876753 YIPFGQOXENMIDY-GARJFASQSA-N 325.369 1.268 10 10 EDCE O=C1C[C@]2(CCN(Cc3cc(Br)ccc3O)C2)CN1 279407769 LPMGLIAFGTXGBS-CQSZACIVSA-N 325.206 1.867 10 10 EDCE CN[C@@H](C)c1ccc(N2CCN(C)[C@@H](CO)C2)c(Br)c1 687613170 YTPDUXCQGOLYDW-WCQYABFASA-N 342.281 1.842 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCc2cnn(C)n2)cc1C 1265826850 LCEKCOKDHJLEAQ-CQSZACIVSA-N 345.447 1.359 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)[C@@H]2COC(=O)N2)cc1C 1277177920 KRYJQBWDOFZPDZ-HIFRSBDPSA-N 349.431 1.487 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C=C2CCC2)cc(OC)n1 1284219754 AEKJXRVVYJVFDT-NSHDSACASA-N 333.388 1.444 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc([C@@H]2CCCN2C)[nH]n1 1447560054 FHZRVSUVCGEZKK-ABAIWWIYSA-N 344.415 1.949 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)N(Cc1ccco1)Cc1ccccc1O 1445639535 WYLAZKNAHOCQBA-INIZCTEOSA-N 347.367 1.828 10 10 EDCE Nc1ncc2c(n1)CCN(C(=O)c1cc3cc(O)c(O)cc3s1)C2 1447926686 SNFUMQVYSNETBZ-UHFFFAOYSA-N 342.380 1.883 10 10 EDCE COc1ccc(O)c([C@H](C)N[C@H](C)c2nc(-c3nc[nH]n3)no2)c1 1459848817 HUOJJGQZXACDRW-DTWKUNHWSA-N 330.348 1.981 10 10 EDCE COCCN(C[C@H](O)C(F)(F)F)C(=O)Cc1ccc(O)c(O)c1 1452647715 DWAINNUGSZXXOL-LBPRGKRZSA-N 337.294 1.039 10 10 EDCE COC(=O)NCC(=O)NC[C@H](NCc1ccc(OC)c(C)c1)C1CC1 1713104518 JATFEIDECJWEEF-HNNXBMFYSA-N 349.431 1.344 10 10 EDCE CC(C)CCNC(=O)[C@H]1CSCN1C(=O)c1cccc(O)c1O 1632673656 HJXPTZGXYVCKLY-GFCCVEGCSA-N 338.429 1.775 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)Cc2nc[nH]n2)cc1C 1497299478 KXLDDDAOLXOKKQ-ZDUSSCGKSA-N 331.420 1.349 10 10 EDCE CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)NCc2cc(O)ccc2O)C1 1633595260 OOTDHZJZUHPYGT-CHWSQXEVSA-N 334.416 1.999 10 10 EDCE CCC(=O)N[C@@H](C)C(=O)N(C)[C@@H](C)CNCc1ccc(OC)c(C)c1 1732421564 VSBQYYXJBZCKFX-GJZGRUSLSA-N 349.475 1.855 10 10 EDCE COC(=O)CCN(C[C@H]1CCCO1)C(=O)Cc1ccc(O)c(O)c1 1586300376 KLEQYFVWZORKQO-CYBMUJFWSA-N 337.372 1.211 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2ccnnc2C)cc1C 1664047409 HDTUEUAXVAYLSL-UHFFFAOYSA-N 328.416 1.964 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)c(Br)c1 2126161993 OOXGCAWVGHJIEV-IOQCUFBNSA-N 327.222 1.086 10 10 EDCE CCOCCN1C[C@H]2C[C@H]1[C@H]2NC(=O)c1ccc(N=NC(N)=O)cc1 1699571782 VUNDTLDZMYIFCE-SNPRPXQTSA-N 345.403 1.688 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCc2ncnn2C1 161340162 YLFDAOITTDLUNN-HNNXBMFYSA-N 342.447 1.891 10 10 EDCE NCc1ccc(N2CCN3CCOC[C@@H]3C2)c(Br)c1 2129378203 MALAKFNSHUIRDC-LBPRGKRZSA-N 326.238 1.429 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H]1CNC(=O)C1 1951702646 ZWQLTRJJWWOLAG-NEPJUHHUSA-N 336.388 1.670 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)[C@@H](N)Cc1ccc(O)c(O)c1 1952710793 OIFGMXXQVOWPQP-FZMZJTMJSA-N 326.393 1.507 10 10 EDCE CNCc1ccc(N2CC[C@@H](OCC(N)=O)C2)cc1Br 2145377595 PDCOKANHVLYFDV-GFCCVEGCSA-N 342.237 1.249 10 10 EDCE CC[C@@]1(O)CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2150756274 BOFWXCMLGJRZPX-GXTWGEPZSA-N 340.221 1.752 10 10 EDCE CC(C)(C)OC(=O)N[C@]12C[C@@H]1CN(C(=O)c1cccc(O)c1O)C2 2006284507 RGJVSWAWMHDOKQ-QGHHPUGFSA-N 334.372 1.837 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@H]1CC(=O)N1CC(N=[N+]=[N-])C1 2010389715 TZWRAAQVFCVXJE-ZYHUDNBSSA-N 339.396 1.827 10 10 EDCE C[C@](NC(=O)C(F)(F)F)(C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C(F)(F)F 2010405998 OSNLCLHNFAGEGH-XRGYYRRGSA-N 347.219 1.897 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C2(CC2)CO1 2012211196 IGSQZEHZMORBDJ-NSHDSACASA-N 339.396 1.924 10 10 EDCE CN(C(=O)C1(NC(=O)OC(C)(C)C)CC(O)C1)c1ccc(N)cc1 2018065697 POWBVUIDZLIQSL-UHFFFAOYSA-N 335.404 1.650 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)C[C@@]2(C)CO)cc1Br 698136304 FZGPXVUUTRIXQZ-UDZFHETQSA-N 329.238 1.791 10 10 EDCE O=C(O)CN1CC[C@H](NCc2cc(Br)cc(F)c2O)C1 2169328149 VMVMEVMBTKBNNT-JTQLQIEISA-N 347.184 1.542 10 10 EDCE CS(=O)(=O)[C@@H]1CCN(c2ccc(CO)c(Br)c2)C1 2059357647 WJBNPXXDTTXYIY-LLVKDONJSA-N 334.235 1.565 10 10 EDCE COc1ccc(Br)c(CNC2(CO)CC(OC)C2)c1O 2236056722 XFXDZDZFWGQSHO-UHFFFAOYSA-N 346.221 1.793 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2329332183 JJRCKHCJHBKQSZ-WTDIUWLJSA-N 327.222 1.099 10 10 EDCE CCn1nc(Br)nc1[C@H](O)[C@@H](N)c1ccccc1O 2353740257 PRFAWIOAUZUMLH-VHSXEESVSA-N 327.182 1.500 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2355336012 KCBSCCLWQDNUQP-LHVMMRPKSA-N 341.249 1.789 10 10 EDCE O=C(c1cccc(O)c1O)N1CCN(C[C@H](O)c2ccccc2)CC1 188428387 OJQGEVHQNKZWDX-KRWDZBQOSA-N 342.395 1.589 10 10 EDCE C[C@H](CCC(=O)O)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 191148544 QZEAUVOXHXLGJB-LHRNQBEKSA-N 332.400 1.906 10 10 EDCE COc1ccc(Br)c(CN(CCO)CCC(=O)O)c1O 2368614255 YIKCVUOROHJBKH-UHFFFAOYSA-N 348.193 1.432 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CNC[C@H]3O)c2C)cc1 262258669 MBRKKPWEWQMRJK-RDTXWAMCSA-N 343.427 1.413 10 10 EDCE Cc1ccc(CNC(=O)Cn2cc(N)cn2)c(O)c1Br 2380815032 HDAYWSMSZVFYHL-UHFFFAOYSA-N 339.193 1.558 10 10 EDCE CNC(=O)[C@H]1CN(C(=O)/C=C/c2ccc(C)nc2)c2ccccc2O1 493645882 HPUWWOOWQKEHQV-OAGJVSPASA-N 337.379 1.943 10 10 EDCE CC[C@@H](O)CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 828259750 SLKAHHSQASCMLV-LJQANCHMSA-N 345.487 1.996 10 10 EDCE C[C@H](NC(=O)[C@@H]1CC[C@H]1C(=O)O)c1ccc(N2CCOCC2)cc1 901949309 FYZMDMZEIDUEJS-APHBMKBZSA-N 332.400 1.811 10 10 EDCE COc1cc(Br)c(C(=O)OCC(=O)C(C)=O)cc1OC 837784553 NDXRATFOQBQWTE-UHFFFAOYSA-N 345.145 1.781 10 10 EDCE CCc1cccc(CN[C@@H]2CCC[C@H]2CNS(C)(=O)=O)c1O 848909513 VPKOPMLOLBOYNJ-DZGCQCFKSA-N 326.462 1.762 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)NCCCn2ccnn2)cc1 845109713 QSBCVQHWUYBVCS-UHFFFAOYSA-N 346.435 1.455 10 10 EDCE Nc1ccc(CCNC(=O)N2CCNC[C@@H]2c2cccnc2)cc1 841955672 JOAOQCZMGVJGCG-QGZVFWFLSA-N 325.416 1.562 10 10 EDCE C[C@@H]1CCN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 920043366 HCPCPGWDQGQYKI-UKRRQHHQSA-N 330.432 1.692 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(Cn2cnnc2)CC1 846472123 XYLQGVUUMKNUIU-DUXPYHPUSA-N 328.372 1.641 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCn4ncnc4C3)C2)cc1 854300073 UJBJTOPGFQSBPL-ZDUSSCGKSA-N 342.403 1.091 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(OC)nn3)C2)cc1 855229628 BKTBRUWRDSYYSO-GFCCVEGCSA-N 328.372 1.503 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2[C@H]3CC[C@H]2c2c[nH]nc2C3)cc1 931293969 ISQCMZLJJGTNIR-YJBOKZPZSA-N 339.443 1.854 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CNC(=O)c2ccccc21 860697277 RLMYVXPYXBUQIU-ABAIWWIYSA-N 340.379 1.672 10 10 EDCE Cc1ccc(O)c(CNC(=O)[C@H]2CCN(C)C[C@H]2c2cnn(C)c2)c1 862754314 XLABVOUEJIPQFT-IRXDYDNUSA-N 342.443 1.786 10 10 EDCE Cc1cc(C(=O)N2CCO[C@@H](CC(N)=O)C2)c(C)n1-c1ccccn1 863487574 VURZFTLOXUWJAM-AWEZNQCLSA-N 342.399 1.206 10 10 EDCE COc1ccc(C(=O)NCC(=O)NCc2ccc(O)c(O)c2)cc1 778913669 AKRSPSYJNYQCML-UHFFFAOYSA-N 330.340 1.153 10 10 EDCE O=C1OCC[C@@H]2CN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)CCN12 770394166 WTOILTWDVSFPJO-LLVKDONJSA-N 341.751 1.980 10 10 EDCE COc1cc(Br)cc(CNCCc2nnnn2C)c1O 771878311 XGWGIAKYRTTWFE-UHFFFAOYSA-N 342.197 1.019 10 10 EDCE CC(=O)c1cn(C2CN(C(=O)NCc3ccc(N(C)C)cc3)C2)nn1 891605698 CHKGTIDWMNYZCP-UHFFFAOYSA-N 342.403 1.313 10 10 EDCE COC(=O)[C@]1(O)CCN(Cc2cc(OC)cc(C(C)(C)C)c2O)C1 895702567 QQNQVRSBLPRPBV-SFHVURJKSA-N 337.416 1.808 10 10 EDCE O=C1CO[C@H]2CCN(C(=O)c3cc4cc(O)c(O)cc4s3)C[C@@H]2N1 897941923 HFSLUNWHBGYEEH-CABZTGNLSA-N 348.380 1.042 10 10 EDCE CCn1nccc1CN(CCO)C(=O)/C=C/c1ccc(O)c(O)c1 794056994 MACUMFFQQUFNGK-GQCTYLIASA-N 331.372 1.349 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC3(CC2)COC(=O)N3)cc1 1152085876 SMEHULZKMAGCSU-UHFFFAOYSA-N 331.332 1.564 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)[C@H](N)c1ccccc1O 1899544938 SCZPUMNDOVTQAN-DGCLKSJQSA-N 344.433 1.330 10 10 EDCE C[C@@H]1COC2(CCC2)CN1C(=O)C(=O)N(C)Cc1ccccc1O 1327765442 QNRQGPOCYHWDRA-CYBMUJFWSA-N 332.400 1.521 10 10 EDCE Cn1nccc1[C@H](NC(=O)c1cc(O)cs1)C(=O)OC(C)(C)C 1261746556 MULRBZNEYAHJQD-LBPRGKRZSA-N 337.401 2.000 10 10 EDCE COc1ccc(F)cc1CNC(=O)C(=O)N(C)Cc1ccccc1O 1346686679 RUASKRNAJGSFHH-UHFFFAOYSA-N 346.358 1.815 10 10 EDCE CCc1nc(C(=O)NC[C@@H](CO)NCc2ccc(OC)c(C)c2)co1 1283745482 QLROIQPFRSTFLS-AWEZNQCLSA-N 347.415 1.435 10 10 EDCE C=C(C)CCC(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1703912502 UZXDWDAEHRMNJZ-HDJSIYSDSA-N 347.415 1.832 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)Cc2cccs2)cc1C 1715574413 LYCSDUXCVDIZOF-HNNXBMFYSA-N 348.468 1.875 10 10 EDCE NC(=O)N1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1626406119 VURNHBRBNBDZTL-UHFFFAOYSA-N 335.385 1.539 10 10 EDCE CC(C)CCN[C@@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1486065699 LDUQIIASTXBQRY-CQSZACIVSA-N 335.408 1.575 10 10 EDCE CN(CCNCc1cnns1)C(=O)c1ccc(N=NC(N)=O)cc1 1713668459 MLBVAJNPOVLIIE-UHFFFAOYSA-N 347.404 1.562 10 10 EDCE Cc1ccc(-c2nnn(CC(=O)NCc3cc(O)ccc3O)n2)cc1 1633595137 JRLAOSOBROCISR-UHFFFAOYSA-N 339.355 1.376 10 10 EDCE COCCOCCc1ncc(C(=O)NCc2ccc(OC)cc2O)[nH]1 1633926783 LXLXQUKRLFDFGK-UHFFFAOYSA-N 349.387 1.259 10 10 EDCE CCC1(Cn2cc(C(=O)NCc3ccc(O)cc3O)nn2)COC1 1638356508 JVZMYWGJKYCZAR-UHFFFAOYSA-N 332.360 1.046 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H](O)Cc1cccc(F)c1 1636600753 AVEXVOUNIFXAJI-KEDPEKRHSA-N 331.343 1.970 10 10 EDCE NC(=O)c1nc2cc(NC(=O)Cc3ccc(O)c(O)c3)ccc2o1 1642406406 SPBPEVDFVZFYSF-UHFFFAOYSA-N 327.296 1.519 10 10 EDCE CC(C)C(=O)NC[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1572478551 DOEGXFWBICWLED-CYBMUJFWSA-N 349.391 1.054 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CCOCCOC 1744549966 XACCGDVZKWLGGY-UHFFFAOYSA-N 334.420 1.846 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CCCn1c(O)nnc1O 1585785994 AHAGSTHDYFJBMZ-UHFFFAOYSA-N 333.392 1.160 10 10 EDCE NC(=O)Cn1cc(NC(=O)c2cc3cc(O)c(O)cc3s2)cn1 1596220446 YWJJHNDWNYKSSA-UHFFFAOYSA-N 332.341 1.247 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)CN(C)C(C)=O)C2CC2)cc1C 1690143212 QIZCEPZZWNBZJT-QGZVFWFLSA-N 347.459 1.466 10 10 EDCE O=C(CCN1C(=O)CSC1=S)N[C@H](C(=O)O)c1ccccc1 1865764820 BZJGWVGHIKKVMF-LBPRGKRZSA-N 338.410 1.179 10 10 EDCE Cn1c(C2=C[C@H](O)[C@H](N)C2)nc2c(Br)cc(F)cc21 2131466946 VIXIUENYVSTPQB-KOLCDFICSA-N 326.169 1.950 10 10 EDCE Cc1cccc(CNC(=O)c2c(Br)nnn2C)c1O 2139760024 NCVXNIYMFRVXBW-UHFFFAOYSA-N 325.166 1.522 10 10 EDCE COc1cccc(CNCc2c(Br)nnn2C)c1O 1967835377 UDORGNUUSQBQTM-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1CCN=[N+]=[N-] 1982240911 DVYLYEIDVDWVLB-NSHDSACASA-N 327.385 1.781 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCO1 1990349014 XSRMXWZMFSYTQT-WDEREUQCSA-N 327.385 1.827 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CN1CCC(NC(=O)OC(C)(C)C)CC1 2010396786 PSPSAUHTPJUNAV-UHFFFAOYSA-N 340.428 1.744 10 10 EDCE COC(=O)[C@H](CC(=O)N1CC[C@@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 2010401054 AJRALRPZNLBLGY-ZJUUUORDSA-N 341.368 1.354 10 10 EDCE Nc1ccc(OCC(=O)NC2[C@@H]3CN(Cc4ccccc4)C[C@@H]23)cc1 398302373 RVWBRADUEAWEAQ-QZTJIDSGSA-N 337.423 1.894 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N(Cc3ccccc3)C[C@H](C)O)c2n1 2062667365 HXGPHJWELRPWGA-ZDUSSCGKSA-N 340.383 1.767 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cncc(N2CCOCC2)c1 2062856123 FNNWYSBIDGEYET-UHFFFAOYSA-N 329.356 1.259 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H](c4ncc[nH]4)C3)c2n1 2063258719 VVSJMEVOWQZFNW-NSHDSACASA-N 326.360 1.486 10 10 EDCE CCN(c1ccc([C@@H](C)O)cc1Br)[C@@H]1CC(=O)NC1=O 2171207254 UPANNXOHZZVSIJ-PRHODGIISA-N 341.205 1.744 10 10 EDCE CN1CC[C@@H]2OCCN(c3ccc(CN)c(Br)c3)[C@H]2C1 2185498741 YRWUYSOQEXGWIM-GJZGRUSLSA-N 340.265 1.817 10 10 EDCE C[C@H](C(=O)NCc1ccccc1O)N1CC(NC(=O)OC(C)(C)C)C1 2068037029 VVEKZSTXLIEEEP-GFCCVEGCSA-N 349.431 1.606 10 10 EDCE O=c1c2c(ccn1Cc1ncsc1Br)CCNC2 2218996947 NDNGTEJYVKIYNO-UHFFFAOYSA-N 326.219 1.761 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)[C@H]1C[C@@H](O)C1 2224218827 NANMZSJHCWDPIJ-KJNMHVQDSA-N 327.178 1.394 10 10 EDCE N[C@H]1[C@H]2C[C@@H](CN(Cc3cc(Br)ccc3O)C2)[C@@H]1CO 2239326127 LRWXUTPAVGKTEB-PBLBJHRBSA-N 341.249 1.542 10 10 EDCE OCc1ccc(N2C[C@@H]3OCC[C@@]3(CO)C2)c(Br)c1 2278868097 ZCWVKTHRISNGPN-KBPBESRZSA-N 328.206 1.529 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCOC2(CNC2)C1 2272912097 FCMMJHAEVVBLNW-UHFFFAOYSA-N 331.185 1.468 10 10 EDCE CO[C@@H]1CCN(CCNCc2cccc(Br)c2O)C1 2267896024 MNKBJQRYAFBSNB-GFCCVEGCSA-N 329.238 1.965 10 10 EDCE OC[C@H](O)[C@@H]1CCN1c1ccc(CNC2CC2)cc1Br 2286216242 SNGPBOUCWFUCCZ-GJZGRUSLSA-N 341.249 1.633 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)OC 2300532272 SQGWQYRDKJEJHK-JTQLQIEISA-N 343.384 1.602 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C12CC(NC(=O)OC(C)(C)C)(CO1)C2 2300531227 CWTLDJVSSPUULK-UHFFFAOYSA-N 339.396 1.972 10 10 EDCE COc1ccc(N/C=C2\C(=O)NC(=O)N(C[C@@H]3CCCO3)C2=O)cc1 103844482 KRFQNBVPPAIKLX-FYQHACEVSA-N 345.355 1.248 10 10 EDCE CN1CCO[C@H](CNC(=O)NCc2ccc3c(c2)CCCN3C)C1 104798802 FNPRSDQGXWIWBK-MRXNPFEDSA-N 332.448 1.199 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCN(C(C)=O)C3)CC2)cc1F 84815520 QLTSOMNXROBYIK-CQSZACIVSA-N 349.406 1.351 10 10 EDCE O=C(Cc1cncnc1)NCc1ccc(N2CCOCC2)c(F)c1 278861197 MFSSEVJFGCCXIA-UHFFFAOYSA-N 330.363 1.311 10 10 EDCE CO[C@H]1CNC[C@@H]1C(=O)NCc1ccc(C)c(Br)c1O 2381139794 BBWFCMAXLJCESB-QWRGUYRKSA-N 343.221 1.314 10 10 EDCE CCOC(=O)COCCN[C@H](C)c1ccc(N2CCOCC2)cc1 809972518 WEQJICGOFWXJJQ-OAHLLOKOSA-N 336.432 1.754 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1coc(COC)n1 819696722 BBMGRCVSQIHAPR-UHFFFAOYSA-N 348.355 1.732 10 10 EDCE CN1CCC[C@@]2(CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)C2)C1 814908396 ALUCUKSCIYPFNY-QGZVFWFLSA-N 346.387 1.848 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Nc3nccn(C)c3=O)C2)cc1 822372044 BUETXXMPUUDNPQ-LBPRGKRZSA-N 343.387 1.189 10 10 EDCE CO[C@H](C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)[C@H]1CCOC1 830899487 FJBOTLXDCRLMSO-BQFCYCMXSA-N 349.427 1.951 10 10 EDCE NC[C@H](NC(=O)c1csc(Cc2ccc(N)cc2)n1)C(F)(F)F 848437504 KMGCHCZTKUJHRA-NSHDSACASA-N 344.362 1.936 10 10 EDCE NC[C@@H](NC(=O)NCCCSc1nccs1)C(F)(F)F 848598350 YNZKBWBAMJWXSQ-SSDOTTSWSA-N 328.385 1.814 10 10 EDCE CCOC(=O)c1cc(NS(=O)(=O)CC(C)(C)OC)ccc1O 840914270 RVUBJOLQDZRVAK-UHFFFAOYSA-N 331.390 1.736 10 10 EDCE Cc1ncc(CNCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cn1 917397581 VKAGBTWPOPSOMS-KRWDZBQOSA-N 339.443 1.777 10 10 EDCE CCCCN(C)S(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849416151 KYSUEKRVLHXHTL-CQSZACIVSA-N 341.477 1.840 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC(=O)N(C)[C@@H](C)C1 840482487 XNMQZMXVYGGNLD-CABCVRRESA-N 346.475 1.864 10 10 EDCE C[C@H](NC[C@H](O)CS(C)(=O)=O)c1cc2c(cc1O)CCCC2 927023858 JDQFVUVJFPCFKH-FZMZJTMJSA-N 327.446 1.327 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC[C@@H]3CCOC3)C2)cc1 852250826 FDQRZOAAAWYTGP-CABCVRRESA-N 333.432 2.000 10 10 EDCE CN(C)CCC[C@@H]1CN(C(=O)NCCc2ccc(N)cc2)CCO1 851664778 KOAGJRHHJBBYLV-QGZVFWFLSA-N 334.464 1.564 10 10 EDCE COc1ccc(N2CCCN(C[C@H]3CCCS3(=O)=O)CC2)cc1 929317021 VCYJFEGIVGJOPR-QGZVFWFLSA-N 338.473 1.785 10 10 EDCE Cc1cncn1CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 859459915 IYZUGMZGOIVCMS-UHFFFAOYSA-N 342.443 1.717 10 10 EDCE Nc1n[nH]c(C2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)n1 854504580 CESFGQUATLEFAN-RQOWECAXSA-N 329.360 1.218 10 10 EDCE CCN(C)c1ccc([C@@H](C)NCC[C@H]2CNCCS2(=O)=O)cc1 925798746 RKRAVLQFXCTZMQ-PBHICJAKSA-N 339.505 1.570 10 10 EDCE C[C@@H](NC(=O)[C@H](O)c1cnc[nH]1)c1ccc(N2CCOCC2)cc1 865019180 NNYDFKWYLZEUFK-MLGOLLRUSA-N 330.388 1.157 10 10 EDCE COc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)nn1C 773853332 OWFQGMYGTVWLBK-NSHDSACASA-N 345.403 1.311 10 10 EDCE Cc1cc(S(N)(=O)=O)sc1C(=O)NCc1ccc(O)c(O)c1 778917158 ZZBZFZYVZVSJIQ-UHFFFAOYSA-N 342.398 1.045 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C[C@@H](C)O1 875508107 UAQAXLDDUBFWMO-IOASZLSFSA-N 349.431 1.786 10 10 EDCE C[C@@H](NCCCN1CCCS1(=O)=O)c1ccc(N(C)C)cc1 772959738 CVQYVZRRBHIKJJ-CQSZACIVSA-N 325.478 1.829 10 10 EDCE Cn1cc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)nn1 783296294 MJNUCIFRLSSZRM-OAHLLOKOSA-N 345.403 1.412 10 10 EDCE Oc1c(F)cc(F)cc1CN1CCN(CCc2cnccn2)CC1 895451329 ICXTYZZKSXSVRJ-UHFFFAOYSA-N 334.370 1.821 10 10 EDCE CC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCCOC1 897361494 JYQPCCVBMFSTBJ-WBVHZDCISA-N 347.459 1.690 10 10 EDCE COc1ccc(Br)c(CNC[C@]2(O)CCN(C)C2)c1O 1964054389 USIKBPKFLKPMKV-CQSZACIVSA-N 345.237 1.320 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2C[C@H](O)[C@H](O)C2)c1 1178290940 LDKPLGOPJSSYRV-XGWQRUHWSA-N 342.395 1.521 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC[C@@]12CCOC2 1327683134 IYWLXALGWMRKDO-IBGZPJMESA-N 341.411 1.070 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCCC[C@H]2CNCCCO)cc1 1328674051 LJPZFJLJLGQOTP-HNNXBMFYSA-N 347.419 1.816 10 10 EDCE CN(C)C[C@]1(O)CCN(c2ccc(CN)c(Br)c2F)C1 713658771 BGAIHIZDFHUCSZ-CQSZACIVSA-N 346.244 1.550 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)c1ccco1 1284267292 XZPLMIFKKSUQQL-SNVBAGLBSA-N 343.343 1.990 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CCn1cncn1 1709038040 AOBPXVXKSYJFTK-UHFFFAOYSA-N 327.392 1.474 10 10 EDCE NCc1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)c(Br)c1 2121591594 JFQIQAZMLYMMKF-WDMOLILDSA-N 327.222 1.351 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1CN([C@H]2CCOC2)C1 1628954814 SUHOLVHLAMYISH-IBGZPJMESA-N 343.471 1.966 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2cnc3c(c2)NC(=O)CN3C)c1 1629741008 WZPGWDXIJWZQFY-UHFFFAOYSA-N 326.356 1.414 10 10 EDCE O=C(Cn1cnc([N+](=O)[O-])n1)NCc1c(O)ccc2ccccc12 1558554335 PJNRTQFJZKSFNO-UHFFFAOYSA-N 327.300 1.362 10 10 EDCE CC(C)(C)c1cc(C(=O)NCc2ccc(O)cc2O)nc2ncnn12 1557084928 UMIFCUGMFCJERK-UHFFFAOYSA-N 341.371 1.763 10 10 EDCE COc1ccc(CNC[C@@H]2CCN(C(=O)CCN(C)C)C2)cc1C 1714364621 XQRRCSQRBPKKJU-KRWDZBQOSA-N 333.476 1.893 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)C(C)(C)C(N)=O)cc1C 1495684271 ODPKZEFIOCKUAC-LBPRGKRZSA-N 335.448 1.357 10 10 EDCE COCCCC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1720026507 JAOMICFXZFLOPS-UHFFFAOYSA-N 335.364 1.122 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cncnc2)cc1C 1725690234 HYVUHHUMYRDLMW-MRXNPFEDSA-N 344.415 1.016 10 10 EDCE COCCC(=O)NCCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1492243145 XCBJTFBEBRUQDC-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@]2(C)CCC(=O)N2)cc1C 1568190733 OORHIKFWBKRPJW-DJJJIMSYSA-N 347.459 1.514 10 10 EDCE CCOCCNC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1733265271 QQHVOOPKMNBKCA-UHFFFAOYSA-N 333.392 1.738 10 10 EDCE COC[C@@H](C)NC[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1732371543 BUWJQEXCKLRRIV-NWDGAFQWSA-N 335.408 1.839 10 10 EDCE N=c1nn[nH]n1-c1cccc(C(=O)Nc2cccc(N3CCCC3)c2)c1 1596707732 QOKGECPWZURILC-UHFFFAOYSA-N 349.398 1.927 10 10 EDCE O=C1C[C@H](CNC(=O)NCc2cccc(Br)c2O)CN1 1683162195 YFSCWZLWKUJUCL-QMMMGPOBSA-N 342.193 1.090 10 10 EDCE COc1ccc(CNCC[C@H]2CCCCN2C(=O)CC(N)=O)cc1C 1698910993 YWCQFEZEXRJOMK-MRXNPFEDSA-N 347.459 1.740 10 10 EDCE [N-]=[N+]=N[C@@H]1CCN(Cc2ncc(I)cn2)C1 1905229909 QFTVTPKKMWCQCZ-MRVPVSSYSA-N 330.133 1.966 10 10 EDCE CN[C@H](C)c1ccc(N2CCO[C@@H](CO)C2)c(Br)c1 221132935 LUVJWJMTTMMROW-ZYHUDNBSSA-N 329.238 1.927 10 10 EDCE CNCc1ccc(N2CC[C@H](O)[C@@](C)(O)C2)c(Br)c1 2136832824 MTVKIJQZCBOXRF-KBPBESRZSA-N 329.238 1.491 10 10 EDCE Oc1cc(Br)ccc1CN[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@H]2O 1974156998 JUXWPDOVOXXFIA-PFNZZMLQSA-N 328.206 1.375 10 10 EDCE CCOC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985101132 OENUOTZRKSLSFD-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE CN(CCc1ccc(N)cc1)C[C@@H](O)CN(C)C(=O)OC(C)(C)C 1999441928 RNUYQVOGPFQHAQ-MRXNPFEDSA-N 337.464 1.971 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2012344403 ZRFITEQDLFPUIY-NEPJUHHUSA-N 341.412 1.954 10 10 EDCE CCn1nnc(Br)c1CNCCc1ccc(O)c(O)c1 2156516911 QZJYCBAUKHYNTG-UHFFFAOYSA-N 341.209 1.804 10 10 EDCE O=C1Nc2cc(N(C3CC3)C3COC3)c(Br)cc2[C@@H]1O 2161291740 QTMWIUVSHUDHEK-ZDUSSCGKSA-N 339.189 1.802 10 10 EDCE COCCNCc1ccc(N2CC(F)(CO)C2)cc1Br 2172916003 OADNDGYNGXQIHC-UHFFFAOYSA-N 347.228 1.706 10 10 EDCE O=C1Nc2cc(N3CC[C@@H]4C[C@@]4(O)C3)c(Br)cc2[C@@H]1O 2171023605 DRIJETLHNCOXGP-FDHQVAJDSA-N 339.189 1.396 10 10 EDCE O=C1CO[C@H]2CCN(c3ccc(CO)cc3Br)C[C@H]2N1 2185523851 ZFCXWJQMDHBEHP-YPMHNXCESA-N 341.205 1.035 10 10 EDCE CN1CCCN(c2ccc(CO)c(Br)c2)CCC1=O 2096280681 ZCFWDFLDNQGBBS-UHFFFAOYSA-N 327.222 2.000 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C)C[C@H]2CCO)cc1Br 2202830159 JUUXCCZEIOEEGY-DGCLKSJQSA-N 342.281 1.972 10 10 EDCE O=C(c1ccc(O)c(O)c1)N1CCC[C@H](NC(=O)C(F)(F)F)CC1 2258224672 DWWVGRVKMNEGAG-JTQLQIEISA-N 346.305 1.771 10 10 EDCE COc1cc(C=C2SC(NC(C)=O)=NC2=O)cc(OC)c1OC 2294009860 QJBAXBDTLFYIBI-UHFFFAOYSA-N 336.369 1.819 10 10 EDCE CCSC[C@H](NC(=O)NCc1cnc(SC)s1)C(=O)O 2284506125 BXDAAZZPFCVJSB-QMMMGPOBSA-N 335.476 1.871 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@]2(C(=O)NCCCN=[N+]=[N-])CO[C@H]1C2 2298332380 VFVVPAOXLPZYGH-ZIBATOQPSA-N 339.396 1.875 10 10 EDCE Cc1cccc2c1NC(=O)/C2=C1/SC(=S)N([C@H](C)C(=O)O)C1=O 102603773 HZBANZUPRUKHMU-UQHWUIMISA-N 348.405 1.992 10 10 EDCE COc1ccc(O)c(CNC(=O)Cn2c(=O)oc3ccccc32)c1 114544270 GGOYIXYJROFRLC-UHFFFAOYSA-N 328.324 1.625 10 10 EDCE CCCNC(=O)N1CCN(c2ccc3c(c2)CCC(=O)N3C)CC1 62575748 SAHIQHGSNSZKGD-UHFFFAOYSA-N 330.432 1.837 10 10 EDCE CN(C)c1ccc(C=c2sc3nnc(-c4cccnc4)n3c2=O)cc1 252672216 POSSXXCOJXDJMD-UHFFFAOYSA-N 349.419 1.827 10 10 EDCE Cc1cc(C(=O)N2CC[C@@](O)(C(N)=O)C2)c(C)n1-c1ccc(F)cc1 276475986 KPOKVFDVBDJSBB-SFHVURJKSA-N 345.374 1.296 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC(c3n[nH]c(=O)o3)CC2)c1O 283925099 GNTNIMXHGMBLQM-UHFFFAOYSA-N 335.335 1.790 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN3C(=O)OC[C@@H]3C2)c([N+](=O)[O-])c1 374553853 HATYMAKIBGRAPI-PYEVWLCESA-N 347.327 1.422 10 10 EDCE Cc1ccc(CN(C)[C@@H](C)C(=O)NC(N)=O)c(O)c1Br 2380770145 YYOWGEQPDYJBFP-QMMMGPOBSA-N 344.209 1.478 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@H](CC(N)=O)C2)c([N+](=O)[O-])c1 808122481 UUBKYAWJXWSZGQ-KTLBGCOUSA-N 333.344 1.483 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1 808520661 WCMFEHOFQUJOSX-CQSZACIVSA-N 347.367 1.005 10 10 EDCE Cc1ccc([C@@H](C)NCCS(=O)(=O)N=S(C)(C)=O)c(O)c1C 903228315 YLGNRVNICKJFBJ-GFCCVEGCSA-N 348.490 1.717 10 10 EDCE CCCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)NC)cc1 822856897 TUZFZEYYVBXHSL-UHFFFAOYSA-N 335.451 1.495 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@H](O)C3CCOCC3)CC2)cc1 735878787 KXRKFGBFXASDNH-SFHVURJKSA-N 348.443 1.521 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NCC[C@H]2CNC(=O)C2)cc1 914254682 QLOTZJVCTPKWDC-OAHLLOKOSA-N 332.448 1.858 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CNC(=O)N3CCCC3)C2)cc1 912292372 LVBHUTZFHGLXGK-AWEZNQCLSA-N 346.431 1.196 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)COC3(C)CNC3)C2)cc1 843504796 HUPICLRAIJBXSY-CQSZACIVSA-N 333.432 1.016 10 10 EDCE COC[C@H](C)S(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849416672 UXBIRPZDYXHKGR-STQMWFEESA-N 328.434 1.228 10 10 EDCE CC[C@H](C)[C@@H](O)CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 854301847 UZHHSYJMGFBQRB-VBQJREDUSA-N 335.448 1.980 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@H](O)C(F)(F)C3)cc2N1 853804364 QXRLKIPXPUTTBZ-LLVKDONJSA-N 329.259 1.132 10 10 EDCE CCO[C@H](CN(C)C)CN1C(=O)CN(Cc2ccccc2O)C1=O 925236619 QLPLFUDNVQRNDO-CQSZACIVSA-N 335.404 1.123 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](OC)[C@H]3CCOC3)C2)cc1 855227265 WWHUQKVFOCAYTO-GRDNDAEWSA-N 334.416 1.442 10 10 EDCE C[C@@H]1C[C@H]1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 852052705 SHHVDMJXUNFNES-IUODEOHRSA-N 337.445 1.129 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CC(=O)N(C4CC4)C3)C2)cc1 855231742 LQUWAQAZDSVDRF-UONOGXRCSA-N 343.427 1.401 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3ncccn3)C2)cc1 852448122 CNSIDTOTPMYPRL-CYBMUJFWSA-N 327.388 1.563 10 10 EDCE CN(C)CC1(O)CCN(Cc2ccc(N3CCOCC3)cc2)CC1 931479017 IUXCQHINTOEACL-UHFFFAOYSA-N 333.476 1.412 10 10 EDCE CN1CCCc2cc(CNC(=O)c3ccc4c(c3)B(O)OC4)ccc21 863872292 PWZPHGMYNLQAHP-UHFFFAOYSA-N 336.200 1.217 10 10 EDCE C[C@@H]1O[C@H](C)[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H]1C 863001296 FXIHVIDLANEYJT-QOBXEIRBSA-N 342.417 1.305 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)[C@H]3CCC(=O)O3)cc2F)CC1 865201362 FAGQMSBMBAWBLB-MRXNPFEDSA-N 349.406 1.289 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@H]1CCOC[C@H]1C)c1ccc(N(C)C)cc1 1117508710 IXWKDIAOWTUDGB-WWGRRREGSA-N 333.432 1.471 10 10 EDCE CCOC(=O)[C@@H]1CN(C(=O)c2cccc(O)c2O)CCC1(F)F 870918699 LXGBQGVPGSGXKC-JTQLQIEISA-N 329.299 1.758 10 10 EDCE CC(C)(C)OC(=O)C1=NO[C@@H](C(=O)N2Cc3cccc(O)c3C2)C1 871204395 DGMUPXPSEMJVKC-CQSZACIVSA-N 332.356 1.721 10 10 EDCE COCc1nc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)co1 775871843 UVQRYFXKWDDOEA-UHFFFAOYSA-N 349.362 1.931 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNCC(=O)NC2CCCCC2)c1O 775030324 QVZDAXHABZSFRK-UHFFFAOYSA-N 337.376 1.848 10 10 EDCE O=[N+]([O-])c1cc(Cl)cc(CN2CCn3c(O)nnc3C2)c1O 776520063 HFPLLWZPUOIERN-UHFFFAOYSA-N 325.712 1.267 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NCc2nnc(O)n2C2CC2)c1 1313188825 GJXXEDMQQWJTRB-SECBINFHSA-N 347.375 1.593 10 10 EDCE Cc1cc(=O)[nH]c2c1c(C(=O)O)nn2Cc1ccc(N(C)C)cc1 82822601 SLPMRVSEEDRSDC-UHFFFAOYSA-N 326.356 1.846 10 10 EDCE C[C@@H]1Oc2c(cccc2C(=O)NCc2cc(O)ccc2O)NC1=O 1176747958 GLUKMKZDINKNDT-VIFPVBQESA-N 328.324 1.747 10 10 EDCE CN(Cc1cc(Br)cc(F)c1O)C[C@H]1CNCCO1 715771095 SAGHDAOSLMMRNE-LLVKDONJSA-N 333.201 1.714 10 10 EDCE COC[C@H]1CCCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332038345 TZAPTRAVYBDQMJ-ZDUSSCGKSA-N 332.400 1.510 10 10 EDCE COc1ccc(CN[C@@H]2CCN(C(=O)CNC(C)=O)[C@H]2C)cc1C 1507271419 OHNMEJVRVVOVDO-XJKSGUPXSA-N 333.432 1.219 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)Cc2cc[nH]n2)cc1C 1482087496 OSVANZHZWWXABH-CYBMUJFWSA-N 330.432 1.811 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)[C@@H](C)NC(C)=O)C2)cc1C 1713939046 HDYRYWQVYCUTLD-DAXOMENPSA-N 333.432 1.265 10 10 EDCE Cn1c(CC(=O)NCc2cc(O)ccc2O)nnc1-c1ccccc1 1637126331 TUELNTAPASBZHU-UHFFFAOYSA-N 338.367 1.752 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CC(=O)N(Cc2ccccc2)C1 1639289358 OQTHLARCEPTUJZ-AWEZNQCLSA-N 340.379 1.763 10 10 EDCE C[C@@H](CNCc1cncn1C)NC(=O)c1ccc(N=NC(N)=O)cc1 1498203962 QNDNDLRFMKILKK-NSHDSACASA-N 343.391 1.491 10 10 EDCE CC(C)(C)OC(=O)C1=NO[C@@H](C(=O)NCc2c(O)cccc2O)C1 1645363312 QDXWAKWYUFCVOZ-CYBMUJFWSA-N 336.344 1.201 10 10 EDCE Cn1nc([C@@H]2CCCOC2)cc1NC(=O)Cc1ccc(O)c(O)c1 1640115282 DQNGTUZTLFSQPN-GFCCVEGCSA-N 331.372 1.907 10 10 EDCE O=C(Nc1nc(C2=S=CC=C2)n[nH]1)c1ccnn1CC(F)(F)F 1650705759 SMHAGCUTORYGBJ-UHFFFAOYSA-N 342.306 1.442 10 10 EDCE COC[C@@H](C)NC[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1698863727 IACWCAUHVBXHPF-VXGBXAGGSA-N 335.408 1.934 10 10 EDCE C[C@@H](CNC(=O)NCCCSc1nccs1)N1CCOCC1 152148929 BGPZAJMAWZHUPJ-LBPRGKRZSA-N 344.506 1.645 10 10 EDCE C[C@@H](C(=O)O)N1CC(NCc2cc(Br)ccc2O)C1 2131768062 YDDJJKFWGADTRO-QMMMGPOBSA-N 329.194 1.402 10 10 EDCE Oc1c(F)cc(Br)cc1CN1C[C@@H](O)CC12CNC2 2130052295 ALNQBYQZBYFBRE-JTQLQIEISA-N 331.185 1.202 10 10 EDCE CC1(C)C[C@@H](O)[C@H](O)CN1c1ccc(CN)cc1Br 2132114635 FOFBRADIKFWSBI-CHWSQXEVSA-N 329.238 1.618 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCCN=[N+]=[N-])[C@H](CC(N)=O)C1 1902749369 WZNCDGJPFMHLOA-LLVKDONJSA-N 326.401 1.484 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](c2ccc(O)c(O)c2O)[C@@H](C(=O)O)C1 1906079347 UUNMIONWWPFCRZ-ZJUUUORDSA-N 339.344 1.839 10 10 EDCE CN[C@@H](C)c1ccc(N2CCO[C@@H](CO)C2)cc1Br 234453429 REOGYKRUPDGWKG-CMPLNLGQSA-N 329.238 1.927 10 10 EDCE N[C@H](COCc1ccccc1)C(=O)NCCc1ccc(O)c(O)c1 1946512186 YLXXLHNKTZBEEP-OAHLLOKOSA-N 330.384 1.301 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)NCCCN=[N+]=[N-])CO1 1985096627 ULMUXPZBOXKYSX-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](OCC(=O)N2CC(N=[N+]=[N-])C2)C1 1985102116 BXPMRAJYPZQQCB-LLVKDONJSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CCC(N=[N+]=[N-])CC2)CCOC1 2010405038 FHAIDUWYDPXGMZ-HNNXBMFYSA-N 339.396 1.972 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4CCO[C@@H]4C3)c(Br)cc2[C@@H]1O 2172075449 ZXMMFEHJEXIZJA-YLJLNXRRSA-N 339.189 1.660 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)c(F)c1Br 2173318822 ZACMVFHHEMOBKY-FRJWGUMJSA-N 345.212 1.367 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@](C)(O)c3cccs3)c2n1 2062382389 WKQOEVBHALCQSG-OAHLLOKOSA-N 332.385 1.442 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1NCc1ccc(O)c(O)c1 1907964244 RKIQTEVIWLQFCA-SWLSCSKDSA-N 338.404 1.822 10 10 EDCE Nc1ccc(NC(=O)CN2C[C@H]3C[C@H]2CN3C(=O)C(F)(F)F)cc1 2044677769 JZAOAAHRDGNASW-NWDGAFQWSA-N 342.321 1.055 10 10 EDCE CC(C)(C)OC(=O)NCc1nnc(NC(=O)Cc2ccc(N)cc2)o1 2083281544 DPXJMOZLBLJMCR-UHFFFAOYSA-N 347.375 1.858 10 10 EDCE COc1ccc(N2C[C@@H](N)C[C@@H](O)C2)c(OC)c1Br 2111801274 PPPNBTROLYLMLV-DTWKUNHWSA-N 331.210 1.365 10 10 EDCE CCNC(=O)CN(CC)c1ccc(C=CC(=O)OC)cc1[N+](=O)[O-] 2297775638 KRGJCXFWGDRZKQ-UHFFFAOYSA-N 335.360 1.743 10 10 EDCE CS(=O)(=O)[C@@H]1CC[C@H]1NCc1cccc(Br)c1O 2319779114 JOQSLHDZPDDUOQ-GHMZBOCLSA-N 334.235 1.820 10 10 EDCE Cc1ccc(CN2CCN(C)[C@@H](CO)C2)c(O)c1Br 2352679283 KQTKGMPSELFXOM-GFCCVEGCSA-N 329.238 1.571 10 10 EDCE COc1cc(O)c(CN2Cc3ccccc3C[C@@H]2C(N)=O)cc1OC 179602200 IDCNNDINCLGFKK-OAHLLOKOSA-N 342.395 1.822 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2CC(=O)Nc3ccccc32)c1 110187927 MGUHTSCYSBPYMW-VOTSOKGWSA-N 336.351 1.440 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@@H]4[C@H]3CO)c(Br)cc21 2357561651 ZKAYEIZGIXYXIH-RUBFCSMDSA-N 338.205 1.218 10 10 EDCE CS(=O)(=O)[C@H]1CSCCN1C(=O)CCc1ccc(N)cc1 90921559 ZFDMIQOFWHIAOV-AWEZNQCLSA-N 328.459 1.148 10 10 EDCE C[C@@]1(C(=O)NCc2ccc(N3CCOCC3)cc2)CCC(=O)NC1 281122431 DGUHIEULUQRTJB-GOSISDBHSA-N 331.416 1.056 10 10 EDCE O=C(NCc1ccccc1O)N[C@H]1CCCN(c2ncccn2)C1 299506205 MTGRGNBWLLQHQO-AWEZNQCLSA-N 327.388 1.650 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3CC(C4CC4)C3)CC2)cc1 812312752 FTUMBKXAFMPYIU-IBGZPJMESA-N 345.487 1.520 10 10 EDCE CC[C@@H](O)CC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 823161151 AMICNDRJIGGQQZ-OAHLLOKOSA-N 337.439 1.745 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N3CN(C)C(=O)[C@H]3C)C2)cc1 826993637 SSWOMJGDQSMKIA-KGLIPLIRSA-N 346.431 1.351 10 10 EDCE C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CCN1S(C)(=O)=O 827272140 XUKDVTYAJUYRGH-GFCCVEGCSA-N 329.441 1.357 10 10 EDCE CO[C@@H](CS(=O)(=O)NCCCSc1nccs1)C1CC1 827149509 LCTRDUNDLUFPAL-NSHDSACASA-N 336.504 1.970 10 10 EDCE C[C@H]1C(=O)NCCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 588564897 LSGOPWIMPIWSIN-KKTNHOPESA-N 343.427 1.273 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCN(CC[S@@](C)=O)CC2)cc1 835026372 RZBUADDWFBGLHE-CHFIUFFRSA-N 335.517 1.762 10 10 EDCE COC(=O)[C@@H]1CSCCN(Cc2cc(OC)c(OC)cc2O)C1 840186245 MJPMKCKTODSPSB-LBPRGKRZSA-N 341.429 1.747 10 10 EDCE COc1cccc([C@H](C)NC[C@H]2CCCCN2S(C)(=O)=O)c1O 846173657 UNSHBSQDLOURHY-QWHCGFSZSA-N 342.461 1.866 10 10 EDCE C[C@H](O)[C@@H]1CN(C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 840274328 DRAXFHZQOVIIFU-GUYCJALGSA-N 333.432 1.360 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCCCNC3=O)C2)cc1 849225658 YMUDIVJMMNHIIQ-CZUORRHYSA-N 346.431 1.242 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@@H]4C[C@H]3C[S@]4=O)ccc21 844935758 VNOKYESJWOWIND-XAPDGSRCSA-N 333.457 1.484 10 10 EDCE CN(C)CCN1CCN(Cc2c(O)ccc3ccncc23)CC1=O 844713742 FSKXUAOHFJERDF-UHFFFAOYSA-N 328.416 1.146 10 10 EDCE COC(=O)[C@@H](NCc1cc(Cl)c(F)cc1O)c1ccnn1C 843429588 HEBJRJDVGWCGGO-ZDUSSCGKSA-N 327.743 1.922 10 10 EDCE C[C@H](NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H]1[C@H]2CN[C@H]1C2 925689903 DFJIEANSCMLLMA-YCCRMZCTSA-N 337.414 1.887 10 10 EDCE O=C(CCNC(=O)OCC(F)(F)F)NCc1c(O)cccc1F 928711559 ITSWSDXRUDVOTN-UHFFFAOYSA-N 338.257 1.826 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCOC[C@H]2CC2CC2)cc1 929236977 GVIXQHGIYBGYBC-QGZVFWFLSA-N 345.443 1.396 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C3(C(=O)NC4CC4)CC3)C2)cc1 855231044 SNUAYPNGZHRUDJ-CQSZACIVSA-N 343.427 1.449 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc([N+](=O)[O-])cn3C)C2)cc1 853818384 WIIQXTQWMBKWEN-LBPRGKRZSA-N 344.371 1.951 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3cnn(C)c3C)C2)cc1 852229221 OUIPEUHBOFHQMZ-OAHLLOKOSA-N 343.431 1.815 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cn3c(n2)C[C@@H](OC)CC3)c1 866766978 GMQOWURTLRQCKT-ZDUSSCGKSA-N 331.372 1.489 10 10 EDCE Nc1ccc(CCNC(=O)N2CC[C@H]3CC[C@@H](C2)S3(=O)=O)cc1 861639413 CAXVRZOVNWXKPT-CABCVRRESA-N 337.445 1.172 10 10 EDCE CC(=O)c1cc(F)cc(Cn2cc(C3CC4(C3)OCCO4)nn2)c1O 880995584 BZWZDXCPJOCWEX-UHFFFAOYSA-N 347.346 1.994 10 10 EDCE Cn1nnc2ccc(C(=O)OCC(=O)c3ccc(O)c(O)c3)cc21 784696294 ARCPTYJKFREYOJ-UHFFFAOYSA-N 327.296 1.419 10 10 EDCE C[C@@H]1CS(=O)(=O)CCN1C(=O)c1cc2cc(O)c(O)cc2s1 896508437 CSOVGCRMPLWPSG-MRVPVSSYSA-N 341.410 1.572 10 10 EDCE CN(C)c1ncn(-c2cccc(NC(=O)c3cccc(O)c3O)c2)n1 799724769 RSBVBPHIPBAQHO-UHFFFAOYSA-N 339.355 1.997 10 10 EDCE CO[C@](C)(C(=O)NCc1ccc(O)cc1O)C(=O)OC(C)(C)C 1142534038 XDPMGJZZEMIFEB-MRXNPFEDSA-N 325.361 1.461 10 10 EDCE Cc1ccc(C(=O)NCc2cc(O)ccc2O)cc1S(C)(=O)=O 1153879666 TXKUVQCHQNDWEO-UHFFFAOYSA-N 335.381 1.740 10 10 EDCE C[C@H]1CN(C(=O)c2cccc(O)c2O)CC[C@@H]1NC(=O)C(F)(F)F 1963846578 YUPFARRWPCDKQN-WPRPVWTQSA-N 346.305 1.627 10 10 EDCE COC(=O)c1cc(C(=O)NCc2ccc3cccnc3c2O)no1 1162612685 OHZPVLZSMVIGJX-UHFFFAOYSA-N 327.296 1.645 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)[C@H](CO)C2)c(Br)c1 704775639 NFZWMRTXAGWJQT-USWWRNFRSA-N 329.238 1.506 10 10 EDCE C[C@@H](OCc1ccccc1)[C@H](NC(=O)Cc1ccc(N)cc1)C(=O)O 706112754 UQQHCUKFEBIMAK-ACJLOTCBSA-N 342.395 1.986 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2cc(C)no2)cc1C 1507171410 CWVAGRKHOVHJQC-CQSZACIVSA-N 333.388 1.181 10 10 EDCE COc1cc(C(=O)N[C@H](C)C[C@H](C)NC(=O)C(F)F)cc(OC)n1 1288499891 AOYNPZCPWOAWQU-BDAKNGLRSA-N 345.346 1.377 10 10 EDCE COc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1OCC(N)=O 1441493717 LHTRAMBUVYIYHZ-UHFFFAOYSA-N 346.339 1.152 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc(CS(N)(=O)=O)cc2)c1 1470254064 FHPMSKRPVJGCNW-UHFFFAOYSA-N 334.397 1.419 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cnn3cc[nH]c23)cc1C 1483188632 PVLBYLZGNXIUCI-CYBMUJFWSA-N 341.415 1.888 10 10 EDCE CCNC(=O)CCC(=O)N[C@H]1C[C@H](NCc2ccc(OC)c(C)c2)C1 1713943873 IUYOETLTYAXWSB-WKILWMFISA-N 347.459 1.657 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 1624955461 ZZCCTRLJAIULHP-HWPZZCPQSA-N 346.339 1.787 10 10 EDCE NS(=O)(=O)Cc1cccc(C(=O)N2Cc3cccc(O)c3C2)c1 1636230429 CGHFGBGGLOYWKB-UHFFFAOYSA-N 332.381 1.337 10 10 EDCE C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@]2(CCOC2)O1 1634917491 LKGGIUMIRMGDRL-BDJLRTHQSA-N 332.360 1.869 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@H]2CCN(C)C2=O)cc1C 1663999608 DOGFRAHOTKPTIB-MRXNPFEDSA-N 347.459 1.420 10 10 EDCE CNS(=O)(=O)c1cccc(C(=O)NCc2ccc(N(C)C)cc2)c1 15134575 QXZIJTFPWRXYIS-UHFFFAOYSA-N 347.440 1.591 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4COC[C@H]43)c(Br)cc2[C@H]1O 2129728732 YAFQWYLZJLKUJW-JPWUCKPDSA-N 325.162 1.270 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2140661771 IQBHUJYZLWGZPE-HPXOCHMKSA-N 333.201 1.349 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCO[C@H]1C(=O)NCCCN=[N+]=[N-] 1985094036 JCBRVFQEKOMVOH-GHMZBOCLSA-N 327.385 1.733 10 10 EDCE COc1ccc(CNC[C@H](CO)NC(=O)OC(C)(C)C)c(O)c1 1985853626 CZQWPYKBIKBKOK-GFCCVEGCSA-N 326.393 1.376 10 10 EDCE COc1ccc(O)c([C@@H](C)N[C@@H](CO)CNC(=O)OC(C)(C)C)c1 2011424360 HRZMTXWGQUBANC-VXGBXAGGSA-N 340.420 1.937 10 10 EDCE CO[C@@H]1CN(c2cc(Br)c(CN)cc2F)[C@H]2COC[C@H]12 2158361211 HGGKNXOFUMJRGF-QCZZGDTMSA-N 345.212 1.897 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)CC[C@H]3O)c(Br)c1 2161397694 UHESGHRNLKLOHB-BYNSBNAKSA-N 342.233 1.794 10 10 EDCE CC[C@@H](N[C@H]1CN(C)NC1=O)c1cc(Br)ccc1O 393895389 HXVIXNDLGNQCEV-MNOVXSKESA-N 328.210 1.541 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3CCN(c4ccccn4)C3)c2n1 2062144471 NJAQXZVNMTVWRT-LBPRGKRZSA-N 338.371 1.147 10 10 EDCE CN(C)C(=O)c1cn(Cc2cc(Br)ccc2O)nc1O 2070594955 RQUUWYJQYQSAMA-UHFFFAOYSA-N 340.177 1.807 10 10 EDCE COc1ccc(Cn2cc(I)c(O)n2)c(O)c1 2070639082 ZEYDVQWMAFNXNO-UHFFFAOYSA-N 346.124 1.956 10 10 EDCE 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Cn1ncc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n1 807569548 PTHCCTFMYKMLKO-HNNXBMFYSA-N 345.403 1.412 10 10 EDCE CNC(=O)[C@@H]1CCN(Cc2ccc(N3CCC(OC)CC3)cc2)C1 817283246 QXIGLARCINWRNZ-MRXNPFEDSA-N 331.460 1.870 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NCC3(C)COC3)C2)cc1 823048486 ZERKWNJVMOZZQQ-CQSZACIVSA-N 333.432 1.857 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@@H]4C[C@@H]4C3)CC2)cc1 824285749 VECULTVIJKBXCI-FVQHAEBGSA-N 343.471 1.980 10 10 EDCE C[C@H](N)c1ccc(N2CCN(C(N)=O)CC2)c(Br)c1 722192392 FHZSYUXJJGDWBX-VIFPVBQESA-N 327.226 1.670 10 10 EDCE CN(C)c1ccc(/C=C\CNC[C@@H]2CCN(S(C)(=O)=O)C2)cc1 835043067 ZZNKRGILMJEYLZ-AWFCHZOYSA-N 337.489 1.637 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]3COCC[C@@H]32)cc1 839502756 KVGTVTXRGBKORQ-AEFFLSMTSA-N 331.460 1.870 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](O)C3CCC3)cc2)CC1 830745991 VGMABYBYKYMFKH-SFHVURJKSA-N 345.443 1.132 10 10 EDCE COC[C@](C)(O)CCNC(=O)N[C@H](C)c1cc(OC)ccc1O 836535158 ZEPXUDJMBBBXMM-BDJLRTHQSA-N 326.393 1.549 10 10 EDCE 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O=C(Cn1cn[nH]c1=O)N(Cc1ccco1)Cc1ccccc1O 156064292 IAVXJASPDODNQU-UHFFFAOYSA-N 328.328 1.099 10 10 EDCE CN(C[C@@H](N)COCc1ccccc1)C(=O)c1ccc(O)c(O)c1 1916340434 RMZTVTLNRGEENT-OAHLLOKOSA-N 330.384 1.714 10 10 EDCE O=C(O)[C@]1(CO)CCN(Cc2cc(Br)ccc2O)C1 2136389118 IIXOCSROQQWBQV-CYBMUJFWSA-N 330.178 1.424 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCN=[N+]=[N-])[C@@H]2CS(=O)(=O)C[C@H]21 1982246000 OWSOOYZFEUHNMA-GHMZBOCLSA-N 345.425 1.015 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCCN=[N+]=[N-])C[C@H](CO)C1 1990178256 CEHQRRBMBQOSAK-WJONMLJTSA-N 327.385 1.469 10 10 EDCE O=C1Nc2cc(N3C[C@H]4[C@@H](O)C[C@H]4C3)c(Br)cc2[C@@H]1O 2151389554 BAPMBWKVGOYXOA-NXXZVQKESA-N 339.189 1.252 10 10 EDCE CC(C)(C)OC(=O)NC1CC2(C1)C[C@@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003169441 KPACDUWXLGZNOX-XRJJVYPSSA-N 336.432 1.945 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010406432 UTRUTKKPSHIVST-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2010406221 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ORXFBNBTHDXGNM-LLVKDONJSA-N 332.360 1.600 10 10 EDCE C[C@H](NC[C@H](C)N1CCOCC1)c1ccc(N2CCOCC2)cc1 123213309 FKJGYCQFAMDKLV-IRXDYDNUSA-N 333.476 1.895 10 10 EDCE COCCNC(=O)Cn1cc(N[C@@H](C)c2cc(F)ccc2O)cn1 186498469 FNDNAXKVNPNFOP-NSHDSACASA-N 336.367 1.664 10 10 EDCE COc1ccc(N2CCN(C(=O)NCc3ccnn3C)CC2)cc1F 84852720 VCSQOTBZWJJNOQ-UHFFFAOYSA-N 347.394 1.600 10 10 EDCE Cc1ccc(O)c([C@H](C)NC[C@@]2(CO)COCC3(CCC3)N2C)c1 527956667 QXYYDWIXTQSXAX-HNAYVOBHSA-N 334.460 1.967 10 10 EDCE COc1ccc(N2CCCN(C(=O)Cc3cncnc3)CC2)cc1 377803154 SBJCNPUBLJMNLC-UHFFFAOYSA-N 326.400 1.767 10 10 EDCE CC[C@](C)(OC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 280160680 BXERRGLAYGIEBN-IBGZPJMESA-N 349.475 1.749 10 10 EDCE O=C(N[C@@H]1CCN(C(=O)COc2ccccc2)C1)c1cc(O)cs1 802659784 LZSZYLUYJROKAC-GFCCVEGCSA-N 346.408 1.863 10 10 EDCE Cc1ccc(CN2C[C@@H](CCO)[C@@H](CO)C2)c(O)c1Br 2381134490 CVUXTIIBRYTEOK-DGCLKSJQSA-N 344.249 1.886 10 10 EDCE CO[C@H]1COCC[C@H]1CC(=O)N1CCOc2cc(N(C)C)ccc21 294857727 GCUFGKVWOJGFIJ-GUYCJALGSA-N 334.416 1.920 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cc(C)cc(C)c1 808533593 RZQVTLDKFGVBIP-INIZCTEOSA-N 345.395 1.999 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](C)[C@](C)(CN)C1 817948724 CUTCPPRNTLJYJX-AUUYWEPGSA-N 347.459 1.574 10 10 EDCE NC(=O)N1CCN(Cc2cc(Br)cc(F)c2O)CC1 722190261 UGLZKDHGNSOYBG-UHFFFAOYSA-N 332.173 1.490 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnn(C4CC4)c3N)CC2)cc1 905103786 DOGDNABANKCRTB-UHFFFAOYSA-N 341.415 1.771 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCC[C@H](CS(N)(=O)=O)C2)cc1 835029778 SFHWNXRZRJZJNZ-WMHVBEDNSA-N 337.489 1.766 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)c2cnn(C)c2OC)cc1 844857539 ZRQDCIQLNVOEAA-UHFFFAOYSA-N 332.404 1.646 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1C(=O)NCCCSc1nccs1 845048119 YZFMSWJITOCEQV-WDEREUQCSA-N 331.463 1.417 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCCC[C@@H](N3CCCC3)C2)cc1 841032645 INWQRURRVWZTAR-MRXNPFEDSA-N 330.432 1.684 10 10 EDCE COc1ccc(N2CCN(CN3CC(F)(F)CC3=O)CC2)cc1F 841681469 UBAHVQUBEHFQCO-UHFFFAOYSA-N 343.349 1.781 10 10 EDCE NC[C@H](NC(=O)NCc1cc(Br)ccc1O)C1CC1 841946296 IWBRTJGXEZMPCY-NSHDSACASA-N 328.210 1.691 10 10 EDCE CC(=O)N(C)C1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 757509740 ZLKBNCXNXMWLNI-UHFFFAOYSA-N 348.359 1.373 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1[C@H]2CC[C@]3(COC(=O)[C@H]13)O2 858199945 VIGYVQYGIRONQB-OAFZBRQQSA-N 344.411 1.432 10 10 EDCE COC[C@]1(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCOC1 856209559 SIZPRXJRCMKTMN-LJQANCHMSA-N 348.443 1.317 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3(CC(N)=O)CC3)C2)cc1 852385474 OSUVNIKTNQFGCA-ZDUSSCGKSA-N 346.431 1.229 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](C)CCCO)C2)cc1 854297021 IITZUKVZGVMGLJ-HUUCEWRRSA-N 335.448 1.982 10 10 EDCE C[C@@H](NC(=O)N1CCO[C@@H](CC(N)=O)C1)c1ccc(N(C)C)cc1 858368579 MISZLHQZQVTDBR-DOMZBBRYSA-N 334.420 1.099 10 10 EDCE COc1cc(C)cc(CN2CCC[C@H](CNS(C)(=O)=O)C2)c1O 754728199 XGWJUYVWABQRDH-CYBMUJFWSA-N 342.461 1.470 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C=C1CCNCC1 852857547 WYIDLRMOKGFJPM-UHFFFAOYSA-N 329.444 1.791 10 10 EDCE C[C@@H](NC[C@]12COCCN1C(=O)COC2)c1ccc(Cl)cc1O 866554870 OHBNQVSJRJTFFF-BDJLRTHQSA-N 340.807 1.324 10 10 EDCE O=C1NC(=O)[C@H](CC(=O)N(Cc2ccco2)Cc2ccccc2O)N1 764289309 VHZQQHFLFNXRNL-ZDUSSCGKSA-N 343.339 1.112 10 10 EDCE O=C(C[C@@H]1CCCS(=O)(=O)C1)NCc1ccc2cccnc2c1O 862025843 BJKKJYCWPIDNIT-LBPRGKRZSA-N 348.424 1.772 10 10 EDCE O=C1OC[C@]2(CNCc3ccc(N4CCCCC4)cc3)COCCN12 865769103 UBSNSRKKOYZGCX-IBGZPJMESA-N 345.443 1.988 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@H](n4ccnc4)C3)cc2N1 761891300 HQNGAGLKZPCTDB-NSHDSACASA-N 343.343 1.964 10 10 EDCE C[C@@H](NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2)c1ccc(N2CCOCC2)cc1 870874600 PTFCHMYZHIXXBT-RGPZOAQRSA-N 329.444 1.828 10 10 EDCE Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1c(Cl)ccc2nonc12 1128704597 QLLWVKACEXLEKE-UHFFFAOYSA-N 336.695 1.928 10 10 EDCE CC(=O)Nc1cccnc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1138153017 VVGAWIKSZHYETE-SNVBAGLBSA-N 329.356 1.812 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC[C@@H](C(=O)OC)O1 1136429056 XGIQBFRQHATMFG-CVEARBPZSA-N 334.416 1.822 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)Cn2c([N+](=O)[O-])cnc2C)c1 1150542450 AFIJOKJQAYHXQW-VIFPVBQESA-N 334.332 1.691 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N(C)C1Cc2ccccc2C1 1344713529 AKDMJTIJNQJIOO-UHFFFAOYSA-N 338.407 1.976 10 10 EDCE NCc1ccc(N2CCC(CNC(N)=O)CC2)c(Br)c1 702152565 YBBQNYPXCQPNME-UHFFFAOYSA-N 341.253 1.793 10 10 EDCE C[C@H]1OCCN(Cc2c(O)cccc2Br)[C@H]1C(=O)O 706647157 DDYAEZWPFVCMAR-PRHODGIISA-N 330.178 1.829 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H]2CC[C@H](C1)O2 1329345940 QVZUHNOQOQAZEO-IYBDPMFKSA-N 346.427 1.911 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@H]3CC[C@@H](O)[C@H]3C2)c([N+](=O)[O-])c1 1187606559 BXHVFGCSBJJDEY-IRAOFSTMSA-N 332.356 1.988 10 10 EDCE CC(C)N(CCCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 92775603 KPJPCJNIIGWYMV-CYBMUJFWSA-N 342.237 1.998 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)C[C@H]2COC(=O)C2)cc1C 1268361278 RSQINRKULJEUGI-GDBMZVCRSA-N 348.443 1.941 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1ccc[n+]([O-])c1 1345433346 NPZLEZJMDSCBOM-UHFFFAOYSA-N 346.362 1.617 10 10 EDCE O=C(C(=O)N1CCO[C@H](c2ccco2)C1)N1Cc2cccc(O)c2C1 1348639523 NCJCTSHQHCWECS-INIZCTEOSA-N 342.351 1.428 10 10 EDCE CCN(CCCNC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)COC 1294472496 MVZLKCMQSZBKJQ-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE CCN(C(=O)Cc1ccc(O)c(O)c1)[C@H](C)CS(=O)(=O)CC 1543663132 NUBSFOOWOVQRFQ-LLVKDONJSA-N 329.418 1.312 10 10 EDCE CC[C@H](CNC(=O)c1cnn(C)n1)NCc1ccc(OC)c(C)c1 1714111619 BXCLGAXOXDKADJ-CQSZACIVSA-N 331.420 1.430 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCCC[C@H]2CCNCCO)cc1 1715458194 PKHBUCHHHHIIDD-HNNXBMFYSA-N 347.419 1.816 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2ccncn2)cc1C 1716356632 WJXVLTCJZTVRST-ARJAWSKDSA-N 326.400 1.869 10 10 EDCE CCC[C@@H](O)CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1636444613 YKJVBYPPIHPVKJ-LLVKDONJSA-N 330.406 1.045 10 10 EDCE COc1ccc(-n2nnnc2CN(C)C[C@H](C)NC(=O)C(C)C)cc1 1498230283 ZWPYSUUJPWQTEL-ZDUSSCGKSA-N 346.435 1.263 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CC[C@H](C(F)(F)F)NC1=O 1635842987 DOUTVBJUTXBKLB-WRWORJQWSA-N 332.278 1.171 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cnnc(O)c2)cc1C 1733001483 WLPHKBWRSHVZPR-LBPRGKRZSA-N 330.388 1.407 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)c(Br)c1 2126161992 OOXGCAWVGHJIEV-DJBIQUGXSA-N 327.222 1.086 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2c[nH]c(=O)cn2)cc1C 1698760641 MHNYXGJEZHGZEW-LBPRGKRZSA-N 344.415 1.243 10 10 EDCE CN1CC[C@@H](N(C)c2ccc(CO)cc2Br)CC1=O 2131950996 WQRSYPBEDTYWAY-LLVKDONJSA-N 327.222 1.998 10 10 EDCE NCc1cc(F)c(N2CCNC(=O)C23CC3)cc1Br 2132029217 RDSQCRFSGGQYLT-UHFFFAOYSA-N 328.185 1.516 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)N1CCC[C@H]1CN=[N+]=[N-] 1912151331 GCQQJLCLHRWCMI-ZETCQYMHSA-N 349.214 1.646 10 10 EDCE CN(C[C@H](O)COCc1ccccc1)c1ccc2c(c1)NC(=O)[C@@H]2N 1916368729 HRZXWKJEOKQSBP-MAUKXSAKSA-N 341.411 1.652 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)C[C@H]2CN(C)C)c(Br)c1 251788101 VGEPKWLCWXHWJI-DRZSPHRISA-N 342.281 1.970 10 10 EDCE COc1ccc(Br)c(CNCc2cnnn2C)c1O 1967694130 VVPCWYDTFXAZIW-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE C[C@H](CC(N)=O)N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2151340611 OSMDYRVRLOJLOB-SREIQFSDSA-N 341.209 1.101 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 2011939937 SJJNFLPWPDHXRG-XHDPSFHLSA-N 339.396 1.660 10 10 EDCE O=C1CN[C@H](c2cc(Br)cc(Br)c2O)N1 308942804 QXKGVNDJISHGMO-VIFPVBQESA-N 335.983 1.635 10 10 EDCE CCNCc1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2160717289 RKJIWZVBRAZGGQ-AQNFWKISSA-N 341.249 1.489 10 10 EDCE CCN(c1ccc([C@H](C)N)cc1Br)[C@@H]1CC(=O)NC1=O 2171191667 BFYHIAGNYIVGTG-QPUJVOFHSA-N 340.221 1.710 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@@H](C2)C3O)c(F)c1Br 2167786262 FOTQCNKQVTZPIP-XFLKPENQSA-N 345.212 1.490 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2182542436 IZEVRFWYDMAWGG-AGCIHXOGSA-N 341.249 1.346 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)c(Br)c1 2190462183 VSHVOIBIAJWZBJ-VJMWFJFBSA-N 341.249 1.932 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CNC(=O)CCc2ccc(N)cc2)C1 2044229240 SUMWHVKYYMKJCV-UHFFFAOYSA-N 349.431 1.299 10 10 EDCE NCc1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(F)c1Br 2199531733 LOLNESDBYYDTBP-RZUQZRBISA-N 345.212 1.367 10 10 EDCE OCc1ccc(N2CC3(C2)OCCC[C@H]3O)cc1Br 2103415160 XLDWNQDZKJGJRY-CYBMUJFWSA-N 328.206 1.672 10 10 EDCE CC(C)(C)OC(=O)NC1CN(CC(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213584329 CBGJHAHVUHIDGM-NEPJUHHUSA-N 338.412 1.543 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1Cc2ccc(Nc3nnc(=N)[nH]n3)cc2C1 2219019569 FXHFCJUDUDMBSO-GFCCVEGCSA-N 343.391 1.415 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cc(C(=O)O)no2)s1 2284502202 YZZOETRFMJYKAX-UHFFFAOYSA-N 335.388 1.030 10 10 EDCE CCN(C)C(=O)[C@@H](C)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2311489413 BZQGZZKOWNIGOS-OAHLLOKOSA-N 345.443 1.519 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N[C@@H]1CCc2ncnn2C1 171868145 RITPKQXMEZQYNO-OAHLLOKOSA-N 340.431 1.693 10 10 EDCE COc1ccc(N2CCN(C(=O)Nc3nccn(C)c3=O)CC2)cc1 183847352 CGROUVKUXAGDBL-UHFFFAOYSA-N 343.387 1.143 10 10 EDCE C[C@H](NC[C@H]1CN(C)CCO1)c1ccc(N2CCOCC2)c(F)c1 180500168 OIBRNDOXIJZJKV-HOCLYGCPSA-N 337.439 1.644 10 10 EDCE O=S(=O)(c1ccccc1)N1CC[C@H](NCc2ccccc2O)C1 367961213 FQMQTDJWGKBGOB-HNNXBMFYSA-N 332.425 1.945 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(CNC(=O)OC(C)(C)C)o1 808523080 CPFJGNXYCPPGHT-UHFFFAOYSA-N 325.317 1.619 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@@H](N)CCO2)c(O)c1Br 2380755236 ZLTPWZOFAQLOIY-QWRGUYRKSA-N 343.221 1.586 10 10 EDCE CC(C)(C)OCCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807289627 BPRJLOAIGDWAFU-UHFFFAOYSA-N 345.443 1.610 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3nnc(OC)s3)C2)cc1 822857438 XQEGCKXHKDSAGR-SNVBAGLBSA-N 349.416 1.956 10 10 EDCE CC[C@@H](NC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1)C(=O)O 909132636 VYQWNKHDELSOIN-SWLSCSKDSA-N 335.404 1.684 10 10 EDCE C[C@@H](NC[C@@]1(CO)COCCN1C)c1ccc2ccccc2c1O 903278374 FNVBMNQPBMRUCM-AUUYWEPGSA-N 330.428 1.889 10 10 EDCE C[C@@H](NC(=O)/C=C\Cn1cncn1)c1ccc(N2CCOCC2)cc1 900386985 NDUZYHZQTRMBTN-MPNWYJEXSA-N 341.415 1.548 10 10 EDCE COCCN1CCC[C@@H]1CNC(=O)NCc1c(O)cccc1F 917830256 YWSQVAWINUCJRF-GFCCVEGCSA-N 325.384 1.441 10 10 EDCE O=C(CN1C(=O)NC2(CCCCC2)C1=O)NCc1c(O)cccc1F 928710926 XRPKBYAITANIPB-UHFFFAOYSA-N 349.362 1.402 10 10 EDCE Cc1cc(C(=O)N2CC(O)(CO)C2)c(C)n1-c1ccc(Cl)cc1 854672034 ABYJVMARFSIVOX-UHFFFAOYSA-N 334.803 1.927 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@]3(C)CCCNC3)C2)cc1 851662907 NMNGIKZKYJKLAK-DNVCBOLYSA-N 346.475 1.963 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@](C)(O)C3CC3)C2)cc1 854301864 VJAHPCXEAMDIBG-RDTXWAMCSA-N 333.432 1.734 10 10 EDCE NC(=O)N[C@@H]1CCN(C(=O)NCCCSc2nccs2)C1 763029770 TZXUYCGYKNRSLR-SECBINFHSA-N 329.451 1.078 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)c3conc3C)CC2)cc1 866388142 CBZRFZPXCXQFEH-UHFFFAOYSA-N 337.401 1.503 10 10 EDCE O=C(C(=O)N1CCC[C@@H](OCC2CC2)C1)N1Cc2cccc(O)c2C1 1118945546 CAXUNKZIEGKGQO-OAHLLOKOSA-N 344.411 1.652 10 10 EDCE Cc1cc(CN(C)C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)no1 774217670 OTXNXZUZAIKTQW-CYBMUJFWSA-N 344.415 1.885 10 10 EDCE COc1cccc(CNC(=O)c2sccc2S(N)(=O)=O)c1O 1137473792 WHBFXURBHHJUBX-UHFFFAOYSA-N 342.398 1.040 10 10 EDCE C[C@@H](NC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2[nH]1)c1ccccc1O 1171722975 IMAHOMKRQWIFEH-GTTSAUCSSA-N 341.367 1.540 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2C[C@H]3CC[C@H]2C3)cc1F 1321934435 AACZMVRMQNVLQR-WHOFXGATSA-N 333.407 1.813 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1c2ccccc2OC[C@H]1CO 1180324476 KXLFWXJYTWSPQW-DPNCUPJTSA-N 341.363 1.969 10 10 EDCE CCN(CCO)[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1264080827 XEYKRKGBSAMEMO-HNNXBMFYSA-N 347.419 1.768 10 10 EDCE CN(C)CCN1CCN(Cc2ccc(N3CCCC3)cc2)CC1=O 1261509102 ILJLHDQFBJPURL-UHFFFAOYSA-N 330.476 1.493 10 10 EDCE C[C@H](CNC[C@H]1CCCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1715963767 DCDZSXYXZGXZGX-CHWSQXEVSA-N 347.419 1.984 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccccc1O[C@H]1CC(=O)N1 1626938642 TWVKKANMFBYDLE-KRWDZBQOSA-N 328.324 1.504 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1C[C@H](CO)[C@@H](CCO)C1 1558826424 PKTRJCMQYMRBBP-GXSJLCMTSA-N 337.397 1.375 10 10 EDCE CC(C)(CN1CCOCC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1629936812 JMBCPLNIXQHEBZ-UHFFFAOYSA-N 333.392 1.690 10 10 EDCE COCC(=O)NCCC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1623550306 XSTOSLKQPUELSI-UHFFFAOYSA-N 333.432 1.398 10 10 EDCE Cn1cnnc1-c1cncc(NC(=O)Cc2ccc(O)c(O)c2)c1 1633237014 YQHSWVNFGPVWHQ-UHFFFAOYSA-N 325.328 1.470 10 10 EDCE O=C(Nc1c(-c2ccccn2)nc2ccccn12)c1cnn(CCO)c1 1570016716 CJCZTHLHWPDMHL-UHFFFAOYSA-N 348.366 1.837 10 10 EDCE Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1ccnc3c1CC(=O)N3)CC2 1597625939 FFBYFSDCDAAGSC-UHFFFAOYSA-N 338.323 1.996 10 10 EDCE CCn1ccc(C(=O)NC[C@@H](CO)NCc2ccc(OC)c(C)c2)n1 1676588338 QSXMXPYFHVQOSY-HNNXBMFYSA-N 346.431 1.101 10 10 EDCE Cc1cc2c(cc1C)N(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)CC2 1773109460 QDXLDFKLKCDYQW-WAYWQWQTSA-N 339.395 1.303 10 10 EDCE O=C(NCc1c(O)cccc1F)N[C@@H]1CCO[C@H]1c1ccc(O)nc1 1684518530 DRKGGAJGKUECAT-CJNGLKHVSA-N 347.346 1.961 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CCc3ncnn3C2)c1 161149721 UVHMNRBNWMHXAV-WDEREUQCSA-N 331.376 1.368 10 10 EDCE CNCc1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)c(Br)c1 2136832829 MTVKIJQZCBOXRF-KGLIPLIRSA-N 329.238 1.491 10 10 EDCE CO[C@@H](c1ccc(O)c(O)c1)[C@@H](NC(=O)OC(C)(C)C)C(=O)O 1952306009 HBJSJMIUJDXDSS-NEPJUHHUSA-N 327.333 1.763 10 10 EDCE COCC[C@@H](NC(=O)OC(C)(C)C)[C@H](N)Cc1ccc(O)c(O)c1 1952829917 QNQZQDWXUIBRSI-CHWSQXEVSA-N 340.420 1.897 10 10 EDCE NC(=O)COC1CCN(c2ccc(CO)c(Br)c2)CC1 2145370458 HRHPFMQOHAUCPT-UHFFFAOYSA-N 343.221 1.412 10 10 EDCE Oc1ccc(CN=c2[nH]ccnc2I)cc1O 2008699160 GQSAVECKSPPMAN-UHFFFAOYSA-N 343.124 1.526 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]12CN(C(=O)OC(C)(C)C)C[C@@H]1CCO2 2010392922 LDPMXROUJHHEPG-XHDPSFHLSA-N 339.396 1.781 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](CO)[C@@H](O)C2)cc1Br 316620527 XMSQLCRCFLXXBY-WFASDCNBSA-N 343.265 1.737 10 10 EDCE CNCc1ccc(N2CCC[C@H](CO)[C@@H]2CO)cc1Br 709823232 MPKFZDPLQTXOFV-DOMZBBRYSA-N 343.265 1.738 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)c(Br)c1 2182559133 IDMAMQROHFCBHP-JLUCKKNBSA-N 341.249 1.346 10 10 EDCE Cc1nn(C)c(Br)c1CNC(=O)c1cc(O)nc(O)c1 2185787934 MMSNFCGOSZRXGX-UHFFFAOYSA-N 341.165 1.227 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1C(=O)c1ccc(O)c(O)c1 2054401432 RVHFIWCJGSKVFB-PSASIEDQSA-N 346.305 1.769 10 10 EDCE CC(C)(C)OC(=O)NCc1nc(NC(=O)Cc2ccc(N)cc2)n[nH]1 2063194974 HVCMXKYWJDWOHO-UHFFFAOYSA-N 346.391 1.593 10 10 EDCE CO[C@@H]1CN(c2ccc(CO)cc2Br)[C@H]2COC[C@@H]12 2102132791 BWORXZHNPBZSCR-DDTOSNHZSA-N 328.206 1.791 10 10 EDCE C[C@@H]1CCN(c2ccc(CN)c(Br)c2F)[C@@H]1C(N)=O 2090256050 LKCRLEPRYZOFBT-KRTXAFLBSA-N 330.201 1.747 10 10 EDCE NCc1ccc(N2CCNC(=O)C(F)(F)C2)c(Br)c1 2090580091 OELQQCQZJNOYBB-UHFFFAOYSA-N 334.164 1.479 10 10 EDCE OCc1ccc(N2C[C@H]3COC[C@@]3(CO)C2)c(Br)c1 2226174105 ISXLVEZAAKMJPF-FZMZJTMJSA-N 328.206 1.387 10 10 EDCE CN[C@H](C)c1ccc(N2CC(O)(CCO)C2)cc1Br 2270656924 RXZKLWJLFDXPQC-SNVBAGLBSA-N 329.238 1.663 10 10 EDCE CNCc1ccc(N2C[C@@H]3OCC[C@]3(CO)C2)c(Br)c1 2296428187 OIBZJIMVJSVKDD-LSDHHAIUSA-N 341.249 1.756 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N[C@@H]1CCCN(c2cccnn2)C1 2307987340 SUZAJMNXGYNYMT-CQSZACIVSA-N 340.383 1.686 10 10 EDCE Cc1ccc(CNS(=O)(=O)[C@@H]2CC[C@H]2N)c(O)c1Br 2352646430 ULYGWXSCELMKOP-NXEZZACHSA-N 349.250 1.372 10 10 EDCE CN(CC(C)(C)S(C)(=O)=O)C(=O)NCc1ccc(N(C)C)cc1 126654231 CIXUXGKKVVVZBU-UHFFFAOYSA-N 341.477 1.717 10 10 EDCE O=C(O)/C=C\c1ccc(N2CCCNC(=O)C2)cc1Br 382871313 HNVZOZIBANFIEI-HYXAFXHYSA-N 339.189 1.873 10 10 EDCE CNC[C@@](C)(C(=O)O)N(C)Cc1ccc(C)c(Br)c1O 2380766110 QRXUOMMBAJFNKL-AWEZNQCLSA-N 345.237 1.958 10 10 EDCE C[C@H](NC(=O)C(=O)N(C)C[C@H]1CCCO1)c1ccc(N(C)C)cc1 807672882 JVVOYHFZVHAOPC-XJKSGUPXSA-N 333.432 1.567 10 10 EDCE CC[C@H](NCc1ccc(N2CCN(C)CC2)cc1)[C@H](O)C(F)F 824635887 KCPMLANXLULUGX-HOTGVXAUSA-N 327.419 1.933 10 10 EDCE CC(C)N(C[C@@H](C)O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823548564 QVYAWUVVIINGNH-OAHLLOKOSA-N 349.475 1.949 10 10 EDCE CN1CCN(c2ccc(CNC(=S)NC[C@H]3CCCO3)cc2)CC1 905528648 GWNHZVNDLXKRDW-QGZVFWFLSA-N 348.516 1.582 10 10 EDCE COc1ccc(N2CCCN(C(=O)/C=C/Cn3cncn3)CC2)cc1 900293853 PLAHLWYJDQWWHB-DUXPYHPUSA-N 341.415 1.582 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN1C/C=C\c1ccc(N(C)C)cc1 835028669 ORHVNQIBEYPCGE-XQDHMALISA-N 337.489 1.779 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)c3nncn3C)C2)cc1 849224939 MJKZWRJYKYTWTC-QWHCGFSZSA-N 344.419 1.463 10 10 EDCE Cc1cc(C(=O)N2CCN3C[C@H](O)C[C@H]3C2)c(C)n1-c1ccccn1 848306966 BAOVUTJUKGXJMV-JKSUJKDBSA-N 340.427 1.380 10 10 EDCE O=C(CS[C@H]1CCS(=O)(=O)C1)NCc1c(O)cccc1F 928709584 JSVVVGSNZNDPPL-VIFPVBQESA-N 333.406 1.068 10 10 EDCE CO[C@@]1(CO)CCCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 852411038 HIQWWNDDOBFOSG-IBGZPJMESA-N 349.475 1.184 10 10 EDCE CCC1CCN(S(=O)(=O)NNc2nc3cccnc3s2)CC1 857224978 BZZHGRKLGRXEJI-UHFFFAOYSA-N 341.462 1.975 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](CC(C)C)C(N)=O)C2)cc1 855224510 LFTMJVZRQBIFLJ-CJNGLKHVSA-N 333.432 1.538 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3COCC3(C)C)C2)cc1 852372739 GJUNUXPKCMBWCI-CZUORRHYSA-N 333.432 1.998 10 10 EDCE CN(C)C[C@@]1(O)CCCN(Cc2ccc(N3CCOCC3)cc2)C1 930905070 YWPFIMVBTPUILD-IBGZPJMESA-N 333.476 1.412 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCN(C4CC4)C3)C2)cc1 852186403 FFGAITZGGXQUHL-LSDHHAIUSA-N 344.459 1.810 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1C[C@@H](O)C[C@@H](O)C1 859789432 QBFCPHRFCUKZIO-IYBDPMFKSA-N 342.395 1.474 10 10 EDCE CCOc1ccc(O)c(CN2CCN(c3nccn(C)c3=O)CC2)c1 769466971 RLUSHUGWMXBSHG-UHFFFAOYSA-N 344.415 1.207 10 10 EDCE COC(=O)[C@]1(OC)CCN(Cc2cc(Br)ccc2O)C1 862474447 TZQFTXSURLRMHY-AWEZNQCLSA-N 344.205 1.919 10 10 EDCE O=C(CN1CC[C@@H]2C[C@H]21)NCc1ccc(N2CCOCC2)c(F)c1 761096796 RCABTVMDHNEIHF-RHSMWYFYSA-N 333.407 1.373 10 10 EDCE CO[C@@H](CS(=O)(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCOC1 867691205 RQLSZBOTQHGTDZ-DOMZBBRYSA-N 327.402 1.089 10 10 EDCE COC[C@H](C)OC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 867161528 FBHIVRZIXYAEHV-AWEZNQCLSA-N 349.431 1.616 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)O[C@@H]3CCNC3=O)ccc21 770021538 YDMMYBSTKUZDGU-MRXNPFEDSA-N 330.384 1.950 10 10 EDCE Cc1cc(Br)c(O)c(CNCCc2nnnn2C)c1 781638271 KTRQLTFNKATQEK-UHFFFAOYSA-N 326.198 1.319 10 10 EDCE Cn1nnnc1CCNCc1cc(Br)cc(F)c1O 883082230 ZNRLFMWXSDWVKH-UHFFFAOYSA-N 330.161 1.150 10 10 EDCE CCOc1ccc(CN2CCC(O)(COCCO)CC2)c(O)c1 895827634 OYANRZPLPCZDAM-UHFFFAOYSA-N 325.405 1.127 10 10 EDCE COC(=O)c1c(CN2CC[C@H](CC(N)=O)C2)c2cc(F)ccc2n1C 894787862 WOSOTCFNDHXAFD-LLVKDONJSA-N 347.390 1.801 10 10 EDCE CN(CC[S@@](C)=O)c1cc2c(cc1Br)[C@H](N)C(=O)N2 399049368 XGPGZQMQLKLRAZ-JEOXALJRSA-N 346.250 1.216 10 10 EDCE C[C@H]1[C@@H](NCc2ccc(Br)cc2O)CCS1(=O)=O 691393243 RZZCRZOWSQKINK-KWQFWETISA-N 334.235 1.820 10 10 EDCE C[C@H](NC(=O)C(=O)N1CC[C@@]12CCOC2)c1ccc(N(C)C)cc1 1331649516 MWOSXYIEGMHQGZ-UGSOOPFHSA-N 331.416 1.321 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3C=CCC3)C2)cc1 1330652824 HRQMDPGZHDOPJK-KBPBESRZSA-N 329.400 1.225 10 10 EDCE CC[C@]1(C(=O)N[C@@H](C)CNCc2ccc(OC)c(C)c2)CCNC1=O 1268691035 ZGNXPAGSFUYADT-LIRRHRJNSA-N 347.459 1.514 10 10 EDCE O=C1NCCN(C(=O)Cc2ccc(O)c(O)c2)[C@@H]1c1ccccc1 1443015553 JETSBXSVRUDPCQ-QGZVFWFLSA-N 326.352 1.340 10 10 EDCE COc1cc(CNC(=O)Cc2ccc(O)c(O)c2)cc(OC)c1OC 1587289786 HKRQWRYBRSLFDK-UHFFFAOYSA-N 347.367 1.983 10 10 EDCE CC(C)[C@H](O)CNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 154178779 AQURKNSKHQLPOF-WMLDXEAASA-N 335.448 1.900 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)cc1Br 2133921660 YCGLKCYBBGONCR-DOERSZECSA-N 327.222 1.371 10 10 EDCE Cc1c(OCC(=O)N2CCCC2)c(=O)ccn1Cc1ccc(N)cc1 1857917851 NSNOTGRGGRBRAR-UHFFFAOYSA-N 341.411 1.788 10 10 EDCE CCN[C@@H](C)c1ccc(N2CC(=O)NC(=O)C2)cc1Br 233564023 ZNUUZTOADIDCBC-VIFPVBQESA-N 340.221 1.582 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)C[C@H]1C(=O)NCCCN=[N+]=[N-] 1985102579 ISURTEZTFHSSSE-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE CC1(NC(=O)OC(C)(C)C)CN(C(=O)COc2ccc(N)cc2)C1 2001284833 BRRMCNCLHXEBSU-UHFFFAOYSA-N 335.404 1.773 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@@H]1CCOC1 2010389092 LGFUUQOQZDWMOI-PWSUYJOCSA-N 339.396 1.685 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H](CNC(=O)OC(C)(C)C)[C@H]1CCOC1 2010388997 KABZPYXAZBDJCR-RYUDHWBXSA-N 341.412 1.933 10 10 EDCE [N-]=[N+]=NCCN[C@@]1(C(N)=O)CN(Cc2ccccc2)[C@]2(CCOC2)C1 2038665962 NSNZLVWGVWHRRI-IAGOWNOFSA-N 344.419 1.175 10 10 EDCE CCCN(Cc1c(O)cccc1Br)[C@H]1CC(=O)NC1=O 2171211763 YYJJCJNVUURDEJ-NSHDSACASA-N 341.205 1.782 10 10 EDCE CN1C(=O)N[C@H]2CN(c3ccc(CO)cc3Br)CC[C@@H]21 2171298602 XHPKBYPBDUHSOK-AAEUAGOBSA-N 340.221 1.544 10 10 EDCE CO[C@H]1CN(Cc2c(O)cccc2Br)C[C@@H]1C(=O)O 706627959 JWUZLUOBIWOXQR-CABZTGNLSA-N 330.178 1.686 10 10 EDCE COc1ccc(Br)c(CN2CC[C@H](NC(C)=O)C2)c1O 1231556170 YTBKWGZXFKPZAM-JTQLQIEISA-N 343.221 1.874 10 10 EDCE C[C@H]1CN(c2ccc(CN)c(Br)c2F)C2(CC2)C(=O)N1 2188545610 PBKMYYGTQSRZCG-QMMMGPOBSA-N 342.212 1.904 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(O)cc2O)[C@H](O)C1 1908521277 PKHXCFHLRJKHLC-UKRRQHHQSA-N 338.404 1.558 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C[C@H](O)C1 1909748004 HHEIXWDAJGVMGG-HFAKWTLXSA-N 339.396 1.706 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3[C@@H]4COC[C@H]3C4)c(Br)cc21 2198574326 HNVMEOUGFFKMHN-BFHDXFOESA-N 338.205 1.639 10 10 EDCE CN(C[C@@H]1CCN1C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2186467997 AYBUXJTXNIEOCF-SDBXPKJASA-N 340.221 1.575 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@]1(CO)C(=O)NCc1ccc(N)cc1 2080666013 JHXYFTPKYSTYLF-GOSISDBHSA-N 349.431 1.647 10 10 EDCE CNCc1ccc(N2C[C@@H]3OCCO[C@H]3C2)cc1Br 2093348414 FYFRWVKXULNSDM-KBPBESRZSA-N 327.222 1.773 10 10 EDCE OCc1ccc(N2CC[C@H]3OCCO[C@@H]3C2)cc1Br 2095427850 WWCBCSVHAYGOKK-ZIAGYGMSSA-N 328.206 1.936 10 10 EDCE C[C@H]1CN(CCNCc2c(O)cccc2Br)C(=O)N1 2230838661 CBQGBDKCRVECQO-VIFPVBQESA-N 328.210 1.658 10 10 EDCE CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)N3CC(N=[N+]=[N-])C3)c2C1 2263184873 KTVICPYXJQHXBW-UHFFFAOYSA-N 347.379 1.838 10 10 EDCE C[C@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)C(=O)N(C)C 2297554804 DPTOBASRACWFDL-AWEZNQCLSA-N 331.416 1.129 10 10 EDCE C[C@@H]1CN(C(=O)C=Cc2ccc(O)c(O)c2)C[C@@H]1N1CCOCC1 2307987826 NPBCHQGCZFBYDE-HIFRSBDPSA-N 332.400 1.290 10 10 EDCE Cc1ccc(CNC[C@H](C)S(C)(=O)=O)c(O)c1Br 2327626867 PTAROZLZVPTAMH-VIFPVBQESA-N 336.251 1.986 10 10 EDCE Cc1ccc(CN2CCN(CCN)CC2)c(O)c1Br 2352579595 QMJGRRKOWMSYTH-UHFFFAOYSA-N 328.254 1.539 10 10 EDCE Cc1ccc(CNC2CN(S(C)(=O)=O)C2)c(O)c1Br 2352931938 GARHQEXNSKENIR-UHFFFAOYSA-N 349.250 1.197 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2CCNO2)c(O)c1Br 2352942344 CXFDURCLDCNLNP-SNVBAGLBSA-N 329.194 1.715 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2355336011 KCBSCCLWQDNUQP-KBZKQINZSA-N 341.249 1.789 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1CNCc1ccc(O)cc1O 305880898 ALGNFSKCILSFCE-CYBMUJFWSA-N 338.404 1.823 10 10 EDCE O=C1C[C@@H](c2ccccc2)N(C(=O)c2cccc(O)c2O)CCN1 188216651 HRYZFWCSGGCPLY-AWEZNQCLSA-N 326.352 1.801 10 10 EDCE CCn1cc([C@H]2CN(Cc3cc4c(cc3O)OCO4)CCO2)cn1 189845306 GTLQLJOTLHZZMK-QGZVFWFLSA-N 331.372 1.911 10 10 EDCE O=C(C[C@H]1CCNC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 130481263 ADIQEEHHNZVRSZ-CQSZACIVSA-N 335.423 1.403 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)CCO1 529640155 BOIORGZDPPDXIL-SECBINFHSA-N 331.775 1.315 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N[C@@H]1C[C@H]2CC[C@@H]1O2 255162691 AFSMSRGTAMNKIZ-CNZDXLEPSA-N 328.412 1.973 10 10 EDCE Nc1nonc1N=NN(Cc1ccc(Cl)cc1)c1nonc1N 254821737 FWOFILGRKJHCTO-UHFFFAOYSA-N 335.715 1.976 10 10 EDCE C[C@H]1[C@@H](C)N(C(=O)NCc2ccc(N(C)C)c(F)c2)CC[S@]1=O 265524268 AMKOZBQXJOZKJM-YCDSQXFLSA-N 341.452 1.943 10 10 EDCE C[C@@]1(C(=O)NCc2cccc(Br)c2O)CCC(=O)NC1 282331883 MVKKJNWJXVPDKV-CQSZACIVSA-N 341.205 1.687 10 10 EDCE COC(C)(C)[C@H](N)C(=O)NCc1ccc(C)c(Br)c1O 2380749351 NWMPQPWQEBMQJV-GFCCVEGCSA-N 345.237 1.832 10 10 EDCE COc1cc(Br)cc(CNCc2cnn(C)n2)c1O 808415753 HGSYQIVTUNNBMF-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cc3c(cn2)OCCO3)cc1F 819196587 SKKHSYLEABPXKK-UHFFFAOYSA-N 331.347 1.988 10 10 EDCE COC(=O)c1cc(S(=O)(=O)N[C@H](C)c2ccccc2O)n(C)c1 919118841 LNNXWVCNVNKMFK-SNVBAGLBSA-N 338.385 1.557 10 10 EDCE COc1ccc(N(C)CCN(C)CC2CCS(=O)(=O)CC2)cc1 844400500 CSXXQAXOWXLGBF-UHFFFAOYSA-N 340.489 1.888 10 10 EDCE C[C@H](CC(=O)NCc1ccc(N2CCSCC2)cc1)NC(N)=O 847355727 FPMYELRYRMYGGL-GFCCVEGCSA-N 336.461 1.303 10 10 EDCE COC(=O)C[C@@H](CN1C(=O)CN(Cc2ccccc2O)C1=O)C1CC1 849363244 HFNBACHSNGQNID-AWEZNQCLSA-N 346.383 1.746 10 10 EDCE CCN(CCC(N)=O)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 922912647 JGFTUFLDYRKZOT-CQSZACIVSA-N 334.464 1.899 10 10 EDCE COc1ccc(N2CCN(CCNC3CCN(OC)CC3)CC2)cc1 924830528 BGMILHFAPXRMKY-UHFFFAOYSA-N 348.491 1.433 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)[C@H](CN)C(F)(F)F 852762365 KYLMETLGOSQBNH-CQSZACIVSA-N 346.397 1.532 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)C[C@H]2CO)c(Br)c1 698118534 ZQSYCODGMUJSNR-USWWRNFRSA-N 329.238 1.661 10 10 EDCE O=C1N[C@]2(CCSC2)C(=O)N1Cc1ccc(N2CC=CC2)cc1 761362350 PDFRBZSVIOMTCB-KRWDZBQOSA-N 329.425 1.990 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCC[C@@H](C)[S@](C)=O)c1 765979774 IIKMXHJLRCPFQC-AUWXTCHYSA-N 328.434 1.918 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@]34CCCN(CC3)C4)CC2)cc1F 896903239 MVDWMBUZBKSWSJ-IBGZPJMESA-N 347.434 1.969 10 10 EDCE COCc1nc([C@@H]2COCCN2Cc2cc(F)cc(F)c2O)no1 894426490 BOZGVROZTXSEAX-LBPRGKRZSA-N 341.314 1.773 10 10 EDCE Cn1ccnc1[C@@H]1C[C@H](NC(=O)Cc2ccc(O)c(O)c2)CCO1 1142058851 WDVHCWZZCQYGGF-DOMZBBRYSA-N 331.372 1.410 10 10 EDCE CNCc1ccc(N(C)CCN(C)CCO)c(Br)c1 691240840 HZEKPIBLSNJKOX-UHFFFAOYSA-N 330.270 1.529 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H]2CCC(=O)NC2)cc1C 1266950682 WABAWSFKMDABDZ-UKRRQHHQSA-N 333.432 1.124 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@H]2CCCN2C)cc1C 1278737284 KUKNWEICECIZAU-IAGOWNOFSA-N 349.475 1.007 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cnn[nH]3)CCCC2)cc1C 1715301125 CMOHYKRUNKHBPK-UHFFFAOYSA-N 343.431 1.954 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@@H](C)C(C)C)cc(OC)n1 1495101988 YAHJPBKGJHIVIN-NEPJUHHUSA-N 337.420 1.625 10 10 EDCE COc1ccc(CNC(=O)c2ccc(S(C)(=O)=O)s2)c(O)c1 1635042646 OFRNHXKOJGLLNC-UHFFFAOYSA-N 341.410 1.796 10 10 EDCE CC(C)N(C[C@@H]1CCC(=O)N1)C(=O)c1ccc(N=NC(N)=O)cc1 1570409794 FUJQHQWIMDRAHT-ZDUSSCGKSA-N 331.376 1.978 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CN3CCN2C[C@@H]3C)cc1 1587459626 DHLGGORGMVKIRF-LPHOPBHVSA-N 344.503 1.880 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H]2CC(=O)N(C)C2)cc1C 1662924255 FVRARFCUGWTSSG-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE C[C@@H](CNCc1cnn(C)c1)NC(=O)c1ccc(N=NC(N)=O)cc1 1669753670 UPWBFMIVUMYIND-NSHDSACASA-N 343.391 1.491 10 10 EDCE COC[C@@]1(C(=O)NCCN=[N+]=[N-])CN(C(=O)OC(C)(C)C)CCO1 1965101743 GZTFEDNJNAURBO-CQSZACIVSA-N 343.384 1.065 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CCCN1c1nccs1 157965489 LMXUXJLFVCJBNQ-LBPRGKRZSA-N 333.413 1.882 10 10 EDCE CC(=O)N1CCN(/N=N/c2ccc(N3CCN(C)CC3)cc2)CC1 1860486289 VTBRXUQVSQJUMF-VHEBQXMUSA-N 330.436 1.601 10 10 EDCE O=C(O)[C@H]1CCCN(C(=O)CCNCc2cc(Cl)ccc2O)C1 1857864897 MFBSIWXNVDZQMG-NSHDSACASA-N 340.807 1.849 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CO[C@H]([C@@H](N)Cc2ccc(O)c(O)c2)C1 1952997539 NTVLCUUTRJMJME-HUBLWGQQSA-N 338.404 1.650 10 10 EDCE NNc1ncc(Br)c(=NCCc2ccc(O)c(O)c2)[nH]1 2148023495 XPGJSQPBBPWZRC-UHFFFAOYSA-N 340.181 1.012 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)NCCN=[N+]=[N-])C1 1985102704 KURBPOJXKUXPOM-HZMBPMFUSA-N 325.369 1.296 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)CNCc1ccc(F)c(F)c1O 1985858719 LHJNCRNZZIMATC-JTQLQIEISA-N 332.347 1.646 10 10 EDCE C[C@H](N)c1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)c(Br)c1 2146307013 VTVNOJHMBODHDY-NZVBXONLSA-N 341.249 1.650 10 10 EDCE NCc1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)c(F)c1Br 2146317381 AQBQWSWTECTUDX-OKILXGFUSA-N 345.212 1.228 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1Cc1cc(N)ccc1O 2010531686 XQKNTWJCRSYAFQ-UONOGXRCSA-N 337.420 1.434 10 10 EDCE CN(Cc1nnnn1C)c1cc(Br)c(CN)cc1F 707664866 HNHDSCIIHHVYQU-UHFFFAOYSA-N 329.177 1.207 10 10 EDCE CN(C)CCN(C)CCN(C)c1ccc(CN)c(Br)c1 2179009923 DWMVUWGFJIEPPT-UHFFFAOYSA-N 343.313 1.837 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)cc1Br 2189046082 ZQQYWFFCVSRUEO-KIGUWFBYSA-N 342.233 1.946 10 10 EDCE CS(=O)(=O)[C@H]1COC[C@@H]1Nc1c(N)cccc1Br 2086312731 NARRILZEDFIQSP-UWVGGRQHSA-N 335.223 1.255 10 10 EDCE CCNC(=O)C1CN(c2ccc(CNC)cc2Br)C1 2111749862 IVUSLDFAGAHMDQ-UHFFFAOYSA-N 326.238 1.741 10 10 EDCE CC1(C)OCCN(c2ccc(CN)cc2Br)[C@@H]1CO 2267738754 KSRVJMZCNMJDGT-CYBMUJFWSA-N 329.238 1.884 10 10 EDCE O=C1C(=Cc2cc([N+](=O)[O-])ccc2O)SC(=S)N1CCO 2294874464 FBAZUZCGGQAOOC-UHFFFAOYSA-N 326.355 1.494 10 10 EDCE COc1cc(C=C2SC(=S)N(CCO)C2=O)cc(OC)c1O 2294874711 PUHHTUSEHMWIOZ-UHFFFAOYSA-N 341.410 1.603 10 10 EDCE Cc1ccc(CN[C@@H]2CC(=O)N(C)C2=O)c(O)c1Br 2352692966 NYQHFYGOMFIFED-SECBINFHSA-N 327.178 1.310 10 10 EDCE Cc1cc(C(=O)N2CCCN(C)C(=O)C2)c(C)n1-c1ccccn1 189768914 SFVZNKMEIULIEL-UHFFFAOYSA-N 326.400 1.793 10 10 EDCE CCc1n[nH]c(=O)c(CNCc2cc3c(cc2O)OCO3)c1CC 194654126 PZGZHLGWZZIUIK-UHFFFAOYSA-N 331.372 1.619 10 10 EDCE CC(C)(C)[C@H](CNCCO)NC(=O)c1ccc(N=NC(N)=O)cc1 1508043112 KALXOLZUYWQICX-ZDUSSCGKSA-N 335.408 1.575 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2COCC[C@H]2N)c(O)c1Br 2380749497 PFFJRKBLDIFUNB-GHMZBOCLSA-N 343.221 1.443 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@H](N)[C@@H]3C)C2)cc1 818656035 VMDMBPLIAABPIW-VBQJREDUSA-N 332.448 1.653 10 10 EDCE Cn1cc(CNC(=O)COc2ccc(N)cc2)c(Br)n1 720645086 IYYBWBAJYGGXPU-UHFFFAOYSA-N 339.193 1.460 10 10 EDCE COc1ccc(N2CCCN(C[C@@H](O)C3(O)CCCC3)CC2)cc1 905916101 XWMFCRQRDDBKTL-GOSISDBHSA-N 334.460 1.873 10 10 EDCE CO[C@]1(CN[C@H](C)c2c(C)cc(C)cc2O)CCS(=O)(=O)C1 903363059 LTXKYHQXGNPZHM-CJNGLKHVSA-N 327.446 1.863 10 10 EDCE CC[C@H](C(=O)O)N(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 844839213 KDLNYKDAMBAPBL-MRXNPFEDSA-N 349.431 1.139 10 10 EDCE COc1ccc(O)c(CNC(=O)NC[C@H]2CN(C3CC3)C(=O)O2)c1 847317038 OLCWWPDWEYAAHE-ZDUSSCGKSA-N 335.360 1.183 10 10 EDCE Cc1cc(N(C)C)ccc1CN[C@@H]1CCC[C@@H]1CNS(C)(=O)=O 840942885 LBQIMUWAALUSTA-NVXWUHKLSA-N 339.505 1.869 10 10 EDCE COc1cc(N2CCN(C[C@@]3(C)CCNC3)CC2)cc(OC)c1OC 843119617 VUUJVNQZJFIXJO-IBGZPJMESA-N 349.475 1.834 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC3CCN(C)CC3)C2)cc1 852180154 IGPKTEBYOJBRSG-HNNXBMFYSA-N 332.448 1.667 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H]2COC[C@H]2C1 850602670 YIEFEXJGCLWYGU-HZPDHXFCSA-N 345.443 1.206 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](OC)C(=O)OC(C)(C)C)c1 866765680 YPEHKQSWDDWINM-QMTHXVAHSA-N 339.388 1.935 10 10 EDCE COC(=O)C12CC(C(=O)NCc3ccc4cccnc4c3O)(C1)C2 862025468 VLHOFHCNJOBBGO-UHFFFAOYSA-N 326.352 1.900 10 10 EDCE COC(=O)c1cc(OCC(=O)Nc2cc(C)on2)ccc1N(C)C 865396506 UIPHPWMYOFBPPY-UHFFFAOYSA-N 333.344 1.853 10 10 EDCE Cc1ccc(C(=O)N2CCN(CCc3cnccn3)CC2)c(O)c1O 871218228 JZBLVKMANNMMNB-UHFFFAOYSA-N 342.399 1.197 10 10 EDCE CCN(CC)c1ccc(CNC(=O)Cn2nc(C)oc2=O)cc1F 878785081 LEUBNRSBLUWOFP-UHFFFAOYSA-N 336.367 1.446 10 10 EDCE CCc1nc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)no1 775378451 WZUWLVZREVHBKI-UHFFFAOYSA-N 348.378 1.662 10 10 EDCE Oc1cc2c(cc1CN1CCc3nc[nH]c3C13CCOCC3)OCO2 895071046 JROOPVDHXHJSEL-UHFFFAOYSA-N 343.383 1.908 10 10 EDCE O=C(NCCNC(=O)c1ccc(O)c(O)c1)OCc1ccccc1 1957291138 JBMYLLLXBVKJJB-UHFFFAOYSA-N 330.340 1.754 10 10 EDCE Cc1ccc(CCC(=O)NCC(=O)NCc2cc(O)ccc2O)cc1 1303223157 COIODAFNMAIMDT-UHFFFAOYSA-N 342.395 1.771 10 10 EDCE CCC(=O)NCC1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1333728449 LEKSLVPIJDXRSZ-UHFFFAOYSA-N 331.376 1.884 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)/C=C/c2ccc[nH]2)cc1C 1272405731 AELFGXLFASBMDQ-DBWMJRBXSA-N 343.427 1.612 10 10 EDCE CCOCC(=O)N(C)[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1280502976 CRWDHYFFHGBSNL-LLVKDONJSA-N 349.391 1.462 10 10 EDCE NC(=O)c1cccc(OCCC(=O)NCc2c(O)cccc2O)c1 1456236811 QUERGOKKJARHQH-UHFFFAOYSA-N 330.340 1.282 10 10 EDCE COC[C@@H](C)C(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1295441840 AXCCUAMIHKMZOJ-GHMZBOCLSA-N 349.391 1.366 10 10 EDCE COC(=O)c1ccc2c(c1)OCCN(C(=O)c1cccc(O)c1O)C2 1472316540 VZNXMBLAITUXHU-UHFFFAOYSA-N 343.335 1.919 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2ccnc(-n3cncn3)c2)c1 1471052796 HTIMVMFTRIABNZ-UHFFFAOYSA-N 338.371 1.676 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H](CO)CC2OCCO2)cc1 1471650440 SPFJKEJYMKJQIT-INIZCTEOSA-N 344.411 1.948 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccc(S(=O)(=O)C2CC2)cc1 1639292943 WQLVLHZIDLTSEQ-UHFFFAOYSA-N 347.392 1.964 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC(CNC(=O)CCCF)C2)cc1 1721409811 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CN(C)c1ccc([C@@H](O)[C@H](N)c2c(Br)cnn2C)cc1 2148331180 NVQUHUBLSJYYSM-TZMCWYRMSA-N 339.237 1.982 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@@H](O)C2CN(C(=O)OC(C)(C)C)C2)cc1 1999536287 IKDBJYHCNAJEOY-CVEARBPZSA-N 335.448 1.980 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2007216221 PHZIKVVOWQFVCK-FDYHWXHSSA-N 340.420 1.182 10 10 EDCE CCN(C(=O)OC(C)(C)C)[C@@H]1COC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010389784 UWLXMCHXIGWMPL-VXGBXAGGSA-N 339.396 1.780 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)CC[C@@H]3O)cc1Br 2161395367 AEIXQBRLTVCSRS-ZQDZILKHSA-N 342.233 1.794 10 10 EDCE COc1ccc(N2CC[C@@H](N)[C@H](CO)C2)c(OC)c1Br 2178907263 OZQPASHLZHIRIV-VHSXEESVSA-N 345.237 1.612 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@@H](C(=O)NCCCN=[N+]=[N-])[C@@H]2C1 1908253920 CLGMUJBGYLRVQX-TUAOUCFPSA-N 339.396 1.685 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CCN2C(=O)COc2ccc(N)cc2)C1 2044625865 AHHZHYODVGLALY-UHFFFAOYSA-N 347.415 1.869 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H]4COC[C@H]43)c(Br)cc21 2186370560 JKZSAVYEIRCVJC-BLBGDKDGSA-N 338.205 1.497 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](CNC(=O)c3ccc(O)c(O)c3)[C@H]2C1 2055515003 OQJOSVWMJUXPIR-CLLJXQQHSA-N 348.399 1.941 10 10 EDCE CN(Cc1nc(=NCc2ccc(O)cc2O)[nH][nH]1)C(=O)OC(C)(C)C 2065560785 YLMAATFHGMKPTA-UHFFFAOYSA-N 349.391 1.617 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210538022 QISIQDSDWPIREE-GMTAPVOTSA-N 327.385 1.874 10 10 EDCE CN1CCCc2cc(CNC(=O)NCCCN3CCCC3=O)ccc21 58483298 CDLFAFLHOWSAKO-UHFFFAOYSA-N 344.459 1.881 10 10 EDCE CCOC(=O)c1c(C)nn(C)c1NC(=O)c1cc(O)c(O)c(O)c1 170190574 MQEOJVVSPMDAIU-UHFFFAOYSA-N 335.316 1.274 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)OCCN1CCCC1=O 108909005 YRMHGLTXBQCUMC-VMPITWQZSA-N 344.411 1.702 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccncc2C)cc1C 1507188466 FESMRRFBFSEHBH-MRXNPFEDSA-N 343.427 1.588 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H]2CCC[C@@H](C(N)=O)C2)cc1F 172571747 KARQASKNHLLCGB-CHWSQXEVSA-N 336.411 1.735 10 10 EDCE CC(C)CN1C(=O)/C(=C/NCCc2ccccc2F)C(=O)NC1=S 255765885 DEIYXXNVTOQZJT-UKTHLTGXSA-N 349.431 1.741 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CC(=O)N1C 282610655 RAUUQMFGRHPKOD-CQSZACIVSA-N 330.432 1.659 10 10 EDCE COc1cc(Br)cc(CN2C[C@H](O)C[C@H]2CO)c1O 370394295 DVXKMUSRYKQQFF-WDEREUQCSA-N 332.194 1.091 10 10 EDCE O=C1Nc2cc(N3CC([C@H](F)CO)C3)c(Br)cc2[C@@H]1O 2166893321 BDXYDHOCIWSRPT-SKDRFNHKSA-N 345.168 1.201 10 10 EDCE C[C@@H](C(=O)NCc1cc(Br)ccc1O)S(C)(=O)=O 804733579 UOLBVYRKSGUBBV-ZETCQYMHSA-N 336.207 1.204 10 10 EDCE CC(C)(C)OC(=O)N1CC(N[C@@H]2CCc3cccc(O)c32)(C(N)=O)C1 715537613 CVHVDLQBGQXRJD-GFCCVEGCSA-N 347.415 1.444 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCC(C)C)C2)cc1 826605018 UNECDFAYSSXBQY-AWEZNQCLSA-N 333.432 1.552 10 10 EDCE CO[C@]1(CO)CCCN(Cc2ccc(N3CCN(C)CC3)cc2)C1 826952116 GRPAGPLSODTHGV-LJQANCHMSA-N 333.476 1.412 10 10 EDCE CO[C@@]1(CN[C@H](C)c2ccc(N(C)C)cc2)CCS(=O)(=O)C1 903369620 YTWKCGDDTPHGSG-CZUORRHYSA-N 326.462 1.607 10 10 EDCE CN(C)c1ccc(/C=C\CN[C@@H]2CCN(c3cnn(C)c3)C2=O)cc1 835041667 ZFGHNRBMJCNIIT-PYTPGESOSA-N 339.443 1.894 10 10 EDCE CN1CCO[C@@H](CSCC(=O)NCc2ccc(N(C)C)cc2)C1 842651924 DJSHJBAWVGOHMF-MRXNPFEDSA-N 337.489 1.433 10 10 EDCE CS(=O)(=O)C1(CNC(=O)NCc2c(O)cccc2F)CCC1 922281792 NATCAAFPVRTFBQ-UHFFFAOYSA-N 330.381 1.298 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3cn(C)nn3)C2)cc1 852450804 WNYRDWJIWQDOSM-CYBMUJFWSA-N 344.419 1.244 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](CN)CC(C)C)C2)cc1 851664576 FWLLBEJFAFLAQL-CABCVRRESA-N 334.464 1.947 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCCC[C@@H]3O)C2)cc1 854298881 JKGIZUUYMQCZGQ-COXVUDFISA-N 333.432 1.877 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC[C@@H](N)C(C)C)C2)cc1 851677046 AWQARORCWKAFKQ-WMLDXEAASA-N 334.464 1.947 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCCC(=O)N(C)C)C2)cc1 855232555 UZEUXIBFCGWWDB-AWEZNQCLSA-N 333.432 1.649 10 10 EDCE OC1CCN(c2ccc(CNC[C@@H]3C[C@@H]4COC[C@@H]4O3)cc2)CC1 922727131 ZHGQLXHHZSIJBU-MNEFBYGVSA-N 332.444 1.541 10 10 EDCE C[C@H](NC[C@@H](O)C1(O)CCCC1)c1ccc(N2CCOCC2)cc1 930211338 SXIJBTYQVUINKJ-MAUKXSAKSA-N 334.460 1.840 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1C[C@H](OC(C)(C)C)C1 1118748712 XZSMRHPKNBPZLL-HDJSIYSDSA-N 334.416 1.813 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](Cn3ccnn3)C2)cc1 1166248449 VNTUSLOCLCXXSS-NSHDSACASA-N 327.348 1.603 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)CCNC(N)=O)C2)cc1C 1316626557 WFLPZHLAIGYHGR-GASCZTMLSA-N 348.447 1.046 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCOC[C@@H]2O)c1O 1964581580 PHPNEOSQYATWRT-QWRGUYRKSA-N 332.194 1.403 10 10 EDCE Cc1ccc(C(=O)Nc2ncn(Cc3cccnc3)n2)c(O)c1O 1337482401 ITOXWHFURXRFLB-UHFFFAOYSA-N 325.328 1.693 10 10 EDCE COC(=O)CCCCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1257507617 UYNYGHYTBAOBTQ-UHFFFAOYSA-N 349.431 1.171 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)CN(C)C(C)=O)C(C)C)cc1C 1268203705 DHCVLQZXRAVIFX-KRWDZBQOSA-N 349.475 1.712 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C2CCCCC2)cc(OC)n1 1354223110 IQYRZUJLNRGLFE-GFCCVEGCSA-N 349.431 1.914 10 10 EDCE CC[C@H](CNC(=O)COC)NC(=O)c1ccc(N=NC(N)=O)cc1 1285023148 DPWYFUCEBBUTBM-LLVKDONJSA-N 335.364 1.120 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cccn1CCN1CCOCC1 1528771104 KDCKKNUNGAQNLB-UHFFFAOYSA-N 345.399 1.162 10 10 EDCE CC(C)(C)[C@H](O)C[C@H](CO)NC(=O)c1ccc(N=NC(N)=O)cc1 1467973219 VHZKDEPYAOJULN-CHWSQXEVSA-N 336.392 1.737 10 10 EDCE C[C@H](C(=O)NCc1cc(O)ccc1O)N1C(=O)c2ccccc2C1=O 1471661767 BBCQHWJVUQPLMD-SNVBAGLBSA-N 340.335 1.399 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)Cc2cnn(C)c2)cc1C 1700388834 BOGGTASTINKQSI-CABCVRRESA-N 344.459 1.963 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cn(C)nn2)cc1C 1716289379 HCTIHPTZFUBWSP-SNAWJCMRSA-N 329.404 1.208 10 10 EDCE Cc1cn2nc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2c(=O)[nH]1 1556157796 JWQVNNAPDRVCLF-SECBINFHSA-N 342.355 1.103 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CN(Cc2ccccc2)CCO1 1558533283 BBBNAVAJGCIMCP-SFHVURJKSA-N 342.395 1.615 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)/C=C/C(=O)N(C)C)C2)cc1 1557133494 MRFICSYPIFSVCT-MYSGNRETSA-N 331.416 1.282 10 10 EDCE CNC(=O)N[C@H]1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 1632537378 KOYOHBARXRVOIO-VIFPVBQESA-N 335.385 1.456 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1cnn(C)c1 1567083402 KGCHCFLQCWFTDF-NSHDSACASA-N 343.391 1.491 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cc3n(n2)CCO3)cc1C 1498054727 BEGCZCOEBGDYAQ-ZDUSSCGKSA-N 344.415 1.501 10 10 EDCE COC(=O)C[C@@](C)(NC(=O)Cc1ccc(O)c(O)c1)c1ccccn1 1567909671 IHUSXQRSABRXOF-GOSISDBHSA-N 344.367 1.630 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)Cc2cncn2C)cc1C 1568700386 ZDTBPPTUMPJMAX-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2[nH]cnc2C)cc1C 1734534043 NTGFRPVRGDPQHO-HNNXBMFYSA-N 346.431 1.258 10 10 EDCE O=C1C[C@H](C(=O)NCc2cc(O)ccc2O)c2ccc(F)cc2N1 1644752431 FIHOFAUYCIVKIZ-ZDUSSCGKSA-N 330.315 1.979 10 10 EDCE O=C(NCc1ncn(-c2ccccc2)n1)c1c(F)ccc(O)c1O 1654610509 VFWQWAVLKVBYLC-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE C=CC(=O)NCCC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 160475285 SAGLMFNIHIEFCU-CQSZACIVSA-N 331.416 1.393 10 10 EDCE COc1cccc(CNC(=O)Cn2cc(-c3ccccc3)nn2)c1O 160592774 YIOYFESKQJVJBF-UHFFFAOYSA-N 338.367 1.976 10 10 EDCE COCCCN(C)CCNC(=O)c1c(C)oc(-n2cccc2)c1C#N 152529252 JWBXPRPCISPSFV-UHFFFAOYSA-N 344.415 1.949 10 10 EDCE O=C(COc1ccccc1Cl)NCCN1C(=O)CSC1=S 7168091 NATYYCUIZXSTEH-UHFFFAOYSA-N 344.845 1.695 10 10 EDCE CCOc1nonc1C(=O)N1CCN(c2ccc(OC)cc2)CC1 1872679962 PRFURUXPYSRCNL-UHFFFAOYSA-N 332.360 1.439 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C1COC1 1985102838 MMTIHMPWJPDMKY-GHMZBOCLSA-N 325.369 1.437 10 10 EDCE CCN1CCc2cc([C@@H](N)[C@H](O)CNC(=O)OC(C)(C)C)ccc21 1999537373 XXTZDLQFCRAEQS-HZPDHXFCSA-N 335.448 1.954 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 2010388962 JNWAUAGAGNFKCY-SNVBAGLBSA-N 343.384 1.664 10 10 EDCE NCc1ccc(N2CC[C@@H](C(CO)CO)C2)c(F)c1Br 2170642673 SILMWIBJCNFUBL-SNVBAGLBSA-N 347.228 1.474 10 10 EDCE CO[C@@H]1CN(Cc2cc(Br)cc(F)c2O)C[C@@H]1C(=O)O 715794002 YLZYJFVHLOMCOO-GXSJLCMTSA-N 348.168 1.825 10 10 EDCE CCNCc1ccc(N(C)[C@H]2CC(=O)NC2=O)c(Br)c1 2171189387 CWOAOQKNLKCCJF-LBPRGKRZSA-N 340.221 1.410 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@H](O)c2cc(Br)nn2C)cc1 2163137155 ADPPOPBSFJEQSW-ZIAGYGMSSA-N 339.237 1.982 10 10 EDCE CNCc1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)c(Br)c1 2178081051 BNGGFDNZIAYFMA-JMSVASOKSA-N 341.249 1.612 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)c(Br)c1 2178087516 RMTNZZXWORIHPG-OXUWNYNTSA-N 342.233 1.946 10 10 EDCE COCCOCCOCCNCc1ccc(Br)cc1O 2187127101 ZMRPDCNZXVEBHE-UHFFFAOYSA-N 348.237 1.924 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CO1 1908253705 YYFDKPHZVYZZTD-IJLUTSLNSA-N 339.396 1.922 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])COC1 2210540154 QCLDOVSKOLOKAP-UWVGGRQHSA-N 325.369 1.628 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210536657 HWQWDABXWCNVRP-GWOFURMSSA-N 327.385 1.608 10 10 EDCE COc1ccc(N2C[C@H](O)C[C@@H](O)C2)c(OC)c1Br 2226546555 GIFLTWNSPUIFPX-RKDXNWHRSA-N 332.194 1.398 10 10 EDCE CSc1ncc(CNc2ccc(S(N)(=O)=O)cc2N)s1 2284699663 OYZSFLDCTVYFOT-UHFFFAOYSA-N 330.460 1.707 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2nccnc2Cl)s1 2270930381 MKIPNUBBQZJZTJ-UHFFFAOYSA-N 336.851 1.787 10 10 EDCE CSc1ncc(CNS(=O)(=O)CC(C)(C)C(N)=S)s1 2269309990 DXTLMAYHKIGQDY-UHFFFAOYSA-N 339.533 1.597 10 10 EDCE COc1cc(C=C2SC(=S)N(CCCO)C2=O)ccc1O 2294874749 SDZHBBUWRZLWGE-UHFFFAOYSA-N 325.411 1.984 10 10 EDCE CSc1ncc(CNS(=O)(=O)[C@H]2CCNC(C)(C)C2)s1 2284720960 JTEFNBIBUCAWAJ-JTQLQIEISA-N 335.520 1.815 10 10 EDCE Cc1ccc(CNC(=O)N(C)CC(=O)O)c(O)c1Br 2352620428 QANLBXLPTVJDFJ-UHFFFAOYSA-N 331.166 1.689 10 10 EDCE C[C@@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)C(N)=O 10959569 IOBKGLWHFZANHB-MRVPVSSYSA-N 338.319 1.075 10 10 EDCE Cc1cc(CN2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)no1 170906242 LPINIUXYQJGVTL-UHFFFAOYSA-N 332.360 1.915 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H](C)NC(C)=O)cc1C 1277750887 DGWQNJKBAUJBLF-UONOGXRCSA-N 335.448 1.465 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)NCC1(CCO)CC1 187983382 QPQDCYQUZWLNSQ-ZZXKWVIFSA-N 330.428 1.815 10 10 EDCE C[C@H]1CN(C(=O)[C@H](C)N2CCOc3cc(N(C)C)ccc32)C[C@@H](C)O1 246085771 NFWHKZBGZQOOHZ-ZNMIVQPWSA-N 347.459 1.976 10 10 EDCE CO[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@H]1C 276260343 MQOOCBUECGYMHO-QMTHXVAHSA-N 342.417 1.261 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@H](S(=O)(=O)NC)C2)c1 371324823 AUFCSKUXTMJLSB-AWEZNQCLSA-N 328.434 1.305 10 10 EDCE CCN(CC(N)=O)c1ccc(/C=C\C(=O)O)cc1Br 387613372 XTGJLIGRWDUGST-XQRVVYSFSA-N 327.178 1.859 10 10 EDCE CN1CC[C@H](C(=O)NCc2cc(Br)ccc2O)CC1=O 804735350 VRXHXYXEHCNMNU-VIFPVBQESA-N 341.205 1.639 10 10 EDCE COc1ccc([C@@H]2[C@H](C(=O)OCC(=O)C(C)=O)CCC(=O)N2C)cc1 808518259 FESMHEDZODCCTP-RHSMWYFYSA-N 347.367 1.306 10 10 EDCE CC(=O)C(=O)COC(=O)CNC(=O)c1ccccc1C(F)(F)F 808525877 HPOMEAQAGVTIJT-UHFFFAOYSA-N 331.246 1.137 10 10 EDCE C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C1(S(C)(=O)=O)CC1 804539988 RGNBFQBPZJVYRC-DFVUYQKZSA-N 325.386 1.193 10 10 EDCE CN1CCC[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1=O 295287664 PXOJLYMQPKXMMV-CVEARBPZSA-N 346.427 1.768 10 10 EDCE CN1CC2(CN(Cc3cccc(Br)c3O)C2)OC1=O 817413719 BLJYSFDLXYEBFU-UHFFFAOYSA-N 327.178 1.791 10 10 EDCE CC1(C)NC(=O)CC[C@@H]1NCc1ccc(N2CCC(O)CC2)c(F)c1 813854662 CVXADYIKIIOZEN-KRWDZBQOSA-N 349.450 1.934 10 10 EDCE COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cnc(O)s1 821191461 NYKJAJNCVALYJG-UHFFFAOYSA-N 330.343 1.142 10 10 EDCE CN1C[C@@H](O)C[C@@]1(C)C(=O)NCc1cccc(Br)c1O 907757721 JGXFHYGXAFQVSF-HZMBPMFUSA-N 343.221 1.226 10 10 EDCE COc1ccc(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)c(O)c1 832178667 VTTHLNXLDNBMMA-DDUZABMNSA-N 334.416 1.550 10 10 EDCE C[C@@H]1CNCC[C@H]1NC(=O)NCc1cc(Br)ccc1O 841989595 ZVRPVVUPEQZNFP-BXKDBHETSA-N 342.237 1.952 10 10 EDCE C[C@H](O)[C@@H]1CN(C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 840281461 SZMGPRFNVUOEHE-NHYWBVRUSA-N 325.384 1.183 10 10 EDCE COc1ccc(N2CCN(Cc3n[nH]c4c3COCC4)CC2)cc1F 929824969 ZUGQWFUETGFSAF-UHFFFAOYSA-N 346.406 1.952 10 10 EDCE C[C@@H](Sc1nnnn1C1CC1)C(=O)NCc1c(O)cccc1F 928711108 DSFMLAQBZYFZJL-MRVPVSSYSA-N 337.380 1.650 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@@H]2C[C@H]2C2CC2)c1 927411225 VMBIWWKJGPDVNS-YPMHNXCESA-N 338.429 1.930 10 10 EDCE CN(c1ccccc1C(N)=O)S(=O)(=O)c1cc(F)cc(F)c1O 753014751 CZUWITXBJQASOC-UHFFFAOYSA-N 342.323 1.594 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@H]1COCCN1C 858544176 QWCPAZMCCBQCDI-QAPCUYQASA-N 348.491 1.622 10 10 EDCE C[C@@H]1CCCN(S(=O)(=O)NNc2nc3cccnc3s2)C1 857225654 PFBCCIAHQDLKQM-SECBINFHSA-N 327.435 1.585 10 10 EDCE C[C@H]1CC[C@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CN1 861652668 JVLQCPAGKWALIW-HOCLYGCPSA-N 346.475 1.587 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC(CO)C2)cc1 860766506 GWYASHQOKVFHDG-UHFFFAOYSA-N 326.396 1.900 10 10 EDCE O=C(NCCCN1CCOCC1)c1cc2cc(O)c(O)cc2s1 895465987 RKBUPMXRXBXDEW-UHFFFAOYSA-N 336.413 1.765 10 10 EDCE COc1cc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)c(O)cc1C 795653162 PJAOORGBITWVDM-AWEZNQCLSA-N 342.461 1.565 10 10 EDCE Cc1[nH]nc(C(=O)NCc2ccc(O)cc2O)c1Br 1142531176 XKWNIXIVENNYPC-UHFFFAOYSA-N 326.150 1.822 10 10 EDCE COC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)Cc1ccc(O)c(O)c1 1303671321 ZNDAIMLXCLNVFY-CQSZACIVSA-N 347.342 1.680 10 10 EDCE C[C@H](NC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2[nH]1)c1ccccc1O 1151892086 IMAHOMKRQWIFEH-AMKSKSKJSA-N 341.367 1.540 10 10 EDCE O=C1CCCC(=O)N1CCNCc1ccc(Br)cc1O 691405269 SNNLQIFSLCMGDY-UHFFFAOYSA-N 341.205 1.783 10 10 EDCE CCOC(=O)[C@@H]1CNCCN1Cc1c(O)cccc1Br 706852275 ZIFGANINWSVTCZ-LBPRGKRZSA-N 343.221 1.492 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@@H]3CCCN3C(C)=O)CC2)cc1 1261853818 SSNWIBJYXXOGBJ-SFHVURJKSA-N 345.443 1.745 10 10 EDCE O=C1CC[C@H](CC(=O)NCc2cccc(Br)c2O)CN1 1448954591 AOANDJYRBKLYOV-SECBINFHSA-N 341.205 1.687 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)Cc2nonc2C)cc1C 1283694491 VYISCGBFGRVFET-ZDUSSCGKSA-N 346.431 1.874 10 10 EDCE COC(=O)CN(CCNC(=O)C1CC1)Cc1cc(Cl)ccc1O 1559607866 ZLJAEMIRHPHXSD-UHFFFAOYSA-N 340.807 1.547 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cc3cc[nH]n3)CC2)cc1C 1716678698 OJYJVLQVWXTOCK-UHFFFAOYSA-N 328.416 1.708 10 10 EDCE CC(C)[C@H](NC(N)=O)C(=O)NCc1cccc(Br)c1O 1626822859 XFUACFGUSHHOPD-JTQLQIEISA-N 344.209 1.464 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccc(N2CCC(O)CC2)cc1 1637126392 XDJHROPJBGWCTB-UHFFFAOYSA-N 342.395 1.989 10 10 EDCE C[C@H](NC(=O)c1cn(C(F)(F)CO)nn1)c1ccc(N(C)C)cc1 1638957793 XECZODCEVBOTJS-JTQLQIEISA-N 339.346 1.377 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)C2=COCCO2)cc1C 1568162495 YKUWKZGIULMLTF-CYBMUJFWSA-N 334.416 1.734 10 10 EDCE CCOc1ccc(C(=O)NCC(=O)NCc2c(O)cccc2F)cc1 1645045833 JFZTVHCPWNSDDP-UHFFFAOYSA-N 346.358 1.976 10 10 EDCE CC[C@@H](CNC(=O)Cn1cncn1)NCc1ccc(OC)c(C)c1 1665882847 DTYRRNBAHPNPND-HNNXBMFYSA-N 331.420 1.280 10 10 EDCE CC[C@@H](CNC(=O)c1c[nH]c(=O)cn1)NCc1ccc(OC)c(C)c1 1665834771 QOLUXILLKNFCOG-AWEZNQCLSA-N 344.415 1.385 10 10 EDCE CCOC(=O)C1CCN(C(=O)CNCc2ccc(N(C)C)cc2)CC1 1857865276 DVOHPWQJTULCQO-UHFFFAOYSA-N 347.459 1.644 10 10 EDCE O=C(N[C@]1(c2cc(O)nc(O)c2)C[C@@H]1C(=O)O)OCc1ccccc1 1952976959 YCBZDOCFEKPMGZ-PXAZEXFGSA-N 344.323 1.719 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)N1CC(N=[N+]=[N-])C1 1985100762 IMCVFXMYEQTPHR-LLVKDONJSA-N 325.369 1.534 10 10 EDCE Cn1cc([C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCN=[N+]=[N-])nn1 2010397077 QYFPLPAFJAKQNA-SNVBAGLBSA-N 338.372 1.198 10 10 EDCE C[C@@]1(CO)CN(c2ccc(CN)c(Br)c2)C[C@@]1(C)CO 704788898 PAXBTVIQMRSHHP-GJZGRUSLSA-N 343.265 1.725 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(CNCc2cccc(O)c2O)CCOC1 688918428 YVYZXGTVHJQNPO-KRWDZBQOSA-N 338.404 1.871 10 10 EDCE CC1(C)[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 380770031 QBUWLPMEVFGTNQ-VXGBXAGGSA-N 340.221 1.751 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCc4ccccc4OC3)c2n1 2065151156 VDJSSWGZMPHBCT-CYBMUJFWSA-N 338.367 1.867 10 10 EDCE CN(C)C(=O)c1cnn(Cc2ccc(Br)cc2O)c1O 2070581134 YPGDWCOGFQDEMI-UHFFFAOYSA-N 340.177 1.807 10 10 EDCE OCc1ccc(N2C[C@H](O)[C@@H](O)CC23CCC3)cc1Br 2169919836 DUGDSTPTLCZEKH-KBPBESRZSA-N 342.233 1.796 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C1(CCO)CC1 2190079181 SVCBWJOOIBLVFP-GFCCVEGCSA-N 340.221 1.752 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)C(F)(F)F)CN1C(=O)Cc1ccc(N)cc1 2044625731 YMPRWTCWMFLMMG-MFKMUULPSA-N 343.349 1.869 10 10 EDCE CN[C@@H](c1ccc2c(c1)CCN2C)C1(O)CN(C(=O)OC(C)(C)C)C1 2044748051 LRVHGVYLHNZSHE-INIZCTEOSA-N 347.459 1.921 10 10 EDCE CN(C)c1ccc([C@@H](O)[C@H](N)c2nn(C)nc2Br)cc1 2235740419 OLUUVMKGKJXUTO-ZYHUDNBSSA-N 340.225 1.377 10 10 EDCE CCn1nnc(CNCc2c(Br)ccc(OC)c2O)n1 2236054338 HKBAADIFGJJPKY-UHFFFAOYSA-N 342.197 1.460 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@H](O)CC2)cc1Br 2284552532 PAAPKYDYJHTCGX-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE Cc1nnc(COC(=O)C=Cc2ccc(N3CCOCC3)cc2)n1C 2297507156 GHIBPLRSIWXSKX-UHFFFAOYSA-N 342.399 1.717 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@H](O)CN(C(=O)OC(C)(C)C)C1 2300531862 MZUKGCMUIUBGMU-RYUDHWBXSA-N 341.412 1.763 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N[C@@H]1CC(=O)N(CC(F)(F)F)C1 2307987814 MQHHMQBZVJDPEL-SNVBAGLBSA-N 344.289 1.390 10 10 EDCE CN(C)C1CCN(CCNC(=O)C=Cc2ccc(O)c(O)c2)CC1 2308001777 OIWHGIWSXQEJKA-UHFFFAOYSA-N 333.432 1.253 10 10 EDCE CC(C)S(=O)(=O)N(C)NCc1cc(Br)ccc1O 2317455759 STPHPRQPPIULQT-UHFFFAOYSA-N 337.239 1.829 10 10 EDCE Cc1ccc(CN[C@H]2CCC[C@@H](O)[C@H]2O)c(O)c1Br 2352669252 CBLMQUWASXWXBA-WDMOLILDSA-N 330.222 1.827 10 10 EDCE CO[C@@H]1CNC[C@@H](NCc2ccc(C)c(Br)c2O)C1 2352942197 AZVXDEKVLSUNIE-RYUDHWBXSA-N 329.238 1.930 10 10 EDCE CCN(CC)CC(=O)N1CCN(Cc2cc3c(cc2O)CCC3)CC1 103461777 PSOUNAZTVGCSCF-UHFFFAOYSA-N 345.487 1.867 10 10 EDCE Nc1ccc(N(C(=O)C(=O)NCCCNC=O)c2ccccc2)cc1 170388775 GZJZEZUYXMKBFA-UHFFFAOYSA-N 340.383 1.186 10 10 EDCE Cc1cc(S(=O)(=O)NCc2ccccc2O)sc1C(=O)O 228403062 ISMZYRRDWNPHEZ-UHFFFAOYSA-N 327.383 1.939 10 10 EDCE COc1ccc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)c(O)c1 92045046 XLRPLLZQUVOYAI-HNNXBMFYSA-N 340.445 1.401 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)NCc2ccc(N(C)C)cc2)c1 254936100 HQGHQIYYMQGREW-TWGQIWQCSA-N 338.411 1.837 10 10 EDCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@H](C2CC2)O1 366507632 VOAKFVQFPPXFAF-BJOHPYRUSA-N 333.344 1.929 10 10 EDCE C[C@H]1CC[C@@](CO)(N(C)CC(=O)NCc2ccc(N(C)C)cc2)C1 299345816 PARRXLCKAKZIQR-HNAYVOBHSA-N 333.476 1.852 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CN[C@H]3[C@H]4CCC[C@H]43)CC2)cc1 819270928 LYWQNORMFJBJNG-FFGOWVMKSA-N 345.487 1.566 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CSC(=O)N3)C2)cc1 819582594 JRJDFHDFGAHMSX-BXUZGUMPSA-N 335.429 1.463 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)cc2N1 828948228 YZFKYTHFRISFCS-HFOBELJZSA-N 329.312 1.315 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N[C@H]1CCCC[C@@H]1O 588531494 MPPRGBCZGHAVBZ-ISRKCNITSA-N 330.428 1.956 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCC(F)(F)CO 588479803 MAQWELYCGBMQES-UTCJRWHESA-N 326.343 1.280 10 10 EDCE Cc1cccc2c1CCCN2C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 733990052 MOTMIBCCUFTSHU-MDZDMXLPSA-N 339.395 1.385 10 10 EDCE O=C(O)CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]1C1CCOCC1 911492136 CDDJMIVQVYGXHJ-LSDHHAIUSA-N 333.384 1.868 10 10 EDCE Cc1cc(CC(=O)N2CC[C@@H](CO)[C@@H](O)C2)c(C)n1-c1ccccc1 834321324 YFIAPELLBLLITO-LPHOPBHVSA-N 342.439 1.838 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)[C@@H](CN)c2ccc(F)cc2)cc1 841845796 DTLKJEZUJKLGIJ-ZWKOTPCHSA-N 344.434 1.750 10 10 EDCE C[C@H]1CNCC[C@H]1NC(=O)NCc1cc(Br)ccc1O 841989597 ZVRPVVUPEQZNFP-JOYOIKCWSA-N 342.237 1.952 10 10 EDCE O=S1(=O)CC[C@]2(CN(Cc3cc(Cl)cc(F)c3O)CCO2)C1 843425741 HNXRGMCUAPECRG-AWEZNQCLSA-N 349.811 1.574 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CC[C@H](C(=O)O)O3)C2)cc1 849182611 HAPSCASXDYKPQT-TUKIKUTGSA-N 334.372 1.022 10 10 EDCE O=C1N[C@H](CC2OCCO2)C(=O)N1Cc1ccc(N2CC=CC2)cc1 924685662 PCITUEIMSBLXBK-OAHLLOKOSA-N 343.383 1.246 10 10 EDCE C[C@H](NC[C@@H](O)CS(C)(=O)=O)c1cc2c(cc1O)CCCC2 927023871 JDQFVUVJFPCFKH-SMDDNHRTSA-N 327.446 1.327 10 10 EDCE O=C(COC1CC1)NCc1cc(NC(=O)COC2CC2)ccc1O 923129376 RTRGQEBJSOFBIZ-UHFFFAOYSA-N 334.372 1.305 10 10 EDCE O=C(OCCc1nnnn1-c1ccccc1)c1cccc(O)c1O 758571113 CMAIDDQOZKJBFE-UHFFFAOYSA-N 326.312 1.473 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3(CO)CCC3)C2)cc1 854299355 OSTPWAGDTPGRHF-AWEZNQCLSA-N 333.432 1.736 10 10 EDCE CCOC(=O)c1[nH]c(C)c(C=C2C(=O)N(C)C(=O)N(C)C2=O)c1C 863176713 AVLUQOLZMQESIH-UHFFFAOYSA-N 333.344 1.242 10 10 EDCE Cn1cccc1[C@@H]1CCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1118998211 ACCVGMLDQPJSCY-INIZCTEOSA-N 339.395 1.937 10 10 EDCE COCCOc1ccccc1NC[C@@H](O)CC1(O)CCOCC1 872210470 AOWQEAYFNVLROO-AWEZNQCLSA-N 325.405 1.416 10 10 EDCE C[C@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccccc1O 783535326 LVQURFXMJJBAGF-DZGCQCFKSA-N 328.416 1.968 10 10 EDCE C[C@@H]1OC[C@]2(CC[C@@H](CNC(=O)c3c(F)ccc(O)c3O)O2)[C@H]1C 899485991 XMUKHUMMANQJRV-IJZKUYQOSA-N 339.363 1.939 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3CC34CC4)cc2)CC1 894592114 HDXFRSSFQBXZPD-INIZCTEOSA-N 327.428 1.805 10 10 EDCE CCNC(=O)[C@H](C)NCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894381391 JRJXWSIFXXNYRS-JTQLQIEISA-N 335.379 1.718 10 10 EDCE C[C@H]1CO[C@@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 895780346 HWVSNGGHJJVDCF-RDTXWAMCSA-N 332.444 1.937 10 10 EDCE CS(=O)(=O)N1CCCC[C@H]1CNCc1cc(Cl)ccc1O 796512557 DFFGNOJMYCIUAT-ZDUSSCGKSA-N 332.853 1.949 10 10 EDCE COc1ccc(-n2cc(C(=O)NCc3ccc(O)c(O)c3)nn2)cc1 1150376768 CPOOTLPOUYNQAL-UHFFFAOYSA-N 340.339 1.617 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H](C)CC(N)=O)CC2)cc1C 1277132555 DUIKWDVMRFCRLV-ZDUSSCGKSA-N 333.432 1.254 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)c2cc[n+]([O-])cc2)cc1C 1328978787 UQKBCBTWAAXGBL-CABCVRRESA-N 343.427 1.934 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C[C@H]1F 1257535443 IOPQCXFCFXDMDC-SMDDNHRTSA-N 339.386 1.714 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC/C=C\CNC(=O)C(F)F)cc1 1501620937 ZNYNJEYUIPEMSA-NNTZTVAXSA-N 339.302 1.516 10 10 EDCE NCc1cc(F)c(N2[C@H]3CC[C@H]2C(=O)NC3)cc1Br 2115749167 YJNIRZTVZSRXSK-KWQFWETISA-N 328.185 1.514 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC3=C(CCC(=O)N3)C2)cc1 1453319994 PGVZVVQDUXOTIB-UHFFFAOYSA-N 327.344 1.859 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C2CCCC2)cc(OC)n1 1704003869 BHHFXYOYQNACAE-NSHDSACASA-N 335.404 1.524 10 10 EDCE CN(C)c1ccc(CNC(=O)COc2ccc(F)cc2C(N)=O)cc1 1473059788 NSDIORTUHIOIBU-UHFFFAOYSA-N 345.374 1.686 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)CO[C@H]3CCOC3)C2)cc1C 1713160639 RTUSRGHKKCEAOS-ULQDDVLXSA-N 348.443 1.546 10 10 EDCE CS(=O)(=O)C1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CCC1 1634669225 NRMRVJWWTKCCCN-UHFFFAOYSA-N 338.389 1.546 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2nc(C(F)(F)F)n[nH]2)c1 1634559114 LFYJPEQBCWZUPV-UHFFFAOYSA-N 329.282 1.837 10 10 EDCE CS(=O)(=O)CC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1635209266 ZZQSPRLBPIVWRI-UHFFFAOYSA-N 338.389 1.404 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H](CO)Cc1c[nH]c2ccccc12 1566497407 TVDZIKALUZQEQR-AWEZNQCLSA-N 340.379 1.841 10 10 EDCE CNS(=O)(=O)c1cc(C(=O)NCc2cccc(Cl)c2O)co1 1647830243 OTNIDBBHCQAUQG-UHFFFAOYSA-N 344.776 1.477 10 10 EDCE O=C(C[C@H]1CCS(=O)(=O)C1)NCc1c(O)ccc2ccccc12 1647788940 UZPQTPOASVJKMG-GFCCVEGCSA-N 333.409 1.986 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2c(C)ncnc2O)cc1C 1669644665 FTYORPHXXJBMLM-LBPRGKRZSA-N 344.415 1.716 10 10 EDCE CSCC(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1689452192 KUICHCNYVIJFGH-VIFPVBQESA-N 337.405 1.447 10 10 EDCE CCNCc1ccc(N2CCS(=O)(=O)CC2)cc1Br 233532975 OJUVLJMSKSRBRA-UHFFFAOYSA-N 347.278 1.793 10 10 EDCE CN(C[C@]1(Br)CC1(F)F)C(=O)c1cc(O)nc(O)c1 2137810328 YIDFNLKAVJWPGK-SNVBAGLBSA-N 337.120 1.738 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N(C)CCCN=[N+]=[N-] 1985095149 ZOKQRMWJSZEFGB-SNVBAGLBSA-N 331.373 1.617 10 10 EDCE NCc1cc(F)c(N2CC[C@H]3CC(=O)N[C@H]3C2)cc1Br 2145058403 TYFQYMKMORZSOE-UFBFGSQYSA-N 342.212 1.762 10 10 EDCE CC(C)(C)OC(=O)NCc1ncc(C(=O)N2CC(N=[N+]=[N-])C2)cn1 2010388792 GZACMPUOTKMYPU-UHFFFAOYSA-N 333.352 1.636 10 10 EDCE CN1CCO[C@@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@H]21 2154046977 AXCNVSWVOVJQRL-CHWSQXEVSA-N 345.212 1.809 10 10 EDCE NCc1ccc(N2CCN3C[C@@H](O)C[C@H]3C2)cc1Br 405256312 KQGTYTIVYFVNKM-STQMWFEESA-N 326.238 1.163 10 10 EDCE CCN(CCS(C)(=O)=O)c1ccc(CN)cc1Br 688594848 YHXYQJOIHATNIW-UHFFFAOYSA-N 335.267 1.779 10 10 EDCE CN(CCCCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 385234567 KCLUYHAOHUMLCY-GFCCVEGCSA-N 328.210 1.610 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@@H](CO)C2)cc1Br 396814197 UERQJWLPKASNPL-RULNRJAQSA-N 329.238 1.648 10 10 EDCE Oc1ccc(Br)cc1CN1CC(O)(C2CCNCC2)C1 2176935279 LPOUZYIKRYVJAF-UHFFFAOYSA-N 341.249 1.701 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)c(Br)c1 2190454888 WBKOJJOQHYHSTD-MGXFYRGHSA-N 342.233 1.965 10 10 EDCE COc1ccc(Br)c(CN2CCNC[C@@H]2C(=O)O)c1O 2236031612 HZFZGPKIDMYLMX-SNVBAGLBSA-N 345.193 1.022 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2COC[C@H]2OC)c1O 2227736787 LACQEIKUYHMTNM-ZYHUDNBSSA-N 332.194 1.667 10 10 EDCE CCCCN(C(=O)C=Cc1cn(C)c(=O)n(C)c1=O)c1ccccc1 2296582615 AYTGIAFJMIUBBR-UHFFFAOYSA-N 341.411 1.931 10 10 EDCE O=C(N[C@@H](CCO)COCc1ccccc1)c1ccc(O)c(O)c1 2303569640 VZOSDUKXAHKZCB-HNNXBMFYSA-N 331.368 1.795 10 10 EDCE COC[C@@H](N)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2352648092 INKUVQMKMFKHMN-SNVBAGLBSA-N 331.210 1.395 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnn4ccncc34)CC2)cc1 194999700 FPKLEKQSYITFCA-UHFFFAOYSA-N 337.383 1.700 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@H](CC(N)=O)C2)c([N+](=O)[O-])c1 367929017 UUBKYAWJXWSZGQ-OGOUPESXSA-N 333.344 1.483 10 10 EDCE Cc1cc(N2CCC[C@H](NCc3cc4c(cc3O)OCO4)C2)n(C)n1 365554254 JXINTVFUUVPKJH-AWEZNQCLSA-N 344.415 1.921 10 10 EDCE O=C1NC(=O)C2(CCN(Cc3cc(Cl)c(F)cc3O)CC2)N1 293738238 WZILRKXATRXEHC-UHFFFAOYSA-N 327.743 1.359 10 10 EDCE COC[C@@H](C(N)=O)N(C)C(=O)c1cc(C)ccc1-n1c(C)ccc1C 817936089 JYKKGBPJNBMHQP-KRWDZBQOSA-N 343.427 1.975 10 10 EDCE O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)C(F)(F)F 819358493 JFPLPLFUNCPURD-GFCCVEGCSA-N 340.292 1.814 10 10 EDCE C[C@H](NC(=O)C[C@@H](C)NC(N)=O)c1ccc(N2CCOCC2)cc1 847393919 RHWIKTOHMKBVGY-OLZOCXBDSA-N 334.420 1.147 10 10 EDCE CCN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCCOC1 846446273 ODMNOWOKHPSKOC-LBPRGKRZSA-N 342.417 1.405 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)C2C[C@H]3COC[C@@H](C2)C3=O)c1 740081614 FGWBJDZCEVRURZ-WODVXLOZSA-N 333.384 1.820 10 10 EDCE CO[C@@H](CS(=O)(=O)Nc1ccc(O)c(C)c1)C1CCOCC1 842584891 KUHXQIMPUWDXQZ-HNNXBMFYSA-N 329.418 1.884 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)Cc2cc(C3CC3)no2)cc1 852791283 FWOZVSNTMBAKQM-MRXNPFEDSA-N 328.416 1.977 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc(F)cnc3O)C2)cc1 857302205 JBEPPLHXKCHLAY-LBPRGKRZSA-N 331.347 1.944 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CSc3n[nH]c(C)n3)C2)cc1 855229685 BWYMHYQZBLULIA-LBPRGKRZSA-N 347.444 1.609 10 10 EDCE Fc1cc(CN[C@@H]2CN3CCC[C@H]2C3)cc(F)c1N1CCOCC1 926558793 IKPIJYOBUMESLV-WMLDXEAASA-N 337.414 1.985 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cc3cnn(C)c3C)C2)cc1 855227020 SOMCSIHIEVAVSE-HNNXBMFYSA-N 328.416 1.675 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cccnc3C(N)=O)C2)cc1 855225949 MJXNQSHFRJGDII-LBPRGKRZSA-N 340.383 1.198 10 10 EDCE CC[S@@](C)(=O)=NS(=O)(=O)N1CCOc2cc(N(C)C)ccc21 866899965 ZUZDGCVMQBGMKW-OAQYLSRUSA-N 347.462 1.314 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2cc(F)c(N(C)C)cc2F)CCO1 862463014 WMLUQMGTSXXWJP-LBPRGKRZSA-N 342.390 1.161 10 10 EDCE CCOc1ccc(O)c(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c1 872255556 ZBBLCFIWLVXUPS-LXZKKBNFSA-N 347.415 1.158 10 10 EDCE COc1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1OCCO 871204624 IBBCYLJEKPNWFY-UHFFFAOYSA-N 329.352 1.928 10 10 EDCE C[C@H](NS(=O)(=O)CCCS(C)(=O)=O)c1ccc(N(C)C)cc1 773084719 SEUUVLJREWBMBX-LBPRGKRZSA-N 348.490 1.168 10 10 EDCE COc1ccc(O)c(CNC(=O)C(=O)Nc2cnn(C)c2C2CC2)c1 770741925 MXXFPDDKAQOMDY-UHFFFAOYSA-N 344.371 1.267 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1(C(=O)NCC2CC2)CCCC1 1137067191 NXFKIWWZOBXLJN-UHFFFAOYSA-N 332.400 1.596 10 10 EDCE Nc1nc(Cl)c(N)c(NCc2ccc(N3CCC(O)CC3)cc2)n1 1307175257 KNFNKMOYRFJQNZ-UHFFFAOYSA-N 348.838 1.868 10 10 EDCE CC(=O)C(=O)[C@@]1(O)C[C@H](C(C)C)N(C(=O)OCc2ccccc2)C1 1892802281 ZIZWLJJDLAAJQQ-CRAIPNDOSA-N 333.384 1.943 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)Cc2cc[nH]n2)cc1C 1267121310 AOMFUFDGCMNSCE-AWEZNQCLSA-N 330.432 1.954 10 10 EDCE C[C@H](CNCc1cncn1C)NC(=O)c1ccc(N=NC(N)=O)cc1 1275046296 QNDNDLRFMKILKK-LLVKDONJSA-N 343.391 1.491 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(CO)c(C)o1 1451912138 GCRUPEFHNXWCCB-UHFFFAOYSA-N 347.367 1.991 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccc(=O)n(-c2ccccc2)n1 1299571537 YIGSGJWDNXCFEO-UHFFFAOYSA-N 337.335 1.574 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1CC12CC2)NC(=O)c1cc(OC)nc(OC)c1 1297496429 OSFDBIXIOXVHBH-STQMWFEESA-N 347.415 1.524 10 10 EDCE CCO[C@H](CC)C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1703120317 KMVZUYGQAQYQHZ-CYBMUJFWSA-N 349.391 1.510 10 10 EDCE CN1C(=O)O[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@H]21 2120399037 BDTAJDUSFAWJOH-ZYHUDNBSSA-N 327.178 1.790 10 10 EDCE COc1ccc(CNC(=O)c2nc(-c3cnccn3)no2)c(O)c1 1556354182 AZIDBBCVEGWEQS-UHFFFAOYSA-N 327.300 1.171 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cccnc2)cc1C 1717044187 RIROQEJKGPODJX-UHFFFAOYSA-N 343.427 1.623 10 10 EDCE C[C@H](NC(=O)[C@@H](c1cncn1C)N(C)C)c1ccc(N(C)C)cc1 1556260744 RNXOUDJOATXAJN-SUMWQHHRSA-N 329.448 1.966 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1ccc(N2CCOC2=O)cc1 1637033113 ITBRPRGUTDJIGB-UHFFFAOYSA-N 342.351 1.913 10 10 EDCE CC[C@@H](CNC(=O)c1nnn(C)c1C)NCc1ccc(OC)c(C)c1 1665770094 DGFWTNYKTMNFDM-HNNXBMFYSA-N 345.447 1.739 10 10 EDCE O=C(c1ccccc1)c1nc[nH]c1C(=O)NCc1cccc(O)c1O 1593739197 JHUSVVHXSJCVEU-UHFFFAOYSA-N 337.335 1.982 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCc1cn(C2CC2)c(=O)nc1O 1675595696 ZQVPSYZJCRGHRP-UHFFFAOYSA-N 344.371 1.331 10 10 EDCE CC(C)(C(N)=O)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1865784113 MCFWVPBCWFQTJE-UHFFFAOYSA-N 336.347 1.912 10 10 EDCE CN(C)c1ccc(CNC2(C(=O)O)CN(C(=O)OC(C)(C)C)C2)cc1 1913938120 SNFAKSFCGHLPAG-UHFFFAOYSA-N 349.431 1.916 10 10 EDCE CN(C[C@@H](O)COCc1ccccc1)c1ccc2c(c1)NC(=O)[C@H]2N 1916368730 HRZXWKJEOKQSBP-QAPCUYQASA-N 341.411 1.652 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@]1(C)CC(=O)N1 1952208960 PBCSRURWBNWKRI-SUMWQHHRSA-N 336.388 1.812 10 10 EDCE COc1cc(C=C2SC(N3CCOCC3)=NC2=O)cc2c1OCO2 2040481399 QDDUKFFMQIZZJH-UHFFFAOYSA-N 348.380 1.726 10 10 EDCE CC1(C)CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C[C@@H]1O 387973577 MHSFZJQOAZGUCW-NWDGAFQWSA-N 340.221 1.608 10 10 EDCE CCCN1CCC(N(C)C(=O)c2cnn3c(O)cc(C)nc23)CC1 2063054846 OXCZSNXIFXCEHO-UHFFFAOYSA-N 331.420 1.690 10 10 EDCE CN(c1ccc(CN)cc1)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C[C@H]1O 1906403911 QEBUPQYMDIYCSS-FVQBIDKESA-N 335.448 1.998 10 10 EDCE C[C@H](O)[C@H]1CCCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2193600669 ZOCAZPYTPVTWIA-HOCOFYGGSA-N 340.221 1.751 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@]1(NC(=O)OC(C)(C)C)C[C@@H](O)C1 2073264958 XNNWLTIYWZYYIR-UJKQEGAGSA-N 349.431 1.645 10 10 EDCE CC1(C)CC[C@H](COc2nnc(=N)[nH]n2)N(C(=O)OC(C)(C)C)C1 2213780834 KTCMWAQLVFRJTP-SNVBAGLBSA-N 338.412 1.484 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)CC[C@@H]1C(=O)NCCCCN=[N+]=[N-] 2246447282 OVKDXZQBADPJJU-NWDGAFQWSA-N 341.412 1.954 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@H](O)CC2)cc1Br 2269120764 HALXVVGKTXCJIX-QCZZGDTMSA-N 329.238 1.791 10 10 EDCE Cc1ccc(CNC(=O)CC[C@H](O)CN)c(O)c1Br 2352637471 KUMPZXWCDHKDNJ-JTQLQIEISA-N 331.210 1.179 10 10 EDCE Cc1nc2n(n1)CCC[C@H]2NC(=O)NCc1ccc(N(C)C)cc1 81163623 NZWKDTGMVXLEMD-OAHLLOKOSA-N 328.420 1.987 10 10 EDCE CC[C@@H](C)[C@@H](NC(N)=O)C(=O)NCc1ccc(N2CCCC2)cc1 41365557 KSEASRGZPPBDEI-CZUORRHYSA-N 332.448 1.986 10 10 EDCE Cc1ncc(CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)s1 285391109 IBTSQYIECPPRNX-UHFFFAOYSA-N 346.456 1.792 10 10 EDCE CCN(C)C(=O)CNC(=O)NCc1cc(Br)ccc1O 805309355 LLOOJUHKHMGIBH-UHFFFAOYSA-N 344.209 1.432 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NCC3(CCO)CC3)C2)cc1 824687983 VKJQEMLANRPCNU-HNNXBMFYSA-N 347.459 1.983 10 10 EDCE COc1ccc(CNC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)c(O)c1 832178669 VTTHLNXLDNBMMA-DHSIGJKJSA-N 334.416 1.550 10 10 EDCE Cn1nccc1[C@@H](CO)NC(=O)NCc1ccc(N2CCCC2)cc1 837625507 OMGPSASMANEFBM-MRXNPFEDSA-N 343.431 1.553 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](CNC(=O)Cc1ccc(N)cc1)C2 831754321 ZGFKFTZQNHCUPP-DZKIICNBSA-N 331.416 1.794 10 10 EDCE CC[C@@H]1CN(C(=O)NCCc2ccc(N)cc2)C[C@@]2(CCOC2)O1 841959699 OXUFCFAMNLJNPX-SJLPKXTDSA-N 333.432 1.791 10 10 EDCE CCN(CCc1nccs1)Cc1cc(O)n2ncc(C(=O)O)c2n1 846253943 MEGPRTLELNABOT-UHFFFAOYSA-N 347.400 1.654 10 10 EDCE CN1CCCc2cc(CNC(=O)N[C@H]3CNCCC3(F)F)ccc21 841760653 XJBXQIRVVUWODI-HNNXBMFYSA-N 338.402 1.865 10 10 EDCE CN1CC[C@@H](C(=O)NCc2ccc(O)c(O)c2)[C@@H](c2cnn(C)c2)C1 849562761 HAGGHNOAXPGMOO-HUUCEWRRSA-N 344.415 1.183 10 10 EDCE CCOC[C@@H]1C(=O)N([C@@H]2CCN(c3ccc(OC)cc3)C2)C(=O)N1C 849358450 WFSIMDGVXCNMBX-GDBMZVCRSA-N 347.415 1.573 10 10 EDCE O=C(O)CCCN1C(=O)/C(=C\c2cnn3c2CCC3)SC1=S 849177107 YZWVQRCVPFWQTN-YRNVUSSQSA-N 337.426 1.895 10 10 EDCE C[C@]1([C@H]2CCCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)COC(=O)N1 928022336 DDLBLYZPBCXBCE-GIFUJIIWSA-N 346.383 1.848 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](CO)[C@@H](c2cc(O)c(O)cc2O)C1 687742606 DWOWNNLRVPUJEL-ONGXEEELSA-N 325.361 1.746 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N3CC(C(=O)O)C3)C2)cc1 857101389 VNZHNBUIFTXCMF-LBPRGKRZSA-N 333.388 1.248 10 10 EDCE Cc1nn(C)c(C)c1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 754480765 AIMLTBBWTLCDBS-UHFFFAOYSA-N 343.431 1.700 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CNC(=O)c2ccccc21 860697279 RLMYVXPYXBUQIU-NHYWBVRUSA-N 340.379 1.672 10 10 EDCE Cc1nc(N(C)C)nc(N(C)Cc2ccc(N3CCOCC3)cc2)n1 768517295 MMMAOSIPWVUWNC-UHFFFAOYSA-N 342.447 1.719 10 10 EDCE C[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC2(CCCC2)O1 1118954996 JDLLBIHCSOAPPV-ZDUSSCGKSA-N 344.411 1.795 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](C(F)F)C3)nc12 761113909 RORVSMOAEGHCGN-SECBINFHSA-N 340.330 1.699 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2C[C@H]3CC[C@H]2C3)cc1F 1321934434 AACZMVRMQNVLQR-CORIIIEPSA-N 333.407 1.813 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@H]1CCOC1 1269517398 XDBMOKJLNVUOSU-TZMCWYRMSA-N 347.419 1.984 10 10 EDCE CO[C@@H](C)C(=O)N[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1284040718 CKUADVJCXNXIIS-XDTLVQLUSA-N 347.375 1.261 10 10 EDCE NC(=O)[C@H]1CC[C@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)O1 1445981128 DANBSPWCYFDGBY-LDYMZIIASA-N 336.369 1.075 10 10 EDCE O=S1(=O)N[C@H]2CN(Cc3ccccc3O)C[C@@H]2Oc2ccccc21 1615259760 KLOADSRRJZYTRJ-BBRMVZONSA-N 346.408 1.316 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1CCN(C)C1=O)NCc1ccc(OC)c(C)c1 1481841911 DUZXWNUAVUXSLB-JKSUJKDBSA-N 347.459 1.466 10 10 EDCE COC(=O)c1cnn(CC(=O)NCc2c(O)ccc3ccccc23)c1 1558554543 LEXBPEJEZUIVRE-UHFFFAOYSA-N 339.351 1.845 10 10 EDCE N[C@@H]1CCN(Cc2cc(Br)cc(F)c2O)C[C@@H]1CO 2122373845 GDZZIZRMBAQUON-BXKDBHETSA-N 333.201 1.435 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2cccc(-c3nc(=O)o[nH]3)c2)c1 1557553381 WHXANSQFHHNAFO-UHFFFAOYSA-N 325.324 1.974 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)=C[C@@H]1O 1908916883 JFIGNDNGJRRSDC-UTUOFQBUSA-N 337.380 1.482 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCCN(Cc2cscn2)CC1 1632327683 LBTLRBZITUIDHG-UHFFFAOYSA-N 347.440 1.831 10 10 EDCE COc1ccc(CNC[C@H]2CC[C@H](NC(=O)CNC(C)=O)C2)cc1C 1571527788 DZQOWQOPYIJLIV-IRXDYDNUSA-N 347.459 1.514 10 10 EDCE CCc1noc(COCC(=O)NCc2ccc3cccnc3c2O)n1 1643284954 NOJDFGALXJRMQW-UHFFFAOYSA-N 342.355 1.719 10 10 EDCE CO[C@@H]1C[C@H](C(=O)O)N(Cc2cc(Br)ccc2O)C1 1964720595 MAFANAUHVXQNHX-GHMZBOCLSA-N 330.178 1.829 10 10 EDCE COc1ccc(-n2nnnc2CN[C@H](CCNC(C)=O)C(C)C)cc1 1676145106 UXYACQWNZXYLGM-MRXNPFEDSA-N 346.435 1.311 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C[C@@H]2CCC(=O)NC2)cc1C 1699365049 BIATVIRUVNTLHF-ZBFHGGJFSA-N 347.459 1.514 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cc2nnc(C)o2)cc1C 1699253782 XOWKZEDSYAPJJX-SNAWJCMRSA-N 344.415 1.700 10 10 EDCE Cc1nc2c(C(=O)O)cnn2c(O)c1Cc1ccc([N+](=O)[O-])cc1 105373268 OWQZNJIUEFTSSJ-UHFFFAOYSA-N 328.284 1.941 10 10 EDCE Nc1ccc(OCCN2CCC(NC(=O)C(F)(F)F)CC2)cc1 586049774 RIKPDHJAJMDGBK-UHFFFAOYSA-N 331.338 1.791 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H](CN(C)C)NC(=O)OC(C)(C)C 1900612189 FCRQVRNCYINZFL-NSHDSACASA-N 328.417 1.600 10 10 EDCE CNCc1ccc(N2CCS(=O)(=O)C[C@@H]2C)cc1Br 234454136 VTAYWNINNRBVOT-JTQLQIEISA-N 347.278 1.792 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCCN=[N+]=[N-] 1985096616 UIINXHFQHKMYCX-LLVKDONJSA-N 328.417 1.648 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C1(N(C)C(=O)OC(C)(C)C)COC1 1985101061 NJULQJQNNLJOQS-UHFFFAOYSA-N 327.385 1.781 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCc2ccc(N)cc2)[C@H](CO)C1 1999482738 DAFZMPLFTZTRRS-INIZCTEOSA-N 335.448 1.725 10 10 EDCE CC(C)(CNC(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 2015122746 NELRKBPSSLDTQT-UHFFFAOYSA-N 340.376 1.837 10 10 EDCE CS(=O)(=O)CC1CN(c2ccc(CN)cc2Br)C1 2041503038 NQYJOQYPOWHZQI-UHFFFAOYSA-N 333.251 1.389 10 10 EDCE NCc1ccc(N2CC(N3CCCC3=O)C2)c(F)c1Br 2182223880 YNQXHHVLBWOAQP-UHFFFAOYSA-N 342.212 1.858 10 10 EDCE CN1CCc2cc([C@H](O)CN3CC(NC(=O)OC(C)(C)C)C3)ccc21 2050171159 RPLKGDMCVHXFKH-QGZVFWFLSA-N 347.459 1.921 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2CN3C(N)=O)c(Br)c1 2192279363 PDCCHHDTYDDICJ-MIMYLULJSA-N 340.221 1.844 10 10 EDCE NCc1ccc(N2CC3(C2)OCCC[C@@H]3O)c(Br)c1 2103409982 ZYEBWJUWNYNHLN-ZDUSSCGKSA-N 327.222 1.638 10 10 EDCE CC(C)(C)OC(=O)N1CCC([C@H](F)COc2nnc(=N)[nH]n2)CC1 2213787054 GHXRVWZSVMBHCC-SNVBAGLBSA-N 342.375 1.043 10 10 EDCE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)Cn1cc(Br)ccc1=O 2234175285 BAVFICTWZYNKRB-ZJUUUORDSA-N 340.181 1.958 10 10 EDCE COc1ccc(N2C[C@@H](CO)C[C@H]2CO)c(OC)c1Br 2234894447 UCKYZZWOSVNVNM-UWVGGRQHSA-N 346.221 1.646 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](C(=O)NCCN=[N+]=[N-])CO1 2242735626 VSTJFDVVNLKPPX-WDEREUQCSA-N 327.385 1.733 10 10 EDCE CO[C@@H]1CCN(CCNCc2cc(Br)ccc2O)C1 2267895171 KETCDOFEWCAJPE-CYBMUJFWSA-N 329.238 1.965 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N[C@H]1CCCCNC1=O 2297505266 MGTXATPOUKTRCT-KRWDZBQOSA-N 343.427 1.321 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N[C@@H]1C[C@H]2CC[C@@H]1O2 2297581097 AFSMSRGTAMNKIZ-KURKYZTESA-N 328.412 1.973 10 10 EDCE CC(=O)N1CC[C@@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 175267621 ZZSKMBOPEALJPF-SJORKVTESA-N 346.427 1.768 10 10 EDCE CN(C)c1ccc(CNC(=O)NCCCN2CCOC2=O)cc1F 170833745 IINAAXNZLDDLQX-UHFFFAOYSA-N 338.383 1.533 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)N1C[C@@H](CO)OC[C@H]1C 305135651 KTSYJUOGDAEDKV-YPMHNXCESA-N 329.356 1.472 10 10 EDCE CC(=O)N1CCC(NCc2ccc(N3CCOCC3)c(F)c2)CC1 79745783 VBRWJAZANKOJKY-UHFFFAOYSA-N 335.423 1.763 10 10 EDCE CC[C@@H](C)[C@H](NC(N)=O)C(=O)N1CCN(c2ccc(OC)cc2)CC1 70719007 ADEZDWWAPUGKIT-CJNGLKHVSA-N 348.447 1.427 10 10 EDCE COCCN1CCCN(Cc2cc(F)cc(C(C)=O)c2O)CC1=O 190811190 FPYBALJENBZRIN-UHFFFAOYSA-N 338.379 1.415 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C[C@@H](O)COC[C@H]1CCCO1 245647483 UIFOONYCICTPIF-HZPDHXFCSA-N 336.432 1.508 10 10 EDCE CCn1ncc(CN2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)n1 530198325 UZJWLSUIWJXMTJ-UHFFFAOYSA-N 349.778 1.621 10 10 EDCE CCOCc1nc([C@@H](C)NC(=O)/C=C/c2ccc(O)c(O)c2)no1 291844616 HDIVTFPOAZXAJI-BREXMAIKSA-N 333.344 1.908 10 10 EDCE CNS(=O)(=O)C1CCN(Cc2cc(Cl)c(F)cc2O)CC1 295066927 AMMVCJVEZBDNKF-UHFFFAOYSA-N 336.816 1.698 10 10 EDCE CC(=O)C(=O)CSc1nnc(Cc2cccc3ccccc23)n1N 808009827 AJCSUFCTCZKPFS-UHFFFAOYSA-N 340.408 1.986 10 10 EDCE C[C@H](NC(=O)C(=O)N1CCO[C@H](C2CC2)C1)c1ccc(N(C)C)cc1 807677693 RTRQSCUSLFRWOU-GUYCJALGSA-N 345.443 1.567 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C)[C@H](C)CO)C2)cc1 824354784 RCKVPQJNQWHVTG-QLFBSQMISA-N 335.448 1.838 10 10 EDCE CN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1ccc2ccccc2c1 490553139 YTSYZRSVFUEPTP-LUAWRHEFSA-N 349.390 1.913 10 10 EDCE COc1cc(O)c(CN2CCOC3(CCN(C)CC3)C2)cc1OC 843431361 CYOOWDKYNYYNNT-UHFFFAOYSA-N 336.432 1.706 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CN1CC(C)(C)C1 848231470 CIUVZUSVQQKFJL-UHFFFAOYSA-N 334.416 1.626 10 10 EDCE COC(=O)CNC(=O)[C@@H]1CCCN1Cc1cc(Cl)cc(C)c1O 841892622 OLQMXGNPLIINPR-ZDUSSCGKSA-N 340.807 1.608 10 10 EDCE CCn1ccc(CC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1 855222851 BKXXILKXIGBSOW-OAHLLOKOSA-N 328.416 1.849 10 10 EDCE CNC(=O)[C@@H](NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)C(C)C 852220701 HFSFVHYAVZYJLE-CJNGLKHVSA-N 348.447 1.344 10 10 EDCE CNC(=O)CCCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852185747 SXRZREKJAOWZGO-CYBMUJFWSA-N 334.420 1.099 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCO[C@H](CC(F)(F)F)C2)cc1 850865706 RYSLEQWWEWDTLX-LLVKDONJSA-N 331.294 1.387 10 10 EDCE COCn1ccc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)n1 855224442 GBVBVQCWURJJMV-ZDUSSCGKSA-N 330.388 1.504 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CNCC[S@@](=O)CC(F)(F)F)c1 850347899 ABOAEBDMQCLLNV-OAQYLSRUSA-N 326.296 1.701 10 10 EDCE COc1ccc(N2CCN(CCO[C@H]3CCOC3)CC2)c(OC)c1 931530821 QIXOPLPKQPQQMO-INIZCTEOSA-N 336.432 1.631 10 10 EDCE O=C(COC(=O)c1ccn(C2CCOCC2)n1)c1ccc(O)c(O)c1 860394938 WHOXNVQAOAWFNQ-UHFFFAOYSA-N 346.339 1.686 10 10 EDCE CC(=O)c1cc(F)cc(Cn2cc(C[C@@H]3CCCNC3)nn2)c1O 880996232 RHSUZSHKGDIEQH-LBPRGKRZSA-N 332.379 1.916 10 10 EDCE C[C@@H](NC(=O)N(C)CC1(CO)CC1)c1ccc(N2CCOCC2)cc1 782950751 TUJJRGVOEIRAQH-OAHLLOKOSA-N 347.459 1.998 10 10 EDCE COC(=O)c1c(CN2CC[C@](C)(C(N)=O)C2)c2cc(F)ccc2n1C 894637718 PKUDJZCKEWGPTA-SFHVURJKSA-N 347.390 1.801 10 10 EDCE Cc1cc(CC(=O)N[C@H]2C[C@H](O)[C@H](O)C2)c(C)n1-c1ccccc1 1303821678 ADYRJPWLUDDOOA-XGWQRUHWSA-N 328.412 1.637 10 10 EDCE CNC(=O)NCCCNCc1c(Br)ccc(OC)c1O 1964069691 BAJGTZLQATXIHT-UHFFFAOYSA-N 346.225 1.572 10 10 EDCE C[C@H]1C[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1321705452 CPCBGDBLQZISFU-JSGCOSHPSA-N 349.406 1.051 10 10 EDCE CC(C)(C)c1cc(C(=O)NCc2cc(O)ccc2O)nc2ncnn12 1176747998 HGQJYMYWJWVLCQ-UHFFFAOYSA-N 341.371 1.763 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2ccc[nH]2)cc1C 1325980003 MDZOEJNJBSVIQA-UHFFFAOYSA-N 331.416 1.556 10 10 EDCE CNCc1ccc(N(C)C[C@H](O)CN(C)C)cc1Br 690234417 RJRIABARGYFPRW-CYBMUJFWSA-N 330.270 1.527 10 10 EDCE COc1ccc(CN[C@@H]2CCN(C(=O)CN(C)C(C)=O)[C@H]2C)cc1C 1331859369 HMSJYAUGUWPSHP-WMLDXEAASA-N 347.459 1.561 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2cnnn2C)cc1C 1267980759 XLWJQOQGQDQRHA-GFCCVEGCSA-N 331.420 1.288 10 10 EDCE c1c[nH]c(N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)n1 1341373031 AFKMBRFHASIIEL-UHFFFAOYSA-N 327.432 1.569 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)c2cnnn2C)cc1C 1274713954 ITEKOJPMKNLSKW-ZDUSSCGKSA-N 331.420 1.430 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CC[C@@H](C(N)=O)C3)C2)cc1 1276832663 YOXRPGCTTWQRAI-KFWWJZLASA-N 345.443 1.539 10 10 EDCE COC(=O)c1cnn(CC(=O)Nc2c(Cl)ccc3nonc23)c1 1525081695 VITDPZGAVKEUSK-UHFFFAOYSA-N 335.707 1.498 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccnc(N2CCCCC2)n1 1456234010 HHXUWNLFORKQKN-UHFFFAOYSA-N 328.372 1.808 10 10 EDCE NC(=O)[C@H]1OCC[C@H]1NCc1cc(Cl)cc(Br)c1O 2117460407 PTDBBSJRLXFHKN-KOLCDFICSA-N 349.612 1.541 10 10 EDCE O=C(CO)NCCC(=O)N(Cc1ccco1)Cc1ccccc1O 1545496336 HPQQWJIVEMSJIY-UHFFFAOYSA-N 332.356 1.013 10 10 EDCE O=C1NC[C@]2(CCN(c3ccc(CO)cc3Br)C2)N1 2121183801 NEJFCDMRFPLCRR-ZDUSSCGKSA-N 326.194 1.203 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)/C=C\c2ccco2)cc1C 1485970912 WPAFAQPSBXFOQB-IOBAAEILSA-N 344.411 1.877 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CC2OCCCO2)cc1C 1714227361 AOOWVNFXKKEFFT-CQSZACIVSA-N 336.432 1.751 10 10 EDCE C[C@@H]1CN(c2ccc(CO)cc2Br)C[C@H](CCO)O1 2122800629 REGTWRAWSTVXIC-PWSUYJOCSA-N 330.222 1.918 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@@H]2CCN(C)[C@@H]2C)cc1C 1491457829 VGYZISOHRJAWCU-ZMSDIMECSA-N 333.476 1.938 10 10 EDCE C[C@@H](NC(=O)c1ccn(CCn2cccn2)n1)c1ccccc1O 1632246684 KUDUIGFUBXUKJI-CYBMUJFWSA-N 325.372 1.976 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)Cc2cnc[nH]2)C2CC2)cc1C 1566722732 OHOHOJIAGBIQDQ-KRWDZBQOSA-N 342.443 1.954 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C(C)(C)NC(C)=O)cc1C 1662366875 KVJYEHVEMILOQH-ZDUSSCGKSA-N 335.448 1.513 10 10 EDCE CC/C=C(\C)C(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1688013420 MKAIUKPDNTVHKY-LQGRVKISSA-N 347.415 1.832 10 10 EDCE O=C(NCc1nc2ncccn2n1)NCc1cccc(Cl)c1O 1682097007 GXXJEQNXINLAFN-UHFFFAOYSA-N 332.751 1.483 10 10 EDCE COc1ccc(Br)c(CNCC[C@]2(O)CCOC2)c1O 1965961699 HFBXSYPSLIVYDU-AWEZNQCLSA-N 346.221 1.794 10 10 EDCE C[C@@H](O)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccsc2)SC1=S 1858595980 KZNJOTIHVBKYSP-GQNMAZTHSA-N 329.424 1.783 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc(N)c(O)c3)CC2)cc1 392241983 OEGLUDUBHSBZTB-UHFFFAOYSA-N 327.384 1.945 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H](O)[C@H]2CF)c(Br)c1 2140661769 IQBHUJYZLWGZPE-GUQKDYTMSA-N 333.201 1.349 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985103545 XAGBUYAYDOGFRV-GMTAPVOTSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)NC1(CNC(=O)Nc2ccc(N)cc2)COC1 1999156728 CJEIBQUZKGBREL-UHFFFAOYSA-N 336.392 1.684 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010390423 DEQNYXAVGYUCHR-IJLUTSLNSA-N 339.396 1.970 10 10 EDCE COc1ccc([C@H](C)N[C@H](CO)CNC(=O)OC(C)(C)C)c(O)c1 2011424307 HAGZLJDNCHEODA-RYUDHWBXSA-N 340.420 1.937 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)CNCc1cc2c(cc1O)OCO2 2011516863 PFIGAFUTFCMBMI-NSHDSACASA-N 340.376 1.096 10 10 EDCE CNC(=O)CN(Cc1ccccc1)C(=O)c1cc(O)c(O)c(O)c1 2015120811 XFKMYDOIZYJGAZ-UHFFFAOYSA-N 330.340 1.192 10 10 EDCE C[C@H](CO)CN(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 688701409 VRQNAXBIFNJAHE-MADCSZMMSA-N 329.194 1.499 10 10 EDCE C[C@@H](CO)CN(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 688701406 VRQNAXBIFNJAHE-JMCQJSRRSA-N 329.194 1.499 10 10 EDCE OCc1ccc(N2CCC[C@@H](CO)[C@@H]2CO)cc1Br 710091399 OCOLNCAUHKBRCA-FZMZJTMJSA-N 330.222 1.511 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)NCc2ccc(N)cc2)CC(O)C1 2080843745 VNIPVHCYUWURON-UHFFFAOYSA-N 349.431 1.551 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@@]4(CO)C3)c(Br)cc2[C@@H]1O 2200842854 ALWAGYHDFYHEBU-UEXBWHTRSA-N 339.189 1.253 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CO[C@H]3COC[C@@H]23)c1O 2236055649 QVWSTRRRERQONX-NDMJEZRESA-N 344.205 1.667 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](O)C[C@@H]2C(=O)O)c1O 2236037595 KGZILEOEGMVBFG-GMSGAONNSA-N 346.177 1.183 10 10 EDCE CN(Cc1cc(Cl)cc(Br)c1O)CC1(O)CNC1 2259129409 BYLXKDCJOULSMU-UHFFFAOYSA-N 335.629 1.574 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]12CO[C@H](C1)[C@H](NC(=O)OC(C)(C)C)C2 2298331343 FAABWIPQJXOWNB-HFAKWTLXSA-N 339.396 1.827 10 10 EDCE COC(=O)c1sccc1S(=O)(=O)NCCc1ccc(N)cc1 171531582 BLCXEZHMOHSYSX-UHFFFAOYSA-N 340.426 1.638 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2357586404 YFKFCLWSRRRWMZ-FWYKCERLSA-N 341.249 1.789 10 10 EDCE COc1ccc(CNC[C@@]2(CO)COCC3(CCC3)N2C)cc1C 527752408 GHHJJNJSXQWMLC-LJQANCHMSA-N 334.460 1.709 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C=C[C@H]2C(=O)O)c(O)c1Br 2380721467 KUCBECGDDKUTTA-NXEZZACHSA-N 340.173 1.966 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)NCc1nc(COC)n[nH]1 821177087 GISVRTHTOFWJKO-UHFFFAOYSA-N 333.392 1.779 10 10 EDCE CCS(=O)(=O)C1(CNC(=O)NCc2cccc(OC)c2O)CC1 823224043 FSHGIQQYRUXFTI-UHFFFAOYSA-N 342.417 1.167 10 10 EDCE Cn1ncc(C(=O)O)c1C(=O)NCCCSc1nccs1 901719285 BDRWDSHRLPCEST-UHFFFAOYSA-N 326.403 1.487 10 10 EDCE CN(C)c1ccc(/C=C\CN[C@@H]2CCCN(S(C)(=O)=O)C2)cc1 835037632 RRKYRZGHVHAOAH-DQOPKJQZSA-N 337.489 1.779 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CC[C@H]2C[C@H]2C1 834770357 HOHKVULFUHJTRA-CWRNSKLLSA-N 329.444 1.982 10 10 EDCE COc1cc(Br)cc(CN2CC(C)(C(N)=O)C2)c1O 843415563 JAOXQZORBVEYSE-UHFFFAOYSA-N 329.194 1.471 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@H]3[C@H](N(C)C)[C@H]3C2)c([N+](=O)[O-])c1 858562572 NOBCCLQOPLJAAS-JLEWQEJHSA-N 331.372 1.777 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCCn3cccn3)C2)cc1 851973047 YCLGXXNSLCAREB-OAHLLOKOSA-N 343.431 1.860 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3ccon3)C2)cc1 850537761 UCBKBYIFHMJTIT-NSHDSACASA-N 330.344 1.017 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)COc3cc(C)on3)C2)cc1 855228896 HMYFFUOCJVGYEN-CYBMUJFWSA-N 331.372 1.766 10 10 EDCE COC(=O)[C@@](C)(CCF)NCC(=O)NCc1ccc(N(C)C)cc1 852579152 XWDJFWLZRBCDIF-QGZVFWFLSA-N 339.411 1.250 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnn(CCF)c3)C2)cc1 855225701 LOPVCRUCJKJUEX-AWEZNQCLSA-N 332.379 1.870 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCC[C@H]3C[C@@H]32)c1 855775941 ONBNEBQQQJFWIR-GVXVVHGQSA-N 338.429 1.930 10 10 EDCE O=C(NCc1cccc(Br)c1O)[C@H](O)C1CCOCC1 765751145 PREZTBCCEJPZEA-CYBMUJFWSA-N 344.205 1.558 10 10 EDCE CNC(=O)c1cccc(OCC(=O)NCCc2ccc(O)c(O)c2)c1 762263198 AZOWNJPGABFDAU-UHFFFAOYSA-N 344.367 1.195 10 10 EDCE COCC(O)(CNCc1c(O)cccc1Br)COC 1875697110 TUUUTLJDMFDNSZ-UHFFFAOYSA-N 334.210 1.268 10 10 EDCE NCc1ccc(N2CCO[C@H]3COC[C@H]32)c(F)c1Br 1877648960 UNNIARFFDQEDGS-MNOVXSKESA-N 331.185 1.651 10 10 EDCE C[C@H](NC(=O)NCCC1CS(=O)(=O)C1)c1ccc(N(C)C)cc1 786817246 SYASLDIMFWAAEI-LBPRGKRZSA-N 339.461 1.548 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cnn3c(=O)cc[nH]c23)c1 1137473810 XCXQNYNSRUNVKF-SECBINFHSA-N 328.328 1.228 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1=C2CCCN=C2NN1 1136025507 NAXZDXVBWRZMEJ-UHFFFAOYSA-N 339.443 1.799 10 10 EDCE CN[C@@H](C)c1ccc(N2CCC2(CO)CO)cc1Br 1879986234 GGEQCXLVZCQENR-JTQLQIEISA-N 329.238 1.663 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)C[C@]2(C)CO)cc1Br 698158835 WUBIMIPSVXEAHH-GLXFQSAKSA-N 330.222 1.824 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)C[C@H](C)O)c(Br)cc21 92775751 ZZBBAOKWJVGYBZ-MADCSZMMSA-N 328.210 1.479 10 10 EDCE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CC(O)(C(N)=O)C2)c1 1350830469 WJJXLTAKGYUKNT-UHFFFAOYSA-N 347.802 1.420 10 10 EDCE CN1C(=O)O[C@H]2CN(Cc3ccc(Br)cc3O)C[C@H]21 2120399036 BDTAJDUSFAWJOH-PWSUYJOCSA-N 327.178 1.790 10 10 EDCE COC(=O)c1cnc(SC[C@@](O)(C(N)=O)c2ccccc2)s1 1559416275 CFILBKUBKMWWAH-AWEZNQCLSA-N 338.410 1.395 10 10 EDCE CN(C[C@H]1COc2ccccc2O1)C(=O)Cc1ccc(O)c(O)c1 1628489428 BHGCDGNVLMXFHA-ZDUSSCGKSA-N 329.352 1.939 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 1633006531 KWMRFFYDWJXBJP-UHFFFAOYSA-N 344.323 1.838 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2cccc(F)c2O)[C@H](O)C1 1966002132 GJAIFFCRBIRDAK-UONOGXRCSA-N 340.395 1.991 10 10 EDCE CCCN(CCC(=O)O)C(=O)CCNCc1ccc(N(C)C)cc1 1857862749 DSFCTPCQCKQAGG-UHFFFAOYSA-N 335.448 1.946 10 10 EDCE CCOc1cccc(CNCC(=O)N(C)C2CCN(C)CC2)c1O 1857867022 OSJJTGFRKKBSTC-UHFFFAOYSA-N 335.448 1.433 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](O)C1(N)CC1 1952667990 ANABTRKGTPZFKW-RISCZKNCSA-N 338.404 1.386 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NCCCN=[N+]=[N-] 1985096718 VUFGHAPQUYXEPS-WDEREUQCSA-N 327.385 1.685 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985102470 HQACDKHLXRGAAT-GARJFASQSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NC(=O)Cc1ccc(N)cc1 1999142736 FIGQVAJGARXYRB-KBPBESRZSA-N 335.404 1.220 10 10 EDCE COc1ccc([C@H](C)N[C@@H](CO)CNC(=O)OC(C)(C)C)c(O)c1 2011424306 HAGZLJDNCHEODA-NWDGAFQWSA-N 340.420 1.937 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H]([C@H](O)[C@H](N)c2ccccc2O)C1 2022706689 JIPIMLVEHCYVOG-ZNMIVQPWSA-N 338.404 1.389 10 10 EDCE CN(C)C(=O)CN(CC(=O)Nc1ccc(N)cc1)Cc1ccccc1 2034783079 OVLYTGPSLWIHFL-UHFFFAOYSA-N 340.427 1.798 10 10 EDCE CNCc1ccc(N2CC[C@H]3C(=O)NC[C@H]3C2)cc1Br 2157170492 BCXWVEUCQYKJJC-WCQYABFASA-N 338.249 1.741 10 10 EDCE CNCc1ccc(N2C[C@H](O)C[C@H]2CN(C)C)c(Br)c1 300495804 JYOCMGPUVBNUMV-QWHCGFSZSA-N 342.281 1.670 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](N3CC(O)C3)C2)cc1Br 2158744245 SOHWUJAAFIYFGD-JQWIXIFHSA-N 340.265 1.724 10 10 EDCE C[C@]1(CO)CN(c2ccc(CO)cc2Br)C[C@]1(C)CO 704291083 VDCDBDHIUTXCAB-HUUCEWRRSA-N 344.249 1.759 10 10 EDCE CC[C@@H](NCCn1ncnn1)c1cc(Br)ccc1O 379904637 IPPZLDYAHKHBPI-LLVKDONJSA-N 326.198 1.882 10 10 EDCE NS(=O)(=O)C1(CNCc2c(O)cccc2Br)CC1 714041191 SVFPZWSXWIRHLL-UHFFFAOYSA-N 335.223 1.065 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)c(Br)c1 2178085183 CXGPSLOCZFIQAO-ZFVXVEAMSA-N 341.249 1.912 10 10 EDCE CCNCc1ccc(N2CC[C@](C)(O)[C@@H](O)C2)cc1Br 2197957260 ABIXFVKQVRHIBP-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2199533023 SVGVGHINUXPFQT-VJMWFJFBSA-N 342.233 1.823 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2104416890 ZOJRWECEBDIRNK-IGJVIKARSA-N 327.222 1.099 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3COC[C@]3(CO)C2)c(Br)c1 2234565797 ILQNWDVJPSZQPC-ITDIGPHOSA-N 342.233 1.948 10 10 EDCE CC1=NN(c2nnc(C)c(O)n2)C(=O)C1=Cc1ccc(N(C)C)cc1 2296612002 SBZCXOJSBGBTLG-UHFFFAOYSA-N 338.371 1.758 10 10 EDCE N[C@H]1CCCC[C@@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2308911522 LYLIOVGNDUYQSF-ROUUACIJSA-N 329.444 1.923 10 10 EDCE Cc1ccc(CN2C[C@@H](O)C[C@@]2(C)CO)c(O)c1Br 2352944512 JAWWLTGHOMMMQW-FZMZJTMJSA-N 330.222 1.781 10 10 EDCE CN(C)c1ccc(CNC(=O)NCc2nnc3ccccn23)cc1F 57647804 IORZSVYUMWLYER-UHFFFAOYSA-N 342.378 1.934 10 10 EDCE CCNc1nc2ccccn2c(=O)c1/C=C1\SC(=S)N(C)C1=O 33450317 UAOHEIYXEAYFOC-NTMALXAHSA-N 346.437 1.957 10 10 EDCE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccccc1O 322307754 KBDSFRRHOYOONQ-UHFFFAOYSA-N 338.341 1.788 10 10 EDCE O=[N+]([O-])c1cc(NS(=O)(=O)c2c[nH]c3ncccc23)ccc1O 133741810 ZAJKJZXEAXMEQP-UHFFFAOYSA-N 334.313 1.978 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@@H](C(F)F)C3)cc2N1 193576526 WBYJGVVYQGXVHX-LLVKDONJSA-N 329.259 1.396 10 10 EDCE Cc1ccc(CNC(=O)[C@H](N)[C@@H]2CCOC2)c(O)c1Br 2380743002 XYSJMFDVOTWGMR-ZYHUDNBSSA-N 343.221 1.443 10 10 EDCE CCCCCn1nc(C(=O)OCC(=O)C(C)=O)c2ccccc2c1=O 808494643 BZICDLKUYZVORT-UHFFFAOYSA-N 344.367 1.902 10 10 EDCE CC(=O)C(=O)COC(=O)CN(C[C@@H]1CCCO1)C(=O)OC(C)(C)C 808522012 LHKUTFGQKHYRNC-LBPRGKRZSA-N 343.376 1.104 10 10 EDCE COc1nccnc1CNCc1ccc(N2CCOCC2)c(F)c1 296601366 YJSHLUCVGGHOAT-UHFFFAOYSA-N 332.379 1.751 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3COC[C@@H](C2)C3O)cc1Br 2167791909 KHHDRGURKHHTMX-LCONVBBXSA-N 341.249 1.912 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)N1C[C@H]2CC[C@@H](C2)C1 828230611 MXUUQRJTDFLAEI-RYUDHWBXSA-N 339.486 2.000 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NCc3cnn(C)n3)C2)cc1 823623146 BGLAHGYYLQTBJR-CYBMUJFWSA-N 344.419 1.149 10 10 EDCE CSC[C@H](NC(=O)NCc1ccc(N(C)C)c(F)c1)C(=O)O 905521783 PVZOSSCMJMTXIQ-NSHDSACASA-N 329.397 1.507 10 10 EDCE COc1ccc(N2CCC(NC(=O)C34CCN(CC3)C4)CC2)cc1 900509590 VSENQLILIQZRCX-UHFFFAOYSA-N 329.444 1.876 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCO[C@H]([C@H](C)O)C2)c([N+](=O)[O-])c1 840384883 BPBMTEMSYFPDBE-RBZUQTFTSA-N 336.344 1.367 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCC(C)(C)CS(C)(=O)=O)c1 926749303 QSPCFSPJHKBPDX-UHFFFAOYSA-N 328.434 1.571 10 10 EDCE CCOC(=O)[C@@H]1CN(Cc2cc(F)cc(C(C)=O)c2O)CCO1 750826885 SYGNUTOEZIWYRU-AWEZNQCLSA-N 325.336 1.498 10 10 EDCE CC(C)OC[C@H](N)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 851629866 CHKZJERTCUOTMJ-PBHICJAKSA-N 335.448 1.453 10 10 EDCE COC(=O)CCNC(=O)CCN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 858541069 GFAPMCCJPHOKRJ-PWSUYJOCSA-N 338.379 1.739 10 10 EDCE COC(=O)[C@H](C[C@@H]1CCCOC1)NC(=O)c1ccc(C)c(O)c1O 862998169 WGOGBOFPKJIEAY-AAEUAGOBSA-N 337.372 1.494 10 10 EDCE CN1CCN(c2ccc(CNC(=O)[C@@H]3CCCOCC3)cc2)CC1 881853918 OHERTEDLHXVHED-QGZVFWFLSA-N 331.460 1.871 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)NCCC1CS(=O)(=O)C1 786843389 UVVXLMNLIXOIGH-UHFFFAOYSA-N 339.461 1.329 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CC[C@@H](N2CCOC2=O)C1 898673882 YWNAHSXIJLVQLX-SNVBAGLBSA-N 348.380 1.979 10 10 EDCE C[C@@H](C(=O)N(C)Cc1ccc(N2CCCC2)cc1)N1CCN(C)CC1 1136025258 CZRZHUJSVHQOLO-KRWDZBQOSA-N 344.503 1.881 10 10 EDCE Cc1cc(C(=O)OCC(=O)c2cnn(C)n2)c(C)n1-c1ccccn1 791688435 CDQDVFFWRXKZAU-UHFFFAOYSA-N 339.355 1.657 10 10 EDCE C[C@@H]1Oc2c(cccc2C(=O)NCc2ccc(O)cc2O)NC1=O 1142533830 SEPOMZZTOLAZQQ-VIFPVBQESA-N 328.324 1.747 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC1C[C@H]2C[C@@H]2C1 1329204934 NASXIQCQZYFULT-HUUCEWRRSA-N 325.412 1.594 10 10 EDCE CN[C@H](C)c1ccc(N2CCOC[C@@H](O)C2)c(Br)c1 399840767 BXROAMXUBDXPBY-PWSUYJOCSA-N 329.238 1.927 10 10 EDCE CN1CCO[C@@H](CN(C)c2ccc(CO)cc2Br)C1 707869935 UWRBCUFCCWNKSY-GFCCVEGCSA-N 329.238 1.708 10 10 EDCE O=C(O)[C@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 715757827 ASJMNNDNOPTEFH-SNVBAGLBSA-N 334.141 1.579 10 10 EDCE C[C@H]1COC2(CCCC2)CN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1332053045 GUGIWYIGABIBDA-ZDUSSCGKSA-N 344.411 1.795 10 10 EDCE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(O)CCOC1 1287182816 ZEUXNFMMZOOISD-SFHVURJKSA-N 346.431 1.895 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C2=COCCC2)cc1C 1283747823 YWBOKMVQOUFAIJ-MRXNPFEDSA-N 334.416 1.265 10 10 EDCE Cn1nc(Br)cc1NC(=O)c1c(F)ccc(O)c1O 1457828041 ZHHXRJHFKDYCPR-UHFFFAOYSA-N 330.113 1.985 10 10 EDCE Cc1cccc2c(=O)n(CC(=O)NCc3cccc(O)c3O)cnc12 1455319763 SSFIQSPJXLOWAT-UHFFFAOYSA-N 339.351 1.433 10 10 EDCE C[C@H](O)[C@H]1CN(c2ccc(CN)c(Br)c2F)CCO1 2117526652 AWXSJLCEZXDBFI-GZMMTYOYSA-N 333.201 1.633 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H]2CCCCO2)cc1C 1482722282 LAIIODXMWSAZSN-NVXWUHKLSA-N 336.432 1.139 10 10 EDCE CC[C@H](NC(C)=O)C(=O)N[C@@H](C)CNCc1ccc(OC)c(C)c1 1498119783 UUXGIDWNQMFMSK-BBRMVZONSA-N 335.448 1.513 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)C(C)(C)C(N)=O)C2CC2)cc1C 1490679711 YLISBBUSXJNTSH-OAHLLOKOSA-N 347.459 1.500 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@@H](CNC(=O)C=C(C)C)C2)cc(OC)n1 1736058573 JFCWYHVWUKZKAW-XBXGTLAGSA-N 347.415 1.690 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cn(CCOC)nn1 1640260223 WFLPVAKVCQVBDP-UHFFFAOYSA-N 325.365 1.046 10 10 EDCE CNS(=O)(=O)c1cccc(C(=O)N2Cc3cccc(O)c3C2)c1 1643169968 XAJFFQGSRVPTKQ-UHFFFAOYSA-N 332.381 1.456 10 10 EDCE C[C@@H](C(N)=O)N(C)c1ccc(C=CC(=O)O)c(Br)c1 1911956386 DUOAZGIVAZSWKC-QMMMGPOBSA-N 327.178 1.857 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)cc1Br 2126152068 CSZXIXDJKICSJB-DJBIQUGXSA-N 327.222 1.086 10 10 EDCE O=C(O)C=Cc1ccc(N2CCNC(=O)C2)c(Br)c1 1912006681 RZICAWCFIGIPQU-UHFFFAOYSA-N 325.162 1.483 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)Cc2nc[nH]n2)cc1C 1676461670 PCSFDIYRGZXOPJ-ZDUSSCGKSA-N 331.420 1.301 10 10 EDCE CC(=O)N1[C@@H](C(=O)NCCN(C)C)CS[C@H]1c1ccccc1O 27910601 ZTGKQJSKRCYCRF-CJNGLKHVSA-N 337.445 1.033 10 10 EDCE COCC[C@@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980377987 RBUOKNDPTZWRNM-IJLUTSLNSA-N 328.409 1.182 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)COC1 1985102004 ALINNJAVZWZKIL-JTQLQIEISA-N 325.369 1.439 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985102527 IEHNHYAWPMRTHO-AXFHLTTASA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CNCc1cc(F)cc(F)c1O 1985771939 ONBNORAAMHMITG-NSHDSACASA-N 332.347 1.646 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](CO)[C@@H](CCO)C2)c(Br)c1 2149912515 DKSXBNDNUFDIQM-KGYLQXTDSA-N 343.265 1.896 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)COc2ccc(N)cc2)CO1 1999127537 DNJRZSCEWRBRSJ-GFCCVEGCSA-N 337.376 1.315 10 10 EDCE Cc1cccc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)O)c1O 2024812154 PDBVWXAEUPMZOT-YPMHNXCESA-N 338.404 1.591 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H](c4ncccn4)C3)c2n1 2063702066 WGXALJOODMRTBV-LBPRGKRZSA-N 338.371 1.553 10 10 EDCE C[C@H](NCc1ccc(Br)cc1O)[C@@H]1CN(C)CCN1C 1183919437 KFZRDDCVNQQFAG-FZMZJTMJSA-N 342.281 1.879 10 10 EDCE CN1CCc2cc([C@@H](N)[C@H](O)C3CN(C(=O)OC(C)(C)C)C3)ccc21 2044749857 IYFHMDKHFVHGCH-IAGOWNOFSA-N 347.459 1.907 10 10 EDCE CC(C)NCc1ccc(N2CCC2(CO)CO)cc1Br 2194350786 AEYADLYRLOILLO-UHFFFAOYSA-N 343.265 1.881 10 10 EDCE CCS(=O)(=O)CCN(C)c1ccc(CN)cc1Br 2050974323 FOZRMZRKAZWTLA-UHFFFAOYSA-N 335.267 1.779 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2199528275 YFKFCLWSRRRWMZ-LHVMMRPKSA-N 341.249 1.789 10 10 EDCE CO[C@@H]1CN(c2ccc(CO)c(Br)c2)[C@H]2COC[C@H]12 2102137615 QEDUTWRDNXGUJW-FPMFFAJLSA-N 328.206 1.791 10 10 EDCE OCc1ccc(N2CC3(C2)OCCC[C@@H]3O)cc1Br 2103415161 XLDWNQDZKJGJRY-ZDUSSCGKSA-N 328.206 1.672 10 10 EDCE COC1(C(N)=O)CN(c2ccc([C@H](C)N)c(Br)c2)C1 2104899971 HISZFLKJLJFXGM-QMMMGPOBSA-N 328.210 1.159 10 10 EDCE CC(C)(C)OC(=O)N1CCOCC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2244009922 PDYWTEUBMCLKCU-NSHDSACASA-N 325.369 1.534 10 10 EDCE O=C1NC[C@@H]2CCCN(c3ccc(CO)c(Br)c3)[C@H]12 2264603239 UMOUDPJUZRDEMD-ZANVPECISA-N 325.206 1.656 10 10 EDCE CC[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2288906487 WYDSHDYKWIDMMP-WCFLWFBJSA-N 341.205 1.784 10 10 EDCE NCc1ccc(N2C[C@@H]3CC[C@H](CO)O[C@H]3C2)c(Br)c1 2289196885 GTYUSLNTZAFNSA-ZOWXZIJZSA-N 341.249 1.884 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@]2(C(=O)N3CC(N=[N+]=[N-])C3)CO[C@H]1C2 2298336787 ZPPJFHARKLOYFL-JRPNMDOOSA-N 337.380 1.580 10 10 EDCE COc1ccc(Br)c(CN2CCN(C(N)=O)CC2)c1O 1231552823 KPEOECVOROFELA-UHFFFAOYSA-N 344.209 1.360 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2355333838 HDXPFVQBJUVOMP-AGEZSHCCSA-N 345.212 1.367 10 10 EDCE CCN[C@@H](C)c1ccc(N2CC([C@H](O)CO)C2)cc1Br 2361913668 OOVUPFVOULJLDP-ZUZCIYMTSA-N 343.265 1.909 10 10 EDCE CN(C)c1ncc(/C=C2/C(=O)N(Cc3ccco3)C(=O)N=C2O)cn1 33387176 ZDWUGBVESBAWDY-WUXMJOGZSA-N 341.327 1.638 10 10 EDCE Cc1ccc(C(=O)N2CCN(c3cccs3)C(=O)C2)c(O)c1O 186243534 BEQVKMIMSASOFB-UHFFFAOYSA-N 332.381 1.957 10 10 EDCE CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1895032209 WROIILWEFJMGNY-SRVKXCTJSA-N 344.477 1.898 10 10 EDCE Nc1nonc1N=NN(Cc1ccc([N+](=O)[O-])cc1)c1nonc1N 252619652 LRYWERRQAXHOOC-UHFFFAOYSA-N 346.267 1.231 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCO[C@@H](C2CC2)C1 368889123 OSDUAYLZVDNFSO-GOSISDBHSA-N 331.460 1.822 10 10 EDCE C[C@@H]1C[C@H]1N1C[C@H](NCc2ccc(N3CCOCC3)cc2)CC1=O 377836588 CKHBMGUSMHAMRT-QGPMSJSTSA-N 329.444 1.622 10 10 EDCE CN(C[C@@H]1CCCO1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 285726678 NSDMGLLEACVKSS-ZDUSSCGKSA-N 337.395 1.145 10 10 EDCE Cc1ccc(CNC(=O)[C@H](N)C2(O)CCC2)c(O)c1Br 2381128838 AGWBLVSITXTUEA-LBPRGKRZSA-N 343.221 1.322 10 10 EDCE COC(=O)N[C@@H](C)C(=O)NCc1cc(Br)ccc1O 804740335 DSJQAZAPKAFYEU-ZETCQYMHSA-N 331.166 1.515 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(=O)OC)c([N+](=O)[O-])c1 813624996 LNEXFNFOEXPELI-OGHDWDKZSA-N 346.339 1.636 10 10 EDCE CN(C)CCN(C/C=C\c1ccc(N(C)C)cc1)CC(=O)N(C)C 827158675 SWJAAZMDSIREMB-FPLPWBNLSA-N 332.492 1.718 10 10 EDCE CSC[C@@H]1NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 904148199 SDGCHJVVYVUIHE-AWEZNQCLSA-N 335.429 1.307 10 10 EDCE O=C(O)CCCN1C(=O)/C(=C/c2cnn(CCF)c2)SC1=S 905015359 HVUNBCPDRIEGOD-POHAHGRESA-N 343.405 1.919 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1COC2(CCC2)C1 830091334 VOYSUACGBVKKGU-OAHLLOKOSA-N 345.443 1.539 10 10 EDCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H](O)C1CCC1 837714740 OYIQPUCKGLWABK-MRXNPFEDSA-N 340.370 1.579 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)c3ccc(C)nc3)C2)cc1 849416273 NNEBJQIJSLFZRC-CQSZACIVSA-N 347.440 1.956 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(O)cc1O)C2 910943790 HJYXBCBUJOBRQJ-BPNCWPANSA-N 334.372 1.581 10 10 EDCE C[C@H](NC(=O)[C@]12C[C@H]3C[C@@H](C(=O)N1)[C@H]2C3)c1ccc(N(C)C)cc1 844486671 ZVTOMLYOMZUHDB-DBFNJNRKSA-N 327.428 1.845 10 10 EDCE C[C@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@@H](CCC2OCCO2)C1=O 924714904 DOVXPASGBILDCM-DOMZBBRYSA-N 347.415 1.887 10 10 EDCE CCc1cccc(CN[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)c1O 848909515 VPKOPMLOLBOYNJ-UKRRQHHQSA-N 326.462 1.762 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](CC(C)C)N1Cc2ccccc2C1=O 923618028 HUJZZUQKNZTTPV-OAHLLOKOSA-N 331.368 1.758 10 10 EDCE O=C1N[C@@H](CC2OCCO2)C(=O)N1Cc1ccc(N2CCCC2)cc1 924488086 OTJZRMRXQVMXOE-HNNXBMFYSA-N 345.399 1.470 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@]3(C)CCC(=O)NC3)C2)cc1 855227475 ZFTWQEVRKOIQOY-UGSOOPFHSA-N 331.416 1.306 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@H]3CN4CCC[C@H]3C4)cc2)C1 924726889 RNTJEDOCIGNGNQ-SCTDSRPQSA-N 342.487 1.572 10 10 EDCE Cn1cccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1=O 856210976 DUKQHFOTYSCCQD-UHFFFAOYSA-N 341.411 1.276 10 10 EDCE COC(=O)c1ccc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)[nH]1 855223931 CYOZMUNERVRFNR-GFCCVEGCSA-N 343.383 1.819 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCCN(C=O)CC2)c([N+](=O)[O-])c1 866126932 MBZDJCLWCVTCHT-GQCTYLIASA-N 333.344 1.450 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)COCC(F)F)C2)cc1 862035617 ZLLGHEGKFLUARA-GFCCVEGCSA-N 328.359 1.919 10 10 EDCE COC[C@H](NCc1cc(C)cc(Br)c1O)C(=O)OC 789576149 OFIRPYZSJNEVFD-NSHDSACASA-N 332.194 1.741 10 10 EDCE O=C(CNC(=O)c1ccc(F)c(F)c1)NCc1cc(O)ccc1O 1153885391 NMZDDAQJEIEQBY-UHFFFAOYSA-N 336.294 1.422 10 10 EDCE COC(=O)[C@H]1C[C@H](O)CN1Cc1cc(OC)cc(C(C)(C)C)c1O 1328200287 HQUIKUWMVRXEFP-SWLSCSKDSA-N 337.416 1.807 10 10 EDCE CNC(=O)[C@@H]1CCCN1Cc1c(Br)ccc(OC)c1O 1964554536 MWCZYAYKEVXAOR-NSHDSACASA-N 343.221 1.874 10 10 EDCE C[C@@H]1C[C@H](NC(=O)Cc2ccc(O)c(O)c2)C(=O)N1c1ccccc1 1465464267 QQWXKXYOGBYNDZ-DOMZBBRYSA-N 340.379 1.951 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2c[nH]cc2C)cc1C 1700958743 QIDKGZYPMPMDOR-MRXNPFEDSA-N 345.443 1.863 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1cccnc1N1CCOCC1 1540664562 OGBOYAIZIOYUDL-UHFFFAOYSA-N 343.383 1.188 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@]2(C)CCNC(=O)C2)cc1C 1483139491 ATTVWDKQODXCKW-AUUYWEPGSA-N 347.459 1.514 10 10 EDCE O=C(C[C@H]1C=CS(=O)(=O)C1)NCc1ccc2cccnc2c1O 1627073486 PHENVZQEVIUWGS-LLVKDONJSA-N 332.381 1.505 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@@H](C)NC(C)=O)C2CC2)cc1C 1480001782 QHXCBUFBMFANEQ-CXAGYDPISA-N 347.459 1.513 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCc1cc(=O)n2ccccc2n1 1565007789 VTODECHAUAWJOL-UHFFFAOYSA-N 338.367 1.742 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCCc1nc2c(s1)COCC2 1639566629 ZHZPROLDUJZRCP-RQOWECAXSA-N 346.408 1.999 10 10 EDCE COC(=O)[C@H]1CN(C(=O)c2ccnc3c2CC(=O)N3)c2ccccc21 1634660657 ZCIQXYJFXHMFTF-ZDUSSCGKSA-N 337.335 1.493 10 10 EDCE CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)O1 1637490016 DDALGSLNXLWIHR-QWHCGFSZSA-N 347.375 1.215 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@H](O)C[C@@H](O)C2)cc1Br 2126909965 PZUQMMLRWHDLEL-MVWJERBFSA-N 329.238 1.661 10 10 EDCE CCn1ccc(C(=O)NC[C@H](CO)NCc2ccc(OC)c(C)c2)n1 1676588340 QSXMXPYFHVQOSY-OAHLLOKOSA-N 346.431 1.101 10 10 EDCE Cc1ccccc1/C=C1\SC(=S)N(CC(=O)NCCO)C1=O 16905421 RLLMKTLATFABSS-WQLSENKSSA-N 336.438 1.305 10 10 EDCE COc1ccccc1/C=C1/SC(=S)N(CCOCCO)C1=O 1858589305 MZHZYSGFECSYTK-JLHYYAGUSA-N 339.438 1.905 10 10 EDCE COc1ccc(N2CCN(C(=O)CNc3ncccn3)CC2)cc1 1873831535 RPBCFFURXAPGBW-UHFFFAOYSA-N 327.388 1.246 10 10 EDCE C[C@@H]1CCN1C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1119960989 HDSBDVTWIMGFFF-CJNGLKHVSA-N 332.448 1.092 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)cc1Br 2140663736 PIEOMJKLILKFAE-GIMBAOAISA-N 334.185 1.382 10 10 EDCE CN(Cc1ccccc1)C[C@H](N)C(=O)NCCc1ccc(O)c(O)c1 1968740026 ZZWRWMQGFLEKEN-INIZCTEOSA-N 343.427 1.216 10 10 EDCE CCNCc1ccc(N2CCN(C)C(=O)C2)cc1Br 233528399 YHMXRHCYDANYQG-UHFFFAOYSA-N 326.238 1.837 10 10 EDCE C[C@](O)(CO)[C@H]1CCN(c2ccc(CO)c(Br)c2)C1 2138092577 YWWXSKBGNUCGKC-FZMZJTMJSA-N 330.222 1.511 10 10 EDCE O=C(O)CN1CCCN(Cc2cc(Br)ccc2O)CC1 236433720 ZVSKLGFPNVWCJV-UHFFFAOYSA-N 343.221 1.747 10 10 EDCE CO[C@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)N2CC(N=[N+]=[N-])C2)C1 1985100975 MBDMZBNWQJUFLN-WJONMLJTSA-N 325.369 1.580 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 1986143071 LXOZNAQNFYUKQN-YGRLFVJLSA-N 325.369 1.270 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)CC[C@@H]1O 166398655 ZDJJWGCNNXJVNX-RDZIJCNDSA-N 340.221 1.608 10 10 EDCE CC(C)(C)OC(=O)NC1CC2(C1)C[C@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003169440 KPACDUWXLGZNOX-OKIRXCCMSA-N 336.432 1.945 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4CO[C@@H](C4)C3)c(Br)cc21 2152299321 YSRWQUIWMUJQEA-UPFKWVMWSA-N 338.205 1.626 10 10 EDCE CN1C(=O)[C@H](N)c2ccc(N(CCC(N)=O)Cc3ccccc3)cc21 2034753087 FZQUIWMHWSKKJB-GOSISDBHSA-N 338.411 1.545 10 10 EDCE CO[C@]1(CO)CCCN(c2ccc(CN)cc2Br)C1 402883943 AFMXALPJXSXTBO-CQSZACIVSA-N 329.238 1.886 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@@](O)(CO)C2)c(Br)c1 313746230 PJNRSQXHWVDZFJ-YGRLFVJLSA-N 329.238 1.663 10 10 EDCE O=C1CC[C@@H](NCc2cc(Cl)cc(Br)c2O)C(=O)N1 708087860 DBXWERPIISVHCF-SECBINFHSA-N 347.596 1.703 10 10 EDCE O[C@H]1COCCN(c2ccc(CNC3CC3)c(Br)c2)C1 399944716 PHFJIXJDVFRVOC-CQSZACIVSA-N 341.249 1.899 10 10 EDCE COc1cccc(O)c1[C@H](C)NC[C@@H]1CCN(S(C)(=O)=O)C1 2064102614 UEGRFRTWMROPFY-RYUDHWBXSA-N 328.434 1.333 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@H](C)O[C@@]4(CCO[C@@H]4C)C3)c2n1 2064412444 PRTLWGJRGYEZEU-JKDFXYPNSA-N 346.387 1.152 10 10 EDCE Cn1cc(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)c(=N)[nH]1 2191539683 ZAODQLAEVYWLOP-UHFFFAOYSA-N 337.188 1.646 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H]3C(C(N)=O)[C@H]3C2)c(Br)c1 2201293160 JXOAAXQTCRPTSK-MIMYLULJSA-N 338.249 1.897 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(NC(=O)Cc2ccc(N)cc2)C1 2216758670 XJDFCOMDRDBJQD-UGSOOPFHSA-N 331.416 1.937 10 10 EDCE CCN1C(=O)NC(=O)/C(=C\NCCc2c[nH]c3ccccc23)C1=O 103912965 ZLDAFEUDMFCJDQ-JLHYYAGUSA-N 326.356 1.282 10 10 EDCE COC(=O)CN1C(=O)[C@H](Cc2ccc(N)cc2)Oc2ccccc21 62495997 SPSZBGWXLHLYAF-INIZCTEOSA-N 326.352 1.779 10 10 EDCE CN1CCCc2cc(CNC(=O)CN3C(=O)NC(=O)C3(C)C)ccc21 73132658 CDIQCRNEFMWYCX-UHFFFAOYSA-N 344.415 1.016 10 10 EDCE CN[C@H](C)c1ccc(N2CC(O)(CN(C)C)C2)c(Br)c1 2369668342 BFAXXOHAEPEQDY-LLVKDONJSA-N 342.281 1.842 10 10 EDCE Cc1cn2c(n1)CN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)CC2 374648686 QSKKCRVIEULEDI-UHFFFAOYSA-N 341.459 1.732 10 10 EDCE Cn1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c(C2CC2)n1 291779898 OSIOEJSNOAPQMN-UHFFFAOYSA-N 344.371 1.006 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)C1 808548416 XYYRDFSHKHMGJJ-JQWIXIFHSA-N 327.377 1.723 10 10 EDCE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2COC(=O)N2)cc1 294522212 WNOUSKQVGZNVQT-MRXNPFEDSA-N 343.383 1.983 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(COc2nnc(=N)[nH]n2)CCCC1(C)C 2213780493 GOSXEPRNDFPWBC-HNNXBMFYSA-N 338.412 1.532 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2c(cn1)OCCO2 819485308 SILZOOSSMPDYSZ-JTQLQIEISA-N 330.340 1.625 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NCc1cc(Br)ccc1O 826967228 IJWPSDUXSWHGRF-CMPLNLGQSA-N 330.178 1.575 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@]1(C)CCCS1(=O)=O 906855163 ISABPNWFALDDGK-MRXNPFEDSA-N 338.429 1.445 10 10 EDCE Cc1cc(CC(=O)N2CC[C@@H](NC(N)=O)C2)c(C)n1-c1ccccc1 831450377 VVASBWPNUVMICD-MRXNPFEDSA-N 340.427 1.906 10 10 EDCE CC[C@@H](NC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)C1CC1 830303684 LNHHUYXTBLZOFI-RHSMWYFYSA-N 345.443 1.695 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(N3CC[C@@H](O)C3)C2)c([N+](=O)[O-])c1 845722853 NDOBRGJDXRUETK-LYKUJDHUSA-N 347.371 1.036 10 10 EDCE COc1cc(Br)cc(CN2CN(C)C(=O)[C@@H]2C)c1O 843435471 OKLJDVFKBKKVJU-QMMMGPOBSA-N 329.194 1.783 10 10 EDCE Cc1cc(O)c(CN(C)[C@@H]2CCN(S(C)(=O)=O)C2)c(Cl)c1 840950083 JNIZCLGFVFWUIU-LLVKDONJSA-N 332.853 1.820 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)NCc2c(O)cccc2F)CS1(=O)=O 923270356 RKZAPSQEWWDPTF-NXEZZACHSA-N 330.381 1.296 10 10 EDCE CC1(C(=O)NCc2cc(NC(=O)C3(C)COC3)ccc2O)COC1 923119370 DAUORCINFHWDQF-UHFFFAOYSA-N 334.372 1.020 10 10 EDCE COc1cccc(CNC(=O)NC[C@]2(OC(C)C)CCOC2)c1O 925749259 WKNZVABCBUWRQS-QGZVFWFLSA-N 338.404 1.784 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@H]3[C@H](C)O)C2)cc1 854297520 RTYSOHYWMAMDHB-GRDNDAEWSA-N 333.432 1.829 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@H]4COC[C@@H](C3)O4)C2)cc1 852451797 PNKZVAXKRGXLIS-XYPHTWIQSA-N 347.415 1.083 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](C(=O)O)C(C)C)C2)cc1 851651524 LZCHFFCOYKHSGY-BBRMVZONSA-N 349.431 1.930 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cnc3c(cnn3C)c2OC)c1 752600103 JZZAFOQDFUXOAJ-UHFFFAOYSA-N 342.355 1.621 10 10 EDCE CCON(CC)C(=O)CNC(=O)NCc1cc(Cl)ccc1O 858710307 VDNAUBMYZUEXLH-UHFFFAOYSA-N 329.784 1.645 10 10 EDCE COC(=O)N[C@H]1CCN(Cc2ccc(N3CCC(O)CC3)cc2)C1 895845286 VWIOGXKZXLCFPT-HNNXBMFYSA-N 333.432 1.578 10 10 EDCE COCC[C@@H](CO)NCc1c(Br)ccc(OC)c1O 1964043238 SLYLWIZRWQSKAP-VIFPVBQESA-N 334.210 1.650 10 10 EDCE C[C@H](C1CCN(C)CC1)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329785907 HIFJSFPEQSJMCN-CYBMUJFWSA-N 345.443 1.423 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N(CCO)CCNCC2CCC2)cc1 1272322940 XXTNGJRXRVMLPV-UHFFFAOYSA-N 347.419 1.673 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccc(C)o2)cc1C 1283731662 AKVVCTIADAQTCR-OAHLLOKOSA-N 332.400 1.786 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1cc(OCC(F)F)ccn1 1295707957 ZMBYIJIZEARNRU-UHFFFAOYSA-N 338.310 1.996 10 10 EDCE O=C(O)C[C@@H]1CN(Cc2c(O)cccc2Br)C[C@@H]1O 2117727174 GATWIGAFOBAZKA-PELKAZGASA-N 330.178 1.422 10 10 EDCE CCN(CC)[C@@H]1[C@H]2OC[C@@H](O2)[C@H](NCc2ccc(N(C)C)cc2)[C@@H]1O 1616153567 XOVRJOQYGFQUEF-BCYZHJNNSA-N 349.475 1.037 10 10 EDCE COc1cccc(C(=O)NCCNC(=O)c2c(F)ccc(O)c2O)c1 1610205102 MKRKHTLKSGBXNO-UHFFFAOYSA-N 348.330 1.405 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)CN1CCOCC1 1628691214 SBRZXLQGWBFINY-GFCCVEGCSA-N 333.392 1.547 10 10 EDCE Cc1cccc([C@@H](CC(=O)NCc2c(O)cccc2O)NC(N)=O)c1 1558533564 HDPDQGICLOOXSS-CQSZACIVSA-N 343.383 1.822 10 10 EDCE CN(C)c1ccc(C=c2sc3nc(-c4cccnc4)nn3c2=O)cc1 1554087176 UAMZMXAYUMGVLF-UHFFFAOYSA-N 349.419 1.827 10 10 EDCE Cn1cc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)n(C)c1=O 1556879773 YTLBDOPWJJPMJP-UHFFFAOYSA-N 348.366 1.686 10 10 EDCE C[C@@H](C(=O)NCc1c(O)cccc1O)c1ccc(S(C)(=O)=O)cc1 1635842891 APBKCFUWYAZSBF-LLVKDONJSA-N 349.408 1.921 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccn(-c2ncccc2F)n1 1630837577 SZLMPNLDQOORJV-UHFFFAOYSA-N 328.303 1.999 10 10 EDCE NC(=O)CC1CC(NC(=O)NCc2c(O)ccc3c2CCCC3)C1 1638329710 CIFMDSJPLPEPQI-UHFFFAOYSA-N 331.416 1.724 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H](C)CC(N)=O)cc1C 1734336308 GPIZMVJCRPXKEL-ZIAGYGMSSA-N 335.448 1.452 10 10 EDCE O=C(NCCc1cccc2c1OCCO2)c1c(F)ccc(O)c1O 1651239396 BFLKGNXXUNYGEC-UHFFFAOYSA-N 333.315 1.981 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)CNC(=O)[C@@H]1C[C@H]1C 1759446168 CXCRCJOLPMNEFQ-MISXGVKJSA-N 345.403 1.987 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2ccc(=O)n(C)n2)cc1C 1669733730 QZVMZGSKIQYMIA-ZDUSSCGKSA-N 344.415 1.005 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2cnnn2C)C2CC2)cc1C 1690149314 IJMDEMXBICSOGM-HNNXBMFYSA-N 343.431 1.430 10 10 EDCE C[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 1914310013 ASSUMBKPPAWWOY-KKIHLJRUSA-N 326.194 1.361 10 10 EDCE C[C@H](CO)N(Cc1ccccc1)S(=O)(=O)Cc1ccc(N)cc1 1914357076 FNGCAZVKMCNTLK-CQSZACIVSA-N 334.441 1.982 10 10 EDCE C[C@@H](NCc1cccc(O)c1O)C1(O)CN(C(=O)OC(C)(C)C)C1 1918681164 ZPCPGQHKUDXGKR-LLVKDONJSA-N 338.404 1.558 10 10 EDCE O=C(NCc1csnc1Br)c1cc(O)nc(O)c1 1925348893 YNXYWIJLOYLPSE-UHFFFAOYSA-N 330.163 1.642 10 10 EDCE C[C@H]1CO[C@@H](CO)CN1c1ccc(CN)c(Br)c1F 231840441 AENZMBNFPXNGAC-WCBMZHEXSA-N 333.201 1.633 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CC(=O)NCCCN=[N+]=[N-])C1 1985101607 VBJFPQQNWTTWRH-WDEREUQCSA-N 327.385 1.421 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)[C@H](CCO)C2)c(Br)c1 2149912521 DKSXBNDNUFDIQM-UHTWSYAYSA-N 343.265 1.896 10 10 EDCE CC(C)(C)OC(=O)N1[C@H]2C[C@H]1CN(C(=O)c1ccc(O)c(O)c1)C2 2006279988 NIRDAQVNCHCDKX-RYUDHWBXSA-N 334.372 1.932 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3OCCN(C)[C@H]3C2)cc1Br 2153995292 QEKPOECYLYAJLZ-ONERCXAPSA-N 340.265 1.988 10 10 EDCE COC1(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 2010403486 FCYJGXGLBLRFLS-NSHDSACASA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCC(N)=O)C(=O)NCCCCN=[N+]=[N-] 2025611091 JRPKQGLDNYRSST-SNVBAGLBSA-N 342.400 1.352 10 10 EDCE NCc1ccc(N2CCN3C[C@H](O)C[C@H]3C2)cc1Br 405256311 KQGTYTIVYFVNKM-QWHCGFSZSA-N 326.238 1.163 10 10 EDCE NCc1ccc(N2CCN([C@H]3CCOC3)CC2)cc1Br 2171291976 BCGOTHCOPAIHCT-AWEZNQCLSA-N 340.265 1.819 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C[C@H]1CO 709218539 BGJIVPYPKSAMQY-BFHDXFOESA-N 340.221 1.466 10 10 EDCE NCc1ccc(N2CCC[C@@H](CO)[C@H]2CO)c(F)c1Br 709805724 KQIMYNQIATUYKO-CMPLNLGQSA-N 347.228 1.617 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC(OC(F)F)C3)c(Br)cc21 398898373 PXIRGUAEIVWEMI-JTQLQIEISA-N 348.147 1.829 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)cc1Br 2182553211 KPPRLZPSHLZPNP-RWDPWNMBSA-N 341.249 1.647 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)CO1 1908253704 YYFDKPHZVYZZTD-GRYCIOLGSA-N 339.396 1.922 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOCC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1908254377 MDMCPKXRUWJQRB-VXGBXAGGSA-N 339.396 1.827 10 10 EDCE Nc1ccc(NC(=O)CCN2CC(CNC(=O)C(F)(F)F)C2)cc1 2044608608 PTNUCFJTNZOXRP-UHFFFAOYSA-N 344.337 1.208 10 10 EDCE C[C@@H](NC(=O)OC(C)(C)C)c1nc(=NCc2cccc(O)c2O)[nH][nH]1 2066590240 KFNJGOKDFLHPQX-SECBINFHSA-N 349.391 1.836 10 10 EDCE NCc1ccc(N2C[C@@H]3OCCO[C@@H]3C2)c(F)c1Br 2093346291 VHQADYNHTBKSCJ-PHIMTYICSA-N 331.185 1.651 10 10 EDCE O=S1(=O)C[C@@H]2[C@@H](CCN2Cc2cc(Br)ccc2O)C1 2094883750 YXCJTKKEUZCVPJ-JOYOIKCWSA-N 346.246 1.774 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213593610 XRLISTYTHFYEHZ-NNYUYHANSA-N 339.396 1.874 10 10 EDCE CCN1CC[C@H](NCc2c(Br)ccc(OC)c2O)C1=O 2208764514 NAAQOUHNJAHRPT-NSHDSACASA-N 343.221 1.874 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)cc2Br)[C@@H](CO)[C@H]1OC 2233354834 KOOHWDXALDNCDN-BFHYXJOUSA-N 345.237 1.119 10 10 EDCE COc1cccc(C=C2SC(=S)N(CC(=O)O)C2=O)c1O 2297327712 BKSRHQICNCTURY-UHFFFAOYSA-N 325.367 1.687 10 10 EDCE COC(=O)[C@@H](O)CNC(=O)C=Cc1cc(C)n(-c2ccccc2)c1C 2308009181 BKYBFBGKIZAIIO-KRWDZBQOSA-N 342.395 1.757 10 10 EDCE Cc1ccc(CNS(=O)(=O)NC(C)C)c(O)c1Br 2327593990 JMTCEMCNYXHYEI-UHFFFAOYSA-N 337.239 1.796 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CNCCS2)c(O)c1Br 2352950384 RRMWWSMXYOTIBB-SNVBAGLBSA-N 345.262 1.784 10 10 EDCE CN1CCCc2cc(CNC(=O)N[C@H]3CCC[C@H](C(N)=O)C3)ccc21 172572043 OONQVEIWKPAHDG-HOTGVXAUSA-N 344.459 1.912 10 10 EDCE NC(=O)Cn1cc(NC(=O)NCc2ccc(N3CC=CC3)cc2)cn1 172592385 MXDXJVXWJLSFIA-UHFFFAOYSA-N 340.387 1.066 10 10 EDCE CN(C)c1ccc(CN(C)S(=O)(=O)NCC(F)(F)F)cc1 192006161 VNWSRMICCFWYHZ-UHFFFAOYSA-N 325.356 1.581 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N[C@@H]1C[C@H]2CC[C@H]1O2 255764784 AFSMSRGTAMNKIZ-JGMFYMQNSA-N 328.412 1.973 10 10 EDCE CCOc1cccc(CN2CCN(CC(F)(F)F)C(=O)C2)c1O 289646575 MNZOEVTWHNHHTK-UHFFFAOYSA-N 332.322 1.997 10 10 EDCE Cc1ccc(C(=O)NC[C@@H]2CCC3(CCOCC3)[C@H]2O)c(O)c1O 283754558 ZONCXTWBVORDFH-LRDDRELGSA-N 335.400 1.704 10 10 EDCE COc1nccnc1CN(C)Cc1ccc(N2CCOCC2)cc1 294509637 CTBNHGSRZSYOTP-UHFFFAOYSA-N 328.416 1.954 10 10 EDCE CC(=O)C(=O)COC(=O)CCC(=O)c1ccc2c(c1)CCC(=O)N2 808538069 XXKGLJGDBXVXHN-UHFFFAOYSA-N 331.324 1.236 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnn4cccnc34)CC2)cc1 298143755 ARJIZFSBXUTUON-UHFFFAOYSA-N 337.383 1.700 10 10 EDCE CN(C)CCCNC(=O)NCc1cc(Br)ccc1O 806277386 ALEKXQKXRLMUSS-UHFFFAOYSA-N 330.226 1.906 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1CCN[C@@H]2COC[C@H]21 2132578373 DIHPVDVHHFKFHU-VXGBXAGGSA-N 347.640 1.981 10 10 EDCE CCC(=O)N1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 819947364 AQUKYHDHSPPWHU-ALCCZGGFSA-N 333.344 1.797 10 10 EDCE O=C(NCc1cccc(Br)c1O)NC1COCCOC1 813817757 GUZGPZNBUSEBKJ-UHFFFAOYSA-N 345.193 1.369 10 10 EDCE CCOc1ccc(O)c(CN2C[C@@H]3[C@H](C2)[C@@H](OC)CS3(=O)=O)c1 827389244 MHIARASPNTZDKH-VNQPRFMTSA-N 341.429 1.035 10 10 EDCE C/C(=C\C(=O)NCc1ccc(N(C)C)cc1C)CN1CCOCC1 900733543 XGTBWTYFGVIHPC-RVDMUPIBSA-N 331.460 1.956 10 10 EDCE CCC[C@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(=O)O 588434939 JDGYNDHRUUZNCA-HWYHOQROSA-N 332.400 1.906 10 10 EDCE CC[C@@](C)(CO)C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 838204997 PQMUEHXOQUBOOL-SFHVURJKSA-N 336.432 1.663 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)N[C@@H](C)C(C)(C)OC)cc1 905130190 BVTYKCIVRXXZRZ-LBPRGKRZSA-N 338.404 1.516 10 10 EDCE CCO[C@@H](CNC(=O)NCc1ccc(N(C)C)cc1C)CN(C)C 919081262 JCPLTXIIDZDWGB-KRWDZBQOSA-N 336.480 1.827 10 10 EDCE CN1CCN(CCCCNC(=O)NCc2c(O)cccc2F)CC1 919510539 UJFFITRUQSCVQE-UHFFFAOYSA-N 338.427 1.358 10 10 EDCE CCN(C)c1ccc([C@@H](C)NCC[C@@H]2CNCCS2(=O)=O)cc1 925798748 RKRAVLQFXCTZMQ-RHSMWYFYSA-N 339.505 1.570 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H]4C[C@@]4(CO)C3)C2)cc1 854299576 PSCOLYSUQMCSNV-GLJUWKHASA-N 331.416 1.298 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCC[S@](=O)CC(F)(F)F 855275805 LTOXDZINMBDPAM-YSNSILARSA-N 337.319 1.538 10 10 EDCE CN(C)c1ccc(CNC(=O)Cn2c3ccccc3c(=O)n2C)cc1 931249336 RZTGIZUJGYUWOY-UHFFFAOYSA-N 338.411 1.722 10 10 EDCE COCCOCCN(CCO)Cc1cccc(Br)c1O 862468951 UHBOZNPKRPUNSA-UHFFFAOYSA-N 348.237 1.612 10 10 EDCE CC[S@@](C)(=O)=NS(=O)(=O)NCCCSc1nccs1 866782216 QRBLMQDZTUQBRC-GOSISDBHSA-N 343.521 1.577 10 10 EDCE COCCN1C[C@H](C(=O)NCc2ccc3cccnc3c2O)CC1=O 862029580 ZQDBJNNIUPTWPE-CQSZACIVSA-N 343.383 1.052 10 10 EDCE COc1cccc2c1CN(C(=O)C(=O)N1Cc3cccc(O)c3C1)C2 1118961111 HNDPGFNQBWBPTR-UHFFFAOYSA-N 338.363 1.785 10 10 EDCE CCN(CC)c1ccc(CNC[C@@H](O)CC2(O)CCOCC2)cc1 872200472 GRMJKSZJQBTMKE-SFHVURJKSA-N 336.476 1.915 10 10 EDCE COc1ccccc1[C@@H](O)CNC(=O)/C=C\c1ccc(O)c(O)c1 779528388 HNROHOHWDYAUHI-GQSKFBFOSA-N 329.352 1.969 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(CO)CNCc1ccc2c(c1)CCO2 1876123533 RSIKYWFWXHHTKG-SFHVURJKSA-N 336.432 1.987 10 10 EDCE COC(=O)c1c(CN2CCCN(C=O)CC2)c2cc(F)ccc2n1C 895354882 UUDYDWSTPIBSIW-UHFFFAOYSA-N 347.390 1.768 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2CCC[C@H]2O)N(C)C)cc1 899097657 DSIHMOFZIFAYHI-IXDOHACOSA-N 334.464 1.568 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCN(c2ncccc2F)C1 1149776043 NIZFUJRIKZANEK-GFCCVEGCSA-N 331.347 1.570 10 10 EDCE O=C(O)C1(O)CCN(Cc2cc(Br)ccc2O)CC1 1890257369 VDQUOMNGTRCBLL-UHFFFAOYSA-N 330.178 1.566 10 10 EDCE O=C(C(=O)N1CC(C2CCOCC2)C1)N1Cc2cccc(O)c2C1 1329397928 VNPGLKLMJOHFRS-UHFFFAOYSA-N 330.384 1.119 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@]1([C@@H]2CCCCO2)CCCO1 1263768777 FOGREMTUTIRFTI-FUHWJXTLSA-N 335.400 1.875 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@H]2CCN(C)C2=O)cc1C 1265812968 HWZCERSNZQSSOI-UKRRQHHQSA-N 333.432 1.076 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cccc(N2C(=O)CCC2=O)c1 1455351886 ZGYVCDPCSYWZAS-UHFFFAOYSA-N 340.335 1.681 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)Cc2ccsc2)cc1C 1700782491 KRBBXAKCPHSELM-MRXNPFEDSA-N 348.468 1.875 10 10 EDCE C[C@H](c1cccnc1)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1629645365 VWQMQFJZYSBEJN-CQSZACIVSA-N 341.411 1.941 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCc2cccc(C(N)=O)c2)cc1 1623968254 FJJRXVCBKCWBDM-UHFFFAOYSA-N 325.328 1.878 10 10 EDCE CC[C@@H](CNC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1)OC 1498204465 WFJREPLDXQCCHS-FZMZJTMJSA-N 335.408 1.982 10 10 EDCE CCOC(=O)[C@@]1(C)CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 1632495852 QQYLJAOVLWFKAT-MRXNPFEDSA-N 348.359 1.643 10 10 EDCE O=C1C[C@@H](C(=O)NCc2ccc(O)cc2O)c2ccc(F)cc2N1 1638353011 YWHSIQHWPIVRJX-CYBMUJFWSA-N 330.315 1.979 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)[C@H](O)CC 1632356657 TVIQWLPIJCXICV-WCFLWFBJSA-N 339.388 1.095 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2(NC[C@H]3CCOC3)CC2)cc1 1569433183 CNMSYYWDPZFERT-GFCCVEGCSA-N 345.403 1.738 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H]2CCCC(=O)N2)cc1C 1732960606 RQDITQKPJOMCCD-UKRRQHHQSA-N 333.432 1.267 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2cnnc(O)c2)cc1C 1733979349 LIROPSHCRPULOE-QWHCGFSZSA-N 344.415 1.796 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCCS(C)(=O)=O 1742755203 ZARDAQSMDAWGQO-UHFFFAOYSA-N 338.433 1.363 10 10 EDCE COc1cc(CNC(=O)c2c(F)ccc(O)c2O)cc(OC)c1O 1650792321 ULYSPIGSEDAXOG-UHFFFAOYSA-N 337.303 1.890 10 10 EDCE C[C@H](O)[C@H]1CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2125823338 OTTGYFZAIOQKCQ-QDWQASTRSA-N 326.194 1.361 10 10 EDCE CC[C@H](F)C(=O)N[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1688053632 WYFBHKVQGDZHNM-XQQFMLRXSA-N 349.366 1.974 10 10 EDCE C[C@@H](NCCCN1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 162477302 YAOCUKMGDGJHQE-GOSISDBHSA-N 346.519 1.811 10 10 EDCE NC(=O)C[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccsc2)SC1=S 1858590472 RYJVQEQNJDEDDN-TWGKFFBLSA-N 342.423 1.278 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1OCC[C@H]1NC(=O)OC(C)(C)C 1900609298 MBVOMLXOPAHEDO-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE COCC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951833642 PPSHSJHPBMVGIS-NSHDSACASA-N 325.361 1.749 10 10 EDCE C[C@H](O)[C@@H](N)C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952234089 MWALDXSZLGOLSU-UHTWSYAYSA-N 340.420 1.632 10 10 EDCE CC(C)(C)OC(=O)N1CCN(NC(=O)Cc2ccc(N)cc2)CC1 1999127551 DTIFVQITGFVNML-UHFFFAOYSA-N 334.420 1.395 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@](C)(C(=O)N2CC(N=[N+]=[N-])C2)C1 2010393538 UCFNOLJQNSOQEF-BMIGLBTASA-N 339.396 1.970 10 10 EDCE CNCc1ccc(N2C[C@@H](OC)C[C@@H]2CO)cc1Br 381695860 FLNVCGNWRXQUIW-OLZOCXBDSA-N 329.238 1.755 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC3CCN(CC(F)F)CC3)c2n1 2064732331 HNTNXZDUONBYAO-UHFFFAOYSA-N 339.346 1.203 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OCCN(Cc3cc(N)ccc3O)[C@@H]2C1 2044612175 UOJMWARZAJQCMS-ZBFHGGJFSA-N 349.431 1.795 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C(CNC(=O)c3ccc(O)c(O)c3)[C@@H]2C1 2054397950 OQJOSVWMJUXPIR-STQMWFEESA-N 348.399 1.941 10 10 EDCE CC(=O)C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1 2245899367 YKXMYWFRVPQFNL-ZANVPECISA-N 339.310 1.837 10 10 EDCE CN1CCN(C2=NC(=O)C(=Cc3cccc([N+](=O)[O-])c3)S2)CC1 2294359203 PSTIPCBQLANMSB-UHFFFAOYSA-N 332.385 1.813 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S 2323831503 WEPWHLZSRMKRFC-VIFPVBQESA-N 343.813 1.987 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@H](c3cnn(C)c3)C2)cc1 116312900 JZDGKTIPXCNAFD-MRXNPFEDSA-N 341.459 1.592 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccnnc1 269297949 SGPRPIRUWJRFHQ-UHFFFAOYSA-N 326.400 1.615 10 10 EDCE CCOC(=O)C[C@H]1C[C@H](OC)CN1Cc1cc2c(cc1O)OCO2 376949298 NVSUNQJXQWBTTQ-OLZOCXBDSA-N 337.372 1.663 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)C2C[C@H]3CNC[C@@H](C2)C3=O)c1 828666773 IIDFEQBZFZKKNF-ODWCKFRGSA-N 332.400 1.393 10 10 EDCE C[C@H]1CN(CC(C)(C)O)CCN1C(=O)/C=C\c1ccc(O)c(O)c1 588538563 TYCTYVYMLAFVIB-VGVVRCBHSA-N 334.416 1.415 10 10 EDCE Oc1cc2c(cc1CN1CCC(Cn3cnnc3)CC1)[C@@H](O)CO2 844734984 AGDOOJJOOLQIPA-INIZCTEOSA-N 330.388 1.322 10 10 EDCE C[C@@H]1C[C@H](S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)CCO1 842785494 NXFKSOULLOYZHS-WQVCFCJDSA-N 341.477 1.239 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)C3(F)CC3)CC2)cc1 843519670 BJTPXUKXWAZDKP-UHFFFAOYSA-N 335.423 1.826 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cn(C)ccc1=O 929537586 QFIZHFSDEVFKPX-UHFFFAOYSA-N 341.411 1.494 10 10 EDCE CN(C)c1cc(F)c(CNC[C@H]2CCCCN2CCO)cc1F 858170994 RPKOBYOMXKDVPV-CQSZACIVSA-N 327.419 1.967 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3nccn3C)C2)cc1 852125749 WXGGWAJRBYRJGO-ZDUSSCGKSA-N 329.404 1.507 10 10 EDCE Cn1cc(/C=C/C(=O)N2CC(C)(C)c3ccccc32)c(=O)n(C)c1=O 758178644 MYSNHZMTZSTWHR-MDZDMXLPSA-N 339.395 1.422 10 10 EDCE O=C(O)[C@H]1CC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 852956494 BIZQGRHCXZACDO-CABCVRRESA-N 346.427 1.765 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCOC[C@H]3C)C2)cc1 852281209 RFPVZKYZIXIOOH-JKIFEVAISA-N 333.432 1.998 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@](C)(CO)C(C)C)C2)cc1 854298206 YFNXIIOJUXQFIF-KBXCAEBGSA-N 335.448 1.980 10 10 EDCE COC[C@@H](C)OC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 866564087 VPHYVXVWFSNSQQ-UKRRQHHQSA-N 349.431 1.649 10 10 EDCE CCCN(CCC)c1ccc(CN2CCN(C(=O)CO)CC2)cc1 793595648 VBYYXXGZLUOUHG-UHFFFAOYSA-N 333.476 1.950 10 10 EDCE Cn1cc(Br)c(C(=O)NCc2cccc(O)c2O)n1 1153798957 YUAIXRRUBDUWFH-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE COc1cncc(NCc2ccc(N3CCN(C)CC3)c(F)c2)n1 1327072148 FECSSQJUAWLOTJ-UHFFFAOYSA-N 331.395 1.988 10 10 EDCE COCCOC1CN(c2cc(Br)c(CN)cc2F)C1 707662777 MVXTUVICRSVHRJ-UHFFFAOYSA-N 333.201 1.899 10 10 EDCE CCCCCOC1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1330470397 DOWPYHYKUKVFSD-UHFFFAOYSA-N 332.400 1.652 10 10 EDCE COc1ccc(Br)c(CN(C)[C@H]2CCCNC2=O)c1O 1964599024 HSNOQBAKOLUGFU-NSHDSACASA-N 343.221 1.874 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2C[C@@H](CCO)[C@@H](CO)C2)cc1 1346255011 ARJOIROQRXAUSB-IAGOWNOFSA-N 349.475 1.665 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2C[C@H]3C=C[C@H]2CC3)cc1F 1354439106 SICKMLWIIKAPIM-DUVNUKRYSA-N 345.418 1.979 10 10 EDCE CC(C)CN(C)C[C@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1278889339 SBRQXFBTVCBSNP-HNNXBMFYSA-N 349.435 1.870 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H](C)O1 1453416247 GUVDZXXAESSTNS-SKDRFNHKSA-N 334.332 1.252 10 10 EDCE O=C(CNC(=O)c1ccccc1Cl)NCc1c(O)cccc1O 1472061031 DHPBYGUFTIKBIP-UHFFFAOYSA-N 334.759 1.797 10 10 EDCE NCc1ccc(N2C[C@@H]3NC(=O)O[C@@H]3C2)c(F)c1Br 2120407784 FOZLVYVKRDJRQJ-IONNQARKSA-N 330.157 1.344 10 10 EDCE CCn1c(C)cc2[nH]nc(NC(=O)c3cccc(O)c3O)c2c1=O 1611487381 PNWRZEWWEZFKOU-UHFFFAOYSA-N 328.328 1.716 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(C(=O)N2CCCCC2)CC1 1623927768 VFTBSPWYOCUWED-UHFFFAOYSA-N 346.427 1.891 10 10 EDCE Cc1nn(-c2cccnc2)nc1C(=O)NCc1ccc(O)cc1O 1626850033 NFZDKGFWFSMZQT-UHFFFAOYSA-N 325.328 1.312 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H]2COCCO2)cc1C 1491984926 JGNDQBOZCHCHJO-RHSMWYFYSA-N 336.432 1.403 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1c(C)nc(C)nc1O 1634939020 ISPUSAURPNXMLS-UHFFFAOYSA-N 336.388 1.849 10 10 EDCE CCn1ccnc1C(=O)NC[C@H](CO)NCc1ccc(OC)c(C)c1 1725542787 UVQFWOCGJWDGTF-OAHLLOKOSA-N 346.431 1.101 10 10 EDCE CC(C)(CNC(=O)c1ccc(N=NC(N)=O)cc1)S(C)(=O)=O 1630184206 YXGWPYPXLPBAEH-UHFFFAOYSA-N 326.378 1.402 10 10 EDCE COc1cc(NCCCNC(=O)c2ccc(C)c(O)c2O)ncn1 1639731016 QPPXGEVKQLOYLP-UHFFFAOYSA-N 332.360 1.437 10 10 EDCE C[C@@H]1C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CCS1(=O)=O 1646493933 QAXKPQJFUQAYBG-VSEZHWFZSA-N 325.386 1.193 10 10 EDCE C[C@H](O)[C@@H]1CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2125823337 OTTGYFZAIOQKCQ-LTEOIEINSA-N 326.194 1.361 10 10 EDCE CS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccccc2O)n1 1595793562 WWVZIGJYRDOZEV-UHFFFAOYSA-N 340.788 1.774 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)[C@@H]2CCCO2)c2nccn2C)cc1 169813575 BTMXCMUEPZRPKE-JKSUJKDBSA-N 328.416 1.871 10 10 EDCE COc1cc2c(=O)oc3c(O)c(O)cc4c(=O)oc(c1OC)c2c34 15150613 DMPZOHHHRRENRS-UHFFFAOYSA-N 330.248 1.919 10 10 EDCE endogenous,in-man Cc1c(OCCC(N)=O)c(=O)ccn1CCCOc1ccc(N)cc1 1857919820 ZJCLLXPHEFIHEQ-UHFFFAOYSA-N 345.399 1.462 10 10 EDCE Cc1c(O[C@H](C)C(N)=O)c(=O)ccn1CCOc1ccc(N)cc1 1857919738 UXCMTNKFFARTEC-GFCCVEGCSA-N 331.372 1.071 10 10 EDCE Nc1ccc(OC[C@@H](O)CN(Cc2ccccc2)C2COC2)cc1 1915707310 OFSMHSKVMVZPQQ-SFHVURJKSA-N 328.412 1.910 10 10 EDCE CN(C)c1ccc([C@@H](NN)c2c(Br)nnn2C)cc1 234250441 ZMCGPABBKFHVRN-SNVBAGLBSA-N 325.214 1.196 10 10 EDCE CCN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C1CN(C)C1 2146886740 RODOUDVVOQCKQG-CYBMUJFWSA-N 340.221 1.575 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 1985099821 SJXKRNWMHDFEAX-QWRGUYRKSA-N 327.385 1.421 10 10 EDCE Cn1[nH]c(=NC(=O)OC(C)(C)C)cc1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010404802 VLNWFBSROUKVSO-SECBINFHSA-N 335.368 1.714 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CO[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]21 2010401714 HKIMBCBEELCCKM-QJPTWQEYSA-N 339.396 1.637 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010406619 WVNSWYDSFMBNEL-QJPTWQEYSA-N 339.396 1.827 10 10 EDCE CN(CCN(C)C(=O)c1cc(O)c(O)c(O)c1)C(=O)OC(C)(C)C 2015126163 RPZLJTACXFKSGB-UHFFFAOYSA-N 340.376 1.742 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]([C@H](O)[C@H](N)c2ccccc2O)C1 2022716857 JIPIMLVEHCYVOG-KFWWJZLASA-N 338.404 1.389 10 10 EDCE C[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C[C@@H]1NC(=O)C(F)(F)F 2044625749 YWFZLKNZZWRZJZ-MFKMUULPSA-N 343.349 1.727 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)Cc2ccc(N)cc2)[C@H](O)C1 2052720297 JQQPWEZVLYILMV-LSDHHAIUSA-N 349.431 1.298 10 10 EDCE CNCc1ccc(N2CC[C@](C)(O)[C@](C)(O)C2)c(Br)c1 2194607884 CGJLXTLUEASQDB-LSDHHAIUSA-N 343.265 1.881 10 10 EDCE CCNCc1ccc(N2C[C@H](O)C[C@@H](O)C2)c(Br)c1 2105072641 GZQXKDBDKXBDIP-VXGBXAGGSA-N 329.238 1.491 10 10 EDCE CN1CCCN(c2ccc(CN)cc2Br)CCC1=O 2096285884 WVBGVASPEYJUCX-UHFFFAOYSA-N 326.238 1.966 10 10 EDCE CCC(CO)(CO)NCc1c(Br)ccc(OC)c1O 2227746818 QWYPEBBSUGVUGL-UHFFFAOYSA-N 334.210 1.386 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccc(CO)s2)s1 2269091890 BEEAROXGJFODSZ-UHFFFAOYSA-N 336.485 1.897 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H](C3)[C@H]4O)c(Br)cc2[C@@H]1O 2286215614 WJUUKMPILAKNPK-JVQMOBQVSA-N 339.189 1.252 10 10 EDCE CN1CC[C@H](NC(=O)C=Cc2ccc(N3CCOCC3)cc2)CC1=O 2311265387 DZVHZYZOTLDIFR-INIZCTEOSA-N 343.427 1.273 10 10 EDCE CN[C@@H](C)c1ccc(N2CC[C@@H](O)[C@@H](O)C2)c(Br)c1 2331776455 RCLJLIRMSQFASH-FZZIBODNSA-N 329.238 1.661 10 10 EDCE Cc1ccc(CNC(=O)[C@]23CNC[C@@H]2C3)c(O)c1Br 2352642093 ASVTTZXUTIHSLQ-IINYFYTJSA-N 325.206 1.689 10 10 EDCE Cc1ccc(CN2C[C@H](O)[C@@H](O)C2(C)C)c(O)c1Br 2352687139 OEHYUQHZNVEBLX-GXFFZTMASA-N 330.222 1.779 10 10 EDCE CC(=O)N(C(=O)[C@@H]1CCCN1C(=O)C(F)(F)F)c1ccc(N)cc1 170225767 BPHBGOMZVXIOKO-LBPRGKRZSA-N 343.305 1.702 10 10 EDCE Cc1ccc(/C=C2/SC(=S)N(CC(=O)NCCO)C2=O)cc1 210393616 OWQZCRYYFIWCTP-XYOKQWHBSA-N 336.438 1.305 10 10 EDCE CC(=O)c1ccc(NC(=O)C(=O)N(C(C)=O)c2ccc(N)cc2)cc1 170318358 BJKZVGZMUFAVOI-UHFFFAOYSA-N 339.351 1.990 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@H](O)[C@H]4C3)c(Br)cc2[C@@H]1O 2358429770 BAPMBWKVGOYXOA-GBWUGMJBSA-N 339.189 1.252 10 10 EDCE NC(=O)[C@@H]1Cc2ccccc2CN1Cc1cc2c(cc1O)OCO2 126346446 BHYDLEACSDPMJI-AWEZNQCLSA-N 326.352 1.533 10 10 EDCE CN1CCN(CCCCN2Cc3ccc(N(C)C)cc3[C@H]2CN)CC1 71683352 PQYMWNLMSBRGEI-HXUWFJFHSA-N 345.535 1.596 10 10 EDCE CN[C@H]1CCCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255031970 NKCVAIAXIRZQKS-SKHCZCESSA-N 329.444 1.747 10 10 EDCE CNC[C@H]1CCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255317560 GRHFZDICNGSIJG-DANOYGIBSA-N 329.444 1.604 10 10 EDCE CO[C@@H]1COCC[C@H]1CC(=O)N1CCOc2cc(N(C)C)ccc21 294857728 GCUFGKVWOJGFIJ-SUMWQHHRSA-N 334.416 1.920 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2COC[C@@H](C)N2)c(O)c1Br 2380748486 FJDODQXMHHBUQX-KOLCDFICSA-N 343.221 1.456 10 10 EDCE CCC[C@@H](NC(N)=O)C(=O)NCc1cc(Br)ccc1O 804739213 AZHFUQLOSLOSGD-SNVBAGLBSA-N 344.209 1.608 10 10 EDCE O=C1Nc2cc(N3CC([C@@H](F)CO)C3)c(Br)cc2[C@H]1O 2166893319 BDXYDHOCIWSRPT-JOYOIKCWSA-N 345.168 1.201 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CNCC[C@H](C)F)CC2)cc1 819334150 VTSMQSMBDDFUFQ-RDJZCZTQSA-N 339.455 1.516 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCC[C@@H](C(=O)O)C1 817888335 FIAHUEXSDNZMIY-CQSZACIVSA-N 347.415 1.034 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC[C@H](O)CN1CCOCC1 819376888 JVMFHTKWXCZDNM-APWZRJJASA-N 335.492 1.275 10 10 EDCE COc1ccc(CNC(=O)N[C@H]2CC[C@H](C)S(=O)(=O)C2)c(O)c1 821986977 ZMWFVPAFNHABAY-JQWIXIFHSA-N 342.417 1.166 10 10 EDCE CC[C@@H](NC[C@@]1(OC)CCS(=O)(=O)C1)c1ccc(C)cc1O 903363392 NTMPYPYDCUGYJV-ZBFHGGJFSA-N 327.446 1.945 10 10 EDCE CCOC(=O)c1cnc(NC(=O)NCc2cccc(OC)c2O)n1C 841714580 UJVMDPLPFPCZOC-UHFFFAOYSA-N 348.359 1.633 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@]23C[C@H]4C[C@@H](C(=O)N2)[C@H]3C4)c1 845835137 ZKVSPFKBHHOPBN-QMYRGPIZSA-N 330.384 1.493 10 10 EDCE Cn1ccnc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 741260825 JVKPNYQLOBIPOA-CQSZACIVSA-N 341.415 1.052 10 10 EDCE Oc1ccc(F)cc1CN1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 856534755 BVRWITIAJMFNFY-JKSUJKDBSA-N 329.375 1.882 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)c3ncnn3C)C2)cc1 852274828 NGMHXERFYGCLLB-OLZOCXBDSA-N 344.419 1.463 10 10 EDCE COCc1nc(C(=O)NCc2ccc3c(c2)CCCN3C)n(C)n1 853801287 UBUBKGUXBHSURI-UHFFFAOYSA-N 329.404 1.274 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(C)C[C@H]2CO)cc1Br 699437767 ZDDFXMULPJSDCV-PWSUYJOCSA-N 329.238 1.615 10 10 EDCE C[C@@H](NCCCN1CCCS1(=O)=O)c1cc(F)cc(F)c1O 756689197 SZNXYMDRMWMOIA-SNVBAGLBSA-N 334.388 1.747 10 10 EDCE C[C@H](NC[C@@H]1C[C@H]2COC[C@@H]2O1)c1ccc(N2CCOCC2)cc1 930211781 WNJYYTJCVMVMQE-CBVHJVASSA-N 332.444 1.978 10 10 EDCE Cc1ncc(NCc2ccc(N3CCOCC3)cc2)cc1C(N)=O 865295369 FSDVAYIQLPXERY-UHFFFAOYSA-N 326.400 1.938 10 10 EDCE C/C=C\C[C@@H]1NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 761068660 ISPJDUOOTGRGNK-YPQKKHBXSA-N 329.400 1.910 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@H](CO)OC[C@H]2C)c([N+](=O)[O-])c1 765537940 ZUSYXWLDWSRBPY-DMBZQDCGSA-N 336.344 1.367 10 10 EDCE COc1ccc(C=C2C(=O)N(C)C(=O)N(C)C2=O)cc1OC1CC1 863177813 XBJKGGWPPGPDBM-UHFFFAOYSA-N 330.340 1.670 10 10 EDCE Cc1ccc(O)c(CNC(=O)CCC(=O)Nc2nnc(C3CC3)o2)c1 862758728 IRLATLCPIHSDHR-UHFFFAOYSA-N 344.371 1.996 10 10 EDCE COC[C@@]1(C)CN(Cc2ccc(N3CCOCC3)c(F)c2)CCO1 862552446 YXJXKJAAZUAVGC-GOSISDBHSA-N 338.423 1.900 10 10 EDCE Cc1cnc(N)c(S(=O)(=O)NCCCSc2nccs2)c1 769753969 FZCYYSHJJCFFLV-UHFFFAOYSA-N 344.487 1.889 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCSC[C@@H]2CCO)cc1F 775423510 NWWXVNMROGCQMX-ZDUSSCGKSA-N 341.452 1.901 10 10 EDCE O=C(NCCN1CCCOCC1)c1cc2cc(O)c(O)cc2s1 897501862 CCMQZLSUCBUUDG-UHFFFAOYSA-N 336.413 1.765 10 10 EDCE COc1cccc(CNC(=O)c2ccc(S(C)(=O)=O)nc2)c1O 1137473736 UMADSVOGCBEXDY-UHFFFAOYSA-N 336.369 1.129 10 10 EDCE CC(=O)N/C(=C/C1=S=CC=C1)C(=O)Nc1nc2cnccc2[nH]1 1153373688 JQCKSPAHQJVPNX-KPKJPENVSA-N 327.369 1.194 10 10 EDCE CCC(=O)N(C)CCCN(C)Cc1nnnn1-c1ccc(OC)cc1 1273475451 PJIMOXTZCDVCNX-UHFFFAOYSA-N 346.435 1.361 10 10 EDCE C[C@H]1C[C@@H](NCCCO)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1277785103 FCFCOVFSAXSZJC-WFASDCNBSA-N 347.419 1.814 10 10 EDCE CCO[C@H](C)C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1295590388 HDCUXRFRDAKOKV-SNVBAGLBSA-N 329.780 1.972 10 10 EDCE CCOC(=O)Cc1nnc(NC(=O)c2c(F)ccc(O)c2O)s1 1457723914 UHLKUNIHPIFLMK-UHFFFAOYSA-N 341.320 1.446 10 10 EDCE C[C@@]1(CC(=O)Nc2c(Cl)ccc3nonc23)CCS(=O)(=O)N1 1539058584 HTIPWVNZAPAPCJ-LBPRGKRZSA-N 344.780 1.287 10 10 EDCE C[C@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCN1c1cnccn1 1607977488 ASTMUUFCHRLOML-LQPUYASZSA-N 340.383 1.638 10 10 EDCE O=C1C[C@@H](c2cccc(NC(=O)Cc3ccc(O)c(O)c3)c2)CN1 1545986050 WXCNZZWALIPWBR-CYBMUJFWSA-N 326.352 1.883 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C2C=CC=CC=C2)cc1C 1725531586 PKPZCDSKKQYYBC-GOSISDBHSA-N 342.439 1.869 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@]2(C)CCNC2=O)cc1C 1725509489 XOUMAWIYZUXUEK-KUHUBIRLSA-N 347.459 1.466 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H]1CCCOC1 1567083510 MLLLXDDBLWTTBS-STQMWFEESA-N 347.419 1.984 10 10 EDCE NS(=O)(=O)c1ccc(C(=O)NCc2c(O)ccc3ccccc23)o1 1635964919 FHGABXJHCMHUHS-UHFFFAOYSA-N 346.364 1.716 10 10 EDCE Cc1cc(C(=O)NC[C@H]2CC[C@@H](C(N)=O)O2)c(C)n1-c1ccccc1 161312049 WVGWJTMXUKBUPL-WBVHZDCISA-N 341.411 1.857 10 10 EDCE Cc1ccc(NC(=O)C[C@@H]2C(=O)NN(C)C2=O)cc1Br 169996095 GRENNDVCMRYZEU-SECBINFHSA-N 340.177 1.206 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CC(=O)OC3(C)C)CC2)cc1 1873831548 SPNHVLMCDWEEBF-HNNXBMFYSA-N 332.400 1.686 10 10 EDCE CNCc1ccc(N2CCNC(=O)C(F)(F)C2)cc1Br 2146741920 SBCJMIVNROAIPA-UHFFFAOYSA-N 348.191 1.740 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NCc2cccc(O)c2O)C1 2011918902 WNNPYIHGNHLRTE-QWHCGFSZSA-N 338.404 1.558 10 10 EDCE CN(Cc1ccccc1)S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 309529292 DGGOZLNOJSUXRG-UHFFFAOYSA-N 336.369 1.879 10 10 EDCE CN1C(=O)O[C@@H]2CN(c3cc(Br)c(CN)cc3F)C[C@@H]21 2176925301 YPSILNKSJXBJMZ-NWDGAFQWSA-N 344.184 1.686 10 10 EDCE CNC(=O)c1cnn(Cc2c(O)cccc2Br)c1O 2070462252 RQBPUFALMRBMIL-UHFFFAOYSA-N 326.150 1.465 10 10 EDCE CN1CCO[C@@H]2CN(c3ccc(CN)c(Br)c3)C[C@H]21 2097702563 IJESCCFZHJSEOU-ZIAGYGMSSA-N 326.238 1.427 10 10 EDCE C[C@H]1CN(C(=O)Cc2ccc(N)cc2)CC[C@@H]1NC(=O)C(F)(F)F 2044627194 PNPHLKQVWPZQSI-GWCFXTLKSA-N 343.349 1.727 10 10 EDCE OCc1ccc(N2CC[C@@]3(O)CCOC[C@H]3C2)cc1Br 2194563938 FEAUEPZSECJWSR-IUODEOHRSA-N 342.233 1.919 10 10 EDCE Cn1cc(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)nc1CNC(=O)OC(C)(C)C 2060638108 SFCNJRZTXRPCCZ-SNVBAGLBSA-N 349.395 1.970 10 10 EDCE CN(C(=O)[C@@]1(O)CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2076970304 OIDPZWJWRXIPTK-GOSISDBHSA-N 349.431 1.994 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213583408 RKCAZRPCDHZPMQ-VWYCJHECSA-N 343.384 1.805 10 10 EDCE COC[C@@H]1[C@@H](O)[C@H](O)CN1c1ccc([C@@H](C)N)c(Br)c1 2234068666 PVLJDVFDKLTYOB-HKSFMPNISA-N 345.237 1.026 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2COC[C@H]2OC)c1O 2236053975 CNCUOKWZBKPZND-NOZJJQNGSA-N 346.221 1.914 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](CO)C[C@@H](CO)C2)cc1Br 2236635947 LISXGMPLLIRXTB-IJLUTSLNSA-N 344.249 1.930 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2C[C@H]2C(=O)O)c1O 2227741122 KXNDFPKXLFLLQT-JGVFFNPUSA-N 330.178 1.974 10 10 EDCE Cc1ccc(C2=NN(C=C3SC(=S)NC3=O)[C@@H](C(=O)O)C2)cc1 2294778308 VHWKRVNWQAENAG-LLVKDONJSA-N 347.421 1.847 10 10 EDCE CC(C)N1C(=O)NC(=O)C(=CNc2ccc3oc(=O)ccc3c2)C1=O 2296548835 JEFBTEIVOMKEJZ-UHFFFAOYSA-N 341.323 1.576 10 10 EDCE CN1CCN(C2=NC(=O)C(=C3C(=O)Nc4ccccc43)S2)CC1 2297325342 BEZGZSHNEXIRDC-UHFFFAOYSA-N 328.397 1.227 10 10 EDCE C[C@H](O)c1ccc(N2CC3(COC(=O)N3)C2)cc1Br 2351838043 SBYFMATYOUBOOT-QMMMGPOBSA-N 327.178 1.801 10 10 EDCE NCc1cc(F)c(N2CC3(CC[C@@H](CO)O3)C2)cc1Br 2361874399 WYKMMTDOAQXWMN-JTQLQIEISA-N 345.212 1.777 10 10 EDCE O=C(N[C@H]1CCCN(c2cccnc2)C1=O)c1cccc(O)c1O 365948405 WPSUFLSFHCWTEG-ZDUSSCGKSA-N 327.340 1.418 10 10 EDCE Cc1ccc(CN(C)C(=O)c2nn[nH]c2N)c(O)c1Br 2380765122 JTJLLGOFGYVIHU-UHFFFAOYSA-N 340.181 1.436 10 10 EDCE CNC(=O)[C@]1(C)CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])C1 281987284 NDOLYSJKZAKFOE-QQOXCAACSA-N 347.371 1.743 10 10 EDCE CCOc1ccc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)c(O)c1 809689112 UIZXJNYRFPEEBT-HNNXBMFYSA-N 342.461 1.647 10 10 EDCE C[C@@H]1C[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 705985614 UJZJBGYQGJZTJT-OTPXZMOZSA-N 340.221 1.751 10 10 EDCE Cn1cccc(C(=O)NCc2ccc(N3CCOCC3)cc2)c1=O 729262650 HUJJZFXOLRAWQC-UHFFFAOYSA-N 327.384 1.152 10 10 EDCE C[C@@H](NC(=O)N1CN(C)C(=O)[C@H]1C)c1ccc(N2CCOCC2)cc1 825775757 AOADCOXDEHKYNV-ZIAGYGMSSA-N 346.431 1.414 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)C[C@H]3CCCN3)CC2)cc1 829504618 GPXASGZSVAQANL-MRXNPFEDSA-N 346.475 1.076 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(NC(=O)C3CC3)C2)c([N+](=O)[O-])c1 588524435 KPNMFDWSRJYGBP-CLTKARDFSA-N 345.355 1.496 10 10 EDCE CN(C)C(=O)CCN1CCN(C/C=C\c2ccc(N(C)C)cc2)CC1 835028616 NFZUDWSHWMIJIZ-WAYWQWQTSA-N 344.503 1.862 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NC1CCC(C(N)=O)CC1 747586577 ZNSVQKWTSCHKMB-UHFFFAOYSA-N 332.448 1.904 10 10 EDCE Cn1c(C(=O)NCc2cc(Cl)ccc2O)c2n(c1=O)CCCC2 846476128 JHJRWWQCSPKSQL-UHFFFAOYSA-N 335.791 1.812 10 10 EDCE O=S(=O)(NCc1c(O)cccc1F)c1cn2c(n1)CCCC2 921452783 ZGZWZXQCUHAQEQ-UHFFFAOYSA-N 325.365 1.543 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC3=C(CCC(=O)N3)C2)cc1 852298602 CDYYSUKTSBHIDJ-UHFFFAOYSA-N 342.443 1.239 10 10 EDCE C[C@H](NC(=O)[C@@H](C(=O)O)C1CC1)c1ccc(N2CCOCC2)cc1 852950866 MYXARMNKMKXUIB-LRDDRELGSA-N 332.400 1.811 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CC[C@H](C2CC2)N1 852868291 CWHVYYVZJBOLOI-MOPGFXCFSA-N 343.471 1.795 10 10 EDCE CCCC[C@@H](NC(N)=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855229421 JZXFAQNJWQXLMT-CZUORRHYSA-N 348.447 1.617 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3nc(C)c(C)[nH]c3=O)C2)cc1 855233927 PKQZCFAGNKLWEE-ZDUSSCGKSA-N 342.399 1.404 10 10 EDCE CN(C)C(=O)N(C)[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 853585212 WNVVNCWWHVKZAP-DOMZBBRYSA-N 335.404 1.006 10 10 EDCE CC[S@@](C)(=O)=NS(=O)(=O)NCc1ccc(N(C)C)c(F)c1 866673054 VSCRPYHDQVGFOS-HXUWFJFHSA-N 337.442 1.344 10 10 EDCE CN(C)c1cc(F)c(CN2CC[C@@H]3OCC(=O)N[C@H]3C2)cc1F 862390850 HIWYWJKTVOCUHI-ZFWWWQNUSA-N 325.359 1.120 10 10 EDCE CS(=O)(=O)NCC1CCN(Cc2c(O)ccc3ccncc23)CC1 795669365 FTNQGTQHOKISNR-UHFFFAOYSA-N 349.456 1.702 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCC(=O)N(C)C2)c1O 1964037749 BHCXIIUOCOHODN-SECBINFHSA-N 343.221 1.874 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CC(N2CCNCC2)C1 715780465 VCICMIIHOBRNCC-UHFFFAOYSA-N 344.228 1.383 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)CCn2cncn2)cc1C 1507047497 MYTUBFWZQGHEKY-HNNXBMFYSA-N 345.447 1.622 10 10 EDCE C[C@H](c1ccccc1)N(CC(N)=O)C(=O)Cc1ccc(O)c(O)c1 1465927788 GSFLJDKYCSLCBB-GFCCVEGCSA-N 328.368 1.715 10 10 EDCE CN1C(=O)NCC12CN(c1ccc(CN)cc1Br)C2 2121196630 DQXWLMXNQWXXLT-UHFFFAOYSA-N 325.210 1.122 10 10 EDCE O=C(C[C@H]1CS(=O)(=O)c2ccccc2O1)NCc1ccccc1O 1545682146 SWYXNYOAXHRLGB-ZDUSSCGKSA-N 347.392 1.633 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](c1cncn1C)N(C)C 1627689141 JYXPTMNNHHNGFO-QGZVFWFLSA-N 329.448 1.714 10 10 EDCE CNC(=O)NCCC(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 1499217255 UCIXZIWJLQDBGR-UHFFFAOYSA-N 348.447 1.061 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CCN(C)C2)cc1C 1568317414 OFJCQYOFOHTCAP-WBVHZDCISA-N 333.476 1.892 10 10 EDCE C[C@H](CCN(C)C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1642155211 IPIABMJATCWRJU-OAHLLOKOSA-N 333.476 1.852 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1ccc(-n2[nH]c(O)nc2=O)cc1 1566303931 LBXGJSCKTDDMNS-UHFFFAOYSA-N 340.339 1.244 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2cnn(C)c2N)cc1C 1732688672 HPMXFSQIXWNMKX-CYBMUJFWSA-N 345.447 1.618 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)O)C1(c2ccc(O)c(O)c2O)CC1 1952603247 UXCBKMDZIZMPPO-LBPRGKRZSA-N 339.344 1.813 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)NCC1(CN=[N+]=[N-])CC1 1986369620 VTAXJBIKZZIIEI-JTQLQIEISA-N 327.385 1.469 10 10 EDCE Cc1cc(Br)cc(CN2CC[C@@H](NC(N)=O)C2)c1O 271758073 AYHATQIXYJDNPU-LLVKDONJSA-N 328.210 1.706 10 10 EDCE O=C1Nc2cc(N3CC(N4CCC4)C3)c(Br)cc2[C@H]1O 2152247694 BQNMMNIACSJLAY-CYBMUJFWSA-N 338.205 1.329 10 10 EDCE Nc1ccc(N2C(=O)[C@@H]3[C@@H]4CC[C@@H](O4)[C@@H]3C2=O)c(Br)c1 2153255725 OMAIVJDKEOGUBP-IWDIQUIJSA-N 337.173 1.698 10 10 EDCE CNCc1ccc(N2CCC[C@@H]3C(=O)NC[C@H]32)c(Br)c1 300500143 ZNEMUNKOTYOKGN-SMDDNHRTSA-N 338.249 1.883 10 10 EDCE Cc1ccc(O)c(CNCC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c1 2041264238 BBUGNWICOJDWFV-UHFFFAOYSA-N 349.431 1.513 10 10 EDCE CS(=O)(=O)[C@@H]1CCCN(c2ccc(CN)c(Br)c2)C1 311796267 JVKYIPHYRRTHTO-GFCCVEGCSA-N 347.278 1.921 10 10 EDCE C[C@H](F)CS(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 2177549325 ABORONIETMQVSR-ZETCQYMHSA-N 344.817 1.811 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC=CC[C@@H]3CO)c(Br)cc21 2176342980 NBNVZVHHUHQAOA-AMIZOPFISA-N 338.205 1.528 10 10 EDCE COCC(=O)N1CCN(c2ccc(CN)cc2Br)CC1 2182577880 GINSLFRXEOUEHH-UHFFFAOYSA-N 342.237 1.203 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)[C@@H]2C1 1907306084 GACMAEYOXIILGE-HTVCTNPSSA-N 336.432 1.755 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H](NC(=O)Cc2ccc(N)cc2)C1 2044229347 UTAWPRPUZZQGPR-OAHLLOKOSA-N 349.431 1.563 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2199527172 OMMZMMCTXLEQQK-UJZSJCAASA-N 341.249 1.789 10 10 EDCE CS(=O)(=O)C[C@@H]1CCCN1c1ccc(CO)cc1Br 2094922458 CXWNYPVQUVWPFD-NSHDSACASA-N 348.262 1.955 10 10 EDCE CNCc1ccc(N2CC[C@@H]([C@@](C)(O)CO)C2)c(Br)c1 2202851680 CTAVENYAPMTZAL-DOMZBBRYSA-N 343.265 1.738 10 10 EDCE CC(C)(C)OC(=O)NC1(COc2nnc(=N)[nH]n2)CCCCCC1 2213778704 KGXUGRHJMPBIHO-UHFFFAOYSA-N 338.412 1.676 10 10 EDCE Oc1ccccc1CNCCn1cnc(I)c1 2215653374 XCRQLBBGBBFJOV-UHFFFAOYSA-N 343.168 1.983 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](CO)C[C@@H](CO)C2)c(Br)c1 2236637050 RCHZCWDGGKWHCR-QJPTWQEYSA-N 343.265 1.896 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)C[C@H]3C2)c(Br)c1 2236991983 ZMHNFNCUPGYZSH-BAESOJJISA-N 342.233 1.509 10 10 EDCE COC(=O)C1(NCc2c(Br)ccc(OC)c2O)CC1 2268318730 XPJWRBROTGXOLS-UHFFFAOYSA-N 330.178 1.959 10 10 EDCE COc1cc(C=C2NC(=S)N(C)C2=O)cc(Br)c1O 2293631456 PCSFHLHHPWUJQS-UHFFFAOYSA-N 343.202 1.851 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)NCc1ccc(N)cc1 2303219143 SYSWPDDKVWMIEY-UHFFFAOYSA-N 337.420 1.505 10 10 EDCE Cc1ccc(C(=O)NCCNC(=O)C=Cc2ccc(O)c(O)c2)cc1 2307996847 ZXMDZAXLUKWMBA-UHFFFAOYSA-N 340.379 1.966 10 10 EDCE O=C(c1ccc(=O)[nH]c1)N1CCc2cc(N3CCOCC3)ccc21 62526653 MJYHKOXGUIPVLD-UHFFFAOYSA-N 325.368 1.414 10 10 EDCE Cc1cc(C)n(C[C@@H]2CN(C(=O)c3ccc(C)c(O)c3O)CCO2)n1 182419046 DETXQKXKLIXYME-AWEZNQCLSA-N 345.399 1.761 10 10 EDCE CC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(O)c(C)c2)s1 228651601 TXNMRXZIBLCRQU-UHFFFAOYSA-N 328.375 1.311 10 10 EDCE Cc1ccc(CN2C[C@H](O)CC[C@H]2C(=O)O)c(O)c1Br 2381136297 DGANPSQLZPVDJE-MNOVXSKESA-N 344.205 1.873 10 10 EDCE COC(=O)[C@H]1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 298737374 RBQPZFIQPKPETE-HNNXBMFYSA-N 333.432 1.206 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@@H](O)c2c(Br)nnn2C)cc1 2163142733 DBZHPYVLTRKECZ-ZYHUDNBSSA-N 340.225 1.377 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCC[C@@H](C(=O)O)C1 817897449 PVMQTDHGALKJGQ-CQSZACIVSA-N 348.399 1.454 10 10 EDCE CN1CCN(c2ccc(CN[C@@H]3CCc4nc[nH]c4C3)cc2)CC1 810171703 QLRFXMDXWWNXGU-MRXNPFEDSA-N 325.460 1.809 10 10 EDCE Cn1ccnc1COCC(=O)NCc1ccc(N2CCOCC2)cc1 816897943 PKFXKBZIINBGHD-UHFFFAOYSA-N 344.415 1.090 10 10 EDCE CCOC(=O)C[C@@H](CO)NC(=O)c1cc(C)n(-c2ccccn2)c1C 820048606 ANQXMPYRSUSZHU-AWEZNQCLSA-N 345.399 1.533 10 10 EDCE O=C([C@@H]1CCCO1)N1CCOc2ccc(N3CCOCC3)cc2C1 581789045 HGZIEFJUORTIQI-KRWDZBQOSA-N 332.400 1.423 10 10 EDCE COc1ccc(N2CCCN(C(=O)/C=C\Cn3cncn3)CC2)cc1 900293855 PLAHLWYJDQWWHB-RQOWECAXSA-N 341.415 1.582 10 10 EDCE Cn1[nH]cnc1=NCc1ccc(N2CCN(CC3CC3)CC2)cc1 846752923 WJTLVLCLFQBCLJ-UHFFFAOYSA-N 326.448 1.381 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CNCC[C@H]1C 842267284 XKHPJAGXZLXZJH-PBHICJAKSA-N 346.475 1.215 10 10 EDCE COc1cnc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2C)nc1 845872112 BWKPFKVYFKXSPK-UHFFFAOYSA-N 343.387 1.115 10 10 EDCE CCOC(=O)c1cn(C)nc1NC(=O)NCCc1ccc(N)cc1 841173149 GJWYWIQXRHBQRR-UHFFFAOYSA-N 331.376 1.543 10 10 EDCE COC[C@@H](NC(=O)NCc1c(O)cccc1F)C1CCOCC1 923194210 DPGQXAMYZUWBAF-CQSZACIVSA-N 326.368 1.772 10 10 EDCE C[C@H]1C[C@H](C)CN(S(=O)(=O)NNc2nc3cccnc3s2)C1 857225614 OJLNDKRLIQGLEL-UWVGGRQHSA-N 341.462 1.831 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@@H]4C[C@H]3C[S@@]4=O)C2)cc1 852448623 KXWLPHLIXIXYLO-GJGGLWAXSA-N 349.456 1.189 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)c3conc3C)C2)cc1 867496406 CMYZUIMFIGHRCT-GFCCVEGCSA-N 337.401 1.549 10 10 EDCE C[C@H](NC(=O)N1CCN2CCOC[C@@H]2C1)c1ccc(N(C)C)cc1 776244171 FKWVWIBSJWYOPS-YOEHRIQHSA-N 332.448 1.540 10 10 EDCE Cc1nn(CC(=O)NCc2cc(Cl)cc(Cl)c2O)c(=O)o1 880004320 SYNFCTGPXPOLDN-UHFFFAOYSA-N 332.143 1.474 10 10 EDCE Cn1cc(C[C@H](O)C(=O)NCc2ccc(N3CCCCC3)cc2)cn1 786843504 YRRGNTXBBAEGJK-SFHVURJKSA-N 342.443 1.630 10 10 EDCE C[C@H](NC(=O)[C@]1(C)CCC(=O)NC1)c1ccc(N2CCOCC2)cc1 798409410 XQGKVMSRJZIIDG-IFXJQAMLSA-N 345.443 1.617 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2CCNC(=O)C2)cc1C 1317390325 OESYPYVAIGRMJK-GDBMZVCRSA-N 347.459 1.514 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCC3(C)CC3)C2)cc1 1329063151 YSGNAHIFHQIZKE-AWEZNQCLSA-N 345.443 1.697 10 10 EDCE CN(CC(C)(C)O)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 92968453 XMDOEXFUMDIHPP-LLVKDONJSA-N 328.210 1.608 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3ccc[n+]([O-])c3)C2)cc1 1345920874 LQXGXBYLRSHEOK-CQSZACIVSA-N 328.372 1.729 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1Cc1ncn(C)n1 1292840276 GYBKEDGCCBLGPJ-UHFFFAOYSA-N 327.392 1.359 10 10 EDCE CCC(=O)N[C@H](CCSC)C(=O)NCc1cccc(O)c1O 1520509672 TYGMYWJLDVJNKN-LLVKDONJSA-N 326.418 1.362 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCNC(=O)c2ccoc2)cc1 1703315655 NSUXRWOFXNEINJ-UHFFFAOYSA-N 343.343 1.992 10 10 EDCE C[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@H]1CNCCO 1482502161 XTHYMFLWEOLVDM-DOMZBBRYSA-N 347.419 1.672 10 10 EDCE NC(=O)N[C@@H](CC(=O)NCc1ccc(O)cc1O)c1ccccc1 1557085043 ZRKQPSCZJYJPLJ-AWEZNQCLSA-N 329.356 1.514 10 10 EDCE COc1ccc(CNC2(CNC(=O)C3=COCCO3)CC2)cc1C 1569390050 ZZVALHNPGQWBBN-UHFFFAOYSA-N 332.400 1.630 10 10 EDCE COC(=O)c1oc(C(=O)Nc2nc(C3=S=CC=C3)n[nH]2)cc1C 1638158409 BHKNIXXBWMKHIL-UHFFFAOYSA-N 332.341 1.371 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cnc3[nH]ncc3c2)c1 1647806967 SIWXSPZUKUEJGW-UHFFFAOYSA-N 347.356 1.287 10 10 EDCE CC[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@@H](C)OC 1582482868 OTODUISASOJEBA-PWSUYJOCSA-N 349.391 1.509 10 10 EDCE O=C(O)C=Cc1ccc(N2CCCNC(=O)C2)c(Br)c1 1911855454 LAAJWCOWOINGGX-UHFFFAOYSA-N 339.189 1.873 10 10 EDCE CNc1nc2ccccn2c(=O)c1/C=C1/SC(=S)N(C)C1=O 1464605 SEHNPTWPFUDTGO-VQHVLOKHSA-N 332.410 1.567 10 10 EDCE CNCc1ccc(N2CCN3C(=O)NC[C@H]3C2)c(Br)c1 234429899 NCZDKPBYHBRHGB-NSHDSACASA-N 339.237 1.382 10 10 EDCE CC(C)(C)OC(=O)N1CCN(NCc2ccc(O)c(O)c2O)CC1 1941832185 QROXIQNZHDXBTB-UHFFFAOYSA-N 339.392 1.361 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1CNCCO1 1952195407 CTTYUKGMBAHJGS-WFASDCNBSA-N 338.404 1.522 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1C 1985094049 JHXLCTWRTXQXQS-LLVKDONJSA-N 326.401 1.306 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 1985095601 GTEZEXSVHMAPPO-SNVBAGLBSA-N 325.369 1.270 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CN1CC[C@@H](NC(=O)OC(C)(C)C)C1 1985094433 OVXCOFJSFZBXOH-LLVKDONJSA-N 326.401 1.354 10 10 EDCE COC(=O)[C@@H](CNC(=O)OC(C)(C)C)N(C)Cc1ccc(N)cc1 1999258857 OXMVZTDYYSDBAN-CQSZACIVSA-N 337.420 1.767 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)[C@H]1CCOC1 2003172212 HXAAKUFTHZLZQE-ZJQBRPOHSA-N 340.420 1.182 10 10 EDCE OC[C@H]1CN(c2ccc(CNC3CC3)c(Br)c2)C[C@H]1O 316630890 ZJCRODJUNFVJHA-IAQYHMDHSA-N 341.249 1.491 10 10 EDCE Oc1ccc(CNC[C@]2(O)CCN(Cc3ccccc3)C2)c(O)c1 702605754 WHCJPNREZCDXNS-LJQANCHMSA-N 328.412 1.824 10 10 EDCE CNCc1ccc(N2CC[C@@]3(CNC(=O)C3)C2)cc1Br 2163325709 KVZCHMAKZZFLPI-OAHLLOKOSA-N 338.249 1.885 10 10 EDCE CNCc1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)cc1Br 2178088230 WMZFLPZDNGGWFX-KYOSRNDESA-N 341.249 1.612 10 10 EDCE CC(C)[C@H]1C(=O)NCCN1c1ccc(CO)cc1Br 2113703346 KQRZJXDROPINEK-ZDUSSCGKSA-N 327.222 1.902 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CCC2)C[C@H]1COc1nnc(=N)[nH]n1 2213785625 OOZPHRFPPPGOFF-JTQLQIEISA-N 336.396 1.238 10 10 EDCE NCc1ccc(N2C[C@@H]3COC[C@]3(CO)C2)c(Br)c1 2226164939 XDCPXRQGNWYHTB-BXUZGUMPSA-N 327.222 1.353 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@H]1C(=O)NCCCN=[N+]=[N-] 2242655259 BHDDADRLIJKOGL-MNOVXSKESA-N 327.385 1.563 10 10 EDCE CN1C(=O)C(=CNCCc2c[nH]c3ccccc23)C(=O)NC1=S 2294265202 MINFYKLZNWMJLE-UHFFFAOYSA-N 328.397 1.057 10 10 EDCE CCCCN1CCc2cc(C=C3C(=O)NC(=O)N(C)C3=O)ccc21 2296938888 IBZSXHCGUHRCFF-UHFFFAOYSA-N 327.384 1.941 10 10 EDCE CNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCN1CCCN=[N+]=[N-] 2303498426 INKTZVXJYNVTJI-LBPRGKRZSA-N 340.428 1.744 10 10 EDCE C[C@@H](Cn1cncn1)NC(=O)NCc1ccc2c(c1)CCCN2C 102010915 BMZYCNWIPJMBJL-ZDUSSCGKSA-N 328.420 1.548 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CN2CCCC[C@@H]2CN2CCOCC2)c1 173376946 SNVNNSREMWUXPX-MRXNPFEDSA-N 335.404 1.987 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)cc1Br 2357052505 KNLOKVZNYDKAAK-FSJWZZSZSA-N 341.249 1.932 10 10 EDCE C[C@@H]1Oc2ccc(S(=O)(=O)Nc3ccc(O)cc3)cc2NC1=O 71538601 YBMLFDJMDXHRBN-VIFPVBQESA-N 334.353 1.912 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2cc3c(cc2O)CCCC3)CCO1 530102108 DMIZQSWGIZSVMS-MRXNPFEDSA-N 333.432 1.401 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H](OC)[C@H](OC)C2)c([N+](=O)[O-])c1 277131684 CPSDRQQUIPYDLB-GWJAVYCQSA-N 336.344 1.631 10 10 EDCE COCCn1[nH]c(Br)nc1=NCCc1ccc(N)cc1 2381923668 QRPKACNGWVBMGW-UHFFFAOYSA-N 340.225 1.346 10 10 EDCE COC(=O)[C@H]1CN(Cc2ccc(C)c(Br)c2O)CCO1 2380669287 CXBSERKQSIADEE-LLVKDONJSA-N 344.205 1.837 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CO[C@@H](CN)C2)c(O)c1Br 2381141766 DSSVIZKFWJHYFD-GHMZBOCLSA-N 343.221 1.443 10 10 EDCE NC(=O)N1CCC[C@H]1C(=O)NCc1cc(Br)ccc1O 804733265 NGDJCRTXRVBLTA-JTQLQIEISA-N 342.193 1.314 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CS(=O)(=O)C1CCCC1 808096184 DLXZUCMROFCQDK-UHFFFAOYSA-N 346.445 1.852 10 10 EDCE CCN(OC)C(=O)CNC(=O)N[C@@H](C)c1cc(OC)ccc1O 827556929 YWUKIUKJNXOXTQ-JTQLQIEISA-N 325.365 1.171 10 10 EDCE C[C@H]1C[C@@H](S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 830297723 IMLDFPGBMBMROD-AAEUAGOBSA-N 330.425 1.879 10 10 EDCE CC(C)[C@@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)N1CCOCC1 588403311 JQUTWPMCTPFWBX-ZDTYVGOBSA-N 334.416 1.584 10 10 EDCE O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)COCC(F)F 911359563 ANVJLBQYXSLBGT-UHFFFAOYSA-N 337.706 1.741 10 10 EDCE COc1ccc2c(c1)CCCN2CN1C(=O)[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C1=O 840033013 UIIXCVOHVHGLMA-NCOADZHNSA-N 340.379 1.344 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CN[C@H]3CN4CCC[C@H]3C4)cc2)C1 924726887 RNTJEDOCIGNGNQ-LNLFQRSKSA-N 342.487 1.572 10 10 EDCE C[C@@H]1OC[C@H](NCc2ccc(N3CCC(C(N)=O)CC3)cc2)[C@@H]1C 926872243 BXLSXYJAAAIWJF-GLJUWKHASA-N 331.460 1.901 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)c2ccc3c(c2)N(C)CC3)c1 751415780 WYYQXCNRUMBZRG-UHFFFAOYSA-N 348.424 1.872 10 10 EDCE CN(C)c1ccc(/C=C\CNC(C)(C)CNS(C)(=O)=O)cc1 922636896 LJEYHBYTENSAHF-SREVYHEPSA-N 325.478 1.683 10 10 EDCE COCc1n[nH]c(CNCc2c(O)cccc2Br)n1 858189648 UPFWKKOBKMPEJO-UHFFFAOYSA-N 327.182 1.709 10 10 EDCE COc1ccc(CNC(=O)NCc2c(O)cccc2F)c(OC)n1 922543338 AJTNLSOLPUQBMU-UHFFFAOYSA-N 335.335 1.943 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)NC2CN(c3ccncn3)C2)c1 866496751 WWTHRJKHPMFIOP-NSHDSACASA-N 328.372 1.508 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCNC2=O)cc1 862153677 RQJQXEMTRCUFSO-KRWDZBQOSA-N 339.395 1.454 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cn(C)c(O)n3)CC2)c(OC)c1 870165737 LMBRVDOFRPVSAF-UHFFFAOYSA-N 346.387 1.105 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)N2C[C@@H]3C[C@]3(CO)C2)N(C)C)cc1 899101224 GJIXDAMOWMRTTG-VDZJLULYSA-N 346.475 1.379 10 10 EDCE COc1ccc(CNC(=O)c2cccc(-n3cncn3)n2)c(O)c1 1155574943 RUPJQPQENKZHIU-UHFFFAOYSA-N 325.328 1.307 10 10 EDCE O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1c(F)ccc(O)c1O 1160747545 QWMMZEWBJIGKKI-UHFFFAOYSA-N 336.275 1.954 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@H]1CC(=O)N(Cc2ccco2)C1 1162277918 DDLUIAJRCKDJQD-LBPRGKRZSA-N 330.340 1.356 10 10 EDCE NCc1ccc(N2CC(n3cncn3)C2)c(F)c1Br 707646003 VUEGWUGDMASEAT-UHFFFAOYSA-N 326.173 1.700 10 10 EDCE C=C/C=C\CCNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1338861292 LAQIHCARKJLUAY-FOSCPCJNSA-N 343.427 1.639 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)C2CC=CC2)cc(OC)n1 1337099041 CKFSDFULSDEAOP-GFCCVEGCSA-N 347.415 1.642 10 10 EDCE CNC(=O)C(C)(C)NCc1c(Br)ccc(OC)c1O 1964567606 XYTHCNKOVJYGOD-UHFFFAOYSA-N 331.210 1.778 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)Cc2nonc2C)cc1C 1283694490 VYISCGBFGRVFET-CYBMUJFWSA-N 346.431 1.874 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cnc(O)c(Br)c1 1455357128 OJXQXWIACDRHCR-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE Cc1cc(C(=O)NCc2c(O)cccc2F)nc2nc(O)nc(O)c12 1456029375 MWKMUFILUXNGBO-UHFFFAOYSA-N 344.302 1.519 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)[C@H]2CC[C@@H](C(N)=O)C2)N(C)C)cc1 1539236801 YNBRNRHOSXCSAC-VYDXJSESSA-N 346.475 1.373 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccc(F)nc2)cc1C 1715576125 AGRQUPVEGQXHPM-OAHLLOKOSA-N 347.390 1.418 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cnc(C)s2)cc1C 1482712600 FPJHCYPBODKYFY-AWEZNQCLSA-N 349.456 1.649 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@H]4CC[C@@H](O)[C@H]4C3)C2)cc1 1636853480 BOWHCFTVZRKTPN-KJWYOANISA-N 345.443 1.686 10 10 EDCE NS(=O)(=O)c1ccc(C(=O)NCc2cc(Cl)ccc2O)o1 1639965159 FULBPMYTPBPQQD-UHFFFAOYSA-N 330.749 1.216 10 10 EDCE COC(=O)[C@@H](Cc1ccccc1O)NC(=O)c1ccc(C)c(O)c1O 1646064890 JVGHJYSRILJISO-CYBMUJFWSA-N 345.351 1.626 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H](F)C(C)C)cc1C 1571438777 SZSSYQRBGRRPQV-HOCLYGCPSA-N 326.412 1.564 10 10 EDCE CC(C)[C@H](C(=O)NCc1cc(O)ccc1O)N1C[C@H](C)O[C@H](C)C1 1643881698 BPYKILJHRKAJHO-IIYDPXPESA-N 336.432 1.848 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1c[nH]c(C(=O)N2CCCC2)c1 1593872979 IXUWVXDWXYGVGB-UHFFFAOYSA-N 329.356 1.592 10 10 EDCE [N-]=[N+]=NC[C@H]1CCCN(C[C@H](O)CN2C(=O)c3ccccc3C2=O)C1 1912173619 OOODYAFAYUYYIX-OLZOCXBDSA-N 343.387 1.666 10 10 EDCE C[C@@H](CCNC[C@@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1699161751 AMIVZVWHOFCKBS-STQMWFEESA-N 347.419 1.984 10 10 EDCE CN1C[C@H](NC(=O)NCCCSc2nccs2)CCC1=O 153802232 PBSZUJITBYCUNW-SNVBAGLBSA-N 328.463 1.545 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N(C)C3COC3)c(Br)cc21 1915666705 IGNXQCGGOCCMLG-ZDUSSCGKSA-N 340.221 1.887 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1ccc2c(c1)NC(=O)[C@@H]2NC 2034782825 MWTWLSINRBDMNI-GOSISDBHSA-N 338.411 1.652 10 10 EDCE NCc1cc(F)c(N2CC3(C2)OCCC[C@H]3O)cc1Br 2159646801 JMDSPLRSJBFMKH-CYBMUJFWSA-N 345.212 1.777 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@@H](CO)C2)c(Br)c1 316967129 IBWGPYTUBYPNNF-GLXFQSAKSA-N 329.238 1.519 10 10 EDCE CC1(C)CN(C2CN(c3ccc(CO)c(Br)c3)C2)C1=O 2182230105 FDBMXUMUOCAIIE-UHFFFAOYSA-N 339.233 1.998 10 10 EDCE CNCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)c(Br)c1 2189067436 NBOOZFCUFFMPPN-JYAVWHMHSA-N 341.249 1.612 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)NCc1ccc(N)cc1 1910912833 VYTYPVQHTCYRLX-UONOGXRCSA-N 335.404 1.255 10 10 EDCE COc1ccc(N2CCN(C)C[C@@H]2CNC(=O)C(F)(F)F)c(N)c1 2044727634 CMDJHIHWPRDXIN-JTQLQIEISA-N 346.353 1.076 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2199533022 SVGVGHINUXPFQT-UJZSJCAASA-N 342.233 1.823 10 10 EDCE O=C1NC[C@@H]2CCCN(c3ccc(CO)cc3Br)[C@@H]12 2264591330 AUTVGFIURHZCNV-GXFFZTMASA-N 325.206 1.656 10 10 EDCE Cc1n[nH]cc1CNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297505864 HHCFCEBZYNDBPG-UHFFFAOYSA-N 326.400 1.884 10 10 EDCE COc1ccc([N+](=O)[O-])cc1/C=C1\SC(N2CCOCC2)=NC1=O 59478038 BENSUAHAVNSMPG-LCYFTJDESA-N 349.368 1.906 10 10 EDCE CC(C)(C)N1C(=O)NC(=O)/C(=C/NCCOc2ccccc2)C1=O 105448235 JEWPEFPAQUOGMT-QBFSEMIESA-N 331.372 1.416 10 10 EDCE O=C(O)/C=C\c1ccc(N2CC(=O)NC(=O)C2)cc1Br 312185909 QYGPEEDZENSARH-RQOWECAXSA-N 339.145 1.010 10 10 EDCE O=C(O)C[C@H]1CS(=O)(=O)CCN1Cc1c(O)cccc1Cl 128842442 OALQZBSLBWUVGI-VIFPVBQESA-N 333.793 1.119 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3[C@@H](C)CC(O)C[C@@H]3C)nc12 276420068 IJXWGKJTJLZEOG-QWRGUYRKSA-N 348.403 1.345 10 10 EDCE COc1ccc(N2CCN(CCN[C@H](C)c3ncc[nH]3)CC2)cc1 285969296 HBKPVQTUFDXIQT-OAHLLOKOSA-N 329.448 1.891 10 10 EDCE Cc1ccc(CN2C[C@@H]3[C@@H](CO)CO[C@H]3C2)c(O)c1Br 2380802067 BNEFIKOTVPLCED-XQQFMLRXSA-N 342.233 1.902 10 10 EDCE O=C(NCc1cc(Br)ccc1O)C1CN(CC(F)F)C1 804738529 TWISYIZBUQWPKK-UHFFFAOYSA-N 349.175 1.968 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)Cc1cc[nH]n1 807095136 LFLOKHNWLYLVFF-UHFFFAOYSA-N 329.404 1.059 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CC34CC4)cc2)C1 823862259 NDEMFVONIVJSHK-HOCLYGCPSA-N 342.443 1.740 10 10 EDCE CCN(C)c1ccc([C@H](C)NC[C@]2(OC)CCS(=O)(=O)C2)cc1 903368656 PDDWLCPPIRUEOZ-WMLDXEAASA-N 340.489 1.997 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CC[C@@H](N2CC[C@@H](O)C2)C1 908200558 JEDFMPDZURSVOB-VXGBXAGGSA-N 348.424 1.594 10 10 EDCE COc1cccc(CNC(=O)[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)O)c1O 911336924 LFFGIVROHPNPCU-LWWSYDQCSA-N 331.368 1.930 10 10 EDCE CN(C)c1ccc(CNC(=O)c2coc(S(C)(=O)=O)c2)cc1F 844357819 RAUBIPMOERDQNM-UHFFFAOYSA-N 340.376 1.818 10 10 EDCE O=S1(=O)CCN(Cc2cc3c(cc2O)CCC3)[C@@H]2CCOC[C@H]21 840168072 YGPWSMZPCJQISZ-NVXWUHKLSA-N 337.441 1.269 10 10 EDCE CNC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)Cc2ccc(N)cc2)C1 842514995 LNDSFAXIYVLRJR-CQSZACIVSA-N 329.322 1.338 10 10 EDCE CO[C@@H](CNC(=O)NCc1ccc(N(C)C)cc1C)[C@H]1CCOC1 852441054 XISOBWMTVPYNME-RDJZCZTQSA-N 335.448 1.912 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@H]4NC(=O)CC[C@H]4C3)cc2N1 853829984 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1578776496 CKUADVJCXNXIIS-WQAKAFBOSA-N 347.375 1.261 10 10 EDCE COC(=O)CCN(C[C@@H]1CCCO1)C(=O)Cc1ccc(O)c(O)c1 1586300377 KLEQYFVWZORKQO-ZDUSSCGKSA-N 337.372 1.211 10 10 EDCE CCCNC(=O)c1ccc(NC=C2C(=O)OC(C)(C)OC2=O)cc1 13617893 COWOQOVBROBGNE-UHFFFAOYSA-N 332.356 1.958 10 10 EDCE O=C(Cn1ncc(=O)c2ccccc21)NCCc1ccc(O)c(O)c1 156693253 URMOURRCNNWEJR-UHFFFAOYSA-N 339.351 1.167 10 10 EDCE CCN(CC)c1ccc(CNCCC(=O)N2CCN(C)CC2)cc1 1649150590 XZFNDGVPOBZQCZ-UHFFFAOYSA-N 332.492 1.787 10 10 EDCE COc1ccc(N2CCN(C(=O)CC(=O)C(F)(F)F)CC2)cc1 1866349872 QOYNGUFNNSBMOD-UHFFFAOYSA-N 330.306 1.865 10 10 EDCE CNC(=O)OCCCNCc1c(Br)ccc(OC)c1O 1973893117 GLIOZJYBEDIQQW-UHFFFAOYSA-N 347.209 1.999 10 10 EDCE C[C@H](N[C@H](CO)CNC(=O)OC(C)(C)C)c1c(O)cccc1O 1985777081 HBVMGGKLPIUABL-QWRGUYRKSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)NCc1ccc(N)cc1 2022785249 VYTYPVQHTCYRLX-KGLIPLIRSA-N 335.404 1.255 10 10 EDCE Cc1ccc(CN=c2nc(CNC(=O)OC(C)(C)C)[nH][nH]2)c(O)c1 2024809322 OSLZDUICRQWJJT-UHFFFAOYSA-N 333.392 1.877 10 10 EDCE CN1C[C@@H](O)[C@H](NCc2cc(Cl)cc(Br)c2O)C1 2029868884 AWIGBZYTEYUYIE-GHMZBOCLSA-N 335.629 1.573 10 10 EDCE CC1(C)C(=O)NCCN1c1cc(Br)c(CN)cc1F 311464646 GYKQHFUDBNNDSA-UHFFFAOYSA-N 330.201 1.762 10 10 EDCE CC[C@@H](N[C@@H]1CN(C)NC1=O)c1cc(Br)ccc1O 393895387 HXVIXNDLGNQCEV-GHMZBOCLSA-N 328.210 1.541 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@]3(CNC(=O)N3)C2)cc1Br 2177695659 ITZZJVXUYAJKEU-YMTOWFKASA-N 339.237 1.731 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3[C@H]4CCCO[C@H]4C3(C)C)c2n1 2062518262 KIYLVULFJSJBOO-LERXQTSPSA-N 330.388 1.677 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N(C)CC3(O)CCCCCC3)c2n1 2064960112 LFCYOFNDVPGNDP-UHFFFAOYSA-N 332.404 1.901 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)c(Br)c1 2189047233 AAZJOKLLIZPUBA-NYMYIZQJSA-N 341.249 1.912 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)C[C@@H](O)C2)c(Br)c1 2105075444 RCNWLOYXEMVBBB-YUSALJHKSA-N 329.238 1.661 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)C[C@@H]2CO)cc1Br 2089863702 MKNWCVXJVTXWFA-JBLDHEPKSA-N 329.238 1.648 10 10 EDCE Oc1cccc(Br)c1CNC1CN([C@@H]2CCOC2)C1 2113054483 IFUUVGCVBKWKTG-LLVKDONJSA-N 327.222 1.717 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CO[C@@H]3COC[C@H]23)c1O 2236055648 QVWSTRRRERQONX-IRUJWGPZSA-N 344.205 1.667 10 10 EDCE COC[C@H]1C[C@@H](CN)N(Cc2c(O)cccc2Br)C1 2273797414 FESPFLVNOYAUNQ-QWRGUYRKSA-N 329.238 1.950 10 10 EDCE CCN(CC)c1ccc(C=C2C(=O)N(c3nn[nH]n3)N=C2C)cc1 2296441850 YIPHBIMDCRKNQH-UHFFFAOYSA-N 325.376 1.852 10 10 EDCE CCCC1=NN(c2ccc(F)cc2)C(=O)C1=CNN1CCN(C)CC1 2296649517 DMOYRGUHRVNDEO-UHFFFAOYSA-N 345.422 1.964 10 10 EDCE COC(=O)C=Cc1ccc(N(C)[C@H](C)C[S@](C)=O)c([N+](=O)[O-])c1 2308458509 MSJSCLSYZOVYBB-BGJPBQGDSA-N 340.401 1.984 10 10 EDCE C[C@@H](O)[C@@H](C(=O)O)N1C(=O)C(=Cc2ccsc2)SC1=S 2323823470 KZNJOTIHVBKYSP-MUWHJKNJSA-N 329.424 1.783 10 10 EDCE Cc1ccc(CNCC2CS(=O)(=O)C2)c(O)c1Br 2327630381 RQKNRMIUHBGYHG-UHFFFAOYSA-N 334.235 1.597 10 10 EDCE Cc1ccc(CN2CC[C@@H](N)[C@@H](CO)C2)c(O)c1Br 2352945128 REDTXRHTVOIEJR-VXGBXAGGSA-N 329.238 1.605 10 10 EDCE COC[C@H](C)S(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 172195894 ADUQARIGYJGIAF-ZDUSSCGKSA-N 328.434 1.182 10 10 EDCE COC(=O)C[C@](C)(N)c1ccc(I)cc1O 309437548 INZHGPLXEZHLOP-NSHDSACASA-N 335.141 1.734 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C/c3ccnn3C)CC2)cc1 193003191 RNYQDHGDIMAPBN-VMPITWQZSA-N 326.400 1.791 10 10 EDCE CC[C@@H](C)N(CCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 383787917 MCTSHURLCCYKMQ-AMIZOPFISA-N 342.237 1.998 10 10 EDCE CCN1C[C@@H](O)[C@H](N(C)Cc2ccc(C)c(Br)c2O)C1 2380774795 GRHCAHJNISVPCJ-CHWSQXEVSA-N 343.265 1.960 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1ccccc1I 808529280 DUNCFZBBHVSGRB-UHFFFAOYSA-N 346.120 1.535 10 10 EDCE C[C@@H](N)CCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 827469501 ZQYLSENHRMIWKT-HIFRSBDPSA-N 332.448 1.132 10 10 EDCE C[C@@H]1Oc2cc(N)ccc2N(OCCOc2ccc(N)cc2)C1=O 821300733 YEPVETQYXCFRFM-NSHDSACASA-N 329.356 1.976 10 10 EDCE COC1CCN(c2ccc(CN3CCC[C@](O)(CO)C3)cc2)CC1 839147363 IOAJTAPUMSDLIJ-LJQANCHMSA-N 334.460 1.621 10 10 EDCE COCCNC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CCC1 1273208949 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FKAVGKKKWFPEAH-LLVKDONJSA-N 342.330 1.917 10 10 EDCE NC(=O)c1cn(CC(=O)N2Cc3cccc(O)c3C2)c2ccccc12 1471355832 XAJIZKUNJFUWDP-UHFFFAOYSA-N 335.363 1.988 10 10 EDCE C[C@@H](C#N)C(=O)N(C)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1705351188 UDVJWHAOGMJTJT-JTQLQIEISA-N 342.359 1.291 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCc2cnn(C)c2)cc1C 1714308684 IASYLNWUUOABBM-HNNXBMFYSA-N 344.459 1.964 10 10 EDCE CCOC(Cn1cc(C(=O)NCc2ccc(O)cc2O)cn1)OCC 1639444686 WACBTBAMQBBQNZ-UHFFFAOYSA-N 349.387 1.623 10 10 EDCE COc1cccn2ncc(C(=O)NCCc3ccc(O)c(O)c3)c12 1631516590 DWRHHYSDDQXVDR-UHFFFAOYSA-N 327.340 1.727 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N=S2(=O)CCCC2)c1 1638921588 HQYJMUJYUHWZPD-UHFFFAOYSA-N 332.403 1.166 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ncc(Br)cc1O 1639444491 NITWASGDPDJPOC-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@]2(F)CCOC2)cc1C 1732356485 LOGPOZUDTAKJPP-FZKQIMNGSA-N 338.423 1.974 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(Cc2ccncc2)CC1 1587665833 AMJBNGKLQOROOK-UHFFFAOYSA-N 327.384 1.380 10 10 EDCE C[C@@H](Cn1cncn1)N[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 164220023 WEASJEAEJFYXLY-KBPBESRZSA-N 333.411 1.993 10 10 EDCE O=C(O)CN1C(=O)/C(=C\c2cnc3ccccc3n2)SC1=S 8220968 BEGKFKDSQOKFBA-VZUCSPMQSA-N 331.378 1.916 10 10 EDCE Nc1ccc(CC(=O)NC[C@@H](O)COc2ccc(F)c(F)c2)cc1 156264249 YNOBPRFSHOVWAL-CYBMUJFWSA-N 336.338 1.646 10 10 EDCE C[C@H](O)CN(Cc1ccccc1)C(=O)[C@@H](N)Cc1ccc(O)c(O)c1 1914622502 HZLHZDMAPJBPOZ-BBRMVZONSA-N 344.411 1.377 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCC[C@]1(O)[C@H](N)c1ccccc1O 1919860794 HBCGJUPXSNZVKA-CKEIUWERSA-N 338.404 1.437 10 10 EDCE CN1CCN(c2ccc(CNC3CC3)cc2Br)CC1=O 234357990 NXTILPBXLTYJEW-UHFFFAOYSA-N 338.249 1.980 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](CO)[C@@H](CCO)C2)c(Br)c1 2149912524 DKSXBNDNUFDIQM-WCFLWFBJSA-N 343.265 1.896 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)C[C@H](O)COc1ccc(N)cc1 1999436912 LBCZYYJMPXRKIM-AWEZNQCLSA-N 339.436 1.465 10 10 EDCE CC(C)(C)OC(=O)N[C@@]12C[C@H]1CN(C(=O)Cc1ccc(N)cc1)C2 1999440511 GUNCKVLJVVBNNA-SCLBCKFNSA-N 331.416 1.937 10 10 EDCE CC(C)(C)OC(=O)NCCc1nc(=NCc2ccccc2O)[nH][nH]1 2011841290 CYWWIYMTHWZLNU-UHFFFAOYSA-N 333.392 1.612 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](C(=O)NCCCN=[N+]=[N-])OCC12CC2 2012212885 VBCNIVPBEDVZFK-LLVKDONJSA-N 339.396 1.972 10 10 EDCE C[C@@H](N)c1ccc(N2CCC(O)(CO)CC2)c(Br)c1 314418602 QJENUYVCHSOSNF-SNVBAGLBSA-N 329.238 1.792 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](CO)[C@@H](CO)C2)cc1Br 704814804 LAFMLTALUOKZEH-UTUOFQBUSA-N 343.265 1.767 10 10 EDCE Cc1ccc(C=CC(=O)NCc2ccc(N3CCNC(=O)C3)cc2)o1 2053603514 CUELWJCKJBWRKQ-UHFFFAOYSA-N 339.395 1.854 10 10 EDCE CO[C@H]1C[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)N(C(=O)OC(C)(C)C)C1 1906905798 FZUSDZVWTDMOCA-ZDEQEGDKSA-N 340.420 1.276 10 10 EDCE CC(C)C[C@]1(C(=O)O)N[C@@H](c2ccccc2O)[C@H]2C(=O)N(C)C(=O)[C@H]21 4690239 FWXFFGWGMHQQTN-NUXNZHGMSA-N 346.383 1.137 10 10 EDCE CCn1nnc(Br)c1[C@@H](O)[C@@H](N)c1ccccc1O 2100283464 VWFVVTJVUQXUFT-ONGXEEELSA-N 327.182 1.500 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@@]2(CO)CO3)cc1Br 2094647816 ZGMYVJXVHCXYDL-GLXFQSAKSA-N 327.222 1.809 10 10 EDCE NCc1ccc(N2C[C@@H]3CCO[C@@]3(CO)C2)cc1Br 2231367626 BIHJBGGWQXGSNU-SMDDNHRTSA-N 327.222 1.495 10 10 EDCE CSc1ncc(CN=c2[nH]c(NN)ncc2Br)s1 2257129471 YGWHANZVNDGBAF-UHFFFAOYSA-N 347.267 1.737 10 10 EDCE OC[C@@H]1CN(c2ccc(OCc3ccccc3)cc2)C[C@@H](O)[C@H]1O 2299511363 HYEIXKZDWLCSAX-IPELMVKDSA-N 329.396 1.416 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2329326249 NDGLWLGBOQPOSX-ZDEDFTPMSA-N 327.222 1.399 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N1C[C@H]2CS(=O)(=O)[C@@H]2C1 2336553833 MYJPKRKDNWLMOW-VYUIOLGVSA-N 346.246 1.945 10 10 EDCE Cc1ccc(CN2C[C@@H](CO)C[C@@H]2CO)c(O)c1Br 2352686190 JJRSKOZPJNRLHH-CMPLNLGQSA-N 330.222 1.638 10 10 EDCE CCOC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C/NCC(=O)OC 102662802 DSGLRQURYRLCII-XYOKQWHBSA-N 337.763 1.683 10 10 EDCE CN1CCC[C@H](CN(C)c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 301696662 PZRIXSPJVWSJHM-NSHDSACASA-N 334.376 1.704 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCCCC(=O)N3)CC2)cc1 193678411 BCBIOYKTHSRSBQ-INIZCTEOSA-N 331.416 1.403 10 10 EDCE O=C(CN1C(=O)CSC1=S)N1CCN(c2ccccc2)CC1 82311438 IDTYMWWEIHGDQV-UHFFFAOYSA-N 335.454 1.196 10 10 EDCE C=CC(=O)NCCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 269482227 WWPDQMADGZUMCA-UHFFFAOYSA-N 345.443 1.204 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2cc(C(C)C)c(C)cc2O)CCO1 530101646 AKARFOHJZOMDOV-OAHLLOKOSA-N 335.448 1.954 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCO[C@]3(CCCOC3)C2)c1O 368042680 VXPVHPKHDZGXEQ-MRXNPFEDSA-N 338.360 1.690 10 10 EDCE COC(C)(C)CS(=O)(=O)NCc1ccc2c(c1)CCCN2C 289327874 LRMGZABTKKVNHV-UHFFFAOYSA-N 326.462 1.913 10 10 EDCE CCOC(=O)C[C@H]1C[C@@H](OC)CN1Cc1cc2c(cc1O)OCO2 376949297 NVSUNQJXQWBTTQ-CHWSQXEVSA-N 337.372 1.663 10 10 EDCE CCc1nc(COc2ccc(C(=O)OCC(=O)C(C)=O)cc2)no1 808519040 UYCXGSQWFRJSSN-UHFFFAOYSA-N 332.312 1.526 10 10 EDCE C[C@@H](NC(=O)NCc1cc(Br)ccc1O)C(=O)N(C)C 804964898 ZHCLLIIHEWTMPV-MRVPVSSYSA-N 344.209 1.431 10 10 EDCE CCC(=O)N[C@H](C)C(=O)NCc1cc(Br)ccc1O 804734331 IJIQXTCJFOSGNT-MRVPVSSYSA-N 329.194 1.686 10 10 EDCE C[C@@H]1C[C@@H]1N(CCO)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2167110376 VRVYDAPCQZOJTC-BITCUVMXSA-N 341.205 1.642 10 10 EDCE O=C(COC(=O)[C@H]1CCCN1CC(F)(F)F)c1ccc(O)c(O)c1 812683964 GTLDDAOISUIEJV-SNVBAGLBSA-N 347.289 1.850 10 10 EDCE NCC(F)(F)CNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588528353 URNVFDOIVYVVFZ-UTCJRWHESA-N 325.359 1.247 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCCC4(CCOCC4)C3)nc12 738701431 BFCADNXEEUVTHY-UHFFFAOYSA-N 346.387 1.526 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCC[C@]4(CCCOC4)C3)nc12 846249572 HPMKFDIVZGCUQF-KRWDZBQOSA-N 346.387 1.526 10 10 EDCE CO[C@H](CN1C(=O)CN(Cc2ccccc2O)C1=O)[C@H]1CCOC1 849357376 MPCAPMXHWHIKLL-DZGCQCFKSA-N 334.372 1.208 10 10 EDCE CCO[C@@H]1C[C@H](NC(=O)NCCc2ccc(N)cc2)[C@@H]1n1cccn1 841907049 ILMSVGBJYDRPIN-BBWFWOEESA-N 343.431 1.726 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@H](NC(C)=O)C3)C2)cc1 852447838 FLJJRMZDTLPCDX-HUUCEWRRSA-N 346.431 1.194 10 10 EDCE Cc1cc(N(C)C)ccc1CN1C(=O)N[C@@H](CCC2OCCO2)C1=O 924671850 NIIUHRDWBGOUHY-HNNXBMFYSA-N 347.415 1.635 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H](Cn4ccnn4)C3)cc2N1 853761993 XLVAJJHBBGFVMC-JTQLQIEISA-N 344.331 1.044 10 10 EDCE C[C@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)C[C@H](CC(F)(F)F)O1 850864281 CYSGGTHVSGXNSW-CABZTGNLSA-N 345.321 1.776 10 10 EDCE CS(=O)(=O)CC1(CCNC(=O)NCc2ccccc2O)CC1 852440973 JCUGFYPPWSCGIJ-UHFFFAOYSA-N 326.418 1.406 10 10 EDCE CN(C)S(=O)(=O)[C@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 894740110 OMYLIHSFSDDKCV-LBPRGKRZSA-N 334.388 1.526 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1nnc(N)o1 1155134694 KMVBTFNRDBTSNO-UHFFFAOYSA-N 339.355 1.802 10 10 EDCE CN(Cc1ccccc1)C[C@@H](NC(=O)c1cccc(O)c1O)C(=O)O 702166249 IEZNQOHCZKZAER-CQSZACIVSA-N 344.367 1.413 10 10 EDCE Cn1cc([C@@H]2CN(C(=O)c3ccc(N=NC(N)=O)cc3)CCN2)cn1 1170112220 NFTFVCMILOGSOF-AWEZNQCLSA-N 341.375 1.369 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@](C)(O)[C@H](O)C2)c(Br)c1 1893326906 YQXUXHJLRJIKDM-CUOATXAZSA-N 329.238 1.791 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@]1([C@H]2CCCCO2)CCCO1 1263768778 FOGREMTUTIRFTI-SJLPKXTDSA-N 335.400 1.875 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)c(Br)c1 2116737199 QHNJPIXZZBHJMM-ICGCDAGXSA-N 328.206 1.262 10 10 EDCE O=C(NCc1ccc(O)nn1)NCc1c(O)ccc2c1CCCC2 1478702010 NJLREGALNQNWPE-UHFFFAOYSA-N 328.372 1.766 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1nc2ncccn2n1 1478839807 CKJKGIOBQWTOQJ-UHFFFAOYSA-N 339.403 1.532 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2[nH]c(O)nc2C)cc1C 1483026249 ZKZMODRNHGAWMU-PLNGDYQASA-N 344.415 1.817 10 10 EDCE C[C@@H](CNCC1CCOCC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1498201906 HGESAEWPGVBAJO-LBPRGKRZSA-N 347.419 1.984 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CCC(=O)N2C)cc1C 1496143968 GLJVZLSSXRYRTE-GDBMZVCRSA-N 347.459 1.561 10 10 EDCE CCn1nncc1C(=O)NCC[C@H](C)NCc1ccc(OC)c(C)c1 1492019506 BJVCEDCBSNVOSE-AWEZNQCLSA-N 345.447 1.913 10 10 EDCE C[C@@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C[C@H]1O 1565126921 GGVBVFLGNSNNTI-RDTXWAMCSA-N 347.459 1.560 10 10 EDCE COc1ccc(CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)c(O)c1 1568098113 VAAQLVOHQJTYMA-OAHLLOKOSA-N 332.312 1.659 10 10 EDCE O=C1C[C@H](c2ccc(NC(=O)c3cccc(O)c3O)cc2)NC(=O)N1 1641181159 IFVQJXUGVFUAHZ-GFCCVEGCSA-N 341.323 1.621 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCCn3nncc3C2)c([N+](=O)[O-])c1 1651423913 MIMFOIDEEVTONR-GQCTYLIASA-N 343.343 1.783 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cn([C@@H]3CC[C@H]3O)nn2)c1 1595806439 KPSGEQLHDKHIMW-XXLQHYSLSA-N 332.360 1.179 10 10 EDCE O=C(N[C@H](Cc1ccc(F)cc1)C(=O)O)c1cc(O)c(O)c(O)c1 1865875647 FATSNXLQROEPEO-LLVKDONJSA-N 335.287 1.368 10 10 EDCE N[C@@H]1CC[C@H](C(=O)O)N(Cc2ccc(Br)cc2O)C1 2132274032 OTRZLYPXKHPLAB-GHMZBOCLSA-N 329.194 1.531 10 10 EDCE CC(=O)Nc1ccc(NC(=O)c2nnn(-c3ccc(N)cc3)n2)cc1 1857879201 YTKKKFTUMHRYBM-UHFFFAOYSA-N 337.343 1.455 10 10 EDCE CCN(CC)c1ccc(CNCCC(=O)NN2CCN(C)CC2)cc1 1857859516 SJNDPDRQWNECMD-UHFFFAOYSA-N 347.507 1.291 10 10 EDCE CN(C)C[C@@H]1COC[C@H]1NCc1c(O)cccc1Br 2141464613 KRODOBZNEDFSTM-ZWNOBZJWSA-N 329.238 1.821 10 10 EDCE C[C@](O)(CO)[C@H]1CCN(c2ccc(CO)cc2Br)C1 2138090711 BHKUSXUXRXAGLM-FZMZJTMJSA-N 330.222 1.511 10 10 EDCE NC(=O)Cn1cc(NCc2cc(Br)ccc2O)cn1 236177216 QDYQJTDYFGMJNR-UHFFFAOYSA-N 325.166 1.449 10 10 EDCE Cn1cc(I)c([C@H](N)c2ccccc2O)n1 1983829899 SGMBFTWKRJUUSY-SNVBAGLBSA-N 329.141 1.778 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCN=[N+]=[N-])C[C@@H]2OCC[C@H]21 1985095896 KMXPWEOKBORWQG-VWYCJHECSA-N 325.369 1.580 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985103985 CWEGMUIPQJBVIW-UWVGGRQHSA-N 327.385 1.467 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985104403 IEHNHYAWPMRTHO-MXWKQRLJSA-N 327.385 1.562 10 10 EDCE CON(CCNC(=O)OC(C)(C)C)CC(=O)Nc1ccc(N)cc1 1999434158 ISJVXOJDYHBJGN-UHFFFAOYSA-N 338.408 1.595 10 10 EDCE CC(C)(C)OC(=O)NCc1cc(C(=O)N2CC[C@H](N=[N+]=[N-])C2)n[nH]1 2010401640 GLCLSKOXBIBPFV-VIFPVBQESA-N 335.368 1.959 10 10 EDCE Cc1ccc(O)c(CN=c2nc(CNC(=O)OC(C)(C)C)[nH][nH]2)c1 2011844559 XUWGXHYWHQFCLH-UHFFFAOYSA-N 333.392 1.877 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)C[C@H](O)C2)cc1Br 2161356943 LALMQVGBGUBIIX-KBPBESRZSA-N 343.265 1.879 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC3CC(NCC(F)(F)F)C3)c2n1 2062280338 POQLYLIVBDSSRG-UHFFFAOYSA-N 343.309 1.156 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)NCCCCN=[N+]=[N-])=C[C@@H]1O 1908920308 XRGBFCWAZZEEQC-NEPJUHHUSA-N 339.396 1.777 10 10 EDCE CN1CCO[C@@H]2CCN(c3ccc(CN)cc3Br)C[C@H]21 2185491721 HDGRHVJMXDNTNN-HUUCEWRRSA-N 340.265 1.817 10 10 EDCE CN1CCN(CCc2ccc(N)cc2)[C@@H](CNC(=O)OC(C)(C)C)C1 2044608003 KYJJFPZBZUVHED-KRWDZBQOSA-N 348.491 1.952 10 10 EDCE Cn1nc(Br)c(CNCCc2ccc(O)c(O)c2)n1 2111450589 ANTIDRQXPWWKEH-UHFFFAOYSA-N 327.182 1.321 10 10 EDCE CN1CCO[C@@H]2CN(c3ccc(CO)c(Br)c3)C[C@@H]21 2097692158 GCOKLWBKERVYSZ-UONOGXRCSA-N 327.222 1.461 10 10 EDCE NCc1ccc(N2CC(n3cnnc3)C2)c(F)c1Br 2113833440 ZMSGINHTCMVSOU-UHFFFAOYSA-N 326.173 1.700 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H]3[C@H](C(N)=O)[C@@H]3C2)cc1Br 2201284778 PBNQKVUUUXNRMZ-PKINLEFWSA-N 338.249 1.897 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@H](O)CC2)cc1Br 2284552523 PAAPKYDYJHTCGX-GASCZTMLSA-N 343.265 1.881 10 10 EDCE 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COc1cccc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)c1O 289095718 BUNYSASVXXXASZ-ZDUSSCGKSA-N 328.434 1.257 10 10 EDCE CO[C@H]1CN(Cc2ccc(C)c(Br)c2O)C[C@H]1C(=O)O 2380810164 FPYIQMWYGNOIOU-MNOVXSKESA-N 344.205 1.995 10 10 EDCE C[C@H](NC(=O)NCc1cc(Br)ccc1O)C(=O)N(C)C 804964899 ZHCLLIIHEWTMPV-QMMMGPOBSA-N 344.209 1.431 10 10 EDCE C[C@@H](C(=O)NCc1cc(Br)ccc1O)n1cncn1 804737114 IMAMCYPQGWIUDV-QMMMGPOBSA-N 325.166 1.624 10 10 EDCE CC(=O)C(=O)COC(=O)CNC(=O)c1ccc(C(F)(F)F)cc1 808494502 DOVXJDPTPAQOHB-UHFFFAOYSA-N 331.246 1.137 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(Br)cc1[N+](=O)[O-] 808525044 PKIINAWNYKLDEX-UHFFFAOYSA-N 330.090 1.672 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NCc1cc(C)cc(Br)c1O 826962361 DNKNMRVZVHEZIQ-WCQYABFASA-N 344.205 1.883 10 10 EDCE COCCCN1CCC(NC(=O)/C=C\c2ccc(O)c(O)c2)CC1 588404612 ZKVYMLAEHAVANK-XQRVVYSFSA-N 334.416 1.728 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)[C@H]1CCN2CCO[C@H]1C2 824494604 HJZAFWWAPGPNDI-OALUTQOASA-N 331.460 1.428 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@@]2(OC)CCS(=O)(=O)C2)c1 903364975 GCGXISXBEKBXQS-NHYWBVRUSA-N 329.418 1.255 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](CF)C(=O)O)C2)cc1 909133342 DSFJKFSVUWPNNV-RISCZKNCSA-N 339.367 1.243 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)CC3(F)CC3)C2)cc1 917169322 MPXJQYAVFJSKAM-GFCCVEGCSA-N 328.409 1.695 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC[C@@](O)(CO)C2)c([N+](=O)[O-])c1 840329631 NDESWMZTGXZTKE-LEXSJLIMSA-N 336.344 1.105 10 10 EDCE CCOC(=O)CC1(S(=O)(=O)Nc2ccc(O)cc2COC)CC1 840918064 PTPWSAYZELCKFN-UHFFFAOYSA-N 343.401 1.766 10 10 EDCE Cn1c2c(ccc1=O)[C@@H](NC(=O)NCc1ccccc1O)CCC2 844935500 CXFLODTUPJDULP-AWEZNQCLSA-N 327.384 1.968 10 10 EDCE CCC(C)(C)N1CCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)CC1 848710868 GWFAHVBPNRMXSG-UHFFFAOYSA-N 347.419 1.439 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@H]3CCC(=O)NC3)C2)cc1 855222861 BMKURBYQXDSNKH-KGLIPLIRSA-N 331.416 1.306 10 10 EDCE C[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1cncnc1 856213631 QXFRNRISUSSPBX-CQSZACIVSA-N 340.427 1.858 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@]3(C)CCN(C(C)=O)C3)C2)cc1 855232798 XYIZIJXREOJUER-DNVCBOLYSA-N 345.443 1.649 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](C)C(OC)OC)cc1 923651579 HTSCQIIQPFZDDK-ZDUSSCGKSA-N 339.436 1.780 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)[C@@H]2COC(C)(C)C2)c1 859007182 VCUDGODSZJONRZ-JQWIXIFHSA-N 329.418 1.949 10 10 EDCE OCc1nnc2n1CCN(Cc1cc(Cl)cc(Cl)c1O)C2 769514857 BQOJYGMJJDLIEY-UHFFFAOYSA-N 329.187 1.799 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@H]2CCCO2)cc1F 786599234 PRMXWGWABVICNF-CYBMUJFWSA-N 337.395 1.193 10 10 EDCE Cc1ccc(C(=O)N2CCC(C(=O)N3CCCC3)CC2)c(O)c1O 780863754 VHTJDFSTHXMZLM-UHFFFAOYSA-N 332.400 1.881 10 10 EDCE C[C@H](NC(=O)[C@H](O)[C@H](O)c1nc2ccccc2[nH]1)c1ccccc1O 1151892087 IMAHOMKRQWIFEH-CIISACIHSA-N 341.367 1.540 10 10 EDCE CNC(=O)C[C@@H](C)NCc1c(Br)ccc(OC)c1O 1964047380 CRBCJHNMOFPRSZ-MRVPVSSYSA-N 331.210 1.778 10 10 EDCE CC(C)c1nnc2n1CCN(C(=O)Cc1ccc(O)c(O)c1)[C@H]2C 1303928379 JCFLEHUEUSEDPN-NSHDSACASA-N 330.388 1.959 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@](C)(O)[C@@H](O)C2)c(Br)c1 1893331929 NMWMJINUJYEULT-IIMNLJJBSA-N 330.222 1.824 10 10 EDCE C[C@H]1C[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 1325662078 ARDPAPMMIPIGQQ-DZGCQCFKSA-N 347.484 1.628 10 10 EDCE COCCNC(=O)CN(C)Cc1cc(Br)cc(F)c1O 715765565 HKPCNVIJJQJZMY-UHFFFAOYSA-N 349.200 1.488 10 10 EDCE C[C@@H]1[C@H](O)CCCN1C(=O)C(=O)NCCCSc1nccs1 1334503983 WKCFBJXTLDNQKB-GHMZBOCLSA-N 343.474 1.113 10 10 EDCE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCC[C@@H]1CNCCS1(=O)=O 1340064126 NHQYXXFZCRICEE-MCIONIFRSA-N 338.473 1.615 10 10 EDCE O=C(Cc1csc(-c2nc[nH]n2)n1)NCc1ccc(O)cc1O 1299573304 JJNKGMREMWQNFS-UHFFFAOYSA-N 331.357 1.198 10 10 EDCE O=C(C[C@H]1CCNC1=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1525592978 DELGEKKMSIMXAZ-LLVKDONJSA-N 348.358 1.927 10 10 EDCE C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)C(=O)OCc1ccccc1 1469666024 VFZFSBZHNXELCC-GFCCVEGCSA-N 329.352 1.888 10 10 EDCE Cc1cc(CN2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)on1 1540504384 SBQIFYSPRBFYGM-UHFFFAOYSA-N 331.372 1.281 10 10 EDCE COc1ccc(N2CCCN(C(=O)NC[C@@H]3CNC(=O)C3)CC2)cc1 1478820526 ONCCPAJXCSCHLX-AWEZNQCLSA-N 346.431 1.053 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2cccs2)cc(OC)n1 1704006241 OXYSKBCNBRJIAM-SNVBAGLBSA-N 349.412 1.709 10 10 EDCE COC(=O)c1cc(C(C)(C)NC(=O)Cc2ccc(O)c(O)c2)no1 1629003553 SGOHCGWIXCGGQE-UHFFFAOYSA-N 334.328 1.466 10 10 EDCE CCC1(CC)CNC(=O)[C@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1558541615 DVBDLRNCCSNUQI-GFCCVEGCSA-N 331.376 1.884 10 10 EDCE CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)CNCc1ccc(OC)c(C)c1 1498049927 ZXSSGYPIYQALCD-KBPBESRZSA-N 335.448 1.513 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)c2nc[nH]n2)C2CC2)cc1C 1733185814 KKJDLPSERIQYMV-AWEZNQCLSA-N 329.404 1.420 10 10 EDCE C[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)c1nnc(O)n1C 1570885694 OIXJFJRRISMMIS-ZCFIWIBFSA-N 334.357 1.638 10 10 EDCE COCCNC[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1661841741 DTSUHCRKDMMIPF-ZDUSSCGKSA-N 347.419 1.937 10 10 EDCE C[C@H](CCNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C1CC1 1758868237 XUZBIMGBDZQWJV-SNVBAGLBSA-N 331.376 1.884 10 10 EDCE Cc1[nH]nc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1O 1597907976 KHHBBFGCSBPSCU-LLVKDONJSA-N 330.388 1.751 10 10 EDCE COc1ccc(N/C=C2\C(=O)N([C@H]3CCS(=O)(=O)C3)N=C2C)cc1 13654861 CLZRMUPGLRLKAJ-GRRFOWRYSA-N 349.412 1.396 10 10 EDCE C[C@H](NCc1ccc(O)c(O)c1)C1(O)CN(C(=O)OC(C)(C)C)C1 1918679525 UZYCHEQUGMPGCR-NSHDSACASA-N 338.404 1.558 10 10 EDCE NCc1ccc(N2CCN3C(=O)CC[C@@H]3C2)c(F)c1Br 231840507 HHQRCTFJSPLKDY-SNVBAGLBSA-N 342.212 1.858 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@H](O)[C@H]2CF)cc1Br 2140663737 PIEOMJKLILKFAE-GUQKDYTMSA-N 334.185 1.382 10 10 EDCE CCNCc1ccc(N2CCOC[C@@H]2C(N)=O)c(Br)c1 233531233 JXCBLYKQVVGMIU-CYBMUJFWSA-N 342.237 1.249 10 10 EDCE CNCc1ccc(N2CCC(C(N)=O)CC2)cc1Br 234425057 AAESCLDQLNCIMP-UHFFFAOYSA-N 326.238 1.870 10 10 EDCE COc1cccc(O)c1CNC[C@H](O)CNC(=O)OC(C)(C)C 1985780259 QPGGRMOZRCGULT-NSHDSACASA-N 326.393 1.376 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1990023491 ZEINHSVUGIVLKJ-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2015122194 JCIXCVWBWWJINS-JTQLQIEISA-N 338.360 1.543 10 10 EDCE CC(C)NCc1ccc(N2CC(C(N)=O)C2)cc1Br 382056810 AMNUTXQAXRPIJU-UHFFFAOYSA-N 326.238 1.869 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)Nc2ccc(N)cc2)[C@H](O)C1 1908508272 YPQIRDKZSFDZMY-QWHCGFSZSA-N 336.392 1.371 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)cc1Br 2102194494 YCRCVZPOACPPDE-RHBIEUIISA-N 327.222 1.665 10 10 EDCE NCc1cc(F)c(N2CC(=O)N[C@@H]3CC[C@@H]32)cc1Br 2112067712 WHBVUFUXLWBBTD-MNOVXSKESA-N 328.185 1.514 10 10 EDCE CC(C)[C@@H]1C(=O)NCCN1c1ccc(CO)cc1Br 2113703345 KQRZJXDROPINEK-CYBMUJFWSA-N 327.222 1.902 10 10 EDCE COc1ccc(Br)c(CN[C@H](C)Cn2cnnc2)c1O 2208873072 UGDIPKAFANTLNS-SECBINFHSA-N 341.209 1.933 10 10 EDCE COc1ccc(Br)c(CNCc2c(C)nnn2C)c1O 2236051973 ZYNYNGASTHQWSZ-UHFFFAOYSA-N 341.209 1.890 10 10 EDCE NC[C@@]1(CO)COCCN1c1ccc(OCc2ccccc2)cc1 2299527474 IIVNXJDXNHNJMT-LJQANCHMSA-N 328.412 1.792 10 10 EDCE CN(Cc1ccccc1O)C1(C(=O)O)CN(C(=O)OC(C)(C)C)C1 2304738800 PVDWDSYPLNKTKG-UHFFFAOYSA-N 336.388 1.898 10 10 EDCE COc1cccc(C=CC(=O)NCCN2C(=O)CSC2=S)c1 2320656360 KJGZPNFTHKZLIR-UHFFFAOYSA-N 336.438 1.685 10 10 EDCE Cc1ccn2ncc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c2n1 186387342 UBDVQTMBJJLVRZ-LLVKDONJSA-N 326.356 1.810 10 10 EDCE C[C@H]1CCCN1CC(=O)NCc1ccc(N2CCNCC2)c(F)c1 237576385 SJDSMNMYROUKJE-AWEZNQCLSA-N 334.439 1.336 10 10 EDCE Cc1cc(O)c(CNC[C@]2(CO)COCC3(CCC3)N2C)cc1C 527751510 COUXRVBILCMCNM-IBGZPJMESA-N 334.460 1.714 10 10 EDCE COC(=O)Nc1ccc(N2CCN(c3ccc(OC)cc3)CC2)nn1 242765721 DOZDLEWWJLHNFN-UHFFFAOYSA-N 343.387 1.990 10 10 EDCE CC(C)NC(=O)CN1CCN(Cc2cc(Cl)c(F)cc2O)CC1 294938818 PGYMEYMHKUPSKK-UHFFFAOYSA-N 343.830 1.827 10 10 EDCE CC(=O)C(=O)COC(=O)c1cn(-c2cccc(Cl)c2F)nn1 808534826 UWLKZLVKMBADSM-UHFFFAOYSA-N 325.683 1.375 10 10 EDCE CN[C@@H](C)c1ccc(N(C)[C@@H]2COC[C@H]2O)c(Br)c1 709479283 XIPFXBLPKDBZRI-CUOATXAZSA-N 329.238 1.925 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3ccco3)C2)cc1 826594582 NIXJVXJOGHTZHZ-ZDUSSCGKSA-N 343.383 1.300 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCC=C(C)C)C2)cc1 829025997 FXPKUFHNPWXLJX-HNNXBMFYSA-N 345.443 1.863 10 10 EDCE C[C@H](NC(=O)NC[C@@H]1CCCCN1CCO)c1ccc(N(C)C)cc1 838560444 XDWYYMWLMLTYFU-YJBOKZPZSA-N 348.491 1.960 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@H]2C[C@@H]3OC(C)(C)O[C@@H]3C2)c1 918745267 IOHVLKRENSVXEL-UWEBFBLFSA-N 336.388 1.883 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@]12CCCN(C(=O)OC(C)(C)C)C2 848826810 QZKJXAUFHAUPFG-SJCJKPOMSA-N 339.388 1.725 10 10 EDCE CN1C[C@H](CCNC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 924725414 DBZOGVPSZZQRHL-OAHLLOKOSA-N 332.448 1.762 10 10 EDCE O=C(OCC(=O)N1CCC(c2ccccc2)=N1)c1cccc(O)c1O 758561751 MAYFTYNDKPICCO-UHFFFAOYSA-N 340.335 1.891 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)[C@@H]3CCCNC3)C2)cc1 851661444 JTXQCNKNUDFFIR-OAGGEKHMSA-N 346.475 1.961 10 10 EDCE O=C(NCc1c(O)cccc1F)NC1CCN([C@H]2CCOC2)CC1 923322499 LXPRTIMFRFIKMG-ZDUSSCGKSA-N 337.395 1.584 10 10 EDCE CC[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C(=O)O 927941848 WFYJOYQOTZLROY-AWEZNQCLSA-N 347.415 1.130 10 10 EDCE C[C@H](NC(=O)N[C@H](C)c1nnc(O)n1C)c1ccc(N(C)C)cc1 922050600 CTOOKGMUEFSRHJ-WDEREUQCSA-N 332.408 1.708 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3cccnc3O)C2)cc1 858600045 SLBCPEXQHHKUPU-CQSZACIVSA-N 342.399 1.874 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCN3CCCC3=O)C2)cc1 855230130 NKUDMPJDMNHTDB-AWEZNQCLSA-N 331.416 1.403 10 10 EDCE CCn1cc(CC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)nn1 930745438 XVAOMQKFWFZOBO-AWEZNQCLSA-N 343.431 1.555 10 10 EDCE O=C(O)[C@H]1C[C@@H](C(=O)NCc2cc(Br)ccc2O)C1 1123284243 GBIOPCACWOZYFA-OCAPTIKFSA-N 328.162 1.882 10 10 EDCE COc1ccc(N2CCN(C(=O)C3CN([C@H]4CCOC4)C3)CC2)cc1 895444647 OMCUKMZMRZOTFG-KRWDZBQOSA-N 345.443 1.065 10 10 EDCE C[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)[C@@H]1CN(C)CCN1C 896534847 WQKVKMULVLYNNR-PWSUYJOCSA-N 349.456 1.677 10 10 EDCE C[C@@H](CS(C)(=O)=O)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1145035530 YGDPLQFNIDCXGT-VIFPVBQESA-N 326.378 1.354 10 10 EDCE CCC[C@@H](CCCS(C)(=O)=O)C(=O)NCc1cccc(O)c1O 1153798697 WMUNRMJHMPHHEB-LBPRGKRZSA-N 343.445 1.955 10 10 EDCE OCCN(Cc1ccc(Br)cc1O)C[C@H]1CCCN1 691498439 UCKNSFSGHRZTTN-CYBMUJFWSA-N 329.238 1.701 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCCC[C@H]2CNCCO)cc1 1275816959 OHSKDNHXUFHAKM-ZFWWWQNUSA-N 347.419 1.720 10 10 EDCE COc1ncc(/C=C/C(=O)N2CCN(C)c3ncc(C)cc32)cn1 1463392361 PDQWMRHTUHDBRS-SNAWJCMRSA-N 325.372 1.685 10 10 EDCE NCC[C@@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 2119413882 DHTAMFALUXRZNK-LLVKDONJSA-N 333.201 1.843 10 10 EDCE O=C(CCc1nc(-c2ccoc2)no1)NCc1c(O)cccc1O 1472063745 POSZWDDNNVQJKE-UHFFFAOYSA-N 329.312 1.990 10 10 EDCE CCOCCNCC1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1485113053 XFNSQVFKESZZNP-UHFFFAOYSA-N 347.419 1.984 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CCO[C@]2(C(=O)N2CC(N=[N+]=[N-])C2)C1 1908254565 QGHQVZALPXSWQK-ZUZCIYMTSA-N 337.380 1.534 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@H]2CCC(=O)N2)cc1C 1716277993 WZHUGVWUNPBJQH-NHZBNJEXSA-N 331.416 1.044 10 10 EDCE O=C1C[C@@](C(=O)NCc2cc(O)ccc2O)(c2ccccc2)CN1 1633598789 ALVPLQHZQNCKMT-SFHVURJKSA-N 326.352 1.172 10 10 EDCE Cc1ncc(Br)c(C(=O)NCc2cc(O)ccc2O)n1 1637125908 GSUOLNAKWOEHHX-UHFFFAOYSA-N 338.161 1.889 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cc(C)no2)cc1C 1571573442 KJWGIFNOLJDPPJ-HNNXBMFYSA-N 347.415 1.523 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2c[nH]cc2C)cc1C 1571446546 HFSSRWHUOXENIU-OAHLLOKOSA-N 331.416 1.521 10 10 EDCE CC(=O)NN1C(=O)/C(=C\c2cc([N+](=O)[O-])ccc2O)SC1=S 5226361 IFYJAJJMBVEXJL-BJMVGYQFSA-N 339.354 1.553 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)cc1Br 2126157193 QBLXSVLPFQEYGK-IOQCUFBNSA-N 328.206 1.119 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@](C)(C(=O)NCCCN=[N+]=[N-])C1 1964881616 ZJDOQZQJZMIYCN-CQSZACIVSA-N 327.385 1.829 10 10 EDCE COCCN[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@@H]1C 1676694948 UXMVCKFSCFXLCK-BXUZGUMPSA-N 333.392 1.688 10 10 EDCE COc1cc(C)cc(CN2CCC[C@H](NS(C)(=O)=O)C2)c1O 164011306 NOQWOMUPGYQFRW-ZDUSSCGKSA-N 328.434 1.223 10 10 EDCE CNCc1ccc(N2CCC(C(N)=O)CC2)c(Br)c1 234424958 BUCZDKLTVCGTTC-UHFFFAOYSA-N 326.238 1.870 10 10 EDCE CNCc1ccc(N(C)CC(=O)NCCOC)cc1Br 234400337 YEDKSZJCACISAU-UHFFFAOYSA-N 344.253 1.367 10 10 EDCE C[C@@H](N[C@H](CO)CNC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985778188 XLOGUTYWZAJGGP-MNOVXSKESA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@](C)(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003172296 IZYHJCGTCIVBFY-PSTGCABASA-N 340.420 1.278 10 10 EDCE CN1CCO[C@H]2CN(c3ccc(CN)c(Br)c3F)C[C@H]21 2153987968 BDVMRQCNEHAQBZ-NEPJUHHUSA-N 344.228 1.566 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2012344405 ZRFITEQDLFPUIY-RYUDHWBXSA-N 341.412 1.954 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2018521650 IZLWGUUCSOBZEB-HKUMRIAESA-N 340.420 1.324 10 10 EDCE CN(C(=O)[C@H](NC(=O)OC(C)(C)C)C(C)(C)O)c1ccc(N)cc1 2022887823 CJNBXDAFJRZRBA-ZDUSSCGKSA-N 337.420 1.896 10 10 EDCE CCN1CC[C@H](N(C)C(=O)c2cnn3c(O)cc(C)nc23)C[C@@H]1C 2062083921 AHWLGUQVFGJAOL-STQMWFEESA-N 331.420 1.688 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H]3CCN3C3CCCC3)c2n1 2063557781 GPSNATPYSCMMHG-CYBMUJFWSA-N 329.404 1.490 10 10 EDCE 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COc1ccc(CNC2(CNC(=O)C3(C(N)=O)CC3)CCC2)cc1C 1484648957 ARSPOQWRKIOCBG-UHFFFAOYSA-N 345.443 1.398 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC1(c2ncccn2)CCOCC1 1558493018 QDJISTOOSLYUBQ-HYXAFXHYSA-N 341.367 1.723 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)[C@H]1C[C@H](O)C1 2122887837 NANMZSJHCWDPIJ-WSFZALMZSA-N 327.178 1.394 10 10 EDCE COC(=O)c1cnc(SCc2coc(S(N)(=O)=O)c2)s1 1641152271 VBROUVCDWGEJKD-UHFFFAOYSA-N 334.400 1.462 10 10 EDCE CO[C@@H](C)CNC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1732938230 DBFAFQGJIYAKDJ-PXTZJAAESA-N 333.392 1.760 10 10 EDCE COc1cc(/C=C2\SC(=S)N(CCO)C2=O)cc(OC)c1O 16904868 PUHHTUSEHMWIOZ-XFFZJAGNSA-N 341.410 1.603 10 10 EDCE Cc1ccc(O)c(CNCCC(=O)Nc2ccc(C(N)=O)cc2)c1 1857853386 XBNJANWJDRNJQF-UHFFFAOYSA-N 327.384 1.918 10 10 EDCE C[C@@]1(CO)COCCN(c2ccc(CN)c(Br)c2)C1 2135102802 BYLRVHRCEWBTSY-CQSZACIVSA-N 329.238 1.743 10 10 EDCE CCN(C(=O)OC(C)(C)C)[C@H]1COC[C@H]1C(=O)NCCN=[N+]=[N-] 1985093736 DRAMRODVROUFSV-MNOVXSKESA-N 327.385 1.685 10 10 EDCE 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CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](N2CCCc3cc(CN)ccc32)C1 2044595800 MYQDHXVHSVIEEN-IRXDYDNUSA-N 347.459 1.878 10 10 EDCE CO[C@@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@H]1NC(=O)OC(C)(C)C 2058774565 FQXMKOSCZLAJSL-HUUCEWRRSA-N 349.431 1.562 10 10 EDCE NCc1cc(F)c(N2C[C@H](O)[C@H]3COC[C@@H]32)cc1Br 2102186378 FYZUBURQXZNBCJ-HJIKLVIJSA-N 331.185 1.243 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213584405 CXXCWAVJCIRJQV-TUAOUCFPSA-N 340.428 1.789 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)CC[C@H]1C(=O)NCCCN=[N+]=[N-] 2242655260 BHDDADRLIJKOGL-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE COC(=O)C=Cc1ccc(N(C)[C@@H](C)C[S@](C)=O)c([N+](=O)[O-])c1 2308458512 MSJSCLSYZOVYBB-RULNZOCKSA-N 340.401 1.984 10 10 EDCE COc1ccc(CN2CCCN(Cc3cnn(C)c3)CC2)c(O)c1 121599573 VIFQSXIGXAFJJK-UHFFFAOYSA-N 330.432 1.842 10 10 EDCE N[C@H](c1ccc(I)cc1O)C(F)(F)CO 95770511 PKNYDMYPUBUXEF-MRVPVSSYSA-N 329.084 1.624 10 10 EDCE O=C1N[C@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CS1 269791623 JPPOJGHCFJNKDB-STQMWFEESA-N 336.413 1.725 10 10 EDCE COC(=O)[C@H](C)NC(=O)NCc1ccc(C)c(Br)c1O 2380726246 OWMDSERDBQRWNI-QMMMGPOBSA-N 345.193 1.824 10 10 EDCE COc1ccc(N2CCC[C@](O)(CN)C2)c(OC)c1Br 2162631400 ONOIISVTDFUXNX-AWEZNQCLSA-N 345.237 1.756 10 10 EDCE COc1ccc(N(C)C[C@H]2CNCCO2)c(OC)c1Br 2162632916 TXBVWRMYEVCPQM-SNVBAGLBSA-N 345.237 1.891 10 10 EDCE COC[C@H]1CNCCN1c1ccc(OC)c(Br)c1OC 2162847529 NLDWOTHMCYCRBD-SNVBAGLBSA-N 345.237 1.891 10 10 EDCE C[C@@H]1CC[C@@H]1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 805864060 OTJWHMHXROYVQD-UNEWFSDZSA-N 344.459 1.986 10 10 EDCE CN(C)CCN(C)CCCN(C)Cc1ccc(N2CCOCC2)cc1 809788114 NMRVUXDMFPIVJL-UHFFFAOYSA-N 348.535 1.839 10 10 EDCE NC(=O)NC1CN(c2ccc(C=CC(=O)O)cc2Br)C1 2163220125 QANDTAUENXNYDP-UHFFFAOYSA-N 340.177 1.404 10 10 EDCE COc1cc(O)ccc1NS(=O)(=O)c1c(C)nn(C)c1Cl 901704737 WEDHAOYVXZVJBB-UHFFFAOYSA-N 331.781 1.897 10 10 EDCE C[C@@H]1C[C@H]1N1C[C@@H](NC(=O)NCc2cc(Cl)ccc2O)CC1=O 845025776 ISWBCZBLDRQRGQ-JIMOISOXSA-N 337.807 1.854 10 10 EDCE COC1(CS(=O)(=O)NCc2c(O)cccc2F)CCOCC1 921451619 SVTPAGVOLAIXNL-UHFFFAOYSA-N 333.381 1.146 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1CCC(=O)N(C)C1 840306171 QOOJIKFODFJHDG-ZBFHGGJFSA-N 346.475 1.912 10 10 EDCE Oc1cc2c(cc1CN1CCc3cc(Cl)nnc3C1)[C@@H](O)CO2 842620846 SMZUGRTWSJLQMD-AWEZNQCLSA-N 333.775 1.820 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@@H]3CNCC[C@H]3C)CC2)cc1 841778435 BBFPUXMKPDHCQH-RDTXWAMCSA-N 346.475 1.961 10 10 EDCE O=C(NCCCSc1nccs1)N1CCN2CCOC[C@H]2C1 758580379 SYKQDZSLRRKXGC-GFCCVEGCSA-N 342.490 1.351 10 10 EDCE C[C@H](NC(=O)C(F)(F)C(=O)N1CCOCC1)c1ccccc1O 866160905 HIHPHTKMJGXMSW-JTQLQIEISA-N 328.315 1.064 10 10 EDCE CC(C)(C(=O)NCc1ccc2cccnc2c1O)N1CCOCC1 862026734 YQZLKKWKAUDLNT-UHFFFAOYSA-N 329.400 1.667 10 10 EDCE O=C(N1Cc2cccc(O)c2C1)[C@]1(O)CCN(Cc2ccccc2)C1 871202210 AHIKJSQOTDFVQG-FQEVSTJZSA-N 338.407 1.871 10 10 EDCE CC(=O)c1cc(Cl)cc(Cn2cc([C@@H]3COCCN3)nn2)c1O 881000083 ZHGZTKSKCNCESH-AWEZNQCLSA-N 336.779 1.549 10 10 EDCE CN1CCCc2cc(CNC(=O)CCCn3c(O)nnc3O)ccc21 1142465983 ZYBSDGRMCOAWQP-UHFFFAOYSA-N 345.403 1.168 10 10 EDCE C[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC2(CCC2)O1 1329497845 UYETUWOCHPTWSH-LBPRGKRZSA-N 330.384 1.404 10 10 EDCE CCC(=O)N[C@@H](C)C1CN(Cc2nnnn2-c2ccc(OC)cc2)C1 1329951912 IKSMVHJLXHPJKR-LBPRGKRZSA-N 344.419 1.017 10 10 EDCE C[C@@H](O)CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C1CC1 691390820 JMAWMNMQRHRCKW-FUXBKTLASA-N 340.221 1.751 10 10 EDCE Cn1ncc(Br)c1CNC(=O)c1ccc(O)c(O)c1 693459627 IMAYWNGIQHLDOP-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE CCn1nncc1C(=O)N[C@H](C)[C@@H](C)NCc1ccc(OC)c(C)c1 1505598975 HTOHPUAJWIIFDP-ZIAGYGMSSA-N 345.447 1.912 10 10 EDCE COc1ccc(N(C)C(=O)c2ccnc3c2CC(=O)N3)c(OC)c1 1446517471 CWLWZIKFDMXTCG-UHFFFAOYSA-N 327.340 1.870 10 10 EDCE O=C(O)C[C@H]1CN(Cc2cc(Br)ccc2O)C[C@H]1O 2117724599 MHEXEGLCQAKRKE-JOYOIKCWSA-N 330.178 1.422 10 10 EDCE CCOCCN(C)[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1700487601 MEBMOGFHOIFYTO-LBPRGKRZSA-N 335.408 1.936 10 10 EDCE COCCN[C@H]1C[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1479418226 COWISJCRHAVUDX-YEORSEQZSA-N 333.392 1.593 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CO[C@H]2CCOC2)cc1C 1714236524 PTCNQRMPEMACTF-HOCLYGCPSA-N 336.432 1.403 10 10 EDCE Cc1nn(-c2cccnc2)nc1C(=O)NCc1c(O)cccc1O 1639292466 DHMWYFYNALKYCN-UHFFFAOYSA-N 325.328 1.312 10 10 EDCE COc1ccc(CN[C@H]2CN(C(=O)CCN(C)C)C[C@H]2C)cc1C 1570354318 JTBTUEUFOQRZON-WBVHZDCISA-N 333.476 1.892 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CC1(CS(C)(=O)=O)CC1 1640259849 GOLYULWONWLVGK-UHFFFAOYSA-N 346.445 1.709 10 10 EDCE CN(c1ccc(CN)c(Br)c1F)[C@@H]1CCC(=O)NC1 2127091673 SSFRAFHSBUYWRS-SECBINFHSA-N 330.201 1.762 10 10 EDCE CNC(=O)CCCN(C)C(=O)c1c(C)oc(-n2cccc2)c1C#N 153756520 RNWGOHXEDPGWGX-UHFFFAOYSA-N 328.372 1.849 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@H](O)[C@@H](O)C2)cc1Br 2132139184 YJQXTPKPSMXJNJ-IIMNLJJBSA-N 329.238 1.661 10 10 EDCE CCCN(CCC(=O)O)C(=O)CNCc1cccc(OCC)c1O 1857866783 CCIAJCSMCMRHEP-UHFFFAOYSA-N 338.404 1.594 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@H](O)[C@H]3C)c(Br)cc21 1914311973 UJGNXBZJQBXORL-BLBGDKDGSA-N 340.221 1.621 10 10 EDCE C[C@@H](c1cc(O)ccc1O)N(Cc1ccccc1)CC1(O)CNC1 1915510590 PWFLEMHSXSOUEF-AWEZNQCLSA-N 328.412 1.995 10 10 EDCE COc1ccc(CNC[C@@H](CO)NC(=O)OC(C)(C)C)c(O)c1 1985857400 CZQWPYKBIKBKOK-LBPRGKRZSA-N 326.393 1.376 10 10 EDCE CCN(CCCO)c1cc2c(cc1Br)[C@@H](NC)C(=O)N2 165211005 QNZZSCSDZFIPLA-CYBMUJFWSA-N 342.237 1.870 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C(NC(=O)c3ccc(O)c(O)c3)[C@H]2C1 2006284067 LWQHYBUZDFLLNX-QWRGUYRKSA-N 334.372 1.693 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCC(CN=[N+]=[N-])CC1 2010393318 QRYLPEVTNYIWLS-LBPRGKRZSA-N 341.412 1.811 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C 2022899341 DOHRXDOGJGXXJQ-AWEZNQCLSA-N 337.420 1.503 10 10 EDCE C[C@@H]1CN(c2ccc(CN)c(Br)c2)C[C@@H](C)S1(=O)=O 400860723 XMYUYPRFWJKYNM-NXEZZACHSA-N 347.278 1.920 10 10 EDCE Oc1cc(Br)ccc1CN1CCN([C@@H]2CCNC2)CC1 701013985 GBUTUPZLYGQSSX-CQSZACIVSA-N 340.265 1.634 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C(=O)NC(=O)[C@@H]3C2)c(Br)c1 387450929 QQUVZTCLKZKVQV-FXBDTBDDSA-N 338.205 1.178 10 10 EDCE C[C@H](c1cc([N+](=O)[O-])ccc1O)n1ncc(S(C)(=O)=O)c1O 2070260317 XPUOAOWSCNOCCN-SSDOTTSWSA-N 327.318 1.215 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cccc(O)c2O)[C@H]2C[C@H]21 884842919 GZMBMTZBPCWOII-NWDGAFQWSA-N 334.372 1.932 10 10 EDCE CNC(=O)c1cn(Cc2c(O)cccc2Br)nc1O 2070625492 QYCZEALUCZDAFK-UHFFFAOYSA-N 326.150 1.465 10 10 EDCE OC[C@]1(NCc2cccc(Br)c2O)C[C@@H](O)C12CCC2 2193964897 CWJFCYJUMDUXLD-IUODEOHRSA-N 342.233 1.910 10 10 EDCE CC(C)(C)OC(=O)NCc1cc(C(=O)C(=O)C[C@H]2C[C@H](N)C2)ccn1 2049782490 JLIWMBWZMJSRTR-AULYBMBSSA-N 347.415 1.986 10 10 EDCE O=C1NC[C@H]2CN(Cc3ccc(Br)cc3O)CC[C@H]12 2100944466 NLVNNZOYWDLNQO-JQWIXIFHSA-N 325.206 1.723 10 10 EDCE OCc1ccc(N2CCO[C@@]3(CCOC3)C2)cc1Br 2111916402 AOYZEOMXNHJVST-AWEZNQCLSA-N 328.206 1.937 10 10 EDCE O=C1C(=Cc2ccc(O)cc2)SC(=S)N1CCS(=O)(=O)O 2293438624 FGOYKFTUYINFAO-UHFFFAOYSA-N 345.423 1.481 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccc(CO)cc2)s1 2284540702 DXLPWNDWROXCIF-UHFFFAOYSA-N 330.456 1.836 10 10 EDCE CN(C)[C@@H](CNC(=O)C=Cc1ccc(O)c(O)c1)c1cnn(C)c1 2308001423 HVVGLWPZUFJFKQ-AWEZNQCLSA-N 330.388 1.264 10 10 EDCE CC(C)Cc1ccc([C@@H](C)NC=C2C(=O)NC(=S)NC2=O)cc1 121028840 FPHRYZMJJSBQHZ-LLVKDONJSA-N 331.441 1.951 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)C(N)=O)C1 435534289 ZQFHZOICRLFHIG-ZDUSSCGKSA-N 342.443 1.398 10 10 EDCE CC(=O)C(=O)COC(=O)CCC(=O)Nc1nnc(CC(C)C)s1 808545318 WMNGSPKLNVBYED-UHFFFAOYSA-N 341.389 1.157 10 10 EDCE CC(C)[C@@H](O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 802981362 QDNXSIHXCJHYIX-LJQANCHMSA-N 345.487 1.852 10 10 EDCE CN1CCC[C@H](C(=O)NCc2cccc(Br)c2O)C1=O 296700147 MKNRJURIECDFGA-SNVBAGLBSA-N 341.205 1.639 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc([N+](=O)[O-])c(Br)cc1F 808524961 MZJKJMWHXLEMON-UHFFFAOYSA-N 348.080 1.811 10 10 EDCE CN(CCN1CCCS1(=O)=O)Cc1cc(Cl)c(F)cc1O 816520609 TXNGERGSPGYFMG-UHFFFAOYSA-N 336.816 1.652 10 10 EDCE C[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)c1ccnn1C 817523235 HWZLCNZNRRSCBB-AWEZNQCLSA-N 328.416 1.677 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NCC[C@H]3CCNC3)C2)cc1 818654638 DFQQHONXMVFGMJ-HZPDHXFCSA-N 346.475 1.820 10 10 EDCE Fc1cc(CN2CC[C@@H](Cn3ccnn3)C2)ccc1N1CCOCC1 826846678 XKAVXEHGZKJSOJ-MRXNPFEDSA-N 345.422 1.776 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@@](O)(CO)C1 838485164 DAOFQWCMFVCDRY-SFHVURJKSA-N 331.416 1.092 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@H]1CNCC[C@H]1C)c1ccc(N(C)C)cc1 842203175 QCFKPRXYLSBLKX-WWGRRREGSA-N 332.448 1.044 10 10 EDCE CO[C@@H](CS(=O)(=O)NC[C@@H](N)c1ccc(N(C)C)cc1)C1CC1 842784997 JWRXGEUHGJQUDJ-CVEARBPZSA-N 341.477 1.097 10 10 EDCE CCN1C[C@@H](NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 852369239 TVBORRIOWZVQGA-KGLIPLIRSA-N 346.431 1.194 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)C[C@@H]2COCCO2)c([N+](=O)[O-])c1 853829954 PHHNSPXROZUTCV-RYWCDNDXSA-N 336.344 1.633 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](O)C(F)(F)F)C2)cc1 854298374 BTQLHFBQVGLDRP-ZWNOBZJWSA-N 347.337 1.496 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H]3C(F)F)nc12 931427606 PTAKVGCJUSHKBA-SNVBAGLBSA-N 326.303 1.451 10 10 EDCE CCN1C[C@@H](S(=O)(=O)N[C@H](C)c2cc(OC)ccc2O)CC1=O 866842165 SKOHPRBONOQZJN-PWSUYJOCSA-N 342.417 1.002 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@@H]2CCCOC2)c1 862390692 BFCHGGRGMJRTPG-NSHDSACASA-N 342.417 1.310 10 10 EDCE CS(=O)(=O)Cc1cccc(C(=O)NCc2cc(O)ccc2O)c1 1153879702 VJYMGYVMUZYPAY-UHFFFAOYSA-N 335.381 1.572 10 10 EDCE C[C@H](O)CCCN1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1269352779 WFZZNLOERXEQIV-WFASDCNBSA-N 347.419 1.814 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cccc(N2CCOC2=O)c1 1299571328 UUUCVJGDIMUHRA-UHFFFAOYSA-N 328.324 1.984 10 10 EDCE COC(=O)c1cnc([C@@H](C)NC(=O)Cc2ccc(O)c(O)c2)s1 1469215853 BSBNTSABVRSQKP-MRVPVSSYSA-N 336.369 1.761 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCOC23CCOCC3)cc1 1472290540 PISGHRBDADHZKH-ZDUSSCGKSA-N 332.360 1.917 10 10 EDCE C[C@H](F)CCN[C@@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1700808287 OLHWNVROEJJKDW-GXFFZTMASA-N 339.371 1.277 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CCN(c2cc(O)ncn2)C1 1472253839 CHNGWNKPIVARCU-DTRQGZQOSA-N 342.355 1.002 10 10 EDCE CN(C)S(=O)(=O)CCC(=O)NCc1c(O)ccc2c1CCCC2 1622664094 GPVZJCHQTYTNJW-UHFFFAOYSA-N 340.445 1.169 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)CN(C)C(C)=O)C2)cc1C 1480105499 DUVFFDJCIYIDSM-INIZCTEOSA-N 333.432 1.172 10 10 EDCE C[C@H](O)c1ccc(N2CCC[C@H]2[C@@H](O)CO)cc1Br 2123170522 IGICYNSRGZVRFS-HERUPUMHSA-N 330.222 1.824 10 10 EDCE Cc1nc(O)nc(O)c1CC(=O)NCCCSc1nccs1 1632807486 ZVZHQQWXIACJMA-UHFFFAOYSA-N 340.430 1.494 10 10 EDCE Cn1c2c(ccc1=O)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)CCC2 1639691961 YYPSTWMDEUESBY-ZDUSSCGKSA-N 328.368 1.533 10 10 EDCE COCCC(=O)N[C@H](C)[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1734693161 ZXEOURRNHHNJQX-MNOVXSKESA-N 349.391 1.509 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 1643809687 ROILTRGKLXVIFS-CYBMUJFWSA-N 341.367 1.158 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccnc(CO)c1 1583334549 MBIIKKHKTUOGIZ-UHFFFAOYSA-N 327.384 1.341 10 10 EDCE Cn1cc(C(=O)N2CCCc3c(O)ncnc32)c(-c2cccnc2)n1 1595853517 ZTZNWLGOJXSCTR-UHFFFAOYSA-N 336.355 1.571 10 10 EDCE Cn1cc(/C=C/C(=O)N2CCc3c(Cl)cccc32)c(=O)n(C)c1=O 157478851 LGPIRTIYSKZVRK-VOTSOKGWSA-N 345.786 1.340 10 10 EDCE Nc1ccc(Oc2ccc(NC(=O)CC[C@H](N)C(O)O)cc2)cc1 1865958867 ICSIONLZCCHTIJ-HNNXBMFYSA-N 331.372 1.418 10 10 EDCE CN1C[C@@H](C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 1874180720 MNUOTLUONYCLHA-NSHDSACASA-N 348.358 1.879 10 10 EDCE CC1(C)[C@@H](O)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2136627678 BGOMPNULTPCNES-QWRGUYRKSA-N 326.194 1.361 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(C(=O)O)C1(c2cc(O)nc(O)c2)CC1 1952432327 XJBBHAHBDYRRGM-OAHLLOKOSA-N 338.360 1.892 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)COc2ccc(N)cc2)C1 1999491980 LALGCOWCUAISHC-ZDUSSCGKSA-N 335.404 1.773 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N(OCc1ccccc1)C1CNC1 2006996605 XCQPLSLXMQYJJM-UHFFFAOYSA-N 328.368 1.573 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010405206 XONIKSJIUWWPSP-JQWIXIFHSA-N 341.412 1.809 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](N3CC(O)C3)C2)c(Br)c1 2158744811 VVMMLNKQYCZYFS-JQWIXIFHSA-N 340.265 1.724 10 10 EDCE C[C@@H](N)c1ccc(N(C)Cc2nnnn2C)cc1Br 707672820 TWDRKPMGNAHRGJ-MRVPVSSYSA-N 325.214 1.629 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C[C@H]1CO 709218552 BGJIVPYPKSAMQY-UJVNDKKSSA-N 340.221 1.466 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC(C)(C)[C@@H]3[C@@H]3CCCO3)c2n1 2063647641 HPMXHKUYRAYLSO-JSGCOSHPSA-N 330.388 1.773 10 10 EDCE CCN(c1ccc([C@H](C)O)c(Br)c1)[C@H]1CC(=O)NC1=O 2171209468 YHMMIYHACOJCFW-UFBFGSQYSA-N 341.205 1.744 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H](C(=O)NCCCCN=[N+]=[N-])C1 1908254625 RJNFHYSCEZKKCF-RYUDHWBXSA-N 341.412 1.811 10 10 EDCE C[C@H]1[C@H](NC(=O)C(F)(F)F)CCCN1C(=O)c1ccc(O)c(O)c1 2054399736 VJFSJCDACPLCGO-WCBMZHEXSA-N 346.305 1.769 10 10 EDCE C[C@@H]1[C@@H](C)S(=O)(=O)CCN1c1ccc(CO)c(Br)c1 2113961557 KLTRYNDRPOGISF-NXEZZACHSA-N 348.262 1.953 10 10 EDCE CC(C)(C)OC(=O)N1CCOC(C)(C)[C@@H]1C(=O)NCCN=[N+]=[N-] 2242757770 OLGLOXZFPXLVJP-JTQLQIEISA-N 327.385 1.827 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@@H](O)CC2)c(Br)c1 2269136882 CNERMTRAVIINOH-HERUPUMHSA-N 329.238 1.791 10 10 EDCE CCC(=O)N(C)C1CN(c2ccc(CO)cc2Br)C1 2352220412 FXKMMZAHIOJJMA-UHFFFAOYSA-N 327.222 1.998 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CNC[C@H]2F)c(O)c1Br 2352640047 FJTMJUHISZYQIG-NXEZZACHSA-N 331.185 1.637 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1[C@@H]2CC[C@@H]1CC(O)C2 171976271 ZEEOBPPRHWDURN-IAGOWNOFSA-N 331.460 1.699 10 10 EDCE CCC(=O)N1CC[C@@H](C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 120750469 AUKNEVZXSKQNAT-OAHLLOKOSA-N 345.443 1.602 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NC[C@]1(O)CCSC1 304488704 MMWQBVJIDOIODT-MRXNPFEDSA-N 331.397 1.848 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC[C@@H]2CN2CCOCC2)cc1 75506194 GYAMHTPXSLHVPW-GOSISDBHSA-N 346.475 1.759 10 10 EDCE CNC(=O)c1ccc(N2CCN(c3ccc(OC)c(F)c3)CC2)nn1 84929159 JHFHHKQHLCIEAB-UHFFFAOYSA-N 345.378 1.311 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2CC(=O)N(C)C2)cc1C 1507083450 SGVNOOPGUXKVNU-HOCLYGCPSA-N 347.459 1.418 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(C[C@H](C)O)CC2)c([N+](=O)[O-])c1 97299825 BZYJZDWMYRRWKP-AGLBCWCQSA-N 349.387 1.284 10 10 EDCE CCN(CC)CCCN/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O 255425124 CMBNXXZEIMCONO-JLHYYAGUSA-N 340.493 1.091 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCNC(=O)[C@H]2C(C)C)c([N+](=O)[O-])c1 270957470 YIMTWBSHQUKVNC-BIENSFFJSA-N 347.371 1.742 10 10 EDCE CN(C)c1ccc(CNC(=O)C2(N3CCOCC3)CCC2)cc1F 367542940 VMQQHNZKGULCPD-UHFFFAOYSA-N 335.423 1.763 10 10 EDCE CN(C)c1ccc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)cc1F 289369382 LGRLKJZEYJAOOO-AWEZNQCLSA-N 343.468 1.748 10 10 EDCE C[C@@]1(F)CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 295500986 KEPFRXXKSQGOAN-CQSZACIVSA-N 330.381 1.728 10 10 EDCE COCCNC(=O)CN(C)c1ccc([C@H](C)N)cc1Br 723185309 LUVWHYNFNQVBKO-JTQLQIEISA-N 344.253 1.668 10 10 EDCE COc1cccc(CNC(=O)CCCCCCS(N)(=O)=O)c1O 830540910 PPSDZKOKYSKMMJ-UHFFFAOYSA-N 344.433 1.256 10 10 EDCE COc1ccc(CNC(=O)c2c3n(c(=O)n2C)CCCC3)c(O)c1 831032941 MVHBITVPMWABLF-UHFFFAOYSA-N 331.372 1.167 10 10 EDCE CN1CCN(C(=O)CCNC/C=C/c2ccc(N(C)C)cc2)CC1 835038239 PHYPRZNFXSCFGC-SNAWJCMRSA-N 330.476 1.520 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCC(CN3CCCC3)CC2)cc1 841015064 JRGCMNLKVVYRDZ-UHFFFAOYSA-N 330.432 1.542 10 10 EDCE CN(C)CCC[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCO1 856430165 SGSMEIHYIJNCHV-PMGBHYCQSA-N 334.416 1.680 10 10 EDCE CCO[C@H](CS(=O)(=O)NCc1ccc(OC)cc1O)C1CC1 859143911 JNFGHPPTZNQFMI-OAHLLOKOSA-N 329.418 1.635 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@H]([C@]3(C)COC(=O)N3)C2)c(O)c1O 928030045 XAIGGJTWSWDTBT-GTNSWQLSSA-N 334.372 1.757 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCCc4nn[nH]c43)C2)cc1 855226963 RQFUPLAVNCYXMV-IUODEOHRSA-N 341.415 1.628 10 10 EDCE CCn1cc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1 929250825 XCINEMDDJWGPRK-UHFFFAOYSA-N 329.404 1.198 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3C[C@@H](N)C34CCC4)CC2)cc1 925508628 RRRINKCZRCNAKR-RTBURBONSA-N 344.503 1.677 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCOCC3CC3)C2)cc1 852078782 HKXOTWPQQONRFK-OAHLLOKOSA-N 333.432 2.000 10 10 EDCE COc1cc(N2CCN(Cc3c(O)cccc3OC)CC2)ncn1 764676173 FUTJYXGXSVYNAC-UHFFFAOYSA-N 330.388 1.522 10 10 EDCE COc1ccc(O)c(CNC(=O)[C@@H](OC)C(=O)OC(C)(C)C)c1 866766155 KTRBNYTZUZSPSR-CYBMUJFWSA-N 325.361 1.374 10 10 EDCE COC(=O)[C@H](C[C@@H]1CCCOC1)NC(=O)/C=C/c1ccc(O)c(O)c1 862995990 GHIXBJPHDFOTCC-MPCGPATOSA-N 349.383 1.586 10 10 EDCE COC(=O)c1c(CNCCN2CC[C@@H](O)C2)c2cc(F)ccc2n1C 895404944 IBFYPNRKVXMXSB-CYBMUJFWSA-N 349.406 1.260 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H](C[C@@H]1COCCO1)C(F)(F)F 1304053986 ZAJZYERLSZPPOD-KOLCDFICSA-N 349.305 1.698 10 10 EDCE Cn1cnc(CCNC(=O)c2cccc(O)c2O)c1Br 1472126451 XERFBXJWDUANHI-UHFFFAOYSA-N 340.177 1.566 10 10 EDCE C[C@H](O)c1ccc(N(C)Cc2nnnn2C)cc1Br 707631413 SVKZOMFPRSRFBH-QMMMGPOBSA-N 326.198 1.662 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CCc2cnn[nH]2)cc1C 1268705122 ZCIHPIMVWHKIAG-ZDUSSCGKSA-N 331.420 1.349 10 10 EDCE COc1ccc(/C=C2\C(=O)NC(=O)N(C(C)(C)C)C2=O)c(OC)c1 192638 CJKYNSZRILSZMR-XYOKQWHBSA-N 332.356 1.964 10 10 EDCE CC(C)C(=O)NC[C@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1464679081 GYPDGKJUBKTRLL-CQSZACIVSA-N 334.416 1.651 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(Cc2cccc(O)c2)CC1 1540607904 FJLKEDQODPGDDP-UHFFFAOYSA-N 342.395 1.690 10 10 EDCE CCNC(=O)CC(=O)N(C)C[C@@H](C)NCc1ccc(OC)c(C)c1 1485866176 QQQPLECYSZLQNA-CQSZACIVSA-N 335.448 1.466 10 10 EDCE C[C@H](NC(=O)CNC(=O)Cc1ccc(O)cc1)c1ccccc1O 1557968259 WGKUDBMKELLHSV-LBPRGKRZSA-N 328.368 1.634 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3CC(=O)N(C)C3)CC2)cc1C 1723520732 CPXLTZGMYBOISX-OAHLLOKOSA-N 345.443 1.220 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccc(-n2ccnc2O)cc1 1643882450 XYNITYCHTVTTGM-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2ccncc2)cc1C 1677052028 KKUQXANEZWWPJU-QGZVFWFLSA-N 343.427 1.621 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2nccnc2N)cc1C 1774111340 HQEABDPWNQITQQ-CYBMUJFWSA-N 343.431 1.626 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)/C(=C/c2ccccc2F)SC1=S 5374126 ATLBPMVIGHDPOS-JRZFIGEHSA-N 327.358 1.472 10 10 EDCE NCc1ccc(N2CCn3nncc3C2)c(F)c1Br 2130065231 WZDAFKRVWSQFKZ-UHFFFAOYSA-N 326.173 1.659 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N3CCOCC3)c(Br)cc21 118711151 VZTOZSLGFQSDHV-CYBMUJFWSA-N 340.221 1.888 10 10 EDCE CNCc1ccc(N2CC[C@H](O)C[C@@H]2CO)c(Br)c1 2136083065 UPFVGISAFJZQGX-NEPJUHHUSA-N 329.238 1.491 10 10 EDCE COc1ccc(Br)c(CN2CC[C@H](CC(N)=O)C2)c1O 1967793655 OGDINMDRPBXYRM-SECBINFHSA-N 343.221 1.861 10 10 EDCE Oc1cc(Br)ccc1CN[C@@H]1COC2(CCC2)[C@@H]1O 2141555829 KPGJTPCBXMLBSZ-DGCLKSJQSA-N 328.206 1.927 10 10 EDCE C[C@H](CNC(=O)OC(C)(C)C)[C@H](F)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980369245 IWRVZOJCOMVVNC-UZWSLXQKSA-N 330.400 1.751 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985101873 YYHJZPKNEARRBG-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010390708 HLOVJUJLZUWJOB-IJLUTSLNSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCC[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)O1 2018246034 GQABBQGQGIQXJJ-NEPJUHHUSA-N 339.396 1.970 10 10 EDCE CNC(=O)CN(Cc1ccccc1)C(=O)CCOc1ccc(N)cc1 2034780931 CCZKCSSBZPSBLV-UHFFFAOYSA-N 341.411 1.813 10 10 EDCE CN(CCN1CCNCC1)Cc1cc(Br)cc(F)c1O 715780782 YMMHVZQLLCUUIS-UHFFFAOYSA-N 346.244 1.631 10 10 EDCE CN(C)c1ccc([C@H](N)[C@@H](O)c2nn(C)nc2Br)cc1 2167724639 SSDFOCZNIJLVRS-CMPLNLGQSA-N 340.225 1.377 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](OCC(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 1906905155 UIPLVQVKIWYGJV-AVGNSLFASA-N 340.420 1.278 10 10 EDCE CC1(C)C[C@@H](O)[C@@H](O)CN1c1ccc(CN)c(Br)c1F 2188639756 SAKPLRBOMXJKAD-MNOVXSKESA-N 347.228 1.757 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(c3cc4c(cc3N)OCCO4)C[C@@H]21 2045672315 WJADOGNYHUDZPX-CDMJZVDBSA-N 347.415 1.999 10 10 EDCE Cn1cc([C@H](NC(=O)OC(C)(C)C)C(=O)N2CC[C@H](N=[N+]=[N-])C2)cn1 2060635658 NXXBSJSZMKRAMB-RYUDHWBXSA-N 349.395 1.897 10 10 EDCE COCC[S@](=O)CCNCc1cccc(Br)c1O 2085938547 LMHOUMIWXVYNJE-GOSISDBHSA-N 336.251 1.639 10 10 EDCE CN(C[C@@H]1COCCO1)c1cc(Br)c(CN)cc1F 2087371287 JBNDEECUMDRFJR-SNVBAGLBSA-N 333.201 1.899 10 10 EDCE Cn1cc(Br)c(CNCCc2ccc(O)c(O)c2)n1 2093820684 AQZPBHTUPCFDEA-UHFFFAOYSA-N 326.194 1.926 10 10 EDCE CN1CC2(CCN2c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2238612092 WRNDYSALPSKSFN-GFCCVEGCSA-N 337.221 1.295 10 10 EDCE Cc1cnn(CCNC(=O)C=Cc2ccc(N3CCOCC3)cc2)c1 2297601686 YGPUWQWUMLOYRP-UHFFFAOYSA-N 340.427 1.858 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2298024017 TZWKPMIUBKWDBF-ZETOZRRWSA-N 339.396 1.706 10 10 EDCE NCC[C@H](COCc1ccccc1)NC(=O)c1cccc(O)c1O 2303740282 OOASTRGNUNKDFA-CQSZACIVSA-N 330.384 1.762 10 10 EDCE COc1cc([C@@H](NCCN=[N+]=[N-])C(=O)O)c(Br)cn1 2336990235 GBVFZOKKFPJKJW-SECBINFHSA-N 330.142 1.878 10 10 EDCE Cc1ccc(CNC(=O)c2c[nH][nH]c2=N)c(O)c1Br 2352641913 YRGQXHFCIAPTOM-UHFFFAOYSA-N 325.166 1.529 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@H](c2cnn(C)c2)N(C)C)cc1 117954048 ODYJDSBQSNYIQI-QGZVFWFLSA-N 344.463 1.588 10 10 EDCE Cc1cc(O)c(CN2CC[C@H](NS(C)(=O)=O)C2)cc1C(C)C 116870054 UQUIQOOCYUKILI-AWEZNQCLSA-N 326.462 1.948 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)C[C@@H]1N1CCOCC1 177233932 QRAAWZHQQJBPGZ-QAPCUYQASA-N 346.475 1.615 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2357586333 XIFMLNQOXXTTIK-ZAJSEHCFSA-N 342.233 1.823 10 10 EDCE CCCS(=O)(=O)Nc1cc(N2CCN(C)CC2)ccc1OC 74587028 QRDBNQSQMUBOLQ-UHFFFAOYSA-N 327.450 1.599 10 10 EDCE N[C@@H](c1ccc(I)cc1O)C(F)(F)C(=O)O 95782869 ZURAZHQQFKDBPS-ZETCQYMHSA-N 343.067 1.717 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@@H]4O)cc1F 249552246 LFASYIUHZVYWCO-IPJLKBMESA-N 333.407 1.802 10 10 EDCE C[C@H]1CN2CCC[C@H]2CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 247540217 YITMKBHHDYHNPC-LPHOPBHVSA-N 344.503 1.880 10 10 EDCE COC(=O)[C@@](C)(O)CN(C)Cc1ccc(C)c(Br)c1O 2380750147 CGYISNBHKARVGO-AWEZNQCLSA-N 346.221 1.819 10 10 EDCE O=C(NCCn1cncn1)NCc1cc(Br)ccc1O 805136571 HDFIFSKUJPFBOY-UHFFFAOYSA-N 340.181 1.246 10 10 EDCE CO[C@H]1C=CCN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2165061805 LWATWLYPIQHXLU-ISVAXAHUSA-N 339.189 1.826 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1C[C@H]2CC[C@H]1CN2 817877358 WTJARWYUQFFQQP-CABCVRRESA-N 348.422 1.308 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](C)n3ncccc3=O)CC2)cc1 585200987 UAJGUSPMLCITCO-AWEZNQCLSA-N 342.399 1.162 10 10 EDCE Cc1cc(Cl)cc(CN2CCS(=O)(=O)[C@@H]3COCC[C@@H]32)c1O 839187975 ZTEYRATULCAIGO-UONOGXRCSA-N 345.848 1.742 10 10 EDCE CCn1cc([C@H]2CN(C(=O)/C=C\c3ccc(O)c(O)c3)CCO2)cn1 588584852 REOZCRBTPNEIKW-XQDHMALISA-N 343.383 1.928 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CC[C@@](O)(C(F)F)C3)ccc21 838031613 LKXWPQPCLZUWHI-KRWDZBQOSA-N 339.386 1.981 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@]3(C2)CC3(F)F)c1 846618908 BAAJJTNZSMAYMW-CYBMUJFWSA-N 346.355 1.635 10 10 EDCE Cn1nccc1[C@@H]1NC(=O)N(CCCSc2nccs2)C1=O 843310821 NANKKMMMXVYTII-JTQLQIEISA-N 337.430 1.652 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H](O)C3CCC3)cc2)CC1 924254796 UYKXWVATACULHT-QGZVFWFLSA-N 345.443 1.166 10 10 EDCE COc1cncc(CN2CCN(c3ccc(OC)c(F)c3)CC2)n1 859160996 KFJLOEXNSPACCY-UHFFFAOYSA-N 332.379 1.955 10 10 EDCE CCCNC(=O)CCC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855231056 SWMSEKPMQSRHOS-CQSZACIVSA-N 333.432 1.697 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CC[C@H](C)NC1 861806275 ZXMSYONIYCJCIA-HOCLYGCPSA-N 346.475 1.358 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1[C@@H]1CCCn2nccc21 865339565 IEZCTXCUEMSDTK-CQSZACIVSA-N 326.356 1.888 10 10 EDCE CCn1cnc(C(=O)NC[C@@H](O)CNCc2ccc(OC)c(C)c2)c1 1320295137 IGGJFRRLRHXGTK-HNNXBMFYSA-N 346.431 1.101 10 10 EDCE CO[C@@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 1325972303 UTEJHBMVEWSMRB-HZPDHXFCSA-N 345.443 1.369 10 10 EDCE CO[C@@H]1CC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 1335761099 WQLYQNWCASHEHT-JKSUJKDBSA-N 333.432 1.313 10 10 EDCE C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)N(C)Cc1ccccc1O 1332092626 BVUAOLVTKKMZLQ-MEWXFMAXSA-N 332.400 1.111 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCC(CO)CC3)c(Br)cc21 92774997 MMICLHIDCMQCTQ-ZDUSSCGKSA-N 340.221 1.610 10 10 EDCE C[C@@H](c1cccnc1)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1261857645 QYCVQFYRYGAYMC-LBPRGKRZSA-N 325.368 1.849 10 10 EDCE CCc1cc(C(=O)NC[C@@H](CO)NCc2ccc(OC)c(C)c2)no1 1507252963 MYAJYGQOIRDEII-AWEZNQCLSA-N 347.415 1.435 10 10 EDCE CC[C@@H](CNC(=O)c1ccc[nH]1)NC(=O)c1cc(OC)nc(OC)c1 1285031850 HAJUGEPZJWPBSP-LBPRGKRZSA-N 346.387 1.365 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1ccc(-n2cnnn2)cn1 1299725432 MPPLJQDXHUAWAX-UHFFFAOYSA-N 347.338 1.241 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCc2cccc(C(N)=O)c2)cc1 1292593015 AFHLDDCPZADSCD-UHFFFAOYSA-N 339.355 1.920 10 10 EDCE C[C@@H](NC(=O)/C=C\C(=O)N(C)C)c1ccc(N2CCOCC2)cc1 1544214569 AUCBBKNLXQPRNY-QIAWRQBBSA-N 331.416 1.345 10 10 EDCE CN1C(=O)c2cccnc2O[C@H]2CN(Cc3ccccc3O)C[C@@H]21 1615259727 JUFGSRLKNSLIHK-HOCLYGCPSA-N 325.368 1.505 10 10 EDCE CCOCc1nnc(N(C)Cc2ccccc2O)n1CC(=O)N(C)C 1548086307 YUXHBXBBXKRUQT-UHFFFAOYSA-N 347.419 1.245 10 10 EDCE Cn1cc(-c2nn(C)cc2NC(=O)/C=C/c2ccc(O)c(O)c2)cn1 1626913204 GWQJXRVCSSGCLK-GQCTYLIASA-N 339.355 1.884 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)Cc2cnc[nH]2)cc1C 1715684635 JNZXJRCOKGATKT-AWEZNQCLSA-N 330.432 1.954 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C[C@H]2C=CCC2)cc1C 1496938460 LJVJUAVJNXARMX-RDJZCZTQSA-N 332.444 1.927 10 10 EDCE O=C(NCc1cccc(Br)c1O)C1(CO)CCOCC1 1640088330 QRAZZCSZTBLBCG-UHFFFAOYSA-N 344.205 1.560 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@H]2CCC(=O)N2)cc1C 1698736754 ASCXOAZRZXGNIQ-IUODEOHRSA-N 333.432 1.124 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCOc1nnc(=N)[nH]n1)C(C)(C)C 1902662557 DKTBYJOLXKJONI-SECBINFHSA-N 326.401 1.387 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2Nc1c(N)cccc1C(N)=O 2000888734 OYIVPENKQLGNBZ-JIMOISOXSA-N 332.404 1.787 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2012344404 ZRFITEQDLFPUIY-NWDGAFQWSA-N 341.412 1.954 10 10 EDCE O=C(O)CCN(Cc1ccccc1)C(=O)c1cc(O)c(O)c(O)c1 2015074706 JVPASXQYDLJGIZ-UHFFFAOYSA-N 331.324 1.921 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2015119383 JCIXCVWBWWJINS-SNVBAGLBSA-N 338.360 1.543 10 10 EDCE O=S1(=O)CC[C@@H]2CN(Cc3c(O)cccc3Br)C[C@@H]21 2088814287 GXUISGYAQLFGEL-RNCFNFMXSA-N 346.246 1.774 10 10 EDCE Cc1cc(Br)cc(CN(C)[C@H]2CC(=O)NC2=O)c1O 2114732225 LABZTWFMYSYCSZ-JTQLQIEISA-N 327.178 1.310 10 10 EDCE Oc1c(Br)cc(Cl)cc1CNC1CN(C2COC2)C1 2114708416 OWAXBBZYJJJLQI-UHFFFAOYSA-N 347.640 1.981 10 10 EDCE CC1CCC(COc2nnc(=N)[nH]n2)(NC(=O)OC(C)(C)C)CC1 2213783406 PKSVPUCBDVAKFR-UHFFFAOYSA-N 338.412 1.532 10 10 EDCE COC[C@@H]1[C@@H](O)[C@@H](O)CN1c1ccc([C@@H](C)N)c(Br)c1 2234068682 PVLJDVFDKLTYOB-ULTHFGNCSA-N 345.237 1.026 10 10 EDCE Cc1cccc2c1NC(=O)C2=C1SC(=S)N(CCC(=O)O)C1=O 2296650697 FKRYUVDLKGRGDP-UHFFFAOYSA-N 348.405 1.993 10 10 EDCE CCc1nn(C)c(OC)c1CNC(=O)C=Cc1ccc(O)c(O)c1 2308009288 MDYVFWUTINJCNR-UHFFFAOYSA-N 331.372 1.732 10 10 EDCE CC(=O)N(C)CCN(C)c1cc(Br)c(CN)cc1F 2339455271 AWDDUFJIGIRNDK-UHFFFAOYSA-N 332.217 1.961 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H](N)[C@H](C)O)c(O)c1Br 2352648741 BANKYBXKJOJRQB-GZMMTYOYSA-N 331.210 1.130 10 10 EDCE COC[C@H](C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 103428408 ZSIHYTCQJLHJBH-INIZCTEOSA-N 349.475 1.606 10 10 EDCE Cc1[nH]c2ccnn2c(=O)c1CC(=O)NCc1ccc(N(C)C)cc1 103737958 PERGIZSRSWMKJR-UHFFFAOYSA-N 339.399 1.256 10 10 EDCE COc1ccc(N2CCN(C=O)CC2)cc1NC(=O)[C@H](C)C1CC1 62275236 HJHHTACFOXSUCB-CYBMUJFWSA-N 331.416 1.958 10 10 EDCE CNCc1ccc(N2CCN3C[C@@H](O)C[C@@H]3C2)c(Br)c1 405242169 WTAAXDLZRXLNKN-OLZOCXBDSA-N 340.265 1.424 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H]2CCCCC[C@H]2C(N)=O)cc1 120622134 LVWLYRCJIYCGTQ-CVEARBPZSA-N 332.448 1.986 10 10 EDCE Cc1cc(N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)n[nH]1 189022593 WACSLZLBATYMRR-UHFFFAOYSA-N 341.459 1.877 10 10 EDCE CN(CC(N)=O)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 383027252 XZZASNBBYGGVNU-UHFFFAOYSA-N 334.420 1.484 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C(C)=O)C(C)(C)C)CC2)cc1 242576250 CGFLWDAPTQVDIP-UHFFFAOYSA-N 347.459 1.991 10 10 EDCE CC(C)Oc1ccc(N2CCN(C(=O)NCCN(C)C)CC2)cc1 242744316 DFMNUPSGKABGNT-UHFFFAOYSA-N 334.464 1.867 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N1CCN2CCC[C@@H]2C1 255616195 UYTANRLDYQWAOF-NVAPOSRTSA-N 341.455 1.843 10 10 EDCE CN=c1[nH]cc(F)c(=NCc2ccc(C)c(Br)c2O)[nH]1 2381130694 CKSDMTWWJUONLH-UHFFFAOYSA-N 341.184 1.890 10 10 EDCE CC[C@@H](O)CC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 822823235 DHVBJGBAMXHXSL-MRXNPFEDSA-N 335.448 1.094 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@H](N)CCC(=O)OC)cc1 826020351 RTIGTGMBIULCBE-MRXNPFEDSA-N 335.448 1.772 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3nnn(C)c3C)C2)cc1 823804268 LYLHYKVMOQXXAW-GFCCVEGCSA-N 330.392 1.533 10 10 EDCE Cc1nc(O)c(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)nc1C 832267038 LRGDOBAKJKBNEE-AWEZNQCLSA-N 329.404 1.295 10 10 EDCE C[C@@H]1CCNC(=O)[C@H]1NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588617948 YVOGZCLSYUOYKV-MZIXXUKJSA-N 343.427 1.177 10 10 EDCE CN(C)c1ccc(/C=C/CNC[C@H]2CCN(S(C)(=O)=O)C2)cc1 835043069 ZZNKRGILMJEYLZ-DWTRPJMMSA-N 337.489 1.637 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)CNC(=O)c2ccccn2)c1 740082732 UFIUJGVGGQNOIU-NSHDSACASA-N 329.356 1.403 10 10 EDCE CN(C)c1ccc(CNC(=O)NCC(C)(C)CS(C)(=O)=O)cc1 913926749 LWAQCLQZXMBYAL-UHFFFAOYSA-N 341.477 1.623 10 10 EDCE CO[C@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)[C@](C)(CO)C1 913658743 PJSSIAHGUTZGEH-HWPZZCPQSA-N 337.397 1.924 10 10 EDCE NC(=O)C1CCN(c2ccc(CN[C@H]3CN4CCC[C@H]3C4)cc2)CC1 926872346 DIRRFKYRAHVOOA-HKUYNNGSSA-N 342.487 1.572 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@H](OC)[C@H]3CCOC3)C2)cc1 854980484 CAPIVGXLGJBHHL-RVKKMQEKSA-N 348.443 1.689 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)c1ccc(-n2cnnn2)cn1 857467155 UKGPZKAUVNMYNX-UHFFFAOYSA-N 338.371 1.815 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCc3nccnc3C2)cc1 852699138 BRKAEGUGJCCADL-UHFFFAOYSA-N 325.416 1.217 10 10 EDCE Cc1cnc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)c(C)c1 929236899 MZANCWPGMHMETQ-UHFFFAOYSA-N 340.427 1.697 10 10 EDCE CO[C@H](CS(=O)(=O)N[C@H](C)c1ccccc1O)C1CCOCC1 867834708 KSHUSFGSRMEDIS-MLGOLLRUSA-N 343.445 1.814 10 10 EDCE C[C@H](O)[C@H]1CCN(c2cc(N3Cc4cccc(O)c4C3)ncn2)C1 866117788 RBMKAZVLWRYYLT-STQMWFEESA-N 326.400 1.910 10 10 EDCE O=C([C@H](O)c1cnc[nH]1)N(Cc1ccccc1O)C[C@H]1CCCO1 866899146 DTUNWZACJIXAPY-CZUORRHYSA-N 331.372 1.357 10 10 EDCE CN(CC(=O)NCc1ccc2cccnc2c1O)[C@@H]1CCSC1 862026994 GKVPSTFQXYCXBQ-CQSZACIVSA-N 331.441 1.994 10 10 EDCE O=C(C(=O)N1CCOC[C@@H]1c1ccco1)N1Cc2cccc(O)c2C1 1119004703 BPGGNOCTDZQDQI-CQSZACIVSA-N 342.351 1.428 10 10 EDCE COc1nn(C)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 789590497 ZSXLDKKQQLTHQV-NSHDSACASA-N 345.403 1.311 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3Cc4cccnc4C3)nc12 787672915 WQJZETSOPRAEQC-UHFFFAOYSA-N 339.355 1.522 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCC4(CCOCC4)C3)nc12 1332644958 IFVQMKCZDHQRCW-UHFFFAOYSA-N 332.360 1.136 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCc2cc3n(n2)CCCO3)cc1 1160296866 BVKLRIMKHBRDCD-UHFFFAOYSA-N 328.332 1.758 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H](C)n2cncn2)cc1C 1331426784 KJQJFYIBOJOFOK-GJZGRUSLSA-N 345.447 1.793 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ncoc2C)cc1C 1331682970 KLYSXMGFWZLDGF-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2cnn(C)c2N)cc1C 1268060651 WVTNRNHDIJNIQL-ZDUSSCGKSA-N 345.447 1.570 10 10 EDCE O=C(CCN1CSCCSC1)NCc1ccc(O)cc1O 1299572737 FWCCCQLHDHUDAK-UHFFFAOYSA-N 328.459 1.801 10 10 EDCE CCCC(=O)NC[C@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1298976919 UTBMCOQOCPZLKM-CYBMUJFWSA-N 331.376 1.980 10 10 EDCE O=S1(=O)C[C@H]2[C@@H](CNCc3cccc(Br)c3O)[C@H]2C1 2117982600 QDMGWYGGFXDUMG-JGPRNRPPSA-N 346.246 1.535 10 10 EDCE COc1ccn2c(C(=O)NCCc3ccc(O)c(O)c3)cnc2c1 1465981574 PSORVVSYXDJISW-UHFFFAOYSA-N 327.340 1.727 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2coc(C(N)=O)c2)cc1C 1481260484 SOTXKPUMVAKNHU-UHFFFAOYSA-N 345.399 1.557 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H]3CCNC(=O)[C@H]32)cc1 1558096716 NIUBYXUQRBFXKA-MFKMUULPSA-N 329.360 1.590 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H]2CCC(=O)NC2)cc1C 1716403509 XYCMHPUEDXCZGG-HIFRSBDPSA-N 333.432 1.124 10 10 EDCE O=C(CNC(=O)c1cc2ccccc2[nH]1)NCc1c(O)cccc1O 1558534185 PGXCRVRRUDIISW-UHFFFAOYSA-N 339.351 1.625 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@H]2CCNC(=O)CC2)cc1C 1732965250 RWXHINDMMXLVQO-ZBFHGGJFSA-N 347.459 1.514 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cn3cncc3C)CC2)cc1C 1733250710 PGWDJARKJHWWSC-UHFFFAOYSA-N 342.443 1.947 10 10 EDCE CC(=O)N1C[C@@H](C(=O)NCc2cc(O)ccc2O)Oc2ccccc21 1651222817 QBYNBIPAEAXITG-KRWDZBQOSA-N 342.351 1.528 10 10 EDCE CCOCC(=O)N[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1758664077 NJSZRIXALDNJQQ-JOCQHMNTSA-N 347.375 1.263 10 10 EDCE COCCNCc1ccc(N2C[C@@H](O)[C@H]2C)cc1Br 2126123207 NXEMJGBMCKSGEW-QMTHXVAHSA-N 329.238 1.755 10 10 EDCE COc1ccc(CNCC(C)(C)CN(C)C(=O)CNC(C)=O)cc1C 1674814743 NJKOIVMDVXRBKX-UHFFFAOYSA-N 349.475 1.714 10 10 EDCE C[C@H]1CCN(C(=O)c2cccc(O)c2O)C[C@@H]1NC(=O)C(F)(F)F 1965198117 FMBWELRMTQJDST-WPRPVWTQSA-N 346.305 1.627 10 10 EDCE NC(=O)NC1CC(NCc2cc(Br)cc(F)c2O)C1 1966034263 QWDGHTMZLLYCOY-UHFFFAOYSA-N 332.173 1.583 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)/C(=C\c2ccc(F)cc2F)SC1=S 1858595852 JWXLDKCTWZMRLS-QKWZMYFISA-N 345.348 1.612 10 10 EDCE CN1CCN(c2ccc(CN)c(Br)c2)C(C)(C)C1=O 228154451 BOQFSKRODPZANK-UHFFFAOYSA-N 326.238 1.965 10 10 EDCE CO[C@H](c1ccc(O)c(O)c1O)[C@@H](NC(=O)OC(C)(C)C)C(=O)O 1952365804 VQKVINZGQOTUCU-BXKDBHETSA-N 343.332 1.469 10 10 EDCE CN1CCc2cc(CNCc3c(Br)nnn3C)ccc21 2145589298 HXNKYYZPNNIYEE-UHFFFAOYSA-N 336.237 1.860 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)NCc1ccccc1O 2010278122 DPIRDSWNFQTUKK-ZDUSSCGKSA-N 338.404 1.674 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](OCC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010403845 KOPRRLRTLJQYTA-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE NCc1ccc(N2CCC[C@@](O)(CO)C2)c(F)c1Br 313651622 KNWZMYVXAJCZLF-ZDUSSCGKSA-N 333.201 1.371 10 10 EDCE CN1CCO[C@@H](CN(C)Cc2c(O)cccc2Br)C1 709429575 ZAXAGIAQKLCWKH-LLVKDONJSA-N 329.238 1.917 10 10 EDCE O=S1(=O)CC(CNCc2cc(Br)cc(F)c2O)C1 715738455 UHBMRWZEQKLWMO-UHFFFAOYSA-N 338.198 1.428 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCN[C@H](c4ccccc4)C3)c2n1 2063461371 PIZIPTJVOSVUDW-HNNXBMFYSA-N 337.383 1.530 10 10 EDCE CC(C)(C)OC(=O)N1CC(F)(F)C[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1906906710 WWDBQKLJJJVYNL-GMTAPVOTSA-N 346.374 1.897 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1908252718 DEQNYXAVGYUCHR-TUAOUCFPSA-N 339.396 1.970 10 10 EDCE CO[C@@H]1CN(c2ccc(CO)c(Br)c2)[C@H]2COC[C@@H]12 2102137617 QEDUTWRDNXGUJW-KWCYVHTRSA-N 328.206 1.791 10 10 EDCE C[C@@H](N)c1ccc(N2CC(CS(C)(=O)=O)C2)c(Br)c1 2103208803 LLJKURGPZJZYAP-SECBINFHSA-N 347.278 1.950 10 10 EDCE O=S1(=O)CC[C@H]2CN(c3ccc(CO)c(Br)c3)C[C@H]21 2088785090 UUUIGVKREZLWTB-TVQRCGJNSA-N 346.246 1.565 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)cc1Br 2201284777 PBNQKVUUUXNRMZ-HDRXNWCYSA-N 338.249 1.897 10 10 EDCE COc1ccc(N2CC[C@H](O)[C@@H](CO)C2)c(OC)c1Br 2234903070 OSVYTGOYPAJDKM-KOLCDFICSA-N 346.221 1.646 10 10 EDCE NCc1ccc(N2CC(O)(C(F)(F)CO)C2)cc1Br 2272885304 QITAIMLZLUCYNO-UHFFFAOYSA-N 337.164 1.087 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N1CCN(C2CC2)CC1 2297505895 PNJKSKPCZNWBLT-UHFFFAOYSA-N 341.455 1.843 10 10 EDCE CC(C)(C)OC(=O)N(CCCO)CCC(=O)N1CC[C@@H](N=[N+]=[N-])C1 2303240691 OPRGGDCPBTUKJF-GFCCVEGCSA-N 341.412 1.907 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)NCC(=O)NCCc1ccccc1 2307996471 HCKLLTLQJSBGKJ-UHFFFAOYSA-N 340.379 1.586 10 10 EDCE 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OIIJXTKDLHQKSU-KCJUWKMLSA-N 330.178 1.829 10 10 EDCE OC[C@@H]1COCCN1c1ccc(CNC2CC2)cc1Br 236494981 GAWGVOSLKRKLGW-CYBMUJFWSA-N 341.249 1.899 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N(C)Cc1ccccc1O 2010263168 UWVVFGWAPMNWGY-SMDDNHRTSA-N 338.404 1.625 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010390351 CDEHXWFUZCOQOR-QJPTWQEYSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N1CC(NCc2ccc(F)cc2O)(C(N)=O)C1 2024891233 VTVDWPDXNVUAEY-UHFFFAOYSA-N 339.367 1.096 10 10 EDCE COC[C@@H](NCc1cc(Cl)cc(Br)c1O)C(N)=O 2034954178 UNHGFCXIAFJEOW-SECBINFHSA-N 337.601 1.398 10 10 EDCE Oc1cccc(Br)c1CN1CCN(C2CNC2)CC1 706818162 JGAQBFGOCFZPRJ-UHFFFAOYSA-N 326.238 1.244 10 10 EDCE O=C1Nc2cc(N3CC[C@H]4[C@@H]3C[C@H]4O)c(Br)cc2[C@@H]1O 2178158079 ZTVNEUXDISRCRO-VWSRCUEZSA-N 339.189 1.394 10 10 EDCE CCNCc1ccc(N2CCN(C)C[C@@H]2CO)cc1Br 699454305 DJDTZBLMDMEOGQ-CQSZACIVSA-N 342.281 1.671 10 10 EDCE C[C@H](O)CN1CCN(c2ccc([C@@H](C)N)c(Br)c2)CC1 2170217055 XCOKAWQVEZZBCI-NWDGAFQWSA-N 342.281 1.972 10 10 EDCE CN(C(=O)CN1CC[C@@H](NC(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2044607244 XYAQNNPWSXVZRV-CQSZACIVSA-N 348.447 1.831 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H]2CN3C(N)=O)cc1Br 2192282761 OZGUASQQWOOMJO-INTQDDNPSA-N 339.237 1.810 10 10 EDCE O=S1(=O)CC[C@H]2CN(c3ccc(CO)c(Br)c3)C[C@@H]21 2088785091 UUUIGVKREZLWTB-ZANVPECISA-N 346.246 1.565 10 10 EDCE C[C@@H](N)c1ccc(N2CCCC2(CO)CO)c(Br)c1 2089868572 SFUIJNIWZHIYPE-SNVBAGLBSA-N 329.238 1.792 10 10 EDCE O=S(=O)(CCNCc1cc(Br)ccc1O)C(F)F 2217595923 UWIYBHNCADFDFE-UHFFFAOYSA-N 344.177 1.882 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CN(C)C[C@H]2OC)c1O 2236049220 NRZAESHJKVURRV-DGCLKSJQSA-N 345.237 1.582 10 10 EDCE COc1ccc(N(CCO)C[C@H](C)O)c(OC)c1Br 2226547020 LUYSWJKTWKMEGC-VIFPVBQESA-N 334.210 1.646 10 10 EDCE CNCc1ccc(N2C[C@H]3CCO[C@@]3(CO)C2)c(Br)c1 2239802236 XPVRXJHQOMFYFH-IUODEOHRSA-N 341.249 1.756 10 10 EDCE O=C1Nc2cc(N3C[C@H]4COC[C@H]3C4)c(Br)cc2[C@@H]1O 2286932275 DEQMGSCDLYIBII-DAROEXNTSA-N 339.189 1.660 10 10 EDCE CCC[C@H](NC(N)=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 68017694 GOIKOEDCIXRXAC-INIZCTEOSA-N 348.447 1.571 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(C(N)=O)cn1C 121546807 YBFBAEQBADVJQM-UHFFFAOYSA-N 328.372 1.229 10 10 EDCE COc1cccc(CN2CCN(c3ccc4nncn4n3)CC2)c1O 120497370 GLWMHLMDPNAFPJ-UHFFFAOYSA-N 340.387 1.161 10 10 EDCE Cc1nnc(CN(C)CC(=O)NCc2ccc(N(C)C)c(F)c2)n1C 78030935 NWROOQCVOVFDPZ-UHFFFAOYSA-N 348.426 1.077 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCc3ccnn3C)CC2)cc1 186752997 ILIIKYBXMLXXFA-UHFFFAOYSA-N 343.431 1.503 10 10 EDCE COc1ccc(CN2CCN(c3cc(OC)ncn3)CC2)c(O)c1 184436731 OVNYEPSPTZCWFN-UHFFFAOYSA-N 330.388 1.522 10 10 EDCE CCOC(=O)[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 327376889 UDUFWXZDMVGHOT-SNVBAGLBSA-N 349.343 1.705 10 10 EDCE COCCCNC(=O)N1CCN(c2ccc(OC)c(OC)c2)CC1 242975412 HPLAFZFGKCOKLE-UHFFFAOYSA-N 337.420 1.572 10 10 EDCE O=C1N[C@@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CS1 266844518 PLXVVQSVHSRZEA-GFCCVEGCSA-N 339.392 1.104 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N[C@H]3CC[C@@H]3C)CC2)cc1 805013890 JKLNHGCPSHXVEE-YJBOKZPZSA-N 346.475 1.915 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCO[C@H](C(F)F)C1 801564862 BGZWORBDUQBDDS-HNNXBMFYSA-N 341.402 1.677 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NCc2cnn(C)n2)cc1F 805093630 DAGXZMHIZWRTAG-UHFFFAOYSA-N 334.399 1.800 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C[C@H]3CCNC3)cc2)C1 827469296 UHKWZXGCZUYHRZ-CVEARBPZSA-N 344.459 1.004 10 10 EDCE CC(C)[C@@](C)(CO)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 823524954 ZRQUAFOLZAHPHD-LJQANCHMSA-N 349.475 1.854 10 10 EDCE CCN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCOC1 823523507 GOUZWNHEFTXRDT-QGZVFWFLSA-N 347.459 1.968 10 10 EDCE COc1ccc(N2CCCN(C[C@H](O)C3(O)CCCC3)CC2)cc1 905916102 XWMFCRQRDDBKTL-SFHVURJKSA-N 334.460 1.873 10 10 EDCE COc1ccc(O)c(CNC(=O)Nc2cnn(-c3ncccn3)c2)c1 746033209 MMIPNVUXBBKORJ-UHFFFAOYSA-N 340.343 1.698 10 10 EDCE COC[C@H](NC(=O)NCc1cc(OC)ccc1O)C1CCOCC1 853736820 PPALIBPTBZQEEN-HNNXBMFYSA-N 338.404 1.642 10 10 EDCE CN(C)c1cc(F)c(CNC(C)(C)CNS(C)(=O)=O)cc1F 922636269 KGNCFDGSEBAWIY-UHFFFAOYSA-N 335.420 1.448 10 10 EDCE CO[C@H](CNCc1ccc(N2CCN(C)CC2)cc1)[C@H]1CCOC1 850341454 AGIWCSOFEGMUKP-PKOBYXMFSA-N 333.476 1.580 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@H](O)C(F)(F)C(F)(F)F 922243481 QOMRVEZITZDCFP-GQPNGRKGSA-N 341.232 1.786 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCC12CC(CN1)C2 851654430 BZWHFMQKUWUOHK-UHFFFAOYSA-N 348.422 1.214 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1ccc(-n2cnnn2)cn1 857548513 MANRYNJBCPSBMT-UHFFFAOYSA-N 330.735 1.346 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)CC[C@@H]1CC[C@H](C(N)=O)O1 865027610 XHLRMZOPQIOKCO-DLBZAZTESA-N 347.459 1.914 10 10 EDCE C[C@H](NC[C@]12COCCN1C(=O)OC2)c1ccc(Cl)cc1O 866520502 BUBMQEBAKKOIFR-ZUZCIYMTSA-N 326.780 1.917 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN[C@H]1CC 861798118 MVAFIZZSXUJOJQ-JKSUJKDBSA-N 347.459 1.778 10 10 EDCE CCO[C@@H](C(=O)NCc1ccc2cccnc2c1O)[C@H]1CCOC1 868937981 PQQUFYLGDTVVLK-WMLDXEAASA-N 330.384 1.998 10 10 EDCE COC(=O)c1ccn(CCCC(=O)NCc2cc(C)ccc2O)n1 880837263 KMYQOKVFYRIVQN-UHFFFAOYSA-N 331.372 1.780 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cc3c(=O)[nH]c(C)cn3n2)c1 1150543058 HVCUEVBFJOWGGB-SNVBAGLBSA-N 342.355 1.536 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@H]3C[C@H]4CC[C@H]3C4)ccc21 1324795036 OUVWUKXICHPMKX-QRTARXTBSA-N 341.455 1.990 10 10 EDCE CN1CCN(c2ccc(CNC[C@@H]3C[C@@H]4COC[C@@H]4O3)cc2F)CC1 1332319433 UUVCPYVOBRDSFP-GJYPPUQNSA-N 349.450 1.471 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C[C@@H](O)CC1(O)CCC1 1261798381 JWCLVRJEGAZGBF-HNNXBMFYSA-N 337.416 1.423 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@H]2CC2(F)F)cc1F 1347940210 GWPQPHDKWMDRGR-NSHDSACASA-N 343.349 1.669 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1C[C@@H](CO)[C@H](CCO)C1 1346297751 ZGMJXFCHPLQECV-CVEARBPZSA-N 335.448 1.193 10 10 EDCE CCCC(=O)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1352729588 HRUOWYFTICOKDR-ZDUSSCGKSA-N 331.376 1.980 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC(=O)NCc2ccccc2)cc1 1543788580 AIKSMOCTDMQVDM-UHFFFAOYSA-N 339.355 1.895 10 10 EDCE COCCCN1CC([C@@H](C)NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1725271654 ZPYGUZNIXXGGMF-GFCCVEGCSA-N 347.419 1.936 10 10 EDCE O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1c(F)ccc(O)c1O 1641154254 YBWSFERXZLDVLD-UHFFFAOYSA-N 335.291 1.987 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)/C=C(/C)C2CC2)cc1C 1734361373 LBCLOZMATJYRIO-GQPJMJRUSA-N 332.444 1.927 10 10 EDCE Cn1cc(C(=O)NCc2c(O)ccc3ccccc23)c(O)nc1=O 1645440405 BUTOFPORCSFNFD-UHFFFAOYSA-N 325.324 1.275 10 10 EDCE CCNC(=O)CC(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 1733242262 AMUHGBSPTQDACI-UHFFFAOYSA-N 333.432 1.268 10 10 EDCE CCCCC(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1758665515 SIXFGTAPTGYBTA-JOCQHMNTSA-N 335.404 1.666 10 10 EDCE CC(C)(C)C(=O)N1CCCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169846364 GBMBBYUYJPEZJO-UHFFFAOYSA-N 336.388 1.524 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@H]1CCCN1c1nccs1 157965640 LMXUXJLFVCJBNQ-GFCCVEGCSA-N 333.413 1.882 10 10 EDCE CCNCc1ccc(N(C)[C@H]2CCNC2=O)c(Br)c1 1916817087 YEHUPEOGCUDOAC-ZDUSSCGKSA-N 326.238 1.883 10 10 EDCE C[C@@H](NCC1(O)CN(C(=O)OC(C)(C)C)C1)c1cc(O)ccc1O 1918696679 JPMWYWLIFWPYEP-LLVKDONJSA-N 338.404 1.730 10 10 EDCE CNCc1ccc(N(C)CCS(C)(=O)=O)c(Br)c1 234403765 HZUWFQAPKUKLQT-UHFFFAOYSA-N 335.267 1.649 10 10 EDCE CNCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@H]32)cc1Br 2146698664 KXDHDHDPNWZLEC-NWANDNLSSA-N 341.249 1.897 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)N2CC(N=[N+]=[N-])C2)CO1 1985093626 CDNHLPWLYFMKFN-ONGXEEELSA-N 325.369 1.532 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985102472 HQACDKHLXRGAAT-HBNTYKKESA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1CC(=O)N1CC(N=[N+]=[N-])C1 2010389714 TZWRAAQVFCVXJE-PWSUYJOCSA-N 339.396 1.827 10 10 EDCE CC[C@H](NC[C@@](O)(CO)COC)c1cc(Br)ccc1O 2158618725 ONKWZTNUKXAEQX-GXTWGEPZSA-N 348.237 1.565 10 10 EDCE CNCc1ccc(N2CCNC(=O)C[C@H]2C)cc1Br 707625356 HVWVUJNOFWNBCD-SNVBAGLBSA-N 326.238 1.883 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3COC[C@@H](C2)C3O)c(Br)c1 2167790663 AAZJOKLLIZPUBA-JURLDLKRSA-N 341.249 1.912 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@@H]1CCC=C1Br 2196820760 YVEHPRUSMSZNEM-WDEREUQCSA-N 341.205 1.525 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)c1nc(=NCc2cccc(O)c2O)[nH][nH]1 2066590241 KFNJGOKDFLHPQX-VIFPVBQESA-N 349.391 1.836 10 10 EDCE CNCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2199525115 CSOFFIANRGFREZ-HJPIBITLSA-N 341.249 1.489 10 10 EDCE CNCc1ccc(N2CC(=O)NC(C)(C)C2)cc1Br 2094062459 HICUUDKLVRNGHD-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE CSc1ncc(CN=c2[nH]c(=N)[nH]cc2Br)s1 2248742458 OITLRCXUPRQEPQ-UHFFFAOYSA-N 332.252 1.864 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)NCCc1nnc2n1CCCCC2 2307982173 REBCYNPPWKFKIM-UHFFFAOYSA-N 342.399 1.788 10 10 EDCE CCCS(=O)(=O)N(C)NCc1c(O)cccc1Br 2317493762 JKMZEUUPNORTSB-UHFFFAOYSA-N 337.239 1.831 10 10 EDCE NCc1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(F)c1Br 2329194055 YRIKYUREJWQATM-DVVUODLYSA-N 331.185 1.243 10 10 EDCE CCOC(=O)[C@@H](O)CNCc1ccc(C)c(Br)c1O 2352634832 YRBAMNYYRJBIIN-JTQLQIEISA-N 332.194 1.477 10 10 EDCE Cc1ccc(CN2CCNC[C@@]2(C)CO)c(O)c1Br 2352684802 TXOJXTSHIIWDCN-AWEZNQCLSA-N 329.238 1.619 10 10 EDCE CC(C)(C)NC(=O)CNC(=O)NCc1ccc(N2CC=CC2)cc1 172690733 IWIWLNXJCLRZFX-UHFFFAOYSA-N 330.432 1.777 10 10 EDCE COCCN(CCN1CCOC[C@H]1C)c1ccc(OC)c(OC)c1 192760449 NVXXMNWCVWCKSQ-OAHLLOKOSA-N 338.448 1.877 10 10 EDCE CNC(=O)[C@H]1CCN(C(=O)NCCCSc2nccs2)C1 817776389 ISVNQDHQRYPZTK-JTQLQIEISA-N 328.463 1.403 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCN(C)S1(=O)=O 843775676 BUMOWBCWSVDHTR-OAHLLOKOSA-N 339.461 1.135 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)C[C@@H]3CCOC3)C2)cc1 849415548 BRULXENUYZGCCP-ZIAGYGMSSA-N 340.445 1.230 10 10 EDCE CC[C@H](CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1)C(=O)O 927941850 WFYJOYQOTZLROY-CQSZACIVSA-N 347.415 1.130 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc(C=O)cn3C)C2)cc1 855226338 RGEFYQIWUUHWHI-AWEZNQCLSA-N 327.384 1.855 10 10 EDCE CNc1nc(C)cc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)n1 855223036 BFPWEWHTESPVIN-ZDUSSCGKSA-N 341.415 1.844 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@H](O)C(F)(F)C2)c([N+](=O)[O-])c1 853802792 GUNIYOJFUPFCPF-LQPUYASZSA-N 342.298 1.987 10 10 EDCE CCO[C@H](C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@H]1CCOC1 864470993 UVTXHAAGYPUKSR-YJBOKZPZSA-N 348.443 1.785 10 10 EDCE COCCCn1nc(C(=O)NCc2cc(C)ccc2O)ccc1=O 862753808 IDFZPZOVEMZQLA-UHFFFAOYSA-N 331.372 1.224 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2C[C@@H](C(N)=O)C2)c1 862129089 MIAAMAWNVMHLDT-FZNQNYSPSA-N 339.395 1.900 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)CC3COC3)CC2)cc1 769674676 DMRIKTJMLWEJKJ-UHFFFAOYSA-N 347.459 1.360 10 10 EDCE CCOC(=O)[C@@H]1CN(C(=O)c2cccc(O)c2O)C[C@H]1C(F)(F)F 874907959 QSMRQRZHBRGFPH-NXEZZACHSA-N 347.289 1.911 10 10 EDCE COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1c(O)cccc1OC 770377201 YMXQSBQRHMTNTD-CZPYZCIJSA-N 349.383 1.326 10 10 EDCE NC(=O)[C@H](CNC(=O)c1cccc(O)c1O)Cc1ccc(F)cc1 790574436 ASLWFFPFMKIDRV-NSHDSACASA-N 332.331 1.311 10 10 EDCE CN(C)c1ccc(CN(C)S(=O)(=O)c2c(Cl)cnn2C)cc1 797440919 HGUXGNPKOHYHHH-UHFFFAOYSA-N 342.852 1.960 10 10 EDCE CCN1C(=O)NC(=O)/C(=C/c2cc(C)n(C[C@H]3CCCO3)c2C)C1=O 1084312690 OSBQWOSUJVNYJK-WJQTUHTMSA-N 345.399 1.766 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cccs2)cc1C 1320187211 ODYJPYBSOYPJBQ-CQSZACIVSA-N 334.441 1.946 10 10 EDCE CO[C@@H]1CC[C@@H](NC(=O)C(=O)NCCCSc2nccs2)C1 1324636776 KUCLTTBIQGEODB-GHMZBOCLSA-N 343.474 1.425 10 10 EDCE NC(=O)CN1CCC(NCc2ccc(Br)cc2O)CC1 691466175 XQHQRQRNDVKTNB-UHFFFAOYSA-N 342.237 1.194 10 10 EDCE COCCOCCNCc1c(Br)ccc(OC)c1O 1964554892 QEVYATCAHGHLTF-UHFFFAOYSA-N 334.210 1.916 10 10 EDCE O=C(C(=O)N1CCOC[C@@H]1C1CCC1)N1Cc2cccc(O)c2C1 1335623716 ZAUCUXIMZHMEKZ-OAHLLOKOSA-N 330.384 1.262 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1CCC(=O)N1C)NCc1ccc(OC)c(C)c1 1267813586 ABDJLEOYCMFDSS-HOTGVXAUSA-N 347.459 1.609 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3C[C@H]3C(C)C)C2)cc1 1347631170 VEIWSIOYHWUWCZ-RRQGHBQHSA-N 345.443 1.551 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CCCS1(=O)=O 1351162105 CXMRHKJWGOSPSI-INIZCTEOSA-N 336.457 1.822 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2c[nH]c(=O)cn2)cc1C 1274317790 FRQRMUBLARZULC-ARJAWSKDSA-N 342.399 1.163 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cc[nH]c2C)cc1C 1501448573 YBVIXGMJNXHOCP-UHFFFAOYSA-N 345.443 1.864 10 10 EDCE NC(=O)[C@@H]1CC[C@@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)O1 1445981047 DANBSPWCYFDGBY-KWQFWETISA-N 336.369 1.075 10 10 EDCE Cc1nc(C)c(CC(=O)NCc2ccc3cccnc3c2O)c(O)n1 1469248372 HIMFWEQBUCPTTO-UHFFFAOYSA-N 338.367 1.912 10 10 EDCE C[C@@H](NC(=O)N[C@H]1CCN(c2cc(O)ncn2)C1)c1ccccc1O 1471524195 SHGYTHPLPJDFOI-NEPJUHHUSA-N 343.387 1.527 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(CC)on1 1624659104 PLVFMCHRPYVVLP-ZDUSSCGKSA-N 348.355 1.552 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CC[C@@H](c2nn[nH]n2)C1 1558078841 MHNBKLHMPIXGKX-SSDOTTSWSA-N 331.357 1.455 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCCNC(=O)c1cccc(F)c1 1629164017 OZSYFHRJFBCVEJ-UHFFFAOYSA-N 346.358 1.716 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H]2CCCC(=O)N2)cc1C 1713603944 UBPGYFVGMXRSFO-OAHLLOKOSA-N 333.432 1.220 10 10 EDCE CC1(C)[C@H](NC(=O)Cc2ccc(O)c(O)c2)C[C@H]1N1CCOCC1 1557316139 LSOVYTQQENCOSC-HZPDHXFCSA-N 334.416 1.256 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)CN2CCOCC2)cc1C 1568268683 WYGKSQCCKSGXGL-MRXNPFEDSA-N 349.475 1.272 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@H]1CCS(=O)(=O)c2ccccc21 1638352240 NJLAMBNBYBURLS-AWEZNQCLSA-N 347.392 1.675 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cccc(-n2ccnc2O)c1 1630335149 LOGHEIGCILUNRI-UHFFFAOYSA-N 339.351 1.962 10 10 EDCE Cc1nc([C@H]2COCCN2C(=O)c2ccc(N=NC(N)=O)cc2)no1 1567511031 SPTXSVPTLMJTGE-GFCCVEGCSA-N 344.331 1.754 10 10 EDCE CC[C@H](CNC(=O)C1(C(N)=O)CC1)NCc1ccc(OC)c(C)c1 1732210274 PUXNHIPAGKPUPY-CQSZACIVSA-N 333.432 1.254 10 10 EDCE CC1=C(C(=O)NCc2c(O)ccc3ccccc23)S(=O)(=O)CCO1 1652709085 UYYBEORDBXCTLK-UHFFFAOYSA-N 347.392 1.838 10 10 EDCE CC[C@H]1C(=O)NCCN1c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1772837154 UUNLLPXDQHJAGH-HWPRWLFBSA-N 333.344 1.496 10 10 EDCE COc1ccc(-n2nnnc2CNCCCN(C)C(=O)C(C)C)cc1 1699493037 ZXVLKNPCZCNJEY-UHFFFAOYSA-N 346.435 1.265 10 10 EDCE O=C(Cn1cnc([N+](=O)[O-])n1)NCc1c(O)ccc2c1CCCC2 156363433 WRNRYMYVDJVOQH-UHFFFAOYSA-N 331.332 1.087 10 10 EDCE O=C1/C(=C\c2cccc(O)c2)SC(=S)N1CCOCCO 1858589268 MBBQVYALKPIXBU-FMIVXFBMSA-N 325.411 1.602 10 10 EDCE Cc1ccc(C[C@H](NC(=O)c2cc(O)c(O)c(O)c2)C(=O)O)cc1 1865876096 RGQDNZUVJFDSRY-LBPRGKRZSA-N 331.324 1.538 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1 1900613548 ZXHHFEVMGZYOME-CQSZACIVSA-N 327.385 1.517 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H](O)C(F)(F)C3)c(Br)cc21 2152098634 PTSGYRKPYWDWPL-ZJUUUORDSA-N 348.147 1.217 10 10 EDCE COC[C@](C)(CC(=O)C(=O)C[C@H]1C[C@H](N)C1)NC(=O)OC(C)(C)C 2003167287 BHBOSWCWJUJMPJ-PRXAMGSTSA-N 342.436 1.572 10 10 EDCE CC(C)(C)OC(=O)N1CC(ONC(=O)COc2ccc(N)cc2)C1 2009380032 XTFUCKKKCPHJIS-UHFFFAOYSA-N 337.376 1.315 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010392131 XMSYJXZRUNUNID-NWDGAFQWSA-N 339.396 1.781 10 10 EDCE C[C@H](C(=O)NCc1c(O)cc(O)cc1O)N1CCc2ccccc21 2064430820 FEICJMDMZSRVPI-LLVKDONJSA-N 328.368 1.871 10 10 EDCE CCNC(=O)c1cn(Cc2c(O)cccc2Br)nc1O 2070638726 SRMUGVDRJDFSQH-UHFFFAOYSA-N 340.177 1.855 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2199533677 XIFMLNQOXXTTIK-FUJOKSKWSA-N 342.233 1.823 10 10 EDCE CC(C)(C)OC(=O)NCC1(NC(=O)CCc2ccc(N)cc2)COC1 2044211182 CKVIGBQVNSVFCT-UHFFFAOYSA-N 349.431 1.611 10 10 EDCE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(C(=O)c2cccc(O)c2O)C1 2054419362 CKPUCZLILVOSIO-DTWKUNHWSA-N 346.305 1.627 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1CO[C@H]2COC[C@@H]12 2101846074 GBUCDRFJQAOOCW-PUYPPJJSSA-N 328.206 1.906 10 10 EDCE O=S1(=O)C[C@@H]2CN(c3ccc(CO)c(Br)c3)C[C@@H]2C1 2087855646 FDHKDMCQJGQOCR-PHIMTYICSA-N 346.246 1.422 10 10 EDCE C[C@H](O)c1ccc(N2CCOC[C@H](CO)C2)cc1Br 2098241622 COPMVAKKSMYFAX-QWRGUYRKSA-N 330.222 1.948 10 10 EDCE CC1(C)CN(c2ccc(CO)cc2Br)CCS1(=O)=O 2113954626 JPERXYYXIQWVJK-UHFFFAOYSA-N 348.262 1.955 10 10 EDCE COC(=O)c1cccc(CS(=O)(=O)NCCc2ccc(N)cc2)c1 171531763 ROJKDTIFVMHOHD-UHFFFAOYSA-N 348.424 1.718 10 10 EDCE CCc1nc2n(n1)C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)CC2 181087136 FMDYQSVDIQCACQ-GXWOQWCDSA-N 328.372 1.396 10 10 EDCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1c[nH]nn1 122596074 NDLJBDWEAYBQQY-UHFFFAOYSA-N 340.431 1.267 10 10 EDCE Cc1ccc(-n2c(C)cc(/C=C\C(=O)NOCC(N)=O)c2C)cc1 222184691 XRMAVXDLDOQBDF-TWGQIWQCSA-N 327.384 1.949 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)cc1 325835572 BAMSNJAAPKHATC-JTDSTZFVSA-N 331.460 1.901 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCN3CCCC[C@H]3C2)cc1 246202950 NVJPZWYFDYLVSN-SFHVURJKSA-N 330.476 1.539 10 10 EDCE Nc1nccc([C@H]2CCCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)n1 376143456 UFSHZBOWDZYINJ-BPJJOFIESA-N 340.383 1.889 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCN(CC(F)(F)F)C(=O)C2)c1O 285613691 XNNCQDBFIHNEAL-UHFFFAOYSA-N 348.296 1.940 10 10 EDCE COc1nc(C)c(Br)cc1C(=O)OCC(=O)C(C)=O 808539212 WLCRJJLYFBTLKO-UHFFFAOYSA-N 330.134 1.476 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC([C@@H](F)CO)C3)c(Br)cc21 2166899668 MNJAWNLUWJUAKA-JOYOIKCWSA-N 344.184 1.168 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@@H](CO)c2cccnc2)cc1F 806634506 LJURNNIWFWNPDS-HNNXBMFYSA-N 346.406 1.862 10 10 EDCE CS(=O)(=O)N1CC[C@H](CNCc2cc(Cl)c(F)cc2O)C1 293573814 JDTVRWSQKCJMBM-SECBINFHSA-N 336.816 1.556 10 10 EDCE CNC(=O)[C@H]1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 817161121 GZSBYGYILSXPGS-HNNXBMFYSA-N 328.416 1.340 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N3CN(C)C(=O)[C@@H]3C)C2)cc1 826993636 SSWOMJGDQSMKIA-KBPBESRZSA-N 346.431 1.351 10 10 EDCE COc1cccc(CNC(=O)C(=O)Nc2ccc(N(C)C)nc2)c1O 737285525 FOIZPRCLQQIOIU-UHFFFAOYSA-N 344.371 1.117 10 10 EDCE NCc1ccc2c(c1)CCCN2Cc1cnnn1[C@@H]1CCCNC1 903872705 AGRORXAUUZHSEA-MRXNPFEDSA-N 326.448 1.614 10 10 EDCE CCC/C=C/[C@H](O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 900268461 CLWHXGSPFKUSHG-BDUNBXCCSA-N 336.407 1.996 10 10 EDCE COc1ccc(CNC(=O)[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)O)c(O)c1 911716612 BZSVWURGYWFLSI-KUDNYVPYSA-N 331.368 1.930 10 10 EDCE O=S(=O)(C[C@@]12CCCN(CC1)C2)NCc1cc(Cl)ccc1O 916704772 QDWMSZMPJOYBKR-HNNXBMFYSA-N 344.864 1.951 10 10 EDCE Cn1[nH]c([C@@H]2CCCN2C(=O)/C=C\c2ccc(O)c(O)c2)nc1=N 846067887 LKHDNCIMDFXHGK-XOIDGJRKSA-N 329.360 1.016 10 10 EDCE C[C@@H](NC(=O)[C@@H]1CC[C@@H]1C(=O)O)c1ccc(N2CCOCC2)cc1 911290909 FYZMDMZEIDUEJS-WQVCFCJDSA-N 332.400 1.811 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CNC(=O)CCC(C)C)C2)cc1 855230065 MNUDWATWYBRBTG-HNNXBMFYSA-N 347.459 1.943 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3c(O)nnc(C)c3C)C2)cc1 855231831 MMNRLGKDNLBJHR-ZDUSSCGKSA-N 342.399 1.816 10 10 EDCE CN1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)CCC1=O 853411513 IUHMIJMEWDKHIE-UHFFFAOYSA-N 330.432 1.661 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N3CCC(C)CC3)C2)cc1 855227878 QUCQFFWHRFSMAN-OAHLLOKOSA-N 345.443 1.649 10 10 EDCE CC[C@@]1(C(=O)NCc2cc(Br)ccc2O)CCNC1=O 868307351 YZUHGCYYQGMPTI-CQSZACIVSA-N 341.205 1.687 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@H]2CS(=O)(=O)NC)c1 769531458 ATOBNUKOFIYSPK-ZDUSSCGKSA-N 328.434 1.305 10 10 EDCE COC(=O)c1cnc(SCC(=O)NC2CCN(C)CC2)s1 865369225 NOHIINHOHOOCDE-UHFFFAOYSA-N 329.447 1.232 10 10 EDCE Cc1nn(CC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)c(=O)o1 880302177 CSBPEKBJQKYNPA-GFCCVEGCSA-N 332.404 1.267 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@@H](O)CC(F)(F)C2)c([N+](=O)[O-])c1 786829113 YESVPVPZZUSECF-TZNOJPMFSA-N 342.298 1.987 10 10 EDCE CCNC(=O)CN(C)Cc1c(C(=O)OC)n(C)c2ccc(F)cc12 893966637 RPHBBRMHYCGHJL-UHFFFAOYSA-N 335.379 1.672 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CC[C@@H](c2cc(O)nc(O)n2)C1 1144510249 GCZGROJJKUCTBI-JRBALWBOSA-N 343.339 1.328 10 10 EDCE COC[C@H](CNCc1c(Br)ccc(OC)c1O)OC 1964076031 DQSXVCHPPWVRJE-VIFPVBQESA-N 334.210 1.914 10 10 EDCE COC(=O)[C@@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@H]2C[C@H]21 1178585903 LDVBWTLDDNHXDX-XQHKEYJVSA-N 330.344 1.776 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC([C@H](C)O)C3)c(Br)cc21 719762759 DORTUMYONSJOEI-CPFSXVBKSA-N 340.221 1.479 10 10 EDCE C[C@@H](NCc1ccc(Br)cc1O)C(=O)N1CCOCC1 691466918 ZHNDRKMNPJLRSL-SNVBAGLBSA-N 343.221 1.492 10 10 EDCE COC(=O)COc1ccc(N(C)C(=O)/C=C\c2cn(C)cn2)cc1 1268948876 RPIDMMCWWPNGRK-WTKPLQERSA-N 329.356 1.648 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@H]3C[C@H]3C)C2)cc1 1347444178 GJRINGLFPDWUIZ-RDBSUJKOSA-N 331.416 1.162 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@@H]2CCN(C)C2)cc1C 1275406681 PJYYKRKGIPDGOG-RDJZCZTQSA-N 333.476 1.940 10 10 EDCE CN(C)CCOc1cc(CNC(=O)Cc2ccc(O)c(O)c2)ccn1 1447111824 PSROGXDTWOYGRW-UHFFFAOYSA-N 345.399 1.292 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(O)cn1 1544675866 CAUBBGXYYLSLAL-UHFFFAOYSA-N 331.347 1.693 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)CN2CCCC2)cc1C 1715270486 JFTNXJLVPROJSA-HNNXBMFYSA-N 333.476 1.941 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H](O)CNC/C=C\Cl)cc1 1715610394 DYGDRTDBSZVLMR-YSZAJKDKSA-N 339.783 1.282 10 10 EDCE NC(=O)COc1ccccc1C(=O)NCc1cc(Cl)ccc1O 1632224228 XIYCPENNERYGOY-UHFFFAOYSA-N 334.759 1.840 10 10 EDCE O=C(NCc1c(O)cccc1O)C1CCN([C@@H]2CCSC2)CC1 1639292766 PVOCQEOKHMZGPY-CYBMUJFWSA-N 336.457 1.932 10 10 EDCE Cc1[nH]nc(Br)c1C(=O)NCc1cccc(O)c1O 1643812867 RSMGNZMKBHHONI-UHFFFAOYSA-N 326.150 1.822 10 10 EDCE C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1650634946 FHNRWTXBDBCQNI-AWEZNQCLSA-N 346.305 1.310 10 10 EDCE NC(=O)c1cnn2c(C(=O)NCc3cccc(Cl)c3O)ccnc12 1653567347 VRKWUAVBSPFBIY-UHFFFAOYSA-N 345.746 1.117 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC[C@H](C)C3)CC2)c(OC)c1 1586630412 KFYDOZLBFBEQFE-HNNXBMFYSA-N 347.459 1.694 10 10 EDCE C[C@@H](NC(=O)NCc1nc([C@@H]2CCCO2)n[nH]1)c1ccccc1O 1686896837 KEFDWHDYMPNNMD-MFKMUULPSA-N 331.376 1.922 10 10 EDCE CC(=O)Nc1ccc(OC(=O)CCN2C(=O)CSC2=S)cc1 1865774479 KVAKCSUZHDMLAX-UHFFFAOYSA-N 338.410 1.801 10 10 EDCE Nc1ccc(-n2nnc(C(=O)N3CCN(c4ccccc4)CC3)n2)cc1 1857878897 NHTBKKNNBYIPGU-UHFFFAOYSA-N 349.398 1.207 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCC[C@@H](O)C3)c(Br)cc21 221242771 FCMQBIWDWGKJOC-KRTXAFLBSA-N 326.194 1.362 10 10 EDCE CC1(C)C(=O)NC(=O)CN1c1ccc(CN)c(Br)c1 228153842 REDYEASDYLXQHI-UHFFFAOYSA-N 326.194 1.149 10 10 EDCE CC(C)(C)OC(=O)N1CC=C[C@@H]1C(=O)NCCc1ccc(O)c(O)c1 1968739997 ZPJSMWSPDOMKRF-CYBMUJFWSA-N 348.399 1.932 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NCc1ccc(O)c(O)c1O 1944916646 BFBYDCGIPQZFPT-MNOVXSKESA-N 340.376 1.185 10 10 EDCE C[C@H](N)[C@H](O)C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952403824 VCNIDRIFXDWFRU-ZKYQVNSYSA-N 340.420 1.632 10 10 EDCE CCCN(CCCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2149422631 JPTRGLNMRUHIKR-ZDUSSCGKSA-N 342.237 2.000 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 2010390592 FXMUJVGBILMJQW-NSHDSACASA-N 339.396 1.660 10 10 EDCE CN(C)C[C@@H]1COCCN1c1ccc(CN)c(Br)c1F 2153249438 QXEGYARKYHZSME-LLVKDONJSA-N 346.244 1.814 10 10 EDCE NC(=O)N1CCC(NCc2c(O)cccc2Br)CC1 706804328 HZWCPKPDMXDHRN-UHFFFAOYSA-N 328.210 1.787 10 10 EDCE O=C(NCc1c(O)cc(O)cc1O)[C@@H]1CCCN(CC(F)(F)F)C1 2064881449 DQEMONKBYAOASP-SECBINFHSA-N 348.321 1.694 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CO1 1908253706 YYFDKPHZVYZZTD-UTUOFQBUSA-N 339.396 1.922 10 10 EDCE C[C@H](NC(=O)Cc1ccc(N)cc1)C1(O)CN(C(=O)OC(C)(C)C)C1 2044227080 RSPIHACXMBGZNX-LBPRGKRZSA-N 349.431 1.298 10 10 EDCE CNC(=O)[C@@H]1[C@@H](C)CCN1c1ccc(CO)c(Br)c1 2090261517 ICJBCGBGEMGBJM-ZANVPECISA-N 327.222 1.902 10 10 EDCE COc1ccc(Br)c(CNCCc2cnn[nH]2)c1O 2227728467 NSQIWOXKYNPCPJ-UHFFFAOYSA-N 327.182 1.614 10 10 EDCE OCc1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2332590010 GCMYFCKATAJJFG-AIUZOBBOSA-N 328.206 1.262 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCO1 54787271 CULXOGZGCKHTSX-PBHICJAKSA-N 333.432 1.890 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCCN(C3CC3)CC2)cc1 172347219 UIFIOOFTDDHHPX-UHFFFAOYSA-N 330.476 1.539 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC[C@@H](n3cncn3)C2)cc1 173305009 WZUUYZBQZRZTEM-MRXNPFEDSA-N 328.420 1.891 10 10 EDCE CCCNCc1ccc(N2CC([C@@H](O)CO)C2)c(Br)c1 2361909426 WHANZOHBAZFAIM-HNNXBMFYSA-N 343.265 1.738 10 10 EDCE O=C(/C=C/c1ccncn1)NCc1ccc(N2CCOCC2)c(F)c1 182944805 SLNGOEKTKBQNMY-DUXPYHPUSA-N 342.374 1.782 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@H](NC(N)=O)C2)c([N+](=O)[O-])c1 270741078 UYABMPKGHMNNCW-TZNOJPMFSA-N 334.332 1.028 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2CNC(=O)C2)c(O)c1Br 2380773508 KSFOPJBEOOVAJX-JTQLQIEISA-N 341.205 1.558 10 10 EDCE Cc1ccc(CNC(=O)[C@]2(N)CCCOC2)c(O)c1Br 2381129414 JYRNHNPRDNLMFP-AWEZNQCLSA-N 343.221 1.587 10 10 EDCE NS(=O)(=O)C1(CNCc2ccc(Br)cc2O)CCC1 721557802 HQEABKIJOPJQHI-UHFFFAOYSA-N 349.250 1.456 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3C[C@H]3c3cnc[nH]3)C2)cc1 824373210 OOZZHXNMJDNJRF-DAXOMENPSA-N 326.400 1.917 10 10 EDCE CCN1CN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC1=O 841588836 GKUPWBMTUSCPFF-AWEZNQCLSA-N 332.448 1.823 10 10 EDCE CCN(CCC(N)=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 923189554 XUIDBOSMXIOCKF-CYBMUJFWSA-N 334.420 1.181 10 10 EDCE CNS(=O)(=O)NC1CCN(Cc2c(O)cc(C)cc2Cl)CC1 840940653 ARLACFMWKONVLV-UHFFFAOYSA-N 347.868 1.372 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3noc(C)n3)C2)cc1 852143787 HRJPOIBVFAXOQI-LBPRGKRZSA-N 331.376 1.465 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCC1=O 924008584 UDHOSLSQCFKFIN-OAHLLOKOSA-N 344.459 1.559 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)N[C@H]1CCc2nnn(C)c2C1 927851983 GFMDDINVHRZTNT-AWEZNQCLSA-N 343.431 2.000 10 10 EDCE CNCCCC(=O)N1CCC(NCc2cc3c(cc2O)OCO3)CC1 853247552 TYUPCKIFLWMVFX-UHFFFAOYSA-N 349.431 1.201 10 10 EDCE C/C=C\CNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 863120870 UQDYLVJGHTVWOA-PWGWRZEZSA-N 343.427 1.592 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2cc(Cl)c(C)cc2O)CCO1 862460528 FITLWDVNDMEEPF-GFCCVEGCSA-N 327.812 1.484 10 10 EDCE CCn1nc(C)cc1NC(=O)C(=O)N[C@H](C)c1cc(OC)ccc1O 861739921 WFXGZRVMJGZERL-LLVKDONJSA-N 346.387 1.742 10 10 EDCE Oc1cc2c(cc1CNC[C@]1(O)[C@H]3[C@H]4C[C@@H]5[C@@H]6[C@H]4[C@H]1[C@@H]6C[C@H]53)OCO2 785546230 ROKNDWMNCXDXFW-SOALCXOCSA-N 341.407 1.719 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)NCCC2CS(=O)(=O)C2)c1 786946344 RVNWJHKGAVSJTI-JTQLQIEISA-N 327.402 1.264 10 10 EDCE COC(=O)c1c(CN2CC(=O)N[C@@H](C)C2)c2cc(F)ccc2n1C 894902554 KUNZHGQUFRWUHG-JTQLQIEISA-N 333.363 1.424 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)NCCCCN=[N+]=[N-] 1895876098 QXVFQFRBGLLSFK-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE COC(=O)[C@H]1CN(C(=O)c2cccc(O)c2O)c2ccc(F)cc2O1 1144519046 ANRJNQMTCLNGNS-CQSZACIVSA-N 347.298 1.818 10 10 EDCE CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1328396151 UVPWOEPJYPWHTO-JCNLHEQBSA-N 343.427 1.363 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)C[C@H](C)CO)c(Br)cc21 688402542 AJWSLZCZUIESIN-ISVAXAHUSA-N 342.237 1.726 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)C(=O)C(F)F 1334352291 CCCVBNYKKHNUMJ-MRVPVSSYSA-N 341.318 1.691 10 10 EDCE CO[C@H]1C[C@@H](C(=O)O)N(Cc2cc(Br)cc(F)c2O)C1 1964721554 WKFGGBFBFXJPAM-ONGXEEELSA-N 348.168 1.968 10 10 EDCE C[C@@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1345504648 BECGIYYCPWCZJN-RISCZKNCSA-N 337.395 1.049 10 10 EDCE CC(=O)N[C@](C)(CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1356944717 HXGDCNDQLSOHPJ-MRXNPFEDSA-N 331.376 1.884 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)[C@@H]1CC12CC2 1285703543 ZPIOTRDUVQJTES-MFKMUULPSA-N 343.387 1.884 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H](CO)Cc2ccncc2)cc1 1447932507 FYOOUQPMSDLIOK-CQSZACIVSA-N 327.344 1.577 10 10 EDCE NC(=O)C[C@H]1COCCN1C(=O)c1cc2cc(O)c(O)cc2s1 1299467479 XGIPINBEKYKBQX-VIFPVBQESA-N 336.369 1.029 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCn1cc(-c2ccccc2)nn1 1457359666 LCRSAGOQPZLFEO-UHFFFAOYSA-N 338.367 1.715 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@H](c2nnc3n2CCC3)C1 1616496951 ZYTLAYPHVWFTBP-ZDUSSCGKSA-N 342.399 1.584 10 10 EDCE CCS(=O)(=O)C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1617246250 UMOSNMCYBJLUGK-SECBINFHSA-N 326.378 1.402 10 10 EDCE CN(C)C(=O)Cn1ccc(NC(=O)c2ccc(N=NC(N)=O)cc2)n1 1542667744 LNIQRCBLIQDLOD-UHFFFAOYSA-N 343.347 1.386 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2cc(C)sn2)cc1C 1485990681 KNXFWZMTUDJMLK-AWEZNQCLSA-N 349.456 1.649 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCc2cc(Cl)ccc2O)cn1 1644596331 IQKQUKJMOPOOMC-UHFFFAOYSA-N 340.788 1.774 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2cc[n+]([O-])cc2)cc1C 1666848894 BASGETWJOBWCPW-OAHLLOKOSA-N 343.427 1.887 10 10 EDCE CCOC(=O)C[C@H](C)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 160054525 CKWLQCCHTUBQDG-PPYMECGQSA-N 346.427 1.994 10 10 EDCE C[C@@]1(CO)COCCN(c2ccc(CO)cc2Br)C1 2135077875 NVARNZCKBPFJLI-CQSZACIVSA-N 330.222 1.777 10 10 EDCE CNCc1ccc(N2C[C@@H](O)C[C@@H]2CN(C)C)cc1Br 234379049 PUXMIFXKEXGRQA-KGLIPLIRSA-N 342.281 1.670 10 10 EDCE CN1C(=O)CN(C(=O)OC(C)(C)C)C[C@@H]1COc1ccc(N)cc1 1952843232 QBHDPNSNHLFPAV-CYBMUJFWSA-N 335.404 1.725 10 10 EDCE C[C@@]12C[C@@H](CO1)N(c1cc3c(cc1Br)[C@H](N)C(=O)N3)C2 2144648881 PXRJEGMYDXQJIC-FMCKTDMXSA-N 338.205 1.769 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985100888 KHJLCDQGMSFGIV-LLVKDONJSA-N 327.385 1.827 10 10 EDCE C[C@H](O)c1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)cc1Br 2146314275 QYWHJJIBZJZETI-LKTVYLICSA-N 342.233 1.684 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010406056 PLLKYVTUSHSSDL-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)c1cc(O)c(O)c(O)c1 2015118386 AESGKUAEDZQNHB-SECBINFHSA-N 340.376 1.694 10 10 EDCE O=c1c2c(ccn1Cc1ncc(Br)s1)CCNC2 2033377605 BQVGYLBDTHAQMR-UHFFFAOYSA-N 326.219 1.761 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)c(Br)c1 2178085178 CXGPSLOCZFIQAO-FQMFCJFBSA-N 341.249 1.912 10 10 EDCE NC[C@H]1CCN(C(=O)c2c[nH]nc2[C@@H]2CCNC2)c2ccccc21 2062576515 LACZWVJLCTUNCM-CHWSQXEVSA-N 325.416 1.579 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2NC(=O)c1cccc(O)c1O 862065982 QJRSXFPBTHDDHH-SUZMYJTESA-N 334.372 1.835 10 10 EDCE NCc1cc(F)c(N2C[C@@H](CO)OCC23CC3)cc1Br 2183972307 QYJPOCSLAJRGEC-JTQLQIEISA-N 345.212 1.777 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1CNC(=O)Cc1ccc(N)cc1 2044213090 QSPVNHWAUKQTKQ-HNNXBMFYSA-N 349.431 1.563 10 10 EDCE CCCNCc1ccc(N2CC[C@H](O)[C@@H](O)C2)cc1Br 2188625798 AORBTHZEZLSANL-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE O=C1CN(c2ccc(CO)c(Br)c2)C[C@@H]2CCCN12 2102000820 QSNZJNRODKIOQO-LBPRGKRZSA-N 325.206 1.752 10 10 EDCE C[C@H](O)c1ccc(N2CC(=O)N[C@@H]3CC[C@H]32)cc1Br 2112060450 FFBULDRWFRCFFD-ZEGGKSINSA-N 325.206 1.970 10 10 EDCE Oc1ccc(Br)cc1CNCC1CN(C2COC2)C1 2114708009 JMCJJEZDHKZRBA-UHFFFAOYSA-N 327.222 1.575 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)Nc1ccc(O)c(N)c1 2227870282 RYZNQSHFDAJCNC-UHFFFAOYSA-N 347.194 1.271 10 10 EDCE Nc1ccc(CC(=O)N2CCC(NC(=O)C(F)(F)F)CC2)cc1 2249484176 KWDAIAJVYJYWNU-UHFFFAOYSA-N 329.322 1.481 10 10 EDCE CN(c1ccc(CN)cc1Br)[C@@H]1COC2(COC2)C1 2270771240 RGTVPVXNABNWCY-NSHDSACASA-N 327.222 1.902 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)cc1Br 2331965944 YCGLKCYBBGONCR-VZZFWQQMSA-N 327.222 1.371 10 10 EDCE CCNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2354483405 CMBSDFZGKYEOTE-FBUXBERBSA-N 341.249 1.489 10 10 EDCE O=C(O)[C@]12CO[C@H](C1)[C@@H](NCc1c(O)cccc1Br)C2 2359172291 PQGXPQXTWQKCBI-SUHUHFCYSA-N 342.189 1.877 10 10 EDCE COc1ccc(N(C)CCn2nc3ccccn3c2=O)cc1OC 67984652 RMCSXBHSPCIDAX-UHFFFAOYSA-N 328.372 1.650 10 10 EDCE CC(=O)NC1CN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 190053470 MLASPOBKOCBWED-UHFFFAOYSA-N 344.459 1.953 10 10 EDCE CC(=O)N1CCC[C@@]2(CN(Cc3ccc(N(C)C)cc3)CCO2)C1 96268755 NUQVEAJHKOHRFX-LJQANCHMSA-N 331.460 1.966 10 10 EDCE Cc1nc(CNC(=O)NCc2ccc(N3CCOCC3)cc2)no1 266504055 GZYFKXMVXSVBPW-UHFFFAOYSA-N 331.376 1.214 10 10 EDCE COC(=O)CCCCC(=O)NCc1ccc(N2CCOCC2)cc1 275296388 NCYIZGJXMHCQIF-UHFFFAOYSA-N 334.416 1.873 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)c3ccnnc3)cc2)CC1 276151597 GMROTEFOBOVBAG-UHFFFAOYSA-N 339.399 1.075 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)C2 819792015 HWZGJLCZLYKSSM-HUYFEHBVSA-N 346.383 1.847 10 10 EDCE COC[C@](C)(O)CCNC(=O)NCc1ccc2c(c1)CCCN2C 836530478 COSAZZGWYLAJLL-GOSISDBHSA-N 335.448 1.656 10 10 EDCE CNC(=O)[C@]1(C(F)(F)F)CCN(C(=O)Nc2ccc(N)cc2)C1 843043359 PPZFBDIBDAYKPL-ZDUSSCGKSA-N 330.310 1.801 10 10 EDCE CCN(CC)C(=O)CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852011600 PJYZFAKTBDMIFA-CQSZACIVSA-N 348.447 1.442 10 10 EDCE CN(C)C(=O)N(C)[C@@H]1CCN(C(=O)NCCc2ccc(N)cc2)C1 851663164 UZHRGKYQNCOAJT-OAHLLOKOSA-N 333.436 1.209 10 10 EDCE COc1ccc(O)c(CNC(=O)NCc2nccc(OC)c2F)c1 853736459 BRFSYQGAWORUSP-UHFFFAOYSA-N 335.335 1.943 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(C(N)=O)CC3)C2)cc1 852455797 OEOCXKOBNWROKY-CQSZACIVSA-N 346.431 1.181 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@@H]1COCCN1CC(F)(F)F 928708531 NSQDFRHSIXVSKE-NSHDSACASA-N 336.285 1.411 10 10 EDCE CNC(=O)Cn1nc(NC(=O)N2Cc3cccc(O)c3C2)cc1C 930630922 KJOGRSLPUKLKPA-UHFFFAOYSA-N 329.360 1.191 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]3C(F)F)nc12 761116579 CZAMDJOEAFNVOD-NSHDSACASA-N 340.330 1.841 10 10 EDCE CCOc1ccc(CN2CCOC[C@H]2c2noc(COC)n2)c(O)c1 779615707 IFJYAYDIOHIXNA-AWEZNQCLSA-N 349.387 1.894 10 10 EDCE CC[C@@H](NC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(=O)O 780477499 AQRFXSPJRQESQR-SWLSCSKDSA-N 335.404 1.747 10 10 EDCE COc1c(NC(=O)NCCc2ccc(O)c(O)c2)cccc1C(N)=O 782710140 CHQYLGWYWMSXHJ-UHFFFAOYSA-N 345.355 1.570 10 10 EDCE COc1cccc(CNC[C@H]2CCCCN2S(C)(=O)=O)c1O 796514006 SRIWLSLFYHGTBT-CYBMUJFWSA-N 328.434 1.305 10 10 EDCE CCS(=O)(=O)c1ccccc1C(=O)NCc1ccc(O)cc1O 1142533648 OZTAGLJAPKILRW-UHFFFAOYSA-N 335.381 1.821 10 10 EDCE COCCN(CC(=O)N=c1cc[nH]cc1)c1ccc(OC)c(OC)c1 1307533833 RZURYSRLMJFXEY-UHFFFAOYSA-N 345.399 1.612 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H](C[C@@H]1COCCO1)C(F)(F)F 1304053987 ZAJZYERLSZPPOD-MWLCHTKSSA-N 349.305 1.698 10 10 EDCE CON(C)C(=O)CNC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1312887421 FVATXVRQRFAXPG-UHFFFAOYSA-N 334.420 1.448 10 10 EDCE Nc1ccc(N2C(=O)N[C@@]3(CCN(Cc4ccccc4)C3)C2=O)cc1 692368895 WYMMHOCXUFQWNN-LJQANCHMSA-N 336.395 1.970 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCNC(=O)[C@@H]2CCCO2)cc1 1349667183 KXPJUNYFVCCUHC-ZDUSSCGKSA-N 347.375 1.264 10 10 EDCE C[C@@H](NC(=O)CN1CCCC2(CC2)S1(=O)=O)c1ccccc1O 1350225791 XQGSDJBNIYFWBU-GFCCVEGCSA-N 338.429 1.528 10 10 EDCE CC[C@H](C)CN[C@H](CO)CNC(=O)c1ccc(N=NC(N)=O)cc1 1507266760 IADHTXCDTDLMEI-FZMZJTMJSA-N 335.408 1.575 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)cc1Br 2116694060 IXPJZKOPCGBOAU-OJICRYGUSA-N 327.222 1.228 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](OC)C(=O)OC(C)(C)C 1467840067 JEFIVTXKXZORRF-AWEZNQCLSA-N 344.404 1.851 10 10 EDCE Cn1nnc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 1534010455 SJQDCPPNYOYNGF-UHFFFAOYSA-N 333.307 1.238 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]12COC[C@H]1CN(C(=O)OC(C)(C)C)C2 1908254292 KQOLBOYRZSQWIN-IAQYHMDHSA-N 339.396 1.639 10 10 EDCE COCCNC(=O)c1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 1623866618 UCYULVUFQGAEJP-UHFFFAOYSA-N 344.367 1.655 10 10 EDCE O=C(CCS(=O)(=O)C1CCCC1)NCc1cc(O)ccc1O 1558174115 DVTAIQZBABZIDM-UHFFFAOYSA-N 327.402 1.462 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)C(C)(C)C(N)=O)C2CC2)cc1C 1723307866 NZZMQWWNXZLEMS-HNNXBMFYSA-N 347.459 1.500 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](OCC)[C@H]1CCOC1 1634944244 PRLABOOLUFUZNQ-BLLLJJGKSA-N 328.405 1.936 10 10 EDCE CC[C@@H]1CN([C@H](CC)C(=O)NCc2cccc(OC)c2O)CCO1 1630365606 AEXQDWMFDOELDC-HUUCEWRRSA-N 336.432 1.906 10 10 EDCE CCC(=O)NC[C@@H](NCc1nnnn1-c1ccc(OC)cc1)C(C)C 1732552064 RWFQYZVFFKGDPZ-OAHLLOKOSA-N 346.435 1.311 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 1640919975 HIURJEZMQLOJSB-UHFFFAOYSA-N 345.742 1.505 10 10 EDCE CN(C)C(=O)N[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1570264957 WWTYHQOEWXMGDO-CYBMUJFWSA-N 346.391 1.725 10 10 EDCE O=C1C[C@@H](N(C(=O)c2cc3cc(O)c(O)cc3s2)C2CC2)C(=O)N1 1598388414 UUEJHAQDTWLWKT-SECBINFHSA-N 346.364 1.332 10 10 EDCE CC[C@@H](NCCNS(=O)(=O)c1cccnc1)c1ccccc1O 156812675 CANXWEYQIPFTLH-OAHLLOKOSA-N 335.429 1.806 10 10 EDCE C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)n1cnnn1 1874179729 MQHLTWIGEHIILO-JTQLQIEISA-N 347.334 1.648 10 10 EDCE CC(=O)C(=O)[C@@]1(O)[C@H](CNC(=O)OC(C)(C)C)CCC12CCC2 1924872866 BIAVKVZBPTWODA-SJCJKPOMSA-N 325.405 1.981 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)C[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985102604 JIMNGCKXQKZALH-WDEREUQCSA-N 325.369 1.268 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010398562 WBAWYSUINSHBQC-SDDRHHMPSA-N 341.412 1.809 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CO[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]12 2010401715 HKIMBCBEELCCKM-TUAOUCFPSA-N 339.396 1.637 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](CO)(NCc2c(O)cccc2F)C1 2016033850 SGBRIGOSMIPYAN-QGZVFWFLSA-N 340.395 1.993 10 10 EDCE CNCc1ccc(N2CCC[C@@](O)(CO)C2)c(Br)c1 314255564 WHCAEIHSQJQFRK-AWEZNQCLSA-N 329.238 1.492 10 10 EDCE Oc1ccc(Br)cc1CN1CCO[C@@]2(CCNC2)C1 717473542 MHIPEXZNQFZVCP-CQSZACIVSA-N 327.222 1.719 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@H](O)c2c(Br)nnn2C)cc1 2163142732 DBZHPYVLTRKECZ-PWSUYJOCSA-N 340.225 1.377 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@H]3C[C@H]4O)c(Br)cc2[C@H]1O 2172055974 NRSHVVOTOGGDEG-NDHFTHCPSA-N 339.189 1.394 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H]3COC4(CCCC4)O3)c2n1 2062643591 FJNBMELSLKUDDD-LLVKDONJSA-N 332.360 1.159 10 10 EDCE COc1ccc(-n2nnnc2CNC(=O)CCc2ccccc2)cc1 16955097 PCBGWCSAGZRVLY-UHFFFAOYSA-N 337.383 1.920 10 10 EDCE CN(C)C(=O)[C@@H]1CCCN1c1ccc(CO)cc1Br 2087358214 YRBPIFPCUUWCOG-ZDUSSCGKSA-N 327.222 1.998 10 10 EDCE NCc1ccc(N2CC[C@H](OCCO)C2)c(F)c1Br 2109130740 OGCRIMCGZUYIOY-JTQLQIEISA-N 333.201 1.635 10 10 EDCE CC[C@H](N[C@@H](COC)C(N)=O)c1cc(Br)ccc1O 2096073602 RVBKAXPKJPPCRC-QWRGUYRKSA-N 331.210 1.696 10 10 EDCE CC(C)(C)OC(=O)NC1(c2ccc(Nc3nnc(=N)[nH]n3)cc2)CC1 2219015943 XJYQAJUCSXKDMB-UHFFFAOYSA-N 343.391 1.937 10 10 EDCE CSc1ncc(CNC[C@H]2CCCN(S(C)(=O)=O)C2)s1 2284636663 LGFROXKVXUTAMK-SNVBAGLBSA-N 335.520 1.626 10 10 EDCE CC[C@@H](C)N1C(=O)C(=CNc2cccc(C(=O)O)c2)C(=O)NC1=S 2296937138 WLIXYTUYCDWULI-SECBINFHSA-N 347.396 1.722 10 10 EDCE C[C@@](CN)(NC(=O)C=Cc1ccc(N2CCOCC2)cc1)C1CC1 2301731405 XKQVOSFDKPUJGT-IBGZPJMESA-N 329.444 1.780 10 10 EDCE CC(C)c1nnc2n1C[C@H](NC(=O)C=Cc1ccc(O)c(O)c1)CC2 2307996493 JYSWTJQZSUXRTK-CYBMUJFWSA-N 342.399 1.957 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2329329706 XNRMVXRKWXLDSE-QKNQZSKASA-N 328.206 1.433 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2330369475 IXPJZKOPCGBOAU-PWURMNTRSA-N 327.222 1.228 10 10 EDCE Nc1ccc(CCNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 171531533 MZRSUFCCNVWVCZ-UHFFFAOYSA-N 335.385 1.839 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1ccc2nc[nH]c2c1)c1ccc(N)cc1 170315337 TYEBXMBUTHZGTM-UHFFFAOYSA-N 337.339 1.663 10 10 EDCE COc1cccc(CNC(=O)c2cc(C)nc3c2cnn3C)c1O 175532924 XERWUXBXOCJZMJ-UHFFFAOYSA-N 326.356 1.921 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1F 247573324 LNBUQLYDVQCGQP-FRFSOERESA-N 349.406 1.986 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@H]3[C@@H](CCCN3C)C2)cc1 252653403 YTRGFEOQRNFBGF-PKOBYXMFSA-N 344.503 1.785 10 10 EDCE COCCN1CCCN(Cc2c(O)ccc(Cl)c2F)CC1=O 365334461 ADNDQYLPGAETNP-UHFFFAOYSA-N 330.787 1.865 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCN(C(=O)Nc2cccc(C)c2)C1 808507518 QGHSAFNNXGXVSX-AWEZNQCLSA-N 346.383 1.940 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H](C)[C@@H]3CCCCN3)CC2)cc1 817892591 BFZKJFYYKPOLTJ-PXNSSMCTSA-N 346.519 1.937 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C[C@H](C)O)C(C)C)CC2)cc1 730420239 UKJJTQJMVHMYAU-INIZCTEOSA-N 349.475 1.435 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC(C)(C)C)C2 838088488 XUAZECPITRZRLZ-FRRDWIJNSA-N 339.388 1.723 10 10 EDCE CCN(C[C@H](C)O)c1cc2c(cc1Br)[C@H](O)C(=O)N2 691520470 IZJKKHZGBHNIRK-MADCSZMMSA-N 329.194 1.642 10 10 EDCE Cc1cc(CC(=O)N2CC[C@@](O)(C(=O)O)C2)c(C)n1-c1ccccc1 910523942 YQMLYYOPHWZXDS-IBGZPJMESA-N 342.395 1.685 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)N[C@](C)(C4CC4)C3=O)C2)cc1 849357159 KRHWCESDCNNLER-KBXCAEBGSA-N 329.400 1.994 10 10 EDCE O=C1[C@H](NCc2ccc(N3CCOCC3)cc2)CCN1C1CCC1 858341018 VWLVWROOGBEHMN-GOSISDBHSA-N 329.444 1.766 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CO)[C@H](c2cc(O)c(O)c(O)c2)C1 687734653 ZCWIUOKVLPQJSJ-MNOVXSKESA-N 325.361 1.746 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H]3CCCNC3=O)C2)cc1 852379769 CEOCXHNXOJOFHQ-UONOGXRCSA-N 346.431 1.099 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])c[nH]3)C2)cc1 853817755 MFYXEYXSGKVONX-LLVKDONJSA-N 330.344 1.940 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCOC2(C)C)cc1 1118644876 FZUYFLVZNAGMIH-CQSZACIVSA-N 333.432 1.300 10 10 EDCE CCOC[C@H](C)NC(=O)C(=O)NCCCSc1nccs1 1117331339 RLGNAQITWQCMGF-JTQLQIEISA-N 331.463 1.283 10 10 EDCE CC[C@@H](NC(=O)NCc1ccc(N2CCSCC2)cc1)C(=O)O 780442620 ISDDFFSJICXCBI-CQSZACIVSA-N 337.445 1.902 10 10 EDCE O=C(O)CCN(CCO)Cc1cc(Br)cc(F)c1O 1963598324 RRIKIRFOHPVQBG-UHFFFAOYSA-N 336.157 1.563 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@H]4CCN(C)[C@H]4C3)C2)cc1 1312993398 AHTUNALFINROFS-RKVPGOIHSA-N 344.459 1.619 10 10 EDCE Cc1ccc(Cc2nn(Cc3ccc(N)cc3)c(=O)nc2O)c(N)c1 82720966 CZSABKCMMQGGHO-UHFFFAOYSA-N 337.383 1.456 10 10 EDCE C[C@H]1CO[C@@H](C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1332005347 UXXFAUUWLMDZIL-CXAGYDPISA-N 345.443 1.430 10 10 EDCE CN[C@@H](C)c1ccc(N2CCN(C)C[C@@H]2CO)cc1Br 699492113 PBVZLQNCUALYCB-WCQYABFASA-N 342.281 1.842 10 10 EDCE CCCN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C[C@@H](C)O 1266579630 WHBVMHWWMZMMQX-GFCCVEGCSA-N 335.408 1.672 10 10 EDCE c1cc(CN2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)on1 1197303311 DFIXWKDBUPUUGK-UHFFFAOYSA-N 342.443 1.829 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@H]2CCCN2C)cc1C 1278737283 KUKNWEICECIZAU-DLBZAZTESA-N 349.475 1.007 10 10 EDCE CS[C@@H](C)C(=O)NC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1297002651 DHMILYXBYMGDOK-VIFPVBQESA-N 349.416 1.541 10 10 EDCE CN1CC[C@H](C(=O)NCc2cccc(O)c2O)[C@@H](c2cnn(C)c2)C1 1520508483 CLWVVDXAJAVKMO-LSDHHAIUSA-N 344.415 1.183 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3OC(=O)N[C@@H]3C2)c(Br)c1 2120405835 NVYPCSUYCIWANM-XXFPWJFMSA-N 326.194 1.766 10 10 EDCE CNS(=O)(=O)c1cc(C(=O)N[C@@H](C)c2ccccc2O)c(C)o1 1635798852 DYVFXGHYQZEJOU-VIFPVBQESA-N 338.385 1.693 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccc(Cn2ccnn2)cc1 1631510678 WBBZJQHUJFPVTQ-UHFFFAOYSA-N 338.367 1.710 10 10 EDCE CN1CCN(c2ccc(CNC(=O)COc3ccsn3)cc2)CC1 1633252088 HDRANTWIRGFXNW-UHFFFAOYSA-N 346.456 1.590 10 10 EDCE COC[C@H](C)NC[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1567155453 PXTOXIMLFQXZIV-QWHCGFSZSA-N 347.419 1.936 10 10 EDCE CC[C@@H](CNC(=O)C[C@H]1CCC(=O)N1)NCc1ccc(OC)c(C)c1 1732215635 WBEQXULVRVHSJS-JKSUJKDBSA-N 347.459 1.657 10 10 EDCE C[C@H](O)[C@@H]1CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2125807647 ACZYVXBPUKNSJK-LTEOIEINSA-N 327.178 1.394 10 10 EDCE CN1C(=O)[C@@H](NC(=O)NCc2c(O)cccc2F)Cc2ccccc21 1683940814 OSDKNGVAUSVUJN-AWEZNQCLSA-N 343.358 1.918 10 10 EDCE CC[C@H](NCCS(=O)(=O)N1CCSCC1)c1ccccc1O 155743722 ROKHAAKWKKJFLI-AWEZNQCLSA-N 344.502 1.812 10 10 EDCE Cc1cc(NC(=O)c2nnn(-c3ccc(N)cc3)n2)ccc1[N+](=O)[O-] 1857878451 CHTVTPWOKNEMST-UHFFFAOYSA-N 339.315 1.713 10 10 EDCE COc1ccc(OC)c(NC(=O)c2nnn(-c3ccc(N)cc3)n2)c1 1857878581 INYFGXUQMNFKGY-UHFFFAOYSA-N 340.343 1.514 10 10 EDCE CCOC(=O)[C@@H]1CCCN(C(=O)CNCc2cc(C)ccc2O)C1 1857867789 BSNJYDFLAUWBKS-CQSZACIVSA-N 334.416 1.592 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985103987 CWEGMUIPQJBVIW-ZJUUUORDSA-N 327.385 1.467 10 10 EDCE CN(C)c1ccc([C@H](O)[C@@H](N)c2cc(Br)nn2C)cc1 2148508651 IBKAWYGLBUTSDK-KBPBESRZSA-N 339.237 1.982 10 10 EDCE NCc1ccc(N2CCC(NC(N)=O)CC2)c(F)c1Br 702143502 BAWWXXPGYPCPJW-UHFFFAOYSA-N 345.216 1.684 10 10 EDCE CN[C@@H](C)c1ccc(N2CC[C@](O)(C(N)=O)C2)cc1Br 380495103 NDMSEMFZWBISDS-LKFCYVNXSA-N 342.237 1.156 10 10 EDCE C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1908254064 GPMPAUFSVQGXTC-QJPTWQEYSA-N 339.396 1.922 10 10 EDCE CS(=O)(=O)[C@H]1CCN(c2ccc(CO)cc2Br)C1 2059356321 KPLABFWEKZSQHC-JTQLQIEISA-N 334.235 1.565 10 10 EDCE O=S1(=O)CC[C@@H]2CN(c3ccc(CO)c(Br)c3)C[C@@H]21 2088785089 UUUIGVKREZLWTB-RNCFNFMXSA-N 346.246 1.565 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)N1CC(N=[N+]=[N-])C1)[C@H]1CCOC1 2244947933 YQAODFXHHCVTKP-NSHDSACASA-N 325.369 1.534 10 10 EDCE Cc1ccc(CNCC(CO)(CO)NC(=O)OC(C)(C)C)c(O)c1 2249533062 YUNLLWVGDXTZHS-UHFFFAOYSA-N 340.420 1.038 10 10 EDCE C[C@H](CN1CCOCC1)NCc1cc(Br)c(O)cc1O 2282985058 WTWVUJFPZVIERS-SNVBAGLBSA-N 345.237 1.671 10 10 EDCE Cc1ccc(C=C2SC(=S)N([C@@H](CC(=O)O)C(=O)O)C2=O)o1 2293031475 FFMXTRJXIVZHPN-QMMMGPOBSA-N 341.366 1.717 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 2300531663 JXUIITXOIOPAKX-VXGBXAGGSA-N 341.412 1.763 10 10 EDCE COC[C@@]1(CO)C=CCN1c1ccc(CN)c(Br)c1 2351697951 XZWXKBZAMLCCSG-AWEZNQCLSA-N 327.222 1.662 10 10 EDCE CCOC(=O)CN(C)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 108788267 MWLXYGHZDHQAOF-RMKNXTFCSA-N 332.400 1.558 10 10 EDCE NC(=O)CCN(Cc1ccccc1)C(=O)CCOc1ccc(N)cc1 310281856 OSAPMZHTXSYOHD-UHFFFAOYSA-N 341.411 1.942 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@H]3CCN(C(C)=O)C3)CC2)cc1 176083331 CXHGNJORCPFOQJ-INIZCTEOSA-N 345.443 1.602 10 10 EDCE CCOC(=O)[C@@H]1C[C@H](N=[N+]=[N-])[C@H](O)C[C@H]1NC(=O)OC(C)(C)C 309772725 BKORQFRBLKLSCW-CHWFTXMASA-N 328.369 1.893 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@H](NC(=O)NCc2ccc(N(C)C)c(F)c2)CC1=O 78918000 KZZIIJXVXBEFOS-KFNAQCHYSA-N 348.422 1.700 10 10 EDCE Cc1ccc(N2C(=O)NC(=O)/C(=C\N3CCN(C)CC3)C2=O)cc1C 33308002 ZGGPRSMKPZSJLA-RVDMUPIBSA-N 342.399 1.018 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cn(C[C@H]3CCOC3)nn2)c1 528860828 MWNDRIFGNJUHDN-NWDGAFQWSA-N 346.387 1.520 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccnc2[nH]cnc12 272303780 XEQGVDPAAWPBPI-UHFFFAOYSA-N 337.383 1.725 10 10 EDCE COC(=O)[C@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1 298883163 LHGNBLCZRIRRKK-HNNXBMFYSA-N 331.416 1.991 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@H](C(=O)O)C1 817890442 UANHNIHVEOLQSO-AWEZNQCLSA-N 347.415 1.034 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCc2nncn2CC1 827764602 YYOKETVQUIHXLW-ZDUSSCGKSA-N 337.383 1.801 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2C[C@@H](C(N)=O)C2)cc1 845448580 GNROXBPPIPHQEK-BETUJISGSA-N 334.420 1.037 10 10 EDCE COC(=O)[C@@H]1CC[C@H](C(=O)NCCCSc2nccs2)O1 859351075 AEVGVBSBEPXKRJ-ZJUUUORDSA-N 330.431 1.462 10 10 EDCE COCCN(CCF)C(=O)NCc1ccc(N2CCOCC2)cc1 852004191 DWVXJIAQELONFN-UHFFFAOYSA-N 339.411 1.651 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CO)CCF)C2)cc1 852449650 VMFMLRXQJLGQEY-QWHCGFSZSA-N 325.384 1.294 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CCCN1C(C)=O 868966611 TVCQQWRZIIIRQW-OAHLLOKOSA-N 348.399 1.295 10 10 EDCE COc1cccc(O)c1CN1CCC[C@@H](C(=O)N2CCOCC2)C1 768235244 YUYPVCQMJQMQDB-CQSZACIVSA-N 334.416 1.472 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](C)[C@H](F)C3)nc12 778237457 PRRDZEDMPBIBLC-GXFFZTMASA-N 336.367 1.792 10 10 EDCE Cc1cc(Br)c(O)c(CN(C)CC(C)(CO)CO)c1 781907829 FWEVMZWAVCBRGD-UHFFFAOYSA-N 332.238 1.886 10 10 EDCE CCN(CC)c1ccc(CN[C@@H]2C(=O)NCC23CCOCC3)cc1 895772507 GEYPFZCBSOPOLY-QGZVFWFLSA-N 331.460 1.918 10 10 EDCE COC(=O)[C@@H](NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C1CC1 781588872 ARZCDIJPLLPVLT-WBVHZDCISA-N 345.443 1.430 10 10 EDCE O=C(CSc1nnnn1C1CCCC1)NCc1cc(O)ccc1O 1153879045 CCYKYBIVFNCECD-UHFFFAOYSA-N 349.416 1.608 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2CCSc3ncccc32)c1 173291206 LDGCUYIEQLFNOI-SNAWJCMRSA-N 340.408 1.988 10 10 EDCE Cc1nn(C)c(Br)c1[C@H](O)[C@@H](N)c1ccccc1O 1890613623 XIEWNDKXJAPZEY-RYUDHWBXSA-N 326.194 1.930 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CNc2ccccc2C1 1326875542 QFUBHXBQOMBOJV-HNNXBMFYSA-N 339.395 1.504 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2nc(C)c[nH]2)cc1C 1272272129 RCODUNFUHHPREU-UHFFFAOYSA-N 346.431 1.259 10 10 EDCE Cn1ccnc1C[C@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1445626503 KAJXYTUHEZFKAX-CQSZACIVSA-N 329.400 1.855 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCCNC(=O)c1ccccc1F 1545111541 VLDMCWMERHKOFJ-UHFFFAOYSA-N 346.358 1.716 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2nccnc2N)cc1C 1568985033 JJUFZBKGLZYAOK-GFCCVEGCSA-N 329.404 1.284 10 10 EDCE CC[C@@H]1C(=O)N(CC)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1567850903 DVXGVSCOGKOXAW-CYBMUJFWSA-N 331.376 1.932 10 10 EDCE CC(C)[C@H](C(=O)NCc1cc(O)ccc1O)N1C[C@@H](C)O[C@H](C)C1 1643881699 BPYKILJHRKAJHO-PBFPGSCMSA-N 336.432 1.848 10 10 EDCE CCOc1ccccc1C(=O)NCC(=O)NCc1c(O)cccc1F 1645046507 ZFPLZMPBYVHJMG-UHFFFAOYSA-N 346.358 1.976 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2ncn(C)n2)C(C)C)cc1C 1667454880 XQXWDGQUOJPMOT-OAHLLOKOSA-N 345.447 1.676 10 10 EDCE C[C@H]1CCN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C[C@H]1O 1684872791 CCUQFVPHIXDZLR-MAUKXSAKSA-N 346.475 1.351 10 10 EDCE COC(=O)NCC(=O)NC[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1691691313 XLSBWEFEVIBHPB-GASCZTMLSA-N 349.431 1.344 10 10 EDCE COc1ccc(CNC[C@](C)(NC(=O)CC(N)=O)C2CC2)cc1C 1698644397 FZFGAGYATKSJCI-SFHVURJKSA-N 333.432 1.254 10 10 EDCE CCOc1nonc1CC(=O)N1CCN(c2ccc(OC)cc2)CC1 1872638228 VWJFBCDKZBNRSO-UHFFFAOYSA-N 346.387 1.368 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1985099820 SJXKRNWMHDFEAX-MNOVXSKESA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2CCO[C@@]2(C(=O)NCCN=[N+]=[N-])C1 1985094266 MIWFCWTUHSZCHW-YGRLFVJLSA-N 325.369 1.439 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)NCCN=[N+]=[N-])CO[C@H]2C1 1985100106 DASXYSNLSXGBDM-MXWKQRLJSA-N 325.369 1.295 10 10 EDCE CN1CCCc2cc([C@H](N)[C@H](O)CNC(=O)OC(C)(C)C)ccc21 1999584953 ROTYUXKFCVYRNM-CVEARBPZSA-N 335.448 1.954 10 10 EDCE CO[C@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010399604 ZSUPCTZNCMLVPQ-ZIBATOQPSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)CCOC1 2010406706 XZHWIXBEYWVVIM-IAQYHMDHSA-N 339.396 1.972 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010406687 XUGGWDWSODQNEG-TUAOUCFPSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010404478 ASTLQIHDGAZASU-QWRGUYRKSA-N 341.412 1.809 10 10 EDCE OCc1ccc(N2CCN([C@@H]3CCOC3)CC2)cc1Br 2171301301 VDNXPUPNFYGZHS-CQSZACIVSA-N 341.249 1.852 10 10 EDCE CNC[C@H]1CN(c2ccc(OC)c(Br)c2OC)CCO1 2162625699 XPYHFPUBGBWZTI-JTQLQIEISA-N 345.237 1.891 10 10 EDCE CCNCc1ccc(N2CC(CC(N)=O)C2)cc1Br 382389321 RKKJLBFXLGVAQH-UHFFFAOYSA-N 326.238 1.870 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCC(C)(C)C3CCOCC3)c2n1 2063037611 NLUHTTZRSCSVPV-UHFFFAOYSA-N 332.404 1.926 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H](C3CCOCC3)C3CC3)c2n1 2063398673 XEIVSDCIILHVDV-OAHLLOKOSA-N 330.388 1.678 10 10 EDCE Cc1c(C(=O)NCc2cc(N)ccc2O)nn(C)c1Br 2168209079 UAXVVZUIPPHCOF-UHFFFAOYSA-N 339.193 1.709 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)c(Br)c1 2102192910 RDRXOLSOWGROBM-HUJUBCJISA-N 327.222 1.665 10 10 EDCE CN(CCCN=[N+]=[N-])S(=O)(=O)c1nn(C)cc1Br 2058157759 CGPWWORJMLABGE-UHFFFAOYSA-N 337.203 1.504 10 10 EDCE CNCc1ccc(N2CCOC[C@@H](CO)C2)cc1Br 2098216479 XCLVXDDBLPJJLR-LLVKDONJSA-N 329.238 1.614 10 10 EDCE C[C@@H](N)c1ccc(N(C)[C@H]2CC(=O)NC2=O)c(Br)c1 2114736655 CYGQIOJHANGKJS-HQJQHLMTSA-N 326.194 1.320 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCN=[N+]=[N-])C[C@H]2OCCC[C@@H]21 2250762359 LUTRSIFQOQKSCS-FIXISWKDSA-N 339.396 1.875 10 10 EDCE COc1cccc(C=C2SC(=S)N(CC(=O)O)C2=O)c1OC 2293031311 INTKVUIEDMELRL-UHFFFAOYSA-N 339.394 1.990 10 10 EDCE CCc1ccc(N2C(=O)NC(=O)C(=CNN3CCCCC3)C2=O)cc1 2296247625 PEEYUMNPSKTPIE-UHFFFAOYSA-N 342.399 1.706 10 10 EDCE Cc1ccc(CN(C)Cc2nnnn2C)c(O)c1Br 2352943021 NNLWRKLIHXVWEE-UHFFFAOYSA-N 326.198 1.619 10 10 EDCE Cc1cccc(N2C(=O)NC(=O)/C(=C/Nc3c(C)n[nH]c3C)C2=O)c1 59858226 JYFNUNKWEFRXNS-JYRVWZFOSA-N 339.355 1.914 10 10 EDCE CCCN(Cc1cc([N+](=O)[O-])ccc1O)[C@@H]1CCS(=O)(=O)C1 173205299 BMWMTTYUBCPQEN-CYBMUJFWSA-N 328.390 1.700 10 10 EDCE CNCc1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2357595937 ZKFWKZDXCATQAE-GBALPHGKSA-N 341.249 1.489 10 10 EDCE C[C@@H]1C[C@H](O)CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 401693422 HVOAUEGEWQISMM-UJVNDKKSSA-N 340.221 1.608 10 10 EDCE COc1ccc(N(C)CC(=O)N2CCC[C@H](C(N)=O)C2)cc1Cl 121856473 QOUURLFDPWXRQY-NSHDSACASA-N 339.823 1.509 10 10 EDCE CCN1C(=O)/C(=C2/SC(N3CCOCC3)=NC2=O)c2ccccc21 33316029 QMTRMWMRYMGITN-BUHFOSPRSA-N 343.408 1.726 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1ccc(C(N)=O)cc1 183437548 WVLQZUQXBBTDHW-BIPYJSMBSA-N 340.379 1.957 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1CCN(C(N)=O)CC1 42720827 AUWIIGGLBMUWFV-UHFFFAOYSA-N 332.448 1.892 10 10 EDCE CC(=O)O[C@H]1[C@@H](N=[N+]=[N-])C[C@@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@@H]1OC(C)=O 256171840 SQKWPVVWVBKSIG-YYNVLWEHSA-N 340.296 1.543 10 10 EDCE CCOc1ccc(O)c(CN2CCCC[C@@H]2CNS(C)(=O)=O)c1 271062544 HLZWTWRLVZSYBP-CQSZACIVSA-N 342.461 1.695 10 10 EDCE O=C1N[C@H](C(=O)NCc2cccc(Br)c2O)CS1 277420410 CWKQBIRWFWXSDW-QMMMGPOBSA-N 331.191 1.596 10 10 EDCE Cc1ccc(Cn2c(O)cc(=O)n(C)c2=O)c(O)c1Br 2381133123 KIODSEIMEABELK-UHFFFAOYSA-N 341.161 1.077 10 10 EDCE CCCS(=O)(=O)Nc1ccc(C(=O)OCC(=O)C(C)=O)cc1 808514212 WBXOMSPHBSZNLP-UHFFFAOYSA-N 327.358 1.153 10 10 EDCE C[C@@H](NC(=O)C(=O)N[C@H]1CCCN(C)C1)c1ccc(N(C)C)cc1 807678314 WFGRJAQVSHTPRE-HIFRSBDPSA-N 332.448 1.140 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1cc([N+](=O)[O-])nc1C 808093026 DVPOOOVYQTTZOS-UHFFFAOYSA-N 339.348 1.607 10 10 EDCE CC(=O)C(=O)COC(=O)C1CCN(C(=O)Nc2ccccc2)CC1 808495712 WWZXSLKPPQSHTC-UHFFFAOYSA-N 332.356 1.632 10 10 EDCE O[C@@H]1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1(F)F 826957790 HEHNNCBNLGZUFP-OAHLLOKOSA-N 330.350 1.864 10 10 EDCE COC(=O)c1conc1C(C)(C)NCc1cc2c(cc1O)OCO2 822534832 YGNSXCNELPLZOM-UHFFFAOYSA-N 334.328 1.920 10 10 EDCE CO[C@]1(CN[C@@H](C)c2ccc(C)c(C)c2O)CCS(=O)(=O)C1 903364778 BSLVCEIWHMDIDE-BBRMVZONSA-N 327.446 1.863 10 10 EDCE C[C@@H]1CN(CCO)CCN1C(=O)NCCCSc1nccs1 838513163 FSODZBDAAVMJNM-GFCCVEGCSA-N 344.506 1.333 10 10 EDCE C[C@H]1CN(CCO)CCN1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 838560046 SYMJUDCQGNXOLD-LSDHHAIUSA-N 334.464 1.522 10 10 EDCE CN1C[C@H](CCNC(=O)NCc2ccc(N(C)C)c(F)c2)CC1=O 915373309 YTJVVOYCWWYCHT-CYBMUJFWSA-N 336.411 1.559 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@@H]2[C@H](C1)C2(F)F 844911893 BGHXUOZKNALRRH-GASCZTMLSA-N 337.370 1.930 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NOC[C@H]3CCOC3)C2)cc1 852273763 HHRXOONGIAYZQY-UONOGXRCSA-N 335.404 1.541 10 10 EDCE COC(=O)C[C@H](C)CC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855226691 PWYVPXWZCKLCAZ-KGLIPLIRSA-N 334.416 1.979 10 10 EDCE CCN1CCO[C@@H](C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 855229862 CJAFHZXEQXOKKG-WMLDXEAASA-N 333.432 1.111 10 10 EDCE COC1(OC)CCN(Cc2cc(Cl)cc(C(C)=O)c2O)C[C@H]1O 931640657 ZQXLYJFFXVOQDF-CQSZACIVSA-N 343.807 1.804 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)cc1 939955434 TUFSSUJEHUIROA-UHFFFAOYSA-N 343.387 1.934 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1ccnn1C 868130791 RZAVPVFBDSJMSE-AWEZNQCLSA-N 343.431 1.817 10 10 EDCE C[C@H](NCCOCCCO)c1ccc(N2CCOCC2)c(F)c1 1117139835 UFMVKAJXDYENQK-AWEZNQCLSA-N 326.412 1.712 10 10 EDCE O=C(COC(=O)C(F)(F)C1CCOCC1)c1ccc(O)c(O)c1 784931295 MNWKANWOWSACLJ-UHFFFAOYSA-N 330.283 1.886 10 10 EDCE Cc1cc(Br)c(O)c(CNC[C@@](C)(O)CN(C)C)c1 781635334 GCSXJOLHWATCRR-CQSZACIVSA-N 331.254 1.865 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 1895875839 NVQMLTYYRUELOD-ONGXEEELSA-N 325.369 1.125 10 10 EDCE O=C(CN1C(=O)CCc2ccccc21)NCc1cccc(O)c1O 1153791462 CZSTWVOWJNBJOD-UHFFFAOYSA-N 326.352 1.693 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H](C3)O4)c(Br)cc2[C@H]1O 1899716683 VCJQQWPXJJGVPU-KEHGIVTQSA-N 325.162 1.412 10 10 EDCE C[C@H]1CCN1C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1338143980 FMNVDPAQNISPOK-LBPRGKRZSA-N 349.406 1.024 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2nccnc2N)cc1C 1268518722 KYKVASYJJXVIIQ-ONEGZZNKSA-N 341.415 1.452 10 10 EDCE C[C@H](NC(=O)N1CCS(=O)(=O)CCO1)c1ccc(N(C)C)cc1 1345858684 YOJSIIRGMIASBU-LBPRGKRZSA-N 341.433 1.185 10 10 EDCE COc1ccc(CNC[C@@H]2CCC[C@@H]2NC(=O)CC(N)=O)cc1C 1272253448 PFGIECYPLYNMRE-GJZGRUSLSA-N 333.432 1.254 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)Cc2ccccc2)cc1C 1507201487 KFGHHOPBMRJSII-SFHVURJKSA-N 342.439 1.813 10 10 EDCE CCN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)C(F)F 1296321574 WOOYHSKJPPHTPF-UHFFFAOYSA-N 341.318 1.692 10 10 EDCE COc1ccc(N2CCC(NC(=O)c3nsnc3O)CC2)cc1 1292594396 RJPOBHGBVNTVPF-UHFFFAOYSA-N 334.401 1.651 10 10 EDCE Cn1cc(C2=NO[C@H](C(=O)Nc3c(Cl)ccc4nonc34)C2)cn1 1525322178 JLPYJMQOJFFZJY-NSHDSACASA-N 346.734 1.741 10 10 EDCE O=C1CN(c2ccc(NC(=O)Cc3ccc(O)c(O)c3)cc2)CCN1 1543666536 CWUVEMPYVSIEOS-UHFFFAOYSA-N 341.367 1.215 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cncc(N2CCCC2=O)c1 1471642030 GMRZKUZOKZMCNX-UHFFFAOYSA-N 327.340 1.550 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CN2CCN1C[C@H]2C 1542169773 ASZGRXQYNNCVMX-APWZRJJASA-N 344.503 1.878 10 10 EDCE C[C@H](Sc1nnnn1C1CC1)C(=O)NCc1cc(O)ccc1O 1558174283 IYCFOCYVFCSEDP-QMMMGPOBSA-N 335.389 1.216 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3CCN(C)C3)CC2)cc1C 1499448537 MJFLRPZMYPJXLU-MRXNPFEDSA-N 331.460 1.694 10 10 EDCE CC[C@H](CNC(=O)[C@@H](C)C1CC1)NC(=O)c1cc(OC)nc(OC)c1 1721458731 SMLNFLGGEOAOBI-SMDDNHRTSA-N 349.431 1.770 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2[nH]nnc2C)cc1C 1725138046 XHRZJAQJZQEEDB-NWDGAFQWSA-N 331.420 1.727 10 10 EDCE CN(CCNC[C@@H]1CCOC1)C(=O)c1ccc(N=NC(N)=O)cc1 1567615211 MBUSICFECWVIBV-LBPRGKRZSA-N 333.392 1.547 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2ccn(C)n2)cc1C 1732455696 ZLOOZGWPMQPVSF-CQSZACIVSA-N 330.432 1.987 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NC(=O)c1cc2cc(O)c(O)cc2s1 1640111293 YOAYUQIRUSURJG-ISVAXAHUSA-N 337.353 1.373 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@H]2CN(C)CCO2)cc1C 1732834475 XHURGCYHSIMPMU-PYTPGESOSA-N 347.459 1.096 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@@H](O)C2(C)C)cc1Br 2124801903 QBQOTAOWKQTPEV-OXHMUOHRSA-N 329.238 1.789 10 10 EDCE C[C@@H]1CCN(C(=O)c2cccc(O)c2O)C[C@H]1NC(=O)C(F)(F)F 1965198115 FMBWELRMTQJDST-PSASIEDQSA-N 346.305 1.627 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(=O)N(C)[C@@H](C)C2)c([N+](=O)[O-])c1 1773055351 NJHRKQJCMZQBMS-XOIDGJRKSA-N 333.344 1.448 10 10 EDCE COCCC(=O)NC[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1688853231 RPZZOPFCARNXMF-NSHDSACASA-N 349.391 1.368 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NCc2c(O)cccc2F)C1 1985827619 NKYRPSGXSJPTRN-OCCSQVGLSA-N 326.368 1.601 10 10 EDCE NCc1ccc(N2CC34COCC3(COC4)C2)cc1Br 2150397377 GFEKVQYWUUAXMK-UHFFFAOYSA-N 339.233 1.761 10 10 EDCE NCc1ccc(N2CCCCC2(CO)CO)c(F)c1Br 2146122564 JJQDHPOZRNBELL-UHFFFAOYSA-N 347.228 1.761 10 10 EDCE CN1CCN(Cc2ccc(N)cc2)[C@@H](CNC(=O)C(F)(F)F)C1 1999479761 HABCPJPOTSHOOR-ZDUSSCGKSA-N 330.354 1.063 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2012344310 YDPPOQDXTCXTQH-RYUDHWBXSA-N 341.412 1.811 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccccc1O)C(C)(C)O 2014467909 AJACKQUFTQIJLG-ZDUSSCGKSA-N 338.404 1.673 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2014510388 XYDUSDRVMBPGTA-VXGBXAGGSA-N 341.412 1.811 10 10 EDCE COc1ccc(N2CCN[C@@H]3COC[C@@H]32)c(OC)c1Br 2189095065 QTINCJXIAOGFOR-KOLCDFICSA-N 343.221 1.643 10 10 EDCE Cc1nn(C)c(CNC(=O)c2ccc(O)c(O)c2)c1Br 2192442316 ZIRCAFVSJGPGDX-UHFFFAOYSA-N 340.177 1.832 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1cccc(O)c1 2067791456 MVYDBPWRPPMZHO-GJZGRUSLSA-N 348.399 1.939 10 10 EDCE CN(CC1(Br)CC1)S(=O)(=O)Cc1ccc(N)cc1 2076242287 BHVOKMQITHUZIA-UHFFFAOYSA-N 333.251 1.958 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2104412757 XNRMVXRKWXLDSE-NDUFBCRNSA-N 328.206 1.433 10 10 EDCE OCc1ccc(N2CC[C@@H](C(CO)CO)C2)c(Br)c1 2114243996 FAXOCEDESIARGO-LLVKDONJSA-N 330.222 1.369 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H]1c1ccc(Nc2nnc(=N)[nH]n2)cc1 2219017997 AVACPUYPLIOLJI-NWDGAFQWSA-N 343.391 1.803 10 10 EDCE C[C@H](NCc1nn(C)nc1Br)c1ccc(O)cc1O 2226968912 DGSQUTMSRYHGIN-ZETCQYMHSA-N 327.182 1.840 10 10 EDCE CCOC(=O)[C@H](O)CNCc1ccc(C)c(Br)c1O 2352950824 YRBAMNYYRJBIIN-SNVBAGLBSA-N 332.194 1.477 10 10 EDCE CN1CCN([C@@H]2CCCCN(C(=O)c3cccc(O)c3O)C2)CC1 187142312 KLZUTSWEFYCJEP-CQSZACIVSA-N 333.432 1.340 10 10 EDCE CCN(CC)c1ccc(CN2CCC[C@]3(C2)NC(=O)NC3=O)cc1 193468815 JMVWQFYYZWBOQM-GOSISDBHSA-N 330.432 1.707 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@H](C)C(=O)N(C)C)CC2)cc1 46970084 RSZGIFLDVWZUGE-CYBMUJFWSA-N 334.420 1.004 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCC(C(=O)N(C)C)CC2)c1O 278251285 PFVBAISJUCPALV-UHFFFAOYSA-N 337.376 1.609 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3CCCN3C(C)=O)C2)cc1 824017322 KLRFGAODVXQBIG-YJBOKZPZSA-N 345.443 1.649 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3CO[C@@H](C4CC4)C3)CC2)cc1 825155935 LZUYRSWNJBBDOT-YLJYHZDGSA-N 345.487 1.974 10 10 EDCE COC(=O)C(C)(C)n1ccc(NC(=O)NCc2ccccc2O)n1 825374572 CDNQVIFKMPRGNA-UHFFFAOYSA-N 332.360 1.819 10 10 EDCE C[C@@H]1CN(CCCNC(=O)/C=C\c2ccc(O)c(O)c2)C[C@@H](C)O1 588403413 MQRMIFIJTKWMJN-KMVAXQJASA-N 334.416 1.727 10 10 EDCE CCOCCS(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849415977 JCBMMIYEBZBOFW-CYBMUJFWSA-N 328.434 1.230 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC(C)(C)C3)CC2)cc1F 847556412 DASXWKAEZUZPRS-UHFFFAOYSA-N 335.423 1.825 10 10 EDCE O=S1(=O)C[C@H](CNCc2cc(F)ccc2O)Oc2ccccc21 843417302 AGJWGMQHRRJZOZ-ZDUSSCGKSA-N 337.372 1.856 10 10 EDCE CC1(C)CN(CCNC(=O)NCc2c(O)cccc2F)CCO1 915855044 ZOPOUNKEOFTRBE-UHFFFAOYSA-N 325.384 1.441 10 10 EDCE COC(=O)[C@@H](F)CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 925151058 JFFXBEJMVGQZFQ-JTQLQIEISA-N 344.726 1.321 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C[C@H](O)CC1(O)CCC1 859060251 PPPKMFQBXFJILL-GOSISDBHSA-N 334.460 1.621 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCCC[C@@H]3O)C2)cc1 854298882 JKGIZUUYMQCZGQ-JQFCIGGWSA-N 333.432 1.877 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCN(C4CC4)C3)C2)cc1 852186399 FFGAITZGGXQUHL-GJZGRUSLSA-N 344.459 1.810 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@@]3(C)CO)C2)cc1 854300040 TYMMFYBAGZVSNN-KDOFPFPSSA-N 333.432 1.830 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@H]2CN=C(c3cnn(C)c3)O2)c1 930213999 LWXXBBNMXKAMTA-RISCZKNCSA-N 330.388 1.631 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNCc1cc(F)ccc1O 1876122675 JKCBQDNDSKQDPF-MRXNPFEDSA-N 328.384 1.897 10 10 EDCE CCOc1cccc(CN2CCC(O)(COCCO)CC2)c1O 895826990 HAABDRSIUIXOGS-UHFFFAOYSA-N 325.405 1.127 10 10 EDCE COCCN(C(=O)NCc1ccc(N(C)C)c(F)c1)[C@H]1CCOC1 787126292 QVIGCHVURKXBFK-AWEZNQCLSA-N 339.411 1.839 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cncc4nc[nH]c34)CC2)cc1 895443523 FSKUCRWEGZKGHU-UHFFFAOYSA-N 337.383 1.929 10 10 EDCE COC[C@@H](CO)NC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 792797810 IGVZYRDEXAMTGO-QGZVFWFLSA-N 345.443 1.943 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1COCC[C@@H]1NC(=O)OC(C)(C)C 1895876855 YVABTXPKPHYHCX-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CNCc1ccc(N2CC[C@@H](NC(N)=O)C2)cc1Br 690802854 DWENQISBOZGLHG-SNVBAGLBSA-N 327.226 1.416 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1Cc1noc2c1COCC2 1333594911 BTNTZGBEZTYVFA-UHFFFAOYSA-N 343.339 1.417 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC3CC=CC3)C2)cc1 1334087167 UEQYMJRCEGLENQ-AWEZNQCLSA-N 329.400 1.225 10 10 EDCE CCN(CC)C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1261856934 UPUBBQHDBFLWKW-UHFFFAOYSA-N 345.443 1.567 10 10 EDCE COC(=O)CCNC(=O)CCN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 1351350575 DNDWVTWZMSALSY-QWHCGFSZSA-N 334.416 1.908 10 10 EDCE CN(C)CCn1ccc(NC(=O)c2ccc(N=NC(N)=O)cc2)n1 1292375755 RQCCMYMCNYXRTM-UHFFFAOYSA-N 329.364 1.859 10 10 EDCE CN1CC[C@H](C(=O)NCc2cccc(O)c2O)[C@H](c2cnn(C)c2)C1 1520508481 CLWVVDXAJAVKMO-GJZGRUSLSA-N 344.415 1.183 10 10 EDCE COC1CCN(c2ccc(CNC3(CO)CCOCC3)cc2)CC1 1459423866 GXRODTVZUOFIPZ-UHFFFAOYSA-N 334.460 1.933 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](C)[C@H](O)C3)C2)cc1 1470772773 MPXYVVUHQGWGLM-JKIFEVAISA-N 333.432 1.686 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)CNC(=O)C2CC2)cc1C 1700394771 WHCBGXQESDLWHP-UONOGXRCSA-N 347.459 1.513 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)CC2CCC2)cc(OC)n1 1487741390 PSICMQKCZGADKU-LBPRGKRZSA-N 349.431 1.866 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCc2nnc3n2CCCC3)cc1 1625879999 ZMAYIEAQIZDUSB-UHFFFAOYSA-N 327.348 1.707 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H](C)NC(N)=O)CCC2)cc1C 1484630911 MQXJNSSYXFZQSV-ZDUSSCGKSA-N 348.447 1.189 10 10 EDCE Cn1cnnc1[C@@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1556068671 NOFWNQDFXNPHOI-LBPRGKRZSA-N 327.348 1.955 10 10 EDCE CN1C(=O)CS/C1=C\C(=O)NCc1ccc2cccnc2c1O 1638573334 SGBLQRJQJYGXQT-AUWJEWJLSA-N 329.381 1.603 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(N)ncnc2c1 1638347798 MMQKSVJSAGLVPL-SNVBAGLBSA-N 338.367 1.984 10 10 EDCE CCN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)[C@H](C)OC 1496802711 QFCCOZNZQMJQPL-NSHDSACASA-N 349.391 1.462 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3nonc3C)CC2)cc1C 1723596815 DHXHTEFKLYANCA-UHFFFAOYSA-N 330.388 1.747 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@@H](CO)[C@H]3C)C2)cc1 1564962842 PHOQHGQBWSBESX-OAGGEKHMSA-N 347.459 1.934 10 10 EDCE COC(=O)COc1ccc(N(C)C(=O)c2cccc(O)c2O)cc1 1567492876 DZHDJEQFSVPXIJ-UHFFFAOYSA-N 331.324 1.926 10 10 EDCE COc1ccc(CNC[C@@H]2CC[C@@H](NC(=O)CNC(C)=O)C2)cc1C 1571527787 DZQOWQOPYIJLIV-IAGOWNOFSA-N 347.459 1.514 10 10 EDCE CCC[C@@H](OC)C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1758043862 CDJZYQOCJOXERC-CYBMUJFWSA-N 349.391 1.510 10 10 EDCE CC(=O)c1cc(F)cc(CN2CC[C@@H](CNS(C)(=O)=O)C2)c1O 1660059816 XLCRUFKVGUTYDZ-NSHDSACASA-N 344.408 1.105 10 10 EDCE COCC(=O)N[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1687954888 ZRMDXNUCBFMQAC-ZDUSSCGKSA-N 347.375 1.120 10 10 EDCE NC(=O)C[C@H](NCc1ccc(N2CCOCC2)cc1)C1CCOCC1 153956003 AMAQQGOOJNZKRZ-SFHVURJKSA-N 347.459 1.283 10 10 EDCE CCC(=O)NCc1ccc(C(=O)N[C@@H](CCSC)C(=O)O)cc1 33520263 LGIKPKMAWZXTGQ-ZDUSSCGKSA-N 338.429 1.649 10 10 EDCE N[C@H]1CC[C@H](C(=O)O)N(Cc2ccc(Br)cc2O)C1 2132274035 OTRZLYPXKHPLAB-WDEREUQCSA-N 329.194 1.531 10 10 EDCE COCCNCc1ccc(N2C[C@H](F)[C@H](O)C2)cc1Br 2149241885 LNDFLIIMMRXWTK-UONOGXRCSA-N 347.228 1.704 10 10 EDCE COc1ccc(Br)c(CN2CC[C@H](NC(N)=O)C2)c1O 1971995900 TZUMHOLHYYPSPD-QMMMGPOBSA-N 344.209 1.406 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCO[C@H]1C(=O)NCCCN=[N+]=[N-] 1985094038 JCBRVFQEKOMVOH-WDEREUQCSA-N 327.385 1.733 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@](C)(NC(=O)C(F)(F)F)C(F)(F)F 1985102700 KTLBVGOWMZKFFA-SSDOTTSWSA-N 335.208 1.755 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCc2ccc(N)cc2)[C@@H](CO)C1 1999482741 DAFZMPLFTZTRRS-MRXNPFEDSA-N 335.448 1.725 10 10 EDCE C[C@H]1CC[C@H](C2OCCO2)N(S(=O)(=O)Cc2ccc(N)cc2)C1 2152088375 NVLOVZOUMJGBJL-SWLSCSKDSA-N 340.445 1.572 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2018521651 IZLWGUUCSOBZEB-MNXVOIDGSA-N 340.420 1.324 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)cc1Br 2173357568 NRYWULHGYCXGKD-PPMYVGRGSA-N 342.233 1.823 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@@]4(CCCO4)[C@@H]3C3CC3)c2n1 2062490406 VUFOVYWGJPMKLC-YOEHRIQHSA-N 328.372 1.527 10 10 EDCE O[C@@H]1CCN(c2ccc(CNC3CC3)c(Br)c2)C[C@H]1O 2188637379 UVJHUWMPXKOWFQ-HUUCEWRRSA-N 341.249 1.633 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2COC[C@]2(C(=O)NCCCN=[N+]=[N-])C1 1908253829 BIALTXYSMQKIJU-IAQYHMDHSA-N 339.396 1.687 10 10 EDCE CN(C(=O)[C@H]1C[C@H](O)CCN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2080895583 CCVRBHQKSOGKPV-HUUCEWRRSA-N 349.431 1.992 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2104412760 XNRMVXRKWXLDSE-YRBMFTTPSA-N 328.206 1.433 10 10 EDCE Nc1ccc(OCCNC(=O)c2cnc(Br)cn2)cc1 2237279470 QDPKSZBWXGPQBB-UHFFFAOYSA-N 337.177 1.630 10 10 EDCE Cc1cccc(N2C(=O)NC(=O)C(=CNN3CCCCC3)C2=O)c1 2296932686 HWWQUCRRKWJXOJ-UHFFFAOYSA-N 328.372 1.452 10 10 EDCE CS(=O)(=O)[C@H]1CC[C@@H]1NCc1cccc(Br)c1O 2319779116 JOQSLHDZPDDUOQ-QWRGUYRKSA-N 334.235 1.820 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCN(C(C)=O)C3)CC2)cc1 175261631 BYUAEILZZUBYJX-HNNXBMFYSA-N 331.416 1.212 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)c(Br)c1 2357053465 WBKOJJOQHYHSTD-MAMIUBEXSA-N 342.233 1.965 10 10 EDCE COC[C@@]1(C(=O)O)C=CCN1Cc1ccc(Br)cc1O 2361559282 YFGFNYSBALALOE-CQSZACIVSA-N 342.189 1.996 10 10 EDCE Cc1cc(C(=O)NC[C@H](C)O)c(C)n1-c1ccc2c(c1)OCCO2 97177893 MCKPGDNRNPXKSP-LBPRGKRZSA-N 330.384 1.976 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1ccc(C(F)F)n1 528997844 ZSVKGLNNJNBOEA-VIFPVBQESA-N 325.315 1.979 10 10 EDCE CC(C)CN1C(=O)/C(=C/NCc2ccccc2F)C(=O)NC1=S 255006807 BZXJQXYNIPVQKV-XYOKQWHBSA-N 335.404 1.699 10 10 EDCE CCC[C@@](C)(O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 269284513 BVJFETHCZHSPLI-LJQANCHMSA-N 349.475 1.485 10 10 EDCE Cc1cc(O)c(CNC[C@@H]2CCC[C@@]23NC(=O)N(C)C3=O)cc1C 371083678 DDNYYJLYGIYHMF-KBXCAEBGSA-N 331.416 1.819 10 10 EDCE COc1ccc(Br)c(CN(C)CCOCCN)c1O 2227750948 MSPNCGKIKJPONX-UHFFFAOYSA-N 333.226 1.570 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(C)[C@H]3C[C@@H](OC)C3)nc12 285333310 JXIXXPRTUIRPDI-TXEJJXNPSA-N 334.376 1.221 10 10 EDCE Cc1ccc(CNCC(=O)N2CCOCC2)c(O)c1Br 2381138076 LTTCKSCDTJYQSE-UHFFFAOYSA-N 343.221 1.412 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCN(C(=O)c2ccc(C)cc2)C1 808502558 LRZGNOWTYIABLE-HNNXBMFYSA-N 331.368 1.549 10 10 EDCE CO[C@@H]1C=CCN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2165061806 LWATWLYPIQHXLU-OQPBUACISA-N 339.189 1.826 10 10 EDCE COc1ccc(N2CC[C@@H](CNS(=O)(=O)N(C)C3CC3)C2)cc1 819887487 LHLBSBGMDCZNPO-ZDUSSCGKSA-N 339.461 1.450 10 10 EDCE Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1ccc(O)cc1C(=O)O 728149975 ZOAKCEXUYCCAFV-UHFFFAOYSA-N 345.764 1.587 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N(C)[C@@H]3CCOC3)C2)cc1 824693180 JSIZTTYIFVPLPV-GOEBONIOSA-N 333.432 1.952 10 10 EDCE C[C@]1([C@@H]2CCCN(Cc3cc4c(cc3O)OCO4)C2)COC(=O)N1 905708039 MPJWLMNYXUDCSE-SJKOYZFVSA-N 334.372 1.831 10 10 EDCE C[C@@H](NC(=O)C1(n2cnnn2)CCOCC1)c1ccc(N(C)C)cc1 832436164 HQRYNPAFGMQUPY-CYBMUJFWSA-N 344.419 1.122 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1OCCO[C@@H]1c1ccccc1 830531174 DWJPRPOUAQGAJW-QZTJIDSGSA-N 343.379 1.913 10 10 EDCE COc1ccc(N2CCCN(C(=O)N[C@H]3CCNC[C@@H]3C)CC2)cc1 841985985 COOZSMBTNAOBCZ-YJBOKZPZSA-N 346.475 1.915 10 10 EDCE Cn1nccc1[C@H]1COCCN1C(=O)/C=C/c1ccc(O)c(O)c1 846611721 KCCZAGUZKNVTKK-LYKUJDHUSA-N 329.356 1.445 10 10 EDCE COC[C@@H](CCCN)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 925777664 QAJXLJNORCWDFZ-QGZVFWFLSA-N 348.491 1.232 10 10 EDCE C[C@@H]1COC[C@H]1N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 688243188 LGPBOFCAWZUQKO-KEMBBXRSSA-N 340.221 1.872 10 10 EDCE Cc1ccncc1CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 855394266 NEUPHTXYYYJYSR-UHFFFAOYSA-N 349.412 1.440 10 10 EDCE Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 757653864 CJHBCSVEWHCMSC-UHFFFAOYSA-N 345.764 1.587 10 10 EDCE O=C1N[C@@H](CC2OCCO2)C(=O)N1Cc1ccc(N2CC=CC2)cc1 924685660 PCITUEIMSBLXBK-HNNXBMFYSA-N 343.383 1.246 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cn(C(C)C)nn3)C2)cc1 855223500 AVSFHMYJWHVZGH-ZDUSSCGKSA-N 329.404 1.876 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)c3cnn(C)c3)C2)cc1 853817274 CBLQCQFKLSJKNH-ZDUSSCGKSA-N 328.372 1.007 10 10 EDCE C[C@@H]1CCNC[C@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851663973 OGSGCUFNTAYBJV-RDTXWAMCSA-N 346.475 1.445 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCN(S(=O)(=O)C3CC3)CC2)cc1 862457113 BAOFIKMQEULURJ-ONEGZZNKSA-N 349.500 1.876 10 10 EDCE COC(=O)[C@H]1CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCO1 776237753 IJFXSWPDQAIVGF-IUODEOHRSA-N 335.404 1.397 10 10 EDCE CCOc1ccc(CN2CCC(OCCC(=O)NC)CC2)c(O)c1 770285681 FXQBMKSYAQXACV-UHFFFAOYSA-N 336.432 1.908 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCCNC(=O)c1cccs1 1143368430 RAMSSFLIRKOGFT-UHFFFAOYSA-N 334.397 1.638 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(Cc2ncon2)CC1 1303862375 YCOXFTJXJNYGTP-RQOWECAXSA-N 329.356 1.975 10 10 EDCE CC(C)(C)OC(=O)N1CCN([S@@](C)(=O)=NCCN=[N+]=[N-])CC1 1962299350 MKNDHNXLBSEDSH-QFIPXVFZSA-N 332.430 1.862 10 10 EDCE N[C@H]1CCCC[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1327581687 BMAAVCMDFPJVQY-MSOLQXFVSA-N 331.460 1.781 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCc2cc(N)ccc21 1329858054 ZYNOANNFMMAGQO-MRXNPFEDSA-N 339.395 1.737 10 10 EDCE O=C(O)[C@H]1OCC[C@H]1CNCc1cc(Br)cc(F)c1O 715786495 GBOAMRTVJLRRMT-MADCSZMMSA-N 348.168 1.873 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCCC[C@@H]2CNCCCO)cc1 1273025228 LJPZFJLJLGQOTP-OAHLLOKOSA-N 347.419 1.816 10 10 EDCE CC(C)(F)C(=O)NCC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1356797490 YTYOZWUKRLUQQH-UHFFFAOYSA-N 349.366 1.785 10 10 EDCE COCC(=O)NCC1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1508388289 GGGKCMMLDSBKLV-UHFFFAOYSA-N 347.375 1.120 10 10 EDCE CCOC(=O)c1cc(CNC(=O)NCc2cc(C)ccc2O)on1 1471129248 YPIQEYNXSWRTIL-UHFFFAOYSA-N 333.344 1.865 10 10 EDCE NCc1nccnc1NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1612920118 MMXLMMFGMDRQFG-UHFFFAOYSA-N 340.431 1.249 10 10 EDCE CNCc1ccc(N2C[C@H]3NC(=O)O[C@@H]3C2)c(Br)c1 2120408328 XOMZNJRDLLCGKO-ZYHUDNBSSA-N 326.194 1.466 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H](C)n2cncn2)cc1C 1715331555 NWSKNSJWZAJUHP-CABCVRRESA-N 345.447 1.793 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2n[nH]cc2C)cc1C 1484482073 FXKRZJOVNRDCAN-UHFFFAOYSA-N 346.431 1.259 10 10 EDCE O=C1C[C@@H](C(F)(F)F)[C@@H](C(=O)NCc2c(O)cccc2O)CN1 1558536167 VIWDRSFTELRTOW-IONNQARKSA-N 332.278 1.029 10 10 EDCE COC(=O)c1cnc(CNC(=O)c2c(F)ccc(O)c2O)s1 1559034647 JNLQZMDWLOQIIW-UHFFFAOYSA-N 326.305 1.410 10 10 EDCE CC1(c2ncc(C(=O)NCc3c(O)cccc3O)s2)OCCO1 1635847159 ITVHDIATFKEHCV-UHFFFAOYSA-N 336.369 1.704 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCc1nc(N)n[nH]1 1637749410 TWNIMAOQHJJETE-UHFFFAOYSA-N 329.408 1.329 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2[nH]ccc2C)cc1C 1568558281 QBEDQHIKYKYARZ-OAHLLOKOSA-N 331.416 1.521 10 10 EDCE Cc1c(C(=O)NCc2cc(O)ccc2O)cnn1C1CCOCC1 1643881837 HQKHRKUCNCPDPL-UHFFFAOYSA-N 331.372 1.884 10 10 EDCE Cc1nc2cc(O)nn2c(C)c1CC(=O)NCc1cc(O)ccc1O 1651222573 JXMFLRFZCWVTTF-UHFFFAOYSA-N 342.355 1.322 10 10 EDCE [N-]=[N+]=NC1CN(CC(=O)NC(=O)c2ccccc2Br)C1 1912153664 IKOLVPLJUDBFPD-UHFFFAOYSA-N 338.165 1.700 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2n[nH]cc2C)cc1C 1677075426 ZDJZCCAXYYHOQJ-OAHLLOKOSA-N 346.431 1.258 10 10 EDCE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@H]2CCC(=O)NC2=O)c1 153365159 QUCIWRCQDHMYFM-HNNXBMFYSA-N 339.395 1.938 10 10 EDCE O=C(CCN1C(=O)CSC1=S)Nc1ccc([N+](=O)[O-])c(F)c1 1865769098 WCRYXVGRVKMVPV-UHFFFAOYSA-N 343.361 1.923 10 10 EDCE CN1C[C@H](N(C)c2ccc(CN)c(Br)c2F)CC1=O 2131952802 OICXHIMOBIJBCU-SECBINFHSA-N 330.201 1.714 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@H](O)[C@H](O)C2)c(Br)c1 2132138103 RCLJLIRMSQFASH-BIGNPOOSSA-N 329.238 1.661 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)c(Br)c1 2136583846 AOSRFMMIINKKGW-UFAOYGAJSA-N 325.206 1.670 10 10 EDCE CN(C)C[C@H]1CN(Cc2cc(Br)ccc2O)CCO1 128223539 PKYLPJHUBSEHLD-ZDUSSCGKSA-N 329.238 1.917 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4[C@@H](CO)[C@@H]4C3)c(Br)cc21 2146877406 QGDQTQZLUVAAEI-QARKVSRYSA-N 338.205 1.076 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985101634 VNZAHWUIAHQCKR-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NC(=O)c1ccc(O)c(O)c1 2006283276 GJJTYLGBTKRTFD-GHMZBOCLSA-N 338.360 1.120 10 10 EDCE CN(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010390094 YUNPEWHVQOMENF-NWDGAFQWSA-N 340.428 1.743 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC[C@@H](CN=[N+]=[N-])C1)C1COC1 2010402193 NIIONGRBZROCHG-CMPLNLGQSA-N 339.396 1.685 10 10 EDCE NCc1cc(F)c(N2CC(=O)N3CCC[C@H]3C2)cc1Br 2158193480 CRSFLYQXFHXVGT-JTQLQIEISA-N 342.212 1.858 10 10 EDCE CO[C@@]1(CO)CCCN(c2ccc(CN)cc2Br)C1 402883936 AFMXALPJXSXTBO-AWEZNQCLSA-N 329.238 1.886 10 10 EDCE Nc1ccc(OCC(=O)NCCn2cc(Br)cn2)cc1 383642691 MAHFMEAFDPMSMC-UHFFFAOYSA-N 339.193 1.423 10 10 EDCE CC(C)(C)OC(=O)N=c1[nH][nH]cc1CNC(=O)c1cccc(O)c1O 2054412034 BWFKZJPGOYVLFX-UHFFFAOYSA-N 348.359 1.520 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@H](O)C3)c(Br)c1 2190454892 WBKOJJOQHYHSTD-UJZSJCAASA-N 342.233 1.965 10 10 EDCE COc1ccc(CN=c2nc(CNC(=O)OC(C)(C)C)[nH][nH]2)c(O)c1 2063196316 QMYJXZWTCWADAE-UHFFFAOYSA-N 349.391 1.578 10 10 EDCE CS(=O)(=O)C[C@H]1CCN(c2ccc(CO)c(Br)c2)C1 2087365311 UXVRWESEAKOPDM-JTQLQIEISA-N 348.262 1.812 10 10 EDCE O=S1(=O)C[C@@H]2CN(c3ccc(CO)cc3Br)C[C@H]2C1 2087855581 DJMYWTKJKUGCDC-QWRGUYRKSA-N 346.246 1.422 10 10 EDCE CN(CC1(S(C)(=O)=O)CC1)c1ccc(CN)cc1Br 2111527694 DWGVGRRUNFIDMN-UHFFFAOYSA-N 347.278 1.921 10 10 EDCE COCCNCc1ccc(N2CC[C@@H]2CO)c(Br)c1 2092550790 WLVLCTJJHMXQPH-GFCCVEGCSA-N 329.238 1.756 10 10 EDCE Oc1c(F)cc(Br)cc1CNC1(c2nn[nH]n2)CC1 2094709820 VMYGIKKDOZXBKC-UHFFFAOYSA-N 328.145 1.586 10 10 EDCE N[C@@H]1CN(Cc2cc(Cl)cc(Br)c2O)CC[C@H]1CO 2122343792 CQRSRTIUIRKHHN-QPUJVOFHSA-N 349.656 1.950 10 10 EDCE CCC[C@H](NCc1c(Br)ccc(OC)c1O)C(N)=O 2227751780 QHWSOASMSJBIKU-JTQLQIEISA-N 331.210 1.907 10 10 EDCE O=C(O)[C@@H]1CC[C@H](O)CN1Cc1ccc(Br)cc1O 2264528103 FTBAAZFAYFXLES-QWRGUYRKSA-N 330.178 1.565 10 10 EDCE NCc1ccc(N2C[C@@H]3CC[C@@H](CO)O[C@H]3C2)cc1Br 2289348902 IMGBPCNDXPAPNK-WHOFXGATSA-N 341.249 1.884 10 10 EDCE CN1CCN(/C=C2/SC(=S)N(C[C@@H]3CCCO3)C2=O)CC1 102724101 OVXCRXWBNLBIRC-OCUQMRJBSA-N 327.475 1.115 10 10 EDCE CNC(=O)c1cccnc1N1CCN(c2ccc(OC)c(F)c2)CC1 301558393 JHGZPOBXFRLQJX-UHFFFAOYSA-N 344.390 1.916 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N[C@H]1CCCn2ncnc21 177306601 JNRYNEYSUYOHEB-INIZCTEOSA-N 338.415 1.989 10 10 EDCE O=C(O)COc1ccc(/C=C2/SC(=S)N(CCO)C2=O)cc1 210388001 TXIYFGFNLZWTKU-YRNVUSSQSA-N 339.394 1.344 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](NC(N)=O)C(C)C)CC2)cc1 42047432 COPJSSRESOTUDF-OAHLLOKOSA-N 334.420 1.037 10 10 EDCE CNCc1cc(F)c(N2CCSC[C@H]2S(C)(=O)=O)c(F)c1 90923198 FARHGPVVIGDDQX-GFCCVEGCSA-N 336.429 1.608 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cnc3c(C)cccn3c2=O)c1 91075465 PTSKYWXORCHUJW-UHFFFAOYSA-N 339.351 1.647 10 10 EDCE CCNC(=O)N1CC[C@H](N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 90409778 DMZBNQUOQSJPPN-RDJZCZTQSA-N 346.475 1.978 10 10 EDCE C[C@]1(C(=O)NCc2ccc(N3CCOCC3)cc2)CCC(=O)NC1 281122433 DGUHIEULUQRTJB-SFHVURJKSA-N 331.416 1.056 10 10 EDCE COc1ccc(Br)c(CC(=O)OCC(=O)C(C)=O)c1 808527771 NRKFRVHIMBVLEW-UHFFFAOYSA-N 329.146 1.702 10 10 EDCE CO[C@H](C(=O)NCc1ccc(C)c(Br)c1O)C1CNC1 2381130055 STWNMLFIPWSPAT-ZDUSSCGKSA-N 343.221 1.314 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H](C)[C@@H]3C)CC2)cc1 815163883 RWTGYYKLLOINNH-RYRKJORJSA-N 333.476 1.518 10 10 EDCE Cc1cc(=O)n(C)cc1NS(=O)(=O)c1cc(F)cc(F)c1O 821185835 RHNOYCUSSFKVMK-UHFFFAOYSA-N 330.312 1.478 10 10 EDCE CN(C)c1ccc(CNC(=O)CN[C@@H]2CCNC23CCCC3)cc1 903484859 XDNZIJRRMSZKDF-QGZVFWFLSA-N 330.476 1.633 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@H](O)C3CCOCC3)CC2)cc1 735878786 KXRKFGBFXASDNH-GOSISDBHSA-N 348.443 1.521 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@H](C[C@H]1COCCO1)C(F)(F)F 910942854 HFTBEOPUNHKGLD-RYUDHWBXSA-N 349.305 1.698 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC[C@](O)(C(F)(F)F)C2)cc1 747868010 LIBLKGPCACECNK-CQSZACIVSA-N 331.338 1.961 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCN(C)S2(=O)=O)cc1 843532286 XKJFSYCGFXDRCV-HNNXBMFYSA-N 339.461 1.183 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N2CCCC2)cc1)c1nnc(O)n1C 914179327 IKXWXSNBPGPQKM-LBPRGKRZSA-N 344.419 1.681 10 10 EDCE Cn1nccc1[C@H](O)CNCc1cc(Br)cc(F)c1O 922975342 SOYKFWUQRXTINX-GFCCVEGCSA-N 344.184 1.851 10 10 EDCE CN(C)CCC[C@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)CCO1 853625651 UTBPGSZBPOKYGV-WMLDXEAASA-N 336.432 1.361 10 10 EDCE COCCO[C@@H]1COCC[C@H]1NC(=O)NCc1c(O)cccc1F 922070655 KRLCNTALYVIBOK-UKRRQHHQSA-N 342.367 1.151 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cccnc3C(N)=O)C2)cc1 855225947 MJXNQSHFRJGDII-GFCCVEGCSA-N 340.383 1.198 10 10 EDCE COC(=O)[C@@H]1CN(Cc2cc(Cl)cc(OC)c2O)C[C@@H](C)O1 862486620 FQHANXOKKRDBIA-RNCFNFMXSA-N 329.780 1.817 10 10 EDCE CCO[C@H](C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@H]1CCOC1 869231597 SLMISRFRPRYUFJ-DAYGRLMNSA-N 348.443 1.832 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C[C@H]1F 1117163937 DLVVPFNVBAHOCK-XJKSGUPXSA-N 347.434 1.892 10 10 EDCE CN(C)c1ccc(/C=C\CN[C@H]2C(=O)NCC23CCOCC3)cc1 895769113 MUKAACUQCRNYPS-LIMHQNJXSA-N 329.444 1.651 10 10 EDCE O=C(O)[C@H]1C[C@H](NCc2cc(Br)ccc2O)CCO1 1880048634 ATLXMAATPKJAIA-ZYHUDNBSSA-N 330.178 1.877 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cnc3ccnn3c2)c1 1159201652 BDQXXXKBAWHJSD-UHFFFAOYSA-N 347.356 1.059 10 10 EDCE CNCc1ccc(N2CCN(C)C[C@H]2CO)c(Br)c1 699447107 DDBLTPZNNNJXBW-LBPRGKRZSA-N 328.254 1.281 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@@]12CCCN(CC1)C2 1333084525 DFCWWYVFNHPSHY-IBGZPJMESA-N 329.444 1.625 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2C[C@H]3[C@@H](C2)C3(F)F)cc1 1261680266 SWLKYOKCCTWEFR-UBSAEIQESA-N 337.370 1.529 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CCC[C@]1(C)NC(=O)NC1=O 1443807829 CKLHFQVXJSIZPR-SFHVURJKSA-N 346.431 1.446 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cc2c(nc1O)CCC[C@H]2O 1445939518 ROTSHAIMMRYYOB-CQSZACIVSA-N 344.367 1.541 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1CN([C@@H]2CCOC2)C1 1628954815 SUHOLVHLAMYISH-LJQANCHMSA-N 343.471 1.966 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cc[n+]([O-])cc2)cc1C 1716263342 BCYNYELHZNZLBS-ARJAWSKDSA-N 341.411 1.713 10 10 EDCE CCCC(=O)NCC1CN(Cc2nnnn2-c2ccc(OC)cc2)C1 1714956865 ZCIFFNDHPWPBNF-UHFFFAOYSA-N 344.419 1.019 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)CC2OCCCO2)cc1C 1497574392 ROERSFAONYMWGY-ARJAWSKDSA-N 348.443 1.919 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@@H]1CCS(=O)(=O)c2ccccc21 1638352241 NJLAMBNBYBURLS-CQSZACIVSA-N 347.392 1.675 10 10 EDCE CS(=O)(=O)c1ccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)cn1 1634523567 GWGINIIRIYNWEA-ZZXKWVIFSA-N 348.380 1.226 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H](C)c2nnc(O)n2C)c1 1565377372 PMCGTQKMHLKBGZ-BDAKNGLRSA-N 335.364 1.356 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C2CN(C(C)=O)C2)cc1C 1498035980 MMHQLHATHOAPDQ-ZDUSSCGKSA-N 333.432 1.076 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](NC(=O)C2CC2)C2CC2)cc1 1737392055 HFANFGHIAHWFJD-CQSZACIVSA-N 343.387 1.884 10 10 EDCE CCOCC(=O)NC[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1738233080 UUKJWSBVAYUTLG-NSHDSACASA-N 349.391 1.368 10 10 EDCE COc1ccc(C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)nn1 1669440156 MUVNXFJEQGVBHB-CYBMUJFWSA-N 344.415 1.710 10 10 EDCE O=C(NCc1ccc(-c2nncnn2)cc1)NCc1ccccc1O 1683561604 WCIDGFBPZQZRJT-UHFFFAOYSA-N 336.355 1.639 10 10 EDCE Cc1ccc(C)n1[C@H](CC(=O)N[C@@H]1CONC1=O)c1ccc(F)cc1 1851356973 AULQXRFOYQEPKG-HZPDHXFCSA-N 345.374 1.770 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCCC[C@H]3CO)c(Br)cc21 252605995 QDRQCKLTWXXGSZ-SDBXPKJASA-N 340.221 1.752 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](C(=O)NCCCN=[N+]=[N-])O1 1985099749 RDOXVTKWDRDWJR-GHMZBOCLSA-N 327.385 1.875 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985100365 FYKQOGQVIFMGPT-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE CN[C@@H](C)c1ccc(N2CC[C@@](O)(C(N)=O)C2)c(Br)c1 312780811 NFJJDWPAPFIGFA-XPTSAGLGSA-N 342.237 1.156 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCn4nc(C5CC5)cc4C3)c2n1 2064905220 WERVNNYIOPWKOT-UHFFFAOYSA-N 338.371 1.473 10 10 EDCE CC(C)(C)OC(=O)N1[C@H]2C[C@@H]1CN(C(=O)COc1ccc(N)cc1)C2 2053415377 IFIAIBJQDJUWDU-OKILXGFUSA-N 347.415 1.868 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NC(=O)CCc2ccc(N)cc2)C1 2062452476 WOMRBYIMEHESSW-GJZGRUSLSA-N 349.431 1.298 10 10 EDCE COc1ccc(N2CC(OCCO)C2)c(OC)c1Br 2226541832 SGIAIGIFNPUGMF-UHFFFAOYSA-N 332.194 1.664 10 10 EDCE CCN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1cccc(C)c1 298298985 OBBAACKVHDMIRL-MDZDMXLPSA-N 327.384 1.459 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)c1cc(=NC(=O)OC(C)(C)C)[nH]n1C 2300525758 JZGOFAXCXIWEEB-UHFFFAOYSA-N 337.384 1.961 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 2300531661 JXUIITXOIOPAKX-NWDGAFQWSA-N 341.412 1.763 10 10 EDCE C[C@@H]1CN(CCCNC(=O)C=Cc2ccc(O)c(O)c2)C[C@@H](C)O1 2307982079 MQRMIFIJTKWMJN-ZIAGYGMSSA-N 334.416 1.727 10 10 EDCE CC(=O)N[C@@H]1C(=O)c2ccccc2C(=O)[C@H]1N1CCc2ccccc2C1 104878609 RGZYRNVATCVQPV-OALUTQOASA-N 348.402 1.997 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3C[C@H](O)[C@@H](O)C3)ccc(N)c2C1 306050511 PJVLIQCQLHSSNF-HOTGVXAUSA-N 349.431 1.104 10 10 EDCE COc1cccc(CN2CCCN(Cc3noc(C)n3)CC2)c1O 127921240 CZICRNNIPCZSAG-UHFFFAOYSA-N 332.404 1.800 10 10 EDCE COc1ccc(CN2CCc3cc(S(N)(=O)=O)ccc32)c(O)c1 127244038 IIIAVDVAHBRWOZ-UHFFFAOYSA-N 334.397 1.611 10 10 EDCE CS(=O)(=O)N[C@@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 93530813 RWOIJCIFNAQQRH-MRXNPFEDSA-N 337.489 1.800 10 10 EDCE CC(C)(C)OC(=O)NCCCNS(=O)(=O)Cc1ccc(N)cc1 230013680 CQVVNDNBMBJQSX-UHFFFAOYSA-N 343.449 1.603 10 10 EDCE COc1ccc(N2CCN(C(=O)CNC(=O)NC(C)C)CC2)cc1 243866199 RKEXVJDAUDSZBC-UHFFFAOYSA-N 334.420 1.051 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCN2CCOC[C@H]2C1 368623152 PGTNUXQAMIVOEM-GOSISDBHSA-N 344.459 1.513 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](C)[C@@H](OC)C3)nc12 275890627 RZSSQCUHDRMHDG-FZMZJTMJSA-N 348.403 1.468 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H](C)NC(N)=O)c(O)c1Br 2380770404 AVOOHBUCRGUWEI-QMMMGPOBSA-N 344.209 1.478 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1 808505180 UROPXPTURMUNLY-CQSZACIVSA-N 349.358 1.308 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccnc(CNC(=O)OC(C)(C)C)c1 808537729 RZVJYPOHOKIMML-UHFFFAOYSA-N 336.344 1.421 10 10 EDCE COc1ccc(CNC(=O)[C@@]23[C@@H]4[C@H]5C(=O)[C@H]2[C@@H]2[C@@H]5C[C@@H]4[C@H]23)c(O)c1 800560627 XXWVCSUQWWDOIH-WSEZRHPFSA-N 325.364 1.344 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN(C(=O)C3CC3)C2)c([N+](=O)[O-])c1 817131462 ASORWPNLINSLGC-XVNBXDOJSA-N 345.355 1.797 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 845663075 GTADBANZSPZCKP-DRKGASSASA-N 336.344 1.367 10 10 EDCE COC[C@H](O)CN[C@@H](C)c1cc(Br)cc(OC)c1O 848548991 NBFSUVMPKFCWMP-WCBMZHEXSA-N 334.210 1.821 10 10 EDCE C[C@@H](CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)NC(N)=O 847604925 RQPYAXYUWVVFPG-GXTWGEPZSA-N 335.404 1.347 10 10 EDCE NC(=O)[C@@H]1CC[C@H]1C(=O)NCc1cc(Br)ccc1O 848067797 CEWMWFZGFMHXEP-NXEZZACHSA-N 327.178 1.282 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NCC[C@H]2CC2(F)F)cc1 856717619 GBWXDAPSAYTMLL-NSHDSACASA-N 342.342 1.748 10 10 EDCE C/C=C\C[C@H](CO)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852451346 INROCJAEUSHACT-LPUOJRKPSA-N 333.432 1.900 10 10 EDCE CNC(=O)c1cccc(OCC(=O)NCc2cccc(OC)c2O)c1 759609920 XSCPUHHUAOVPGV-UHFFFAOYSA-N 344.367 1.456 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cn4c(n3)CCC4)C2)cc1 855222916 CYTOZSJQFDEUTC-ZDUSSCGKSA-N 326.400 1.847 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c1 751316791 BETQYKJZBQXUQH-SRVKXCTJSA-N 344.433 1.405 10 10 EDCE COc1ccc(N2CCN(CC3(CS(C)(=O)=O)CC3)CC2)cc1 767358419 FYGZQYXACSSQDB-UHFFFAOYSA-N 338.473 1.642 10 10 EDCE CCOC(=O)CCCS(=O)(=O)Nc1ccc(O)cc1C(=O)O 776434445 GEDCNOUVVSGSBN-UHFFFAOYSA-N 331.346 1.175 10 10 EDCE Cc1nc([C@H]2COCCN2C(=O)NCc2ccc(N(C)C)cc2)no1 779641198 HECORELFZTWZSN-OAHLLOKOSA-N 345.403 1.727 10 10 EDCE O=C1C[C@@]2(CCN(Cc3ccc(N4CCOCC4)c(F)c3)C2)CN1 789766838 AIPAYICUGVZISV-SFHVURJKSA-N 333.407 1.374 10 10 EDCE COc1ccc(CNS(=O)(=O)c2c(C)nn(C)c2Cl)c(O)c1 795363147 WDEOFPZPTLFGKW-UHFFFAOYSA-N 345.808 1.575 10 10 EDCE C[C@@H]([C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1)S(C)(=O)=O 1136768448 CRJRIFBGXGKOCQ-ZJUUUORDSA-N 340.405 1.743 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnc4c[nH]nc4c3)CC2)cc1 1150069556 KHBNLZQUTUMRBU-UHFFFAOYSA-N 337.383 1.929 10 10 EDCE COc1ccc(Br)c(CNC2(CO)CCOCC2)c1O 1964032730 NEIXGXQCJVWUFW-UHFFFAOYSA-N 346.221 1.794 10 10 EDCE C[C@H](NC(=O)C(=O)N1CC[C@H]2COC[C@@H]2C1)c1ccc(N(C)C)cc1 1330968547 KQIDSERADVLVPP-BPUTZDHNSA-N 345.443 1.425 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cnnc(O)c2)cc1C 1267387067 FBMDXYQFLBOGLL-UHFFFAOYSA-N 330.388 1.361 10 10 EDCE C[C@H](NC(=O)C(=O)N1CCO[C@H](C)CC1)c1ccc(N(C)C)cc1 1351363143 MBRAMWIDNPUGFU-KGLIPLIRSA-N 333.432 1.567 10 10 EDCE CCOCc1nnc(N(C)Cc2ccccc2O)n1CCC(=O)NC 1548086328 ZTXVBAYSLHSOAX-UHFFFAOYSA-N 347.419 1.293 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)[C@@H]2COC(=O)N2)C2CC2)cc1C 1483558021 KJPZMUJDEBIGEP-GJZGRUSLSA-N 347.415 1.096 10 10 EDCE O=C(CCc1nc(-c2ncccn2)no1)NCc1cc(O)ccc1O 1558175068 ZZHZZTRLRZKEAL-UHFFFAOYSA-N 341.327 1.187 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@@H]2CCC(=O)N2)cc1C 1714284974 RFRVFWQWPAQNKO-ZFWWWQNUSA-N 333.432 1.267 10 10 EDCE CSCC(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1720919507 NDUBKPQSMDACMP-SECBINFHSA-N 337.405 1.447 10 10 EDCE C[C@H](NC(=O)[C@@H]1COCCN1CC(F)F)c1ccc(N(C)C)cc1 1567777033 HDCPOEIPGROOJN-WFASDCNBSA-N 341.402 1.896 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@H](O)C2(C)C)cc1Br 2124803264 UQYPIBXBGAZKHV-WQHBLYJGSA-N 330.222 1.823 10 10 EDCE COc1ccccc1C(=O)NCC(=O)NCc1c(O)cccc1F 1635360222 DTCTYSVMBRETAB-UHFFFAOYSA-N 332.331 1.586 10 10 EDCE CCS(=O)(=O)CCCNC(=O)c1cc2cc(O)c(O)cc2s1 1639180561 NWOLNXIMQJVCIA-UHFFFAOYSA-N 343.426 1.867 10 10 EDCE C=CC(=O)N(C)CC(=O)NCc1cccc(Br)c1O 1640084401 VFLKMPYVKLHEKU-UHFFFAOYSA-N 327.178 1.415 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)CCCF)cc(OC)n1 1735225867 NSEBRRVJVLZBJE-NSHDSACASA-N 341.383 1.425 10 10 EDCE COc1cc(C(=O)NCc2cc(O)ccc2O)cc2c1OCCO2 1593868815 QDEMWYJFFQJXNO-UHFFFAOYSA-N 331.324 1.808 10 10 EDCE CN(C)c1ncnc2c1cc(C(=O)NCc1cc(O)ccc1O)n2C 1593873216 LRAKYAIPVGXGEN-UHFFFAOYSA-N 341.371 1.376 10 10 EDCE C[C@H](CCNC[C@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1699161747 AMIVZVWHOFCKBS-CHWSQXEVSA-N 347.419 1.984 10 10 EDCE CC[C@H](C)CNC[C@@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1699072472 KNWCEWZXYHZVRO-SMDDNHRTSA-N 335.408 1.575 10 10 EDCE CC(/C=C1/SCCN1C)=C1/SC(=S)N(CC(=O)O)C1=O 2506524 LNKNWPNGZMWPFA-HAMFBJRISA-N 330.456 1.725 10 10 EDCE CN(C)C(=O)[C@H]1CCN(c2ccc(CN)c(Br)c2F)C1 2143702436 GMQBHZBBYOJISA-JTQLQIEISA-N 344.228 1.961 10 10 EDCE C[C@@H](CNS(=O)(=O)Cc1ccc(N)cc1)NC(=O)OC(C)(C)C 1977696003 FGVGNPMXABGFHU-NSHDSACASA-N 343.449 1.601 10 10 EDCE Cn1cnc(CCNCc2ccc(O)c(O)c2O)c1Br 2144573220 HRZVKMBCWUIRMQ-UHFFFAOYSA-N 342.193 1.632 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@@H]1COC[C@H]1C(=O)NCCCN=[N+]=[N-] 1985101875 YZKMHVBZIAJJMY-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OC(C)(C)C 2010392956 LUVLNQKBYXGQFI-LLVKDONJSA-N 337.384 1.614 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010402681 UPEXEBWNWGDVSI-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC(N=[N+]=[N-])CC1)C1COC1 2010401566 FIUKYUSGHNVEAH-LBPRGKRZSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)NCCc1nc(=NCc2ccc(N)cc2)[nH][nH]1 2011844324 VGDIXGQFTICKGW-UHFFFAOYSA-N 332.408 1.488 10 10 EDCE COc1ccc(N2CCO[C@@H]3CNC[C@H]32)c(OC)c1Br 2162651104 SJRCNNLKOFIGAB-ZYHUDNBSSA-N 343.221 1.643 10 10 EDCE C[C@H](O)CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C1CC1 691473298 WBJYDLYWMXMHHT-CPFSXVBKSA-N 341.205 1.784 10 10 EDCE Oc1cc(Br)ccc1CNC[C@@H]1CN2CCN1CC2 691489601 SNOJYQISDSLGJU-CYBMUJFWSA-N 326.238 1.244 10 10 EDCE CNCc1ccc(N2C[C@@H](OC)C[C@H]2CO)cc1Br 381695862 FLNVCGNWRXQUIW-STQMWFEESA-N 329.238 1.755 10 10 EDCE C[C@H](O)CN1CCCN(c2ccc(CN)c(Br)c2)CC1 2176855521 HYAMTMVQLSTGCU-LBPRGKRZSA-N 342.281 1.801 10 10 EDCE C[C@@H]1C[C@@H]2CN(c3ccc(CN)cc3Br)CCN2C1=O 2181270496 WBPVJWZFDUEWRL-ZYHUDNBSSA-N 338.249 1.965 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)C(=O)CCOCc1ccccc1 2042206519 MUDHQUQAIJBTLF-UHFFFAOYSA-N 341.411 1.690 10 10 EDCE CN(C)[C@@H]1CN(c2ccc(CN)c(Br)c2F)C[C@@H]1O 2089923893 ROJRAFNVCFVROH-MNOVXSKESA-N 332.217 1.158 10 10 EDCE CN[C@H](c1ccccc1O)[C@H](O)c1cc(Br)nn1C 2091864199 RWQFRWSWFIJUSD-CHWSQXEVSA-N 326.194 1.882 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)[C@H]3C[C@@H](O)C3)c(Br)cc21 2232433903 MRLLORVMIMBFIF-DAROEXNTSA-N 340.221 1.621 10 10 EDCE O=C(O)[C@@H]1CC[C@@H](O)CN1Cc1cc(Br)cc(F)c1O 2279185454 DQZWDVHJXTZVDO-KOLCDFICSA-N 348.168 1.704 10 10 EDCE NCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2332602469 WAZJBIYQYVWNLI-DGJRKYIQSA-N 327.222 1.228 10 10 EDCE Cc1ccc(CNC(=O)Cn2cnnc2)c(O)c1Br 2352640036 FGNDROCYMDNFFS-UHFFFAOYSA-N 325.166 1.371 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCNC(=O)C2)c1O 2208771693 HPLFYATYDAEIGE-QMMMGPOBSA-N 329.194 1.532 10 10 EDCE COC(=O)[C@H](C)CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 178226737 ZTZHSKQBHMUFIH-CQSZACIVSA-N 334.416 1.681 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)c1 179894365 OFEFNJQBFULZIV-OAHLLOKOSA-N 348.443 1.862 10 10 EDCE CN(C[C@@H]1CCCC[C@@H]1O)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 302044336 MKKPDOJMMQFLJH-HZMBPMFUSA-N 335.360 1.913 10 10 EDCE Cc1nccc(N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)n1 184943437 AEUZQJYLAJEGQP-UHFFFAOYSA-N 328.372 1.467 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)NCC1(CO)CCC1 182279535 LEOIYKZJDGDGCG-QPJJXVBHSA-N 330.428 1.815 10 10 EDCE COc1cc(N(C)Cc2cc(=O)n3nccc3[nH]2)cc(OC)c1OC 125793921 FDHRMKNTQRPZMF-UHFFFAOYSA-N 344.371 1.685 10 10 EDCE CN(C)c1ccc(CN2CCC[C@H](CS(N)(=O)=O)C2)cc1F 271177828 LBVBVLKJNSKMMC-ZDUSSCGKSA-N 329.441 1.392 10 10 EDCE CC[C@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)OC 276569801 AZPMOMMWJUDJFV-QGZVFWFLSA-N 348.443 1.711 10 10 EDCE CCOCc1nc([C@@H](C)NC(=O)c2c(F)ccc(O)c2O)no1 296301656 ZUWMCZKCFIPNLN-SSDOTTSWSA-N 325.296 1.647 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CC(=O)N(c2cc(F)cc(F)c2)C1 808508094 RLTDWFJMLMEBSQ-VIFPVBQESA-N 325.267 1.019 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@H]3CCCN(C)C3=O)C2)cc1 819589879 HMUORMASUMVGFS-WMLDXEAASA-N 345.443 1.506 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@@](C)(CO)C(C)C)CC2)cc1 810074829 ALMUVODLPYYNFZ-IBGZPJMESA-N 349.475 1.340 10 10 EDCE C[C@@H](O)[C@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 840305851 XVVCUAOXWCFYFV-RHSMWYFYSA-N 331.416 1.354 10 10 EDCE COc1cc(CN2CCS(=O)(=O)[C@@H]3CCC[C@@H]32)c(O)cc1C 840146519 PXZPYNUEPDAOOD-XJKSGUPXSA-N 325.430 1.861 10 10 EDCE CN1CC[C@@H](C(=O)N(C)Cc2ccccc2O)[C@@H](c2cnn(C)c2)C1 849561194 HRAHDYUGYRPBRH-IAGOWNOFSA-N 342.443 1.820 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNCc3ccnc(O)c3)cc2)C1 921573132 IIDXJDPMXFVBJQ-MRXNPFEDSA-N 340.427 1.779 10 10 EDCE CC(C)(CNCc1ccc(N2CCOCC2)cc1)[C@]1(O)CCOC1 842760597 HQSRWSDCZKHTHX-IBGZPJMESA-N 334.460 1.790 10 10 EDCE C[C@H]1[C@@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CCN1C 925321068 OGLBSQBTBCFMDL-YJBOKZPZSA-N 346.475 1.757 10 10 EDCE C[C@@H]1C[C@@H](NC2CN(S(=O)(=O)N(C)C)C2)c2c(O)ccc(F)c21 858569740 NOONWPCMVBMMGK-BXKDBHETSA-N 343.424 1.160 10 10 EDCE C[C@H](NC[C@H](O)CS(C)(=O)=O)c1ccc(N2CCCCC2)cc1 927032991 NUTVBSZAUYADRZ-YOEHRIQHSA-N 340.489 1.733 10 10 EDCE COc1cc(O)c(CN2CC[C@@H](N(C)C(=O)N(C)C)C2)cc1OC 853585180 VXPZGIMOQHZCDO-CYBMUJFWSA-N 337.420 1.597 10 10 EDCE COCCN(CCF)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 697313697 QQIDJBDTONEJQP-GFCCVEGCSA-N 347.184 1.857 10 10 EDCE CCn1nc(C)cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 861830742 FNBJGVQMUYZACU-SNVBAGLBSA-N 346.387 1.309 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](C)[C@H](CN)C1 868367468 NLXFFWKFPYRVBR-UKRRQHHQSA-N 333.432 1.184 10 10 EDCE NC(=O)C1CCN(c2ccc(CNCc3cncnc3)cc2)CC1 1119504781 LIBVVVLIMHCZER-UHFFFAOYSA-N 325.416 1.468 10 10 EDCE O=c1onc(-c2cnccn2)n1Cc1ccc(N2CCOCC2)cc1 877889915 SFVQYKBSBYRNAC-UHFFFAOYSA-N 339.355 1.178 10 10 EDCE C[C@@H](NC(=O)CNC(=O)COc1ccccc1)c1ccccc1O 1302530645 UPXUQWAHNSLYDK-CYBMUJFWSA-N 328.368 1.765 10 10 EDCE C[C@@]1(CO)CN(c2ccc(CN)cc2Br)C[C@]1(C)CO 704771883 QRZACWJZXXBZIZ-GASCZTMLSA-N 343.265 1.725 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1C[C@@H]1C(=O)OC 1331870428 YXZBBSRETIYUGD-KBPBESRZSA-N 348.399 1.056 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C[C@H](O)CC1(O)CCC1 1261798382 JWCLVRJEGAZGBF-OAHLLOKOSA-N 337.416 1.423 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)C(=O)NCC2CC2)cc1C 1266180340 DTHHYGLAWNNEGQ-AWEZNQCLSA-N 347.459 1.514 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@@H]2CCC(=O)NC2)cc1C 1266950679 WABAWSFKMDABDZ-DZGCQCFKSA-N 333.432 1.124 10 10 EDCE O=C(NCc1cccc(Br)c1O)c1cnn(CCO)c1 1448966520 SQBSWAFQRAEOFP-UHFFFAOYSA-N 340.177 1.274 10 10 EDCE Cn1nccc1[C@H]1C[C@@H](NC(=O)Cc2ccc(O)c(O)c2)CCO1 1297999335 IZXGFUROKBQFQI-BLLLJJGKSA-N 331.372 1.410 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@H]2CC2(C)C)cc1C 1700936768 HKXMUOZHTVVENX-HZPDHXFCSA-N 334.460 1.959 10 10 EDCE Cn1nc(C2CCOCC2)cc1C(=O)NCc1cc(O)ccc1O 1471661768 BBFJEPHAALJGIR-UHFFFAOYSA-N 331.372 1.655 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2ocnc2C)cc1C 1717914334 XDRMUFKYNLOGDN-HNNXBMFYSA-N 347.415 1.523 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H]2CCC(=O)N2C)cc1C 1715944860 PAVKDLJAZWBQOU-UKRRQHHQSA-N 333.432 1.219 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cc(OC)n(C)n2)cc1C 1713326221 VDULCFWYFRNHLY-ZDUSSCGKSA-N 346.431 1.654 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1nnn(C)c1C 1568733124 VFLGYCCZYQTMIW-UHFFFAOYSA-N 345.447 1.692 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cc(C)nn2C)cc1C 1731581030 HMPKWROSKJEKSH-CQSZACIVSA-N 330.432 1.954 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cnn(C)c2N)cc1C 1732844270 WRRKVKKVONYASL-SNAWJCMRSA-N 343.431 1.395 10 10 EDCE CCC(CC)C(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1744430027 LRIQXDUFNHXZSG-OKILXGFUSA-N 349.431 1.912 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCN1CCOC[C@@H]1C 1693459062 QFOJVVRAKXZXHL-AWEZNQCLSA-N 345.447 1.649 10 10 EDCE OCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2134819409 GCMYFCKATAJJFG-IOEYQFCTSA-N 328.206 1.262 10 10 EDCE COC(=O)C1(NCc2ccc(N)cc2)CN(C(=O)OC(C)(C)C)C1 1913899656 SPJAJQGVDDRZCQ-UHFFFAOYSA-N 335.404 1.521 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)OCCCN 1951698537 PBPAFYKYSJSANH-CQSZACIVSA-N 326.393 1.857 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H](O)[C@@H](F)C3)c(Br)cc21 2144574204 SSJYQINCARAMCG-AXTRIDKLSA-N 344.184 1.310 10 10 EDCE C[C@@H]1COC[C@@H](C(=O)N(C)CCN=[N+]=[N-])N1C(=O)OC(C)(C)C 1985095263 BQWJCUZJCVRMSH-MNOVXSKESA-N 327.385 1.780 10 10 EDCE CO[C@H]1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 300096315 MFNZQYKCMCITLR-MADCSZMMSA-N 326.194 1.626 10 10 EDCE OCc1ccc(N2CCC[C@H](CO)[C@@H]2CO)cc1Br 710091401 OCOLNCAUHKBRCA-RISCZKNCSA-N 330.222 1.511 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](N)[C@H]3COC[C@H]32)c1O 2236039749 DHSSPVURODITIR-ADEWGFFLSA-N 343.221 1.321 10 10 EDCE CCN1C(=O)C(=Cc2cc(OC)c(O)c(OC)c2)C(=O)NC1=S 2297327115 CSHXQDCCBDVHMH-UHFFFAOYSA-N 336.369 1.056 10 10 EDCE Cc1cc(CN2CCN(C(=O)C=Cc3ccc(O)c(O)c3)CC2)on1 2307982265 WODCHTQICWQSHR-UHFFFAOYSA-N 343.383 1.752 10 10 EDCE O=C1NCCN(C(=O)C=Cc2ccc(O)c(O)c2)[C@H]1c1ccccc1 2307986938 OSHXSCXXJDLUPP-SFHVURJKSA-N 338.363 1.811 10 10 EDCE O=S1(=O)C[C@@H]2CN(c3ccc(CO)cc3Br)C[C@H]21 2314882067 ZQDPSNIYAWGEEL-JOYOIKCWSA-N 332.219 1.175 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H]1C(=O)N1CCc2cc(O)c(O)cc2C1 2318653699 GJMIJFNUIVDCNJ-CHWSQXEVSA-N 348.399 1.896 10 10 EDCE CN(C[C@H]1CCO1)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2341208020 BPCFBVSVTKDBKN-KRTXAFLBSA-N 327.178 1.660 10 10 EDCE C[C@H]1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C[C@@H]1O 2341401950 CIWPANUZUBYHSZ-HQDFOZKBSA-N 327.178 1.252 10 10 EDCE Cc1ccc(CN=c2[nH]c(Cl)nc(=N)[nH]2)c(O)c1Br 2352932681 PWTLQXXYURDLBM-UHFFFAOYSA-N 344.600 1.748 10 10 EDCE Cc1cc(N2CCOCC2)ccc1/C=C1\C(=O)N(C)C(=S)N=C1O 33457872 GTWKFWXDCLXGPX-UVTDQMKNSA-N 345.424 1.928 10 10 EDCE CNC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)C(C)C 178706777 IKFNLSUURYRGQD-INIZCTEOSA-N 328.416 1.990 10 10 EDCE COC(=O)c1ccc(/C=C2/SC(N3CCN(C)CC3)=NC2=O)cc1 33315131 ZTDTZAUIVVAQHA-SDNWHVSQSA-N 345.424 1.691 10 10 EDCE COc1cc(O)c2c(c1)C(=O)c1c(O)c(C)c(O)c(OC)c1C2=O 14647489 ZDNSTRKFXBMLND-UHFFFAOYSA-N 330.292 1.904 10 10 EDCE biogenic COC(=O)c1cc(C(=O)N2CCOc3cc(N(C)C)ccc32)c[nH]1 341351436 GGZKKPQMIWZJHA-UHFFFAOYSA-N 329.356 1.907 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N1CCN(CC(N)=O)CC1 700795624 CEZWKBCZJQDXDD-SNVBAGLBSA-N 342.237 1.319 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)[C@@H]1CCC[C@H]1O 709334095 UMISZWKBUMMLFW-RAIGVLPGSA-N 340.221 1.751 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc(Br)cnc1N(C)C 808517838 OSUZBPMTGNOVFA-UHFFFAOYSA-N 329.150 1.225 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@](C)(C3CC3)C2)cc1 826705992 DUMBBWQSVPAHHM-IBGZPJMESA-N 345.443 1.396 10 10 EDCE CS[C@@H]1CC[C@@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 822455352 DLJXVVAMABXUOC-JKSUJKDBSA-N 340.514 1.905 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN(CCO)C[C@H]2C)c([N+](=O)[O-])c1 829577018 IFIQDLJUPREYBQ-DIECRNLCSA-N 349.387 1.284 10 10 EDCE Cc1cc(CCNC(=O)[C@@H](O)C(C)(C)O)c(C)n1-c1ccccc1 900033057 SPPGGWFDJBAUDL-QGZVFWFLSA-N 330.428 1.885 10 10 EDCE COc1ncc(/C=C\C(=O)N2C[C@@H](CO)Cc3cccc(F)c32)cn1 911692338 OMGTYFMZXYZVDN-SZZPACECSA-N 343.358 1.835 10 10 EDCE Cn1c2c(ccc1=O)[C@H](NC(=O)C(=O)Nc1ccc(N)cc1)CCC2 846328909 LFFGMHAPOSJTRH-CQSZACIVSA-N 340.383 1.100 10 10 EDCE Cn1nc2c(c1CNCc1ccc(N3CCOCC3)cc1)COCC2 921582941 RYNTWDOOSYFCQY-UHFFFAOYSA-N 342.443 1.619 10 10 EDCE Cc1cc(CC(=O)NCC(C)(CO)CO)c(C)n1-c1ccccc1 854648928 MWNHOWYPGIHLIZ-UHFFFAOYSA-N 330.428 1.744 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](CO)CC3CC3)C2)cc1 852451961 RQZRGHLUVFPMCW-CABCVRRESA-N 333.432 1.734 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](NC(N)=O)C(C)(C)C)C2)cc1 855226645 RTZLGLJEUARUEG-IUODEOHRSA-N 348.447 1.473 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F 859993562 HZEAPIXDWCFVNT-ZWNOBZJWSA-N 330.258 1.870 10 10 EDCE C[C@@H](C(=O)NCc1c(O)cccc1F)N1C(=O)NC2(CCCC2)C1=O 928712769 ZBIIZQPJGOTJTI-JTQLQIEISA-N 349.362 1.401 10 10 EDCE CCO[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1 864984675 ZGRKGGUAMDFDAE-SJLPKXTDSA-N 348.443 1.581 10 10 EDCE Cc1cc(Cl)cc(CN(C)CCN2CCCS2(=O)=O)c1O 775735835 ZGZXHLWOAHGFHC-UHFFFAOYSA-N 332.853 1.821 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]2C1 897619164 PQAAUAFIXUYTQY-PHIMTYICSA-N 346.246 1.631 10 10 EDCE CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1cc(O)ccc1O 1153879639 SLEYSNROUBZVMS-INIZCTEOSA-N 326.352 1.692 10 10 EDCE Cc1cccc([C@H](CC(=O)NCc2cc(O)ccc2O)NC(N)=O)c1 1303223146 BZJAUBQDGXJSOB-HNNXBMFYSA-N 343.383 1.822 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)Cc2nonc2C)cc1C 1319557232 GQHQSSGCGXRKOK-CYBMUJFWSA-N 346.431 1.874 10 10 EDCE CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NCCCN=[N+]=[N-] 1963699268 OODOUAPDJJSBAX-LLVKDONJSA-N 326.401 1.354 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1CCC2(CCCC2)O1 1326860702 BYGBZLPCVCDOTI-OAHLLOKOSA-N 346.427 1.959 10 10 EDCE Cc1[nH]nc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1O 1463778861 OJJDSPXECRAXTA-UHFFFAOYSA-N 330.388 1.533 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCCN(CC(F)(F)F)CC1 1464502378 QLDGDUQVCYXCKD-UHFFFAOYSA-N 332.322 1.737 10 10 EDCE CO[C@@H]1COC[C@@H]1N(C)c1ccc(CN)c(Br)c1F 2120773114 CSYMUNRTQUUGDO-WDEREUQCSA-N 333.201 1.897 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cc[n+]([O-])cc2)cc1C 1716263343 BCYNYELHZNZLBS-ONEGZZNKSA-N 341.411 1.713 10 10 EDCE CNC(=O)N[C@H]1CCN(Cc2ccc(N3CCC(OC)CC3)cc2)C1 1559733687 UFYQHXYOUZSZPJ-INIZCTEOSA-N 346.475 1.805 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@@H](C)NC(=O)C=C(C)C)cc1 1497786332 AOQFCKFCZHNFCD-CYBMUJFWSA-N 344.419 1.231 10 10 EDCE CN(CCO)C[C@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1725058877 MZCFHDNUVFHCRF-CQSZACIVSA-N 333.392 1.378 10 10 EDCE COC(=O)c1cc(C(=O)NCc2cc(O)ccc2O)cc([N+](=O)[O-])c1 1644752457 GQOQZSFSJMVCIZ-UHFFFAOYSA-N 346.295 1.723 10 10 EDCE COc1cc(C(=O)NCc2c(O)cccc2O)cc2c1OCCO2 1645360889 NOAUQJHQXYSCEH-UHFFFAOYSA-N 331.324 1.808 10 10 EDCE COc1cc(N2CCN(C(=O)C(C)C)CC2)c([N+](=O)[O-])cc1OC 1651278364 OQKYYWIAOPVPJT-UHFFFAOYSA-N 337.376 1.917 10 10 EDCE CC(C)(C)C(=O)NC1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169878126 QSCRMKMMKCLOKQ-UHFFFAOYSA-N 336.388 1.570 10 10 EDCE O=C1Nc2cc(N3CC[C@@](F)(CO)C3)c(Br)cc2[C@@H]1O 1917136829 WTDMJMNLQXYJHT-AAEUAGOBSA-N 345.168 1.345 10 10 EDCE CN(C)C[C@H]1COC[C@H]1NCc1cccc(Br)c1O 2141466762 UGMPFDJDDLNYMP-WCQYABFASA-N 329.238 1.821 10 10 EDCE C[C@H](O)[C@@H](N)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952122392 UMECTTMHYOZGMB-NURSFMCSSA-N 326.393 1.242 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)N2CC(N=[N+]=[N-])C2)C1 1985100114 DCTNZOFMPPYICS-NSHDSACASA-N 325.369 1.534 10 10 EDCE NCc1ccc(N2CCC(OCC(N)=O)CC2)c(Br)c1 2145379426 LNZUCTQFYGZLBT-UHFFFAOYSA-N 342.237 1.379 10 10 EDCE C[C@H](CNC(=O)COc1ccc(N)cc1)CNC(=O)OC(C)(C)C 1999131735 LLXUZSLUXJEYCB-GFCCVEGCSA-N 337.420 1.925 10 10 EDCE Cn1ncc(C(=O)NCCOc2ccc(N)cc2)c1Br 379193187 ZJZJNSREDKSQPO-UHFFFAOYSA-N 339.193 1.574 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCN4CC[C@H]3C4)c(Br)cc21 381772561 JSVHIQJDJPBKNT-ISVAXAHUSA-N 337.221 1.295 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H]3CCN3C3CCCC3)c2n1 2063557782 GPSNATPYSCMMHG-ZDUSSCGKSA-N 329.404 1.490 10 10 EDCE CS(=O)(=O)c1cnn(Cc2cc(F)ccc2O)c1Br 2070220882 FNZCFTPLQKGDOB-UHFFFAOYSA-N 349.181 1.942 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H]4[C@@H](O)C[C@H]43)c(Br)cc21 2178170612 XFUDEJQRANFMOX-MPMACKMQSA-N 338.205 1.361 10 10 EDCE Cc1ccc(N(C)C(=O)C2=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C2)cn1 2080944481 YNFMUKWJJCMZEO-GJZGRUSLSA-N 347.415 1.937 10 10 EDCE O=C1C[C@H]2CCN(Cc3c(O)cccc3Br)C[C@@H]2N1 2088806653 RWEGELXWMQQNDB-SKDRFNHKSA-N 325.206 1.865 10 10 EDCE Cc1cc(O)ccc1NS(=O)(=O)c1cc(Br)nn1C 2089753094 PMLABQINKXDDKD-UHFFFAOYSA-N 346.206 1.997 10 10 EDCE O=C(O)[C@@H]1[C@H]2OCCN(Cc3cc(Br)ccc3O)[C@H]12 2092840761 HYFTZFJWTNFUKA-QJPTWQEYSA-N 328.162 1.439 10 10 EDCE CC1(C)C[C@H](COc2nnc(=N)[nH]n2)CN(C(=O)OC(C)(C)C)C1 2213784661 DTUMHONNHCJAGF-JTQLQIEISA-N 338.412 1.341 10 10 EDCE Cc1ccc(CN(C)S(=O)(=O)NC2CC2)c(O)c1Br 2352933020 VDJGMKHZLNARKX-UHFFFAOYSA-N 349.250 1.892 10 10 EDCE Nc1ccc(N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1 8031013 YYHUAISAFQVISM-UHFFFAOYSA-N 335.404 1.919 10 10 EDCE COCCN1CCC[C@H]1CNC(=O)NCc1ccc(N(C)C)cc1C 115825993 XSWMNLVICLIXCO-SFHVURJKSA-N 348.491 1.971 10 10 EDCE COc1cc(O)c(CN2Cc3ccccc3C[C@H]2C(N)=O)cc1OC 179602210 IDCNNDINCLGFKK-HNNXBMFYSA-N 342.395 1.822 10 10 EDCE COCCNC(=O)c1ccccc1NC(=O)Cc1ccc(N)cc1 66153912 MHEVKCLGTKSTTE-UHFFFAOYSA-N 327.384 1.826 10 10 EDCE O=C(O)[C@H]1CC[C@@H](c2cc(I)ccc2O)N1 309494971 KNIMVKOUFUYVBY-DTWKUNHWSA-N 333.125 1.875 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCCn3ccnn3)CC2)cc1 183557626 IMJYCJAFXATDJQ-UHFFFAOYSA-N 344.419 1.209 10 10 EDCE O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1cccc(O)c1O 280442300 KLUNFJJQBGWSGP-UHFFFAOYSA-N 347.346 1.399 10 10 EDCE Cc1ccc(CN2C[C@H]3OCCN(C)[C@@H]3C2)c(O)c1Br 2381142232 JSSCLZPUQNROFI-CHWSQXEVSA-N 341.249 1.978 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)CCC[C@@H]2CCOC2)c1 827199848 GFPHGVDMVZHRLF-GFCCVEGCSA-N 329.418 1.637 10 10 EDCE COCCN1CCC[C@@H]1CNC(=O)NCc1cc(OC)ccc1O 734069468 MALHMUGKMZIFBA-CQSZACIVSA-N 337.420 1.311 10 10 EDCE COCC1(CNC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 847296278 ZZXUARCDDKMWNI-UHFFFAOYSA-N 333.432 1.749 10 10 EDCE COCC1(CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 848937346 NTZHUUZSGSYWHH-CYBMUJFWSA-N 333.432 1.473 10 10 EDCE CCON(C)C(=O)CNC(=O)NCc1ccc2c(c1)CCCN2C 844935782 VQFYPGZTDPGGAR-UHFFFAOYSA-N 334.420 1.278 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@]23CNC[C@H]2COC3)cc1 846673795 WYILDUYSFRXYOB-LPHOPBHVSA-N 331.460 1.727 10 10 EDCE Cc1cc(C)n([C@@H](C)C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)n1 844163297 XQSCEFNSLCBLQU-YOEHRIQHSA-N 329.448 1.943 10 10 EDCE CO[C@@](C)(CO)CNC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 847386091 SABYEWCCOWMHDC-KBXCAEBGSA-N 337.464 1.689 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C3CCN(C(C)=O)CC3)C2)cc1 855230375 VUMGMWWSMAGKPO-MRXNPFEDSA-N 345.443 1.649 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)C=C3CCNCC3)C2)cc1 852894431 WBSBVTJBAHJXDX-INIZCTEOSA-N 329.444 1.948 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H](C[C@@H]3CCCO3)C2=O)cc1F 924544297 XUAKDUVCAJSJGF-GXTWGEPZSA-N 335.379 1.881 10 10 EDCE Cc1cc(C2(C(=O)NCCc3ccc(O)c(O)c3)CCOCC2)on1 860235328 RMRPRSCNPFOSGA-UHFFFAOYSA-N 346.383 1.801 10 10 EDCE Cc1cn2c(n1)C[C@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)CC2 860697432 WKQCHAMGJUQAEH-BXUZGUMPSA-N 329.400 1.913 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@H](C)NC2)cc1 861767587 SXMDXMXNQSHEPB-GOEBONIOSA-N 346.475 1.406 10 10 EDCE COc1ccc(N2CCN(C(=O)CNc3cc(OC)n[nH]3)CC2)cc1 863357073 UBLOPGCSXZTLFH-UHFFFAOYSA-N 345.403 1.188 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@@H](OC)C(=O)OC(C)(C)C)c1 866765679 YPEHKQSWDDWINM-IINYFYTJSA-N 339.388 1.935 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCC[C@H](C(F)(F)F)C3)nc12 872163045 UIHWMWMTORDCAE-QMMMGPOBSA-N 344.293 1.907 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)NCc1cc(F)cc(F)c1O 1876251053 CTFFNFJNRBSDSQ-NSHDSACASA-N 332.347 1.646 10 10 EDCE CC(C)(C)NS(=O)(=O)C1(CNCc2cc(F)ccc2O)CC1 895614965 XFKVCEBAFLYXQY-UHFFFAOYSA-N 330.425 1.871 10 10 EDCE C[C@@H](NCc1ccc(N2CCOCC2)cc1)C1(S(C)(=O)=O)CC1 796493181 WEAVNRHPRWFYAI-CQSZACIVSA-N 338.473 1.579 10 10 EDCE Cn1nc(-c2ccncc2)cc1C(=O)NCCc1ccc(O)c(O)c1 1150488386 QYNOPHAXGUFAOQ-UHFFFAOYSA-N 338.367 1.866 10 10 EDCE CCCNC(=O)CCn1c(C)nnc1N(C)Cc1ccccc1O 1313475528 DRDVYTAATMWFCA-UHFFFAOYSA-N 331.420 1.845 10 10 EDCE CN(C)c1ccc(CNc2cn3nc(N)nc3cc2C(=O)O)cc1 82729831 DDZJEPRIMQLLGV-UHFFFAOYSA-N 326.360 1.688 10 10 EDCE CN(CC[S@](C)=O)c1cc2c(cc1Br)[C@H](N)C(=O)N2 399049374 XGPGZQMQLKLRAZ-WLRWDXFRSA-N 346.250 1.216 10 10 EDCE C[C@H](NC(=O)C1CC2(C1)CS(=O)(=O)C2)c1ccc(N(C)C)cc1 1263777685 TWWCEESLRAUPBQ-LBPRGKRZSA-N 336.457 1.755 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cc2cnn(C)c2)cc1C 1273901985 XBVUAWGSRWNTPH-SNAWJCMRSA-N 342.443 1.742 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H](CO)NCCC2CC2)cc1 1278203254 ZMLYKCZYOSIPSH-CQSZACIVSA-N 333.392 1.329 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1nc(-c2ccncc2)n[nH]1 1451587284 AEGSQZPAQKNHIQ-UHFFFAOYSA-N 325.328 1.137 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H](C)n2cccc2)cc1C 1715583102 VTWYDUGHNYMOID-WBVHZDCISA-N 345.443 1.633 10 10 EDCE CCn1ncc(C(=O)N[C@H](C)CCNCc2ccc(OC)c(C)c2)n1 1716138177 ZUFMJHOHBYIMTL-CQSZACIVSA-N 345.447 1.913 10 10 EDCE COCCN(CCOC)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1559053718 FNAYLSDBPZTHIR-ALCCZGGFSA-N 338.360 1.880 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H](CO)Cc1ccc(F)cc1 1631598209 KLBWMMXENDUFTF-AWEZNQCLSA-N 333.359 1.747 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]([C@@H]1CCCO1)C1(CO)CCC1 1639166779 FPJONNMJYPXUBR-RDJZCZTQSA-N 335.400 1.467 10 10 EDCE CC(C)CCNC[C@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1732668332 YBSAPOGACWUFPS-AWEZNQCLSA-N 335.408 1.575 10 10 EDCE CNc1ccc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)nc1 1644526746 VYTARBPFJXFJNR-UHFFFAOYSA-N 339.443 1.805 10 10 EDCE COC1CCN(c2ccc(CN3C[C@@H](CCO)[C@@H](CO)C3)cc2)CC1 1655900524 XKRZNSFFOVJCPW-QZTJIDSGSA-N 348.487 1.725 10 10 EDCE C=CC(=O)Nc1ccc(O)c(C(=O)NCc2cc(O)ccc2O)c1 1593882059 PTLSYNYOUHKTBX-UHFFFAOYSA-N 328.324 1.858 10 10 EDCE Cc1c([C@@H](NCCCN=[N+]=[N-])C(=O)O)c(Br)nn1C 2131552173 PAIIQWPMTHEYHX-MRVPVSSYSA-N 331.174 1.907 10 10 EDCE CN(C)C[C@H]1C[C@H](O)CN1c1ccc(CN)c(Br)c1F 231840235 FNJYBHBMNSXFFY-MNOVXSKESA-N 346.244 1.548 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)cc1Br 2140663739 PIEOMJKLILKFAE-HPXOCHMKSA-N 334.185 1.382 10 10 EDCE CO[C@H](CO)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951699255 QWRIWCJCAWTDDG-SMDDNHRTSA-N 327.377 1.541 10 10 EDCE O=C1Nc2cc(N3CC[C@H](O)[C@H](F)C3)c(Br)cc2[C@H]1O 2144566451 LJNWEDCEEHWNSV-JFUSQASVSA-N 345.168 1.344 10 10 EDCE C[C@H](N)c1ccc(N2CCC(O)(CO)CC2)c(Br)c1 314418599 QJENUYVCHSOSNF-JTQLQIEISA-N 329.238 1.792 10 10 EDCE CCCNCc1ccc(N2C[C@@H](CO)[C@@H](O)C2)cc1Br 316619708 XJHWAXAZINMJIB-WFASDCNBSA-N 343.265 1.738 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)CC[C@@H]3O)c(Br)c1 2161354908 PGZFVKXBMXNEGC-ZQDZILKHSA-N 341.249 1.761 10 10 EDCE O=C(O)[C@@H]1OCC[C@H]1CNCc1cc(Br)ccc1O 716163952 HNPZZLXNACXZGL-QPUJVOFHSA-N 330.178 1.734 10 10 EDCE CC(C)(C)OC(=O)N1CCN(Cc2cc(N)ccc2O)[C@@H]2COC[C@@H]21 2068826770 OTAOLUBKUZBGCN-CABCVRRESA-N 349.431 1.795 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](C(=O)O)N1CCCc2cc(CN)ccc21 2078702211 DKMBKGJYXJKERU-OAHLLOKOSA-N 349.431 1.876 10 10 EDCE NCc1ccc(N2C[C@H]3CS(=O)(=O)C[C@H]3C2)cc1Br 2087858564 OAEQMCJEXSDHBO-PHIMTYICSA-N 345.262 1.389 10 10 EDCE NCc1ccc(N2C[C@@H]3CCO[C@]3(CO)C2)c(Br)c1 2231371525 MFHPKCKCEIJGSN-FZMZJTMJSA-N 327.222 1.495 10 10 EDCE C[C@@H]1O[C@]2(C(=O)N(C)CCN=[N+]=[N-])C[C@@]1(NC(=O)OC(C)(C)C)C2 2247287599 PNVADDMIPBEXSA-LKTVYLICSA-N 339.396 1.970 10 10 EDCE Cc1cc(C=C2C(=O)NC(=S)N(C)C2=O)c(C)n1C[C@H]1CCCO1 2313630106 JLLZGRBBBPZPOO-CYBMUJFWSA-N 347.440 1.540 10 10 EDCE CO[C@@H](CNCCc1ccc(O)c(O)c1)CNC(=O)OC(C)(C)C 2307259868 NMPCTWKAECMKKH-ZDUSSCGKSA-N 340.420 1.770 10 10 EDCE Cc1ccc(CN2CCS(=O)(=O)CC2)c(O)c1Br 2327566450 CEYLBNOZTFGUHV-UHFFFAOYSA-N 334.235 1.694 10 10 EDCE C[C@@H](N)c1ccc(N2CC3(COC(=O)N3)C2)c(Br)c1 2351882955 MGEDUBGNFDKIQG-MRVPVSSYSA-N 326.194 1.767 10 10 EDCE CO[C@@H](C)[C@H](N)C(=O)NCc1ccc(C)c(Br)c1O 2352950273 QCAJBRGPDNUSJM-KWQFWETISA-N 331.210 1.442 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCO[C@@H](CN(C)C)C2)c([N+](=O)[O-])c1 105796404 ODPZMRXLVLUWMD-DYLGSBMWSA-N 349.387 1.548 10 10 EDCE c1cc2c(cc1CNC[C@@]1(N3CCOCC3)CCSC1)CCO2 67218373 LXSDXCKEYRKLRB-SFHVURJKSA-N 334.485 1.919 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1C[C@H]2CC[C@@H]1O2 73108090 ZBIWGITWCJPBBJ-RKVPGOIHSA-N 348.418 1.971 10 10 EDCE Cc1nn(C)c(C)c1S(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1 133736757 KDMKLHYEWGSISW-UHFFFAOYSA-N 326.334 1.452 10 10 EDCE CC(C)n1cnc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c1 133732064 UTIYMLDYVVKXGG-UHFFFAOYSA-N 326.334 1.879 10 10 EDCE Cc1cc(C(=O)N2CCOC[C@H]2C(N)=O)c(C)n1-c1ccc(F)cc1 91784173 HHSMDHCUQLKBRK-INIZCTEOSA-N 345.374 1.560 10 10 EDCE COc1ccc(O)c(CNC[C@]2(CO)COCC3(CCC3)N2C)c1 529645186 RIVVHGWXLBNRJM-SFHVURJKSA-N 336.432 1.106 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cn[nH]c1 270174980 CXMDUXZOMYETPI-LBPRGKRZSA-N 347.394 1.946 10 10 EDCE C[C@H](CN(C)C)N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2379882475 LQHUWWPJJHJJHA-AMIZOPFISA-N 341.253 1.787 10 10 EDCE CCNCc1ccc(N2CC3(COC(=O)N3)C2)cc1Br 2379977616 WHAHQYONXDXGQK-UHFFFAOYSA-N 340.221 1.857 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@@H](O)c2nn(C)cc2Br)cc1 2163148568 YWCDLVALHORUAQ-TZMCWYRMSA-N 339.237 1.982 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@@H]2C(N)=O)cc1Br 723202475 VLOUENOLVKKJDM-QPUJVOFHSA-N 328.210 1.159 10 10 EDCE CCOc1ccc(CN2CCS(=O)(=O)[C@H]3CCC[C@@H]32)c(O)c1 825201368 JYQQRQGPSARCHO-HOCLYGCPSA-N 325.430 1.942 10 10 EDCE COC(=O)C[C@H]1C(=O)NCCN1C/C=C/c1ccc(N(C)C)cc1 835026494 YFAPCOHQBHNZPS-APHBUQMISA-N 331.416 1.129 10 10 EDCE C/C=C/[C@@H](O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 901288641 YOKZUAYWHKFVNT-LSTKMXGYSA-N 343.471 1.772 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3cccnn3)C2)cc1 852280459 ILMXQHZBNPLXCW-CQSZACIVSA-N 327.388 1.563 10 10 EDCE COCCOCCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852008855 JBHWWOPSBFKJER-CQSZACIVSA-N 337.420 1.236 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1C1CC1 859960448 PQQDZVBJNXEYIA-DLBZAZTESA-N 329.396 1.846 10 10 EDCE O=[N+]([O-])c1cc(NS(=O)(=O)c2ccc3c(c2)OCO3)ccc1O 753519841 BXAUBGFTLDKKOG-UHFFFAOYSA-N 338.297 1.830 10 10 EDCE CS(=O)(=O)CC1(CCNCc2cc3c(cc2O)OCO3)CC1 850344926 BTVFQNQTUZGPPQ-UHFFFAOYSA-N 327.402 1.425 10 10 EDCE COc1ccc(N2CCN(CCc3nnc(C)o3)CC2)c(OC)c1 931530479 HCVPTXYNXOXLSC-UHFFFAOYSA-N 332.404 1.760 10 10 EDCE COc1cc(O)c(CN[C@@H]2CCO[C@@H]2c2nc(C)no2)cc1OC 862544116 SRESMQKJZORCQI-ABAIWWIYSA-N 335.360 1.721 10 10 EDCE O=C(C(=O)N1CCOC[C@H]1c1ccco1)N1Cc2cccc(O)c2C1 1119004702 BPGGNOCTDZQDQI-AWEZNQCLSA-N 342.351 1.428 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CCn4c(O)nnc4C3)ccc21 1118592302 KDOBCNMBRNLKFQ-UHFFFAOYSA-N 342.403 1.092 10 10 EDCE Nc1cccc(Br)c1N[C@H]1CCNCC[C@H]1C(=O)O 1876304237 KZZKYYAFDHHCAX-KCJUWKMLSA-N 328.210 1.896 10 10 EDCE Cn1cc(S(=O)(=O)NCc2cc(Br)ccc2O)cn1 796190202 BXLTXTYIQFWKSO-UHFFFAOYSA-N 346.206 1.367 10 10 EDCE CO[C@@](C)(C(=O)NCc1ccc(O)cc1O)C(=O)OC(C)(C)C 1142534037 XDPMGJZZEMIFEB-INIZCTEOSA-N 325.361 1.461 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@@H]3[C@H]4COC[C@H]43)CC2)cc1 792963947 SQXYTEYUTLHJCQ-FVQHAEBGSA-N 331.416 1.608 10 10 EDCE COc1cccc2c(C(=O)NCCc3ccc(O)c(O)c3)cnn12 1150488943 YZKZUZQPZWNYJB-UHFFFAOYSA-N 327.340 1.727 10 10 EDCE CNC(=O)c1ccc(S(=O)(=O)Nc2cccc(N(C)C)c2)cc1 1191619541 RAJKBWAYWNDHFN-UHFFFAOYSA-N 333.413 1.913 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1C[C@H]1C1CC1 1323327102 PNPXGHDIHAFXMF-DLBZAZTESA-N 325.412 1.594 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCOC[C@@H]1C 1323276777 FMICPNYQPMAFNP-XJKSGUPXSA-N 333.432 1.218 10 10 EDCE CO[C@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 1325972301 UTEJHBMVEWSMRB-CVEARBPZSA-N 345.443 1.369 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccccc2O)cc1C 1331685033 RGPHASDJKUAYTD-HNNXBMFYSA-N 344.411 1.590 10 10 EDCE O=C1CCN(c2nnc(-c3sccc3O)n2CC2CC2)CCN1 1346098168 BNEBCGYSQUFEEF-UHFFFAOYSA-N 333.417 1.449 10 10 EDCE CCOCCC(=O)NCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1355518510 YERSEPOFCXBEEB-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE Cc1noc(C[C@@H]2CCCN(C(=O)Cc3ccc(O)c(O)c3)C2)n1 1472147828 UVNCAEBLAKPRII-ZDUSSCGKSA-N 331.372 1.813 10 10 EDCE COc1ccc(CNCc2nnc(Br)n2C)c(O)c1 2121515993 YYZAKDBMZKSWKA-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE COc1ccc(C(=O)NCCNC(=O)Cc2ccc(O)c(O)c2)cc1 1626124508 CKKIQZVAVHNQEC-UHFFFAOYSA-N 344.367 1.195 10 10 EDCE Cn1nncc1CCNCc1cc(Br)cc(F)c1O 2123265981 CDCPEZXAUKJWLD-UHFFFAOYSA-N 329.173 1.755 10 10 EDCE COC[C@@H](C)N(C)[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1725199355 BMCBRBQCQWUWGM-NWDGAFQWSA-N 335.408 1.934 10 10 EDCE O=C1CC[C@H](c2ccc(C(=O)NCc3cccc(O)c3O)cc2)N1 1637046262 NMNOZMCCPMZYIZ-CQSZACIVSA-N 326.352 1.979 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@]2(C)CCN(C(C)=O)C2)cc1 1724189123 LSDDMLTYFXAKIJ-KRWDZBQOSA-N 344.419 1.019 10 10 EDCE CCOCC(=O)N[C@@H](C)[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1725913564 ZPAZOIUFFPEOMQ-QWRGUYRKSA-N 349.391 1.509 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@]23CCCC[C@@H]2NC(=O)C3)cc1 1653503676 RVWHZKBAUKCPEL-BLLLJJGKSA-N 329.360 1.780 10 10 EDCE CN(C)c1ccc(CN(C(=O)NC[C@H]2CNC(=O)C2)C2CC2)cc1 1774157491 GOASEQQVCFLAIJ-CQSZACIVSA-N 330.432 1.563 10 10 EDCE CN(Cc1ccccc1O)c1nnc([C@@H]2CCOC2)n1CC1(O)CC1 1696701186 WNAFDDCHDYFJKJ-CQSZACIVSA-N 344.415 1.649 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@@H]2COC(=O)C2)cc1C 1699402485 SAPMGYXOWDOURF-ZFWWWQNUSA-N 334.416 1.551 10 10 EDCE CN1CCc2cc([C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccc21 1917191326 RIOXYDSDQOVKDL-KBPBESRZSA-N 336.388 1.690 10 10 EDCE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@H](CO)NC(=O)OC(C)(C)C 1968793432 XCZMLDOPQJDXJX-WCQYABFASA-N 338.404 1.797 10 10 EDCE CNCc1ccc(N2CCSC[C@H]2S(C)(=O)=O)cc1Cl 234371208 MTTOUOWFRDZXMZ-CYBMUJFWSA-N 334.894 1.983 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(N)cc2)[C@@H](CO)C1 2005085287 NYJFRLNJQDHQMN-ZBFHGGJFSA-N 335.448 1.976 10 10 EDCE C[C@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)Cc1ccc(N)cc1 1977701573 WJUJAINXVWWPFK-LLVKDONJSA-N 343.449 1.601 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985099719 AWFFHYWPECTCTE-MXWKQRLJSA-N 327.385 1.419 10 10 EDCE COc1ccc(O)c(CN[C@H](CO)CNC(=O)OC(C)(C)C)c1 1985776857 CWWWRKMQBPHUBP-LBPRGKRZSA-N 326.393 1.376 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(O)c(O)c2)[C@@H]2C[C@H]21 2006285579 YMAUHYFJVWWBIF-VXGBXAGGSA-N 334.372 1.932 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3OCCN(C)[C@@H]3C2)cc1Br 2153995289 QEKPOECYLYAJLZ-KMUNFCNLSA-N 340.265 1.988 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)N2CCC[C@H]2CN=[N+]=[N-])COC1 2010401308 CUNUOZZIJKUNLD-NSHDSACASA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(F)cc(F)c2O)[C@H](O)C1 2011488459 WUJYLAVVAQMTPB-QWHCGFSZSA-N 344.358 1.740 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CC(C(=O)NCCCCN=[N+]=[N-])=C[C@@H]1O 2014507790 XRGBFCWAZZEEQC-RYUDHWBXSA-N 339.396 1.777 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)C[C@H](O)COCc1ccccc1 2038122484 HBGXGSYIZUCCEQ-SFHVURJKSA-N 343.427 1.134 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4C[C@@H](O)[C@H]3C4)c(Br)cc21 2177159341 LRDICHARJIJKQR-GNNHTFIESA-N 338.205 1.361 10 10 EDCE CN(C(=O)Cn1cncc(Br)c1=O)c1ccc(N)cc1 90764434 ISIDWUZNEINVCQ-UHFFFAOYSA-N 337.177 1.251 10 10 EDCE CN[C@H](C)c1ccc(N2CC(O)(C(=O)OC)C2)c(Br)c1 714438010 ADIIEMAYWWOEEI-SECBINFHSA-N 343.221 1.454 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCOCC4(CCCC4)C3)c2n1 2065226725 NDRUEHJXXPYMIJ-UHFFFAOYSA-N 330.388 1.776 10 10 EDCE COCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 878559787 RQENMIGAKIUVRH-ZDUSSCGKSA-N 338.404 1.938 10 10 EDCE CN(C)C[C@@H]1CN(c2ccc(CO)c(Br)c2)CCO1 2113972437 ZSAHMTGWXGXEDV-CYBMUJFWSA-N 329.238 1.708 10 10 EDCE OCc1ccc(N2C[C@@H]3CCO[C@]3(CO)C2)c(Br)c1 2231313528 KRXLTYOYJZFWHW-FZMZJTMJSA-N 328.206 1.529 10 10 EDCE OC[C@@H]1NC[C@@H]2CN(Cc3cc(Br)cc(F)c3O)C[C@@H]21 2235576894 UZLLEXZVMVEEBV-CDMKHQONSA-N 345.212 1.306 10 10 EDCE O=C(c1ccc(O)c(O)c1)N1CCC[C@@H](NC(=O)C(F)(F)F)CC1 2258224673 DWWVGRVKMNEGAG-SNVBAGLBSA-N 346.305 1.771 10 10 EDCE CC(C)(C)OC(=O)N1CC(N2CC(C(=O)N3CC(N=[N+]=[N-])C3)C2)C1 2248527714 AXFJNLHFJYRCRJ-UHFFFAOYSA-N 336.396 1.059 10 10 EDCE C[C@H]1CN(Cc2ccc(Br)cc2O)CC2(CNC2)O1 2272928327 ADDMOALNAUWCCV-JTQLQIEISA-N 327.222 1.717 10 10 EDCE COC(=O)C(C)(C)CS(=O)(=O)NCc1cnc(SC)s1 2290056512 MVTSIBMLUNANGU-UHFFFAOYSA-N 338.476 1.484 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N=c1ccn(CC(F)(F)F)[nH]1 2308001894 AGIKDZKPGGLIIO-UHFFFAOYSA-N 327.262 1.930 10 10 EDCE CC(=O)N(C(=O)NCCNC(=O)OC(C)(C)C)c1ccc(N)cc1 217263559 FQMDCAKVMGQXLE-UHFFFAOYSA-N 336.392 1.856 10 10 EDCE Oc1cc2c(cc1CN1CCN(c3ccc(F)cn3)CC1)OCO2 91589228 IWHFWBYDSDWWGJ-UHFFFAOYSA-N 331.347 1.977 10 10 EDCE Cc1ccc(CNC(=O)[C@]2(CN)CCCO2)c(O)c1Br 2380746586 VTZFEGJCGPMLGK-CQSZACIVSA-N 343.221 1.587 10 10 EDCE Cc1ccc(CN2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(O)c1Br 2380804212 LBNQUONOGCUAFL-PBUVFVDJSA-N 342.233 1.779 10 10 EDCE CC(=O)C(=O)COC(=O)CCCCN1C(=O)c2ccccc2C1=O 808541603 ZSSNMCGDUKWUFU-UHFFFAOYSA-N 331.324 1.154 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)C[C@@H]1CCCO1 297733371 FSRSOIDYOSNFLG-KRWDZBQOSA-N 347.459 1.739 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CCC3(O)CCC3)CC2)cc1 905875494 PNERHBRHYVQUQN-KRWDZBQOSA-N 334.460 1.873 10 10 EDCE CC(C)[C@H](O)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 823548147 IKNACBVANQFEPT-QGZVFWFLSA-N 335.448 1.464 10 10 EDCE C[C@H](NC(=O)[C@@H]1CCN=C2C1=NNN2C)c1ccc(N(C)C)cc1 832431233 LWGAYKVLEYHZKD-SMDDNHRTSA-N 328.420 1.154 10 10 EDCE C[C@@]1(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CCCO1 837709076 ZOHHTUKQHXBKQR-KRWDZBQOSA-N 340.370 1.987 10 10 EDCE COC(=O)/C(C)=C/CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 923183008 JXDNHWQKYIMUJZ-MAUPQMMJSA-N 347.415 1.692 10 10 EDCE C[C@H]1[C@@H](N)CCN1C(=O)NCc1ccc(N2CCSCC2)cc1 841707035 MBGHQCJDWUZQHO-BBRMVZONSA-N 334.489 1.871 10 10 EDCE C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCS1 929238038 VNHMGKKZVPDDPT-TZMCWYRMSA-N 335.473 1.769 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NC[C@H](OC)[C@@H]2CCOC2)c1 852440841 VMHSPQMTTBRUJJ-OZVIIMIRSA-N 338.404 1.813 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CO)CC(C)C)C2)cc1 852450436 MHJXVGNBHKIYQJ-LSDHHAIUSA-N 335.448 1.980 10 10 EDCE CCn1nc(C)cc1NC(=O)C(=O)NCc1cc(OC)ccc1O 861747687 VLSQEXJUKVUWIS-UHFFFAOYSA-N 332.360 1.181 10 10 EDCE O=C1OC[C@@]2(CNCc3cc(Cl)c(F)cc3O)COCCN12 872260868 FRZYYCGDQRYQPE-CQSZACIVSA-N 330.743 1.496 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCn3ncnc3C2)c([N+](=O)[O-])c1 770222467 PBVPEEBFWVVTBX-HYXAFXHYSA-N 329.316 1.393 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 889327413 LVAVLNBCHUANRR-DVOMOZLQSA-N 347.415 1.382 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)N[C@@]23COC[C@@H]2C3)N(C)C)cc1 899098030 KQVXZFUJFUUNPQ-ZVZYQTTQSA-N 332.448 1.443 10 10 EDCE O=C(Cn1cc([N+](=O)[O-])cn1)NCc1ccc2cccnc2c1O 1162607282 MGYPVTVHLJSYBA-UHFFFAOYSA-N 327.300 1.362 10 10 EDCE CCN(CC)c1ccc([C@H]2NC(=S)NC(C(=O)O)=C2OC)cc1 76260616 ZYLMQIANAJSHGG-GFCCVEGCSA-N 335.429 1.994 10 10 EDCE CCN(CC(=O)NC)Cc1c(Br)ccc(OC)c1O 1964546180 RFMXTBZHJDNVPG-UHFFFAOYSA-N 331.210 1.731 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C[C@H]2COC(=O)C2)cc1C 1321024903 OXIOWYZJFMTYCR-QDLOVBKTSA-N 346.427 1.719 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2C[C@H]3[C@@H](C2)C3(F)F)c1 1331247336 LJJMBZVWQHMXMU-GUDFOSOFSA-N 346.355 1.537 10 10 EDCE COc1cc(C(=O)N[C@H](C)CCNC(=O)C2CCCC2)cc(OC)n1 1355045003 BEBOZYWCHPZDBW-GFCCVEGCSA-N 349.431 1.914 10 10 EDCE COc1ccc(CNC(=O)CCc2ccc(C(N)=O)cc2)c(O)c1 1448371157 HPUMBUYRBWQVOY-UHFFFAOYSA-N 328.368 1.749 10 10 EDCE O=C(CN1C(=O)COc2ccccc21)NCc1c(O)cccc1F 1456101563 SLOWCBRQTPYZLF-UHFFFAOYSA-N 330.315 1.573 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@H]2CC23CCC3)cc1C 1700807894 IETGNKAPSMAVRU-JKSUJKDBSA-N 332.444 1.761 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCc1nc(N)n[nH]1 1637751679 BWJVDVFHFHCGQM-NSHDSACASA-N 331.424 1.192 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)Cn2ccnc2)cc1C 1498660127 BPBUZDCRXZQDCW-UHFFFAOYSA-N 330.432 1.838 10 10 EDCE COC(=O)c1ncoc1COCC(=O)N[C@H](C)c1ccccc1O 1642827421 IFYZCHSQOODDSJ-SNVBAGLBSA-N 334.328 1.561 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@@H](O)C2(C)C)cc1Br 2124803258 UQYPIBXBGAZKHV-AQUOVQTQSA-N 330.222 1.823 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@@H](O)C2(C)C)c(Br)c1 2124799975 JGHGNYOVVNNBEM-OXHMUOHRSA-N 329.238 1.789 10 10 EDCE O=C1C[C@@H](CNC(=O)NCc2cccc(Br)c2O)CN1 1683162194 YFSCWZLWKUJUCL-MRVPVSSYSA-N 342.193 1.090 10 10 EDCE CC1(C)C[C@H](O)[C@@H](O)CN1c1ccc(CN)c(Br)c1 2132116376 PWSXFJAMZDVPEU-STQMWFEESA-N 329.238 1.618 10 10 EDCE CC1([C@H]2CCCCN2S(=O)(=O)Cc2ccc(N)cc2)OCCO1 2145810124 SUDDIAJWKNKRRE-OAHLLOKOSA-N 340.445 1.716 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2NCc1ccc(O)c(O)c1O 400641488 OACFWSKOMBGCHE-NTZNESFSSA-N 336.388 1.901 10 10 EDCE CCCn1cc(CNC(=O)c2cnn3c(O)cc(C)nc23)c(C)n1 2064972658 WKKUNHSOIFKNKL-UHFFFAOYSA-N 328.376 1.588 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC=C(CO)CC3)c(Br)cc21 2171003220 WXSSAZSUCJZXGD-ZDUSSCGKSA-N 338.205 1.530 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(Br)c1 2182554624 SENBRMLAJNFQGC-MUVVKYGDSA-N 341.249 1.647 10 10 EDCE CNCc1ccc(N2CC[C@](C)(O)[C@](C)(O)C2)cc1Br 2194611558 UJJUVQUGXMEBFO-LSDHHAIUSA-N 343.265 1.881 10 10 EDCE Cn1[nH]c(CNC(=O)OC(C)(C)C)nc1=NCc1ccc(O)cc1O 2063130409 LPVIHYRHCGGWNX-UHFFFAOYSA-N 349.391 1.285 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3OCCO[C@@H]3C2)cc1Br 2093343061 BHBZQASZBBBYRP-BETUJISGSA-N 331.185 1.651 10 10 EDCE CC(C)(C)OC(=O)N1CCCC(C)(C)[C@H]1COc1nnc(=N)[nH]n1 2213781942 YSWJRMAAGNJMRP-SNVBAGLBSA-N 338.412 1.484 10 10 EDCE COc1ccc(Br)c(CN(C)C[C@@H]2CNCCO2)c1O 2236031905 JIURIQFKWBWHKO-JTQLQIEISA-N 345.237 1.584 10 10 EDCE C[C@H]1O[C@]2(C(=O)NCCN=[N+]=[N-])C[C@@]1(NC(=O)OC(C)(C)C)C2 2243119516 NGRKULVMQXOSLW-OWYVNGRQSA-N 325.369 1.628 10 10 EDCE O=C(O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2cccnc2)SC1=S 2294871903 DWQANUCFCDJFST-QMMMGPOBSA-N 338.366 1.211 10 10 EDCE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=CNN1CCCCCC1 2296936040 VTOUDLJQQOGHQC-UHFFFAOYSA-N 346.362 1.673 10 10 EDCE CN(C(=O)/C=C\c1cncc(O)c1)c1ccc(N2CCOCC2)nc1 492478946 XPDMUKWAQZMZKO-DJWKRKHSSA-N 340.383 1.695 10 10 EDCE COC(=O)COc1ccc(N(C)C(=O)/C=C\c2cnn(C)c2C)cc1 492428168 REEHIFJBNQTEJP-YHYXMXQVSA-N 343.383 1.957 10 10 EDCE Cc1ccc(CNC(=O)[C@H](ON)C2CC2)c(O)c1Br 2352950004 MBKWGFGWJOXEAG-GFCCVEGCSA-N 329.194 1.748 10 10 EDCE COc1ccc(/C=C\C(=O)NN2C(=O)CSC2=S)cc1OC 6007163 PZRRDOQLHHSXEG-XQRVVYSFSA-N 338.410 1.609 10 10 EDCE C[C@H](C(=O)NC(=O)NCC(F)(F)F)N(C)Cc1ccccc1O 111235668 ADGOZNBFVNWGFV-SECBINFHSA-N 333.310 1.601 10 10 EDCE O=C1NC(=S)NC(=O)C1=CN[C@@H](c1ccccc1)c1ccco1 52528988 XGIBASOMEXXXEN-ZDUSSCGKSA-N 327.365 1.373 10 10 EDCE CNC(=O)[C@H](NC(=O)NCc1c(O)ccc2c1CCCC2)C(C)C 178412049 RXQGRRBVOMVREL-MRXNPFEDSA-N 333.432 1.841 10 10 EDCE NS(=O)(=O)c1ccc(CNCc2c(O)cccc2Cl)cc1 127231347 KFRVYMJUVJRTPZ-UHFFFAOYSA-N 326.805 1.983 10 10 EDCE CCn1cc([C@@H]2CN(C(=O)/C=C/c3ccc(O)c(O)c3)CCO2)cn1 191766568 REOZCRBTPNEIKW-YXMMZVCTSA-N 343.383 1.928 10 10 EDCE C[C@@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(=O)N(C)C 255048371 DPTOBASRACWFDL-DEBLGDTFSA-N 331.416 1.129 10 10 EDCE CO[C@@H](C(=O)O)C1CN(Cc2ccc(C)c(Br)c2O)C1 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10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc(=O)c(OC)c[nH]3)C2)cc1 1520328959 PHILHZUYLIVQOO-LBPRGKRZSA-N 343.383 1.401 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCN(c2ccc(F)cc2)C1=O 1469038769 GJMXJQCMGCPUOX-AWEZNQCLSA-N 344.342 1.701 10 10 EDCE OCc1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)c(Br)c1 2121593420 QACIMTBRRUHZEC-MJVIPROJSA-N 328.206 1.385 10 10 EDCE Cc1ccc2ncc(C(=O)NCc3c(O)cccc3O)c(=O)n2c1 1472061397 OPYGLJIVHYVFKK-UHFFFAOYSA-N 325.324 1.344 10 10 EDCE CC[C@H](F)C(=O)N(C)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1705346867 MWCNRIBEOQGSIL-ZDUSSCGKSA-N 349.366 1.880 10 10 EDCE NCc1ccc(N2CCC[C@@H]2[C@H](O)CO)c(F)c1Br 2123233408 CYKDBDHZVQTQIO-MWLCHTKSSA-N 333.201 1.369 10 10 EDCE C[C@](CO)(Cn1cnc2ccccc21)NC(=O)c1cccc(O)c1O 1558784096 PKVPZTUPGVUCBJ-GOSISDBHSA-N 341.367 1.629 10 10 EDCE CNC(=O)CCN(C)c1nnc(C)n1Cc1ccc(N(C)C)cc1C 1729704381 DSDSYWSIDXBJSR-UHFFFAOYSA-N 344.463 1.582 10 10 EDCE CCc1nsc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)n1 1566152985 LJXOTNDCSAZFRI-UHFFFAOYSA-N 348.428 1.403 10 10 EDCE CC(C)(C)OC(=O)Cn1cc(NC(=O)Cc2ccc(O)c(O)c2)cn1 1631052955 XNIMLKNJAAPEGH-UHFFFAOYSA-N 347.371 1.817 10 10 EDCE CN(C)[C@H](C(=O)NCCCSc1nccs1)c1cncn1C 1565620682 ZIKFTIBVYYJCHR-LBPRGKRZSA-N 339.490 1.778 10 10 EDCE COc1ccc(N2CCN(C(=O)C[C@@H]3CCC(=O)NC3)CC2)cc1 1566326625 TYPPUVIDSDZCAI-AWEZNQCLSA-N 331.416 1.260 10 10 EDCE CN1C[C@@H](C(=O)NCc2cc(O)ccc2O)c2ccccc2C1=O 1644754461 XWELBEWOTNRYPW-OAHLLOKOSA-N 326.352 1.583 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ccc(Cn2ccccc2=O)o1 1570462359 QGZXSIFUWLLRTF-UHFFFAOYSA-N 340.335 1.831 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)c2cnn[nH]2)cc1C 1734241963 HXTZTTDXLONQGG-CYBMUJFWSA-N 331.420 1.810 10 10 EDCE COc1ccc2c(c1)OC[C@H](C(=O)NCc1cc(O)ccc1O)C2 1644752535 JOBJMRCPWQIWLW-CYBMUJFWSA-N 329.352 1.974 10 10 EDCE CC[C@@H](CNC(=O)CCOC)NC(=O)c1ccc(N=NC(N)=O)cc1 1582368767 LPPRVDNOJBOLSO-LBPRGKRZSA-N 349.391 1.510 10 10 EDCE CC[C@H](CNC(=O)CC1CCC1)NC(=O)c1cc(OC)nc(OC)c1 1759307913 KSVXXAROOXCBNO-CQSZACIVSA-N 349.431 1.914 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cnsn3)cc2)CC1 1598009228 LHERBZVOSINIOA-UHFFFAOYSA-N 345.428 1.170 10 10 EDCE COc1ccc(CNC[C@](C)(NC(=O)c2nc[nH]n2)C2CC2)cc1C 1698653838 WHXCCNBDGQNACK-SFHVURJKSA-N 343.431 1.810 10 10 EDCE O=C(O)COc1ccc(/C=C2\SC(=S)N(CCO)C2=O)cc1 16904931 TXIYFGFNLZWTKU-XFFZJAGNSA-N 339.394 1.344 10 10 EDCE O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C/N1CCOCC1 208227617 AEUPMSJUXKXVPU-FMIVXFBMSA-N 335.747 1.139 10 10 EDCE CCCNCc1ccc(N2CC(CO)(CO)C2)c(Br)c1 1914984535 CAROAAANMAAGOQ-UHFFFAOYSA-N 343.265 1.740 10 10 EDCE CCOC[C@](O)(CNC(=O)OC(C)(C)C)[C@@H](N)c1ccccc1O 1921854522 IREOEKMNOAGPDS-WMLDXEAASA-N 340.420 1.684 10 10 EDCE CN(C)[C@H]1COC[C@H]1CNCc1c(O)cccc1Br 1924632412 FWGQCSQSIFQZNJ-MFKMUULPSA-N 329.238 1.821 10 10 EDCE CO[C@@]1(C(=O)NCCCN=[N+]=[N-])CCN(C(=O)OC(C)(C)C)C1 1985094323 NHCULTQWZWIURM-AWEZNQCLSA-N 327.385 1.829 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCCN(CC(=O)NCCN=[N+]=[N-])C1 1985094982 XEZOOQBLAOXBCV-NSHDSACASA-N 326.401 1.402 10 10 EDCE C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985101708 WNSVNQYHRFIRSO-ONGXEEELSA-N 325.369 1.532 10 10 EDCE COC[C@@H](ONC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2010388710 GCWFIMIPOQZUKC-GHMZBOCLSA-N 343.384 1.617 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2010403885 LDZJFTIFNZTNMC-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010404961 WBAWYSUINSHBQC-IJLUTSLNSA-N 341.412 1.809 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](N3CC(O)C3)C2)cc1Br 2158747401 XQPZWSXIUJXELK-PWSUYJOCSA-N 341.249 1.758 10 10 EDCE NCc1ccc(N2CCC[C@](O)(CO)C2)c(F)c1Br 313651619 KNWZMYVXAJCZLF-CYBMUJFWSA-N 333.201 1.371 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CO1 1908252709 DAZNJQIBZMBFQE-TUAOUCFPSA-N 339.396 1.827 10 10 EDCE C[C@@H](NCCc1nnc(Br)n1C)c1cc(O)ccc1O 2185197916 LWPLRZMJZXWCRT-MRVPVSSYSA-N 341.209 1.882 10 10 EDCE O=C(c1cccc(O)c1O)N1[C@H]2CC[C@H]1CN(C(=O)C(F)(F)F)C2 2054409364 BPTNLTKTFGPISO-IUCAKERBSA-N 344.289 1.476 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)cc1Br 2102194491 YCRCVZPOACPPDE-DVXMNORISA-N 327.222 1.665 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)cc1Br 2089926829 NJKURMXCQGZJMC-OWYVNGRQSA-N 329.238 1.614 10 10 EDCE O=S1(=O)C[C@H]2CCN(c3ccc(CO)cc3Br)[C@H]2C1 2094927403 OLBFKUSUPYWQPW-MFKMUULPSA-N 346.246 1.565 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2225801029 RUCJHSXAUSDPHU-NKWVEPMBSA-N 349.214 1.692 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)c(Br)c1 2331967469 UVZSAKSSNQZJLM-HYNSBDGHSA-N 328.206 1.404 10 10 EDCE Cc1ccc(CN2CCN[C@H]3COC[C@@H]32)c(O)c1Br 2352945000 PIGMZEHIEZHNJL-RYUDHWBXSA-N 327.222 1.636 10 10 EDCE CO[C@H](CN)CC(=O)NCc1ccc(C)c(Br)c1O 2352948719 SUQSJYZXBIYUCH-JTQLQIEISA-N 331.210 1.443 10 10 EDCE CCS(=O)(=O)N(C)CC(=O)NCc1ccc(N2CCCC2)cc1 175972803 MLHVEZPUVSSDPE-UHFFFAOYSA-N 339.461 1.185 10 10 EDCE CN(C)[C@H](Cc1ccccc1)C(=O)NCCc1ccc(O)c(O)c1 122399549 UESTXVODETUKEA-MRXNPFEDSA-N 328.412 1.929 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CC[C@H](NC(N)=O)C2)cc1 270660065 KDAUGWATWHWXIB-AWEZNQCLSA-N 333.436 1.485 10 10 EDCE C[C@H]1OCC[C@@H]1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 274945031 NYBCHEDZXZTOEI-CJNGLKHVSA-N 340.445 1.120 10 10 EDCE CN(CCC(N)=O)c1ccc(/C=C\C(=O)O)c(Br)c1 381919965 JMEOIBIWDCPPOS-HYXAFXHYSA-N 327.178 1.859 10 10 EDCE O=C(CN1CSCC1=O)NCc1cc(Br)ccc1O 804733045 CGMXNOPEKVXZLQ-UHFFFAOYSA-N 345.218 1.304 10 10 EDCE COc1cccc(CNC(=O)c2c3n(c(=O)n2C)CCCC3)c1O 825703311 PYRSTUFZZVAQQY-UHFFFAOYSA-N 331.372 1.167 10 10 EDCE CN(C)c1ccc([C@@H](N)CNCc2cnnn2[C@H]2CCCNC2)cc1 903917979 PMKAGRLCIGQFGD-WMZOPIPTSA-N 343.479 1.058 10 10 EDCE C[C@@]1([C@H]2CCCN(Cc3cc4c(cc3O)OCO4)C2)COC(=O)N1 905708038 MPJWLMNYXUDCSE-SJCJKPOMSA-N 334.372 1.831 10 10 EDCE CC1(C)NC(=O)N(CC(=O)NCCCSc2nccs2)C1=O 733973041 DQPVXSSCSPGWCC-UHFFFAOYSA-N 342.446 1.072 10 10 EDCE CCN1C(=O)C(=CNNc2ccc(F)cn2)C(=O)N(CC)C1=S 731371397 CCCWSYQCBWWMRY-UHFFFAOYSA-N 337.380 1.017 10 10 EDCE COc1ccc(O)c(CN2C[C@@H]3CC[C@H](C2)N3C2CCNCC2)c1 903980096 HEOHGLFJIXEKSY-CALCHBBNSA-N 331.460 1.801 10 10 EDCE CCS(=O)(=O)NCCCNC/C=C/c1ccc(N(C)C)cc1 835038108 UOYZINJSELSFTN-FNORWQNLSA-N 325.478 1.685 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NC[C@H](O)c2ccnn2C)cc1 914254278 DWFYUXFRYSHYIL-KRWDZBQOSA-N 345.447 1.799 10 10 EDCE CC1(C(N)=O)CN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 843415878 MEDDWLFIRHLHCE-UHFFFAOYSA-N 332.404 1.892 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(Cn2cnnc2)CC1 846472125 XYLQGVUUMKNUIU-RQOWECAXSA-N 328.372 1.641 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Cc3ccon3)cc2)C1 746147260 MYAVAPQULLUUBR-CQSZACIVSA-N 342.399 1.235 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NC[C@@H]2CN(C3CC3)C(=O)O2)c1 847456969 RLKGKOHCCCMKRW-GXFFZTMASA-N 349.387 1.744 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC[C@@H](C)CCO)C2)cc1 854296641 FMQOFOBZCINLOU-CABCVRRESA-N 335.448 1.982 10 10 EDCE CO[C@@H](C(=O)NCc1cc(Br)ccc1O)[C@H]1CCOC1 854442423 RJQWTFHUBOARNN-TVQRCGJNSA-N 344.205 1.822 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H]3CCCN(C)C3)C2)cc1 852188739 LQERWWSVWRGZQR-HZPDHXFCSA-N 346.475 1.915 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C)C[C@H]2CO)c(Br)c1 699486177 IANYNLJIQPSKOK-PWSUYJOCSA-N 328.254 1.582 10 10 EDCE OC[C@H]1CCCN(c2cc(N3Cc4cccc(O)c4C3)ncn2)C1 866119802 SNWNJBOIZUQTGE-ZDUSSCGKSA-N 326.400 1.911 10 10 EDCE CCOC(=O)C[C@@H]1CCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1118939614 DNDIFMNUOBAGKE-ZDUSSCGKSA-N 346.383 1.179 10 10 EDCE CN(C)c1cccc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)c1 787933593 BSZYMOFKJSZQHH-UHFFFAOYSA-N 336.369 1.957 10 10 EDCE COC(=O)c1cncnc1NCc1ccc(N2CCOCC2)cc1 786584913 WRLUHMUYQHKPSY-UHFFFAOYSA-N 328.372 1.712 10 10 EDCE O=C(CN1C(=O)CCOc2ccccc21)NCc1cccc(O)c1O 1153791818 KWMJLNWNEQODOY-UHFFFAOYSA-N 342.351 1.530 10 10 EDCE C[C@@H](NC(=O)[C@H](CO)NC(=O)c1ccc(F)cc1)c1ccccc1O 1151886208 ZLQYUBUSZAMKOQ-ABAIWWIYSA-N 346.358 1.499 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1C(=O)NCCN=[N+]=[N-] 1963817511 OFJQBBFOFYLTHW-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE COc1ccc(Br)c(CNCCc2ncn(C)n2)c1O 1964052375 PAQJDHNLKBLPNG-UHFFFAOYSA-N 341.209 1.624 10 10 EDCE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NC1CN(S(=O)(=O)N(C)C)C1 1329192883 URYRMHTVHBCNJA-AAEUAGOBSA-N 339.461 1.329 10 10 EDCE NC(=O)C1CCN(c2ccc(CN[C@@H]3C[C@H]4CC[C@H]3O4)cc2)CC1 1332460262 TYZMWNHENKHCGW-KZNAEPCWSA-N 329.444 1.798 10 10 EDCE CCNCC1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1330567473 HQBXIDXSLHYFBJ-UHFFFAOYSA-N 331.416 1.083 10 10 EDCE O=C(C(=O)N1CC(F)(F)C(F)(F)C1)N1Cc2cccc(O)c2C1 1348652671 SSRHBTSZAQSITK-UHFFFAOYSA-N 332.253 1.347 10 10 EDCE COC(=O)c1cc(C(=O)Nc2c(Cl)ccc3nonc23)n(C)n1 1459789286 QNFLJWZTCZGAHW-UHFFFAOYSA-N 335.707 1.649 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)cc1 1466689810 HRQJOCKNIWTWOT-ZDUSSCGKSA-N 344.375 1.525 10 10 EDCE COc1ccc(CNCCn2ncc(Br)n2)c(O)c1 2123092812 SMYNSQRTACSJFE-UHFFFAOYSA-N 327.182 1.545 10 10 EDCE Cn1nccc1[C@H](O)CNC(=O)c1cc2cc(O)c(O)cc2s1 1639198626 FATIFJANCZZQTG-GFCCVEGCSA-N 333.369 1.509 10 10 EDCE O=C1CS(=O)(=O)c2cc(NC(=O)c3cccc(O)c3O)ccc2N1 1637357735 QZQRKBUBTIEIDT-UHFFFAOYSA-N 348.336 1.076 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2[nH]ccc2C)cc1C 1569931750 UKVKBTIAHDYRNO-UHFFFAOYSA-N 345.443 1.864 10 10 EDCE CCNCc1ccc(N2C[C@H](CO)C[C@H]2CO)cc1Br 2146073999 VCVWEKAAEGSPDZ-RISCZKNCSA-N 343.265 1.738 10 10 EDCE NC(=O)C1(N)CCN(Cc2cc(Br)cc(F)c2O)CC1 2154308953 YGMKDFOWWYIWKM-UHFFFAOYSA-N 346.200 1.072 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(N)cc1 2022862208 QMSHNJBVXPFZDI-BXUZGUMPSA-N 337.420 1.202 10 10 EDCE O=C1NC(=O)[C@@H]2CN(c3ccc(CO)c(Br)c3)CC[C@H]12 2158790181 SSKLZUKBWUJKKY-WDEREUQCSA-N 339.189 1.040 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@@](O)(CO)C2)cc1Br 314018326 RFFUFCRZCIAQSU-YGRLFVJLSA-N 329.238 1.792 10 10 EDCE CCNCc1ccc(N2CC[C@](O)(CO)C2)c(Br)c1 314203559 PXCOKSSUSJNKLO-CQSZACIVSA-N 329.238 1.492 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@H](CO)C2)c(Br)c1 316808928 WXNHDBNPVPQUKC-SMDDNHRTSA-N 329.238 1.348 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)cc1Br 2173317246 KCBSCCLWQDNUQP-PPMYVGRGSA-N 341.249 1.789 10 10 EDCE C[C@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1C(=O)Cc1ccc(N)cc1 2044625730 YMPRWTCWMFLMMG-GXFFZTMASA-N 343.349 1.869 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(CNC(=O)Cc2ccc(N)cc2)C1 2045130275 IJQYXELDFZGMSD-UHFFFAOYSA-N 349.431 1.346 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1Cc2nc[nH]c2CN1C(=O)OC(C)(C)C 2060616591 CLLLVHSAIPUNER-LBPRGKRZSA-N 349.395 1.840 10 10 EDCE CN1CC[C@H]2OCCN(c3ccc(CN)c(Br)c3)[C@@H]2C1 2185498742 YRWUYSOQEXGWIM-HUUCEWRRSA-N 340.265 1.817 10 10 EDCE O=C(NC[C@@H]1COCCN1Cc1ccccc1)c1cccc(O)c1O 2074174242 MJULUZOIWDDRAK-OAHLLOKOSA-N 342.395 1.729 10 10 EDCE COCCNCc1ccc(N2CC[C@H]2CO)c(Br)c1 2092550791 WLVLCTJJHMXQPH-LBPRGKRZSA-N 329.238 1.756 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NCCC=CBr)cc1 2114288670 JIKZUSFTVHBDSL-UHFFFAOYSA-N 349.250 1.866 10 10 EDCE COC[C@@H]1[C@@H](O)[C@@H](O)CN1c1ccc(OCc2ccccc2)cc1 2299515062 NYTPZIUDDRJSGL-CEXWTWQISA-N 329.396 1.822 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@@H]4[C@@H](O)C[C@@H]43)c(Br)cc21 2355698744 XFUDEJQRANFMOX-MSHQNVTJSA-N 338.205 1.361 10 10 EDCE CC(=O)N1CC[C@@H](C(=O)NCc2ccc(N3CCSCC3)cc2)C1 176040692 FIWVXFRBQDZCKZ-MRXNPFEDSA-N 347.484 1.724 10 10 EDCE Cc1cc(O)c(O)cc1CCNS(=O)(=O)c1c(C)noc1C 170269058 MAEQVHWEPHMDAD-UHFFFAOYSA-N 326.374 1.532 10 10 EDCE OC[C@@H](O)C1CN(c2ccc(CNC3CC3)c(Br)c2)C1 2361909421 WFTZURGHRACYRJ-OAHLLOKOSA-N 341.249 1.491 10 10 EDCE O=C(CN1C(=O)CSC1=S)NC[C@H]1Cc2ccccc2CO1 219818957 PQLYUMFYDZBNLB-GFCCVEGCSA-N 336.438 1.104 10 10 EDCE CCOc1cccc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)c1O 124461064 ZURVSLRFYBXDFQ-MRXNPFEDSA-N 348.443 1.862 10 10 EDCE CN(CC1CC(O)C1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 92776066 KBBRBABOKOHJRA-KTRLOWJHSA-N 340.221 1.608 10 10 EDCE CCN(C)S(=O)(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 245777054 BAQRJNVDPDDHRC-CQSZACIVSA-N 328.434 1.570 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCc3ccnc(O)c3C2)cc1 276938790 NFKSMUCUVHFIDH-UHFFFAOYSA-N 340.427 1.528 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1c(C)nn(-c2nc(C)cc(C)n2)c1C 808501927 YFMWLEJYYVAKKH-UHFFFAOYSA-N 344.371 1.140 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1 808504642 HQFKCPLILMIDQF-CHWSQXEVSA-N 333.384 1.611 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)Cc2nncn2C)c([N+](=O)[O-])c1 291863166 HYKFQTCEVMTVHY-FNORWQNLSA-N 331.332 1.546 10 10 EDCE CC[C@@H](O)CN(C)c1cc2c(cc1Br)[C@@H](NC)C(=O)N2 2162893107 GQCQKFVEYHLFSY-AMIZOPFISA-N 342.237 1.869 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H](C)C3CCC3)C2)cc1 828309564 LEUCQCXDTYWRRN-DZGCQCFKSA-N 345.443 1.695 10 10 EDCE COCCN1CCCN(C/C=C\c2ccc(N(C)C)cc2)CC1=O 835051020 WFAACPVGKULBOE-XQRVVYSFSA-N 331.460 1.947 10 10 EDCE Cc1ccc(=O)n([C@H]2COC[C@H]2NCc2ccc3c(c2)CCO3)n1 585626439 PQJDLWDQDDNMNN-CVEARBPZSA-N 327.384 1.216 10 10 EDCE C[C@H]1OC(=O)N[C@@H]1C(=O)NCc1cc(Br)ccc1O 841434821 OHJONQHMJGMWNF-LDWIPMOCSA-N 329.150 1.268 10 10 EDCE C[C@@H](NC(=O)N[C@H]1CCc2nnn(C)c2C1)c1ccc(N(C)C)cc1 922054853 MGERIEPQCONPCX-OCCSQVGLSA-N 342.447 1.799 10 10 EDCE COCCO[C@@H]1COCC[C@@H]1NC(=O)NCc1c(O)cccc1F 922070651 KRLCNTALYVIBOK-DZGCQCFKSA-N 342.367 1.151 10 10 EDCE NC(=O)[C@H]1C[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 858769153 DNLLLZQQNDVDGH-JOTVFPGJSA-N 332.187 1.762 10 10 EDCE CNC(=O)C1(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCC1 855231704 NKOBONSDUKPBMM-ZDUSSCGKSA-N 331.416 1.306 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@](C)(O)C(C)C)C2)cc1 854301839 UWRMYBGSJUODKZ-KSSFIOAISA-N 335.448 1.980 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)C[C@@]2(C)CO)cc1Br 698158844 WUBIMIPSVXEAHH-PUYPPJJSSA-N 330.222 1.824 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCCC(=O)[C@@H]3C)nc12 932855776 MYROADVEUXCIFW-JTQLQIEISA-N 332.360 1.165 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cn3)CC2)cc1 761784107 SKMLBFDPPPGRHN-UHFFFAOYSA-N 342.355 1.961 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@]34COC[C@@H]3C4)C2)cc1 889265151 SNBIUASKQZEZCT-GLJUWKHASA-N 331.416 1.610 10 10 EDCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(C)ccc1O 770373304 HCDKHCMYMHKBPG-VDERGJSUSA-N 333.384 1.626 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 889327414 LVAVLNBCHUANRR-XJKCOSOUSA-N 347.415 1.382 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CNc1ccccc1C(N)=O 1154027761 ZYRGHEMNBCVADU-NSHDSACASA-N 343.383 1.356 10 10 EDCE COc1ccc(CNC[C@@H]2CN(C(=O)CCN(C)C)CCO2)cc1C 1327033122 BXLMKZXRJAAOIE-QGZVFWFLSA-N 349.475 1.272 10 10 EDCE C[C@H](NC(=O)C(=O)NC[C@H]1C[C@H]1C)c1ccc(N2CCOCC2)cc1 1321666402 WANYYPVNSKGGOT-IJEWVQPXSA-N 345.443 1.473 10 10 EDCE N[C@@]1(C(=O)O)CCN(Cc2cc(Br)cc(F)c2O)C1 715770062 MTXQZRDBSAHNFT-LBPRGKRZSA-N 333.157 1.282 10 10 EDCE CCOC(=O)C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1261855048 GAFGAQLFAQFPJM-UHFFFAOYSA-N 346.383 1.036 10 10 EDCE CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1cccc(O)c1O 1546271485 DHTLUUMQBMXZGJ-LBPRGKRZSA-N 339.388 1.965 10 10 EDCE CS(=O)(=O)CCS(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 213430805 UVBVBHGHKLEYCC-UHFFFAOYSA-N 348.229 1.485 10 10 EDCE C/C=C(\C)C(=O)N[C@@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1483218151 PTIJPNLIJKOVMA-YFTXEMMHSA-N 344.419 1.231 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@H]2CCC(=O)NC2)cc1C 1715237693 BJOLRYMGISQJQM-CJNGLKHVSA-N 347.459 1.372 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)Cc1cnns1 1567321881 ILGMZJXKGFFFQL-UHFFFAOYSA-N 347.404 1.562 10 10 EDCE COc1ccc(CN[C@H]2CN(C(=O)CNC(C)=O)CC2(C)C)cc1C 1734490783 YSYDDJOHZKBTAP-KRWDZBQOSA-N 347.459 1.466 10 10 EDCE NS(=O)(=O)c1cccc(N2Cc3cccc(O)c3C2)c1[N+](=O)[O-] 1640308225 ZAZVSESSWJNRFF-UHFFFAOYSA-N 335.341 1.468 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)[C@@H]2CC2(C)C)cc(OC)n1 1572248934 FECGUNJWUGOOEQ-YPMHNXCESA-N 349.431 1.722 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@H](O)C2(C)C)c(Br)c1 2124803109 UIPCYXPXAVEGMT-HJIKLVIJSA-N 330.222 1.823 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2ncn(C)n2)cc1C 1670083399 FEDRPIBJZGQXRJ-UHFFFAOYSA-N 331.420 1.384 10 10 EDCE CC[C@@H](F)C(=O)NC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1689370591 WWUZXKALEILHTJ-VBFCFCCWSA-N 349.366 1.999 10 10 EDCE CO[C@@H](C)CNC[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1698776960 LIOXCODXAWCFCZ-NEPJUHHUSA-N 335.408 1.839 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)/C(=C/C=C/c2ccccc2)SC1=S 5374263 JXAPEWNYYREQDN-SIWUQKNHSA-N 335.406 1.890 10 10 EDCE O=C(Nc1nccnc1Br)c1cc(O)c(O)c(O)c1 2132409034 BMLQCVNWYVEXJK-UHFFFAOYSA-N 326.106 1.608 10 10 EDCE Cc1cc(=O)c(OCCC(N)=O)cn1CCCOc1ccc(N)cc1 1857916900 RNJJQUYHWYUKMO-UHFFFAOYSA-N 345.399 1.462 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)CCOC)c(Br)cc21 118590005 MEDRQMQBGZGRHU-GFCCVEGCSA-N 328.210 1.744 10 10 EDCE COCCNC(=O)[C@H](C)NCc1cc(Br)ccc1O 234637226 HQXLHHLOZXUBKF-VIFPVBQESA-N 331.210 1.395 10 10 EDCE CCOC(=O)C[C@H](N)c1cc(I)ccc1O 1951377097 NFQRZVGHSOPGOI-VIFPVBQESA-N 335.141 1.950 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](N)C1(O)CC1 1952671353 UCEGKIDSMQJNIF-RISCZKNCSA-N 338.404 1.386 10 10 EDCE Nc1ccc(OCCNC(=O)c2ncc(Br)cn2)cc1 2143863402 XXXDYIUTSPADGB-UHFFFAOYSA-N 337.177 1.630 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCCOC1 1985093852 GFOPBEBFBWVTBU-CQSZACIVSA-N 325.369 1.581 10 10 EDCE 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CC(C)(CN1CCOCC1)NCc1ccc(N2CCOCC2)cc1 308638365 GLIUFXWZTYLXMB-UHFFFAOYSA-N 333.476 1.724 10 10 EDCE Cc1cc(C(=O)N2CCO[C@H](CN(C)C)C2)c(C)n1-c1ccccn1 116791730 MCSWIODYIGRZFZ-MRXNPFEDSA-N 342.443 1.892 10 10 EDCE CNCc1ccc(N2CCN3C[C@@H](O)C[C@H]3C2)c(Br)c1 405242174 WTAAXDLZRXLNKN-STQMWFEESA-N 340.265 1.424 10 10 EDCE CN1CCN([C@H]2CCCCN(C(=O)c3cccc(O)c3O)C2)CC1 187142330 KLZUTSWEFYCJEP-AWEZNQCLSA-N 333.432 1.340 10 10 EDCE COc1ccc(N2CCN(C(=O)C3(OC)CCOCC3)CC2)cc1 284237724 HHALNXQRDMIDEP-UHFFFAOYSA-N 334.416 1.539 10 10 EDCE Cc1ccc(CN2CCC(N)(C(N)=O)CC2)c(O)c1Br 2380816135 LYUUVSFWLKAQNJ-UHFFFAOYSA-N 342.237 1.242 10 10 EDCE CCC(=O)N1CSC[C@H]1C(=O)N[C@@H](C)c1cc(OC)ccc1O 728978383 FLWCWBXMHPLIAU-GWCFXTLKSA-N 338.429 1.890 10 10 EDCE N[C@@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(F)(F)F 827364649 JNRLCBYCKZNXTC-LBPRGKRZSA-N 335.301 1.168 10 10 EDCE CCCn1nccc1NC(=O)C(=O)NCc1cccc(OC)c1O 746415282 UBOJJBLVJLLAPE-UHFFFAOYSA-N 332.360 1.262 10 10 EDCE CCN(Cc1cc(Br)ccc1O)C(=O)CNC(N)=O 743808680 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325.361 1.113 10 10 EDCE CON(Cc1ccc(C)o1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329461066 PDPJAKBZRVLNCT-UHFFFAOYSA-N 330.340 1.726 10 10 EDCE COC(=O)c1cc2n(n1)CCC[C@H]2NC(=O)c1ccc(C)c(O)c1O 1180099672 ILTOMTVPSCRIBC-LLVKDONJSA-N 345.355 1.654 10 10 EDCE O=C(NCCCc1nc[nH]n1)NCc1c(O)ccc2c1CCCC2 1252765887 GNDAMSSDNHMKPW-UHFFFAOYSA-N 329.404 1.821 10 10 EDCE O=C(C(=O)N1CCO[C@@H](c2ccco2)C1)N1Cc2cccc(O)c2C1 1348639524 NCJCTSHQHCWECS-MRXNPFEDSA-N 342.351 1.428 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2C[C@H]2C(F)(F)F)cc1 1340448665 ZLXRMZAKJYFEID-WCQYABFASA-N 343.349 1.683 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCN(c2ccccc2O)CC1 1457693399 YEAZEQSTVVBBAQ-UHFFFAOYSA-N 332.331 1.905 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cncc(C=O)c1 1469230396 IZWDHEBGYVPPQI-UHFFFAOYSA-N 342.351 1.805 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H](C)CC(N)=O)cc1C 1482316646 JTPATYUVYJABQB-ZIAGYGMSSA-N 335.448 1.452 10 10 EDCE Cc1cccc([C@H](CC(=O)NCc2c(O)cccc2O)NC(N)=O)c1 1558533563 HDPDQGICLOOXSS-AWEZNQCLSA-N 343.383 1.822 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)C[C@H]1C 1633819718 UEBLBJFZHCCSBI-ANGCBRKESA-N 337.372 1.112 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CON(C(=O)OC(C)(C)C)C2)c(O)c1O 1639900354 OUUOAGUUNQMVAA-SNVBAGLBSA-N 338.360 1.687 10 10 EDCE O=C(CCC(=O)Nc1nnc(C2CC2)o1)NCc1cc(O)ccc1O 1644754435 WVYVHXVLCGGWPB-UHFFFAOYSA-N 346.343 1.393 10 10 EDCE CC(C)N1C(=O)C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1=O 1587273397 NBQYPJNXNCQWKQ-LLVKDONJSA-N 331.332 1.115 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@@H](NC(C)=O)C(C)(C)C)cc1 1677223556 POWRJSJZPMVNPZ-OAHLLOKOSA-N 346.435 1.311 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)Cc3nc[nH]n3)C2)cc1C 1688949492 XKRFOJGKOIWEAG-SHTZXODSSA-N 343.431 1.349 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)Cc2nonc2C)cc1C 1774043122 ZMMAAXLYXYNYJO-GFCCVEGCSA-N 332.404 1.532 10 10 EDCE CCCNC(=O)COc1c(C)n(Cc2ccc(N)cc2)ccc1=O 1857920094 NVUVKPKGUSOXKZ-UHFFFAOYSA-N 329.400 1.692 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H](COC)ONC(=O)OC(C)(C)C 1900609511 ODHLOTAMLKBRKH-SNVBAGLBSA-N 331.373 1.617 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC4(CCOC4)C3)c(Br)cc21 1915831406 HJAUONBYWRKCEM-LBPRGKRZSA-N 338.205 1.628 10 10 EDCE CN(CCNS(=O)(=O)Cc1ccc(N)cc1)C(=O)OC(C)(C)C 1977696209 IEUTXWJGRYLRKQ-UHFFFAOYSA-N 343.449 1.555 10 10 EDCE CC(C)(C)OC(=O)Nc1snnc1C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980370320 PPIDIUYLUVEJLA-ZKCHVHJHSA-N 340.405 1.764 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CCC(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985101255 PTHVEMXCZVWVJY-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE COC[C@@](C)(NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985101138 OEPZGQVATHMPEZ-QMTHXVAHSA-N 327.385 1.827 10 10 EDCE C[C@H](NC[C@H](O)CNC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985771949 OQGUUNUGNQEPRU-JQWIXIFHSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1Cc2nncn2C[C@@H]1[C@@H](N)c1ccccc1O 2029556688 VBYJIMIGSYRQGM-DOMZBBRYSA-N 345.403 1.803 10 10 EDCE C[C@H]1CN(c2cc(Br)c(CN)cc2F)C[C@@H](CO)O1 311423510 ONXHEAZUTQONMY-WPRPVWTQSA-N 333.201 1.633 10 10 EDCE CN[C@@H](C)c1ccc(N2CC3(CNC(=O)N3)C2)cc1Br 2177692212 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LODCVMCVWFOERD-DGJRKYIQSA-N 345.237 1.026 10 10 EDCE CC(C)(C)N1C(=O)[C@H]2[C@@H](c3ccccc3O)N[C@](C)(C(=O)O)[C@@H]2C1=O 248229250 KJFBWRKYRZLXEA-WLHTULFXSA-N 346.383 1.280 10 10 EDCE CC(C)Cn1cnc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)c1 274977685 XHCQPQFYTPWNEI-UHFFFAOYSA-N 339.373 1.744 10 10 EDCE CS(=O)(=O)NC[C@@H]1CCC[C@H]1NCc1cc([N+](=O)[O-])ccc1O 800310429 ZHTDDGQABGKCDJ-GXFFZTMASA-N 343.405 1.108 10 10 EDCE Oc1ccc(Br)cc1CN1CC[C@]2(CNCCO2)C1 719998872 IIAXDYYLHRPEBZ-AWEZNQCLSA-N 327.222 1.719 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N[C@H]3CC34CC4)CC2)cc1 822855528 IIPHMFNQRBATOI-KRWDZBQOSA-N 344.459 1.669 10 10 EDCE O=C(/C=C/Cn1cncn1)NCc1ccc(N2CCOCC2)c(F)c1 900269130 KDYQMCOTVROBAK-OWOJBTEDSA-N 345.378 1.126 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)c1cn([C@@H]2CC[C@H]2O)nn1 900187124 BMPFTAFEFJWXDU-IAGOWNOFSA-N 341.415 1.504 10 10 EDCE CN1C[C@H](CCNC(=O)NCc2ccc3c(c2)CCCN3C)CC1=O 915389875 DTOMQKSSUDPABO-OAHLLOKOSA-N 344.459 1.737 10 10 EDCE COCCO[C@@H]1CCN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])C1 844214411 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C[C@@H](NC(=O)[C@@H]1[C@H]2CC[C@]3(COC(=O)[C@H]13)O2)c1ccc(N(C)C)cc1 860950265 KPVMCFIGKZJEOO-WQTQNVOBSA-N 344.411 1.650 10 10 EDCE CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 875005961 CSQJLHBGMAARQE-UHFFFAOYSA-N 331.416 1.196 10 10 EDCE C[C@H](C(=O)N1Cc2cccc(O)c2C1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 871200224 ZWHDQVVFCSUDRX-BNOWGMLFSA-N 342.395 1.798 10 10 EDCE CC1(C)[C@H](O)C[C@@]1(CO)NCc1cc(Br)ccc1O 1879559768 QSIPFLXGNSCGRY-OCCSQVGLSA-N 330.222 1.766 10 10 EDCE C[C@@H](NC(=O)c1cccc(O)c1O)C(=O)NCCc1ccccc1 1141836134 CNZPRSRDNJFLQG-GFCCVEGCSA-N 328.368 1.575 10 10 EDCE O=C1C[C@@]2(CCN(Cc3cc(Br)ccc3O)C2)CN1 279407766 LPMGLIAFGTXGBS-AWEZNQCLSA-N 325.206 1.867 10 10 EDCE COc1ccc(CNC2(CNC(=O)OC(C)(C)C)COC2)c(O)c1 707884294 ITYXVUCSANGOLZ-UHFFFAOYSA-N 338.404 1.784 10 10 EDCE NCc1ccc(N2CCC[C@@H](CO)[C@@H]2CO)cc1Br 709811561 RUQBQDIJMDKGTK-FZMZJTMJSA-N 329.238 1.477 10 10 EDCE O=S(=O)(NCCNCc1cc(Br)ccc1O)C1CC1 1964610051 NDJLAYNKCXQORD-UHFFFAOYSA-N 349.250 1.326 10 10 EDCE Cn1c(CNC(=O)Cc2ccc(O)c(O)c2)nc2cc(F)ccc21 1444274292 PRECFNLDFIXQNI-UHFFFAOYSA-N 329.331 1.983 10 10 EDCE O=S1(=O)C[C@H]2C(CNCc3ccc(Br)cc3O)[C@@H]2C1 2117982284 OUCRAHXGNHJAJA-RYUDHWBXSA-N 346.246 1.535 10 10 EDCE NC[C@@]12CN(Cc3cc(Br)ccc3O)C[C@H]1CCO2 2118561200 IFIJHKCPJKDFIG-BXUZGUMPSA-N 327.222 1.704 10 10 EDCE COc1cc(N2CCN(CCCCO)CC2)c([N+](=O)[O-])cc1OC 1559112839 NEZZMJNFNQRCLV-UHFFFAOYSA-N 339.392 1.507 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CCc2nccn2C)cc1C 1483251202 PPONVJAVEYLONB-HNNXBMFYSA-N 344.459 1.964 10 10 EDCE Cc1cc(CC(=O)Nc2[nH]nnc2C(N)=O)c(C)n1-c1ccccc1 1586899498 APLSKFUKNOSMLI-UHFFFAOYSA-N 338.371 1.492 10 10 EDCE [N-]=[N+]=N[C@@H]1CCN([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2O)C1 1912151718 KPNUVHWTXXDLPV-RBSFLKMASA-N 331.376 1.753 10 10 EDCE CC1(C)C[C@H]1C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1686538827 BYMIUTZCSLWGBP-LBPRGKRZSA-N 331.376 1.741 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)c2cnn(C)n2)C2CC2)cc1C 1699592840 PXDXSXZUOFACBE-HNNXBMFYSA-N 343.431 1.430 10 10 EDCE CCOC(=O)[C@H]1[C@@H](c2ccccc2O)NC(=O)N[C@]1(O)C(F)(F)F 5592805 DMBBIGPNGBWBPX-GIPNMCIBSA-N 348.277 1.176 10 10 EDCE CC(=O)Nc1ccc(S(=O)(=O)[n+]2cc(=O)[nH]c3ccccc32)cc1 14181558 IVFPECMDXXLFMX-UHFFFAOYSA-O 344.372 1.011 10 10 EDCE C=CC(=O)NCCC(=O)NC1CCN(c2ccc(OC)cc2)CC1 156054647 XESSGGBNJRYYTK-UHFFFAOYSA-N 331.416 1.473 10 10 EDCE CN1C(=O)/C(=C/c2ccc(C(=O)N3CCOCC3)cc2)SC1=S 8375316 BYHBTQWKIGXSAX-RAXLEYEMSA-N 348.449 1.990 10 10 EDCE C[C@H](CO)N(Cc1ccccc1)C[C@H](O)COc1ccc(N)cc1 1914368738 VUWRKULALNRXSL-QAPCUYQASA-N 330.428 1.892 10 10 EDCE OCCN(c1ccc(CNC2CC2)c(Br)c1)C1COC1 1915505057 VZSGJQWGOBESII-UHFFFAOYSA-N 341.249 1.899 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1CCNC1=O 1952209584 VYZMGTJZIGHKSY-VXGBXAGGSA-N 336.388 1.670 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c(O)c1 2011005294 LWQHYBUZDFLLNX-GNXNZQSNSA-N 334.372 1.693 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NCc2cccc(O)c2O)C1 2011918901 WNNPYIHGNHLRTE-OLZOCXBDSA-N 338.404 1.558 10 10 EDCE O=C(O)[C@@H]1CNCCN1Cc1cc(Cl)cc(Br)c1O 708110791 HVAQVFMLNUQRAP-JTQLQIEISA-N 349.612 1.667 10 10 EDCE CN1CCO[C@H]2CN(Cc3cccc(Br)c3O)C[C@H]21 769481471 APZUOYQHTSAXQO-OLZOCXBDSA-N 327.222 1.670 10 10 EDCE COC(=O)c1cnn(Cc2cc(Br)ccc2O)c1O 2070462902 GWXYZHOPTWBPPA-UHFFFAOYSA-N 327.134 1.892 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H](C3)O4)c(Br)cc21 2198588625 XIGDHCLUWDYXSS-DAROEXNTSA-N 338.205 1.639 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCN(CC(=O)NCc2ccccc2O)C1 2060029795 KMSKQTBUKHBATN-CQSZACIVSA-N 349.431 1.607 10 10 EDCE Cn1nccc1[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2060621776 RJGKAETYGGRYGS-PWSUYJOCSA-N 349.395 1.897 10 10 EDCE CCNCc1ccc(N2CC(CNC(N)=O)C2)cc1Br 2187286991 YGMQQHFIFLJBEC-UHFFFAOYSA-N 341.253 1.663 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)C[C@H]2CO)c(Br)c1 2200834786 YOOAYUWDYZWITG-STQMWFEESA-N 343.265 1.881 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](COc1nnc(=N)[nH]n1)c1ccccc1 2213779714 XCCDXIXYRKNPNC-NSHDSACASA-N 332.364 1.324 10 10 EDCE Oc1ccc(CNCCc2conc2Br)c(O)c1O 2230742605 NJMMBLOIDZKCCT-UHFFFAOYSA-N 329.150 1.886 10 10 EDCE O=C1C(=Cc2ccco2)SC(=S)N1[C@@H]1CCS(=O)(=O)C1 2296664491 GXKQTSQNBJJWKH-MRVPVSSYSA-N 329.424 1.668 10 10 EDCE N[C@@H]1CC[C@@H]2CN(C(=O)C=Cc3ccc(N4CCOCC4)cc3)C[C@H]21 2308750405 PLOPMPNXOXYWJD-BHIYHBOVSA-N 341.455 1.732 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2354486489 YPHVDERAVJLPHU-LHVMMRPKSA-N 341.249 1.660 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]2c2cnn(C)c2)cc1 173315876 TWGZYOSPDJOOGA-SFHVURJKSA-N 341.459 1.939 10 10 EDCE C[C@@H](O)CN(CCNCc1ccc(O)cc1O)C(=O)OC(C)(C)C 379691948 NXTRKEOLZITJSR-GFCCVEGCSA-N 340.420 1.805 10 10 EDCE Cc1cc(CNC(=O)/C=C/c2ccc(O)c(O)c2)nc(N(C)C)n1 191096045 FTSANUSQJAHRCD-FNORWQNLSA-N 328.372 1.592 10 10 EDCE C[C@@H]1CCCN1CC(=O)NCc1ccc(N2CCNCC2)c(F)c1 237402804 SJDSMNMYROUKJE-CQSZACIVSA-N 334.439 1.336 10 10 EDCE CNS(=O)(=O)C1CCN(Cc2cc(Cl)cc(C)c2O)CC1 271718491 JBHWNKDHPFDFFS-UHFFFAOYSA-N 332.853 1.868 10 10 EDCE CSCC[C@H](O)C(=O)NCc1cc(Br)ccc1O 804740463 HSNMKJWOUCTHRV-NSHDSACASA-N 334.235 1.885 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3C[C@H]4CC[C@H]3CN4)C2)cc1 818654480 BNNGEMKJRLPHNW-INMHGKMJSA-N 344.459 1.667 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H](CC2CCOCC2)C(=O)O)cc1 908758907 SOVRCRYQNMXWQU-INIZCTEOSA-N 349.431 1.822 10 10 EDCE COC(=O)[C@@](C)(CCF)NCc1ccc(N2CCN(C)CC2)cc1 827352939 ULVRNIDZVSVXCK-GOSISDBHSA-N 337.439 1.819 10 10 EDCE CN(C)C(=O)CN1CCC(NC/C=C/c2ccc(N(C)C)cc2)CC1 835037584 QHAQAMPABHVXHC-AATRIKPKSA-N 344.503 1.908 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CNCC[C@H]2C)cc1 842206430 GKKRTHPNXMRIHL-PBHICJAKSA-N 346.475 1.263 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cnnn2C2CCNCC2)cc1F 852798599 MHEWEECIILEGDM-UHFFFAOYSA-N 346.410 1.338 10 10 EDCE CCO[C@H](CNCc1ccc(N2CCN(C)CC2)cc1)CN(C)C 922758101 QORDPUMBMNSGBG-LJQANCHMSA-N 334.508 1.495 10 10 EDCE CCN(C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCN(C)C1 850685888 JGZDMUOYCJVXFS-KRWDZBQOSA-N 346.475 1.264 10 10 EDCE CN1CCn2nc(NCc3ccc(N4CCOCC4)c(F)c3)cc2C1 865844378 LAJNKFZVCQOZDI-UHFFFAOYSA-N 345.422 1.916 10 10 EDCE CN1CCN(c2ccc(CNC(=O)N3CC[C@@]4(O)C[C@H]4C3)cc2)CC1 889660695 GAQSNHFBJJFSOB-QFBILLFUSA-N 344.459 1.105 10 10 EDCE CN1CCCc2cc(CNC(=O)C3CN(C4CCOCC4)C3)ccc21 895981686 XQGREETWBJOCNL-UHFFFAOYSA-N 343.471 1.796 10 10 EDCE CCCOc1ccnc(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n1 1138152324 FCVQQBXGVBREBP-LBPRGKRZSA-N 345.399 1.967 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)N2CCC(CN)CC2)N(C)C)cc1 1338776463 CXMLLHPBSXRIJQ-SFHVURJKSA-N 347.507 1.736 10 10 EDCE O=C(c1ccccc1)c1nc[nH]c1C(=O)NCc1ccc(O)c(O)c1 1150378693 UHYIMSPXWMTYDR-UHFFFAOYSA-N 337.335 1.982 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@](O)(C(F)F)C3)cc2F)CC1 1327953844 ZRDVAGKGGUXJSV-QGZVFWFLSA-N 343.393 1.779 10 10 EDCE COc1ccc(N2CCC(NC(=O)C(=O)N3CC(C)(F)C3)CC2)cc1 1324006472 TZTPBAKSYOVNSJ-UHFFFAOYSA-N 349.406 1.351 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2c(F)ccc(O)c2O)CO1 1184392052 ACNFKSOEZIDWAR-QMMMGPOBSA-N 342.323 1.518 10 10 EDCE COC(=O)c1cc(C(=O)N[C@@H](C)c2cc(OC)ccc2O)n(C)n1 1465992704 KZIXQKXOQZHCCX-VIFPVBQESA-N 333.344 1.412 10 10 EDCE CNCc1ccc(N2CC[C@@H](S(C)(=O)=O)C2)cc1Br 2123324819 WHXRBAXBQMSAMX-GFCCVEGCSA-N 347.278 1.792 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CC(=O)N(c2ccccc2F)C1 1636536998 BMFDGLIABOOWIQ-LBPRGKRZSA-N 344.342 1.701 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1CCC(=O)NC1)NCc1ccc(OC)c(C)c1 1495014024 VWSNLHZAWYHUMJ-CVEARBPZSA-N 347.459 1.514 10 10 EDCE COC(=O)Cc1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1 1633978344 CEOBTQAMCAZKNY-UHFFFAOYSA-N 329.352 1.672 10 10 EDCE Cc1nc(N2CCN(C(=O)c3ccc(N=NC(N)=O)cc3)CC2)n[nH]1 1631806523 OQDQRFPQOIDURA-UHFFFAOYSA-N 342.363 1.238 10 10 EDCE CC[C@@H](C(=O)NCc1cccc(OC)c1O)N1CCO[C@H](CC)C1 1630365604 AEXQDWMFDOELDC-CABCVRRESA-N 336.432 1.906 10 10 EDCE CNC(=O)C1(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)CC1 1731622425 IIQFRBWAIWVZHT-CYBMUJFWSA-N 333.432 1.124 10 10 EDCE Cn1cncc1[C@H](CO)NC(=O)c1cc2cc(O)c(O)cc2s1 1647841570 YRHPAAOQIZHXER-VIFPVBQESA-N 333.369 1.509 10 10 EDCE CN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@@H]1CCN2CCO[C@H]1C2 1641313985 NLBNYINPKAVPIG-KGLIPLIRSA-N 331.376 1.394 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H](NC(C)=O)C(C)C)cc1C 1662395575 XYJDGNWJXBESAQ-KBXCAEBGSA-N 349.475 1.759 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@@H](O)C[C@@H]32)cc1Br 2128875199 KTKBQSHCPVHBTL-FPMFFAJLSA-N 327.222 1.636 10 10 EDCE C[C@@H]1CO[C@@H](CO)CN1c1ccc(CN)c(Br)c1F 231840438 AENZMBNFPXNGAC-PSASIEDQSA-N 333.201 1.633 10 10 EDCE NC(=O)CN(Cc1ccccc1)c1cc2c(cc1F)[C@@H](O)C(=O)N2 1946830908 IPBZATABMDDEHE-MRXNPFEDSA-N 329.331 1.303 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)CC1(O)CNC1 1952206720 OMBOXNNDGLIVAM-GFCCVEGCSA-N 338.404 1.258 10 10 EDCE CC(C)(C)OC(=O)NC[C@@]1(CO)COCCN1c1ccc(N)cc1 1999450497 YSMANODUKWQOPR-QGZVFWFLSA-N 337.420 1.361 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CN(C(=O)c3cccc(O)c3O)C[C@@H]21 2006292959 KGBZNRNOCOAQKH-PTEHBNRSSA-N 334.372 1.693 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010404688 BXBAVMBABCNAJA-QWRGUYRKSA-N 341.412 1.952 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H]2CS3(=O)=O)c(F)c1Br 321588287 JYVSGWGZCIODHJ-DTWKUNHWSA-N 349.225 1.423 10 10 EDCE CCOC(=O)[C@@H](NCCN=[N+]=[N-])c1c(C)nn(C)c1Br 2197473445 MJSCAYWOAVWCBK-VIFPVBQESA-N 345.201 1.995 10 10 EDCE C[C@@H](NC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)c1ccccc1O 1557966729 OOEMZJFIOMTKBM-VXGBXAGGSA-N 338.404 1.845 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(O)c(O)c2)[C@@H]2C[C@@H]21 1907374812 YMAUHYFJVWWBIF-NEPJUHHUSA-N 334.372 1.932 10 10 EDCE C[C@H](N)c1ccc(N(C)[C@H]2CC(=O)NC2=O)cc1Br 2114737838 PRBUBXVFVQBNBC-CPCISQLKSA-N 326.194 1.320 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])C1 2213593564 SKEPTMALXFFJTF-IJLUTSLNSA-N 339.396 1.970 10 10 EDCE COc1ccc(Br)c(CN2CC[C@@H]3CNC[C@H]32)c1O 2227743046 NHSCNUKLCANGMV-BXKDBHETSA-N 327.222 1.957 10 10 EDCE CN(C)C(=O)[C@@H]1C=CCN1c1cc(Br)c(CN)cc1F 2280238014 RWMZDPURHVXBJF-LBPRGKRZSA-N 342.212 1.880 10 10 EDCE CN(C)C(=O)[C@@H]1C=CCN1c1ccc(CN)c(Br)c1F 2280363740 CXZNWJCHDBYXJD-NSHDSACASA-N 342.212 1.880 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(COC(=O)N3)C2)c(Br)c1 2351839987 LSTZCAOSEWOWQZ-MRVPVSSYSA-N 327.178 1.801 10 10 EDCE COC(=O)[C@H](CN)N(C)Cc1ccc(C)c(Br)c1O 2352947936 LGTYLDFDSZTBRH-JTQLQIEISA-N 331.210 1.395 10 10 EDCE O=C1N=C(N2CCN(CCO)CC2)S/C1=C/c1ccc(F)cc1 20289542 IEPQDTHCSQEWPY-SDNWHVSQSA-N 335.404 1.406 10 10 EDCE CCCCNC(=O)NC(=O)CN1CCN(c2ccc(OC)cc2)CC1 38425539 IFFZGOKGAZSJSG-UHFFFAOYSA-N 348.447 1.443 10 10 EDCE COc1cc(/C=C2\C(=O)N(C)C(=S)N=C2O)cc([N+](=O)[O-])c1O 38167728 RHZIJIFPMZUQJN-CLTKARDFSA-N 337.313 1.406 10 10 EDCE Oc1cc2c(cc1O)CN(c1ncnc(O)c1Br)CC2 2366901602 BBLIUPQSQNQVGQ-UHFFFAOYSA-N 338.161 1.919 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NC[C@@H]2CSCCS2)cc1 229577380 WMUDKGDZXXTGGA-CYBMUJFWSA-N 348.515 1.416 10 10 EDCE CN1CC[C@@]2(CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)C2)C1 368305301 UKKVFCCUZAYRSV-MRXNPFEDSA-N 332.360 1.458 10 10 EDCE Cc1ccc(CNC(=O)N2CCN[C@@H](C)C2)c(O)c1Br 2380747047 RLTXVXPFWIKVQD-JTQLQIEISA-N 342.237 1.966 10 10 EDCE Cc1ccc(CN2C[C@@H]3OC[C@H](CO)[C@@H]3C2)c(O)c1Br 2380802062 BNEFIKOTVPLCED-AVGNSLFASA-N 342.233 1.902 10 10 EDCE CO[C@]1(C(=O)NCc2ccc(C)c(Br)c2O)CCNC1 2381140988 SKFRVPYLFYVNMO-CQSZACIVSA-N 343.221 1.458 10 10 EDCE COC(=O)CCCNC(=O)NCc1cc(Br)ccc1O 806302090 CCUWJIATBSYPJU-UHFFFAOYSA-N 345.193 1.907 10 10 EDCE COC(=O)[C@@H](CF)NCc1cc(Br)cc(OC)c1O 809778375 QAYUQGZHICUMIH-SECBINFHSA-N 336.157 1.764 10 10 EDCE OC[C@@H](CNCc1ccc(N2CCOCC2)cc1)c1cccnc1 808430696 JFOHVAUIGUUMJF-GOSISDBHSA-N 327.428 1.784 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H](CN4CCCC4)C3)cc2N1 814852884 SQYCNUZKCGENAQ-GFCCVEGCSA-N 346.387 1.848 10 10 EDCE CCN(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@H]1CCOC1 812879153 MNTHVJQOSPEVTO-KRWDZBQOSA-N 347.459 1.455 10 10 EDCE NCc1ccc(N2CCN(C(N)=O)CC2)c(F)c1Br 721771039 UKAIGPVHCULMMI-UHFFFAOYSA-N 331.189 1.248 10 10 EDCE COC(=O)[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2C)CCO1 734687409 ZCWVGFJATJCVAL-OAHLLOKOSA-N 335.404 1.144 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCOC[C@@H]2c2ccnn2C)cc1 844781043 BVZMWSHDEJNZOL-QGZVFWFLSA-N 343.431 1.769 10 10 EDCE CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1 917716089 LQPSNQPSBMTMGY-UHFFFAOYSA-N 341.410 1.987 10 10 EDCE Cc1cc(C(=O)N2CCOC3(CNC3)C2)c(C)n1-c1ccccn1 853245496 WIWPZBQJAUNURJ-UHFFFAOYSA-N 326.400 1.304 10 10 EDCE CCS(=O)(=O)C1(CNC(=O)NCc2cc(OC)ccc2O)CC1 853736512 DMUVOACFHUCAFO-UHFFFAOYSA-N 342.417 1.167 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cc3nnc(C)s3)C2)cc1 855225622 PDWJCAIXCSOBQY-GFCCVEGCSA-N 332.429 1.793 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCc3ccncn3)C2)cc1 855226906 UJUOSVKHDYRNPA-HNNXBMFYSA-N 326.400 1.813 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cn(CC4CC4)nn3)C2)cc1 855224601 MSUTYHKKHVSEKD-CQSZACIVSA-N 341.415 1.705 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@H]2CC[C@@H](O)[C@@H]21 860125883 DCTBUWNCFGAILQ-KVSKMBFKSA-N 331.460 1.556 10 10 EDCE C[C@H](NC(=O)CN1C(=O)NC(=O)C1(C)C)c1ccc(N(C)C)cc1 775406720 ZQKPBEMOJLZINA-NSHDSACASA-N 332.404 1.260 10 10 EDCE C[C@H](Sc1nnnn1C1CC1)C(=O)N1Cc2cccc(O)c2C1 871200569 GRDMRWRFQXAWQY-VIFPVBQESA-N 331.401 1.737 10 10 EDCE O=C(c1ccc(CN2CCOCC2)o1)N1Cc2cccc(O)c2C1 881429010 OYAAOETZLGNZQW-UHFFFAOYSA-N 328.368 1.973 10 10 EDCE C[C@@H](O)[C@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 895015679 HSSHKJRXWZSLNS-PRHODGIISA-N 334.185 1.875 10 10 EDCE COc1ccc(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)cn1 795303509 HCXATCVLKVSPFC-UHFFFAOYSA-N 349.412 1.728 10 10 EDCE C[C@]1(c2ccccn2)NC(=O)N(CCOc2ccc(N)cc2)C1=O 57849831 QHUZKJDRLMOLTF-QGZVFWFLSA-N 326.356 1.510 10 10 EDCE C[C@@H](N)c1ccc(N(C)CC(C)(CO)CO)cc1Br 689675476 QENZZUWKEMPNID-SNVBAGLBSA-N 331.254 1.896 10 10 EDCE CNC(=O)C1(NCc2ccc(N3CCC(O)CC3)cc2)CCOCC1 1331598223 UBIMLCRQEOYOMY-UHFFFAOYSA-N 347.459 1.033 10 10 EDCE O=C(NC[C@H]1CCC2(CCC2)CO1)C(=O)N1Cc2cccc(O)c2C1 1331887933 VMUXRSSNTZZUGJ-CQSZACIVSA-N 344.411 1.700 10 10 EDCE CC(C)(C)[C@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@@H]1O 1348640902 UURUUNVNAUMRDL-HOCLYGCPSA-N 346.427 1.490 10 10 EDCE CC(C)N1CCN(CCCC(=O)NCc2cccc(O)c2O)CC1 1352671389 QYNWIWQGBJHMIH-UHFFFAOYSA-N 335.448 1.520 10 10 EDCE Cc1nc(O)nc(S)c1C(=O)NCc1ccc2cccnc2c1O 1299723945 AFPICQMUXMKEIC-UHFFFAOYSA-N 342.380 1.963 10 10 EDCE CCS(=O)(=O)c1cccc(C(=O)NCc2cc(O)ccc2O)c1 1455355529 BRWZWSBIKYJJBO-UHFFFAOYSA-N 335.381 1.821 10 10 EDCE O=C(NCCCn1cc(CO)nn1)c1cc2cc(O)c(O)cc2s1 1468721074 RXKYNNVIAILIOS-UHFFFAOYSA-N 348.384 1.216 10 10 EDCE CCN(CCNC(=O)CCOC)C(=O)c1ccc(N=NC(N)=O)cc1 1704260326 VYMSWDOXROLVRI-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE C[C@@H](N)c1ccc(N2CC(C(=O)N(C)C)C2)cc1Br 2121048005 YAWPFAZEQFMLDE-SECBINFHSA-N 326.238 1.993 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(c2cccc(F)c2)C(=O)C1 1611096456 LXZJTGCGHYHUII-UHFFFAOYSA-N 344.342 1.655 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2nc(C)oc2C)cc1C 1716105778 BGVIPGWVWCHIFE-HNNXBMFYSA-N 347.415 1.489 10 10 EDCE CS(=O)(=O)C1(CNC(=O)Cc2ccc(O)c(O)c2)CCCC1 1623529251 QQDZRPWWHKANAG-UHFFFAOYSA-N 327.402 1.114 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)C3COC3)c(Br)cc21 1915667262 MONICOBSEUUGOH-GFCCVEGCSA-N 326.194 1.497 10 10 EDCE CC[C@H](OC)C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1720037814 YGLOFBGRVDFGJV-LBPRGKRZSA-N 335.364 1.120 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@H](C)[C@H](C)S(C)(=O)=O)c1 1630366443 PYYRBPUCSWKIQY-VWYCJHECSA-N 329.418 1.647 10 10 EDCE Cc1cc(CC(=O)N2CC(NC3COC3)C2)c(C)n1-c1ccccc1 1648030137 NITHLMKCPPGFEN-UHFFFAOYSA-N 339.439 1.836 10 10 EDCE CCC(=O)NC[C@@H](C)N(C)Cc1nnnn1-c1ccc(OC)cc1 1570690854 FXJPMLRVIFPETG-GFCCVEGCSA-N 332.408 1.017 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2[C@@H](C(=O)NCCCCN=[N+]=[N-])[C@@H]21 1964944425 PUOQIQCURGFEHG-SDDRHHMPSA-N 339.396 1.827 10 10 EDCE COC(=O)NCC(=O)N1CC[C@@H](CNCc2ccc(OC)c(C)c2)C1 1774057942 ONYSASVXNBAXMQ-HNNXBMFYSA-N 349.431 1.298 10 10 EDCE Cn1c(Br)nnc1CCNCc1ccc(O)cc1O 2128771773 MBYBXXORAMVWMZ-UHFFFAOYSA-N 327.182 1.321 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)Nc3cc(C)on3)CC2)cc1 9856890 HSJKPKOEMOJJOW-UHFFFAOYSA-N 344.371 1.279 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H](O)[C@@H]3C)c(Br)cc21 1914304174 UJGNXBZJQBXORL-PAWXDDDFSA-N 340.221 1.621 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1COC[C@@H]1NC(=O)OC(C)(C)C 1900606980 ITJFQGXHRMSWMP-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CC[C@H](NC1CN(C(N)=O)C1)c1cc(Br)ccc1O 1917757828 AXICHPPAYNIPIP-NSHDSACASA-N 328.210 1.958 10 10 EDCE CO[C@H]1C[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)C1 2010388356 AEFYVMHOJGNKNQ-WOPDTQHZSA-N 339.396 1.922 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]12COC[C@@H]1CN(C(=O)OC(C)(C)C)C2 2010403854 KQOLBOYRZSQWIN-NHYWBVRUSA-N 339.396 1.639 10 10 EDCE O=C(O)C[C@]1(O)CCCN(Cc2ccc(Br)cc2O)C1 2160865439 RHLGRVDZMAWNSW-CQSZACIVSA-N 344.205 1.956 10 10 EDCE C[C@@H](OCc1ccccc1)[C@H](NC(=O)c1cccc(O)c1O)C(=O)O 706058592 UAOREEAQHYNOHC-ABAIWWIYSA-N 345.351 1.886 10 10 EDCE C[C@H]1C[C@@H]2CN(c3ccc(CN)c(Br)c3)CCN2C1=O 2181290293 UNGHWFCIRRLOBD-GXFFZTMASA-N 338.249 1.965 10 10 EDCE O=C(O)CN1CC(CNCc2cc(Br)cc(F)c2O)C1 2169323111 OOMXFSHDICIBAQ-UHFFFAOYSA-N 347.184 1.400 10 10 EDCE NCc1cc(F)c(N2[C@H]3CC[C@H]2CC(=O)NC3)cc1Br 2170535024 FGIXRZUULVGRHJ-UWVGGRQHSA-N 342.212 1.904 10 10 EDCE CCN(c1ccc(CN)c(Br)c1F)[C@@H]1CC(=O)NC1=O 2171208203 RYJFIALVTPULNE-SECBINFHSA-N 344.184 1.288 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2199533679 XIFMLNQOXXTTIK-LHVMMRPKSA-N 342.233 1.823 10 10 EDCE CCn1nc(Br)c([C@H](O)[C@H](N)c2ccccc2O)n1 2111411540 PFFHSEQQQGIJPS-MWLCHTKSSA-N 327.182 1.500 10 10 EDCE NCc1ccc(N2CCc3c(cnnc3O)C2)cc1Br 2206101150 XNHRBFXTBSFOFF-UHFFFAOYSA-N 335.205 1.966 10 10 EDCE C[C@@H]1CN(Cc2cc(Br)cc(F)c2O)CC2(CNC2)O1 2288444960 LGDJDRQCCNHLRT-SECBINFHSA-N 345.212 1.857 10 10 EDCE COCCN1CCC(CNC(=O)C=Cc2ccc(O)c(O)c2)CC1 2307987008 WJZMTLUUJFUYKP-UHFFFAOYSA-N 334.416 1.586 10 10 EDCE C[C@@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CC[C@H]1O 2310369557 OZZWVAHJNLHLPE-CRAIPNDOSA-N 330.428 1.766 10 10 EDCE Cc1ccc(CNC(=O)C2[C@H]3CNC[C@H]23)c(O)c1Br 2352949241 AWZHHDFKINPTFU-UWVGGRQHSA-N 325.206 1.545 10 10 EDCE COc1ccc(N2CCN(c3nccn(C(F)F)c3=O)CC2)cc1 288164258 PMBZUNQWSZSGDS-UHFFFAOYSA-N 336.342 1.974 10 10 EDCE COC(=O)[C@@H]1C[C@H](O)CN1Cc1ccc(C)c(Br)c1O 2380674209 UIXOOYVQEOARKY-QWRGUYRKSA-N 344.205 1.571 10 10 EDCE Cc1ccc(CN[C@@]23CC[C@@H](C2)[C@@H](O)[C@H]3O)c(O)c1Br 2380801137 OYOLBLZEHIHYBD-MOZUYYIMSA-N 342.233 1.827 10 10 EDCE Cc1ccc(CN2CCN(C[C@H](C)O)CC2)c(O)c1Br 2380815702 RNBHQOKZHURRPW-LBPRGKRZSA-N 343.265 1.962 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2NCCO[C@H]2C)c(O)c1Br 2381127465 YFCCXXVQSQVLEU-JOYOIKCWSA-N 343.221 1.456 10 10 EDCE C[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)C1(S(C)(=O)=O)CC1 804539989 RGNBFQBPZJVYRC-OAQKJQOQSA-N 325.386 1.193 10 10 EDCE CN1CCN(c2ccc(CN3CCO[C@]4(CCCOC4)C3)cc2)CC1 809687442 ZIQPOSTZYNEPRP-HXUWFJFHSA-N 345.487 1.820 10 10 EDCE O=C(NCc1cc(NC(=O)[C@@H]2CCOC2)ccc1O)[C@@H]1CCOC1 829558007 VEIZJGPVVWDNKT-VXGBXAGGSA-N 334.372 1.020 10 10 EDCE CCOc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)ncn1 585357303 ULFLFXCJBGHERY-UHFFFAOYSA-N 342.399 1.846 10 10 EDCE CC[C@@H]1C[C@H]1C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 837979379 NPKXNSFZBHMHRK-RHSMWYFYSA-N 346.427 1.933 10 10 EDCE Cc1cc(C(=O)N(C)CCN(C)CCO)c(C)n1-c1ccccn1 912609526 FABCFEAOROBCDY-UHFFFAOYSA-N 330.432 1.485 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=S)NCc3ccon3)C2)cc1 849270436 DAWSGBXQZQHUMZ-CYBMUJFWSA-N 332.429 1.926 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCCC[C@H]2[C@H]2CCNC2)cc1 844223707 AEWSWHGHCSIODP-HKUYNNGSSA-N 344.503 1.833 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)C3(O)CCCC3)CC2)cc1F 929820693 GFUSBBQFIBAESU-QGZVFWFLSA-N 338.423 1.622 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C3(O)CCSCC3)C2)cc1 855234295 WUFGQOGRNPTDKA-CYBMUJFWSA-N 336.457 1.648 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCN(C)C(=O)C3)C2)cc1 855232189 PEHAWKCGVZABSM-UONOGXRCSA-N 331.416 1.259 10 10 EDCE CCS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCC[C@H]2C)cc1 769865176 GKOCLLSERONFHZ-LLVKDONJSA-N 347.462 1.589 10 10 EDCE Cc1cn(C2CCOCC2)nc1C(=O)NCc1ccc(O)c(O)c1 866769456 LCJZQOYLWABBRQ-UHFFFAOYSA-N 331.372 1.884 10 10 EDCE C[C@H](NC(=O)Cc1ccc(C(N)=O)nc1)c1ccc(N(C)C)cc1 860949907 DWLMVRZAVXQAOB-LBPRGKRZSA-N 326.400 1.666 10 10 EDCE CC[C@@H](C(=O)NCc1ccc2cccnc2c1O)N1CCCC1=O 862027960 LAXJEODHRHHTRL-AWEZNQCLSA-N 327.384 1.958 10 10 EDCE CNC(=O)C1(NCc2c(O)cccc2Br)CCOCC1 895885534 QXGWNASCVAHCNG-UHFFFAOYSA-N 343.221 1.540 10 10 EDCE CNC(=O)[C@H]1CCC[C@H]1NC(=O)c1cc2cc(O)c(O)cc2s1 897268553 MIBXKRSSIZFLQN-VHSXEESVSA-N 334.397 1.957 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cccc(-n2ccnc2O)c1 1178916785 AVLOMQSJJVHLAH-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE CN(CC1(C)COC1)c1cc2c(cc1Br)[C@H](O)C(=O)N2 702959869 YHNFARQSTOVILY-LBPRGKRZSA-N 341.205 1.907 10 10 EDCE O=C(C(=O)N1CC[C@H](N2CCCCC2)C1)N1Cc2cccc(O)c2C1 1330415560 NVYHRVQLQIGDAQ-HNNXBMFYSA-N 343.427 1.321 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC([C@@H](C)O)C3)c(Br)cc21 719789302 DORTUMYONSJOEI-UHLUBPPHSA-N 340.221 1.479 10 10 EDCE C[C@H](NC(=O)C(=O)N1C[C@H]2COC[C@]2(C)C1)c1ccc(N(C)C)cc1 1330967339 AZRZSLHRZUMVKP-RFUYNDQBSA-N 345.443 1.425 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2cncnc2)cc1C 1267983103 YBZDFHCLOFWDSO-CYBMUJFWSA-N 328.416 1.949 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)CC(C)(F)F)cc1C 1283803688 KWDRUDATTNXTMI-CYBMUJFWSA-N 330.375 1.616 10 10 EDCE C[C@@H](NC(=O)[C@@H](O)c1cnn(C)c1)c1ccc(N2CCOCC2)cc1 1442406238 AEPPLVJJWBNWOE-DYVFJYSZSA-N 344.415 1.168 10 10 EDCE COC(=O)N1C[C@H]2C=C[C@H]1[C@@H](C(=O)NCc1cccc(O)c1O)C2 1520508889 ONAXVWSFEXVCBL-DRZSPHRISA-N 332.356 1.357 10 10 EDCE O=C(Cc1ccn(CC(F)(F)F)n1)NCc1cccc(O)c1O 1528782378 SZZJERFBLXGCRY-UHFFFAOYSA-N 329.278 1.716 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2COCCO2)cc1C 1700738322 MNRYHNYYMNFUFH-WMLDXEAASA-N 336.432 1.356 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)c2cn(C)c(O)n2)cc1C 1482868536 VIZLLMNFYKDQHP-ZDUSSCGKSA-N 346.431 1.741 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C[C@H]2CCN(C)C2)cc1C 1483184542 PJYYKRKGIPDGOG-NVXWUHKLSA-N 333.476 1.940 10 10 EDCE CC1(NCCO)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1717304500 IFCOSGXRRGHEGQ-UHFFFAOYSA-N 333.392 1.426 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)c3ccnc(CO)c3)C2)cc1 1638649929 PKHHBICDYUNQRK-AWEZNQCLSA-N 341.411 1.839 10 10 EDCE COc1cccc2c1OC[C@H](NC(=O)Cc1ccc(O)c(O)c1)C2 1632566613 XXJRMYGIRDJDHY-CYBMUJFWSA-N 329.352 1.769 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)CCCS1(=O)=O 1632681239 NXJQLXMBSYLQTL-BONVTDFDSA-N 327.402 1.112 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@H]1CC(=O)N(Cc2ccccn2)C1 1639441002 FHJSLFIFUMFGKT-ZDUSSCGKSA-N 341.367 1.158 10 10 EDCE COC(=O)CN(C(=O)c1ccc(N=NC(N)=O)cc1)C1CCOCC1 1630113911 GFIXUNHTMCJVAF-UHFFFAOYSA-N 348.359 1.643 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]([C@H]1CCCO1)C1(CO)CCC1 1639166778 FPJONNMJYPXUBR-NVXWUHKLSA-N 335.400 1.467 10 10 EDCE CN(c1cc(Br)c(CN)cc1F)[C@@H]1CCC(=O)NC1 2127090011 GFWMLBHYZGBXKE-SECBINFHSA-N 330.201 1.762 10 10 EDCE CC[C@H](N[C@@H]1CC(=O)N(C)C1=O)c1cc(Br)ccc1O 116072821 MEBXEQNKIIPJJY-WDEREUQCSA-N 341.205 1.953 10 10 EDCE OCC12COC(CNCc3cccc(Br)c3O)(C1)C2 1967801187 FAHTZTAJKDRNMC-UHFFFAOYSA-N 328.206 1.786 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2cccc(O)c2O)[C@H](O)C1 2005086158 UCSYGDIVWINQRF-GXTWGEPZSA-N 338.404 1.558 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CO[C@@H](CNC(=O)OC(C)(C)C)C1 1985094447 OYUZVIMVXMQDEM-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CN1CCCc2cc([C@@H](N)[C@H](O)CNC(=O)OC(C)(C)C)ccc21 1999584955 ROTYUXKFCVYRNM-HZPDHXFCSA-N 335.448 1.954 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@H]1CNC(=O)c1ccc(O)c(O)c1 2006292280 YWABXVDYDGRXRA-NWDGAFQWSA-N 336.388 1.988 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H](O)C[C@@H]3C)c(Br)cc21 385109371 SBHLYSCPQZJTGP-UPFKWVMWSA-N 340.221 1.621 10 10 EDCE COc1cccc(Cn2nc(O)cc2I)c1O 2070204157 WVUIGAGHMCDTDC-UHFFFAOYSA-N 346.124 1.956 10 10 EDCE COc1ccc(Br)c(CN2CCn3cnnc3C2)c1O 1231548492 SZJTYTGIUOSZFZ-UHFFFAOYSA-N 339.193 1.771 10 10 EDCE C[C@@H](N)c1ccc(N2CC3(CNC(=O)N3C)C2)cc1Br 2177693131 FOFJXRGXUHLEBM-SECBINFHSA-N 339.237 1.683 10 10 EDCE O=C(c1cc(O)c(O)c(O)c1)N1CCC(NC(=O)C(F)(F)F)CC1 169852887 DNMQTIUQWQGWEH-UHFFFAOYSA-N 348.277 1.087 10 10 EDCE OCc1ccc(N2CCO[C@H]3COCC[C@@H]32)cc1Br 2087487598 SAIMLVOELJKMKF-KBPBESRZSA-N 328.206 1.936 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3OCCO[C@H]3C2)cc1Br 2093343063 BHBZQASZBBBYRP-STQMWFEESA-N 331.185 1.651 10 10 EDCE CCCN1C(=O)C(=CN(CC)[C@@H]2CCS(=O)(=O)C2)SC1=S 2296535442 FFIMSQJSMHTEDD-SNVBAGLBSA-N 348.515 1.607 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C[C@@H]2C(=O)O)c(O)c1Br 2352948128 MLJMSSOSSADFMM-IUCAKERBSA-N 328.162 1.800 10 10 EDCE Nc1ccc(CS(=O)(=O)NCC(F)(F)Br)cc1 383354860 PTBIWNOOWBDWIF-UHFFFAOYSA-N 329.166 1.676 10 10 EDCE Cc1ccc(O)c([C@@H](C)NC[C@@]2(CO)COCC3(CCC3)N2C)c1 527956666 QXYYDWIXTQSXAX-DNVCBOLYSA-N 334.460 1.967 10 10 EDCE CCn1ccnc1CNC(=O)NCc1ccc(N2CCOCC2)cc1 296431430 SRQHFIVDWKWLIS-UHFFFAOYSA-N 343.431 1.739 10 10 EDCE C[C@H](C[S@](C)=O)NC(=O)NCc1cc(Br)ccc1O 805280075 YINNLDHYUAUWSL-YLVJLNSGSA-N 349.250 1.721 10 10 EDCE CC(=O)C(=O)COC(=O)c1nn(-c2ccccc2F)c2c1CCC2 808503648 JORSYSUWGVSFIQ-UHFFFAOYSA-N 330.315 1.815 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)c1cn([C@H]2CCCNC2)nn1 818103617 ULRYEWFADHDMIA-HNNXBMFYSA-N 343.431 1.961 10 10 EDCE COc1ccc(N2CCC(NC(=O)/C=C/Cn3cncn3)CC2)cc1 900507425 FNXMNYVGWDMQEU-NSCUHMNNSA-N 341.415 1.628 10 10 EDCE CCO[C@@H]1[C@@H](C)[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 912709657 RNHSAHXYSFKGLF-MORSLUCNSA-N 332.444 1.935 10 10 EDCE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CC(S(N)(=O)=O)C2)c1 910519788 MBHDLXSPBKFCRJ-UHFFFAOYSA-N 347.440 1.515 10 10 EDCE COCCCCS(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849416193 LZXBRJBJMRJDGL-CQSZACIVSA-N 342.461 1.620 10 10 EDCE C[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccn1 855177178 JSQHKPJEAQADNN-LLVKDONJSA-N 349.412 1.692 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3cc(C)[nH]n3)C2)cc1 852129758 BOZYAVGXZBVADO-CYBMUJFWSA-N 329.404 1.805 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C2)cc1 855232539 RSDRZVOWIZJBTC-UONOGXRCSA-N 347.459 1.941 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3nc(C4CC4)no3)C2)cc1 866019937 XWHIYVGMZACBQS-GFCCVEGCSA-N 328.372 1.964 10 10 EDCE O=C(CN1CCCCC(=O)C1=O)NCc1ccc2cccnc2c1O 868938538 UZAPGTCFSUGJDK-UHFFFAOYSA-N 341.367 1.138 10 10 EDCE CC(=O)c1cc(O)ccc1NS(=O)(=O)c1cccc(C(N)=O)c1 1116606266 PVLSTTWXEFGTNW-UHFFFAOYSA-N 334.353 1.495 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H]2CN3C(N)=O)c(Br)c1 1877073555 HUHCGHLAIJXDHL-UWVGGRQHSA-N 325.210 1.249 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN1Cc1cc(Cl)cc(C)c1O 775734771 ZQJBPJICXJHIDN-ZDUSSCGKSA-N 332.853 1.868 10 10 EDCE CCOC[C@@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1895031680 LRXANOKMBOANEL-IJLUTSLNSA-N 328.409 1.182 10 10 EDCE COc1cccc(CNC(=O)c2cc3c(nc2O)CCC[C@H]3O)c1O 1137473312 FPSIMBOHTQUUEP-CQSZACIVSA-N 344.367 1.801 10 10 EDCE CC(=O)NCc1ccc(CNC(=O)c2ccc(C)c(O)c2O)cc1 1146950275 LWJMVYSRQNIWKN-UHFFFAOYSA-N 328.368 1.972 10 10 EDCE CC1(C)CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC(C)(C)O1 1329422026 GURLEKRVDDEZIV-UHFFFAOYSA-N 332.400 1.650 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@]1(C)CC1(F)F 1330950703 ILNJVRXBYMAGND-MRXNPFEDSA-N 339.386 1.839 10 10 EDCE C[C@@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1261089478 OJJKEPIVOOZVND-RHSMWYFYSA-N 343.427 1.220 10 10 EDCE COCCCN1CC(N(C)C(=O)c2ccc(N=NC(N)=O)cc2)C1 1269900035 VQUTUDCRGILCGF-UHFFFAOYSA-N 333.392 1.642 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)C1CC2(C1)CS(=O)(=O)C2 1349952132 VALVPURFCJGUMD-UHFFFAOYSA-N 346.408 1.381 10 10 EDCE CCOC(=O)N1CSC[C@@H]1C(=O)NCc1cccc(O)c1O 1520508813 MXOGLUSGZIALFM-SNVBAGLBSA-N 326.374 1.245 10 10 EDCE CN1C(=O)O[C@@H]2CN(c3ccc(CN)cc3Br)C[C@H]21 2120412837 UNFRELKEFQWGKI-VXGBXAGGSA-N 326.194 1.547 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@@H]2CCC(=O)N2)cc1C 1482893185 YYSJVOVYELVBCW-ZFWWWQNUSA-N 333.432 1.267 10 10 EDCE C[C@@H](CNC(=O)C1(C)CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1721943713 XZMKUPLCCQDOIC-JTQLQIEISA-N 331.376 1.884 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)Cc2nc[nH]n2)C(C)C)cc1C 1568466665 CZLQIALVNLSDBL-OAHLLOKOSA-N 345.447 1.595 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)c2nn[nH]n2)cc1 1634121628 RENMMNBVRNCCJI-UHFFFAOYSA-N 338.371 1.625 10 10 EDCE O=C(Cn1nnc(-c2ccccc2)n1)NCc1cc(O)ccc1O 1643879578 WFBBXDFMXYNXLO-UHFFFAOYSA-N 325.328 1.068 10 10 EDCE O=C(CCCNC(=O)c1ccsc1)NCc1c(O)cccc1O 1597569323 OCSJCWXQEYUVDC-UHFFFAOYSA-N 334.397 1.986 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCC[C@H](C)[S@](C)=O)c1 166533424 IIKMXHJLRCPFQC-WEVHURDZSA-N 328.434 1.918 10 10 EDCE O=C(O)CNC(=O)CN1C(=O)/C(=C\c2ccsc2)SC1=S 1858595648 FZPKKDQVUDJRDI-FPYGCLRLSA-N 342.423 1.150 10 10 EDCE CC(C)(C)OC(=O)N1CC(NCc2ccc(O)cc2O)(C(=O)O)C1 1913944307 NUBFCGCBYBQZQA-UHFFFAOYSA-N 338.360 1.262 10 10 EDCE CN(C)C[C@@H]1COC[C@@H]1NCc1c(O)cccc1Br 2141464612 KRODOBZNEDFSTM-MFKMUULPSA-N 329.238 1.821 10 10 EDCE CCCNCc1ccc(N2C[C@H](O)[C@H](O)C2)c(Br)c1 233113933 FMFHRACCRIQWSC-OKILXGFUSA-N 329.238 1.491 10 10 EDCE CCNC(=O)[C@H]1CNCCN1Cc1cc(Br)ccc1O 233485753 LDVBRYBIQOTUJE-GFCCVEGCSA-N 342.237 1.065 10 10 EDCE COc1cc([C@@](C)(NC(=O)OC(C)(C)C)C(=O)O)cc(O)c1O 1952081700 RIYNVXUWSAJFBS-OAHLLOKOSA-N 327.333 1.931 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1C[C@@H](O)CN1 1952346894 PCFMJZMGVODENV-JHJVBQTASA-N 338.404 1.256 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@](C)(NC(=O)OC(C)(C)C)C(C)(C)O 1985104870 MCHGCWGLKWOAJL-CQSZACIVSA-N 329.401 1.809 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1985103217 RUIGQSQNWUYREO-GHMZBOCLSA-N 327.385 1.421 10 10 EDCE CN(C)c1ccc([C@H](N)[C@@H](O)C2CN(C(=O)OC(C)(C)C)C2)cc1 1999536288 IKDBJYHCNAJEOY-HOTGVXAUSA-N 335.448 1.980 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)c1cnc(CNC(=O)OC(C)(C)C)nc1 2010388807 HEIWLXCMNRMNLI-UHFFFAOYSA-N 335.368 1.884 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)N2CCC(N=[N+]=[N-])CC2)C1 2010392193 XRMSEHJWISACBY-UHFFFAOYSA-N 339.396 1.660 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CC(=O)NCCCCN=[N+]=[N-])C1 2010402573 SJGJQEPHSHASEF-NWDGAFQWSA-N 341.412 1.811 10 10 EDCE CN[C@H](C)c1ccc(N2CC(=O)NC(=O)[C@H]2C)cc1Br 300519958 UZONGMYWVMSGPY-RKDXNWHRSA-N 340.221 1.581 10 10 EDCE C[C@H]1CNCCN1S(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 2162244016 GGZKEBNYTZKEPH-ZETCQYMHSA-N 340.232 1.649 10 10 EDCE O=C(O)[C@]12CN(Cc3cc(Br)ccc3O)C[C@@H]1CCO2 705101216 ROFYXEFIBNLRMQ-HZMBPMFUSA-N 342.189 1.830 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3C[C@@H](O)C3(C)C)c(Br)cc21 2201308111 HYQPACJJCFEYJV-VXGBXAGGSA-N 340.221 1.621 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H](O)C34CCC4)c(Br)cc21 2201413679 QNOUSVRYABICQI-RYUDHWBXSA-N 338.205 1.505 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2236633840 RYPBLUFJXYXNCF-UTUOFQBUSA-N 343.265 1.896 10 10 EDCE O=C1NC[C@H]2CN(Cc3cc(Br)ccc3O)CC[C@H]12 365661703 RGHPFWYWVIRLMJ-JQWIXIFHSA-N 325.206 1.723 10 10 EDCE Cc1ccc(CN(C)C(=O)C2(F)CNC2)c(O)c1Br 2352947833 VNQXMJPIZXPGTL-UHFFFAOYSA-N 331.185 1.733 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC(N3CCCC3)CC2)cc1 108864917 QJQCNPXLFJGSST-UHFFFAOYSA-N 344.503 1.929 10 10 EDCE COc1cc([N+](=O)[O-])cc([C@@H]2N[C@@H](C(=O)O)C(C)(C)S2)c1O 83236942 ZLUBVFJCYFVRGW-WDEREUQCSA-N 328.346 1.876 10 10 EDCE CN1C(=O)N(CC(=O)Nc2ccc(N)cc2)C(=O)C12CCCCC2 237104013 OTTNGGYFCHUQHX-UHFFFAOYSA-N 330.388 1.804 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@]3(O)CCCC[C@@H]3C2)cc1 140480353 ZPTSVIUIMCNJLQ-YLJYHZDGSA-N 345.487 1.996 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)N3CCCCCC3)CC2)cc1 240648669 AFLTWLSQKBWBKI-UHFFFAOYSA-N 345.443 1.746 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@H](C3CC3)C2)c1 375330624 ZABINBKVYBGJBH-AWEZNQCLSA-N 340.401 1.015 10 10 EDCE CC(=O)C(=O)COC(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1 808520101 KNUMZCMLDBEUGI-UHFFFAOYSA-N 341.245 1.601 10 10 EDCE COC[C@H]1CCN(C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 800890300 DTZCVASRFAOIHJ-HNNXBMFYSA-N 333.432 1.906 10 10 EDCE CC(=O)C(=O)COC(=O)CCCS(=O)(=O)c1ccc(Cl)cc1 808549673 LFGGKMTXCKRVSN-UHFFFAOYSA-N 346.788 1.595 10 10 EDCE COC[C@]1(C(=O)O)CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 392779692 DOLHCLOUNZEFRV-HNNXBMFYSA-N 340.332 1.540 10 10 EDCE CC(C)N(C[C@@H](C)O)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803660897 IRZZOBLLMZFBSU-GFCCVEGCSA-N 339.411 1.126 10 10 EDCE OCCN1CCCC[C@@H]1CNCc1ccc(N2CCOCC2)cc1 824583448 LTINOBPTQPRXHG-LJQANCHMSA-N 333.476 1.460 10 10 EDCE Cc1cc(CC(=O)N2CCO[C@@H](C(N)=O)C2)c(C)n1-c1ccccc1 824823820 DUGOSZXHYQBAFQ-QGZVFWFLSA-N 341.411 1.349 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCCN(c2cccnn2)CC1 588404610 KGRXSTPGSADEPJ-ALCCZGGFSA-N 340.383 1.640 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)NCc1nc(CO)n[nH]1 912942080 ZQUSMHPLMMQLLZ-UHFFFAOYSA-N 331.401 1.696 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@@H]3C[C@H]2C[S@]3=O)c([N+](=O)[O-])c1 845735574 YBPNPXNUIDDWJB-ZJEXCAJLSA-N 336.369 1.491 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)N(C)CC(C)C)C2)cc1 849416182 LXJHQDPFJSCKTR-AWEZNQCLSA-N 341.477 1.696 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCNC[C@@H]2C)cc1 846172416 MFELBAFNDAYAQZ-WMLDXEAASA-N 334.464 1.771 10 10 EDCE CCc1noc(C)c1NC(=O)C(=O)NCc1cccc(OC)c1O 755066332 VSMNNJOLFXLSCF-UHFFFAOYSA-N 333.344 1.515 10 10 EDCE COC(=O)C1=CC[C@@H](NC(=O)NCc2ccc(N(C)C)c(F)c2)C1 858738195 AXWUEZAIGHYPOL-CYBMUJFWSA-N 335.379 1.953 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H]3C(F)F)nc12 931427603 PTAKVGCJUSHKBA-JTQLQIEISA-N 326.303 1.451 10 10 EDCE CC(=O)C(=O)COC(=O)/C=C/[C@H]1CCCN(C(=O)OC(C)(C)C)C1 869740731 QQFOPQGUZRGTAF-SBDDDAINSA-N 339.388 1.891 10 10 EDCE Nc1ccc(CS(=O)(=O)N[C@@H]2CCCC3(C2)OCCO3)cc1 1876528197 YKKQKWYEQKEEHB-CQSZACIVSA-N 326.418 1.374 10 10 EDCE O=C(NC[C@]1(O)[C@H]2[C@H]3C[C@@H]4[C@@H]5[C@H]3[C@H]1[C@@H]5C[C@H]42)c1cccc(O)c1O 787680214 BBPKBDLWUNNSBV-BOQSDGSVSA-N 327.380 1.337 10 10 EDCE O=C(Nc1ccc(S(=O)(=O)CCO)cc1)c1cc(O)cs1 1137757846 WRHFZYHFVLFDAM-UHFFFAOYSA-N 327.383 1.472 10 10 EDCE O=S1(=O)CC[C@]2(CN(Cc3cc(F)cc(F)c3O)CCO2)C1 895078100 CVMSKIFJGYAAOF-AWEZNQCLSA-N 333.356 1.060 10 10 EDCE COc1cc(N2C[C@@H](CCO)[C@@H](CO)C2)c([N+](=O)[O-])cc1OC 1307234045 LNCZMOSDZVRSIW-GHMZBOCLSA-N 326.349 1.039 10 10 EDCE Cc1sc2ncc(C(=O)NCc3cc(O)ccc3O)c(=O)n2c1C 1303225274 DYZODAPGORDBEP-UHFFFAOYSA-N 345.380 1.714 10 10 EDCE CC1(C)OC[C@@H]([C@@H]2CN(C(=O)Cc3ccc(O)c(O)c3)CCO2)O1 1177097031 KAPXWLGUMUUHJQ-GJZGRUSLSA-N 337.372 1.019 10 10 EDCE C[C@H](O)C[C@@H]1CCCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1330418647 QIDKFKZHYLRNAN-JSGCOSHPSA-N 332.400 1.386 10 10 EDCE CN(c1ccc(CN)cc1Br)C1CCS(=O)(=O)CC1 694192354 NNQXIOVCFDYWJU-UHFFFAOYSA-N 347.278 1.921 10 10 EDCE CNC(=O)[C@H]1CN(C(=O)/C=C(/C)c2cnccn2)c2ccccc2O1 1350994204 BJMQIFJMCXDAIS-HMWXGYMHSA-N 338.367 1.420 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C1)OCCN2C(=O)c1cc(O)cs1 1353390989 OFSGYRVGNCPYHY-UHFFFAOYSA-N 340.401 1.873 10 10 EDCE C[C@@H](CNC(=O)CCN(C)C)NC(=O)c1ccc(N=NC(N)=O)cc1 1284323810 FQIZTFKYFVYZDE-NSHDSACASA-N 348.407 1.035 10 10 EDCE CCn1cc(C(=O)N(C)C[C@@H](C)NCc2ccc(OC)c(C)c2)nn1 1283694083 RKKRKUBOIRPJSV-CQSZACIVSA-N 345.447 1.865 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)NCC1(CN=[N+]=[N-])CC1 2117729610 XKSVMGLAFCZNQX-UHFFFAOYSA-N 349.214 1.551 10 10 EDCE CC(C)(C)C#CC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1703175523 MCJTVUZWHDGXAA-UHFFFAOYSA-N 343.387 1.745 10 10 EDCE O=C(NCC1CC1)[C@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1544280955 OUEZBESTQQQPCC-AWEZNQCLSA-N 332.400 1.405 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H]2CN3CCC2CC3)cc1C 1481230927 JSLGFHLZVBKYFT-GOSISDBHSA-N 345.487 1.893 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2C[C@H]2C(N)=O)cc1C 1717741904 WXSWRFLCRJWGEN-YUELXQCFSA-N 333.432 1.062 10 10 EDCE C[C@H](NC(=O)Cc1ccc(S(N)(=O)=O)s1)c1ccccc1O 1557967493 FBKVEQWJRNAKBZ-VIFPVBQESA-N 340.426 1.521 10 10 EDCE CN1CCN([C@H]2CC[C@@H](NC(=O)Cc3ccc(O)c(O)c3)CC2)CC1 1556299438 OLMIFONMQWMPCL-IYBDPMFKSA-N 347.459 1.315 10 10 EDCE Nc1c(C(=O)NCCc2ccc(O)c(O)c2)cnn1-c1ccccc1 1636022596 MQKZEVSRHWXMLY-UHFFFAOYSA-N 338.367 1.838 10 10 EDCE CC[C@H](CN[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1)OC 1491691398 GMYXNIYYUNSGSZ-BXUZGUMPSA-N 335.408 1.982 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN2CCOc3cccc1c32 1631691535 JNGVUTNJPMFASA-UHFFFAOYSA-N 326.352 1.886 10 10 EDCE CN(C)C(=O)/C=C\C(=O)Nc1c(-c2ccccn2)nc2ccccn12 1637107714 GFSFXZCLQPAZMK-KTKRTIGZSA-N 335.367 1.979 10 10 EDCE NS(=O)(=O)c1ccsc1C(=O)NCc1cccc(Cl)c1O 1647830519 ZVZRXYWXGHCJBH-UHFFFAOYSA-N 346.817 1.685 10 10 EDCE N=C1NC(=O)[C@@H](CC(=O)NCc2ccc3cccnc3c2O)S1 1643283173 JRVQYUJMYWNWDE-SNVBAGLBSA-N 330.369 1.113 10 10 EDCE O=C(CCn1cnc2sccc2c1=O)NCc1c(O)cccc1O 1645361007 SOQHXXDQPPYTBM-UHFFFAOYSA-N 345.380 1.576 10 10 EDCE C[C@]1(CNC(=O)Cc2ccc(O)c(O)c2)COc2ccccc2O1 1646507133 KHZFIDJBUMWPDZ-SFHVURJKSA-N 329.352 1.987 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@H](O)C2(C)C)cc1Br 2124804277 QZHGZSFXNNFZOW-OLZOCXBDSA-N 329.238 1.489 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)c2nccnc2N)cc1C 1668005744 ZPFHCYQLDVXYPS-ZDUSSCGKSA-N 343.431 1.674 10 10 EDCE COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1597633840 BTFVHHDFVLNWGN-OLZOCXBDSA-N 348.359 1.642 10 10 EDCE [N-]=[N+]=N[C@H]1CCN(S(=O)(=O)c2cncc(Br)c2)C1 1912143434 GGDMIWDPXDYOMC-QMMMGPOBSA-N 332.183 1.917 10 10 EDCE Nc1ccc(OCCN2CCC[C@@H](NC(=O)C(F)(F)F)C2)cc1 586063430 LKVIRRMQOKQUMB-GFCCVEGCSA-N 331.338 1.791 10 10 EDCE CO[C@@H]1C[C@H](C(=O)O)N(Cc2c(O)cccc2Br)C1 2136360056 OIIJXTKDLHQKSU-LDYMZIIASA-N 330.178 1.829 10 10 EDCE CC(C)(C)NCc1ccc(N2C[C@H](O)[C@H](O)C2)cc1Br 232494487 DAIPDNVPNOPXRI-OKILXGFUSA-N 343.265 1.879 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2140662022 JVENZGIMUWSRLJ-GZFGJDTESA-N 334.185 1.382 10 10 EDCE CNCc1ccc(N2CCNC(=O)C2(C)C)c(Br)c1 234449525 CCZHZLGLRLJCRD-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE CO[C@H](CO)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951699248 QWRIWCJCAWTDDG-BXUZGUMPSA-N 327.377 1.541 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(C(=O)C(=O)C[C@H]1C[C@H](N)C1)C(F)F 1980377022 KTEXGRIOOMOSBT-UTEYVOQOSA-N 334.363 1.801 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1985103286 SJXKRNWMHDFEAX-MNOVXSKESA-N 327.385 1.421 10 10 EDCE CNC(=O)CN(CCC(=O)Nc1ccc(N)cc1)Cc1ccccc1 2034781381 FGRJEYQXPRPOPP-UHFFFAOYSA-N 340.427 1.846 10 10 EDCE CCCN1C(=O)C(=CNc2ccc([N+](=O)[O-])cc2)C(=O)NC1=S 2053511469 UVRYWZLDMIFTCF-UHFFFAOYSA-N 334.357 1.544 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H](c3ccccc3)N(C)C)c2n1 2064300001 WNBUTJGYHFNZHR-OAHLLOKOSA-N 339.399 1.776 10 10 EDCE Cc1cc(O)n2ncc(C(=O)Nc3c4c(nn3C)CCCC4)c2n1 2065187846 PKQYOKMPBSUAME-UHFFFAOYSA-N 326.360 1.608 10 10 EDCE COc1ccc(N2CCOC[C@@H]2CN)c(OC)c1Br 2106372159 CEKPSDLHMALZEQ-VIFPVBQESA-N 331.210 1.630 10 10 EDCE C[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2273250968 LTJLYRWAMZQEJR-QNRPFLCFSA-N 327.178 1.394 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2CCC(=O)N2)c1O 2227747318 YQOXVUQBZIMSOK-QMMMGPOBSA-N 329.194 1.532 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)[C@@H](O)CC2)cc1Br 2269122751 XQBVURCKCOKYLS-HERUPUMHSA-N 330.222 1.824 10 10 EDCE NCc1ccc(N2C[C@@H]3OCC[C@]3(CO)C2)c(F)c1Br 2296384060 KNCXKZOZCQTIAT-SMDDNHRTSA-N 345.212 1.635 10 10 EDCE OC[C@H](O)[C@@H]1CCN1c1ccc(CNC2CC2)c(Br)c1 2286208959 MTVVLQKWTBEWGB-GJZGRUSLSA-N 341.249 1.633 10 10 EDCE COc1ccc(NC=C2C(=O)NC(=O)N(C(C)(C)C)C2=O)c(OC)c1 2296946530 MILXZWCWDDYBCP-UHFFFAOYSA-N 347.371 1.877 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H](CCO)COCc1ccccc1 2320371372 SJWCSDBUVISWLD-INIZCTEOSA-N 345.395 1.724 10 10 EDCE Cc1ccc(CN2CCN(C)S2(=O)=O)c(O)c1Br 2327602355 HNDXPZUUQJAMPY-UHFFFAOYSA-N 335.223 1.455 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCCOC1 171599552 UEXWNYZLFLMVEH-QGZVFWFLSA-N 347.459 1.874 10 10 EDCE Cc1cc(C(=O)N[C@@H]2CCc3ncnn3C2)c(C)n1-c1ccccn1 112651326 AHHOLRPMIGEKKK-CQSZACIVSA-N 336.399 1.825 10 10 EDCE Cc1cccc(CN2CCN(CCNC(=O)NC(C)C)CC2)c1O 179933916 IXEDWDBIQHASDE-UHFFFAOYSA-N 334.464 1.526 10 10 EDCE CCCNS(=O)(=O)N1CCc2cc(N3CCOCC3)ccc21 62526682 JJBZJUHCOMOGMS-UHFFFAOYSA-N 325.434 1.130 10 10 EDCE C[C@@]1(c2cccc(CNCc3ccccc3O)c2)NC(=O)NC1=O 171130133 PGXSBRLRCVMJOC-SFHVURJKSA-N 325.368 1.737 10 10 EDCE COc1ccc(O)c(CNC(=O)NCc2nnc3ccccn23)c1 114583711 DAVDVLUESFEKLJ-UHFFFAOYSA-N 327.344 1.443 10 10 EDCE Cc1ccc(O)c([C@H](C)NCCS(=O)(=O)N2CCSCC2)c1 185395106 JQFRGVBJRULSNH-ZDUSSCGKSA-N 344.502 1.730 10 10 EDCE CC[C@@H](C)NC(=O)CN1CCN(Cc2cc3c(cc2O)CCC3)CC1 74172931 HLBOOAUPYUSVTA-OAHLLOKOSA-N 345.487 1.913 10 10 EDCE COc1cc(/C=C2/SC(=S)N(CCCO)C2=O)ccc1O 210384779 SDZHBBUWRZLWGE-XYOKQWHBSA-N 325.411 1.984 10 10 EDCE CO[C@@H]1O[C@H](CN=[N+]=[N-])[C@@H](O)[C@H](N=[N+]=[N-])[C@H]1NC(=O)c1ccccc1 32107297 BXZZELVEUAWUOZ-CBLPJQPBSA-N 347.335 1.506 10 10 EDCE CN1CCC[C@@H](CNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255204055 XFKJYHPRGXZIRW-KKMIYCERSA-N 343.471 1.994 10 10 EDCE CO[C@H]1C[C@@H](N(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 286041239 PTSCQBCYQILOSA-PHIMTYICSA-N 328.390 1.013 10 10 EDCE Cc1ccc(CN2C[C@H](CC(=O)O)[C@@H](O)C2)c(O)c1Br 2381137784 QJDNKZFPKNMBJK-QWRGUYRKSA-N 344.205 1.731 10 10 EDCE Oc1c(F)cc(Br)cc1CNC[C@H]1Cc2nncn2C1 2167745823 HYYZUKQNBZPEEK-MRVPVSSYSA-N 341.184 1.847 10 10 EDCE C[C@@H]1CC[C@H]1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 805864058 OTJWHMHXROYVQD-UKPHBRMFSA-N 344.459 1.986 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC[C@H](O)CN1CCOCC1 819376889 JVMFHTKWXCZDNM-LPHOPBHVSA-N 335.492 1.275 10 10 EDCE C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC[C@@H](C)O1 826707745 XHHKAEZLEXDVRZ-KGLIPLIRSA-N 333.432 1.395 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@H](OC)[C@H]3CCOC3)CC2)cc1 822918948 GFHRYUHKLFHJIH-MAUKXSAKSA-N 348.443 1.785 10 10 EDCE C[C@H]1CCC[C@H](CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)O1 826707724 WWCPUUPZVYIFFW-XJKSGUPXSA-N 333.432 1.443 10 10 EDCE Cc1nc(NC(=O)NCc2cc(Br)ccc2O)nn1C 836642552 UVJQYABINRTQPE-UHFFFAOYSA-N 340.181 1.913 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)N2CC(S(N)(=O)=O)C2)c1C 910514628 YRVCSJRZSBCTJF-UHFFFAOYSA-N 347.440 1.515 10 10 EDCE COC[C@H]1C[C@@H](O)CN1c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 845680969 GTADBANZSPZCKP-LOWFTVKWSA-N 336.344 1.367 10 10 EDCE NCC1(CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 846342496 CWJWIZIIBIYUMC-UHFFFAOYSA-N 344.459 1.148 10 10 EDCE C[C@H](O)[C@@H]1CN(C(=O)NCCCSc2nccs2)CCO1 840324872 HWACMGWXAJZQQR-QWRGUYRKSA-N 331.463 1.417 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C[C@H](C)O)C3CC3)C2)cc1 854295968 FQJRMEBANSBPLS-KBPBESRZSA-N 333.432 1.829 10 10 EDCE COC1(OC)CCN(Cc2cc(Cl)cc(C(C)=O)c2O)C[C@@H]1O 931640656 ZQXLYJFFXVOQDF-AWEZNQCLSA-N 343.807 1.804 10 10 EDCE CC(=O)N1CCO[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)C1 930297394 YVWCZBJDADMXIS-GOSISDBHSA-N 347.459 1.737 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H](C(=O)OC)C1 1117912738 TWMKTYXNLIYUOF-CQSZACIVSA-N 348.399 1.152 10 10 EDCE C[C@@H](NC(=O)[C@@](C)(O)Cn1ccccc1=O)c1ccc(N(C)C)cc1 790940149 JEFXPSBJOXXWSQ-KUHUBIRLSA-N 343.427 1.543 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CCc2nncn2CC1 889294898 AUUUHNZECAZSOE-CYBMUJFWSA-N 341.415 1.722 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC3C[C@@H]4C[C@H]4C3)C2)cc1 1328210055 OJCIUOASKBSEQY-IHRRRGAJSA-N 343.427 1.305 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1C[C@H]2C=C[C@H]1O2 1334177283 RMHNQZOYCTXDDP-CKEIUWERSA-N 332.375 1.622 10 10 EDCE COC(=O)c1c(CNCc2nnc(C)n2C)c2cc(F)ccc2n1C 1331552841 KJQPXTPYLHXBAE-UHFFFAOYSA-N 345.378 1.831 10 10 EDCE C[C@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1345504645 BECGIYYCPWCZJN-FZMZJTMJSA-N 337.395 1.049 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3C[C@H]4CCC[C@H]43)ccc21 1340602639 IMEKYHPYMYMQLN-DJIMGWMZSA-N 341.455 1.990 10 10 EDCE CO[C@H](CCNC(=O)C(=O)N(C)Cc1ccccc1O)C(F)(F)F 1346982057 PGMQVOYPVPDAON-GFCCVEGCSA-N 348.321 1.434 10 10 EDCE CC[C@H](CNC(=O)[C@H]1CCC(=O)N1)NCc1ccc(OC)c(C)c1 1269377311 DAJGFULXMSVIGR-HUUCEWRRSA-N 333.432 1.267 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2C[C@H]3C=C[C@H]2CC3)cc1F 1354439108 SICKMLWIIKAPIM-NOLJZWGESA-N 345.418 1.979 10 10 EDCE COc1ccc(CNCCC[C@H](C)NC(=O)[C@H]2COC(=O)N2)cc1C 1277177918 KRYJQBWDOFZPDZ-DZGCQCFKSA-N 349.431 1.487 10 10 EDCE COC(=O)[C@@H](O)CCNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1353510479 NGEUYJZKCLOJGY-KRWDZBQOSA-N 344.411 1.677 10 10 EDCE NC(=O)c1ccc(OCC(=O)NCc2cccc(Cl)c2O)cc1 1606860410 KVCLAWHYKOUXCM-UHFFFAOYSA-N 334.759 1.840 10 10 EDCE COCCC(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1533602366 USLRCBFBAAFUQS-SNVBAGLBSA-N 335.364 1.120 10 10 EDCE CCCC(=O)NC[C@H]1CCN1Cc1nnnn1-c1ccc(OC)cc1 1498913694 WUIUIQZLRKEZLH-CQSZACIVSA-N 344.419 1.162 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc([N+](=O)[O-])cc2c1OCCO2 1643882374 UFAMBKGAECNPSA-UHFFFAOYSA-N 346.295 1.707 10 10 EDCE CNC(=O)N[C@H]1CCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 1654085779 RETUCTFBHYXOOV-LBPRGKRZSA-N 325.796 1.752 10 10 EDCE COCCC(=O)N1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1744128398 VFLRYYFHXPJAOB-ZDUSSCGKSA-N 347.375 1.216 10 10 EDCE O=C(CN1Cc2ccccc2OC1=O)NCc1ccc(O)c(O)c1 1595595592 HAIRMAMZVVSIGC-UHFFFAOYSA-N 328.324 1.729 10 10 EDCE CCO/C=C/C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1596355519 RYPBSSXSIILMSF-FMIVXFBMSA-N 331.416 1.555 10 10 EDCE CN(C)C[C@@H]1C[C@H](O)CN1c1ccc(CN)c(Br)c1F 231840233 FNJYBHBMNSXFFY-QWRGUYRKSA-N 346.244 1.548 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]1(CO)CCN(C(=O)OC(C)(C)C)C1 1985104070 FDXUDHCKCFJTKA-CQSZACIVSA-N 327.385 1.375 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H]1CNC(=O)COc1ccc(N)cc1 1999127242 ZKBMNJYYVDACGP-ZDUSSCGKSA-N 335.404 1.773 10 10 EDCE CN(Cc1c(Br)nnn1C)C(=O)c1ccc(O)c(O)c1 2156461900 FTJZLCVVSHRQRA-UHFFFAOYSA-N 341.165 1.261 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(CCO)C(=O)C2)cc1Br 2171074160 JHCNUHOTGFJQHL-SNVBAGLBSA-N 343.221 1.143 10 10 EDCE CCNCc1ccc(N(C)[C@H]2COC[C@H]2O)cc1Br 708088490 GWTIHJFGLADKLJ-UONOGXRCSA-N 329.238 1.755 10 10 EDCE CO[C@H]1C[C@H](N(C)C(=O)c2cnn3c(O)cc(C)nc23)C12CCC2 2062331861 QXVMWXFOCMKUIA-STQMWFEESA-N 330.388 1.773 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3C[C@H](N(C)C)C34CCC4)c2n1 2063754171 MAXBIDIXSMIVIB-STQMWFEESA-N 329.404 1.346 10 10 EDCE CN1C[C@@H]2C[C@H](C1)N2c1cc2c(cc1Br)[C@H](O)C(=O)N2 2187626520 LSKWBUYZPXHWIS-DAROEXNTSA-N 338.205 1.327 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)c(Br)c2)[C@H](CO)[C@H]1OC 2233356682 QNJQBTHAPJKZMO-MGPQQGTHSA-N 345.237 1.119 10 10 EDCE CN(C)c1ccc([C@H](O)[C@@H](N)c2nn(C)nc2Br)cc1 2235740417 OLUUVMKGKJXUTO-JQWIXIFHSA-N 340.225 1.377 10 10 EDCE COc1ccc(Br)c(CNCCN2CCCO2)c1O 2227750322 JLTSCSBWUATSAH-UHFFFAOYSA-N 331.210 1.890 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@H](O)CC2)cc1Br 2269137232 HALXVVGKTXCJIX-QCZZGDTMSA-N 329.238 1.791 10 10 EDCE Cc1ccc(CN2C[C@H]3C[C@@]2(CO)CO3)c(O)c1Br 2352687222 FZOIEWRIGBUAQV-BXUZGUMPSA-N 328.206 1.799 10 10 EDCE CN[C@@H](c1ccccc1O)[C@@H](O)c1nc(Br)cn1C 2353756842 LVYKZUCHJGXHAT-NWDGAFQWSA-N 326.194 1.882 10 10 EDCE CN(C)c1ccc([C@H](CN2CCC(O)CC2)N2CCNCC2)cc1 107901880 NIHZWWLCCYDZSH-IBGZPJMESA-N 332.492 1.156 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@H]4[C@@H]3CO)c(Br)cc2[C@@H]1O 2357563279 JTNFPYQSLXHUMM-PMNUGZBVSA-N 339.189 1.252 10 10 EDCE CC[C@@H](C)[C@@H](NC(N)=O)C(=O)N1CCN(c2ccc(OC)cc2)CC1 70719011 ADEZDWWAPUGKIT-CZUORRHYSA-N 348.447 1.427 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccncc3C(=O)O)CC2)cc1 83238419 VKEJOSKPYIWIAK-UHFFFAOYSA-N 341.367 1.751 10 10 EDCE CS(=O)(=O)[C@@H]1CSCCN1c1ccc(/C=C\C(=O)O)cc1 221370925 GNMKLGHONFCHHP-LLPBQKLSSA-N 327.427 1.708 10 10 EDCE CN1C2(CCC2)COC[C@@]1(CO)CNCc1cc(Cl)ccc1O 527752012 FJQPLOGZYATXLG-KRWDZBQOSA-N 340.851 1.751 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1 808520660 WCMFEHOFQUJOSX-AWEZNQCLSA-N 347.367 1.005 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)CCCCO 298229641 JBPHZUFLOQCMIU-UHFFFAOYSA-N 349.475 1.721 10 10 EDCE Nc1ccc(CC(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)cc1 832002314 HITQOPXJQHSAIU-UHFFFAOYSA-N 325.416 1.761 10 10 EDCE COC(=O)[C@H]1COCCN1C(=O)c1cc2cc(O)c(O)cc2s1 900925333 YDNQRPVXGRTSJU-SECBINFHSA-N 337.353 1.327 10 10 EDCE COC[C@@]1(C(=O)NCc2cccc(Br)c2O)CCOC1 830530263 YAWYIKXXVNMVMF-AWEZNQCLSA-N 344.205 1.824 10 10 EDCE C[C@@H]1C[C@H]1N1C[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)CC1=O 743813790 HKMUGHMEOZNEDO-IVMMDQJWSA-N 330.432 1.561 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@H]3C[C@@H](C(N)=O)C3)CC2)cc1 844944552 KSVJIQGYWQYMNZ-XBXGTLAGSA-N 346.431 1.227 10 10 EDCE COc1ccc(N2CCCN(C(=O)N[C@H]3CNCC[C@H]3C)CC2)cc1 841975429 FVTPQRDIXIHKBQ-QAPCUYQASA-N 346.475 1.915 10 10 EDCE COc1ccc(-c2cc(C(=O)OCC(=O)C(C)=O)nn2C)cc1OC 923837856 OELWZQKHFZMMFX-UHFFFAOYSA-N 346.339 1.419 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3cncnc3N)C2)cc1 854300117 UZYNFWNZVYZHAV-CYBMUJFWSA-N 342.403 1.146 10 10 EDCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N[C@H]1CC12CC2 852387452 DJAWJSKCMICGIG-HNNXBMFYSA-N 349.456 1.273 10 10 EDCE Cc1cc(C(=O)N[C@H]2CCNC(=O)CC2)c(C)n1-c1ccccn1 854960361 GYXYJGBYJVSNCQ-CQSZACIVSA-N 326.400 1.888 10 10 EDCE COC(=O)N[C@H](C(=O)NCc1ccc2cccnc2c1O)C(C)C 862028438 ZHLJGGLBLUOTQO-ZDUSSCGKSA-N 331.372 1.937 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccn(C2CC2)c1=O 867301843 GCGHFZLCQRZOIN-NSHDSACASA-N 328.368 1.955 10 10 EDCE C[C@H](NC[C@]12COCCN1C(=O)OC2)c1cc(F)cc(F)c1O 866522229 UGBSFOLAYSZMGC-BJOHPYRUSA-N 328.315 1.542 10 10 EDCE COc1ccccc1[C@H](O)CNC(=O)/C=C/c1ccc(O)c(O)c1 779528390 HNROHOHWDYAUHI-MNDMWVCDSA-N 329.352 1.969 10 10 EDCE OC1CCN(c2ccc(CNCc3noc4c3COCC4)cc2)CC1 1119682367 HBQXLADJVZBWDP-UHFFFAOYSA-N 343.427 1.998 10 10 EDCE C[C@@H](NC(=O)CNC(=O)c1ccccn1)c1ccc(N(C)C)cc1 773993517 HDDSVIUBLTWTPS-CYBMUJFWSA-N 326.400 1.755 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H](O)Cc1cnn(C)c1 786801547 JJSWJBBXDSJIJE-GOSISDBHSA-N 344.459 1.827 10 10 EDCE C[C@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)CCS1(=O)=O 896489806 YGJZIKQCNDNTPF-QMMMGPOBSA-N 341.410 1.572 10 10 EDCE C[C@@H]1C[C@@]2(CC[C@H](CNC(=O)c3c(F)ccc(O)c3O)O2)CO1 899476899 AOHZYRMKCSLMFE-LYGAQUJYSA-N 325.336 1.693 10 10 EDCE COCCNC(=O)CN(C)[C@H](C)c1cc(Br)ccc1O 133126960 ZAJUSZLNDOBYRG-SNVBAGLBSA-N 345.237 1.910 10 10 EDCE Cc1nc2ncnn2c(C)c1CCC(=O)NCc1ccc(O)cc1O 1142531160 WZTQNIXSSISPRE-UHFFFAOYSA-N 341.371 1.401 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(C(=O)NC)nc1 1140198408 CEJLJNSNWXNNDW-UHFFFAOYSA-N 334.372 1.563 10 10 EDCE C[C@@H]1COCC[C@H]1NC(=O)C(=O)NCCCSc1nccs1 1323025993 LASDRLQAVNJJSO-GHMZBOCLSA-N 343.474 1.283 10 10 EDCE C[C@@H]1COC2(CCCC2)CN1C(=O)C(=O)N(C)Cc1ccccc1O 1329767455 DGSDTWQBQDATKM-CQSZACIVSA-N 346.427 1.911 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)c2cc[n+]([O-])cc2)cc1C 1320341107 CGFMIFSDPZRDNN-HNNXBMFYSA-N 343.427 1.935 10 10 EDCE C[C@@H]1C[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1321705453 CPCBGDBLQZISFU-OCCSQVGLSA-N 349.406 1.051 10 10 EDCE CO[C@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 1324280070 KNIUDSSKBRMTEM-RDJZCZTQSA-N 345.443 1.587 10 10 EDCE CCN(CC)CCN(C(=O)OC(C)(C)C)[C@H](CN=[N+]=[N-])C(N)=O 698451864 LUPVLZDUIUMRRB-LLVKDONJSA-N 328.417 1.730 10 10 EDCE CCC(=O)N[C@H](C)C(=O)N(C)CCNCc1ccc(OC)c(C)c1 1267376693 NWMHJVXGEUSOSJ-CQSZACIVSA-N 335.448 1.466 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H](NC(C)=O)C(C)C)cc1C 1267457033 AQXKIVTYNFQAQA-GOSISDBHSA-N 349.475 1.712 10 10 EDCE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCC[C@@H]1CNCCS1(=O)=O 1340064127 NHQYXXFZCRICEE-MGPQQGTHSA-N 338.473 1.615 10 10 EDCE CC1(C(=O)NCC2CN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)CC1 1297215853 XUYPAVSWZCKKBR-UHFFFAOYSA-N 343.387 1.837 10 10 EDCE Cc1cc(NC(=O)c2ccc(C3=S=CC=C3)o2)n2ncnc2n1 1525568341 JEAAKGACJGUDSR-UHFFFAOYSA-N 325.353 1.904 10 10 EDCE C[C@H](NC(=O)C[C@@H]1CCC(=O)NC1)c1ccc(N2CCOCC2)cc1 1542403346 SRRWQLNGYSRGMI-GJZGRUSLSA-N 345.443 1.617 10 10 EDCE COc1ccc(-n2nnnc2CN(CCCNC(C)=O)C(C)C)cc1 1481345817 GGVOLRCDSZJFLG-UHFFFAOYSA-N 346.435 1.408 10 10 EDCE COc1cccc(CNC(=O)Cc2nc(C3CCOCC3)n[nH]2)c1O 1622779523 QONSKWOJOBLTOS-UHFFFAOYSA-N 346.387 1.272 10 10 EDCE CS(=O)(=O)C[C@@H](C(=O)NCc1ccc(O)cc1O)c1ccccc1 1638353037 ZWXRYIVJEUFXDY-OAHLLOKOSA-N 349.408 1.542 10 10 EDCE COCCNC[C@](C)(NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1732251766 BKXAXXIPIPNQRW-KRWDZBQOSA-N 347.419 1.984 10 10 EDCE CC(=O)c1cc(F)cc(CN2C[C@@H](C)[C@H](CS(N)(=O)=O)C2)c1O 1654943988 KWQPEECMRZAKGR-SKDRFNHKSA-N 344.408 1.090 10 10 EDCE C[C@@H]1C(=O)NCCN1c1ccc(C=CC(=O)O)cc1Br 1911890106 HHTHEVHCCZKBSX-SECBINFHSA-N 339.189 1.872 10 10 EDCE O=C(NCc1cn(C2CC2)c(=O)nc1O)NCc1c(O)cccc1F 1684887822 UVDDWQSHNFLQID-UHFFFAOYSA-N 348.334 1.128 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)C2(C(N)=O)CC2)C(C)C)cc1C 1698975348 IUOFQKRFULXEPC-OAHLLOKOSA-N 347.459 1.500 10 10 EDCE CC(C)CC(=O)N[C@@H](C(=O)NCCc1ccc(O)c(O)c1)C(C)C 154008791 MLZGMMIKAUKKGP-QGZVFWFLSA-N 336.432 1.943 10 10 EDCE C[C@@H](O)c1ccc(N2CCNC(=O)C23CC3)cc1Br 2132030013 OXQLWFNHUPFTLX-SECBINFHSA-N 325.206 1.971 10 10 EDCE CN1C[C@@H](COc2ccc(N)cc2)N(C(=O)OC(C)(C)C)CC1=O 1952755240 OOOQANWMIGMKGD-ZDUSSCGKSA-N 335.404 1.725 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)[C@@H](CCO)C2)c(Br)c1 2149912527 DKSXBNDNUFDIQM-WXHSDQCUSA-N 343.265 1.896 10 10 EDCE CO[C@H]1C[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)C1 2010391603 AEFYVMHOJGNKNQ-GRYCIOLGSA-N 339.396 1.922 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@H](CN=[N+]=[N-])C2)C1 2010404993 WIEOVMCDCRQURA-NEPJUHHUSA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCc2ccccc2O)C1 2011935003 VVTXUIVCHUKGAZ-QGZVFWFLSA-N 336.388 1.380 10 10 EDCE COc1ccc(C=CC(=O)NN2C(=O)CSC2=S)cc1OC 2040469384 PZRRDOQLHHSXEG-UHFFFAOYSA-N 338.410 1.609 10 10 EDCE CCCNCc1ccc(N(C)C(CO)CO)c(Br)c1 394188895 CHXZAHHOILGPAV-UHFFFAOYSA-N 331.254 1.738 10 10 EDCE OCc1ccc(N2C[C@@H](O)[C@H](O)CC23CCC3)cc1Br 2169919839 DUGDSTPTLCZEKH-ZIAGYGMSSA-N 342.233 1.796 10 10 EDCE COCCNCc1ccc(N2CC=C[C@H]2CO)cc1Br 2176339734 RTCVXQSCNQHNQF-AWEZNQCLSA-N 341.249 1.922 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCC[C@@H](COc2nnc(=N)[nH]n2)C1 2213787588 MLCOFLNPPFBTGZ-WDEREUQCSA-N 338.412 1.389 10 10 EDCE CN(C)C[C@@H]1COC[C@H]1NCc1cc(Br)cc(F)c1O 2206389161 AXRHHYWNIJREEK-ZWNOBZJWSA-N 347.228 1.960 10 10 EDCE Cc1ccc2c(c1)C(=C1SC(=S)N([C@H](C)C(=O)O)C1=O)C(=O)N2 2293308678 VWBAEVPDXVDJPP-SSDOTTSWSA-N 348.405 1.992 10 10 EDCE CC(C)c1ccccc1N(C)C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 493494653 URCSAZFBTDQJAG-KHPPLWFESA-N 341.411 1.884 10 10 EDCE CC(=O)O[C@@H]1[C@H](N=[N+]=[N-])CO[C@]2(COC(C)(C)O2)[C@@H]1OC(C)=O 6363523 YWEMWEKIXSKBDT-UZWSLXQKSA-N 329.309 1.038 10 10 EDCE Cc1ccc(C(=O)N2CCC(N3CCO[C@H](C)C3)CC2)c(O)c1O 177676590 SWUQIQMYHUWLFD-CYBMUJFWSA-N 334.416 1.732 10 10 EDCE C[C@H]1CN(S(=O)(=O)CCOc2ccc(N)cc2)C[C@@H](C)S1 70490933 GYJBJWDREIAZGI-TXEJJXNPSA-N 330.475 1.803 10 10 EDCE Cc1noc([C@@H](C)N2CCN(C(=O)c3cccc(O)c3O)CC2)n1 193062289 RHWRKBVQDNUMHM-SNVBAGLBSA-N 332.360 1.308 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@](O)(C(N)=O)C2)cc1 276518832 SMONHEKBFQGGMH-SFHVURJKSA-N 327.384 1.156 10 10 EDCE C[C@@H]1C[C@H](N(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)CCN1C 283564618 RLEPBNFVTALSGS-RHSMWYFYSA-N 346.475 1.310 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC[C@H](O)C(F)(F)F)cc2)C1 818967878 DMMKQLATHYASTF-JSGCOSHPSA-N 345.365 1.401 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC[C@H](O)C(F)(F)F)cc2)C1 818967879 DMMKQLATHYASTF-OCCSQVGLSA-N 345.365 1.401 10 10 EDCE O=C1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CCN1 728195315 JPIDXODRYWYQEP-UHFFFAOYSA-N 340.379 1.651 10 10 EDCE COc1c(C)cc(/C=C2\SC(=S)N(CC(N)=O)C2=O)cc1C 727175434 BDKUWMKZMYYIPO-WDZFZDKYSA-N 336.438 1.999 10 10 EDCE CNC(=O)N1CCN(c2ccc([C@H](C)N)cc2Br)CC1 722153802 SKZASOWHMDNALO-JTQLQIEISA-N 341.253 1.930 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)C[C@H]3CCNC3)cc2F)CC1 828883440 LNEAHZNTZHQOAB-MRXNPFEDSA-N 348.466 1.583 10 10 EDCE COc1cc(O)c(CN2CCOC[C@H]2c2ccnn2C)cc1OC 844758298 UVCOFGMSMPBMPM-AWEZNQCLSA-N 333.388 1.716 10 10 EDCE O=C(NCCCSc1nccs1)N1C[C@@H]2C[C@H]1C[S@@]2=O 845047068 QPKHDPLCSOLMIZ-VUPYVKPUSA-N 331.488 1.540 10 10 EDCE COC(=O)[C@H]1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 741091070 WSBPXYIMNQLAIU-HNNXBMFYSA-N 329.400 1.767 10 10 EDCE CC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCCCO1 848930529 UWFKATTVLBIHGB-DLBZAZTESA-N 347.459 1.833 10 10 EDCE CN(C)CCN1CCN(Cc2ccc(N3CCCCC3)cc2)CC1=O 846012278 YYLIINQTQJWGNN-UHFFFAOYSA-N 344.503 1.883 10 10 EDCE CCC[C@@H](C)C(=O)NCCNC(=O)NCc1c(O)cccc1F 922603953 PMPOQIXLYVMQNZ-LLVKDONJSA-N 325.384 1.883 10 10 EDCE CN1CCC2(CC1)CN(C(=O)/C=C\c1ccc(O)c(O)c1)CCO2 844094533 OTBGRCLQJFCGRD-HYXAFXHYSA-N 332.400 1.434 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3CO[C@H](C)[C@H]3C)CC2)cc1 924832179 PRBAVQIBMOFJMP-GPMSIDNRSA-N 333.476 1.830 10 10 EDCE CC[C@H](NCC[C@H]1CNCCS1(=O)=O)c1ccc(F)cc1O 925789243 RFAJFPSGRCUEOO-JSGCOSHPSA-N 330.425 1.349 10 10 EDCE CN(C)C(=O)N(C)[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 856086477 AFDIDJMMRCJZMW-IYNGYCSASA-N 333.388 1.325 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cc3c(C)nn(C)c3C)C2)cc1 855232299 PHYUCSWWCRJZLW-HNNXBMFYSA-N 342.443 1.983 10 10 EDCE C[C@H](NC[C@@H]1COCCN1C)c1ccc(N2CCOCC2)c(F)c1 858519900 AZDALPMYPFBBKF-GOEBONIOSA-N 337.439 1.644 10 10 EDCE COC(=O)CCCCCS(=O)(=O)N1Cc2cccc(O)c2C1 867690548 HTTDKNHSRXYVNG-UHFFFAOYSA-N 327.402 1.771 10 10 EDCE CC[S@@](C)(=O)=NS(=O)(=O)N[C@H](C)c1ccc(N(C)C)cc1 867125983 RRCDZUGNVJJLMM-BIBXISHDSA-N 333.479 1.766 10 10 EDCE O=C(c1cccc(O)c1O)N1CC2(CC(=O)N2Cc2ccccc2)C1 871454831 AHAIJRWUKWQBCJ-UHFFFAOYSA-N 338.363 1.725 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1cccc(N2CCOC2=O)c1 1141842848 KBJTVQVWEIAXJJ-UHFFFAOYSA-N 342.351 1.913 10 10 EDCE C[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)[C@H]1CCO 1329872288 APYDTUVHETWMJL-WFASDCNBSA-N 332.400 1.244 10 10 EDCE CNCc1ccc(N2CC[C@@](O)(CN(C)C)C2)cc1Br 713717787 FMCOVXVAKWBZSL-OAHLLOKOSA-N 342.281 1.671 10 10 EDCE Oc1c(F)cc(Br)cc1CNCCCCc1nn[nH]n1 715744686 IEXPUJHUSXMYTI-UHFFFAOYSA-N 344.188 1.919 10 10 EDCE C[C@H](O)C1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 719752317 IMCVZWNEFUAGLF-QTTZVWFDSA-N 326.194 1.218 10 10 EDCE C=CS(=O)(=O)CCC(=O)N1CCN(c2ccc(OC)cc2)CC1 1338417017 WTHROXUTMVPMCA-UHFFFAOYSA-N 338.429 1.292 10 10 EDCE COC(=O)c1c(CN[C@H](CO)CCF)c2cc(F)ccc2n1C 1331579877 AWBFOIZTRPXEIW-NSHDSACASA-N 326.343 1.914 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2c[nH]c(C(N)=O)c2)cc1C 1267081546 MUIZBLWICNEGEG-UHFFFAOYSA-N 344.415 1.292 10 10 EDCE CNC(=O)C1(C(=O)NC[C@H](C)CNCc2ccc(OC)c(C)c2)CC1 1268006746 JEVPJYOBNNASGG-CYBMUJFWSA-N 347.459 1.372 10 10 EDCE Cc1ccccc1-n1cc(C(=O)NCCc2ccc(O)c(O)c2)nn1 1445937974 LKIKHUORVOSBAG-UHFFFAOYSA-N 338.367 1.959 10 10 EDCE COC(=O)c1ccc2c(c1)N(C(=O)/C=C\c1cnc(OC)nc1)CC2 1440070841 RSBXTQCKINKBDZ-UTCJRWHESA-N 339.351 1.874 10 10 EDCE CCO[C@H](CCN(C)C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1446012325 KDPSXDMSONOGRO-CQSZACIVSA-N 335.408 1.936 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1Cc1nncn1CC 1513793822 JDZAKCPVUZHITE-UHFFFAOYSA-N 341.419 1.842 10 10 EDCE Cc1cc(CNC(=O)NCc2nc(N)n[nH]2)c(C)n1-c1ccccc1 1479132820 IKRPOBDRSPFDHZ-UHFFFAOYSA-N 339.403 1.794 10 10 EDCE CN1CCN([C@H]2CCN(Cc3cc(Cl)ccc3O)C[C@H]2O)CC1 1614351581 ZAGZKFCUWAECBQ-DOTOQJQBSA-N 339.867 1.228 10 10 EDCE COc1ccc(C(=O)N(C)C)cc1NC(=O)Cc1ccc(O)c(O)c1 1544861197 WCESHYMRNFEZLO-UHFFFAOYSA-N 344.367 1.989 10 10 EDCE CN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(O)c(O)c1 1616338114 GFKODPQLKBZMHK-OAHLLOKOSA-N 342.395 1.456 10 10 EDCE COc1ccc(CNCC[C@H]2CCN(C(=O)CNC(C)=O)C2)cc1C 1484506677 XIYGKQOGVBBSHA-INIZCTEOSA-N 347.459 1.468 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)Cn2cncn2)C2CC2)cc1C 1480064010 FUFMLTGMNSCGHB-INIZCTEOSA-N 343.431 1.280 10 10 EDCE C[C@@H](O)c1ccc(N2CCC[C@@H]2[C@H](O)CO)cc1Br 2123170527 IGICYNSRGZVRFS-OWYVNGRQSA-N 330.222 1.824 10 10 EDCE CCOCCN1CC(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1494636008 RJWGQBIZNOIHNO-UHFFFAOYSA-N 333.392 1.547 10 10 EDCE C[C@@H]1[C@H](NCCCO)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1725575434 QBSMOSJODREXTL-BXUZGUMPSA-N 333.392 1.424 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@H]1CCCOC1 1567083509 MLLLXDDBLWTTBS-QWHCGFSZSA-N 347.419 1.984 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@]2(C)CCNC2=O)cc1C 1731735803 YETZSRNJWQGZPQ-KUHUBIRLSA-N 347.459 1.514 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)C3CC3)CC2)c(OC)c1 1648084258 LTIROHDRQVBRPK-UHFFFAOYSA-N 333.432 1.352 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)Cn2ccnc2)C2CC2)cc1C 1733192049 ZRWBSKJVQWAQHV-QGZVFWFLSA-N 342.443 1.885 10 10 EDCE C[C@@H](CNC(=O)C1CC1)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1734741224 UFLYGZRHNDWAMH-JTQLQIEISA-N 331.376 1.836 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)Cc2n[nH]c(C)n2)cc1C 1649450522 XVLWCGOPCUHITB-CYBMUJFWSA-N 345.447 1.609 10 10 EDCE Cc1c(Br)cnn1CC(=O)NCc1ccc(O)c(O)c1 1595595582 GLHORZSKXZOPFV-UHFFFAOYSA-N 340.177 1.682 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C[C@@H](C)C2CC2)cc(OC)n1 1758780483 JMAFJBBLVSCWNB-VXGBXAGGSA-N 349.431 1.770 10 10 EDCE CN(C)c1ccc(CNC(=O)Cn2cnn(C(C)(C)C)c2=O)cc1 155871574 YKTBALRBLARFAZ-UHFFFAOYSA-N 331.420 1.182 10 10 EDCE C[C@H](CN1CCN(C)CC1)N[C@H](C)c1ccc(N2CCOCC2)cc1 154883948 VOUDBDZJMARFSJ-QZTJIDSGSA-N 346.519 1.810 10 10 EDCE Nc1ccc(NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)c2ccccc2)cc1 1866198664 GBSWCUHPWOBBJC-CVEARBPZSA-N 325.368 1.483 10 10 EDCE O=S(=O)(Nc1cc(Cl)c(O)c(Cl)c1)N1CCC[C@@H](O)C1 1914131561 FJRQPRYAJMIMHN-MRVPVSSYSA-N 341.216 1.812 10 10 EDCE COCc1nc(-c2ccc(O)c(O)c2)[nH]c(=O)c1Br 234731578 JLDCARHIEBDOOT-UHFFFAOYSA-N 327.134 1.757 10 10 EDCE O=C(N[C@H](COCc1ccccc1)C(=O)O)c1cccc(O)c1O 1946579227 NEBICOPEUNCUHD-CYBMUJFWSA-N 331.324 1.498 10 10 EDCE CO[C@]1(C(=O)N(C)CCN=[N+]=[N-])CCN(C(=O)OC(C)(C)C)C1 1985093936 HQRRHUDRUKDABM-CQSZACIVSA-N 327.385 1.781 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1COC[C@H]1NC(=O)OC(C)(C)C 1985102032 AWIGCYJLCGIWCS-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CC(=O)Nc2ccc(N)cc2)C1 2022856091 WRIDBNXGLJUQDP-KRWDZBQOSA-N 335.404 1.969 10 10 EDCE CC(C)NCc1ccc(N2C[C@H](O)[C@@H](CO)C2)c(Br)c1 316634560 ZUSFFKSPZMUIFT-DOMZBBRYSA-N 343.265 1.737 10 10 EDCE CN(Cc1c(O)cccc1Br)[C@H]1COC[C@@H]1C(=O)O 706649263 KJIQCYQOWKBKTM-ONGXEEELSA-N 330.178 1.686 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCC=C[C@H]3CO)c(Br)cc21 2182332299 ODTPDROURCNVTG-ISVAXAHUSA-N 338.205 1.528 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1CNC(=O)c1cccc(O)c1O 1907373132 AGQJQUURUDQAHC-MNOVXSKESA-N 336.388 1.988 10 10 EDCE CN(C)C(=O)C1CN(c2cc(Br)c(CN)cc2F)C1 2121047881 XEYWPRWWVMHERH-UHFFFAOYSA-N 330.201 1.571 10 10 EDCE COc1ccc(Br)c(CN[C@@H](C)c2nn[nH]n2)c1O 2208786064 HGMHSJHJDMZHCB-LURJTMIESA-N 328.170 1.527 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCNC(=O)CC2)c1O 2236055844 RXDQNDGROSCINU-VIFPVBQESA-N 343.221 1.922 10 10 EDCE CSc1ncc(CNC(=O)c2c(Br)nnn2C)s1 2257102219 OTVYSVHUPJWLPO-UHFFFAOYSA-N 348.251 1.686 10 10 EDCE CCN(CCCNC=C1C(=O)N(C)C(=O)N(C)C1=O)c1ccccc1 52536947 AMTABQHVKNAFAW-UHFFFAOYSA-N 344.415 1.427 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1nc2ccccc2c(=O)[nH]1 115171578 PTGGABALYFGOCR-UHFFFAOYSA-N 325.324 1.307 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CC[C@H](C2CC2)N1 407348720 LXBOCESJUHUOBR-IAGOWNOFSA-N 347.434 1.809 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@H]2CCCN(S(C)(=O)=O)C2)c1 182414357 ZZLXZHYXEGJBQH-CHWSQXEVSA-N 342.461 1.723 10 10 EDCE O=C(Nc1cc(O)c(O)c(O)c1)N1CCN(C(=O)c2ccco2)CC1 217278955 SUFMBUJSVUFEBZ-UHFFFAOYSA-N 347.327 1.386 10 10 EDCE NC(=O)[C@@H]1CCCN(C(=O)COc2ccc(N3CCCC3)cc2)C1 132036381 IMCXLFBGVRFJOY-CQSZACIVSA-N 331.416 1.390 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NC[C@@H]2C[C@H]3C=C[C@@H]2C3)cc1 231918697 HDRVLHDKWVKSLS-ZNMIVQPWSA-N 344.411 1.915 10 10 EDCE N[C@H](c1cccc(I)c1O)C(F)(F)CO 95769584 JEWUJAIORFPVGX-MRVPVSSYSA-N 329.084 1.624 10 10 EDCE C[C@H]1C[C@H](O)C[C@@H](C)N1CC(=O)N(C)Cc1ccc(N(C)C)cc1 249118977 YYLJYGJHCXPRLM-JLVBRIDZSA-N 333.476 1.945 10 10 EDCE NC1=C(C(=O)N=NC(=O)CSc2ccc(Cl)cc2)NC=CN1 254762788 BSTARSPUYNDHRA-UHFFFAOYSA-N 337.792 1.729 10 10 EDCE CC[C@@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(=O)OC 255767807 GMJUVQDQYPVKQD-CXOKCQFOSA-N 332.400 1.604 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cnc2n1CCOC2 611658359 VADHAOSPHKZCGV-UHFFFAOYSA-N 328.372 1.519 10 10 EDCE CO[C@@H](C)c1noc(CN(C)C(=O)/C=C/c2ccc(O)c(O)c2)n1 272678472 RMCMIQICBQERPV-STUBTGCMSA-N 333.344 1.860 10 10 EDCE CCN1C[C@H](O)[C@H](N(C)Cc2ccc(C)c(Br)c2O)C1 2380774798 GRHCAHJNISVPCJ-OLZOCXBDSA-N 343.265 1.960 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CC[C@H](C(=O)O)O3)C2)cc1 819000934 CHPZAUCNQFJYIV-UHOFOFEASA-N 348.399 1.270 10 10 EDCE CNC(=O)[C@@H]1COCCN1c1ccc([C@H](C)N)cc1Br 723184063 YQKAIYNPLHCIKM-ZANVPECISA-N 342.237 1.420 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)C(C)(C)OC)nc12 730887653 WZOIZSQRDQAIMF-UHFFFAOYSA-N 337.332 1.080 10 10 EDCE C[C@@H](NC(=O)N(C)[C@@H]1CCN2CCO[C@H]1C2)c1ccc(N(C)C)cc1 836407438 ZFMWBFDZUVPZKV-OLMNPRSZSA-N 346.475 1.928 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC(C)(C)O[C@@H]3COC[C@H]32)cc1 844782294 UOTIMRBSSXRPNE-HZPDHXFCSA-N 333.432 1.840 10 10 EDCE C[C@H]1C(=O)N(CCN(C)C)CN1Cc1cc(Cl)c(F)cc1O 843428725 MHXXWIOUVBHUOA-JTQLQIEISA-N 329.803 1.737 10 10 EDCE CNCc1ccccc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 841002604 BXEPXZNXCOYMOR-UHFFFAOYSA-N 340.427 1.727 10 10 EDCE COc1ccc(N2CCN(Cc3cncnc3OC)CC2)cc1F 843396789 QPCHFPBBFMGYOP-UHFFFAOYSA-N 332.379 1.955 10 10 EDCE CO[C@@](C)(CO)CN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 848557590 GEBYHRCFVJRVGF-SUMWQHHRSA-N 326.412 1.710 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@H]2CNOC2)C1 848058537 DGMRDUJWEVDYIK-AWEZNQCLSA-N 343.427 1.854 10 10 EDCE C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)[C@H](C)CN1CCO 841892359 XVZOBZYYENFCCB-WDEREUQCSA-N 343.811 1.841 10 10 EDCE Cc1cc(CNC[C@@H](O)CN2CCOCC2)c(C)n1-c1ccccc1 743759915 WMEPBGXOXDWEIQ-HXUWFJFHSA-N 343.471 1.877 10 10 EDCE OCCO[C@@]1(CNCc2cc(Br)ccc2O)CCOC1 850358611 SKNZUMZYVRGNQR-CQSZACIVSA-N 346.221 1.412 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](CCO)C3CC3)C2)cc1 854298994 DJKLSWSQZRZIKQ-PBHICJAKSA-N 333.432 1.734 10 10 EDCE CCn1ncc(CNC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1 858600101 SVGFZLVNKKEFOD-CYBMUJFWSA-N 344.419 1.385 10 10 EDCE CC(C)[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 755864335 SIMQQSREHNGHPA-LLVKDONJSA-N 326.418 1.882 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCCCN3C(C)=O)C2)cc1 855229433 KIWIYZGABLKFRT-CRAIPNDOSA-N 345.443 1.791 10 10 EDCE COC[C@@H](NC(=O)NCc1c(O)cccc1F)[C@H]1CCCOC1 924050564 BQGWHSVSWQGSDQ-SMDDNHRTSA-N 326.368 1.772 10 10 EDCE CCOC(=O)C1(S(=O)(=O)N[C@@H](C)c2ccccc2O)CCC1 867836165 IFYJDOHNYCPUTN-NSHDSACASA-N 327.402 1.858 10 10 EDCE CC[C@@H](CO)N1CCN(Cc2cc(F)c(N(C)C)cc2F)CC1 862249257 JGMKPQPRGJHXCZ-AWEZNQCLSA-N 327.419 1.919 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)CNC(=O)c2cccnc2)c1 767957393 GOJJPXVYRNLYAU-LLVKDONJSA-N 329.356 1.403 10 10 EDCE COC(=O)c1cnc(SC[C@@H](O)CC2(O)CCOCC2)s1 871980555 CKQONUYOANRGGP-VIFPVBQESA-N 333.431 1.314 10 10 EDCE CCONC(=O)CNCc1c(C(=O)OC)n(C)c2ccc(F)cc12 895147937 AWLDJGALFIOUMS-UHFFFAOYSA-N 337.351 1.261 10 10 EDCE Cc1cc2[nH]nc(NC(=O)Cc3ccc(O)c(O)c3)c2c(=O)n1C 1142821803 RIIBPWFEJSKSTM-UHFFFAOYSA-N 328.328 1.162 10 10 EDCE CO[C@@H](C)CNC[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1319591957 FTGXUEMWWBSLNQ-NEPJUHHUSA-N 335.408 1.934 10 10 EDCE NC(=O)Cc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1 1312804154 OOUZYGXOXPZRKH-UHFFFAOYSA-N 325.368 1.645 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CSC2(C)C)cc1F 1325970736 DOGSGJDOONDQFM-CYBMUJFWSA-N 339.436 1.518 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@@H](O)C(C)(C)O 1191683239 VVNABJGGPZCUOZ-CYBMUJFWSA-N 331.796 1.152 10 10 EDCE CCN1CCC(CCNC(=O)C(=O)N(C)Cc2ccccc2O)CC1 1346239534 GXRFHLIYXHWIGO-UHFFFAOYSA-N 347.459 1.589 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@@H]2CCC(=O)N2C)cc1C 1268390931 AELVBYHIEPGRRK-HOCLYGCPSA-N 347.459 1.609 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H]2CCNC(=O)C2)cc1C 1268786814 FRHMZQVENOBVRP-INIZCTEOSA-N 347.459 1.468 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2coc(C)c2)cc1C 1507190164 CGTZKMMGGGPTNX-MRXNPFEDSA-N 332.400 1.786 10 10 EDCE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@]1(O)CCOC1 1287182815 ZEUXNFMMZOOISD-GOSISDBHSA-N 346.431 1.895 10 10 EDCE COCC(=O)N[C@H](C)[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1285270614 XTGLDUKNLJNQSN-ZJUUUORDSA-N 335.364 1.118 10 10 EDCE Cn1ncc(CNC(=O)c2cccc(O)c2O)c1Br 2116551568 JRLWPTZMTJJETO-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE COC[C@@H](C)C(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1295441841 AXCCUAMIHKMZOJ-MNOVXSKESA-N 349.391 1.366 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)C3(C(N)=O)CC3)C2)cc1C 1479393525 JIOHPURCQVOBBK-SHTZXODSSA-N 345.443 1.254 10 10 EDCE CN1C(=O)[C@H](/N=N/[C@@H]2CCC[C@H]([N+](=O)[O-])C2)[C@H](O)[C@H]2CCCC[C@H]21 1615013325 IWFZIMAGKPMOOH-WKYZLSFBSA-N 338.408 1.787 10 10 EDCE COc1ccc(CNCCC[C@H](C)NC(=O)[C@H]2CCC(=O)N2)cc1C 1485714467 HLLUFSGNFJATOH-GOEBONIOSA-N 347.459 1.657 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)Cn2cncn2)cc1C 1485002360 DGKANYIIROZYHF-AWEZNQCLSA-N 331.420 1.280 10 10 EDCE Cn1cc([C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)c2ncon2)cn1 1625165055 DCIUGZWUSMFOOA-QTLSWZBMSA-N 341.327 1.133 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2[nH]nnc2C)C(C)C)cc1C 1715726573 MPHSSIPEDMNXQG-HNNXBMFYSA-N 345.447 1.974 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2cn(C)nn2)C2CC2)cc1C 1713109773 WSMSSOSMFGOBLH-OAHLLOKOSA-N 343.431 1.430 10 10 EDCE COc1ccc(CN[C@@H]2C[C@H](C)N(C(=O)CNC(C)=O)C2)cc1C 1725573214 HMVNVTKLHVRAHS-XJKSGUPXSA-N 333.432 1.219 10 10 EDCE C[C@H](NC(=O)CNC(=O)c1ncccc1O)c1ccc(N(C)C)cc1 1634448267 OBESALHIHUMBAX-LBPRGKRZSA-N 342.399 1.460 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc(-c2cnccn2)no1 1633818302 HHLOMKUWBFYWQQ-SECBINFHSA-N 341.327 1.299 10 10 EDCE O=C(NCc1c(O)cccc1F)c1ccc(-c2nc(=O)o[nH]2)cc1 1639082142 CWNDAVOCBCQMGL-UHFFFAOYSA-N 329.287 1.805 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1COCCN1CC(F)F 1633819743 UUINPZVBXKWGJF-PWSUYJOCSA-N 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N[C@@H]1CCO[C@H]([C@H]2CCCCN2Cc2cc3c(cc2O)OCO3)C1 844911981 QOABTJSLQKKHGC-FMKPAKJESA-N 334.416 1.982 10 10 EDCE COCC[C@@H]1NC(=O)N([C@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849357158 KQEBXURGUYYDSP-ZFWWWQNUSA-N 333.388 1.231 10 10 EDCE COCCO[C@H]1CCN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])C1 844214408 PXNYSHYBHKLECP-DXTPNHAXSA-N 336.344 1.934 10 10 EDCE CC[C@H](CN1CCOCC1)NC(=O)NCc1c(O)cccc1F 925614012 WBGQAYAUARJBHX-GFCCVEGCSA-N 325.384 1.441 10 10 EDCE COc1ccc(N2CCN(C(=O)NCC34CC(CN3)C4)CC2)cc1F 851677473 QCEJWQKDDIABPH-UHFFFAOYSA-N 348.422 1.418 10 10 EDCE Cc1ccc(O)c(CNC(=O)N[C@@H](C)C2(S(C)(=O)=O)CC2)c1 858450103 YZXMQFZIKPGDTA-NSHDSACASA-N 326.418 1.466 10 10 EDCE C[C@@H](NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H]1[C@H]2CN[C@H]1C2 925689901 DFJIEANSCMLLMA-HQQPKKBNSA-N 337.414 1.887 10 10 EDCE C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cscn1 857553888 APCNJJOBUUHPBC-QMMMGPOBSA-N 341.414 1.711 10 10 EDCE OCCOc1cncc(NCc2ccc(N3CCC(O)CC3)cc2)n1 853955412 NRFGZWYARZPYEL-UHFFFAOYSA-N 344.415 1.421 10 10 EDCE CC[C@@H](NCCC(=O)NCCC(=O)OC)c1ccc(F)cc1O 858542878 YUOWZTDARVSSQQ-CYBMUJFWSA-N 326.368 1.641 10 10 EDCE COC[C@H](CCNC(=O)N[C@H](C)c1cc(OC)ccc1O)OC 852448698 NBXQKWIABMYLCE-YPMHNXCESA-N 326.393 1.813 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)CC3CN(C)C3)C2)cc1 852450746 UJZHNDBGTSEGCR-OAHLLOKOSA-N 332.448 1.477 10 10 EDCE CNC(=O)NC[C@H]1CCCCN1Cc1ccc(N2CCOCC2)cc1 931476651 LFPJFZBPQPBMLY-GOSISDBHSA-N 346.475 1.807 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCCN(C)C1=O 935945003 HHYHIURYNUDZEU-LBPRGKRZSA-N 325.405 1.753 10 10 EDCE CO[C@@H]1CCn2cc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)nc2C1 867302549 RHGAGQHLJOWDGW-DGCLKSJQSA-N 345.399 1.617 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2C[C@@H]3[C@H]4CC[C@@H](NC4)[C@H]3C2)c1O 863650893 BOGOOWPUXSWCIW-AHLTXXRQSA-N 333.388 1.739 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@H](C(F)F)CC2)cc1 872269826 QAZFKRDYCWZRFX-HNNXBMFYSA-N 341.402 1.725 10 10 EDCE Cn1c(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)cnc1Cl 776432987 IMWZTENVJFPLEQ-UHFFFAOYSA-N 331.737 1.278 10 10 EDCE CN1CCN(c2ccc(CN[C@@H]3CCO[C@@]4(CCOC4)C3)cc2)CC1 771873229 VEDPTADLYPSGGV-QUCCMNQESA-N 345.487 1.866 10 10 EDCE Cc1cc(C(=O)N[C@H](C)c2nnc(O)n2C)c(C)n1-c1ccccn1 880605422 ZVKVYROXLMBICO-LLVKDONJSA-N 340.387 1.814 10 10 EDCE C[C@H](NC(=O)c1cccc(O)c1O)[C@H](O)c1ccc2c(c1)OCO2 787750273 YFXYQOSBWXKIDG-VFZGTOFNSA-N 331.324 1.678 10 10 EDCE COc1ccc(N2CCN(C(=O)Nc3cn(C)nc3OC)CC2)cc1 789319072 MAKBLIZXQZVBCA-UHFFFAOYSA-N 345.403 1.791 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CC(=O)N2CC(N=[N+]=[N-])C2)C1 1895875487 JZEJRFPMVFVRQB-MWLCHTKSSA-N 325.369 1.125 10 10 EDCE C[C@H](O)CNCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCCC1 1318670796 NLDIOLQEBHJOFP-LBPRGKRZSA-N 347.419 1.862 10 10 EDCE C[C@@H]1COC[C@H]1N(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 688222906 MQYSRRDBZAOZOK-KEMBBXRSSA-N 341.205 1.906 10 10 EDCE CCC(=O)N[C@H](C)C1CN(Cc2nnnn2-c2ccc(OC)cc2)C1 1329951911 IKSMVHJLXHPJKR-GFCCVEGCSA-N 344.419 1.017 10 10 EDCE NC(=O)C1CCN(c2ccc(CN[C@H]3C[C@H]4CC[C@H]3O4)cc2)CC1 1332460260 TYZMWNHENKHCGW-FGTMMUONSA-N 329.444 1.798 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2ncccn2)cc1C 1268008388 NHZSRHUMPCCGRT-ZDUSSCGKSA-N 328.416 1.949 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cn(C)nn3)CCC2)cc1C 1273077598 NYXGTMADERMDHI-UHFFFAOYSA-N 343.431 1.574 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@@H]2CC2(C)C)cc(OC)n1 1526500661 LRUZCGSXJSTTFZ-PWSUYJOCSA-N 335.404 1.379 10 10 EDCE O=C(/C=C\[C@@H]1CCOC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1465420633 KIYVYNJUEHOBSG-CTGSTSKSSA-N 348.418 1.996 10 10 EDCE Cc1ccc(C(=O)Nc2ccc(OCc3nn[nH]n3)cc2)c(O)c1O 1617744284 YMXWPLJTOFNDGW-UHFFFAOYSA-N 341.327 1.751 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@H]2CC23CC3)cc1C 1700952245 QQEIGZGBQBTGFQ-HZPDHXFCSA-N 332.444 1.713 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)N1CC(NC2COC2)C1 1558610865 AWWSPXCVSLRSMK-UHFFFAOYSA-N 331.441 1.968 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1CCNC1=O 1497435711 FECHOGXPEPWACS-OAHLLOKOSA-N 333.432 1.078 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@@H]2C[C@@H]3C[C@@H]3C2)cc1 1720146266 KJOFYDJNSIVNNT-ITGUQSILSA-N 343.387 1.741 10 10 EDCE COc1cc(OC)nc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n1 1633818731 KHANCGDNONPWEC-SECBINFHSA-N 333.344 1.266 10 10 EDCE CC(C)OCCN1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1732118178 ATQLXYUCVNHXTL-UHFFFAOYSA-N 333.392 1.688 10 10 EDCE Cn1c(=O)n(C)c2cc(NC(=O)c3c(F)ccc(O)c3O)c(O)cc21 1648834768 RZJGWNCICKNDEM-UHFFFAOYSA-N 347.302 1.385 10 10 EDCE CCOC(=O)CN(CCCCS(C)(=O)=O)Cc1ccccc1O 1659100678 PHTDZXXCQTXWPU-UHFFFAOYSA-N 343.445 1.582 10 10 EDCE C[C@H](CNC(=O)NCCCSc1nccs1)N1CCOCC1 152148988 BGPZAJMAWZHUPJ-GFCCVEGCSA-N 344.506 1.645 10 10 EDCE Cn1c(C2=C[C@@H](O)[C@H](N)C2)nc2c(Br)cc(F)cc21 2131466947 VIXIUENYVSTPQB-MWLCHTKSSA-N 326.169 1.950 10 10 EDCE CC1(C)C[C@@H](O)[C@@H](O)CN1c1ccc(CO)c(Br)c1 2132172311 JFGJIYGVVAEOLG-OLZOCXBDSA-N 330.222 1.652 10 10 EDCE CCOc1cccc(CNCC(=O)N2CCC[C@H](C(=O)O)C2)c1O 1857866940 LBKLKTPYXKWEPK-ZDUSSCGKSA-N 336.388 1.204 10 10 EDCE CN1CCc2cc([C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)O)ccc21 1917191327 RIOXYDSDQOVKDL-KGLIPLIRSA-N 336.388 1.690 10 10 EDCE Oc1cccc(Br)c1CN[C@@H]1COC2(CCC2)[C@@H]1O 2141560642 ZMMOJXLQWNKDDT-DGCLKSJQSA-N 328.206 1.927 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@H](CO)C3)c(Br)cc21 252768583 JEBHLMKFYQNXHH-MADCSZMMSA-N 326.194 1.220 10 10 EDCE CC(C)(C)OC(=O)NC1(CNCc2ccc(O)c(O)c2O)COC1 1946129004 HQRBUDSXARDATG-UHFFFAOYSA-N 340.376 1.187 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1ccc(CO)cc1[N+](=O)[O-] 1946866318 AMKCJKHFMSDVEG-UHFFFAOYSA-N 329.356 1.840 10 10 EDCE O=C(O)C[C@@H](NC(=O)OCc1ccccc1)c1cc(O)nc(O)c1 1951656631 DWFTVDCVPLTXRT-GFCCVEGCSA-N 332.312 1.935 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]1(CO)CCCN1C(=O)OC(C)(C)C 1985094679 SANSGCZPTLGQQP-CQSZACIVSA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NCc2ccc3c(c2)CCO3)[C@H](O)C1 1997820034 NEAFIMKZGUTIFS-LSDHHAIUSA-N 334.416 1.691 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCCN(CC(=O)N2CC(N=[N+]=[N-])C2)C1 2010390083 YQYZKRZKZNUOBM-LLVKDONJSA-N 338.412 1.497 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H]2CS3(=O)=O)c(Br)c1 320949870 FICAVRMQOSWERK-INTQDDNPSA-N 345.262 1.845 10 10 EDCE O=C(N1CCC[C@@H](CNCc2ccc(O)c(O)c2O)C1)C(F)(F)F 689435129 WBCFSTIURHRNFC-VIFPVBQESA-N 348.321 1.694 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NCCc1ccc(O)c(O)c1 830530978 CZCQNOHOJZJGLZ-LBPRGKRZSA-N 336.388 1.766 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@H](O)C3)c(Br)c1 2190454887 WBKOJJOQHYHSTD-HMUFECAUSA-N 342.233 1.965 10 10 EDCE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(C(=O)c2cccc(O)c2O)C1 2054419361 CKPUCZLILVOSIO-BDAKNGLRSA-N 346.305 1.627 10 10 EDCE CCC[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1COc1nnc(=N)[nH]n1 2213779856 YCXRYHZROCFPRV-WDEREUQCSA-N 338.412 1.341 10 10 EDCE CC[C@@H](C)NCc1ccc(N2CC(O)(CO)C2)cc1Br 2240030454 DXNDXKYMSDVQOA-LLVKDONJSA-N 343.265 1.881 10 10 EDCE C[C@H](O)c1ccc(N2CC3(CNC(=O)CO3)C2)cc1Br 2289657359 SDUCQOAGWYIIQZ-VIFPVBQESA-N 341.205 1.208 10 10 EDCE COC(=O)[C@H](CO)NC(=O)C=Cc1cc(C)n(-c2ccccc2)c1C 2308675080 WNHVQWCCELCBIS-KRWDZBQOSA-N 342.395 1.757 10 10 EDCE CCn1nnc(CNCc2ccc(C)c(Br)c2O)n1 2352673096 VJNKSZXYWPOVAX-UHFFFAOYSA-N 326.198 1.759 10 10 EDCE Cc1ccc(Cn2cc(CC(=O)O)nn2)c(O)c1Br 2352685892 HKVDGFZNCAYMPG-UHFFFAOYSA-N 326.150 1.730 10 10 EDCE C[C@@H](NC(=O)CCc1cnn(C)n1)c1ccc(N2CCOCC2)cc1 1357929918 ZWAPRJZTJZDWPK-CQSZACIVSA-N 343.431 1.462 10 10 EDCE COc1ccc(N2CCN(C(=O)NCc3noc(C)n3)CC2)cc1 173561427 LBMMUCPGSDNIMO-UHFFFAOYSA-N 331.376 1.418 10 10 EDCE Cc1ncsc1CNS(=O)(=O)CCOc1ccc(N)cc1 70490881 SWOKQPHXSSEDBZ-UHFFFAOYSA-N 327.431 1.532 10 10 EDCE Nc1ccc(CCNS(=O)(=O)c2ccc3c(c2)C(=O)NCC3)cc1 193336435 GMSBYBWZQRNVHC-UHFFFAOYSA-N 345.424 1.076 10 10 EDCE Cc1cc(C)n(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 273883486 OTZWPXMVZYXEFI-UHFFFAOYSA-N 342.443 1.995 10 10 EDCE Cc1cnn([C@@H]2CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)C2)c1 370684070 MFUMZQRBLLADSR-LLVKDONJSA-N 343.343 1.882 10 10 EDCE COCCN(c1ccc(OC)c(Br)c1OC)C1CNC1 2162645191 XHDLPSSXDGEOIF-UHFFFAOYSA-N 345.237 1.891 10 10 EDCE COc1cc(Br)cc(CN(C[C@@H](O)CO)C(C)C)c1O 817417785 PMYUBXAVMIEYMG-GFCCVEGCSA-N 348.237 1.727 10 10 EDCE COc1cc2c(c(OC)c1)N(C[C@H](O)CN1CCOCC1)CCC2 839655911 XGUNGFZTFAPBGB-OAHLLOKOSA-N 336.432 1.150 10 10 EDCE CCOC(=O)[C@@H](F)[C@@H]1CCN(C(=O)c2ccc(C)c(O)c2O)C1 912251811 CNCVGGJNVORUNL-PWSUYJOCSA-N 325.336 1.770 10 10 EDCE O=C(NCC[C@@H]1CCNC1)NCc1cccc(Br)c1O 841937662 BIDZSSHILWFPIC-JTQLQIEISA-N 342.237 1.954 10 10 EDCE COC[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)CC1 842238664 VOKFMADEYLHTRA-OAHLLOKOSA-N 333.432 1.203 10 10 EDCE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2nc(CO)n[nH]2)c1 912941427 NIAUGRAYTJFUCU-UHFFFAOYSA-N 339.399 1.943 10 10 EDCE CCON(C)C(=O)CNC(=O)NCc1ccc(N(CC)CC)cc1 844898598 LRNBSLNXKLPVBI-UHFFFAOYSA-N 336.436 1.742 10 10 EDCE C[C@@H]1CNCC[C@@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 841730710 VBDIDCAQZJPSIT-PBHICJAKSA-N 332.448 1.320 10 10 EDCE O=C(NCc1c(O)cccc1F)NC[C@H]1CCN1C1CCOCC1 927631422 STEBPGGOOUQJCU-CYBMUJFWSA-N 337.395 1.584 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCNC(=O)C[C@@H]3C)C2)cc1 854299906 LWUGDIUEVFFFTP-UONOGXRCSA-N 346.431 1.194 10 10 EDCE CCCC[C@H](NC(N)=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855229420 JZXFAQNJWQXLMT-CJNGLKHVSA-N 348.447 1.617 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc4n(n3)CCC4)C2)cc1 855227829 ZUGQDGVLNQINEM-ZDUSSCGKSA-N 326.400 1.847 10 10 EDCE COc1ccc(N(C)CC(=O)N2CCOC[C@@H]2C2CC2)cc1OC 766238931 CQZMGWPERHWMPC-OAHLLOKOSA-N 334.416 1.777 10 10 EDCE CCO[C@H](C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)[C@@H]1CCOC1 869231603 SLMISRFRPRYUFJ-VKJFTORMSA-N 348.443 1.832 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H]2COC[C@]2(C)C1 1118687906 OZBMBPGJFGATKV-BEFAXECRSA-N 345.443 1.172 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCN(Cc3n[nH]c(C)n3)CC2)c1O 775989271 XXGVIWOIOMVBKW-UHFFFAOYSA-N 347.394 1.478 10 10 EDCE COC(=O)[C@@H]1COCCN1Cc1cc(C)cc(Br)c1O 781914694 ZRINHUVXSHOSOW-LBPRGKRZSA-N 344.205 1.837 10 10 EDCE COc1cc(N2CCN(Cc3cc(F)cc(F)c3O)CC2)ncn1 894469486 HOOLWHBCXLCREA-UHFFFAOYSA-N 336.342 1.791 10 10 EDCE CCOc1ccc(N2CCN(C(=O)c3ccc(=O)n(C)c3)CC2)cc1 1137658721 TXCYTFVGPVWWLD-UHFFFAOYSA-N 341.411 1.746 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cccc(-n2ccnc2O)c1 1162279201 VOHJCJFQTYZKCR-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE CS(=O)(=O)c1cc(C(=O)NCc2ccc3cccnc3c2O)co1 1162612925 SGLQVUHRPXLLGU-UHFFFAOYSA-N 346.364 1.867 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCC[C@@H]2CNCCO)cc1 1268293428 BVZSODLNBXKPJE-OCCSQVGLSA-N 333.392 1.329 10 10 EDCE CCN(C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CCCOC1 1349614553 PTFXNFNUOWYISL-QGZVFWFLSA-N 347.459 1.739 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)CN2CCCC2=O)cc1C 1283572943 PINOLBMODLKEKB-OAHLLOKOSA-N 347.459 1.563 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2CN(C)CCO2)cc1C 1281703350 OMBGWIVJTKTPTK-MAUKXSAKSA-N 349.475 1.319 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)NCc1cccc(Br)c1O 1448966335 UBJHBBDLPISSHO-SNVBAGLBSA-N 346.177 1.085 10 10 EDCE CNS(=O)(=O)c1cc(C(=O)NCc2c(O)cccc2F)c(C)o1 1456026573 BGXACRGEMKVOAO-UHFFFAOYSA-N 342.348 1.271 10 10 EDCE Cc1cc(CC(=O)OC[C@@H]2OCCNC2=O)c(C)n1-c1ccccc1 1526568589 IJBPCSJLIMVKLX-KRWDZBQOSA-N 342.395 1.695 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(C)COCCO1 1709038440 INXHUAKHOMPFSC-SFHVURJKSA-N 346.431 1.988 10 10 EDCE CCN1CC[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1542180408 KTFMKCOFSIHEIU-WBVHZDCISA-N 344.459 1.099 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CC[C@H](C(F)(F)F)[C@@H](CO)C1 1472559595 HKRGTFFJZUWPLV-SFYZADRCSA-N 337.269 1.870 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)C2CN(C(C)=O)C2)cc1C 1482827409 JQIOGNMSJOMURN-CQSZACIVSA-N 347.459 1.466 10 10 EDCE N[C@@H]1CCN(Cc2cc(Cl)cc(Br)c2O)C[C@H]1CO 2122380265 YVBGCUNRPORSEE-JOYOIKCWSA-N 349.656 1.950 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2ccc(O)nn2)cc1C 1483107010 YQDGNZPTTCIYBZ-GFCCVEGCSA-N 330.388 1.407 10 10 EDCE COCCCN1CC[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1713543750 TXYDTUGGCFLUQY-ZDUSSCGKSA-N 347.419 1.937 10 10 EDCE CCC(=O)N[C@H](C)[C@H](C)NCc1nnnn1-c1ccc(OC)cc1 1725080162 RPKGUWVXHAGALX-NWDGAFQWSA-N 332.408 1.064 10 10 EDCE NC(=O)COc1cccc(C(=O)NCc2cc(Cl)ccc2O)c1 1632223948 RVHXMMPHRRWINH-UHFFFAOYSA-N 334.759 1.840 10 10 EDCE O=C(Cn1cc(Br)ccc1=O)N1Cc2cccc(O)c2C1 1636230402 BIGBCGCPNJLENJ-UHFFFAOYSA-N 349.184 1.859 10 10 EDCE CCc1nnc(O)c(CNC(=O)Cc2ccc(O)c(O)c2)c1CC 1630030140 XYZNUHHACSQECI-UHFFFAOYSA-N 331.372 1.577 10 10 EDCE CN(C)C(=O)C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccccc1 1569425088 VWFSNAKMZNTYIH-OAHLLOKOSA-N 342.395 1.976 10 10 EDCE CC[C@H](CNCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1)OC 1731988213 BEVGNCUHISHDRG-CQSZACIVSA-N 335.408 1.936 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)CCCF)cc(OC)n1 1737578942 UDNLLXRFGADYKN-SNVBAGLBSA-N 327.356 1.083 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)c2ncn(C)n2)C(C)C)cc1C 1667454879 XQXWDGQUOJPMOT-HNNXBMFYSA-N 345.447 1.676 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](N)Cc3ccccc3)CC2)cc1 11805365 GQLACWFEFUGMTM-IBGZPJMESA-N 339.439 1.914 10 10 EDCE Cc1c(NC(=O)c2nnn(-c3ccc(N)cc3)n2)cccc1[N+](=O)[O-] 1857878995 RMHBNWIDSBKRRB-UHFFFAOYSA-N 339.315 1.713 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1(OC)CN(C(=O)OC(C)(C)C)C1 1900613161 UOALHTCRCSWQFV-UHFFFAOYSA-N 327.385 1.781 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](O)C2)cc1Br 233640448 WMFVVRTXELOVAW-IIMNLJJBSA-N 329.238 1.661 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@](C)(N)CO 1951698564 PMYZKQFJBLHUPB-CJNGLKHVSA-N 326.393 1.243 10 10 EDCE CN(CCCN=[N+]=[N-])S(=O)(=O)N1CC(OCc2ccccc2)C1 1977429669 XMAFVPBUBKAWEX-UHFFFAOYSA-N 339.421 1.764 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@@](O)(C(N)=O)C2)c(Br)c1 312237607 BSTLAIVBIYWMMS-OTYXRUKQSA-N 342.237 1.285 10 10 EDCE CCN(CCCCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2159108024 HTBDNXCQLONZKF-ZDUSSCGKSA-N 342.237 2.000 10 10 EDCE COCC1(O)CN(c2ccc(CNC3CC3)cc2Br)C1 384096651 DKPVRZZUMBWIHQ-UHFFFAOYSA-N 341.249 1.899 10 10 EDCE O=C(O)C(F)(F)CCS(=O)(=O)Nc1ccc(O)cc1Cl 2178767461 KKKHINWVZBOXKG-UHFFFAOYSA-N 329.708 1.897 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)NCc2ccccc2O)C1 1262495281 XPQPURCBXHKPAA-UHFFFAOYSA-N 336.388 1.380 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)cc1Br 2182542438 IZEVRFWYDMAWGG-HGSJOUDDSA-N 341.249 1.346 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@H](O)C[C@@H]32)c(F)c1Br 2185305610 GOQVOXGEOPYHRY-ADEWGFFLSA-N 345.212 1.775 10 10 EDCE CSc1ncc(CNC(=O)NCC(F)(F)CC(=O)O)s1 2284554513 FGNIXWLGMCCDND-UHFFFAOYSA-N 325.362 1.774 10 10 EDCE Cc1nn(C)cc1C=C1SC(=S)N(CCCC(=O)O)C1=O 2297506125 KYANJFRNOLPMNN-UHFFFAOYSA-N 325.415 1.795 10 10 EDCE CN[C@H](c1ccccc1O)[C@@H](O)[C@@H](CNC(=O)OC(C)(C)C)OC 2307259261 JNOLKHLJBZKLIF-KFWWJZLASA-N 340.420 1.553 10 10 EDCE CO[C@@H](CCN)C(=O)NCc1ccc(C)c(Br)c1O 2352626201 LOSPWILIYXCFGH-JTQLQIEISA-N 331.210 1.443 10 10 EDCE NC(=O)NC(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2 57642759 UUDRGDCTGHNZKI-UHFFFAOYSA-N 347.396 1.721 10 10 EDCE CCN1CCN([C@@H]2CCN(Cc3cc([N+](=O)[O-])ccc3O)C2)CC1 174544572 AZXPUVHNFZJZHD-MRXNPFEDSA-N 334.420 1.512 10 10 EDCE CC(=O)N(C(=O)C(=O)NCCc1ccccc1)c1ccc(N)cc1 170318162 QBRGHZWGYVVMFM-UHFFFAOYSA-N 325.368 1.507 10 10 EDCE Nc1ccc(CC(=O)N2CCC[C@H]2C(=O)Nc2nccs2)cc1 237883100 KWHQMYSDOYCRSI-ZDUSSCGKSA-N 330.413 1.898 10 10 EDCE C[C@H](O)CN1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C[C@H]1C 245753439 OETNQIVJTMWVJP-MNOVXSKESA-N 343.811 1.841 10 10 EDCE CCCN(CC(=O)OC)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255732170 DYFUWGCRDYLQMT-TWGQIWQCSA-N 346.427 1.948 10 10 EDCE O=C1N[C@@H](CF)C(=O)N1Cc1ccc(N2CCC(O)CC2)c(F)c1 287626163 IKDWMJJVZUOLQZ-ZDUSSCGKSA-N 339.342 1.177 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CC[C@@H](C(=O)NC)C2)cc1 817155162 VHZGZHMKJSZVTE-OAHLLOKOSA-N 332.448 1.810 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1cc(C[C@H]2CCCNC2)nn1 900602855 CPLCXYVEIFAHIU-QGZVFWFLSA-N 341.459 1.705 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CC[C@@](O)(C(F)F)C1 838478938 NWNPEVDHNFLSCG-INIZCTEOSA-N 327.375 1.973 10 10 EDCE CN(C)c1ccc(/C=C\CNc2cnn(CC(=O)NCCO)c2)cc1 835043943 CVFHHXVSKOQCIJ-ARJAWSKDSA-N 343.431 1.183 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@]1(C)C[C@@H](O)CN1C 910557512 DAVMFXNHABKDOP-YJLNNSPDSA-N 333.476 1.563 10 10 EDCE CN(CC(=O)OC(C)(C)C)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 842036050 PRDDCQTXAGIRTJ-UHFFFAOYSA-N 337.332 1.704 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CNCC[C@@H]1C 842267290 XKHPJAGXZLXZJH-YOEHRIQHSA-N 346.475 1.215 10 10 EDCE O=C(NCc1c(O)cccc1F)NC1CCN(c2cccnn2)CC1 922194680 ZLXLOLGONKTMSS-UHFFFAOYSA-N 345.378 1.790 10 10 EDCE C[C@H](NC(=O)N1CC2CC1(CN)C2)c1ccc(N2CCOCC2)cc1 851654544 DRJJLDPBADTLRJ-XVTSOASTSA-N 344.459 1.717 10 10 EDCE C[C@H](NC1CN(S(=O)(=O)N(C)C)C1)c1ccc(Cl)cc1O 858572956 YGZDXHFYUORPOC-VIFPVBQESA-N 333.841 1.187 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3cnn(C)c3)C2)cc1 852004614 IQCVJPGNVXFTGE-AWEZNQCLSA-N 329.404 1.507 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3nc4ncccn4n3)C2)cc1 855224480 KULJJUYLWBGMKR-LBPRGKRZSA-N 338.371 1.142 10 10 EDCE COC[C@H](NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)C1CC1 852226161 XDOYJOCPWGLRFX-YOEHRIQHSA-N 333.432 1.998 10 10 EDCE CN1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CCC1=O 853775877 FOWXWBJTHSWQLE-UHFFFAOYSA-N 328.416 1.437 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)C[C@]2(C)CO)c(Br)c1 698159133 XDQLDBRQFQNASB-DRCTWCGVSA-N 330.222 1.824 10 10 EDCE COCCOCCN(CCO)Cc1c(O)cccc1Br 862468308 GSNIMZBCCHOHHN-UHFFFAOYSA-N 348.237 1.612 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCN(S(=O)(=O)C3CC3)CC2)cc1 862457112 BAOFIKMQEULURJ-ARJAWSKDSA-N 349.500 1.876 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@@H](CC(N)=O)C2)cc1 863487898 YAZDDTYKBONQCX-KRWDZBQOSA-N 341.411 1.811 10 10 EDCE COCCCN(CCO)C(=O)c1cc2cc(O)c(O)cc2s1 897500414 SJCQTGVNHDFWCP-UHFFFAOYSA-N 325.386 1.784 10 10 EDCE CC1(C)COC[C@@H]1NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 894384097 CWUPUUXAGPQBAH-WBVHZDCISA-N 331.460 1.903 10 10 EDCE CO[C@H](C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)C(=O)OC(C)(C)C 1138152998 VJYPVNYFGLAGHR-IINYFYTJSA-N 339.388 1.502 10 10 EDCE CCn1cc(-c2nn(C)cc2C(=O)N2C[C@@H](C)Cn3nccc32)cn1 893888240 YCMUBYPPMURROI-GFCCVEGCSA-N 339.403 1.797 10 10 EDCE Cc1ccc(C(=O)Oc2ccc3c(c2)n(C)c(=O)n3C)c(O)c1O 794166693 CZVXZKISGJFPCI-UHFFFAOYSA-N 328.324 1.816 10 10 EDCE CC(C)(C)OC(=O)C1=NO[C@@H](C(=O)NCc2cccc(O)c2O)C1 1303195486 VALJCKTXOHEESG-GFCCVEGCSA-N 336.344 1.201 10 10 EDCE CNCc1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)c(Br)c1 1893331993 NSXPEHSWSRFTDY-UONOGXRCSA-N 329.238 1.491 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@@H]2CCC2(C)C)cc(OC)n1 1354653991 JJIJPQOZOZHVMF-YPMHNXCESA-N 349.431 1.770 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H]2C[C@@H]3C[C@@H]3C2)cc1C 1278137807 JLQAUIOSFKFTTR-LTIDMASMSA-N 332.444 1.616 10 10 EDCE CC/C(C)=C/C(=O)N1CC[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1284007137 CVQHPBRTZXEMIY-BCNIOPEESA-N 347.415 1.786 10 10 EDCE CCn1c(=O)n(CC(=O)NCc2ccc(O)cc2O)c2ccccc21 1299572546 DXCQHGFQLKQMQM-UHFFFAOYSA-N 341.367 1.551 10 10 EDCE CC(C)CN1C[C@@H]2CN(C(=O)Cc3ccc(O)c(O)c3)CCN2C1=O 1467740209 VVJGGHSYTWMRQZ-AWEZNQCLSA-N 347.415 1.245 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnns1 1466398940 VDGISKSCFWNHGA-UHFFFAOYSA-N 341.776 1.713 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C1CCC1 1705121045 XRNMHUMBGIZZEO-JTQLQIEISA-N 331.376 1.884 10 10 EDCE COC[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)C(=O)OC 1623908003 CRYYNGBLMBECHW-QMMMGPOBSA-N 325.342 1.230 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1nncs1 1480602009 IUUQMTAJCWRJBU-SECBINFHSA-N 347.404 1.609 10 10 EDCE C[C@@](CO)(Cn1cnc2ccccc21)NC(=O)c1cccc(O)c1O 1558784098 PKVPZTUPGVUCBJ-SFHVURJKSA-N 341.367 1.629 10 10 EDCE C[C@@H](NC(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1)c1ccccc1O 1557966995 SXNOJQSKJUBCEA-BMIGLBTASA-N 347.396 1.300 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1CCC(=O)NC1)NCc1ccc(OC)c(C)c1 1495014027 VWSNLHZAWYHUMJ-HOTGVXAUSA-N 347.459 1.514 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H]2CCC(=O)NC2)cc1C 1568877126 GPJYHFJLFGEZFU-QDLOVBKTSA-N 345.443 1.292 10 10 EDCE COCCC(=O)N1CC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1738679934 HCHNZHMTRQYDFD-CYBMUJFWSA-N 347.375 1.216 10 10 EDCE C[C@@H]1CN(CCNC(=O)c2ccc(N=NC(N)=O)cc2)[C@H](C)CO1 1640240091 OCHVLGVSJOYZQQ-VXGBXAGGSA-N 333.392 1.688 10 10 EDCE C/C=C(\C)C(=O)NC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1745841973 UBKZNFFPHIBLMG-BBXFXDEXSA-N 329.360 1.756 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1cnn(CC)n1 1668419109 GNPMYQLMHHYEND-UHFFFAOYSA-N 345.447 1.867 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 1596952313 BDBFYACUKPZHEZ-MRXNPFEDSA-N 336.432 1.804 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCNC(=O)[C@H]2C(C)C)c([N+](=O)[O-])c1 1772905881 YIMTWBSHQUKVNC-GMNBZTITSA-N 347.371 1.742 10 10 EDCE COc1cccc(O)c1CN[C@@H]1COC[C@H]1NC(=O)OC(C)(C)C 1997933683 XHQZUDIQMFIONY-CHWSQXEVSA-N 338.404 1.783 10 10 EDCE CN(Cc1ccccc1O)C(=O)C1(NC(=O)OC(C)(C)C)COC1 2010165775 CKSIYKBJHGCUNW-UHFFFAOYSA-N 336.388 1.644 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1[C@@H]2OCCN(C(=O)OC(C)(C)C)[C@@H]21 2010391968 CJHIBHUNIGAZIJ-TUAOUCFPSA-N 339.396 1.780 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3C[C@@H](O)C[C@@H]3C2)cc1Br 405475106 LRBICTBYEKCTLZ-RTXFEEFZSA-N 340.265 1.724 10 10 EDCE CNCc1ccc(N2CC3(CNC(=O)N3C)C2)c(Br)c1 2177695082 BORXPMHMVCPLKX-UHFFFAOYSA-N 339.237 1.382 10 10 EDCE CN(C)c1ccc([C@H](N)[C@@H](O)c2c(Br)cnn2C)cc1 2163131736 UPPQIDQKKAFHOA-GXTWGEPZSA-N 339.237 1.982 10 10 EDCE CN[C@H]1CCCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2053855033 NKCVAIAXIRZQKS-KRWDZBQOSA-N 329.444 1.747 10 10 EDCE CC[C@H](CO)N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 379127561 ZHKBFXFBKNQZQR-KRTXAFLBSA-N 328.210 1.608 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC4(CC[C@@H]4O)C3)c(Br)cc21 2179703368 KZJXGIVXKOALCE-RYUDHWBXSA-N 338.205 1.362 10 10 EDCE OC[C@]1(NCc2cc(Cl)cc(Br)c2O)C[C@@H](O)C1 2076632893 VGNRIDRNUKYJPA-WVSHTKLVSA-N 336.613 1.784 10 10 EDCE CN(C(=O)[C@@]1(CO)CCCN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2080649396 DYQMCQVTWIMBLD-SFHVURJKSA-N 349.431 1.994 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@@H](CO)C2)c(Br)c1 2098210104 XBHZZOJMPGHNLR-WDEREUQCSA-N 329.238 1.914 10 10 EDCE O=C(O)[C@@H]1C[C@H](O)CN(Cc2cc(Br)cc(F)c2O)C1 2201044922 OETCTADGXDJRAJ-SCZZXKLOSA-N 348.168 1.561 10 10 EDCE CCN(Cc1ccc(N)cc1)C(=O)c1nn(C)nc1Br 2235276117 OQLDCXHXRCGZHN-UHFFFAOYSA-N 338.209 1.822 10 10 EDCE NCCCN1CCN(Cc2ccc(Br)cc2O)CC1 2226068387 LAKSREJINFWWRS-UHFFFAOYSA-N 328.254 1.621 10 10 EDCE C[C@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2273221528 ASSUMBKPPAWWOY-GHGOGRRBSA-N 326.194 1.361 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@@H](O)CC2)c(Br)c1 2269120359 CNERMTRAVIINOH-HERUPUMHSA-N 329.238 1.791 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@]4(O)C[C@@H]4C3)c(Br)cc21 2280028206 OFESZZXLVSTCKU-FDHQVAJDSA-N 338.205 1.362 10 10 EDCE CN1C(=O)[C@@H]2ON(Cc3ccccc3)[C@H](c3ccccc3O)[C@H]2C1=O 102544978 NOEZTLRTUYTPAB-BRWVUGGUSA-N 338.363 1.864 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN(C)C(=O)[C@@H]2C)c([N+](=O)[O-])c1 302451555 SIEUBJKWCRFIRP-ZRQQLDRUSA-N 333.344 1.448 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3C=CCCC3)C2)cc1 1350766499 FSQVSLKYCUQYPF-HUUCEWRRSA-N 343.427 1.615 10 10 EDCE COC(=O)[C@@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(C)C 255233339 PPOUYZKVJUWYKJ-KKMIYCERSA-N 346.427 1.850 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCCNC(=O)C1CC1 255373649 JYULIILVZCSKEF-BAQGIRSFSA-N 343.427 1.179 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1 808489762 ZFPHHPIKFHLHHT-NSHDSACASA-N 333.384 1.804 10 10 EDCE CC(=O)C(=O)COC(=O)CSc1nnc(-c2cccs2)n1C 808512440 KBSZQRCADAGBDP-UHFFFAOYSA-N 339.398 1.337 10 10 EDCE CCCN(CC(N)=O)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 723169869 UTLXRYJGQYHCPX-GFCCVEGCSA-N 341.209 1.103 10 10 EDCE COC[C@]1(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CCOC1 825600588 MZLFXRUCLBMMBN-LJQANCHMSA-N 348.443 1.833 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCC(C(=O)NCCCO)CC2)cc1 835026694 ZSMDJOQYFLIMGW-HYXAFXHYSA-N 345.487 1.976 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCNC[C@@H]2C)cc1 842208523 WIWPXCLYDJEAIL-WMLDXEAASA-N 346.475 1.263 10 10 EDCE COC(=O)[C@@H]1C[C@H]1[C@@H]1NC(=O)N([C@@H](C)c2ccc(N(C)C)cc2)C1=O 924717271 LYUNOELNXFADIW-QOWREQOWSA-N 345.399 1.543 10 10 EDCE Cn1nccc1[C@@H]1COCCN1C(=O)NCCc1ccc(N)cc1 846171438 GQQXTJIHSOBSAX-INIZCTEOSA-N 329.404 1.328 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCC[C@H]2CC(=O)N(C)C2)c1 924737531 QHUPRANDMDEOMQ-RYUDHWBXSA-N 335.404 1.629 10 10 EDCE COc1ccc(N2CCN(C[C@H]3CCC4(CNC4)O3)CC2)cc1F 852746648 NSEVTWGNSQBVGU-OAHLLOKOSA-N 335.423 1.477 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@H]2COC[C@@H]2C1 852004552 HWCNLDYPKFPXLF-IRXDYDNUSA-N 345.443 1.701 10 10 EDCE COc1cc2c(cc1C(=O)NCCc1ccc(O)c(O)c1)OCO2 759959598 VSHOCQPYAPVIIJ-UHFFFAOYSA-N 331.324 1.808 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@@H](O)C(F)(F)C(F)(F)F 922243484 QOMRVEZITZDCFP-WUWIAWFRSA-N 341.232 1.786 10 10 EDCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@H](C)C(N)=O)C1 769662543 DTJCKOLDUBWHOI-CYBMUJFWSA-N 343.427 1.825 10 10 EDCE CC(C)NS(=O)(=O)c1c[nH]c(C(=O)NCc2ccccc2O)c1 769366408 ZKCPTIMQFMBNGO-UHFFFAOYSA-N 337.401 1.337 10 10 EDCE Cc1cc(O)c(CNC[C@]23COCCN2C(=O)OC3)cc1Cl 872261373 NVBFDHYKUMVNBQ-OAHLLOKOSA-N 326.780 1.665 10 10 EDCE CCN1C[C@H](NCc2c(C(=O)OC)n(C)c3ccc(F)cc23)CC1=O 894900918 PYYUZMIKGIPMFB-GFCCVEGCSA-N 347.390 1.814 10 10 EDCE O=C(Nc1ccc(-c2ccon2)cc1)C1=S=c2c(cc[nH]c2=O)=C1 1156504871 TZMPICFTWAMGDY-UHFFFAOYSA-N 337.360 1.619 10 10 EDCE CN(CCCNC(=O)c1ccc(N=NC(N)=O)cc1)Cc1cnon1 1316867526 NMZSEZUENRTUKW-UHFFFAOYSA-N 345.363 1.484 10 10 EDCE CN1CCN(c2ccc(CNC[C@H](O)C(F)(F)F)cc2F)CC1 1321797419 NVDBZIKJSHHABL-AWEZNQCLSA-N 335.345 1.590 10 10 EDCE COCCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@H]1CC[C@@H](C)C1 1332023601 RBPWHMRZCYCEIB-HIFRSBDPSA-N 346.427 1.898 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@]1(C)CC1(F)F 1330950702 ILNJVRXBYMAGND-INIZCTEOSA-N 339.386 1.839 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1CC12CC2)NC(=O)c1cc(OC)nc(OC)c1 1297496428 OSFDBIXIOXVHBH-QWHCGFSZSA-N 347.415 1.524 10 10 EDCE O=C(C[C@@H]1NC(=O)c2ccccc21)NCCc1ccc(O)c(O)c1 1294914114 WCJUDUAWNBZQCR-AWEZNQCLSA-N 326.352 1.631 10 10 EDCE NC[C@]12CN(Cc3ccc(Br)cc3O)C[C@H]1CCO2 2118556103 NHMJQSWGPDOSBL-RISCZKNCSA-N 327.222 1.704 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1ccnc(-n2cncn2)c1 1627072561 BBSCTEHGJKOGII-UHFFFAOYSA-N 346.350 1.846 10 10 EDCE C[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@@H]1CNCCO 1482502163 XTHYMFLWEOLVDM-SWLSCSKDSA-N 347.419 1.672 10 10 EDCE CC(=O)N/C(=C/c1cccs1)C(=O)NCc1c(O)cccc1O 1635847680 RLXXMCCZOBARFD-MDWZMJQESA-N 332.381 1.953 10 10 EDCE CNC(=O)CNCCC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1725473370 QLSGQAFGGVKPRR-NSHDSACASA-N 348.407 1.083 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cc2c(nc1O)CCOC2 1630335825 VOQDEFNTDBSZQW-UHFFFAOYSA-N 330.340 1.244 10 10 EDCE COC(=O)/C=C\c1ccc(N2C3CCC2(C(N)=O)CC3)c([N+](=O)[O-])c1 1643259648 DRXMSNSTDFIDQB-HYXAFXHYSA-N 345.355 1.768 10 10 EDCE CC(C)NC(=O)CN(C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1731797438 PPQKENKHORTDQU-UHFFFAOYSA-N 348.407 1.035 10 10 EDCE CC/C(C)=C\C(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1578823460 VFFSBIZQGCIYBZ-YEJLBBQYSA-N 347.415 1.832 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)CN2CCCC2=O)cc1C 1666510905 UGEBUCSECYXRBO-CQSZACIVSA-N 347.459 1.468 10 10 EDCE C[C@H](NCC1CCN(CCO)CC1)c1ccc(N2CCOCC2)cc1 151784655 RTJXJQLEXOMWJC-KRWDZBQOSA-N 347.503 1.878 10 10 EDCE O=S1(=O)CC[C@H]1CNCc1cc(Br)cc(F)c1O 1972335904 BKYGEXLWNSIGJM-VIFPVBQESA-N 338.198 1.571 10 10 EDCE O=C1NC(=O)[C@H](CCCNCc2cc(Br)ccc2O)N1 2150322308 BTQTYSZBWFSUGB-JTQLQIEISA-N 342.193 1.233 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)COC1 1987697108 NIUHPHTXIOKVSX-JTQLQIEISA-N 325.369 1.439 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(C(=O)N1CC[C@H](N=[N+]=[N-])C1)C(C)(C)O 2010404156 PAUKFCLOORMTEP-ZUZCIYMTSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](Nc2c(N)cccc2C(=O)O)C1 2011486836 FUTRYCWPNUUDNJ-NEPJUHHUSA-N 337.376 1.359 10 10 EDCE C[C@H](N)c1ccc(N2CC(S(C)(=O)=O)C2)c(Br)c1 2034840156 WRRDVOBRAKOPMD-QMMMGPOBSA-N 333.251 1.702 10 10 EDCE CNC(=O)c1cncc(C=CC(=O)N(C)c2ccc(C(N)=O)cc2)c1 2042435121 MXIKIYRALLPOLW-UHFFFAOYSA-N 338.367 1.216 10 10 EDCE Oc1ccc(CNC[C@@H]2CN(Cc3ccccc3)CCO2)c(O)c1O 311717858 XKYOXKBEUARFLN-MRXNPFEDSA-N 344.411 1.794 10 10 EDCE CNCc1ccc(N2CC(=O)N3CCC[C@@H]3C2)c(Br)c1 2158194187 WYGYITDSCHGZHV-GFCCVEGCSA-N 338.249 1.980 10 10 EDCE C[C@@]1(CO)CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 381807996 VBBGOCZQKIGGMY-TZMCWYRMSA-N 340.221 1.610 10 10 EDCE CN1CCN(Cc2cc(Br)cc(F)c2O)[C@@H](CN)C1 715769528 LSOPBHFIXOMHMU-NSHDSACASA-N 332.217 1.369 10 10 EDCE C[C@@H](N)c1ccc(N2CC(N3CCOCC3)C2)cc1Br 2169499635 FAQBLXRHOGBEKO-LLVKDONJSA-N 340.265 1.990 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CN(Cc2ccc(N)cc2)CC[C@H]1CO 1907957574 LRHCLWIMRAEHEL-GOEBONIOSA-N 335.448 1.976 10 10 EDCE OCc1ccc(N2CC(c3nc(O)[nH]c3O)C2)cc1Br 2184935298 KRDCNDXJERXCHP-UHFFFAOYSA-N 340.177 1.680 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](CO)C[C@H]2CO)c(Br)c1 2089863111 HCSGPJONNQDXIF-UMNHJUIQSA-N 330.222 1.682 10 10 EDCE Cn1cc(Br)c(NC(=O)COc2ccc(N)cc2)n1 2099584418 QIMMMLMIFNDXPG-UHFFFAOYSA-N 325.166 1.782 10 10 EDCE CN(CCNC(=O)OC(C)(C)C)CC(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213590569 BJUFZSPSXFJRSM-NWDGAFQWSA-N 340.428 1.791 10 10 EDCE CN(C)C[C@@H]1COC[C@@H]1NCc1cc(Br)cc(F)c1O 2206389160 AXRHHYWNIJREEK-MFKMUULPSA-N 347.228 1.960 10 10 EDCE O=C1C(=Cc2cccc(F)c2)SC(=S)N1CCS(=O)(=O)O 2293438628 GLCRRKKWSXECLG-UHFFFAOYSA-N 347.414 1.915 10 10 EDCE CC(=O)Nc1ccc(C=C2SC(=S)N(CC(=O)O)C2=O)cc1 2297178718 KPSZPGHEVZCTFK-UHFFFAOYSA-N 336.394 1.931 10 10 EDCE O=C(O)CN1C(=O)C(=Cc2ccc([N+](=O)[O-])s2)SC1=S 2323688039 KYHWNJMMCDQFKF-UHFFFAOYSA-N 330.368 1.942 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2329329373 UEWXVWRUKHUVPS-MAQCBKMQSA-N 328.206 1.433 10 10 EDCE CN1C(=O)[C@H]2[C@@H](c3ccccc3O)N(Cc3ccccc3)O[C@H]2C1=O 102544973 NOEZTLRTUYTPAB-GVDBMIGSSA-N 338.363 1.864 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)CCN2CCOCC2)c([N+](=O)[O-])c1 171476973 NIJDCWNYEIAPGO-GQCTYLIASA-N 349.387 1.549 10 10 EDCE Cc1cc(O)cc(=O)n1[C@H](C)C(=O)NCc1ccc(N(C)C)c(F)c1 176211778 OWTVDJOZKZIEQD-GFCCVEGCSA-N 347.390 1.945 10 10 EDCE COc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(OC)c1Br 2358637173 SGSHODTWALLFBL-MNNHZPJKSA-N 344.205 1.397 10 10 EDCE O=C(/C=C\c1cscn1)NCc1ccc(N2CCNC(=O)C2)cc1 96188045 FHBSEXJYXDSDGM-UTCJRWHESA-N 342.424 1.409 10 10 EDCE CCS(=O)(=O)N(C)C1CCN(Cc2ccc(OC)cc2O)CC1 93321178 PICHTSSBCFUISW-UHFFFAOYSA-N 342.461 1.647 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@@H]3O 249359947 AEYJZMODNUBIRZ-BHEBFOIGSA-N 339.439 1.974 10 10 EDCE CN1CCN(c2ccc(CN[C@@H]3C[C@H]4C[C@@]4(C(=O)O)C3)cc2)CC1 901955320 AOBQLGWNMZHXMS-FRQCXROJSA-N 329.444 1.781 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1(COC)CC1 848630024 LBVZVLISAVZPJN-UHFFFAOYSA-N 347.459 1.644 10 10 EDCE CN(C)[C@H]1C[C@@H](CNC(=O)NCc2ccc(N3CCOCC3)cc2)C1 847296235 YVHBQRJAGJEUHZ-MAEOIBBWSA-N 346.475 1.663 10 10 EDCE CCOc1ccc(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)c(O)c1 843425532 BOKLWVLOPGRSGW-INIZCTEOSA-N 341.429 1.180 10 10 EDCE COc1ccc(N2CCCN(C(=O)N[C@@H]3CNCC[C@H]3C)CC2)cc1 841975427 FVTPQRDIXIHKBQ-CRAIPNDOSA-N 346.475 1.915 10 10 EDCE CCn1cncc1S(=O)(=O)N[C@@H](C)c1cc(OC)ccc1O 751326965 VKHNWIRBILWNHJ-JTQLQIEISA-N 325.390 1.657 10 10 EDCE Nc1ccc(CCNC(=O)[C@@H](C[C@H]2COCCO2)C(F)(F)F)cc1 851632792 WSTPUIBQKSYNQE-UONOGXRCSA-N 346.349 1.912 10 10 EDCE O=C(NCC12CC(CN1)C2)N(Cc1ccccc1O)C[C@H]1CCCO1 851676901 KQUNQHJZWHMZQF-NLGTXKQRSA-N 345.443 1.835 10 10 EDCE NC(=O)C1CCN(c2ccc(CN[C@@H]3C[C@H](N)C34CCC4)cc2)CC1 925775820 AQSYDGRIKOZMMU-ZWKOTPCHSA-N 342.487 1.748 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)CN3CCOCC3)C2)cc1 855234152 TXOPVGCBVUYCPA-HZPDHXFCSA-N 347.459 1.358 10 10 EDCE Cc1cc(C(=O)NCCCc2ncnn2C)c(C)n1-c1ccccn1 862089908 WPGJVVRGWLLSPM-UHFFFAOYSA-N 338.415 1.980 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](C(F)F)C3)nc12 761113910 RORVSMOAEGHCGN-VIFPVBQESA-N 340.330 1.699 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N[C@H](C1CCOCC1)C1CC1 1118300584 ZKCCVIZDOQVAKE-KRWDZBQOSA-N 346.427 1.672 10 10 EDCE C[C@@]1(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1(F)F 1118625638 JQAMCRVNZLYKHL-KRWDZBQOSA-N 349.381 1.841 10 10 EDCE C[C@@H](NC(=O)C(=O)NC[C@@H]1CCOC1(C)C)c1ccc(N(C)C)cc1 1118631867 PFNJUICMGAAYQK-HIFRSBDPSA-N 347.459 1.861 10 10 EDCE CN1CCN(c2ccc(CN3CCSC[C@@H]3CCO)cc2)CC1 775737237 LHIKLICQYAWIIG-SFHVURJKSA-N 335.517 1.738 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@H](C3CC3)C2)cc1 785427264 BXVGNADQWCTGOS-INIZCTEOSA-N 331.416 1.006 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@](C)(O)[C@H](O)C2)c(Br)c1 1893326907 YQXUXHJLRJIKDM-FZQKWOKYSA-N 329.238 1.791 10 10 EDCE Nc1ccc(NS(=O)(=O)CCN2C(=O)c3ccccc3C2=O)cc1 703988590 YVVBXLLBWLXUOD-UHFFFAOYSA-N 345.380 1.307 10 10 EDCE CC1(C)CC[C@H](CNC(=O)C(=O)N2Cc3cccc(O)c3C2)OC1 1338836483 AMTYFIKBPBFMCZ-CYBMUJFWSA-N 332.400 1.556 10 10 EDCE O=C(C(=O)N1CC(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1 1261857938 ACDCNXWGNTYFNP-UHFFFAOYSA-N 336.391 1.936 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@H](O)COc1ccc(F)cc1 1445779134 GYVKPIHZEURJHN-ZDUSSCGKSA-N 335.331 1.336 10 10 EDCE O=C1Nc2cc(N3CCC34COC4)c(Br)cc2[C@H]1O 2115223040 PWTCWEIKQYTEFY-LLVKDONJSA-N 325.162 1.414 10 10 EDCE CN(C(=O)[C@@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1)C1CC1 1540496525 XISVEJHBCMYMRI-LBPRGKRZSA-N 336.413 1.163 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3NC(=O)O[C@@H]3C2)c(Br)c1 2120416768 QHVCXUDHCYGXNG-INNHCVQGSA-N 327.178 1.799 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CCNC2=O)cc1C 1715356779 QZBUBHGRDSMPJZ-HIFRSBDPSA-N 333.432 1.076 10 10 EDCE Cn1nnnc1-c1ccccc1NC(=O)Cc1ccc(O)c(O)c1 1558680927 RQGHOMGSTFOHQX-UHFFFAOYSA-N 325.328 1.470 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C2(F)CCCC2)cc1C 1497008599 BOPREMSSTCLADE-HNNXBMFYSA-N 338.423 1.853 10 10 EDCE CCCNC(=O)CNC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1569040744 LBCUCWTTWHVRJT-LLVKDONJSA-N 348.407 1.083 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1n[nH]cc1F 1631533749 DWISISPXCADLPC-UHFFFAOYSA-N 341.726 1.723 10 10 EDCE Cn1cc([C@H]2C[C@@H](NC(=O)Cc3ccc(O)c(O)c3)CCO2)cn1 1636573416 JRXXNNUKVZUMFR-XJKSGUPXSA-N 331.372 1.410 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CN2CCCC2=O)cc1C 1566996375 MEMUOBRVXMLUIF-AWEZNQCLSA-N 333.432 1.220 10 10 EDCE C=CC(=O)NCc1ccc(C(=O)NCc2cccc(O)c2O)cc1 1643809346 LBKOLACJPBRHTD-UHFFFAOYSA-N 326.352 1.830 10 10 EDCE COc1cc(OC)c(OC)cc1/C=C1/SC(=S)N(N)C1=O 1006705 HSNGHYFPLNOIRS-VZUCSPMQSA-N 326.399 1.787 10 10 EDCE COC(=O)[C@H]1Cc2ccc(O)cc2CN1C(=O)c1cccc(O)c1O 1653832156 OUWPHGVICXTMQP-CQSZACIVSA-N 343.335 1.544 10 10 EDCE [N-]=[N+]=N[C@@H]1CCN(C(=O)Cn2cc(Br)ccc2=O)C1 1912161757 NAKDHXCVCFAOPW-SECBINFHSA-N 326.154 1.522 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)Cc2n[nH]c(C)n2)cc1C 1774115291 AGEOJEXMPOSYFE-CYBMUJFWSA-N 345.447 1.609 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)Nc1ccc2c(c1)C[C@@H](O)[C@H](O)C2 201383917 FHFVXMMQJSARHG-CXWAGAITSA-N 329.396 1.961 10 10 EDCE C[C@@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 1914411348 LTJLYRWAMZQEJR-LKXWSVAYSA-N 327.178 1.394 10 10 EDCE CN(Cc1ccc(N)cc1)C[C@@H](O)CN1C(=O)c2ccccc2C1=O 1929661112 JMVBUXPXEDOBNW-OAHLLOKOSA-N 339.395 1.358 10 10 EDCE O=C1Nc2cc(N3C[C@@H](O)C4(CC4)C3)c(Br)cc2[C@H]1O 2149753426 FCJPYBZJVZVMLE-VXGBXAGGSA-N 339.189 1.396 10 10 EDCE CN(Cc1ccccc1O)C(=O)CN(CCO)C(=O)OC(C)(C)C 2010123976 MKXICWWFYJSOHK-UHFFFAOYSA-N 338.404 1.580 10 10 EDCE COC(=O)[C@@H](CC(=O)N1CC[C@@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 2010401051 AJRALRPZNLBLGY-NXEZZACHSA-N 341.368 1.354 10 10 EDCE CNCc1ccc(N2CCN(CCOC)CC2)c(Br)c1 2154744965 PMEOKKIYZZEUDU-UHFFFAOYSA-N 342.281 1.937 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)NCCc1ccc(N)cc1 2022874264 XUXFDEGWMMXPFK-CQSZACIVSA-N 337.420 1.203 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C[C@H]1O 387956506 FCQPWWKPXQUSIE-KKIHLJRUSA-N 326.194 1.218 10 10 EDCE OCc1ccc(N2CCO[C@@H]3COCC[C@@H]32)cc1Br 2087487602 SAIMLVOELJKMKF-UONOGXRCSA-N 328.206 1.936 10 10 EDCE COC[C@]1(O)CCCN(c2ccc(CO)c(Br)c2)C1 2095481973 HZJOWYAGBGWRIS-AWEZNQCLSA-N 330.222 1.919 10 10 EDCE O=C1NC(=S)N(C2CC2)C(=O)C1=CNc1ccc(C(=O)O)cc1 2296931370 HNXUPMNTWHAQRI-UHFFFAOYSA-N 331.353 1.086 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(Br)c1 2330368908 DSCYSXCWTJEJDB-IGJVIKARSA-N 327.222 1.228 10 10 EDCE CN(C)C[C@@H]1CN(C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 117040823 HYDNKCZGDIARSZ-QGZVFWFLSA-N 346.475 1.541 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCN(C2CC2)CC1 61040722 MPXKWHDLIRDHFO-UHFFFAOYSA-N 344.503 1.881 10 10 EDCE COc1ncc(Br)c(C)c1[C@H](NCCN=[N+]=[N-])C(N)=O 2368189354 KUEPVEQKXNKINA-VIFPVBQESA-N 343.185 1.587 10 10 EDCE CC1(N2CCOCC2)CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 530104397 JPIFFCHERODDPU-KRWDZBQOSA-N 348.443 1.505 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnnc(C)c1 276335233 HLJSNTFTFGDSSN-UHFFFAOYSA-N 349.774 1.959 10 10 EDCE Cc1ccc(CN(C)C2(C(=O)O)CC(N)C2)c(O)c1Br 2380764218 BPLYUAGMBANVGM-UHFFFAOYSA-N 343.221 1.839 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[C@@H]1CCOC1 807323463 OAUJNFCGRITXOY-MRXNPFEDSA-N 347.459 1.644 10 10 EDCE C[C@H](Cn1cncn1)NC(=O)c1csc(Cc2ccc(N)cc2)n1 817920220 FFELEBYPYAXJNN-LLVKDONJSA-N 342.428 1.726 10 10 EDCE Cn1ncc(CCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n1 825777467 VXMORTYKNGKKFK-INIZCTEOSA-N 344.415 1.661 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2C[C@@H](OC(C)(C)C)C2)cc1 834536613 JVMIWNQCCCBACS-FZNQNYSPSA-N 347.459 1.831 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2C[C@H](N3CCOCC3)C2(C)C)c(O)c1O 911843361 LUNIBNBOPVHJJC-KGLIPLIRSA-N 334.416 1.635 10 10 EDCE CCOC(=O)[C@@H]1NC(=O)N([C@H](C)Cc2ccc(N(C)C)cc2C)C1=O 842263959 BPTZXHGYPRUDNG-IUODEOHRSA-N 347.415 1.476 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCC[C@@H](N3CCNCC3=O)C2)cc1 843063367 ABDHNHMPXMQJDY-SIEMBAAWSA-N 342.487 1.662 10 10 EDCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C(=O)Nc1ccc(N)cc1 841298205 NTZSSABZZBUMDI-MQYQWHSLSA-N 347.371 1.226 10 10 EDCE CC(C)(C(=O)O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 844250841 OEJNUWRHKMFTAE-ZDUSSCGKSA-N 347.415 1.115 10 10 EDCE C[C@@H]1CN(C)C[C@@H]1NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 756103990 XRUFCIJKCVOCDI-HFTRVMKXSA-N 330.476 1.428 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 855232510 RIEULVRNYCVASQ-LBPRGKRZSA-N 345.359 1.195 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N1CC2CC1(CN)C2 852918050 SWDBJCKMDHWINJ-UHFFFAOYSA-N 345.443 1.471 10 10 EDCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H]1[C@H]2COC[C@H]21 854905660 ACCYIJVHDNEVTK-JYAVWHMHSA-N 338.354 1.310 10 10 EDCE C[C@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@H](CCC2OCCO2)C1=O 924714909 DOVXPASGBILDCM-IUODEOHRSA-N 347.415 1.887 10 10 EDCE CC[C@@H](NC[C@@]12COCCN1C(=O)COC2)c1ccc(N(C)C)cc1 866552734 BNTGYPSEIOTJBK-MJGOQNOKSA-N 347.459 1.421 10 10 EDCE CCOc1ccc(O)c(CN(C)CCN2CCCS2(=O)=O)c1 769557351 NTRPQLNILLSHPM-UHFFFAOYSA-N 328.434 1.258 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CC[C@H]4CSC[C@H]4C3)nc12 872163833 MSKJFOPJNKNBLU-VHSXEESVSA-N 334.401 1.318 10 10 EDCE O=C(O)[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cccc2nonc12 775289089 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XZJHGVCWEYXUPR-IMJJTQAJSA-N 346.427 1.359 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H]2CCCN2C)cc1C 1267999001 OJYJBCRCAUYAMG-WMLDXEAASA-N 333.476 1.940 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3C[C@@H]4CCC[C@H]43)ccc21 1340602645 IMEKYHPYMYMQLN-USXIJHARSA-N 341.455 1.990 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cn3cncn3)CC2)cc1C 1277246011 QXZPPURIZGZXCD-UHFFFAOYSA-N 329.404 1.034 10 10 EDCE C[C@@H]1C[C@@H](NCCCO)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1277785100 FCFCOVFSAXSZJC-DOMZBBRYSA-N 347.419 1.814 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@H]2CC23CC3)cc(OC)n1 1284344561 QSKREVOLBJUULS-ZYHUDNBSSA-N 333.388 1.133 10 10 EDCE CCn1cc(-c2n[nH]cc2C(=O)NCc2ccc(O)cc2O)cn1 1299572136 BPZYUKOHKLXIAE-UHFFFAOYSA-N 327.344 1.634 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H]2[C@H]3CCC[C@H]32)cc1C 1716081840 FZAGXHUGUXHRAK-CBZIJGRNSA-N 332.444 1.616 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)C[C@@H](C)NC(N)=O)C2)cc1C 1713160541 OQOPOLVQOKYRDJ-BPLDGKMQSA-N 348.447 1.187 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCc2nnc(O)n2C1 1634943878 GLLNTPUVRKOMFF-SNVBAGLBSA-N 337.376 1.054 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)CO[C@@H]3CCOC3)C2)cc1C 1491019428 RTUSRGHKKCEAOS-IXDOHACOSA-N 348.443 1.546 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)N[C@H](C)c2nnc(O)n2C)c1 1565377375 PMCGTQKMHLKBGZ-RKDXNWHRSA-N 335.364 1.356 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)C(=O)NCC1CC1 1732804085 ABZMJFJKESLWME-UHFFFAOYSA-N 347.459 1.468 10 10 EDCE C[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CCS1(=O)=O 1652551442 CWFRPEHMVCUYMQ-JOYOIKCWSA-N 338.389 1.545 10 10 EDCE CN(C)C(=O)C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 162598288 VPBHZIKICHJVDL-UHFFFAOYSA-N 331.460 1.823 10 10 EDCE N[C@@H]1CC[C@@H](C(=O)O)N(Cc2c(O)cccc2Br)C1 2132273885 NSPOTWVTZUYCPI-KCJUWKMLSA-N 329.194 1.531 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@H](CCO)C3)c(Br)cc21 123540507 CPHHVNBMUPXYFV-AMIZOPFISA-N 340.221 1.610 10 10 EDCE CC(C)(C)OC(=O)NC1(CNCc2cccc(F)c2O)COC1 1938402075 KBGZENHOTZYBPY-UHFFFAOYSA-N 326.368 1.915 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(CO)CNCc1cccc(O)c1O 1985189638 DHLGIEWRHPPDDZ-INIZCTEOSA-N 326.393 1.463 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985103546 XAGBUYAYDOGFRV-HBNTYKKESA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1990023617 BTAYESPMJYXWFA-QWRGUYRKSA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CCO[C@@]2(C(=O)N2CC(N=[N+]=[N-])C2)C1 2010393281 QGHQVZALPXSWQK-BONVTDFDSA-N 337.380 1.534 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010406685 XUGGWDWSODQNEG-SDDRHHMPSA-N 341.412 1.952 10 10 EDCE O[C@]1(c2cnn[nH]2)CCN(Cc2ccc(N3CCCCC3)cc2)C1 2059817585 ZJTSXEVVFKNCDQ-GOSISDBHSA-N 327.432 1.889 10 10 EDCE CCn1nc(C)c(CNC(=O)c2cnn3c(O)cc(C)nc23)c1C 2064009524 YBIGUNOWHHIHQT-UHFFFAOYSA-N 328.376 1.507 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H]3CCC4(CCC4)CO3)c2n1 2064457754 IHUJPGPLZCTSFT-LBPRGKRZSA-N 330.388 1.822 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC[C@H](N4CCCC4)[C@H]3C)c2n1 2064593201 OXNXQGODMIDFBP-OCCSQVGLSA-N 329.404 1.442 10 10 EDCE Nc1ccc(CC(=O)N2CCC[C@@H](CNC(=O)C(F)(F)F)C2)cc1 2044622351 BZCYYXJJWHSREB-LBPRGKRZSA-N 343.349 1.728 10 10 EDCE CC1(CO)CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2101059523 QAZSYOYDJIGFIC-NSHDSACASA-N 326.194 1.220 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213586275 ABSHRHKSYDFOGK-WHOHXGKFSA-N 339.396 1.704 10 10 EDCE COc1ccc(Br)c(CN2CC3(CCNC3)C2)c1O 2227753028 ZHFZOUMIBSRQLH-UHFFFAOYSA-N 327.222 1.959 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cnnc(Br)c1 2289623023 PPKCDYLBUSDTDY-UHFFFAOYSA-N 338.161 1.623 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)c(Br)c1 2331967471 UVZSAKSSNQZJLM-PCDDKUFXSA-N 328.206 1.404 10 10 EDCE Cc1ccc(CNC[C@@H]2C[C@H](CO)CO2)c(O)c1Br 2352692628 JUGURLLPLRKYBZ-PWSUYJOCSA-N 330.222 1.950 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@H]3CCCN3C(C)=O)CC2)cc1 102382191 HCLCIRGNWQFPTO-SFHVURJKSA-N 345.443 1.791 10 10 EDCE NCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(F)c1Br 2357592651 LOLNESDBYYDTBP-KUQGBDSZSA-N 345.212 1.367 10 10 EDCE CCn1nccc1N1CCC[C@@H](NCc2cccc(OC)c2O)C1=O 191638049 XPQYDLPRDICKCT-CQSZACIVSA-N 344.415 1.902 10 10 EDCE O=C(NCCN1C(=O)CSC1=S)c1ccc([N+](=O)[O-])cc1 49756618 QOQXOAKXLNTDCK-UHFFFAOYSA-N 325.371 1.185 10 10 EDCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)NCC(F)(F)F)c1 195285663 OADQMBBSEKJGCH-SSDOTTSWSA-N 328.312 1.448 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC(N(C)C)CC1 193813246 WCRROFMSAAVDHV-UHFFFAOYSA-N 332.492 1.737 10 10 EDCE COc1ccc(N2CCN([C@H](C)C(=O)NCC(F)(F)F)CC2)cc1 97653816 FSCCBWVNQXJIDT-GFCCVEGCSA-N 345.365 1.884 10 10 EDCE CCNC(=O)CN(CC)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 255394700 KRGJCXFWGDRZKQ-CLFYSBASSA-N 335.360 1.743 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCO[C@]3(CCCOC3)C2)cc1 285389926 AGDWWDYJICQKCJ-GOSISDBHSA-N 333.432 1.844 10 10 EDCE Cc1ccc(CN(C)[C@]2(C(=O)O)CN[C@H]2C)c(O)c1Br 2380765467 MNJLXBSSVNWCKO-LKFCYVNXSA-N 343.221 1.710 10 10 EDCE CCN1C[C@H](N(C)Cc2ccc(C)c(Br)c2O)[C@H](O)C1 2380774802 GRHCAHJNISVPCJ-QWHCGFSZSA-N 343.265 1.960 10 10 EDCE CO[C@@H]1CNC[C@H]1C(=O)NCc1ccc(C)c(Br)c1O 2381139792 BBWFCMAXLJCESB-GHMZBOCLSA-N 343.221 1.314 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)C[C@H]1CCCO1 297902343 RTZNHIJMBNMLEI-MRXNPFEDSA-N 333.432 1.348 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 808541883 VDQICVJBZZMTSC-JTQLQIEISA-N 349.330 1.580 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](C)NC(=O)c1cccc(Cl)c1Cl 808505227 VOTBYZJAGFGOEM-SSDOTTSWSA-N 346.166 1.813 10 10 EDCE Cn1cc(CCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nn1 822687626 DQRCZAVKCWJLDE-UHFFFAOYSA-N 347.394 1.040 10 10 EDCE O=C(NC[C@H]1C[C@@H]2COC[C@@H]2O1)c1cc2cc(O)c(O)cc2s1 831227411 ROHVBCUBHVJQDW-BREBYQMCSA-N 335.381 1.846 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@@H]3C[C@H]3C2)cc1F 834678287 UCKLALRBBPSSKY-HZSPNIEDSA-N 333.407 1.813 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N[C@]1(C(=O)O)CCSC1 909042757 JGQYVOJEVGBQDN-MRXNPFEDSA-N 337.445 1.821 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CCCN(C)C1=O 839922377 SJQQXJOYJUHOIG-PBHICJAKSA-N 331.460 1.977 10 10 EDCE CO[C@](C)(CO)CNC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 847386092 SABYEWCCOWMHDC-KDOFPFPSSA-N 337.464 1.689 10 10 EDCE O=C(COc1ccnnc1)NCc1ccc(N2CCOCC2)c(F)c1 853712338 GOFYQKYUIWYGDW-UHFFFAOYSA-N 346.362 1.148 10 10 EDCE CCOC(=O)C(C)(C)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855233780 MSTOANIXCBAOAR-CYBMUJFWSA-N 334.416 1.979 10 10 EDCE C[C@@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1ccc(F)cc1O 858488927 NWEYELNFVDBKEA-DGCLKSJQSA-N 342.378 1.899 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3C[C@H]4COC[C@H]4O3)CC2)c(OC)c1 931531071 WSYJOYGVQIJTFQ-URLQWDBASA-N 348.443 1.630 10 10 EDCE C[C@@H]1CN(Cc2c(O)cccc2Br)CCN1CCO 862332726 KLTAWDKOMURNKA-LLVKDONJSA-N 329.238 1.653 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CC[C@H]3C[C@@H]3C2)c1 862374720 PSZSRGKSVAGTIJ-WOPDTQHZSA-N 338.429 1.930 10 10 EDCE C[C@H](NS(=O)(=O)c1c[nH]c(C(=O)O)c1)c1ccc(N(C)C)cc1 773983303 XJCJTDXNETXCRP-JTQLQIEISA-N 337.401 1.818 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCCCC(N)=O 779591243 NXCDDNVYQFQQIQ-UHFFFAOYSA-N 333.432 1.527 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C\Cn3cncn3)CC2)cc1 899940841 XXTAPPMXWBATKU-IHWYPQMZSA-N 327.388 1.192 10 10 EDCE CN(CCO)C[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1317862057 GIENSXJJNVZKKA-LBPRGKRZSA-N 333.392 1.235 10 10 EDCE CCCN1CCC(CNC(=O)C(=O)N(C)Cc2ccccc2O)CC1 1321780655 FLEXPXCNAMNLHI-UHFFFAOYSA-N 347.459 1.589 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cccnn2)cc1C 1332589523 XLZWOBQPGPZNSA-OAHLLOKOSA-N 344.415 1.016 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)CC[C@@H](C)N)cc2)CC1 1332156162 HRIRUSYORPUKCN-CQSZACIVSA-N 332.448 1.099 10 10 EDCE O=C1Nc2cc(N3CCO[C@@H]4C[C@@H]43)c(Br)cc2[C@H]1O 2115219384 GVUXYTWKWSYJGZ-QJPTWQEYSA-N 325.162 1.412 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2c(C)ncn2C)cc1C 1480480965 IROKOKGACYORIY-ZDUSSCGKSA-N 330.432 1.954 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)Cc2ncc[nH]2)C2CC2)cc1C 1490725035 WRBRUVJXJXAYTL-INIZCTEOSA-N 342.443 1.954 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cccc(N2CCOC2=O)c1 1643879187 DXLDDBMKGAAIMJ-UHFFFAOYSA-N 328.324 1.984 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2cccn2C)cc1C 1734362447 RIKUQQGFALHZFD-HNNXBMFYSA-N 331.416 1.223 10 10 EDCE CC(C)(O)[C@H](Oc1ccccc1)C(=O)NCc1cc(O)ccc1O 1644754044 OVWUXLUGYMEPLN-MRXNPFEDSA-N 331.368 1.933 10 10 EDCE C[C@H](CNCc1nccn1C)NC(=O)c1ccc(N=NC(N)=O)cc1 1669486008 UXLYILKATRTWER-LLVKDONJSA-N 343.391 1.491 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2126162190 QBLXSVLPFQEYGK-DHPDLVEQSA-N 328.206 1.119 10 10 EDCE C[C@@H](C(=O)NCC(=O)O)N1C(=O)/C(=C/c2ccco2)SC1=S 15047800 NLMXUHSULGKXSU-VYVBZAQUSA-N 340.382 1.070 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C1(CO)CC1 2128182792 BNVYDYUDPNHGBZ-LLVKDONJSA-N 327.178 1.396 10 10 EDCE CC(C)n1nnnc1CN(C)Cc1ccc(N2CCOCC2)cc1 157569755 AXNUZBQTEDDAOE-UHFFFAOYSA-N 330.436 1.723 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@@H](O)C[C@H]32)cc1Br 2128875200 KTKBQSHCPVHBTL-IACUBPJLSA-N 327.222 1.636 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@@H](C)[C@H](C)CO)CC2)cc1 154529785 AAWCZIKRCIIPON-KGLIPLIRSA-N 335.448 1.980 10 10 EDCE C[C@@H]1CN(c2ccc(CO)cc2Br)C2(CC2)C(=O)N1 2132023457 CAOYJTVEFCFXCR-SECBINFHSA-N 325.206 1.799 10 10 EDCE COc1ccc(NC(=O)c2nnn(-c3ccc(N)cc3)n2)cc1OC 1857878966 QDWOEFFBNYKSKY-UHFFFAOYSA-N 340.343 1.514 10 10 EDCE Cc1c(O[C@@H](C)C(N)=O)c(=O)ccn1CCOc1ccc(N)cc1 1857919739 UXCMTNKFFARTEC-LBPRGKRZSA-N 331.372 1.071 10 10 EDCE CC(C)(C)OC(=O)NCCOCCNCc1ccc(O)c(O)c1 1939418441 ACVQGIIANNOTBK-UHFFFAOYSA-N 326.393 1.729 10 10 EDCE COCCNCc1ccc(N2C[C@@H](O)[C@H](F)C2)cc1Br 2149241886 LNDFLIIMMRXWTK-ZIAGYGMSSA-N 347.228 1.704 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)cc1Br 2149915563 VRBIFQZRKGOFMU-IJLUTSLNSA-N 343.265 1.896 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C1 2010393830 XXHKDBPVIQJFJB-NSHDSACASA-N 339.396 1.375 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2018047156 KWVWJQOLJOPCIK-RYUDHWBXSA-N 341.412 1.811 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(N)cc1 2022860415 QMSHNJBVXPFZDI-SMDDNHRTSA-N 337.420 1.202 10 10 EDCE NCc1cc(F)c(N2CCC[C@@H](NC(N)=O)C2)cc1Br 702151440 URVGBSLEUQXCQX-SECBINFHSA-N 345.216 1.684 10 10 EDCE CN(C)C[C@@H]1C[C@@H](O)CN1c1cc(Br)c(CN)cc1F 380293332 DVNIODDBYBPCKB-WDEREUQCSA-N 346.244 1.548 10 10 EDCE CCOC1CN(c2cc3c(cc2Br)[C@@H](NC)C(=O)N3)C1 382736147 IFPXGYVWTOLSHI-CYBMUJFWSA-N 340.221 1.887 10 10 EDCE CNCc1ccc(N2CC[C@H](C(CO)CO)C2)c(Br)c1 2170644015 WAXMXJXQIHVCFE-LBPRGKRZSA-N 343.265 1.596 10 10 EDCE NCc1ccc(N2CCCC2(CO)CO)c(F)c1Br 2089906339 BKKUROUCWLTTAE-UHFFFAOYSA-N 333.201 1.371 10 10 EDCE CNCc1ccc(N2C[C@@H]3OCCO[C@@H]3C2)c(Br)c1 2093350052 XHZZSVWPPHZINP-OKILXGFUSA-N 327.222 1.773 10 10 EDCE CC(C)(C)OC(=O)NC1CN(CC(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213584331 CBGJHAHVUHIDGM-RYUDHWBXSA-N 338.412 1.543 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](COc2nnc(=N)[nH]n2)C2(CCC2)C1 2213790247 RMNAWCQRLXEKRV-JTQLQIEISA-N 336.396 1.095 10 10 EDCE COC(=O)[C@H]1CN(C(=O)/C=C\c2cncc(O)c2)c2ccccc2O1 492521746 RBPINBAYEJCQPY-MWWKQMNYSA-N 340.335 1.768 10 10 EDCE CN(NCc1cc(Cl)cc(Br)c1O)S(C)(=O)=O 2301514077 HYBUZZWUPMZNGM-UHFFFAOYSA-N 343.630 1.704 10 10 EDCE NCC[C@H](COCc1ccccc1)NC(=O)c1ccc(O)c(O)c1 2303739994 KJBFBERUQCHMBX-OAHLLOKOSA-N 330.384 1.762 10 10 EDCE Cc1ccc(CNCC[C@H]2COC[C@@H]2O)c(O)c1Br 2352670861 KXHBBXBZISGYJZ-RYUDHWBXSA-N 330.222 1.950 10 10 EDCE Cc1ccc(CN2CCO[C@H](C(=O)O)C2)c(O)c1Br 2352687356 PHPGRMABMMOAEW-JTQLQIEISA-N 330.178 1.749 10 10 EDCE Cc1cc(Br)ccc1N1C(=O)NC(=O)/C(=C\NO)C1=O 108831183 DFDUYVXPOBKCPF-VMPITWQZSA-N 340.133 1.203 10 10 EDCE CNCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2357584814 CSOFFIANRGFREZ-SDJAHQOYSA-N 341.249 1.489 10 10 EDCE CC[C@H](C)NC(=O)CN1CCN(Cc2cc3c(cc2O)CCC3)CC1 74172934 HLBOOAUPYUSVTA-HNNXBMFYSA-N 345.487 1.913 10 10 EDCE CCCCC(=O)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 41428753 OEUOCXPDXUAZNX-UHFFFAOYSA-N 333.432 1.650 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCO[C@@H]([C@@H]2CCCO2)C1 91927109 WSZKGECLNPNHJQ-RBUKOAKNSA-N 332.444 1.903 10 10 EDCE COc1ccc2nc(C(=O)NCc3ccc(N(C)C)cc3)cn2n1 97938780 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Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CC[C@@H](O)[C@@H](O)C2)c1 827611661 ZCTKXMWPNIGDKH-MSOLQXFVSA-N 328.412 1.970 10 10 EDCE CO[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1 823292042 MDMVHLRSAMJOAC-WBVHZDCISA-N 334.416 1.191 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)NC[C@H]2CCCCN2CCO)c1 834851116 UTIVUMHCFPOOSM-UKRRQHHQSA-N 336.432 1.676 10 10 EDCE CCN1C(=O)[C@H]2CN(C/C=C/c3ccc(N(C)C)cc3)CCN2C1=O 835027968 FRMOZULLIRHHTM-FUTAKVPZSA-N 342.443 1.734 10 10 EDCE CC(=O)C(=O)COC(=O)CC(C)(C)NC(=O)OCc1ccccc1 910155417 AUIGYNPLDXTZAC-UHFFFAOYSA-N 335.356 1.783 10 10 EDCE CN1CC[C@H](C(=O)NCc2ccccc2O)[C@@H](c2cnn(C)c2)C1 849565300 SRUFBSLJEAETOD-JKSUJKDBSA-N 328.416 1.477 10 10 EDCE CCONC(=O)CNC(=O)NCc1cc(Br)ccc1O 845531891 GKSOOKFGGDZFSE-UHFFFAOYSA-N 346.181 1.022 10 10 EDCE COCc1nc(C(=O)NCc2ccc(N3CCCC3)cc2)n(C)n1 853799983 WMUWOAQRGLHZQD-UHFFFAOYSA-N 329.404 1.492 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cn2c(n1)CCC2 856208331 CNKBNKAQQNYCPP-UHFFFAOYSA-N 340.427 1.720 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3CC4(CNC4)CO3)CC2)cc1F 923325158 ASCMKVFGPFCIAX-HNNXBMFYSA-N 335.423 1.335 10 10 EDCE C[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C)C1O 852501939 YESFFYBBBVWLMI-HUUCEWRRSA-N 333.476 1.660 10 10 EDCE CCN(CC)c1ccc(CNC[C@@]2(OCCO)CCOC2)cc1F 850358602 SJRQAELTKZYAGE-SFHVURJKSA-N 340.439 1.930 10 10 EDCE CCOC[C@@H](C(=O)OC)N(C)Cc1ccc(N2CCOCC2)cc1 930062528 MKDALRMRODJADL-KRWDZBQOSA-N 336.432 1.533 10 10 EDCE O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H](O)c1cnc[nH]1 864917886 BPGWVWNASAJRNJ-HNNXBMFYSA-N 332.429 1.313 10 10 EDCE O[C@@H](CNCCCSc1nccs1)CC1(O)CCOCC1 872202198 YKPBENYCANJILN-GFCCVEGCSA-N 332.491 1.507 10 10 EDCE C[C@H](NC(=O)[C@@]12C[C@@H](N)C[C@@H]1C2)c1ccc(N2CCOCC2)cc1 870874601 PTFCHMYZHIXXBT-YBKUAAOGSA-N 329.444 1.828 10 10 EDCE NC(=O)CCCCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 779630424 KLVBOAVLKGZPQO-UHFFFAOYSA-N 347.459 1.557 10 10 EDCE COC(=O)c1c(CNCCNC(=O)C(C)C)c2cc(F)ccc2n1C 894147850 QHAFZTXFGLMOJH-UHFFFAOYSA-N 349.406 1.966 10 10 EDCE C[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)[C@@H]1CN(C)CCN1C 896534846 WQKVKMULVLYNNR-JQWIXIFHSA-N 349.456 1.677 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC([C@H]2CCOC2)C1 1323041077 CBXZNSPQEWRKEE-HNNXBMFYSA-N 345.443 1.172 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCOC[C@H]1C 1342766165 GHLXELHVNAUUSP-RHSMWYFYSA-N 347.459 1.642 10 10 EDCE COc1cccc(CNC(=O)c2cc(C3CCOCC3)nn2C)c1O 1263768829 GXKOENMZQCOZMI-UHFFFAOYSA-N 345.399 1.958 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C23CCN(CC2)C3)cc1C 1267456812 KQDKTCCSUXTIOO-UHFFFAOYSA-N 331.460 1.647 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cn(C)c(O)n2)cc1C 1270507521 OGSJTRPZWHINJE-LBPRGKRZSA-N 346.431 1.598 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cc(C)co2)cc1C 1272503927 JDEYDNXAKRKMKZ-HNNXBMFYSA-N 332.400 1.786 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2nc(O)nc(O)c2OC)c1 1465992348 JPNWLUALINRGDA-SSDOTTSWSA-N 335.316 1.102 10 10 EDCE Cc1cc(Cn2nnc(C(=O)NCc3ccc(O)c(O)c3)c2C)no1 1545637283 QLOGKHKTFMLYPZ-UHFFFAOYSA-N 343.343 1.272 10 10 EDCE 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CCCNCc1ccc(N2C[C@@H](CO)[C@@H](O)C2)c(Br)c1 316840758 ZYELELPVEMKUAW-WFASDCNBSA-N 343.265 1.738 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N3CC(O)C3)c(Br)cc21 384042072 KBQVVEUGQVYPCJ-GFCCVEGCSA-N 326.194 1.233 10 10 EDCE CN(C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1cccc(O)c1 2067791457 MVYDBPWRPPMZHO-HUUCEWRRSA-N 348.399 1.939 10 10 EDCE CCn1nnc(Br)c1CNCc1ccc(O)c(O)c1 2100251998 DLOWMNVOHGYQNN-UHFFFAOYSA-N 327.182 1.762 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2104424373 NDGLWLGBOQPOSX-OYMDGAASSA-N 327.222 1.399 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)C[C@@H]2CO)c(Br)c1 2089862709 CEBRDCZIVFIULX-JFGNBEQYSA-N 329.238 1.648 10 10 EDCE CN[C@H](C)c1ccc(N2CC(OCCO)C2)cc1Br 2095969948 QTJCWOIZZVWVFE-SNVBAGLBSA-N 329.238 1.927 10 10 EDCE NCc1ccc(N2CC[C@](CO)(CCO)C2)cc1Br 2097023434 BBPCPXHWKSGXAO-AWEZNQCLSA-N 329.238 1.479 10 10 EDCE C[C@@H](O)c1ccc(N(C)[C@@H]2CC(=O)NC2=O)c(Br)c1 2114727467 PRVNBIXZDAVZGN-RDDDGLTNSA-N 327.178 1.354 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213582291 GKJQBRQODIZHEN-SRVKXCTJSA-N 339.396 1.970 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3COC[C@]3(CO)C2)c(Br)c1 2234551144 IRKCZCLKKCJTES-IXPVHAAZSA-N 341.249 1.914 10 10 EDCE COc1ccc(Br)c(CNC2([C@H](O)CO)CC2)c1O 2227741067 KGNBKFKSKIHLNH-LLVKDONJSA-N 332.194 1.139 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2CCOc3nc(C)ccc32)c1 492324932 SGFGFCUMAXRVDQ-XQRVVYSFSA-N 338.367 1.583 10 10 EDCE C[C@H]1C(=O)NCCCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2311330412 LSGOPWIMPIWSIN-HNNXBMFYSA-N 343.427 1.273 10 10 EDCE CNCc1ccc(N2C[C@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2336474338 WLVRSOLZMSSVOJ-GWCFXTLKSA-N 345.262 1.402 10 10 EDCE Cc1ccc(CN(C)C(=O)c2nn[nH]n2)c(O)c1Br 2352952401 NHHPYIZSGNKRBG-UHFFFAOYSA-N 326.154 1.248 10 10 EDCE COC[C@H](O)CN1CCC(N[C@@H](C)c2ccc(F)c(F)c2O)CC1 187808925 PUKJPEQKGRAYAW-WCQYABFASA-N 344.402 1.793 10 10 EDCE COc1ccc(N2CCN(C)CC2)cc1NC(=O)c1ccc(O)nn1 74586718 QORRDEOSGNSJMU-UHFFFAOYSA-N 343.387 1.195 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NCCc2ccsc2)cc1 70490777 AGSVNYVETGHGQY-UHFFFAOYSA-N 326.443 1.871 10 10 EDCE C[C@H](O)CN(CCNCc1cccc(O)c1O)C(=O)OC(C)(C)C 382722703 TYUSTJQRDCUTFB-LBPRGKRZSA-N 340.420 1.805 10 10 EDCE COc1ccc(N2CCN(C(=O)CC(=O)NCCC(C)C)CC2)cc1 242719301 DAWMJOWKZWJBFW-UHFFFAOYSA-N 347.459 1.896 10 10 EDCE Cn1ccnc1[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 374363398 CIHWVVFWVZYAFL-JTQLQIEISA-N 343.343 1.653 10 10 EDCE COc1ccc(O)c(CN2CCC(CNS(C)(=O)=O)CC2)c1 289577761 SXSGFNSNDXKXOX-UHFFFAOYSA-N 328.434 1.162 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C(C)C)S(=O)(=O)C1CCCCC1 808514040 RRRIZVFJHXRTCL-AWEZNQCLSA-N 332.418 1.460 10 10 EDCE CC(=O)C(=O)COC(=O)CC[C@H]1CCN(C(=O)OC(C)(C)C)C1 808530892 GEJXZSNVVHFMFT-LBPRGKRZSA-N 327.377 1.725 10 10 EDCE CCS(=O)(=O)C1(CNC(=O)N(C)Cc2ccccc2O)CC1 823223903 CVXWSMJLPQGEMP-UHFFFAOYSA-N 326.418 1.501 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)cc1 836226390 DTLUORLUXHNPDI-KBAYOESNSA-N 347.459 1.824 10 10 EDCE Cc1cc(C(=O)NC2(C(=O)N(C)C)CC2)c(C)n1-c1ccccn1 840505829 RCNMJCQFQHIAKG-UHFFFAOYSA-N 326.400 1.840 10 10 EDCE CCCN(C)S(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849416373 QFEWKPFMCJSENU-CYBMUJFWSA-N 327.450 1.450 10 10 EDCE C[C@@H](NCC[C@@H]1CNCCS1(=O)=O)c1cc(Cl)ccc1O 925795697 NUHPJVUSIHIELY-ZYHUDNBSSA-N 332.853 1.473 10 10 EDCE O=C1N[C@H](CC2OCCO2)C(=O)N1Cc1ccc(N2CCCC2)cc1 924488087 OTJZRMRXQVMXOE-OAHLLOKOSA-N 345.399 1.470 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(=O)N(C)CC1 854176151 BLUUUBWUFJPNQT-HNNXBMFYSA-N 346.475 1.866 10 10 EDCE C[C@@H](CO)[C@@H](C)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 853776557 RMEYXXMQCQERGF-UONOGXRCSA-N 335.448 1.464 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC(O)(CO)CC2)c([N+](=O)[O-])c1 853831473 CQBXVOXLLXRKFP-HYXAFXHYSA-N 336.344 1.105 10 10 EDCE Cc1cnn(C)c1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 850360320 HCRHEUOSMSMUMV-UHFFFAOYSA-N 333.367 1.189 10 10 EDCE C[C@H](NC[C@]12COCCN1C(=O)COC2)c1ccc(Cl)cc1O 866554872 OHBNQVSJRJTFFF-MEDUHNTESA-N 340.807 1.324 10 10 EDCE 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MLRSTMIVLIGNNG-HKWRFOASSA-N 335.715 1.976 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 170760636 FMEMIINIBGOMIJ-CHWSQXEVSA-N 336.363 1.088 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCN(C4CCCC4)CC3)cc2N1 301614226 HXZDMGAMNYEMSL-UHFFFAOYSA-N 346.387 1.990 10 10 EDCE COc1ccc(/C=C2/SC(=S)N(CCO)C2=O)c(OC)c1 210386468 RZDKSBQMTZEQKW-KPKJPENVSA-N 325.411 1.897 10 10 EDCE Nc1ccc(CC(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)cc1 237928175 SJUVZJKSLBVGKG-UHFFFAOYSA-N 341.415 1.705 10 10 EDCE O=C1C[C@@]2(CCN(C(=O)NCc3ccc(N4CC=CC4)cc3)C2)CN1 279582910 URCPQXQYDUSYON-IBGZPJMESA-N 340.427 1.484 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](N)C2COC2)c(O)c1Br 2380767612 HJTWNDSFVDVZFK-LBPRGKRZSA-N 343.221 1.395 10 10 EDCE COCCNC(=O)[C@@H](C)NCc1ccc(C)c(Br)c1O 2380798131 MFTOQBNBSHCQAD-SNVBAGLBSA-N 345.237 1.704 10 10 EDCE C[C@H]1C[C@H](N(C)CC(=O)NCc2ccc(N(C)C)cc2)CCN1C 299215094 HVJUDELAWKRSHL-MAUKXSAKSA-N 332.492 1.783 10 10 EDCE Cc1ccc(CN2CCC(CN)(CO)CC2)c(O)c1Br 2381134925 JYXRWHOLMJYMSR-UHFFFAOYSA-N 343.265 1.996 10 10 EDCE CCNS(=O)(=O)[C@H]1CCN(Cc2cc(Cl)c(F)cc2O)C1 293684741 RSAGQLPKKIZPRW-JTQLQIEISA-N 336.816 1.698 10 10 EDCE CCc1nn(C)c(OC)c1CNC(=O)/C=C\c1ccc(O)c(O)c1 588407877 MDYVFWUTINJCNR-VURMDHGXSA-N 331.372 1.732 10 10 EDCE COc1cc(O)c(CN[C@H]2CNCC3(CCOCC3)C2)cc1OC 903975330 ZXNXBWGCJYNKSO-CQSZACIVSA-N 336.432 1.658 10 10 EDCE CN1C[C@@H](CCNC(=O)NCc2ccc3c(c2)CCCN3C)CC1=O 915389874 DTOMQKSSUDPABO-HNNXBMFYSA-N 344.459 1.737 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@]1(C)C[C@H](O)CN1C 910557511 DAVMFXNHABKDOP-UCLAIMLFSA-N 333.476 1.563 10 10 EDCE C[C@H]1CN([C@@H](C)CNC(=O)NCCc2ccc(N)cc2)C[C@@H](C)O1 848603902 VNKSBWOXDIZYGN-SOUVJXGZSA-N 334.464 1.608 10 10 EDCE CCO[C@@H](CS(=O)(=O)NCc1cc(OC)ccc1O)C1CC1 859007603 BUXYLRQWQIOFKF-HNNXBMFYSA-N 329.418 1.635 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1c[nH]nc1[C@H]1CCNC1 852805998 BERZJOODZHDGAY-AWEZNQCLSA-N 327.432 1.791 10 10 EDCE COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(C)cc(C)c1O 754741021 NXRCYZZKCFTJJR-KLHDSHLOSA-N 347.411 1.934 10 10 EDCE COC(=O)N1CC(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 853874468 AZJJCNJHUVAZAC-LBPRGKRZSA-N 348.403 1.024 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCN(C)[C@H]2C)cc1 925348970 OUVXOKUQQCUERA-YOEHRIQHSA-N 334.464 1.865 10 10 EDCE C[C@@H](NC(=O)c1ncccc1N)c1ccc(N2CCOCC2)cc1 865018217 INTOFVSKLKTQCT-CYBMUJFWSA-N 326.400 1.991 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H]2CNC[C@]2(C)C1 872154279 UCLRWAMBWVYTMG-QFBILLFUSA-N 330.476 1.252 10 10 EDCE Cc1cc(NS(=O)(=O)c2cccc3nonc23)ccc1OCCO 782266557 KQMMXBAGCTYANE-UHFFFAOYSA-N 349.368 1.703 10 10 EDCE CC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(F)(F)F 787682661 IAWOPVUQRXXTMI-JTQLQIEISA-N 340.323 1.834 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCCc1nnc2n1CCCC2 784488527 LGXGXUYLJBFOFQ-ALCCZGGFSA-N 328.372 1.398 10 10 EDCE C[C@H](CS(C)(=O)=O)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1145035529 YGDPLQFNIDCXGT-SECBINFHSA-N 326.378 1.354 10 10 EDCE COC(=O)NCC(=O)N[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1317101663 AAIMOGUSZIQYOQ-OKILXGFUSA-N 335.404 1.096 10 10 EDCE CCNC(=O)[C@H]1CNCCN1Cc1c(O)cccc1Br 706851957 BZTRVWRLACXUAB-GFCCVEGCSA-N 342.237 1.065 10 10 EDCE CCOc1cc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)[nH]n1 1331230905 ZIRVXXZZDMBZQE-GFCCVEGCSA-N 330.388 1.826 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)Cn2nccc2C)cc1C 1275327977 HRDGXOFTUCEVIA-AWEZNQCLSA-N 330.432 1.803 10 10 EDCE C[C@H](CN(C)C(=O)c1ccc(N=NC(N)=O)cc1)NCc1cnon1 1278024707 HUDVSKFSEYHJKY-SNVBAGLBSA-N 345.363 1.482 10 10 EDCE Cc1nnnn1-c1ccc(C(=O)NCc2cccc(O)c2O)c(F)c1 1455313516 CXMAPCYPEIAQJM-UHFFFAOYSA-N 343.318 1.451 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H](CNC(=O)C2CC2)C2CC2)cc1 1524301077 IMBKJULJSXNEKX-AWEZNQCLSA-N 343.387 1.884 10 10 EDCE O=C(NCCS(=O)(=O)C1CC1)c1cc2cc(O)c(O)cc2s1 1469022076 GXYZYZCKEFHIHC-UHFFFAOYSA-N 341.410 1.620 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)CN(C)C(C)=O)C2)cc1C 1479281259 YFWDLCJGMYIGGH-CALCHBBNSA-N 347.459 1.466 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)N(C)Cc1ccc(N(CC)CC)cc1 1623452477 WUZWUTNUECYQQU-MRXNPFEDSA-N 336.432 1.805 10 10 EDCE O=C(CNC(=O)c1ccccc1)NCc1ccc2cccnc2c1O 1557123868 YNGCOYPCJUSTRB-UHFFFAOYSA-N 335.363 1.987 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1=C2CCCN=C2NN1 1630180660 PLFCXRWGKYUYJJ-ZDUSSCGKSA-N 341.459 1.662 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)c2cnnc(O)c2)cc1C 1733979350 LIROPSHCRPULOE-STQMWFEESA-N 344.415 1.796 10 10 EDCE COc1ccc(CNC[C@@H]2CCCC[C@H]2NC(=O)CC(N)=O)cc1C 1669950627 WOHWMAPQIBOEIA-JKSUJKDBSA-N 347.459 1.644 10 10 EDCE CCCC(=O)N[C@H]1[C@H]2C[C@H]1N(C(=O)c1ccc(N=NC(N)=O)cc1)C2 1689478000 PBBSPWHPFVSLLT-LNSITVRQSA-N 343.387 1.978 10 10 EDCE C[C@@H](O)CN(Cc1ccccc1)C[C@@H](O)COc1ccc(N)cc1 1914616648 FJDYOOJLSGEFNU-CRAIPNDOSA-N 330.428 1.892 10 10 EDCE CC(C)(C)OC(=O)NC1CC(C(=O)O)(c2ccc(O)c(O)c2O)C1 1952590171 NWJQCZINXLBPEC-UHFFFAOYSA-N 339.344 1.813 10 10 EDCE O=C(N[C@@]1(c2cc(O)nc(O)c2)C[C@@H]1C(=O)O)OCc1ccccc1 1952976961 YCBZDOCFEKPMGZ-SJKOYZFVSA-N 344.323 1.719 10 10 EDCE O=S1(=O)CC[C@@H]1CNCc1cc(Br)cc(F)c1O 1972335903 BKYGEXLWNSIGJM-SECBINFHSA-N 338.198 1.571 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CCC(=O)N1CC[C@H](N=[N+]=[N-])C1 1985101258 PTHVEMXCZVWVJY-WDEREUQCSA-N 327.385 1.563 10 10 EDCE CN(C)c1ccc([C@H](O)CN2CC(NC(=O)OC(C)(C)C)C2)cc1 2003462344 ZIDCOTFJKWWPBE-MRXNPFEDSA-N 335.448 1.995 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010396684 OYARFKRUSJLIPH-ABAIWWIYSA-N 339.396 1.660 10 10 EDCE CN(C)C(=O)[C@@H]1COCCN1c1ccc(CO)c(Br)c1 2155016314 DPWICDRGEGYVTK-ZDUSSCGKSA-N 343.221 1.235 10 10 EDCE CCN(c1cc(Br)c(CN)cc1F)[C@H]1CC(=O)NC1=O 2171211827 ZGLKPSZTQXRXRT-NSHDSACASA-N 344.184 1.288 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)c(Br)c1 2102178884 XJSYVIIMEXTKMQ-NKBRHBOISA-N 328.206 1.698 10 10 EDCE CN(C)C[C@H]1COCCN1Cc1ccc(Br)cc1O 2096920928 HTKQXNFRTHYXHN-ZDUSSCGKSA-N 329.238 1.917 10 10 EDCE O=C(O)[C@@H]1CCC2(CN(Cc3ccc(Br)cc3O)C2)O1 2205351261 CKFGLRIFBJGOMX-LBPRGKRZSA-N 342.189 1.973 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(NC(=O)c2ccc(O)c(O)c2)C1 2216764445 SFWPYCNVAVIUDI-GTNSWQLSSA-N 334.372 1.837 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2236645740 RYPBLUFJXYXNCF-SDDRHHMPSA-N 343.265 1.896 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCN(OC)C2)c1O 2227749261 CIGNSVRLQDZHMQ-SECBINFHSA-N 331.210 1.889 10 10 EDCE CCOc1ccc(C=C2C(=O)N(c3nn[nH]n3)N=C2C)cc1OC 2296441782 PDBKWJJTDAHEQZ-UHFFFAOYSA-N 328.332 1.413 10 10 EDCE CC(C)NCc1ccc(N2CC(O)(CCO)C2)c(Br)c1 2286175396 HUJDNWXBJJVRMF-UHFFFAOYSA-N 343.265 1.881 10 10 EDCE C[C@@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)c1nc[nH]n1 2297957116 MUQIMPPXLULZPO-CYBMUJFWSA-N 327.388 1.532 10 10 EDCE CC[C@@H](N[C@@H]1C[C@H](O)[C@@H](O)[C@H]1O)c1cc(Br)ccc1O 2354717773 HTTSBHFXIHWLLO-SJVBDLOYSA-N 346.221 1.050 10 10 EDCE COc1ccc(N2CCN(C(=O)c3c[nH]c(=O)c(Cl)c3)CC2)cc1 54057247 LUJGXOPLYINOPO-UHFFFAOYSA-N 347.802 1.999 10 10 EDCE Cc1ccc(C(=O)N(C)[C@@H]2CCCN(c3cccnn3)C2)c(O)c1O 182471615 YVFDUFBFNCKSLB-CYBMUJFWSA-N 342.399 1.937 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc2ccccn2c1=O 183485317 ORNZDZAGFREYKN-LLVKDONJSA-N 339.351 1.467 10 10 EDCE CCCn1nc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccc1=O 183444878 CMTPRWQVAMBGTL-LLVKDONJSA-N 331.372 1.426 10 10 EDCE COCCNC(=O)Cn1cc(N[C@@H](C)c2ccc(F)cc2O)cn1 186498185 CCSDSHDBKKXEFG-NSHDSACASA-N 336.367 1.664 10 10 EDCE C[C@H](NC(=O)N[C@H](C)[C@@H](C)CO)c1ccc(N2CCOCC2)cc1 77796531 YZKGIOKPWSWXSI-ZNMIVQPWSA-N 335.448 1.900 10 10 EDCE Cc1ccc(C(=O)N2CCC(Oc3cnccn3)CC2)c(O)c1O 373246068 VDUWBPABIYTUOQ-UHFFFAOYSA-N 329.356 1.880 10 10 EDCE O[C@H](CNCc1ccc(N2CCOCC2)cc1)c1ccc(F)cn1 818972044 CAVMVQBWWYCBBU-GOSISDBHSA-N 331.391 1.881 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)[C@@H]2CCCc3n[nH]cc32)cc1 843299535 XJVZYFJGJPVCJZ-ZBFHGGJFSA-N 327.432 1.712 10 10 EDCE C[C@H]1CCCN(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)C1 746702054 DZNYFWJZHSITLY-LBPRGKRZSA-N 329.441 1.958 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CO)[C@H](c2ccc(O)c(O)c2O)C1 687737233 VYXMFVNIXFTCCX-MWLCHTKSSA-N 325.361 1.746 10 10 EDCE O=C(NCCS(=O)(=O)CC(F)(F)F)NCc1ccccc1O 853571045 VJOKDVNSIOQXTK-UHFFFAOYSA-N 340.323 1.169 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](O)C(F)(F)F)C2)cc1 854298372 BTQLHFBQVGLDRP-GXFFZTMASA-N 347.337 1.496 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H]3CCCCN3)C2)cc1 851660976 CBCDNFMNYYRWKV-HUUCEWRRSA-N 332.448 1.715 10 10 EDCE O=C(N[C@H]1CCCN2CCSC[C@@H]12)N1Cc2cccc(O)c2C1 925173421 XTMCGRFIYJDNDU-GJZGRUSLSA-N 333.457 1.997 10 10 EDCE CC(C)NC(=O)CN(C)CC(=O)NCc1ccc2cccnc2c1O 862028097 PPSRVZVVXFFIBD-UHFFFAOYSA-N 344.415 1.013 10 10 EDCE CCOC(=O)c1cn(C)nc1NC(=O)NCc1cc(C)ccc1O 860887689 YDDINDGEYKHIRI-UHFFFAOYSA-N 332.360 1.933 10 10 EDCE CN(C)c1cc(F)c(CN(C)[C@H]2CCN3CCO[C@H]2C3)cc1F 862382037 OFZMJAADFFOSIA-RDJZCZTQSA-N 325.403 1.936 10 10 EDCE CNC(=O)c1ccc(NCc2cccc(Br)c2O)nn1 764935579 YETOPRCYUUYORT-UHFFFAOYSA-N 337.177 1.916 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H]2CN3C(N)=O)cc1Br 1877074786 WIZYRBGSRRBMPZ-QWRGUYRKSA-N 325.210 1.249 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)NCc1ccc(F)c(F)c1O 1876257020 QSXYSFAKKBDTMW-SNVBAGLBSA-N 332.347 1.646 10 10 EDCE CNC(=O)C1(NCc2ccc(Br)cc2O)CCOCC1 895884281 JEQUNWURVCGGNV-UHFFFAOYSA-N 343.221 1.540 10 10 EDCE CN1CCN(c2ccc(CNC(=O)/C=C\c3ccncn3)cc2)CC1 893607750 KNCKREBUXQAPIB-DAXSKMNVSA-N 337.427 1.558 10 10 EDCE CC1(C)CN(Cc2cc3c(cc2O)OC[C@@H]3O)C[C@]2(CCOC2)O1 794695497 QZMVAGGAAPHRBA-YJBOKZPZSA-N 335.400 1.588 10 10 EDCE CCn1cc(C(=O)NC[C@@H](O)CNCc2ccc(OC)c(C)c2)cn1 1320203936 UFPZOJGETYHCOD-INIZCTEOSA-N 346.431 1.101 10 10 EDCE CCc1cc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)nn1C 1334471230 NHNLWUVRWXMWNJ-CYBMUJFWSA-N 328.416 2.000 10 10 EDCE COCCN(C(=O)OC(C)(C)C)[C@H](C(N)=O)c1ccc(O)c(O)c1 698423519 PYJJTQAOFPFXSP-ZDUSSCGKSA-N 340.376 1.508 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)c2[nH]nnc2C)C2CC2)cc1C 1269099948 ULBYVOWVXIVBEI-OAHLLOKOSA-N 343.431 1.728 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H](C[C@@H]1COCCO1)C(F)(F)F 1455355188 QQYCLRVKLFCHNN-VXGBXAGGSA-N 349.305 1.698 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CCCN(C(=O)N2CCCC2)C1 1472063495 LGLQTAQQJTUYCP-ZDUSSCGKSA-N 347.415 1.642 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2cnn(C)c2)cc1C 1700742890 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10 10 EDCE O=C(NCc1cccc(O)c1O)c1ccc(Cn2ccccc2=O)o1 1651172928 LCFXNSHGIIGSHZ-UHFFFAOYSA-N 340.335 1.831 10 10 EDCE C[C@H](NC(=O)c1ccn(CCn2cccn2)n1)c1ccccc1O 1587451180 KUDUIGFUBXUKJI-ZDUSSCGKSA-N 325.372 1.976 10 10 EDCE COc1ccc(N2CCN(CCNc3nccnc3CN)CC2)cc1 1120888266 BSSSPYKVBKOUSP-UHFFFAOYSA-N 342.447 1.178 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N3CC[C@@H](O)C3)c(Br)cc21 221246873 HCDNFLRAFFIRMN-AMIZOPFISA-N 340.221 1.623 10 10 EDCE CCN(CC(N)=O)c1ccc(CNCCOC)c(Br)c1 233444954 GZEAUSVLLJFZCZ-UHFFFAOYSA-N 344.253 1.497 10 10 EDCE CNCc1ccc(N2CCCS(=O)(=O)CC2)cc1Br 234435706 KBEOVIDBQMPTRC-UHFFFAOYSA-N 347.278 1.793 10 10 EDCE CO[C@@H]1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C[C@H]1F 2146474418 VDLSYLRFRIZWPJ-GGZOMVNGSA-N 345.168 1.608 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1OCCC1=O 1952404276 YJGOAZNWCHOBCN-NHYWBVRUSA-N 337.372 1.892 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CN1CCCN(C(=O)OC(C)(C)C)CC1 2010391154 NHXGIYPTVHJNLU-UHFFFAOYSA-N 340.428 1.698 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](OCC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010405673 KOPRRLRTLJQYTA-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)CNCc1ccc2c(c1)CCCO2 2011516546 JFJPQCSNULZVDX-OAHLLOKOSA-N 336.432 1.987 10 10 EDCE CN(CCCNC(=O)c1cc(O)c(O)c(O)c1)C(=O)OC(C)(C)C 2015122672 MLWRCMXHAZHTPL-UHFFFAOYSA-N 340.376 1.790 10 10 EDCE C[C@@H](NCC1(C(N)=O)CN(C(=O)OC(C)(C)C)C1)c1ccccc1O 2041265040 HTGXXQPUALNTSY-GFCCVEGCSA-N 349.431 1.765 10 10 EDCE CO[C@@H]1CN(Cc2ccc(Br)cc2O)C[C@@H]1C(=O)O 691436440 IFIUFUULOXPTHS-CMPLNLGQSA-N 330.178 1.686 10 10 EDCE OC[C@@H]1C[C@H](O)CN1c1ccc(CNC2CC2)cc1Br 698202120 VWTDUTWXLZUEOE-STQMWFEESA-N 341.249 1.633 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@@H]([C@H](O)C(F)(F)F)C1 2064271073 WQORIVNFWICVJG-YGRLFVJLSA-N 333.306 1.802 10 10 EDCE CN(C)C(=O)c1cn(Cc2cccc(Br)c2O)nc1O 2070595752 KBVHOYMQEKQKHZ-UHFFFAOYSA-N 340.177 1.807 10 10 EDCE CC[C@@H](O)CN(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2106613047 HSYGZUUWNJKYAB-KRTXAFLBSA-N 329.194 1.642 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)C[C@H]3C2)cc1Br 2236980680 RNUAVDCAECKPJW-AGCIHXOGSA-N 341.249 1.476 10 10 EDCE C[C@@H](NCc1nn(C)nc1Br)c1ccc(O)cc1O 2226968910 DGSQUTMSRYHGIN-SSDOTTSWSA-N 327.182 1.840 10 10 EDCE CO[C@H](CNCCc1ccc(O)c(O)c1)CNC(=O)OC(C)(C)C 2307259867 NMPCTWKAECMKKH-CYBMUJFWSA-N 340.420 1.770 10 10 EDCE CO[C@H]1CN(c2ccc(CO)c(Br)c2)[C@@H]2COC[C@@H]21 2329192135 QEDUTWRDNXGUJW-YUTCNCBUSA-N 328.206 1.791 10 10 EDCE Cn1cc(Br)c(CS(=O)(=O)Cc2ccc(N)cc2)n1 2341258100 FUQVKKJHQMBFCK-UHFFFAOYSA-N 344.234 1.880 10 10 EDCE Cc1ccc(N2CCCN(C(=O)c3ccc(C)c(O)c3O)CC2)nn1 179494875 KFKOVEAJFFWQLR-UHFFFAOYSA-N 342.399 1.857 10 10 EDCE Cc1ccc(S(=O)(=O)NCCN2C(=O)CSC2=S)cc1 71558017 VBSWBXYDUQSUGK-UHFFFAOYSA-N 330.456 1.134 10 10 EDCE Cc1ccc(/C=C2/SC(N3CCN(CCO)CC3)=NC2=O)cc1 33285959 JGRUKOWDZFHORB-NTCAYCPXSA-N 331.441 1.575 10 10 EDCE CCN(CC(F)(F)F)S(=O)(=O)CCOc1ccc(N)cc1 70490793 OPTRBSPNCVKNQN-UHFFFAOYSA-N 326.340 1.862 10 10 EDCE CC(C)Cn1cnc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c1 133763635 ZYUIJWQMDHWDDJ-UHFFFAOYSA-N 340.361 1.954 10 10 EDCE CCc1nc2n(n1)CCC[C@@H]2NC(=O)NCc1cccc(OC)c1O 88755963 TZUQZFNXDKVDQF-LBPRGKRZSA-N 345.403 1.889 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@@H](CO)C[C@H](O)C(C)(C)C)c1 284543166 XOKGPLJEWJTKQP-GHJWDPDVSA-N 339.432 1.987 10 10 EDCE Cc1ccc(CN[C@H]2CCn3nnnc3C2)c(O)c1Br 2380798807 SRZJUJMLERJZEZ-JTQLQIEISA-N 338.209 1.554 10 10 EDCE Cc1ccc(CN(C)[C@@]2(C(=O)O)CC[C@@H]2N)c(O)c1Br 2381130498 ZXHUGGGSDSFGJR-HZMBPMFUSA-N 343.221 1.839 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2CNCCO2)c(O)c1Br 2381133697 RYDCNZLLNXIIDU-NSHDSACASA-N 343.221 1.410 10 10 EDCE O=C(CN1CCOCC1)NCc1cc(Br)ccc1O 804738068 AZLVRAMNANXYFA-UHFFFAOYSA-N 329.194 1.103 10 10 EDCE CC(=O)C(=O)COC(=O)CC1CCN(C(=O)OC(C)(C)C)CC1 808508532 GYUFOWRILNLRGM-UHFFFAOYSA-N 327.377 1.725 10 10 EDCE CCNC(=O)CCC(=O)NCc1cc(Br)ccc1O 804733327 OTDOAJBOVIBNKW-UHFFFAOYSA-N 329.194 1.687 10 10 EDCE COC[C@](C)(O)CCNC(=O)NCc1c(O)ccc2c1CCCC2 836531681 IXMZJLDJEZNYSF-GOSISDBHSA-N 336.432 1.858 10 10 EDCE CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)n1 832285127 OHQXEVNIZBWGFE-ZDUSSCGKSA-N 346.391 1.307 10 10 EDCE N=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)NC1CC1 849053090 YKMGPJKXYKPWIM-UHFFFAOYSA-N 327.476 1.995 10 10 EDCE CCO[C@H](CNC(=O)NCc1cccc(OC)c1O)CN(C)C 926836937 JYBAHZGGYSXWTJ-CYBMUJFWSA-N 325.409 1.167 10 10 EDCE CS(=O)(=O)[C@@H]1CN(C(=O)c2cc(O)cs2)C[C@H]1C(F)(F)F 855332968 SAIIYDMBWIMQOL-VXNVDRBHSA-N 343.348 1.501 10 10 EDCE COC(=O)[C@H](C[C@H]1CCCOC1)NC(=O)c1ccc(C)c(O)c1O 862998172 WGOGBOFPKJIEAY-YPMHNXCESA-N 337.372 1.494 10 10 EDCE COC(=O)[C@]1(C)C[C@H](OC)CN1C(=O)/C=C\c1ccc(O)c(O)c1 869991335 NAGXXUMZUMYIDF-PSMYOLFUSA-N 335.356 1.290 10 10 EDCE Oc1ccc(F)cc1CNC[C@H]1CN(Cc2ccncc2)CCO1 862536601 QCCVDBBWNDXJFB-KRWDZBQOSA-N 331.391 1.917 10 10 EDCE C[C@H](NC(=O)c1ncccc1N)c1ccc(N2CCOCC2)cc1 865018218 INTOFVSKLKTQCT-ZDUSSCGKSA-N 326.400 1.991 10 10 EDCE CCOc1cccc(CN2CCC[C@H](CS(=O)(=O)NC)C2)c1O 862552028 RKGZTCCQQWIXGK-ZDUSSCGKSA-N 342.461 1.552 10 10 EDCE O=C(NCc1cccnc1-n1ccnc1)c1c(F)ccc(O)c1O 789953949 BZWIDMKRZPNIIF-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE Cn1cc2c(=NCc3cc(Br)ccc3O)ncnc-2[nH]1 794788997 ZFPOYYYEDUEYES-UHFFFAOYSA-N 334.177 1.817 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@@H](C(=O)C4CC4)C3)cc2N1 795139685 BAMBLHXYZJEEFB-CQSZACIVSA-N 347.327 1.110 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 1333118241 JUCSGOVSZMRALA-GFCCVEGCSA-N 337.395 1.145 10 10 EDCE COCc1n[nH]c(CNC(=O)NCc2cccc(Cl)c2O)n1 1252737003 OIFSGVGBSPSFDU-UHFFFAOYSA-N 325.756 1.310 10 10 EDCE CN1CCN(c2ccc(CN[C@H]3C[C@@H](O)C34CCC4)cc2F)CC1 1330298842 GVXGOKRYTKOIQD-ZWKOTPCHSA-N 333.451 1.971 10 10 EDCE C[C@@H](CNC(=O)C(C)(C)F)NC(=O)c1ccc(N=NC(N)=O)cc1 1285741037 LRIAVSYKIJGVFI-VIFPVBQESA-N 337.355 1.832 10 10 EDCE C[C@H]1Oc2ccccc2N(CC(=O)NCc2ccc(O)cc2O)C1=O 1299574022 OAXVOSMSPISWOZ-LLVKDONJSA-N 342.351 1.528 10 10 EDCE NS(=O)(=O)c1cc(C(=O)NCc2cccc(Cl)c2O)cs1 1457039149 VDORQWZUBVLHQG-UHFFFAOYSA-N 346.817 1.685 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)CN2CCCC2=O)cc1C 1480746597 BVOBYERXCXSFFZ-HNNXBMFYSA-N 347.459 1.610 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc3c(c2)N(C)C(=O)CO3)c1 1629740772 PLAUYLVQFRIDDJ-UHFFFAOYSA-N 326.352 1.986 10 10 EDCE CN1C(=O)C[C@@H](C(=O)NCc2ccc(O)cc2O)c2ccccc21 1639441593 ZMKHBGLNAZMIFH-CQSZACIVSA-N 326.352 1.864 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cnccn2)cc1C 1568808498 LOBQHDDMCYYKPF-ONEGZZNKSA-N 326.400 1.869 10 10 EDCE CSc1ncc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(O)n1 1567467962 WQLJJYDNOSSXMY-QMMMGPOBSA-N 335.385 1.676 10 10 EDCE CS(=O)(=O)c1ccc(/C=C\C(=O)NCc2ccc(O)cc2O)o1 1643103815 GNZLBTDSIWVQMK-XQRVVYSFSA-N 337.353 1.424 10 10 EDCE Cc1cc(CN(C)Cc2nnc3n2CCN(C)C3=O)ccc1N(C)C 1654765918 SEMMMZUEAOGNIU-UHFFFAOYSA-N 342.447 1.370 10 10 EDCE CCOC(=O)c1sc(NC(=O)c2cc(O)c(O)c(O)c2)nc1C 1865876322 CXEGSEKSZKKIDT-UHFFFAOYSA-N 338.341 1.997 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1COCCN1 1952551682 NFYRBEKHMYFQEH-STQMWFEESA-N 338.404 1.522 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC1(c2cc(O)nc(O)c2)CC1)C(=O)O 1952640896 VCGHCHFMYHHPHQ-SNVBAGLBSA-N 338.360 1.892 10 10 EDCE CC(C)(C)OC(=O)N1CCN=C(NCCOc2ccc(N)cc2)C1 1998959725 ZWUCNZVQZAEXCP-UHFFFAOYSA-N 334.420 1.886 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010405208 XONIKSJIUWWPSP-ZYHUDNBSSA-N 341.412 1.809 10 10 EDCE O=C(O)[C@@H]1OCC[C@H]1CNCc1c(O)cccc1Br 716260332 CHXWJKRTKKKNKW-QPUJVOFHSA-N 330.178 1.734 10 10 EDCE C[C@H](N)c1ccc(N2CC(N3CCOCC3)C2)c(Br)c1 2169500008 KJWXJVDCKIGBLO-NSHDSACASA-N 340.265 1.990 10 10 EDCE NCc1ccc(N2[C@H](CO)C[C@@H]3OCC[C@H]32)c(Br)c1 2090540587 COFZHOVPCTVPCZ-GDLCADMTSA-N 327.222 1.636 10 10 EDCE CCNCc1ccc(N(C)C2CS(=O)(=O)C2)cc1Br 2095899484 DZMCQMJMFRVAPB-UHFFFAOYSA-N 347.278 1.792 10 10 EDCE CCC[C@@H](CCOc1nnc(=N)[nH]n1)CNC(=O)OC(C)(C)C 2210652248 SZPZDRHVXWNKAZ-JTQLQIEISA-N 326.401 1.389 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](COc2nnc(=N)[nH]n2)C[C@@H]2CCC[C@H]21 2213778083 BWDYUGSXVAJOQN-GARJFASQSA-N 336.396 1.236 10 10 EDCE C[C@H]1CN(CCNCc2ccc(Br)cc2O)C(=O)N1 2230839889 VNOKRFQXFJYDLW-VIFPVBQESA-N 328.210 1.658 10 10 EDCE COc1ccc(N(C)C[C@@H](O)CN(C)C)c(OC)c1Br 2234882582 XTJYIVLUOSGXOV-JTQLQIEISA-N 347.253 1.825 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCC(=O)NC2=O)c1O 2236050011 ZEURFWQQDRMEHB-VIFPVBQESA-N 343.177 1.058 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC(CCCO)C3)c(Br)cc21 2239131506 UNZUQDODYJTRBS-ZDUSSCGKSA-N 340.221 1.610 10 10 EDCE CN(C)C(=O)[C@@H]1C=CCN1c1ccc(CO)c(Br)c1 2265497525 FSYRFNSNSASEDT-ZDUSSCGKSA-N 325.206 1.774 10 10 EDCE CC[C@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2288906485 WYDSHDYKWIDMMP-DRZSPHRISA-N 341.205 1.784 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)OCCn1cccn1 2297507159 GRQZSXSKUVFFGM-UHFFFAOYSA-N 327.384 1.976 10 10 EDCE C[C@@H](CNC(=O)C=Cc1ccc(O)c(O)c1)CN1CCN(C)CC1 2308001111 AEMMZAQOLXBHPK-AWEZNQCLSA-N 333.432 1.111 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)COC[C@@H]1CCOC1 117747391 XVNCDELTRVAKHK-QGZVFWFLSA-N 348.443 1.535 10 10 EDCE COc1cc(C)cc(CN2CCCN(S(C)(=O)=O)CC2)c1O 178847269 IPXWXAAZDCJMJT-UHFFFAOYSA-N 328.434 1.177 10 10 EDCE CN1C[C@@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)CCC1=O 127343862 DBUDZBMEMCBBKV-HNNXBMFYSA-N 328.416 1.483 10 10 EDCE C[C@@H]1C(=O)NCCCN1C(=O)NCc1ccc(N2CCCC2)cc1 191255667 JMUSCIQLUDISQB-CQSZACIVSA-N 330.432 1.707 10 10 EDCE C[C@H](NC[C@H]1CCC[C@]12NC(=O)N(C)C2=O)c1ccc(F)cc1O 363846411 CITSMKJHSDIOBM-RVPKQNPDSA-N 335.379 1.902 10 10 EDCE C[C@H]1C[C@@H](C(=O)NCc2ccc(N3CCOCC3)cc2)CCN1C 279124694 DELIJLIJGDUIEN-RDJZCZTQSA-N 331.460 1.870 10 10 EDCE Cc1ccc(C(=O)NC[C@H]2CCC3(CCOCC3)[C@H]2O)c(O)c1O 283754560 ZONCXTWBVORDFH-WBMJQRKESA-N 335.400 1.704 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CC[C@@H](CN)O2)c(O)c1Br 2380725577 LSYSTJOQSPBFLT-QWRGUYRKSA-N 343.221 1.586 10 10 EDCE CN(C)c1ccc([C@H](N)[C@@H](O)c2cn(C)nc2Br)cc1 2163139536 YKCSUWONIIRFMY-STQMWFEESA-N 339.237 1.982 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cn([C@@H]2CCCNC2)nn1 818208831 MYXOTZFDYAJWEO-MRXNPFEDSA-N 342.447 1.541 10 10 EDCE COc1ccc(N2CCCN(C(=O)CCc3cn(C)nn3)CC2)cc1 822919697 ODQROVWRHVNOPG-UHFFFAOYSA-N 343.431 1.495 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc(F)c(N2CCOCC2)c(F)c1 838171108 AFTIXYYITLJOGP-UHFFFAOYSA-N 327.283 1.116 10 10 EDCE Cc1cc(CN2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)on1 588403852 WODCHTQICWQSHR-HYXAFXHYSA-N 343.383 1.752 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)C(C)(C)C(=O)O)cc2)CC1 843332210 LGOMHJHFIJIFRC-UHFFFAOYSA-N 347.415 1.082 10 10 EDCE COc1cccc(CNC(=O)Nc2cnn(-c3ncccn3)c2)c1O 746032760 AXUVRIXXSVLMQF-UHFFFAOYSA-N 340.343 1.698 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](OC)[C@@H]3CCOC3)CC2)cc1 854198898 SMMIQNRTBCEUFF-PBHICJAKSA-N 334.416 1.395 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3c(C)nc(N)nc3C)C2)cc1 855228307 ZFNVCMHSSHTODI-CYBMUJFWSA-N 341.415 1.693 10 10 EDCE COC[C@@H]1COCCN1C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 923188581 SCTXHDUIDMGIPK-GOEBONIOSA-N 349.431 1.331 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc(C(N)=O)c[nH]3)C2)cc1 855229556 APWWWUVDSZVHHC-LBPRGKRZSA-N 328.372 1.131 10 10 EDCE Cc1cc(CCNC(=O)N[C@H]2CCNC2=O)c(C)n1-c1ccccc1 852411427 UGMNQPPKSAXNFW-KRWDZBQOSA-N 340.427 1.824 10 10 EDCE C[C@@H]1CNCC[C@@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851664361 XZFCAJLCXKHREC-KDOFPFPSSA-N 346.475 1.445 10 10 EDCE CC(=O)NC[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 761887544 UVPNKELURCJASE-LLVKDONJSA-N 348.359 1.278 10 10 EDCE COCCN(CCF)Cc1ccc(N2CCN(C)CC2)c(F)c1 1118656090 YXEQVOGJPYHTGX-UHFFFAOYSA-N 327.419 1.995 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@H](n3cncn3)C2)c([N+](=O)[O-])c1 776840070 VXHKVGHLOCQNMD-DXTPNHAXSA-N 343.343 1.824 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2Cc3cccc(O)c3C2)C1 871204352 YOLCLINITXRERK-HNNXBMFYSA-N 348.399 1.870 10 10 EDCE COC(=O)c1c(CN2CN(C)C(=O)[C@@H]2C)c2cc(F)ccc2n1C 895083954 NKDDITDZTIQTDT-JTQLQIEISA-N 333.363 1.724 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1895876751 YIPFGQOXENMIDY-DCAQKATOSA-N 325.369 1.268 10 10 EDCE C[C@H](NC(=O)[C@@](C)(O)Cn1ccccc1=O)c1ccc(N(C)C)cc1 790940151 JEFXPSBJOXXWSQ-LIRRHRJNSA-N 343.427 1.543 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2ccnnc2)cc1C 1321261337 JGAGMBPQNVECEY-ARJAWSKDSA-N 326.400 1.869 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2CCOc3nc(C)ccc32)c1 180449772 SGFGFCUMAXRVDQ-GQCTYLIASA-N 338.367 1.583 10 10 EDCE Cc1cnc2nc(C(=O)Nc3c(Cl)ccc4nonc34)nn2c1 1271356648 OVJGGVTXLCJENK-UHFFFAOYSA-N 329.707 1.875 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)C2=COCCO2)cc1C 1272628645 MKDZBMVQUPHIOC-CQSZACIVSA-N 334.416 1.876 10 10 EDCE COc1ccc(CNCC(C)(C)CN(C)C(=O)CC(N)=O)cc1C 1282288004 AKPWWIMKEUYRFP-UHFFFAOYSA-N 335.448 1.453 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc2nc(O)[nH]c2n1 1293284081 VEXRYYKFOHCXBS-UHFFFAOYSA-N 325.372 1.968 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2cc(S(N)(=O)=O)cc(C)c2C)c1 1453646780 BLDVDLIKRJKTAP-UHFFFAOYSA-N 348.424 1.895 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CN2CCN1C[C@H]2C 1542169776 ASZGRXQYNNCVMX-VQIMIIECSA-N 344.503 1.878 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(O)cn2)N(C)C)cc1 1472280737 LQCAIRSGKHRLOG-QGZVFWFLSA-N 328.416 1.886 10 10 EDCE COc1cc(N2CCN3C(=O)OCC[C@H]3C2)c([N+](=O)[O-])cc1OC 1612155029 NYVLUCGYXXRFPO-JTQLQIEISA-N 337.332 1.643 10 10 EDCE CC1CC(CNC[C@@H](O)CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1482802164 QDYOVGKRQFGZPE-KOHJWAIASA-N 347.419 1.575 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@](O)(C(F)(F)F)CC1 1627291702 LFDWHNCMNRKZRD-CQSZACIVSA-N 333.306 1.946 10 10 EDCE CCn1ccc(C(=O)NC[C@@H](O)CNCc2ccc(OC)c(C)c2)n1 1715605789 QCQNXARZBKTJTR-HNNXBMFYSA-N 346.431 1.101 10 10 EDCE C[C@@H](NC(=O)NCCN1CCNC1=S)c1ccc(N(C)C)cc1 1564598030 XMUGQQBQFMSUOS-GFCCVEGCSA-N 335.477 1.303 10 10 EDCE CNS(=O)(=O)c1cccc(NC(=O)c2cc(O)cs2)c1C 1566282263 NEDFIGQOPASKPM-UHFFFAOYSA-N 326.399 1.923 10 10 EDCE Nc1ncn(CC(=O)N(Cc2ccco2)Cc2ccccc2O)n1 1631143110 HACZYIYSUHPNDL-UHFFFAOYSA-N 327.344 1.388 10 10 EDCE CC[C@@H](CNC(=O)C1(C(N)=O)CC1)NCc1ccc(OC)c(C)c1 1732210272 PUXNHIPAGKPUPY-AWEZNQCLSA-N 333.432 1.254 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CN(C)CC3CCC3)CC2)cc1 1655796981 DYPSAUBPSFVVRF-IBGZPJMESA-N 347.503 1.910 10 10 EDCE COC(=O)c1cc(C2CN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)[nH]n1 1653474876 JZLHZVRXKONVHN-HYXAFXHYSA-N 343.339 1.247 10 10 EDCE NC(=O)C1CN(c2ccc(C=CC(=O)O)cc2Br)C1 1912025565 FSAOAOUVGDQDQP-UHFFFAOYSA-N 325.162 1.468 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)Cc2nc[nH]n2)cc1C 1670308330 FBHIJBRJZDBUOJ-UHFFFAOYSA-N 331.420 1.303 10 10 EDCE C[C@@H](O)CNC[C@]1(C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1671814655 BWAYKRLNNYASIR-PXAZEXFGSA-N 347.419 1.672 10 10 EDCE COc1ccc(OC)c(NC(=O)CN2C(=O)[C@H](C)SC2=S)c1 11635481 WNNNANBWINSZHJ-QMMMGPOBSA-N 340.426 1.891 10 10 EDCE CC(C)(C)C(=O)N1CCC(NC(=O)c2cc(O)c(O)c(O)c2)CC1 169859844 OMOYKPFTRLHCJG-UHFFFAOYSA-N 336.388 1.570 10 10 EDCE Nc1ccc(-n2nnc(C(=O)Nc3cccc([N+](=O)[O-])c3)n2)cc1 1857878429 BGJPOWVXUDHUHW-UHFFFAOYSA-N 325.288 1.405 10 10 EDCE COc1cccc(CNCC2(NC(=O)OC(C)(C)C)COC2)c1O 1946140665 XTGZMBXEZPVHAB-UHFFFAOYSA-N 338.404 1.784 10 10 EDCE O[C@@H]1CN(c2ccc(CNC3CC3)cc2Br)C[C@H]1O 236526419 VCMCIDRLEKRHSU-ZIAGYGMSSA-N 327.222 1.243 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N(C)C[C@H](C)O)c(Br)cc21 252600847 LYGJZMKQPSIESP-ISVAXAHUSA-N 342.237 1.869 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C[C@@H]1CCCO1)C(=O)NCCN=[N+]=[N-] 1985102792 LXRZOOAXJYRGAI-QWRGUYRKSA-N 327.385 1.875 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)NCC1(CN=[N+]=[N-])CC1 1990022961 OGEXKLNXCKWTKR-JTQLQIEISA-N 327.385 1.469 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4C[C@@]4(CO)C3)c(Br)cc21 2146313602 LFZDFPLYDGVCNQ-UEXBWHTRSA-N 338.205 1.220 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@]1(C)C(=O)N1CC(N=[N+]=[N-])C1 1993371882 JYFGZNWJJALPCJ-CQSZACIVSA-N 325.369 1.534 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)cc1Br 2149908169 QMAGTSUZZBIECF-QJPTWQEYSA-N 344.249 1.930 10 10 EDCE CC(C)(C)OC(=O)NC1CN(C[C@@H](O)COc2ccc(N)cc2)C1 1999479138 AEOOLJBNYQDBFU-CQSZACIVSA-N 337.420 1.217 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(N)=O)CN(Cc2ccc(N)cc2)C1 2001287203 PBAUPJQXMKSTHW-UHFFFAOYSA-N 334.420 1.175 10 10 EDCE Oc1cccc(CN=c2[nH]ccnc2I)c1O 2008699223 HHFQEEQFJIOXQY-UHFFFAOYSA-N 343.124 1.526 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)c1cnc(CNC(=O)OC(C)(C)C)n1C 2010405433 IBSFBUCYRIEMTM-UHFFFAOYSA-N 337.384 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H](CC(=O)N2CC(N=[N+]=[N-])C2)C1 2014405331 TXJBVQOLZGASEQ-ZYHUDNBSSA-N 339.396 1.970 10 10 EDCE CN(C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1ccncn1 2022936575 TWMZHLGFUWETCK-VXGBXAGGSA-N 334.376 1.024 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)CC[C@@H]3O)c(Br)c1 2161397695 UHESGHRNLKLOHB-ZQDZILKHSA-N 342.233 1.794 10 10 EDCE COC(=O)[C@@H](NCCCN=[N+]=[N-])c1cnn(C)c1Br 712458962 LMDDCEXRHIOICF-QMMMGPOBSA-N 331.174 1.687 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H](C(F)F)n3cccn3)c2n1 2062433924 BQVVLLRHBMWLIE-JTQLQIEISA-N 336.302 1.176 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@H](C)O[C@]4(CCO[C@H]4C)C3)c2n1 2064412445 PRTLWGJRGYEZEU-NVGCLXPQSA-N 346.387 1.152 10 10 EDCE C[C@@H](O)CN1CCCN(c2ccc(CN)c(Br)c2)CC1 2176855520 HYAMTMVQLSTGCU-GFCCVEGCSA-N 342.281 1.801 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)cc1Br 2190456380 GTYRXKYPZQGHPF-CYUUQNCZSA-N 341.249 1.631 10 10 EDCE COC(=O)NC[C@@H]1CCN1c1cc(Br)c(CN)cc1F 2187292956 LEEALGXFERQOKU-VIFPVBQESA-N 346.200 1.982 10 10 EDCE NCc1ccc(N2C[C@@H]3CCS(=O)(=O)[C@H]3C2)c(Br)c1 2088819816 MTQLERJBDBUIKW-GWCFXTLKSA-N 345.262 1.531 10 10 EDCE CN1CCO[C@@H]2CN(c3ccc(CN)cc3Br)C[C@H]21 2097704511 YOBWJRBGPGCJQC-ZIAGYGMSSA-N 326.238 1.427 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N(C)c2ccc(OC)nc2)c1 491686765 SIFIHQCZDPBCHO-QPJJXVBHSA-N 326.356 1.521 10 10 EDCE Cc1c(/C=C\C(=O)N(C)c2ccc(N3CCOCC3)nc2)cnn1C 492436229 GJEPXNPXHCSPCI-DAXSKMNVSA-N 341.415 1.636 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2333233765 JVENZGIMUWSRLJ-VGYUKGMSSA-N 334.185 1.382 10 10 EDCE Cc1ccc(CNC(=O)[C@]23C[C@](N)(C2)C3)c(O)c1Br 2352942839 LFZVDEWTSICHTJ-OKILXGFUSA-N 325.206 1.961 10 10 EDCE CNCc1ccc(N2CC3(CC[C@H](CO)O3)C2)cc1Br 2361840906 NXJMAJUICCMYGC-CYBMUJFWSA-N 341.249 1.899 10 10 EDCE COC(=O)C[C@@H]1C(=O)NCCN1Cc1cc(Cl)cc(C)c1O 183508418 XCLJQINVQSLBMS-GFCCVEGCSA-N 326.780 1.218 10 10 EDCE C[C@H](NCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1O 185065786 MBALRSJFVAWJLN-AWEZNQCLSA-N 345.422 1.794 10 10 EDCE COc1cccc(/C=C/C(=O)NCCN2C(=O)CSC2=S)c1 49756646 KJGZPNFTHKZLIR-AATRIKPKSA-N 336.438 1.685 10 10 EDCE COC(=O)c1ccc(S(=O)(=O)NCCc2ccc(N)cc2)cc1C 193336495 FQUTUVFQNPAKSC-UHFFFAOYSA-N 348.424 1.885 10 10 EDCE CC1(C)OCC[C@@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 296238148 OHMKDJKTILXGDC-LBPRGKRZSA-N 328.390 1.061 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC3(CNC(=O)O3)C2)c([N+](=O)[O-])c1 817131546 DAZNBVKZDCCSJD-HWKANZROSA-N 333.300 1.080 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cnnc(C)c1 819698200 IUERQBLFQRIDIW-UHFFFAOYSA-N 329.356 1.696 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NCCCc2ncn(C)n2)c1 827369680 IYDXPASOLHUCOV-LLVKDONJSA-N 333.392 1.522 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC3CCCC3)C2)cc1 826617013 HYORILDUANGTFZ-CQSZACIVSA-N 331.416 1.449 10 10 EDCE C[C@@H]1CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC[C@H]1O 588530696 OZZWVAHJNLHLPE-JNVBQHHASA-N 330.428 1.766 10 10 EDCE NCc1ccc2c(c1)CCCN2Cc1cnnn1[C@H]1CCCNC1 903872704 AGRORXAUUZHSEA-INIZCTEOSA-N 326.448 1.614 10 10 EDCE CN(C)c1ccc(/C=C/CNCCCN2CCC[C@@H](C(N)=O)C2)cc1 835037772 MREHBVDCGKCWBA-HNSSHINMSA-N 344.503 1.943 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)CO1 1895876485 VPHCGZAYQFLDIA-ONGXEEELSA-N 325.369 1.437 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)N3CCCC3)C2)cc1 849416679 VAOVCBLHPINIIU-CYBMUJFWSA-N 325.434 1.204 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN(C3CC3)C(=O)C2)c([N+](=O)[O-])c1 748285604 YMRKYASTYNTMQJ-XVNBXDOJSA-N 345.355 1.592 10 10 EDCE Oc1cc2c(cc1CN1CCn3c(CC4CC4)nnc3C1)OCO2 844717648 ACSUUSIVQQDBID-UHFFFAOYSA-N 328.372 1.681 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@@H]3C[C@H](N)C34CCC4)cc2)C1 925484222 CSQUFGDPRMLPBR-BPQIPLTHSA-N 342.487 1.748 10 10 EDCE O=C(CS[C@@H]1CCS(=O)(=O)C1)NCc1c(O)cccc1F 928709583 JSVVVGSNZNDPPL-SECBINFHSA-N 333.406 1.068 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC([C@@H]4CCOC4)C3)C2)cc1 854296910 HPBFALDXHQLVGX-GDBMZVCRSA-N 345.443 1.952 10 10 EDCE CO[C@@H](CNCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCOC1 850342911 OKPKVEFUAMXDOB-YJBOKZPZSA-N 338.423 1.803 10 10 EDCE CCc1noc(C[C@@]2(O)CCCN(Cc3c(O)cccc3OC)C2)n1 856595642 GVXURRXGASCELL-SFHVURJKSA-N 347.415 1.916 10 10 EDCE CCN(CC)c1ccc(CN(C)[C@@H]2CCN(CC(=O)O)C2=O)cc1 852726556 SFIJKEPSKNKLED-MRXNPFEDSA-N 333.432 1.650 10 10 EDCE COc1ccc(N2CCN(C[C@H]3CC4(CNC4)CO3)CC2)cc1F 923325159 ASCMKVFGPFCIAX-OAHLLOKOSA-N 335.423 1.335 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](CC(C)C)C(N)=O)C2)cc1 855224512 LFTMJVZRQBIFLJ-CZUORRHYSA-N 333.432 1.538 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCNC(=O)C3CC3)C2)cc1 851972056 UZIYIXUOBQSLBH-AWEZNQCLSA-N 346.431 1.099 10 10 EDCE CC[S@@](=O)CCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852117914 BIGZQCOFJMULJG-JCQPUDPBSA-N 339.461 1.342 10 10 EDCE CC1(C)COC[C@@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852374764 XVIAGVWXNLCWDC-KRWDZBQOSA-N 347.459 1.872 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCc4nncn4C3)C2)cc1 855226138 NOAPTCFLEQISRS-KBPBESRZSA-N 341.415 1.244 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3nnc(C4CC4)o3)C2)cc1 866019108 QYAZPXYHTLMZCA-GFCCVEGCSA-N 328.372 1.964 10 10 EDCE COC(=O)c1ncoc1COCC(=O)N(C)Cc1ccccc1O 860049056 PXCOWAVMVYNFEH-UHFFFAOYSA-N 334.328 1.342 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)C1CCN(C(=O)OC)CC1 935944890 BZLWXVCSCLKVHK-UHFFFAOYSA-N 341.404 1.973 10 10 EDCE NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(CO)cc1Br 1877072658 VTCJMDBZMXAVCG-UWVGGRQHSA-N 326.194 1.283 10 10 EDCE O=C(c1cc(N2CCOCC2)ccn1)N1Cc2cccc(O)c2C1 871199603 ZJLCVOHJTSHAAA-UHFFFAOYSA-N 325.368 1.780 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnn4c3NCCC4)C2)cc1 1123924567 MPFGONXNBKKQPR-CYBMUJFWSA-N 341.415 1.716 10 10 EDCE CO[C@@H]1C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)C1 1895876090 QVPMXJACJWLEJY-GHMZBOCLSA-N 325.369 1.532 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)N(C)C)cc1 1304766989 CBAGXVWLBNFFFT-CQSZACIVSA-N 346.391 1.417 10 10 EDCE Cc1cccc([C@@H](CC(=O)NCc2cc(O)ccc2O)NC(N)=O)c1 1303223147 BZJAUBQDGXJSOB-OAHLLOKOSA-N 343.383 1.822 10 10 EDCE CCn1cc(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nn1 1335923867 IGAFECQPOHERSR-UHFFFAOYSA-N 347.394 1.133 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2COCCO2)cc1C 1268511187 CXPCLLXEHDLLBN-LIMHQNJXSA-N 334.416 1.181 10 10 EDCE C[C@H](O)CN(C)C[C@@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1505466319 WKMRCTAFCXXERH-WFASDCNBSA-N 347.419 1.766 10 10 EDCE O=C(CCN1C(=O)CSC1=S)NCCCCN1CCCC1 1865765117 QZWWLIFZKGAFDX-UHFFFAOYSA-N 329.491 1.229 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN(Cc2cccnc2)CC1 1293622128 SBAIBUKABRSGTN-UHFFFAOYSA-N 341.411 1.816 10 10 EDCE O=C(O)C[C@H]1CN(Cc2ccc(Br)cc2O)C[C@H]1O 2117729041 UDBJVQJDYGTALO-JOYOIKCWSA-N 330.178 1.422 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@]2(C)CCNC(=O)C2)cc1C 1483139492 ATTVWDKQODXCKW-KUHUBIRLSA-N 347.459 1.514 10 10 EDCE CS[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)C[C@H]1N1CCCC1 1556103733 BGRKHFZWWMJUIF-CJNGLKHVSA-N 336.457 1.679 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2cnn(C)n2)C(C)C)cc1C 1715676865 NDMKHKXQIASHSS-OAHLLOKOSA-N 345.447 1.676 10 10 EDCE C[C@@H](O)CNC[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1567155329 OTGBEZLGDRZVHO-NEPJUHHUSA-N 333.392 1.282 10 10 EDCE NC(=O)COc1ccc(C(=O)NCc2cccc(Cl)c2O)cc1 1648606444 QNVFLAQZOSOMRA-UHFFFAOYSA-N 334.759 1.840 10 10 EDCE CC[C@@H](CNC(=O)[C@H](F)CC)NC(=O)c1cc(OC)nc(OC)c1 1582525928 PUFWEIFZZKMQQH-NWDGAFQWSA-N 341.383 1.472 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@@H](O)C2(C)C)c(Br)c1 2124803107 UIPCYXPXAVEGMT-BZHVJNSISA-N 330.222 1.823 10 10 EDCE CC(C)OCC(=O)NC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1759179677 MYYSBWIPWOGNNM-UHFFFAOYSA-N 347.375 1.215 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)c(Br)c1 2126155918 AVRXTJXJPKRRAT-DJBIQUGXSA-N 328.206 1.119 10 10 EDCE Cc1cccc(C(=O)NCCNC(=O)c2cc(O)c(O)c(O)c2)c1 169839041 QDLBMUNKAOXFBR-UHFFFAOYSA-N 330.340 1.272 10 10 EDCE CN1NC(=O)[C@H](CC(=O)Nc2ccc(N3CCCCC3)cc2)C1=O 169996201 MPIKBSNTPQEPDI-AWEZNQCLSA-N 330.388 1.125 10 10 EDCE COCCNC(=O)CCNCc1cc(Br)ccc1O 227439168 WXEWRGDLACACGO-UHFFFAOYSA-N 331.210 1.397 10 10 EDCE CNCc1ccc(N2CCSC[C@@H]2S(C)(=O)=O)cc1Cl 234371038 MTTOUOWFRDZXMZ-ZDUSSCGKSA-N 334.894 1.983 10 10 EDCE CN(Cc1cc(N)ccc1O)C[C@@H](O)CNC(=O)OC(C)(C)C 1977887361 CANAPKSYBNPPDV-ZDUSSCGKSA-N 325.409 1.292 10 10 EDCE CC(C)(C)OC(=O)N1CCN(Cc2ccc(N)cc2)[C@H](C(=O)O)C1 1999443022 VCUFDUABSYXWCR-AWEZNQCLSA-N 335.404 1.775 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010390424 DEQNYXAVGYUCHR-QJPTWQEYSA-N 339.396 1.970 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)c1cn(C)nc1CNC(=O)OC(C)(C)C 2010404543 BBXVIZZYQPZEKC-UHFFFAOYSA-N 337.384 1.827 10 10 EDCE CCCNCc1ccc(N(C)C(CO)CO)cc1Br 311880336 MXHCGKXNUMZOLU-UHFFFAOYSA-N 331.254 1.738 10 10 EDCE CNCc1ccc(N2C3COCC2COC3)c(Br)c1 399787569 XYYRCZICRAKOST-UHFFFAOYSA-N 327.222 1.773 10 10 EDCE CN[C@H](c1ccccc1O)[C@@H](O)c1nn(C)cc1Br 2093828206 AFVZNFPZGMDUBC-DGCLKSJQSA-N 326.194 1.882 10 10 EDCE CC(C)N1CCN(c2ccc(CN)cc2Br)CC1=O 2114173606 WUWVHEYPIAMBSA-UHFFFAOYSA-N 326.238 1.965 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2OCC[C@]2(C(=O)NCCN=[N+]=[N-])C1 2246329574 AASFTGCTWVIRHR-YGRLFVJLSA-N 325.369 1.439 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)CNC(=O)c1ccc(O)c(O)c1 2301727077 FTSZZYAYTRSTPG-NSHDSACASA-N 340.376 1.367 10 10 EDCE Cn1nc(Br)c(N2CCc3cc(O)c(O)cc3C2)n1 2341212833 ARGYCPQAPWAAGK-UHFFFAOYSA-N 325.166 1.552 10 10 EDCE Cc1cc(N2CCN(C(=O)NCc3ccc(N(C)C)cc3)CC2)n[nH]1 186842877 XXSZWAZFNGOEDI-UHFFFAOYSA-N 342.447 1.816 10 10 EDCE COc1cc(N2CCN(Cc3cc(C)cc(OC)c3O)CC2)ncn1 185610309 OIATXXDHEQZDFG-UHFFFAOYSA-N 344.415 1.830 10 10 EDCE O=C1CCCN1C[C@@H](O)CN(Cc1ccccc1O)C[C@H]1CCCO1 121038268 PKLPIXIWALBCCB-DLBZAZTESA-N 348.443 1.357 10 10 EDCE COc1ccc(N2C(=O)/C(=C/N3CCCCC3)C(=O)NC2=S)cc1 254869414 ILWMBEMMJRAJNL-SDNWHVSQSA-N 345.424 1.813 10 10 EDCE CC(C)C[C@@H](CO)N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 283610074 VKTDSQMNFFMUMZ-INIZCTEOSA-N 335.448 1.234 10 10 EDCE CC(C)N(C[C@H](C)O)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803660898 IRZZOBLLMZFBSU-LBPRGKRZSA-N 339.411 1.126 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 808484353 BOVUEFHCPDACGM-IHRRRGAJSA-N 349.383 1.054 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C 808500609 SIWMNUPKZVGGSI-AWEZNQCLSA-N 349.383 1.824 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(C)C3)CC2)cc1 801253377 YFHBLLJIDBQGOY-FPLPWBNLSA-N 343.427 1.378 10 10 EDCE COCCNCc1ccc(N2CC=C[C@H](O)C2)c(Br)c1 2165068944 MCATVQIXPSREJN-ZDUSSCGKSA-N 341.249 1.922 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](NC(N)=O)C2)cc1Br 723173802 POZXKWLLANHMRA-IUCAKERBSA-N 327.226 1.716 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CCC[C@H](C)O1 828438673 ZIGIILRDWIAEBJ-YOEHRIQHSA-N 347.459 1.751 10 10 EDCE CNS(=O)(=O)CCNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 832746853 ZYSDOQPICOISRR-UHFFFAOYSA-N 349.456 1.302 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C/Cn3cncn3)CC2)cc1F 900997535 GLMBYTIKGHEYEO-NSCUHMNNSA-N 345.378 1.331 10 10 EDCE NC(=O)C12CCC(CC1)N2C(=O)NCc1ccc(N2CCCC2)cc1 914180819 XMGNBMQALQTTRE-UHFFFAOYSA-N 342.443 1.979 10 10 EDCE O=C(O)[C@@H]1CC[C@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)O1 911745751 UGUCYTPDDYHXHL-ZJUUUORDSA-N 334.155 1.947 10 10 EDCE O=C1C[C@H](CCNC(=O)NCc2ccc(N3CCCC3)cc2)CN1 914180522 PJFGNARGVORVSP-HNNXBMFYSA-N 330.432 1.612 10 10 EDCE Cc1cc(CN2CCN(CC(N)=O)C(=O)C2)c(O)c(C(C)(C)C)c1 840159516 LTBHLQNKYOQCDJ-UHFFFAOYSA-N 333.432 1.128 10 10 EDCE Nc1ccc(NC(=O)NC[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@@H]6[C@H]4[C@H]2[C@@H]6C[C@H]53)cc1 841297336 OVZZSWKCNIASLI-CSBCJRBRSA-N 325.412 1.899 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@@H]3C[C@H]2C[S@@]3=O)c([N+](=O)[O-])c1 845735578 YBPNPXNUIDDWJB-IDYFQQOYSA-N 336.369 1.491 10 10 EDCE O=S(=O)(CCOCC1CC1)NNc1nc2cccnc2s1 857226009 XKTYVUAZCGGCCB-UHFFFAOYSA-N 328.419 1.364 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCc4cncn4C3)C2)cc1 855224460 GMCOSBRNAZWOIC-GJZGRUSLSA-N 340.427 1.849 10 10 EDCE C[C@H](NC[C@H](O)[C@@H]1CCCO1)c1ccc(N2CCOCC2)c(F)c1 858469669 XXALTDHPLAGWHO-KKXDTOCCSA-N 338.423 1.853 10 10 EDCE COC(=O)[C@@H]1C[C@H]1[C@H]1NC(=O)N([C@@H](C)c2ccc(N(C)C)cc2)C1=O 924717262 LYUNOELNXFADIW-CJYSPXJISA-N 345.399 1.543 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1c(C)cnn1C 850345226 OVEYCRMYJHWJIS-UHFFFAOYSA-N 343.431 1.782 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CC[C@](CO)(C(F)(F)F)C1 924456092 KZOIUOWHBTWOJN-XBPVQUQDSA-N 331.290 1.884 10 10 EDCE CN1CCN(c2ccc(CN3CCN4C(=O)OCC[C@@H]4C3)cc2)CC1 775743952 HVHIERLZHBCUMR-GOSISDBHSA-N 344.459 1.465 10 10 EDCE CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1cccc(O)c1O 776640258 JCJRQUNORODZHF-UHFFFAOYSA-N 348.380 1.209 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@@H](C(=O)N3CCCC3)C2)c(O)c1O 780942078 ZCGZOXFFLSMZSN-CYBMUJFWSA-N 332.400 1.881 10 10 EDCE CCOc1ccc(O)c(CN2CCC(O)(COCCO)CC2)c1 895827344 OFRUVDCQIVUHNM-UHFFFAOYSA-N 325.405 1.127 10 10 EDCE C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 897581481 RLIJKMFOGGBJNS-RZFFKMDDSA-N 347.434 1.916 10 10 EDCE C[C@H]1C(=O)N(NC(=O)c2cc3cc(O)c(O)cc3s2)C(=O)N1C 1148186877 JGZYDZVZBBXODO-LURJTMIESA-N 335.341 1.240 10 10 EDCE CC(C)(C)OC(=O)NCCOCCC(=O)NCc1ccccc1O 1962863805 FYSGXRRIYFOJAP-UHFFFAOYSA-N 338.404 1.940 10 10 EDCE NC(=O)N[C@@H](CC(=O)NCc1cc(O)ccc1O)c1cccs1 1176748319 OQXBWHIXMFSSOG-NSHDSACASA-N 335.385 1.575 10 10 EDCE CC[C@@H](CNCc1ccc(N2CCN(C)CC2)c(F)c1)C(=O)OC 1331547210 FXPGLFSBYQHXFN-HNNXBMFYSA-N 337.439 1.866 10 10 EDCE C[C@H](O)CCCN1CC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1269352778 WFZZNLOERXEQIV-SWLSCSKDSA-N 347.419 1.814 10 10 EDCE O=C(O)[C@H](NCc1c(O)cccc1Br)[C@H]1CCCO1 1351742994 USSCUYHBNBKGMF-VXGBXAGGSA-N 330.178 1.877 10 10 EDCE CCC(=O)NC[C@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1296384918 PZKQGBVOZGYDTH-CYBMUJFWSA-N 331.376 1.980 10 10 EDCE O=C(NCc1nnnn1CC1CC1)c1cc2cc(O)c(O)cc2s1 1467339599 ZBDNVSWSEXUVMR-UHFFFAOYSA-N 345.384 1.639 10 10 EDCE COCCCN[C@H]1C[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1707075921 VHEWRGOBVIVEGS-JNSHFYNHSA-N 347.419 1.984 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc(CO)nc1 1625607232 CSJPJDJPTHVIIE-UHFFFAOYSA-N 327.384 1.341 10 10 EDCE COc1ccc(-n2nnnc2CNCC[C@H](C)NC(=O)C(C)C)cc1 1716121263 YCMZOEQFPCPWQO-ZDUSSCGKSA-N 346.435 1.311 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2cncnc2O)cc1C 1715338762 MWOHJVPVQFLXKY-ZDUSSCGKSA-N 344.415 1.750 10 10 EDCE O=C(CNC(=O)Cc1cccc(F)c1)NCc1c(O)cccc1O 1647270707 XQLGNEJNSVUHTQ-UHFFFAOYSA-N 332.331 1.212 10 10 EDCE CNC(=O)NC1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1642790773 VVSKPKUTFCVTLY-UHFFFAOYSA-N 349.412 1.846 10 10 EDCE CCOCC(=O)NCCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1758328871 XCUNLJPSTOOECK-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@@](C)(C(N)=O)C2)c([N+](=O)[O-])c1 1773003272 STGUZBRKADFLAB-DQOPKJQZSA-N 333.344 1.483 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@H]2COC(=O)C2)cc1C 1699402484 SAPMGYXOWDOURF-DZGCQCFKSA-N 334.416 1.551 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](O)C2)c(Br)c1 233640387 PDEPYYSVCPJBBV-IIMNLJJBSA-N 329.238 1.661 10 10 EDCE COc1ccc(N(C)C[C@](N)(CO)C2(Br)CC2)cc1 2141692666 GMKCDJLMOAHHLH-AWEZNQCLSA-N 329.238 1.749 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NCc1cccc(O)c1O 1948531750 VDDNYRFAJCGHID-CHWSQXEVSA-N 338.404 1.727 10 10 EDCE CN[C@@H](C)c1ccc(N2CCO[C@H](CO)C2)c(Br)c1 168117508 LUVJWJMTTMMROW-JQWIXIFHSA-N 329.238 1.927 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985093828 FYKQOGQVIFMGPT-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985100621 IEARHZZWCMPUAH-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE CC(C)NCc1ccc(N(C)CC(CO)CO)cc1Br 2150414391 FJRKPYJVIKWCTI-UHFFFAOYSA-N 345.281 1.984 10 10 EDCE CN1CCc2cc([C@@H](N)C3(O)CN(C(=O)OC(C)(C)C)C3)ccc21 1999536912 QJFSFKGGJICICJ-OAHLLOKOSA-N 333.432 1.661 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1Nc1c(N)cccc1C(=O)O 2000872809 ZCGZOPZJMRJGRF-RYUDHWBXSA-N 337.376 1.671 10 10 EDCE COc1ccc(N2C[C@@H](NC(=O)OC(C)(C)C)C[C@@H](O)C2)c(N)c1 2002706779 CXCARRDHNXFVOL-NWDGAFQWSA-N 337.420 1.742 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CCCOC1 2003639306 ZAUCBZLTPAZOHD-PSTGCABASA-N 340.420 1.326 10 10 EDCE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)C(=O)c1ccc(O)c(O)c1 2006281824 RROAZSUVKPMVHS-NSHDSACASA-N 340.376 1.055 10 10 EDCE CNCc1ccc(N2CC(S(C)(=O)=O)C2)c(Br)c1 2034838138 IEHPIWNVTLUPDI-UHFFFAOYSA-N 333.251 1.402 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@H](CO)C2)cc1Br 316654208 DTHIXAUFKJWBSS-SMDDNHRTSA-N 329.238 1.348 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)cc1Br 2178086655 MQSUGAIOWARCAZ-VWFLFCASSA-N 341.249 1.912 10 10 EDCE O=C(O)CN(CC(=O)O)Cc1cc(Br)cc(F)c1O 715757802 AQEZHDILXHLWSL-UHFFFAOYSA-N 336.113 1.265 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2060611416 SYCXTCYXMSDUFG-JQWIXIFHSA-N 349.395 1.757 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1CO[C@@H]2COC[C@H]12 2101884580 GJWNYXPYVOOIDW-YUSALJHKSA-N 332.169 1.797 10 10 EDCE O=C(O)[C@@H](NCc1cc(Br)cc(F)c1O)C1COC1 2104897017 UKWWZGKQTREWFW-JTQLQIEISA-N 334.141 1.483 10 10 EDCE CN[C@H](C)c1ccc(N2CC(OCCO)C2)c(Br)c1 2095969617 KJKXTTXATDUPSM-SNVBAGLBSA-N 329.238 1.927 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CN(Cc3ccc(N)cc3)C[C@@H]2[C@H]1CO 2220131230 OEUWIAXFMPXDLW-BHYGNILZSA-N 347.459 1.928 10 10 EDCE Cn1nc(Br)c(COC(=O)Cc2ccc(N)cc2)n1 2226994365 GDEISFDHORZUOJ-UHFFFAOYSA-N 325.166 1.446 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)CC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 2242655888 HVLOQNRHTIDINT-WDEREUQCSA-N 325.369 1.268 10 10 EDCE Nc1ccc(CS(=O)(=O)Nc2cnncc2Br)cc1 2278731592 ZQSCWSSUTFXLRP-UHFFFAOYSA-N 343.206 1.763 10 10 EDCE OC[C@@H]1CN(c2ccc(OCc3ccccc3)cc2)C[C@H](O)[C@H]1O 2299511369 HYEIXKZDWLCSAX-SNRMKQJTSA-N 329.396 1.416 10 10 EDCE CNC(=O)[C@H]1CN(C(=O)/C=C\c2cncc(C)c2)c2ccccc2O1 492978350 CQKSAHQTJXBUQX-ZPUOCTKUSA-N 337.379 1.943 10 10 EDCE CS(=O)(=O)[C@@H]1CC[C@H]1NCc1ccc(Br)cc1O 2319822778 RAIJCIFQCQDNTF-ZYHUDNBSSA-N 334.235 1.820 10 10 EDCE CN[C@H](C)c1ccc(N2CC([C@@H](O)CO)C2)cc1Br 2336782487 GNSHPAORBFGBFL-OTYXRUKQSA-N 329.238 1.519 10 10 EDCE COc1ccc(N(CCCOC(N)=O)CCCOC(N)=O)cc1 3623073 VTLIEJJDWYPNTM-UHFFFAOYSA-N 325.365 1.472 10 10 EDCE CC1(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)COC1 112724187 GPVMPQSLLZHIRC-UHFFFAOYSA-N 347.459 1.731 10 10 EDCE Cc1ccc(O)c([C@H](C)NCCN2CCN(c3ncccn3)CC2)c1 185065204 QSDYIRLYPYQPEC-INIZCTEOSA-N 341.459 1.963 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@]3(O)CCCC[C@@H]3C2)cc1 140480525 ZPTSVIUIMCNJLQ-XLIONFOSSA-N 345.487 1.996 10 10 EDCE C[C@H](NC[C@@]1(CO)COCC2(CCC2)N1C)c1ccc(F)cc1O 527955326 NOMCYCOXACIFHO-SCLBCKFNSA-N 338.423 1.798 10 10 EDCE Cc1cc(N2CCC[C@@H](NCc3cc4c(cc3O)OCO4)C2)n(C)n1 365554255 JXINTVFUUVPKJH-CQSZACIVSA-N 344.415 1.921 10 10 EDCE COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1C(=O)/C=C/c1ccc(O)c(O)c1 276238032 LQYKDEREGPUPQZ-AHRVHSDPSA-N 331.368 1.911 10 10 EDCE Cc1ccc(CNC(=O)[C@]2(C)COC[C@@H]2N)c(O)c1Br 2380725246 JDCFXBPXAROPDO-IINYFYTJSA-N 343.221 1.443 10 10 EDCE CN(C)c1ccc(/C=C\CNC2CCN(S(C)(=O)=O)CC2)cc1 835035102 FNLRSHUNEOGDQF-PLNGDYQASA-N 337.489 1.779 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CC[C@@H]3C(=O)O)CC2)cc1F 911582137 MDKFZUMLEMGJPH-OLZOCXBDSA-N 336.363 1.594 10 10 EDCE O=S(=O)(CC1(F)CC1)NCc1ccc(N2CCOCC2)c(F)c1 913943582 RUAZNNGQICNIAE-UHFFFAOYSA-N 346.399 1.584 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CN1CC[C@@H](C)C1 848232176 YRHGOCFMNKLROL-CQSZACIVSA-N 334.416 1.626 10 10 EDCE Cc1cc(O)c(CN2CCN(c3cnn(C)c3)C(=O)C2)c(Cl)c1 840917450 LFTFUGCEIXCYII-UHFFFAOYSA-N 334.807 1.936 10 10 EDCE C[C@H]1CNCC[C@@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 841730715 VBDIDCAQZJPSIT-YOEHRIQHSA-N 332.448 1.320 10 10 EDCE C[C@H](c1ccc(N2CCOCC2)cc1)N1C(=O)N[C@H](CCF)C1=O 844723271 WFXTWTPWNYWXGG-IUODEOHRSA-N 335.379 1.864 10 10 EDCE Cn1ncc2c1CCCN(c1cc3c(cc1[N+](=O)[O-])OCC(=O)N3)C2 840359867 QYQWBQYJZQSZJF-UHFFFAOYSA-N 343.343 1.612 10 10 EDCE C[C@H]1CN(c2ccc(CNC(=O)CC3(N)CC3)cc2F)C[C@H](C)O1 852860807 VHDOWRMQBMHLCR-STQMWFEESA-N 335.423 1.937 10 10 EDCE COc1cc(Cl)cc(CN2C[C@@H]3COC[C@]3(C(=O)O)C2)c1O 854242599 NQFIPJRIYVRUMN-MEBBXXQBSA-N 327.764 1.587 10 10 EDCE Fc1cc(CNC2CN(c3ccncn3)C2)ccc1N1CCOCC1 865748801 CZLSLMHZVCFOJQ-UHFFFAOYSA-N 343.406 1.431 10 10 EDCE O=S(=O)(c1cnn(C2CCOCC2)c1)N1Cc2cccc(O)c2C1 867690193 CFDYEDYRNYKPPJ-UHFFFAOYSA-N 349.412 1.645 10 10 EDCE Nc1ccc(NC(=O)N2CCN(CCc3cnccn3)CC2)cc1 868163127 MVFIAKHJURCKMD-UHFFFAOYSA-N 326.404 1.451 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(c2cn[nH]c2)CC1 1119000385 HWWFLADSSSWBNU-UHFFFAOYSA-N 340.383 1.364 10 10 EDCE COC(=O)N1C[C@H]2C=C[C@H]1[C@H](C(=O)N1Cc3cccc(O)c3C1)C2 871206263 XPUCCGKARHVDGY-LNSITVRQSA-N 328.368 1.877 10 10 EDCE COC(=O)c1cc(O)ccc1NS(=O)(=O)c1cnc2n1CCC2 783532684 MSVCMNVMVXZNMR-UHFFFAOYSA-N 337.357 1.122 10 10 EDCE COC(=O)c1c(CNC[C@@]2(O)CCN(C)C2)c2cc(F)ccc2n1C 894469656 OUMZIPMCAXLUSE-SFHVURJKSA-N 349.406 1.260 10 10 EDCE C[C@@H](NCc1ccc(N2CCC(O)CC2)cc1)c1nnc(O)n1C 895171949 NGERZEOSVSQGKY-GFCCVEGCSA-N 331.420 1.333 10 10 EDCE COc1ccc(N2CCC(NC(=O)C[C@H]3CCC(=O)NC3)CC2)cc1 1136546466 JOSLFELSPNEGFQ-CQSZACIVSA-N 345.443 1.697 10 10 EDCE CN1C(=O)C(=Cc2ccnn2-c2ccc(F)cc2)C(=O)N(C)C1=O 794864898 GMYOOTIRDQINSI-UHFFFAOYSA-N 328.303 1.445 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1(n2cccn2)CC1 1334178005 XGMYXXHDQCQVKE-UHFFFAOYSA-N 344.390 1.664 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CNCc2ccc(O)cc2O)C1 1251452784 DJQKKNDNQAEDGK-KRWDZBQOSA-N 338.404 1.559 10 10 EDCE CCOCCNC[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1267069814 DXAFHFUIZUHDTK-CYBMUJFWSA-N 347.419 1.937 10 10 EDCE COc1ccc(CNC[C@H]2C[C@H](NC(=O)[C@@H](C)NC(C)=O)C2)cc1C 1506875854 NKKXANJKPCFIKB-KBRIMQKVSA-N 347.459 1.513 10 10 EDCE CO[C@H](C)C(=O)NC[C@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1505632116 FEQLPKSLRVRNJL-ZWNOBZJWSA-N 347.375 1.215 10 10 EDCE CCC(=O)NC[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1290010756 LEKSLVPIJDXRSZ-GSJFWJNXSA-N 331.376 1.884 10 10 EDCE CC[C@@H](CNC(=O)Cc1cnc[nH]1)NCc1ccc(OC)c(C)c1 1714107901 VWQSZTSVPGOWKD-HNNXBMFYSA-N 330.432 1.954 10 10 EDCE CS(=O)(=O)Nc1ccc(NC(=O)c2c(F)ccc(O)c2O)cc1 1558904133 KYASZXYSIGOUOJ-UHFFFAOYSA-N 340.332 1.861 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)C2=COCCO2)cc1C 1569178838 UKWKNAVRUIMZNR-UHFFFAOYSA-N 334.416 1.830 10 10 EDCE CCCOCC(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1494780136 DLCFJJXCQGERGO-NSHDSACASA-N 349.391 1.510 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H](F)C(C)C)cc1C 1568574229 BXIQGBMNFXXVBV-GOEBONIOSA-N 326.412 1.564 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](C(=O)N3CCCC3)C2)cc1 1569885048 HZKQFTAHQWHPAL-CYBMUJFWSA-N 343.387 1.934 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2nonc2C)C2CC2)cc1C 1566731920 KNZVVVSNXGCCAW-OAHLLOKOSA-N 344.415 1.993 10 10 EDCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc[n+]1[O-] 1642297855 UNVLGRHCFZGVOQ-UHFFFAOYSA-N 349.337 1.365 10 10 EDCE O=C1C[C@@H](Oc2ccc(NC(=O)c3c(F)ccc(O)c3O)cc2)N1 1654568347 MJJQQICIJMRRRU-CYBMUJFWSA-N 332.287 1.714 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cnnc(O)c2)cc1C 1668872168 GDRRPHHDAZGDGZ-ARJAWSKDSA-N 342.399 1.575 10 10 EDCE Nc1ccc(COC[C@H](O)CN2C(=O)c3ccccc3C2=O)cc1 1905313392 DTJGSHXYHOKFPJ-CQSZACIVSA-N 326.352 1.443 10 10 EDCE C[C@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)NCCCN=[N+]=[N-] 1985101616 VFWBUDCFYLJWKC-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCN(CC(=O)NCCCCN=[N+]=[N-])C1 2010393877 YPMSENHLFMZSDU-GFCCVEGCSA-N 340.428 1.792 10 10 EDCE COC1(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])CN(C(=O)OC(C)(C)C)C1 2010405536 ZKFHJQWWSJDFBG-LLVKDONJSA-N 339.396 1.924 10 10 EDCE CCNCc1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2160713380 CMBSDFZGKYEOTE-AQNFWKISSA-N 341.249 1.489 10 10 EDCE CS(=O)(=O)N[C@@H]1CCN(Cc2ccc(Br)cc2O)C1 703136798 FERXSFYMMKRUNX-LLVKDONJSA-N 349.250 1.278 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCN(C(=O)CC(C)C)CC3)c2n1 2062659671 XCMTZWLVNVCDHB-UHFFFAOYSA-N 345.403 1.074 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H](N4CCCCC4)C3)c2n1 2064191900 PGTPDICPZJYGCY-CQSZACIVSA-N 343.431 1.834 10 10 EDCE CC(C)(C)OC(=O)N1CC(n2cnc(C(=O)NCCN=[N+]=[N-])c2)C1 2213270946 LNECKXRBJSJXLM-UHFFFAOYSA-N 335.368 1.715 10 10 EDCE NCc1ccc(N2CCc3c(O)ncnc3C2)c(Br)c1 2206105713 BOSROTWJMUKLNY-UHFFFAOYSA-N 335.205 1.966 10 10 EDCE COc1ccc(Br)c(CNc2ccnn(C)c2=O)c1O 2236057051 YYQQISFYJZNTDY-UHFFFAOYSA-N 340.177 1.869 10 10 EDCE OC[C@]1(O)CCN(c2ccc(OCc3ccccc3)cc2)C[C@H]1O 2299509677 AZPWYHPZUPYEDQ-RTBURBONSA-N 329.396 1.560 10 10 EDCE COc1ccc(Br)c(CNN(C)S(C)(=O)=O)c1O 2317499065 KXAOQFNPMRKPMY-UHFFFAOYSA-N 339.211 1.059 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3CS(=O)(=O)[C@H]3C2)cc1Br 2336471289 QKVQQCHMODZSRZ-RVBZMBCESA-N 345.262 1.702 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N[C@@H]2CCC(=O)N(C)C2)cc1 172357397 UTUCZNSEDUQDAR-OAHLLOKOSA-N 332.448 1.953 10 10 EDCE Cc1nccc(N2CCN(Cc3cc4c(cc3O)OCO4)CC2)n1 184108855 CYHLGOJENSSLPT-UHFFFAOYSA-N 328.372 1.542 10 10 EDCE Cc1cc(C(=O)CN2C[C@@H](O)C[C@H]2CO)c(C)n1-c1ccc(F)cc1 186511963 XNDSVYXQCNUIQY-IRXDYDNUSA-N 346.402 1.843 10 10 EDCE CC(C)C[C@@H](NC(N)=O)C(=O)NCc1ccc(N2CCCC2)cc1 73955063 PWHAXDGCMPZUAK-MRXNPFEDSA-N 332.448 1.986 10 10 EDCE C[C@@H](c1cc(Br)ccc1O)N1CCS(=O)(=O)CC1 132277573 DANUXFJBTAIFFR-VIFPVBQESA-N 334.235 1.946 10 10 EDCE CCn1nccc1N1CCC[C@H](NCc2cccc(OC)c2O)C1=O 191638032 XPQYDLPRDICKCT-AWEZNQCLSA-N 344.415 1.902 10 10 EDCE Cc1ncn(Cc2ccc(N)cc2)c(=O)c1I 90769917 YXCJIKPFHWHWSA-UHFFFAOYSA-N 341.152 1.787 10 10 EDCE NC(=O)N[C@@H]1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 270723340 XCCKFDAOXSVMGC-CQSZACIVSA-N 329.404 1.015 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](C)N2CC(N)C2)c(O)c1Br 2381131709 RHANPJSBFMROMN-SECBINFHSA-N 342.237 1.111 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CNC[C@H](O)C2)c(O)c1Br 2381147063 OQYJPCRBNZWOAL-GHMZBOCLSA-N 343.221 1.050 10 10 EDCE O=C1CC[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN1 815063215 XFJDBGDXPMFNTN-AWEZNQCLSA-N 349.406 1.195 10 10 EDCE COC[C@@H]1CCN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 814363454 MBKNNDXPDCWPTD-AWEZNQCLSA-N 337.395 1.593 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC[C@@H](O)C(F)(F)F)cc2)C1 818967880 DMMKQLATHYASTF-TZMCWYRMSA-N 345.365 1.401 10 10 EDCE Cc1cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cnn1 837711315 ZLCSXWXPLOXWIZ-UHFFFAOYSA-N 348.353 1.830 10 10 EDCE CC[C@H]1[C@H](CO)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1 837818061 XYKHUIQCEDKWMH-WMZOPIPTSA-N 347.459 1.826 10 10 EDCE Cc1cc(CC(=O)N[C@@]2(CO)CCOC2)c(C)n1-c1ccccc1 832149159 SWBSBPWGNVAZRL-LJQANCHMSA-N 328.412 1.904 10 10 EDCE C[C@H]1CN(CCCNC(=O)NCc2c(O)cccc2F)C[C@@H](C)O1 913987840 CFHPQSGQUXZWOP-BETUJISGSA-N 339.411 1.830 10 10 EDCE COc1cccc([C@@H](C)NC[C@H]2CCCCN2S(C)(=O)=O)c1O 846173650 UNSHBSQDLOURHY-CHWSQXEVSA-N 342.461 1.866 10 10 EDCE CCOC(=O)c1cnc(NC(=O)NCc2ccc(OC)cc2O)n1C 841708989 UPRJKVDMPZSKME-UHFFFAOYSA-N 348.359 1.633 10 10 EDCE Fc1cc(CN2CCNC[C@@H]2C(F)F)ccc1N1CCOCC1 843124971 SPYGHOINJOALSP-OAHLLOKOSA-N 329.366 1.701 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCCCNC2)cc1 842206153 BFSLJRVDPFMKAB-INIZCTEOSA-N 346.475 1.407 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC(N3CC[C@@H](O)C3)CC2)cc1 853244196 GUNKOZNADLIKLQ-GOSISDBHSA-N 346.475 1.493 10 10 EDCE CCCn1cc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)nn1 855234100 SCYVJZIQKJSJOS-CYBMUJFWSA-N 329.404 1.705 10 10 EDCE COCCCOc1ccccc1NC[C@H](O)CC1(O)CCOCC1 872211109 WQERIQJOLZUQCI-OAHLLOKOSA-N 339.432 1.806 10 10 EDCE CC1(C)[C@H](O)C[C@@]1(CO)NCc1cccc(Br)c1O 1879557868 FEMSJMFYIQLNDX-RISCZKNCSA-N 330.222 1.766 10 10 EDCE COc1cccc(CNC(=O)[C@@H]2CC(c3ccccn3)=NO2)c1O 1137473645 QBQBZWJMYZRECU-HNNXBMFYSA-N 327.340 1.605 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC3CCC3)C2)cc1 1327892652 NGNWOPGGPOOWOS-CQSZACIVSA-N 331.416 1.306 10 10 EDCE COc1ccc(N2CCC(NC(=O)c3cnn(C)c3OC)CC2)cc1 1331344617 DKSOLKZOXDSDDN-UHFFFAOYSA-N 344.415 1.836 10 10 EDCE CCN(C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)[C@@H]1CCCOC1 1332787901 GWQSIADZTUICCU-RHSMWYFYSA-N 347.459 1.957 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CC[C@@H](O)C(F)(F)C3)ccc21 1333723893 ZYNNLKWHRZTUCL-OAHLLOKOSA-N 339.386 1.981 10 10 EDCE O=S1(=O)C[C@H]2[C@@H](CNCc3c(O)cccc3Br)[C@H]2C1 2117988823 QXIOLUUXQHPBDW-GUDFOSOFSA-N 346.246 1.535 10 10 EDCE CC(C)[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cccc(O)c1O 1628785625 VYUHBQZEHVZOMX-PWSUYJOCSA-N 338.429 1.774 10 10 EDCE C/C=C(/C)C(=O)N[C@@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1483218150 PTIJPNLIJKOVMA-XLVZXTRVSA-N 344.419 1.231 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CCNC(=O)C2)cc1C 1482271908 HGRYMAYZTLOHPP-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE C[C@H](NC(=O)c1ccco1)C(=O)NCc1ccc2cccnc2c1O 1557124115 WFVJDCNUMBSXMC-NSHDSACASA-N 339.351 1.968 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cnn(C)c2)cc1C 1497522724 MIJWEDLYIFFBTI-SNAWJCMRSA-N 328.416 1.813 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CC[C@H](Oc2cnccn2)CC1 1636563621 GDAAXBZMXVFPIC-HDJSIYSDSA-N 343.383 1.937 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1C[C@H]1C(=O)OC 1568727781 ABKQWTPFOWOUPR-JKSUJKDBSA-N 348.443 1.751 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H]2CN3CCC2CC3)cc1C 1569058675 PJBYFHCYXQLICP-YJBOKZPZSA-N 345.487 1.940 10 10 EDCE CC(=O)N/C(=C\c1cccs1)C(=O)NCc1cccc(O)c1O 1643812409 ITAPDBAKITUXAZ-JYRVWZFOSA-N 332.381 1.953 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cccnn2)cc1C 1669101201 HBWNNHZMXDNIEM-ARJAWSKDSA-N 326.400 1.869 10 10 EDCE Cc1cc(=O)c(OCC(=O)c2ccc(O)c(O)c2)cn1CCCO 1857915295 PGZKOHCRWITJJC-UHFFFAOYSA-N 333.340 1.212 10 10 EDCE C[C@@H](NC[C@@H](CO)NC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985852803 HBXCMEOQRKHBEC-MNOVXSKESA-N 326.393 1.634 10 10 EDCE CC1(C)CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)[C@@H]1CO 2148961448 DPLAPDNUCDDALW-NEPJUHHUSA-N 341.205 1.642 10 10 EDCE CO[C@@H]1C[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 2010394171 BAJFXMOSDZHDMV-ZYHUDNBSSA-N 339.396 1.780 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010393785 XPECKAKEIPGZAM-NWDGAFQWSA-N 341.412 1.954 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@@H](CO)CNC(=O)OC(C)(C)C 2014472247 FZERBZRBOACOMW-CYBMUJFWSA-N 338.404 1.484 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)NCCCN=[N+]=[N-])O2)C1 2025154864 AQWHPXYWMMZEFD-NSHDSACASA-N 339.396 1.972 10 10 EDCE CNCc1ccc(N2C[C@@H](OC)C[C@H]2CO)c(Br)c1 311562626 SIZMUZWGFVLLKQ-RYUDHWBXSA-N 329.238 1.755 10 10 EDCE CC[C@@H](CO)N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 379127562 ZHKBFXFBKNQZQR-MADCSZMMSA-N 328.210 1.608 10 10 EDCE CCCNCc1ccc(N2CC(NC(N)=O)C2)c(Br)c1 2163216533 MVVZCIRDYHDXIG-UHFFFAOYSA-N 341.253 1.806 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@H]2O 2174414779 ZSDARITZVXUPPP-RWDPWNMBSA-N 342.233 1.622 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)c(Br)c1 2178085176 CXGPSLOCZFIQAO-BTABJRDXSA-N 341.249 1.912 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213586279 ABSHRHKSYDFOGK-YFKTTZPYSA-N 339.396 1.704 10 10 EDCE COC[C@@H]1[C@@H](O)[C@@H](O)CN1c1ccc([C@H](C)O)cc1Br 2233867578 ZSKXPSZEDBDLNX-ZLCVWYCYSA-N 346.221 1.059 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1CCC[C@@H](O)[C@@H]1O 2224348773 NMHJCHQDVOAEBY-NQBHXWOUSA-N 334.185 1.658 10 10 EDCE CSc1ncc(CNc2cccc(S(N)(=O)=O)c2N)s1 2284696909 DNLOWLQSHZQJOQ-UHFFFAOYSA-N 330.460 1.707 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2OCC[C@@]2(C(=O)NCCN=[N+]=[N-])C1 2246329573 AASFTGCTWVIRHR-QMTHXVAHSA-N 325.369 1.439 10 10 EDCE O=C(O)CN(Cc1c(O)cccc1Br)[C@@H]1CCOC1 2272418095 DYRGYSQJNMFYPG-SECBINFHSA-N 330.178 1.830 10 10 EDCE CCOc1ccc(N2C(=O)NC(=O)C(=CN[C@@H](C)CC)C2=O)cc1 2297315549 QJCKRIIEHFPPAD-NSHDSACASA-N 331.372 1.940 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2C[C@H](O)Cc3ccccc32)c1 493237948 JQFNWQKLCPEDSW-FYCOFBDGSA-N 337.379 1.405 10 10 EDCE CCCN1C(=O)/C(=C\N(CC)[C@@H]2CCS(=O)(=O)C2)SC1=S 102676219 FFIMSQJSMHTEDD-MXBGMFSPSA-N 348.515 1.607 10 10 EDCE CN(C[C@@]1(O)CCOC1)c1ccc(CN)c(Br)c1F 2129437438 RHBPJTXWDSFVKR-ZDUSSCGKSA-N 333.201 1.635 10 10 EDCE O=C1N[C@@H](c2cc(O)cc(Br)c2O)N2CCCC[C@@H]12 124872365 LXXGFQKFIWPVAN-CMPLNLGQSA-N 327.178 1.843 10 10 EDCE CN1CCN(c2cc(C(=O)NCc3ccc(O)c(O)c3)ccn2)CC1 182543427 KXVQXBGIUUYQHQ-UHFFFAOYSA-N 342.399 1.175 10 10 EDCE COC(=O)[C@@H]1C[C@H](OC)CN1Cc1cccc(Br)c1O 125807231 ZEDNMIGLCRQCRM-JQWIXIFHSA-N 344.205 1.917 10 10 EDCE Cn1cc(N2CCC[C@@H](NC(=O)/C=C/c3ccc(O)c(O)c3)C2)cn1 181122720 VSYGIYIHNCJDIF-HZRUHFOJSA-N 342.399 1.630 10 10 EDCE COc1ccc(N2CCN(C(=O)CNCc3cccnc3)CC2)cc1 243834855 RAWQTNZHYVTOPQ-UHFFFAOYSA-N 340.427 1.529 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@@H]3O 249359951 AEYJZMODNUBIRZ-NXJYUQPGSA-N 339.439 1.974 10 10 EDCE CCCN1C(=O)/C(=C\N(CC)[C@H]2CCS(=O)(=O)C2)SC1=S 254413928 FFIMSQJSMHTEDD-NGPGYTDTSA-N 348.515 1.607 10 10 EDCE COCCNC(=O)CN(C)c1cc(Br)c(CN)cc1F 380360584 IFHMADYBARWBJK-UHFFFAOYSA-N 348.216 1.246 10 10 EDCE O=C1NN(c2ccccc2)C(=O)/C1=C/c1ccc(-n2cncn2)cc1 728699357 SJGMJURAPURDQX-MHWRWJLKSA-N 331.335 1.729 10 10 EDCE O=S1(=O)C[C@@H](CNCc2cc3c(cc2O)OCO3)c2ccccc21 824517467 WAOISNLWOACLLD-GFCCVEGCSA-N 347.392 1.782 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc3nccn3c2)c1 738540286 IMKADUUXUGCVJL-UHFFFAOYSA-N 346.368 1.664 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@@H]2C[C@H]1C[S@@]2=O 844887500 HMCHDSOFBSBXTA-KXNSMUHISA-N 333.457 1.702 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2CNCCC2(F)F)c1 842003662 ODLLYNHBTWCSGO-ZANVPECISA-N 329.347 1.758 10 10 EDCE COC1CCN(c2ccc(CN3CCN4C[C@H](O)C[C@H]4C3)cc2)CC1 847049415 PSOICXHITZBAIL-RBUKOAKNSA-N 345.487 1.553 10 10 EDCE CCO[C@H](CNC(=O)NCc1ccc(N(C)C)c(F)c1)CN(C)C 915365220 CDGCPVMEDQSWIX-CQSZACIVSA-N 340.443 1.658 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCC1(COC)CC1 848633302 IRUZESWNONCDLE-UHFFFAOYSA-N 334.416 1.674 10 10 EDCE C[C@@H]1C[C@H]1N1C[C@H](NC(=O)NCc2ccc(N(C)C)cc2)CC1=O 743813791 HKMUGHMEOZNEDO-XNRPHZJLSA-N 330.432 1.561 10 10 EDCE COC(=O)CCNC(=O)CCN[C@H](C)c1cc2c(cc1O)CCCC2 858541579 LYLXPLFOZBAGBN-CYBMUJFWSA-N 348.443 1.991 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(F)(F)C3(O)CCC3)C2)cc1 855234360 YAWSPSUJQAFXCU-LBPRGKRZSA-N 340.370 1.940 10 10 EDCE O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1cc(O)cs1 855404498 WAXXGJWMMDDKIX-AWEZNQCLSA-N 332.425 1.950 10 10 EDCE CN1CCN(c2ccc(CN3CCO[C@]4(CCOC4)C3)cc2F)CC1 1116648923 PPJRCYQEVCQYOT-LJQANCHMSA-N 349.450 1.569 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCC(=O)O3)CC2)c(OC)c1 870166500 PVILKQXXKLZIPG-CQSZACIVSA-N 334.372 1.058 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1CCOC[C@H]1C)c1ccc(N(C)C)cc1 1117508708 IXWKDIAOWTUDGB-DVOMOZLQSA-N 333.432 1.471 10 10 EDCE CN(CCc1cnccn1)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 771259372 UQRXNLNVEZZTJM-UHFFFAOYSA-N 329.316 1.395 10 10 EDCE C[C@]1(O)CCN(c2ccc(CN)c(Br)c2)C[C@]1(C)O 1880698321 NJCWJGFKECSFJB-KBPBESRZSA-N 329.238 1.620 10 10 EDCE COc1ccc(Br)c(CNC[C@@]2(O)CCO[C@@H]2C)c1O 1964064081 GLLGGQUOEAZDAM-OTYXRUKQSA-N 346.221 1.793 10 10 EDCE CCN(CC)c1ccc([C@@H]2NC(=S)NC(C(=O)O)=C2OC)cc1 76260617 ZYLMQIANAJSHGG-LBPRGKRZSA-N 335.429 1.994 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)Cc1ccn(C)n1 1320733845 CEBPPAGIOBGXFH-UHFFFAOYSA-N 344.459 1.918 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCCC[C@@H]2CNCCO)cc1 1275816958 OHSKDNHXUFHAKM-UKRRQHHQSA-N 347.419 1.720 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)[C@@H]2CCC(=O)N2)cc1C 1506945822 HLLUFSGNFJATOH-ZBFHGGJFSA-N 347.459 1.657 10 10 EDCE CC/C(C)=C/C(=O)N1CC[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1283340159 CVQHPBRTZXEMIY-CEFACKQISA-N 347.415 1.786 10 10 EDCE COC(=O)[C@]1(NC(=O)c2cc3cc(O)c(O)cc3s2)CCOC1 1545388898 ZYKCXVNUXXLOBK-HNNXBMFYSA-N 337.353 1.374 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H]2CNC(=O)CCCF)cc1 1705230636 MPIRBDDCFLBJEA-ZDUSSCGKSA-N 349.366 1.929 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)Cc2[nH]cnc2C)cc1C 1714294667 ACVAFMQDGXAOFT-ZDUSSCGKSA-N 330.432 1.872 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC(Cn3cnnc3)CC2)cc1 1557378893 BBUHLQFLIWNLIL-UHFFFAOYSA-N 341.375 1.993 10 10 EDCE Cc1nn(CC(=O)NCc2c(O)ccc3ccccc23)c(=O)n1C 1635968507 CITIJNNAXQXJGK-UHFFFAOYSA-N 326.356 1.065 10 10 EDCE COC(=O)c1cnn(CC(=O)NCc2ccc3cccnc3c2O)c1 1630533244 ZSERUHHJYUBTGJ-UHFFFAOYSA-N 340.339 1.240 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ncccc1N 1630480510 BHMHMOYKTYERAZ-UHFFFAOYSA-N 329.356 1.575 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H]2CC[C@@H]2C(N)=O)cc1C 1493654467 BSZMCZIBNMIWEO-GJZGRUSLSA-N 333.432 1.063 10 10 EDCE COc1ccc(CNC(=O)c2nn(-c3cccnc3)nc2C)c(O)c1 1568097299 DGQUPYVMDBPUOI-UHFFFAOYSA-N 339.355 1.615 10 10 EDCE CCn1nc(C)c(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)n1 1567617425 PYEZHYBZABXKKF-UHFFFAOYSA-N 345.447 1.785 10 10 EDCE CS[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1569753643 VHJVFCIHEZSOPJ-SNVBAGLBSA-N 330.431 1.341 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cn(C)ccc2=O)cc1C 1569006160 SOGOZWKBLBKXRT-CQSZACIVSA-N 343.427 1.610 10 10 EDCE O=C(CCc1nc(O)c2ccccc2n1)NCc1cc(O)ccc1O 1643879289 JPNLOUMXIMEQAV-UHFFFAOYSA-N 339.351 1.996 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC[C@@H](O)COCc1ccccc1 1642761124 FPTGPFXMTCOQGO-MRXNPFEDSA-N 345.395 1.724 10 10 EDCE CCC(=O)NCC(=O)N[C@@H](C)[C@@H](C)NCc1ccc(OC)c(C)c1 1674639770 ITBZQGPUMCKJSZ-KGLIPLIRSA-N 335.448 1.513 10 10 EDCE CC1(CC(=O)NC2CN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)CC1 1688627182 CWRANNZBEPUUIG-UHFFFAOYSA-N 343.387 1.980 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H](O)CNCC2CCC2)cc1 1699071826 AZINPFCVOVZPBT-CQSZACIVSA-N 333.392 1.329 10 10 EDCE C[C@H](CNCc1ncccn1)NC(=O)c1ccc(N=NC(N)=O)cc1 1699391465 NLOWKASVSCRBKP-LLVKDONJSA-N 341.375 1.547 10 10 EDCE Oc1cc2c(cc1CN1CCC(Nc3cccnn3)CC1)OCO2 156478896 SCMWUIQGQXFRMX-UHFFFAOYSA-N 328.372 1.987 10 10 EDCE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@H]3C[C@H](O)CN3)cccc21 1866040636 SWSHWCUIASIVJC-ZUZCIYMTSA-N 336.347 1.123 10 10 EDCE Nc1ccc(OCCN2CCC(NC(=O)[C@H]3CCCO3)CC2)cc1 586044786 MKRNIYRQVFFINU-QGZVFWFLSA-N 333.432 1.407 10 10 EDCE C[C@H]1CCN1C(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1119960991 HDSBDVTWIMGFFF-XJKSGUPXSA-N 332.448 1.092 10 10 EDCE CN(C)c1ccc(CNCCC(=O)N2CCC[C@@H](C(=O)O)C2)cc1 1857863040 OKXLSPGZMKZQSB-OAHLLOKOSA-N 333.432 1.556 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985104402 IEHNHYAWPMRTHO-HBNTYKKESA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNC(=O)c1cccc(O)c1O 2010537173 NWXMDFNFBNXNKK-MRXNPFEDSA-N 340.376 1.103 10 10 EDCE CN1CCC(NCc2ccc(Br)cc2O)(C(N)=O)CC1 2154496646 FLHWPYCABVUCLP-UHFFFAOYSA-N 342.237 1.194 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCC1(CN=[N+]=[N-])CC1)C(C)(C)O 2014483445 SHCCUUIXRPWDOP-SNVBAGLBSA-N 341.412 1.857 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@]2(C1)C(=O)NCCN2CCN=[N+]=[N-] 2018432651 JGXYAYKDPZMLIG-HNNXBMFYSA-N 338.412 1.498 10 10 EDCE Cc1cc(Br)cc(CN2CC[C@]3(CNC(=O)N3)C2)c1O 2177680121 JSOWMLRYQIVKRK-AWEZNQCLSA-N 340.221 1.720 10 10 EDCE CS(=O)(=O)c1cnn(Cc2cccc(Br)c2O)c1N 2070217150 LPGZYCAOAINMOA-UHFFFAOYSA-N 346.206 1.385 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4[C@H](CO)[C@@H]4C3)c(Br)cc2[C@@H]1O 2182047540 HDYYRNLLETVYAJ-ZZIUEJKTSA-N 339.189 1.109 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)cc1Br 2182543941 VIZPGOOEQALJKI-HZZFPTLFSA-N 345.212 1.225 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H]2CN3C(N)=O)cc1Br 2192283657 PITKGXRZTHNNNT-INTQDDNPSA-N 340.221 1.844 10 10 EDCE CN(C)C(=O)[C@H]1CCN(c2ccc(CN)cc2Br)C1 2087394884 BQRFJANIFZTILO-NSHDSACASA-N 326.238 1.822 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](CO)C[C@@H]2CO)c(Br)c1 2089863106 HCSGPJONNQDXIF-HOSYDEDBSA-N 330.222 1.682 10 10 EDCE Nc1cc(NS(=O)(=O)N2CC(OCc3ccccc3)C2)ccc1O 2214990509 KTGLHXMGWHLXSG-UHFFFAOYSA-N 349.412 1.532 10 10 EDCE Cn1nc(Br)c(CNCc2cc3c(cc2O)OCO3)n1 2235253146 VSJMMVZYEKBELZ-UHFFFAOYSA-N 341.165 1.302 10 10 EDCE N[C@@H](Cc1ccc(Br)cc1)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2237416150 NLXXWIMACYCQLZ-DRZSPHRISA-N 339.233 1.585 10 10 EDCE COc1ccc(Br)c(CN[C@@H](C(N)=O)C2CC2)c1O 2227747487 AWDWMGORYHBSDX-LLVKDONJSA-N 329.194 1.517 10 10 EDCE COc1ccc(Br)c(CNCc2nnc(O)o2)c1O 2227749082 DQKCSDLFLGXOBF-UHFFFAOYSA-N 330.138 1.542 10 10 EDCE CSc1ncc(CNC(=O)[C@H]2CNC[C@@H]2C(F)(F)F)s1 2284638150 FTYMNIUGTOXDTQ-YUMQZZPRSA-N 325.381 1.879 10 10 EDCE O=C(Nc1cnncc1Br)c1cc(O)c(O)c(O)c1 2278737045 HFCMEEDFWZWSKH-UHFFFAOYSA-N 326.106 1.608 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CC=CCN2)c(O)c1Br 2352640814 MVSMWBMBCNQZRE-LLVKDONJSA-N 325.206 1.997 10 10 EDCE CN1C(=O)N=C(O)/C(=C2/C[C@H](c3ccc(N(C)C)cc3)NN2)C1=O 102697251 MYCIBIURGYRFNH-GXZRWPEMSA-N 329.360 1.094 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCC[C@@H](O)[C@H]2O)c1O 2358678047 FCQXMJSIBJKSRC-WDMOLILDSA-N 346.221 1.527 10 10 EDCE OC[C@H](Cc1ccc(O)cc1)NCc1ccc(N2CCOCC2)cc1 190513231 WKOKYVVGBDGVDO-SFHVURJKSA-N 342.439 1.922 10 10 EDCE COc1cc(I)cc([C@H](N)CC(=O)O)c1O 44217080 BUUVJVKBUULKAT-SSDOTTSWSA-N 337.113 1.480 10 10 EDCE CC(=O)N(C(=O)NCCN1C(=O)CSC1=O)c1ccc(N)cc1 244414799 YQCSPQUXWPEFGV-UHFFFAOYSA-N 336.373 1.027 10 10 EDCE CCCn1[nH]ccc1=NC(=O)CN(C)c1ccc(OC)cc1OC 255460699 XKKQHMHDEUESHE-UHFFFAOYSA-N 332.404 1.807 10 10 EDCE Cc1ccc(CN(C)[C@]2(C(=O)O)CN[C@@H]2C)c(O)c1Br 2380765470 MNJLXBSSVNWCKO-YMTOWFKASA-N 343.221 1.710 10 10 EDCE Cc1ccc(CN2CCC[C@](O)(C(=O)O)C2)c(O)c1Br 2380813200 DNWYLMWODNMBPM-CQSZACIVSA-N 344.205 1.875 10 10 EDCE CNCc1ccc(N2CC=C[C@@]2(CO)COC)c(Br)c1 2379804460 CRKTYTSTVSACRN-OAHLLOKOSA-N 341.249 1.922 10 10 EDCE COc1cc(I)cc([C@H]2COCCN2)c1O 380631511 FRHMNCDYUDVKQE-SECBINFHSA-N 335.141 1.666 10 10 EDCE CCN1CCO[C@@H](C(=O)NCc2cc(Br)ccc2O)C1 804737851 REYUIGORRMTVBM-CYBMUJFWSA-N 343.221 1.492 10 10 EDCE O=C(NCc1cccnn1)NCc1cc(Br)ccc1O 805366224 RDMJNKXFHFJKDV-UHFFFAOYSA-N 337.177 1.944 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H](CO)C1CCC1 823519831 OUFHZUGBAWQOED-GOSISDBHSA-N 347.459 1.608 10 10 EDCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1n[nH]cc1F 909857544 WCKZULIRWQUFLD-UHFFFAOYSA-N 340.305 1.594 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@@H](C3CCC3)C2)cc1 839622354 CBXYHHJTUSYWRK-GOSISDBHSA-N 331.460 1.870 10 10 EDCE CC(C)n1cnc(NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)n1 845814794 NRWNKHTUYOSRKF-UHFFFAOYSA-N 344.419 1.522 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CNCC[C@@H]1C 842267288 XKHPJAGXZLXZJH-WMLDXEAASA-N 346.475 1.215 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CO[C@H]3CCCNC3)C2)cc1 852900652 OOSYFYWKSCUUKH-PBHICJAKSA-N 333.432 1.159 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CC=CCC3)C2)cc1 1118621077 SYSKJEZYGASYFZ-GJZGRUSLSA-N 343.427 1.615 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN(Cc3cn[nH]c3)CC2)cc1 1142589714 POULBUUHKMQXJB-UHFFFAOYSA-N 341.375 1.530 10 10 EDCE CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1cccc(O)c1O 1347233672 JHAKWWZAYGUKNJ-MRXNPFEDSA-N 340.379 1.687 10 10 EDCE COc1cncc(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)n1 1266854562 UCLQXSFZAAPDQT-UHFFFAOYSA-N 344.415 1.664 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2CC3(C2)CC3(F)F)c1 1347998853 FWQUILVAPCZPLD-UHFFFAOYSA-N 346.355 1.681 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H]2CCC(=O)NC2)cc1C 1266950683 WABAWSFKMDABDZ-ZFWWWQNUSA-N 333.432 1.124 10 10 EDCE CNCc1ccc(N2C[C@@H]3NC(=O)O[C@H]3C2)c(Br)c1 2120408326 XOMZNJRDLLCGKO-JQWIXIFHSA-N 326.194 1.466 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3NC(=O)O[C@@H]3C2)c(Br)c1 2120405834 NVYPCSUYCIWANM-VIRWGQHYSA-N 326.194 1.766 10 10 EDCE CCN1CCN(CCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1713078883 IDAWLBWRIWVCET-UHFFFAOYSA-N 332.408 1.216 10 10 EDCE COc1ccc(N2CCC(NC(=O)/C=C/C(=O)N(C)C)CC2)cc1 1626479171 DKQXVMBWZYMBKI-CMDGGOBGSA-N 331.416 1.425 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@H]2CCCNC2=O)cc1C 1716307780 XJHRYUUORPRHIE-QDLOVBKTSA-N 345.443 1.292 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1cn(C)cn1 1715728534 ZWUVOZIXAMIGNO-UHFFFAOYSA-N 330.432 1.989 10 10 EDCE CCNC(=O)CC(=O)N1CCC[C@H]1CNCc1ccc(OC)c(C)c1 1716776298 YVVBKGYAGDYJMM-INIZCTEOSA-N 347.459 1.610 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1CN(C)C(=O)N1)NCc1ccc(OC)c(C)c1 1495035919 DGPDXWXESKTQPG-CABCVRRESA-N 348.447 1.012 10 10 EDCE Cc1ncccc1/C=C\C(=O)N1CCc2ccc(S(N)(=O)=O)cc21 1633432028 YJWUMFWRTAWFKC-ALCCZGGFSA-N 343.408 1.640 10 10 EDCE O=S1(=O)CCCN1CCNCc1cccc(Br)c1O 105473289 PRAXSOCYMCSXBT-UHFFFAOYSA-N 349.250 1.280 10 10 EDCE Cc1ccn2c(=O)c(C(=O)NCc3ccc(O)cc3O)cnc2c1 1638351731 DPZYPGVGVMHEQU-UHFFFAOYSA-N 325.324 1.344 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(O)cn1 1641204532 TULMWKLRATZDSK-UHFFFAOYSA-N 327.384 1.678 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)NCCCCN=[N+]=[N-])CC(CO)C1 1964944348 PJFXHNUIYIAHRB-UHFFFAOYSA-N 341.412 1.859 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@]2(C)CCNC2=O)cc1C 1670245919 JHCYUSKHQXMORK-IBGZPJMESA-N 347.459 1.468 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)C(C)(C)NC(C)=O)cc1C 1674743244 ZQJFLVYBSJTNAN-KBPBESRZSA-N 349.475 1.901 10 10 EDCE CCC(=O)NCC(=O)N[C@@H](C)[C@H](C)NCc1ccc(OC)c(C)c1 1674639769 ITBZQGPUMCKJSZ-KBPBESRZSA-N 335.448 1.513 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)Cc2nc[nH]n2)cc1C 1690874752 RHBFWYRFGGGLLL-CYBMUJFWSA-N 331.420 1.349 10 10 EDCE CO[C@@H]1C[C@@H](C(=O)O)N(Cc2c(O)cccc2Br)C1 2136357817 OIIJXTKDLHQKSU-KCJUWKMLSA-N 330.178 1.829 10 10 EDCE CC(C)(C)OC(=O)NCCOC[C@@](C)(O)[C@H](N)c1ccccc1O 1920089028 KNLDZQHRQSFONX-RHSMWYFYSA-N 340.420 1.684 10 10 EDCE C[C@H](O)[C@H](N)C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952234087 MWALDXSZLGOLSU-CYZMBNFOSA-N 340.420 1.632 10 10 EDCE CO[C@@H](c1cccc(O)c1O)[C@@H](NC(=O)OC(C)(C)C)C(=O)O 1952308272 JSZLPQXQSIFKCU-PWSUYJOCSA-N 327.333 1.763 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNCc1cccc(O)c1O 1985189639 DHLGIEWRHPPDDZ-MRXNPFEDSA-N 326.393 1.463 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985103648 YNENYFXJKFRURK-MWLCHTKSSA-N 327.385 1.562 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C(F)(F)C1(O)CN(C(=O)OC(C)(C)C)C1 2010392341 FNEVMTPZVAMAMQ-UHFFFAOYSA-N 349.338 1.372 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCOC[C@H]3C)c(Br)cc21 92775186 MAPBLDJVNMSDFV-OQPBUACISA-N 340.221 1.887 10 10 EDCE COc1cc(N)c(N(Cc2ccccc2)CC2(O)CNC2)cc1OC 2071587493 WIPYPYACSPOIRK-UHFFFAOYSA-N 343.427 1.627 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)cc1Br 2189048987 KHHDRGURKHHTMX-YYHMBLRTSA-N 341.249 1.912 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2060611418 SYCXTCYXMSDUFG-ZYHUDNBSSA-N 349.395 1.757 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)C[C@@H](O)C2)cc1Br 2105075165 PZUQMMLRWHDLEL-ZMLRMANQSA-N 329.238 1.661 10 10 EDCE C[C@@H](CCCCCOc1nnc(=N)[nH]n1)NC(=O)OC(C)(C)C 2210649862 NDMMPPBBJSLWTP-JTQLQIEISA-N 326.401 1.532 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@@]3(CO)C2)c(F)c1Br 2234560167 UQKLSJAYBMBSOX-HZMBPMFUSA-N 345.212 1.492 10 10 EDCE COc1ccc(Br)c(CNCC[C@@H]2COC[C@@H]2O)c1O 2236056511 VWPUPIKMMWLOTN-SKDRFNHKSA-N 346.221 1.650 10 10 EDCE CN(CC1(O)CN(C(=O)OC(C)(C)C)C1)C(=O)Cc1ccc(N)cc1 2259144130 IGOMYYOSVGMMLX-UHFFFAOYSA-N 349.431 1.252 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(O)(CCO)C2)cc1Br 2270656923 RXZKLWJLFDXPQC-JTQLQIEISA-N 329.238 1.663 10 10 EDCE Cc1ccc(CN2CC(CO)(C(=O)O)C2)c(O)c1Br 2352678869 JALFGGUYJIBXGI-UHFFFAOYSA-N 330.178 1.342 10 10 EDCE Cc1ccc(CN[C@H](C)[C@H]2CNCCO2)c(O)c1Br 2352690655 GWXDWERYSFTGNZ-ZYHUDNBSSA-N 329.238 1.930 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)N1C[C@@H](CO)OC[C@@H]1C 305135648 KTSYJUOGDAEDKV-AAEUAGOBSA-N 329.356 1.472 10 10 EDCE C[C@H]1CC[C@H](C(N)=O)CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 78490034 NWVMQPXKMVCEHJ-HOCLYGCPSA-N 346.475 1.297 10 10 EDCE CCC(=O)N1CC[C@H](C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 120750304 AUKNEVZXSKQNAT-HNNXBMFYSA-N 345.443 1.602 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)CC2)cc1 220521910 LCIHVULWYPMCSE-AWEZNQCLSA-N 340.427 1.872 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(O)c(O)c1 802784944 VCCMDJLRGZUYMO-NSHDSACASA-N 340.376 1.254 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1csc(NC(=O)c2ccccc2)n1 808497145 RTFIJCVTXODCNX-UHFFFAOYSA-N 346.364 1.639 10 10 EDCE CCn1nc(Br)c([C@@H](O)[C@H](NC)c2ccccc2O)n1 2167716978 MSYNDHFCOUPSIY-PWSUYJOCSA-N 341.209 1.760 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2C[C@H]3CC[C@H]2[C@H]2CNC[C@@H]32)c1O 903962865 LOIKYYARPCTXMA-SAXRGWBVSA-N 333.388 1.739 10 10 EDCE Cc1cc(C(=O)N2CCO[C@](C)(C(=O)O)C2)c(C)n1-c1ccccn1 910321893 AJQLAMZWJVRLBN-SFHVURJKSA-N 343.383 1.805 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@H](CO)C3)C2)cc1 854301897 FXECEUHCFBDTAD-LSDHHAIUSA-N 333.432 1.688 10 10 EDCE CN1CCN(c2ccc(CN3C(=O)N4CC5CC4(C5)C3=O)cc2)CC1 925081188 YWQGHQVKRHOYBH-UHFFFAOYSA-N 340.427 1.365 10 10 EDCE O=C(/C=C\c1ccncn1)NCc1ccc(N2CCC(O)CC2)cc1 856213061 VQZYUHAROSEEJJ-UTCJRWHESA-N 338.411 1.767 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@](C)(C(=O)OCC(=O)C(C)=O)C1 859989681 YJXMPSHAANJEMX-ZBEGNZNMSA-N 343.376 1.102 10 10 EDCE CC[C@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)CCN1CC(F)F 768466329 ZCCAZQBGSWMKGK-WFASDCNBSA-N 342.386 1.979 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CN1 861685371 NKAOUNVJJHPZKQ-WBVHZDCISA-N 346.475 1.805 10 10 EDCE O=C(CCCNC(=O)C1CC1)NCc1ccc2cccnc2c1O 862028692 HYVTVYXGHDGXHR-UHFFFAOYSA-N 327.384 1.863 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN(C)CC(C)(C)S(C)(=O)=O)c1O 774909471 NLJGKOVJIQLYEO-UHFFFAOYSA-N 346.405 1.564 10 10 EDCE O=C(CCC(=O)Nc1nnc(C2CC2)o1)NCc1ccc(O)c(O)c1 778929894 OEPYNABNZXNFBK-UHFFFAOYSA-N 346.343 1.393 10 10 EDCE COC(=O)c1c(CN2CCC[C@@H]2C(N)=O)c2cc(F)ccc2n1C 894907421 SBAMFCOLKZWRRJ-CQSZACIVSA-N 333.363 1.554 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@H](NC2CCOCC2)C1 1176478256 FUAVMLXFGQTYMR-HNNXBMFYSA-N 334.416 1.400 10 10 EDCE CCOc1ccc(N2CCN(c3nnnn3C3(C)CC3)CC2)cc1 1332988158 FMYRIUJIBSACJJ-UHFFFAOYSA-N 328.420 1.907 10 10 EDCE CN(CC(C)(C)S(C)(=O)=O)C(=O)c1ccc(N=NC(N)=O)cc1 1303264449 HWBDMGGKWZHFGJ-UHFFFAOYSA-N 340.405 1.744 10 10 EDCE O=C(COCCNC(=O)c1ccccc1)NCc1c(O)cccc1F 1156170134 HNSGJKBCNKEGPF-UHFFFAOYSA-N 346.358 1.594 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2NC(=O)Cc1ccc(O)c(O)c1 1163273765 XJRRLSLHISLIAR-BFQNTYOBSA-N 348.399 1.764 10 10 EDCE CCC(C)(C)CNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1328392260 DNTYASZKMBEDJJ-CQSZACIVSA-N 347.459 1.943 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2n[nH]c(C)c2C)cc1C 1320200246 FHTSOXBYDFDKQK-OAHLLOKOSA-N 346.431 1.224 10 10 EDCE Cn1c(C(=O)NCCc2ccc(O)c(O)c2)cc(=O)c2ccccc21 1445935950 FHWNRVFVFKFYBB-UHFFFAOYSA-N 338.363 1.922 10 10 EDCE NC(=O)[C@@H]1CC[C@H](CCC(=O)Nc2c(Cl)ccc3nonc23)O1 1520358816 GUHIZJAACDBJAB-XCBNKYQSSA-N 338.751 1.628 10 10 EDCE Cc1noc(C[C@H]2CCCN(C(=O)Cc3ccc(O)c(O)c3)C2)n1 1472147827 UVNCAEBLAKPRII-CYBMUJFWSA-N 331.372 1.813 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CCN(C)CCOC 1546421600 LNERPBWLPJPPSI-UHFFFAOYSA-N 347.463 1.761 10 10 EDCE CO[C@@H](CS(=O)(=O)Nc1ccc(O)cc1C(N)=O)C1CCCC1 1615587689 JBYDQDIAALJANX-AWEZNQCLSA-N 342.417 1.438 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N2CC[C@H](CN=[N+]=[N-])C2)n1 2121909758 HLCXHVODQDQURF-SSDOTTSWSA-N 349.214 1.504 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCc2nc[nH]n2)cc1C 1480441542 KISVUFHLFLNXGI-ZDUSSCGKSA-N 331.420 1.349 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1CNCCCO 1484384914 CYVXNIFKFXHKCK-JSGCOSHPSA-N 347.419 1.529 10 10 EDCE CO[C@H](C)CNC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1483606728 FCDLDOMQACUSMV-ABAIWWIYSA-N 347.419 1.982 10 10 EDCE CN(C)C(=O)/C=C\C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1623640015 BXMDWVQSAZYTGS-KVPUOBJLSA-N 332.400 1.544 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1nnnn1C 1556286812 ZOOVPIHCXXFVAH-UHFFFAOYSA-N 338.371 1.360 10 10 EDCE Cc1c[nH]c(CC(N)=O)c1C(=O)NCCCSc1nccs1 1632807171 PHXQEMUPWLZPBW-UHFFFAOYSA-N 338.458 1.720 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C(C)(C)F)cc(OC)n1 1737546878 BEFZYXCAFJFQPD-SECBINFHSA-N 327.356 1.081 10 10 EDCE Cn1cc(Br)c(C(=O)NCc2c(O)cccc2O)n1 1645363404 UDDHKGBDVQKESU-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE COc1c(O)nc(O)nc1C(=O)NCc1ccc2cccnc2c1O 1643283217 LOMXVFLJRIAHNT-UHFFFAOYSA-N 342.311 1.080 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@H](NC(=O)C=C(C)C)C2)cc(OC)n1 1744362379 FQBZISBMPDKWJX-JOCQHMNTSA-N 333.388 1.442 10 10 EDCE CC[C@H](CNC(=O)c1nnn(C)c1C)NCc1ccc(OC)c(C)c1 1665770095 DGFWTNYKTMNFDM-OAHLLOKOSA-N 345.447 1.739 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(C)CN(C)C1=O 1764723694 ZFVXUFZYLOKCHM-SFHVURJKSA-N 343.431 1.661 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)NCCCCN=[N+]=[N-])CC(O)C1 1964944852 QYZJDBUTXXNXDI-UHFFFAOYSA-N 341.412 1.859 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H](C)n2cncn2)cc1C 1690566742 OAKITTFRHQTYAQ-KBPBESRZSA-N 331.420 1.451 10 10 EDCE N[C@H]1CC[C@@H](C(=O)O)N(Cc2ccc(Br)cc2O)C1 2132274034 OTRZLYPXKHPLAB-QWRGUYRKSA-N 329.194 1.531 10 10 EDCE CCN(CC)c1ccc(CNCCC(=O)NCCCNC(C)=O)cc1 1857859401 NRACNUKWJBCOJS-UHFFFAOYSA-N 348.491 1.655 10 10 EDCE OC[C@H]1CN(c2ccc(CNC3CC3)cc2Br)CCO1 236501174 AXUNDFYAHONGAN-CYBMUJFWSA-N 341.249 1.899 10 10 EDCE CC(=O)[C@@H](O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951994175 UJWUGKBYZRAQNX-SMDDNHRTSA-N 325.361 1.484 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985103201 RNPVNYZIHFXKRZ-GHMZBOCLSA-N 325.369 1.534 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985101872 YYHJZPKNEARRBG-MNOVXSKESA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)NCC1(CN=[N+]=[N-])CC1 2010401098 AZWKWTHETLXDLH-NSHDSACASA-N 341.412 1.859 10 10 EDCE CC(C)(C)OC(=O)NCc1nc(=NCc2cccc(O)c2O)[nH][nH]1 2011842312 NRIMIAJDGLLLQB-UHFFFAOYSA-N 335.364 1.275 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@H](CO)CNC(=O)OC(C)(C)C 2014472309 FZERBZRBOACOMW-ZDUSSCGKSA-N 338.404 1.484 10 10 EDCE OCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)CC[C@@H]3O)c(Br)c1 2161397693 UHESGHRNLKLOHB-AJNGGQMLSA-N 342.233 1.794 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NCC2SCCS2)cc1 692343796 QWALGOOQMKPMKL-UHFFFAOYSA-N 334.488 1.373 10 10 EDCE Oc1c(F)cc(Br)cc1CN1C2COCC1COC2 715808188 ZMLAPLKIAUFBCH-UHFFFAOYSA-N 332.169 1.893 10 10 EDCE Cn1cc(Br)c(CNC(=O)c2cccc(O)c2O)n1 393668390 WQUOWEMTKRFZMJ-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC(NC(=O)C(C)C)CC3)c2n1 2063402593 HSDYROWSMLTFJU-UHFFFAOYSA-N 345.403 1.120 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN[C@@H]1C[C@@H](O)C[C@@H]1O 2046481548 GSFJSUPOMUSICL-IEBDPFPHSA-N 336.613 1.782 10 10 EDCE CCCN1CCN(C(=O)C=Cc2ccc(O)c(O)c2)C(C)(C)C1=O 2310377157 ZYEKRRJVCNUNIV-UHFFFAOYSA-N 332.400 1.970 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCc3nc(C)no3)CC2)cc1 171226145 NDMPRWRBEPQOKR-UHFFFAOYSA-N 345.403 1.461 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCNC(=O)CC2)cc1F 66978897 JPZYKGWMRCKNLC-UHFFFAOYSA-N 336.411 1.703 10 10 EDCE COc1ccc2c(c1)CCN2Cc1cnc(N2CCN(C)CC2)nc1 127689684 DIEDMFCKKRTXSP-UHFFFAOYSA-N 339.443 1.800 10 10 EDCE CCCCCCc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)c(=O)[nH]c1=O 38883737 UUWXBZDKPJYRAP-YNEHKIRRSA-N 337.380 1.618 10 10 EDCE Cc1ccc(CN=c2nc([N+](=O)[O-])n(C)[nH]2)c(O)c1Br 2381130878 GHMTVUIVFPQDOR-UHFFFAOYSA-N 342.153 1.534 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN(C(=O)Nc2cccc(C)c2)C1 808507519 QGHSAFNNXGXVSX-CQSZACIVSA-N 346.383 1.940 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](O)c1ccccn1 819697921 FYHRZAKMKSKHHA-QGZVFWFLSA-N 344.367 1.413 10 10 EDCE COC[C@@H](C(N)=O)N(C)C(=O)c1cc(C)n(-c2ccccn2)c1C 817940974 SDFADIWQJCTRCR-AWEZNQCLSA-N 330.388 1.061 10 10 EDCE COc1cccc(CNC(=O)N[C@H]2CC[C@@H](C)S(=O)(=O)C2)c1O 822001271 SDDZUAQVXPRAGX-PWSUYJOCSA-N 342.417 1.166 10 10 EDCE CC(C)(C)n1nnc(C(=O)NCc2ccc(N3CCOCC3)cc2)n1 823292962 VOSMFSYOZIIHSN-UHFFFAOYSA-N 344.419 1.195 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCCN1C[C@@H]2CCCCN2C1=O 823263942 CWSVAPQYTWXBLA-HNNXBMFYSA-N 346.431 1.824 10 10 EDCE CN1CC[C@@H](C(=O)NCc2ccc(O)cc2O)[C@H](c2cnn(C)c2)C1 910942926 ISNRJFONBLNMOE-CVEARBPZSA-N 344.415 1.183 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N2CCCC2)cc1)c1nnc(O)n1C 914179326 IKXWXSNBPGPQKM-GFCCVEGCSA-N 344.419 1.681 10 10 EDCE Cc1cc(O)c(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1C 842633063 OMEGLTNOSBIMEM-INIZCTEOSA-N 325.430 1.399 10 10 EDCE COC[C@]1(C)NC(=O)N([C@@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849356099 CGOJEKXWQREOHF-DYVFJYSZSA-N 333.388 1.231 10 10 EDCE c1cc(N2CCN(CC3CC3)CC2)ccc1CN[C@@H]1CNCCOC1 925633032 YGMVMIWEQBZFLT-LJQANCHMSA-N 344.503 1.297 10 10 EDCE COCc1nc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)no1 853817228 AMBBBTFVAUSPBN-LLVKDONJSA-N 332.360 1.233 10 10 EDCE CN(C)C(=O)N(C)[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 856086483 AFDIDJMMRCJZMW-VUDGCMKMSA-N 333.388 1.325 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCCc3nc[nH]n3)C2)cc1 854297910 XSYVXLHAYJFQAS-CYBMUJFWSA-N 344.419 1.324 10 10 EDCE CN1CCC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1=O 856214898 GBXARJCCMXYCRD-QGZVFWFLSA-N 345.443 1.132 10 10 EDCE C[C@H](O)c1ccc(N2CCN(C)C[C@@H]2CO)c(Br)c1 699431918 HGYGEWDMFONQJD-CMPLNLGQSA-N 329.238 1.615 10 10 EDCE CC(C)NC(=O)[C@@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 856237716 UBALBJHAUFJERY-IZPAUZPXSA-N 332.400 1.874 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)N1CCOC[C@@H]1C1CC1 759588073 HMUHSCNMPTXDBE-HSVJCBRXSA-N 347.367 1.292 10 10 EDCE COc1ccc(CNC(=O)COC(=O)c2cccc(O)c2O)cc1 776281331 BRZVEUTUOPUUFY-UHFFFAOYSA-N 331.324 1.580 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCC34CC(CN3)C4)C2)cc1 870952714 WRGHBCSBGAKGTL-HVEKOLDVSA-N 329.444 1.922 10 10 EDCE CCN(CC)c1ccc(CNC[C@H](O)CC2(O)CCOCC2)cc1 872200470 GRMJKSZJQBTMKE-GOSISDBHSA-N 336.476 1.915 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCn3ncnc3C2)c([N+](=O)[O-])c1 770222460 PBVPEEBFWVVTBX-HWKANZROSA-N 329.316 1.393 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@@H]2CCCCN2S(C)(=O)=O)c1 797097847 YVIDHWGIDHNLLB-OLZOCXBDSA-N 342.461 1.866 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@H](C(=O)C4CC4)C3)cc2N1 795139683 BAMBLHXYZJEEFB-AWEZNQCLSA-N 347.327 1.110 10 10 EDCE COc1ccc(CNC(=O)[C@H](C)NC(=O)c2ccccc2)c(O)c1 794369716 KAOPHTWNMFNTNC-LBPRGKRZSA-N 328.368 1.836 10 10 EDCE COC(C)(C)[C@@H](C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1303921170 LNOQGYINWIYBFM-SECBINFHSA-N 330.406 1.307 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NCCCCN=[N+]=[N-])C1 1963732873 SKOGHUUKKHWJTQ-NSHDSACASA-N 327.385 1.829 10 10 EDCE O=C(NCc1cnc(Br)s1)c1cc(O)nc(O)c1 718862820 OGQZNMWTLBXWJM-UHFFFAOYSA-N 330.163 1.642 10 10 EDCE C[C@@H](O)CCCN1CC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1269352777 WFZZNLOERXEQIV-IUODEOHRSA-N 347.419 1.814 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc[n+]([O-])c1 1263651419 KULHFJQLIFJRKS-UHFFFAOYSA-N 342.399 1.603 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2cccnc2C)cc1C 1278139656 UQXGKRKVIGSUKI-MRXNPFEDSA-N 343.427 1.588 10 10 EDCE COc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1-n1cnnn1 1465541795 UKRFDJVBZIYCKQ-UHFFFAOYSA-N 341.327 1.263 10 10 EDCE Cc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1-n1cnnn1 1464089968 CCZHRCJVDSYDGG-UHFFFAOYSA-N 325.328 1.563 10 10 EDCE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CC(=O)N(C)C 1541326520 NEKQGPSEQIBCIB-UHFFFAOYSA-N 331.420 1.832 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@H](O)c2cnn(C)c2)cc1 1540459531 LGSMGRUXZXPTCW-QGZVFWFLSA-N 330.432 1.958 10 10 EDCE CCN(C(=O)c1cc2cc(O)c(O)cc2s1)[C@@H]1CC(=O)NC1=O 1544343529 FIMOGZZEFBREJR-MRVPVSSYSA-N 334.353 1.190 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C2CC(C)C2)cc(OC)n1 1704015698 SCTFWWOPKYVCRF-MOENNCHZSA-N 335.404 1.379 10 10 EDCE CN(C)c1noc(CNC(=O)c2cc3cc(O)c(O)cc3s2)n1 1625760360 BIDMUOUTVGEOJK-UHFFFAOYSA-N 334.357 1.692 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CN(C)C(=O)C2CC2)cc1C 1714240773 QDCJWYMSXDUZGO-AWEZNQCLSA-N 347.459 1.466 10 10 EDCE CCc1[nH]ccc1C(=O)NC[C@@H](O)CNCc1ccc(OC)c(C)c1 1716085382 IDCPXLUZLUCCMS-HNNXBMFYSA-N 345.443 1.775 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cn[nH]c3)cc2)CC1 1634974334 PAWSTXAPELKQQF-UHFFFAOYSA-N 327.388 1.041 10 10 EDCE COC(=O)[C@@]1(O)CCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 1636664723 QSKHHCHULOKDSX-OAHLLOKOSA-N 337.353 1.063 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)CN2CCCC2=O)cc1C 1732407363 MINCBIGFLZMJHX-HNNXBMFYSA-N 347.459 1.563 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cn(Cc2cccs2)nn1 1645362968 HBXSOWHYRVLFNB-UHFFFAOYSA-N 330.369 1.729 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2126160787 CSZXIXDJKICSJB-DHPDLVEQSA-N 327.222 1.086 10 10 EDCE CN1[C@H](CNCc2c(O)cccc2Br)CCS1(=O)=O 1965950316 UBMYXYBCSULQGI-VIFPVBQESA-N 349.250 1.278 10 10 EDCE C[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 1914430240 LTJLYRWAMZQEJR-JPWUCKPDSA-N 327.178 1.394 10 10 EDCE CN1C[C@H](COc2ccc(N)cc2)N(C(=O)OC(C)(C)C)CC1=O 1952755239 OOOQANWMIGMKGD-CYBMUJFWSA-N 335.404 1.725 10 10 EDCE CNc1nc[nH]c(=NCCc2ccc(O)c(O)c2)c1Br 2148003862 LFPGMZSSTOHWCS-UHFFFAOYSA-N 339.193 1.769 10 10 EDCE CCn1ncc(Br)c1C(=O)NCc1cc(N)ccc1O 2150664313 KZVOLIXLPGHIIL-UHFFFAOYSA-N 339.193 1.883 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCc2ccc(N)cc2)C[C@H](O)C1 2018058260 VMADJKJVYQPLLS-XFHMXUHZSA-N 335.404 1.303 10 10 EDCE CCNCc1ccc(N(C)C[C@@H](O)CN(C)C)cc1Br 690256768 ONJSXNHWQHNSGY-AWEZNQCLSA-N 344.297 1.917 10 10 EDCE CCN(C)C1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2169449248 PQMOJQHNXFZSIO-ZDUSSCGKSA-N 339.237 1.541 10 10 EDCE NCc1ccc(N2CC[C@@H]3CS(=O)(=O)C[C@H]32)cc1Br 2094931378 SEDHOFXXVACELD-ZWNOBZJWSA-N 345.262 1.531 10 10 EDCE CC(C)(C)OC(=O)N1CC2(COc3nnc(=N)[nH]n3)CCC1CC2 2213784667 DVKQSWCSWVMEPS-UHFFFAOYSA-N 336.396 1.238 10 10 EDCE NCc1ccc(N2CCC3(CC2)CC(=O)N3)c(F)c1Br 2207924134 VHRBHCUCSICLFC-UHFFFAOYSA-N 342.212 1.906 10 10 EDCE CN(C)c1ccc([C@H](O)C(=O)c2nn(C)nc2Br)cc1 2235692117 RDGFPZJOHSXOQW-NSHDSACASA-N 339.193 1.560 10 10 EDCE C[C@H]1CN(CCCNC(=O)C=Cc2ccc(O)c(O)c2)C[C@H](C)O1 2307982077 MQRMIFIJTKWMJN-KBPBESRZSA-N 334.416 1.727 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCN(CC(F)F)CC3)cc2N1 301621979 NNJQBYSEUUYZDD-UHFFFAOYSA-N 342.302 1.313 10 10 EDCE Cc1cccc(/C=C2/SC(=S)N(CC(=O)NCCO)C2=O)c1 210393493 COYFERXHWYLLSD-XYOKQWHBSA-N 336.438 1.305 10 10 EDCE C[C@H]1CN(S(=O)(=O)CCOc2ccc(N)cc2)C[C@H](C)S1 70490934 GYJBJWDREIAZGI-RYUDHWBXSA-N 330.475 1.803 10 10 EDCE C[C@@H](NC(=O)C(=O)N(C)CC1(CO)CC1)c1ccc(N(C)C)cc1 807674429 KUIRZGNOKRMPCF-CYBMUJFWSA-N 333.432 1.161 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CCNC(=O)CC1 814824838 MVLAGLGLKVMJIY-INIZCTEOSA-N 345.443 1.398 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CC[C@H](C(=O)O)O3)C2)cc1 819000932 CHPZAUCNQFJYIV-DAXOMENPSA-N 348.399 1.270 10 10 EDCE CN(C)c1ccc(CNC(=O)c2nnn(C)c2C(F)(F)F)cc1 905318268 PSIMUJAHVBVICL-UHFFFAOYSA-N 327.310 1.830 10 10 EDCE C[C@@](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)(C(=O)O)C1CC1 588592707 UCKWCHJPEFKMTF-JAFJLQOXSA-N 344.411 1.906 10 10 EDCE COC1CCN(c2ccc(CN3CCO[C@@H]([C@@H](C)O)C3)cc2)CC1 839670534 HFEDAHMHIQIIGJ-DNVCBOLYSA-N 334.460 1.883 10 10 EDCE C[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)CC(F)F 843958951 DYYPBNOSVAYMNV-MRVPVSSYSA-N 336.360 1.785 10 10 EDCE CC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCCCO1 848930535 UWFKATTVLBIHGB-SJORKVTESA-N 347.459 1.833 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCCCNC3=O)C2)cc1 849225657 YMUDIVJMMNHIIQ-CJNGLKHVSA-N 346.431 1.242 10 10 EDCE COC(=O)c1cc2ccccc2c(CN2CN(C)C(=O)[C@H]2C)c1O 842642380 UFBSHBQJJVSVKC-LLVKDONJSA-N 328.368 1.952 10 10 EDCE Cc1cc(Cl)cc(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)c1O 843426329 SRMNQWSVZBOEGZ-OAHLLOKOSA-N 345.848 1.744 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N2CCC(c3ccco3)CC2)cc1 851688141 RDKHMYAFGASYSZ-UHFFFAOYSA-N 341.411 1.927 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc(=O)c(OC)co3)C2)cc1 855223005 ARXCZBLCOZXDKA-GFCCVEGCSA-N 344.367 1.666 10 10 EDCE CC[C@H](NC(C)=O)C(=O)NCc1cc(Br)ccc1O 868307288 WKJRBHHWIFQNNB-NSHDSACASA-N 329.194 1.686 10 10 EDCE CCNC(=O)N1CC[C@H](NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 773385902 FCFIXOFPUMZRDB-ZFWWWQNUSA-N 347.463 1.917 10 10 EDCE CCN(CC)c1ccc(CN[C@H]2C(=O)NCC23CCOCC3)cc1 895772506 GEYPFZCBSOPOLY-KRWDZBQOSA-N 331.460 1.918 10 10 EDCE C=CC(=O)NCCNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1144065415 JMVJSVYOBWTMKL-UHFFFAOYSA-N 339.395 1.939 10 10 EDCE CN(C)S(=O)(=O)[C@H]1CCCN(Cc2c(O)ccc3ccncc23)C1 795650182 FSZSECUSVOCVKP-AWEZNQCLSA-N 349.456 1.796 10 10 EDCE COC(=O)C[C@@H]1CSCCN1C(=O)Cc1ccc(O)c(O)c1 1147844185 YEJRZPJSIQXTMW-LLVKDONJSA-N 325.386 1.147 10 10 EDCE COC[C@H](CCO)NCc1c(Br)ccc(OC)c1O 1964049410 UJDWZKOWLQOONE-VIFPVBQESA-N 334.210 1.650 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC2CC3(C2)CC3(F)F)cc1 1327856921 ZQBIYBYDKRWLHX-UHFFFAOYSA-N 337.370 1.673 10 10 EDCE CCN1CC[C@@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@@H]1C 1329812703 WYIWJPXKACFYAM-DZGCQCFKSA-N 345.443 1.566 10 10 EDCE CN[C@H](C)c1ccc(N(C)[C@@H]2COC[C@@H]2O)c(Br)c1 709229255 XIPFXBLPKDBZRI-FZQKWOKYSA-N 329.238 1.925 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3[C@H]4CC[C@H]3COC4)c(Br)cc21 695050201 DCEHDQOTWUDHJP-UPFKWVMWSA-N 338.205 1.769 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)C[C@@H]2COC(=O)C2)cc1C 1268361280 RSQINRKULJEUGI-HOCLYGCPSA-N 348.443 1.941 10 10 EDCE CN(Cc1ccccc1O)c1nnc(-c2cnn[nH]2)n1CC1CC1 1521073942 BUKALQHJFKJHNJ-UHFFFAOYSA-N 325.376 1.815 10 10 EDCE COc1ccc(O)c([C@H](C)N[C@@H](C)c2nc(-c3nc[nH]n3)no2)c1 1459848822 HUOJJGQZXACDRW-IUCAKERBSA-N 330.348 1.981 10 10 EDCE CN(Cc1ncnn1CC(F)F)C(=O)Cc1ccc(O)c(O)c1 1297322010 JWZDAMSGJDAWRH-UHFFFAOYSA-N 326.303 1.156 10 10 EDCE C/C(=C/C(=O)N(C)c1ccc(S(C)(=O)=O)cc1)c1cnccn1 1535260152 ZKXBSFZZSNUQCM-BENRWUELSA-N 331.397 1.946 10 10 EDCE C[C@@H]1[C@@H](CO)CCN1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1471547199 JXANYUUSQFDMBL-QGPMSJSTSA-N 348.491 1.768 10 10 EDCE NS(=O)(=O)c1ccc(C(=O)NCc2cccc(Cl)c2O)s1 1637227122 OCBCBQIEGFPKOS-UHFFFAOYSA-N 346.817 1.685 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1ccc(O)nn1 1497353740 ZZFQXKCTTGYPMT-UHFFFAOYSA-N 344.415 1.751 10 10 EDCE COC(=O)[C@@H](Cc1ccncc1)NC(=O)c1ccc(C)c(O)c1O 1569605344 RYJIELWVTDPZSA-CYBMUJFWSA-N 330.340 1.315 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@H](C)NC(C)=O)C(C)C)cc1C 1732554898 ODAQOZYCDCQHMS-WMLDXEAASA-N 349.475 1.759 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@H]2CCC(=O)N2)cc1C 1734351854 HMODVHPKRCRTBM-HIFRSBDPSA-N 333.432 1.219 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCc2ccccc2NC1=O 1644146308 SIYMDVMJVRKWIG-AWEZNQCLSA-N 326.352 1.710 10 10 EDCE COc1ccc(-n2nnnc2CN(C)C[C@@H](C)NC(=O)C2CC2)cc1 1669762444 HJFXAKIMQDDCIJ-GFCCVEGCSA-N 344.419 1.017 10 10 EDCE CC(C)COC(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169902549 RIVQWWLQYFXFCE-UHFFFAOYSA-N 338.360 1.354 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cc(Cn3cc(C)cn3)on2)c1 160301898 SBXLTOJZNJEVHF-UHFFFAOYSA-N 342.355 1.872 10 10 EDCE CC(=O)C(=O)[C@]1(O)[C@@H](CNC(=O)OC(C)(C)C)CCC12CCC2 1924872869 BIAVKVZBPTWODA-SJKOYZFVSA-N 325.405 1.981 10 10 EDCE CCCNCc1ccc(N2CC(=O)NC(=O)C2)c(Br)c1 233102264 CHALCGCBVCPQFT-UHFFFAOYSA-N 340.221 1.412 10 10 EDCE COc1cc([C@@]2(NC(=O)OC(C)(C)C)C[C@H]2C(=O)O)cc(O)c1O 1952888698 WNEYYETYGLIJFI-FVMDXXJSSA-N 339.344 1.931 10 10 EDCE CC[C@]1(O)CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2150756276 BOFWXCMLGJRZPX-OCCSQVGLSA-N 340.221 1.752 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@]2(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003172032 FHOCSBGHOHOSFY-JJFYZRJRSA-N 336.432 1.899 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010398227 VPCDVPLSORRUBY-GRYCIOLGSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010406784 YYDFXDYANVZDQY-VHSXEESVSA-N 340.384 1.056 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(CCC(N)=O)Cc3ccccc3)ccc21 2034754820 SEUKJQYIHJWKRO-SFHVURJKSA-N 338.411 1.781 10 10 EDCE CC[C@H](N[C@H]1CN(C)NC1=O)c1cc(Br)ccc1O 393895391 HXVIXNDLGNQCEV-QWRGUYRKSA-N 328.210 1.541 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCN(C)C[C@@H]3CC(C)C)c2n1 2065223728 NVDSQLUANPKJAG-ZDUSSCGKSA-N 331.420 1.546 10 10 EDCE C[C@@H](F)CS(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 2177549324 ABORONIETMQVSR-SSDOTTSWSA-N 344.817 1.811 10 10 EDCE C[C@@H](NCc1ccc(Br)cc1O)[C@@H]1CN(C)CCN1C 1183919438 KFZRDDCVNQQFAG-RISCZKNCSA-N 342.281 1.879 10 10 EDCE O=C1Nc2cc(N3CCOC[C@H]3CF)c(Br)cc2[C@@H]1O 2182598531 SROVYNVXRGWWMP-KRTXAFLBSA-N 345.168 1.609 10 10 EDCE C[S@](=O)(=Nc1ccc(C2=S=CC=C2)s1)N1CCNCC1 2205853698 YSGJNVNIIFBGFV-FQEVSTJZSA-N 327.500 1.923 10 10 EDCE COc1ccc(Br)c(CNC2CS(=O)(=O)C2)c1O 2220463031 VKWCSZROKLMQNE-UHFFFAOYSA-N 336.207 1.050 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](CCC(=O)NCCN=[N+]=[N-])C1 2245921740 OMQHROYWDAANAH-NSHDSACASA-N 327.385 1.829 10 10 EDCE O=C(O)CN(Cc1cc(Br)ccc1O)[C@@H]1CCOC1 2272415823 PFGBQCAHEZHQOP-LLVKDONJSA-N 330.178 1.830 10 10 EDCE CNCc1ccc(N2CCC[C@@H]3CNC(=O)[C@H]32)c(Br)c1 2279281225 RVNFHHASKAOKKF-RISCZKNCSA-N 338.249 1.883 10 10 EDCE COc1ccc(C=C2SC(N3CCN(C)CC3)=NC2=O)cc1O 2293746743 YIHPBSRHIFWERS-UHFFFAOYSA-N 333.413 1.619 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N[C@@H]1CCCCNC1=O 2297505267 MGTXATPOUKTRCT-QGZVFWFLSA-N 343.427 1.321 10 10 EDCE CNC(=O)c1cncc(C=CC(=O)N(C)c2ccc(Cl)nn2)c1 2299394560 CTBRVBLJBZVBLN-UHFFFAOYSA-N 331.763 1.561 10 10 EDCE CCCn1[nH]c(Br)nc1=NCc1cc(N)ccc1O 2353708551 DVPHVTGANKTGNS-UHFFFAOYSA-N 326.198 1.772 10 10 EDCE CCOCCOCC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 124882052 SVSYMRVJAJZPAD-HNNXBMFYSA-N 336.432 1.754 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc2c(=O)[nH]cnc2cn1 187521513 DYTYSVPKQSLPCT-UHFFFAOYSA-N 337.383 1.656 10 10 EDCE CN[C@H](C)c1ccc(N2CC(O)(CN(C)C)C2)cc1Br 2369669235 JNBRFIYAVMNBBS-LLVKDONJSA-N 342.281 1.842 10 10 EDCE Cc1ccc([C@H](C)NC[C@]2(CO)COCC3(CCC3)N2C)c(O)c1 527956552 PYNDAXCJJSGAOS-KXBFYZLASA-N 334.460 1.967 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1C[C@@H]2CC[C@H](C1)O2 369869710 CSPKFXRGDMVWGY-GASCZTMLSA-N 349.406 1.735 10 10 EDCE O=C(NCc1ccccc1O)C(=O)Nc1ncn(C2CCCCC2)n1 273345362 WZGNOIXTZJLXKU-UHFFFAOYSA-N 343.387 1.744 10 10 EDCE COCc1nc([C@@H]2COCCN2Cc2ccc(N(C)C)cc2)no1 374787552 IATVMMYPUFRUNX-HNNXBMFYSA-N 332.404 1.856 10 10 EDCE COC[C@@](C)(N)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380790106 ONUQRIRYEIDWCO-CQSZACIVSA-N 345.237 1.785 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCS(=O)(=O)CC2)c([N+](=O)[O-])c1 727757335 AJPITFWKJIPFFP-HYXAFXHYSA-N 340.357 1.016 10 10 EDCE O=C(NCc1ccccc1O)C(=O)Nc1ccc2c(c1)CCCO2 726294120 RPVMONLTZLQHSD-UHFFFAOYSA-N 326.352 1.972 10 10 EDCE CC(=O)N(C)c1cccc(NC(=O)C(=O)NCc2ccccc2O)c1 746039676 UMTLWRJFXZYCPH-UHFFFAOYSA-N 341.367 1.630 10 10 EDCE NCC1(CCNC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 846137651 DXBPGVZOAOXEAV-UHFFFAOYSA-N 332.448 1.451 10 10 EDCE CN(C)S(=O)(=O)CC(=O)NCc1ccc(N2CCCCC2)cc1 751681720 ZCPQBTGZWCYKNW-UHFFFAOYSA-N 339.461 1.185 10 10 EDCE C[C@H](NC(=O)N(C)CC1CN(C)C1)c1ccc(N2CCOCC2)cc1 852011867 BLMDHMPJABNOOY-HNNXBMFYSA-N 346.475 1.787 10 10 EDCE C[C@@H](CN(C)CCCN(C)C)NC(=O)c1c(F)ccc(O)c1O 857304939 VLEJIUVGEAAVOT-NSHDSACASA-N 327.400 1.239 10 10 EDCE C/C=C/C[C@H](CO)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852451347 INROCJAEUSHACT-LRPXVYOUSA-N 333.432 1.900 10 10 EDCE CN(C)C(=O)N(C)[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C1 857328807 HAOOMWIVWZABIA-VIFPVBQESA-N 325.340 1.065 10 10 EDCE O=C(COC(=O)c1ccnn1C1CCOCC1)c1ccc(O)c(O)c1 850330798 GLRIYNCESJDOOP-UHFFFAOYSA-N 346.339 1.686 10 10 EDCE COC(=O)[C@H]1CSCCN1Cc1ccc(N2CCOCC2)cc1 931759401 WTYUEIHNRVFGRP-MRXNPFEDSA-N 336.457 1.614 10 10 EDCE C[C@H](NC1CCN(C(N)=O)CC1)c1ccc(N2CCOCC2)cc1 765328390 FJJCJKTULOSHPJ-AWEZNQCLSA-N 332.448 1.717 10 10 EDCE NCc1ccc(N2CCO[C@@H]3COC[C@H]32)c(F)c1Br 1877648959 UNNIARFFDQEDGS-GHMZBOCLSA-N 331.185 1.651 10 10 EDCE COC(=O)c1c(CN2CC(C)(C(N)=O)C2)c2cc(F)ccc2n1C 895075748 GOENXHOMWPSHOG-UHFFFAOYSA-N 333.363 1.411 10 10 EDCE COC(=O)c1ccncc1C(=O)OCC(=O)c1ccc(O)c(O)c1 784137018 BEHIRIYNAQTZRV-UHFFFAOYSA-N 331.280 1.319 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCO[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1895876403 UYTUTRCRSKAORI-ONGXEEELSA-N 325.369 1.437 10 10 EDCE COC(=O)Cc1nc(NC(=O)c2cc3cc(O)c(O)cc3s2)n[nH]1 1147684487 SHRKQIPXWXTZDQ-UHFFFAOYSA-N 348.340 1.398 10 10 EDCE Cn1cc(C(=O)NCc2cc(N)ccc2O)nc1Br 710707019 KEFHENIKOJAKHK-UHFFFAOYSA-N 325.166 1.400 10 10 EDCE Cc1ccc(-c2nnn(CC(=O)NCc3ccc(O)cc3O)n2)cc1 1299570335 IRWOULIWHOTVOX-UHFFFAOYSA-N 339.355 1.376 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)NCc2nc(N)n[nH]2)cc1 1471102707 ZGYXGOIRVAECIJ-UHFFFAOYSA-N 331.424 1.575 10 10 EDCE COc1ccn2c(C(=O)NCc3cccc(OC)c3O)cnc2c1 1545684126 KPEMHERHPYIYCW-UHFFFAOYSA-N 327.340 1.987 10 10 EDCE CCNC(=O)C1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CCC1 1618544075 NXYIRXKUWHWSGY-UHFFFAOYSA-N 331.376 1.885 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)c2[nH]nnc2C)cc1C 1725138045 XHRZJAQJZQEEDB-NEPJUHHUSA-N 331.420 1.727 10 10 EDCE CCC(=O)NC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1744181777 QYQNJOLAKCQIQS-CYBMUJFWSA-N 331.376 1.884 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)CCc2cnn[nH]2)cc1C 1674729991 YMMCTXALCCQCNK-KGLIPLIRSA-N 345.447 1.737 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2cn(C)c(O)n2)cc1C 1676418141 NGAVZRMRQIZXBD-ZDUSSCGKSA-N 346.431 1.693 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2CCCNC2=O)cc1C 1699514682 TXIUOYSGNMGFME-MRXNPFEDSA-N 347.459 1.468 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)c2cnn(C)n2)C2CC2)cc1C 1699592841 PXDXSXZUOFACBE-OAHLLOKOSA-N 343.431 1.430 10 10 EDCE CNC(=O)CCCN(C)c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 157688429 UGOZQRQTMFDKLY-VQHVLOKHSA-N 335.360 1.743 10 10 EDCE C[C@H](O)[C@H](C(=O)O)N1C(=O)/C(=C\c2cccc(O)c2)SC1=S 1858592043 GZHHBUOCCCYKON-JZMJZOPTSA-N 339.394 1.427 10 10 EDCE O=C(O)C[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccsc2)SC1=S 1858595738 HMHFQQOHQDQSLK-TWGKFFBLSA-N 343.407 1.877 10 10 EDCE CN[C@H](c1ccccc1O)[C@@]1(O)COC[C@@H]1NC(=O)OC(C)(C)C 1920513112 MNNHNCFUBPRYFU-JJRVBVJISA-N 338.404 1.307 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)NCCCN=[N+]=[N-])CO1 1985094796 ULMUXPZBOXKYSX-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE COc1ccc(O)c(CNC[C@H](CO)NC(=O)OC(C)(C)C)c1 1985857744 FYDXWNOANVASNU-GFCCVEGCSA-N 326.393 1.376 10 10 EDCE Oc1ccccc1CN=c1cc(I)cn[nH]1 1986298164 JXMVBAILYOQITB-UHFFFAOYSA-N 327.125 1.821 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 1990359368 ZIBUOZVGOUSHLZ-GXSJLCMTSA-N 325.369 1.580 10 10 EDCE CNCc1ccc(N2CCOC[C@H]2CN(C)C)cc1Br 2153245668 WLXJJSIOVNJISR-CQSZACIVSA-N 342.281 1.935 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@H](O)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010406778 YWIXGMCGXSSOLF-SRVKXCTJSA-N 341.412 1.809 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3OCCN(C)[C@H]3C2)c(Br)c1 2153997498 YQNSBPDMBZRLGV-LKTVYLICSA-N 340.265 1.988 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC[C@H]1NC(=O)c1cc(O)c(O)c(O)c1 2015121139 AOVSQLBJDHYNFB-NXEZZACHSA-N 338.360 1.589 10 10 EDCE C[C@@]1(NCc2cc(Br)cc(F)c2O)CCC(=O)NC1=O 2172836273 DTULKKOTQLJJCT-CYBMUJFWSA-N 345.168 1.579 10 10 EDCE O=C(c1cc(O)c(O)c(O)c1)N1CCN(Cc2ccccc2)CC1 586738087 YEQNEOAPMSVBQZ-UHFFFAOYSA-N 328.368 1.761 10 10 EDCE CN(CCCS(C)(=O)=O)c1ccc(CN)c(Br)c1 694185940 LVVFSYGYXIGFJL-UHFFFAOYSA-N 335.267 1.779 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1CN2CCN1CC2 394700518 PXXDCAIIUGZAKA-CYBMUJFWSA-N 326.238 1.244 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3CCN(CC(F)(F)F)C3)c2n1 2062786374 LSRMVYDMRYLPKV-VIFPVBQESA-N 343.309 1.110 10 10 EDCE COc1cc(CN(C)C(=O)c2cnn3c(O)cc(C)nc23)sn1 2063839802 CRJDMJKAIKVEDR-UHFFFAOYSA-N 333.373 1.481 10 10 EDCE CC(=O)NC1CCC(N(C)C(=O)c2cnn3c(O)cc(C)nc23)CC1 2064779946 YBUCJKSDLMYCNA-UHFFFAOYSA-N 345.403 1.263 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3CC(O)(CN)C3)ccc(N)c2C1 2071658246 LAKNVBPJOKLXTJ-UHFFFAOYSA-N 348.447 1.072 10 10 EDCE O=C1NC[C@H]2CN(Cc3cccc(Br)c3O)CC[C@H]12 2100946535 YYIGGAKBTYVCQT-QWRGUYRKSA-N 325.206 1.723 10 10 EDCE C[C@H](O)CN(C[C@H](C)O)c1cc(Br)c(CN)cc1F 2103485411 VCJPEGHTWWKJGC-IUCAKERBSA-N 335.217 1.615 10 10 EDCE COc1ccc(Br)c(CN2CCOC[C@H]2CN)c1O 2227741968 XZJYWGGZCMFKLQ-SECBINFHSA-N 331.210 1.323 10 10 EDCE CC(C)c1ccc(N2C(=O)NC(=O)C(=CNCCN(C)C)C2=O)cc1 2296138894 AKWDWLKYRIHCRS-UHFFFAOYSA-N 344.415 1.428 10 10 EDCE C[C@H]1CN(C(=O)C=Cc2ccc(O)c(O)c2)C[C@H]1N1CCOCC1 2307987825 NPBCHQGCZFBYDE-DZGCQCFKSA-N 332.400 1.290 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@H]2NC(=O)COc1ccc(N)cc1 2311829024 PJNLOZACAXUMLG-PJODQICGSA-N 347.415 1.772 10 10 EDCE Cc1ccc(CNS(=O)(=O)C2COC2)c(O)c1Br 2327589339 OYKZNRIVFPIKRD-UHFFFAOYSA-N 336.207 1.281 10 10 EDCE COc1cc(/C=C2\C(=O)NC(=O)N(C)C2=O)ccc1OCC(C)C 59860999 AHVNNCBBKDSNSI-KPKJPENVSA-N 332.356 1.822 10 10 EDCE COC(=O)NCC(=O)N1C[C@H](C)[C@@H](NCc2ccc(OC)c(C)c2)C1 1502703528 MVYMBVVPBVKOAM-ZFWWWQNUSA-N 349.431 1.296 10 10 EDCE NC(=O)c1coc(CNC(=O)NCc2ccc(N3CCCC3)cc2)c1 190284354 CXYUJCXKMDWXGM-UHFFFAOYSA-N 342.399 1.978 10 10 EDCE CCn1nccc1S(=O)(=O)N1CCOc2cc(N(C)C)ccc21 274493279 JAGYENJZGHJOQR-UHFFFAOYSA-N 336.417 1.557 10 10 EDCE CC[C@@H](C)N(CCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 383787930 MCTSHURLCCYKMQ-OQPBUACISA-N 342.237 1.998 10 10 EDCE C[C@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1ccc(F)cc1O 806170759 CHOOYWUQCAGNPZ-WCQYABFASA-N 345.440 1.453 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]12[C@@H]3[C@H]4C(=O)[C@H]1[C@@H]1[C@@H]4C[C@@H]3[C@H]12 800532514 QQPSOKPJUJRHHX-QMQCJWFVSA-N 339.391 1.472 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H](CC3CCOCC3)C2=O)cc1 904135800 TXHNHRAMMINREL-MRXNPFEDSA-N 331.416 1.990 10 10 EDCE O[C@H]1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1(F)F 826957789 HEHNNCBNLGZUFP-HNNXBMFYSA-N 330.350 1.864 10 10 EDCE C/C=C/[C@H](O)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 909855621 IHYSWHGBFPQMCQ-HSWBROFVSA-N 326.343 1.355 10 10 EDCE Cc1cc(Cl)cc(CN2CCS(=O)(=O)[C@H]3COCC[C@@H]32)c1O 839187971 ZTEYRATULCAIGO-KBPBESRZSA-N 345.848 1.742 10 10 EDCE CC[C@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)CCN1CC(F)F 841081890 HMKYMGKVPKXNTE-ZDUSSCGKSA-N 340.374 1.395 10 10 EDCE O=C1CN(Cc2cc3c(cc2O)OC[C@@H]3O)Cc2ccccc2N1 848498986 ZXTSCACOCWWIQW-INIZCTEOSA-N 326.352 1.772 10 10 EDCE C[C@H]1CS(=O)(=O)CCCN1C(=O)NCc1ccc(N(C)C)cc1 913927018 SEBDLDYWQALLBJ-ZDUSSCGKSA-N 339.461 1.471 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)[C@@H]2CCCc3n[nH]cc32)cc1 843299532 XJVZYFJGJPVCJZ-GDBMZVCRSA-N 327.432 1.712 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc(C(N)=O)c[nH]3)C2)cc1 855229555 APWWWUVDSZVHHC-GFCCVEGCSA-N 328.372 1.131 10 10 EDCE COC(=O)C1(CNC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 852267096 YMUPEUXPDWQUHJ-ZDUSSCGKSA-N 347.415 1.526 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc4nnnn4c3)C2)cc1 855234168 UHNTYYXQJVMWTK-CYBMUJFWSA-N 338.371 1.142 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)[C@H]3CCCNC3)C2)cc1 851661443 JTXQCNKNUDFFIR-JYJNAYRXSA-N 346.475 1.961 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CC[C@H](C(=O)O)C3)C2)cc1 852954466 IHGCUDICCQNJSP-HZSPNIEDSA-N 332.400 1.891 10 10 EDCE O=C(O)[C@@H](F)C1(O)CN(Cc2cc(Br)ccc2O)C1 1875538997 POJLYKQECCJTJA-SNVBAGLBSA-N 334.141 1.124 10 10 EDCE CN(CCn1cc(Br)c(=N)[nH]1)Cc1ccccc1O 1877525698 YHDJJGVACZFOCF-UHFFFAOYSA-N 325.210 1.896 10 10 EDCE COc1ccc(C(=O)NCC(=O)NCc2ccc(OC)cc2O)cc1 794374641 XDBIUYHOBWPYQU-UHFFFAOYSA-N 344.367 1.456 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)C[C@@H]2CCC(=O)N2)cc1C 1319256661 IAVFRHPMNYTORF-BBRMVZONSA-N 347.459 1.514 10 10 EDCE CN1CC2(CN(Cc3ccc(N4CCOCC4)c(F)c3)C2)OC1=O 1326217789 IREWXMDPMWEOAZ-UHFFFAOYSA-N 335.379 1.299 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NC1C[C@@H]2C[C@H]2C1 1329195842 CLJMSGXMUPAQER-GJZGRUSLSA-N 343.427 1.054 10 10 EDCE CCN1C[C@@H](C)N(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H]1C 1329437589 OCEYEKBBPNZSBP-CHWSQXEVSA-N 331.416 1.176 10 10 EDCE CN1CCOC[C@H]1CNCc1cc(Br)cc(F)c1O 715719090 AYZMECXGVZNXIY-LLVKDONJSA-N 333.201 1.714 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)NCc2ccccc2O)CO1 1251384081 BZFSAIGKCYRVOT-LBPRGKRZSA-N 337.376 1.742 10 10 EDCE CC(C)(C)OC(=O)c1cc(C(=O)NCCc2ccc(O)c(O)c2)[nH]n1 1445939547 SGKBYDOGXQOZLV-UHFFFAOYSA-N 347.371 1.749 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)C(C)(C)C(N)=O)cc1C 1700406286 XMARILBCFQCELP-QWHCGFSZSA-N 335.448 1.498 10 10 EDCE CN1CC[C@H](C(=O)NCc2c(O)cccc2O)[C@H](c2cnn(C)c2)C1 1558536062 RPNNARCLFIDVCB-ZFWWWQNUSA-N 344.415 1.183 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccc(-n2ccnc2O)cc1 1595753037 WTCYOMAGWOXXSY-UHFFFAOYSA-N 339.351 1.962 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)NCCN=[N+]=[N-])OCC1(C)C 1965101231 AIMVQXXRBPKJPJ-JTQLQIEISA-N 327.385 1.827 10 10 EDCE OC[C@H]1CO[C@H](CNCc2cc(Br)cc(F)c2O)C1 1966089131 VWOVIXWFMLSXHF-KWQFWETISA-N 334.185 1.781 10 10 EDCE C[C@H](O)C[C@@H]1COCCN1c1ccc(CN)c(Br)c1 2128866372 QSLJYKDYEASTRH-GXFFZTMASA-N 329.238 1.884 10 10 EDCE COC[C@@](O)(CNC(=O)OC(C)(C)C)[C@H](N)c1ccccc1O 1921822907 HCKVWEXNVZZBFV-CJNGLKHVSA-N 326.393 1.294 10 10 EDCE CCN(CC(=O)N(C)C)c1ccc(CN)c(Br)c1F 231839155 ZGFYABGLAYUTPZ-UHFFFAOYSA-N 332.217 1.961 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C[C@@H]1CCCO1)C(=O)NCCN=[N+]=[N-] 1985102793 LXRZOOAXJYRGAI-WDEREUQCSA-N 327.385 1.875 10 10 EDCE Cn1cc([C@H](NC(=O)OC(C)(C)C)[C@@H](N)c2ccccc2O)nn1 2001804800 TZJWRVUGSVXHBY-KBPBESRZSA-N 333.392 1.787 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@@H](NCc3ccc(N)cc3)[C@H]2C1 2008714222 USXSFZHBWNKBRY-OAGGEKHMSA-N 333.432 1.993 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC(N=[N+]=[N-])C2)COCC1(C)C 2010391934 CEBACJHXACRBGF-NSHDSACASA-N 339.396 1.922 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(C)[C@@H](CO)C2)cc1Br 687612684 IYEHKDRUZYCVTO-DGCLKSJQSA-N 342.281 1.842 10 10 EDCE CCOC1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 382741387 NPJJFJOLPULMGD-GFCCVEGCSA-N 326.194 1.626 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H]3CCCO[C@H]3C(C)C)c2n1 2063383873 LZTNTTSGJVKAQD-WFASDCNBSA-N 332.404 1.924 10 10 EDCE COc1cccc(O)c1[C@H](C)NC[C@H]1CCCN1S(C)(=O)=O 2064486642 CWXGYXXPVOUCNF-NWDGAFQWSA-N 328.434 1.475 10 10 EDCE C[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C[C@H]1NC(=O)C(F)(F)F 2044625748 YWFZLKNZZWRZJZ-GXFFZTMASA-N 343.349 1.727 10 10 EDCE O=S1(=O)C[C@H]2[C@@H](C1)[C@@H]2NCc1cc(Br)ccc1O 2054270427 NHSHXWJGAXSQSC-IAZYJMLFSA-N 332.219 1.287 10 10 EDCE O=S1(=O)C[C@H]2CCN(c3ccc(CO)cc3Br)[C@@H]2C1 2094927404 OLBFKUSUPYWQPW-ZWNOBZJWSA-N 346.246 1.565 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])C1 2213593568 SKEPTMALXFFJTF-TUAOUCFPSA-N 339.396 1.970 10 10 EDCE C[C@@H]1OC2(C(=O)NCCN=[N+]=[N-])CC1(NC(=O)OC(C)(C)C)C2 2243112210 NGRKULVMQXOSLW-SQNUNTJVSA-N 325.369 1.628 10 10 EDCE CSc1cccc(N(C)C(=O)C=Cc2cn(C)c(=O)n(C)c2=O)c1 2297436195 JDEPLZZDVATHPO-UHFFFAOYSA-N 345.424 1.482 10 10 EDCE CNC(=O)CCN(C)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297505719 UXBHEXBOPMTTRS-UHFFFAOYSA-N 331.416 1.131 10 10 EDCE O=C(CSc1ncccn1)NC1=NN(c2ccccc2)C(=O)C1 8333555 WAOAPRQLLLMVOX-UHFFFAOYSA-N 327.369 1.435 10 10 EDCE CNC(=O)c1cccnc1NCc1ccc(N2CCOCC2)cc1 301375924 VUITYIWPHWONNL-UHFFFAOYSA-N 326.400 1.890 10 10 EDCE CC[C@H]1C(=O)NCCN1c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 267301304 UUNLLPXDQHJAGH-PZBABLGHSA-N 333.344 1.496 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)/C=C/c1ccncn1 272184342 DJSJHFJKHRCAMC-QPJJXVBHSA-N 338.411 1.985 10 10 EDCE NC(=O)CC1CN(c2ccc(/C=C/C(=O)O)c(Br)c2)C1 382148003 FGUDPTYTLNOJLG-DUXPYHPUSA-N 339.189 1.859 10 10 EDCE Cc1ccc(CN2C[C@H]3C(=O)NC(=O)[C@@H]3C2)c(O)c1Br 2381129462 KQULHKHWSAGIFZ-NXEZZACHSA-N 339.189 1.168 10 10 EDCE COc1c(O)cccc1/C=C1/SC(=S)N(CC(=O)O)C1=O 810199646 NWRVMAQRNHFGJM-WEVVVXLNSA-N 325.367 1.687 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N[C@@H]1CCC[C@@H](C(N)=O)C1 739018653 DUNPBUDOHBZVIF-UKRRQHHQSA-N 332.448 1.904 10 10 EDCE COc1ccc(N2CCCN(C(=O)c3cnn(C)c3OC)CC2)cc1 839557398 YGBBQAAHMZPMMO-UHFFFAOYSA-N 344.415 1.790 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H](O)C1CCOCC1 735876592 JFIOOAZCFNQJKK-SFHVURJKSA-N 348.443 1.269 10 10 EDCE C[C@@H]1CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C[C@H](CO)O1 588561479 UPGZNNYRGPUYQI-JNVBQHHASA-N 346.427 1.145 10 10 EDCE O=S1(=O)CC[C@@]2(CN(Cc3c(O)ccc4ccncc34)CCO2)C1 842634584 WUARPVTUMCLEMJ-QGZVFWFLSA-N 348.424 1.330 10 10 EDCE Cc1cc(N(C)C)ccc1CN[C@@H]1CCC[C@H]1CNS(C)(=O)=O 840942884 LBQIMUWAALUSTA-DOTOQJQBSA-N 339.505 1.869 10 10 EDCE CCc1cccc(CNC[C@@H]2CCCCN2S(C)(=O)=O)c1O 848910939 OOBMEKPXAOAKJF-HNNXBMFYSA-N 326.462 1.858 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3nc(C)c(C)[nH]c3=O)C2)cc1 855233926 PKQZCFAGNKLWEE-CYBMUJFWSA-N 342.399 1.404 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(C(F)(F)Br)nc1 850287073 NZILLKYNVKGETC-UHFFFAOYSA-N 336.088 1.841 10 10 EDCE O=C(NCc1ccccc1O)N[C@H]1CCCN(c2cccnc2)C1=O 753146552 BWZKOPNYUMGKRH-HNNXBMFYSA-N 340.383 1.782 10 10 EDCE Cc1cc(C)c([C@@H](C)NCC[C@@H]2CNCCS2(=O)=O)c(O)c1 925788079 FOVXLPZTHGKSSP-ZIAGYGMSSA-N 326.462 1.436 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3CCNCC3)C2)cc1 851662503 YVCMKARARGXZFG-HNNXBMFYSA-N 332.448 1.573 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@@]1(C)C(=O)O 863533728 XTDYGKNWQUGWIC-SFHVURJKSA-N 333.432 1.650 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(C(=O)NCc2ccc(O)c(O)c2)C1 934944892 UREUVWRPFCDCSK-KPZWWZAWSA-N 348.399 1.971 10 10 EDCE CN1CCc2ccc(S(=O)(=O)NCc3ccc(O)cc3O)cc21 867416908 JFCAXCMDRSKNPJ-UHFFFAOYSA-N 334.397 1.569 10 10 EDCE CCS(=O)(=O)N1CCC(C(=O)N2Cc3cccc(O)c3C2)CC1 871198277 FRELPMZNMHWQBW-UHFFFAOYSA-N 338.429 1.296 10 10 EDCE CC1(C)C[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CCS1(=O)=O 1157724588 DRQRCKPWOSDBJZ-FUEXJSSKSA-N 339.413 1.583 10 10 EDCE CO[C@H]1C[C@@H](C(=O)O)N(Cc2cc(Br)ccc2O)C1 1964719248 MAFANAUHVXQNHX-QWRGUYRKSA-N 330.178 1.829 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(OC[C@@H]2CCOC2)CC1 1295464917 IIJCFVLHISPSKX-CQSZACIVSA-N 335.400 1.684 10 10 EDCE CCO/C=C/[C@](O)(CNC(=O)Cc1ccc(O)c(O)c1)C(F)(F)F 1450334282 BYRCOEXYZSDCFM-GJBLVYBDSA-N 349.305 1.600 10 10 EDCE N[C@H]1CN(Cc2cc(Cl)cc(Br)c2O)CC[C@H]1CO 2122343793 CQRSRTIUIRKHHN-UFBFGSQYSA-N 349.656 1.950 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1CCCNC1=O)NCc1ccc(OC)c(C)c1 1481821433 OBHCWJKQUKYWLS-HZPDHXFCSA-N 347.459 1.514 10 10 EDCE CCOC(=O)[C@@H]1CSCCN1C(=O)Cc1ccc(O)c(O)c1 1623839527 PNDOYUZVZBVXNP-NSHDSACASA-N 325.386 1.147 10 10 EDCE O=C(CCc1nn[nH]n1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1636951594 UOJNZFHUKRCVBH-ZDUSSCGKSA-N 331.376 1.046 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CSc1n[nH]c(O)n1 1636058449 CGLKLDZQMGLXKN-UHFFFAOYSA-N 329.378 1.110 10 10 EDCE CNS(=O)(=O)c1ccc(C(=O)NCc2cccc(Cl)c2O)o1 1648606576 SVVQHTSCWNLHBL-UHFFFAOYSA-N 344.776 1.477 10 10 EDCE [N-]=[N+]=N[C@H]1CCCN(C[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1 1912190521 FFWBMHGZYZFAQK-NWDGAFQWSA-N 329.360 1.418 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CO)c3ncc[nH]3)C2)cc1 1687025736 UACZLTNJIHFZGK-SWLSCSKDSA-N 345.403 1.030 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2C[C@H](CO)CO2)c1O 1966088615 REROSKCTSOBJPF-NXEZZACHSA-N 346.221 1.650 10 10 EDCE CC1(C)O[C@@H]2[C@@H](n3cnc4c(N)ncnc43)O[C@@H](CN=[N+]=[N-])[C@H]2O1 105228993 QWAPXRJZRIFMTR-CIPNSKCISA-N 332.324 1.136 10 10 EDCE CCOC[C@H](O)CNCc1c(Br)ccc(OC)c1O 1969427870 OMRINUODYKQUSR-SECBINFHSA-N 334.210 1.650 10 10 EDCE CNC(=O)[C@H]1CCCN(c2ccc(CN)c(Br)c2)C1 228157202 WRJIAMQCLRYVPP-NSHDSACASA-N 326.238 1.870 10 10 EDCE COC[C@@H](CC(=O)N1CC[C@@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1985096978 ZHMGHSLJGNXNRE-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1 1987692516 LRVYXEHSBPRJQA-GHMZBOCLSA-N 325.369 1.339 10 10 EDCE NS(=O)(=O)CCCCNCc1cc(Cl)cc(Cl)c1O 312058384 BHZVVMIXXCIEIJ-UHFFFAOYSA-N 327.233 1.857 10 10 EDCE CCNCc1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2160717290 RKJIWZVBRAZGGQ-KAOXEZKKSA-N 341.249 1.489 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N3C[C@@H](O)[C@@H]3C)c(Br)cc21 2182523005 JMUPSLVPABZBNA-YLJLNXRRSA-N 340.221 1.621 10 10 EDCE CNCc1ccc(N2CC[C@@](C)(O)[C@@](C)(O)C2)cc1Br 2194611555 UJJUVQUGXMEBFO-CABCVRRESA-N 343.265 1.881 10 10 EDCE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(C(=O)Cc2ccc(N)cc2)C1 2044641642 MXSQNQRNCBFMIR-GXFFZTMASA-N 343.349 1.727 10 10 EDCE CN[C@H](C)c1ccc(N2CC(CNC(N)=O)C2)c(Br)c1 2187292052 FZZRZDMNJAMQBQ-SECBINFHSA-N 341.253 1.834 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C[C@@H](O)CN2CCc2ccc(N)cc2)C1 2066539209 HXDMPFVEHDVWDK-MRXNPFEDSA-N 347.459 1.867 10 10 EDCE CCS(=O)(=O)NC1CN(c2ccc(CN)c(Br)c2)C1 2109344868 SZJAVFDPAFXGBS-UHFFFAOYSA-N 348.266 1.036 10 10 EDCE CN1CCCc2cc(CNC(=O)C=CCN3CCOCC3)ccc21 2296580263 OEOMVBVEDHARTG-UHFFFAOYSA-N 329.444 1.574 10 10 EDCE COC(=O)c1ccc(C=C2SC(N3CCN(C)CC3)=NC2=O)cc1 2297328356 ZTDTZAUIVVAQHA-UHFFFAOYSA-N 345.424 1.691 10 10 EDCE C[C@@H](CNC(=O)C=Cc1ccc(N(C)C)cc1)CN1CCOCC1 2320615727 RYMLPKZVJKBODF-INIZCTEOSA-N 331.460 1.850 10 10 EDCE Cc1noc(CCNC(=O)NCc2ccc3c(c2)CCCN3C)n1 101618664 YOABZLJEYXYVLP-UHFFFAOYSA-N 329.404 1.802 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCSCC2)c1 63760772 MFCYWTBDKDXWMA-UHFFFAOYSA-N 330.431 1.343 10 10 EDCE O=C(NCCCN1CCOC1=O)NCc1ccc(N2CCCC2)cc1 77516072 WJPFAAGXTBDXIB-UHFFFAOYSA-N 346.431 1.928 10 10 EDCE CNC(=O)[C@H](C)CN(C)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 255710170 HHQFZLMLFZSRPC-BPOWMSRESA-N 335.360 1.599 10 10 EDCE CC1(N2CCOCC2)CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 530104398 JPIFFCHERODDPU-QGZVFWFLSA-N 348.443 1.505 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@]3(CNC(=O)C3)C2)c([N+](=O)[O-])c1 279227524 ZPXKRRDNBCWCGX-RCFWFJCLSA-N 345.355 1.497 10 10 EDCE CN(C)c1ccc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)cc1 285491495 DQULIKCNUDJGSS-INIZCTEOSA-N 325.478 1.608 10 10 EDCE CC1(C)OCC[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 296238144 OHMKDJKTILXGDC-GFCCVEGCSA-N 328.390 1.061 10 10 EDCE CCn1nnc(C)c1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 294282849 BNAITTAXNRPUAK-UHFFFAOYSA-N 347.394 1.512 10 10 EDCE COc1cc(I)cc([C@@H]2CNCCN2)c1O 390057550 PNYGIKFTUZDDMT-VIFPVBQESA-N 334.157 1.239 10 10 EDCE Cc1cc(Cl)cc(CN(C)[C@@H]2CCN(S(C)(=O)=O)C2)c1O 292746320 HZRIVGGRMMRIRT-CYBMUJFWSA-N 332.853 1.820 10 10 EDCE Oc1cccc(Br)c1CN1CC[C@@]2(CNCCO2)C1 719944470 DGUQXHIKRIJWKP-CQSZACIVSA-N 327.222 1.719 10 10 EDCE C[C@@H]1CCNC[C@@H]1NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 817888266 CHNBPEFIWAZDTI-HFTRVMKXSA-N 330.476 1.476 10 10 EDCE CN(C[C@@H]1CCCO1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823542840 LTSPIPOXOROQEA-SFHVURJKSA-N 347.459 1.968 10 10 EDCE CO[C@@H](CS(=O)(=O)N(C)Cc1ccccc1O)C1CCOCC1 827187495 DHXHJBFBINEJAQ-INIZCTEOSA-N 343.445 1.595 10 10 EDCE CN1CCN(c2ccc(CNC[C@@H]3CCCCN3CCO)cc2)CC1 824582587 ATQAXBJCCSMJGV-FQEVSTJZSA-N 346.519 1.375 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCN(C(C)(C)C(N)=O)CC2)cc1 835026366 RWOJYXIDFBTXAS-WAYWQWQTSA-N 330.476 1.647 10 10 EDCE Cc1cc(N2CC[C@H](N3CCCc4cc(CN)ccc43)C2=O)n(C)n1 844219217 IWBMFBDCISJINK-KRWDZBQOSA-N 339.443 1.745 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CCCOC3)C2)cc1 851996422 PYNOAOQUBPLMRD-CABCVRRESA-N 333.432 2.000 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCn3cc(C)cn3)C2)cc1 855231993 ZOLZFAAWJMPZAK-OAHLLOKOSA-N 328.416 1.985 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C2)cc1 855232537 RSDRZVOWIZJBTC-KBPBESRZSA-N 347.459 1.941 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC[C@@]3(O)CCOC3)C2)cc1 852396683 BWLGWPWEQCIEHE-KBXCAEBGSA-N 349.431 1.115 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)COCc2ccnc(O)c2)c1 860241237 GXGQUFUYXAOGPT-LLVKDONJSA-N 332.356 1.895 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 875508158 VDMUVYUYINLDAU-XNRPHZJLSA-N 349.431 1.691 10 10 EDCE C[C@H]1CC[C@@H](C(N)=O)CN1Cc1ccc(N2CCN(C)CC2)cc1 775648846 GRBJSWKBZKLUHE-DOTOQJQBSA-N 330.476 1.524 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1cccc(N2CCOCC2)n1 1155069606 JXRISSVECDCZAS-UHFFFAOYSA-N 343.383 1.188 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H]2CCN(C)C2)cc1C 1319284822 XCICGDYPXYFVPE-WMLDXEAASA-N 333.476 1.797 10 10 EDCE Cc1ccc(-c2nn3cnnc3n(Cc3ccc(N)cc3)c2=O)cc1 82719393 PBJCKTVGEZQWIJ-UHFFFAOYSA-N 332.367 1.892 10 10 EDCE COC[C@H](C)N(C)C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1322304946 AXROQZPMKOLXPB-NEPJUHHUSA-N 335.408 1.934 10 10 EDCE COC(=O)[C@@H]1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 1337001523 UKMOGUGXIJPAKG-OAHLLOKOSA-N 335.423 1.572 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C)OCC[C@H]3C)nc12 1198761066 CWIGNGBCDUHLNM-VXGBXAGGSA-N 348.403 1.611 10 10 EDCE CCn1nncc1C(=O)NC[C@H](C)NCc1ccc(OC)c(C)c1 1266935045 FVFMCUISFVSTIR-ZDUSSCGKSA-N 331.420 1.523 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2nonc2C)cc1C 1268964239 KRBCSEWGYJVAAI-UHFFFAOYSA-N 332.404 1.947 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)CCN(C)C 1298695349 XZZUWUUCONMNLV-LLVKDONJSA-N 348.407 1.035 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)C1CCCC1)C(=O)NCc1ccc(N(C)C)cc1 1463728547 WABDACBRAQMHLQ-CXAGYDPISA-N 347.459 1.425 10 10 EDCE CO[C@H](C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1703164625 AQPHTPQJBXOQCI-ZDUSSCGKSA-N 347.375 1.120 10 10 EDCE COCCCN[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1C 1484909174 IPCYJVNQYVTRSS-SWLSCSKDSA-N 347.419 1.936 10 10 EDCE CC[C@H](C)C(=O)N[C@@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1715967328 IPCFYFXJNMQGTO-STQMWFEESA-N 346.435 1.311 10 10 EDCE COc1cc(C(=O)N[C@H](C)CCNC(=O)[C@H]2CC2(C)C)cc(OC)n1 1495501788 KOBSYFHROBCYRR-DGCLKSJQSA-N 349.431 1.770 10 10 EDCE C[C@@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C[C@@H]1O 1565126919 GGVBVFLGNSNNTI-KDOFPFPSSA-N 347.459 1.560 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CCCN1Cc1ccccn1 1647270715 XUHZMVUWZUETRH-HNNXBMFYSA-N 327.384 1.774 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ncccc2F)cc1C 1732663880 QBJFKHMMZWUMKA-AWEZNQCLSA-N 347.390 1.418 10 10 EDCE O=C1CCCN1C[C@H]1CCCCN1C(=O)Cc1ccc(O)c(O)c1 1643571309 GLOGMZPUVIGXSR-CQSZACIVSA-N 332.400 1.644 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@@H](CC(C)C)NC(C)=O)cc1 1732459062 MFKLVMXEQAZUTO-CQSZACIVSA-N 346.435 1.311 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)[C@H](C)NC(N)=O)C2)cc1C 1656194700 MQIWTZURIFKWAW-QEJZJMRPSA-N 348.447 1.045 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC[C@@H](C)C3)CC2)c(OC)c1 1586630413 KFYDOZLBFBEQFE-OAHLLOKOSA-N 347.459 1.694 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)N1CC[C@H](N=[N+]=[N-])C1 1912165137 GYMDTCHIKFSMLU-LURJTMIESA-N 335.187 1.256 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C2(N(C)C)CCC2)cc1C 1667836702 GCRXMKFHMQEVLO-INIZCTEOSA-N 349.475 1.055 10 10 EDCE C[C@@H](O)c1ccc(N2CC(CNC(N)=O)C2)cc1Br 2130741839 GXMHGQOMAJXEEP-MRVPVSSYSA-N 328.210 1.607 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)CN1CC(NC(=O)OC(C)(C)C)C1 1900612861 PCBFXVYOBIEIOL-UHFFFAOYSA-N 326.401 1.354 10 10 EDCE CC(C)(C)OC(=O)NCCNS(=O)(=O)Cc1ccc(N)cc1 230013941 KYLZUAAXWUUVJB-UHFFFAOYSA-N 329.422 1.213 10 10 EDCE CCCNCc1ccc(N2C[C@H](O)[C@@H](O)C2)cc1Br 233113914 YSMAWUCRSOSVMS-KBPBESRZSA-N 329.238 1.491 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1COC[C@H]1NCc1cccc(O)c1O 1948520439 VDDNYRFAJCGHID-QWHCGFSZSA-N 338.404 1.727 10 10 EDCE CO[C@H](C(=O)O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951836394 YSPUVPDEDOQVML-GWCFXTLKSA-N 341.360 1.633 10 10 EDCE CC(C)(C)OC(=O)N1[C@@H](C(=O)NCCN=[N+]=[N-])COCC1(C)C 1985094002 IMPVSKBUGFXDGM-SNVBAGLBSA-N 327.385 1.827 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1COCC[C@@H]1NC(=O)OC(C)(C)C 1985103669 YVABTXPKPHYHCX-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE C[C@H](NC[C@@H](O)CNC(=O)OC(C)(C)C)c1c(O)cccc1O 1985776543 YKQNICVUWGONOY-WDEREUQCSA-N 326.393 1.634 10 10 EDCE CN(C)c1ccc([C@H](O)[C@@H](N)c2c(Br)cnn2C)cc1 2148331178 NVQUHUBLSJYYSM-JSGCOSHPSA-N 339.237 1.982 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1Nc1c(N)cccc1C(=O)O 2000872808 ZCGZOPZJMRJGRF-NEPJUHHUSA-N 337.376 1.671 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CCO[C@@]2(C(=O)NCCCN=[N+]=[N-])C1 2010392644 HWYJFVOAYOJVPA-NHYWBVRUSA-N 339.396 1.829 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2010390007 XIPBZDBSSOJXKK-LLVKDONJSA-N 339.396 1.924 10 10 EDCE CN1C(=O)N[C@@H]2CN(c3ccc(CO)c(Br)c3)CC[C@@H]21 2171297997 SZWMSDPIKDSVCG-OLZOCXBDSA-N 340.221 1.544 10 10 EDCE C[C@@H]1C[C@@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 705162234 ULSTUDONQMROKB-BFHDXFOESA-N 341.205 1.784 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C[C@H]1CO 708575230 BMPFGMYPAIFJBX-UJVNDKKSSA-N 341.205 1.499 10 10 EDCE CO[C@H](C)CN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 387954162 NEOMXADIUWJUHS-JMCQJSRRSA-N 328.210 1.872 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@@H](CO)C2)c(Br)c1 396818446 XJUWDUQXOKNMMY-GLXFQSAKSA-N 329.238 1.648 10 10 EDCE CS(=O)(=O)c1cnn(Cc2ccc(Br)cc2O)c1O 2070259362 BGKGQKBITNGXGY-UHFFFAOYSA-N 347.190 1.509 10 10 EDCE C[C@H](NCc1c(Br)nnn1C)c1ccc(O)cc1O 2089351725 DLBFNFPSHBZRMG-ZETCQYMHSA-N 327.182 1.840 10 10 EDCE NCc1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)c(Br)c1 2093495607 KNTKNHMTYAKXHG-VXGBXAGGSA-N 329.238 1.335 10 10 EDCE C[C@@]1(CCO)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2205509203 FIBYIANWPKVGRD-JSGCOSHPSA-N 340.221 1.752 10 10 EDCE COc1ccc(N2CCN(C(=O)C=Cc3cnc(=N)[nH]c3)CC2)cc1 2297629644 CJBUZNATMZNUPQ-UHFFFAOYSA-N 339.399 1.260 10 10 EDCE C[C@@H]1C(=O)NCCCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2311330413 LSGOPWIMPIWSIN-OAHLLOKOSA-N 343.427 1.273 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(Br)c1 2355338500 BVUPWACLWUUMEU-KBZKQINZSA-N 342.233 1.823 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)N[C@H]2CCCn3ncnc32)c1 177321827 PPWNVZILSDNHNK-MFKMUULPSA-N 331.376 1.888 10 10 EDCE CC(C)N(CC(N)=O)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255013432 LLGUMDOTSHRJLB-YVMONPNESA-N 331.416 1.259 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@@](C)(C(N)=O)C2)c([N+](=O)[O-])c1 280317334 STGUZBRKADFLAB-MQDFFIGUSA-N 333.344 1.483 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(C)COCCN2)c(O)c1Br 2380754443 QHPMUKGBONAEMT-CQSZACIVSA-N 343.221 1.458 10 10 EDCE Cc1ccc(CN2C[C@H]3COC[C@@H](C2)[C@H]3O)c(O)c1Br 2380803736 IVSBXYWHCGEEAJ-DABQJJPHSA-N 342.233 1.902 10 10 EDCE Cc1ccc(CN2CCN([C@H](C)CN)CC2)c(O)c1Br 2381126841 CBUPCABABNFSSN-GFCCVEGCSA-N 342.281 1.928 10 10 EDCE CC(=O)C(=O)COC(=O)CCNC(=O)c1ccc2ccccc2c1 808500307 IRYURWCTEGBBNC-UHFFFAOYSA-N 327.336 1.661 10 10 EDCE CC(C)N(C[C@@H](C)O)C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 807670736 HPUYEWAYUAFKBH-ZIAGYGMSSA-N 335.448 1.548 10 10 EDCE CC(C)C[C@@H]1CN(C)CCN1Cc1cc(O)n2ncc(C(=O)O)c2n1 903942488 CMILFWGJGQQWCI-CYBMUJFWSA-N 347.419 1.295 10 10 EDCE Cc1cc(C)n([C@H](C)C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)n1 844163294 XQSCEFNSLCBLQU-PBHICJAKSA-N 329.448 1.943 10 10 EDCE C[C@@H]1CCNC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 842214341 PJGYSCFVRDYDKM-RHSMWYFYSA-N 344.459 1.017 10 10 EDCE Cn1[nH]c([C@@H]2CCCN2C(=O)/C=C/c2ccc(O)c(O)c2)nc1=N 846067888 LKHDNCIMDFXHGK-ZRQQLDRUSA-N 329.360 1.016 10 10 EDCE Nc1ccc(CCNC(=O)NCCCNC(=O)c2ccccc2)cc1 841772750 BNQOARFCPDOUKY-UHFFFAOYSA-N 340.427 1.931 10 10 EDCE CCOCc1cc(CN[C@H](C(=O)O)c2cnn(C)c2)ccc1OC 841807305 QBXMOUCRBLKZBF-INIZCTEOSA-N 333.388 1.881 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)C[C@@H]2COCCO2)c([N+](=O)[O-])c1 853829952 PHHNSPXROZUTCV-DIECRNLCSA-N 336.344 1.633 10 10 EDCE C[C@@H](N[C@H]1CCN(C2CCOCC2)C1=O)c1cc([N+](=O)[O-])ccc1O 756735395 BIPZVWNOICDZCQ-ABAIWWIYSA-N 349.387 1.731 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@H]2COC[C@H]2C1 852669122 MMWJPEZVWKGCSI-IAGOWNOFSA-N 331.460 1.679 10 10 EDCE O=S1(=O)CCC(CCNCc2cc3c(cc2O)OCO3)CC1 768649942 BGBZJHPNCYCNSX-UHFFFAOYSA-N 327.402 1.425 10 10 EDCE CC1(C)SC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1117407204 MCCDCZDTSRNFSR-HNNXBMFYSA-N 345.468 1.689 10 10 EDCE OCC[C@H]1CSCCN1Cc1ccc(N2CCOCC2)c(F)c1 770305733 KDHAATLLNRVFFR-HNNXBMFYSA-N 340.464 1.962 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cccn4nnnc34)C2)cc1 898580586 MDVPSUDOJDMNII-GFCCVEGCSA-N 338.371 1.142 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCO[C@@H]1C(=O)NCCCN=[N+]=[N-] 1895875392 JCBRVFQEKOMVOH-QWRGUYRKSA-N 327.385 1.733 10 10 EDCE Cc1ccc(C(=O)NCC(=O)NCc2ccc(O)cc2O)cc1C 1162271325 AQPBWGSFIWLACG-UHFFFAOYSA-N 328.368 1.761 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc(N2CCNC2=O)ccc1F 1176747916 FJWBCAJVDKVZHS-UHFFFAOYSA-N 345.330 1.697 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2scnc2C)cc1C 1331684164 OIJKNCOOHHGTCM-AWEZNQCLSA-N 349.456 1.649 10 10 EDCE CO[C@@H](C)C(=O)NC[C@@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1505632105 FEQLPKSLRVRNJL-GWCFXTLKSA-N 347.375 1.215 10 10 EDCE COC(=O)NCC(=O)N1C[C@@H](NCc2ccc(OC)c(C)c2)C[C@@H]1C 1700830509 LRAISQAMYPGOAC-ZFWWWQNUSA-N 349.431 1.439 10 10 EDCE CO[C@@H](C)C(=O)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1722079247 GHSRMCRWCPZCBW-JTQLQIEISA-N 347.375 1.263 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2ccncc2)cc(OC)n1 1720893852 DZBAYKULIIOZJC-LLVKDONJSA-N 344.371 1.042 10 10 EDCE C[C@@H]1CCN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C[C@H]1O 1638917649 JKEBJJNHSVGCDJ-FHLIZLRMSA-N 348.491 1.768 10 10 EDCE CCC(=O)N[C@@H](C)C(=O)N(C)C[C@H](C)NCc1ccc(OC)c(C)c1 1734326442 GKOVKQQWBUXEIB-GJZGRUSLSA-N 349.475 1.855 10 10 EDCE CC[C@H]1CN(C(C)=O)[C@H](CC)CN1C(=O)Cc1ccc(O)c(O)c1 1587395187 UOYKHRHJFMOHRW-CABCVRRESA-N 334.416 1.888 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)[C@@H]1CCC[C@H]1O 1597780548 IIQWVXPKUWFYML-QZTJIDSGSA-N 333.476 1.946 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2ccco2)cc1C 1677052714 WMHYKNRYWNAPRW-OAHLLOKOSA-N 332.400 1.819 10 10 EDCE CCOC(=O)[C@H]1[C@H](c2ccccc2O)NC(=O)N[C@]1(O)C(F)(F)F 5592778 DMBBIGPNGBWBPX-GBIKHYSHSA-N 348.277 1.176 10 10 EDCE Cc1noc([C@H](C)N2CCN(Cc3cc4c(cc3O)OCO4)CC2)n1 152647640 CDMYZPRUXBLONW-NSHDSACASA-N 346.387 1.691 10 10 EDCE O=C1COc2ccc(N3CCNCC3)cc2N1CCN1CCCCC1 31947292 ORGYORKVDNJTOI-UHFFFAOYSA-N 344.459 1.308 10 10 EDCE Cc1cc(=O)c(O[C@@H](C)C(=O)O)cn1CCOc1ccc(N)cc1 1857917052 ZQZKAZWREHSUDW-LBPRGKRZSA-N 332.356 1.670 10 10 EDCE CON1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)CC1 1915777122 RZGROADTCOUTRG-LBPRGKRZSA-N 341.209 1.084 10 10 EDCE COC[C@@H](N)C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952117505 AVYXUJZCFMWINQ-QWHCGFSZSA-N 340.420 1.897 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COCC[C@H]1C(=O)NCCCN=[N+]=[N-] 1985100817 JHPIGSWWFHWQBH-MNOVXSKESA-N 327.385 1.733 10 10 EDCE C[C@H](NC[C@@H](O)CNC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985775305 GXFBTZMFWOKHKT-CMPLNLGQSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]1CNC(=O)c1ccc(O)c(O)c1 2006292281 YWABXVDYDGRXRA-VXGBXAGGSA-N 336.388 1.988 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@]1(C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010398870 WVAYHOOGPUIJKO-RWSFTLGLSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2012309331 KVTKTXPXXQSGFP-VTWZXRTESA-N 339.396 1.706 10 10 EDCE C[C@H](O)c1ccc(N2CC(S(C)(=O)=O)C2)c(Br)c1 2034834742 YHSNOBYGZOMJPF-QMMMGPOBSA-N 334.235 1.736 10 10 EDCE CN1CCO[C@@H]2CCN(c3ccc(CO)c(Br)c3)C[C@H]21 2185530522 UTSHGMWPKOYSDV-HUUCEWRRSA-N 341.249 1.851 10 10 EDCE NCc1ccc(N2CCc3nnc(O)cc3C2)cc1Br 2206098791 LGYAZABENVSPSU-UHFFFAOYSA-N 335.205 1.966 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3COC[C@@]3(CO)C2)cc1Br 2234546822 CCSYKJBMRJVFOC-HFAKWTLXSA-N 341.249 1.914 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](OC)C[C@@H]2CN)c1O 2236053051 OPMVSEVORNJXBM-NXEZZACHSA-N 345.237 1.711 10 10 EDCE OCc1ccc(N2C[C@H]3COC[C@]3(CO)C2)c(Br)c1 2226174107 ISXLVEZAAKMJPF-SMDDNHRTSA-N 328.206 1.387 10 10 EDCE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=Cc1ccc2c(c1)OCO2 2296390088 JUNFNNULXMKDRD-UHFFFAOYSA-N 340.291 1.670 10 10 EDCE O=C(O)[C@H]1CCOCCN1Cc1cc(Br)cc(F)c1O 2285385672 FCFZSRUKDZPHTM-LLVKDONJSA-N 348.168 1.969 10 10 EDCE CO[C@@H]1COCCN(c2cc(Br)c(CN)cc2F)C1 2351577152 AHJIDXJXAWEUKX-JTQLQIEISA-N 333.201 1.899 10 10 EDCE COc1ccc(N2CCOCC2)cc1NC(=O)NC1CCOCC1 62274242 PPYBSQIWLKRHBU-UHFFFAOYSA-N 335.404 1.832 10 10 EDCE CN1C2(CCC2)COC[C@]1(CO)CNCc1c(O)cccc1Cl 527753994 NBTKMFZDDPGVPN-QGZVFWFLSA-N 340.851 1.751 10 10 EDCE Cc1cc(C(=O)N2CC[C@@]3(CNC(=O)C3)C2)c(C)n1-c1ccccn1 279449499 DIKQPEGRUUVTEU-LJQANCHMSA-N 338.411 1.841 10 10 EDCE CN(C[C@@H]1CCCO1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 285818478 XPAPUZJLGBCHPA-INIZCTEOSA-N 345.443 1.323 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@@H]2CCc3nc[nH]c3C2)cc1F 378072528 RTLUGSULMLJMRM-GFCCVEGCSA-N 331.395 1.972 10 10 EDCE NCc1ccc(N2CC3(CCOCC3)[C@@H]2CO)cc1Br 2381034371 OPSSQWYZFVKRIU-AWEZNQCLSA-N 341.249 1.886 10 10 EDCE COc1ccc(CNC(=O)[C@H]2CCc3nnc(C4CC4)n3C2)c(O)c1 816550052 GZWKSEDGDNOZGF-ZDUSSCGKSA-N 342.399 1.749 10 10 EDCE CC(C)(C)[N+](=O)/C=C1/C=CC(=S(=O)(O)O)C=C1S(=O)(=O)O 585662105 DRHPEMDVOOORBG-FPLPWBNLSA-O 338.383 1.192 10 10 EDCE CCOCCN1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)C[C@@H]1C 588407995 NBRDCUJDRJDXKL-VSKVDJIOSA-N 334.416 1.680 10 10 EDCE CCN(C)c1ccc(Cn2cc(CN3CCC(N)CC3)nn2)cc1 905802387 XLVLBMWDNRYVFT-UHFFFAOYSA-N 328.464 1.706 10 10 EDCE CC[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCN1C[C@@H](C)O 588406568 DKMFXTAGDICOQI-BBUPELFUSA-N 334.416 1.415 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](CO)[C@H]3CC)nc12 830715128 VTRYBRHDARAUTN-SMDDNHRTSA-N 348.403 1.204 10 10 EDCE CNS(=O)(=O)[C@H]1CCCN(C/C=C/c2ccc(N(C)C)cc2)C1 835028134 JSGZCLLLFJDTLB-YXMMZVCTSA-N 337.489 1.779 10 10 EDCE Nc1ccc(NC(=O)N2CC(S(=O)(=O)NC3CCCC3)C2)cc1 841296556 VFMDWHMRFHBIDF-UHFFFAOYSA-N 338.433 1.347 10 10 EDCE C[C@H]1CNCC[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 841730714 VBDIDCAQZJPSIT-WMLDXEAASA-N 332.448 1.320 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](C)[C@@](C)(CO)C3)C2)cc1 854296988 MGQNBZPAXZVJNN-ZRGWGRIASA-N 347.459 1.934 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CCN(C)[C@@H]3C)C2)cc1 922950293 HEOXYNJQEOFYAT-IIDMSEBBSA-N 346.475 1.913 10 10 EDCE C[C@@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1cc(F)ccc1O 858489027 QESVOUWYZTXGTJ-DGCLKSJQSA-N 342.378 1.899 10 10 EDCE CC(C)[C@H](N)CCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 851687002 XAWMNPZCGFIJJZ-QGZVFWFLSA-N 346.475 1.393 10 10 EDCE COc1cc(N2CCN(c3nccnc3F)CC2)cc(OC)c1OC 858480958 GGWUZAPGSAQOOI-UHFFFAOYSA-N 348.378 1.968 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@H]3CCOC[C@@H]3OC)C2)cc1 855226232 OKMHNOWABNHCQH-VKJFTORMSA-N 348.443 1.832 10 10 EDCE CN(C)c1nc(O)cc(C(=O)NCc2ccc(N(C)C)c(F)c2)n1 765275688 BROVZHZASLUDMR-UHFFFAOYSA-N 333.367 1.383 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1[C@H]2OCCC[C@@H]21 779855932 DHOMXYLRMPHAPL-XYPHTWIQSA-N 334.391 1.704 10 10 EDCE C[C@H](CNS(=O)(=O)Cc1ccc(N)cc1)CC1(C)OCCO1 1876529904 USMVMCPWGSDQQG-LBPRGKRZSA-N 328.434 1.477 10 10 EDCE NS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C/c1cncc(O)c1)CC2 779666922 POYDZQOATBBETM-DAFODLJHSA-N 345.380 1.037 10 10 EDCE COC(=O)C[C@@H]1CC[C@H](NC(=O)NCc2cccc(OC)c2O)C1 899115964 HIKAMWKIWSVQBZ-YPMHNXCESA-N 336.388 1.932 10 10 EDCE COc1cc(/C=C2/C(=O)NC(=O)N(C)C2=O)ccc1OCC(C)C 1084064647 AHVNNCBBKDSNSI-GHXNOFRVSA-N 332.356 1.822 10 10 EDCE Cc1nc(O)[nH]c1C(=O)NCc1cccc(Br)c1O 1156792713 OGDZSJSFUPXXSL-UHFFFAOYSA-N 326.150 1.822 10 10 EDCE CC1(C)C[C@@H](NC(=O)Cc2ccc(O)c(O)c2)CCS1(=O)=O 1179551286 DXJSPOQKZTXHNJ-NSHDSACASA-N 327.402 1.112 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@](C)(C(=O)NCCCN=[N+]=[N-])C1 1964881615 ZJDOQZQJZMIYCN-AWEZNQCLSA-N 327.385 1.829 10 10 EDCE CCC(CC)[C@@H](C(=O)NCc1cccc(O)c1O)N1CCOCC1 1263894657 PVZJQIDJKLFAJD-INIZCTEOSA-N 336.432 1.851 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2CCN(C)C2)cc1C 1267157280 LEGMIMJQDLKXLJ-NVXWUHKLSA-N 333.476 1.940 10 10 EDCE CO[C@@H](C)C(=O)N(C)C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1280987821 ZJLRHTHWBGSHGR-MNOVXSKESA-N 349.391 1.461 10 10 EDCE C[C@@]1(NCc2ccc(Br)cc2O)CCC(=O)NC1=O 2116204796 FLXAJXAZDYBYFC-CYBMUJFWSA-N 327.178 1.440 10 10 EDCE CO[C@@H](C(=O)NCCc1ccc(O)c(O)c1)C(=O)OC(C)(C)C 1465981992 VZROPSGYTVLMMR-ZDUSSCGKSA-N 325.361 1.113 10 10 EDCE CN(C)C[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)c2ccccc2O1 1545762060 BZYDKVDSNCRGHX-AWEZNQCLSA-N 342.395 1.996 10 10 EDCE CC[C@@H](C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)C 1703236083 SLELNDRYBQMTQK-ZDUSSCGKSA-N 348.407 1.035 10 10 EDCE Cc1nccn1-c1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cn1 1626266047 GKPVALMBJAXVDJ-UHFFFAOYSA-N 338.367 1.846 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)c2cnc(O)n2C)cc1C 1725132754 MIJLONXZWSJIHD-CHWSQXEVSA-N 346.431 1.739 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)c2ccc(C)o2)cc(OC)n1 1494586179 XBGSLCNWOFLZLY-JTQLQIEISA-N 347.371 1.549 10 10 EDCE CC(C)[C@@H](C(=O)NCc1c(O)cccc1O)N1C[C@H](C)O[C@H](C)C1 1635843301 LGIBOJJCMZPOKA-AHIWAGSCSA-N 336.432 1.848 10 10 EDCE CC(C)C(=O)NC[C@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1572478553 DOEGXFWBICWLED-ZDUSSCGKSA-N 349.391 1.054 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@]2(C)CCC(=O)N2)cc1C 1669027347 PTMDAYKLXNFZMU-PXPVJAHISA-N 345.443 1.434 10 10 EDCE COCCNC(=O)/C(=C/c1ccc(N(C)C)cc1)n1ccccc1=O 6247451 ZRJUGXXMRQUZTH-VKAVYKQESA-N 341.411 1.675 10 10 EDCE C[C@H](O)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccccc2F)SC1=S 1858592706 VBKZOPISJXSHJH-OMOYZJFYSA-N 341.385 1.861 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)C(C)(C)C(=O)O)c2nccn2C)cc1 1865994990 SYTYQOMOZHXHNT-CQSZACIVSA-N 344.415 1.803 10 10 EDCE C[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 1914411346 LTJLYRWAMZQEJR-JPWUCKPDSA-N 327.178 1.394 10 10 EDCE C[C@H](CCO)N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 1917039459 ITOHOYWGBZAYOV-JMCQJSRRSA-N 328.210 1.608 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CN[C@H]2CCc3cccc(O)c32)C1 1918657239 GZWAFUNJQYXJPE-ZDUSSCGKSA-N 334.416 1.951 10 10 EDCE CN(C)[C@H]1COC[C@H]1CNCc1cccc(Br)c1O 1924701051 AYAJSBKJYCQMIQ-YPMHNXCESA-N 329.238 1.821 10 10 EDCE CNCc1ccc(N2CC[C@@H]3CC(=O)N[C@H]3C2)cc1Br 2145056390 ZUWFLURCNQNPAX-YGRLFVJLSA-N 338.249 1.883 10 10 EDCE COC(C)(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC(N=[N+]=[N-])C1 1985094328 NHNICWYINVDBPQ-JTQLQIEISA-N 327.385 1.826 10 10 EDCE Cn1cc([C@@H](NC(=O)OC(C)(C)C)[C@H](N)c2ccccc2O)nn1 2001804803 TZJWRVUGSVXHBY-ZIAGYGMSSA-N 333.392 1.787 10 10 EDCE CC(C)(C)OC(=O)NC/C=C/C(=O)NCCc1ccc(O)c(O)c1 2010140622 RAHZMVFFXQWTCG-SNAWJCMRSA-N 336.388 1.837 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010393519 TVIYHSYECQLZRS-QJPTWQEYSA-N 339.396 1.780 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1ccc2c(c1)N(C)C(=O)[C@@H]2N 2034784357 WVDROZBRLHFPNA-GOSISDBHSA-N 338.411 1.415 10 10 EDCE COc1ccc([C@H](NCCN=[N+]=[N-])C(N)=O)c(Br)c1 311357159 PODIRRNGNSJDOJ-JTQLQIEISA-N 328.170 1.884 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H](C)C(=O)N3CCCC[C@H]3C)c2n1 2063448485 PGONSOIEHVYRSZ-VXGBXAGGSA-N 345.403 1.263 10 10 EDCE CN(C)C(=O)c1cn(Cc2ccc(Br)cc2O)nc1O 2070599212 VPNAKURFLYARRS-UHFFFAOYSA-N 340.177 1.807 10 10 EDCE OC[C@@]1(NCc2c(O)cccc2Br)C[C@H](O)C12CCC2 2193966853 MQBCQCMBFZCFSF-ZFWWWQNUSA-N 342.233 1.910 10 10 EDCE C[C@H]1[C@H](NC(=O)C(F)(F)F)CCCN1C(=O)c1cccc(O)c1O 2054399252 MYPUUWBREHUMLY-WCBMZHEXSA-N 346.305 1.769 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H]2CN3C(N)=O)c(Br)c1 2192280875 CANRIOXZVAWEJM-WDEREUQCSA-N 339.237 1.510 10 10 EDCE O=C(c1cc(O)c(O)c(O)c1)N1CC2(CN(Cc3ccccc3)C2)C1 2068565216 AGYDBULITXLMBP-UHFFFAOYSA-N 340.379 1.761 10 10 EDCE CNCc1ccc(N2C[C@H](N(C)C)[C@H](O)C2)cc1Br 2089922013 FRWUMZXKVMXWMG-UONOGXRCSA-N 328.254 1.280 10 10 EDCE C[C@@]1(CO)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2097247571 OEELVQRLUPBKFP-AAEUAGOBSA-N 327.178 1.396 10 10 EDCE COC[C@@H]1[C@H](O)[C@@H](O)CN1c1ccc([C@H](C)O)c(Br)c1 2233867095 VVDZOTJRIPQUNQ-ISTUKMMPSA-N 346.221 1.059 10 10 EDCE CNCc1ccc(N2CC[C@@H](O)[C@H](O)CC2)c(Br)c1 2269139555 TYZDHCHBLBVIQB-ZIAGYGMSSA-N 329.238 1.491 10 10 EDCE COCCOCC(=O)NCc1ccc(C)c(Br)c1O 2352933371 YHLVTNWZSRHJRE-UHFFFAOYSA-N 332.194 1.742 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)cc1Br 2355334680 RJDMAUDHQFQHBI-GBALPHGKSA-N 341.249 1.489 10 10 EDCE Cc1cc(O)c(O)cc1CCNC(=O)[C@H]1CC(=O)N(C(C)(C)C)C1 170196263 GWKVPDKZLJUANL-ZDUSSCGKSA-N 334.416 1.712 10 10 EDCE COc1ccc(N2CCOCC2)cc1NS(=O)(=O)NC(C)C 62274240 XFSKTMGXQGHDSJ-UHFFFAOYSA-N 329.422 1.187 10 10 EDCE CCCCS(=O)(=O)N1CCN(c2ccc3c(c2)OCCO3)CC1 41380246 JEZVIIQNQYEXLJ-UHFFFAOYSA-N 340.445 1.710 10 10 EDCE CCOc1cccc(CNCC2CN(S(=O)(=O)CC)C2)c1O 190289712 BXJDEABSRJCJAS-UHFFFAOYSA-N 328.434 1.162 10 10 EDCE CCc1ccc(OCC(=O)NCCN2C(=O)CSC2=S)cc1 49756100 DFBLNUGKSGHOQA-UHFFFAOYSA-N 338.454 1.604 10 10 EDCE CC[C@@H](CO)N1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 93739921 VHCVFHQPDYUSJN-ZDUSSCGKSA-N 343.811 1.842 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3C(=O)NC3CC3)CC2)cc1 242806399 FGWFXTNTPNHKCN-DLBZAZTESA-N 343.427 1.259 10 10 EDCE CCOC(=O)C[C@@H](C)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255548063 CKWLQCCHTUBQDG-WUKHSURWSA-N 346.427 1.994 10 10 EDCE C[C@@]1(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCC(=O)NC1 281991641 VUOJGQVQODISEE-GOSISDBHSA-N 349.406 1.195 10 10 EDCE CO[C@@H](C)[C@H](N)CC(=O)NCc1ccc(C)c(Br)c1O 2380747613 WBPPXHSTGNCMRI-GXSJLCMTSA-N 345.237 1.832 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2COCC[C@@H]2N)c(O)c1Br 2380759556 PFFJRKBLDIFUNB-MNOVXSKESA-N 343.221 1.443 10 10 EDCE CSCC[C@@H](O)C(=O)NCc1cc(Br)ccc1O 804740462 HSNMKJWOUCTHRV-LLVKDONJSA-N 334.235 1.885 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H](N)C(C)(C)C1 903750872 WAPIFOOXQJQDIV-INIZCTEOSA-N 347.459 1.717 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@@H](N)C(C)(C)C1 903715112 BBSYNUKEPRXPSR-MRXNPFEDSA-N 346.475 1.297 10 10 EDCE CC(C)N(Cc1ccc(N2CCN(C)CC2)cc1)C[C@@H]1CCC(=O)N1 840975354 GIGCNNDPZRLBAI-SFHVURJKSA-N 344.503 1.927 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@](O)(CO)C1 840485557 URIMAFQKOFZICC-BEFAXECRSA-N 349.475 1.521 10 10 EDCE COc1ccc(N2CCCN(C(=O)N[C@H]3CCNC[C@H]3C)CC2)cc1 841985983 COOZSMBTNAOBCZ-QAPCUYQASA-N 346.475 1.915 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@H](C)[C@@H](O)[C@H](C)C3)C2)cc1 854297130 MYQKKPRGFLDDJG-FSZRXZPDSA-N 347.459 1.932 10 10 EDCE CNc1nnc(CC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)s1 855227997 STZPJVXECADFMQ-LLVKDONJSA-N 347.444 1.526 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)Cn3cncn3)C2)cc1 852061367 RMTIOQGBPWZDFQ-UONOGXRCSA-N 344.419 1.253 10 10 EDCE CO[C@@H](C)c1noc(CN(C)Cc2cc3c(cc2O)OC[C@H]3O)n1 768463665 LCYXLCWUTVWQOT-TVQRCGJNSA-N 335.360 1.540 10 10 EDCE C[C@H](NC(=O)NC[C@@H]1CC[C@H](C(=O)N(C)C)O1)c1ccccc1O 868477638 ZINAGRSKUXPRBX-SLEUVZQESA-N 335.404 1.388 10 10 EDCE CC[C@@H](NC[C@]12COCCN1C(=O)COC2)c1ccc(N(C)C)cc1 866552732 BNTGYPSEIOTJBK-IEBWSBKVSA-N 347.459 1.421 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCNC34CCC4)C2)cc1 861658808 OBVICVMZKDRMRW-PBHICJAKSA-N 344.459 1.858 10 10 EDCE COC[C@H](NC(=O)C(=O)N(C)Cc1ccccc1O)c1ccccc1 1117173519 KDTMCFZYUQGFAY-INIZCTEOSA-N 342.395 1.855 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCC[C@H](C(N)=O)C3)CC2)cc1 786686508 FLUORQSIFXLUJL-GJZGRUSLSA-N 345.443 1.636 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCc2cc(C3CC3)no2)cc1 897361225 BWOOXXAGSBIPMT-UHFFFAOYSA-N 342.399 1.551 10 10 EDCE [N-]=[N+]=NCCNC(=O)C(F)(F)CNC(=O)OCc1ccccc1 1882298087 NAAVGRXGTMQBDF-UHFFFAOYSA-N 327.291 1.975 10 10 EDCE O=C1c2ccccc2C(=O)N1CCS(=O)(=O)Nc1ccc(O)cc1 704001794 MWTGGHITQOVEFY-UHFFFAOYSA-N 346.364 1.430 10 10 EDCE CC1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCC1 1323067514 CRGGMBSJVCQNHV-UHFFFAOYSA-N 345.443 1.446 10 10 EDCE O=S1(=O)CCN(c2ccc(CN[C@@H]3C[C@H]4CC[C@H]3O4)cc2)CC1 1262202363 SJNKLXMEVSGEQM-BRWVUGGUSA-N 336.457 1.331 10 10 EDCE COCC(=O)N1CCC[C@](CO)(NCc2ccc(OC)c(C)c2)C1 1502548200 OHXISHKDLJDLGF-SFHVURJKSA-N 336.432 1.093 10 10 EDCE CN(C)c1ccc(CNC(=O)c2ccnc3[nH]c(O)nc23)cc1F 1442475983 RBYBWLMXRZKOSS-UHFFFAOYSA-N 329.335 1.799 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC(NC(=O)CCC3CC3)C2)cc1 1530400935 DCELNSTZXOISJF-UHFFFAOYSA-N 343.387 1.980 10 10 EDCE O=C(CNC(=O)OCc1ccccc1)NCc1ccc(O)cc1O 1469160938 WRRLVCSJNIKGIV-UHFFFAOYSA-N 330.340 1.640 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)CC(F)(F)F)cc(OC)n1 1704010420 HJLZCMCGXJIFOV-QMMMGPOBSA-N 349.309 1.286 10 10 EDCE CCS(=O)(=O)N(C)CC(=O)NCCCSc1nccs1 1616241443 MQSGFBSZEMMJHF-UHFFFAOYSA-N 337.492 1.023 10 10 EDCE COc1ccc(-n2nnnc2CNCCN(C)C(=O)CC2CC2)cc1 1714680431 PGOQUCFLFUDVPU-UHFFFAOYSA-N 344.419 1.019 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)C23CCN(CC2)C3)cc1C 1714443628 FFEQCJCKMKPTBM-HNNXBMFYSA-N 345.487 1.941 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2cnnn2C)cc1C 1715642209 RYNGGLNXIQMASO-CYBMUJFWSA-N 331.420 1.430 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccsn2)cc1C 1717770249 MUIXJLQHKRDDJB-CYBMUJFWSA-N 335.429 1.341 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1ncnc(O)c1Br 1638357106 OPWCKODLNNESRL-UHFFFAOYSA-N 340.133 1.286 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)C2CC3(CC3)C2)cc1C 1568580176 RIJDSSURQWASIL-MRXNPFEDSA-N 332.444 1.761 10 10 EDCE Cc1c(C(=O)NCc2cccc(Cl)c2O)nnn1-c1ccn(C)n1 1648606533 RWVNNEPVKGPURD-UHFFFAOYSA-N 346.778 1.598 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccc(F)cn2)cc1C 1667814886 XJHORVGTXLGMSM-OAHLLOKOSA-N 347.390 1.418 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H](C)SC)cc1C 1667790557 YFCCQHJQPSRQHE-OCCSQVGLSA-N 326.462 1.322 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)c(Br)c1 2126155919 AVRXTJXJPKRRAT-IOQCUFBNSA-N 328.206 1.119 10 10 EDCE CNC(=O)[C@H]1CCCN1C(=O)NCc1ccc(N2CC=CC2)cc1 158914320 WUWWEIOOHAQZQU-MRXNPFEDSA-N 328.416 1.483 10 10 EDCE CN(C)CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCCCC1 1866207672 DVTPQDOGVXYIGB-SFHVURJKSA-N 332.492 1.957 10 10 EDCE CN1C[C@H](N(C)c2ccc(CO)c(Br)c2)CCC1=O 2131957130 ZFFAINOKNMWZCI-GFCCVEGCSA-N 327.222 1.998 10 10 EDCE CC(C)(C)OC(=O)NCCn1cc([C@H](N)c2ccccc2O)nn1 1942402981 JUJCNSIUXVVLDB-CQSZACIVSA-N 333.392 1.557 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CC(=O)NCCCN=[N+]=[N-])[C@@H](O)C1 1985101606 VBJFPQQNWTTWRH-QWRGUYRKSA-N 327.385 1.421 10 10 EDCE CNCc1ccc(N2CC[C@@H]3C(=O)NC[C@H]3C2)c(Br)c1 2157188838 APOCRGUODUFJAV-RYUDHWBXSA-N 338.249 1.741 10 10 EDCE NS(=O)(=O)CCCCNCc1cc(Br)ccc1O 386272484 XOESVTQBWIOLFU-UHFFFAOYSA-N 337.239 1.313 10 10 EDCE CN(C)[C@@]1(C(=O)Nc2ccc(O)c(O)c2)COc2ccccc2C1 2062537484 QMEIGBMUBMGMFV-GOSISDBHSA-N 328.368 1.972 10 10 EDCE CC1(NC(=O)OC(C)(C)C)CN(c2cc3c(cc2N)OCC(=O)N3)C1 2047094847 CMMIZAUTCUVRJD-UHFFFAOYSA-N 348.403 1.703 10 10 EDCE CN1CCc2cc([C@@H](O)CN3CC(NC(=O)OC(C)(C)C)C3)ccc21 2050171158 RPLKGDMCVHXFKH-KRWDZBQOSA-N 347.459 1.921 10 10 EDCE C[C@@H]1[C@H](NC(=O)C(F)(F)F)CCCN1C(=O)c1ccc(O)c(O)c1 2054399734 VJFSJCDACPLCGO-PSASIEDQSA-N 346.305 1.769 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCCc2ccc(N)cc2)C1 2076780784 GXRVBJYBSDJSQO-SFHVURJKSA-N 349.431 1.299 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1CO[C@H]2COC[C@H]12 2101857804 YXEFPLGRGPHHEJ-WZRBSPASSA-N 328.206 1.906 10 10 EDCE CS(=O)(=O)C[C@@H]1CCN(c2ccc(CN)cc2Br)C1 2087365498 WWYQSMJBXQJYTA-LLVKDONJSA-N 347.278 1.779 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](N(C)C)[C@H](O)C2)c(Br)c1 2089925698 FGOQVWKSNGFUFI-BIGNPOOSSA-N 329.238 1.614 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CCC(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213593368 RMPOPYYWHSEJKM-WOPDTQHZSA-N 341.412 2.000 10 10 EDCE COC[C@@H]1[C@H](O)[C@H](O)CN1c1ccc([C@@H](C)N)c(Br)c1 2234068678 PVLJDVFDKLTYOB-OJICRYGUSA-N 345.237 1.026 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CN(C)C[C@@H]2OC)c1O 2236049219 NRZAESHJKVURRV-AAEUAGOBSA-N 345.237 1.582 10 10 EDCE O=C(NCCc1cc(Br)no1)c1cccc(O)c1O 2228871660 PDUNMPUEUUVSSS-UHFFFAOYSA-N 327.134 1.821 10 10 EDCE CC(C)(C)OC(=O)N1CCn2cnc(C(=O)N3CC(N=[N+]=[N-])C3)c2C1 2258598747 BFRHIHMTNZTBDE-UHFFFAOYSA-N 347.379 1.769 10 10 EDCE O=C(O)c1cc(O)ccc1NC(=O)c1nccnc1Br 2283038573 QRKMRHMEPQKOBG-UHFFFAOYSA-N 338.117 1.895 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@H](O)C[C@@H]2CO)cc1Br 2335170442 XKMGELCTYAXRFF-MVWJERBFSA-N 329.238 1.661 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3CS(=O)(=O)[C@@H]3C2)c(Br)c1 2336465847 MLNBMXFAPSKOJP-GMOODISLSA-N 346.246 1.736 10 10 EDCE COC(=O)N1CC(N[C@H](C)c2ccc(N3CCC(O)CC3)cc2)C1 181462374 UYBDLYRFHZBMLZ-CYBMUJFWSA-N 333.432 1.749 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3C[C@@H](C)[C@@H](O)C3)c(Br)cc21 2367017984 SXZBFVOQDGQIKF-HYJLZEBJSA-N 340.221 1.479 10 10 EDCE OC[C@H](CNCc1ccc(N2CCOCC2)cc1)c1cccnc1 808430698 JFOHVAUIGUUMJF-SFHVURJKSA-N 327.428 1.784 10 10 EDCE C[C@@H](CONC(=O)c1c(F)ccc(O)c1O)NC(=O)OC(C)(C)C 297034170 HLOBJBKONXCSHK-QMMMGPOBSA-N 344.339 1.812 10 10 EDCE CS(=O)(=O)N1CCCC[C@@H]1CNC(=O)NCc1ccccc1O 805834111 DACYEVMNLZNLRU-CYBMUJFWSA-N 341.433 1.006 10 10 EDCE COC(=O)[C@@H](NCc1cc(Cl)c(F)cc1O)c1ccn(C)n1 816588954 GXFLQUXZSXWNQS-ZDUSSCGKSA-N 327.743 1.922 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CNCC[C@@H](C)F)CC2)cc1 819334152 VTSMQSMBDDFUFQ-WBVHZDCISA-N 339.455 1.516 10 10 EDCE CCC(=O)N1CSC[C@@H]1C(=O)N[C@@H](C)c1cc(OC)ccc1O 728978384 FLWCWBXMHPLIAU-GXFFZTMASA-N 338.429 1.890 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CN1C(=O)Cc2ccccc21 831924455 IQZFWFCIIOFDEW-LBPRGKRZSA-N 340.379 1.734 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)c3cnccn3)C2)cc1 912292993 RMRXVYNGGKIEST-UONOGXRCSA-N 326.400 1.984 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(n1)OCCO2 847696645 SLYGDRFVQASGKN-JTQLQIEISA-N 330.340 1.625 10 10 EDCE C[C@H](O)[C@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 840305852 XVVCUAOXWCFYFV-WMLDXEAASA-N 331.416 1.354 10 10 EDCE CC[C@](C)(CO)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 847508055 UHCAHQJDBFSLDF-LJQANCHMSA-N 334.460 1.920 10 10 EDCE NC1(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC2(CCC2)C1 852916487 KIWDAAUVOKUGPN-UHFFFAOYSA-N 343.471 1.926 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC(=O)N(C)C2)c1 860607202 UCAJIAJUNRNQAF-UHFFFAOYSA-N 325.368 1.778 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cc(S(C)(=O)=O)cs2)c1 767796228 PUXSUDQAWGZVBG-UHFFFAOYSA-N 341.410 1.796 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCCS(=O)(=O)C1 862026352 LPHXUHMDEHEHIC-ZDUSSCGKSA-N 334.397 1.381 10 10 EDCE CCCN(C)C[C@@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1119015170 LGJSFOWDVXUUJY-AWEZNQCLSA-N 345.443 1.425 10 10 EDCE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(F)ccc1O 779033426 MVZBQFRFZQUBEE-GBOPCIDUSA-N 337.347 1.456 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@H](C[C@@H]1COCCO1)C(F)(F)F 1123890131 UIGJCSQGLFYZTP-MNOVXSKESA-N 349.305 1.698 10 10 EDCE COc1cc(Cl)cc(CNCC2(S(=O)(=O)N(C)C)CC2)c1O 895811646 HYENBCAZQHTORN-UHFFFAOYSA-N 348.852 1.568 10 10 EDCE O=C(N[C@@H](CO)C1CCOCC1)c1cc2cc(O)c(O)cc2s1 897363595 NCKJNUSGICHCDI-NSHDSACASA-N 337.397 1.830 10 10 EDCE COC(=O)c1c(CN[C@H]2CC(=O)N(C)C2)c2cc(F)ccc2n1C 894210679 FUIFMASQKGVWTQ-NSHDSACASA-N 333.363 1.424 10 10 EDCE Cc1cn2nnc(C(=O)N(C)Cc3ccc(N(C)C)cc3)c2c(O)n1 1135690774 YIWXGEAXFTUFAH-UHFFFAOYSA-N 340.387 1.477 10 10 EDCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@H](C)[S@]1=O 790798906 FAOFQMXGGSWFKW-JRUOFSLYSA-N 339.373 1.271 10 10 EDCE CS(=O)(=O)c1cccc(CNC(=O)Cc2ccc(O)c(O)c2)c1 1140790195 OWTUSHVQTIDBHQ-UHFFFAOYSA-N 335.381 1.360 10 10 EDCE COC(=O)[C@H](CNC(=O)c1cccc(O)c1O)Cc1ccncc1 1144472325 PLPRNUWUXSBAJX-LBPRGKRZSA-N 330.340 1.255 10 10 EDCE C=CC(=O)Nc1ccc(O)c(C(=O)NCc2cccc(O)c2O)c1 1303194830 LCXUSLZOFUNPIB-UHFFFAOYSA-N 328.324 1.858 10 10 EDCE CCOC[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1329799567 YRIBEGDSKQOHAB-ZDUSSCGKSA-N 332.400 1.510 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](CO)[C@@H](CO)C2)c(Br)c1 704796734 NFZWMRTXAGWJQT-YUSALJHKSA-N 329.238 1.506 10 10 EDCE CN(CC[C@H]1CCCCN1C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329810398 KWGLIKIHXVHVJS-OAHLLOKOSA-N 345.443 1.567 10 10 EDCE COc1nsc([C@@H](NCCN=[N+]=[N-])C(N)=O)c1Br 690071199 NNKGHPBTBOQJPX-RXMQYKEDSA-N 335.187 1.341 10 10 EDCE O=S1(=O)CCNC[C@@H]1CCNCc1ccc(N2CCCC2)cc1 1332014881 XQNPCRCJPOIQQQ-KRWDZBQOSA-N 337.489 1.153 10 10 EDCE CC[C@H](CNC(=O)c1ccoc1)NC(=O)c1cc(OC)nc(OC)c1 1356868084 FCBXUMDHIRBTSX-CYBMUJFWSA-N 347.371 1.630 10 10 EDCE O=C1NCCC[C@H]1C(=O)Nc1c(-c2ccccn2)nc2ccccn12 1298830764 ZKSDDRRWYCCWCQ-GFCCVEGCSA-N 335.367 1.861 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](O)CNC/C=C\Cl)cc1 1715610390 DYGDRTDBSZVLMR-GOKHHHTDSA-N 339.783 1.282 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H](C)n2cncn2)cc1C 1482999606 LZKKHTULWMUUFB-MBVDDHJVSA-N 343.431 1.618 10 10 EDCE Cn1ccc(C(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)c1 1491228425 YHIOUQHLJGXRJN-UHFFFAOYSA-N 342.359 1.347 10 10 EDCE CC(C)[S@@](C)(=O)=NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1638932959 LZEABZULWVTOMK-HXUWFJFHSA-N 334.419 1.410 10 10 EDCE CC[C@@H](c1cc(Br)ccc1O)N1C[C@H](O)C[C@H]1CN 2124716488 ZWARYJRLDOVZSF-LOWVWBTDSA-N 329.238 2.000 10 10 EDCE CCC(=O)NCC(=O)N[C@H]1C[C@H](CNCc2ccc(OC)c(C)c2)C1 1571095125 PUKSQJSEBOOIJJ-WKILWMFISA-N 347.459 1.514 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)C2CCNCC2)c2nccn2C)cc1 1865871687 CNOZDVYEYWBPKR-KRWDZBQOSA-N 341.459 1.691 10 10 EDCE Nc1ccc(NC(=O)[C@@H]2C[C@H](O)CN2C(=O)c2ccccc2)cc1 1866198665 GBSWCUHPWOBBJC-HOTGVXAUSA-N 325.368 1.483 10 10 EDCE OCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)c(Br)c1 2132542199 GWYGRBWXKOTKGA-GNXNZQSNSA-N 328.206 1.385 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1NS(=O)(=O)Cc1ccc(N)cc1 1977696668 NPKKYZGEFTVPPG-OLZOCXBDSA-N 341.433 1.354 10 10 EDCE O=C1NC[C@@]2(CCCN(c3ccc(CO)cc3Br)C2)N1 2177667541 AXMYTXCTAGDUEX-CQSZACIVSA-N 340.221 1.593 10 10 EDCE CN1C[C@H](C(=O)NCc2c(O)cc(O)cc2O)[C@@H](C(F)(F)F)C1 2063152148 APFTWZMFORYOBW-UWVGGRQHSA-N 334.294 1.160 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H](n4cccn4)C3)c2n1 2063925130 LDVPZRBXCFKXPO-GFCCVEGCSA-N 326.360 1.417 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)COc2ccc(N)cc2)[C@H]2C[C@@H]21 2044625531 WECUJTYIHUBVQR-GJZGRUSLSA-N 347.415 1.868 10 10 EDCE CN1CC[C@@H]2OCCN(c3ccc(CN)c(Br)c3)[C@@H]2C1 2185498740 YRWUYSOQEXGWIM-CABCVRRESA-N 340.265 1.817 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)c(Br)c1 2102190067 RDRXOLSOWGROBM-OIUVXRBSSA-N 327.222 1.665 10 10 EDCE NC(=O)c1coc(CNCc2c(O)cccc2Br)n1 2104343904 FVVKXKGBRLDOAM-UHFFFAOYSA-N 326.150 1.531 10 10 EDCE CN1CCN(CCC(C)(C)NC(=O)C=Cc2ccc(O)c(O)c2)CC1 2309677621 SIEPOMCNKNDBNK-UHFFFAOYSA-N 347.459 1.643 10 10 EDCE Cc1cc(O)c(CN2CC[C@@H](NS(C)(=O)=O)C2)cc1C(C)C 116870057 UQUIQOOCYUKILI-CQSZACIVSA-N 326.462 1.948 10 10 EDCE NCc1ccc(-c2csc(NS(=O)(=O)c3c[nH]cn3)n2)o1 70416322 BMUXPEQLVHSGQS-UHFFFAOYSA-N 325.375 1.386 10 10 EDCE C[C@H]1Oc2ccc(N)nc2N(CCCOc2ccc(N)cc2)C1=O 75259193 MSTWLUKQJJPPOE-LLVKDONJSA-N 328.372 1.829 10 10 EDCE COc1ccc(N2CCN(C(=O)CC[C@H]3CN(C)C(=O)O3)CC2)cc1 74683297 AQTSUNXYJATQOV-INIZCTEOSA-N 347.415 1.575 10 10 EDCE COC[C@@H](O)CN1CCC(N[C@H](C)c2cc(F)ccc2O)CC1 186195172 WQFBLPOTXCVACO-DOMZBBRYSA-N 326.412 1.654 10 10 EDCE CCN(CC)c1ccc(CN2CCC[C@@]3(C2)NC(=O)NC3=O)cc1F 193472673 QSZPUUBQNWLYPH-SFHVURJKSA-N 348.422 1.846 10 10 EDCE CN1O[C@@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2[C@@H]1c1ccccc1O 248032627 ILRDIUAKHZMGGH-ULQDDVLXSA-N 338.363 1.864 10 10 EDCE C[C@H](O)CN1CCN(C(=O)NCc2ccc(N(C)C)cc2)C[C@H]1C 247577316 SJNXOSJYGSBTEO-CABCVRRESA-N 334.464 1.349 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C[C@H]2CCOC2)nn1 528995922 JORSXBPXMURKFF-DGCLKSJQSA-N 346.387 1.087 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@@H](CC(N)=O)C2)c([N+](=O)[O-])c1 367929018 UUBKYAWJXWSZGQ-PYEVWLCESA-N 333.344 1.483 10 10 EDCE Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)c1cccc(O)c1O 365755945 BNPVWEHCZVVSJY-ZDUSSCGKSA-N 331.372 1.662 10 10 EDCE Cc1ccc(CN(C)C(=O)C(C)(CO)CO)c(O)c1Br 2380764855 HXANEPWCLBQQNT-UHFFFAOYSA-N 346.221 1.412 10 10 EDCE Cc1ccc(CN2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)c(O)c1Br 2380805575 QZHIPWGCUSGWRM-ZAZJYDDPSA-N 342.233 1.922 10 10 EDCE COC(=O)CC[C@@H]1CC[C@H](C(=O)NCc2cccc(OC)c2O)O1 821065087 KTFINZBPQSDQNS-GXTWGEPZSA-N 337.372 1.518 10 10 EDCE O=C(C1CCOCC1)N1CCOc2ccc(N3CCOCC3)cc2C1 581789033 FFACLOIPFMJDRG-UHFFFAOYSA-N 346.427 1.671 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C[C@]3(O)CCCN(C)C3)C2)cc1 912293223 WHBQHKUYLLLMEY-DNVCBOLYSA-N 347.459 1.237 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCN(C2CC2)C(=O)C1 748613196 GLCMEPYCDSNIPZ-UHFFFAOYSA-N 342.443 1.803 10 10 EDCE CC(C)[C@H]1CN(Cc2cc(O)n3ncc(C(=O)O)c3n2)CCS1 846254691 ALECQXMJKXVKDZ-GFCCVEGCSA-N 336.417 1.707 10 10 EDCE COC[C@H](CN(CC(=O)OC)Cc1cc(Cl)ccc1O)OC 851841707 WXESWJLCESBUKC-ZDUSSCGKSA-N 331.796 1.682 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)NCC12CC(CN1)C2 851690499 DKESTZQCDPGZML-UHFFFAOYSA-N 345.443 1.389 10 10 EDCE COc1ccc(N2CC[C@@H](Nc3cc(NC[C@H](C)O)ncn3)C2)cc1 853758163 ATIKCZCKOFLPIT-UONOGXRCSA-N 343.431 1.969 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC(=O)N(C)[C@H](C)C3)C2)cc1 852450965 AJVHBUYTTUFVAD-KGLIPLIRSA-N 346.431 1.146 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCC[S@@](=O)CC(F)(F)F 855275803 LTOXDZINMBDPAM-WYAMSBGYSA-N 337.319 1.538 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CNC[C@@H]3CCCO3)C2)cc1 851639520 HBFUKKYMUIDXDS-PBHICJAKSA-N 333.432 1.159 10 10 EDCE C[C@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@H]1CN 923496409 IAGDYXOKFQHRGR-RDJZCZTQSA-N 332.492 1.628 10 10 EDCE CO[C@@H]1CC[C@@H]2OCCN(Cc3cc4c(cc3O)OC[C@@H]4O)[C@H]2C1 768465440 MRJKDIWMNVNDLX-QCPWZWHMSA-N 335.400 1.586 10 10 EDCE CCOC(=O)c1cccc(/C=C2\SC(N3CCOCC3)=NC2=O)n1 863182084 ZIMZQSGWGMXUJN-RAXLEYEMSA-N 347.396 1.561 10 10 EDCE Cc1cnc(N)c(S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)c1 766794423 ZIYYPDQVKGNQKS-UHFFFAOYSA-N 338.408 1.656 10 10 EDCE Oc1c(Cl)cccc1CN[C@@H]1CCN(c2ccc3nncn3n2)C1 862481812 LZCCBGLODFWPDJ-GFCCVEGCSA-N 344.806 1.852 10 10 EDCE Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)Cc1ccc(N(C)C)cc1 776841751 ZUKNKKLZPWCIAQ-UHFFFAOYSA-N 331.376 1.824 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CCO[C@]2(C(=O)NCCN=[N+]=[N-])C1 1895875698 MIWFCWTUHSZCHW-IINYFYTJSA-N 325.369 1.439 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)c1cn([C@@H]2CC[C@H]2O)nn1 1150387769 SKOQXIAUQCTSBT-NVXWUHKLSA-N 342.399 1.488 10 10 EDCE CO[C@]1(C(=O)O)CCN(Cc2cc(Br)ccc2O)C1 703783244 NIULQZFHWWLMIN-CYBMUJFWSA-N 330.178 1.830 10 10 EDCE C[C@@H]1C[C@@H]1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1257235003 XQXBLGAFMAJCNR-FVQBIDKESA-N 346.427 1.672 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@]3(C)CCOC3=O)C2)cc1 1263794155 NPDMHNRSSSJPMI-SJCJKPOMSA-N 333.388 1.279 10 10 EDCE O=S1(=O)CC[C@H]2CN(Cc3c(O)cccc3Br)C[C@H]21 898081461 GXUISGYAQLFGEL-TVQRCGJNSA-N 346.246 1.774 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)C2(C(N)=O)CC2)cc1C 1283664733 OHKSFUBWYLYEOI-CYBMUJFWSA-N 333.432 1.206 10 10 EDCE COc1cc(C(=O)N[C@H](C)C[C@@H](C)NC(=O)C2CCC2)cc(OC)n1 1288501526 MVLQNOZEEOJUJJ-VXGBXAGGSA-N 349.431 1.912 10 10 EDCE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H]2C[C@H]2C(N)=O)cc1 1292382325 QMRSKADTHIUHLB-BBWFWOEESA-N 345.443 1.382 10 10 EDCE CC(C)(O)[C@@H](O)C(=O)Nc1c(-c2ccccn2)nc2ccccn12 1468659019 MBTHSILUPIBVHZ-AWEZNQCLSA-N 326.356 1.467 10 10 EDCE C[C@@H](NCc1nnc(Br)n1C)c1c(O)cccc1O 2121515026 SINNOJJSDFCKNI-SSDOTTSWSA-N 327.182 1.840 10 10 EDCE CCO[C@@H]1C[C@@H]1C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1623928448 NFNQCMMKWHYCGL-GXTWGEPZSA-N 341.791 1.972 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CNC(=O)C(C)(C)C)cc1C 1716464610 ZUVXHOLOHWWZCD-AWEZNQCLSA-N 349.475 1.760 10 10 EDCE CCCOCC(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1494780135 DLCFJJXCQGERGO-LLVKDONJSA-N 349.391 1.510 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@H]1CC(=O)c2ccccc2O1 1642867209 WRHBPPJXNTWUTP-GFCCVEGCSA-N 327.336 1.791 10 10 EDCE O=C1C[C@@H](c2ccc(NC(=O)c3cccc(O)c3O)cc2)NC(=O)N1 1641181160 IFVQJXUGVFUAHZ-LBPRGKRZSA-N 341.323 1.621 10 10 EDCE CCOC(=O)[C@H](NC(=O)c1cc(O)cs1)[C@@H](O)c1cccnc1 1587187488 WVIMLLPOWWFQRF-OLZOCXBDSA-N 336.369 1.244 10 10 EDCE CC(=O)Nc1ccc(CCNC(=O)Cc2ccc(O)c(O)c2)cc1 1585381296 LNGWFZCDWARFBI-UHFFFAOYSA-N 328.368 1.958 10 10 EDCE CCC1(C(=O)NC2CN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)CC1 1582103081 KPUXSFQBCNNNIM-UHFFFAOYSA-N 343.387 1.980 10 10 EDCE COCCCNC[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1662733499 QEOBOOJCURGXRN-CYBMUJFWSA-N 347.419 1.937 10 10 EDCE COC(=O)[C@H](COC1CCC1)N(C)C(=O)Cc1ccc(O)c(O)c1 1596029997 VNFRMLDQQGOIPS-ZDUSSCGKSA-N 337.372 1.209 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)[C@H]3CCOC3)c(Br)cc21 250703754 DJDVMDNHLWZAPN-ISVAXAHUSA-N 340.221 1.887 10 10 EDCE O=C(CCn1c2c(c3ccccc31)CCCC2)NCCn1ncnn1 1850015704 RHPGCFUEMBYMEX-UHFFFAOYSA-N 338.415 1.713 10 10 EDCE CCOC(=O)COc1ccc(C=C2C(=O)N(C)C(=O)N(C)C2=O)cc1 1252605784 BFWFHMQVQRHYDJ-UHFFFAOYSA-N 346.339 1.062 10 10 EDCE CCc1c(OCCOc2ccc(N)cc2)c(=O)ccn1CC(=O)O 1857913741 WLQOXCCGBWKYAO-UHFFFAOYSA-N 332.356 1.535 10 10 EDCE C[C@]1(Br)CN(C(=O)c2cc(O)nc(O)c2)C[C@@]1(C)F 2140730132 GREJYUXWHDLJIU-NWDGAFQWSA-N 333.157 1.830 10 10 EDCE CC(C)(C)OC(=O)NCCn1cc([C@@H](N)c2ccccc2O)nn1 1942402980 JUJCNSIUXVVLDB-AWEZNQCLSA-N 333.392 1.557 10 10 EDCE CN(C)c1ccc([C@@H](N)CN2CC(NC(=O)OC(C)(C)C)C2)cc1 2003462730 CZUWPHLENKLPAT-INIZCTEOSA-N 334.464 1.961 10 10 EDCE CC(C)(C)OC(=O)N1CC(NCc2cc(F)ccc2O)(C(N)=O)C1 715501592 MYQOFAXPMKMBGM-UHFFFAOYSA-N 339.367 1.096 10 10 EDCE CN(C)c1ccc([C@@H](O)[C@@H](N)c2nc(Br)nn2C)cc1 2173169102 RTDCGUICVIIMGN-GHMZBOCLSA-N 340.225 1.377 10 10 EDCE CN1CCN(CCc2ccc(N)cc2)[C@@H](CNC(=O)C(F)(F)F)C1 2044676696 GXORVSWYCZDKCD-AWEZNQCLSA-N 344.381 1.106 10 10 EDCE O=c1c2c(ccn1Cc1cnsc1Br)CCNC2 2055665348 IMZKNDAFEPQFAN-UHFFFAOYSA-N 326.219 1.761 10 10 EDCE O=S1(=O)CC[C@@H]2CN(Cc3c(O)cccc3Br)C[C@H]21 2088814286 GXUISGYAQLFGEL-NOZJJQNGSA-N 346.246 1.774 10 10 EDCE NCc1cc(F)c(N2CC[C@@]3(C[C@@H](O)CO3)C2)cc1Br 2201772203 NXZRLXSETMLGOI-QMTHXVAHSA-N 345.212 1.777 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)c(Br)c1 2236633999 AOQWGOAINJUKTC-SDDRHHMPSA-N 344.249 1.930 10 10 EDCE O=C(O)[C@H]1CC[C@H](O)CN1Cc1c(O)cccc1Br 2264529376 RKOJZEIAPVNBDA-GZMMTYOYSA-N 330.178 1.565 10 10 EDCE COc1ccc(N2CCOC3(CNC3)C2)c(OC)c1Br 2288477649 MAAIQOPCJHIZIL-UHFFFAOYSA-N 343.221 1.645 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2C[C@H](CO)c3ccccc32)c1 492940253 IPIZVYXEMZAJKP-LQYUOIDQSA-N 337.379 1.577 10 10 EDCE COc1c(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c2c1O 6483403 JMIFIYIEXODVTO-UHFFFAOYSA-N 332.264 1.997 10 10 EDCE endogenous,in-man CNC(=O)CCc1ccc(NC=C2C(=O)OC(C)(C)OC2=O)cc1 100417168 TXYGOFCNRBVUED-UHFFFAOYSA-N 332.356 1.497 10 10 EDCE [N-]=[N+]=NCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12 252487104 HSSTWUOLSWCKKL-GMXVVIOVSA-N 340.453 1.919 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCCNC(=O)c1ccco1 186419609 UNRPDQNNKAEYMR-LBPRGKRZSA-N 346.383 1.948 10 10 EDCE C[C@H](c1cc(Br)ccc1O)N1CCS(=O)(=O)CC1 132277768 DANUXFJBTAIFFR-SECBINFHSA-N 334.235 1.946 10 10 EDCE COc1ccc(N2CCN(Cc3cc(=O)c(O)cn3C)CC2)cc1 96299131 MFPPOHRGGGWPIK-UHFFFAOYSA-N 329.400 1.422 10 10 EDCE COc1ccc(N2CCN(C(=O)CN(C)CCCCO)CC2)cc1 276433215 SOERPYNMGZTQPE-UHFFFAOYSA-N 335.448 1.048 10 10 EDCE CCOC(=O)[C@@H]1C[C@H](O)[C@@H](N=[N+]=[N-])C[C@@H]1NC(=O)OC(C)(C)C 381071204 PETGZSIPWBXEIZ-RCWTZXSCSA-N 328.369 1.893 10 10 EDCE COc1cccc(CNC(=O)N[C@H](C)C2(S(C)(=O)=O)CC2)c1O 807478172 SABORVPKGYYQJJ-SNVBAGLBSA-N 342.417 1.166 10 10 EDCE C[C@H]1CCCN(c2ccc(CNC(=O)CNC(N)=O)cc2Cl)C1 800343491 SNVHPUSBZUQDBO-NSHDSACASA-N 338.839 1.861 10 10 EDCE COc1cccc(CNS(=O)(=O)CCC[C@@H]2CCOC2)c1O 827194341 KFDDGXRAMXCCQU-GFCCVEGCSA-N 329.418 1.637 10 10 EDCE CCOC1(C)CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 823523405 DSRWOFNJMFPAPR-UHFFFAOYSA-N 347.459 1.968 10 10 EDCE C[C@H](NC(=O)N[C@@H](CF)C(=O)O)c1ccc(N2CCOCC2)cc1 837296250 OOCYPYZFCFBEAO-FZMZJTMJSA-N 339.367 1.306 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@H](O)C3CCOCC3)CC2)cc1 735882187 QOXNWYHICGVZMN-SFHVURJKSA-N 348.443 1.568 10 10 EDCE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@@H]2COC(=O)N2)cc1 912109662 KMBNQTADFAWAPP-LBPRGKRZSA-N 345.321 1.752 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)c3ccccn3)C2)cc1 849415646 CZYBWOZDYSALIC-CYBMUJFWSA-N 333.413 1.647 10 10 EDCE CCOCc1cc(CN[C@H](C(=O)OC)c2ccnn2C)ccc1OC 843430038 MVIJBPHEWZZYPV-KRWDZBQOSA-N 347.415 1.969 10 10 EDCE CC(C)C[C@@H](N)c1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 842586769 PNOLBKCPMIANSK-LLVKDONJSA-N 340.405 1.860 10 10 EDCE CC[C@@](C)(CO)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 847366973 LODWFTVVBPNRGO-BEFAXECRSA-N 347.459 1.413 10 10 EDCE CCNS(=O)(=O)[C@@H]1CCN(Cc2c(O)cc(C)cc2Cl)C1 840938204 ZATOGGXJCUATFS-LLVKDONJSA-N 332.853 1.868 10 10 EDCE Nc1ccc(Cc2nc(C(=O)O[C@H]3CCCNC3=O)cs2)cc1 751937745 VZCBBZDHAGSVQU-ZDUSSCGKSA-N 331.397 1.752 10 10 EDCE C[C@@H]1C[C@@H](NCC[C@@H]2CNCCS2(=O)=O)c2c(O)ccc(F)c21 925791762 GSZLYMYTCNRGFC-NQBHXWOUSA-N 342.436 1.446 10 10 EDCE CC[C@H](C)[C@H](O)CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 854301846 UZHHSYJMGFBQRB-JJRVBVJISA-N 335.448 1.980 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccn(C)c(=O)c3)C2)cc1 855233004 VNEJDDHFROFEOT-CQSZACIVSA-N 327.384 1.403 10 10 EDCE COc1ccc(N2CCN(CCCN[C@H]3CN(C)C[C@H]3C)CC2)cc1 756103298 BHRDLRHOYWPAPT-XLIONFOSSA-N 346.519 1.747 10 10 EDCE COC(=O)c1cc(OCC(=O)NC[C@@H]2CCCO2)ccc1N(C)C 865395811 CDWQYJQKLMGEOP-ZDUSSCGKSA-N 336.388 1.213 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@]12C[C@@H](NC(=O)OC(C)(C)C)C[C@@H]1C2 870017804 HLWFFOIKHPMLDZ-GDLVEWKHSA-N 325.361 1.381 10 10 EDCE COc1ccc(CNC(=O)c2cc(C3CCOCC3)nn2C)c(O)c1 1123771815 ZKGPSQQTDSMNGK-UHFFFAOYSA-N 345.399 1.958 10 10 EDCE C/C(=C/C(=O)N(C[C@H]1CCCO1)c1ccnnc1)c1cnccn1 893109519 XDJASSQBNSSRTC-UZGISAJGSA-N 325.372 1.882 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nccc(C)n3)CC2)cc1F 792211403 FNHNHWLOYVRENC-UHFFFAOYSA-N 330.363 1.895 10 10 EDCE O=C(CN1CCOCC1=O)NCc1ccc(N2CCCCC2)cc1 790590955 VPMSPIBCOPOETR-UHFFFAOYSA-N 331.416 1.152 10 10 EDCE O=C(Cn1nnc(-c2ccccc2)n1)NCc1ccc(O)cc1O 1142530604 RWSZBMLBLNZASB-UHFFFAOYSA-N 325.328 1.068 10 10 EDCE CCOC(=O)c1[nH]cnc1CNC(=O)/C=C/c1ccc(O)c(O)c1 1179687322 HMPWHRYHWZXXCC-GQCTYLIASA-N 331.328 1.327 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H]2CN2CCOCC2)cc1 1160682326 YTWSFEFRKBTEDS-HNNXBMFYSA-N 345.403 1.786 10 10 EDCE CC(C)N1CC[C@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1329430259 ZXIKPYMBVYUJNC-AWEZNQCLSA-N 331.416 1.176 10 10 EDCE O=C(OCc1ccccc1)N1CC(NCc2ccc(O)c(O)c2O)C1 397244884 AKZMINWTJMTQFI-UHFFFAOYSA-N 344.367 1.914 10 10 EDCE CCNCc1ccc(N(C)CC(C)(CO)CO)c(Br)c1 689700179 ZASNDDUMEGPACA-UHFFFAOYSA-N 345.281 1.986 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1290375123 SCFGLRWREDYMOI-INIZCTEOSA-N 334.416 1.559 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cc2n[nH]c(C)n2)cc1C 1715811034 BPRSDJNGGUMABV-PLNGDYQASA-N 343.431 1.435 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCC[C@@H]2CCCN2CCO)cc1 1713442815 UXWSMCBXXRINHA-OAHLLOKOSA-N 347.419 1.816 10 10 EDCE C[C@@H](CNC[C@H]1CCOC1)CNC(=O)c1ccc(N=NC(N)=O)cc1 1715271124 GZRSVQHBJBPUSD-QWHCGFSZSA-N 347.419 1.841 10 10 EDCE C[C@H](O)CNC[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1485707339 XCWJDWCPAPFFJV-MJVIPROJSA-N 333.392 1.328 10 10 EDCE CO[C@H](C)C(=O)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1722079248 GHSRMCRWCPZCBW-SNVBAGLBSA-N 347.375 1.263 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)C[C@H]1CCC(=O)N1 1568783877 BILJUGUOTSTUPX-MRXNPFEDSA-N 347.459 1.610 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)CCOC 1746166902 OBDVPTMZJCNDSX-GFCCVEGCSA-N 349.391 1.510 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@@H]2CCCC(=O)N2)cc1C 1669610368 BGQCGJIMXMIBNF-HOCLYGCPSA-N 347.459 1.657 10 10 EDCE COc1ccc(CNC(=O)NCC[C@H]2CCCS2(=O)=O)c(O)c1 1684901365 QBXBMKPUFJMVNR-CYBMUJFWSA-N 342.417 1.167 10 10 EDCE O=C(O)[C@H](c1ccc(O)c(O)c1)[C@@H](C(=O)O)c1ccc(O)c(O)c1 13587794 UMAASMUXEBOCLH-OKILXGFUSA-N 334.280 1.546 10 10 EDCE C[C@]1(O)CC[C@@H](O)c2c1ccc1c2C(=O)C(=O)c2c(CO)coc2-1 102474709 GSUXVWUEFDCUBE-ZMZPIMSZSA-N 328.320 1.853 10 10 EDCE biogenic COC(=O)[C@H]1CCC[C@H]1NCC(=O)N(C)Cc1ccc(N(C)C)cc1 1116835328 HGNYCTSMEAFKRF-DLBZAZTESA-N 347.459 1.642 10 10 EDCE O=C(O)[C@@H]1CO[C@H]2CN(Cc3c(O)cccc3Br)C[C@H]12 2160867462 KMYOZWOLVPSYND-JQEORGNBSA-N 342.189 1.686 10 10 EDCE OCCN1CCC[C@H](NCc2c(O)cccc2Br)C1 706835369 XEZQEUZWRVFTQZ-NSHDSACASA-N 329.238 1.701 10 10 EDCE C[C@H](O)c1ccc(N2CCN(C)[C@@H](CO)C2)c(Br)c1 687589012 FUOIOMAXVIHGNU-CMPLNLGQSA-N 329.238 1.615 10 10 EDCE CCCNCc1ccc(N2CC(C(N)=O)C2)c(Br)c1 382062910 GWCKFMRYSNHYAB-UHFFFAOYSA-N 326.238 1.870 10 10 EDCE CNC[C@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 715768665 FTHWWWLULIMEFA-NSHDSACASA-N 333.201 1.714 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCC[C@]45OCC[C@H]4C[C@@H]35)c2n1 2064564382 ACFKINQQOZXYRW-NASWQRNTSA-N 342.399 1.821 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CCC34COC4)c(Br)cc21 2171802112 ILFIYCNQUUWDAR-GFCCVEGCSA-N 338.205 1.641 10 10 EDCE NCc1ccc(N2CC[C@@]3(O)CCOC[C@@H]3C2)c(Br)c1 2194550429 FQVNPOHXYRSNIQ-SWLSCSKDSA-N 341.249 1.886 10 10 EDCE CN1C(=O)O[C@H]2CN(Cc3c(O)cccc3Br)C[C@H]21 2120402668 OTZFPERTAVHVFD-PWSUYJOCSA-N 327.178 1.790 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)C[C@H]3C2)cc1Br 2236991422 XADPFTOVUYOBOF-JLUCKKNBSA-N 342.233 1.509 10 10 EDCE OCc1ccc(N2CC3(CC[C@H](CO)O3)C2)cc1Br 2336719417 SOSBWMNBKOLNFP-GFCCVEGCSA-N 328.206 1.672 10 10 EDCE Cc1cc(N2C(=O)NC(=O)/C(=C\O)C2=O)ccc1Br 101350093 DLGAOLANVFYWSD-VMPITWQZSA-N 325.118 1.782 10 10 EDCE COc1ccccc1NC(=O)C(=O)N(C(C)=O)c1ccc(N)cc1 170318032 DRDKXHGOXYSNTG-UHFFFAOYSA-N 327.340 1.796 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1[C@H]2CC[C@H]1CC(O)C2 111838085 CCUPJIRDFHEPOX-IRXDYDNUSA-N 345.443 1.721 10 10 EDCE COc1ccc(N2CCCN(C(=O)NCc3noc(C)n3)CC2)cc1 173557083 MCSMZHMNKAHWHU-UHFFFAOYSA-N 345.403 1.809 10 10 EDCE CC(C)c1nnnn1CC(=O)NCCCSc1nccs1 174227102 YWJYSUWIAGTZIT-UHFFFAOYSA-N 326.451 1.552 10 10 EDCE CCCNC(=O)[C@@H]1C[C@@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 244532044 ZTQAWBSEBZXERG-SJORKVTESA-N 345.443 1.506 10 10 EDCE CC(=O)N(C(=S)NC(=O)c1ccccc1N)c1ccc(N)cc1 244206477 VRRVTGLDVQHPCV-UHFFFAOYSA-N 328.397 1.919 10 10 EDCE CC(=O)c1cc(F)cc(CN2C[C@H](C)[C@H](N3CCOCC3)C2)c1O 246300637 BUZXXFGVOYSVCQ-YVEFUNNKSA-N 336.407 1.886 10 10 EDCE COC(=O)CC[C@H](N)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 377531806 YKNCCLZDTBNHBP-INIZCTEOSA-N 349.431 1.014 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CCC(=O)[C@H](C)C3)CC2)cc1 283117967 MVJHWBZQTUWQDD-OAHLLOKOSA-N 345.443 1.255 10 10 EDCE Cc1ccc(CN2CC[C@H](O)C[C@H]2C(=O)O)c(O)c1Br 2380812963 BGDMLDQZFUCOKR-QWRGUYRKSA-N 344.205 1.873 10 10 EDCE CC(=O)C(=O)COC(=O)c1cnn(CCO[C@@H]2CCCCO2)c1C 808531402 OWUBUEQBAYICIG-OAHLLOKOSA-N 338.360 1.050 10 10 EDCE COc1cc(F)c(F)cc1NC(=O)C(=O)NCc1ccccc1O 810358635 GDUKTALCIJMODY-UHFFFAOYSA-N 336.294 1.934 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N(C)CC3(CO)CC3)C2)cc1 824685083 AEKUJDUTONHYMN-OAHLLOKOSA-N 347.459 1.935 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NCc1ccc(N2CCOCC2)c(F)c1 826967124 DPJNIAAXRQHURS-GOEBONIOSA-N 338.379 1.082 10 10 EDCE CS(=O)(=O)[C@@H]1CN(Cc2cc(F)ccc2O)C[C@H]1C(F)(F)F 826894251 MIMWGOPWCVEHPM-ZYHUDNBSSA-N 341.326 1.939 10 10 EDCE CC[C@@H](NCc1ccc(N2CCN(C)CC2)cc1)[C@@H](O)C(F)F 824635888 KCPMLANXLULUGX-HZPDHXFCSA-N 327.419 1.933 10 10 EDCE Cc1cc(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)nc(C)n1 585332897 JYJJAQCDBDBFFR-UHFFFAOYSA-N 344.371 1.583 10 10 EDCE O=C(/C=C/Cn1cncn1)NCc1ccc(N2CCSCC2)cc1 900254241 DAOFDWFOILAABP-OWOJBTEDSA-N 343.456 1.704 10 10 EDCE CN(Cc1cc[nH]n1)C(=O)NCc1ccc(N2CCOCC2)cc1 732674601 PGTYKOQRKUVIHZ-UHFFFAOYSA-N 329.404 1.588 10 10 EDCE COc1cc2c(c(OC)c1)N(C[C@@H](O)CN1CCOCC1)CCC2 839655909 XGUNGFZTFAPBGB-HNNXBMFYSA-N 336.432 1.150 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)NCc1ccc(N2CCCCC2)cc1 848227076 XEONXPBCODIQCJ-INIZCTEOSA-N 334.416 1.607 10 10 EDCE C[C@@H]1CN(C(=N)NCc2ccc(N3CCC(CO)CC3)cc2)CCO1 849093160 KVCAFTABQVCNGV-OAHLLOKOSA-N 346.475 1.640 10 10 EDCE CC(C)(C)OC(=O)CSCC(=O)NCc1ccc(O)cc1O 910950870 LKFXFNHJKKOGLX-UHFFFAOYSA-N 327.402 1.789 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC[C@](O)(CO)C2)c([N+](=O)[O-])c1 840329633 NDESWMZTGXZTKE-MQDFFIGUSA-N 336.344 1.105 10 10 EDCE CNC(=O)CN1CCC(NCc2c(O)cc(C)cc2Cl)CC1 840879458 UNASGDZLUYONFB-UHFFFAOYSA-N 325.840 1.654 10 10 EDCE O=C1N[C@@]2(C(=O)NCc3c(O)ccc4c3CCCC4)C[C@H]3C[C@H]1[C@H]2C3 845833490 GSUDBFDLOHQNSY-VNWDQTBVSA-N 340.423 1.802 10 10 EDCE Nc1ccc(Cc2nc(C(=O)N3CC[C@@H](C(=O)O)C3)cs2)cc1 844931254 CIMUAPOPTDZIOW-LLVKDONJSA-N 331.397 1.863 10 10 EDCE COC[C@@H]1COCCN1C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 923188579 SCTXHDUIDMGIPK-GDBMZVCRSA-N 349.431 1.331 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCn3cc(C)cn3)C2)cc1 855231990 ZOLZFAAWJMPZAK-HNNXBMFYSA-N 328.416 1.985 10 10 EDCE Cc1cnn(C)c1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 850415935 ZBCIEFKCWWMLIX-GFCCVEGCSA-N 329.404 1.610 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCc3cn(C)cn3)C2)cc1 852377427 IRDSWVJFLJMDGA-OAHLLOKOSA-N 343.431 1.549 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H](Cc3ccccn3)C2=O)cc1F 761182141 XESWIFNMUFRXCT-HNNXBMFYSA-N 342.374 1.950 10 10 EDCE CN1CCCc2cc(CNC(=O)CC[C@@H]3CC[C@H](C(N)=O)O3)ccc21 865054853 VLVFNBMVGOVUHK-DOTOQJQBSA-N 345.443 1.498 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H](C(=O)OC)C1 1117912737 TWMKTYXNLIYUOF-AWEZNQCLSA-N 348.399 1.152 10 10 EDCE O=C(COC(=O)c1cccc(-n2cncn2)c1)c1ccc(O)c(O)c1 783684514 LYQUVYFAHCPCKQ-UHFFFAOYSA-N 339.307 1.718 10 10 EDCE CCOCC(=O)N(C)[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1280502977 CRWDHYFFHGBSNL-NSHDSACASA-N 349.391 1.462 10 10 EDCE C[C@]1(O)CCN(c2ccc(CO)cc2Br)C[C@]1(C)O 1880700561 DEXRIJLRAHPZEC-KBPBESRZSA-N 330.222 1.654 10 10 EDCE CCc1c(C(=O)NCc2ccc(OC)cc2O)[nH]c(C)c1C(N)=O 794379530 OYKXOFPIYXYGFM-UHFFFAOYSA-N 331.372 1.629 10 10 EDCE CN1C(=O)NC(=O)/C(=C/c2cc([N+](=O)[O-])ccc2N2CCCC2)C1=O 1084410858 CGPBUNSWZXIILZ-XFXZXTDPSA-N 344.327 1.287 10 10 EDCE CO[C@H]1C[C@@H](CNC(=O)NCc2ccc(N3CCOCC3)cc2)C1 1328704387 VEORZRJGBZTVIW-WOVMCDHWSA-N 333.432 1.747 10 10 EDCE C[C@@H](N)c1ccc(N(C)CCN(C)CCO)c(Br)c1 691341581 AATCJKDMEVBFDI-LLVKDONJSA-N 330.270 1.829 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@@]3(C)CCC(=O)NC3)CC2)cc1 1344548977 CTYPYIJKUZHIEU-IBGZPJMESA-N 345.443 1.650 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1nc2ncccn2n1 1351164786 YKEJFWQRQYACCN-UHFFFAOYSA-N 336.399 1.997 10 10 EDCE O=C(Cc1nc2ncccn2n1)NCc1ccc2cccnc2c1O 1469248960 JYWYZVOMJDGOLH-UHFFFAOYSA-N 334.339 1.237 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2nc(O)nc(O)c2OC)c1 1465992356 JPNWLUALINRGDA-ZETCQYMHSA-N 335.316 1.102 10 10 EDCE CC(C)[C@@H](F)C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1703234523 BRGLHGQLQZOEOQ-GFCCVEGCSA-N 337.355 1.689 10 10 EDCE C[C@@H]1[C@H](CO)CCN1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1471547405 JXANYUUSQFDMBL-UWWQBHOKSA-N 348.491 1.768 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CC(=O)NCC1CC1 1543149277 ZZICPWUKUSPCGK-UHFFFAOYSA-N 329.404 1.455 10 10 EDCE COC(=O)[C@H](Cc1cncs1)NC(=O)/C=C\c1ccc(O)c(O)c1 1471710438 BIOYVWMDWXMSIR-FHMRSRPSSA-N 348.380 1.468 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CN(c2ccc(F)cc2)C1=O 1632686491 NMCFFUYWUDGNMA-CYBMUJFWSA-N 330.315 1.311 10 10 EDCE CN(C[C@H](O)CNCC1CC1)C(=O)c1ccc(N=NC(N)=O)cc1 1571598103 ZPEMBBBANWODML-CQSZACIVSA-N 333.392 1.282 10 10 EDCE NS(=O)(=O)c1ccc(C(=O)NCc2cccc(Cl)c2O)o1 1653563746 LHOCOEMVGUUNEV-UHFFFAOYSA-N 330.749 1.216 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)c1cccnc1OCCO 1595616581 UXVVTKYKEKVPSA-UHFFFAOYSA-N 342.395 1.967 10 10 EDCE COC1CC(C(=O)NCCN=[N+]=[N-])(N(C)C(=O)OC(C)(C)C)C1 1965102079 LKLVBOWSEFZVTH-UHFFFAOYSA-N 327.385 1.827 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)CN2CCCC2)cc1C 1699362222 KHJWHVDZHQOHRV-ARJAWSKDSA-N 331.460 1.861 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@@H]2CCCC(=O)N2)cc1C 1690600114 OPBYMRIORQYPMT-HOCLYGCPSA-N 347.459 1.657 10 10 EDCE CC(C)[C@H](O)CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 153806212 CZIPTCGXHPLCNS-MRXNPFEDSA-N 339.411 1.478 10 10 EDCE CCN1CCO[C@H](CNCc2cc(Br)ccc2O)C1 223332538 NJKGWXOYCQBPPO-CYBMUJFWSA-N 329.238 1.965 10 10 EDCE CC(C)(C)OC(=O)N1CC=C[C@H]1C(=O)NCCc1ccc(O)c(O)c1 1968739998 ZPJSMWSPDOMKRF-ZDUSSCGKSA-N 348.399 1.932 10 10 EDCE Oc1c(Br)cccc1CN[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@@H]2O 1974158979 WFTXMCCOTOYPFO-QELSEJFDSA-N 328.206 1.375 10 10 EDCE COCCC1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2152248818 QAURICAIBKETTL-ZDUSSCGKSA-N 341.205 1.907 10 10 EDCE CC(C)(O)C1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2152282838 JKGORZLPXXVVCI-LBPRGKRZSA-N 340.221 1.608 10 10 EDCE C[C@H](C(=O)NCCCN=[N+]=[N-])N1CCN(C(=O)OC(C)(C)C)CC1 2010393194 PBKUDWPPWKQJIC-GFCCVEGCSA-N 340.428 1.744 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)N2CC(N=[N+]=[N-])C2)C1 2010403643 HKDZGVWVWHWHSA-LBPRGKRZSA-N 339.396 1.924 10 10 EDCE COCCNCc1cnc(Sc2nnc(N(C)C)s2)s1 2155333735 CSCLWAILIZAFNO-UHFFFAOYSA-N 331.492 1.948 10 10 EDCE CN(C(=O)[C@@H](O)C(C)(C)NC(=O)OC(C)(C)C)c1ccc(N)cc1 2022837628 BNPOKAPSGIGUTJ-CYBMUJFWSA-N 337.420 1.896 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H](C(C)C)[C@H](O)C(F)(F)F)c2n1 2062347096 WGOAXZBMTMGRKY-QWRGUYRKSA-N 346.309 1.421 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]12CN(C(=O)OC(C)(C)C)C[C@H]1CCO2 1908254317 LDPMXROUJHHEPG-ABAIWWIYSA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](N2CCCc3cc(CN)ccc32)C1 2044595801 MYQDHXVHSVIEEN-SJORKVTESA-N 347.459 1.878 10 10 EDCE CCNCc1ccc(N(C)CC(CO)CO)c(Br)c1 2094031107 RGECXZDCYYPPFC-UHFFFAOYSA-N 331.254 1.596 10 10 EDCE O=C(O)[C@H]1CC[C@@H](O)CN1Cc1cc(Br)cc(F)c1O 2279185455 DQZWDVHJXTZVDO-MWLCHTKSSA-N 348.168 1.704 10 10 EDCE CSc1ncc(Cn2c(CO)nnc2SCC(=O)O)s1 2284539035 RJLOTVGFHKCUEG-UHFFFAOYSA-N 332.432 1.174 10 10 EDCE COC(=O)C=Cc1ccc(N(C)[C@H](C)C[S@@](C)=O)c([N+](=O)[O-])c1 2308458511 MSJSCLSYZOVYBB-QVQLBTGDSA-N 340.401 1.984 10 10 EDCE CC(C)(C)OC(=O)N1CCN[C@H](CC(=O)NCc2ccccc2O)C1 2320302266 FAOUGMDPCNECDI-CQSZACIVSA-N 349.431 1.607 10 10 EDCE Cc1ccc(CN(C)S(=O)(=O)CCO)c(O)c1Br 2327800416 KIZJWUGBZYEEKQ-UHFFFAOYSA-N 338.223 1.217 10 10 EDCE Cc1ccc(CN2C[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(O)c1Br 2352946153 GRAFMKXBAITUOD-OAACRXHESA-N 328.206 1.389 10 10 EDCE COc1ccc(N2CCN(C[C@H](C)CS(C)(=O)=O)CC2)cc1F 119933632 LOGLBWVBIFQTFJ-ZDUSSCGKSA-N 344.452 1.637 10 10 EDCE CN1C(=O)[C@H]2C[C@H]1CCN2c1ccc(CN)c(Br)c1F 2360828972 LXPNROJBNGQZOQ-MWLCHTKSSA-N 342.212 1.856 10 10 EDCE COc1cc(Cl)cc(CN2CC[C@@H](N3CCOCC3)C2)c1O 184682126 MNMVYWUSOLMSGS-CQSZACIVSA-N 326.824 1.961 10 10 EDCE CC(=O)N1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)[C@H](C)C1 268810845 GKYFXXIVHPFEJP-CQSZACIVSA-N 344.459 1.831 10 10 EDCE COCc1nc([C@H]2COCCN2C(=O)c2ccc(C)c(O)c2O)no1 371678100 YAFZHKZZPGQONY-LLVKDONJSA-N 349.343 1.149 10 10 EDCE Cc1nc(CNC(=O)NCc2cc(Br)ccc2O)no1 805153097 YMDRPGNUHFXMEL-UHFFFAOYSA-N 341.165 1.846 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)N1CC(N=[N+]=[N-])C1)C[C@@H]1CCCO1 2250599123 LDQNVRNKTPRGOW-LBPRGKRZSA-N 339.396 1.924 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@@H]3CCCN3C)C2)cc1 823247771 KCHOABHKBGOZNJ-RDJZCZTQSA-N 346.475 1.915 10 10 EDCE CC(C)[C@@H](O)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 823548146 IKNACBVANQFEPT-KRWDZBQOSA-N 335.448 1.464 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)/C=C/Cn2cncn2)cc1 911890902 CYSYDZGYOCSESW-SNAWJCMRSA-N 329.404 1.438 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NC[C@H]2CN(C3CC3)C(=O)O2)c1 847456968 RLKGKOHCCCMKRW-GWCFXTLKSA-N 349.387 1.744 10 10 EDCE CNC(=O)c1cc(N2CCN(c3ccc(OC)cc3)CC2)ccn1 746962507 FDOSYNLIYFJMDT-UHFFFAOYSA-N 326.400 1.776 10 10 EDCE CCCC[C@H](NC(N)=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855229419 JZXFAQNJWQXLMT-BBRMVZONSA-N 348.447 1.617 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cccc4nn[nH]c34)C2)cc1 855228271 YNPNDOKBFPOJKT-GFCCVEGCSA-N 337.383 1.975 10 10 EDCE CN(C)C(=O)N(C)[C@H]1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 856086481 AFDIDJMMRCJZMW-VGVVRCBHSA-N 333.388 1.325 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCC[C@@H](C)CO)C2)cc1 853917054 SYYSTWFTMRSNCY-CABCVRRESA-N 335.448 1.982 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1C[C@H](C(N)=O)C1 858542763 BKNHPTOWXAKZGB-BPLDGKMQSA-N 332.448 1.555 10 10 EDCE Cc1cn(C)nc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 850415689 PFEXZJVZHFUAGY-GFCCVEGCSA-N 329.404 1.610 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCOC[C@H](C)C3)C2)cc1 854300494 UQKZATOKOAUAND-HUUCEWRRSA-N 333.432 1.952 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3nccn3C)C2)cc1 854298321 AHEAMFUMGJGELC-CQSZACIVSA-N 343.431 1.849 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@H]3CC[C@H]2[C@@H]2CNC[C@H]32)cc1 866696386 IKHIWGAXBRIZLS-OWYHZJEWSA-N 342.487 1.299 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 860194857 YTIOGYOOXBWLGJ-OAHLLOKOSA-N 325.478 1.514 10 10 EDCE CN1CCN(c2ccc(CNC(=O)Cc3cncnc3)cc2)CC1 881853928 OLTFYIIDHRGRKH-UHFFFAOYSA-N 325.416 1.087 10 10 EDCE COCCN(Cc1cc(C)cc(Br)c1O)[C@@H](C)C(N)=O 781912611 OXRHOFIJHJMNEA-JTQLQIEISA-N 345.237 1.785 10 10 EDCE CN(C)C(=O)NCCCNCc1c(O)cccc1Br 1964070764 LPWPYMDXBCAKER-UHFFFAOYSA-N 330.226 1.906 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1170073486 UHOFERNEYNVIBU-GFCCVEGCSA-N 336.388 1.766 10 10 EDCE O=C(C(=O)N(Cc1ccccn1)C1CC1)N1Cc2cccc(O)c2C1 1331987118 YJNCICVQURBGQF-UHFFFAOYSA-N 337.379 1.821 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(C)C[C@H]2CO)c(Br)c1 699491595 LZHHXVMWVQKFDU-YPMHNXCESA-N 342.281 1.842 10 10 EDCE O=C(NC[C@H]1CCC2(CCC2)O1)C(=O)N1Cc2cccc(O)c2C1 1333027163 STYVKEZRVYQYOJ-CYBMUJFWSA-N 330.384 1.452 10 10 EDCE O=C1COC[C@]2(CNCc3ccc(N4CCCC4)cc3)COCCN12 1331966911 XNKBDLWMHXLOBI-IBGZPJMESA-N 345.443 1.004 10 10 EDCE O=C(NC[C@H]1CC2(CCC2)CO1)C(=O)N1Cc2cccc(O)c2C1 1353841281 UGBZEMTVIYEPDY-CYBMUJFWSA-N 330.384 1.310 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21 1351821828 BKUFZKCMCYIHCU-RBZJEDDUSA-N 328.412 1.759 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)Cn3nccc3N)C2)cc1 1452033823 VJYIRZWODXSYLA-CYBMUJFWSA-N 329.404 1.117 10 10 EDCE CCN(CC)c1ccc(CNC(=O)CN(C)[C@@H]2CCC[C@H]2O)cc1 1464303065 WNZILIIIAWPZCM-QZTJIDSGSA-N 333.476 1.994 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)Cc2cnc[nH]2)cc1C 1700768955 SSAZHDZIQXAUNO-CQSZACIVSA-N 330.432 1.906 10 10 EDCE O=C(COc1ccc2c(c1)CCC(=O)N2)NCc1cccc(O)c1O 1471643122 FCCVJOZAEAITJM-UHFFFAOYSA-N 342.351 1.678 10 10 EDCE O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCc1c(O)cccc1O 1558534755 XRWFSPJIUCFANG-RYUDHWBXSA-N 346.383 1.279 10 10 EDCE CC[C@H](CNC(=O)[C@H](C)NC(C)=O)NCc1ccc(OC)c(C)c1 1715050337 LTDXNGOLLBVGHE-XJKSGUPXSA-N 335.448 1.513 10 10 EDCE Cc1nn(-c2cccnc2)nc1C(=O)NCc1ccc(O)c(O)c1 1630273862 VQFLEBWFELASJZ-UHFFFAOYSA-N 325.328 1.312 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@]2(F)CCOC2)cc1C 1732891557 LAQGPXMBNFWFFL-JXCVUKRWSA-N 336.407 1.894 10 10 EDCE C[C@@H](Cc1cccnc1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1647839258 FKHAMEPOSAWMPU-NSHDSACASA-N 349.412 1.520 10 10 EDCE NS(=O)(=O)c1cc(C(=O)NCc2c(O)cccc2F)oc1Cl 1652298409 KDSMRZRBKZYCEG-UHFFFAOYSA-N 348.739 1.355 10 10 EDCE COCCNCc1ccc(N2C[C@@H](O)[C@H]2C)c(Br)c1 2126118977 HLENFMUKGLFBDV-QMTHXVAHSA-N 329.238 1.755 10 10 EDCE CC(C)(CNC(=O)NCc1cccc(Cl)c1O)CS(N)(=O)=O 1687336266 VOSIPXMNCYTBPS-UHFFFAOYSA-N 349.840 1.160 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)[C@H]3CCOC3)c(Br)cc21 250703758 DJDVMDNHLWZAPN-SDBXPKJASA-N 340.221 1.887 10 10 EDCE CCNC(=O)CC(=O)N(C)[C@H](C)CNCc1ccc(OC)c(C)c1 1698823731 SFFBCTOPCVNUCN-CQSZACIVSA-N 335.448 1.466 10 10 EDCE COC(=O)[C@H](O)CNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 155352552 WSPFWXAQPWEDOV-OAHLLOKOSA-N 334.347 1.497 10 10 EDCE Nc1ccc(N2CCN(c3nc4c(c(=O)[nH]3)CCCC4)CC2)cc1 19689660 SSAWRNQMXVLTBY-UHFFFAOYSA-N 325.416 1.558 10 10 EDCE COC(=O)[C@H](NCCN=[N+]=[N-])c1c(Br)nn(C)c1C 2131551996 NIIXSXRLMGPMIE-MRVPVSSYSA-N 331.174 1.605 10 10 EDCE OCC12COC(CNCc3cc(Br)ccc3O)(C1)C2 1967803102 RRZUYBACXPVBTG-UHFFFAOYSA-N 328.206 1.786 10 10 EDCE CN(C)C[C@H]1COC[C@@H]1NCc1ccc(Br)cc1O 2141464578 KJZIDJMWKUUOMI-AAEUAGOBSA-N 329.238 1.821 10 10 EDCE Oc1c(Br)cccc1CN[C@@H]1COC2(CCC2)[C@@H]1O 2141560264 YCRZPKHPNFNXGA-DGCLKSJQSA-N 328.206 1.927 10 10 EDCE COCCNCc1ccc(N2CC[C@H](O)C2)c(Br)c1 234694333 QEYZRDXDMGANEP-LBPRGKRZSA-N 329.238 1.756 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985100353 FVJMFWIWDMFYEO-LLVKDONJSA-N 327.385 1.687 10 10 EDCE COc1cccc(CNC[C@@H](O)CNC(=O)OC(C)(C)C)c1O 1985772328 VCJPIYLQJIHOAA-GFCCVEGCSA-N 326.393 1.376 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 1990359371 ZIBUOZVGOUSHLZ-ONGXEEELSA-N 325.369 1.580 10 10 EDCE CN(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010393696 WCNIOAYCUZPKJG-VXGBXAGGSA-N 340.428 1.743 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)N1CC[C@H](N=[N+]=[N-])C1 2010402683 UPEXEBWNWGDVSI-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)Nc1ccc(N)cc1 2029277743 YKIIRWSXUUZDHM-UHFFFAOYSA-N 331.195 1.566 10 10 EDCE CNC(=O)CN(Cc1ccccc1)C[C@@H](O)COc1ccc(N)cc1 2034782830 MOXDCQZUTMFRMA-QGZVFWFLSA-N 343.427 1.257 10 10 EDCE O=C(O)C[C@H](COCc1ccccc1)NC(=O)c1cc(O)nc(O)c1 2035474292 XXPXYPYATCVXRM-CYBMUJFWSA-N 346.339 1.283 10 10 EDCE Cn1ncc(CNCc2cc3c(cc2O)OCO3)c1Br 2173184918 YAJJRAQUVFKXHC-UHFFFAOYSA-N 340.177 1.907 10 10 EDCE CNCc1ccc(N2CC[C@@H](O)[C@@H](CO)C2)c(Br)c1 396829983 PPBOGTNKVFFPJU-BXUZGUMPSA-N 329.238 1.348 10 10 EDCE O=C(N1CCC(CNCc2ccc(O)cc2O)CC1)C(F)(F)F 397725679 MYDXYZRLDFAARQ-UHFFFAOYSA-N 332.322 1.988 10 10 EDCE NCc1cc(F)c(N2C3COCC2COC3)cc1Br 399766455 IJSZJOUUYDTVFA-UHFFFAOYSA-N 331.185 1.651 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCO[C@@H](COC(C)C)C3)c2n1 2062553787 XLUKSBUXKOTTON-GFCCVEGCSA-N 334.376 1.009 10 10 EDCE CS(=O)(=O)c1cnn(Cc2cccc(F)c2O)c1Br 2070220947 GWKZSRQOKVRXAA-UHFFFAOYSA-N 349.181 1.942 10 10 EDCE CN1CCN(CCc2ccc(N)cc2)[C@H](CNC(=O)OC(C)(C)C)C1 2044608004 KYJJFPZBZUVHED-QGZVFWFLSA-N 348.491 1.952 10 10 EDCE CN1C[C@@H]2C[C@H]1CN2c1cc2c(cc1Br)[C@H](N)C(=O)N2 2187589473 YRVRMHFOVODCJC-UPFKWVMWSA-N 337.221 1.294 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@H](O)CC2(C)C)c(Br)c1 2188630058 JJWYABRDQZCMML-ZIAGYGMSSA-N 343.265 1.879 10 10 EDCE CNCc1ccc(N2CCOC[C@]2(C)CO)cc1Br 2112706264 SNCDTVPNXIMLKB-AWEZNQCLSA-N 329.238 1.756 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2247135059 YVYHYRUNYCDSLG-PRXAMGSTSA-N 342.411 1.991 10 10 EDCE COCCN1C(=O)C(=Cc2c[nH]c3ccccc23)C(=O)NC1=S 2297560257 HZANXHYCKMHBKQ-UHFFFAOYSA-N 329.381 1.441 10 10 EDCE C[C@@H]1CN(C(=O)C=Cc2ccc(O)c(O)c2)CCN1CC(C)(C)O 2310590550 LMMIIMIZZZKPIT-CYBMUJFWSA-N 334.416 1.415 10 10 EDCE CN(CC1(CO)CC1)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2310796511 SXVUTVLRITZZAK-UHFFFAOYSA-N 330.428 1.767 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2329333927 ZOJRWECEBDIRNK-OLRMPSLUSA-N 327.222 1.099 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(Br)c1 2330386772 QHNJPIXZZBHJMM-NZPIUUIZSA-N 328.206 1.262 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)cc1Br 2331965945 YCGLKCYBBGONCR-YXCITZCRSA-N 327.222 1.371 10 10 EDCE Cc1ccc(CN2CCCN(C)S2(=O)=O)c(O)c1Br 2352949095 YJJQPYZOWWMSBS-UHFFFAOYSA-N 349.250 1.845 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(S(C)(=O)=O)CC2)c(Cl)c1 62084954 GIFOIVSXTMXEGM-LLVKDONJSA-N 331.869 1.702 10 10 EDCE CN1C2(CCC2)COC[C@]1(CO)CNCc1ccc2c(c1)CCO2 527753648 MISWNMKXTXRGGR-LJQANCHMSA-N 332.444 1.327 10 10 EDCE COc1ccc(O)c(CNC(=O)/C=C\c2ccc(C(N)=O)cc2)c1 255475339 TUEWRQBLAGDLQZ-WTKPLQERSA-N 326.352 1.829 10 10 EDCE CC(=O)N1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H](C)C1 268718118 VDQQNFZHTFWYIG-OAHLLOKOSA-N 346.475 1.264 10 10 EDCE CC(=O)N1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)[C@@H](C)C1 268810843 GKYFXXIVHPFEJP-AWEZNQCLSA-N 344.459 1.831 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cccn(C)c3=O)CC2)cc1F 267947625 JNTIWUPQSCEODY-UHFFFAOYSA-N 345.374 1.495 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2[C@H]3CC[C@H]2CC(O)C3)cc1F 285583924 ADMONYDZHDFJON-STQMWFEESA-N 349.406 1.022 10 10 EDCE Cc1ccc(CN2CC[C@]3(CNC(=O)N3)C2)c(O)c1Br 2381128433 UPQKJMMBKUHVLU-AWEZNQCLSA-N 340.221 1.720 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2[C@H]3NCCO[C@@H]32)c(O)c1Br 2381141984 HINFTHKJORRWGZ-IRUJWGPZSA-N 341.205 1.066 10 10 EDCE NC(=O)CC1CN(c2ccc(/C=C/C(=O)O)cc2Br)C1 382221487 WDXYMBHSRSSMMN-DUXPYHPUSA-N 339.189 1.859 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CCCN1CC(F)(F)F 291964604 RUGUFXXQMUOSAG-NSHDSACASA-N 332.322 1.783 10 10 EDCE CC(=O)C(=O)COC(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2 808499844 PBLCHIRQBVRMKQ-UHFFFAOYSA-N 330.315 1.815 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC[C@H](O)CN1CCN(C)CC1 819376732 IKIUIBHWQWWJKB-PXNSSMCTSA-N 348.535 1.190 10 10 EDCE COc1ccc(O)c(CNC(=O)Nc2cc(C)nnc2N(C)C)c1 824535039 MVRZLBWHKBVYIU-UHFFFAOYSA-N 331.376 1.887 10 10 EDCE CN(C)C(=O)N(C)[C@@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 827544724 IYDRKGYNAPHXAI-GOSISDBHSA-N 346.475 1.711 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)c2cc3c(cn2)OCCO3)cc1 832267319 QKZQCPGXLUWPDX-AWEZNQCLSA-N 342.399 1.349 10 10 EDCE Cn1nnc2c1C[C@@H](NCc1c(O)cccc1Br)CC2 922991060 DVMAUIBCRQZZGY-VIFPVBQESA-N 337.221 1.930 10 10 EDCE CN1CCN(C(=O)c2csc(Cc3ccc(N)cc3)n2)CCC1=O 851646029 UAMNPEJEGSKIOZ-UHFFFAOYSA-N 344.440 1.620 10 10 EDCE O=C(O)CSCC(=O)NCc1ccc(N2CCC(O)CC2)cc1 851703743 YJGPIERGPNPBJZ-UHFFFAOYSA-N 338.429 1.082 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnn4cccnc34)C2)cc1 855230843 FHCBUJZBXBWHNX-CYBMUJFWSA-N 337.383 1.747 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H](C[C@H]3CCCO3)C2=O)cc1F 924544302 XUAKDUVCAJSJGF-OCCSQVGLSA-N 335.379 1.881 10 10 EDCE COc1ccc(N2CCCN(C(=O)NCc3ccn(C)n3)CC2)cc1 765766190 NDJOWAMYLJBQKJ-UHFFFAOYSA-N 343.431 1.851 10 10 EDCE COC(=O)[C@@H]1CC[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)O1 860243659 SWVWFNSVSILJRX-CVEARBPZSA-N 333.384 1.608 10 10 EDCE C[C@H](NS(=O)(=O)c1cnc2n1CCC2)c1ccc(N(C)C)cc1 773089672 UALKYXNIRQGFLH-LBPRGKRZSA-N 334.445 1.935 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCOCC3(CC3)C2)cc1 785423865 ICIVQQIXKSOOHB-UHFFFAOYSA-N 331.416 1.008 10 10 EDCE Cc1nccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1 793760978 HZLOTIBCMMEKOC-LBPRGKRZSA-N 341.415 1.345 10 10 EDCE CCO[C@H]1C[C@H](N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1(C)C 1261859875 HUGKQADZDKPTAM-HOTGVXAUSA-N 346.427 1.896 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)C[C@@H]2CCC(=O)N2)cc1C 1268409574 ZVBMSQHFJIUQHS-HOCLYGCPSA-N 347.459 1.657 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)C[C@H]2COC(=O)C2)cc1C 1268361279 RSQINRKULJEUGI-GOEBONIOSA-N 348.443 1.941 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC1(N2CCCC2)CCOCC1 1443649045 YBPCIRBKMZDRHG-UHFFFAOYSA-N 334.416 1.402 10 10 EDCE CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1440745703 ILUNBYAVHXRTIC-CMPLNLGQSA-N 338.429 1.457 10 10 EDCE C[C@@H](NC(=O)Cc1nc(C2CCOCC2)n[nH]1)c1ccccc1O 1454803740 GLZPHAMJMRIRHK-LLVKDONJSA-N 330.388 1.824 10 10 EDCE Cc1ccc(C(=O)NCc2ccccc2S(C)(=O)=O)c(O)c1O 1451530615 WWFPCQVXISUELK-UHFFFAOYSA-N 335.381 1.740 10 10 EDCE CN(C)C(=O)/C=C/C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1456937219 VBNDHNVMPBAYRN-PCUGXKRQSA-N 332.448 1.116 10 10 EDCE O=C(/C=C/[C@@H]1CCOC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1465420634 KIYVYNJUEHOBSG-KWEXDPCDSA-N 348.418 1.996 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NOCc2ccccn2)c1 1629526129 VPLQXKPNSSDVGH-UHFFFAOYSA-N 337.357 1.020 10 10 EDCE CN(CCCO)[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1713400766 KYBYEGHRZYQDRL-OAHLLOKOSA-N 347.419 1.768 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cc2cc[nH]n2)cc1C 1715800082 QFZFQWFTCYAHLF-ARJAWSKDSA-N 328.416 1.731 10 10 EDCE CCN1CCN(CCCCNC(=O)Cc2ccc(O)c(O)c2)CC1 1628249191 NARIRKYRGZMFHL-UHFFFAOYSA-N 335.448 1.174 10 10 EDCE CN1C(=O)[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)Cc2ccccc21 1557449121 QHSMFYBQISYURH-RCQQVGEISA-N 338.363 1.815 10 10 EDCE COC(=O)C1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCOCC1 1569103673 QHTXJVSMIIMJFI-UHFFFAOYSA-N 334.332 1.301 10 10 EDCE CCCCCN1CC(O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1569791577 MINDETWLTKBYLB-UHFFFAOYSA-N 347.419 1.816 10 10 EDCE CC[C@@H](CNC(=O)Cc1nonc1C)NCc1ccc(OC)c(C)c1 1732217995 MYBRMRNPIHXNBK-HNNXBMFYSA-N 346.431 1.922 10 10 EDCE CCC(=O)NC[C@H](NCc1nnnn1-c1ccc(OC)cc1)C(C)C 1732552063 RWFQYZVFFKGDPZ-HNNXBMFYSA-N 346.435 1.311 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCc1cc(=O)n2ccccc2n1 1583402874 GTFXMPWOQCRIDE-ALCCZGGFSA-N 337.335 1.435 10 10 EDCE Cc1cc(O)nc(N2CCC[C@@H](NC(=O)c3cccc(O)c3O)C2)n1 1595959464 DHCIBJSBXSLPJQ-LLVKDONJSA-N 344.371 1.301 10 10 EDCE CNCc1ccc(N(C)C[C@@]2(O)CCOC2)c(Br)c1 2129430342 CLSILJXQEKEHRB-AWEZNQCLSA-N 329.238 1.756 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)c(Br)c1 2140657772 IQBHUJYZLWGZPE-GIMBAOAISA-N 333.201 1.349 10 10 EDCE CCNCc1ccc(N2CCOC[C@H]2C(N)=O)c(Br)c1 233531803 JXCBLYKQVVGMIU-ZDUSSCGKSA-N 342.237 1.249 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)OC1(C)CNC1 1952206654 NNGNHNKODRFQRB-CQSZACIVSA-N 338.404 1.870 10 10 EDCE CC(C)(C)OC(=O)N1CCC(=O)[C@@H]1[C@H](N)Cc1ccc(O)c(O)c1 1952911335 RIBVWZFVHPHNGM-ABAIWWIYSA-N 336.388 1.546 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985102851 MRLWDJRPISUSAS-HBNTYKKESA-N 325.369 1.437 10 10 EDCE NCc1ccc(N2CC[C@@H]3CC(=O)N[C@H]3C2)c(F)c1Br 2145058726 VKRGCVZQMMZGSF-SCZZXKLOSA-N 342.212 1.762 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010404917 VPCDVPLSORRUBY-UTUOFQBUSA-N 341.412 1.952 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)OC[C@H]2C)cc1Br 300497518 YPXMNKRBKXONIR-MFKMUULPSA-N 329.238 1.755 10 10 EDCE NCc1cc(F)c(N2CC[C@H]3C(=O)NC[C@H]3C2)cc1Br 2157183396 IHVSGGVFRXDCOV-VHSXEESVSA-N 342.212 1.619 10 10 EDCE [N-]=[N+]=NCCCNC(=O)CNC(=O)c1cccc(Br)c1 701323020 ISGOKLKRSWQFII-UHFFFAOYSA-N 340.181 1.996 10 10 EDCE NC(=O)N1CC[C@H](NCc2cc(Br)cc(F)c2O)C1 715719930 HFAIHZTVQRXWNP-VIFPVBQESA-N 332.173 1.536 10 10 EDCE O=C(O)[C@@H]1CN(Cc2cc(Br)ccc2O)C2(CC2)CO1 2183995743 IIQRWTXBZGIFCL-LBPRGKRZSA-N 342.189 1.973 10 10 EDCE CNCc1ccc(N2CCO[C@H](CCO)C2)cc1Br 2116230072 PWPNHPLYNGRTKB-CYBMUJFWSA-N 329.238 1.756 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])COC1 2210540151 QCLDOVSKOLOKAP-NXEZZACHSA-N 325.369 1.628 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213584407 CXXCWAVJCIRJQV-WOPDTQHZSA-N 340.428 1.789 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@@H]([C@H](C)N)C2)c1O 2236033289 ORPKKEIIUMPPHI-TVQRCGJNSA-N 345.237 1.711 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)N1CC[C@@H](N=[N+]=[N-])C1)[C@H]1CCOC1 2250661820 AUPCIJWOSLZLSU-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE CNCc1ccc(S(=O)(=O)NCc2cnc(SC)s2)o1 2284688160 JLVIYMZVYXOMSC-UHFFFAOYSA-N 333.460 1.656 10 10 EDCE NC(=O)c1cccc(CCNC(=O)C=Cc2ccc(O)c(O)c2)c1 2308000913 ZBPKLPAOCOUOLG-UHFFFAOYSA-N 326.352 1.569 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2329332626 NDGLWLGBOQPOSX-ZDEDFTPMSA-N 327.222 1.399 10 10 EDCE Cc1ccc(CNS(=O)(=O)NC2CCC2)c(O)c1Br 2352931690 BXPATYNARCCOML-UHFFFAOYSA-N 349.250 1.940 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@H](N4CC=CC4)C3)cc2N1 301627283 ABTSZLJDGQEODR-LLVKDONJSA-N 330.344 1.376 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)N2CCOC[C@H]2C(N)=O)c1C 180219824 MNHNBWARMYNXKQ-KRWDZBQOSA-N 341.411 1.729 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@]1(CCO)CCOC1 130448441 NKHMFISNCZXHGB-GOSISDBHSA-N 335.448 1.649 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN(C)[C@@H]2CCN3CCO[C@H]2C3)c1O 295181663 VTUBTWOWVWXRRG-OCCSQVGLSA-N 337.376 1.214 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(CC)[C@@H]3CCOC3)nc12 812877732 FYZLWTLQLQQTHD-GFCCVEGCSA-N 334.376 1.222 10 10 EDCE CN(C)c1ccc(CN2CCN([C@H]3CCNC(=O)CC3)CC2)cc1F 825147394 FHURXRMZVBHXIM-MRXNPFEDSA-N 348.466 1.678 10 10 EDCE CCOc1ccc(O)c(CN2CCS(=O)(=O)[C@@H]3CCC[C@H]32)c1 825202668 SWBWBWUMOUZLRM-GDBMZVCRSA-N 325.430 1.942 10 10 EDCE Cc1cc(CCNC(=O)[C@@H]2CN(C)C(=O)N2)c(C)n1-c1ccccc1 820005415 QFFOCNWGEJEWHJ-KRWDZBQOSA-N 340.427 1.776 10 10 EDCE Cc1cc(C(=O)CN2C[C@H](O)[C@@H](CO)C2)c(C)n1-c1ccc(F)cc1 839171902 LYZZIRPSOKCMPH-KDOFPFPSSA-N 346.402 1.701 10 10 EDCE C[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccncc1 749544733 IOHFASWMVCSZDT-LLVKDONJSA-N 349.412 1.692 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)c3cnccn3)C2)cc1 912292994 RMRXVYNGGKIEST-ZIAGYGMSSA-N 326.400 1.984 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1C[C@@H](N(C)C)C1 848934464 LNDOPIAHKBRBFY-KDYLLFBJSA-N 346.475 1.134 10 10 EDCE CCO[C@@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)C[C@H]1CN 846144263 GSIWIPGPGLJWOH-SJLPKXTDSA-N 344.459 1.568 10 10 EDCE NC(=O)CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 746201062 STPOJVCOHCEJHC-UHFFFAOYSA-N 327.331 1.248 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)c3ncnn3C)C2)cc1 852274826 NGMHXERFYGCLLB-CHWSQXEVSA-N 344.419 1.463 10 10 EDCE CCON(CC)C(=O)CNC(=O)NCc1ccc(N(C)C)cc1C 858712550 JBGNUBXMCFNZJF-UHFFFAOYSA-N 336.436 1.660 10 10 EDCE O=C(NCc1c(O)cccc1F)N[C@H]1CCCN2CCSC[C@@H]12 925169819 LILQISKUWKTDQW-KBPBESRZSA-N 339.436 1.910 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](O)C(F)(F)F)C2)cc1 854298371 BTQLHFBQVGLDRP-GWCFXTLKSA-N 347.337 1.496 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@]3(CCCCN3)C2)cc1 923532978 DEHWOPGBCDUDPF-LJQANCHMSA-N 330.476 1.587 10 10 EDCE COc1ncncc1CNCc1ccc(N2CCC(O)CC2)cc1 850406490 IJCCFVRLMZDDBJ-UHFFFAOYSA-N 328.416 1.736 10 10 EDCE 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XNMQZMXVYGGNLD-HUUCEWRRSA-N 346.475 1.864 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3CN4CCC[C@H]3C4)CC2)cc1 924832568 SHRYJAGKJDRPKJ-FXAWDEMLSA-N 344.503 1.501 10 10 EDCE O=S(=O)(CCOCC(F)(F)F)NCc1c(O)cccc1F 921452572 SKDSSKIULSFDHP-UHFFFAOYSA-N 331.287 1.530 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3COC(C)(C)O3)C2)cc1 853977781 RRFWZYIHXFFJSH-XJKSGUPXSA-N 349.431 1.725 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCc3ccn(C)n3)C2)cc1 855223465 AJGUQLWMLYAQHR-HNNXBMFYSA-N 328.416 1.756 10 10 EDCE CN(C)CCn1ccc(C(=O)NCc2ccc3cccnc3c2O)n1 862025461 UZQLHBAQFAYQFX-UHFFFAOYSA-N 339.399 1.629 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCO[C@H](CC(N)=O)C2)c1O 860016426 JUOACHSFDGWQGJ-GFCCVEGCSA-N 326.780 1.324 10 10 EDCE COC(=O)c1c(CN2C[C@@H]3C[C@@]3(CO)C2)c2cc(F)ccc2n1C 894535883 XPQKYYSKIKEORK-VOJFVSQTSA-N 332.375 1.918 10 10 EDCE COc1cccc(CNc2ccc3c(c2)CN(CC(N)=O)CC3)c1O 788528846 GRRXGEVDUZDMCY-UHFFFAOYSA-N 341.411 1.856 10 10 EDCE CNC(=O)CCN(C)Cc1c(C(=O)OC)n(C)c2ccc(F)cc12 893999544 SHGJNTIRGROAAS-UHFFFAOYSA-N 335.379 1.672 10 10 EDCE COC(=O)COc1ccc(N(C)C[C@H]2[C@H](C(=O)OC)C2(F)F)cc1 894445989 SKEJYQYETRBQGN-GXTWGEPZSA-N 343.326 1.729 10 10 EDCE COC(=O)[C@]1(O)CCN(Cc2cc(Br)cc(F)c2O)C1 895702340 NNVJZICNUUJZBD-ZDUSSCGKSA-N 348.168 1.404 10 10 EDCE CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(O)cc1O 1142533238 IDGBERYFRQLKSB-LRDDRELGSA-N 349.431 1.934 10 10 EDCE Nc1ncnc2c1ncn2CCCC(=O)NCc1c(O)cccc1F 1303875624 LRWCGETXTHFSJF-UHFFFAOYSA-N 344.350 1.350 10 10 EDCE CC[C@H](CNC(=O)C[C@H]1CCNC1=O)NCc1ccc(OC)c(C)c1 1318526943 BBKDINDSWXEGEP-HZPDHXFCSA-N 347.459 1.514 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@]3(O)C[C@H]3C2)cc1 1327959805 OWUTUUDPEASIGY-HNAYVOBHSA-N 345.443 1.132 10 10 EDCE CO[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1322535380 GJSNBANLQVJSGR-QWHCGFSZSA-N 337.395 1.192 10 10 EDCE COc1cncc(C(=O)N[C@@H](C)CNCc2ccc(OC)c(C)c2)n1 1322012280 HGMQQHLOMWKADM-ZDUSSCGKSA-N 344.415 1.710 10 10 EDCE COCCc1noc(CN(C)C(=O)c2c(F)ccc(O)c2O)n1 1182987542 ZVCMZTZDGGABFJ-UHFFFAOYSA-N 325.296 1.081 10 10 EDCE CC(C)C[C@@H]1COCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1332018562 GWBOIFFJXUAURP-CQSZACIVSA-N 332.400 1.508 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@@H](C)C2CC2)cc(OC)n1 1354320567 PWJUBPFMGKVTGK-QWRGUYRKSA-N 335.404 1.379 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cc3ncc[nH]3)CC2)cc1C 1277208691 FRAMHPMSICEHBE-UHFFFAOYSA-N 328.416 1.708 10 10 EDCE Cc1oc(C(=O)NCc2ccc(O)cc2O)cc1S(C)(=O)=O 1451753308 IJNYRSMSOVYEFM-UHFFFAOYSA-N 325.342 1.333 10 10 EDCE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H]2C[C@H]2C(N)=O)cc1 1292382326 QMRSKADTHIUHLB-ZACQAIPSSA-N 345.443 1.382 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCN(c2ccccc2F)C1=O 1543268940 WBBZUZXTDVDPLT-CYBMUJFWSA-N 344.342 1.701 10 10 EDCE O=C(NCc1cccc(Br)c1O)c1nc2ncccn2n1 1626823014 ZBOSJVQYSHKFAK-UHFFFAOYSA-N 348.160 1.522 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)Cn2cncn2)C2CC2)cc1C 1723352038 YLWVLMDRDSVCIF-MRXNPFEDSA-N 343.431 1.280 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCn2c(cnc2C(F)(F)F)C1 1639833492 JZAZKMUGSONWFI-UHFFFAOYSA-N 341.289 1.898 10 10 EDCE Cc1nn(CC(=O)N(Cc2ccco2)Cc2ccccc2O)c(=O)o1 1631143554 UGMUIILWRAOVMD-UHFFFAOYSA-N 343.339 1.672 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)CC(N)=O)C2CCCC2)cc1C 1724077458 PMISEAWBEJWODS-INIZCTEOSA-N 347.459 1.644 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@H](CO)[C@H]3C)C2)cc1 1564962841 PHOQHGQBWSBESX-BZUAXINKSA-N 347.459 1.934 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](N)Cc3ccccc3)CC2)cc1 207064125 GQLACWFEFUGMTM-LJQANCHMSA-N 339.439 1.914 10 10 EDCE COC(=O)[C@H](N)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951498418 RXTBSFQAMDBOPF-ZWNOBZJWSA-N 340.376 1.034 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)C(F)(F)F 1980379061 ZYRAEOYIJWNMFS-SOCHQFKDSA-N 338.326 1.708 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1CC(=O)N1CC(N=[N+]=[N-])C1 1987647459 SJILEYJAJRDCQU-KOLCDFICSA-N 325.369 1.437 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@@H]2[C@H](O)CO)c(Br)c1 2146333616 HLXQZBBCVVQLHF-CUOATXAZSA-N 345.237 1.027 10 10 EDCE NCc1ccc(N2CCC([C@H](O)CO)CC2)c(F)c1Br 2152463873 KBBVNSCHJFQFDT-GFCCVEGCSA-N 347.228 1.617 10 10 EDCE N[C@H]1CN(Cc2cc(Br)cc(F)c2O)[C@]2(CCOC2)C1 2154540283 IPZXHIUCCKUHTP-BXUZGUMPSA-N 345.212 1.986 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)COC1 2010401806 IESYBYPENWUHIE-LLVKDONJSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2010403260 BLFWICGNYLPVSO-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE CCN(CCS(C)(=O)=O)c1ccc(CO)cc1Br 688507676 HOONYVSUNDMLKD-UHFFFAOYSA-N 336.251 1.812 10 10 EDCE Oc1c(F)cc(Br)cc1CNC[C@H]1CN2CCN1CC2 715818219 NRJAJKZBWHVDIN-LBPRGKRZSA-N 344.228 1.383 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3COc4c(C)cccc4C3)c2n1 2065023390 AEBLGHFESMSYNF-CYBMUJFWSA-N 338.367 1.785 10 10 EDCE CN(C)C(=O)c1cnn(Cc2c(O)cccc2Br)c1O 2070580115 BMKFYWDBZXBRMJ-UHFFFAOYSA-N 340.177 1.807 10 10 EDCE CNCc1ccc(N2C[C@@H]3OCCO[C@H]3C2)c(Br)c1 2093350051 XHZZSVWPPHZINP-KBPBESRZSA-N 327.222 1.773 10 10 EDCE COC[C@]1(O)CCCN(c2ccc(CN)cc2Br)C1 2095480194 LSADMHMBFKQVBE-AWEZNQCLSA-N 329.238 1.886 10 10 EDCE CN[C@H](c1ccccc1O)[C@@H](O)c1c(Br)ncn1C 2337352370 ZUNCRKVYSZXPRK-ZYHUDNBSSA-N 326.194 1.882 10 10 EDCE CN1CCC(CO)(NCc2ccc(Br)cc2O)CC1 2352525721 UVRZTZVYCFFKNO-UHFFFAOYSA-N 329.238 1.701 10 10 EDCE OCCN(c1ccc(CO)cc1Br)C1CCOCC1 2353644945 JLOVNXQHWXGDGF-UHFFFAOYSA-N 330.222 1.919 10 10 EDCE C[C@@H](NC=C1C(=O)NC(=S)NC1=O)c1ccc2ccccc2c1 60865158 HCUPRYVVNOFWTQ-SNVBAGLBSA-N 325.393 1.905 10 10 EDCE C[C@H]1CN(S(=O)(=O)NCc2ccc(N(C)C)cc2)[C@H](C)CO1 172986837 DBKIBSKQBZHPFW-OLZOCXBDSA-N 327.450 1.196 10 10 EDCE CCONC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 125625044 OPUYMVYZHADEDR-UHFFFAOYSA-N 332.448 1.969 10 10 EDCE Nc1ccc(CC(=O)N2CCC[C@@H]2C(=O)Nc2nccs2)cc1 237882516 KWHQMYSDOYCRSI-CYBMUJFWSA-N 330.413 1.898 10 10 EDCE O=C(O)/C=C/c1ccc(N2CCCNC(=O)C2)c(Br)c1 236466643 LAAJWCOWOINGGX-HWKANZROSA-N 339.189 1.873 10 10 EDCE CC(C)(C)[C@@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(N)=O 255266463 CFMGYKXUWMSPHQ-SKHCZCESSA-N 345.443 1.553 10 10 EDCE CCCn1[nH]ccc1=NC(=O)CN1CCOc2cc(N(C)C)ccc21 255336788 LJFCESCYWDDAAN-UHFFFAOYSA-N 343.431 1.619 10 10 EDCE CC[C@@H]1C(=O)NCC(=O)N1Cc1ccc(C)c(Br)c1O 2380811581 MYJFORXNRAQMMB-SNVBAGLBSA-N 341.205 1.700 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[C@H]1CCOC1 807325497 IELUIZGPHHWASG-HNNXBMFYSA-N 333.432 1.254 10 10 EDCE COc1ccc(C(=O)NCc2cc(Br)ccc2O)nn1 804739396 YNVKTMGPRZYWHW-UHFFFAOYSA-N 338.161 1.883 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCCOC(C)(C)C)cc1F 803661908 ODHIGEQGWOBJSR-UHFFFAOYSA-N 339.411 1.439 10 10 EDCE COC1(CF)CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2168733911 XAWLMZFURUXALN-LLVKDONJSA-N 345.168 1.609 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H](C(=O)O)C1 817890443 UANHNIHVEOLQSO-CQSZACIVSA-N 347.415 1.034 10 10 EDCE CNS(=O)(=O)CCCN(Cc1ccc(N(C)C)cc1)C1CC1 734847288 GXFAPNONKHGRMM-UHFFFAOYSA-N 325.478 1.656 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN1Cc1c(O)cc(C)cc1Cl 840919088 SZRUUZYJAQSVQQ-NSHDSACASA-N 332.853 1.868 10 10 EDCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C1(F)CC1 843773248 MIKVRRRIAQBNIC-UHFFFAOYSA-N 326.393 1.040 10 10 EDCE COC[C@H]1C[C@@H](O)CN1c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 845680967 GTADBANZSPZCKP-FSMZVQOTSA-N 336.344 1.367 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)Cn3ccnc3)C2)cc1 849225068 NATSWRIIQPVZQJ-GJZGRUSLSA-N 343.431 1.858 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3C)C2)c1 750657067 LVXCCSOUDZANPR-UUIJZJDISA-N 347.415 1.770 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC3CC2(C(=O)OC)C3)c([N+](=O)[O-])c1 853808770 IXIIZXYMUQRYKM-XQRVVYSFSA-N 346.339 1.923 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3nc(C)no3)C2)cc1 852185041 UJFLSSBIWIJUIA-LBPRGKRZSA-N 331.376 1.465 10 10 EDCE CC[C@H](NC1CN(S(=O)(=O)N(C)C)C1)c1cc(Cl)ccc1O 858569543 KEKCNGRKYDTZCB-ZDUSSCGKSA-N 347.868 1.577 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3[C@H]4CC[C@H]3COC4)C2)cc1 852448652 LJEQXXPXCBFLKG-KBMXLJTQSA-N 331.416 1.847 10 10 EDCE Cn1nc(C(=O)OC(C)(C)C)cc1/C=C1/SC(=S)NC1=O 864363514 RVBXUFCHVADEMS-RMKNXTFCSA-N 325.415 1.864 10 10 EDCE C[C@@H](O)CNC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 765533942 AMTUSBGHZSKISX-OAHLLOKOSA-N 346.475 1.399 10 10 EDCE O=C1N=C(N2CCCCC2)S/C1=C\c1cn(C[C@@H]2CCOC2)nn1 865219262 XMXSOYBAJFHQCU-QENILXLESA-N 347.444 1.771 10 10 EDCE NCc1cc(F)c(N2CCO[C@@H]3COC[C@@H]32)cc1Br 1877649233 WHXHPWSIGUIZAJ-QWHCGFSZSA-N 331.185 1.651 10 10 EDCE COC(=O)c1c(CN2C[C@H]3C[C@H]2C(=O)O3)c2cc(F)ccc2n1C 894878049 QGNBRAYLASXMJT-YGRLFVJLSA-N 332.331 1.604 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1ccc2nnc(O)n2c1 1142728231 OXQFXICMKRZFRW-UHFFFAOYSA-N 335.323 1.619 10 10 EDCE Cn1nccc1[C@@H]1C[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CCO1 1158230111 MVDZLLBASQQCFU-WXVIGYHGSA-N 343.383 1.881 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H](O)Cc1ccccc1F 1177982229 VELKQYNVGHNTIG-OWNNVSBGSA-N 331.343 1.970 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nccc(C)n1 1321477892 GUVYNNWWLDQFPH-LBPRGKRZSA-N 345.355 1.100 10 10 EDCE CCN(CCN(C)C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 688295377 QZYOGVJSARDURW-ZDUSSCGKSA-N 341.253 1.789 10 10 EDCE C[C@H]1C[C@@H]1C(=O)NC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1357922090 PACUKZYJJURHFK-DGFJTUPSSA-N 343.387 1.907 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CN(C)CCN1C 1444416583 RPCHISSEUWNDBC-SMDDNHRTSA-N 332.408 1.213 10 10 EDCE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CC[C@H](C(N)=O)C1 1510671675 DPQCVKAITDVETL-HNNXBMFYSA-N 342.447 1.321 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@@H]2CN3CCN2C[C@@H]3C)cc1F 1293225640 ZXQZVBCPYIXNEY-KSSFIOAISA-N 348.466 1.676 10 10 EDCE COc1ccc(C(=O)NCc2c(O)cccc2O)cc1-n1cnnn1 1456310487 BTIVJSUBYAZLCD-UHFFFAOYSA-N 341.327 1.012 10 10 EDCE NC(=O)[C@@H](C1CC1)N(CC1CC1)C(=O)/C=C/c1ccc(O)c(O)c1 1454964244 WUVAQYQSBTWQIX-IOMDMTNGSA-N 330.384 1.614 10 10 EDCE COc1ccc(N2CCN(c3nn(C)cc3[N+](=O)[O-])CC2)cc1F 1612120110 XVUDQCGFWMRTHI-UHFFFAOYSA-N 335.339 1.803 10 10 EDCE CC1=C(C(=O)NCc2ccc(N(C)C)cc2C)S(=O)(=O)CCO1 1617046212 BGTKVLAWFGKDNX-UHFFFAOYSA-N 338.429 1.354 10 10 EDCE C[C@H](NC(=O)C[C@H]1CCC(=O)NC1)c1ccc(N2CCOCC2)cc1 1542403348 SRRWQLNGYSRGMI-LSDHHAIUSA-N 345.443 1.617 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(Cn2ccnn2)o1 1556158119 SFQYLIZHARPTJY-LLVKDONJSA-N 342.355 1.692 10 10 EDCE C[C@@H](NC(=O)c1cnn2c(=O)cc[nH]c12)c1ccc(N(C)C)cc1 1556260605 OGITUXQCBYDXAS-LLVKDONJSA-N 325.372 1.580 10 10 EDCE CN1C(=O)[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)Cc2ccccc21 1557449118 QHSMFYBQISYURH-KGXGESDWSA-N 338.363 1.815 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H]3[C@H]2CCCN3CCO)cc1 1558701799 GFPDEHJIUITJOC-LSDHHAIUSA-N 345.403 1.520 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2cncn2C)cc1C 1498575933 IULANZHAQBWQGC-UHFFFAOYSA-N 330.432 1.989 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCc1ccn(C)n1 1726357811 RFVSHPJZFBKJIE-UHFFFAOYSA-N 326.404 1.905 10 10 EDCE COCc1cc(C(=O)N(C)CCNCc2ccc(OC)c(C)c2)no1 1493721472 DRAYFWIFEYGQCT-UHFFFAOYSA-N 347.415 2.000 10 10 EDCE CC(=O)N1CCC(NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 1560290948 VXEMMDLKZYQPFO-UHFFFAOYSA-N 349.450 1.887 10 10 EDCE C=C/C=C\CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1641098018 NMRFIMYQSIZIRA-ARJAWSKDSA-N 334.441 1.670 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC1CCN([C@@H]2CCOC2=O)CC1 1597147903 KTTUXYGWINNWHM-CTGSTSKSSA-N 346.383 1.007 10 10 EDCE CN(C)c1noc(CNC(=O)NCc2cccc(Cl)c2O)n1 1682277742 LCSMCTBLJKZJCD-UHFFFAOYSA-N 325.756 1.494 10 10 EDCE CN(C)C(=O)CNC(=O)c1cccc2c1C(=O)c1ccccc1C2=O 175277997 WXZNJIDITFIBNM-UHFFFAOYSA-N 336.347 1.280 10 10 EDCE CN(C)C(=O)[C@H]1CCCN1c1ccc(CN)c(Br)c1 228148270 JNZKSJUMIPHJBJ-CYBMUJFWSA-N 326.238 1.965 10 10 EDCE CO[C@@H](c1ccc(O)c(O)c1O)[C@H](NC(=O)OC(C)(C)C)C(=O)O 1952365805 VQKVINZGQOTUCU-CABZTGNLSA-N 343.332 1.469 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N(C)CCN=[N+]=[N-] 1985095752 IXPVTFFKDAJOOV-QWRGUYRKSA-N 327.385 1.637 10 10 EDCE Nc1ccc(OCCNS(=O)(=O)c2cnc(Cl)s2)cc1 2162376992 FFEHBBZOXUMGQH-UHFFFAOYSA-N 333.822 1.736 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@H](c3ccccc3)N(C)C)c2n1 2064300000 WNBUTJGYHFNZHR-HNNXBMFYSA-N 339.399 1.776 10 10 EDCE NC[C@@]12CN(Cc3cc(Br)cc(F)c3O)C[C@@H]1CCO2 2175178704 BTRSDQSDHUJWSC-IINYFYTJSA-N 345.212 1.843 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 1906905758 FHOCSBGHOHOSFY-RSLFNQERSA-N 336.432 1.899 10 10 EDCE CO[C@@H]1CN(Cc2cc(Cl)cc(Br)c2O)C[C@H]1N 2058768542 QSJHZMACSVWYKT-GHMZBOCLSA-N 335.629 1.966 10 10 EDCE CC(C)(C)OC(=O)N1Cc2[nH]cnc2C[C@H]1C(=O)NCCCN=[N+]=[N-] 2060617868 SCVIYFRFCGPXFB-LBPRGKRZSA-N 349.395 1.888 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2CC(=O)Nc1ccc(N)cc1 2067324873 YDJROMQRXIKEMF-GJZGRUSLSA-N 346.431 1.901 10 10 EDCE CNCc1ccc(N2C[C@H](O)C[C@@H](OC)C2)cc1Br 2109023082 WKNRAGGLSZWFDC-CHWSQXEVSA-N 329.238 1.755 10 10 EDCE OCc1ccc(N2CCc3c(cnnc3O)C2)c(Br)c1 2206096748 AKAAQPNLJZZYEK-UHFFFAOYSA-N 336.189 2.000 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2236646053 SVSSDJKQBCXMQU-TXEJJXNPSA-N 343.265 1.596 10 10 EDCE O=C1NN(c2ccccc2)C(=O)C1=Cc1coc2ccc(O)cc2c1=O 2296311831 KDAWRGNYZOSWEM-UHFFFAOYSA-N 348.314 1.960 10 10 EDCE CN(C)C(=O)C1(CNC(=O)C=Cc2ccc(O)c(O)c2)CCCC1 2307987261 NSZDKXSMLWDXLM-UHFFFAOYSA-N 332.400 1.876 10 10 EDCE O=C(O)C=CC(=O)Nc1cc2c(cc1O)C(=O)c1ccccc1C2=O 2314592681 BWTAYPFISHURPW-UHFFFAOYSA-N 337.287 1.747 10 10 EDCE NCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2332599877 WAZJBIYQYVWNLI-DSMZTOPNSA-N 327.222 1.228 10 10 EDCE C[C@H]1CN(c2ccc(CN)cc2Br)C[C@@H](C)S1(=O)=O 400845122 NHJSVKSVPDBEDM-AOOOYVTPSA-N 347.278 1.920 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@]1(CCO)CCOC1 130448245 NKHMFISNCZXHGB-SFHVURJKSA-N 335.448 1.649 10 10 EDCE O=C(COc1ccc(Cl)cc1)NCCN1C(=O)CSC1=S 49755751 TYDSHVRPIGGVRS-UHFFFAOYSA-N 344.845 1.695 10 10 EDCE O=C(N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cccc(O)c1O 364666790 RWFHUQIXJURXMH-CQSZACIVSA-N 344.342 1.768 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3C[C@H](C(N)=O)C3)ccc21 628780385 UYWFDAIBQPOTEK-SHTZXODSSA-N 343.427 1.898 10 10 EDCE COc1cc(O)c(CN2CCCC[C@@H]2[C@@H]2CNC(=O)C2)cc1OC 373218810 VDRKTGHWDIKESV-GXTWGEPZSA-N 334.416 1.900 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cn([C@@H]3CCCNC3)nn2)cc1F 827901039 IYGRDRJIHMOZSI-CYBMUJFWSA-N 346.410 1.338 10 10 EDCE CCN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCOC1 823523505 GOUZWNHEFTXRDT-KRWDZBQOSA-N 347.459 1.968 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCNC[C@@H]1C 842264674 BKNBZRFKBXXPLT-ZFWWWQNUSA-N 333.432 1.245 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)N2Cc3cccc(O)c3C2)CO1 927344766 SOXOZYQYTLWSFN-LBPRGKRZSA-N 349.387 1.968 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)COCC(F)(F)F)C2)cc1 855224989 HFXNJEDQGMGFPL-LLVKDONJSA-N 332.322 1.969 10 10 EDCE CCOC(=O)[C@@H]1NCC[C@H]1N[C@@H]1CCN(c2ccc(OC)cc2)C1 854218605 ZEAKAFWWNUFQNP-KBRIMQKVSA-N 333.432 1.157 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)c2cc(C(C)(C)N)no2)cc1 852791759 LUIIYEDJHITKOI-ZDUSSCGKSA-N 331.420 1.364 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)NCCCCCN2CCNCC2)c1 925847043 ZOGJFVMNMFLBHJ-OAHLLOKOSA-N 349.475 1.905 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3C[C@H]4CC[C@H]3NC4)C2)cc1 851639600 HXHKIFNEBLBVLY-DTTOXWODSA-N 329.444 1.778 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)C1(N2CCOCC2)CC1 868936834 GMGXPSBBKIWAJY-UHFFFAOYSA-N 327.384 1.421 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CNCCC2CCS(=O)(=O)CC2)c1 768648910 AHHVOJRHERNTDD-UHFFFAOYSA-N 328.390 1.605 10 10 EDCE CC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 869294504 AXMWLGJFAXLLEK-GOSISDBHSA-N 345.443 1.275 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cn(C4CC4)nn3)C2)cc1 862159128 OQTLXIAIUFCKPA-GFCCVEGCSA-N 327.388 1.630 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCC(c2ccon2)CC1 1118475733 QZVXYDFTRFUSCX-UHFFFAOYSA-N 343.383 1.745 10 10 EDCE CN(C)S(=O)(=O)C1(CNCc2cc(Cl)cc(F)c2O)CC1 895812124 LPDLRWRESMOMEO-UHFFFAOYSA-N 336.816 1.698 10 10 EDCE CC(=O)N1CCN(c2ccc(CN=c3cc[nH]cc3CO)cc2)CC1 893403333 YQYNEPHEXIHJFT-UHFFFAOYSA-N 340.427 1.276 10 10 EDCE CC(=O)N1CC[C@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)C1 897779884 UCZHWGUDRBVMRM-SNVBAGLBSA-N 334.397 1.911 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cnn(-c2ccc(F)cc2)n1 1156881205 URZDDBBXDKLRNF-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE CCOc1ccc(-c2nn(Cc3ccc(N)cc3)c(=O)[nH]c2=O)cc1 82725300 FTQVMQYIEQTIQJ-UHFFFAOYSA-N 338.367 1.628 10 10 EDCE O=C(CNC(=O)Cc1cccc(F)c1)NCc1cc(O)ccc1O 1176748305 NYTZVXMCBLEXDY-UHFFFAOYSA-N 332.331 1.212 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CN2CCCCC2=O)cc1C 1321905861 ATSKNGBZLJCOHX-HNNXBMFYSA-N 347.459 1.610 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN(c2ccncc2)CC1 1180913969 LXGCEZLRDQNCOE-UHFFFAOYSA-N 327.384 1.821 10 10 EDCE CCOc1ccc(N2CCN(C[C@@H](O)C3(O)CCCC3)CC2)cc1 1354457644 YNJOQILSZJOTCZ-GOSISDBHSA-N 334.460 1.873 10 10 EDCE CCOCCC(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1284266432 NEMVYVNPFFIPNW-NSHDSACASA-N 349.391 1.510 10 10 EDCE Cc1c(Br)cnn1CC(=O)NCc1cc(O)ccc1O 1455354380 MQAUIRTYHHHDHQ-UHFFFAOYSA-N 340.177 1.682 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H](O)CN2CCCCC2)cc1 1451803568 VTDGYMSLOBVHAG-AWEZNQCLSA-N 333.392 1.426 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H](O)C(F)(F)C(F)(F)F 1471524820 DJPYXJIOUIYZIW-SECBINFHSA-N 329.221 1.315 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2n[nH]c(C)c2O)cc1C 1497564949 NVFVEJLUXGRIAW-SNAWJCMRSA-N 344.415 1.817 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc2c(cc1[N+](=O)[O-])OCCO2 1639441271 OKPMVLFNYFVEML-UHFFFAOYSA-N 346.295 1.707 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCCn1cccn1 1774050369 PMHLKCDFFDQZBX-LBPRGKRZSA-N 343.391 1.454 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)C2CCNCC2)c2nccn2C)cc1 1865871688 CNOZDVYEYWBPKR-QGZVFWFLSA-N 341.459 1.691 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NCc1cc(F)ccc1O 1937553753 TVXYHRLGLZVMCP-STQMWFEESA-N 326.368 1.913 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)cc1Br 2140659152 RHQVGWUBMMLDSR-GZFGJDTESA-N 333.201 1.349 10 10 EDCE NC(=O)CCN(Cc1ccccc1)c1ccc2c(c1)NC(=O)[C@@H]2O 1946834217 MLZMFGLOQJEZQE-QGZVFWFLSA-N 325.368 1.554 10 10 EDCE COc1ccc([C@@H](C)NC[C@H](O)CNC(=O)OC(C)(C)C)c(O)c1 2011423662 VYXCHWUUBQDBKE-NEPJUHHUSA-N 340.420 1.937 10 10 EDCE CNCc1ccc(N2C[C@H](C)O[C@H](CO)C2)c(Br)c1 300494719 GPIHNYMGMGWWDH-JQWIXIFHSA-N 329.238 1.755 10 10 EDCE CNCc1ccc(N2CC(=O)N3CCC[C@@H]3C2)cc1Br 2158197001 INFYRCSIVCBKRY-CYBMUJFWSA-N 338.249 1.980 10 10 EDCE C[C@@H]1CN(c2ccc(CN)cc2Br)CCS1(=O)=O 707125286 JPVPGSYHGJZUBM-SECBINFHSA-N 333.251 1.531 10 10 EDCE COC(=O)Cc1cc(O)n2nc(C3CCCCC3)c(C(=O)O)c2n1 2080934122 DLLSFGZMEVZEFS-UHFFFAOYSA-N 333.344 1.896 10 10 EDCE CN1C[C@@H]2C[C@H](C1)N2c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2187626519 LSKWBUYZPXHWIS-BFHDXFOESA-N 338.205 1.327 10 10 EDCE CCNCc1ccc(N2CC(NC(N)=O)C2)c(Br)c1 2106928180 QSIVPTMYKVHOCU-UHFFFAOYSA-N 327.226 1.416 10 10 EDCE C[C@H](O)c1ccc(N2CC(OCC(N)=O)C2)c(Br)c1 2089139161 HSVQXCSWQMCFDT-QMMMGPOBSA-N 329.194 1.193 10 10 EDCE CCOC(=O)N1CCN(N=Nc2ccc3c(c2)OCC(=O)N3C)CC1 2330245889 JSTDZFHOWIZGCJ-UHFFFAOYSA-N 347.375 1.815 10 10 EDCE CO[C@H]1CNC[C@H](NCc2ccc(C)c(Br)c2O)C1 2352942198 AZVXDEKVLSUNIE-VXGBXAGGSA-N 329.238 1.930 10 10 EDCE Cc1ccc(CN(C)C(=O)c2nc[nH]n2)c(O)c1Br 2352951033 BCQVEDSLBCNZOS-UHFFFAOYSA-N 325.166 1.853 10 10 EDCE Oc1ccc(Cl)cc1CN1CCN(c2ccc3nncn3n2)CC1 120482919 UZRGVPDPACSXBM-UHFFFAOYSA-N 344.806 1.806 10 10 EDCE COc1cc(O)c(CN2CCC[C@H](Cn3cncn3)C2)cc1OC 183405798 PBXOSCKCEWJVCZ-ZDUSSCGKSA-N 332.404 1.913 10 10 EDCE Cc1ccc(S(=O)(=O)NCCN2C(=O)CSC2=S)cc1C 71558022 JGPCTMGXQJRMLR-UHFFFAOYSA-N 344.483 1.442 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)C1C[C@H]2CNC[C@@H](C1)C2=O 369907898 HYXNSIPDUMNPSN-AGUYFDCRSA-N 343.427 1.293 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CC(F)(F)C[C@H]1CO 368722622 QXKGOQCKBYRUJV-HNNXBMFYSA-N 337.370 1.974 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2CC(=O)N1CCOC[C@H]1C1CC1 376149059 MXTZGKUZXVCGGZ-KRWDZBQOSA-N 345.443 1.589 10 10 EDCE COc1ccc(N2CCN([C@@H](C)c3nc(N)nc(Cl)n3)CC2)cc1 289012967 ADYSBMIXYCFUNB-NSHDSACASA-N 348.838 1.999 10 10 EDCE Cc1ccc(CNC(=O)CCNCCCO)c(O)c1Br 2380758199 USQCJUKQFWNBJD-UHFFFAOYSA-N 345.237 1.441 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2C[C@H](O)CN2)c(O)c1Br 2380760757 AGYYPLCMIPIBSD-WDEREUQCSA-N 343.221 1.144 10 10 EDCE COCC1(C(=O)O)CN(Cc2ccc(C)c(Br)c2O)C1 2380802185 CIQCXKGGUBRZML-UHFFFAOYSA-N 344.205 1.996 10 10 EDCE C[C@H](Cn1cncn1)NC(=O)NCc1ccc(N2CCCC2)cc1 299622588 JRWOQZJHGWWROD-CQSZACIVSA-N 328.420 1.766 10 10 EDCE CS(=O)(=O)N1CCCC[C@H]1CNCc1cccc(Cl)c1O 809709377 AJWDUKHFNNBHMD-LBPRGKRZSA-N 332.853 1.949 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[C@H]1CCOC1 807323462 OAUJNFCGRITXOY-INIZCTEOSA-N 347.459 1.644 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC(=O)c1cccc(O)c1O)C2 819615943 JJOQLELRUFDVPK-LOWVWBTDSA-N 334.372 1.695 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cnn(C)c1OC 819699850 NALHJEOUAWTARM-UHFFFAOYSA-N 347.371 1.340 10 10 EDCE C[C@@H](CF)NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 814421116 YYWUPPZSSPJKRX-GXTWGEPZSA-N 336.411 1.546 10 10 EDCE COC(=O)[C@@H]1CC[C@@H]1C(=O)N(C)CCN(C)c1ccc(OC)cc1 824207881 IHQIWZYKPJRQMF-JKSUJKDBSA-N 334.416 1.789 10 10 EDCE COc1ccc(CNC(=O)COC(=O)c2ccc(C)c(O)c2O)cc1 727004032 LETUIDYTHQFMJE-UHFFFAOYSA-N 345.351 1.888 10 10 EDCE C[C@@]1(C2CC2)CN(Cc2cc(O)n3ncc(C(=O)O)c3n2)CCO1 849344042 AIXBQZFIWFDODN-INIZCTEOSA-N 332.360 1.134 10 10 EDCE O=C(O)C1(C(=O)NCc2ccc(N3CCCC3)cc2)CCOCC1 911221495 GVUNTQAKXLKYLD-UHFFFAOYSA-N 332.400 1.784 10 10 EDCE CCCN(C)S(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849416374 QFEWKPFMCJSENU-ZDUSSCGKSA-N 327.450 1.450 10 10 EDCE CC(C)C(=O)N1CCC[C@@H]1C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 843296667 CZSXOFOCKOWJQA-IAGOWNOFSA-N 346.475 1.516 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)/C=C\C3CC3)cc2)C1 742566611 OEYPRSPIOWZILZ-BJIFSAINSA-N 327.428 1.971 10 10 EDCE Cc1cc(O)c(CN2CCN(CC(=O)NC3CC3)CC2)c(Cl)c1 840910630 UJWSQTCJIYHVFG-UHFFFAOYSA-N 337.851 1.750 10 10 EDCE C[C@@H](C(=O)N(C)CC(=O)NC1CC1)N1CCCc2cc(CN)ccc21 843350798 VIRGUNCEJIXYSZ-ZDUSSCGKSA-N 344.459 1.023 10 10 EDCE Cc1cn(C)nc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 850383635 RMQMUPUGNQYNSX-UHFFFAOYSA-N 342.399 1.568 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)[C@@H]4CSCN4C3=O)C2)cc1 924976530 BZBDSYYMLJODNB-OCCSQVGLSA-N 333.413 1.611 10 10 EDCE O=C(COC(=O)c1cccc(O)c1O)Nc1ccc2c(c1)OCO2 758573561 VQYOAHFNOMROPU-UHFFFAOYSA-N 331.280 1.622 10 10 EDCE COc1ccc(N(C)C[C@H](O)COC[C@H]2CCCO2)c(OC)c1 752126473 SUSXLYNNISQBQL-DZGCQCFKSA-N 325.405 1.697 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@H](Cn4ccnn4)C3)cc2N1 853761994 XLVAJJHBBGFVMC-SNVBAGLBSA-N 344.331 1.044 10 10 EDCE COc1ccc(CNC(=O)[C@@H]2OCCO[C@@H]2C(F)(F)F)c(O)c1 867956878 ZRPYUKIJRUHZTE-NEPJUHHUSA-N 335.278 1.363 10 10 EDCE CC(=O)N1CCN(c2ccc(CNc3cc(C)nc(N)n3)cc2)CC1 786071000 DCWNUIWRCSUSTC-UHFFFAOYSA-N 340.431 1.648 10 10 EDCE O=C(N[C@@H](CO)[C@H]1CCCOC1)c1cc2cc(O)c(O)cc2s1 897975088 BADNPPPXRHVJTM-ONGXEEELSA-N 337.397 1.830 10 10 EDCE O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1154950506 YWIDDRNFBOJUAN-SNVBAGLBSA-N 346.305 1.167 10 10 EDCE O=C(O)C1=C[C@H](c2ccc(N3CCC(O)CC3)cc2)NC(=S)N1 76260981 SVAITIHVWXJGKY-CYBMUJFWSA-N 333.413 1.135 10 10 EDCE C[C@H](OCc1ccccc1)[C@@H](NC(=O)c1cccc(O)c1O)C(=O)O 706111341 UAOREEAQHYNOHC-XHDPSFHLSA-N 345.351 1.886 10 10 EDCE Cc1cc(O)c(CN2CCN(CCN(C)C)C(=O)C2)cc1Cl 1330278859 INTSTNHBKVYSMK-UHFFFAOYSA-N 325.840 1.560 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@H]2CCC(=O)NC2)cc1C 1266941379 DUOJXHQLHKTCNT-GOEBONIOSA-N 347.459 1.514 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@@H](CCO)[C@@H](CO)C3)ccc21 1518889467 JGBFSBXZLGAUNB-IAGOWNOFSA-N 347.459 1.201 10 10 EDCE CCOC(=O)[C@@H](CC(=O)NCCCSc1nccs1)C(C)=O 1292997640 OQXSYUIEGTURGA-NSHDSACASA-N 344.458 1.900 10 10 EDCE COc1ccc(N2CCCN(C(=O)c3ccnc(CO)c3)CC2)cc1 1291855696 CGGRVOHDMHNGRX-UHFFFAOYSA-N 341.411 1.935 10 10 EDCE O=C(CCNC(=O)c1ccco1)NCc1ccc2cccnc2c1O 1299721321 GTMOQQSMQSDKJZ-UHFFFAOYSA-N 339.351 1.970 10 10 EDCE NC[C@]12CN(Cc3cc(Br)ccc3O)C[C@@H]1CCO2 2118561201 IFIJHKCPJKDFIG-FZMZJTMJSA-N 327.222 1.704 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)/C=C(/C)c2cnccn2)c2ccccc2O1 1532446112 MMDWXTSLVCONCW-CKDIWJPDSA-N 339.351 1.847 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@H]2COCCO2)cc1C 1482084960 XBYVOIOBTLJYRM-CXAGYDPISA-N 336.432 1.261 10 10 EDCE C[C@@H](NCCO)C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1713685123 XQWYUFQQKJQGIW-GFCCVEGCSA-N 347.419 1.672 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CO[C@H]2CCOC2)cc1C 1714236526 PTCNQRMPEMACTF-ZBFHGGJFSA-N 336.432 1.403 10 10 EDCE Cn1cnnc1CCCNC(=O)c1cc2cc(O)c(O)cc2s1 1624824545 XFTDFUZNIVFKSB-UHFFFAOYSA-N 332.385 1.804 10 10 EDCE CCn1cc(Br)c(=NCc2ccc(O)c(O)c2O)[nH]1 2124741497 MIIATAMRHSFMNV-UHFFFAOYSA-N 328.166 1.816 10 10 EDCE Cc1cc(C(=O)N2CCN(C)[C@@H](CO)C2)c(C)n1-c1ccc(F)cc1 1642567314 PPVYZNYQIWUREU-QGZVFWFLSA-N 345.418 1.982 10 10 EDCE CCn1cc(Br)c(=NC(=O)c2cccc(O)c2O)[nH]1 2124746064 IJOPPYCOSHCWMN-UHFFFAOYSA-N 326.150 1.751 10 10 EDCE COCCC(=O)N[C@H](C)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1734693160 ZXEOURRNHHNJQX-GHMZBOCLSA-N 349.391 1.509 10 10 EDCE COC(=O)C1(C2(O)CCN(C(=O)c3cccc(O)c3O)CC2)CCC1 1648714708 JPGNPTSVQFCUNL-UHFFFAOYSA-N 349.383 1.408 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(Cc2ccccn2)CC1 1587543721 YKHONUZTVIYPAH-UHFFFAOYSA-N 327.384 1.380 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)C[C@@]2(C)CCS(=O)(=O)N2)c1 1595806340 HHAALNYPYNSHKF-MEBBXXQBSA-N 342.417 1.050 10 10 EDCE COC(=O)CN/C=C1/C(=O)N(c2ccccc2)N=C1C(F)(F)F 18067273 RZRSSJGQIQFQOO-JXMROGBWSA-N 327.262 1.598 10 10 EDCE CC(=O)C(=O)[C@@]1(O)CN(C(=O)OC(C)(C)C)C[C@]2(CCCO2)C1 1924244662 DDYKUIXNMGOQBF-HOTGVXAUSA-N 327.377 1.066 10 10 EDCE CC(C)(C)OC(=O)N=c1cc([C@H](N)Cc2ccc(O)c(O)c2)[nH][nH]1 1952760291 NMMLELDEFURGEU-SNVBAGLBSA-N 334.376 1.832 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)C(C)(C)F 1982063057 DRBCBXZFHKQMIQ-GIPNMCIBSA-N 330.400 1.893 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(O)C[C@H](C(=O)NCCCN=[N+]=[N-])C1 1985100924 LCVUOILUBVFMHH-YPFXGUDJSA-N 327.385 1.469 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985104240 HQACDKHLXRGAAT-DCAQKATOSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1990033325 UWFUHWHPCTXYGR-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010388712 GCWFIMIPOQZUKC-QWRGUYRKSA-N 343.384 1.617 10 10 EDCE C[C@H](NC(=O)[C@@H](O)[C@H](C)NC(=O)OC(C)(C)C)c1ccccc1O 2017514404 GNODLFYZMJMUPN-MJVIPROJSA-N 338.404 1.844 10 10 EDCE C[C@]1(CO)CN(c2ccc(CN)c(Br)c2)C[C@]1(C)CO 704788899 PAXBTVIQMRSHHP-HUUCEWRRSA-N 343.265 1.725 10 10 EDCE CCNCc1ccc(N2CCC[C@@H]2[C@@H](O)CO)cc1Br 2179801252 ZHOMMTOVDVOHDU-CABCVRRESA-N 343.265 1.881 10 10 EDCE Cn1cc(Br)c(S(=O)(=O)N2CC[C@@H](N=[N+]=[N-])C2)n1 2058158143 HCMFIZYIFGTMKT-ZCFIWIBFSA-N 335.187 1.256 10 10 EDCE CCCN1CCN(c2ccc(CO)cc2Br)CC1=O 2102564450 HXNRKGUCZBHIJB-UHFFFAOYSA-N 327.222 2.000 10 10 EDCE CN(C)C(=O)[C@@H]1CCN(c2ccc(CO)c(Br)c2)C1 2087356726 DFLPGDPUUAQPDO-SNVBAGLBSA-N 327.222 1.856 10 10 EDCE CN1CC(N(C)c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2089247228 QWYMAVQANLQVQW-LBPRGKRZSA-N 326.194 1.185 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](CO)C[C@@H]2CO)c(Br)c1 2089863104 HCSGPJONNQDXIF-CKYFFXLPSA-N 330.222 1.682 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(OCCO)C2)c(Br)c1 2095969616 KJKXTTXATDUPSM-JTQLQIEISA-N 329.238 1.927 10 10 EDCE C[C@@]1(CO)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2097238796 RUSTXUVXTDZUKP-YPMHNXCESA-N 326.194 1.362 10 10 EDCE Oc1c(Br)cccc1CNC1CN([C@@H]2CCOC2)C1 2113048225 WDAOSZHRBXOSQJ-GFCCVEGCSA-N 327.222 1.717 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2COC[C@@H]2OC)c1O 2236053978 CNCUOKWZBKPZND-ZANVPECISA-N 346.221 1.914 10 10 EDCE NCCCN1CCN(Cc2cc(Br)ccc2O)CC1 2226063671 YYZUYDGLGSPEIU-UHFFFAOYSA-N 328.254 1.621 10 10 EDCE CSc1ncc(CNS(=O)(=O)[C@H]2CC[C@H](C(=O)O)C2)s1 2284499441 OXGKFTGVYHBWHN-CBAPKCEASA-N 336.460 1.538 10 10 EDCE CSc1ncc(CNS(=O)(=O)CC[C@@H]2CCCCN2)s1 2284501705 TUGYKMNKIBXEQL-JTQLQIEISA-N 335.520 1.817 10 10 EDCE Cc1ccc(C)c(N2C(=O)C(=CNCCN(C)C)C(=O)NC2=S)c1 2296943151 ALUDKYBZWHDYRH-UHFFFAOYSA-N 346.456 1.086 10 10 EDCE COc1ccc(C(=O)NCC(=O)N(C)Cc2ccccc2O)cc1 53914957 XSTVGCPDMJSWON-UHFFFAOYSA-N 328.368 1.789 10 10 EDCE CCc1n[nH]c(NC(=O)/C=C/c2ccc(N3CCOCC3)cc2)n1 123049192 CPBZOQQQYAOHFY-VMPITWQZSA-N 327.388 1.856 10 10 EDCE Cc1ccc(O)c(CN2CCN(c3cc(C)nc4ncnn34)CC2)c1 133953146 FWYPYJFZGSWKHK-UHFFFAOYSA-N 338.415 1.769 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])nc2)cc1 195060598 SJESGMMGGZRAQE-UHFFFAOYSA-N 336.373 1.534 10 10 EDCE CC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(O)cc2C)s1 228651463 NYKXCGUEAJFSSB-UHFFFAOYSA-N 328.375 1.311 10 10 EDCE Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)nn1C1CCOCC1 528856654 CZPKLNGAAXBOAC-UHFFFAOYSA-N 345.399 1.927 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C2C[C@H]3CNC[C@@H](C2)C3=O)cc1 368363538 UYMQYOXSFUWEBW-ALOPSCKCSA-N 343.471 1.964 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1ccc(OCc2ccccn2)cc1 808529986 HYRBSXLNRRCMJL-UHFFFAOYSA-N 327.336 1.904 10 10 EDCE COc1cccc(O)c1CN1CCC[C@@H](S(=O)(=O)N(C)C)C1 809688145 CGDAHDYOEFWHCL-GFCCVEGCSA-N 328.434 1.257 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCC[C@H](C(=O)O)C1 817888334 FIAHUEXSDNZMIY-AWEZNQCLSA-N 347.415 1.034 10 10 EDCE C[C@H]1Cc2ccccc2N(C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)C1 729424214 OASHIMUBPNHGEI-YXVBKTCISA-N 339.395 1.323 10 10 EDCE COc1ccc(N2CCC(NC(=O)N3CN(C)C(=O)[C@@H]3C)CC2)cc1 826105448 WBKYOMXHNQYDNB-ZDUSSCGKSA-N 346.431 1.494 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnn(C)c3OC)CC2)cc1 839459648 PJKILSFFAJHSAW-UHFFFAOYSA-N 330.388 1.400 10 10 EDCE Cc1cc(CC(=O)N2CCN(C)C[C@H]2CO)c(C)n1-c1ccccc1 912734886 QSIJGPBKGQHYBM-IBGZPJMESA-N 341.455 1.772 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CSCN3C(C)=O)CC2)cc1 747371433 XMBDZOVDDUHZNZ-MRXNPFEDSA-N 349.456 1.265 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3C[C@@H](N(C)C)C3)C2)cc1 852401190 HVHCZUIUCDMBTI-YQQAZPJKSA-N 346.475 1.913 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3ccc(N(C)C)c(C)c3)C[C@@H]12 852594038 RYYJIIZDTXPGNI-UAGQMJEPSA-N 338.473 1.305 10 10 EDCE CC[C@@H](C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)N1CCCC1=O 855230014 DNIDHDSNMGFFGJ-YOEHRIQHSA-N 345.443 1.791 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)CCn3cccn3)C2)cc1 852453965 MTLJWRHDLRUGMI-OAHLLOKOSA-N 343.431 1.812 10 10 EDCE C[C@@]1(CCF)NC(=O)N(Cc2ccc(N3CCC(O)CC3)cc2)C1=O 853089494 QHPXSDFVQWHRMH-SFHVURJKSA-N 349.406 1.818 10 10 EDCE C[C@H]1[C@@H](N)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 851680815 KIQNIPGMPLMSRV-GUYCJALGSA-N 332.448 1.279 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)c2cn3c(n2)COCC3)cc1 862129482 QETRIXVYJWDLFU-UHFFFAOYSA-N 344.415 1.630 10 10 EDCE C[C@](O)(C[C@@H](O)CNCc1ccc(N2CCOCC2)cc1)C1CC1 872200087 SXLWZWPAJZKZDF-MOPGFXCFSA-N 334.460 1.525 10 10 EDCE COC(=O)[C@@H]1CN(Cc2cc(C)cc(Br)c2O)CCO1 781912554 OOOFWBMUFVGOPT-LBPRGKRZSA-N 344.205 1.837 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc([N+](=O)[O-])cc2c1OCCO2 1142533224 HOJYMEAIQFHJHN-UHFFFAOYSA-N 346.295 1.707 10 10 EDCE CS(=O)(=O)N1CCC[C@H]1C(=O)NCc1c(O)ccc2ccccc12 1304089759 KTCDAGQIOQOHQK-HNNXBMFYSA-N 348.424 1.586 10 10 EDCE O=C(CC1(Cn2cnnn2)CCCCC1)NCc1cc(O)ccc1O 1176756147 YLBWMMCALRHJGP-UHFFFAOYSA-N 345.403 1.741 10 10 EDCE O=C(O)[C@]12CN(Cc3ccc(Br)cc3O)C[C@@H]1CCO2 707652266 SMUQAEFBYLAZOM-HZMBPMFUSA-N 342.189 1.830 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3cc(C)c(C)cc3O)C[C@@H]12 1327804446 UKCSWZZCLYYYKW-IMJJTQAJSA-N 325.430 1.253 10 10 EDCE COC(=O)NC1CN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 1333777232 GMKLOXBIZZQKHZ-GFCCVEGCSA-N 348.403 1.024 10 10 EDCE COCCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@@H]1CC[C@@H](C)C1 1332023602 RBPWHMRZCYCEIB-UKRRQHHQSA-N 346.427 1.898 10 10 EDCE COC[C@H](CCNCc1ccc(N2CCN(C)CC2)c(F)c1)OC 1346843497 YPRRZUVNZMYESJ-INIZCTEOSA-N 339.455 1.719 10 10 EDCE CN(C)c1ccc(CN(C(=O)[C@H](O)c2cnn(C)c2)C2CC2)cc1 1543500980 FEBSIAJYDFWWSD-QGZVFWFLSA-N 328.416 1.711 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@](O)(CC)C3)nc12 1620487933 KADSOLSGPJZPCJ-QGZVFWFLSA-N 348.403 1.349 10 10 EDCE CC(C)(C)OC(=O)C1=NO[C@@H](C(=O)NCc2ccc(O)c(O)c2)C1 1622642860 CJKPOFLZBRDTGQ-CYBMUJFWSA-N 336.344 1.201 10 10 EDCE COc1cc(C(=O)N[C@@H]2CCN(C(=O)CCC(C)C)C2)cc(OC)n1 1491789782 MRDPZDPXBMSBIO-CQSZACIVSA-N 349.431 1.866 10 10 EDCE COc1ccc(C(=O)NCc2ccc(O)cc2O)cc1OCCO 1630302283 WNYOIIIQNRBQPH-UHFFFAOYSA-N 333.340 1.408 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2cn(C)nn2)cc1C 1733099065 XXMDAJIJQCXZRB-UHFFFAOYSA-N 331.420 1.384 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC[S@@](=O)Cc1ccccc1 1584994791 GBEWUDCGQQLBFC-HSZRJFAPSA-N 333.409 1.705 10 10 EDCE CNC(=O)C(C)(C)Cn1c(C)nnc1N(C)Cc1ccccc1O 1769088702 YHFFHRXDCFVUPS-UHFFFAOYSA-N 331.420 1.701 10 10 EDCE Cn1cc(I)c(CN2CC[C@@H](N=[N+]=[N-])C2)n1 1902313617 LHGALXGGIACZGH-SSDOTTSWSA-N 332.149 1.909 10 10 EDCE COC(=O)NC[C@H]1CCN1c1ccc(CO)c(Br)c1 2130740733 RREHOLRQIVDIEX-LLVKDONJSA-N 329.194 1.876 10 10 EDCE O=C(O)[C@@]1(CO)CCN(Cc2cc(Br)ccc2O)C1 2136389120 IIXOCSROQQWBQV-ZDUSSCGKSA-N 330.178 1.424 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NCc1cccc(O)c1O 1948520432 VDDNYRFAJCGHID-CHWSQXEVSA-N 338.404 1.727 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@]1(C(=O)O)c1cc(O)c(O)c(O)c1 1952678683 UZTXYMPHNFGERX-BONVTDFDSA-N 325.317 1.423 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1OCC[C@H]1CNC(=O)OC(C)(C)C 1985095003 XMSBIVVPYIKOMQ-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)C[C@@H]1C(=O)NCCCN=[N+]=[N-] 1985102580 ISURTEZTFHSSSE-WDEREUQCSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)C(C)(C)O 1987681091 OHLKKXVVUKZXNN-VHSXEESVSA-N 327.385 1.562 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010391511 RVHJCONHXLISLW-RYUDHWBXSA-N 340.428 1.743 10 10 EDCE CN1CCc2cc(CN[C@H](CO)CNC(=O)OC(C)(C)C)ccc21 2011425395 XRROTSQUMSBUDS-HNNXBMFYSA-N 335.448 1.654 10 10 EDCE O=C(O)[C@H]1CNCCN1Cc1cc(Cl)cc(Br)c1O 708110792 HVAQVFMLNUQRAP-SNVBAGLBSA-N 349.612 1.667 10 10 EDCE C[C@H](NCCN1CCOCC1=O)c1cc(Br)ccc1O 2062867733 LYKOVWKMGPWZIC-JTQLQIEISA-N 343.221 1.664 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H](C4(C)OCCO4)C3)c2n1 2063493681 IZWKHHRSFKKZEY-GFCCVEGCSA-N 346.387 1.359 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCCC[C@H]1CCn1ccnn1 1457133795 DRFRJQSLZRLWNZ-AWEZNQCLSA-N 330.388 1.703 10 10 EDCE CC(C)(C)OC(=O)NCc1ncc(C(=O)C(=O)C[C@H]2C[C@H](N)C2)cn1 2049787322 WXVAAPZPDNLNIB-UMSPYCQHSA-N 348.403 1.381 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NC/C=C/Br)cc1 2051152841 SGWDGRARIAKTBM-LZCJLJQNSA-N 335.223 1.476 10 10 EDCE O=c1c2c(ccn1Cc1nscc1Br)CCNC2 2219920518 SMBKPPKWNRIDTQ-UHFFFAOYSA-N 326.219 1.761 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3COC[C@@]3(CO)C2)cc1Br 2234566786 MDNMCEHPEREWNM-RWSFTLGLSA-N 342.233 1.948 10 10 EDCE COc1ccc(N2CCOC[C@@H]2CO)c(OC)c1Br 2226540745 LMENXIKJOULUCN-VIFPVBQESA-N 332.194 1.664 10 10 EDCE Cn1cccc1C=C1SC(=S)N([C@@H](CC(=O)O)C(=O)O)C1=O 2293039474 ATTLQCXMUVMLOD-QMMMGPOBSA-N 340.382 1.154 10 10 EDCE COc1ccc(C=C2SC(N3CCN(C)CC3)=NC2=O)c(OC)c1 2293320818 TYRRNWYJVCUJEM-UHFFFAOYSA-N 347.440 1.922 10 10 EDCE O=C1N=C(N(CCO)CCO)SC1=Cc1ccc(Cl)cc1 2294850886 VZTQRWCVZZYJLQ-UHFFFAOYSA-N 326.805 1.597 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2COC[C@H]2N)c(O)c1Br 2352620204 NUWCKDMSLNWFPI-NXEZZACHSA-N 329.194 1.053 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CNCCO2)c(O)c1Br 2352634391 UETCRCPUBQRPCM-JTQLQIEISA-N 329.194 1.068 10 10 EDCE Cc1ccc(CN[C@H]2CCOC[C@@H]2CO)c(O)c1Br 2352677595 BEMFVPKDXQPWEF-RYUDHWBXSA-N 330.222 1.950 10 10 EDCE CNC(=O)[C@@H]1C[C@H](N)CN1Cc1cc(C)n(-c2cc(C)ccn2)c1C 67758774 YTWQUURFWMXOCQ-IRXDYDNUSA-N 341.459 1.445 10 10 EDCE CC[C@@H](NCC1CN(S(C)(=O)=O)C1)c1ccc(N(C)C)cc1 187816653 NBTLKIKJSSHYOF-MRXNPFEDSA-N 325.478 1.685 10 10 EDCE CNCc1ccc(N2CCS(=O)(=O)CC2)cc1Br 234453933 HFCGXTMUUIKQLU-UHFFFAOYSA-N 333.251 1.403 10 10 EDCE CNC(=O)[C@H](C)CN(C)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255767438 FTMCKRWESINAIE-WUKHSURWSA-N 345.443 1.377 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)N2CC[C@](O)(C(N)=O)C2)c1C 276432007 DGVAMPVSSYFCOI-LJQANCHMSA-N 341.411 1.465 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)N3C[C@H](O)C[C@H]3CO)c2C)c1 368428439 FVYPVFYEFMHLHQ-DLBZAZTESA-N 328.412 1.970 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 808532246 PJAHGTVKAOAVMA-GFCCVEGCSA-N 339.388 1.725 10 10 EDCE Cc1ccc(CN2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)c(O)c1Br 2381140870 QZHIPWGCUSGWRM-YXMPFFBPSA-N 342.233 1.922 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N3C[C@H](C)[C@H]3C)CC2)cc1 297163822 JMTAHRXJFJNGJM-JKSUJKDBSA-N 346.475 1.867 10 10 EDCE Cn1[nH]cnc1=NC(=O)NCc1cc(Br)ccc1O 806363509 CBVNBFORGYHGJI-UHFFFAOYSA-N 326.154 1.027 10 10 EDCE C[C@H](N)c1ccc(N2CCN3C(=O)NC[C@H]3C2)cc1Br 723178363 MWUJCQMUZCDPHQ-ONGXEEELSA-N 339.237 1.683 10 10 EDCE COC(=O)[C@](C)(O)CNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 832202625 MHDFEBZAMDGPIZ-LJQANCHMSA-N 344.411 1.677 10 10 EDCE COC1CCN(c2ccc(CN3CCN(CCO)C[C@@H]3C)cc2)CC1 832782020 FVQHXXHCLOZWOM-KRWDZBQOSA-N 347.503 1.800 10 10 EDCE CC1(C)CN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])C[C@@H](CO)O1 844214814 VENGHUAXMBGXNM-FUEXJSSKSA-N 336.344 1.669 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)C[C@@H]3CCCO3)C2)cc1 849416411 QWLWFMWQBNCXAL-CJNGLKHVSA-N 340.445 1.372 10 10 EDCE CC(C)n1cnc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 845791979 AUUNJEJSEQSFAK-UHFFFAOYSA-N 330.392 1.180 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ncc(OC)cn3)C2)cc1 855225314 JUZISKJQQLQWEY-LBPRGKRZSA-N 328.372 1.503 10 10 EDCE C[C@@H]1CN(CCCNC(=O)NCc2c(O)cccc2F)CCCO1 922200716 GEPGKWCFWGBWKI-CYBMUJFWSA-N 339.411 1.831 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN[C@@H]1C[C@H](O)C12CCC2 852584455 NNEYNXTXJBEVHX-SJORKVTESA-N 331.460 1.604 10 10 EDCE Nc1ccc(NC(=O)C(=O)NC[C@@H]2CC[C@H](C(F)(F)F)O2)cc1 927837800 PCNMGOACOLSMNY-WDEREUQCSA-N 331.294 1.433 10 10 EDCE C[C@@H](CN(C)CCCN(C)C)NC(=O)NCc1ccc(N(C)C)cc1 853245157 ULVYQSXLEHCMJL-INIZCTEOSA-N 349.523 1.824 10 10 EDCE CN(C)CCC[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)CCO1 857340563 YUDKTJJUNUQYRV-NSHDSACASA-N 326.368 1.420 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC(=O)N(C)CC3)C2)cc1 854296122 HAAGDEIAOGFMGD-AWEZNQCLSA-N 346.431 1.148 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCCn3cncn3)C2)cc1 855232091 QQFQOBSEIHKLBB-AWEZNQCLSA-N 329.404 1.462 10 10 EDCE Cc1ncc(CNCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)o1 862294343 HUTMPUVUIYLJPO-HNNXBMFYSA-N 328.416 1.975 10 10 EDCE Cc1ccc(O)c(CNC(=O)[C@@H]2CCN(C)C[C@H]2c2cnn(C)c2)c1 862754315 XLABVOUEJIPQFT-SJORKVTESA-N 342.443 1.786 10 10 EDCE Cc1ccn(C[C@](C)(O)C(=O)N2Cc3cccc(O)c3C2)c(=O)c1 871204439 JGUJREQRLKFVAE-SFHVURJKSA-N 328.368 1.156 10 10 EDCE C[C@@H](NS(=O)(=O)CCCS(C)(=O)=O)c1ccc(N(C)C)cc1 773084717 SEUUVLJREWBMBX-GFCCVEGCSA-N 348.490 1.168 10 10 EDCE CC(C)[C@@H](NC(=O)c1ccccn1)C(=O)NCc1ccc(O)c(O)c1 778917155 ZUGGPEKKGVYRSK-MRXNPFEDSA-N 343.383 1.564 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3C[C@H]3C)CC2)cc1 778257506 ULDOKYGREWKYTD-UBULPXNDSA-N 343.427 1.425 10 10 EDCE CCN1CN(Cc2c(C(=O)OC)n(C)c3ccc(F)cc23)CC1=O 894554887 AVZWWMNGWSPQOW-UHFFFAOYSA-N 333.363 1.726 10 10 EDCE C[C@H]1CN(CCO)CCN1Cc1cc(Br)cc(F)c1O 894959390 RZYLXLZNCZKRAC-JTQLQIEISA-N 347.228 1.792 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@H](CN2CCOCC2)C1 1155718940 ACMINFAQMVVMBZ-OAHLLOKOSA-N 334.416 1.211 10 10 EDCE CN1CCN(c2ccc(CNC(=O)[C@@H]3C[C@@H]4CC[C@H]3N4)cc2)CC1 1344556209 IDDGMVYUVZZYRD-CGTJXYLNSA-N 328.460 1.195 10 10 EDCE COc1ccc(Br)c(CN2CCS(=O)CC2)c1O 1964560020 NCSDDHWTPJNKOD-UHFFFAOYSA-N 334.235 1.728 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1[C@H]2CCC[C@H]21 1324119336 QXWMWCSURMTTHV-BJWYYQGGSA-N 343.427 1.054 10 10 EDCE CCc1cccc(CN2CCN([C@@]3(C(=O)OC)CCOC3)CC2)c1O 1329067324 OINZYFHECRRPPC-IBGZPJMESA-N 348.443 1.404 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@@H]1COCCO1 1347839569 IEQGJUPOQZOCCP-CYBMUJFWSA-N 329.780 1.436 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H]2COC(=O)N2)cc1C 1277810179 MEYMIGMHUXPHSV-JSGCOSHPSA-N 335.404 1.049 10 10 EDCE COCCCC(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1284205686 DPUQCWZMFSVZEW-LLVKDONJSA-N 349.391 1.510 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1nc(O)c2ccccc2n1 1298791041 CUQYDMQBVXGKKA-UHFFFAOYSA-N 325.324 1.606 10 10 EDCE COC(=O)c1ccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)cn1 1294283054 XJUWQLDLYYTWBQ-QPJJXVBHSA-N 328.324 1.609 10 10 EDCE CSCC(=O)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1299187397 GRPPRBGCXMEVBS-UHFFFAOYSA-N 349.416 1.591 10 10 EDCE NS(=O)(=O)CCCC(=O)NCc1cc(Cl)cc(Cl)c1O 1468668102 JSHYPVFPRSSOCY-UHFFFAOYSA-N 341.216 1.384 10 10 EDCE CC(C)(C)c1nnc2n1CCN(C(=O)Cc1ccc(O)c(O)c1)C2 1470387949 UFTBVQBBRSPIHO-UHFFFAOYSA-N 330.388 1.572 10 10 EDCE COCCCOC1CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 1472731362 GPMNJYBMBCABFH-UHFFFAOYSA-N 326.349 1.854 10 10 EDCE CC1(CC(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1703236018 QDPTZBSVOWOLHK-UHFFFAOYSA-N 331.376 1.885 10 10 EDCE O=C(CCCNC(=O)c1cccnc1)NCc1c(O)cccc1F 1558454219 BVWZXSWIKZQZPP-UHFFFAOYSA-N 331.347 1.753 10 10 EDCE Cc1cn2nnc(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)c2c(O)n1 1625544402 UAXKDCVIPZOWLZ-LLVKDONJSA-N 340.387 1.695 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)CNC(C)=O)C2)cc1C 1488701749 SGXMJKAZXQPEPT-IYBDPMFKSA-N 333.432 1.124 10 10 EDCE O=C(Nc1cccc(CN2CCOCC2)n1)c1cccc(O)c1O 1556054272 SPLMDEBCUIUOPW-UHFFFAOYSA-N 329.356 1.577 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)Cc2nonc2C)cc1C 1492105692 WVHKPIUKMYUUCU-CYBMUJFWSA-N 346.431 1.922 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)Cc2cc(C)on2)cc1C 1725527189 JOBMRBMVRFREHY-MRXNPFEDSA-N 347.415 1.109 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)Cn2cncn2)cc1C 1496227603 SSBDHRWRRQYXTD-CQSZACIVSA-N 331.420 1.232 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2cncnc2)cc1C 1567531514 OWJXKSZMCSEHAT-UHFFFAOYSA-N 342.443 1.974 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)Cc2cnc[nH]2)cc1C 1732441035 RNGQXAIXJFUUDP-AWEZNQCLSA-N 330.432 1.906 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cncnc2O)cc1C 1731600370 RXLWAVVJZHZEIZ-LBPRGKRZSA-N 330.388 1.407 10 10 EDCE COc1ccc(CN[C@@H]2CN(C(=O)CCN(C)C)C[C@@H]2C)cc1C 1570354316 JTBTUEUFOQRZON-DOTOQJQBSA-N 333.476 1.892 10 10 EDCE COCC(=O)N[C@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1572269538 IXVAISQQAJUYGT-SNVBAGLBSA-N 335.364 1.072 10 10 EDCE CO[C@H](C)CN(C)C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1733067552 PXRPYJANGNFPIR-VXGBXAGGSA-N 335.408 1.934 10 10 EDCE CN(CC(F)F)C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1586962089 NGLCXZMXSNWTME-UHFFFAOYSA-N 328.359 1.828 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)Cc2ccn(C)n2)cc1C 1662219933 RHLZQFLNRJCXJO-CQSZACIVSA-N 330.432 1.574 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)[C@@H](O)C2(C)C)c(Br)c1 2124803113 UIPCYXPXAVEGMT-ZEGGKSINSA-N 330.222 1.823 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cn(CCc2ccccc2)nn1 1597574836 UHGFRHQDCABCFM-UHFFFAOYSA-N 338.367 1.862 10 10 EDCE C[C@@H](NC(=O)NCc1nc([C@H]2CCCO2)n[nH]1)c1ccccc1O 1686896838 KEFDWHDYMPNNMD-ZWNOBZJWSA-N 331.376 1.922 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2c[nH]c(=O)cn2)cc1C 1698760639 MHNYXGJEZHGZEW-GFCCVEGCSA-N 344.415 1.243 10 10 EDCE CN(C)C[C@@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 155710379 PPDIYNAAOQKOID-GOSISDBHSA-N 344.459 1.535 10 10 EDCE Nc1ccc(NC(=O)CN2C(=O)COc3ccccc3C2=O)cc1 1866039800 RIYLKIQVCSDRRN-UHFFFAOYSA-N 325.324 1.269 10 10 EDCE C[C@H](O)C[C@H]1COCCN1c1ccc(CN)c(Br)c1 2128866371 QSLJYKDYEASTRH-GWCFXTLKSA-N 329.238 1.884 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C(C(N)=O)[C@@H]3C2)c(Br)c1 2136583845 AOSRFMMIINKKGW-SZEHBUNVSA-N 325.206 1.670 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@]1(CO)C(=O)N1CC(N=[N+]=[N-])C1 1985094507 PWPZXEYUQHDDQJ-AWEZNQCLSA-N 325.369 1.270 10 10 EDCE NCc1ccc(N2CCC([C@@H](O)CO)CC2)c(F)c1Br 2152463874 KBBVNSCHJFQFDT-LBPRGKRZSA-N 347.228 1.617 10 10 EDCE CN1C[C@H](O)[C@H](NCc2cc(Cl)cc(Br)c2O)C1 2029868885 AWIGBZYTEYUYIE-MNOVXSKESA-N 335.629 1.573 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCN(c2cc3c(cc2N)OCC(=O)N3)C1 2044629473 SLZFHVRLLFPTOH-SNVBAGLBSA-N 348.403 1.703 10 10 EDCE Nc1ccc(OCC(=O)Nc2nnc(Br)s2)cc1 2218857999 YEWOAUJCIZTEGT-UHFFFAOYSA-N 329.179 1.900 10 10 EDCE C[C@@H]1CN(c2ccc(CO)cc2Br)C[C@@H](CCO)O1 2122800630 REGTWRAWSTVXIC-ZYHUDNBSSA-N 330.222 1.918 10 10 EDCE COc1ccc(Br)c(CN2C[C@H]3NCC[C@@H]3C2)c1O 2227742756 JLHVMNKRMLVORH-BXKDBHETSA-N 327.222 1.957 10 10 EDCE CSc1ncc(CNS(=O)(=O)CC[C@H]2CCCCN2)s1 2284501706 TUGYKMNKIBXEQL-SNVBAGLBSA-N 335.520 1.817 10 10 EDCE CNC(=O)[C@@H](C)CN(C)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297777282 FTMCKRWESINAIE-HNNXBMFYSA-N 345.443 1.377 10 10 EDCE Cc1c(C=CC(=O)N(C)c2ccc(N3CCOCC3)nc2)cnn1C 2308585757 GJEPXNPXHCSPCI-UHFFFAOYSA-N 341.415 1.636 10 10 EDCE Cc1ccc(CNS(=O)(=O)[C@H]2CC[C@H]2N)c(O)c1Br 2352945316 ULYGWXSCELMKOP-ZJUUUORDSA-N 349.250 1.372 10 10 EDCE CC1(C)CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)CCN1 175404846 QLTKKRSZQSEMLD-VMPITWQZSA-N 329.444 1.747 10 10 EDCE NC(=O)[C@H]1Cc2ccccc2CN1Cc1cc([N+](=O)[O-])ccc1O 119741491 XFKYWFXQBPQVEO-OAHLLOKOSA-N 327.340 1.713 10 10 EDCE CCCS(=O)(=O)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 123030578 MFCRMWKYASZFBS-VMPITWQZSA-N 338.429 1.392 10 10 EDCE Cc1cc(/C=C/C(=O)NC(C)(CO)CO)c(C)n1-c1ccccc1 120641133 RNDSZFSMUGYDGU-MDZDMXLPSA-N 328.412 1.967 10 10 EDCE CCNC(=O)c1coc(CN2CCN(c3ccc(OC)cc3)CC2)n1 34684283 DLQBLVLPVQHPDS-UHFFFAOYSA-N 344.415 1.755 10 10 EDCE CNC(=O)c1ccc(N2CCN(c3ccc(OC)cc3)CC2)nn1 74725202 BLKBJZOFGRNHOA-UHFFFAOYSA-N 327.388 1.171 10 10 EDCE CCN(CC)c1ccc(CN2CCC[C@@]3(C2)NC(=O)NC3=O)cc1 193468828 JMVWQFYYZWBOQM-SFHVURJKSA-N 330.432 1.707 10 10 EDCE C[S@@](=O)CCCNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255341520 ANOVKFUOZNGPNT-OJGACTJDSA-N 336.457 1.421 10 10 EDCE O=S1(=O)[C@H]2CC[C@H]1CN(Cc1cc3c(cc1O)OCO3)CC2 529672378 KUKWYZGTFIWEEA-RYUDHWBXSA-N 325.386 1.272 10 10 EDCE CN(CCCO)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 282573187 BHUNYXAWVMQARF-UHFFFAOYSA-N 325.384 1.186 10 10 EDCE CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1O 800310428 ZHTDDGQABGKCDJ-GWCFXTLKSA-N 343.405 1.108 10 10 EDCE COc1ccc(N2C[C@H](N)[C@@H]3COC[C@@H]32)c(OC)c1Br 2162633859 BZPJQMGOENOYNL-QXEWZRGKSA-N 343.221 1.629 10 10 EDCE CCOc1cccc(CN2C[C@@H]3[C@H](C2)[C@@H](OC)CS3(=O)=O)c1O 827390152 USIYJBVVVOELFX-VHDGCEQUSA-N 341.429 1.035 10 10 EDCE CCN1CCN(CC(=O)NCCCSc2nccs2)CC1 746021756 UQHUZGOJOREOLI-UHFFFAOYSA-N 328.507 1.379 10 10 EDCE CC(C)C(=O)N1CCC(NC(=O)NCc2c(O)cccc2F)CC1 914014630 GOJIKSPYERCXRR-UHFFFAOYSA-N 337.395 1.978 10 10 EDCE Cc1cc(CC(=O)N2[C@@H](CO)CC[C@@H]2CO)c(C)n1-c1ccccc1 912224441 CEMKNKBTUQLMES-RTBURBONSA-N 342.439 1.981 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)[C@@H]3C[C@H]3OC)CC2)cc1 929477781 ZDENNQFXEZLAKV-QZTJIDSGSA-N 347.459 1.358 10 10 EDCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)[C@H]2COC(C)(C)C2)c1 859007184 VCUDGODSZJONRZ-ZYHUDNBSSA-N 329.418 1.949 10 10 EDCE C[C@@H](NCCc1nnnn1C)c1cc(Br)ccc1O 756676853 NIGXZEPHRFWPHJ-MRVPVSSYSA-N 326.198 1.572 10 10 EDCE COc1ccc(N2CC[C@@H](Nc3nc(N)nc4c3cnn4C)C2)cc1 853761719 VOFUTKAHPJTGTJ-LLVKDONJSA-N 339.403 1.645 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCCn3cncn3)C2)cc1 851971336 BEUNMIZSURRYIH-CQSZACIVSA-N 344.419 1.255 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CO)CC(C)C)C2)cc1 852450434 MHJXVGNBHKIYQJ-GJZGRUSLSA-N 335.448 1.980 10 10 EDCE CCOC(=O)C[C@H](O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 859190410 JXULWYOIPXFTBA-HOTGVXAUSA-N 337.416 1.687 10 10 EDCE CC(=O)C(=O)COC(=O)C1(C(=O)OC(C)(C)C)CCSCC1 860391285 PAQDWVHSDAJISQ-UHFFFAOYSA-N 330.402 1.543 10 10 EDCE O=C(O)c1cc(O)ccc1NS(=O)(=O)C1Cc2ccccc2C1 776434834 NVFJIOQFNOSQFQ-UHFFFAOYSA-N 333.365 2.000 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 885003951 LSXNZMKRXWDRPO-NSHDSACASA-N 327.377 1.581 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)C1=C2CCCN=C2NN1 1136972422 MDUYBQUZSOOTBX-UHFFFAOYSA-N 327.388 1.032 10 10 EDCE COC(=O)[C@@H]1[C@H]2CN(C(=O)c3cc4cc(O)c(O)cc4s3)C[C@H]21 897825697 MXAKCBUYNQDAGX-QRJZZWFUSA-N 333.365 1.804 10 10 EDCE C[C@@H]1C(=O)Nc2cc(C(=O)NCc3c(O)cccc3O)ccc2N1C 1304053083 BTMWMVSYHYYLJH-SNVBAGLBSA-N 341.367 1.805 10 10 EDCE Oc1cc(Br)ccc1CN1CCO[C@]2(CCNC2)C1 717405191 IIYKQCNUVDRFNM-AWEZNQCLSA-N 327.222 1.719 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(C)C[C@@H]2CO)c(Br)c1 699431923 HGYGEWDMFONQJD-ZYHUDNBSSA-N 329.238 1.615 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC3CC(C)C3)C2)cc1 1261700798 QEUJGRHWVARKBL-MOKVOYLWSA-N 331.416 1.305 10 10 EDCE COC(=O)c1ccc(C(=O)NCc2ccc3cccnc3c2O)n1C 1451946160 CHYVJVKBTGDBIF-UHFFFAOYSA-N 339.351 1.996 10 10 EDCE COC[C@@H](C)C(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1295538861 LSHYRNGSLNVPBI-GHMZBOCLSA-N 349.391 1.366 10 10 EDCE C[C@H]1CN=C(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)S1 1293435455 MJCISSFSVMLXDI-NSHDSACASA-N 335.429 1.276 10 10 EDCE O=C1Nc2cc(N3CC=C[C@H]3CO)c(Br)cc2[C@H]1O 2119853770 RNRWUUJWVHMIAQ-JVXZTZIISA-N 325.162 1.172 10 10 EDCE COCCCN[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1713208087 AOLLPGSXMYVUQS-OKILXGFUSA-N 333.392 1.736 10 10 EDCE COc1ccc(CNC2CC(N(C)C(=O)CCNC(N)=O)C2)cc1C 1717999919 QOXWYGHSZPVCJK-UHFFFAOYSA-N 348.447 1.141 10 10 EDCE CCn1nccc1C(=O)NC[C@@H](O)CNCc1ccc(OC)c(C)c1 1496970877 ZFVNBGRLFLLZPJ-HNNXBMFYSA-N 346.431 1.101 10 10 EDCE C[C@H](O)c1ccc(N2CCC[C@@H]2[C@@H](O)CO)cc1Br 2123170521 IGICYNSRGZVRFS-FZZIBODNSA-N 330.222 1.824 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@H](C)CC(N)=O)cc1C 1734336307 GPIZMVJCRPXKEL-UONOGXRCSA-N 335.448 1.452 10 10 EDCE C[C@@H]1CCN(CC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C1 1648478109 QJNJZGGFVCIPFK-CRAIPNDOSA-N 332.492 1.813 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)CCc2cnn[nH]2)cc1C 1674729990 YMMCTXALCCQCNK-KBPBESRZSA-N 345.447 1.737 10 10 EDCE CC(C)(C)OC(=O)NCC12CC(C(=O)NCCN=[N+]=[N-])(CO1)C2 1965102755 SVBCHCOJPIGHGE-UHFFFAOYSA-N 325.369 1.487 10 10 EDCE CCCCC(=O)N1CCC(NC(=O)c2cc(O)c(O)c(O)c2)CC1 169859766 OMDOUYJCKXIMEM-UHFFFAOYSA-N 336.388 1.714 10 10 EDCE CS(=O)(=O)CCOc1cccc(NC(=O)Cc2ccc(N)cc2)c1 154427827 FWVIEYACKDKMGF-UHFFFAOYSA-N 348.424 1.873 10 10 EDCE CCOC(=O)CCN(C)C(=O)CCNCc1ccc(N(C)C)cc1 1857863317 VZCJKYWFBNAFKQ-UHFFFAOYSA-N 335.448 1.644 10 10 EDCE C[C@](O)(CO)[C@@H]1CCN(c2ccc(CN)c(Br)c2)C1 2138099266 AUIVHYNWEQGQLG-RISCZKNCSA-N 329.238 1.477 10 10 EDCE CN(CCC(=O)O)S(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 232389524 KKFYKTCEBXYUGQ-UHFFFAOYSA-N 343.188 1.762 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1COC(=O)N1 1951941929 ZKMOBNAFKRBSDW-MNOVXSKESA-N 338.360 1.642 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1CC(=O)CN1 1952233187 FXPUOAVBIKAUKV-CHWSQXEVSA-N 336.388 1.465 10 10 EDCE CO[C@H](c1cc(O)c(O)c(O)c1)[C@@H](NC(=O)OC(C)(C)C)C(=O)O 1952306356 LAVDYNVUYQTULM-ZYHUDNBSSA-N 343.332 1.469 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CO[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1985102562 INCMATLFLRDFMG-LLVKDONJSA-N 327.385 1.781 10 10 EDCE CC1([C@H]2CCCN(S(=O)(=O)Cc3ccc(N)cc3)C2)OCCO1 2145834431 GWIDXZAIOYJNSI-AWEZNQCLSA-N 340.445 1.574 10 10 EDCE C[C@H]1CN(Cc2cc(N)ccc2O)CC[C@H]1NC(=O)C(F)(F)F 1999437669 RNFADRAABBPOPG-JOYOIKCWSA-N 331.338 1.863 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cccc(O)c2O)[C@@H](O)C1 2005086160 UCSYGDIVWINQRF-OCCSQVGLSA-N 338.404 1.558 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1(F)F 2003170368 QCRGKAUPNAKSGY-BFLSOPEQSA-N 346.374 1.658 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](O)CN1CCc1ccc(N)cc1 2014240964 ZNMXXUQRPUGLQK-HOTGVXAUSA-N 335.448 1.771 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCCN(C(C)(C)C)CC3)c2n1 2062085667 KZFNSUCINPNDRA-UHFFFAOYSA-N 331.420 1.690 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)cc1Br 2178087059 OYPBZGSEPPCXSQ-JLBHGKSJSA-N 342.233 1.946 10 10 EDCE CC(C)NCc1ccc(N2CC[C@@H](O)[C@H](O)C2)cc1Br 2188629629 INLMWEBTSIQWNN-HUUCEWRRSA-N 343.265 1.879 10 10 EDCE C[P@@]1(=O)C[C@@H](NCc2c(O)cccc2Br)[C@@H](O)C1 2057718212 GVEYKMUTXARHFL-GDAOTKPNSA-N 334.150 1.980 10 10 EDCE C[C@H](O)c1ccc(N2CC(=O)N[C@@H]3CC[C@@H]32)c(Br)c1 2112061624 MKSBVZIASRNGMW-KDDOJWQBSA-N 325.206 1.970 10 10 EDCE O=C(O)[C@@H]1[C@@H]2OCCN(Cc3ccc(Br)cc3O)[C@H]21 2092844069 JOXBQCYYLPLHSK-SRVKXCTJSA-N 328.162 1.439 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H](C3)[C@@H]4O)c(Br)cc2[C@H]1O 2286215616 WJUUKMPILAKNPK-NFECNHKBSA-N 339.189 1.252 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@H](O)CC2)c(Br)c1 2284540495 CBWMSINTUHBMFQ-GASCZTMLSA-N 343.265 1.881 10 10 EDCE O=C(O)[C@@H]1CCCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2309144757 IAWURJBAYNLQLL-MRXNPFEDSA-N 344.411 1.860 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H](CCO)COCc1ccccc1 2320367140 SJWCSDBUVISWLD-MRXNPFEDSA-N 345.395 1.724 10 10 EDCE Cc1ccc(CN(C)C[C@@H]2CNCCO2)c(O)c1Br 2352944374 GTBQXABRKYVCLM-LBPRGKRZSA-N 329.238 1.883 10 10 EDCE CN[C@@H](c1ccccc1O)[C@@H](O)c1nc(Br)nn1C 2353741212 ZHGIOGYCGKZNBJ-VHSXEESVSA-N 327.182 1.277 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2355340216 NRYWULHGYCXGKD-KBZKQINZSA-N 342.233 1.823 10 10 EDCE COC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1cccc(O)c1O 1148218789 LHCCZGLGYMKHCE-CQSZACIVSA-N 327.336 1.838 10 10 EDCE O=C(CN1C(=O)/C(=C/C=C\c2ccccc2)SC1=S)NCCO 210394047 MJCNLWUIOHECCD-TWMMPZAQSA-N 348.449 1.553 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCO[C@]2(CCOC2)C1 184410446 VJUMZMIJYKTXFT-LJQANCHMSA-N 345.443 1.988 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N[C@H]1CCCCNC1=O 255278634 MGTXATPOUKTRCT-SKHCZCESSA-N 343.427 1.321 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CNC[C@H]3O)c2C)cc1 262258665 MBRKKPWEWQMRJK-KBXCAEBGSA-N 343.427 1.413 10 10 EDCE O=C1N[C@@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CS1 266918163 VJGHBPTZILOIJC-OAHLLOKOSA-N 349.456 1.337 10 10 EDCE COc1ccc(N(C)CC(=O)N2CCOC[C@H]2C2CC2)c(OC)c1 367284539 DOJOWUIVSDEXMW-INIZCTEOSA-N 334.416 1.777 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@H]([C@@H]4CCOC4)C3)cc2N1 366709136 IEWNLSMFIQLJQH-GHMZBOCLSA-N 333.344 1.789 10 10 EDCE CC[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@]2(CCOC2)O1 366525099 WCVKVTWSTQLXCR-QPKYCAORSA-N 333.384 1.908 10 10 EDCE CC(=O)C(=O)CSc1nnc(COc2ccc(C(C)C)cc2)n1N 289620147 LQDAALZSGVUUQD-UHFFFAOYSA-N 348.428 1.945 10 10 EDCE COC(=O)[C@@H]1CN(Cc2ccc(C)c(Br)c2O)CCO1 2380669288 CXBSERKQSIADEE-NSHDSACASA-N 344.205 1.837 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(C)COCCO2)c(O)c1Br 2380754014 LZYYSUVWNWGGRH-CQSZACIVSA-N 344.205 1.885 10 10 EDCE Cc1cc(Cl)cc(CN(C)[C@H]2CCN(S(C)(=O)=O)C2)c1O 292746340 HZRIVGGRMMRIRT-ZDUSSCGKSA-N 332.853 1.820 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1ccn(C)n1 805701833 ZCHBGNOBEVIIDY-UHFFFAOYSA-N 343.431 1.151 10 10 EDCE O=[N+]([O-])c1c[nH]ccc1=NCc1ccc(N2CCOCC2)c(F)c1 727430850 FONLEEMKHHSVCR-UHFFFAOYSA-N 332.335 2.000 10 10 EDCE C[C@@H]1CC[C@@H](O)CN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823520511 WOEXOORCYHWPGA-RDTXWAMCSA-N 347.459 1.703 10 10 EDCE Cc1cc(CC(=O)NCCOCC(N)=O)c(C)n1-c1ccccc1 830154691 DWZXSOVTORYZFL-UHFFFAOYSA-N 329.400 1.255 10 10 EDCE NC(=O)[C@H]1CC[C@@H]1C(=O)NCc1cc(Br)ccc1O 848067798 CEWMWFZGFMHXEP-UWVGGRQHSA-N 327.178 1.282 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CNCC[C@H]1C 842266631 WIJPHUDQVKHSIP-HIFRSBDPSA-N 333.432 1.245 10 10 EDCE COc1cc(N(C)Cc2nc(C(C)(C)N)no2)cc(OC)c1OC 843358924 GDVAEZCYBILCGR-UHFFFAOYSA-N 336.392 1.926 10 10 EDCE C[C@@H](NC(=O)NCC(=O)N=S(C)(C)=O)c1ccc(N(C)C)cc1 922052992 ZQJKXOMTKFZMEX-LLVKDONJSA-N 340.449 1.367 10 10 EDCE CN(CC(=O)N1CCOCC1)C(=O)CSc1ncc(Cl)s1 849999283 XVFXJIFRCMZVLU-UHFFFAOYSA-N 349.865 1.206 10 10 EDCE C[C@@H](NCCc1nnnn1C)c1cc(Br)c(F)cc1O 756677580 RDYWNMWBTFDCMT-SSDOTTSWSA-N 344.188 1.711 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](C)[C@@H](CO)C3)C2)cc1 856920276 RZLOCRJRGUXNQA-XHSDSOJGSA-N 347.459 1.934 10 10 EDCE COc1ccc(N(C)C[C@H](O)COC[C@@H]2CCCO2)c(OC)c1 752126482 SUSXLYNNISQBQL-ZFWWWQNUSA-N 325.405 1.697 10 10 EDCE CC[C@@H](C)OCC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 751753788 HPRNCSDPVQRZKG-MRXNPFEDSA-N 349.475 1.749 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)CN2CCCCC(=O)C2=O)c1 866763449 DVKXAAKMEBESGK-NSHDSACASA-N 334.372 1.160 10 10 EDCE c1cc(N2CC(NCc3ccc(N4CCOCC4)cc3)C2)ncn1 865748807 DDPFTBKYTPYPCS-UHFFFAOYSA-N 325.416 1.292 10 10 EDCE CCN(C)c1ccc(CN2CCN(C(=O)C(OC)OC)CC2)cc1 930957919 HZPSXPIRKDMXTB-UHFFFAOYSA-N 335.448 1.406 10 10 EDCE Cc1cc(N(C)C)ccc1CN1C(=O)N[C@H](c2ccn(C)n2)C1=O 761354450 IPNIVZKGKDGCIR-OAHLLOKOSA-N 327.388 1.588 10 10 EDCE CC(C)O[C@]1(CS(=O)(=O)N2Cc3cccc(O)c3C2)CCOC1 867691061 QLYPMTXZAFGFAL-MRXNPFEDSA-N 341.429 1.622 10 10 EDCE N[C@H](CO)c1c(O)c(C(=O)O)cc2cc(Br)ccc12 72199907 ZNCCYCAGHYHADW-SNVBAGLBSA-N 326.146 1.998 10 10 EDCE COc1ccc(CNC(=O)NCCOc2ncccc2F)c(O)c1 793007767 BJCNTJIVLIFMIK-UHFFFAOYSA-N 335.335 1.813 10 10 EDCE Cc1ccc(C(=O)NCc2nc(-c3ccncc3)n[nH]2)c(O)c1O 1142373113 HWYRCXARYYONCS-UHFFFAOYSA-N 325.328 1.516 10 10 EDCE 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C[C@@H]1CCN1C(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1119960990 HDSBDVTWIMGFFF-CZUORRHYSA-N 332.448 1.092 10 10 EDCE NCc1cc(F)c(N2CC[C@H](O)C[C@@H]2CO)cc1Br 2136084075 HMBDKRRFJYNWOL-ZJUUUORDSA-N 333.201 1.369 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1COC[C@H]1N(C)C(=O)OC(C)(C)C 1985101774 XLKXTCBGLQJTCS-GHMZBOCLSA-N 327.385 1.637 10 10 EDCE CC(C)(C)OC(=O)NCCCNC(=O)c1cc(O)c(O)c(O)c1 1988123976 QUFGHYWDJSYGTQ-UHFFFAOYSA-N 326.349 1.448 10 10 EDCE COCCNCc1ccc(N2CC[C@H]2C(N)=O)cc1Br 2145604541 NTEVEXWZLRKQHY-ZDUSSCGKSA-N 342.237 1.249 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H]2CN(CCCN=[N+]=[N-])CCN2C1=O 2006170754 OJHBKNUTMZVBPM-NEPJUHHUSA-N 338.412 1.497 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CCC(=O)NCc1ccccc1O 2010278121 DPIRDSWNFQTUKK-CYBMUJFWSA-N 338.404 1.674 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)NCCc1ccc(N)cc1 2018032694 BQOGDNWFZLQHDK-AWEZNQCLSA-N 337.420 1.203 10 10 EDCE C[C@@H](C(=O)Nc1ccc(N)cc1)N(CCC(N)=O)Cc1ccccc1 2034749768 LKVUZPREVICDOD-AWEZNQCLSA-N 340.427 1.973 10 10 EDCE CC(C)NCc1ccc(N(C)C(CO)CO)c(Br)c1 394095932 VUUGHYVLVGEBTM-UHFFFAOYSA-N 331.254 1.737 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H]3[C@H]3CCC[C@H]3O)c2n1 2063504246 QFTJUHUAKROPTB-MRVWCRGKSA-N 330.388 1.509 10 10 EDCE CCN(C[C@H](O)C(F)(F)F)C(=O)c1cnn2c(O)cc(C)nc12 2064159305 LPYLGWAASUWBFO-VIFPVBQESA-N 332.282 1.129 10 10 EDCE C[C@]1(NC(=O)C(F)(F)F)CCN(CC(=O)Nc2ccc(N)cc2)C1 2044611896 RZPBDBJKBXVQKU-AWEZNQCLSA-N 344.337 1.350 10 10 EDCE O=C1C[C@@H]2CCN(c3ccc(CO)c(Br)c3)C[C@@H]2N1 2088803498 JAKGKTKORZYMCW-ZANVPECISA-N 325.206 1.656 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](COc1nnc(=N)[nH]n1)c1ccsc1 2210644959 RTLZEAVRMLHNPP-VIFPVBQESA-N 338.393 1.385 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1[C@H]2C[C@@H](CN(CCN=[N+]=[N-])C2)[C@@H]1CO 2212449657 CQCQLUUESIHBQU-CYDGBPFRSA-N 325.413 1.750 10 10 EDCE COc1ccc(N2CC[C@@H](O)[C@H](O)CC2)c(OC)c1Br 2284570625 JFTOTCPWVXAEEH-GHMZBOCLSA-N 346.221 1.788 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3CS(=O)(=O)[C@H]3C2)c(Br)c1 2336465845 MLNBMXFAPSKOJP-DVYJOKAKSA-N 346.246 1.736 10 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CON(C(=O)c1cccc(O)c1O)C1CN(C(=O)OC(C)(C)C)C1 2006280112 PMVBMGFJIRMEEV-UHFFFAOYSA-N 338.360 1.721 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)([C@@H](F)C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010394841 FRMYKKJKJYSJAL-ZJUUUORDSA-N 343.359 1.218 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@]1(CO)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010389928 WEXAKWNJBNVAKR-NHYWBVRUSA-N 339.396 1.660 10 10 EDCE O=C(O)[C@@H]1CO[C@H]2CN(Cc3c(O)cccc3Br)C[C@@H]12 2160867463 KMYOZWOLVPSYND-PLMOITTCSA-N 342.189 1.686 10 10 EDCE NC[C@@H]1CCCCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2053835279 VCRNJSOFBJMAOM-SFHVURJKSA-N 329.444 1.876 10 10 EDCE CN(Cc1ccc(Br)cc1O)[C@@]1(C(=O)O)CCOC1 691423398 MUGFGCSSROQJTC-ZDUSSCGKSA-N 330.178 1.830 10 10 EDCE CN1C(=O)O[C@@H]2CN(c3ccc(CN)c(Br)c3F)C[C@H]21 2176923766 JHQWLLIHXYOOTQ-NXEZZACHSA-N 344.184 1.686 10 10 EDCE N[C@@H]1C[C@H](O)CN(Cc2cc(Cl)cc(Br)c2O)C1 2049113235 HVGWKXZILKEBNL-ZJUUUORDSA-N 335.629 1.702 10 10 EDCE OCc1ccc(N2CC[C@H]3OCCO[C@@H]3C2)c(Br)c1 2095426239 JGDARYBDPDWEEM-ZIAGYGMSSA-N 328.206 1.936 10 10 EDCE 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CC(=O)C(=O)COC(=O)Cc1csc(NC(=O)C(C)(C)C)n1 808521932 JLRGFJRWNQXXHS-UHFFFAOYSA-N 326.374 1.372 10 10 EDCE CC(C)N(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCOC1 292985616 XVZVPCUXHFZRJU-GFCCVEGCSA-N 342.417 1.403 10 10 EDCE CN(C)C(=O)C1(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 806506114 KBAQOFIMJSGKTI-UHFFFAOYSA-N 347.484 1.724 10 10 EDCE C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)/C=C\c1ccc(O)c(O)c1 588538556 TYCTYVYMLAFVIB-SCXUMTSISA-N 334.416 1.415 10 10 EDCE COC(=O)[C@H]1CSCCN(Cc2cc(OC)c(OC)cc2O)C1 840186244 MJPMKCKTODSPSB-GFCCVEGCSA-N 341.429 1.747 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCN(c3nncn3C)CC2)cc1 848926330 PCDHTQZCCMDWOY-SNAWJCMRSA-N 326.448 1.717 10 10 EDCE C[C@@H]1[C@@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCN1C 923338024 WZXQCNZZJNLINR-KDOFPFPSSA-N 346.475 1.540 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCNC[C@H]1C(F)F 844225179 ZYHFPUMBSXLKIP-HNNXBMFYSA-N 340.418 1.250 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C[C@@H]1CN(C2CC2)C(=O)O1 844342274 AUFCLMRNOQETGD-OAHLLOKOSA-N 348.399 1.741 10 10 EDCE 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1.498 10 10 EDCE CO[C@H](C(=O)N1CC(N=[N+]=[N-])C1)C1CN(C(=O)OC(C)(C)C)C1 1985099685 ANUDLZPSLJBSRL-NSHDSACASA-N 325.369 1.389 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C1(CO)CN(C(=O)OC(C)(C)C)C1 1985093514 AMOJTDYWMZNUIU-UHFFFAOYSA-N 327.385 1.375 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H]2[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003170303 POOZYEDNFSQPEK-BAYHKCFCSA-N 336.432 1.898 10 10 EDCE C[C@H]1OCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010405218 GPMPAUFSVQGXTC-WOPDTQHZSA-N 339.396 1.922 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2014510387 XYDUSDRVMBPGTA-RYUDHWBXSA-N 341.412 1.811 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)C[C@@H](O)C2)cc1Br 2161356944 LALMQVGBGUBIIX-OKILXGFUSA-N 343.265 1.879 10 10 EDCE CCNC(=O)c1cn(Cc2cccc(Br)c2O)nc1O 2070636243 KPMFANWPFPBVKA-UHFFFAOYSA-N 340.177 1.855 10 10 EDCE Nc1ccc(CCNC(=O)c2nnc(Br)s2)cc1 2062556020 JWDCZLPJVWLBRQ-UHFFFAOYSA-N 327.207 1.855 10 10 EDCE C[C@H](N)c1ccc(N2CCCC2(CO)CO)cc1Br 2089867622 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Cc1ccn(C[C@](C)(O)C(=O)NCc2c(O)cccc2F)c(=O)c1 928707466 FAQALFSUWZOWAZ-KRWDZBQOSA-N 334.347 1.069 10 10 EDCE O=S1(=O)Cc2ccccc2[C@H](NCc2cc3c(cc2O)OCO3)C1 857061727 USLPABHEYZHIJX-CQSZACIVSA-N 347.392 1.880 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1nccn1C 852005732 ZSYDTPAZRLSTQI-AWEZNQCLSA-N 343.431 1.817 10 10 EDCE CS(=O)(=O)CC1(CCNC(=O)/C=C\c2ccc(O)c(O)c2)CC1 855215727 YRKOOMGJBPCHHC-HYXAFXHYSA-N 339.413 1.442 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC(O)(CO)C2)cc1 861848472 IZFUKXCHELMKCR-UHFFFAOYSA-N 342.395 1.015 10 10 EDCE CN(C)c1ccc(/C=C\CNC[C@@]23COCCN2C(=O)OC3)cc1 865770365 KOMDLFHQDKGDDS-JXCVUKRWSA-N 331.416 1.577 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1N(C(=O)OCc2ccccc2)CC1(C)C 869572983 GCCXNZSBTRKHBM-HNNXBMFYSA-N 347.367 1.735 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)CC3CSC3)cc2)CC1 867680215 COSGWXJZWMKELR-UHFFFAOYSA-N 347.484 1.724 10 10 EDCE C[C@@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)CCS1(=O)=O 896489805 YGJZIKQCNDNTPF-MRVPVSSYSA-N 341.410 1.572 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccc(C(N)=O)nc1 797636191 KQCKQJHXIBCPLA-VIFPVBQESA-N 330.344 1.344 10 10 EDCE COCCNC(=O)CN(C)Cc1cccc(Br)c1O 133125672 DPAAZORYWHSKSO-UHFFFAOYSA-N 331.210 1.349 10 10 EDCE COC(=O)c1cnc(C(=O)NCc2ccc3cccnc3c2O)cn1 1142728503 VUSLETGIVVYTLC-UHFFFAOYSA-N 338.323 1.447 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CNC(=O)C(C)(C)C)cc1C 1317291966 XQVJSXNIZNXXNB-CQSZACIVSA-N 349.475 1.760 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C[C@@H]1F 1346326541 INRSVNWJLCHERM-QWRGUYRKSA-N 345.465 1.948 10 10 EDCE O=C(CNC(CO)CO)Nc1ccc(N=Nc2ccccc2)cc1 1194488512 PQYYYTUKHYCCMZ-UHFFFAOYSA-N 328.372 1.983 10 10 EDCE CCC(=O)N[C@]1(C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1506384383 VYKMVKLPBMJUJZ-MRXNPFEDSA-N 331.376 1.980 10 10 EDCE COc1ccc(CNCCC[C@H](C)NC(=O)[C@@H]2CNC(=O)N2)cc1C 1700671060 HZBSTLUAMMBGAA-ZFWWWQNUSA-N 348.447 1.060 10 10 EDCE COc1ccc(NC(=O)c2cccc(O)c2O)cc1S(C)(=O)=O 1557039057 KOJFSUPAPMFJCI-UHFFFAOYSA-N 337.353 1.762 10 10 EDCE CNC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(O)c(O)c1 1625144601 UEPYMXFUBNIDAC-AWEZNQCLSA-N 328.368 1.114 10 10 EDCE C[C@@H](NC(=O)CC1(n2cnnn2)CCOCC1)c1ccccc1O 1557968078 SCEBXMXZPCFQOD-GFCCVEGCSA-N 331.376 1.152 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cnns2)cc1C 1497537558 NWCLVUNSQPPALI-ONEGZZNKSA-N 332.429 1.931 10 10 EDCE CC(=O)N/C(=C/C1=S=CC=C1)C(=O)Nc1ccnc2cc(C)nn12 1633943307 RVVCOGFRVOHYSS-UKTHLTGXSA-N 341.396 1.274 10 10 EDCE C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1CNCCO 1569855899 OXOKILDGFZXAHY-YPMHNXCESA-N 333.392 1.139 10 10 EDCE C[C@@H](NC(=O)[C@H]1CN(C(=O)C(C)(C)C)CCO1)c1ccccc1O 1643741940 GLHUDAQOLOWEEO-IUODEOHRSA-N 334.416 1.843 10 10 EDCE CC[C@@H](CNC(=O)Cc1ccn(C)n1)NCc1ccc(OC)c(C)c1 1665789546 YETVARWTMOJSBB-INIZCTEOSA-N 344.459 1.964 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2ccncc2)cc1C 1677052027 KKUQXANEZWWPJU-KRWDZBQOSA-N 343.427 1.621 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(=O)N(C)[C@H](C)C2)c([N+](=O)[O-])c1 1773055349 NJHRKQJCMZQBMS-JPVGGKMYSA-N 333.344 1.448 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)[C@@H]2CCCNC2)c2nccn2C)cc1 1865975445 CUSCAFUPTVHGSE-NVXWUHKLSA-N 341.459 1.691 10 10 EDCE O=S(=O)(C[C@H]1CC[C@@H](C2CC2)O1)NCc1ccc(O)cc1O 1212223341 PEACRXGBJPZBOR-HIFRSBDPSA-N 327.402 1.475 10 10 EDCE Cc1c(O[C@@H](C)C(=O)O)c(=O)ccn1CCOc1ccc(N)cc1 1857919560 LTWCOQWGFUDTRD-LBPRGKRZSA-N 332.356 1.670 10 10 EDCE CN1CCN(c2ccc(CN)cc2Br)[C@@H](CCO)C1 2138079916 AVKWVYFCPCOXGE-LBPRGKRZSA-N 328.254 1.411 10 10 EDCE CC[C@H]1C(=O)NCCN1c1ccc(CNC)c(Br)c1 233945745 HDYWSWIZXGBLIZ-ZDUSSCGKSA-N 326.238 1.883 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H](O)[C@H](F)C3)c(Br)cc21 2149255948 ACHDUCCXPJNQLH-FXAINCCUSA-N 344.184 1.181 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](O)C(C)(C)N 1951507014 LGPKJMBPMLNOCZ-BXUZGUMPSA-N 340.420 1.632 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2CCN(C)C2=O)c1O 1973451569 MTKKPOLSQHTUCA-SECBINFHSA-N 343.221 1.731 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 1985101472 SVTMTIPUAVPCJX-NSHDSACASA-N 327.385 1.781 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)[C@@H](CCO)C2)cc1Br 2149908171 QMAGTSUZZBIECF-SRVKXCTJSA-N 344.249 1.930 10 10 EDCE CCNCc1ccc(N2C[C@H]3C[C@@]2(CO)CO3)cc1Br 2150999919 GYLUXFAFLPCFKM-UKRRQHHQSA-N 341.249 1.899 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)CCc2ccc(N)cc2)CO1 1999129381 VRHIODNWMBJHTN-CQSZACIVSA-N 335.404 1.869 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010396687 OYARFKRUSJLIPH-NHYWBVRUSA-N 339.396 1.660 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@H]2CNC(=O)OC(C)(C)C)c(N)c1 2014240239 UZEFAPNGVJDUJY-RYUDHWBXSA-N 337.420 1.742 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H]2CS3(=O)=O)cc1Br 321179273 MLOXYJOHVAUTJE-DVVUODLYSA-N 345.262 1.845 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H]3C3CCOCC3)c2n1 2064652904 VCILUFVERYCTSR-CQSZACIVSA-N 330.388 1.775 10 10 EDCE O=C1Nc2cc(N3CC[C@@H]4[C@H](O)C[C@H]43)c(Br)cc2[C@H]1O 2178158076 ZTVNEUXDISRCRO-BFTZAXHYSA-N 339.189 1.394 10 10 EDCE O[C@H]1CN(c2ccc(CNC3CC3)c(Br)c2)CC[C@H]1O 2188637372 UVJHUWMPXKOWFQ-CABCVRRESA-N 341.249 1.633 10 10 EDCE Cn1cc(N)c(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)n1 2191538373 HQIYFLDBVIOTPQ-UHFFFAOYSA-N 337.188 1.816 10 10 EDCE O=C(N[C@H](COCc1ccccc1)C(=O)O)c1cc(O)c(O)c(O)c1 2068567769 SHSKXWAWGZAYNL-GFCCVEGCSA-N 347.323 1.203 10 10 EDCE COc1ccc(N2CCOC[C@H]2CN)c(OC)c1Br 2106372158 CEKPSDLHMALZEQ-SECBINFHSA-N 331.210 1.630 10 10 EDCE CNCc1ccc(N2CC[C@H]([C@@](C)(O)CO)C2)cc1Br 2202853776 RSZAHSSTLXGMOX-WFASDCNBSA-N 343.265 1.738 10 10 EDCE CNCc1ccc(N2CC[C@@H]([C@@](C)(O)CO)C2)cc1Br 2202853773 RSZAHSSTLXGMOX-DOMZBBRYSA-N 343.265 1.738 10 10 EDCE OC[C@@H](O)[C@H]1CCN1c1ccc(CNC2CC2)c(Br)c1 2286208962 MTVVLQKWTBEWGB-HUUCEWRRSA-N 341.249 1.633 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)[C@H](O)CC2)c(Br)c1 2269120107 BGTCLYPJXVNJFF-QCZZGDTMSA-N 330.222 1.824 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCc1ccc(O)nc1 2297610874 SUARIZQOBGRLHO-UHFFFAOYSA-N 339.395 1.953 10 10 EDCE CC(C)n1ncc2cc(/C=C\C(=O)N(C)c3ccn(C)n3)c(=O)[nH]c21 492642902 GHVPYMZQIMZKMN-WAYWQWQTSA-N 340.387 1.715 10 10 EDCE Cc1ccc(CN2CC[C@@](O)(C(=O)O)C2)c(O)c1Br 2352944631 KIUXPEWHHRKNFF-ZDUSSCGKSA-N 330.178 1.485 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)c(Br)c1 2357057242 VSHVOIBIAJWZBJ-AMPPCDIJSA-N 341.249 1.932 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)C[C@@H]2CCNC2=O)cc1C 1283619665 BAAKHQGJUYNTCH-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE CCN(CC)c1ccc(CNC(=O)CNC(=O)c2ccccn2)cc1 172517901 OTLIAIDHWONQRJ-UHFFFAOYSA-N 340.427 1.974 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)[C@@H](O)[C@H]2CF)cc1Br 2358209616 UEOTVNLBCAGXMR-IYMWITQMSA-N 347.228 1.609 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H](CO)C[C@@H](O)C(C)(C)C)cc1 284693381 HCCNOOLUYOSYEI-GOEBONIOSA-N 337.464 1.710 10 10 EDCE CC1CCN(c2ccc(CNC[C@@H](O)CN3CCOCC3)cc2)CC1 819039503 RDLZQHADUXLFRY-HXUWFJFHSA-N 347.503 1.706 10 10 EDCE CCOc1cccc(CN2CCS(=O)(=O)[C@@H]3CCC[C@@H]32)c1O 825200695 GLTAEZPWTWNNIG-DZGCQCFKSA-N 325.430 1.942 10 10 EDCE CCOC(=O)c1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)on1 828884412 BEQFKHHKBHDAIN-SECBINFHSA-N 334.328 1.624 10 10 EDCE CCO[C@@H]1C[C@@H](NC(=O)c2c(F)ccc(O)c2O)[C@@H]1n1cccn1 832932924 DGZWAUSSORPFGX-QKCSRTOESA-N 335.335 1.582 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CC[C@](O)(C(F)F)C1 838478942 NWNPEVDHNFLSCG-MRXNPFEDSA-N 327.375 1.973 10 10 EDCE CC1(C)[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C[C@H]1N1CCOCC1 911848713 YDFXGEASGZSFNT-TZNLOLHFSA-N 346.427 1.727 10 10 EDCE NC(=O)[C@H]1C[C@@H](NC(=O)NCc2cc(Br)ccc2O)C1 845448740 UDJHPDRNTVZXBU-WKFQBHICSA-N 342.193 1.218 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCNC[C@@H]2c2cccnc2)c1O 843113663 AAALRAKYXFDCTI-OAHLLOKOSA-N 344.371 1.851 10 10 EDCE COC(=O)[C@@H]1CCCCC[C@@H]1NC(=O)C(=O)Nc1ccc(N)cc1 841136910 YKGXXBWPTZVASS-KGLIPLIRSA-N 333.388 1.445 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H](O)C(F)(F)C(F)(F)F 922243487 QOMRVEZITZDCFP-XCRNYIDWSA-N 341.232 1.786 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(C)(C)n3ccc(N)n3)C2)cc1 852900982 XLDJUXLNZXWMBH-ZDUSSCGKSA-N 343.431 1.604 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(C)(C)N3CCOCC3)C2)cc1 855224267 JMYBLZBOTSWSTR-HNNXBMFYSA-N 347.459 1.501 10 10 EDCE C[C@H](NC(=O)[C@@H]1OCCO[C@@H]1C)c1ccc(N2CCOCC2)cc1 930745534 ZSALHJQXIWFASY-JJRVBVJISA-N 334.416 1.504 10 10 EDCE CC(C)NC(=O)[C@@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 856237715 UBALBJHAUFJERY-IQCBXXCUSA-N 332.400 1.874 10 10 EDCE O=Cc1cncc(C(=O)NCc2ccc(N3CCOCC3)cc2)c1 930523093 LSBMNDRRGHNLQP-UHFFFAOYSA-N 325.368 1.661 10 10 EDCE C[C@@H](C(=O)NCc1ccc2cccnc2c1O)N1CCN(C)CC1 862028402 YDOYTYPHANXUAV-ZDUSSCGKSA-N 328.416 1.193 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2cc(OC)c(C)cc2O)C1 863341890 WHXWCBXXOFUGCC-ZDUSSCGKSA-N 342.461 1.470 10 10 EDCE CN1CCC[C@@H]2CN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC[C@@H]21 1118953523 UCUNETHRAFHEIL-ZBFHGGJFSA-N 343.427 1.177 10 10 EDCE O=C(NCc1ccnc(-n2cncn2)c1)NCc1c(O)cccc1F 1313143253 HTYJFKOOMHYENY-UHFFFAOYSA-N 342.334 1.506 10 10 EDCE CO[C@H]1C[C@@H](C(=O)O)N(Cc2ccc(Br)cc2O)C1 1964722109 ZKHXAUNWGQPORU-QWRGUYRKSA-N 330.178 1.829 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccncc2)cc1C 1272353263 XFXLCVXIRUUJKX-INIZCTEOSA-N 329.400 1.279 10 10 EDCE CN(C(=O)c1cccc(O)c1O)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 1629859613 JCPHGPPNOWWELD-YPMHNXCESA-N 327.402 1.526 10 10 EDCE COc1cc([C@H](C)NC(=O)c2cccc(O)c2O)ccc1OCCO 1566394592 SPGMNYOHLLKZEV-NSHDSACASA-N 347.367 1.969 10 10 EDCE Cn1nc2c(cc1=O)CN(C(=O)c1ccc(N=NC(N)=O)cc1)CC2 1566148967 BGKDYTQVKVDWJK-UHFFFAOYSA-N 340.343 1.141 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc2c(nc1O)CCC[C@@H]2O 1644753764 JCXIKLIECTXJAW-HNNXBMFYSA-N 330.340 1.498 10 10 EDCE CCN(CCCNC(=O)c1ccc(N=NC(N)=O)cc1)C[C@@H](C)O 1731325902 XYJIDRXSGPBCMF-GFCCVEGCSA-N 335.408 1.672 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CN3CCC[C@H]3CO2)cc1 1583994133 KZWTWJJVRZPHEM-UONOGXRCSA-N 331.376 1.442 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CNC(=O)c1ccccc1Br 1912171392 JXUWGTWRDZMXKK-UHFFFAOYSA-N 340.181 1.948 10 10 EDCE CC(C)=CCN1CC(O)(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1699925713 LUPBXIGPOFRXLS-UHFFFAOYSA-N 345.403 1.592 10 10 EDCE CCOc1cc(C2=NN=C3C4CCN(CC4)[C@@H]23)cc([N+](=O)[O-])c1O 169962661 NAQCHMJKCXHVQY-OAHLLOKOSA-N 330.344 1.952 10 10 EDCE CN1C(=O)c2ccc(NC(=O)c3cc(O)c(O)c(O)c3)cc2C1=O 1865875804 IRWVPYJQRHVIAP-UHFFFAOYSA-N 328.280 1.282 10 10 EDCE OC/C=C/c1ccc2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@@H](CO)O2 33831958 PPZYUSOIUGJLFB-ZHEVZCJESA-N 330.336 1.977 10 10 EDCE biogenic,in-vitro C[C@@H](N)c1ccc(N2CC(CNC(N)=O)C2)c(Br)c1 2130742937 HFNDECKIKIXGHQ-MRVPVSSYSA-N 327.226 1.573 10 10 EDCE O=C(CN1C(=O)CCC1=O)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1889748990 XFGHPPNDCJIOBL-HOCLYGCPSA-N 341.411 1.441 10 10 EDCE CC[C@@H](c1cc(Br)ccc1O)N(CCO)CC(=O)O 2136353774 ATAPPLHXVRISPN-NSHDSACASA-N 332.194 1.985 10 10 EDCE CC1(CNCc2cc(Br)ccc2O)CS(=O)(=O)C1 1967847863 DMSOXHXWKCVWFP-UHFFFAOYSA-N 334.235 1.679 10 10 EDCE CC1(C)[C@H](O)CN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2136633397 YNLADXBBGUCLAB-GHMZBOCLSA-N 327.178 1.394 10 10 EDCE COc1ccc(CNN2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1 1941833054 YLYAUZUGPXYFKZ-UHFFFAOYSA-N 337.420 1.958 10 10 EDCE O=C1CC2(CCN(c3ccc(CO)cc3Br)CC2)N1 2142865155 OKCNAUKMPDVMIP-UHFFFAOYSA-N 325.206 1.800 10 10 EDCE Cn1cnc(CCNC(=O)c2ccc(O)c(O)c2)c1Br 2144575412 HEVMVBGOQMUYKQ-UHFFFAOYSA-N 340.177 1.566 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985103836 AWFFHYWPECTCTE-GARJFASQSA-N 327.385 1.419 10 10 EDCE Nc1ccc(N2C(=O)[C@@H]3[C@H]4CC[C@H](O4)[C@@H]3C2=O)c(Br)c1 2153255720 OMAIVJDKEOGUBP-BKUVIOGVSA-N 337.173 1.698 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1[C@@H]2OCCN(C(=O)OC(C)(C)C)[C@H]21 2010391967 CJHIBHUNIGAZIJ-SRVKXCTJSA-N 339.396 1.780 10 10 EDCE CO[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 2014405448 UNGOQANPNUEUNE-VXGBXAGGSA-N 339.396 1.922 10 10 EDCE Nc1ccc(CCC(=O)N[C@@H](COCc2ccccc2)C(=O)O)cc1 2034488530 RAKWKYGEPAMYPF-KRWDZBQOSA-N 342.395 1.988 10 10 EDCE CN1C(=O)N[C@@H]2CN(c3ccc(CN)c(Br)c3)CC[C@H]21 2171305823 WSVFPJNMMGLIPL-CHWSQXEVSA-N 339.237 1.510 10 10 EDCE CO[C@H]1CN(c2cc(Br)c(CN)cc2F)C[C@H]1OC 382241113 BYNLZZQDHITFDT-BETUJISGSA-N 333.201 1.897 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@H](O)C[C@H]3c3ccccc3)c2n1 2065007377 RVGPGPUIXVOMKI-HIFRSBDPSA-N 338.367 1.691 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2182546349 AQYLSLHUOHQBAB-TXFSYDTDSA-N 342.233 1.680 10 10 EDCE CN1CCO[C@@H]2CCN(c3ccc(CO)cc3Br)C[C@@H]21 2185528215 GFXDMZKQGKYFMI-LSDHHAIUSA-N 341.249 1.851 10 10 EDCE CN(C[C@@H]1CCS(=O)(=O)C1)c1ccc(CO)cc1Br 2092347457 YJJBWJVJRCOCTF-NSHDSACASA-N 348.262 1.812 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213593567 SKEPTMALXFFJTF-SRVKXCTJSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2246444086 BLWZQSBBUOFDFO-QJPTWQEYSA-N 339.396 1.658 10 10 EDCE COC[C@@]1(C(=O)N(C)CCN=[N+]=[N-])C=CCN1C(=O)OC(C)(C)C 2299699451 DLNSHJDMUCVPAH-OAHLLOKOSA-N 339.396 1.947 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1(CNC(=O)OC(C)(C)C)CC(O)C1 2300531266 DDLFLBIXHBAQQB-UHFFFAOYSA-N 341.412 1.811 10 10 EDCE C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)C=Cc1ccc(O)c(O)c1 2310572299 TYCTYVYMLAFVIB-CYBMUJFWSA-N 334.416 1.415 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCO1 54787273 CULXOGZGCKHTSX-RHSMWYFYSA-N 333.432 1.890 10 10 EDCE Cc1cc(N2CCC[C@@H](NCc3ccc4c(c3)CCO4)C2=O)n(C)n1 173849716 HWABERQUWBIZCY-MRXNPFEDSA-N 340.427 1.949 10 10 EDCE CC1=NN(c2ccc(C)cc2C)C(=O)/C1=C\c1c(O)[nH]c(=O)[nH]c1=O 101123891 GFFQXRZFKRNDJG-XFFZJAGNSA-N 340.339 1.192 10 10 EDCE Nc1ccc(N(C(=O)C(=O)NCCOCCO)c2ccccc2)cc1 170385319 XDAVAQHCRWNHQJ-UHFFFAOYSA-N 343.383 1.059 10 10 EDCE CCc1cccc(OCC(=O)NCCN2C(=O)CSC2=S)c1 49756117 FHPXKAYQVPFGGJ-UHFFFAOYSA-N 338.454 1.604 10 10 EDCE COCCC(=O)N1C[C@@H]2CN(Cc3ccc(N(C)C)cc3)C[C@@H]2C1 96080892 TUVHSYCHEXMQSS-CALCHBBNSA-N 331.460 1.679 10 10 EDCE COc1cc(NS(=O)(=O)c2c(C)nn(C)c2Cl)ccc1O 280628631 SNYZREHHLQKVPE-UHFFFAOYSA-N 331.781 1.897 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)[C@H](CO)CC(C)C 807100928 QYCAUBXBMOQDPC-KRWDZBQOSA-N 349.475 1.543 10 10 EDCE CCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@@H]1CCN(C)C1 828438491 WTYHIWZBFPSTMT-QGZVFWFLSA-N 346.475 1.230 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3ccnc(OC)n3)C2)cc1 822759415 POOOWNDWTNDYHT-GFCCVEGCSA-N 343.387 1.894 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1C[C@H]2CC[C@H]1[C@H]1CNC[C@H]21 903962850 LLZRAECVRPCADG-LMCOJAPRSA-N 327.472 1.953 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NOC[C@@H]1CCOC1 588563958 SDOHPFOBZGWAJM-QQNRWZHASA-N 332.400 1.621 10 10 EDCE CCOC[C@@H](C(=O)O)N(C)C(=O)NCc1ccc(N(C)C)cc1C 909042594 HXRDWQWJXBHQFE-HNNXBMFYSA-N 337.420 1.692 10 10 EDCE CC1(C)[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C[C@H]1N1CCOCC1 911848712 YDFXGEASGZSFNT-LYYDLTQRSA-N 346.427 1.727 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC[C@@](O)(CO)C2)c([N+](=O)[O-])c1 840329635 NDESWMZTGXZTKE-NBUZRDOWSA-N 336.344 1.105 10 10 EDCE O=C(NCCN1C[C@@H]2CCCCN2C1=O)c1c(F)ccc(O)c1O 857331290 CQFGKCSZBUMTCE-JTQLQIEISA-N 337.351 1.257 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC(C(N)=O)CC3)C2)cc1 852455795 OEOCXKOBNWROKY-AWEZNQCLSA-N 346.431 1.181 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCC[C@@H](C(N)=O)C3)C2)cc1 855228033 UIYMIWQXJBMCNJ-ILXRZTDVSA-N 345.443 1.682 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C\c1ccnn1CC1CCC1 865217089 JIFLJFQFEBZQBR-UVTDQMKNSA-N 332.429 1.986 10 10 EDCE Cn1nccc1C1=CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 795656499 OSAXNZRCYRZFGN-QGZVFWFLSA-N 327.384 1.841 10 10 EDCE CC1(F)CN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 792045323 RMVJKNHRUWHKME-AWEZNQCLSA-N 348.422 1.642 10 10 EDCE CCn1nnnc1CN(C)c1ccc(CO)cc1Br 1885611316 FRYLCHXPXUHBOL-UHFFFAOYSA-N 326.198 1.584 10 10 EDCE COc1ccc(N(C)Cc2cc(=O)n3nc(N)[nH]c3n2)cc1Cl 1307556138 VFPZFRMLJOVFRE-UHFFFAOYSA-N 334.767 1.298 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2CCN(C)C2=O)cc1C 1317402824 LWIZFTAMPQHQNI-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE C[C@H](O)C1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 719867493 NJJWBZGGPSEGSZ-QTTZVWFDSA-N 327.178 1.252 10 10 EDCE C[C@@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1261089477 OJJKEPIVOOZVND-PBHICJAKSA-N 343.427 1.220 10 10 EDCE COc1ccc(CNCC[C@H]2CCN(C(=O)c3nc[nH]n3)C2)cc1C 1501628567 FPYSAUISGLEDOV-AWEZNQCLSA-N 343.431 1.764 10 10 EDCE CC[C@H](CNC(=O)[C@H]1CC1(C)C)NC(=O)c1cc(OC)nc(OC)c1 1285047897 SMPHNIAMLYHOOO-CHWSQXEVSA-N 349.431 1.770 10 10 EDCE O=C(COc1ccc([N+](=O)[O-])c(F)c1)NCc1ccc(O)cc1O 1451772091 TZUINOXYBYPIGU-UHFFFAOYSA-N 336.275 1.840 10 10 EDCE CCC(=O)N[C@H](C)CCNCc1nnnn1-c1ccc(OC)cc1 1482800589 BSQWKVSUKNOKOJ-GFCCVEGCSA-N 332.408 1.065 10 10 EDCE CCOC(=O)Cc1cnc(N(C)C(=O)c2cccc(O)c2O)s1 1626382095 AVRGDFLNJXZYBG-UHFFFAOYSA-N 336.369 1.937 10 10 EDCE Cn1cc(N2CC[C@H](NC(=O)c3ccc(N=NC(N)=O)cc3)C2)cn1 1628428325 CWTPPQMCYSHKIE-ZDUSSCGKSA-N 341.375 1.591 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C(C)(C)C(F)F)cc1C 1715601138 DEPBEUJPKOPRPX-ZDUSSCGKSA-N 344.402 1.862 10 10 EDCE O=C(Cn1ccc(Br)cc1=O)NCc1ccccc1O 1622772706 CHSSNAUCMCOHSU-UHFFFAOYSA-N 337.173 1.633 10 10 EDCE CC(C)(C)OC(=O)[C@]1(C(=O)NCc2ccc(O)c(O)c2)CCCO1 1635958887 BXUWTZRKAIFRFY-QGZVFWFLSA-N 337.372 1.605 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@H](C)c2ccco2)cc1C 1725545624 UJVNIIJILNPJJS-GDBMZVCRSA-N 346.427 1.967 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H](C)NC(C)=O)CCC2)cc1C 1724781063 RVRVTQYCGKYKND-AWEZNQCLSA-N 347.459 1.657 10 10 EDCE COc1ccc(CNC[C@@H]2CCCN2C(=O)CN(C)C(C)=O)cc1C 1733333910 ZYBUIIWSZOIWEP-KRWDZBQOSA-N 347.459 1.563 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)NC/C=C/CNCc1ccc(OC)c(C)c1 1732828625 DFURRAXYVWJHTH-FZZYSBJUSA-N 346.427 1.575 10 10 EDCE C[C@H](CCN(C)C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1643610361 UVNVPWUQGQRIHF-MRXNPFEDSA-N 332.492 1.642 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)Cn2cncc2C)cc1C 1731606773 QRYZEDZUVFNCRW-AWEZNQCLSA-N 330.432 1.803 10 10 EDCE CCO[C@H](C)C(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1744688095 KFSVTLSCJNESKA-GHMZBOCLSA-N 349.391 1.509 10 10 EDCE CCCC(=O)N[C@@H]1CCN(Cc2nnnn2-c2ccc(OC)cc2)C1 1660952946 QWHYHZUJXGDNCG-CYBMUJFWSA-N 344.419 1.162 10 10 EDCE CC[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N[C@H](C)C(=O)NC 1698623382 PRLFQYRBXHYLPL-PWSUYJOCSA-N 348.407 1.082 10 10 EDCE CC(=O)N1[C@@H](C(=O)NCCN(C)C)CS[C@@H]1c1ccccc1O 27910613 ZTGKQJSKRCYCRF-CZUORRHYSA-N 337.445 1.033 10 10 EDCE Cc1cc(C(N)=O)c(NC(=O)CNCc2ccc(N(C)C)cc2)s1 1857852124 HQLPYEMAALGLJV-UHFFFAOYSA-N 346.456 1.950 10 10 EDCE CNC(=O)[C@H](C)N(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 1916788482 TUKCXCHQIAGILB-UPONEAKYSA-N 342.193 1.005 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CCO[C@@]2(C(=O)NCCN=[N+]=[N-])C1 1985094264 MIWFCWTUHSZCHW-HZMBPMFUSA-N 325.369 1.439 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)OC(C)(C)C)c(O)c1 1985772388 VXMNLDJDBRYYDJ-GFCCVEGCSA-N 326.393 1.376 10 10 EDCE COc1ccc(O)c(CN[C@@H](CO)CNC(=O)OC(C)(C)C)c1 1985776856 CWWWRKMQBPHUBP-GFCCVEGCSA-N 326.393 1.376 10 10 EDCE CC(C)(C)OC(=O)N1CCC(O)(C(=O)NCCCN=[N+]=[N-])CC1 1986140478 FDAFHZARPPTZBR-UHFFFAOYSA-N 327.385 1.565 10 10 EDCE Nc1ccc(CS(=O)(=O)N(Cc2ccccc2)C2CNC2)cc1 1989301509 WLKBIASUTSJJAK-UHFFFAOYSA-N 331.441 1.573 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1[C@H]1C[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2005898488 NRRRWDTUBMABOZ-FAYOZSNISA-N 336.432 1.801 10 10 EDCE COc1ccc(CNC[C@@](C)(CO)NC(=O)OC(C)(C)C)c(O)c1 2010528083 DJXJWRSGTOEWQK-KRWDZBQOSA-N 340.420 1.766 10 10 EDCE CN(Cc1ncon1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2160445497 HUNXLRNCCVOUFT-NSHDSACASA-N 338.165 1.420 10 10 EDCE O=C1C(=CNN2CCOCC2)C(C(F)(F)F)=NN1c1ccccc1 2040736878 NAPPJXLPFQLCCF-UHFFFAOYSA-N 340.305 1.672 10 10 EDCE C[C@H](N)c1ccc(N2CCC(O)(CO)CC2)cc1Br 314408960 PFTURFOCVSGBKP-JTQLQIEISA-N 329.238 1.792 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H]3CC[C@H](C(F)(F)F)O3)c2n1 2062333007 ZJPBUYLDWGXCNN-PSASIEDQSA-N 344.293 1.583 10 10 EDCE Cc1cc(Br)cc(CN2C[C@@H]3OCCN(C)[C@H]3C2)c1O 775716582 DKWYGUFCOJRYLV-KBPBESRZSA-N 341.249 1.978 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](C(CO)CO)C2)c(Br)c1 2170642222 ISGMMKQRCCQPCP-CMPLNLGQSA-N 344.249 1.930 10 10 EDCE C[C@@H]1[C@@H](C)S(=O)(=O)CCN1c1ccc(CN)cc1Br 2113895110 RQIWBQPOOWTBMX-NXEZZACHSA-N 347.278 1.920 10 10 EDCE O=C1OC[C@H]2CN(c3ccc(CO)cc3Br)CCN12 2114273999 IJRXLNOHHHYCLP-SNVBAGLBSA-N 327.178 1.582 10 10 EDCE COC1(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])CN(C(=O)OC(C)(C)C)C1 2213582977 NJCVQAMJOJSHGX-MNOVXSKESA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCC[C@H](COc2nnc(=N)[nH]n2)C1 2213787587 MLCOFLNPPFBTGZ-QWRGUYRKSA-N 338.412 1.389 10 10 EDCE CN1CCc2cc([C@H](NN)c3nn(C)nc3Br)ccc21 2235279062 HBNAEZMAJZXYNV-NSHDSACASA-N 337.225 1.123 10 10 EDCE COc1ccc(Br)c(CN[C@H](C)c2nc(=O)o[nH]2)c1O 2236056855 YALZPIXDSSJMKQ-ZCFIWIBFSA-N 344.165 1.690 10 10 EDCE COC[C@@](C)(N)C(=O)NCc1ccc(C)c(Br)c1O 2352620085 MOMMVWKTYVJMSQ-CYBMUJFWSA-N 331.210 1.443 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2C=CCN2)c(O)c1Br 2352944317 GGOKZEKXIZCSTA-LLVKDONJSA-N 325.206 1.950 10 10 EDCE Cc1ccc(C(=O)N2CCCC[C@@H]2CN2CCOCC2)c(O)c1O 179490796 RYHQCECQOFTLLX-CQSZACIVSA-N 334.416 1.733 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC[C@H](n3cncn3)C2)cc1 173304997 WZUUYZBQZRZTEM-INIZCTEOSA-N 328.420 1.891 10 10 EDCE COc1ccc(N2CCN(CCCNCc3cncnc3)CC2)cc1 171127663 HHOUFYARPRFXGT-UHFFFAOYSA-N 341.459 1.787 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)CNC(=O)c1ccccn1 173209035 UZIOTJZQRPCZLX-UHFFFAOYSA-N 340.383 1.303 10 10 EDCE O=[N+]([O-])c1cc(O)ccc1NS(=O)(=O)c1cnc(Cl)nc1 38106172 JKCCRNMFZWNXNG-UHFFFAOYSA-N 330.709 1.545 10 10 EDCE COc1cccc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)c1O 124498340 JAFRMIVFLPWZMJ-OAHLLOKOSA-N 334.416 1.472 10 10 EDCE C[C@@H](NCCS(=O)(=O)N1CCSCC1)c1cc(F)ccc1O 185395407 JFLIKVJPUXTENX-LLVKDONJSA-N 348.465 1.561 10 10 EDCE CO[C@@H](C)[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 187845475 ZWFFTQOQWVLONK-STQMWFEESA-N 339.411 1.885 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@H](C)c2nnc3n2CCCC3)c1 140594582 OYMHTNILKLGWFM-LLVKDONJSA-N 345.403 1.889 10 10 EDCE COC(=O)[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 92013459 WZGQOGWVVPDNBA-PBHICJAKSA-N 334.416 1.286 10 10 EDCE Cn1nccc1/C=C\C(=O)NCc1ccc(N2CCOCC2)c(F)c1 255642169 WUBPBTAJZYHIEW-HYXAFXHYSA-N 344.390 1.725 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@@H]3CN(C)C[C@@H]3C2)c([N+](=O)[O-])c1 278747678 MKPJHKOXEQEIBF-MRPPWBEGSA-N 331.372 1.779 10 10 EDCE Cc1ccc(CNC(=O)CN2CC[C@H](N)C2)c(O)c1Br 2380749687 QXVGIIYHXPMAEC-NSHDSACASA-N 342.237 1.112 10 10 EDCE CN(CCC(N)=O)c1ccc(/C=C/C(=O)O)c(Br)c1 381919964 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10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCn2nncc2C1 847386378 XPKNBZCVZRXEBI-AWEZNQCLSA-N 342.447 1.809 10 10 EDCE COC[C@@]1(C)NC(=O)N([C@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849356101 CGOJEKXWQREOHF-SUMWQHHRSA-N 333.388 1.231 10 10 EDCE C[C@@H]1CC2(CCOCC2)CN1Cc1cc(O)n2ncc(C(=O)O)c2n1 846259909 CAMBWUXDMDXBKY-LLVKDONJSA-N 346.387 1.524 10 10 EDCE COc1cc(Br)cc(CN2CCO[C@H]([C@@H](C)O)C2)c1O 840979102 YZKZRAJVMKUSOD-RNCFNFMXSA-N 346.221 1.745 10 10 EDCE COC[C@H]1C(=O)N[C@@H](c2cc(Br)cc(OC)c2O)N1C 840829062 MUXBEMLQKOQPSQ-JOYOIKCWSA-N 345.193 1.239 10 10 EDCE COc1ccc(CNC(=O)NCc2nccc(OC)c2F)c(O)c1 852585291 ABFKDPIXPNIDMQ-UHFFFAOYSA-N 335.335 1.943 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@]3(OC)CCOC3)C2)cc1 852256189 SUPKBHBTYVDXGX-RDTXWAMCSA-N 349.431 1.379 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCC1(C2(O)CCOCC2)CC1 925638456 CAIBICDYHAOQFM-UHFFFAOYSA-N 334.416 1.855 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCCN(C(N)=O)C3)C2)cc1 855229273 LZABGCUNEYFIQE-KBPBESRZSA-N 346.431 1.181 10 10 EDCE 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NCc1ccc(N2CC[C@H](C(CO)CO)C2)cc1Br 2114236592 WHSNWZXUEHJOAK-NSHDSACASA-N 329.238 1.335 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCCC[C@@H]1CCOc1nnc(=N)[nH]n1 2213780598 HYWSYOFVYLBBKJ-MNOVXSKESA-N 338.412 1.532 10 10 EDCE CN(Cc1nn(C)nc1Br)c1ccc(CN)c(F)c1 2226984529 GTXHBPMFEUIROE-UHFFFAOYSA-N 328.189 1.812 10 10 EDCE CC(C)CN1C(=O)C(=CNCCc2ccc(F)cc2)C(=O)NC1=S 2295113277 ZXPAFESTMYYFFV-UHFFFAOYSA-N 349.431 1.741 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2354478846 SPKAAABURTUJKT-AISOMTMTSA-N 341.249 1.660 10 10 EDCE Nc1ccc(CS(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1 310152316 GCTROWXJKDCEFI-GOSISDBHSA-N 345.468 1.963 10 10 EDCE CCCN1C(=O)/C(=C/Nc2cc([N+](=O)[O-])ccc2C)C(=O)NC1=S 105490688 NOEQMTJSDWJPKA-DHZHZOJOSA-N 348.384 1.852 10 10 EDCE Nc1ccc(CC(=O)Nc2ccc(C(=O)NCC(=O)O)cc2)cc1 71700542 MUDSXMXMGPYYQW-UHFFFAOYSA-N 327.340 1.264 10 10 EDCE COc1cc(N2CCN(Cc3ccc(N(C)C)cc3)CC2)ncn1 184438237 ZKNMGUKBXVDINE-UHFFFAOYSA-N 327.432 1.873 10 10 EDCE COc1ccc(N2CCN(c3nncc(NC4CC4)n3)CC2)cc1 242689181 CWQNQSIFWUEDPD-UHFFFAOYSA-N 326.404 1.781 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@H]2COCCN2CC(F)(F)F)cc1 287098816 LPCBHGGJAZETBJ-CQSZACIVSA-N 345.365 1.632 10 10 EDCE CCCC(=O)NCC(=O)N1CCCN(c2ccc(OC)cc2)CC1 372542366 HTCIBBCIMYFXRP-UHFFFAOYSA-N 333.432 1.650 10 10 EDCE CN[C@H]1COC[C@H]1C(=O)NCc1ccc(C)c(Br)c1O 2380756308 KCMDMZDKEAELEX-MNOVXSKESA-N 343.221 1.314 10 10 EDCE NCc1cc(F)c(N2C[C@H](CO)[C@@H](CO)C2)cc1Br 704702321 NBILIFOGPVAAQT-NXEZZACHSA-N 333.201 1.084 10 10 EDCE CCOCc1cc(CNCc2cnn(C)c2C(=O)O)ccc1OC 904067568 GXWQDJHZEKRMRW-UHFFFAOYSA-N 333.388 1.953 10 10 EDCE COc1cccc(O)c1CN1C[C@@H]2CC[C@H](C1)N2C1CCNCC1 903980256 MACAUTBZJBIAPH-IYBDPMFKSA-N 331.460 1.801 10 10 EDCE C[C@@H]1C[C@@H](S(=O)(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 830297726 IMLDFPGBMBMROD-YPMHNXCESA-N 330.425 1.879 10 10 EDCE CO[C@](C)(CO)CN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 848557589 GEBYHRCFVJRVGF-GUYCJALGSA-N 326.412 1.710 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 914180570 RFHYMPHUQQEANO-NJAFHUGGSA-N 345.443 1.890 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCO[C@H](c3ccsc3)C2)cc1 841068947 XYMGJJUDCHTCGP-AWEZNQCLSA-N 331.397 1.869 10 10 EDCE C[C@@H]1CCNC[C@H]1NC(=O)NCc1cc(Br)ccc1O 841978760 YMRBKMVIKKYDPJ-BXKDBHETSA-N 342.237 1.952 10 10 EDCE CCCCN(C)S(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849416150 KYSUEKRVLHXHTL-AWEZNQCLSA-N 341.477 1.840 10 10 EDCE C[C@@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1[C@H]2CN[C@H]1C2 925486207 FWKWOPFJNFMUTH-LFVTVUPYSA-N 349.500 1.007 10 10 EDCE CCOC(=O)[C@@H](CSC)NC(=O)/C=C\c1ccc(O)c(O)c1 928294104 VSBBEDOWJDRGLY-JPVGGKMYSA-N 325.386 1.522 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)N3CCSCC3)C2)cc1 855233664 KHKYBNSNWRDEJE-CABCVRRESA-N 349.500 1.827 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC3=C(CCC(=O)N3)C2)cc1 853244386 KSPZDITYOSXECB-UHFFFAOYSA-N 328.416 1.832 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)c2ccnc3c2CC(=O)N3)cc1 852791739 LHXBIMNNXSFEPU-HNNXBMFYSA-N 339.399 1.072 10 10 EDCE COCCN(CCF)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 697293538 GZCGUCKHQREJHH-GFCCVEGCSA-N 346.200 1.823 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)/C=C\CN3CCOCC3)C2)cc1 869228228 FNGCEFOFFBYHGW-RXYHWBRQSA-N 345.443 1.279 10 10 EDCE C[C@H](NC(=O)c1cc(O)nc(N(C)C)n1)c1ccc(N(C)C)cc1 765515765 NVGINEBZWYDODK-NSHDSACASA-N 329.404 1.805 10 10 EDCE COc1ccc(O)c(CNC[C@@]2(O)[C@@H]3[C@@H]4[C@H]5[C@H]6C[C@@H]4[C@H]2[C@@H]6C[C@H]53)c1 787304098 QFZCINWSMOPFEG-VNVMELSDSA-N 327.424 1.999 10 10 EDCE O=C(NCCC1(O)CCOCC1)c1cc2cc(O)c(O)cc2s1 897729520 BUTZKSBMTPSWQT-UHFFFAOYSA-N 337.397 1.974 10 10 EDCE C[C@@H](NC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2[nH]1)c1ccccc1O 1171722989 IMAHOMKRQWIFEH-UHNFBRDESA-N 341.367 1.540 10 10 EDCE COC(=O)[C@]1(OC)CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 1334929891 GNDDGEDCGHBISC-HNNXBMFYSA-N 340.332 1.380 10 10 EDCE CN1CCCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)CC1 92774977 OFICFZZFKBRUKU-ZDUSSCGKSA-N 339.237 1.543 10 10 EDCE O=C(NCc1ccccc1O)c1ccnc(-n2ccc([N+](=O)[O-])n2)c1 1465990741 PUSJAVMKWWORAQ-UHFFFAOYSA-N 339.311 1.811 10 10 EDCE O=C(C[C@@H]1CS(=O)(=O)c2ccccc2O1)NCc1ccccc1O 1545682145 SWYXNYOAXHRLGB-CYBMUJFWSA-N 347.392 1.633 10 10 EDCE OC[C@@H]1[C@H](O)[C@H](O)[C@@H](Cc2ccccc2)N1Cc1cccc(F)c1O 1615122262 XSTAAKMGAKPZQP-RWQQGDIJSA-N 347.386 1.041 10 10 EDCE CCN(C(=O)Cc1ccc(O)c(O)c1)c1ncc(C(=O)OC)s1 1544771989 JLASZZOQTVHBBH-UHFFFAOYSA-N 336.369 1.937 10 10 EDCE O=C1C[C@@](C(=O)NCc2ccc(O)cc2O)(c2ccccc2)CN1 1626850236 SCRDZNITSPZHDU-SFHVURJKSA-N 326.352 1.172 10 10 EDCE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)NCC(F)(F)F 1625273643 NLMDDGSEESPLEN-ZETCQYMHSA-N 345.281 1.646 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1715732050 QMWDNCAINUNFIF-HUUCEWRRSA-N 335.404 1.607 10 10 EDCE C[C@H](Sc1ccccc1C(=O)NCc1cccc(O)c1O)C(N)=O 1637045884 MDLULNMUZBGYKK-JTQLQIEISA-N 346.408 1.994 10 10 EDCE COCC(=O)N[C@H](C(=O)NCc1c(O)ccc2ccccc12)C(C)C 1639384852 XTLDPAXOGSTHTH-SFHVURJKSA-N 344.411 1.949 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H]2CCC(=O)N2C)cc1C 1733121620 IJMZRRCHMJWMBB-MRXNPFEDSA-N 347.459 1.563 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccn(CCn2cccn2)n1 1643882421 WCCHDMYMGBTNQQ-UHFFFAOYSA-N 327.344 1.121 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)N(C)CCCNCc1ccc(OC)c(C)c1 1699498234 OREHVXZRXLYFPZ-HZPDHXFCSA-N 348.443 1.751 10 10 EDCE C[C@H](C(=O)O)N1CC(NCc2cc(Br)ccc2O)C1 2131768061 YDDJJKFWGADTRO-MRVPVSSYSA-N 329.194 1.402 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1CCC(=O)N1 1952208832 NQBHSHOAADZQJX-RYUDHWBXSA-N 336.388 1.812 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2010406433 UTRUTKKPSHIVST-NWDGAFQWSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1CC(=O)C(=O)C[C@H]1C[C@H](N)C1 2014421765 FHBSZKXGWGUHSB-CYDGBPFRSA-N 340.420 1.182 10 10 EDCE CN1CCN(CCNCc2cc(Br)cc(F)c2O)CC1 715713978 TURZURMDKIJMCD-UHFFFAOYSA-N 346.244 1.631 10 10 EDCE OCc1ccc(N2C[C@H](O)[C@H](O)CC23CCC3)cc1Br 2169919837 DUGDSTPTLCZEKH-KGLIPLIRSA-N 342.233 1.796 10 10 EDCE CNCc1ccc(N(C)CCN2CCOCC2)c(Br)c1 2170098340 NRSHECDLOCDHCO-UHFFFAOYSA-N 342.281 1.937 10 10 EDCE CC(C)(O)[C@H]1CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2191157677 SZTYBUJAYVPPGE-NEPJUHHUSA-N 340.221 1.751 10 10 EDCE O=C1CO[C@@H]2CCN(c3ccc(CO)cc3Br)C[C@H]2N1 2185523849 ZFCXWJQMDHBEHP-DGCLKSJQSA-N 341.205 1.035 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)NCc2ccc(N)cc2)=C[C@@H]1O 2080947047 CQLWNBLASGSKTP-CABCVRRESA-N 347.415 1.469 10 10 EDCE OCc1ccc(N2CCC([C@H](O)CO)CC2)cc1Br 2096158232 PUDGCGWYHRAGLX-CQSZACIVSA-N 330.222 1.511 10 10 EDCE CC1=NN(c2ccccc2)C(=O)C1=C(C)NCCCN1CCOCC1 2294474399 PHJGTAZNPLUVCX-UHFFFAOYSA-N 342.443 1.995 10 10 EDCE OC[C@H](O)[C@@H]1COCCN1c1ccc(OCc2ccccc2)cc1 2299515146 OSODPYQDYLPLIZ-OALUTQOASA-N 329.396 1.824 10 10 EDCE Cc1ccc(CNC(=O)[C@H](O)C(C)(C)N)c(O)c1Br 2352639845 CKHMCRJIOHINTN-NSHDSACASA-N 331.210 1.178 10 10 EDCE O=C1Nc2cc(N3CC[C@H]4[C@H](O)C[C@H]43)c(Br)cc2[C@H]1O 2355697858 ZTVNEUXDISRCRO-OJMGLTJKSA-N 339.189 1.394 10 10 EDCE O=C1NC(=S)N(Cc2ccco2)C(=O)/C1=C/NCc1cccs1 104911231 XQBYCLFYOOLKRD-XYOKQWHBSA-N 347.421 1.758 10 10 EDCE CCN1C(=O)N/C(=C\c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)C1=O 111846961 OBMBWRHDMUCMEU-XFXZXTDPSA-N 346.343 1.344 10 10 EDCE C[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@@H]1N1CCOCC1 180825480 NPBCHQGCZFBYDE-YTRREALPSA-N 332.400 1.290 10 10 EDCE Cn1c(CNc2ccccc2C(=O)c2ccccc2)cc(=O)n(C)c1=O 192589222 LUDHFUIKXJVHSE-UHFFFAOYSA-N 349.390 1.927 10 10 EDCE CNS(=O)(=O)c1ccc2c(c1)N(Cc1ccc(OC)cc1O)CC2 191559034 JSFDDLJEEHMNLV-UHFFFAOYSA-N 348.424 1.872 10 10 EDCE CN(C)S(=O)(=O)[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 367697821 CTKXWGJAFPOPCQ-CYBMUJFWSA-N 332.853 1.901 10 10 EDCE C[C@H]1CN(c2ccc(/C=C/C(=O)O)c(Br)c2)CC(=O)N1 395672683 CLUBVLZOIMQFKE-SGRBOOSSSA-N 339.189 1.872 10 10 EDCE O=C(Cn1ccccc1=O)NCc1cc(Br)ccc1O 804737192 LDUNYQFOQAVLCR-UHFFFAOYSA-N 337.173 1.633 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN[C@H]3[C@H]4CCC[C@H]43)CC2)cc1 819270931 LYWQNORMFJBJNG-RSPOEFSDSA-N 345.487 1.566 10 10 EDCE O=C1OCCN1C[C@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 824451208 ORTXLHONWHPEAC-KRWDZBQOSA-N 345.443 1.797 10 10 EDCE O=C(NC1(CCO)CCOCC1)c1cc2cc(O)c(O)cc2s1 901358105 UBKVQEWWWANLCH-UHFFFAOYSA-N 337.397 1.974 10 10 EDCE COC(C)(C)CS(=O)(=O)NC[C@H](N)c1ccc(N(C)C)cc1 842786350 YTTAAYJLNLPOLP-AWEZNQCLSA-N 329.466 1.097 10 10 EDCE CCOc1ccc(O)c(CNC[C@H](N2CCNCC2)C(F)(F)F)c1 841069464 AQHCKMPHWQGHIY-HNNXBMFYSA-N 347.381 1.717 10 10 EDCE C[C@]1([C@@H]2CCCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)COC(=O)N1 928022330 DDLBLYZPBCXBCE-CVECVMAHSA-N 346.383 1.848 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN(C[C@@H]2CCC(=O)N2)C(C)C)c1O 840976724 QICFZYNPADFTTK-LBPRGKRZSA-N 337.376 1.798 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCOC[C@@H]2CC2CC2)cc1 929236975 GVIXQHGIYBGYBC-KRWDZBQOSA-N 345.443 1.396 10 10 EDCE C[C@H]1CCC[C@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)O1 855793391 MEDAMMBQMBXDBV-CMPLNLGQSA-N 342.417 1.451 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCCCN3C(C)=O)C2)cc1 855229436 KIWIYZGABLKFRT-YJBOKZPZSA-N 345.443 1.791 10 10 EDCE CCO[C@@H](C(=O)N1CCOc2cc(N(C)C)ccc21)[C@H]1CCOC1 866208877 WIVMMDCRNGFOEO-SUMWQHHRSA-N 334.416 1.920 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnnc(C)c3)CC2)c(OC)c1 870167601 LRWFPFDBZJDRDX-UHFFFAOYSA-N 342.399 1.765 10 10 EDCE C[C@H](N[C@H](C)C(=O)N(C)CC(=O)NC1CC1)c1ccc(N(C)C)cc1 774483354 KAHOBMURCDPDAM-UONOGXRCSA-N 346.475 1.529 10 10 EDCE COc1cc(C)cc(CN[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)c1O 894671772 CJZKDIMGIDZGSV-TZMCWYRMSA-N 342.461 1.517 10 10 EDCE C[C@H]1CO[C@@H](C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 891515527 OBWLLMDQLXJGIV-IAQYHMDHSA-N 340.370 1.843 10 10 EDCE COc1ccc(Br)c(CNCc2cnn(C)n2)c1O 1964044608 FTEWBVNIBORSOI-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCCS(=O)(=O)C(F)(F)F 1166281885 PFBFCEWVMCACHZ-RQOWECAXSA-N 339.291 1.162 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)[C@@H](CO)C2)c(Br)c1 704451149 JDQAIDOBBRKCLH-ZMLRMANQSA-N 330.222 1.539 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC([C@H]2CCCO2)CC1 1329798824 TWMDVSUCXTZTPX-QGZVFWFLSA-N 344.411 1.652 10 10 EDCE O=S1(=O)CCC(S(=O)(=O)Nc2ccc(O)c(Cl)c2)CC1 70333959 XHFNHFKOAKSAJZ-UHFFFAOYSA-N 339.822 1.365 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2C[C@@H](CO)[C@H](CCO)C2)cc1 1346255013 ARJOIROQRXAUSB-SJORKVTESA-N 349.475 1.665 10 10 EDCE CNC(=O)CCCC(=O)N[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1266679010 WBBPQVGDJCEAGQ-IYBDPMFKSA-N 347.459 1.657 10 10 EDCE COc1ccccc1CN(CCO)C(=O)Cc1ccc(O)c(O)c1 1623369289 LLUIVZMZRGNOMZ-UHFFFAOYSA-N 331.368 1.670 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)C1=C[S@@](=O)CCC1 1625607525 IJAGEPMKFWDQQV-QHCPKHFHSA-N 334.441 1.566 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H](O)Cc1cccc(F)c1 1636600755 AVEXVOUNIFXAJI-ZKKXHLJNSA-N 331.343 1.970 10 10 EDCE CNC(=O)CNCCC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1725473368 QLSGQAFGGVKPRR-LLVKDONJSA-N 348.407 1.083 10 10 EDCE CN1CC[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1=O 1638273499 XZPBDYAKYANWHL-GFCCVEGCSA-N 335.367 1.813 10 10 EDCE CSCC[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1nn[nH]n1 1646036704 CJXHZAWLJRJEMG-GFAPAMAISA-N 335.389 1.235 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)Cc2ncc[nH]2)cc1C 1674746411 BLZOGDZPCVYTQI-ZIAGYGMSSA-N 330.432 1.952 10 10 EDCE CS(=O)(=O)c1ccccc1CCNC(=O)Cc1ccc(N)cc1 1865957130 YGWGNDKKXRMHKU-UHFFFAOYSA-N 332.425 1.574 10 10 EDCE NCc1ccc(N2CC[C@H](OCCCO)C2)c(Br)c1 2142090730 ZTKQNOIHAPCYGE-LBPRGKRZSA-N 329.238 1.886 10 10 EDCE CN1CCN(C(=O)OC(C)(C)C)[C@@H](COc2ccc(N)cc2)C1=O 1952755048 MMRYSHQIGGKLRD-AWEZNQCLSA-N 335.404 1.725 10 10 EDCE Nc1ccc(CS(=O)(=O)N2CC(OCc3ccccc3)C2)cc1 1977136391 PVYJZZVBYVLKRE-UHFFFAOYSA-N 332.425 2.000 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985099762 RGFLLUVIFYJHMH-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1990033895 ZEINHSVUGIVLKJ-WDEREUQCSA-N 327.385 1.563 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@]4(CCO4)C3)c(Br)cc21 2153334928 RFHSKVZSPRQSKU-JSGCOSHPSA-N 338.205 1.770 10 10 EDCE COC[C@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCN(C(=O)OC(C)(C)C)C1 2010389504 QWUIJPLPDJQBCQ-HNNXBMFYSA-N 339.396 1.781 10 10 EDCE O=C(O)C[C@H]1COCCN1Cc1ccc(Br)cc1O 691422346 IDARSRWLGAHQGC-NSHDSACASA-N 330.178 1.830 10 10 EDCE NCc1ccc(N2CCC[C@@]3(CNC(=O)N3)C2)cc1Br 2177692189 STLKNXBHCFMRDJ-CQSZACIVSA-N 339.237 1.560 10 10 EDCE C[C@H](O)c1ccc(N2CC(CS(C)(=O)=O)C2)c(Br)c1 2103222693 VQBNSISVLHWQPR-VIFPVBQESA-N 348.262 1.983 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 1866303419 VKCKNQHOSFXVBA-UHFFFAOYSA-N 338.360 1.496 10 10 EDCE C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)c2cc(O)c(O)c(O)c2)C1 2068627239 FSYOPFJTWFEHAD-ZDUSSCGKSA-N 348.277 1.087 10 10 EDCE CN[C@H](C)c1ccc(N2CC(NC(N)=O)C2)cc1Br 2106928289 RRUIYBBLJLJOMP-MRVPVSSYSA-N 327.226 1.586 10 10 EDCE COC[C@H]1C[C@H](CN)N(Cc2cc(Br)ccc2O)C1 2273809126 HMAGRWCNWVPHJT-GXFFZTMASA-N 329.238 1.950 10 10 EDCE CC(C)c1nc2n(n1)C[C@H](NC(=O)C=Cc1ccc(O)c(O)c1)CC2 2308002301 RLZUJRMNAYHHRC-CYBMUJFWSA-N 342.399 1.957 10 10 EDCE CO[C@H](CN)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2352660978 KJDDGXINAGNVPU-SNVBAGLBSA-N 331.210 1.395 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@@H]4[C@@H]3CO)c(Br)cc21 2357561650 ZKAYEIZGIXYXIH-OJAMJJRASA-N 338.205 1.218 10 10 EDCE CC[C@@](C)(O)CN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 189203326 VPNPWZVZUGZKAI-GOSISDBHSA-N 338.448 1.995 10 10 EDCE COc1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)c(O)c1 133205948 BEUFLCZHWVISNG-UHFFFAOYSA-N 342.399 1.217 10 10 EDCE COc1ccc(N2CCN(c3nc[nH]c(=O)c3[N+](=O)[O-])CC2)cc1 40611247 IPCADFYTKZFNIE-UHFFFAOYSA-N 331.332 1.013 10 10 EDCE CNC(=O)C(C)(C)CNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255589244 CMASNLBIXJHYSP-TWGQIWQCSA-N 345.443 1.425 10 10 EDCE Cn1cc(/C=C\C(=O)N(CC2CC2)c2ccccc2)c(=O)n(C)c1=O 255662813 UVZBYCSRCJUHBS-KHPPLWFESA-N 339.395 1.540 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(=O)N(C3CC3)C2)c([N+](=O)[O-])c1 279081324 LWQABQWYULEBQM-XVNBXDOJSA-N 331.328 1.550 10 10 EDCE C[C@H](CO)N1CCN(c2cc(Br)c(CN)cc2F)CC1 2169364342 QGEMWAQTXVIKEZ-SNVBAGLBSA-N 346.244 1.550 10 10 EDCE COCCn1nnc2c1CCN(Cc1cc(Cl)c(F)cc1O)C2 293710734 SKTKHUAUUMJWPU-UHFFFAOYSA-N 340.786 1.981 10 10 EDCE O=C(NCc1cc(Br)ccc1O)[C@@]1(O)CCSC1 804737720 WOZYMUKLNUEKCY-GFCCVEGCSA-N 332.219 1.639 10 10 EDCE CS(=O)(=O)CC[C@H]1CCCCN1C(=O)c1cccc(O)c1O 816805374 VOYUQOJQVKPENR-LLVKDONJSA-N 327.402 1.527 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@@H](NC(N)=O)C2)c(Br)c1 723183183 RCSZTZHVNGKSDQ-MWLCHTKSSA-N 341.253 1.977 10 10 EDCE Cc1c(C[C@@H](CN)CN2CCCc3cc(CN)ccc32)cnn1C 903874270 WUMALDDKYJYFFL-INIZCTEOSA-N 327.476 1.757 10 10 EDCE COc1ccc(N2CCN(CN3Cc4cccnc4C3=O)CC2)cc1 839950671 URBARFQCMYQERG-UHFFFAOYSA-N 338.411 1.826 10 10 EDCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCCO1 838739715 NXXPZTBYXFHHQA-UHFFFAOYSA-N 327.331 1.648 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCCn3ccnc3)C2)cc1 849225095 NTOZHBANGCDVFS-HNNXBMFYSA-N 343.431 1.860 10 10 EDCE C[C@H](NC(=O)C(=O)N1C[C@@H]2CCC[C@H](C1)N2)c1ccc(N(C)C)cc1 842201727 AJDWUFLZIZIZRO-CWRNSKLLSA-N 344.459 1.283 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)[C@@H]3CCOC3)C2)cc1 852146822 IWZWBGMGAUYUHV-KFWWJZLASA-N 333.432 1.998 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)c1cc(=O)n(C)c(=O)n1C 853096069 MGWJDIWJSGSNDS-UHFFFAOYSA-N 342.443 1.711 10 10 EDCE CC[C@@H](NCC[C@@H]1CNCCS1(=O)=O)c1cc(Cl)ccc1O 925787799 CMZWPIKNISSCLT-TZMCWYRMSA-N 346.880 1.863 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)c3n[nH]c(C)n3)C2)cc1 854296026 ACVWTVCBXVTESE-YPMHNXCESA-N 344.419 1.761 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2cc(OC)ccc2O)C1 862551763 PLAKMNOHEIKGED-LBPRGKRZSA-N 328.434 1.162 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cc(O)nc(N(C)C)n2)c1 765426348 YFLAVXGHSPHHKF-VIFPVBQESA-N 332.360 1.453 10 10 EDCE CC(=O)C(=O)COC(=O)/C=C/[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 869740729 QQFOPQGUZRGTAF-GWJCSSMESA-N 339.388 1.891 10 10 EDCE CCc1nc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)no1 775378431 WKLTXDOLBIZQMN-GFCCVEGCSA-N 330.388 1.960 10 10 EDCE O=C(c1cncc(N2CCOCC2)c1)N1Cc2cccc(O)c2C1 871203639 OUVINIMYKKDTKB-UHFFFAOYSA-N 325.368 1.780 10 10 EDCE CCN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCOC1 794682332 BYTXRSNDEMERRC-NSHDSACASA-N 328.390 1.015 10 10 EDCE C[C@H]1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CS1(=O)=O 1146271710 UNJPGIMCWYCHGF-CABZTGNLSA-N 338.389 1.545 10 10 EDCE CCOC(=O)N[C@H](CNC(=O)Cc1ccc(O)c(O)c1)CC(C)C 1441255530 ZYVWFCKQELQXRD-ZDUSSCGKSA-N 338.404 1.917 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1[nH]cnc1C 1447350490 XDWHRGLXNIZVSI-NSHDSACASA-N 333.344 1.034 10 10 EDCE C/C(=C/c1cccnc1)C(=O)N1CCc2ccc(S(N)(=O)=O)cc21 1465067891 FDWWOVYBLOBGGL-XFXZXTDPSA-N 343.408 1.722 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(C)c3cc(C)[nH]n3)nc12 1460663826 YCILKXKRFNDLGS-UHFFFAOYSA-N 330.348 1.280 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)Cc2n[nH]c(C)n2)cc1C 1717410642 LYVOCTUIRQOXMI-STQMWFEESA-N 345.447 1.656 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)c2cnn(C)c2N)cc1C 1485139855 XCVUMHQBYFTELL-CHWSQXEVSA-N 345.447 1.616 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1CCCS1(=O)=O 1624954302 HNEQVDSCNXQXIE-CMPLNLGQSA-N 327.402 1.112 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1COCCO1)NCc1ccc(OC)c(C)c1 1714061302 VTWYJDGRGUVGKP-WBVHZDCISA-N 336.432 1.403 10 10 EDCE CCN1C[C@H](C(=O)N(C)CCNCc2ccc(OC)c(C)c2)CC1=O 1713598628 XTWBPRFHJLNYOV-MRXNPFEDSA-N 347.459 1.420 10 10 EDCE CCCN(C)C(=O)[C@@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1626399043 PTBJZUQPBSTHSQ-LBPRGKRZSA-N 338.429 1.410 10 10 EDCE CCCC(=O)N[C@@H](C)CN(C)Cc1nnnn1-c1ccc(OC)cc1 1498218101 ORORUUYZXJETGC-ZDUSSCGKSA-N 346.435 1.408 10 10 EDCE CC1(C)[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C[C@@H]1N1CCOCC1 1557316138 LSOVYTQQENCOSC-HOTGVXAUSA-N 334.416 1.256 10 10 EDCE CC[C@H](C)C(=O)NCCN(C)Cc1nnnn1-c1ccc(OC)cc1 1492194144 IGTTVLGWQIODNP-ZDUSSCGKSA-N 346.435 1.265 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2n[nH]c(C)c2O)cc1C 1497564947 NVFVEJLUXGRIAW-PLNGDYQASA-N 344.415 1.817 10 10 EDCE COC1CCN(c2ccc(CN3CC[C@H](c4nn[nH]n4)C3)cc2)CC1 1659944361 TUUNFRXRNNXRDD-HNNXBMFYSA-N 342.447 1.804 10 10 EDCE CC(C)(CNC(=O)NCc1cc(Cl)ccc1O)CS(N)(=O)=O 1684709481 LTCQLMLLBHEDFF-UHFFFAOYSA-N 349.840 1.160 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C[C@H]2CCC(=O)NC2)cc1C 1699365048 BIATVIRUVNTLHF-GDBMZVCRSA-N 347.459 1.514 10 10 EDCE C[C@H](Cn1cncn1)NC(=O)NCCCSc1nccs1 152998507 KBLVPKMZTMIXSO-SNVBAGLBSA-N 326.451 1.605 10 10 EDCE CNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1CCN=[N+]=[N-] 1902747247 VRIMLPULFNTQSQ-LLVKDONJSA-N 326.401 1.354 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(=O)NC(=O)C2)cc1Br 234444934 IUUYSFLBWYZWFD-QMMMGPOBSA-N 326.194 1.192 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1OCC[C@H]1O 1952399012 CEIZLQFKRDPZNW-KYOSRNDESA-N 339.388 1.683 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)cc1Br 2146314273 QYWHJJIBZJZETI-COLVAYQJSA-N 342.233 1.684 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CN(C(=O)Cc3ccc(N)cc3)C[C@@H]21 2000279511 HZOHNLLBBMZQPI-MIFYACCESA-N 331.416 1.793 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNCc1ccc(O)c(O)c1O 2010527512 AQFLGULTGYVGNX-MRXNPFEDSA-N 342.392 1.169 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C[C@H]1O 387956505 FCQPWWKPXQUSIE-JPWUCKPDSA-N 326.194 1.218 10 10 EDCE CCN1CC[C@@H](N(C)C(=O)c2cnn3c(O)cc(C)nc23)C[C@H]1C 2062083918 AHWLGUQVFGJAOL-CHWSQXEVSA-N 331.420 1.688 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CNCc2cccc(F)c2O)C1 897692205 PNSAKZLOPRSWJS-KRWDZBQOSA-N 340.395 1.993 10 10 EDCE CCCn1nnnc1CN(C)c1ccc(CO)c(Br)c1 2196301164 XTUKJSXNBKKVPF-UHFFFAOYSA-N 340.225 1.974 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H](O)CN(C(=O)Cc2ccc(N)cc2)C1 2049115580 BLMHRGXEJCMVGT-GJZGRUSLSA-N 349.431 1.298 10 10 EDCE CN1C[C@@H]2C[C@H](C1)N2c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2187625395 QIWANPFMTZWDHF-BFHDXFOESA-N 337.221 1.294 10 10 EDCE C[C@@]1(CCO)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2205512612 NEFJLKRUEPSUKX-JSGCOSHPSA-N 341.205 1.786 10 10 EDCE COc1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)c(OC)c1Br 2234896379 BAUPNWCEISUMEH-GDPRMGEGSA-N 344.205 1.662 10 10 EDCE Cc1ccc(CNC(=O)CSCC(=O)O)c(O)c1Br 2352947367 HWBPZOSLLDRVJQ-UHFFFAOYSA-N 348.218 1.897 10 10 EDCE CC(C)NC(=O)COC(=O)/C=C/c1ccc(N2CCOCC2)cc1 66656274 DHWZEUZSXYRHKD-VMPITWQZSA-N 332.400 1.604 10 10 EDCE COc1nn(C)cc1NC(=O)N1CCOc2cc(N(C)C)ccc21 354756024 HPRNREGVSDIDNE-UHFFFAOYSA-N 331.376 1.926 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN(C3COC3)CC2)c([N+](=O)[O-])c1 368584155 SLRBUHWAVLXALY-HWKANZROSA-N 347.371 1.302 10 10 EDCE CCC(=O)N1CSC[C@H]1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 273180067 OEDXVSOXGKUNRG-PWSUYJOCSA-N 338.429 1.457 10 10 EDCE Cc1ccc(CNC(=O)Cn2ccc(=N)[nH]2)c(O)c1Br 2380813824 BCMDAHJUDJEXQB-UHFFFAOYSA-N 339.193 1.389 10 10 EDCE CCN(C[C@@H]1CCN(S(C)(=O)=O)C1)c1ccc(OC)c(OC)c1 801522351 RUDYBOUUPQTGES-ZDUSSCGKSA-N 342.461 1.812 10 10 EDCE OCc1ccc(N2C[C@H](O)[C@@H](O)CC23CCC3)c(Br)c1 2169919754 DCILVHYTMCFHTD-KBPBESRZSA-N 342.233 1.796 10 10 EDCE O=[N+]([O-])c1cc(Br)c(O)c([C@@H](CF)N2CCNCC2)c1 575272672 RGKRTRVWSIENSF-LLVKDONJSA-N 348.172 1.979 10 10 EDCE CCN(C)c1ccc([C@H](C)NC[C@@]2(OC)CCS(=O)(=O)C2)cc1 903368657 PDDWLCPPIRUEOZ-YOEHRIQHSA-N 340.489 1.997 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCC[C@](O)(CO)C2)c1 839160102 QCTUVMSSMBXUBS-CQSZACIVSA-N 330.222 1.782 10 10 EDCE CCOC[C@H]1C(=O)N([C@@H]2CCN(c3ccc(OC)cc3)C2)C(=O)N1C 849358453 WFSIMDGVXCNMBX-ZBFHGGJFSA-N 347.415 1.573 10 10 EDCE C[C@@H](NC[C@H](O)c1ccnn1C)c1ccc(N2CCOCC2)c(F)c1 927135307 XSVMKCSHUTYSKI-ACJLOTCBSA-N 348.422 1.780 10 10 EDCE O=C(NCc1c(O)cccc1F)c1ccc(CN2CCOCC2)cn1 928707524 FMHIZHQXNGGRRH-UHFFFAOYSA-N 345.374 1.689 10 10 EDCE COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)NCc1c(O)cccc1F 921452679 WGLBZWFZDYUTQE-QMTHXVAHSA-N 345.392 1.683 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)c3ccc(O)cc3)C2)cc1 855223287 FDIRLFZVWYZOKR-AWEZNQCLSA-N 340.379 1.979 10 10 EDCE CCO[C@@H](CS(=O)(=O)NCc1cccc(OC)c1O)C1CC1 859006661 RMKGUXOWRGKWOY-AWEZNQCLSA-N 329.418 1.635 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1[C@@H](C)NCc1ccc(N2CCOCC2)c(F)c1 850034282 KKIZXAYRBRHBPR-BPLDGKMQSA-N 336.407 1.950 10 10 EDCE CCOC(=O)/C(=C/c1cn(C[C@H]2CCOC2)nn1)c1nccn1C 865218483 NCAALSRJYJCCCJ-ZBQKXELDSA-N 331.376 1.152 10 10 EDCE CN1CCN(c2ccc(CNC3CC(CC(N)=O)C3)cc2F)CC1 1119614532 CUZMAHNVXLPJHO-UHFFFAOYSA-N 334.439 1.321 10 10 EDCE CN1CCN(c2ccc(CN3C[C@H](O)CC(F)(F)C3)cc2)CC1 787439127 AYHSVVCBAJAZTL-MRXNPFEDSA-N 325.403 1.640 10 10 EDCE CC1(C)[C@H](O)C[C@]1(CO)NCc1cccc(Br)c1O 1879557866 FEMSJMFYIQLNDX-BXUZGUMPSA-N 330.222 1.766 10 10 EDCE COCCN(c1ccc(CN)c(Br)c1F)C1COC1 1879158072 LCZHVUIFCDUBDT-UHFFFAOYSA-N 333.201 1.899 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H](c1ccccc1)c1nn[nH]n1 1149501746 WFDZCVNPULAPTR-DYLHUKMJSA-N 337.339 1.530 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H](N3CCOCC3)C2)cc1 1158517559 NZPZNJWLQLXGLP-HNNXBMFYSA-N 345.403 1.786 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2c1nnnn1Cc1cccnc1 1351031406 AAVXUXHGUVTMMP-UHFFFAOYSA-N 337.387 1.713 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H]3[C@H]4CCC[C@H]43)C2)cc1 1347617595 SSYFZKRLDJFDFP-VDNDLQMASA-N 343.427 1.305 10 10 EDCE C[C@H](CO)[C@@H]1CCCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1351929025 FPQLCHBJQSPTTN-DOMZBBRYSA-N 332.400 1.244 10 10 EDCE O=C(CCN1C(=O)COc2ccccc21)NCc1c(O)cccc1F 1456094362 RBUMNKPNFDJICU-UHFFFAOYSA-N 344.342 1.963 10 10 EDCE NC(=O)NC[C@H]1CCCCN1C(=O)c1cc2cc(O)c(O)cc2s1 1542767357 XFXDCZIJBSFBQL-SNVBAGLBSA-N 349.412 1.976 10 10 EDCE C[C@H](NC(=O)C(F)F)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1486627204 KCXXDGJQPFUGHF-SFYZADRCSA-N 341.318 1.737 10 10 EDCE Cc1nccc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)n1 1556141826 CBJFLUYLWMBFOR-UHFFFAOYSA-N 328.372 1.088 10 10 EDCE CCNC(=O)CNCC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1715710364 BHDLYSJCIVVLSD-NSHDSACASA-N 348.407 1.083 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccc(F)nc2)cc1C 1715576123 AGRQUPVEGQXHPM-HNNXBMFYSA-N 347.390 1.418 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H](CCNCCO)C2)cc1 1715163173 UYQROXMOTOLANM-CYBMUJFWSA-N 347.419 1.673 10 10 EDCE CCOC(=O)N1CSC[C@H]1C(=O)NCc1c(O)cccc1O 1639292951 WYIWGJPGRHOZLY-JTQLQIEISA-N 326.374 1.245 10 10 EDCE C[C@@H](CNCc1nccn1C)NC(=O)c1ccc(N=NC(N)=O)cc1 1733025217 UXLYILKATRTWER-NSHDSACASA-N 343.391 1.491 10 10 EDCE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H]2CCC(=O)NC2=O)c1 153365048 QUCIWRCQDHMYFM-OAHLLOKOSA-N 339.395 1.938 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H](O)[C@](C)(O)C2)c(Br)c1 2136835882 ZSOHQAGAQZGDCM-QCZZGDTMSA-N 329.238 1.791 10 10 EDCE C[C@@H]1CN(c2ccc(CN)c(Br)c2F)C[C@@H](CO)O1 231840926 GOPNBXQDQRSNMA-SCZZXKLOSA-N 333.201 1.633 10 10 EDCE CNCc1ccc(N2CCCN(C)C(=O)C2)cc1Br 234432757 ABZKSRGEOZQWEM-UHFFFAOYSA-N 326.238 1.837 10 10 EDCE NC(=O)CCN(Cc1ccccc1)c1ccc(CO)cc1[N+](=O)[O-] 1946831967 BKCOSDXGCFIMSY-UHFFFAOYSA-N 329.356 1.969 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985095343 CKZCOZMVHVNFPD-GMTAPVOTSA-N 325.369 1.580 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CC(C(=O)NCCCN=[N+]=[N-])=C[C@H]1O 1987692022 ICBXLYLRCUEDGQ-WDEREUQCSA-N 325.369 1.387 10 10 EDCE CC(C)(C)OC(=O)NC1CN(c2cc3c(cc2N)OCC(=O)N3)C1 1999505517 FKYIIZGZTFOVMT-UHFFFAOYSA-N 334.376 1.313 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2010405582 JIGRERHYNPAJIN-VXGBXAGGSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1CCc1ccc(N)cc1 2010532143 ZNMXXUQRPUGLQK-JKSUJKDBSA-N 335.448 1.771 10 10 EDCE COc1cccc(O)c1CN[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 2011487467 MNEPYOZPMOZVOI-OCCSQVGLSA-N 338.404 1.471 10 10 EDCE CN(C)c1ccc(C=C2C(=O)Nc3ccc(S(N)(=O)=O)cc32)cc1 2042454584 DXZPCSFCTHVXPY-UHFFFAOYSA-N 343.408 1.893 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1CCO[C@H]2CNC[C@H]21 708134193 PCVHHBFTFWQPJC-NEPJUHHUSA-N 347.640 1.981 10 10 EDCE C[C@@H](CNCc1cc(Br)cc(F)c1O)S(N)(=O)=O 715789276 ONEXBKHZVKVXCE-LURJTMIESA-N 341.202 1.060 10 10 EDCE NCc1cc(F)c(N2CCS[C@@H](CO)C2)cc1Br 720069235 UWDPNOPJHQEVAK-SECBINFHSA-N 335.242 1.961 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2COC[C@]2(C(=O)N2CC(N=[N+]=[N-])C2)C1 1908254815 VWOZTTPBMRTQRH-MEBBXXQBSA-N 337.380 1.391 10 10 EDCE C[C@H](NC(=O)CN1CC(NC(=O)OC(C)(C)C)C1)c1ccccc1O 2072480610 XNRRUXSJVFKMMS-LBPRGKRZSA-N 349.431 1.778 10 10 EDCE C[C@](O)(CO)[C@@H]1CCN(c2ccc(CN)c(Br)c2F)C1 2202839972 HRYXTONNBSTDQY-YGRLFVJLSA-N 347.228 1.617 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3COC[C@@]3(CO)C2)cc1Br 2234566788 MDNMCEHPEREWNM-ZETOZRRWSA-N 342.233 1.948 10 10 EDCE CN(c1ccc(CNC2CCC2)c(Br)c1)C(CO)CO 2239981353 LIUZXLNCUCIWKE-UHFFFAOYSA-N 343.265 1.881 10 10 EDCE O=C1NC(=O)N(c2ccccc2)C(=O)C1=CNCCN1CCCCC1 2296226393 GOOQRUBLUDRSQI-UHFFFAOYSA-N 342.399 1.229 10 10 EDCE COc1ccc(CN2C(=O)NC(=O)/C(=C/c3ccco3)C2=O)cc1 6008978 YWBQLJPBFAEUSW-ZROIWOOFSA-N 326.308 1.950 10 10 EDCE COC[C@@]1(C(=O)O)C=CCN1Cc1c(O)cccc1Br 2361558897 TVHUSZMIKVKRKT-CQSZACIVSA-N 342.189 1.996 10 10 EDCE COC[C@](C)(CCO)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 182816186 TVTVWWHSSPUORS-MEQKGCOVSA-N 348.443 1.440 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)cc1 243146373 JLVMCROTZCLOMJ-UHFFFAOYSA-N 342.395 1.998 10 10 EDCE COc1ccc(N2CCN(C(=O)CCN(C(C)=O)C3CC3)CC2)cc1 242910096 GSSNPMTZRHOBCB-UHFFFAOYSA-N 345.443 1.745 10 10 EDCE O=C(NCc1cc(Br)ccc1O)[C@@H](O)c1cccnc1 804734982 GKCHYHGCIJTIIT-ZDUSSCGKSA-N 337.173 1.900 10 10 EDCE COC(=O)[C@H]1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)C1 299400416 BVJJLRHATADRKX-HNNXBMFYSA-N 331.416 1.774 10 10 EDCE NCc1cc(F)c(N2C[C@@H](CO)[C@@H](CO)C2)cc1Br 704702318 NBILIFOGPVAAQT-AOOOYVTPSA-N 333.201 1.084 10 10 EDCE CNCc1ccc(N2CCN([C@H](C)CO)CC2)c(Br)c1 2169366865 RLCDIUNVWPECQP-GFCCVEGCSA-N 342.281 1.671 10 10 EDCE Cc1cc(CN(C)CCN2CCCS2(=O)=O)ccc1N(C)C 815055874 QWDWUIVGNWJEAK-UHFFFAOYSA-N 325.478 1.528 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1CCCN(C)C1=O 819698613 OQHORKOSPQWLKE-CQSZACIVSA-N 348.399 1.152 10 10 EDCE Cc1cc(Br)c(O)c(CN2CC3(CNC(=O)O3)C2)c1 817417100 ZLQPWBFDJHTXEK-UHFFFAOYSA-N 327.178 1.757 10 10 EDCE CCOC(=O)C(=O)[C@@H](N)c1cc([N+](=O)[O-])cc(Br)c1O 725426831 LMIZNRFIPBYCGI-QMMMGPOBSA-N 347.121 1.195 10 10 EDCE COc1ccc(O)c(CNC(=O)NCCCCN2CCOCC2)c1 734067154 WGJZJCORNQMOBE-UHFFFAOYSA-N 337.420 1.312 10 10 EDCE CN(C)c1ccc(CNC(=O)NCC2(C3(O)CCOCC3)CC2)cc1 902942551 SGSMFFKAWLVKJX-UHFFFAOYSA-N 347.459 1.874 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)NCc3cnn[nH]3)ccc21 673928705 UOBNRPSWOSLILQ-UHFFFAOYSA-N 327.388 1.953 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)c3ccccn3)C2)cc1 849415647 CZYBWOZDYSALIC-ZDUSSCGKSA-N 333.413 1.647 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(=O)N(C)CC3)C2)cc1 854296123 HAAGDEIAOGFMGD-CQSZACIVSA-N 346.431 1.148 10 10 EDCE COC(OC)[C@@H](C)NC(=O)NCc1cc(Br)ccc1O 923655000 NIEPFVHEMSYIBG-MRVPVSSYSA-N 347.209 1.961 10 10 EDCE O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCc1c(O)cccc1F 928710966 YTQJDRQBQROFRU-GHMZBOCLSA-N 334.347 1.323 10 10 EDCE COC1(C(=O)NCc2cc(NC(=O)C3(OC)CC3)ccc2O)CC1 923117714 DWMWEDDRKWZGCN-UHFFFAOYSA-N 334.372 1.305 10 10 EDCE CO[C@@H](C(=O)NCc1cc(Br)ccc1O)[C@@H]1CCOC1 854442421 RJQWTFHUBOARNN-NOZJJQNGSA-N 344.205 1.822 10 10 EDCE NC(=O)CCCCC(=O)NCc1cccc(Br)c1O 765730994 FEUWSTFIULKAKQ-UHFFFAOYSA-N 329.194 1.817 10 10 EDCE O=C(C(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)N1Cc2cccc(O)c2C1 1119033943 ZBJWYGMOASKSMP-GJZGRUSLSA-N 344.411 1.386 10 10 EDCE COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(OC)c3O)C[C@@H]1C2 876133960 IFPRQUGEHRMDRF-PEBVRCNWSA-N 334.372 1.542 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@]2(CCO)CCOC2)c1O 775035003 WNODFSVPGYCZKZ-HNNXBMFYSA-N 326.349 1.188 10 10 EDCE O=C(NCC[C@@H]1CCOC1)NCc1ccc(N2CCOCC2)cc1 784240321 GHEVHVFDJKSAAL-MRXNPFEDSA-N 333.432 1.749 10 10 EDCE O=C(NCCCC1CC1)C(=O)NCc1ccc(N2CCOCC2)cc1 788323987 OURSKNFLWOVXSB-UHFFFAOYSA-N 345.443 1.446 10 10 EDCE Cn1cc(C[C@@H](CO)CNC(=O)c2ccc(N=NC(N)=O)cc2)cn1 1157612011 CSLIYZBBVXVOGA-GFCCVEGCSA-N 344.375 1.164 10 10 EDCE CC(C)(C)OC(=O)N1CCS(=O)(=O)CCN1CCCN=[N+]=[N-] 1962301048 TZWKRNRHJBDZMU-UHFFFAOYSA-N 333.414 1.569 10 10 EDCE CNC(=O)N[C@H]1CCCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 1164146689 YTDCJRLLEBDASK-JTQLQIEISA-N 338.364 1.510 10 10 EDCE Cc1c(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)cnn1C 1321419525 HPXKEZNBGVLMMI-UHFFFAOYSA-N 343.431 1.069 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CC[C@H](O)C(F)(F)C3)ccc21 1333723892 ZYNNLKWHRZTUCL-HNNXBMFYSA-N 339.386 1.981 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC3CC(C)C3)C2)cc1 1347968691 ZFUYEAOGXZYNBL-YMAMQOFZSA-N 345.443 1.552 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@]3(C)CCOC3=O)C2)cc1 1263794154 NPDMHNRSSSJPMI-PXAZEXFGSA-N 333.388 1.279 10 10 EDCE CC(C)CN(C)C[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1278889340 SBRQXFBTVCBSNP-OAHLLOKOSA-N 349.435 1.870 10 10 EDCE O=S1(=O)C[C@H]2[C@@H](CNCc3ccc(Br)cc3O)[C@H]2C1 2117990201 OUCRAHXGNHJAJA-ZSBIGDGJSA-N 346.246 1.535 10 10 EDCE CC(F)(F)CC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1522716192 LAZQOPBVHIDUMB-UHFFFAOYSA-N 341.318 1.740 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccc([C@@H]2NC(=O)NC2=O)cc1 1454191593 DXHQFDOBFOFKBT-HNNXBMFYSA-N 341.323 1.160 10 10 EDCE C[C@@H](c1ccccc1)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)C(N)=O 1628757964 DDEDPGQCVMSZBW-APPDUMDISA-N 328.368 1.414 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1ccc(-n2cncn2)c(F)c1 1625039157 DFCAFCUIXAULDV-UHFFFAOYSA-N 328.303 1.999 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2CCC(=O)N2)cc1C 1492113798 XHRUWLWVRQXNCC-HIFRSBDPSA-N 333.432 1.267 10 10 EDCE CCNCC1(O)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1724985653 CTZFOXDLHHFTPV-UHFFFAOYSA-N 333.392 1.426 10 10 EDCE CCCC(=O)NC[C@@H]1CCN1Cc1nnnn1-c1ccc(OC)cc1 1498913692 WUIUIQZLRKEZLH-AWEZNQCLSA-N 344.419 1.162 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C[C@H]2CCNC2=O)cc1C 1568863571 XDVDMWQCQUCGBK-QDLOVBKTSA-N 345.443 1.292 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)[C@H]2CCC(=O)N2)C2CC2)cc1C 1569296106 MDXBXPFOPHOQSN-CVEARBPZSA-N 345.443 1.267 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCNC(=O)C2(CF)CC2)cc1 1575938689 OTVRJLVZTVGDEJ-UHFFFAOYSA-N 349.366 1.835 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H](C)SC)cc1C 1667790556 YFCCQHJQPSRQHE-JSGCOSHPSA-N 326.462 1.322 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCNC(=O)[C@H]2CCOC2)cc1 1758137048 MEXBNCWJYREIOK-LBPRGKRZSA-N 347.375 1.122 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2nc(O)c3c(n2)CCOC3)c1 1683594723 OWEQAINLATYQHS-UHFFFAOYSA-N 344.371 1.268 10 10 EDCE CC[C@@H](CNC(=O)[C@@]1(C)CCNC1=O)NCc1ccc(OC)c(C)c1 1698612241 ICIUWNAHGXLQBA-KXBFYZLASA-N 347.459 1.514 10 10 EDCE CN[C@H](C)c1ccc(N(CCO)C2COC2)c(Br)c1 1915544368 AJDCDAHCYPNVIE-SNVBAGLBSA-N 329.238 1.927 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2140659153 RHQVGWUBMMLDSR-VFFVRTRHSA-N 333.201 1.349 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985100089 CWEGMUIPQJBVIW-ZJUUUORDSA-N 327.385 1.467 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985101226 PGRLAVXNKHSUGF-LLVKDONJSA-N 327.385 1.827 10 10 EDCE CO[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCCN=[N+]=[N-] 1986262037 MOGAYAJCIIJLQU-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)NCCOCCNC(=O)Cc1ccc(N)cc1 1999148980 OSAKESSWFATLQL-UHFFFAOYSA-N 337.420 1.469 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2010391786 UXVPMUURVGBDOD-VXGBXAGGSA-N 339.396 1.970 10 10 EDCE COC(=O)[C@@H](CC(=O)N1CC[C@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 2010401053 AJRALRPZNLBLGY-VHSXEESVSA-N 341.368 1.354 10 10 EDCE COc1cccc(CNC[C@@](C)(CO)NC(=O)OC(C)(C)C)c1O 2010528249 DZKAEPPBVZNYFY-KRWDZBQOSA-N 340.420 1.766 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)C[C@H](O)C2)c(Br)c1 2161356452 GQZQYJDCSBJGDM-STQMWFEESA-N 343.265 1.881 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@@H](O)CC[C@@H]3O)cc1Br 2161354679 MSVMDHXZZGCCAM-AJNGGQMLSA-N 341.249 1.761 10 10 EDCE C[C@@H](NCCc1nnc(Br)n1C)c1c(O)cccc1O 2185197548 HFUAROZJYADVMO-MRVPVSSYSA-N 341.209 1.882 10 10 EDCE CC(C)(C)OC(=O)N1Cc2[nH]cnc2C[C@@H]1C(=O)NCCCN=[N+]=[N-] 2060617867 SCVIYFRFCGPXFB-GFCCVEGCSA-N 349.395 1.888 10 10 EDCE Cn1[nH]c(CNC(=O)OC(C)(C)C)nc1=NCc1cccc(O)c1O 2063131041 VBCRLOXGNFLFBX-UHFFFAOYSA-N 349.391 1.285 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1CO[C@@H]2COC[C@@H]12 2101884578 GJWNYXPYVOOIDW-MVWJERBFSA-N 332.169 1.797 10 10 EDCE CN(C)C(=O)[C@H]1CCN(c2ccc(CN)c(Br)c2)C1 2087395651 JEHHCLKMOYYNOZ-NSHDSACASA-N 326.238 1.822 10 10 EDCE CC(C)(C)OC(=O)N1C[C@]2(C)CC[C@@]1(COc1nnc(=N)[nH]n1)C2 2213789626 KGCCDVZSEQQKNE-CABCVRRESA-N 336.396 1.238 10 10 EDCE Cc1ccc(CN2C[C@H](O)C[C@]2(C)CO)c(O)c1Br 2352944511 JAWWLTGHOMMMQW-BXUZGUMPSA-N 330.222 1.781 10 10 EDCE C[C@@H]1C[C@H](O)CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 401693419 HVOAUEGEWQISMM-BFHDXFOESA-N 340.221 1.608 10 10 EDCE Cc1cccn(CC(=O)N2CCOc3cc(N(C)C)ccc32)c1=O 181474354 DCQBZLWADXZPOO-UHFFFAOYSA-N 327.384 1.648 10 10 EDCE COc1cc(NC(=O)N2CCOc3cc(N(C)C)ccc32)nn1C 548167913 OXLMIMBWMZAWRA-UHFFFAOYSA-N 331.376 1.926 10 10 EDCE Cn1ccc(/C=C2\SC(=S)N(CCN3CCOCC3)C2=O)c1 270619838 RIIVNEGOTXPREW-RAXLEYEMSA-N 337.470 1.559 10 10 EDCE CO[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)CC[C@H]1C 807098215 UFMNAFTXENIVIL-DYVFJYSZSA-N 347.459 1.561 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)cc1 808494106 KQQJSLAHVWXOPA-UHFFFAOYSA-N 341.385 1.078 10 10 EDCE COCCn1c([C@@H]2COCCO2)nnc1N(C)Cc1ccccc1O 812117163 LRCMXLKCYJYBPI-HNNXBMFYSA-N 348.403 1.354 10 10 EDCE Cn1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)c(Cl)n1 822721036 PVDKZQYQXHNIOU-UHFFFAOYSA-N 334.807 1.840 10 10 EDCE COC1CCN(c2ccc(CN3CCC[C@@](O)(CO)C3)cc2)CC1 839147361 IOAJTAPUMSDLIJ-IBGZPJMESA-N 334.460 1.621 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1CN(C2CCOCC2)C1 907272667 HJSOGMWHNYXXLD-LBPRGKRZSA-N 334.416 1.256 10 10 EDCE C[C@H](NC(=O)C(=O)NCC[C@H]1CCCNC1)c1ccc(N(C)C)cc1 842203853 XWXFYMNZJDYOIV-LSDHHAIUSA-N 346.475 1.436 10 10 EDCE CC(C)COC1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)CC1 842236520 PAEYWZPETPXNFO-UHFFFAOYSA-N 347.459 1.591 10 10 EDCE COc1cc(Br)cc([C@H](C)N[C@@H]2COC[C@H]2O)c1O 848554621 YBOMPXIOUUXJOL-WHGOUJPWSA-N 332.194 1.574 10 10 EDCE CC(=O)C(=O)COC(=O)C1(C(=O)Nc2c(F)cccc2F)CC1 848874485 BCTDLZPVFHSRBG-UHFFFAOYSA-N 325.267 1.385 10 10 EDCE CCOC(=O)C1(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 855231382 LJSMDHDNZFPKIY-CYBMUJFWSA-N 332.400 1.733 10 10 EDCE CN(C)c1cnn(C2CCN(C(=O)c3cccc(O)c3O)CC2)c1 854655295 VZOBJRGIJLEGSX-UHFFFAOYSA-N 330.388 1.838 10 10 EDCE COC(=O)[C@@H]1CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 854301155 JKPYDBVRIQDDMM-KGLIPLIRSA-N 347.415 1.478 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1N(C(=O)OCc2ccccc2)CC1(C)C 869572984 GCCXNZSBTRKHBM-OAHLLOKOSA-N 347.367 1.735 10 10 EDCE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1nc[nH]n1 761981138 GVWVCFPLLPDVEF-LBPRGKRZSA-N 335.795 1.558 10 10 EDCE Cc1nc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cs1 763235723 QEGXYWISZKBEBL-UHFFFAOYSA-N 327.387 1.781 10 10 EDCE NC(=O)N1C[C@@H]2C[C@H]1CN2Cc1cc(Br)ccc1O 1877018672 ZKMUFDYQCHPHFG-QWRGUYRKSA-N 326.194 1.492 10 10 EDCE COC(=O)CC1(NCc2cc(F)ccc2O)CCS(=O)(=O)CC1 784669943 GOYDBGICQWBUPP-UHFFFAOYSA-N 345.392 1.131 10 10 EDCE COCCN(C)C1CN(c2ccc(CO)cc2Br)C1 1877430300 JRGOPCQFOPZKHK-UHFFFAOYSA-N 329.238 1.708 10 10 EDCE Cn1cc(C[C@H](O)C(=O)NCCCSc2nccs2)cn1 786974937 MNYKXPHJMMDHKY-NSHDSACASA-N 326.447 1.079 10 10 EDCE CN1CCN(c2ccc(CNC(=O)[C@@]34C[C@H]3COC4(C)C)cc2)CC1 893608481 VDKQDDMTQDUZGX-OXJNMPFZSA-N 343.471 1.870 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@]3(OC)CCSC3)C2)cc1 892686077 YHMSJBSZKBXKEN-CXAGYDPISA-N 336.457 1.912 10 10 EDCE O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1cc2cc(O)c(O)cc2s1 895989344 ADNJRFXLTUIECM-VXGBXAGGSA-N 348.424 1.906 10 10 EDCE COCCN1CCC[C@@H]1CNC(=O)NCc1ccc(OC)cc1O 792950068 GRVOEQGOCNPKEZ-CQSZACIVSA-N 337.420 1.311 10 10 EDCE CSc1c(C(=O)NCc2ccc(N3CCOCC3)cc2)cnn1C 790489797 HADNQGYEJCLMLH-UHFFFAOYSA-N 346.456 1.909 10 10 EDCE C[C@@H]1CC[C@H](C(N)=O)CN1Cc1ccc(N2CCN(C)CC2)c(F)c1 1337001608 XSAKRVFYTOVRAG-ZBFHGGJFSA-N 348.466 1.663 10 10 EDCE CC[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H]1CCOC1 1269517393 XDBMOKJLNVUOSU-JSGCOSHPSA-N 347.419 1.984 10 10 EDCE CC[C@H](CNC(=O)[C@H]1CCNC1=O)NCc1ccc(OC)c(C)c1 1269448536 LWGMVBHBDDXLBO-CABCVRRESA-N 333.432 1.124 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2ccccn2)cc1C 1507462295 OBHWICSUFXHGTE-MRXNPFEDSA-N 343.427 1.621 10 10 EDCE COc1ccc(CNC(=O)Cn2nc(C)c3cccnc32)c(O)c1 1448380337 ILXIQECGELDUHK-UHFFFAOYSA-N 326.356 1.770 10 10 EDCE O=S1(=O)C[C@H]2[C@H](CNCc3cc(Br)ccc3O)[C@H]2C1 2117990092 ZHPNTEWEVVHRLI-CNDDSTCGSA-N 346.246 1.535 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@@H](CO)[C@H](CCO)C3)ccc21 1518889471 JGBFSBXZLGAUNB-SJORKVTESA-N 347.459 1.201 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1noc2c1COCC2 1451959416 YDVCXWZDHWRWPT-UHFFFAOYSA-N 325.324 1.931 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)C2(CF)CC2)cc1 1292893758 CHGCNLIDGGXLEZ-UHFFFAOYSA-N 335.339 1.445 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@H]1CCCN(Cc2ncon2)C1 1467946832 SHIZQIHFBJDYGA-CYBMUJFWSA-N 346.387 1.052 10 10 EDCE CO[C@H](C(=O)NCCc1ccc(O)c(O)c1)C(=O)OC(C)(C)C 1465981989 VZROPSGYTVLMMR-CYBMUJFWSA-N 325.361 1.113 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CC(=O)N(Cc2ccco2)C1 1471661688 YDXQLSBIFFEDIX-GFCCVEGCSA-N 330.340 1.356 10 10 EDCE O=C(NCc1cn(C2CC2)c(=O)nc1O)N1Cc2cccc(O)c2C1 1479188840 FMGYOMFKKAQPFO-UHFFFAOYSA-N 342.355 1.215 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)C2=CCOCC2)cc1C 1700936247 CSEYWGBBOIWAIJ-QGZVFWFLSA-N 348.443 1.259 10 10 EDCE CCOCCN[C@@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1485963658 RUEDPMBBGJFSHK-LBPRGKRZSA-N 335.408 1.936 10 10 EDCE CCC(=O)NCC(=O)N[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1713982431 FOHKYIBAXICYAQ-GASCZTMLSA-N 333.432 1.267 10 10 EDCE COC(=O)c1cccn(CC(=O)N[C@@H](C)c2ccccc2O)c1=O 1557968611 KCMBPHFWYVRTDQ-NSHDSACASA-N 330.340 1.218 10 10 EDCE O=C(Cc1csc(N2CCCC2=O)n1)NCc1ccc(O)cc1O 1626838346 XRAZPXKQXWANAM-UHFFFAOYSA-N 347.396 1.540 10 10 EDCE CC[C@@H](CNC(=O)CNC(=O)OC)NCc1ccc(OC)c(C)c1 1567951551 QRAZGPGYCXQELQ-AWEZNQCLSA-N 337.420 1.344 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@@H](O)C2(C)C)c(Br)c1 2124796467 PFTLCGFQHOSKFM-QWHCGFSZSA-N 329.238 1.489 10 10 EDCE Cc1cnc(C2(NC(=O)c3ccc(C)c(O)c3O)CCOCC2)[nH]1 1645500771 RNCXVOYNKNCSQD-UHFFFAOYSA-N 331.372 1.873 10 10 EDCE Cc1noc([C@@H]2OCC[C@@H]2NC(=O)N(C)Cc2ccccc2O)n1 1674929930 FYCIXFIOQSPZGX-GXTWGEPZSA-N 332.360 1.755 10 10 EDCE CCCN(CC(=O)N1CCC[C@@H](C(N)=O)C1)Cc1ccccc1O 154569313 PSISZQCSQCAKRF-OAHLLOKOSA-N 333.432 1.328 10 10 EDCE CCOc1cccc(CNCC(=O)N2CCCC[C@@H]2CCO)c1O 1857866881 IOUXBFPFFJCNHD-OAHLLOKOSA-N 336.432 1.644 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2140657775 IQBHUJYZLWGZPE-VFFVRTRHSA-N 333.201 1.349 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)CCCN=[N+]=[N-] 1985093611 BUPOVWJRSNFZPN-NSHDSACASA-N 328.417 1.600 10 10 EDCE CO[C@@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C[C@@H]1F 2146468802 CSMNNWKVLBSOFE-AXTRIDKLSA-N 344.184 1.574 10 10 EDCE CCN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)C1CN(C)C1 2146886245 JJUXNOZCBUIZEY-ZDUSSCGKSA-N 339.237 1.541 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@H](NC(=O)OC(C)(C)C)C2)c(N)c1 2002706783 CXCARRDHNXFVOL-RYUDHWBXSA-N 337.420 1.742 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@H]1NC(=O)COc1ccc(N)cc1 2009325713 CGLLMQVFLMSRGD-BXUZGUMPSA-N 335.404 1.677 10 10 EDCE CC(C)(C)OC(=O)NC1CN(CC(=O)NCc2ccccc2O)C1 2010119748 GAQYIBBQHKGRIE-UHFFFAOYSA-N 335.404 1.217 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@](O)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2011938698 CKMVOPYWVPJEBY-ABAIWWIYSA-N 339.396 1.660 10 10 EDCE OCc1ccc(N2CCn3c(CO)nnc3C2)cc1Br 2171797957 JCJBOGYPEWPBCB-UHFFFAOYSA-N 339.193 1.045 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@]3(CNC(=O)N3)C2)cc1Br 2177695656 ITZZJVXUYAJKEU-LKFCYVNXSA-N 339.237 1.731 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@](O)(CN(C)C)C2)c(Br)c1 713709120 SIHNZVUKGACPCQ-XHDPSFHLSA-N 342.281 1.972 10 10 EDCE CCNCc1ccc(N2CC(NC(C)=O)C2)c(Br)c1 387991242 VITDRABWVOTZKA-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE O=C(N1CCC(CNCc2cccc(O)c2O)CC1)C(F)(F)F 397708064 AXXGYKKYGMYUPP-UHFFFAOYSA-N 332.322 1.988 10 10 EDCE CNCc1ccc(N2CCN(CCCO)CC2)c(Br)c1 2169924789 LWVHIZRPRJIWKH-UHFFFAOYSA-N 342.281 1.673 10 10 EDCE O[C@@H]1CCN(c2ccc(CN=c3[nH]ncn3-c3cccnc3)cc2)C1 2080430140 RTBMYUFTLKPLNV-QGZVFWFLSA-N 336.399 1.267 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H](N(C)C)C2)cc1Br 2089926806 NCAPQIIAOFDPEH-FZZIBODNSA-N 328.254 1.580 10 10 EDCE CC1(C)CN(c2ccc(CN)cc2Br)CCNC1=O 2093988287 JJRPHWLPZLUQKF-UHFFFAOYSA-N 326.238 1.870 10 10 EDCE COC[C@@H]1[C@H](O)[C@@H](O)CN1c1ccc([C@H](C)N)c(Br)c1 2234068669 PVLJDVFDKLTYOB-ISTUKMMPSA-N 345.237 1.026 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@H]1C(=O)NCCCCN=[N+]=[N-] 2246447281 OVKDXZQBADPJJU-NEPJUHHUSA-N 341.412 1.954 10 10 EDCE CO[C@H]1CCN(CCNCc2cccc(Br)c2O)C1 2267896025 MNKBJQRYAFBSNB-LBPRGKRZSA-N 329.238 1.965 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C1 2300530673 UUOLSHHZCBUVNI-RYUDHWBXSA-N 339.396 1.730 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N[C@H]1CCCN(c2ncccn2)C1 2307990558 YZUHOXLSHMPVET-AWEZNQCLSA-N 340.383 1.686 10 10 EDCE COC(=O)[C@@H](O)CN(C)Cc1ccc(C)c(Br)c1O 2352639959 DLUUXOIJTGOOMF-JTQLQIEISA-N 332.194 1.429 10 10 EDCE O=C1NCCN(Cc2cc([N+](=O)[O-])ccc2O)[C@H]1c1ccccc1 173488164 NOMXKDFCAQUQHY-INIZCTEOSA-N 327.340 1.974 10 10 EDCE N[C@@H]1CCCC[C@H]1NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 128801346 LYLIOVGNDUYQSF-CVRCPQJVSA-N 329.444 1.923 10 10 EDCE CNC(=O)[C@@H]1CCCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 210024790 UXSSTSWVMIPRQS-FWPCIQOSSA-N 347.371 1.743 10 10 EDCE CC(=O)NC1CN(C(=O)c2cc(C)n(-c3ccc(C#N)cc3)c2C)C1 191477492 ZIOYDOASMZIJKH-UHFFFAOYSA-N 336.395 1.926 10 10 EDCE COc1ccc(N2CCN(c3cnnc(NC4CC4)n3)CC2)cc1 243121640 JHXOCPKFQRPFGO-UHFFFAOYSA-N 326.404 1.781 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCc2ccccn2)c1 269398437 CKKJGADGGUEOIV-UHFFFAOYSA-N 349.412 1.521 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCNC3=O)ccc21 616965260 YNUQUCOJTWKFAD-HNNXBMFYSA-N 329.400 1.523 10 10 EDCE CCN(CC)c1ccc(CNC(=O)CN2CCOCC2=O)cc1F 279310034 OGEBDHUTYVPVKR-UHFFFAOYSA-N 337.395 1.147 10 10 EDCE Cc1c(Br)cc(C(=O)O)c(O)c1CN1CCOCC1 642879884 DTDIIAGVIUEKJZ-UHFFFAOYSA-N 330.178 1.994 10 10 EDCE CN1CCc2cc([C@@H](NN)c3c(Br)nnn3C)ccc21 2163150548 XDMAVVVGBSPIHH-LLVKDONJSA-N 337.225 1.123 10 10 EDCE C[C@@H]1CC[C@](CO)(N(C)CC(=O)NCc2ccc(N(C)C)cc2)C1 299345806 PARRXLCKAKZIQR-BEFAXECRSA-N 333.476 1.852 10 10 EDCE CC[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CCO1 817274982 VKPVKPOKNCSFPE-ZBFHGGJFSA-N 333.432 1.443 10 10 EDCE COc1cccc(CNC(=O)C(=O)c2cnn(C(C)(C)C)c2)c1O 729859542 USRGEAWZBWKJHV-UHFFFAOYSA-N 331.372 1.851 10 10 EDCE C[C@@]1(CO)CCCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 722983555 XKRCMTLHKWZHIY-OCCSQVGLSA-N 340.221 1.752 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CCO)C[C@H]1C 838479600 RUOGXKLCCMHVFI-OAHLLOKOSA-N 334.464 1.269 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](O)Cc1cnn(C)c1 839922449 VBEKEZZTHZGOOH-KDOFPFPSSA-N 344.459 1.445 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H](c3ccnn3C)C2=O)cc1F 843305372 BULCVOLOBHYCKF-CQSZACIVSA-N 331.351 1.418 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C\C3CC3)nc12 745556086 YGEJIZOVSBBQMS-WAYWQWQTSA-N 331.328 1.621 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ncc(OC)cn1 845931632 UGPMSDULFHPXNS-UHFFFAOYSA-N 344.371 1.568 10 10 EDCE COC[C@H]([C@@H]1CCCOC1)N1C(=O)CN(Cc2ccccc2O)C1=O 925142507 OGAJNIALJQAJQF-HUUCEWRRSA-N 348.399 1.598 10 10 EDCE COC[C@H](CCNC(=O)NCc1ccc(N(C)C)c(F)c1)OC 852449295 RPJIGPNYKMWRCW-ZDUSSCGKSA-N 327.400 1.742 10 10 EDCE CCO[C@H]1[C@@H](C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1C 923443117 QUJOZSORZBLGSM-JEBQAFNWSA-N 348.443 1.925 10 10 EDCE C[C@@H](O)[C@H]1CCN(c2cc(N3Cc4cccc(O)c4C3)ncn2)C1 866117786 RBMKAZVLWRYYLT-OLZOCXBDSA-N 326.400 1.910 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](O)[C@@H](C)O)cc1 871142957 MPXLRYWRROLKFJ-KDOFPFPSSA-N 344.411 1.307 10 10 EDCE C[C@@H](NC(=O)[C@@H]1CC[C@H](C(N)=O)C1)c1ccc(N2CCOCC2)cc1 888455049 JPDCMKLFSICPJP-VNQPRFMTSA-N 345.443 1.602 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)OC[C@@H]1OCCNC1=O 1123229114 FDKJSMDLDIHQPX-ZDUSSCGKSA-N 334.397 1.827 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCO[C@@H]2COC[C@H]21 1877615407 UQOIHNWYHZMXIQ-VXGBXAGGSA-N 332.169 1.893 10 10 EDCE CNCc1ccc(N2CCO[C@@H]3COC[C@@H]32)cc1Br 1877659728 PABRAXTYBNASPL-UONOGXRCSA-N 327.222 1.773 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2C(=O)NC[C@@H]2C1 896873816 MTROSDGRJILVRW-SECBINFHSA-N 333.369 1.162 10 10 EDCE COc1ccc(Br)c(CNCCn2cncn2)c1O 1964033776 XNFWAHZVINPLGY-UHFFFAOYSA-N 327.182 1.545 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])N(C)C)cc1 1304769236 TXHGLMSTUBUJFS-ZDUSSCGKSA-N 346.391 1.417 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2CCN(C)C2=O)cc1C 1317402825 LWIZFTAMPQHQNI-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE COC(=O)[C@@]1(C)CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1329436330 MXUZIICXCRZKOJ-SFHVURJKSA-N 346.383 1.036 10 10 EDCE CCOC(=O)[C@H](CC1CC1)NCC(=O)NCc1ccc(N(C)C)cc1 1175918926 VNNOENBFABQLEC-KRWDZBQOSA-N 347.459 1.690 10 10 EDCE COCC(=O)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@H]1C 1281140038 JYJDOFPFCSQLRQ-GWCFXTLKSA-N 347.375 1.215 10 10 EDCE CN1CCN(CC(=O)N(C)Cc2ccc(N3CCCC3)cc2)CC1=O 1440714713 MOLSDZUPZAOJQH-UHFFFAOYSA-N 344.459 1.019 10 10 EDCE 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1.359 10 10 EDCE Nc1ccc(CCC(=O)N2C[C@H]3C[C@H]2CN3C(=O)C(F)(F)F)cc1 2044618463 BEMRAXXXLAAXCI-QWHCGFSZSA-N 341.333 1.575 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2CN3C(N)=O)c(Br)c1 2192287525 XOBJSWBAHUMLAQ-MIMYLULJSA-N 339.237 1.810 10 10 EDCE Cc1nnc(CCNCc2cc(Br)ccc2O)n1C 2104144924 SAQUGSTXXRULRT-UHFFFAOYSA-N 325.210 1.924 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@@H](N(C)C)C2)c(Br)c1 2089925585 DNBYXGQAUAXHAV-IIMNLJJBSA-N 328.254 1.580 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCN(C)C(=O)C2)c1O 2236047205 TVWNVICSIDAABM-VIFPVBQESA-N 343.221 1.874 10 10 EDCE CN(C[C@@H](O)[C@@H](N)c1ccc2c(c1)CCN2C)C(=O)OC(C)(C)C 2250282963 JCFNTIHMTCAVNJ-CVEARBPZSA-N 335.448 1.907 10 10 EDCE Cc1ccc(CN(C)Cc2nc(=O)o[nH]2)c(O)c1Br 2352665217 PUDCJHBQZRUYKQ-UHFFFAOYSA-N 328.166 1.771 10 10 EDCE COCCN(CC(=O)O)Cc1ccc(C)c(Br)c1O 2352945014 PLDFITOXOBYFAB-UHFFFAOYSA-N 332.194 1.996 10 10 EDCE NCc1ccc(N(CCO)C2CCOCC2)cc1Br 2353587109 NZKAOWRNYXVBKD-UHFFFAOYSA-N 329.238 1.886 10 10 EDCE COc1ccc(/C=C2\C(=O)N(C)C(=S)N=C2O)c(OC)c1OC 56708693 DOKVIBLKSMGQPH-CLFYSBASSA-N 336.369 1.809 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)c(Br)c1 2357056177 GBLSXPWNIMXTCR-AQNFWKISSA-N 341.249 1.631 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2357593602 YFKFCLWSRRRWMZ-BHGZDDGQSA-N 341.249 1.789 10 10 EDCE O=C(O)/C=C\c1ccc(N2CCNC(=O)C2)cc1Br 311267467 WZCUQRDLBSYJTN-RQOWECAXSA-N 325.162 1.483 10 10 EDCE COCCOC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O 45916204 OJMOMPMOZASEPY-UHFFFAOYSA-N 325.320 1.847 10 10 EDCE Cc1ccc(O[C@H]2CCCN(C(=O)c3cc(O)nc(O)c3)C2)nn1 238849839 JEXUHNHGGQRQFP-LBPRGKRZSA-N 330.344 1.275 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cn(C[C@@H]3CCOC3)nn2)c1 528860830 MWNDRIFGNJUHDN-RYUDHWBXSA-N 346.387 1.520 10 10 EDCE CN(C)[C@H]1CCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255760213 YNCUJGQUUOLIGV-MTIYJEKLSA-N 329.444 1.699 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CC[C@@H](CC(N)=O)C2)cc1 376585614 CWNAYBVZKWTXIW-HNNXBMFYSA-N 332.448 1.940 10 10 EDCE 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C/C=C(/C)C(=O)N(C)CCNCc1nnnn1-c1ccc(OC)cc1 1267360661 LRIFZBVKSXJDOO-ACAGNQJTSA-N 344.419 1.185 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)c1ccc2c(c1)COB2O 1456310115 ORUBWZIBUGTTMN-UHFFFAOYSA-N 333.152 1.693 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CCCN(C(=O)N2CCCC2)C1 1471661719 ZTKFPAKCLGOEBG-CYBMUJFWSA-N 347.415 1.642 10 10 EDCE CN(C)C(=O)C1CN(c2ccc(CN)c(Br)c2F)C1 2121046195 QMAOYHIBADZSAY-UHFFFAOYSA-N 330.201 1.571 10 10 EDCE CO[C@@H](C)C(=O)N[C@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1701632544 UUQLZPMYBJEOBD-MNOVXSKESA-N 349.391 1.461 10 10 EDCE COc1ccc(CNCCC[C@H](C)NC(=O)c2cnn(C)n2)cc1C 1717688459 QXJITCHXXNMHSE-AWEZNQCLSA-N 345.447 1.820 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H](C)S(C)(=O)=O)cc1C 1491499060 BKSZWXLXOHGPLZ-CHWSQXEVSA-N 342.461 1.031 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](NC(N)=O)C(C)C 1639340674 BIFMAHUZFMNBMG-BBRMVZONSA-N 334.464 1.801 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CC(=O)N(C)C3)CC2)cc1C 1723520730 CPXLTZGMYBOISX-HNNXBMFYSA-N 345.443 1.220 10 10 EDCE CCOC(=O)CC(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1637243718 HFOMRJUDNSAMOJ-UHFFFAOYSA-N 343.763 1.500 10 10 EDCE CCOCCNC[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1568322651 PZWJXFCOASNGRZ-GFCCVEGCSA-N 335.408 1.936 10 10 EDCE C[C@@H]1OC[C@]2(CC[C@@H](CNC(=O)Cc3ccc(O)c(O)c3)O2)[C@H]1C 1652141342 ZJXOQGLYMRJKRV-MMNXLFCMSA-N 335.400 1.729 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCO[C@@H](c2noc(C3CC3)n2)C1 1654798598 HJTAHAUIKHIJEM-LLVKDONJSA-N 349.318 1.711 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cn(C)nc2C)cc1C 1662185380 ZMURBJNDHCOAAA-ZDUSSCGKSA-N 330.432 1.954 10 10 EDCE COCC(=O)NC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1758597722 YZAKADOUJAGVQE-ZDUSSCGKSA-N 347.375 1.120 10 10 EDCE Cc1ccn2c(=O)c(C(=O)NCc3cccc(O)c3O)cnc2c1 1593738765 AJDQIVBPKJXRAS-UHFFFAOYSA-N 325.324 1.344 10 10 EDCE CO[C@@H](C)CN[C@H]1C[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1688950977 DMHCKCUIUFKOSY-HUBLWGQQSA-N 347.419 1.982 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1ccon1 1774050349 HTRWXIBVSHSMMX-SNVBAGLBSA-N 330.348 1.745 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H](C)n1cncn1 1699179003 XVRUJTWAUQOJFD-HNNXBMFYSA-N 345.447 1.794 10 10 EDCE CCc1c(OCCOc2ccc(N)cc2)c(=O)ccn1CCC(=O)O 1857913285 BONZMCXAIWYZHT-UHFFFAOYSA-N 346.383 1.925 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCCN=[N+]=[N-])[C@H](O)C(C)(C)C 1989789964 LFWKTVISXHSLFG-UWVGGRQHSA-N 329.401 1.713 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](N3CC(O)C3)C2)c(Br)c1 2158747520 YQXVDLBHQYNXCY-CMPLNLGQSA-N 341.249 1.758 10 10 EDCE CC(C)(C)OC(=O)N=c1[nH][nH]cc1C(=O)NCc1ccccc1O 2010183826 VMFKJQLMLUEQOJ-UHFFFAOYSA-N 332.360 1.814 10 10 EDCE Cn1ncc(CNC(=O)OC(C)(C)C)c1C(=O)N1CC(N=[N+]=[N-])C1 2010391307 PEVJVPRVWXPYNS-UHFFFAOYSA-N 335.368 1.580 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)Nc1ccc(O)cc1 2029281498 RUUZEBKBQMIFMH-UHFFFAOYSA-N 332.179 1.689 10 10 EDCE O=C(O)C[C@H](C(=O)O)N1C(=O)C(=Cc2cccs2)SC1=S 2040482550 SHXVXJRIDDKZLK-SSDOTTSWSA-N 343.407 1.877 10 10 EDCE CCOC1=NN(c2ccc(Cl)cc2)C(=O)C1=CNCC(=O)OC 2040744307 DSGLRQURYRLCII-UHFFFAOYSA-N 337.763 1.683 10 10 EDCE NCc1ccc(N2CC[C@H]3C(=O)NC[C@H]3C2)c(F)c1Br 2157192972 ZIOCAAXONRWLCW-VHSXEESVSA-N 342.212 1.619 10 10 EDCE NC(=O)C1(NCc2ccc(N)cc2)CCN(Cc2ccccc2)CC1 2036951520 DSDWVXBFAFEHNX-UHFFFAOYSA-N 338.455 1.879 10 10 EDCE CCCN1C(=O)C(=CNc2ccc(C(=O)OC)cc2)C(=O)NC1=S 2042447165 BOPOLDRYCYTRJU-UHFFFAOYSA-N 347.396 1.422 10 10 EDCE COC(=O)[C@@H](NCCCN=[N+]=[N-])c1c(C)nn(C)c1Br 2197474565 RORWBPSEVOBINB-VIFPVBQESA-N 345.201 1.995 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2060611417 SYCXTCYXMSDUFG-PWSUYJOCSA-N 349.395 1.757 10 10 EDCE CN[C@H](C)c1ccc(N2CC(CNC(N)=O)C2)cc1Br 2187295183 SQXUZMGXTAPQPM-SECBINFHSA-N 341.253 1.834 10 10 EDCE [N-]=[N+]=NC1CN(S(=O)(=O)Cc2ncsc2Br)C1 2213767750 DKAQSWQSLZLFTC-UHFFFAOYSA-N 338.212 1.730 10 10 EDCE COCC[S@@](=O)CCNCc1cc(Br)ccc1O 2085938848 OZAJRHATUMLCBL-SFHVURJKSA-N 336.251 1.639 10 10 EDCE CN(Cc1ccc(Nc2nnc(=N)[nH]n2)cc1)C(=O)OC(C)(C)C 2213786101 UJRWCEJLMHCIEJ-UHFFFAOYSA-N 331.380 1.790 10 10 EDCE CC(C)(C)CCN(CCOc1nnc(=N)[nH]n1)C(=O)OC(C)(C)C 2251509990 MJMBVWISRXDOIY-UHFFFAOYSA-N 340.428 1.731 10 10 EDCE NCc1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)c(Br)c1 2314962783 KLTHYGODKGKYOP-SKDRFNHKSA-N 331.235 1.141 10 10 EDCE CN1C(=O)/C(=C/NCCc2c[nH]c3ccccc23)C(=O)NC1=S 101749679 MINFYKLZNWMJLE-FMIVXFBMSA-N 328.397 1.057 10 10 EDCE O=C(NC[C@@H]1COc2ccccc2O1)Nc1cc(O)c(O)c(O)c1 217278940 ZXXAFERZYYGPGW-SNVBAGLBSA-N 332.312 1.765 10 10 EDCE Cc1cc(C(=O)NCc2ccc(O)c(O)c2)nn1C1CCOCC1 528863785 QFEROHHIGFEHHH-UHFFFAOYSA-N 331.372 1.884 10 10 EDCE CC(=O)NC[C@@H](C)OC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255029466 XEEBIGMFKBWJID-BMWLXYDHSA-N 332.400 1.604 10 10 EDCE CN1CCc2cc(C=c3sc(=CC(=O)C(C)(C)C)[nH]c3=O)ccc21 255585636 UYPJEXQCNCCQQQ-UHFFFAOYSA-N 342.464 1.653 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CO[C@@H](C)CN2)c(O)c1Br 2381128209 QIIPLRVWXVGSBF-GXSJLCMTSA-N 343.221 1.456 10 10 EDCE CSc1ccc(N2C[C@@H](C(=O)OCC(=O)C(C)=O)CC2=O)cc1 808500667 VHUVMJPDDFGEBW-NSHDSACASA-N 335.381 1.463 10 10 EDCE CC(C)C[C@H](CNC(=O)C(=O)N(C)Cc1ccccc1O)C(=O)O 818659094 KHRQMBQHEFOIGL-CYBMUJFWSA-N 336.388 1.214 10 10 EDCE C[C@@H]1CCN(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 725803703 OBHCUNLTQLLMOU-MRXNPFEDSA-N 331.460 1.823 10 10 EDCE COC(=O)c1cn(CCNC/C=C/c2ccc(N(C)C)cc2)nn1 835048894 CODFJMMNXYWKLH-SNAWJCMRSA-N 329.404 1.434 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CC[C@@H](C)C3)CC2)cc1F 847557633 UJESHIFFMUAAET-CQSZACIVSA-N 335.423 1.825 10 10 EDCE CCc1cnc(CC(=O)NCc2ccc(N3CCN(C)CC3)cc2)[nH]1 918840241 YAQLYPCSSMVMLV-UHFFFAOYSA-N 341.459 1.583 10 10 EDCE CCN(C)C(=O)CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852260703 ADYYUGFRXAEPPT-ZDUSSCGKSA-N 334.420 1.051 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCN(C)C(=O)C3)C2)cc1 855232188 PEHAWKCGVZABSM-KGLIPLIRSA-N 331.416 1.259 10 10 EDCE CCO[C@@H](CNCc1ccc(N2CCN(C)CC2)cc1)CN(C)C 922758100 QORDPUMBMNSGBG-IBGZPJMESA-N 334.508 1.495 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@](C)(O)C3CC3)C2)cc1 854301862 VJAHPCXEAMDIBG-KDOFPFPSSA-N 333.432 1.734 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@H](OC)[C@H]2CCOC2)cc1 855021097 ZFXBKIDVTFHTPZ-WMLDXEAASA-N 336.432 1.641 10 10 EDCE CCONC(=O)CNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 855023690 GZLDCJXQKMLDDY-UHFFFAOYSA-N 329.400 1.821 10 10 EDCE NC(=O)Nc1cccc(NS(=O)(=O)c2cc(F)cc(F)c2O)c1 753022469 XBKOZIOIICAADE-UHFFFAOYSA-N 343.311 1.962 10 10 EDCE Cc1cncn1CC(=O)NCc1ccc(N2CCC(O)CC2)cc1 862225781 GSPFMKUHSNPWKA-UHFFFAOYSA-N 328.416 1.469 10 10 EDCE CC(C)(C)[C@H](NC(N)=O)C(=O)NCc1ccc2cccnc2c1O 862026482 PZHFSZIFXHNUBR-CQSZACIVSA-N 330.388 1.640 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H]2CC[C@H]1[C@H](CN)C2 866696260 XYWWRKUDYMMPQT-LNLFQRSKSA-N 344.503 1.770 10 10 EDCE COc1cncc(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)c1 799122319 COPZGGXVXGNXPZ-UHFFFAOYSA-N 349.412 1.728 10 10 EDCE COc1ccc(CNC(=O)NCCNC(=O)c2ccccc2)c(O)c1 792795608 IAZIUEVUHHWFOJ-UHFFFAOYSA-N 343.383 1.630 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)CCc3cnn[nH]3)C2)cc1C 1317124127 ZNEVZIFXKRASMH-IYBDPMFKSA-N 343.431 1.491 10 10 EDCE CCN(C)C(=O)Cn1c(C2CC2)nnc1N(C)Cc1ccccc1O 1313554136 ZKFNHRFNDGOIBF-UHFFFAOYSA-N 343.431 1.976 10 10 EDCE O=C(O)[C@H]1CO[C@@H](CNCc2cc(Br)ccc2O)C1 714008402 MESUWEREXUHOBV-MWLCHTKSSA-N 330.178 1.734 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@H](C)n2cncn2)cc1C 1331426787 KJQJFYIBOJOFOK-HUUCEWRRSA-N 345.447 1.793 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3[C@H]4CC[C@H]3COC4)c(Br)cc21 695050202 DCEHDQOTWUDHJP-UVPNAGLESA-N 338.205 1.769 10 10 EDCE C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)N(C)Cc1ccccc1O 1332092629 BVUAOLVTKKMZLQ-XKVFNRALSA-N 332.400 1.111 10 10 EDCE CN(CCc1nccs1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1335602539 PHQKDEMBLFLBCC-UHFFFAOYSA-N 331.397 1.392 10 10 EDCE C[C@H]1CO[C@H](C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1332005348 UXXFAUUWLMDZIL-DYVFJYSZSA-N 345.443 1.430 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CC[C@@]4(CCCOC4)C3)nc12 1350354485 NVXSIRAURQXRML-INIZCTEOSA-N 332.360 1.136 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2CCC(=O)N2)cc1C 1283581426 HMODVHPKRCRTBM-UKRRQHHQSA-N 333.432 1.219 10 10 EDCE Cc1cnn(Cc2cc(C(=O)NCc3cc(O)ccc3O)no2)c1 1455357536 SSBWLMKNHWWQAY-UHFFFAOYSA-N 328.328 1.569 10 10 EDCE Cc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1S(N)(=O)=O 1463710934 KGLOJHZLFLMMIA-UHFFFAOYSA-N 336.369 1.235 10 10 EDCE CC(=O)N/C(=C\c1cccs1)C(=O)NCc1ccc(O)c(O)c1 1465953339 FLKGUIMGJKYSKZ-JYRVWZFOSA-N 332.381 1.953 10 10 EDCE CCN(CCCNC(=O)COC)C(=O)c1ccc(N=NC(N)=O)cc1 1703682349 XNMPZQZEIBGKSL-UHFFFAOYSA-N 349.391 1.464 10 10 EDCE CS(=O)(=O)C1CC(NC(=O)NCc2cccc(Cl)c2O)C1 1615572980 HQGGROLBSCLDMD-UHFFFAOYSA-N 332.809 1.420 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H]2CCN(C)C2=O)cc1C 1483258483 RPAGDUQZRHNYLY-DZGCQCFKSA-N 333.432 1.076 10 10 EDCE CCOCCN[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1C 1717293134 HHJSGOCIWKCGKH-WFASDCNBSA-N 347.419 1.936 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H]2CC(=O)N(C)C2)cc1C 1715977954 HCKBMBYJHJJALI-ZFWWWQNUSA-N 333.432 1.076 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@@H]2CCNC(=O)C2)cc1C 1491433138 ZGRGAZZBVYFAKY-DZGCQCFKSA-N 333.432 1.124 10 10 EDCE Cc1ccc(S(=O)(=O)CCC(=O)NCc2ccc(O)cc2O)cc1 1639441588 ZFOJSUKOIDQZBP-UHFFFAOYSA-N 349.408 1.886 10 10 EDCE COC[C@@H](C)NC[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1732371545 BUWJQEXCKLRRIV-VXGBXAGGSA-N 335.408 1.839 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2ccc[nH]2)cc1C 1734505170 FWJVXCPLJFYWIP-HNNXBMFYSA-N 331.416 1.554 10 10 EDCE COC(=O)[C@@H](C[C@H]1CCCOC1)NC(=O)Cc1ccc(O)c(O)c1 1648734813 YHFBOOAYQFNAPC-CHWSQXEVSA-N 337.372 1.115 10 10 EDCE Cc1ccc(S(C)(=O)=O)cc1C(=O)NCc1c(O)cccc1O 1647177664 FZOYYLMUTJFDJW-UHFFFAOYSA-N 335.381 1.740 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H](C)SC)cc1C 1667790558 YFCCQHJQPSRQHE-TZMCWYRMSA-N 326.462 1.322 10 10 EDCE C[C@@H](NC(=O)NCc1cc(=O)n2ccccc2n1)c1ccccc1O 1683711938 NUAFLNTVPLBPPR-GFCCVEGCSA-N 338.367 1.961 10 10 EDCE CC[C@H](CNC(=O)c1cnc(O)n1C)NCc1ccc(OC)c(C)c1 1698609571 PQJZIWLNUIIHJZ-CQSZACIVSA-N 346.431 1.741 10 10 EDCE COC(=O)NC[C@H]1CCN1c1ccc(CN)c(Br)c1 2130738690 VGGHVRWPYHAHOG-LLVKDONJSA-N 328.210 1.843 10 10 EDCE C[C@H](CO)N(Cc1ccccc1)c1cc2c(cc1N)OCC(=O)N2 1914366610 VUIJBIYKYKXFRV-GFCCVEGCSA-N 327.384 1.987 10 10 EDCE CNCc1ccc(N2C[C@H](C)O[C@@H](CO)C2)c(Br)c1 234380569 GPIHNYMGMGWWDH-CMPLNLGQSA-N 329.238 1.755 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1NCc1ccc(O)cc1O 1943955393 QXYZVACTYPVEMF-KGLIPLIRSA-N 338.404 1.870 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C[C@]1(O)CCN(C(=O)OC(C)(C)C)C1 2010394885 FWLLSROSQPJJRF-OAHLLOKOSA-N 341.412 1.907 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])CCOC1 2010405015 FAJOLXGOKIZGLI-ABAIWWIYSA-N 339.396 1.972 10 10 EDCE COc1ccc(N2CCNC[C@H]2C(=O)O)c(OC)c1Br 2162632680 SHWBJXVCFLCDMJ-VIFPVBQESA-N 345.193 1.329 10 10 EDCE CO[C@H]1CN(Cc2c(O)cccc2Br)C[C@H]1C(=O)O 706627964 JWUZLUOBIWOXQR-SKDRFNHKSA-N 330.178 1.686 10 10 EDCE CCN1CCOC[C@@H]1CC(=O)NCc1c(O)ccc2c1CCCC2 2062689657 MQAGKHIGKMZRPY-HNNXBMFYSA-N 332.444 1.998 10 10 EDCE COc1cccc(CNC(=O)c2ccc(C3(O)COC3)cc2)c1O 2063482424 KMBHGGGIJKNMQK-UHFFFAOYSA-N 329.352 1.549 10 10 EDCE O=C1NCC2(CCN(Cc3c(O)cccc3Br)CC2)N1 1140102959 ANGJKLCAYPFDMV-UHFFFAOYSA-N 340.221 1.802 10 10 EDCE CO[C@@H]1CN(Cc2cc(N)ccc2O)C[C@@H]1NC(=O)OC(C)(C)C 1908013610 UCKYDQWGUYWETR-DZGCQCFKSA-N 337.420 1.698 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CN(CC(=O)Nc3ccc(N)cc3)C2)C1 2044615736 NTFLIEBLQYTMJL-UHFFFAOYSA-N 346.431 1.760 10 10 EDCE CN1CCO[C@@H]2CCN(c3ccc(CN)cc3Br)C[C@@H]21 2185491722 HDGRHVJMXDNTNN-LSDHHAIUSA-N 340.265 1.817 10 10 EDCE O=C(N=c1[nH]nc(Cl)cc1Br)c1cc(O)nc(O)c1 2102658648 LKFUIUXGTXXJKO-UHFFFAOYSA-N 345.540 1.373 10 10 EDCE NCc1ccc(N2CCN3C(=O)OC[C@H]3C2)c(Br)c1 2114271920 MKIUYADOUMBYFY-SNVBAGLBSA-N 326.194 1.549 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210536665 HWQWDABXWCNVRP-ZDCRXTMVSA-N 327.385 1.608 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CC[C@@H](C(N)=O)C2)c1O 2236031064 ITNZKJGRSOYMEU-BDAKNGLRSA-N 343.221 1.907 10 10 EDCE COc1ccc(Br)c(CN(C)C(C)(C)C(N)=O)c1O 2227775935 BZQRRQRTPDSORT-UHFFFAOYSA-N 331.210 1.859 10 10 EDCE CSc1ncc(CNc2ccc(N)cc2S(N)(=O)=O)s1 2284697182 FIVYLMIJJBDCPY-UHFFFAOYSA-N 330.460 1.707 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2329326115 MELQUKUGBSFLIO-QKNQZSKASA-N 327.222 1.399 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)[C@H](C)COC)cc2F)CC1 106702708 AGGGCSRRDAFJMM-CQSZACIVSA-N 337.439 1.866 10 10 EDCE CNS(=O)(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCCCC1 62370886 XAOZHJLXBKUVLM-INIZCTEOSA-N 340.493 1.333 10 10 EDCE CCN(CC)c1nc(N)nc2c1ncn2[C@H]1C[C@H](N=[N+]=[N-])[C@@H](CO)O1 32036817 SBKVJGRLAWSUAC-IVZWLZJFSA-N 347.383 1.213 10 10 EDCE COc1cc(N2CCN(CCNC(C)C)CC2)cc(OC)c1OC 193497263 LHARJTDNOOKQEO-UHFFFAOYSA-N 337.464 1.832 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)CC(=O)NC2CC2)c([N+](=O)[O-])c1 229940041 RWWYRVQSLOQCPE-YWEYNIOJSA-N 333.344 1.496 10 10 EDCE CN1C[C@@H](NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)CCC1=O 255771529 MUNXXFSKSRDZTD-FAOGRTBUSA-N 343.427 1.273 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2CCSc3ccncc32)c1 255378534 LAQXMQAOZIRKAV-IHWYPQMZSA-N 340.408 1.988 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CC[C@@H](CC(N)=O)C3)ccc21 367882448 COPBZZDPYJSBEI-AWEZNQCLSA-N 330.432 1.476 10 10 EDCE CO[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC[C@@H]1C 276260340 MQOOCBUECGYMHO-IINYFYTJSA-N 342.417 1.261 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCCC[C@H]2[C@@H]2CNC(=O)C2)c1O 373209245 KIDNSVISXZCJFC-STQMWFEESA-N 349.387 1.800 10 10 EDCE Cc1ccc(CN(C)C(=O)c2n[nH]c(=N)[nH]2)c(O)c1Br 2380785239 BDMGEXSPNDZIQC-UHFFFAOYSA-N 340.181 1.266 10 10 EDCE COC(=O)C[C@H]1C(=O)NCCN1Cc1cc(Cl)c(F)cc1O 294936107 PCUKEBIKRRDTRA-NSHDSACASA-N 330.743 1.048 10 10 EDCE O=C(CCn1cncn1)NCc1cc(Br)ccc1O 804734419 KNRWCTJNJPLCLP-UHFFFAOYSA-N 325.166 1.453 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](C)SCC(=O)Nc1ccc(F)cc1 808494297 MSYSTXGOAJGIHC-SNVBAGLBSA-N 341.360 1.587 10 10 EDCE CC(C)n1cc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)nn1 814102971 KVTNYUCWSYZVNB-UHFFFAOYSA-N 343.431 1.968 10 10 EDCE C[C@H]1[C@@H](O)CCCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823523295 CLYZIRICGZZILM-KSSFIOAISA-N 347.459 1.703 10 10 EDCE Cn1cc(CCC(=O)NCc2cccc(Br)c2O)nn1 834476380 WUNCPAQOANVYJL-UHFFFAOYSA-N 339.193 1.532 10 10 EDCE CC[C@@H]1[C@H](CO)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1 837818057 XYKHUIQCEDKWMH-FUHWJXTLSA-N 347.459 1.826 10 10 EDCE CN(C)c1ccc(/C=C\CN[C@H]2CCN(c3cnn(C)c3)C2=O)cc1 835041670 ZFGHNRBMJCNIIT-XDXAGZTOSA-N 339.443 1.894 10 10 EDCE COC[C@](C)(CCO)NCc1ccc(N2CCOCC2)c(F)c1 749923678 XKCGVFMAPAOEFD-KRWDZBQOSA-N 326.412 1.539 10 10 EDCE C[C@@H](N)CNC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 841866688 NJJNLZXLIJKGFH-OAHLLOKOSA-N 345.491 1.365 10 10 EDCE COc1ccc2c(n1)N(C)CCN2C(=O)/C=C(\C)c1cnccn1 928398026 AIWDRLMOSLDZTH-ZRDIBKRKSA-N 325.372 1.767 10 10 EDCE C[C@H]1CCN(CC(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 856216280 TXPPBJKCOLZSFO-HNNXBMFYSA-N 331.460 1.606 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cc3ccc(O)nc3)C2)cc1 855224734 GWBPBRVHJDJDPS-CQSZACIVSA-N 327.384 1.733 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](N)Cc3ccccc3)C2)cc1 851639895 MTFUHHNKAOZTAT-LPHOPBHVSA-N 339.439 1.960 10 10 EDCE COC[C@@]1(C)CN(Cc2ccc(N3CCN(C)CC3)cc2)CCO1 862550555 FKQHRAIPJDUGAO-LJQANCHMSA-N 333.476 1.676 10 10 EDCE C[C@H](NC(=O)NC[C@@H]1COC2(CCOCC2)O1)c1ccccc1O 868481053 IWOUMGFUEQKBFT-QWHCGFSZSA-N 336.388 1.675 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2 865315177 IREKCNUBQMWDRL-NTLKJNNPSA-N 328.368 1.580 10 10 EDCE NC(=O)N1CCC(NCc2ccc(N3CCC(CO)CC3)cc2)CC1 1116289455 WLDRBXNFOXSOQC-UHFFFAOYSA-N 346.475 1.528 10 10 EDCE CC(C)(O)C[C@H](O)CNCc1ccc(N2CCOCC2)c(F)c1 872200956 NTIZOSXIYPIXDM-AWEZNQCLSA-N 326.412 1.274 10 10 EDCE C[C@H]1C[C@@H](O)CN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 889663529 RIMRHCVANMMPBU-MAUKXSAKSA-N 346.475 1.351 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1[C@@H]2CCCO[C@@H]21 780388858 FBZRBDVPDFTUGZ-QGTPRVQTSA-N 348.418 1.828 10 10 EDCE CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1cc2cc(O)c(O)cc2s1 897268554 MIBXKRSSIZFLQN-ZJUUUORDSA-N 334.397 1.957 10 10 EDCE C[S@@](=O)C1(CNC(=O)c2cc3cc(O)c(O)cc3s2)CC1 897663210 BFHZGGWTRZLKKR-OAQYLSRUSA-N 325.411 1.953 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@H](C)C2(S(C)(=O)=O)CC2)c1 797069582 HEBIXEMIUQMPHT-WDEREUQCSA-N 341.429 1.795 10 10 EDCE Cc1c(CN(C)c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)cnn1C 790294174 DJOAHAQLBTWFEV-UHFFFAOYSA-N 331.332 1.604 10 10 EDCE CC(C)S(=O)(=O)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1141754466 PDUFETFSRLLQTL-UHFFFAOYSA-N 326.378 1.402 10 10 EDCE COC1=C(C(=O)O)NC(=S)N[C@@H]1c1ccc(N2CCCC2)cc1 76260608 KDYOLVVRBVPTHI-GFCCVEGCSA-N 333.413 1.748 10 10 EDCE C[C@@H](c1ccccn1)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329353087 OYTNATAZDARKGS-LBPRGKRZSA-N 325.368 1.849 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1 1332389994 JXJFFSPFJPDHQF-CEXWTWQISA-N 331.460 1.727 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)C[C@]2(C)CO)cc1Br 698136294 FZGPXVUUTRIXQZ-NURSFMCSSA-N 329.238 1.791 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)C[C@]2(C)CO)c(Br)c1 698159135 XDQLDBRQFQNASB-NURSFMCSSA-N 330.222 1.824 10 10 EDCE CC[C@]1(C(=O)O)CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332447948 ZRFTULQUMZRYAR-SFHVURJKSA-N 346.383 1.338 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2CCC(=O)N2C)cc1C 1267141945 MNJNALHJXDATIG-GOEBONIOSA-N 347.459 1.609 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2ccc(C(N)=O)o2)cc1C 1268652662 JPGIWKRMEOSZHD-GFCCVEGCSA-N 345.399 1.604 10 10 EDCE CCOC(=O)c1cn(CCNC(=O)/C=C\c2ccc(O)c(O)c2)cn1 1297287709 HQEVDGBFSHJSAS-XQRVVYSFSA-N 345.355 1.301 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)NCc1cccc(O)c1O 1521852029 RMPJMXNOYICDNJ-IMRBUKKESA-N 348.399 1.827 10 10 EDCE C/C(=C/C(=O)N(C)c1ccccc1S(C)(=O)=O)c1cnccn1 1524280008 ALBYOTYLSKFPNZ-BENRWUELSA-N 331.397 1.946 10 10 EDCE COCC(=O)N[C@H](C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1701980054 LZNWWWJXCODCFM-MNOVXSKESA-N 349.391 1.509 10 10 EDCE COc1ccc(-n2nnnc2CN2CC[C@@H]2CNC(=O)C(C)C)cc1 1716644430 VUPVSNOYLIKCGZ-CQSZACIVSA-N 344.419 1.017 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H]2CCC(=O)NC2)cc1C 1715237691 BJOLRYMGISQJQM-BBRMVZONSA-N 347.459 1.372 10 10 EDCE O=C1N[C@@H]2CN(C(=O)c3cc4cc(O)c(O)cc4s3)CC[C@H]2CO1 1632085526 BLBPMHPHLYDXGU-WCBMZHEXSA-N 348.380 1.883 10 10 EDCE O=C(NCc1ncc(C(F)(F)F)cn1)c1c(F)ccc(O)c1O 1638708630 HPNXQZWQRDIJBS-UHFFFAOYSA-N 331.225 1.976 10 10 EDCE CC(C)C(=O)NCC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1721381815 JFEAXSXWUYWKJR-UHFFFAOYSA-N 331.376 1.693 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(C)CCCS1(=O)=O 1632681240 NXJQLXMBSYLQTL-MEBBXXQBSA-N 327.402 1.112 10 10 EDCE C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1570632005 DAUDKGLIIWWGHU-LLVKDONJSA-N 346.391 1.041 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2conc2C)cc1C 1732654213 VCTBRZTZZFNARJ-CQSZACIVSA-N 333.388 1.181 10 10 EDCE CC1=C(C(=O)NCc2ccc(N(C)C)cc2C)Cn2nnnc2N1C 1585788301 UJSSXWMKYXTDBO-UHFFFAOYSA-N 341.419 1.088 10 10 EDCE CC(C)[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H](C)O 1667525098 QDEOGAZLAHRCFV-RISCZKNCSA-N 335.408 1.574 10 10 EDCE CCOc1cc(C2=NN=C3C4CCN(CC4)[C@H]23)cc([N+](=O)[O-])c1O 169962658 NAQCHMJKCXHVQY-HNNXBMFYSA-N 330.344 1.952 10 10 EDCE CCOC(=O)N1CCC(NC(=O)[C@H](C)Oc2ccc(N)cc2)CC1 1860082792 UGICOLRYPDJQOC-LBPRGKRZSA-N 335.404 1.773 10 10 EDCE O=C(NCCNCc1ccc(O)c(O)c1O)OCc1ccccc1 1929069146 DTZAVTJWHIADDU-UHFFFAOYSA-N 332.356 1.819 10 10 EDCE NC(=O)CN1CCC(NCc2cccc(Br)c2O)CC1 48797068 NABYQBQMAVSZJA-UHFFFAOYSA-N 342.237 1.194 10 10 EDCE C[C@@H](c1cc(Br)ccc1O)N1CC[C@]2(CNC(=O)N2)C1 2177680595 OHAXWWYNHRJNEE-XPTSAGLGSA-N 340.221 1.973 10 10 EDCE CCN1CC[C@@H](N(C)C(=O)c2cnn3c(O)cc(C)nc23)C[C@@H]1C 2062083920 AHWLGUQVFGJAOL-QWHCGFSZSA-N 331.420 1.688 10 10 EDCE COC(=O)c1cnn(Cc2c(O)cccc2Br)c1N 2070447468 SRBGVUVUZJKCHZ-UHFFFAOYSA-N 326.150 1.768 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NCc2ccc(O)c(O)c2)C1 1908634689 PFSPBKXKCVNXDG-CHWSQXEVSA-N 338.404 1.558 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(NC(=O)c2cccc(O)c2O)C1 2216762683 KVLXQFLRULWPFF-BMLIUANNSA-N 334.372 1.837 10 10 EDCE COCCN1CCN(c2ccc(C=CC(=O)OC)cc2[N+](=O)[O-])CC1 2296857159 KNAVMDIOGJGMFB-UHFFFAOYSA-N 349.387 1.549 10 10 EDCE Cc1cc(C=C2C(=O)NC(=O)N(Cc3ccco3)C2=O)c(C)n1C 2297335239 QVLSRGJWCRBMDD-UHFFFAOYSA-N 327.340 1.897 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@]1(CO)CCN(C(=O)OC(C)(C)C)C1 2300530641 UHLAPIPLBVRQQK-OAHLLOKOSA-N 341.412 1.765 10 10 EDCE CN1CCCc2cc(CNC(=O)N[C@@H]3CCc4ncnn4C3)ccc21 112746910 BPHKLEXRGBQGLT-OAHLLOKOSA-N 340.431 1.475 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC(=O)NCC1CC1 183799375 UQSJYSXTXCINDV-UHFFFAOYSA-N 332.448 1.810 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(F)(F)[C@H](CO)C3)cc2N1 404049562 XQMQKBQHGAWHTM-QMMMGPOBSA-N 343.286 1.380 10 10 EDCE CC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(O)cc2F)s1 228651516 KJGPQYHLUWGXMV-UHFFFAOYSA-N 332.338 1.142 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1ccc(C(F)F)n1 528997843 ZSVKGLNNJNBOEA-SECBINFHSA-N 325.315 1.979 10 10 EDCE CN1C(=O)[C@H](N=N[C@@H]2CCC[C@H]([N+](=O)[O-])C2)[C@H](O)[C@@H]2CCCC[C@@H]21 299804212 IWFZIMAGKPMOOH-ARSDKDGVSA-N 338.408 1.787 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccnn1CC(F)(F)F 295620415 ZTBRGKWSGNMUKK-UHFFFAOYSA-N 329.278 1.829 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@]12C[C@H]3C[C@@H](C(=O)N1)[C@H]2C3 649789130 MUBCRPNWVCWPPI-ABTXLKSRSA-N 341.411 1.393 10 10 EDCE CCOc1cccc(CN2CCN(S(C)(=O)=O)[C@H](C)C2)c1O 827270946 HFHKMPDZAYZEMM-GFCCVEGCSA-N 328.434 1.257 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3cc(Cl)cc(C)c3O)C[C@@H]12 827388447 FNNDIFHSKWBJDP-MJBXVCDLSA-N 345.848 1.598 10 10 EDCE CO[C@]1(CN[C@H](C)c2cc(F)cc(F)c2O)CCS(=O)(=O)C1 903365420 NECSUHZGBINNTO-OTYXRUKQSA-N 335.372 1.525 10 10 EDCE O=C1N(Cc2ccc(N3CCOCC3)c(F)c2)C(=O)C23CC(CN12)C3 849351157 CQQYZLQSOQXIRA-UHFFFAOYSA-N 345.374 1.589 10 10 EDCE C[C@@H](NC(=O)N[C@H](C)c1nnc(O)n1C)c1ccc(N(C)C)cc1 922050597 CTOOKGMUEFSRHJ-GHMZBOCLSA-N 332.408 1.708 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc([N+](=O)[O-])n3C)C2)cc1 855228765 GCXIDPNBVMMGGM-GFCCVEGCSA-N 344.371 1.951 10 10 EDCE CNC(=O)C[C@@H](C)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852374743 XQCGHVSPQHERSQ-OLZOCXBDSA-N 334.420 1.098 10 10 EDCE CC(C)c1ncc(S(=O)(=O)NNc2nc3cccnc3s2)[nH]1 857225164 HECORERIZPIJGT-UHFFFAOYSA-N 338.418 1.843 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCOC[C@@H]1CCO 758360990 IOKOZWBJMQTDHB-KRWDZBQOSA-N 333.432 1.580 10 10 EDCE Cn1cc(-c2nn(C)cc2C(=O)N2CCc3nc(F)ccc32)cn1 857893815 NCCSPTBOSJCYTB-UHFFFAOYSA-N 326.335 1.558 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H]2COC[C@H]2C1 850626135 MYHOAXIADBAYBS-JKSUJKDBSA-N 346.427 1.626 10 10 EDCE NC(=O)Nc1ccc(NS(=O)(=O)c2cc(F)cc(F)c2O)cc1 753015238 BRYINTKFBDRZBF-UHFFFAOYSA-N 343.311 1.962 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cn(C)c(C)cc3=O)C2)cc1 855224965 MHDDUWAJJWQHSE-AWEZNQCLSA-N 341.411 1.711 10 10 EDCE C[C@H]1C[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCN1C 856213363 IYGGYHNNXCIERF-RDJZCZTQSA-N 345.487 1.994 10 10 EDCE O=C1[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CCN1C1CCC1 863540160 ROGXBAYVXANOHO-AWEZNQCLSA-N 343.383 1.310 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H](Cc3ccccn3)C2=O)cc1F 761182143 XESWIFNMUFRXCT-OAHLLOKOSA-N 342.374 1.950 10 10 EDCE Cc1cnc(C(=O)NCc2ccc(N3CCOCC3)cc2)c(O)c1 763248668 GNCGMSHCFFMAJB-UHFFFAOYSA-N 327.384 1.862 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2c(O)cccc2F)c1 770864455 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1.701 10 10 EDCE OC[C@@H]1[C@@H](O)[C@@H](c2ccc(F)cc2)CN1Cc1cccc(F)c1O 1615116388 DWAGXWJYMAWLHU-KYJSFNMBSA-N 335.350 1.992 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C[C@@H]1CCC(=O)NC1 1540536712 OWOLKVBRNPNTGJ-INIZCTEOSA-N 345.443 1.398 10 10 EDCE CC[C@@H](CNC(=O)c1cn(C)nn1)NCc1ccc(OC)c(C)c1 1714069477 BRSGESCJBQQVMR-AWEZNQCLSA-N 331.420 1.430 10 10 EDCE CCOCCN[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1C 1717293132 HHJSGOCIWKCGKH-DOMZBBRYSA-N 347.419 1.936 10 10 EDCE CNc1cnc(C(=O)NCc2cccc(Br)c2O)cn1 1635839763 LGSOFMPYDVTYKC-UHFFFAOYSA-N 337.177 1.916 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)C=C(C)C)C2)cc(OC)n1 1720817578 FQBZISBMPDKWJX-BETUJISGSA-N 333.388 1.442 10 10 EDCE Cc1noc(COc2ccc(C(=O)NCc3ccccc3O)cn2)n1 1630362879 AMMOYZUFJVXTJH-UHFFFAOYSA-N 340.339 1.988 10 10 EDCE CCOC(=O)N1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1567783022 UECPWIVFAPSKMR-LBPRGKRZSA-N 333.348 1.810 10 10 EDCE COc1cc(C(=O)N[C@H](C)C[C@H](C)NC(=O)C2CC2)cc(OC)n1 1572628325 MOBHUNUEBYGVHL-WDEREUQCSA-N 335.404 1.522 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CC[C@H](O)CC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 837713729 FMVHHADIVVNUJB-LBPRGKRZSA-N 328.359 1.579 10 10 EDCE CCOC(=O)[C@H]1CCCN(CC(=O)N2Cc3cccc(O)c3C2)C1 913725976 FNIKKAUCUFXHQZ-AWEZNQCLSA-N 332.400 1.510 10 10 EDCE CCO[C@@H]1C[C@@H](NC(=O)c2c(F)ccc(O)c2O)[C@H]1n1cccn1 832932923 DGZWAUSSORPFGX-MPKXVKKWSA-N 335.335 1.582 10 10 EDCE COc1cc(O)c(CN2CCNC[C@@H]2c2cccnc2)cc1OC 843116168 MLYLQZTYBNRWAY-OAHLLOKOSA-N 329.400 1.951 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3CCC4(COC4)C3)CC2)cc1 852683750 RRFLBJFPDLAQAS-UHFFFAOYSA-N 345.443 1.066 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCNC(=O)CC3)C2)cc1 855225796 MEWIZADYINVKIX-UONOGXRCSA-N 331.416 1.306 10 10 EDCE C[C@H](NC[C@H](O)CS(C)(=O)=O)c1cc(Cl)c(Cl)cc1O 927024440 KNSAFQQQYRFQDN-YUMQZZPRSA-N 342.244 1.755 10 10 EDCE CN1C[C@@H](CCNC(=O)NCc2cc(Cl)ccc2O)CC1=O 924757844 WEHZGAIHZAFJAY-JTQLQIEISA-N 325.796 1.713 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CNC[C@H]3CCCO3)C2)cc1 851639521 HBFUKKYMUIDXDS-RHSMWYFYSA-N 333.432 1.159 10 10 EDCE 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[N-]=[N+]=NC[C@H]1CCCN1C[C@H](O)CN1C(=O)c2ccccc2C1=O 1885288123 TWFDRNQAJKBYIS-NEPJUHHUSA-N 329.360 1.418 10 10 EDCE C[C@@H](C1CCN(C)CC1)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329785912 HIFJSFPEQSJMCN-ZDUSSCGKSA-N 345.443 1.423 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(CNCc2ccc(O)c(O)c2)CCOC1 688913038 RRCIQKQDWQRDJA-QGZVFWFLSA-N 338.404 1.871 10 10 EDCE C[C@H](NC(=O)C(=O)N1C[C@H]2COC[C@@]2(C)C1)c1ccc(N(C)C)cc1 1330967341 AZRZSLHRZUMVKP-ZUEVXXBESA-N 345.443 1.425 10 10 EDCE COc1nc(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)co1 1266959820 XMJSOVKDOUWQLT-GFCCVEGCSA-N 333.388 1.908 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)C2CC3(C2)CS(=O)(=O)C3)c1 1351666707 NYCMOMNIEMHFSH-SNVBAGLBSA-N 339.413 1.403 10 10 EDCE CCCC(=O)N[C@@H](C)C[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1512188519 CZIRZSHREUTKPF-NWDGAFQWSA-N 337.420 1.912 10 10 EDCE C[C@@H]1C[C@H](C(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)CO1 1283079815 YJDLMNWMHPIWID-PWSUYJOCSA-N 347.375 1.120 10 10 EDCE CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1293690604 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24544073 AEKZDOWPVQUPHV-GXDHUFHOSA-N 333.413 1.619 10 10 EDCE CN1CCc2cc(CNC3CCN(S(=O)(=O)C4CC4)CC3)ccc21 124546702 WJLMAJVZUQBKFN-UHFFFAOYSA-N 349.500 1.725 10 10 EDCE C[C@H]1COCC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 194076213 YERHINZRPVGZFO-ZFWWWQNUSA-N 336.407 1.951 10 10 EDCE CCNC(=O)N1CC[C@@H](N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 90409781 DMZBNQUOQSJPPN-NVXWUHKLSA-N 346.475 1.978 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC(OC)C3)c(Br)cc21 382101043 ORPFXDQZDGHGOZ-LBPRGKRZSA-N 326.194 1.497 10 10 EDCE CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)C(C)=O)cc1 808495900 SPEGCCCTOZSFBA-SNVBAGLBSA-N 341.385 1.078 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)C[C@@H](OC)C2CC2)c1 827195305 YPUJATFBDWUBCR-ZUZCIYMTSA-N 329.418 1.806 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CCCN(c2cccnn2)C1 588404813 SUZAJMNXGYNYMT-IQCBXXCUSA-N 340.383 1.686 10 10 EDCE COC[C@@](C)(O)CCNC(=O)NCc1ccc(N2CC=CC2)cc1 836320508 MZKXCGICWDNRCH-SFHVURJKSA-N 333.432 1.650 10 10 EDCE O=C(NCC1=CCOCC1)NCc1ccc(N2CCOCC2)c(F)c1 836240813 JWYKRJGZBZQLGL-UHFFFAOYSA-N 349.406 1.808 10 10 EDCE COc1ccc(N2CC[C@H](CN3C(=O)N4CC5CC4(C5)C3=O)C2)cc1 849357635 RXMTWVDHWDPJRY-CDJWAVJASA-N 341.411 1.948 10 10 EDCE CCC[C@@H](C)[C@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 846359023 GFSOVGKYVRINSR-MFKMUULPSA-N 344.433 1.291 10 10 EDCE COC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NCCc2ccc(N)cc2)C1 841881022 MQZFFEORBSRIDQ-HIFRSBDPSA-N 348.447 1.977 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CC[C@@H](C(=O)O)O3)C2)cc1 849182608 HAPSCASXDYKPQT-CQDKDKBSSA-N 334.372 1.022 10 10 EDCE C[C@@H](CC(=O)N(Cc1ccco1)Cc1ccccc1O)NC(N)=O 847570516 QIBCUIWNNOOLIG-LBPRGKRZSA-N 331.372 1.961 10 10 EDCE Cc1ccn(C[C@@](C)(O)C(=O)NCc2c(O)cccc2F)c(=O)c1 928707467 FAQALFSUWZOWAZ-QGZVFWFLSA-N 334.347 1.069 10 10 EDCE C[C@@H](NC(=O)NC1C[C@@H]2CC[C@H](C1)S2(=O)=O)c1ccccc1O 927322187 GXJHYRJCPKTHDU-ODWCKFRGSA-N 338.429 1.861 10 10 EDCE O=C1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)C2(CN1)COC2 921794312 LBUQYRMDNHFYRG-UHFFFAOYSA-N 348.380 1.044 10 10 EDCE CC1CCN(c2ccc(CNC(=O)C3=NO[C@H](CN)C3)cc2)CC1 852866215 GSLLJSWFWHTPLR-INIZCTEOSA-N 330.432 1.643 10 10 EDCE OCCO[C@]1(CNCc2c(O)cccc2Br)CCOC1 858187911 LMSJIGIWUQUSCR-AWEZNQCLSA-N 346.221 1.412 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2C[C@@H]3[C@@H](C2)[C@H]2CC[C@H]3CN2)c1O 863650898 BOGOOWPUXSWCIW-SCUASFONSA-N 333.388 1.739 10 10 EDCE CCCC(=O)NCC(=O)NCc1cccc(Br)c1O 765732103 PLWIZOWSUKCBCI-UHFFFAOYSA-N 329.194 1.687 10 10 EDCE O=C1O[C@H]2CNC[C@H]2N1[C@H]1CCN(Cc2cc(Cl)ccc2O)C1 872255564 ZFWJLHLGRAJNKF-GUTXKFCHSA-N 337.807 1.413 10 10 EDCE C[C@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccccc1O 783535334 LVQURFXMJJBAGF-ZFWWWQNUSA-N 328.416 1.968 10 10 EDCE C[C@@H](NC(=O)N1CC[C@]2(CNC(=O)C2)C1)c1ccc(N(C)C)cc1 789213735 SCYFFBVHCIOGRA-ACJLOTCBSA-N 330.432 1.735 10 10 EDCE CCN(CC)c1ccc(CN2CCC(O)(COCCO)CC2)cc1 895827331 NRSABTREWAFFOH-UHFFFAOYSA-N 336.476 1.869 10 10 EDCE C[C@@H]1C[C@]2(CC[C@H](CNC(=O)c3c(F)ccc(O)c3O)O2)CO1 899476901 AOHZYRMKCSLMFE-XIZWVBILSA-N 325.336 1.693 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C/C(C)C)nc12 785034479 HTVIYFBCPIEKKA-AATRIKPKSA-N 333.344 1.867 10 10 EDCE C[C@@H]1CO[C@@H](C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 891515531 OBWLLMDQLXJGIV-XHDPSFHLSA-N 340.370 1.843 10 10 EDCE Cc1c(CN(C)CC(=O)N(C)Cc2ccc(N(C)C)cc2)cnn1C 790446023 MTBVEIYROURDQA-UHFFFAOYSA-N 343.475 1.885 10 10 EDCE COc1cc(NS(=O)(=O)c2ccc(O)c([N+](=O)[O-])c2)ccc1O 797819615 OYOZJNNXGAXUAF-UHFFFAOYSA-N 340.313 1.815 10 10 EDCE CONC(=O)C1CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 1307203142 QGZZEIHJRRRZKS-UHFFFAOYSA-N 339.348 1.506 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@](C)(O)[C@@H](O)C2)cc1Br 1893330956 GOTYXHNCWZRQDJ-HERUPUMHSA-N 329.238 1.791 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1ccnn1C 1265872925 JLHMIQRFGJKPPR-LLVKDONJSA-N 343.391 1.491 10 10 EDCE COCCC(=O)N(C)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1358716576 SBALJWFDOIDTRO-UHFFFAOYSA-N 347.375 1.168 10 10 EDCE CCNC(=O)CC(=O)N1C[C@@H](C)[C@@H](NCc2ccc(OC)c(C)c2)C1 1281389242 DJWLLBWCCRIAFJ-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE O=C(CCN1CSCCSC1)NCCc1ccc(O)c(O)c1 1445936915 HLYYYQIZRHOJOA-UHFFFAOYSA-N 342.486 1.844 10 10 EDCE C[C@H]1CCCN(c2ccc(CNC(=O)C3(O)COC3)cc2Cl)C1 1297009124 BYJCGEZUPVULGM-LBPRGKRZSA-N 338.835 1.954 10 10 EDCE O=C(CCN1CC[C@@H](F)C1)NCc1ccc(N2CCOCC2)cc1 1626698989 UDGXCLLNNNYCEB-MRXNPFEDSA-N 335.423 1.573 10 10 EDCE CCn1ncc(C(=O)N[C@@H](C)CCNCc2ccc(OC)c(C)c2)n1 1716138176 ZUFMJHOHBYIMTL-AWEZNQCLSA-N 345.447 1.913 10 10 EDCE C[C@@H]1CCS(=O)(=O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1625135306 LXXAKZBYGKMEOK-SNVBAGLBSA-N 338.389 1.498 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@@H](c2nn[nH]n2)C1 1632775343 KMCQYHROUIUTIR-SNVBAGLBSA-N 347.356 1.039 10 10 EDCE Cn1c(=O)c2ccc(NC(=O)c3cc(O)cs3)cc2n(C)c1=O 1652293219 SEMUFHARNWIWAX-UHFFFAOYSA-N 331.353 1.257 10 10 EDCE Cc1nc(O)c2ccc(C(=O)NCc3cc(O)ccc3O)cc2n1 1593881156 GQLBMGVRUOODAK-UHFFFAOYSA-N 325.324 1.985 10 10 EDCE Oc1cccc(Br)c1CN1CCO[C@H]2CCNC[C@@H]21 2129072079 OSHLIBQQBTVQFS-JSGCOSHPSA-N 327.222 1.717 10 10 EDCE CC(C)NCc1ccc(N2CC(CO)(CO)C2)c(Br)c1 1914984968 HFMDRUXSPYKZSB-UHFFFAOYSA-N 343.265 1.738 10 10 EDCE CN(C)[C@@H]1COC[C@@H]1CNCc1cc(Br)cc(F)c1O 1924641111 PCSXVZHENBGIBW-GXFFZTMASA-N 347.228 1.960 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCC[C@H](CO)C3)c(Br)cc21 252607754 RRRRQHHEILKXHS-SDBXPKJASA-N 340.221 1.610 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)NCCCCN=[N+]=[N-])C1 1986341129 UWIVQMRIQNIQBR-UHFFFAOYSA-N 327.385 1.611 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@]2(C(=O)C(=O)C[C@H]3C[C@H](N)C3)C[C@@H]2C1 2003171705 ZZPOLBNJNYPWIV-JJFYZRJRSA-N 336.432 1.899 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C1 2010398651 WIEOVMCDCRQURA-RYUDHWBXSA-N 339.396 1.781 10 10 EDCE CNCc1ccc(N2C[C@H](CO)OC[C@H]2C)c(Br)c1 300494036 BQBNBIHVHZPABB-ZYHUDNBSSA-N 329.238 1.755 10 10 EDCE OCc1ccc(N2CC[C@H](N3CC(O)C3)C2)c(Br)c1 2102521332 YRSNIQZFNMWHOX-NSHDSACASA-N 327.222 1.197 10 10 EDCE Cc1cc(Br)nc(NC(=O)c2cc(O)nc(O)c2)n1 2272033399 JYJOUDXWMSBIPD-UHFFFAOYSA-N 325.122 1.606 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)[C@H](O)CC2)cc1Br 2269120761 HALXVVGKTXCJIX-CUOATXAZSA-N 329.238 1.791 10 10 EDCE COc1ccc(C=C2SC(=S)N(CC(=O)O)C2=O)c(OC)c1 2293026460 PASSBNGUBKVNBZ-UHFFFAOYSA-N 339.394 1.990 10 10 EDCE COC[C@H](O)CCNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2305338705 VFTGKBCQESOVOQ-QGZVFWFLSA-N 334.416 1.050 10 10 EDCE Cc1ccc(CNS(=O)(=O)NC2CC2)c(O)c1Br 2327594082 KQWKAPIRVLSMBM-UHFFFAOYSA-N 335.223 1.550 10 10 EDCE Cc1ccc(CN2CC(=O)N[C@H]3CC[C@H]32)c(O)c1Br 2352652059 OLGHSWJRSBBZMM-WDEREUQCSA-N 325.206 1.926 10 10 EDCE Cc1cc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)nn1C 4362548 VWYHQLCMCOYHCO-UHFFFAOYSA-N 327.432 1.410 10 10 EDCE COC(=O)CC1=NN(c2ccc(F)cc2)C(=O)/C1=C(\C)NCCCO 101834055 NXLPHJFYRFLNLK-LFIBNONCSA-N 349.362 1.337 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1ccc(C)cc1N)c1ccc(N)cc1 170319138 MPANTXLIRAGBGD-UHFFFAOYSA-N 326.356 1.678 10 10 EDCE CCCN(Cc1cc([N+](=O)[O-])ccc1O)[C@H]1CCS(=O)(=O)C1 173205316 BMWMTTYUBCPQEN-ZDUSSCGKSA-N 328.390 1.700 10 10 EDCE COc1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc12 6483402 ZASFHSAGASJGRN-UHFFFAOYSA-N 332.264 1.997 10 10 EDCE biogenic,in-vitro COc1ccc(N2CCN(C(=O)NCC(=O)NC(C)(C)C)CC2)cc1 73258845 KQCAXOPEAQNYDX-UHFFFAOYSA-N 348.447 1.442 10 10 EDCE COc1cccc(CNC[C@@H]2CCC[C@]23NC(=O)N(C)C3=O)c1O 371083963 FJMAWXZVPNGIMT-SJCJKPOMSA-N 333.388 1.211 10 10 EDCE Cc1ccc(CN(C)CCN2CCNC2=O)c(O)c1Br 2381129419 KAFZSTIIZYHEEM-UHFFFAOYSA-N 342.237 1.920 10 10 EDCE Cc1ccc(CN(C)[C@@]2(C(=O)O)CC[C@H]2N)c(O)c1Br 2381130501 ZXHUGGGSDSFGJR-YGRLFVJLSA-N 343.221 1.839 10 10 EDCE Oc1ccc(Br)cc1CN1CC[C@@]2(CNCCO2)C1 719998874 IIAXDYYLHRPEBZ-CQSZACIVSA-N 327.222 1.719 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC=C[C@@H](O)C3)c(Br)cc21 2165067361 FZGXGWGVBOXVKV-AMIZOPFISA-N 338.205 1.399 10 10 EDCE CC[C@@H](CS(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1)OC 817127646 FDQIQMMRTUCFEV-HNNXBMFYSA-N 342.461 1.572 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCc1ccnn1C 819697010 LJRSNUPEQCVKMI-UHFFFAOYSA-N 345.399 1.650 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)NCc2cnn[nH]2)CCCC1 651430099 DSKPNNHSZAOYKL-UHFFFAOYSA-N 339.399 1.963 10 10 EDCE CO[C@H]1CNC[C@H]1S(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 722220798 CIDBCLFWUWSMOE-VHSXEESVSA-N 341.216 1.428 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(C)(C(=O)OC)C2)c([N+](=O)[O-])c1 819954991 FNJFDRVOCRQITC-FNORWQNLSA-N 334.328 1.780 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H](n3ccnc3)C2)cc1 729919766 CPZHHLXSSUXLSU-SFHVURJKSA-N 341.459 1.902 10 10 EDCE CN1CCN(C)CC(C(=O)NCc2cc(Cl)cc(Cl)c2O)C1 908211050 DZAKDCQTWAXLIA-UHFFFAOYSA-N 346.258 1.809 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@@H]2C[C@H]1C[S@@]2=O 845002195 HMLLZVMKIGXMLR-KXNSMUHISA-N 331.441 1.478 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)C3(OC)CC3)CC2)cc1 843520771 XRTPVQYUQHNFQI-UHFFFAOYSA-N 347.459 1.503 10 10 EDCE C[C@H](NCC[C@@H]1CNC(=O)C1)c1ccc(N2CCOCC2)c(F)c1 926988132 QJXOYGUHPRWBGP-KBPBESRZSA-N 335.423 1.839 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cccc(C(N)=O)n3)C2)cc1 855223589 AXDCPUNZBLQWFU-GFCCVEGCSA-N 340.383 1.198 10 10 EDCE NC(=O)c1csc(NCc2ccc(N3CCC(O)CC3)cc2)n1 853955072 CNXZCMLAUHUSLB-UHFFFAOYSA-N 332.429 1.815 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 860230487 MDPDKJJBXBLGRZ-ZYHUDNBSSA-N 331.340 1.283 10 10 EDCE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N1Cc2cccc(O)c2C1 871206622 BRRBQJRZXCFRHH-UHFFFAOYSA-N 347.415 1.044 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)C2CN(C3CCOCC3)C2)c1 896162694 GOIRFYGNCJPKDO-LBPRGKRZSA-N 334.416 1.689 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)/C=C\c2ccc(C(N)=O)o2)c1 1150543361 MOQROQXWYCVHHY-NVDWLVSRSA-N 330.340 1.983 10 10 EDCE CC(C)C[C@H]1COCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1329872616 GWBOIFFJXUAURP-AWEZNQCLSA-N 332.400 1.508 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@H](CO)[C@@H](CCO)C2)cc1F 1346266689 HPMLTLQJSZOMMR-UONOGXRCSA-N 339.411 1.024 10 10 EDCE CO[C@@H](C)CN[C@@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1507159807 UQOQSAVQXBZECK-RYUDHWBXSA-N 335.408 1.934 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1CC1(C)C)NC(=O)c1cc(OC)nc(OC)c1 1285047904 SMPHNIAMLYHOOO-STQMWFEESA-N 349.431 1.770 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2ccccc2)cc(OC)n1 1295408653 LXBQNVRGJGVHCR-GFCCVEGCSA-N 343.383 1.647 10 10 EDCE Cc1ncc([N+](=O)[O-])n1CC(=O)NCCCSc1nccs1 1542958386 YVTNNDGGASULRH-UHFFFAOYSA-N 341.418 1.855 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)CCC(F)(F)F)cc1C 1717761041 BWNVKRZYLQINAU-ZDUSSCGKSA-N 348.365 1.913 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC[C@H]1C(=O)Nc2ccccc21 1624727652 JXFXXNFYESWYAL-CYBMUJFWSA-N 326.352 1.883 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H]2CCCCN2C)cc1C 1716091716 RNWUVPGVUZWYDE-DLBZAZTESA-N 349.475 1.055 10 10 EDCE CCC[C@H](O)CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1636444614 YKJVBYPPIHPVKJ-NSHDSACASA-N 330.406 1.045 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)C[C@H]2CCNC2=O)cc1C 1568863570 XDVDMWQCQUCGBK-MJSXRHKHSA-N 345.443 1.292 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](N3CCCC3=O)C2)cc1 1638535108 ZHEWKLYMEFYERY-CYBMUJFWSA-N 329.360 1.686 10 10 EDCE CCCC(=O)N(C)C1CC(NC(=O)c2cc(OC)nc(OC)c2)C1 1739124650 NRNLYNUTEAXLTE-UHFFFAOYSA-N 335.404 1.618 10 10 EDCE CC[C@@H](CNC(=O)c1cocn1)NC(=O)c1cc(OC)nc(OC)c1 1738108007 IZBUDWDUGOWSJU-NSHDSACASA-N 348.359 1.025 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](CO)[C@@H](CCO)C2)cc1Br 2149908170 QMAGTSUZZBIECF-SDDRHHMPSA-N 344.249 1.930 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 1985094000 ILLDPSPGJLTABO-SNVBAGLBSA-N 325.369 1.127 10 10 EDCE COC(=O)[C@@H](CC(=O)NCCCN=[N+]=[N-])NC(=O)OC(C)(C)C 1985100216 VYPJBHHRNKXIHE-SECBINFHSA-N 329.357 1.259 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@]1(C)C(=O)NCCCN=[N+]=[N-] 1993373052 SOPIFXMEZPXSPL-AWEZNQCLSA-N 327.385 1.829 10 10 EDCE COC(=O)[C@H](CC(=O)N(C)CCCN=[N+]=[N-])NC(=O)OC(C)(C)C 2010394563 DCLMGMULFCJVBK-JTQLQIEISA-N 343.384 1.602 10 10 EDCE Cc1nc(I)c(N)c(-c2ccn(C)c(=O)c2)n1 2008831559 UTDFXSMMVHZBFM-UHFFFAOYSA-N 342.140 1.338 10 10 EDCE C[C@H]1C[C@H](N)CCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2054048997 XWRZURQWCXUODF-DOTOQJQBSA-N 329.444 1.875 10 10 EDCE CCNCc1ccc(N2CC[C@H](NC(N)=O)C2)c(Br)c1 690812664 KGQFBIYBFDVKIW-NSHDSACASA-N 341.253 1.806 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H](C)C(=O)N3CCCC[C@H]3C)c2n1 2063448482 PGONSOIEHVYRSZ-NEPJUHHUSA-N 345.403 1.263 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)cc1Br 2182553214 KPPRLZPSHLZPNP-TZDNBKRZSA-N 341.249 1.647 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CC[C@@H]2C[C@@H]21 1906906192 MTQXAQOSNRBGMJ-QXIMGHOESA-N 336.432 1.945 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NC(=O)CCc1ccc(N)cc1 2044227574 YVGXSHWKGFKWQG-CABCVRRESA-N 349.431 1.610 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2CN3C(N)=O)c(Br)c1 2192287524 XOBJSWBAHUMLAQ-LSJOCFKGSA-N 339.237 1.810 10 10 EDCE CO[C@@H]1C[C@@H](CN)N(Cc2cc(Br)cc(F)c2O)C1 2090738338 CLNDYAGMMPCREX-WDEREUQCSA-N 333.201 1.842 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)C[C@H]3C2)c(Br)c1 2236991985 ZMHNFNCUPGYZSH-JLUCKKNBSA-N 342.233 1.509 10 10 EDCE NCc1ccc(N2C[C@@H](CO)C[C@H](CO)C2)cc1Br 2228405154 UQFUXIGPFSOZMR-QWRGUYRKSA-N 329.238 1.335 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCO[C@@H](Cn3cccn3)C2)cc1 111425995 FPTKFTDFHWXZOO-QGZVFWFLSA-N 343.431 1.560 10 10 EDCE Cc1nn(C)cc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 179122640 GFMASCNCQSPKKC-UHFFFAOYSA-N 333.367 1.189 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CNC(=O)c1cccnc1 121237288 OWGXTJQFTYEDPP-UHFFFAOYSA-N 326.400 1.502 10 10 EDCE C[C@@H]1Oc2ccc([N+](=O)[O-])nc2N(CCOc2ccc(N)cc2)C1=O 75259537 MMMROBVMOWLKGM-JTQLQIEISA-N 344.327 1.765 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCO[C@]2(CCOC2)C1 185158481 JLXACGIHTHKPEO-LJQANCHMSA-N 347.459 1.202 10 10 EDCE COC(=O)[C@H]1C[C@H](OC)CN1Cc1cccc(Br)c1O 125806702 ZEDNMIGLCRQCRM-CMPLNLGQSA-N 344.205 1.917 10 10 EDCE Cc1cc(N2CCC[C@@H](NCc3cc(F)ccc3O)C2=O)n(C)n1 180810834 PIUCODKOZZXTMP-CQSZACIVSA-N 332.379 1.858 10 10 EDCE COc1ccc(N2CCN(c3cncc(OCCO)n3)CC2)cc1F 133202019 OQLPZENSMKBTOG-UHFFFAOYSA-N 348.378 1.322 10 10 EDCE FC(F)CN1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 92586573 VBGNYYLRVBXKTG-UHFFFAOYSA-N 325.403 1.906 10 10 EDCE CN(C)[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 365226601 DVOLYBWQXSHQNI-NSHDSACASA-N 334.376 1.846 10 10 EDCE CCOc1cccc(CN2CCN(CCC(=O)N(C)C)CC2)c1O 271205289 ZIZUOEQWCUCQEB-UHFFFAOYSA-N 335.448 1.387 10 10 EDCE CC(=O)C(=O)COC(=O)c1coc(CNC(=O)OC(C)(C)C)c1 808540139 OADHEQJUVSIRFI-UHFFFAOYSA-N 325.317 1.619 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C1=COCCC1 730851229 PQISUTODPXEKCV-UHFFFAOYSA-N 332.400 1.949 10 10 EDCE O=S1(=O)C[C@@H](CNCc2cc(F)ccc2O)Oc2ccccc21 843417301 AGJWGMQHRRJZOZ-CYBMUJFWSA-N 337.372 1.856 10 10 EDCE CCN(CC)C(=O)[C@H]1CCCN1C(=O)C(=O)Nc1ccc(N)cc1 841071234 LGUUTIFFLFQACE-CQSZACIVSA-N 332.404 1.067 10 10 EDCE C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1[C@H]2CN[C@H]1C2 925486209 FWKWOPFJNFMUTH-UNQWWWNPSA-N 349.500 1.007 10 10 EDCE CC(C)OC[C@@H](CO)N(C)c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 844216189 CAHUQRZPMGJWGB-VUDGCMKMSA-N 338.360 1.915 10 10 EDCE Nc1ccc(NC(=O)C(=O)NC[C@@H]2CCC[C@@H](C(F)(F)F)O2)cc1 927867777 PELTXZNZKKSFHB-RYUDHWBXSA-N 345.321 1.824 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 1895876831 YOWLKRVNOKKZDC-GHMZBOCLSA-N 327.385 1.373 10 10 EDCE CCC1(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)COC1 755247000 CJFQLKJCFFYNTL-UHFFFAOYSA-N 347.459 1.360 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)CC3(CO)CC3)C2)cc1 854300175 VWSNKMMKMDOJHA-AWEZNQCLSA-N 333.432 1.688 10 10 EDCE CC(C)(C)CC(=O)N1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768440098 DBMYHBNFLBPERP-MRXNPFEDSA-N 348.443 1.898 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)c3ncccc3N)C2)cc1 868956369 PLCOFGFEINUDNV-CYBMUJFWSA-N 326.400 1.929 10 10 EDCE CC1(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@H]2C[C@@H]2C1 863124655 ZFYRCRNWZWHECB-GHMZBOCLSA-N 338.429 1.930 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCSC[C@H]2CO)c([N+](=O)[O-])c1 765639654 AVZGOPOMIRYZPW-KTLBGCOUSA-N 338.385 1.695 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)N2CCNC(C)(C)C2)N(C)C)cc1 1336271314 ACLVWGJVBVJDFQ-KRWDZBQOSA-N 347.507 1.749 10 10 EDCE CN(Cc1cc(F)c(N(C)C)cc1F)C[C@@H]1CCS(=O)(=O)C1 862247657 KTRSBLXOAFTNEB-NSHDSACASA-N 332.416 1.897 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)[C@H](C)O)CCCC1 871141623 SHUIKKUZDPHVKG-SGTLLEGYSA-N 346.427 1.387 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2CC3(CSC3)C2)c1 871508450 LKYNZKVEJIIOMG-UHFFFAOYSA-N 342.442 1.389 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C)CCCN(C)C)cc1 788940675 VBLIRVPQZTWQDW-UHFFFAOYSA-N 348.491 1.559 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1[C@H]2CCCO[C@H]21 780120147 DMGNXLYXDCPMOV-KBAYOESNSA-N 346.427 1.679 10 10 EDCE COC(=O)c1c(CN2CCC(C(N)=O)CC2)c2cc(F)ccc2n1C 893872329 RGFRSEOSIMRCCI-UHFFFAOYSA-N 347.390 1.801 10 10 EDCE CN(C)c1ccc(CNc2ccc(C(=O)O)n3nc(N)nc23)cc1 82729869 DZWJHMWYGZZBHU-UHFFFAOYSA-N 326.360 1.688 10 10 EDCE Nc1ccc(CS(=O)(=O)NCCSCC(F)(F)F)cc1 710823582 ZMLAXTLRNIRICU-UHFFFAOYSA-N 328.381 1.984 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(Cc2nn[nH]n2)CC1 1176780306 MRNFICQXLFIBOD-RQOWECAXSA-N 329.360 1.105 10 10 EDCE CCS(=O)(=O)[C@@H]1CCN(c2ccc(CN)cc2Br)C1 2123307221 YIOHMCYHYBRYGM-LLVKDONJSA-N 347.278 1.921 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H](NC(C)=O)C(C)C)cc1C 1321713759 RKFPTINKJXGEGK-RDTXWAMCSA-N 349.475 1.759 10 10 EDCE COCCN(Cc1ccco1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1330396538 MOBSHCMAXRETKV-UHFFFAOYSA-N 344.367 1.503 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)c2cnnn2C)cc1C 1277811133 QHNRMDPBKQPKIO-CYBMUJFWSA-N 331.420 1.382 10 10 EDCE CC[C@@H](C)CC(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1295112393 LAHLYRLIFSWMSE-MRVWCRGKSA-N 349.431 1.912 10 10 EDCE CC/C=C(/C)C(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1295178214 MKAIUKPDNTVHKY-YEJLBBQYSA-N 347.415 1.832 10 10 EDCE Nc1ccc(CS(=O)(=O)N2CCC3(C2)CC2(C3)OCCO2)cc1 1917304336 TWIXCTMCHVLSKA-UHFFFAOYSA-N 338.429 1.328 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@]34CCOC4)c(Br)cc21 1915825814 JCAMNLXWUSFXBH-JSGCOSHPSA-N 338.205 1.770 10 10 EDCE CC(C)(C)[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1nc(=O)o[nH]1 1469343595 UAQVRMLNPBNKNJ-SCXUMTSISA-N 333.344 1.691 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)/C=C/C(=O)O)c2nccn2C)cc1 1615096824 ZOKAJDUCLOHLCF-ROJDOSBLSA-N 328.372 1.333 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCc2cnn(C)c2)cc1C 1715962696 OUKLJWHJVODNDV-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE O=C(Cn1nnnc1-c1ccsc1)NCCc1ccc(O)c(O)c1 1622753136 IFGFTICYVBPCGW-UHFFFAOYSA-N 345.384 1.172 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C2(C(F)F)CC2)cc1C 1717764954 BJXVTZLFFBMUNQ-CYBMUJFWSA-N 342.386 1.616 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(c2ccccn2)=NO1 1556157742 IWWHCNOVUYNOHL-GTNSWQLSSA-N 341.367 1.733 10 10 EDCE Cc1nn(C)c(=O)c(C(=O)NCc2ccc3cccnc3c2O)c1C 1639621714 PZHADQUFPDAOGL-UHFFFAOYSA-N 338.367 1.581 10 10 EDCE CCNS(=O)(=O)c1cccc(C(=O)N2Cc3cccc(O)c3C2)c1 1636230744 HOCCFSNANVAQAO-UHFFFAOYSA-N 346.408 1.846 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)CNC(=O)C(F)F 1721576133 JCHYOXFGTYCJLL-QMMMGPOBSA-N 341.318 1.596 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)CC2(C)CC2)cc(OC)n1 1572280009 OXLAGZUNEAFCEY-GFCCVEGCSA-N 349.431 1.866 10 10 EDCE CC1(C)CCN(C(=O)c2c(F)ccc(O)c2O)CCS1(=O)=O 1650985559 JDSKDTABNPXBJV-UHFFFAOYSA-N 331.365 1.276 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CC[C@@H]1NCCCO 1667216148 FGRPXHZVBLOHAM-WFASDCNBSA-N 347.419 1.672 10 10 EDCE C[C@@H]1CCN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C[C@@H]1O 1684872792 CCUQFVPHIXDZLR-QAPCUYQASA-N 346.475 1.351 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCn1cc(Br)cn1 1157249810 CBHKXLHCTHBTIJ-UHFFFAOYSA-N 340.177 1.416 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985095838 JYAWFRUWVOZJCN-QWRGUYRKSA-N 326.401 1.353 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H]1CNC(=O)COc1ccc(N)cc1 1999571594 BIGOFWKLZGBJSV-FZMZJTMJSA-N 335.404 1.677 10 10 EDCE NCc1ccc(N2CC[C@](CO)(CCO)C2)c(F)c1Br 2153343968 CUPRWFQNLYNDAP-AWEZNQCLSA-N 347.228 1.618 10 10 EDCE CN(Cc1ncno1)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2160398896 HSYROOSPEJGKKM-LLVKDONJSA-N 339.149 1.454 10 10 EDCE C[C@H]1[C@@H](NCc2cccc(Br)c2O)CCS1(=O)=O 380992442 FKKKDWYUKZFYCH-KWQFWETISA-N 334.235 1.820 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2182553210 KPPRLZPSHLZPNP-PZSFLXJQSA-N 341.249 1.647 10 10 EDCE O=S1(=O)C[C@@H]2C(NCc3cccc(Br)c3O)[C@H]2C1 2054279428 ZSDBAXPPXQENGK-IUCAKERBSA-N 332.219 1.287 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(O)c(O)c2)CC[C@@H]1NC(=O)C(F)(F)F 2054398427 YDQFRGMNKFYNDJ-WPRPVWTQSA-N 346.305 1.627 10 10 EDCE Nc1ccc(CC(=O)NC[C@@H]2COCCN2Cc2ccccc2)cc1 2074178430 GKNCGHBDNDGDIO-LJQANCHMSA-N 339.439 1.829 10 10 EDCE C[C@H](O)c1ccc(N2CC(CS(C)(=O)=O)C2)cc1Br 2103219827 FIPAHOOCSQNNTL-VIFPVBQESA-N 348.262 1.983 10 10 EDCE NCc1ccc(N2C[C@H](CO)C[C@@H](CO)C2)c(Br)c1 2228401355 CTRCFHRSNPACPL-VXGBXAGGSA-N 329.238 1.335 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2OCC[C@@]2(C(=O)NCCCN=[N+]=[N-])C1 2253377272 SIPBOSGPVKTGBT-IAQYHMDHSA-N 339.396 1.829 10 10 EDCE CSc1ncc(CNC(=O)N2CCSC[C@H]2C(=O)O)s1 2284544263 NVMMDQLMBWEOTK-QMMMGPOBSA-N 333.460 1.577 10 10 EDCE OCc1ccc(N2C[C@@H]3CC[C@@H](CO)O[C@H]3C2)c(Br)c1 2289341573 WHJSCZCFHJPOAT-HUBLWGQQSA-N 342.233 1.918 10 10 EDCE CN(C)CCCNC=C1C(=O)N(C)C(=S)N(c2ccccc2)C1=O 2297512690 QHXQZBWDGIOPHK-UHFFFAOYSA-N 346.456 1.202 10 10 EDCE COC(=O)COc1ccc(N(C)C(=O)/C=C/c2cnccn2)cc1 492466646 XLNGURFTLAZWGS-FPYGCLRLSA-N 327.340 1.705 10 10 EDCE CCN[C@@H](C)c1ccc(N2C[C@@H](O)[C@H](O)C2)cc1Br 2328969525 WMFVVRTXELOVAW-CUOATXAZSA-N 329.238 1.661 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2[C@H]3CN[C@@H]2C3)c(O)c1Br 2352645116 GLEPIYWYEKPXCL-MXWKQRLJSA-N 325.206 1.687 10 10 EDCE Cc1ccc(CN2C[C@H](O)[C@H]3COC[C@@H]32)c(O)c1Br 2352691865 XCFZEPHZBWAITI-SRVKXCTJSA-N 328.206 1.655 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@@H](C)O1 54786342 XHJRBBDKAQVXLS-HUUCEWRRSA-N 333.432 1.842 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CCCN(c3cccnn3)C2)c(O)c1O 179504788 AEJYRQBCLZMCDV-LBPRGKRZSA-N 328.372 1.595 10 10 EDCE O=C(NCc1ccccc1)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O 302907423 NYYPSLMLNUDRKP-ZDUSSCGKSA-N 330.340 1.593 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)[C@H](O)C2(C)C)cc1Br 2124803260 UQYPIBXBGAZKHV-CKLFPEKLSA-N 330.222 1.823 10 10 EDCE C[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCS1(=O)=O 127877312 MWJMHWXXEQDEBG-MRVPVSSYSA-N 334.781 1.573 10 10 EDCE COc1ccc(N2CCN(C(=O)C(C)(C)C(=O)NC(C)C)CC2)cc1 243456787 NGMZTBSTJZTELK-UHFFFAOYSA-N 347.459 1.895 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@](C)(F)C3)nc12 295378059 KENIUOFWPMIKLH-MRXNPFEDSA-N 336.367 1.936 10 10 EDCE CC[C@@H](COCC1CC1)NC(=O)C(=O)NCc1ccc(N(C)C)cc1 826707635 WLYRHYBPONDPPZ-INIZCTEOSA-N 347.459 1.690 10 10 EDCE CO[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@@H]1C 839219855 VDMUSQLOTFHQFX-YOEHRIQHSA-N 347.459 1.594 10 10 EDCE C[C@@H]1CCn2ncc(C(=O)NC[C@H](N)c3ccc(N(C)C)cc3)c2C1 843296574 BEXHVAQWCUOOJM-DYVFJYSZSA-N 341.459 1.961 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 919918527 NYJQSYYBJCCKAO-NJAFHUGGSA-N 343.427 1.666 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@@H](O)C2CCOCC2)cc1 846447613 RMSDEFQNFZZZBG-KRWDZBQOSA-N 336.432 1.377 10 10 EDCE COc1cc(Br)cc(CN2CCO[C@@H]([C@H](C)O)C2)c1O 840979105 YZKZRAJVMKUSOD-TVQRCGJNSA-N 346.221 1.745 10 10 EDCE O=C1N[C@@]2(C(=O)NCc3c(O)ccc4c3CCCC4)C[C@H]3C[C@@H]1[C@H]2C3 845833482 GSUDBFDLOHQNSY-ADHALDRMSA-N 340.423 1.802 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cn3ccc([N+](=O)[O-])n3)C2)cc1 855232131 NWCRMZDBNFNFDR-GFCCVEGCSA-N 345.359 1.195 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H](CO)C1CCC1 852004781 KDKPXSPICXBOJK-KRWDZBQOSA-N 333.432 1.483 10 10 EDCE CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)/C=C/c1ccc(O)c(O)c1 854642376 LEOLDMROUBRLNM-ZWXLGZMVSA-N 332.400 1.433 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1C[C@H](O)CO1 1952208710 MHFSEPFCMWXTCF-ZOWXZIJZSA-N 339.388 1.683 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCc4c[nH]nc4C3)C2)cc1 854300383 SGMJDYLGARMWNQ-CQSZACIVSA-N 341.415 1.765 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H]3[C@H](N(C)C)[C@H]3C2)c([N+](=O)[O-])c1 858562575 NOBCCLQOPLJAAS-YGBQLFGPSA-N 331.372 1.777 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3CN(C)C[C@H]3C)CC2)cc1 756108231 UXVOKLHIUONIOK-APWZRJJASA-N 332.492 1.357 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)[C@@H]3CCN(C)C3=O)C2)cc1 854296392 CDDWZQNADFMFDZ-XJKSGUPXSA-N 346.431 1.146 10 10 EDCE COc1cccc(CNC(=O)C(=O)Nc2c(C)nn(C)c2C)c1O 754489749 UYXNRZCVJAFOMF-UHFFFAOYSA-N 332.360 1.006 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CC[C@H](C)NC1 861803843 GKAGCVSNTIMKLM-ZFWWWQNUSA-N 333.432 1.388 10 10 EDCE CC(C)(C)n1nnc(CC(=O)NCc2ccc3cccnc3c2O)n1 862024565 AYYYUWPLSXFWNW-UHFFFAOYSA-N 340.387 1.541 10 10 EDCE Cc1nn(CC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)c(=O)o1 880302178 CSBPEKBJQKYNPA-LBPRGKRZSA-N 332.404 1.267 10 10 EDCE COc1cc(CN2CCN(CC(F)(F)F)C(=O)C2)c(O)cc1C 795729164 IHLAPBGOJWIUMN-UHFFFAOYSA-N 332.322 1.916 10 10 EDCE CN1C(=O)C[C@@H](NCc2cc(Br)cc(F)c2O)C1=O 715792962 TVSGGSFAUAQGDI-SECBINFHSA-N 331.141 1.141 10 10 EDCE NCC1(O)CCN(Cc2cc(Br)cc(F)c2O)CC1 715790467 ACBJKDNKHANFMH-UHFFFAOYSA-N 333.201 1.579 10 10 EDCE COC(=O)[C@@H](NC(=O)c1cccc(O)c1O)c1ccc(OC)cc1 1148219869 CXUHTBCOJBHVEV-AWEZNQCLSA-N 331.324 1.751 10 10 EDCE CNC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1300232898 KQQFNPSNQFQAEZ-CQSZACIVSA-N 346.305 1.167 10 10 EDCE C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)N(C)Cc1ccccc1O 1332092623 BVUAOLVTKKMZLQ-DCDXPUDHSA-N 332.400 1.111 10 10 EDCE C[C@]1(CNC(=O)C(=O)NCCCSc2nccs2)CC1(F)F 1261697847 WEYUUDKVJAWTRF-GFCCVEGCSA-N 349.428 1.903 10 10 EDCE CC[C@H](CNC(=O)C1=COCCO1)NCc1ccc(OC)c(C)c1 1267794499 WPDJMIGCOGMVLO-OAHLLOKOSA-N 334.416 1.876 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)Cn2cccn2)cc1C 1272649823 ZWDYVWYHAGWHEO-OAHLLOKOSA-N 330.432 1.885 10 10 EDCE O=C(NCC(=O)N1Cc2cccc(O)c2C1)NCc1ccc(F)cc1 1455036849 KHTFDPVGYODACX-UHFFFAOYSA-N 343.358 1.873 10 10 EDCE C[C@@H](CNC(=O)C(C)(F)F)NC(=O)c1ccc(N=NC(N)=O)cc1 1298807684 YUGLIWDXJZQBEE-QMMMGPOBSA-N 341.318 1.739 10 10 EDCE CC(C)S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 112334425 YQXYEVGJMYYHKK-UHFFFAOYSA-N 326.827 1.862 10 10 EDCE CN(C)c1ccc(CNC(=O)CS(=O)(=O)c2cccnc2)cc1 1614989320 ASZFIFSDWBSNDR-UHFFFAOYSA-N 333.413 1.238 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)c(Br)c1 2136877657 JBGVXQPVNFMDBS-FZZIBODNSA-N 330.222 1.824 10 10 EDCE Cn1ccc(NC(=O)CNC(=O)c2cc3cc(O)c(O)cc3s2)n1 1626521119 ZXCZBWMNFZZVMW-UHFFFAOYSA-N 346.368 1.415 10 10 EDCE COc1ccc(-n2nnnc2CN[C@H](C)CNC(=O)C2CCC2)cc1 1480416433 UCDKBKHNQWUSGR-GFCCVEGCSA-N 344.419 1.065 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C2C=CC=CC=C2)cc1C 1725531588 PKPZCDSKKQYYBC-SFHVURJKSA-N 342.439 1.869 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@@]2(C)CCN(C(C)=O)C2)cc1 1724189124 LSDDMLTYFXAKIJ-QGZVFWFLSA-N 344.419 1.019 10 10 EDCE COc1cccc2c1OC[C@@H](NC(=O)Cc1ccc(O)c(O)c1)C2 1632566614 XXJRMYGIRDJDHY-ZDUSSCGKSA-N 329.352 1.769 10 10 EDCE O=C(NCc1c(O)cccc1O)c1coc(Sc2ncccn2)n1 1645362993 IBASMRJKHHRQHO-UHFFFAOYSA-N 344.352 1.957 10 10 EDCE CS(=O)(=O)Nc1cc(F)ccc1NC(=O)c1cccc(O)c1O 1597580331 JMRTYSAHYJOGKW-UHFFFAOYSA-N 340.332 1.861 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H]2CC[C@@H]2C(N)=O)cc1C 1670205343 WZUKIZHGIBCHRI-HOTGVXAUSA-N 347.459 1.453 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)[C@H](C)NC(C)=O)C2)cc1C 1691764509 CMYZLAILFCFHNK-JQFCIGGWSA-N 347.459 1.513 10 10 EDCE Cn1cc(C(=O)NCc2ccccc2O)c(=NC(=O)OC(C)(C)C)[nH]1 1966110579 ZKUNPTRTQDBGJP-UHFFFAOYSA-N 346.387 1.825 10 10 EDCE CCN[C@H](c1ccccc1O)[C@H](O)c1c(Br)nnn1C 2148153762 PUDRIDJYJNMYKR-PWSUYJOCSA-N 341.209 1.667 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](OCC(N)=O)C2)c(Br)c1 2145370953 JNYOIOPDXRJZBI-KOLCDFICSA-N 343.221 1.583 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1990023280 UWFUHWHPCTXYGR-MNOVXSKESA-N 327.385 1.563 10 10 EDCE CC1(C)C[C@H](O)CN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2154827024 BZJOELYCSKBINO-JVXZTZIISA-N 341.205 1.784 10 10 EDCE O=C1CCC(=O)N1CCNCc1cccc(Br)c1O 405463303 YTKABKRJOXWQBL-UHFFFAOYSA-N 327.178 1.393 10 10 EDCE Oc1cc(Br)ccc1CN1CC[C@@H](N2CCNCC2)C1 691496448 JRVPHORYHGMGCX-CQSZACIVSA-N 340.265 1.634 10 10 EDCE O=C1NC(=O)N(Cc2ccco2)C(=O)/C1=C/Nc1cccc(O)c1 9265684 YHRSZFVCFQHIPM-MDWZMJQESA-N 327.296 1.560 10 10 EDCE Nc1ccc(CC(=O)N2CCC[C@H](CNC(=O)C(F)(F)F)C2)cc1 2044622350 BZCYYXJJWHSREB-GFCCVEGCSA-N 343.349 1.728 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)cc2Br)[C@H]2COC[C@@H]12 2102139856 FDRRRGJLBXDYCB-DDTOSNHZSA-N 327.222 1.758 10 10 EDCE NCC1CN(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)C1 2104917965 XHNWQGHPHQIEPE-UHFFFAOYSA-N 326.205 1.246 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](CO)C[C@H]2CO)c(Br)c1 2089862711 CEBRDCZIVFIULX-SCVCMEIPSA-N 329.238 1.648 10 10 EDCE CNCc1ccc(N(C)[C@H]2CCCNC2=O)cc1Br 2114632548 XIUCMQUCVVPKTB-ZDUSSCGKSA-N 326.238 1.883 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@H](O)CN(C(=O)OC(C)(C)C)C1 2300531860 MZUKGCMUIUBGMU-NEPJUHHUSA-N 341.412 1.763 10 10 EDCE Cc1ccc(CN2C[C@H](O)[C@H](O)[C@@H]2CF)c(O)c1Br 2352686047 IKHMIOLVNCZKRZ-OUJBWJOFSA-N 334.185 1.339 10 10 EDCE O=C(NN1C(=O)CSC1=S)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3135997 BYEIBYZSDJXSLC-UHFFFAOYSA-N 342.314 1.008 10 10 EDCE O=C(O)C[C@H]1CS(=O)(=O)CCN1Cc1cc(Cl)ccc1O 126364955 YCDYRERXWODGML-NSHDSACASA-N 333.793 1.119 10 10 EDCE O=C(CNCc1ccc(N2CCOCC2)cc1)NCc1ccco1 48710451 DWKMIAANXOPMDX-UHFFFAOYSA-N 329.400 1.522 10 10 EDCE CC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1 195078805 XQQLOXBLTDQYPF-MRXNPFEDSA-N 333.457 1.824 10 10 EDCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[S@](=O)C1 365221601 IWOCRTHUHINEBL-KLVQOETNSA-N 339.373 1.131 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H]1NC(=O)NC1=O 271385120 SHZWNBWKEVEURN-AWEZNQCLSA-N 332.404 1.088 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](N)[C@H]2CCOC2)c(O)c1Br 2380743000 XYSJMFDVOTWGMR-JQWIXIFHSA-N 343.221 1.443 10 10 EDCE Cc1ccc(CNC(=O)C[C@@H]2COC[C@@H]2N)c(O)c1Br 2380751838 OYRVOLVSEUVOTN-MNOVXSKESA-N 343.221 1.443 10 10 EDCE C[C@@H](NC(=O)C(=O)N1CCO[C@H](C2CC2)C1)c1ccc(N(C)C)cc1 807677692 RTRQSCUSLFRWOU-DYVFJYSZSA-N 345.443 1.567 10 10 EDCE C[C@H]1CCN(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 816891094 IDMIDRJQHKQFJG-AWEZNQCLSA-N 349.450 1.745 10 10 EDCE CCOc1ccc(CN2CCN([C@H]3CCNC(=O)CC3)CC2)c(O)c1 825147154 CIPLCUCEOYMKDD-MRXNPFEDSA-N 347.459 1.577 10 10 EDCE C[C@@H](NC(=O)[C@@H]1CC[C@H](C(=O)O)O1)c1ccc(N2CCOCC2)cc1 901950622 NTHJBCRRFRKUIV-UHOFOFEASA-N 348.399 1.333 10 10 EDCE CCC[C@@H](C)[C@@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 846359024 GFSOVGKYVRINSR-ZWNOBZJWSA-N 344.433 1.291 10 10 EDCE Cn1nccc1[C@@H](NC(=O)c1cccc(O)c1O)C(=O)OC(C)(C)C 844099587 NOPGNFTUUBCOSV-CYBMUJFWSA-N 347.371 1.644 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC2(N)CCCCCC2)cc1 842037161 WHBHBEYRMCSGHT-UHFFFAOYSA-N 346.475 1.537 10 10 EDCE O=c1c(F)cc([N+](=O)[O-])cn1Cc1ccc(N2CCOCC2)cc1 917873566 PJKQELZZDGVUED-UHFFFAOYSA-N 333.319 1.781 10 10 EDCE C[C@H](C(=O)NC(=O)NC(C)(C)C)N1CCCc2cc(CN)ccc21 843349663 HXHIDHFLCGBDEA-GFCCVEGCSA-N 332.448 1.911 10 10 EDCE COC(=O)/C(C)=C/CNC(=O)N(C)CCN(C)c1ccc(OC)cc1 925012082 WKZHZMOBWKCEHK-GXDHUFHOSA-N 349.431 1.892 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCOC3CCOCC3)C2)cc1 855233969 QBSWRJDVHQZKMZ-OAHLLOKOSA-N 348.443 1.976 10 10 EDCE C[C@@H](NC(=O)NCc1ccn(C)n1)c1ccc(N2CCOCC2)cc1 765672040 ZMSAUILXFXWGIG-CQSZACIVSA-N 343.431 1.817 10 10 EDCE CNc1cnc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)cn1 862158197 DBKGCGQHJNEOME-LBPRGKRZSA-N 327.388 1.536 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H](C[C@@H]3CCCOC3)C2=O)cc1 863500218 QJAWWBZRCCZWEG-GOEBONIOSA-N 331.416 1.990 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNc2c(C)c(C)nn2CCO)c1O 775038698 ZQALNOQTYZVGCB-UHFFFAOYSA-N 336.348 1.727 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1cnn(C)c1-n1cnnc1 1136743001 FUXPDZUOVILBCN-UHFFFAOYSA-N 339.403 1.305 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)[C@@](C)(O)Cn1ccccc1=O 790724271 CFBUKVOVQGEXKK-IBGZPJMESA-N 343.427 1.290 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC(COC)C3)c(Br)cc21 1916902121 SLRZOIVOVFOHQU-ZDUSSCGKSA-N 340.221 1.744 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N2CCC(c3ccon3)CC2)cc1 1328367905 KVDVBJTYSYUYJA-UHFFFAOYSA-N 342.399 1.322 10 10 EDCE CCCC(=O)N[C@@H](C)[C@H](C)NCc1nnnn1-c1ccc(OC)cc1 1328967463 DQHDWECXRNILPJ-STQMWFEESA-N 346.435 1.454 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H](C)C(C)(F)F)cc1C 1320271872 FQWQOCCBQJIREB-TZMCWYRMSA-N 344.402 1.862 10 10 EDCE CO[C@H]1CC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1334574408 UILJJQGLEUTFGG-IRXDYDNUSA-N 345.443 1.539 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2scnc2C)cc1C 1331684166 OIJKNCOOHHGTCM-CQSZACIVSA-N 349.456 1.649 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC([C@@H](F)C(N)=O)CC2)cc1 1348384257 FQOLKVNBRXVMKR-OAHLLOKOSA-N 336.411 1.498 10 10 EDCE CNC(=O)C1CN(c2ccc(C=CC(=O)O)cc2Br)C1 1911841335 GMMLRBMSFHAISE-UHFFFAOYSA-N 339.189 1.729 10 10 EDCE COc1ccc(CNC2(CNC(=O)CN(C)C(C)=O)CC2)cc1C 1269380047 UTWHWVWQUXKXNA-UHFFFAOYSA-N 333.432 1.220 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1C[C@H]2CCC[C@@H]21 1351287423 JYGNOENEPBMTAV-XOKHGSTOSA-N 329.444 1.982 10 10 EDCE O=C(C(=O)N1CCC[C@]2(CCSC2)C1)N1Cc2cccc(O)c2C1 1351920498 REHJEEREHCRXJM-SFHVURJKSA-N 346.452 1.980 10 10 EDCE CS(=O)(=O)C[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1298396350 QDFDALNRTZEWQS-SNVBAGLBSA-N 338.389 1.356 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCC=CO3)cc2)C1 1543377624 IASRCXRIYYDZKB-NVXWUHKLSA-N 343.427 1.697 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)/C=C\C(=O)N(C)C)C2)cc1 1557133493 MRFICSYPIFSVCT-CKXPSTMWSA-N 331.416 1.282 10 10 EDCE C[C@H](O)CN1CC[C@H](CCNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1732060073 AUOBLBBCBCLOIL-STQMWFEESA-N 347.419 1.672 10 10 EDCE COC(=O)N1C[C@H]2C=C[C@H]1[C@H](C(=O)NCc1cc(O)ccc1O)C2 1643882076 MNIGUNRSOJETAI-GDLCADMTSA-N 332.356 1.357 10 10 EDCE COCC(=O)N[C@@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1572269537 IXVAISQQAJUYGT-JTQLQIEISA-N 335.364 1.072 10 10 EDCE CN1CCN(Cc2cc(CN(C)C[C@H]3CCN(C)C3)ccc2O)CC1 19590060 BNQFXPIHLHDQDD-SFHVURJKSA-N 346.519 1.523 10 10 EDCE CN(C)[C@@H](CNC(=O)c1cc(O)c(O)c(O)c1)c1ccc(O)cc1 1865876017 MTJKYKLGZUCBNV-ZDUSSCGKSA-N 332.356 1.542 10 10 EDCE Cc1nn(C)c([C@H](O)[C@H](N)c2ccccc2O)c1Br 1877195188 VMGDNCMNZRIOBW-DGCLKSJQSA-N 326.194 1.930 10 10 EDCE COc1ccc(Br)c(CNC[C@H](O)C(F)F)c1O 1964557281 BCLSMFAZBGICQQ-QMMMGPOBSA-N 326.137 1.879 10 10 EDCE CO[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NCCN=[N+]=[N-])C1 1965101395 CIBQPPUEWRCWMT-WDEREUQCSA-N 327.385 1.827 10 10 EDCE C[C@H](N[C@@H](CO)CNC(=O)OC(C)(C)C)c1c(O)cccc1O 1985777082 HBVMGGKLPIUABL-WDEREUQCSA-N 326.393 1.634 10 10 EDCE CO[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 2010169393 DAHKNHCQBMAPGX-FZMZJTMJSA-N 338.404 1.937 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCCN(CC(=O)NCCCN=[N+]=[N-])C1 2010389423 PUJDTJVUCIWZOY-GFCCVEGCSA-N 340.428 1.792 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2COC[C@]2(C(=O)N2CC(N=[N+]=[N-])C2)C1 2010404949 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OWUXVMNKXNSZNZ-UHFFFAOYSA-N 349.250 1.495 10 10 EDCE CC[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2288894659 ALSGIMXMXGZAMM-RAIGVLPGSA-N 340.221 1.751 10 10 EDCE CC[C@@H]1[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2288913281 WYDSHDYKWIDMMP-WXHSDQCUSA-N 341.205 1.784 10 10 EDCE COc1cc(C=C2SC(N3CCN(C)CC3)=NC2=O)ccc1O 2297508944 AEKZDOWPVQUPHV-UHFFFAOYSA-N 333.413 1.619 10 10 EDCE CCOc1cccc(C=C2SC(=S)N(CCO)C2=O)c1O 2323676433 VTNCWTYRFMMZTQ-UHFFFAOYSA-N 325.411 1.984 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CCc2cc(O)c(O)cc2C1 2318660163 MOTPPOHHPXQRHH-ZDUSSCGKSA-N 348.399 1.992 10 10 EDCE Cc1ccc(CNS(=O)(=O)C2CC(N)C2)c(O)c1Br 2352645960 OYEPWFHDSSCZPS-UHFFFAOYSA-N 349.250 1.372 10 10 EDCE COCCn1[nH]c(Br)nc1=NCc1ccc(N)cc1 2353709941 MHQCPBSZDFXPQD-UHFFFAOYSA-N 326.198 1.303 10 10 EDCE Cc1noc([C@H](C)N2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)n1 171590837 XQYDKPPPRSPFAJ-NSHDSACASA-N 347.375 1.871 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCCO2)N2CCOCC2)cc1 36100167 XQCZFMNQUWPEFR-QZTJIDSGSA-N 347.459 1.421 10 10 EDCE CN(C)C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCO1 128196710 CTMXBHOUBNBTIG-LBPRGKRZSA-N 329.784 1.716 10 10 EDCE COC[C@@H](C)N(C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 193377450 IJVIANIOIZGESU-CYBMUJFWSA-N 339.411 1.839 10 10 EDCE Cc1cc(O)c(CNC[C@@]2(CO)COCC3(CCC3)N2C)cc1C 527751512 COUXRVBILCMCNM-LJQANCHMSA-N 334.460 1.714 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCn3nc(C)nc3C2)c([N+](=O)[O-])c1 267153521 XCNQFQXMKDOFCB-GQCTYLIASA-N 343.343 1.701 10 10 EDCE Cc1cnn([C@H]2CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)C2)c1 370684071 MFUMZQRBLLADSR-NSHDSACASA-N 343.343 1.882 10 10 EDCE Cc1ccc(CN2C[C@H]3COC[C@@H](C2)C3O)c(O)c1Br 2380813806 IVSBXYWHCGEEAJ-ONXXMXGDSA-N 342.233 1.902 10 10 EDCE C[C@@H]1O[C@H](C)CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)[C@@H]1C 807677070 LAZXAPVNJIFTTE-TUVASFSCSA-N 347.459 1.954 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N1CC(CO)C1 297665331 FVBYZOSYVLZXDC-UHFFFAOYSA-N 345.443 1.086 10 10 EDCE CN1CCc2cc([C@@H](NN)c3cnn(C)c3Br)ccc21 2163140618 LKNUQBFVNRGDLL-CYBMUJFWSA-N 336.237 1.728 10 10 EDCE Cc1cc(O)c(CN2CCC[C@@H](CS(N)(=O)=O)C2)cc1Cl 824777236 MCRRIEZVYDZRAS-LLVKDONJSA-N 332.853 1.855 10 10 EDCE COc1ccc(CNC(=O)N[C@@H]2CC[C@H](C)S(=O)(=O)C2)c(O)c1 821986975 ZMWFVPAFNHABAY-CMPLNLGQSA-N 342.417 1.166 10 10 EDCE COc1cccc(CN2CCC(N3[C@H]4CC[C@H]3CNC4)CC2)c1O 903978712 UTVJWTOQPNSUBH-IRXDYDNUSA-N 331.460 1.801 10 10 EDCE CCn1cc(-c2nn(C)cc2C(=O)N(C)c2cc(OC)ccn2)cn1 582542557 BLAWEZKVNULIDQ-UHFFFAOYSA-N 340.387 1.984 10 10 EDCE C[C@H](NC(=O)N1CCN(CCO)C[C@@H]1C)c1ccc(N(C)C)cc1 838560044 SYMJUDCQGNXOLD-GJZGRUSLSA-N 334.464 1.522 10 10 EDCE O=C1CCC(=O)N1c1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1 675032800 SYWCVWANMXVVNQ-UHFFFAOYSA-N 346.364 1.846 10 10 EDCE C[C@@H]1CO[C@@H](C(=O)N(CC(=O)O)Cc2cc(Cl)ccc2O)C1 911360830 YSIMWBZOCHVNTQ-TVQRCGJNSA-N 327.764 1.884 10 10 EDCE N=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CCC1 849112326 IYDGZZQICVSZGB-UHFFFAOYSA-N 327.476 1.949 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCOC[C@@H]2CCO)cc1F 758429273 OFODNYOBFFEFDF-ZDUSSCGKSA-N 325.384 1.185 10 10 EDCE COC(=O)CCCCCS(=O)(=O)NCc1c(O)cccc1F 921452544 RZZCIYUZRAERTP-UHFFFAOYSA-N 333.381 1.684 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3ncccn3)C2)cc1 852448123 CNSIDTOTPMYPRL-ZDUSSCGKSA-N 327.388 1.563 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC3CCC(N)CC3)C2)cc1 851666095 YJSLMCQZKVFUJL-NRXISQOPSA-N 332.448 1.843 10 10 EDCE COC(=O)CCNC(=O)CCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 858541070 GFAPMCCJPHOKRJ-ZYHUDNBSSA-N 338.379 1.739 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc4nc[nH]c4n3)C2)cc1 855228285 YSTUDTGSHQYJMQ-GFCCVEGCSA-N 337.383 1.975 10 10 EDCE COC(=O)C(C)(C)n1ccc(NC(=O)NCCc2ccc(N)cc2)n1 850763592 GTPNEOXNYFPHPZ-UHFFFAOYSA-N 345.403 1.738 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)C[C@H]2CO)c(Br)c1 698194802 AVVFPZQAHOBIPO-STQMWFEESA-N 343.265 1.881 10 10 EDCE COC1CCN(c2ccc(CN3C[C@H]4C(=O)OC[C@H]4C3)cc2)CC1 860167953 NLBIQXDJHOODHJ-CRAIPNDOSA-N 330.428 1.907 10 10 EDCE Cc1cc(CC(=O)NCCN2CC[C@H](O)C2)c(C)n1-c1ccccc1 863834988 PAQIWAOAGXTREO-IBGZPJMESA-N 341.455 1.819 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](O)[C@H](C)O)cc1 871142958 MPXLRYWRROLKFJ-KSSFIOAISA-N 344.411 1.307 10 10 EDCE O=S(=O)(Nc1cccc2c1OCC[C@H]2O)c1cccc2nonc12 795346954 BFPZYHWTAQEFJW-GFCCVEGCSA-N 347.352 1.840 10 10 EDCE CNC(=O)Cn1cc(NCc2c(O)cccc2Br)cn1 706821267 ACFJKYKMQQOTFN-UHFFFAOYSA-N 339.193 1.709 10 10 EDCE CN(C)c1ccc(CNC[C@@H]2CCCCN2S(C)(=O)=O)cc1F 796513999 SPMOEBOJLJCLID-AWEZNQCLSA-N 343.468 1.795 10 10 EDCE NC[C@@H]1CN(Cc2cc(Br)cc(F)c2O)CCCO1 715790594 BNROLVCDCLSAPW-LLVKDONJSA-N 333.201 1.843 10 10 EDCE CN1C[C@@H]2CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)[C@@H]2C1 794926599 CNEOEYDLLRBDHT-FUHWJXTLSA-N 330.476 1.347 10 10 EDCE C[C@H](O)c1ccc(N2CCC(CO)(CO)C2)cc1Br 694630752 VKROONONNORUDK-JTQLQIEISA-N 330.222 1.684 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN3C(=O)OCC[C@@H]3C2)cc1 1151045863 RELDGCUUSHJNEM-GFCCVEGCSA-N 331.332 1.516 10 10 EDCE NS(=O)(=O)CCCCCCC(=O)NCc1c(O)cccc1F 1303875343 DXZHHKPRLNQNLR-UHFFFAOYSA-N 332.397 1.387 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)c2cnnn2C)C2CC2)cc1C 1322990858 LCRRXXZJOQDYHJ-HNNXBMFYSA-N 343.431 1.430 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCC3(C)CC3)C2)cc1 1329063156 YSGNAHIFHQIZKE-CQSZACIVSA-N 345.443 1.697 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC3CC=CC3)C2)cc1 1334087168 UEQYMJRCEGLENQ-CQSZACIVSA-N 329.400 1.225 10 10 EDCE COC(=O)c1c(CN[C@H]2C[C@@H](C(N)=O)C2)c2cc(F)ccc2n1C 1353593472 NWEFHQMPBNGZLY-JGZJWPJOSA-N 333.363 1.458 10 10 EDCE CCO[C@H](C)C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1293163237 SXZZLZHEEGPRQF-LLVKDONJSA-N 349.391 1.510 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)C2CCCC2)cc1 1292439054 LHYODYFPTUOCHJ-UHFFFAOYSA-N 331.376 1.885 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCc2nc[nH]n2)cc1C 1480441540 KISVUFHLFLNXGI-CYBMUJFWSA-N 331.420 1.349 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CCCCS2(=O)=O)cc1 1637126718 IESZPUUPLXWLKE-GFCCVEGCSA-N 338.389 1.546 10 10 EDCE CCOCCNC[C@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1568322652 PZWJXFCOASNGRZ-LBPRGKRZSA-N 335.408 1.936 10 10 EDCE CCOCC(=O)N[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1720782759 IIJYICTWLJFKBK-ZDUSSCGKSA-N 347.375 1.216 10 10 EDCE CC[C@H](F)C(=O)NCC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1721409016 LLRLHOVYBNEQOZ-ZDUSSCGKSA-N 349.366 1.785 10 10 EDCE O=C(CCN1C(=O)c2ccccc2C1=O)NCc1c(O)cccc1F 1646028411 IBWJZDBDFVHLDI-UHFFFAOYSA-N 342.326 1.834 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2c(C)ccn2C)cc1C 1676525135 VAROJPNLNKSQJK-INIZCTEOSA-N 345.443 1.531 10 10 EDCE CCC[C@@H]1C(=O)NCCN1c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1772906880 XJUORRDSUGTKAQ-IQCBXXCUSA-N 347.371 1.886 10 10 EDCE O=C(O)[C@H](CO)N1C(=O)/C(=C\c2c[nH]c3ccccc23)SC1=S 1858595360 AXXUOPSVBBGMEC-FIJZOYEMSA-N 348.405 1.815 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)NCCCN=[N+]=[N-])CC(CO)C1 1964879241 CEHQRRBMBQOSAK-UHFFFAOYSA-N 327.385 1.469 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@](C)(C(=O)NCCN=[N+]=[N-])C1 1965102566 QMXXJHUTLXHSLN-YGRLFVJLSA-N 327.385 1.875 10 10 EDCE OCc1ccc(N2C[C@]3(CO)CC[C@@]3(CO)C2)cc1Br 2145746206 OMIGYCUJEIUGFW-GJZGRUSLSA-N 342.233 1.513 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1CC[C@@H](CNC(=O)OC(C)(C)C)O1 1985099163 IKDLDXURCZWXCN-WDEREUQCSA-N 327.385 1.827 10 10 EDCE COC1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 1985106109 WKEBXHYLAAPMKF-JTQLQIEISA-N 325.369 1.534 10 10 EDCE CN(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010390093 YUNPEWHVQOMENF-NEPJUHHUSA-N 340.428 1.743 10 10 EDCE COCC1(NCc2cccc(O)c2O)CN(C(=O)OC(C)(C)C)C1 2016205879 BVFXRMFFDUSXRB-UHFFFAOYSA-N 338.404 1.823 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1cc2c(cc1N)OCC(=O)N2 2034783696 TVQSSSSGGAOBIG-UHFFFAOYSA-N 340.383 1.352 10 10 EDCE CN(C)C[C@@H]1CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2160848121 TVUZPEGTGMVVTJ-ISVAXAHUSA-N 340.221 1.575 10 10 EDCE C[C@H]1CC(=O)NCCN1c1ccc(CN)c(Br)c1F 687898702 MLTRERRHZGBECL-QMMMGPOBSA-N 330.201 1.762 10 10 EDCE COCCNCc1ccc(N2CC(C(N)=O)C2)c(Br)c1 382051112 BBZFSUVLZVNZJR-UHFFFAOYSA-N 342.237 1.107 10 10 EDCE CC(C)(C)OC(=O)N1CC(CCO)(NCc2ccc(O)cc2O)C1 398013810 UVZWPDOAZNMPHQ-UHFFFAOYSA-N 338.404 1.559 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC=C(c4cnn(C)c4)C3)c2n1 2062997688 PLVVSZWQOZQQBN-UHFFFAOYSA-N 338.371 1.406 10 10 EDCE CN[C@H](C)c1ccc(N(C)Cc2nnn(C)n2)cc1Br 2197848755 ZMCDVDPGEYGMCU-SECBINFHSA-N 339.241 1.889 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@@H]2[C@H](O)CO)cc1Br 2270701225 OVZATDQFEAFRQP-OWYVNGRQSA-N 329.238 1.661 10 10 EDCE NCc1ccc(N2C[C@@H]3OCC[C@@]3(CO)C2)c(F)c1Br 2296384058 KNCXKZOZCQTIAT-FZMZJTMJSA-N 345.212 1.635 10 10 EDCE Cc1ccc(CNC[C@H]2CCS2(=O)=O)c(O)c1Br 2327619176 QXZKLMXRJVAAFA-SNVBAGLBSA-N 334.235 1.740 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2329326116 MELQUKUGBSFLIO-SLZGKSLHSA-N 327.222 1.399 10 10 EDCE C[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@@H]1N1CCOCC1 180229027 PJPBBIRPWMPIIM-XLIONFOSSA-N 345.487 1.676 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1C[C@H](O)CN1 1952346895 PCFMJZMGVODENV-RWMBFGLXSA-N 338.404 1.256 10 10 EDCE CN1CCC(CNC(=O)c2cccc(O)c2O)(N2CCCCC2)CC1 189444556 FIGGPXYEEUOOIA-UHFFFAOYSA-N 347.459 1.778 10 10 EDCE COc1ccccc1OCC(=O)NCCN1C(=O)CSC1=S 49755973 BWWQUEIOQCDUPV-UHFFFAOYSA-N 340.426 1.051 10 10 EDCE CC(C)C(=O)N1CCC(NC(=O)/C=C/c2ccc(O)c(O)c2)CC1 272510503 UPHLQNUGRWVLAE-GQCTYLIASA-N 332.400 1.874 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@@H]1CN(C(=O)C(C)(C)C)CCO1 369763589 PRDWVCCNEBUPKN-HNNXBMFYSA-N 334.416 1.624 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCCc2ccccc2)cc1F 283151777 FHJVXAHHJJSWCQ-UHFFFAOYSA-N 343.402 1.867 10 10 EDCE O=C(NCc1cc(Br)ccc1O)[C@@H](O)C1CCOCC1 804739765 RQUKBKUPLPPHAV-ZDUSSCGKSA-N 344.205 1.558 10 10 EDCE CN[C@H](c1ccc2c(c1)CCN2C)c1c(Br)nnn1C 2163141722 XLDXTANGSZQTBP-GFCCVEGCSA-N 336.237 1.879 10 10 EDCE C[C@H](NC(=O)C(=O)N(C)Cc1cc[nH]n1)c1ccc(N(C)C)cc1 807672108 WOZZSXDQHNZFQD-LBPRGKRZSA-N 329.404 1.312 10 10 EDCE COCCCOc1ccccc1NC[C@H](O)CN1CCN(C)CC1 819422221 SPGFUVNPZWLCQW-INIZCTEOSA-N 337.464 1.122 10 10 EDCE CNC(=O)[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 817638280 BAJHXBDMZPETCI-CQSZACIVSA-N 326.400 1.697 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NCc1cc(Cl)cc([N+](=O)[O-])c1O 826967094 CJUCUXRPTYAKFH-JOYOIKCWSA-N 330.724 1.374 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCC[C@]3(C2)NC(=O)NC3=O)cc1 835051498 GTTCJYAZSRRBMF-LKIHTYOGSA-N 328.416 1.440 10 10 EDCE Cn1ncc(CCC(=O)NCc2cccc(Br)c2O)n1 830529146 DMPDMCMDDUUVPT-UHFFFAOYSA-N 339.193 1.532 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N[C@H](CO)c2ccnn2C)cc1 837723941 AUNSUIQCHYOFMD-MRXNPFEDSA-N 345.447 1.799 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1895876756 YIPFGQOXENMIDY-OUAUKWLOSA-N 325.369 1.268 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)N3CCCCC3)C2)cc1 849415937 ILZFNVJQEAYJAL-AWEZNQCLSA-N 339.461 1.594 10 10 EDCE C[C@H]1CCC[C@@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)O1 855793392 MEDAMMBQMBXDBV-JQWIXIFHSA-N 342.417 1.451 10 10 EDCE CS(=O)(=O)CC1(CCNC(=O)NCc2c(O)cccc2F)CC1 923183553 RRKPGEFCXCVUIC-UHFFFAOYSA-N 344.408 1.545 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(=O)n(C)c3)C2)cc1 855229903 APPWVQHDJVNQBQ-CQSZACIVSA-N 327.384 1.403 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCO3)CC2)cc1 771454161 XYTCOBMEWCKBCM-FPLPWBNLSA-N 345.399 1.064 10 10 EDCE O=C1N[C@H](C(F)(F)F)CC[C@@H]1C(=O)N1Cc2cccc(O)c2C1 871198262 FCZPAHVQISQUSQ-CABZTGNLSA-N 328.290 1.692 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1C[C@@H]1C(C)C 1116669154 IDHSPIXXUVSCBX-RDBSUJKOSA-N 335.400 1.980 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CC[C@@]2(CNC(=O)C2)C1 789024352 JRHSNLZSQKVVAA-GOSISDBHSA-N 330.432 1.483 10 10 EDCE Cn1ncc(C(=O)NCCCN=[N+]=[N-])c1I 393582304 GIWQSQLAJPUNJY-UHFFFAOYSA-N 334.121 1.455 10 10 EDCE CSc1nc(C)c(CCC(=O)NCc2ccc(O)cc2O)c(O)n1 1162278523 JXZUNPRBYDVBSB-UHFFFAOYSA-N 349.412 1.873 10 10 EDCE O=C(C[C@H]1Oc2ccccc2NC1=O)NCc1c(O)cccc1O 1178905298 KRSRRWPHTRIHHZ-OAHLLOKOSA-N 328.324 1.504 10 10 EDCE O=C1COC[C@@]2(CNCc3ccc(N4CCCC4)cc3)COCCN12 1331966912 XNKBDLWMHXLOBI-LJQANCHMSA-N 345.443 1.004 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCC(C)(C)C)C2)cc1 1350650983 NFHODOHRNYRNAF-AWEZNQCLSA-N 347.459 1.943 10 10 EDCE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@@]12COCCN1C(=O)COC2 1351794315 MIEHLNCZQKQKKC-TYILLQQXSA-N 346.427 1.466 10 10 EDCE COC(=O)C[C@]1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCCOC1 1616974993 OBMBKMDNEWUONR-MRXNPFEDSA-N 348.359 1.691 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@@H](N2CCCC2=O)CC1 1557016294 HNJZJWYCCPFHCS-CQSZACIVSA-N 332.400 1.644 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)c2ncn(C)n2)cc1C 1716137453 LLAADZSJKVTMLA-ZDUSSCGKSA-N 331.420 1.430 10 10 EDCE C[C@@H](CCS(C)(=O)=O)NC(=O)c1cc2cc(O)c(O)cc2s1 1630463092 OVAQUGUZZVNEAJ-QMMMGPOBSA-N 343.426 1.866 10 10 EDCE CN1CCN(c2ccc(CN)c(Br)c2)[C@H](CCO)C1 2138082116 JKFHPJBVQSFWOQ-CYBMUJFWSA-N 328.254 1.411 10 10 EDCE CCc1ccc(S(C)(=O)=O)cc1C(=O)NCc1ccc(O)cc1O 1570462164 HCWOOZLBABGNQE-UHFFFAOYSA-N 349.408 1.994 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)Cc2n[nH]c(C)n2)cc1C 1649450523 XVLWCGOPCUHITB-ZDUSSCGKSA-N 345.447 1.609 10 10 EDCE C[C@@H](NC(=O)c1ccc(S(N)(=O)=O)cc1F)c1ccccc1O 1587447481 SMDFWSFHHOAFKV-SECBINFHSA-N 338.360 1.670 10 10 EDCE CNS(=O)(=O)c1cccc(C(=O)N[C@H](C)c2ccccc2O)c1 1587445060 SXYQFTFQSZOMKE-LLVKDONJSA-N 334.397 1.791 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cncs2)cc1C 1667794498 FNKIFOZZUUDPDM-CYBMUJFWSA-N 335.429 1.341 10 10 EDCE COC(=O)[C@@H](COC1CCC1)N(C)C(=O)Cc1ccc(O)c(O)c1 1596029992 VNFRMLDQQGOIPS-CYBMUJFWSA-N 337.372 1.209 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)C[C@H]2CCNC2=O)cc1C 1674196694 PGVMIXQJVHBQJA-GOEBONIOSA-N 347.459 1.514 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CC[C@@H]1COCCO1 1762515669 GBFUNHGBHZFDBM-OAHLLOKOSA-N 332.404 1.734 10 10 EDCE CCn1cc(C(=O)N(C)[C@H](C)CNCc2ccc(OC)c(C)c2)nn1 1698853323 XWBWPNUHHFWRQN-CQSZACIVSA-N 345.447 1.865 10 10 EDCE O=C(Cc1nnn[nH]1)Nc1cccc2c1C(=O)c1ccccc1C2=O 169864816 IZMCMLLJLIBXFO-UHFFFAOYSA-N 333.307 1.156 10 10 EDCE CC[C@@](C)(N)C(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1866113326 PHYRKBBXKGYVTQ-MAUKXSAKSA-N 329.448 1.819 10 10 EDCE NCc1cc(F)c(N2CCO[C@H]3COC[C@H]32)cc1Br 1877649232 WHXHPWSIGUIZAJ-OLZOCXBDSA-N 331.185 1.651 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985099030 FYKQOGQVIFMGPT-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)Nc1ccc(N)cc1 2029274211 FBYDCABMKNMVGV-UHFFFAOYSA-N 331.195 1.566 10 10 EDCE C[C@@H]1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C[C@H]1O 300006472 MESRSFMXDOFXHS-BLBGDKDGSA-N 340.221 1.608 10 10 EDCE CCNCc1ccc(N2CC[C@@](O)(CO)C2)c(Br)c1 314203558 PXCOKSSUSJNKLO-AWEZNQCLSA-N 329.238 1.492 10 10 EDCE Cn1c(O)nnc1CNCc1cc(Cl)cc(Br)c1O 708173573 WAOKYBMQPVQLMB-UHFFFAOYSA-N 347.600 1.932 10 10 EDCE CC[C@@H]1CCCCN1CCNC(=O)c1cnn2c(O)cc(C)nc12 2062381019 RGATVAOEIYTILJ-CYBMUJFWSA-N 331.420 1.738 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N(C)c2ncccc2OC)c1 255337615 AZTRQEHWTKIPJM-SREVYHEPSA-N 326.356 1.521 10 10 EDCE C[C@@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)c(Br)c1 2190462178 VSHVOIBIAJWZBJ-MGXFYRGHSA-N 341.249 1.932 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3CNC[C@@H]3C2)c1O 2227746321 KBXMFBKZUUJTOE-AOOOYVTPSA-N 327.222 1.815 10 10 EDCE CC(=O)Nc1ccc(NC=C2C(=O)NC(=S)N(C3CC3)C2=O)cc1 2297057088 KTHQSEQYFSUPJY-UHFFFAOYSA-N 344.396 1.347 10 10 EDCE COc1ccc(O)c(CNC(=O)NCc2ccnc(N(C)C)c2)c1 114587254 AEVKKEBXPVKXFP-UHFFFAOYSA-N 330.388 1.861 10 10 EDCE O=C1CCc2cc(N3CCN(C(=O)[C@H]4CCCO4)CC3)ccc2N1 62093370 UWNZNNIAZMMXSW-MRXNPFEDSA-N 329.400 1.399 10 10 EDCE O=C(O)CN(Cc1c(O)cccc1Cl)[C@@H]1CCS(=O)(=O)C1 128810761 XMYIFLRLMVJGCH-SECBINFHSA-N 333.793 1.119 10 10 EDCE C[C@@H]1CC[C@H](C(N)=O)CN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 78490030 NWVMQPXKMVCEHJ-ZBFHGGJFSA-N 346.475 1.297 10 10 EDCE C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCS1(=O)=O 127877521 MWJMHWXXEQDEBG-QMMMGPOBSA-N 334.781 1.573 10 10 EDCE COc1cc(N(C)C[C@@H]2CCCS(=O)(=O)C2)cc(OC)c1OC 283991222 GGGWUKQCTGFDLT-LBPRGKRZSA-N 343.445 1.973 10 10 EDCE CCN1C(=O)[C@@H]2CN(Cc3cc(Cl)cc(C)c3O)CCN2C1=O 378440713 DPIHFJNLNGXQEU-ZDUSSCGKSA-N 337.807 1.822 10 10 EDCE Cc1ccc(CNC(=O)C[C@H]2CNC[C@@H]2O)c(O)c1Br 2381128932 BHMDUDAMGBHODH-QWRGUYRKSA-N 343.221 1.050 10 10 EDCE C[C@@H](NC(=O)NCc1cnn(C)n1)c1ccc(N2CCOCC2)cc1 804988568 FCUUPTBTLODSMS-CYBMUJFWSA-N 344.419 1.212 10 10 EDCE COc1ccc(O)c(CN[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)c1 800541942 WWAMEKYIKDXJMC-BXUZGUMPSA-N 328.434 1.208 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)c3nnn(C)c3C)C2)cc1 819583859 AZBMQFOJHNVSQS-CYBMUJFWSA-N 329.404 1.388 10 10 EDCE COc1cccc(CNC(=O)N[C@@H]2CC[C@H](C)S(=O)(=O)C2)c1O 822001269 SDDZUAQVXPRAGX-CMPLNLGQSA-N 342.417 1.166 10 10 EDCE CC(C)(C)n1nnc(C(=O)NCCCSc2nccs2)n1 827474680 JGBYRMNEAYZAEH-UHFFFAOYSA-N 326.451 1.797 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H](N)C(C)(C)C1 903735838 QCWUCOJQERWNLZ-HNNXBMFYSA-N 333.432 1.327 10 10 EDCE C/C=C\[C@@H](O)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 909855622 IHYSWHGBFPQMCQ-PYLYLYNFSA-N 326.343 1.355 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@]2(C)C[C@H](O)CN2C)cc1 911890934 DMQZKURDIPMSFY-YJBOKZPZSA-N 335.448 1.045 10 10 EDCE C[C@@H]1CCCc2nc(S(=O)(=O)NCCc3ccc(N)cc3)cn21 842820939 AOPWNZUSSOWITB-GFCCVEGCSA-N 334.445 1.884 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@@H]3CCNC[C@@H]3C)CC2)cc1 841779185 NBFSPGRVMFNPOU-KBXCAEBGSA-N 346.475 1.961 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H](C[C@@H]3CCCO3)C2=O)cc1F 924544298 XUAKDUVCAJSJGF-JSGCOSHPSA-N 335.379 1.881 10 10 EDCE CN1C[C@H](CCNCc2ccc(N3CCOCC3)c(F)c2)CC1=O 922490300 XZEATXLMZWRGRB-OAHLLOKOSA-N 335.423 1.620 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CC(=O)N(C4CC4)C3)C2)cc1 855231745 LQUWAQAZDSVDRF-ZIAGYGMSSA-N 343.427 1.401 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CSc1nnc2nc[nH]n12 920118953 WFKNICLMHIELEG-UHFFFAOYSA-N 345.432 1.269 10 10 EDCE CS(=O)(=O)CC1(CCNC(=O)NCCc2ccc(N)cc2)CC1 851662215 CNWZWYHEOQSNQP-UHFFFAOYSA-N 339.461 1.325 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3C[C@@H](O)C34CCC4)C2)cc1 854297156 NTHSFVKMVZYOQX-IAOVAPTHSA-N 345.443 1.877 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc([N+](=O)[O-])n[nH]3)C2)cc1 855224224 JBFHFYWPXVLBPP-JTQLQIEISA-N 331.332 1.335 10 10 EDCE CO[C@@H]1CC[C@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 870714836 ANASXUAEAZHGLC-CMPLNLGQSA-N 342.417 1.403 10 10 EDCE CCON(CC)C(=O)CNC(=O)c1cc2cc(O)c(O)cc2s1 899129281 BAWFNQFEFLNBFH-UHFFFAOYSA-N 338.385 1.842 10 10 EDCE Cc1cc(CC(=O)NCCN(C)CCO)c(C)n1-c1ccccc1 899741005 KZVJMCQGJHOCML-UHFFFAOYSA-N 329.444 1.677 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)NC[C@@](C)(O)CO)c2C)cc1 798264593 LLTBNNMOTSHFLS-GOSISDBHSA-N 332.400 1.576 10 10 EDCE COc1ccc(CNC(=O)c2ccc(Cn3ccnn3)o2)c(O)c1 1155573874 BBCAIKHGOTXJLZ-UHFFFAOYSA-N 328.328 1.564 10 10 EDCE CN(Cc1ccccc1)C[C@@H](NC(=O)c1ccc(O)c(O)c1)C(=O)O 702165148 DMADXOUAFOSATR-CQSZACIVSA-N 344.367 1.413 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)C[C@]2(C)CO)cc1Br 698136289 FZGPXVUUTRIXQZ-DRCTWCGVSA-N 329.238 1.791 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2CN(C)C(=O)N2)cc1C 1503413949 CFCBGAICXBTZAW-DZGCQCFKSA-N 348.447 1.012 10 10 EDCE CN1CC[C@H]2[C@H](CCCN2C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1351857202 WZOWVGBQUSZLKW-ZBFHGGJFSA-N 343.427 1.177 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC(=O)Nc2cccnc2)cc1 1442801924 LPDRIWCSRYJECF-UHFFFAOYSA-N 326.316 1.613 10 10 EDCE CC(C)(O)[C@@H]1CN(c2ccc(CO)cc2Br)CCO1 2117518129 VMBLMTFIJKBJLJ-ZDUSSCGKSA-N 330.222 1.918 10 10 EDCE CO[C@H](C)C(=O)N[C@@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1701632548 UUQLZPMYBJEOBD-WDEREUQCSA-N 349.391 1.461 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1C 1716292954 VKZMSTJMKZMCMF-LPUOJRKPSA-N 333.388 1.431 10 10 EDCE NC[C@@H]1CN(C(=O)c2cccc(O)c2O)CCN1Cc1ccccc1 1914862253 MEYZKAGWRMYVMR-OAHLLOKOSA-N 341.411 1.383 10 10 EDCE COc1cccc(CNC(=O)c2cnn3cccc(OC)c23)c1O 1630366439 PXIMDBUTNDKHNM-UHFFFAOYSA-N 327.340 1.987 10 10 EDCE COC[C@@H](C)NCC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1497329031 LNZXLBZSHPGKSA-NWDGAFQWSA-N 335.408 1.982 10 10 EDCE CC(C)(C)OC(=O)C1=NO[C@H](C(=O)NCc2c(O)cccc2O)C1 1645363313 QDXWAKWYUFCVOZ-ZDUSSCGKSA-N 336.344 1.201 10 10 EDCE C[C@H](NC(=O)NCc1cn(C2CC2)c(=O)nc1O)c1ccccc1O 1675599975 LNNQUWZOUBXGDI-JTQLQIEISA-N 344.371 1.550 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](C(=O)NCCCN=[N+]=[N-])[C@@H]1CCOC1 1964885302 YVEVXYQKHRNFLS-VXGBXAGGSA-N 341.412 1.980 10 10 EDCE CCNCc1ccc(N(CCO)C2COC2)c(Br)c1 1915498932 ZSAYDZNYAGVJFN-UHFFFAOYSA-N 329.238 1.756 10 10 EDCE O=C(O)[C@@H]1C[C@H](O)CCN1Cc1cc(Br)ccc1O 2136384928 VSTKHGAEXZEDHQ-MNOVXSKESA-N 330.178 1.565 10 10 EDCE COC[C@@](C)(N)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951993115 MFISJYMOEJZTNG-WMLDXEAASA-N 340.420 1.897 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCCCN=[N+]=[N-])C[C@H](O)C1 1990022723 IQFFKWPKEKGTHQ-WJONMLJTSA-N 327.385 1.611 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCc2ccc(N)cc2)C[C@@H](O)C1 1999475121 MYOYKENFNKPBGP-MRXNPFEDSA-N 335.448 1.725 10 10 EDCE Cn1ncc(NC(=O)OC(C)(C)C)c1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003169943 NMTWTRLJJBRLRB-MGCOHNPYSA-N 336.392 1.646 10 10 EDCE C[C@H]1CN(c2ccc(CN)cc2Br)CCS1(=O)=O 707125287 JPVPGSYHGJZUBM-VIFPVBQESA-N 333.251 1.531 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N1C[C@@H](O)C2(CC2)C1 2058986164 KPAINAPACHQWTR-QGZVFWFLSA-N 328.412 1.520 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@]3(CNC(=O)N3)C2)c(Br)c1 2177669318 VBOMLNKCNMXGHL-YMTOWFKASA-N 340.221 1.764 10 10 EDCE N[C@@H]1CC(C(=O)N2CCCc3c(Br)cccc32)=C[C@@H]1O 2188021636 NWPFOMKYUMAKBF-OCCSQVGLSA-N 337.217 1.747 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H]1CNC(=O)COc1ccc(N)cc1 1906804435 BIGOFWKLZGBJSV-SMDDNHRTSA-N 335.404 1.677 10 10 EDCE C[C@@H](O)c1ccc(N2CCCC2(CO)CO)c(Br)c1 2089868664 UGOLGNUCYYMZPX-SNVBAGLBSA-N 330.222 1.826 10 10 EDCE CC1(C)CN(c2ccc(CN)cc2Br)CCS1(=O)=O 2113899736 ABBCKROBLGPRHT-UHFFFAOYSA-N 347.278 1.921 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]12C[C@](NC(=O)OC(C)(C)C)(CO1)C2 2243120056 RDOSFFCSOXDDMF-HDJSIYSDSA-N 325.369 1.581 10 10 EDCE CC(C)(C)OC(=O)NCc1cc(F)ccc1Nc1nnc(=N)[nH]n1 2248366754 BZSLLOSONNKKCE-UHFFFAOYSA-N 335.343 1.587 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)c(Br)c1 2355338504 BVUPWACLWUUMEU-UDQBKAKJSA-N 342.233 1.823 10 10 EDCE COC(=O)[C@H](C)CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 177596044 YDQIJIYKJLKPOM-CQSZACIVSA-N 348.443 1.711 10 10 EDCE CN1CCC[C@H]1C(=O)N1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1 178146708 SUKUVSHQMXDFDH-HNNXBMFYSA-N 348.403 1.039 10 10 EDCE CC(=O)N1CC[C@H](OC(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255058665 OENSXSYDMPWMPH-GINYUPMKSA-N 344.411 1.700 10 10 EDCE CCOC(=O)[C@H](C)CNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255659919 JVKLQLQNOUAXBO-WUKHSURWSA-N 346.427 1.852 10 10 EDCE CC[C@](N)(COC)C(=O)NCc1ccc(C)c(Br)c1O 2381139077 ZYNYJPLQHIGIRC-AWEZNQCLSA-N 345.237 1.833 10 10 EDCE C[C@H]1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)CC(=O)N1C 282385601 NZANWNAZZDMQCU-PXTSUWAFSA-N 343.427 1.226 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](NCc1cc3c(cc1O)OCO3)C2 818234670 PZGWOCYBKXTITL-UHTWSYAYSA-N 334.372 1.830 10 10 EDCE COC1(CS(=O)(=O)NCc2ccc(N(C)C)cc2)CCOCC1 845802170 KOIXRVPUIHBVLU-UHFFFAOYSA-N 342.461 1.368 10 10 EDCE C[C@H]1CC2(CO1)CC(NC(=O)C(=O)NCc1ccc(N(C)C)cc1)C2 929238643 QXFKFWAKZOIIPI-XIWWETDGSA-N 345.443 1.443 10 10 EDCE Cn1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c(Cl)n1 856215591 MQBCKLYVRVRLPT-UHFFFAOYSA-N 348.834 1.965 10 10 EDCE CCn1nccc1CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852448080 BTJZVQRSXCCBIP-AWEZNQCLSA-N 343.431 1.990 10 10 EDCE Cc1cc(CN2CCN(C(=O)N3CCNCC3)CC2)ccc1N(C)C 923398986 PGKDHWDIEVPIKE-UHFFFAOYSA-N 345.491 1.204 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CC3(O)CCC3)CC2)cc1F 859161276 MHYNHPUMAJXWKA-OAHLLOKOSA-N 338.423 1.622 10 10 EDCE CC1(C)OC[C@@H]2C[C@@]21NC(=O)c1cc(NS(C)(=O)=O)ccc1O 862688981 JMFHPMLTIMMXET-BJOHPYRUSA-N 340.401 1.061 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CC[C@@H]3C[C@H]3C2)c1 862374718 PSZSRGKSVAGTIJ-IJLUTSLNSA-N 338.429 1.930 10 10 EDCE O=S(=O)(c1c[nH]nc1C(F)(F)F)N1Cc2cccc(O)c2C1 867691232 SHQHWMPJJPCBPL-UHFFFAOYSA-N 333.291 1.839 10 10 EDCE NC(=O)CN1C(=O)/C(=C\c2cncc3ccccc23)SC1=S 772802116 QKRSNIYARFVMJV-LFYBBSHMSA-N 329.406 1.921 10 10 EDCE Cn1ncc(Br)c1/C=C1\C(=O)NN(c2ccccc2)C1=O 782325052 KPFVVXYZBKIIIJ-JXMROGBWSA-N 347.172 1.644 10 10 EDCE CCS(=O)(=O)C[C@H](C)NC(=O)c1cc2cc(O)c(O)cc2s1 1136765551 NZUBMKUVTNUJRV-QMMMGPOBSA-N 343.426 1.866 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3C[C@H](O)[C@H](O)C3)c2C)cc1 1155973219 PWIDTUPSCBQSAS-WVJCCSTMSA-N 344.411 1.717 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CCCN1Cc1ccccn1 1153885487 PFWCLHCDWVVOIW-INIZCTEOSA-N 327.384 1.774 10 10 EDCE O=C(CN1Cc2ccccc2OC1=O)NCc1ccc(O)cc1O 1162278511 JLHXRIYFSUFZGU-UHFFFAOYSA-N 328.324 1.729 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC=C(C)C)C2)cc1 1327991922 LCFLQIQPUNVEGD-AWEZNQCLSA-N 331.416 1.473 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC3CC(C)C3)C2)cc1 1347968690 ZFUYEAOGXZYNBL-NRXISQOPSA-N 345.443 1.552 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2nocc2C)cc1C 1283816889 LFMGHEGLTVYEFD-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE COc1ccc(CNC(=O)Cn2nnnc2-c2ccccc2)c(O)c1 1467471280 WSTPHHPPWJBSDG-UHFFFAOYSA-N 339.355 1.371 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3cnnn3C)CCC2)cc1C 1700130596 IIBYWMNSXQPBJB-UHFFFAOYSA-N 343.431 1.574 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@]23COC[C@@H]2C3)cc1C 1716296462 KMIDJARIWFMBAE-PDNKVIRKSA-N 330.428 1.802 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC(OC[C@@H]2CCOC2)CC1 1558957073 PGHGHGGUFBGVCX-LLVKDONJSA-N 339.363 1.895 10 10 EDCE O=C(CNC(=O)Nc1cccc([N+](=O)[O-])c1)NCc1ccccc1O 1566374133 VLCIUUSLEPPVSA-UHFFFAOYSA-N 344.327 1.738 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1C[C@@H]1C)NC(=O)c1cc(OC)nc(OC)c1 1499276686 IFULWDALYNETCA-DRZSPHRISA-N 335.404 1.379 10 10 EDCE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CC(CO)(CO)C2)c1 1637849921 LLIJAMSULGFIGX-UHFFFAOYSA-N 328.412 1.829 10 10 EDCE O=C(CCNC(=O)c1ccc(F)cc1)NCc1c(O)cccc1O 1647270108 MSUAXBSRMZOOPH-UHFFFAOYSA-N 332.331 1.673 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cccc(-n2ccnc2O)c1 1644753762 JACMXDKLNYQJMJ-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE CCOC(=O)[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 1648419459 CQRZHRQCIZFDEN-LBPRGKRZSA-N 334.332 1.253 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCO[C@]3(CCOC3)C2)cc1 1597917840 QZAXVKMHDYDYGO-CZUORRHYSA-N 332.360 1.917 10 10 EDCE CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NCc1c(O)cccc1O 1597574772 SLKOAPPZQSONNJ-NSHDSACASA-N 334.294 1.417 10 10 EDCE COc1ccc(Br)c(CNC[C@@](C)(O)CCO)c1O 1966083754 HXUQUVFKDUDIED-ZDUSSCGKSA-N 334.210 1.386 10 10 EDCE CN1CCCC[C@H]1CN1CCN(Cc2cc3c(cc2O)OCO3)CC1 152589824 AFKCXOUPYQIEAE-INIZCTEOSA-N 347.459 1.723 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)/C(=C\c2ccc(F)c(F)c2)SC1=S 1858596016 MIRACACIIDDGMM-BZFUBLJMSA-N 345.348 1.612 10 10 EDCE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)[C@@H]1CCS(=O)(=O)C1 1890271666 RZYIKRDABCXPAN-UXLLHSPISA-N 348.468 1.726 10 10 EDCE CCN(CC)c1ccc(CNCC(=O)N2CCC[C@@H]2C(=O)O)cc1 1857866522 OGAASLXDKMIJPD-MRXNPFEDSA-N 333.432 1.698 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1COC[C@H]1NC(=O)OC(C)(C)C 1900606982 ITJFQGXHRMSWMP-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H](NCc2ccc(O)c(O)c2)C1 1946802384 OLJVZUYUZZLZDO-CYBMUJFWSA-N 338.404 1.823 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@]1(C(=O)O)c1ccc(O)c(O)c1O 1952723833 LEBNBWMMBKEKRG-VFZGTOFNSA-N 325.317 1.423 10 10 EDCE CNCc1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)cc1Br 2146312602 YDQCSPXPLLUVDJ-GJZGRUSLSA-N 341.249 1.350 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(O)c(O)c2)[C@@H](O)C1 2005084606 JVNFVZHMSJJGLO-DOMZBBRYSA-N 338.404 1.558 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2010402027 LDZJFTIFNZTNMC-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE CN1CCCc2cc(C=CC(=O)N[C@H]3CCS(=O)(=O)C3)ccc21 2041531331 SHFZVRLJROMRKM-HNNXBMFYSA-N 334.441 1.386 10 10 EDCE CNCc1ccc(N(C)C[C@H]2CN(C)CCO2)cc1Br 707884659 BBFDRKHMCHJEDR-CQSZACIVSA-N 342.281 1.935 10 10 EDCE CC(C)CN(CC(N)=O)c1cc(Br)c(CN)cc1F 382370779 MIHZNQXCJBPRCD-UHFFFAOYSA-N 332.217 1.995 10 10 EDCE CN1C[C@H]2C[C@H]1CN2c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2187612420 HNZPTLFUTDWKOP-HHURGBBESA-N 338.205 1.327 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)cc1Br 2089926809 NCAPQIIAOFDPEH-OWYVNGRQSA-N 328.254 1.580 10 10 EDCE CNCc1ccc(N2CC[C@@]3(C[C@H](O)CO3)C2)c(Br)c1 2201779764 PQCYIJYGUWWRHK-SWLSCSKDSA-N 341.249 1.899 10 10 EDCE CO[C@@H]1CCN(CCNCc2c(O)cccc2Br)C1 2267885956 HIPJZGQBJLYKTE-LLVKDONJSA-N 329.238 1.965 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2c[nH]c(=N)cc2C)s1 2284701536 BCAIZSUKUVOSPQ-UHFFFAOYSA-N 330.460 1.459 10 10 EDCE NC(=O)[C@@H]1C[C@H](N)CN(c2ccc(OCc3ccccc3)cc2)C1 2299504271 LZAOZSWIGLWRRI-CVEARBPZSA-N 325.412 1.905 10 10 EDCE O=C(O)CNC(=O)CN1C(=O)C(=Cc2ccsc2)SC1=S 2323831223 FZPKKDQVUDJRDI-UHFFFAOYSA-N 342.423 1.150 10 10 EDCE O=C1NCCN(c2ccc(OCc3ccccc3)cc2)[C@H]1C1CNC1 2326758232 QSNKZWPTNDWZNL-IBGZPJMESA-N 337.423 1.790 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2COCCO2)c(O)c1Br 2352624705 GSGDZAOJEBWNGY-SNVBAGLBSA-N 330.178 1.495 10 10 EDCE Cc1ccc(CNC(=O)c2cn(C)nn2)c(O)c1Br 2352625691 JZEUNNKHZPUFQD-UHFFFAOYSA-N 325.166 1.522 10 10 EDCE C[C@H](NC1=NC(=O)/C(=C\c2ccccc2-n2cccn2)S1)C(=O)O 33616566 IAKMWWMHZXECRI-YWEFTTLKSA-N 342.380 1.905 10 10 EDCE C[C@@H](O)CN1CCN(Cc2ccc(N3CCOCC3)cc2)C[C@H]1C 120610350 WGACVTZPMINLJM-IAGOWNOFSA-N 333.476 1.410 10 10 EDCE COC(=O)Cn1ncc(NC(=O)NCc2ccc(N(C)C)cc2)c1C 194759976 TVDCNSQPIIXUPD-UHFFFAOYSA-N 345.403 1.752 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1cn(C[C@H]2CCOC2)nn1 529510429 BLMFBUYOVYHPPS-SNVBAGLBSA-N 336.779 1.604 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@@H](NC(=O)NCc2ccc(N(C)C)c(F)c2)CC1=O 363318117 KZZIIJXVXBEFOS-FFSVYQOJSA-N 348.422 1.700 10 10 EDCE Cc1ccc(CN=c2ncc(C(=O)O)c[nH]2)c(O)c1Br 2380724594 ALBXGMIYADCCBN-UHFFFAOYSA-N 338.161 1.985 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](F)C2CNC2)c(O)c1Br 2381129686 NLRHCVPJRMKKCT-LBPRGKRZSA-N 345.212 1.979 10 10 EDCE CCN1CC[C@@H](NC(=O)NCCCSc2nccs2)C1=O 802244643 YTNYNITUTCTTGR-SNVBAGLBSA-N 328.463 1.545 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)CCc3cnn(C)n3)C2)cc1 819587201 IBCXIEBYDOGRGK-CQSZACIVSA-N 343.431 1.399 10 10 EDCE CCc1nc(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)no1 818090332 CJBVFQPOFYCNKH-LBPRGKRZSA-N 330.388 1.897 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)[C@H]1CCN=C2C1=NNN2C 816914091 CZEILWGTWGKVDH-ZDUSSCGKSA-N 329.404 1.355 10 10 EDCE CCN1CCN(CCCNC(=O)/C=C\c2ccc(O)c(O)c2)CC1 588403583 PWYFRYPESGNFIS-ALCCZGGFSA-N 333.432 1.255 10 10 EDCE Cc1cn(C2CCOCC2)nc1C(=O)NCc1ccc(O)cc1O 910956000 IUAMMGQHVVYKJW-UHFFFAOYSA-N 331.372 1.884 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1 841137165 FKOSXZFRSPZNQR-XHSDSOJGSA-N 331.416 1.749 10 10 EDCE c1nc(-c2nnn(Cc3ccc(N4CCOCC4)cc3)n2)cs1 920339567 KALQBEUPCZKHAU-UHFFFAOYSA-N 328.401 1.682 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1cn[nH]c1 852229257 PNFDSBAUBVOKCL-ZDUSSCGKSA-N 343.431 1.931 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCn3cnccc3=O)C2)cc1 855225302 JOSMZVUXZVHPTH-AWEZNQCLSA-N 342.399 1.037 10 10 EDCE O=C(NCCCSc1nccs1)N1CCOC[C@H]1CCO 758581025 AVQSEGBVBWRRHS-LLVKDONJSA-N 331.463 1.418 10 10 EDCE C[C@H](NC(=O)[C@H](C(=O)O)C1CC1)c1ccc(N2CCOCC2)cc1 852950864 MYXARMNKMKXUIB-BLLLJJGKSA-N 332.400 1.811 10 10 EDCE CCOC(=O)[C@H](CC)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855224537 LMRUAQFAFXHUIZ-XJKSGUPXSA-N 334.416 1.979 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@H]3CCC(=O)N3C)C2)cc1 855227726 ZLYPJDSCGAMWOJ-DZGCQCFKSA-N 331.416 1.401 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3C[C@@H](O)C34CCC4)nc12 852584960 VMHMULZEADIWFO-CHWSQXEVSA-N 346.387 1.005 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2c(O)ccc3ccncc23)C1 863339885 GMSIIASNBBJFQD-CYBMUJFWSA-N 349.456 1.702 10 10 EDCE C[C@H](Oc1cccc(CO)c1)C(=O)NCCc1ccc(O)c(O)c1 764849509 RSMQDLHBPBCCLG-LBPRGKRZSA-N 331.368 1.716 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](O)[C@H](C)O)c1 871144524 YHEDOMZNXSXUQI-SUMWQHHRSA-N 330.384 1.378 10 10 EDCE Cn1ncc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c1C1CC1 770759315 GIEPRXFHFGBYFK-UHFFFAOYSA-N 344.371 1.006 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(F)(F)C[C@H]2CO)c([N+](=O)[O-])c1 780609074 CNAKUSNPEOJXGQ-TZNOJPMFSA-N 342.298 1.987 10 10 EDCE CN1CCN(c2ccc(CN3CC(F)(F)C[C@H]3CO)cc2)CC1 783703331 XZUUXXFCUDWQTQ-INIZCTEOSA-N 325.403 1.640 10 10 EDCE CN1CC[C@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)CC1=O 898009478 QPUMVHFJKGVBQQ-VIFPVBQESA-N 334.397 1.911 10 10 EDCE Cc1ccc(C(=O)NCCC(=O)NCc2cc(O)ccc2O)c(O)c1 1303225264 DOKUDLAFWDWSAX-UHFFFAOYSA-N 344.367 1.548 10 10 EDCE CNS(=O)(=O)c1ccc(CCNC(=O)c2cc(O)cs2)cc1 1302529424 AZHOJUOBENLMJQ-UHFFFAOYSA-N 340.426 1.334 10 10 EDCE CCN(CCNCc1nnnn1-c1ccc(OC)cc1)C(=O)C1CC1 1320658065 AIWXZRSUIBXEGP-UHFFFAOYSA-N 344.419 1.019 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2n[nH]c(C)c2C)cc1C 1320200240 FHTSOXBYDFDKQK-HNNXBMFYSA-N 346.431 1.224 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@]2(CCCOC2)C1 1330151453 HFYGXSNCVQRXMS-SFHVURJKSA-N 332.400 1.380 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)[C@H](C)C2CC2)cc(OC)n1 1337099054 CKYCEGQRVKXFRM-VXGBXAGGSA-N 349.431 1.722 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H]2CCC(=O)NC2)cc1C 1268803037 ZPLXTFBBGAXWHA-INIZCTEOSA-N 347.459 1.468 10 10 EDCE COc1ccc(-n2nnnc2CNCCN(C)C(=O)C=C(C)C)cc1 1266634497 UNHNKBGPWIBJHP-UHFFFAOYSA-N 344.419 1.185 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cn(C)cn2)cc1C 1268527630 KLRKKIQSOUBVEQ-PLNGDYQASA-N 328.416 1.813 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccnc(F)c2)cc1C 1268299026 MBRYYBZBEJTWLH-HNNXBMFYSA-N 347.390 1.418 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3C[C@@H]4CC[C@H]3O4)C2)cc1 1353843418 GWCYPBSPJRGYJT-VJUNAUMWSA-N 331.416 1.893 10 10 EDCE COc1cccc(CNC(=O)c2cccc(Cn3cncn3)c2)c1O 1445972479 YGOHTVTZQGATNJ-UHFFFAOYSA-N 338.367 1.971 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cc(C)on2)cc1C 1284382163 VPUJHSWQTAYGJO-OAHLLOKOSA-N 347.415 1.523 10 10 EDCE NC(=O)[C@H]1OCC[C@@H]1NCc1cc(Cl)cc(Br)c1O 2117460409 PTDBBSJRLXFHKN-ONGXEEELSA-N 349.612 1.541 10 10 EDCE NC(=O)[C@@H](C1CC1)N(CC1CC1)C(=O)/C=C\c1ccc(O)c(O)c1 1454964251 WUVAQYQSBTWQIX-RLXIPRIJSA-N 330.384 1.614 10 10 EDCE COc1ncnc(OC)c1C(=O)NCc1ccc2cccnc2c1O 1299722099 YUJQYPSXUOSHCP-UHFFFAOYSA-N 340.339 1.678 10 10 EDCE CO[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H]1C 1298140807 WWIMJJDWLDITPZ-IINYFYTJSA-N 342.417 1.261 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2c(C)ncn2C)cc1C 1480480963 IROKOKGACYORIY-CYBMUJFWSA-N 330.432 1.954 10 10 EDCE Cn1cc(C[C@@H]2CCC[C@H]2NC(=O)Cc2ccc(O)c(O)c2)cn1 1629623393 IMCDEUVSBUVCDS-LSDHHAIUSA-N 329.400 1.901 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)CN2CCCC2=O)cc1C 1715783087 DXJBNNUKCIFZOO-ARJAWSKDSA-N 345.443 1.388 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H]2CCCNC2=O)cc1C 1716307778 XJHRYUUORPRHIE-CWDCEQMOSA-N 345.443 1.292 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@@H]2COC(=O)N2)C2CC2)cc1C 1713109403 UYJWDPGHVMBDEO-GJZGRUSLSA-N 347.415 1.096 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CC(C)(C)C(=O)NC 1498675295 OZSJIDBVDPBPOG-UHFFFAOYSA-N 345.447 1.955 10 10 EDCE CN1C(=O)C[C@H](C(=O)NCc2ccc(O)cc2O)c2ccccc21 1639441592 ZMKHBGLNAZMIFH-AWEZNQCLSA-N 326.352 1.864 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H]2CCNC(=O)C2)cc1C 1497565269 PWPOMIGNNFNINC-QDLOVBKTSA-N 345.443 1.292 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@@H](C(F)(F)F)[C@H](CO)C1 1640497801 AULPTZPZKZWHDI-WDEREUQCSA-N 333.306 1.660 10 10 EDCE Cn1c(=O)oc2cc(NC(=O)Cc3ccc(O)c(O)c3)c(F)cc21 1642338603 GVMYRZAFFZOWRM-UHFFFAOYSA-N 332.287 1.863 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC[C@]2(CCS(=O)(=O)C2)C1 1651020909 ULHXWSBWBYDCOP-HNNXBMFYSA-N 343.376 1.278 10 10 EDCE COC(=O)c1ccc(CNC(=O)c2c(F)ccc(O)c2O)cc1OC 1654426725 SMSKFRAYSFGILH-UHFFFAOYSA-N 349.314 1.962 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)C(C)(C)NC(C)=O)cc1C 1676446288 BCEGYHPUFJORTJ-CQSZACIVSA-N 349.475 1.855 10 10 EDCE C[C@H](NC(=O)C(=O)N1CC[C@H]1C)c1ccc(N2CCOCC2)cc1 1119436570 CCHUFMBASAAYSZ-KGLIPLIRSA-N 331.416 1.321 10 10 EDCE Cc1ccc(O)c(CNCC(=O)N2CCN(c3ccccn3)CC2)c1 1857868051 OZKMKWJTACITRX-UHFFFAOYSA-N 340.427 1.534 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985100087 CWEGMUIPQJBVIW-NXEZZACHSA-N 327.385 1.467 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)CCc2ccc(N)cc2)CO1 1999129380 VRHIODNWMBJHTN-AWEZNQCLSA-N 335.404 1.869 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)NCc1ccc(N)cc1 2022838195 KHXLJTQQQOLZFC-CYBMUJFWSA-N 337.420 1.549 10 10 EDCE O[C@H]1C[C@H](O)CN(c2ccc(CNC3CC3)cc2Br)C1 2161356015 BQSGCIDEZNSHMW-STQMWFEESA-N 341.249 1.633 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCCC[C@H]3CO)c(Br)cc21 92775388 QDRQCKLTWXXGSZ-ISVAXAHUSA-N 340.221 1.752 10 10 EDCE Oc1ccc(Br)cc1CNC[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@H]2O 2174411402 DJPSSSOQCIFMJE-AOZIVVCUSA-N 342.233 1.622 10 10 EDCE CNCc1ccc(N2C[C@H](CO)OCC23CC3)c(Br)c1 2183972095 PBHGRXMIJGGRFO-GFCCVEGCSA-N 341.249 1.899 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H]2CN3C(N)=O)c(F)c1Br 2192282351 MHPXMFQVJKSALK-IUCAKERBSA-N 343.200 1.389 10 10 EDCE COCCN(C)C1CN(c2ccc(CN)c(Br)c2F)C1 2192548357 NHIGSIMFEFZAIL-UHFFFAOYSA-N 346.244 1.814 10 10 EDCE O=C(O)[C@@H]1[C@H]2OCCN(Cc3ccc(Br)cc3O)[C@H]12 2092844065 JOXBQCYYLPLHSK-QJPTWQEYSA-N 328.162 1.439 10 10 EDCE C[C@H](O)c1ccc(N2CCOC[C@@H](CO)C2)cc1Br 2098241623 COPMVAKKSMYFAX-WDEREUQCSA-N 330.222 1.948 10 10 EDCE CCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1ccccc1C 491186793 QJYNYXWWFYLEDJ-KHPPLWFESA-N 327.384 1.459 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2354479484 YPHVDERAVJLPHU-LHVMMRPKSA-N 341.249 1.660 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)N1CCC2(C1)OCCO2 108811358 LAUUMMGRCQXNCW-ZZXKWVIFSA-N 344.411 1.512 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCN(CC(F)F)CC2)cc1 57916139 HXGRMCPGRIBNRQ-UHFFFAOYSA-N 340.418 1.252 10 10 EDCE C[C@H]1Oc2ccc(S(=O)(=O)Nc3ccc(O)cc3)cc2NC1=O 71538600 YBMLFDJMDXHRBN-SECBINFHSA-N 334.353 1.912 10 10 EDCE CCC[C@H]1C(=O)NCCN1c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 270844811 XJUORRDSUGTKAQ-OWNNVSBGSA-N 347.371 1.886 10 10 EDCE C[C@H](C1CC1)n1nccc1NC(=O)C(=O)NCc1ccccc1O 277520024 OXXMEQYOCFHGFF-LLVKDONJSA-N 328.372 1.815 10 10 EDCE c1cc(N2CCOCC2)ccc1CNC[C@H]1CN2CCC[C@@H]2CO1 378903892 YDAZTDGWADXNFA-MOPGFXCFSA-N 331.460 1.476 10 10 EDCE O=C(CCn1ccnn1)NCc1cc(Br)ccc1O 804737481 SBQDGSJKAGAVPD-UHFFFAOYSA-N 325.166 1.453 10 10 EDCE C[C@@H]1C[C@@H]1N(CCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2167109741 PXNOVCFZDICTDK-BITCUVMXSA-N 340.221 1.608 10 10 EDCE COCc1csc(NC(=O)C(=O)N(C)Cc2ccccc2O)n1 806855203 CATDDSGGBDVBEA-UHFFFAOYSA-N 335.385 1.592 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)Cn1nnn(C2CC2)c1=O 808142643 WRZIOVFBYPDRQZ-UHFFFAOYSA-N 330.436 1.709 10 10 EDCE CN1CCc2cc([C@@H](NN)c3nn(C)cc3Br)ccc21 2163158262 NKPVWOLUQFPJOG-CYBMUJFWSA-N 336.237 1.728 10 10 EDCE N[C@@H](c1cc(Br)cc([N+](=O)[O-])c1O)[C@H](O)C(F)(F)F 575282377 VFJKTKDMFRZLRV-XPUUQOCRSA-N 345.071 1.986 10 10 EDCE CN[C@H](C)c1ccc(N2CCOC[C@@H]2C(N)=O)c(Br)c1 723151360 XRJDYOJFEIDIBD-NOZJJQNGSA-N 342.237 1.420 10 10 EDCE CN1CCCc2cc(CNC(=O)c3ccnc4c3CC(=O)N4)ccc21 824676257 HNHUPJHLQRCARU-UHFFFAOYSA-N 336.395 1.889 10 10 EDCE FC1(F)CCNC[C@@H]1CNCc1ccc(N2CCOCC2)cc1 903955305 OUBKRBDPILJGDB-OAHLLOKOSA-N 325.403 1.858 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCCC[C@H]1CN1CCOCC1 588405027 IHXPSHXRDYOZTD-WRLNGNIRSA-N 346.427 1.824 10 10 EDCE C[C@H]1CN(C(=N)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 849095954 UJUYRVNCALHBAA-ZDUSSCGKSA-N 336.411 1.407 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@H]3CNCC[C@H]3C)CC2)cc1 841778431 BBFPUXMKPDHCQH-KDOFPFPSSA-N 346.475 1.961 10 10 EDCE Cc1cc(Cl)cc(CN2CCC[C@@H](N3CCNCC3=O)C2)c1O 843065899 RBNASCJFOIMNSU-OAHLLOKOSA-N 337.851 1.750 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCC[C@H](C3CCOCC3)C2)cc1 927935215 YAVXCGIYMQKDSV-AWEZNQCLSA-N 331.416 1.873 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCN[C@@H](C)C3)C2)cc1 851668798 UQQATFBRUMUGCZ-KKUMJFAQSA-N 332.448 1.714 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cn3ccccc3=O)C2)cc1 855229690 PLRXIVYOGNMLOU-AWEZNQCLSA-N 327.384 1.252 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)C[C@]2(C)CO)cc1Br 698158832 WUBIMIPSVXEAHH-DRCTWCGVSA-N 330.222 1.824 10 10 EDCE C[C@@H](NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccnn1C 867302095 JATDNDJMAMRYHZ-CYBMUJFWSA-N 343.431 1.322 10 10 EDCE CCOc1cccc(CNCCn2ncc(Br)n2)c1O 1875994288 KUKHDGUFSNZBNP-UHFFFAOYSA-N 341.209 1.935 10 10 EDCE CCN(C)c1ccc(CN2CCN(c3nccn(C)c3=O)CC2)cc1 773756054 SUXSBGMHGMGQMV-UHFFFAOYSA-N 341.459 1.559 10 10 EDCE O=C(O)[C@@]1(O)CCCN(Cc2cc(Br)ccc2O)C1 1964722372 WLUALWRWFQZPTN-CYBMUJFWSA-N 330.178 1.566 10 10 EDCE NC(=O)[C@H](C1CC1)N(CC1CC1)C(=O)/C=C\c1ccc(O)c(O)c1 1454964248 WUVAQYQSBTWQIX-LYLYKKCESA-N 330.384 1.614 10 10 EDCE CCOC1(CO)CN(c2ccc(CNC)c(Br)c2)C1 2116351815 VUBZGWUOUGMBAT-UHFFFAOYSA-N 329.238 1.756 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC(N3CCOC3=O)CC2)cc1 1454024558 YXMQLVVWFJITRZ-UHFFFAOYSA-N 345.359 1.906 10 10 EDCE COCCN(C)C[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1714906380 DMSUFOROAULCTE-ZDUSSCGKSA-N 347.419 1.889 10 10 EDCE Cc1cc(Cn2nnc(C(=O)NCc3c(O)cccc3F)c2C)on1 1558455172 RLPWUFJZOIYLLY-UHFFFAOYSA-N 345.334 1.706 10 10 EDCE C[C@H](O)CNC[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1566913850 VPVSDDBTGOUQRX-STQMWFEESA-N 347.419 1.672 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC[C@@H](O)C(C)C)C2)cc1 1636854136 SXOREIDXORTYDX-WMLDXEAASA-N 335.448 1.980 10 10 EDCE O=C(CSc1nnc(S)s1)NCc1c(O)cccc1O 1635848090 ZUSKCKIGZZIOTP-UHFFFAOYSA-N 329.428 1.647 10 10 EDCE C[C@H](CNC(=O)C1CC1)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1734741226 UFLYGZRHNDWAMH-SNVBAGLBSA-N 331.376 1.836 10 10 EDCE CC[C@@H](CNC(=O)C=C(C)C)NC(=O)c1cc(OC)nc(OC)c1 1582383081 XYDAHDHLQKFALS-ZDUSSCGKSA-N 335.404 1.690 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CN3CCN2C[C@@H]3C)cc1 1587459627 DHLGGORGMVKIRF-QFBILLFUSA-N 344.503 1.880 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCC[C@@H]2CNCCCO)cc1 1667778464 MDUPNQFPAJWNRH-HIFRSBDPSA-N 347.419 1.720 10 10 EDCE CC1=NN(c2ccc(F)cc2)C(=O)/C1=C(\C)NN1CCN(C)CC1 17068031 SNMLZFZQJAAVEU-FOWTUZBSSA-N 331.395 1.574 10 10 EDCE O=C1C[C@H](CNCc2cc(Br)cc(F)c2O)CCN1 1969109861 MEJPREMIJWJTOW-MRVPVSSYSA-N 331.185 1.910 10 10 EDCE CC(C)(C)OC(=O)NCCCONCc1ccc(O)c(O)c1O 1937015810 GFISZDPFZFRJMH-UHFFFAOYSA-N 328.365 1.739 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1COC[C@@H]1NCc1ccc(O)c(O)c1 1948517774 ILKWJXMJOLAFMK-STQMWFEESA-N 338.404 1.727 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](F)[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 1983546035 FZXSHENYAIPTRA-BJDJZHNGSA-N 328.384 1.457 10 10 EDCE CCOC1(C(=O)N(C)CCN=[N+]=[N-])CN(C(=O)OC(C)(C)C)C1 1985095122 ZEXRHPDJAYNAFS-UHFFFAOYSA-N 327.385 1.781 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2010402399 QEPSHPWBCOKGRE-RYUDHWBXSA-N 341.412 1.811 10 10 EDCE CC(C)(C)OC(=O)N1CC(CCO)(NCc2ccc(F)cc2O)C1 2024888901 XOSUDNRBFIHFQA-UHFFFAOYSA-N 340.395 1.993 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C1CSC1 2028430231 PAUCFUVRPBKWML-NSHDSACASA-N 329.219 1.986 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@H]2C3)c(F)c1Br 2173318821 ZACMVFHHEMOBKY-BKWHQTBESA-N 345.212 1.367 10 10 EDCE O=C1Nc2cc(N3CC4(CC[C@H]4O)C3)c(Br)cc2[C@@H]1O 2179697154 JAOPCYSAJDYREI-NEPJUHHUSA-N 339.189 1.396 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCC3(c4ccccn4)CCC3)c2n1 2063515794 CWBXTUUSIAYQCZ-UHFFFAOYSA-N 337.383 1.990 10 10 EDCE COc1ccc(O)c(Cn2ncnc2I)c1 2070057824 IGFGBMAXVSZISO-UHFFFAOYSA-N 331.113 1.645 10 10 EDCE C[C@H](N)c1ccc(N2CCN(CCCO)CC2)cc1Br 2169932710 ZAKWMSQYURVMHY-LBPRGKRZSA-N 342.281 1.973 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2199528272 YFKFCLWSRRRWMZ-AWQUKHNNSA-N 341.249 1.789 10 10 EDCE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CC(CNC(=O)C(F)(F)F)C1 2044608606 PQZVMYQQEATHJL-VIFPVBQESA-N 344.337 1.206 10 10 EDCE CC(C)(C)OC(=O)NCc1nc(=NC(=O)Nc2ccc(N)cc2)[nH][nH]1 2063197542 IRKPVGQGZIHKAX-UHFFFAOYSA-N 347.379 1.478 10 10 EDCE O=C1Nc2cc(N3C[C@@H](O)C34CCC4)c(Br)cc2[C@@H]1O 2201417315 UJZZNLRBRZTSET-NEPJUHHUSA-N 339.189 1.538 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N[C@H]1CC[C@H](O)CC1 2303607517 SKOXOJMMPHCTRU-SAABIXHNSA-N 330.428 1.956 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2329326117 MELQUKUGBSFLIO-VIUKWPJHSA-N 327.222 1.399 10 10 EDCE O=C1N=C(N(CCO)CCO)S/C1=C/c1ccc(Cl)cc1 35575547 VZTQRWCVZZYJLQ-FMIVXFBMSA-N 326.805 1.597 10 10 EDCE CN1C(=O)Cc2cc(N3CCN(C(=O)[C@H]4CCCO4)CC3)ccc21 62575996 IBZVDOFLXQEXBC-MRXNPFEDSA-N 329.400 1.033 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2358208209 PKWAXLVCYODCSR-IOEYQFCTSA-N 347.228 1.609 10 10 EDCE Cc1ccc2c(c1)N(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)CCC2 255769074 HYYVXZPCRKKWIW-HJWRWDBZSA-N 339.395 1.385 10 10 EDCE Cc1ccc(CN2CC[C@@H](O)[C@@H](C(=O)O)C2)c(O)c1Br 2380676971 JDISGGVJWOBXOJ-WDEREUQCSA-N 344.205 1.731 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)COCc1nncn1C 293254505 MIBRKAJYSJRRHN-UHFFFAOYSA-N 331.420 1.446 10 10 EDCE COc1ccc(-c2noc(CCC(=O)OCC(=O)C(C)=O)n2)cc1 808493399 CHWGLTBHZFRVBJ-UHFFFAOYSA-N 332.312 1.379 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1 808495959 UPGZGDIMEJJSFT-CQSZACIVSA-N 339.347 1.894 10 10 EDCE C[C@@H]1CCNC[C@@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 817891390 BMIFSXARUMLAAT-PBHICJAKSA-N 337.489 1.009 10 10 EDCE CCOC(=O)c1ccc(CNC(=O)c2cc(O)c(O)c(O)c2)cc1 586738084 YBAFQSYVMSPELS-UHFFFAOYSA-N 331.324 1.910 10 10 EDCE Cc1cc(N(C)C)ccc1CN1CCN(S(C)(=O)=O)[C@H](C)C1 827266439 RUILAHJAQSWNNT-CQSZACIVSA-N 325.478 1.527 10 10 EDCE COC(=O)/C=C\c1ccc(N2[C@H]3CC[C@H]2CC(=O)NC3)c([N+](=O)[O-])c1 748280769 DOAKEGWTUPUMMR-UHPDYOMPSA-N 345.355 1.638 10 10 EDCE COc1ccc(O)c(CNC(=O)Nc2cnn(CCN(C)C)c2)c1 747558773 XOVOQHGIXKMJJX-UHFFFAOYSA-N 333.392 1.481 10 10 EDCE CC[C@]1(COC)NC(=O)N([C@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849356957 INASBVRULFPDHK-KBXCAEBGSA-N 347.415 1.621 10 10 EDCE COc1ccnc(N2CCN(C(=O)Nc3ccc(N)cc3)CC2)n1 841299594 FNBFUHRSJZLUJE-UHFFFAOYSA-N 328.376 1.422 10 10 EDCE Cc1nc(CNC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)no1 743565211 UKKZQCAZIZDYPZ-LBPRGKRZSA-N 345.403 1.775 10 10 EDCE COCc1n[nH]c(CNC2CCN(c3ccc(OC)cc3)CC2)n1 850360170 CXRWWNJYGFJERU-UHFFFAOYSA-N 331.420 1.718 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)C[C@@H](CC(F)(F)F)O1 850864280 CYSGGTHVSGXNSW-BXKDBHETSA-N 345.321 1.776 10 10 EDCE C[C@H](NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1[C@H]2CN[C@H]1C2 925486206 FWKWOPFJNFMUTH-DHXZDTOLSA-N 349.500 1.007 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1CCCOC1 852126499 BOUXLHLETVVOGH-OAHLLOKOSA-N 333.432 1.626 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(CO)CC3)C2)cc1 854301572 CAJJQKNOGDNTSE-OAHLLOKOSA-N 333.432 1.688 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCC[C@@H](C)CO)C2)cc1 853917056 SYYSTWFTMRSNCY-HUUCEWRRSA-N 335.448 1.982 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](O)C3CCC3)C2)cc1 854297242 LDSJALZFZXUMGI-RHSMWYFYSA-N 333.432 1.734 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)CC[C@@H]1CC[C@H](C(N)=O)O1 866205876 HUPOWHXASUNLHQ-DZGCQCFKSA-N 347.415 1.291 10 10 EDCE Cc1noc([C@@H]2OCC[C@@H]2NC(=O)NCCc2ccc(N)cc2)n1 861639742 GACUJVJGRMSKDS-UONOGXRCSA-N 331.376 1.332 10 10 EDCE O=C1C[C@H](C(=O)N2Cc3cccc(O)c3C2)CN1Cc1ccccn1 871197968 BTGQSOFCXZTQGU-AWEZNQCLSA-N 337.379 1.678 10 10 EDCE C[C@H](C(=O)N1Cc2cccc(O)c2C1)N1C(=O)NC2(CCCC2)C1=O 871200557 GHIGWUGGYYVUBQ-LLVKDONJSA-N 343.383 1.488 10 10 EDCE C[C@@H]1O[C@H](C)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H]1C 783814055 NQMWKAFQMIWCCK-MXWKQRLJSA-N 342.417 1.402 10 10 EDCE CCc1cccc(CNCCc2nnc3c(=O)n(C)ccn23)c1O 895789971 RJMQGDDCZHWNMS-UHFFFAOYSA-N 327.388 1.028 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1COCCN1CC(F)F 1136743558 VGHCXCNQISZJAH-OAHLLOKOSA-N 341.402 1.643 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H]3[C@H]4COC[C@H]43)CC2)cc1F 793458125 ORDKLLXZHTYNHQ-VIKVFOODSA-N 335.379 1.311 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cncn2C)cc1C 1319205226 LMWTXEXLVQDWNQ-ZDUSSCGKSA-N 330.432 1.893 10 10 EDCE CN(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCN=[N+]=[N-] 1963698159 IMJSPCWSBNVCAR-LLVKDONJSA-N 328.417 1.648 10 10 EDCE CN(CCNC(=O)c1ccc(N=NC(N)=O)cc1)Cc1csnn1 1317472424 BFNCYWACXCNTAB-UHFFFAOYSA-N 347.404 1.562 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CC[C@H](C3CC3)O2)cc1 1333758646 LUPWIMNAUJHCGF-DLBZAZTESA-N 345.443 1.443 10 10 EDCE CO[C@H]1C[C@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 1262125322 FQEFCOIWJQFRIF-XEZPLFJOSA-N 333.432 1.471 10 10 EDCE CC1(C)CNC(=O)CN1c1cc(Br)c(CN)cc1F 2119117484 NDECBVSRUNPJJF-UHFFFAOYSA-N 330.201 1.762 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cncc(N2CCCC2=O)c1 1472063695 QIYMXZJZQHPPHJ-UHFFFAOYSA-N 327.340 1.550 10 10 EDCE Cn1nnnc1-c1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 1623792059 MXTXUGWIWRXYKC-UHFFFAOYSA-N 325.328 1.470 10 10 EDCE Cc1cc(C)n(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(=O)n1 1556158113 RZKXTGJHJFOMDX-LLVKDONJSA-N 331.372 1.019 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H](C)n2cncn2)cc1C 1481222751 HYMHEONMBKBKTG-AWEZNQCLSA-N 331.420 1.404 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CCn2ccnn2)cc1C 1716434555 CZJGLUVBPDGPEO-AWEZNQCLSA-N 331.420 1.280 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2nccs2)cc1C 1725707400 FPHGRMAWZULETR-AWEZNQCLSA-N 349.456 1.683 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)Cn2cccn2)C2CC2)cc1C 1723274030 UODJYXUCLXPOJC-QGZVFWFLSA-N 342.443 1.885 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2C[C@@H](NC(=O)CCCF)C2)cc1 1578851397 LRNKZBMAYLTKLM-BETUJISGSA-N 349.366 1.976 10 10 EDCE C[C@H](CNCc1ccon1)CNC(=O)c1ccc(N=NC(N)=O)cc1 1666673183 NMBAMDSKNPJYGL-LLVKDONJSA-N 344.375 1.993 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)Cc2n[nH]c(C)n2)cc1C 1670091477 YOZGFMBLKBISJR-UHFFFAOYSA-N 345.447 1.611 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H]2CCC(=O)N2)cc1C 1670041976 NYOGWMQUSYFLAO-OAHLLOKOSA-N 333.432 1.220 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@H](C)n1cncn1 1699179004 XVRUJTWAUQOJFD-OAHLLOKOSA-N 345.447 1.794 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2cncn2C)cc1C 1698831973 JFSICVCWNWFILB-AWEZNQCLSA-N 330.432 1.987 10 10 EDCE COc1ccc(CN[C@H]2CCC[C@@H](NC(=O)CC(N)=O)C2)cc1C 1690764747 DWAAUTKRXKAULM-LSDHHAIUSA-N 333.432 1.396 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4COC[C@@H]43)c(Br)cc2[C@H]1O 2129728734 YAFQWYLZJLKUJW-LKXWSVAYSA-N 325.162 1.270 10 10 EDCE CN1CC[C@H](N(C)c2ccc(CN)c(Br)c2)CC1=O 2131957594 HUWSJODXMJHZOR-LBPRGKRZSA-N 326.238 1.965 10 10 EDCE COc1ccc(Br)c(CNC[C@@](C)(CO)OC)c1O 1967780919 OWDKBCRSNPOSNC-ZDUSSCGKSA-N 334.210 1.650 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)c1ccncc1Br 163968249 KAQZXBHVVFUFPU-UHFFFAOYSA-N 335.205 1.918 10 10 EDCE COC[C@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCCN1C(=O)OC(C)(C)C 2010393217 PJZSPYNVGNBVLM-HNNXBMFYSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2010406124 QERMTCIAGNHJKV-VXGBXAGGSA-N 341.412 1.811 10 10 EDCE CNC(=O)[C@@H](C)CN(C)c1cc(Br)c(CN)cc1F 311325377 BIGOUMUJBPCCTM-QMMMGPOBSA-N 332.217 1.865 10 10 EDCE C[C@@H](O)CN1CCCN(c2ccc(CN)cc2Br)CC1 2176856064 OHWRBXAKCGWUIH-GFCCVEGCSA-N 342.281 1.801 10 10 EDCE CN[C@@H]1CCCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2053855034 NKCVAIAXIRZQKS-QGZVFWFLSA-N 329.444 1.747 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)cc1Br 2189046083 ZQQYWFFCVSRUEO-OZWUEAAUSA-N 342.233 1.946 10 10 EDCE CC1(C)[C@@H](O)C[C@]1(CO)NCc1cc(Br)cc(F)c1O 2193972289 ZTOVILSTUJPRRD-SMDDNHRTSA-N 348.212 1.905 10 10 EDCE NC(=O)c1coc(CNCc2ccc(Br)cc2O)n1 2104345098 YEAQTCONMNDAQJ-UHFFFAOYSA-N 326.150 1.531 10 10 EDCE Cn1nnc(Br)c1COC(=O)Cc1ccc(N)cc1 2089736795 SYORWCZBXUUAGI-UHFFFAOYSA-N 325.166 1.446 10 10 EDCE CCNCc1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)c(Br)c1 2201292397 FQIROOSATCSOAG-YABSGUDNSA-N 338.249 1.726 10 10 EDCE CS(=O)(=O)[C@H]1COC[C@@H]1NCc1cc(Cl)cc(Cl)c1O 2207470564 MJQHAYDLPCMKNC-QWRGUYRKSA-N 340.228 1.601 10 10 EDCE CC(C)(C)OC(=O)NC/C=C\CNC(=O)COc1ccc(N)cc1 2248245212 JKCLYLXHKZGBNS-PLNGDYQASA-N 335.404 1.845 10 10 EDCE CN(C(=O)/C=C\c1cnccn1)c1ccc(S(=O)(=O)N(C)C)cc1 493574691 AKIFMMZXYNODOJ-WTKPLQERSA-N 346.412 1.403 10 10 EDCE Cc1ccc(-n2nc(C)c(/C=C3/C(=O)NC(=O)N(C)C3=O)c2O)cc1 101113106 MAXDTQADWPHJSO-JYRVWZFOSA-N 340.339 1.286 10 10 EDCE [N-]=[N+]=NCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12 252487105 HSSTWUOLSWCKKL-GVXVVHGQSA-N 340.453 1.919 10 10 EDCE Cc1ccc(CNC(=O)C2(N)CCOCC2)c(O)c1Br 2380736590 DLQKAFIOVQAYCS-UHFFFAOYSA-N 343.221 1.587 10 10 EDCE NCc1cn(C2CN(Cc3cc(Br)ccc3O)C2)nn1 713373468 JMBUAFSYDOGRGV-UHFFFAOYSA-N 338.209 1.262 10 10 EDCE COC(=O)[C@@H]1CC[C@@H]1C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 823776426 PEUCKFORFJYMBX-XOKHGSTOSA-N 346.427 1.837 10 10 EDCE CC[C@H](NC[C@]1(CO)COCCN1C)c1cccc(Cl)c1O 903277418 GZZVNVYCYCZHAC-HOCLYGCPSA-N 328.840 1.779 10 10 EDCE CO[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2C)[C@](C)(C(=O)O)C1 909042580 HLYVXKNXZOSSJT-YJBOKZPZSA-N 349.431 1.835 10 10 EDCE C[C@@H](CCC(=O)O)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588592880 QZEAUVOXHXLGJB-PODYEWJSSA-N 332.400 1.906 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1CCCN(c2ncccn2)C1 588405997 YZUHOXLSHMPVET-VSKVDJIOSA-N 340.383 1.686 10 10 EDCE C[C@@H]1OC(=O)N[C@H]1C(=O)NCc1cc(Br)ccc1O 841434824 OHJONQHMJGMWNF-QUBYGPBYSA-N 329.150 1.268 10 10 EDCE COCC[C@@H]1CCCCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 842238293 NDEJLRCAWVMDSS-INIZCTEOSA-N 347.459 1.593 10 10 EDCE CN1CC[C@H](C(=O)NCc2ccc(O)c(O)c2)[C@@H](c2cnn(C)c2)C1 849562764 HAGGHNOAXPGMOO-LSDHHAIUSA-N 344.415 1.183 10 10 EDCE COc1cc(O)c(CN2CC[C@@H](Nc3ncccn3)C2)cc1OC 842617801 WSEHMJKWSMBFDW-CYBMUJFWSA-N 330.388 1.886 10 10 EDCE C[C@@H](NC(=O)C(=O)N[C@@H]1CCCCNC1)c1ccc(N(C)C)cc1 842203916 YNRWVCGSNNMESE-UKRRQHHQSA-N 332.448 1.188 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)N[C@@](C)(CCF)C3=O)C2)cc1 849356088 CCDKOLPGDYCBPY-DYVFJYSZSA-N 335.379 1.944 10 10 EDCE CS(=O)(=O)NC[C@H]1CCC[C@H]1NCc1ccc2c(c1)CCCO2 922106533 QQCBHUIYOQNIMX-HZPDHXFCSA-N 338.473 1.819 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C3(CO)CCOCC3)C2)cc1 855223103 DYTRYFHSQDVSGM-AWEZNQCLSA-N 334.416 1.179 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)N3CC(O)(CO)C3)c2C)cc1 854672352 GJWCWNYPVOHBGX-UHFFFAOYSA-N 330.384 1.282 10 10 EDCE COc1cc(C)cc(CN2CCN(CCC(=O)N(C)C)CC2)c1O 754740197 KMAAVUFMDGNMQN-UHFFFAOYSA-N 335.448 1.305 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NC[C@H](C)CC(F)F)cc1 853010374 BCLARFRWOOVPCF-LLVKDONJSA-N 344.358 1.994 10 10 EDCE C[C@@H](NC(=O)NCC12CC(CN1)C2)c1ccc(N2CCOCC2)cc1 851655763 WXJHLWQNUBTEAP-TZGCNFNXSA-N 344.459 1.635 10 10 EDCE CN(C)c1ccc(CN(C(=O)CC2CS(=O)(=O)C2)C2CC2)cc1 864786621 VHQITNCNKPCMDJ-UHFFFAOYSA-N 336.457 1.678 10 10 EDCE CC(C)(CNC(=O)NCCc1ccc(N)cc1)C(=O)N1CCCC1 861640798 OPQKGXSGMNHDNW-UHFFFAOYSA-N 332.448 1.759 10 10 EDCE COc1ccc(COCC(=O)NCCc2ccc(O)c(O)c2)cn1 860235734 YJBKERMKJDXYCB-UHFFFAOYSA-N 332.356 1.377 10 10 EDCE CO[C@H]1CC[C@@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 870714840 ANASXUAEAZHGLC-PWSUYJOCSA-N 342.417 1.403 10 10 EDCE CN1CCN(c2ccc(CN3CCN(CC(F)F)CC3)cc2)CC1 775663855 FMQGWDHWDMLKEH-UHFFFAOYSA-N 338.446 1.821 10 10 EDCE NC(=O)CN1C(=O)/C(=C/c2cccc3cnccc23)SC1=S 782880867 PYMRILGEDXNQSO-SDQBBNPISA-N 329.406 1.921 10 10 EDCE Cc1ccc(C(=O)NC[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@H]6[C@@H](C[C@H]53)[C@@H]2[C@@H]64)c(O)c1O 787668368 FNTJMYKIXQORJT-LZKNYQOMSA-N 341.407 1.645 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CNC[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@H]6[C@@H](C[C@H]53)[C@@H]2[C@@H]64)c1 785546866 UCNDREIOMPZOSC-DLSQHGJNSA-N 342.395 1.899 10 10 EDCE Cc1cnn(-c2c(C(=O)NCc3cccc(O)c3O)c(C)nn2C)c1 1153797910 HYKBWOZJIYHBMG-UHFFFAOYSA-N 341.371 1.564 10 10 EDCE COc1ccc(Br)c(CNCc2ncnn2C)c1O 1964054001 NVOBEGHTGJMIFD-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cnn(C)c2N)cc1C 1317235454 QPDDMWGBXZSSOM-GFCCVEGCSA-N 331.420 1.227 10 10 EDCE O=C(O)[C@H]1CO[C@H](CNCc2c(O)cccc2Br)C1 714029823 OKGBHAOKZBGHSE-BDAKNGLRSA-N 330.178 1.734 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](C)N(C(=O)CN(C)C(C)=O)C2)cc1C 1331953516 KCLTXLFSULRIIG-YOEHRIQHSA-N 347.459 1.561 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)cc1 1296520754 OXGNDEANDNXDBJ-CYZMBNFOSA-N 329.360 1.575 10 10 EDCE C[C@@H](CNC(=O)CCCF)NC(=O)c1ccc(N=NC(N)=O)cc1 1526880359 QNSPXKCFPLXBST-JTQLQIEISA-N 337.355 1.833 10 10 EDCE COc1ccc(CNC(=O)c2ccc(S(C)(=O)=O)nc2)c(O)c1 1626080041 UIFMKDUFBSGPSJ-UHFFFAOYSA-N 336.369 1.129 10 10 EDCE CN(C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1ccncn1 1910968903 TWMZHLGFUWETCK-NWDGAFQWSA-N 334.376 1.024 10 10 EDCE CC(C)CNC(=O)C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1636422175 XTNNZBRACXWSFN-UHFFFAOYSA-N 334.416 1.651 10 10 EDCE CC(=O)N/C(=C/c1ccccc1)C(=O)NCc1c(O)cccc1O 1635843040 FSSDJDQJARALLR-XNTDXEJSSA-N 326.352 1.891 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2CCC(=O)NC2)cc1C 1734332409 UGKQLWDPRUVTPU-ZBFHGGJFSA-N 347.459 1.466 10 10 EDCE NC(=O)c1cn(CC(=O)NCc2cc(O)ccc2O)c2ccccc12 1643879466 QONUCBSBNVYWKG-UHFFFAOYSA-N 339.351 1.468 10 10 EDCE O=C(NCc1nc(-c2ccccn2)n[nH]1)NCc1c(O)cccc1F 1672691402 RJVLTOXNTDPBHV-UHFFFAOYSA-N 342.334 1.711 10 10 EDCE CCNCc1ccc(N2CC(=O)NC(=O)[C@@H]2C)c(Br)c1 233516307 OYDQQSRNMHENTJ-VIFPVBQESA-N 340.221 1.410 10 10 EDCE CNCc1ccc(N2C[C@H](CO)OC[C@@H]2C)c(Br)c1 234381220 BQBNBIHVHZPABB-CMPLNLGQSA-N 329.238 1.755 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]1NC(=O)c1cc(O)c(O)c(O)c1 2015124136 ZKECBXRXKGPCAP-UWVGGRQHSA-N 338.360 1.446 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2015125185 JCIXCVWBWWJINS-JTQLQIEISA-N 338.360 1.543 10 10 EDCE C[C@@H](NC(=O)C1(NC(=O)OC(C)(C)C)COC1)c1ccccc1O 2017517359 UJKNAGXTZMSUOJ-LLVKDONJSA-N 336.388 1.863 10 10 EDCE O=C(O)[C@@]12COC[C@H]1CN(Cc1cc(Br)ccc1O)C2 2160991332 MTVAZYXPDIZIPF-YGRLFVJLSA-N 342.189 1.688 10 10 EDCE C[C@@H]1CC(=O)NCCN1c1ccc(CN)c(Br)c1F 687898694 MLTRERRHZGBECL-MRVPVSSYSA-N 330.201 1.762 10 10 EDCE Oc1c(Br)cccc1CNC[C@H]1CN2CCN1CC2 394694627 MKDXDUCXSJOGDX-LBPRGKRZSA-N 326.238 1.244 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H](C)CN3CCC[C@H](C)C3)c2n1 2064763068 MDKPKLOIWZVONS-WCQYABFASA-N 331.420 1.594 10 10 EDCE COc1ccc(CNCc2c(Br)nnn2C)c(O)c1 2089351779 FCNPPVXPQMPTFJ-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE Cc1cccc(CN=c2nc(C(=O)O)c(Br)c[nH]2)c1O 2204621020 GRVAJWVJYWPGKI-UHFFFAOYSA-N 338.161 1.985 10 10 EDCE CNCc1ccc(N2C[C@H]3COC[C@]3(CO)C2)cc1Br 2234553370 XPNUXSWQRSHUHR-SWLSCSKDSA-N 341.249 1.614 10 10 EDCE O=C(O)CC[C@H](C(=O)O)N1C(=O)C(=Cc2ccc[nH]2)SC1=S 2293202075 MDPVHJGWDFPVIO-MRVPVSSYSA-N 340.382 1.534 10 10 EDCE CSc1ncc(CNS(=O)(=O)C[C@@H]2CCNC2(C)C)s1 2284725771 RPGPVVQIDZPIMS-VIFPVBQESA-N 335.520 1.673 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)c(Br)c1 2330386770 QHNJPIXZZBHJMM-HYNSBDGHSA-N 328.206 1.262 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)cc1Br 2336343383 RMAJIXSWFZUIQL-JRKPZEMJSA-N 346.246 1.736 10 10 EDCE CN(C)CC1(O)CN(c2ccc(CN)c(Br)c2F)C1 2343651010 GZOFTYRUGVDQQR-UHFFFAOYSA-N 332.217 1.160 10 10 EDCE CCn1c(O)nnc1CNCc1c(O)cccc1Br 2351549071 GZHOUACAMAJEDU-UHFFFAOYSA-N 327.182 1.762 10 10 EDCE Cc1c(N/C=C2\SC(=S)NC2=O)c(=O)n(-c2ccccc2)n1C 110100919 HYOVIUUCAPAHKZ-FLIBITNWSA-N 346.437 1.886 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@@H](C(=O)NCCN=[N+]=[N-])[C@@H]2C1 1895874909 DASXYSNLSXGBDM-AXFHLTTASA-N 325.369 1.295 10 10 EDCE O=C(O)/C=C\C(=O)Nc1cc2c(cc1O)C(=O)c1ccccc1C2=O 39899570 BWTAYPFISHURPW-WAYWQWQTSA-N 337.287 1.747 10 10 EDCE Cc1cc(C(=O)NCCNS(C)(=O)=O)c(C)n1-c1ccccc1 74004125 MYUPUZTVFGEVLQ-UHFFFAOYSA-N 335.429 1.373 10 10 EDCE CN(C)c1ccc(CNC(=O)NCCNC(=O)c2ccccc2)cc1 31728912 NSAIQJMIUWHCJR-UHFFFAOYSA-N 340.427 1.982 10 10 EDCE C[C@H](NC(=O)c1cccc(O)c1O)c1nnnn1-c1ccccc1 193073624 KWQABHPBGCNPAS-JTQLQIEISA-N 325.328 1.565 10 10 EDCE CC(=O)N1CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)[C@@H](C)C1 268771872 BOAKPPTWYQTMBU-LBPRGKRZSA-N 336.411 1.654 10 10 EDCE CNC(=O)C1CCC(NC(=O)NCc2cccc(OC)c2O)CC1 266674963 BLIVIIUPFBOPHM-UHFFFAOYSA-N 335.404 1.505 10 10 EDCE CC1(C)CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@@]2(CCOC2)O1 280417946 GDAXDHKAGPOJCT-MJICGBHWSA-N 333.384 1.908 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]3COCC[C@H]32)cc1 839502758 KVGTVTXRGBKORQ-SJLPKXTDSA-N 331.460 1.870 10 10 EDCE CCNS(=O)(=O)[C@@H]1CCN(C/C=C/c2ccc(N(C)C)cc2)C1 835045645 XPDWKEBYUWYSDY-FUTAKVPZSA-N 337.489 1.779 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1C=C[C@H]2O1 839953387 PRBQQXBDIBWFDF-QBPKDAKJSA-N 341.411 1.080 10 10 EDCE Cc1ccc(C(=O)N2CCS(=O)(=O)[C@@H]3CCC[C@H]32)c(O)c1O 837095371 CIOJSVZZPJZRHV-VXGBXAGGSA-N 325.386 1.198 10 10 EDCE Cc1nc(O)c(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)nc1C 832267039 LRGDOBAKJKBNEE-CQSZACIVSA-N 329.404 1.295 10 10 EDCE CC(C)N(C[C@@H](C)O)C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 839289015 USJLWKAUJVJYCC-CQSZACIVSA-N 335.448 1.329 10 10 EDCE CC(C)(CO)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 847640487 LDOQSKYKBZEOHW-UHFFFAOYSA-N 345.487 1.853 10 10 EDCE CN=[S@](C)(=O)CCNC(=O)c1cc2cc(O)c(O)cc2s1 912781719 QFXRRWIQXKABPF-OAQYLSRUSA-N 328.415 1.770 10 10 EDCE CN(C)c1ccc(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1F 843426513 XWZCFWBXWJUVAF-INIZCTEOSA-N 342.436 1.281 10 10 EDCE C[C@]1(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)COC(=O)N1 928158934 ACDRPDQPYOKKDE-YWPBOTNQSA-N 346.383 1.848 10 10 EDCE CO[C@H](C(=O)OCC(=O)C(C)=O)c1ccc(Br)s1 923520196 KGOITVCKBIEIJR-JTQLQIEISA-N 335.175 1.899 10 10 EDCE COC(=O)C1=CC[C@H](NC(=O)NCc2ccc(N(C)C)c(F)c2)C1 858738197 AXWUEZAIGHYPOL-ZDUSSCGKSA-N 335.379 1.953 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3n[nH]c(C)c3[N+](=O)[O-])C2)cc1 855231370 VWRBGCYPFWQOEL-NSHDSACASA-N 345.359 1.644 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3c([N+](=O)[O-])cnn3C)C2)cc1 855233660 KEVUINRFBPYTAO-LLVKDONJSA-N 345.359 1.346 10 10 EDCE C[C@@H](CNC(=O)N[C@@H](C)c1ccccc1O)CN1CCN(C)CC1 868358904 UHUFWWUYMQUNND-GJZGRUSLSA-N 334.464 1.636 10 10 EDCE C[C@H](NC[C@]12COCCN1C(=O)COC2)c1cc(Cl)ccc1O 866551976 FAGXLXAVMZHQAG-MEDUHNTESA-N 340.807 1.324 10 10 EDCE CCOCc1cc(CNCCC2CS(=O)(=O)C2)ccc1OC 786823307 MPLWEIJCWYPQSE-UHFFFAOYSA-N 327.446 1.756 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)N(C)C)cc1 891242405 GBANEDCPQRDXGK-LHIBYTEYSA-N 343.471 1.895 10 10 EDCE Cc1cc(NC(=O)Cc2ccc(O)c(O)c2)ccc1-n1cnnn1 1141452367 HUQXENXCPGASKQ-UHFFFAOYSA-N 325.328 1.563 10 10 EDCE COc1ncc(C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)cn1 1321693891 UFWIQEPHQARWEP-CYBMUJFWSA-N 344.415 1.710 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)[C@H]2CC23CC3)cc1C 1326093894 AZWXWHCQDCQJEZ-MRXNPFEDSA-N 332.444 1.714 10 10 EDCE CNCc1ccc(N2CC[C@H](NC(N)=O)C2)cc1Br 690802848 DWENQISBOZGLHG-JTQLQIEISA-N 327.226 1.416 10 10 EDCE C[C@H]1CC2(CCNCC2)CN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1261875541 JWYVUGOTZUGJBV-ZDUSSCGKSA-N 343.427 1.225 10 10 EDCE CNC(=O)[C@@H]1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 1348633883 NMOIRTHHCUDYLQ-OAHLLOKOSA-N 334.439 1.145 10 10 EDCE C[C@H](CCNCC(=O)N(C)C)NC(=O)c1ccc(N=NC(N)=O)cc1 1273212452 LSEGQTSWOCUHRY-LLVKDONJSA-N 348.407 1.035 10 10 EDCE CCCNC(=O)C1(NC(=O)Cc2ccc(O)c(O)c2)CCCCC1 1443057017 JFJAUOMGHYAJPY-UHFFFAOYSA-N 334.416 1.986 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2C[C@@H]3CCCCN3C2=O)cc1 1450890950 LNDPGRXBLNMDRY-QWHCGFSZSA-N 329.360 1.732 10 10 EDCE CCOC(=O)c1cc(CNC(=O)NCc2cccc(OC)c2O)on1 1479146494 CWFSKCKTADBHCX-UHFFFAOYSA-N 349.343 1.565 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)CC(F)(F)F)cc(OC)n1 1704010419 HJLZCMCGXJIFOV-MRVPVSSYSA-N 349.309 1.286 10 10 EDCE CCOC(=O)Cn1nc(C)cc1NC(=O)c1ccc(C)c(O)c1O 1557308826 ADZCMJRDUWJGST-UHFFFAOYSA-N 333.344 1.727 10 10 EDCE CCOC(=O)[C@H](C[C@@H]1CCCO1)NC(=O)/C=C/c1ccc(O)c(O)c1 1644419737 BRHXEDACPYUNHR-AJKRIUKHSA-N 349.383 1.728 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)c2ccoc2)cc(OC)n1 1679903292 VSUJBWLLPKUCFI-NSHDSACASA-N 347.371 1.582 10 10 EDCE CCS(=O)(=O)CC(=O)NC[C@@H](C)NCc1ccc(OC)c(C)c1 1774048840 PSNSQYKCFAAVTH-CYBMUJFWSA-N 342.461 1.033 10 10 EDCE Cc1cccc(/C=C2\SC(=S)N(CC(=O)NCCO)C2=O)c1 16905424 COYFERXHWYLLSD-WQLSENKSSA-N 336.438 1.305 10 10 EDCE CN1C(=O)NC(=O)/C(=C\c2cccn2-c2ccc([N+](=O)[O-])cc2)C1=O 446775 MTSWJDHXTLFKFI-UKTHLTGXSA-N 340.295 1.477 10 10 EDCE CON(C)C1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2144645656 UQCUDODHKXZKJI-GFCCVEGCSA-N 341.209 1.083 10 10 EDCE COC[C@H](CC(=O)N1CC[C@H](N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1985096980 ZHMGHSLJGNXNRE-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1C[C@H](O)CN1CCc1ccc(N)cc1 2014240963 ZNMXXUQRPUGLQK-CVEARBPZSA-N 335.448 1.771 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)cc1Br 2158411535 UAJDQIMRZUDMIT-VHIFSBLJSA-N 341.249 1.925 10 10 EDCE COc1cccc(O)c1[C@H](C)N[C@H]1CCCN(S(C)(=O)=O)C1 2064901840 NQKJHRDNGNVAIA-RYUDHWBXSA-N 328.434 1.475 10 10 EDCE CCN(c1ccc(CNC)c(Br)c1)[C@H]1CC(=O)NC1=O 2171193683 VZSJEGAKZOTDJX-LBPRGKRZSA-N 340.221 1.410 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NCc1cccc(O)c1O 1907968314 AEJSHJLEPIIDTH-TZMCWYRMSA-N 338.404 1.822 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1908253673 YJJGWYFDYMQPAR-GRYCIOLGSA-N 339.396 1.685 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](CO)C[C@@H]2CO)c(Br)c1 2089862707 CEBRDCZIVFIULX-HOSYDEDBSA-N 329.238 1.648 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(NC(=O)c2cccc(O)c2O)C1 2216762686 KVLXQFLRULWPFF-BTDLBPIBSA-N 334.372 1.837 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](N)[C@@H](OC)C2)c1O 2227741991 YHCHTMOBOQYSRO-JQWIXIFHSA-N 331.210 1.321 10 10 EDCE CCN(CC)CCCNC=C1C(=O)NC(=S)N(CC(C)C)C1=O 2295113166 CMBNXXZEIMCONO-UHFFFAOYSA-N 340.493 1.091 10 10 EDCE CSc1ncc(CNC(=O)NC(CF)(CF)C(=O)O)s1 2295316497 YXXAVDORHLIMFP-UHFFFAOYSA-N 325.362 1.427 10 10 EDCE Cc1c(/C=C\C(=O)N2Cc3cnnn3Cc3ccccc32)cnn1C 492034469 UIZJYJFXGJICLM-FPLPWBNLSA-N 334.383 1.928 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCC[C@H]1O 172554704 OHLVQBWXAFRTFH-GOEBONIOSA-N 337.395 1.375 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cnc3ccccn3c2=O)c1 114542067 NCVLQPWATTWZMV-UHFFFAOYSA-N 325.324 1.339 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)N[C@H]3C[C@H]3C)CC2)cc1 170806281 HEYGEZGQIHGOAX-QAPCUYQASA-N 346.475 1.915 10 10 EDCE O=C(O)[C@]12CO[C@H](C1)[C@H](NCc1cc(Br)ccc1O)C2 2359170012 RAWCWVXHCZJKIP-QKCSRTOESA-N 342.189 1.877 10 10 EDCE O=C(NCc1ccccc1)N[C@H](Cc1ccc(O)c(O)c1)C(=O)O 302907420 NYYPSLMLNUDRKP-CYBMUJFWSA-N 330.340 1.593 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2c(O)ccc3ccccc23)CCO1 529644134 SLDCNROVXRVDGC-AWEZNQCLSA-N 329.400 1.675 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccnc2c1CC(=O)N2 611658127 QQAWZBIMUOOOTC-UHFFFAOYSA-N 338.367 1.681 10 10 EDCE Cc1ccc(CN2CC[C@](O)(CC(=O)O)C2)c(O)c1Br 2380807373 XLSVZJPGPRLREL-AWEZNQCLSA-N 344.205 1.875 10 10 EDCE Cc1cc(CN(C)C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)no1 297968338 XWQDYEZMGBKZNJ-UHFFFAOYSA-N 344.415 1.666 10 10 EDCE Cc1ccc(CN2CC[C@@H](C(=O)O)[C@H](O)C2)c(O)c1Br 2381141727 DIHMZWVSEPHPEO-GHMZBOCLSA-N 344.205 1.731 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@@H](CO)c2cccnc2)cc1 806324393 HCTPIKWQRBQGAD-INIZCTEOSA-N 328.416 1.723 10 10 EDCE CN(C)c1ccc(CNC(=O)NCCN=c2cc[nH]cc2)cc1F 729604515 BWENJXROVGQCTR-UHFFFAOYSA-N 331.395 1.620 10 10 EDCE C[C@H]1C[C@@H](O)CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 823523299 COKAFPQQQLOGDE-KBXCAEBGSA-N 347.459 1.560 10 10 EDCE CN(Cc1cc[nH]n1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823554170 PYLOHOHFIRFCRH-UHFFFAOYSA-N 343.431 1.712 10 10 EDCE C[C@H](NC(=O)c1cccn(C)c1=O)c1ccc(N2CCOCC2)cc1 729527520 OXTWWYDGOIGJDZ-AWEZNQCLSA-N 341.411 1.713 10 10 EDCE CC(C)c1nc2n(n1)C[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)CC2 588407780 RLZUJRMNAYHHRC-IBSXUBTNSA-N 342.399 1.957 10 10 EDCE C[C@@H]1O[C@H](C)CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1C 839387268 JJSGKJXKUVCNPS-ILXRZTDVSA-N 347.459 1.735 10 10 EDCE C[C@H]1CCNC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 842214343 PJGYSCFVRDYDKM-YOEHRIQHSA-N 344.459 1.017 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N[C@H]1CCCCNC1 842239124 CYWAEFAKRRNYEY-HNNXBMFYSA-N 333.432 1.389 10 10 EDCE COC(=O)/C(C)=C\COC(=O)c1cc(NS(C)(=O)=O)ccc1O 748177620 HXQTVXSSLNSORN-TWGQIWQCSA-N 343.357 1.040 10 10 EDCE C[C@H](NC[C@H]1COCCN1C)c1ccc(N2CCOCC2)c(F)c1 858519901 AZDALPMYPFBBKF-HOCLYGCPSA-N 337.439 1.644 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@]2(C)CCCCO2)cc1 929235934 FUCCBNBGQNMQNU-GOSISDBHSA-N 333.432 1.444 10 10 EDCE c1cc(N2CCOCC2)ccc1CNC[C@H]1CCN1C1CCOCC1 922952411 YDMXIEBYIHNBPR-HXUWFJFHSA-N 345.487 1.866 10 10 EDCE COc1ccc(O)c([C@@H](C)NCc2coc(S(N)(=O)=O)c2)c1 851899575 AAINWUOKNROBST-SECBINFHSA-N 326.374 1.492 10 10 EDCE COC(=O)c1cc(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)c(C)o1 852792051 PRIQWGMFZMHHFX-HNNXBMFYSA-N 345.399 1.870 10 10 EDCE CC(C)n1ncc2cc(/C=C\C(=O)N(C)c3cn[nH]c3)c(=O)[nH]c21 754347861 ANTDMZREGPGARR-PLNGDYQASA-N 326.360 1.705 10 10 EDCE COc1cc2c(c(OC)c1)N(CC1CN(S(C)(=O)=O)C1)CCC2 930720987 GHDNFVMNGXXBIR-UHFFFAOYSA-N 340.445 1.348 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(Cl)cn1 1117406911 FKTPVUSZFUUDGZ-UHFFFAOYSA-N 333.775 1.715 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1[C@H]2COC[C@H]21 1117440940 CIXWIQDVOQBAKT-FOLVSLTJSA-N 332.400 1.282 10 10 EDCE CNC(=O)c1cccc(OCC(=O)NCc2ccc(OC)cc2O)c1 794390640 NFISBYITMBYDOV-UHFFFAOYSA-N 344.367 1.456 10 10 EDCE CN(C[C@@H](O)CN1C(=O)c2ccccc2C1=O)c1ccc(CN)cc1 1958924566 BTMFCECISYBDBZ-OAHLLOKOSA-N 339.395 1.239 10 10 EDCE O=C(NC[C@@H](CO)Cc1ccc(F)cc1)c1c(F)ccc(O)c1O 1160998888 YFQOTJBOPGUYKQ-NSHDSACASA-N 337.322 1.957 10 10 EDCE CN1C(=O)C[C@@H](C(=O)NCc2cc(O)ccc2O)c2ccccc21 1176747939 FXHXYWCPDDHKBY-CQSZACIVSA-N 326.352 1.864 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)C[C@@]2(C)CO)c(Br)c1 698134509 AZNGAFFHKAIKCR-PXWWUCIGSA-N 329.238 1.791 10 10 EDCE COC[C@@H]1CCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 92776008 BVVPXWQKSNLDDM-OQPBUACISA-N 340.221 1.874 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@H]2CC=CCC2)cc1C 1331668591 SREQNMPIEXNSRL-DLBZAZTESA-N 332.444 1.927 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@H]3C[C@@H]3C)C2)cc1 1347444175 GJRINGLFPDWUIZ-IHRRRGAJSA-N 331.416 1.162 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)NCc1c(O)cccc1F 1456027291 DNYAJOIJVLIXLN-LLVKDONJSA-N 328.340 1.033 10 10 EDCE CN1C(=O)O[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]21 2120399401 FMCATPGRESTREV-CMPLNLGQSA-N 327.178 1.790 10 10 EDCE Oc1c(Br)cccc1CN[C@@]12CC[C@@H](C1)[C@@H](O)[C@@H]2O 2120387800 BZGHEFAYOJHCES-ISTUKMMPSA-N 328.206 1.519 10 10 EDCE NCc1ccc(N2CC[C@]3(CNC(=O)N3)C2)c(Br)c1 2121212340 ZNFBLTJPHHVFQW-ZDUSSCGKSA-N 325.210 1.170 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCn1c(O)nc2ccccc21 1629532364 CGRAFHAIDZSPQS-UHFFFAOYSA-N 327.340 1.512 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)cc1 1626346409 VPGNNTZGYSERPC-LSDHHAIUSA-N 345.403 1.520 10 10 EDCE Cc1nc([C@@H]2COCCN2C(=O)c2ccc(N=NC(N)=O)cc2)no1 1567511036 SPTXSVPTLMJTGE-LBPRGKRZSA-N 344.331 1.754 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@@](O)(c2ccc(F)cc2)C1 1637384426 NIIDHWTWGWHGMG-SFHVURJKSA-N 331.343 1.900 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)c2nc[nH]n2)C2CC2)cc1C 1733185815 KKJDLPSERIQYMV-CQSZACIVSA-N 329.404 1.420 10 10 EDCE CN(CCNC(=O)[C@H]1CC12CC2)C(=O)c1ccc(N=NC(N)=O)cc1 1581029077 IDFMALDFAVFLGW-CYBMUJFWSA-N 343.387 1.837 10 10 EDCE COCC(=O)NC[C@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1746544219 AIAVBWPIVXWHRU-CYBMUJFWSA-N 347.375 1.216 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)CC[C@H]1CC[C@@H](C(N)=O)O1 1588184278 WUZKYNPRDZMAFO-ZBFHGGJFSA-N 334.416 1.944 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(Br)c1 2126153328 OOXGCAWVGHJIEV-DHPDLVEQSA-N 327.222 1.086 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nnc4ccccc4n3)CC2)cc1 1120942189 CDCFKCQAAXCKFF-UHFFFAOYSA-N 349.394 1.996 10 10 EDCE CCN(CCO)c1cc2c(cc1Br)[C@H](NC)C(=O)N2 118589964 GQKGOFYPDXNAJH-LBPRGKRZSA-N 328.210 1.480 10 10 EDCE O=C1Nc2cc(N3C[C@H](F)[C@@H](CO)C3)c(Br)cc2[C@@H]1O 2177137296 HTRAUENDQLJOCN-ZIGWGHGNSA-N 345.168 1.201 10 10 EDCE Oc1cc(Br)ccc1CNC[C@H]1CN2CCN1CC2 691489602 SNOJYQISDSLGJU-ZDUSSCGKSA-N 326.238 1.244 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC[C@H]4CC[C@@H](C3)N4C(C)C)c2n1 2064401706 PMYBCOWMLXTSEV-KGLIPLIRSA-N 343.431 1.831 10 10 EDCE CCS(=O)(=O)CCN(C)c1ccc(CN)c(Br)c1 2050976920 UQGDQFPBJCTSKP-UHFFFAOYSA-N 335.267 1.779 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2102178886 XJSYVIIMEXTKMQ-PGOKHVGTSA-N 328.206 1.698 10 10 EDCE CN(C)C(=O)[C@H]1CCCN1c1ccc(CO)c(Br)c1 2087358156 XVGQRRTYPTVNON-CYBMUJFWSA-N 327.222 1.998 10 10 EDCE OCc1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2228396294 NRZDRZSFAZBRKE-PHIMTYICSA-N 330.222 1.369 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2cncc(CO)c2)s1 2284542373 VDJGEUMYFQCUNB-UHFFFAOYSA-N 331.444 1.231 10 10 EDCE O=C(O)CN(Cc1cc(Br)cc(F)c1O)[C@@H]1CCOC1 2288224308 CIARJORNIVAXEA-SNVBAGLBSA-N 348.168 1.969 10 10 EDCE CC[C@@H]1CN(C(=O)C=Cc2ccc(O)c(O)c2)CCN1CCOC 2308001370 CFNUBAYAWQZMBR-OAHLLOKOSA-N 334.416 1.680 10 10 EDCE O=C1CCc2cc(N3CCN(C(=O)c4ccncc4)CC3)ccc2N1 62575825 GBLCQYCBWMUYLF-UHFFFAOYSA-N 336.395 1.929 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCOC[C@H](F)C3)c(Br)cc21 2361809511 XFFIKBNJEOEOAR-JMCQJSRRSA-N 344.184 1.576 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CC(NC(=O)COC)C2)cc1 188451548 JYGAGVGRUKRUNO-UHFFFAOYSA-N 348.447 1.189 10 10 EDCE COc1ccc(N2CCN(C(=O)CNC(=O)CC(C)C)CC2)cc1 41428754 OFLQLSLHFGSYAO-UHFFFAOYSA-N 333.432 1.506 10 10 EDCE C[C@H]1[C@@H](C)SCCN1S(=O)(=O)CCOc1ccc(N)cc1 132039098 VSOPSDIQAREGLL-NWDGAFQWSA-N 330.475 1.803 10 10 EDCE COC(=O)CCC(=O)NS(=O)(=O)c1ccc(N=NN(C)C)cc1 254879199 GNSABPCJGWQJST-UHFFFAOYSA-N 342.377 1.005 10 10 EDCE C[C@@H]1C[C@H]1N1C[C@@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 374188597 BPOBIBNMZLCYKU-UKPHBRMFSA-N 344.459 1.903 10 10 EDCE Cc1cc(O)c(CN2CCC(CNS(C)(=O)=O)CC2)cc1C 284953328 BLYKWMFIPXCTDT-UHFFFAOYSA-N 326.462 1.770 10 10 EDCE Cc1ccc(CN2CCC(O)(C(=O)O)CC2)c(O)c1Br 2381136480 GTIIWMAQWQVNGZ-UHFFFAOYSA-N 344.205 1.875 10 10 EDCE O=C(C[C@@H](O)C(Cl)(Cl)Cl)NCCc1ccc(O)c(O)c1 907057105 NJUNKKVOMDDMOA-SNVBAGLBSA-N 342.606 1.878 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3nccn(C)c3=O)C2)cc1 822372043 BUETXXMPUUDNPQ-GFCCVEGCSA-N 343.387 1.189 10 10 EDCE COc1ccc(CNS(=O)(=O)c2ccnn2C2CCC2)c(O)c1 915163598 FUVKWNMHHDNYJW-UHFFFAOYSA-N 337.401 1.801 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4[C@@H](C3)C4(F)F)nc12 844452437 CXCCTBRKBCGQEK-GHMZBOCLSA-N 338.314 1.309 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@]3(CCNC3)C2)cc1 844224874 KCUSQLDPYKYTPB-LJQANCHMSA-N 330.476 1.444 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@H]3CCNC34CCC4)cc2)C1 925484971 JNZQWVNRXZEGPW-AEFFLSMTSA-N 342.487 1.763 10 10 EDCE CN1CCN(c2ccc(CN3C(=O)N[C@@](C)(CCF)C3=O)cc2)CC1 925080529 VPVRTOZQAAINKH-SFHVURJKSA-N 348.422 1.609 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)CC3(O)CCC3)C2)cc1 854298539 FILSGJUXGVUMFM-AWEZNQCLSA-N 333.432 1.830 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3c[nH]nc3[N+](=O)[O-])C2)cc1 855226805 SGVBMOOZKVNLOU-SNVBAGLBSA-N 331.332 1.335 10 10 EDCE COc1ccc(N2CCCN(CC(=O)Nc3cccnn3)CC2)cc1 929316963 SYVAEVKKCOLCHT-UHFFFAOYSA-N 341.415 1.636 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@H]2CCCN(C3CC3)C2=O)cc1F 931146781 JXZCVLMUNNBESN-CQSZACIVSA-N 333.407 1.909 10 10 EDCE Cc1cnc(N)c(S(=O)(=O)Nc2cccc(N3CCOCC3)c2)c1 766895792 IDDHIJZENRVWFV-UHFFFAOYSA-N 348.428 1.610 10 10 EDCE COCCN(Cc1ccc(N2CCOCC2)cc1)Cc1ccnn1C 787331337 ITRXLKIKKVZFCU-UHFFFAOYSA-N 344.459 1.905 10 10 EDCE CO[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)c1ccc(O)cc1 784730548 VLWICQZNNHKCMB-INIZCTEOSA-N 332.308 1.917 10 10 EDCE COC(=O)N[C@H]1CCN(Cc2ccc(N3CCN(C)CC3)cc2)C1 895848387 MXFVGFQDLMZDFP-INIZCTEOSA-N 332.448 1.369 10 10 EDCE O=C1C[C@](C(=O)NCc2ccc(O)c(O)c2)(c2ccccc2)CN1 1137443611 WIWMTUKRVKBQII-GOSISDBHSA-N 326.352 1.172 10 10 EDCE C[C@H](Oc1cccc(CO)c1)C(=O)OCC(=O)c1ccc(O)c(O)c1 784350308 ZCYQVPGEHCLRMD-NSHDSACASA-N 346.335 1.784 10 10 EDCE COc1ccc(CNC(=O)Nc2cnn(CCN(C)C)c2)c(O)c1 797632036 UEKISPJFWOANSJ-UHFFFAOYSA-N 333.392 1.481 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CCCN(CC(F)(F)F)C1 1153884968 IAWUUIMTICSNFG-JTQLQIEISA-N 332.322 1.988 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CC(N[C@H]2CCOC2)C1 1304083131 BELIMIIVOUTHCT-JTQLQIEISA-N 334.397 1.515 10 10 EDCE O=S(=O)(NCCNCc1ccc(Br)cc1O)C1CC1 1964609987 METXIPQDCLXQPA-UHFFFAOYSA-N 349.250 1.326 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](OCC(=O)NCCCN=[N+]=[N-])C1 1963704987 XGTMFWCRHNDNIC-LLVKDONJSA-N 327.385 1.829 10 10 EDCE CC(C)(C)[C@@H]1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)C[C@@H]1O 1327545174 MOEGWFKNCDJWTL-CVEARBPZSA-N 347.459 1.183 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC3(CC2)CC(=O)N3)c([N+](=O)[O-])c1 1320935108 QBABQZDGPXMCID-HYXAFXHYSA-N 345.355 1.640 10 10 EDCE O=C(N1CCC[C@H](CNCc2ccc(O)cc2O)C1)C(F)(F)F 689439239 BQWZEWQERIYEJD-SNVBAGLBSA-N 332.322 1.988 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@]3(C)CCC(=O)NC3)CC2)cc1 1344548978 CTYPYIJKUZHIEU-LJQANCHMSA-N 345.443 1.650 10 10 EDCE O=C(CCCn1c(O)nnc1O)NCc1cccc(Cl)c1O 1606870167 WQYSCBRCLXLQTC-UHFFFAOYSA-N 326.740 1.145 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](C)CN3CCOCC3)CC2)cc1 1631277249 NGCDMVJRWUWFHW-MRXNPFEDSA-N 347.459 1.312 10 10 EDCE C[C@@H](NC(=O)c1csc(S(N)(=O)=O)c1)c1ccccc1O 1643738800 RFBWNXXJVAPKEP-MRVPVSSYSA-N 326.399 1.592 10 10 EDCE Cc1oc(-c2cnn(C)c2)nc1C(=O)NCc1ccc(O)cc1O 1570462124 FBLSIIHCQWHVRN-UHFFFAOYSA-N 328.328 1.725 10 10 EDCE CN(Cc1nn(C)cc1Br)C(=O)c1cccc(O)c1O 1912462671 NRYNJJJNSNZWAY-UHFFFAOYSA-N 340.177 1.866 10 10 EDCE Cc1nnc(N2CC[C@H](C(N)=O)C2)n1Cc1ccc(N(C)C)c(F)c1 1751899258 XQSISDLGCBOZDO-ZDUSSCGKSA-N 346.410 1.152 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@H](O)[C@@H]3C)C2)cc1 1682188431 QEZMANLPQHVLCJ-VBQJREDUSA-N 333.432 1.686 10 10 EDCE O=C(CCN1C(=O)CSC1=S)N[C@@H](C(=O)O)c1ccccc1 1865764819 BZJGWVGHIKKVMF-GFCCVEGCSA-N 338.410 1.179 10 10 EDCE CC(=O)NCCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866087256 VJWRVYNQNNDPFD-UHFFFAOYSA-N 336.347 1.927 10 10 EDCE CCNCc1ccc(N2CCOC[C@@H]2CO)cc1Br 233531672 SVAWXLSZWLXFOP-ZDUSSCGKSA-N 329.238 1.756 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1OCCC1=O 1952404274 YJGOAZNWCHOBCN-ABAIWWIYSA-N 337.372 1.892 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](CO)[C@H](CCO)C2)cc1Br 2149908172 QMAGTSUZZBIECF-TUAOUCFPSA-N 344.249 1.930 10 10 EDCE CC(=O)C(=O)[C@@]1(O)COC2(CCN(C(=O)OC(C)(C)C)CC2)C1 1981626219 IOPUHVYOSZBVNE-INIZCTEOSA-N 327.377 1.066 10 10 EDCE CN(NCc1c(O)cccc1Br)S(=O)(=O)C1CCC1 2339722137 DLBUCUPPLSXWDN-UHFFFAOYSA-N 349.250 1.973 10 10 EDCE Cc1cccc(CNC(=O)C[C@H](O)CNC(=O)OC(C)(C)C)c1O 2024813230 UJAYBYRSEBAZSV-ZDUSSCGKSA-N 338.404 1.593 10 10 EDCE CCCN1C(=O)C(=Cc2ccc(N3CCOCC3)cc2)NC1=S 2053527941 VYUKSSUYFSJQQK-UHFFFAOYSA-N 331.441 1.991 10 10 EDCE OCc1ccc(N2C[C@@H](O)[C@H](O)CC23CCC3)c(Br)c1 2169919757 DCILVHYTMCFHTD-ZIAGYGMSSA-N 342.233 1.796 10 10 EDCE NC(=O)c1cnc(CNCc2cc(Br)ccc2O)s1 2112200088 PACAWKRRTYBSOZ-UHFFFAOYSA-N 342.218 2.000 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](OC)C[C@H]2CN)c1O 2236053053 OPMVSEVORNJXBM-VHSXEESVSA-N 345.237 1.711 10 10 EDCE COc1ccc(N2C[C@@H](O)[C@H](CO)C2)c(OC)c1Br 2226549015 KIXNFWFBNJHJII-WCBMZHEXSA-N 332.194 1.256 10 10 EDCE CN1C(=O)NC(=O)C(=Cc2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1=O 2313526860 TYBVNTWZFAQGGD-UHFFFAOYSA-N 344.327 1.287 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@]23C[C@H]3N)c(O)c1Br 2352642520 GDPJTQKQMOOKKT-RBZYPMLTSA-N 325.206 1.817 10 10 EDCE CNC(=O)[C@H]1CCCN1C(=O)NCc1ccc(N2CCCC2)cc1 179241487 BFEJAWGJBJLPQC-MRXNPFEDSA-N 330.432 1.707 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@H]4O)cc1F 249552245 LFASYIUHZVYWCO-HNKZQRQQSA-N 333.407 1.802 10 10 EDCE O=C(NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1)c1cccc(O)c1O 248765186 RLOLTVJLLXPBOI-LSDHHAIUSA-N 342.395 1.463 10 10 EDCE CC(=O)N1CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)[C@H](C)C1 268771871 BOAKPPTWYQTMBU-GFCCVEGCSA-N 336.411 1.654 10 10 EDCE Cc1ccc(CNC(=O)c2ccnnc2O)c(O)c1Br 2380751436 KPZBAHXXFOTKPT-UHFFFAOYSA-N 338.161 1.889 10 10 EDCE CNC(=O)C1CN(c2ccc(/C=C\C(=O)O)cc2Br)C1 381880796 GMMLRBMSFHAISE-HYXAFXHYSA-N 339.189 1.729 10 10 EDCE Nc1ccc(CCNC(=O)NCCCNCc2cccnc2)cc1 841936962 YMVZAVHURMYIFX-UHFFFAOYSA-N 327.432 1.685 10 10 EDCE CN(CC(=O)N1CCNCC1)Cc1cccc(Br)c1O 843047415 UMWIOLYLILHERQ-UHFFFAOYSA-N 342.237 1.018 10 10 EDCE COC[C@@H]1CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 849416398 QSZANZPCXKVIHA-HUUCEWRRSA-N 333.432 1.952 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)N3CCC[C@H]3C)C2)cc1 849416066 KBYJTZWAHVJNSA-ZIAGYGMSSA-N 339.461 1.593 10 10 EDCE Cc1cc(C)n([C@@H](C)C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)n1 844163296 XQSCEFNSLCBLQU-WMLDXEAASA-N 329.448 1.943 10 10 EDCE CN(CCc1ccc(F)cc1)C(=O)C(=O)NCCc1ccc(N)cc1 842237549 FFLQYYQGZXGKPE-UHFFFAOYSA-N 343.402 1.768 10 10 EDCE C[C@H](NC[C@H](O)CS(C)(=O)=O)c1ccc(Cl)c(Cl)c1O 927024472 KZAWBGDVPDNUGD-YUMQZZPRSA-N 342.244 1.755 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H]4C[C@@H]43)CC2)cc1 754082461 PPXUPERGTCYAJW-AYBZRNKSSA-N 331.460 1.272 10 10 EDCE Cn1nnc2c1C[C@H](NC(=O)NCc1cc(Cl)ccc1O)CC2 927861132 JSLHTBIWJBNMOW-LLVKDONJSA-N 335.795 1.531 10 10 EDCE C[C@@]12CCN(Cc3cc(O)n4ncc(C(=O)O)c4n3)C[C@@H]1C2(F)F 851708304 CUXYIWOHAKZXTM-IINYFYTJSA-N 338.314 1.610 10 10 EDCE COC(=O)CCNC(=O)CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 858541960 QLGSYUJLUYXJBI-SNVBAGLBSA-N 339.348 1.020 10 10 EDCE C[C@H](NC(=O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(N(C)C)cc1 922055998 VLRRMXUYWZPXPO-YVVXQTMVSA-N 333.432 1.917 10 10 EDCE COc1cc(O)c(CN2CCO[C@H](CCCN(C)C)C2)cc1OC 853623658 CQDYGDRGCKMJMQ-OAHLLOKOSA-N 338.448 1.952 10 10 EDCE Cn1cc(S(=O)(=O)NCCc2ccc(N)cc2)c(C(C)(C)C)n1 866761386 PXVFNAOWMNNONE-UHFFFAOYSA-N 336.461 1.821 10 10 EDCE Cc1ccc(C(=O)NC[C@](C)(O)CO)cc1-n1c(C)cc(C=O)c1C 861486360 VJKMOCPTOFIAFF-IBGZPJMESA-N 344.411 1.688 10 10 EDCE COCn1nc(C)c(S(=O)(=O)N[C@@H](C)c2ccccc2O)c1C 867835025 ZMAWPLUACTXOQX-JTQLQIEISA-N 339.417 1.849 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN3C(=O)OC[C@H]3C2)c([N+](=O)[O-])c1 763390926 HATYMAKIBGRAPI-KTLBGCOUSA-N 347.327 1.422 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CC(C)=NO3)C2)cc1 875954365 HHQAGZDZHUSCAG-XJKSGUPXSA-N 332.404 1.738 10 10 EDCE O=C(NCCCN1CCOC1=O)c1cc2cc(O)c(O)cc2s1 1119527287 MAQXHWVFMAEVDC-UHFFFAOYSA-N 336.369 1.885 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCS(=O)(=O)CC2)c1 781913518 QVMIVTJUIFBDTB-UHFFFAOYSA-N 334.235 1.694 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C)Cc2cc[nH]n2)cc1 788955589 YEYWOXJLGNLJFC-UHFFFAOYSA-N 343.431 1.531 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CCc1nc(N(C)C)no1 1140198503 GERAPIACMNNSJL-UHFFFAOYSA-N 339.392 1.576 10 10 EDCE O=C1CC[C@H](c2ccc(C(=O)NCc3ccc(O)c(O)c3)cc2)N1 1150378858 XNMWPSSQUFSVSS-CQSZACIVSA-N 326.352 1.979 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H]2CCN(C)C(=O)C2)cc1C 1317602143 MHCKHKPIZBFPBV-MRXNPFEDSA-N 347.459 1.420 10 10 EDCE C[C@@H](NC(=O)N(C)Cc1ccc(N2CCCC2)cc1)c1nnnn1C 1313376687 CRPONHUJDQHKDJ-CYBMUJFWSA-N 343.435 1.713 10 10 EDCE C[C@@H](CNC(=O)[C@H]1CC12CC2)NC(=O)c1ccc(N=NC(N)=O)cc1 1284345524 YYEZLXYTEOBWNS-GXFFZTMASA-N 343.387 1.884 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@@H]2C[C@H]2C2CC2)cc1C 1507509070 NZLNINVUWKTGPX-OKZBNKHCSA-N 346.471 1.959 10 10 EDCE O=C(CCn1cnnn1)Nc1c(-c2ccccn2)nc2ccccn12 1515043753 PHJBYDDCEYQTTG-UHFFFAOYSA-N 334.343 1.412 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@H]2C(=O)NC3)cc1Br 2115749658 VCLWJKUZZKMUQL-DVYJOKAKSA-N 325.206 1.970 10 10 EDCE COC[C@H](C)C(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1295538864 LSHYRNGSLNVPBI-WDEREUQCSA-N 349.391 1.366 10 10 EDCE CNS(=O)(=O)c1cc(C(=O)N[C@H](C)c2ccccc2O)c(C)o1 1454802859 DYVFXGHYQZEJOU-SECBINFHSA-N 338.385 1.693 10 10 EDCE Cn1cc(C(=O)C[C@H]2CCCN2C(=O)Cc2ccc(O)c(O)c2)cn1 1545938771 FRKRILASNAGTTD-CQSZACIVSA-N 343.383 1.638 10 10 EDCE O=C(NCc1ccc(O)cc1O)C(=O)c1cnn(-c2ccccc2)c1 1626837608 ALGWPZDPHZEKKJ-UHFFFAOYSA-N 337.335 1.783 10 10 EDCE O=C(NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)c1cccc(O)c1O 1558227747 YUISDOZJLMLNTC-FGWVZKOKSA-N 325.386 1.183 10 10 EDCE CC(C)c1nc([C@H]2COCCN2C(=O)Cc2ccc(O)c(O)c2)no1 1556161822 YOOGNUHOAWOQHG-GFCCVEGCSA-N 347.371 1.747 10 10 EDCE COCC(=O)N(C)[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1491976404 CTYJZUASQXURSL-CYBMUJFWSA-N 347.375 1.168 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)Cc2ccn(C)n2)cc1C 1725485305 YWCHHHZPJPGRAW-HNNXBMFYSA-N 344.459 1.916 10 10 EDCE CCC(=O)N[C@H](C)[C@@H](C)NCc1nnnn1-c1ccc(OC)cc1 1725080164 RPKGUWVXHAGALX-VXGBXAGGSA-N 332.408 1.064 10 10 EDCE CNS(=O)(=O)c1ccc(CC(=O)N[C@H](C)c2ccccc2O)cc1 1632246071 AASRKFSLRKPUEJ-GFCCVEGCSA-N 348.424 1.720 10 10 EDCE CCCOc1ccnc(CC(=O)NCc2cccc(OC)c2O)n1 1630366471 QSTBTYJLWDQSBP-UHFFFAOYSA-N 331.372 1.839 10 10 EDCE O=C(/C=C\c1ccc2c(c1)NC(=O)CO2)NCc1cccc(O)c1O 1643812287 CHVXMGUFAMMFLU-ALCCZGGFSA-N 340.335 1.758 10 10 EDCE CCN1CCOC[C@@H]1C(=O)N[C@@H](C)CNCc1ccc(OC)c(C)c1 1669599389 OARVUCLSWLWXOE-DOTOQJQBSA-N 349.475 1.319 10 10 EDCE COc1cccc(CNC(=O)NCc2nc(C(F)F)no2)c1O 1685384855 CSFPNMHNUPBHDS-UHFFFAOYSA-N 328.275 1.721 10 10 EDCE CO[C@@H](C)C(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1689406916 OTOIQZJQJXHDOC-ZJUUUORDSA-N 335.364 1.118 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N[C@@H](C)C(=O)NC 1698623375 PRLFQYRBXHYLPL-CMPLNLGQSA-N 348.407 1.082 10 10 EDCE CC(C)NC(=O)c1cccc(NC=C2C(=O)OC(C)(C)OC2=O)c1 14835417 XFHLVFWMTADNDV-UHFFFAOYSA-N 332.356 1.957 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N(CCO)CC(=O)O 2136353773 ATAPPLHXVRISPN-LLVKDONJSA-N 332.194 1.985 10 10 EDCE COCC[C@@H](N)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951943172 KFTLXMLEPXPEKQ-CHWSQXEVSA-N 340.420 1.897 10 10 EDCE O=C1Nc2cc(N3C[C@@H](O)C4(CC4)C3)c(Br)cc2[C@@H]1O 2149753423 FCJPYBZJVZVMLE-NEPJUHHUSA-N 339.189 1.396 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H](F)C1(O)CN(C(=O)OC(C)(C)C)C1 1985099395 MUBCUVIKHCXIAV-VIFPVBQESA-N 331.348 1.075 10 10 EDCE C[C@@H](O)c1ccc(N2CCOC[C@H]2[C@H](O)CO)c(Br)c1 2146324177 SPLWICDAIJUXLB-BIGNPOOSSA-N 346.221 1.061 10 10 EDCE CCN1CCc2cc([C@@H](N)[C@@H](O)CNC(=O)OC(C)(C)C)ccc21 1999537374 XXTZDLQFCRAEQS-JKSUJKDBSA-N 335.448 1.954 10 10 EDCE CC(C)(C)OC(=O)N1CC(ONC(=O)c2cc(O)c(O)c(O)c2)C1 2015124380 BQPPQVFWVLPPCM-UHFFFAOYSA-N 340.332 1.084 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)NCCN=[N+]=[N-])[C@H]1OC 2025208066 PYUZVWFGFDSKKR-VWYCJHECSA-N 343.384 1.062 10 10 EDCE CN(C)C[C@@H]1CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2160848123 TVUZPEGTGMVVTJ-SDBXPKJASA-N 340.221 1.575 10 10 EDCE OCCN(Cc1c(O)cccc1Br)C[C@H]1CCCN1 706830365 SUGCINCPBGLJQV-LLVKDONJSA-N 329.238 1.701 10 10 EDCE Oc1cccc(Br)c1CNCCCCc1nn[nH]n1 708205813 ZVLZOZABSHLLNE-UHFFFAOYSA-N 326.198 1.780 10 10 EDCE O=C(O)C(F)(F)CCS(=O)(=O)Nc1ccc(O)c(Cl)c1 2178764538 VQDOJWCVSLNSIC-UHFFFAOYSA-N 329.708 1.897 10 10 EDCE O=C(NCc1ccc(Br)cn1)c1cc(O)c(O)c(O)c1 2188927616 GHQFELSBVVGVHK-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE CN(C[C@H]1COCCO1)c1cc(Br)c(CN)cc1F 2087371286 JBNDEECUMDRFJR-JTQLQIEISA-N 333.201 1.899 10 10 EDCE O=S1(=O)CC[C@@H]2CN(c3ccc(CO)cc3Br)C[C@@H]21 2088783615 FQDITFUHMPMDBH-MFKMUULPSA-N 346.246 1.565 10 10 EDCE CN(CC1COC1)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2269769982 YAOXZJWGAPMTJD-GFCCVEGCSA-N 327.178 1.517 10 10 EDCE CC1(C)OCCN(c2ccc(CO)c(Br)c2)[C@H]1CO 2267737544 LMAHZKVVHTWOCD-ZDUSSCGKSA-N 330.222 1.918 10 10 EDCE Cc1ccc(C=C2SC(=S)N([C@H]3CCS(=O)(=O)C3)C2=O)o1 2297358863 FXBANHZGPICQGQ-VIFPVBQESA-N 343.451 1.976 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN(CCO)[C@@H](C)C2)c([N+](=O)[O-])c1 189395283 HUYRTQICBYXZEX-BPJJOFIESA-N 349.387 1.284 10 10 EDCE C[C@@H](N)c1ccc(N(C)CCS(C)(=O)=O)cc1Br 235168231 FTOLXEYYTNDPNS-SECBINFHSA-N 335.267 1.950 10 10 EDCE CNC(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255110728 NWGPMZSDNSXIPI-UXHZXRBQSA-N 343.427 1.273 10 10 EDCE C[C@@H]1C[C@H]1N1C[C@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 374188592 BPOBIBNMZLCYKU-FRFSOERESA-N 344.459 1.903 10 10 EDCE CC(=O)C(=O)COC(=O)CCn1c(=O)oc2cc(Cl)ccc21 808498858 YFMFIBKKTBLELC-UHFFFAOYSA-N 325.704 1.339 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1cncnc1 819698388 LZCBKWVDMKHZFZ-UHFFFAOYSA-N 329.356 1.317 10 10 EDCE NS(=O)(=O)C1(CNCc2cccc(Br)c2O)CCC1 721544443 UNGFRFBEMAFSCB-UHFFFAOYSA-N 349.250 1.456 10 10 EDCE COC(C)(C)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 730747372 PCJBLYWBPVYFFP-AWEZNQCLSA-N 333.432 1.430 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)c3ccccc3N)C2)cc1 849415877 GSVHHILNMAWFBT-ZDUSSCGKSA-N 347.440 1.835 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCNC[C@H]2C)cc1 842208521 WIWPXCLYDJEAIL-PBHICJAKSA-N 346.475 1.263 10 10 EDCE COCn1ccc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1 855224441 GBVBVQCWURJJMV-CYBMUJFWSA-N 330.388 1.504 10 10 EDCE COC(=O)C1(CS(=O)(=O)NCc2ccc(N(C)C)c(F)c2)CC1 866673232 ZTKKIYNZAFWXPI-UHFFFAOYSA-N 344.408 1.264 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCCC[C@@H](N)C1 866670109 AQQYLGGDJVEFCQ-QGZVFWFLSA-N 332.492 1.914 10 10 EDCE O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)N1Cc2cccc(O)c2C1 871199698 SNQSDQAWOKLSCU-STQMWFEESA-N 328.368 1.410 10 10 EDCE CCCn1nccc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1 774372627 WQEGNTQKTZQUDH-UHFFFAOYSA-N 332.360 1.002 10 10 EDCE CCS(=O)(=O)C[C@@H](C)NC(=O)c1cc2cc(O)c(O)cc2s1 1136765550 NZUBMKUVTNUJRV-MRVPVSSYSA-N 343.426 1.866 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(=O)NCCCN=[N+]=[N-])CO1 1895876863 YVQHXCAIPBNANT-QWRGUYRKSA-N 327.385 1.733 10 10 EDCE O=C(NC[C@@H]1CCS(=O)(=O)C1)c1cc2cc(O)c(O)cc2s1 1136158744 JDGUQSOLZXZTQR-QMMMGPOBSA-N 341.410 1.477 10 10 EDCE C[C@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)S(C)(=O)=O 1151376103 NEJORQSPOVOAEW-SSDOTTSWSA-N 329.399 1.475 10 10 EDCE CC1(C)C[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)CCS1(=O)=O 1157724591 DRQRCKPWOSDBJZ-TXNVCOODSA-N 339.413 1.583 10 10 EDCE O=C(O)[C@@]1(O)CCCN(Cc2cc(Br)cc(F)c2O)C1 1964721288 CDMACHAXCOSQET-CYBMUJFWSA-N 348.168 1.705 10 10 EDCE COc1cc(N2CCC[C@@H](CNC(N)=O)C2)c([N+](=O)[O-])cc1OC 1184856938 PRQSUOBBQLUYDZ-JTQLQIEISA-N 338.364 1.497 10 10 EDCE COC(=O)[C@@H](NCCCN=[N+]=[N-])c1cn(C)nc1Br 712432172 AGZPGUXAHSRQQT-QMMMGPOBSA-N 331.174 1.687 10 10 EDCE O=C(NCCCSc1nccs1)N1C[C@@H](CCO)[C@@H](CO)C1 1348591851 PPDATIILDQPKSE-VXGBXAGGSA-N 345.490 1.258 10 10 EDCE CC[C@H](CNC(=O)[C@@H]1CCC(=O)N1C)NCc1ccc(OC)c(C)c1 1267813585 ABDJLEOYCMFDSS-CVEARBPZSA-N 347.459 1.609 10 10 EDCE COc1ccc(CNC2(CNC(=O)CNC(=O)C3CC3)CC2)cc1C 1269379252 FMIYEPOVIFUYOB-UHFFFAOYSA-N 345.443 1.268 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cnco2)cc1C 1507496370 XKKZTTLJQBZNFX-CQSZACIVSA-N 333.388 1.214 10 10 EDCE C[C@@H](CNC(=O)[C@@H]1CC12CC2)NC(=O)c1ccc(N=NC(N)=O)cc1 1284345523 YYEZLXYTEOBWNS-GWCFXTLKSA-N 343.387 1.884 10 10 EDCE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CCNC(=O)CC1 1361096131 WAGMTLXHLYGWNC-UHFFFAOYSA-N 342.447 1.336 10 10 EDCE O=C1Nc2cc(N3CC4(CCO4)C3)c(Br)cc2[C@H]1O 2115260708 BXCIHVPJKDZEDG-LLVKDONJSA-N 325.162 1.414 10 10 EDCE CC[C@H](CNC(=O)C=C1CCC1)NC(=O)c1cc(OC)nc(OC)c1 1297384252 YVTULISSQAHCOO-CQSZACIVSA-N 347.415 1.834 10 10 EDCE C=CC(=O)Nc1ccc(O)c(C(=O)NCc2ccc(O)cc2O)c1 1451761025 PKSXIHBASMQISC-UHFFFAOYSA-N 328.324 1.858 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)c2cnn(C)c2N)cc1C 1485139858 XCVUMHQBYFTELL-STQMWFEESA-N 345.447 1.616 10 10 EDCE COC[C@@H](C)NC/C=C/CNC(=O)c1ccc(N=NC(N)=O)cc1 1715916971 WEMAPHZBMSFWOL-CUQVVGSPSA-N 333.392 1.760 10 10 EDCE CC(F)(F)C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1720213391 XCRYMPXMOBKWBQ-UHFFFAOYSA-N 341.318 1.740 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)CN(C)C(C)=O)cc1C 1498516394 OBCZFWDWZWFZLG-UHFFFAOYSA-N 335.448 1.420 10 10 EDCE CCCN(CCNC(C)=O)Cc1nnnn1-c1ccc(OC)cc1 1663649776 XUDULJAOETVQHE-UHFFFAOYSA-N 332.408 1.019 10 10 EDCE C[C@@H](NC(=O)CNS(=O)(=O)c1ccccc1)c1ccccc1O 1587444411 FLFJRIBNGSQGAE-GFCCVEGCSA-N 334.397 1.548 10 10 EDCE CN(Cc1ccccc1O)C(=O)N[C@H]1CC(=O)N(CC(F)(F)F)C1 163626227 UNGQQURAKYSHDB-NSHDSACASA-N 345.321 1.697 10 10 EDCE CCS(=O)(=O)NC1CCN(Cc2cc(C)cc(OC)c2O)CC1 164028552 WDOYBOOTIZZCPI-UHFFFAOYSA-N 342.461 1.613 10 10 EDCE O=C1/C(=C/NN2CCOCC2)C(C(F)(F)F)=NN1c1ccccc1 5224495 NAPPJXLPFQLCCF-ZRDIBKRKSA-N 340.305 1.672 10 10 EDCE COC(=O)NCC1CN(c2ccc(CO)cc2Br)C1 2130746155 IEBHWQSKENSSBT-UHFFFAOYSA-N 329.194 1.734 10 10 EDCE CC(C)(C)OC(=O)N1CC(NCc2cc(F)ccc2O)(C(=O)O)C1 1913937901 QXLYHKSYYOSPSN-UHFFFAOYSA-N 340.351 1.695 10 10 EDCE CCN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)C1COC1 1915657212 PWXWLRGOMDODPY-LBPRGKRZSA-N 326.194 1.626 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N3CC[C@H](O)C3)c(Br)cc21 118712348 HCDNFLRAFFIRMN-ISVAXAHUSA-N 340.221 1.623 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](N)C(C)(C)O 1951698121 OYJHQHGOTJFOMD-RISCZKNCSA-N 340.420 1.632 10 10 EDCE CN1CCN(C(=O)OC(C)(C)C)[C@H](COc2ccc(N)cc2)C1=O 1952755049 MMRYSHQIGGKLRD-CQSZACIVSA-N 335.404 1.725 10 10 EDCE COC(=O)[C@H](CC(=O)N(C)CCN=[N+]=[N-])NC(=O)OC(C)(C)C 1985100953 LVXYPKYMFLPRFB-VIFPVBQESA-N 329.357 1.212 10 10 EDCE C[C@@H](NC[C@@H](O)CNC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985775919 OQGUUNUGNQEPRU-ZYHUDNBSSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)NCC1CN(CC(=O)NCCCCN=[N+]=[N-])C1 2010389062 KXAJQGJNDIKRCF-UHFFFAOYSA-N 340.428 1.650 10 10 EDCE COc1cccc(CN[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)c1O 2011488219 UNMGNVOWDLDAPR-STQMWFEESA-N 338.404 1.471 10 10 EDCE CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2020666795 TYVSLJXXIUHHQD-QGZVFWFLSA-N 335.404 1.604 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(F)cc2O)[C@H](O)C1 2024899385 ZWUAHDDYMLYSRH-DZGCQCFKSA-N 340.395 1.991 10 10 EDCE CN[C@@H](C)c1ccc(N2CCO[C@H](CO)C2)cc1Br 300517902 REOGYKRUPDGWKG-JQWIXIFHSA-N 329.238 1.927 10 10 EDCE NC(=O)CN1CCC(Nc2c(N)cccc2Br)CC1 701020673 WTXCVGHMALRMKK-UHFFFAOYSA-N 327.226 1.393 10 10 EDCE CNCc1ccc(N(C)C2CC(C(N)=O)C2)c(Br)c1 703527409 OIWXNFNHIYCVHD-UHFFFAOYSA-N 326.238 1.869 10 10 EDCE CN1CCN(CCNCc2c(O)cccc2Br)CC1 706800498 SGACWSBVYCHJGD-UHFFFAOYSA-N 328.254 1.492 10 10 EDCE NCc1cc(F)c(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)cc1Br 2173316895 HDXPFVQBJUVOMP-PRCPCBAVSA-N 345.212 1.367 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)C[C@]2(C)CO)cc1Br 698136292 FZGPXVUUTRIXQZ-GLXFQSAKSA-N 329.238 1.791 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCCN=[N+]=[N-])C[C@@H]2OCC[C@@H]21 1908253740 ZTUSMDZRHWJJMQ-SRVKXCTJSA-N 339.396 1.970 10 10 EDCE CNCc1ccc(N2CC(C[S@](C)=O)C2)c(Br)c1 2047848249 QZOMDTPTWUTPDL-SFHVURJKSA-N 331.279 1.983 10 10 EDCE CC1(C)C[C@H](O)[C@@H](O)CN1c1ccc(CN)c(Br)c1F 2188639757 SAKPLRBOMXJKAD-QWRGUYRKSA-N 347.228 1.757 10 10 EDCE O=S1(=O)C[C@H]2CN(Cc3ccc(Br)cc3O)C[C@@H]2C1 2087857915 FMHNLHCDWDFLGW-GHMZBOCLSA-N 346.246 1.631 10 10 EDCE CC(C)NC(=O)C1CN(c2ccc(CN)cc2Br)C1 2111753181 KZWGNDNUAJTHRH-UHFFFAOYSA-N 326.238 1.869 10 10 EDCE CN1CCO[C@@H]2CN(c3ccc(CO)cc3Br)C[C@@H]21 2097691766 CGAJYRMMTGZIFG-UONOGXRCSA-N 327.222 1.461 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3COC[C@@]3(CO)C2)c(Br)c1 2234551140 IRKCZCLKKCJTES-GMXABZIVSA-N 341.249 1.914 10 10 EDCE C[C@H](O)c1ccc(N2CC3(CNC(=O)CO3)C2)c(Br)c1 2289654935 HGTRGUILBAJEGX-VIFPVBQESA-N 341.205 1.208 10 10 EDCE Cc1ccc(CN(C)C[C@](C)(O)C(=O)O)c(O)c1Br 2352639923 DDLCQXJJTFHLBX-ZDUSSCGKSA-N 332.194 1.731 10 10 EDCE Cc1ccc(CN2CCO[C@@H]3CNC[C@H]32)c(O)c1Br 2352940786 IFICGUJUXKUDNF-VXGBXAGGSA-N 327.222 1.636 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](N)C(F)(F)F)c(O)c1Br 2352950059 NDARGZQOPMWDKK-SECBINFHSA-N 341.127 1.969 10 10 EDCE CC(=O)N1CSC[C@H]1C(=O)N1CCOc2cc(N(C)C)ccc21 408415117 NNOVMHXKHGQBHZ-AWEZNQCLSA-N 335.429 1.399 10 10 EDCE O=C1NCCN(Cc2cc([N+](=O)[O-])ccc2O)[C@@H]1c1ccccc1 173488149 NOMXKDFCAQUQHY-MRXNPFEDSA-N 327.340 1.974 10 10 EDCE CN1CCC[C@@H]2CN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC[C@H]21 301733784 ZDMKJCLVFSTZCQ-DGCLKSJQSA-N 346.387 1.846 10 10 EDCE CS(=O)(=O)C[C@@H](N)c1cccc(I)c1O 95780800 UUZYCDVCBJTMNI-MRVPVSSYSA-N 341.170 1.041 10 10 EDCE O=C1CN(Cc2ccc(N3CCOCC3)cc2)[C@@H]2CCCC[C@@H]2N1 245556844 JKANCWLTDQRYRV-ZWKOTPCHSA-N 329.444 1.766 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])[nH]n3)CC2)cc1 284818705 AEDWLKCRRZGHQI-UHFFFAOYSA-N 331.332 1.289 10 10 EDCE C[C@]1(F)CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 295500982 KEPFRXXKSQGOAN-AWEZNQCLSA-N 330.381 1.728 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 808521143 ISAHRGIGVZWXPN-NEPJUHHUSA-N 327.377 1.771 10 10 EDCE COc1ccc(N2CCC(NC(=O)N3C[C@H]4CC[C@H]3CN4)CC2)cc1 817876840 NSVZKCCMEMNYHR-WBVHZDCISA-N 344.459 1.810 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CO[C@H](C)c1nccn1C 813513271 LBEQPWGEDGCAKB-NWDGAFQWSA-N 333.388 1.656 10 10 EDCE NS(=O)(=O)c1cc2c(s1)CCN(Cc1cc(F)ccc1O)C2 827775692 IBALXYAKJFBDOC-UHFFFAOYSA-N 342.417 1.799 10 10 EDCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3cc(Cl)c(C)cc3O)C[C@@H]12 827388543 GRKIPLLNAQKJMH-GLQYFDAESA-N 345.848 1.598 10 10 EDCE COc1cc(O)c(CN[C@H]2CC[C@@H](C)S(=O)(=O)C2)cc1OC 827173151 VSBMBZZXNCCZNL-PWSUYJOCSA-N 329.418 1.465 10 10 EDCE CNC(=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cn2)c1C 837648686 ULIKCNKTLWFUTH-UHFFFAOYSA-N 347.346 1.490 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2C[C@H]3CC[C@H]2[C@H]2CNC[C@H]32)c1O 903962867 LOIKYYARPCTXMA-ZZVYKPCYSA-N 333.388 1.739 10 10 EDCE COC(=O)c1cc2ccccc2c(CN(C)CCNC(C)=O)c1O 842632792 ZSVOMIPAQCGQBA-UHFFFAOYSA-N 330.384 1.900 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@H](C4CCC4)C3)cc2N1 840359298 SWBKFBCPDPFUIG-HNNXBMFYSA-N 333.344 1.931 10 10 EDCE CC[C@@]1(COC)NC(=O)N([C@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849356959 INASBVRULFPDHK-KSSFIOAISA-N 347.415 1.621 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCCC(=O)N(C)C)C2)cc1 852006426 NIOQJISDRQLWPE-CQSZACIVSA-N 348.447 1.442 10 10 EDCE C[C@@H](C(=O)N(C)CC(=O)NCc1c(O)cccc1F)n1cccn1 928711647 KJTDKCJBGCLSQK-NSHDSACASA-N 334.351 1.064 10 10 EDCE Oc1ccccc1CN(C[C@H]1CCCO1)C[C@H]1CCC2(CNC2)O1 852742533 JPSLKCRYZWWRJZ-IAGOWNOFSA-N 332.444 1.894 10 10 EDCE CN[C@@H](C)c1ccc(N2CCN(C)C[C@@H]2CO)c(Br)c1 699491587 LZHHXVMWVQKFDU-WCQYABFASA-N 342.281 1.842 10 10 EDCE COC(=O)c1cc(OCC(=O)N(C)CC(F)(F)F)ccc1N(C)C 865396434 TXFHLYSXENAVKF-UHFFFAOYSA-N 348.321 1.939 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CN[C@H]3C[C@H]4CC[C@H]3O4)cc2)C1 1119688900 DJJJNJMWROEDLD-XOYOTBSWSA-N 329.444 1.798 10 10 EDCE COC(=O)c1ccccc1NC(=O)C(=O)NCc1ccccc1O 781478018 BZOLSXKQVVNKQV-UHFFFAOYSA-N 328.324 1.434 10 10 EDCE CCCN(C(=O)Cc1ccc(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1 1136139472 HSTJAIWZRSOQNP-GFCCVEGCSA-N 327.402 1.066 10 10 EDCE COC(=O)[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1ccc(O)cc1 1153804283 WPCCMOMTUHWZFO-UWLCPZNKSA-N 343.335 1.847 10 10 EDCE O=C(NCc1cccc(Cl)c1O)c1cccc(-n2cncn2)n1 1159041674 XNPGBCCCUJCRDN-UHFFFAOYSA-N 329.747 1.951 10 10 EDCE Cn1nccc1[C@H](O)C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1301302076 SKVWRYYMMYZDIC-GOSISDBHSA-N 345.399 1.346 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2CCCNC2=O)c1O 1964043471 PUSZYLVGDBTEHW-SECBINFHSA-N 343.221 1.779 10 10 EDCE O=C(C(=O)N1CC[C@H](c2ccco2)C1)N1Cc2cccc(O)c2C1 1335563983 SRDLAZVUXJUDCA-ZDUSSCGKSA-N 326.352 1.844 10 10 EDCE C[C@H]1COCCN1CCNC(=O)c1cc2cc(O)c(O)cc2s1 1331580376 OIYHECIYHMUYSV-JTQLQIEISA-N 336.413 1.763 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)C[C@@H]2COC(=O)C2)cc1C 1268361281 RSQINRKULJEUGI-ZBFHGGJFSA-N 348.443 1.941 10 10 EDCE COCCCN(C)[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1282505385 YFCMEPQFMWJARK-LBPRGKRZSA-N 335.408 1.936 10 10 EDCE CS(=O)(=O)[C@@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1448362980 YZNVBMGQKKDRRE-GFCCVEGCSA-N 327.402 1.066 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCc2nncn2CC1 1447566425 XKOKTKCLVAOSKW-DGCLKSJQSA-N 330.388 1.389 10 10 EDCE Cn1nc(CCNC(=O)Cc2ccc(O)c(O)c2)c2ccccc21 1616757918 ZQPQZQOISYZEIN-UHFFFAOYSA-N 325.368 1.886 10 10 EDCE COC[C@H](C)N[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1480069646 QVXCEZVKJGYTKO-XHDPSFHLSA-N 347.419 1.982 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](N3CCCC3=O)C2)cc1 1638535109 ZHEWKLYMEFYERY-ZDUSSCGKSA-N 329.360 1.686 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@@H]1CC(=O)N(c2cccc(F)c2)C1 1630273290 MJOLKWLEASCTHW-GFCCVEGCSA-N 344.342 1.906 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCc1nc(-c2ccccn2)n[nH]1 1636655988 AQIVQNVHDITJEE-FNORWQNLSA-N 337.339 1.608 10 10 EDCE NC(=O)CN(Cc1ccccc1)C(=O)c1ccc(N=NC(N)=O)cc1 1565698426 DLRRYNSOTXWEKR-UHFFFAOYSA-N 339.355 1.977 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)Cc2cnc[nH]2)cc1C 1732441036 RNGQXAIXJFUUDP-CQSZACIVSA-N 330.432 1.906 10 10 EDCE NC(=O)N[C@H](CC(=O)NCc1ccc(O)cc1O)c1cccs1 1570462309 NTKSKHBKNCMRJE-LLVKDONJSA-N 335.385 1.575 10 10 EDCE CCOC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(O)c(O)c1 1583409096 XJYOXOAULFKHJQ-HNNXBMFYSA-N 343.379 1.931 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](C(=O)NCCN=[N+]=[N-])[C@H]1CCOC1 1965103320 ZYBUDOOYISAJQH-WDEREUQCSA-N 327.385 1.590 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@H](C)NC(C)=O)cc1C 1699080029 UKKJGLRZXSIADS-KBPBESRZSA-N 335.448 1.513 10 10 EDCE C[C@@H](NC(=O)c1nnn(-c2ccc(N)cc2)n1)[C@@H]1C[C@H]2CC[C@H]1C2 1857878763 LKQHCUVCWSDPLW-YXMPFFBPSA-N 326.404 1.799 10 10 EDCE CNC(=O)[C@H]1CCCN(c2ccc(CN)cc2Br)C1 232278222 LKCLRGMIQQUBRW-NSHDSACASA-N 326.238 1.870 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985102529 IEHNHYAWPMRTHO-GARJFASQSA-N 327.385 1.562 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@@H]1COC[C@@H]1C(=O)NCCCN=[N+]=[N-] 1985101878 YZKMHVBZIAJJMY-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1990033326 UWFUHWHPCTXYGR-WDEREUQCSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N1CCCN(CC(=O)NCCCN=[N+]=[N-])CC1 2010392246 YISLHENYAPVPGY-UHFFFAOYSA-N 340.428 1.746 10 10 EDCE COc1ccc(N2C[C@H](O)C[C@@H]2CNC(=O)OC(C)(C)C)c(N)c1 2010530891 UZEFAPNGVJDUJY-VXGBXAGGSA-N 337.420 1.742 10 10 EDCE CNC(=O)CN(C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 310798394 XFUYAMPWAIJUAF-UHFFFAOYSA-N 348.447 1.744 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)c(Br)c1 2173320397 OWCRJFDWJUDZFB-RABLLNBGSA-N 341.249 1.489 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN[C@@H]1C[C@@H](O)C[C@H]1O 2046481546 GSFJSUPOMUSICL-FBIMIBRVSA-N 336.613 1.782 10 10 EDCE Cn1[nH]c(=NC(=O)OC(C)(C)C)cc1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2060642629 ZRWUGPCOQPHQFA-SNVBAGLBSA-N 349.395 1.961 10 10 EDCE O=C1C[C@@]2(CCN(c3ccc(CO)c(Br)c3)C2)CN1 2107033018 SPPHAFLSMXSYDJ-AWEZNQCLSA-N 325.206 1.658 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C[C@]1(O)CCN(C(=O)OC(C)(C)C)C1 2300531581 IQMVUQULRLQEQT-OAHLLOKOSA-N 341.412 1.907 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H]2CCCCC[C@@H]2C(N)=O)cc1 120621824 LVWLYRCJIYCGTQ-HOTGVXAUSA-N 332.448 1.986 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H](C)C[S@@](C)=O)CC2)cc1 183632887 OKUGXQONFYCVHQ-ZAMGYDSWSA-N 339.461 1.294 10 10 EDCE Cc1noc(CCNC(=O)NCc2ccc(N3CC=CC3)cc2)n1 126424815 MTDFBRMUHQRXSA-UHFFFAOYSA-N 327.388 1.796 10 10 EDCE COc1ccc(N2CCN(C(=O)c3c[nH]c(=O)cc3C)CC2)cc1F 133944356 WVRAKDYPYJCCDA-UHFFFAOYSA-N 345.374 1.793 10 10 EDCE O=C1CCCC[C@@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)N1 194394224 FWPMBGCHUSRFFW-CVEARBPZSA-N 346.427 1.959 10 10 EDCE CC(=O)N1CCO[C@@]2(CCCN(Cc3ccc(N(C)C)cc3)C2)C1 96268785 NCLHSQJBPWVXKR-LJQANCHMSA-N 331.460 1.966 10 10 EDCE CN[C@@H]1CCCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255031971 NKCVAIAXIRZQKS-UXHZXRBQSA-N 329.444 1.747 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)OCCN1CCCC1=O 255616306 YRMHGLTXBQCUMC-YVMONPNESA-N 344.411 1.702 10 10 EDCE COc1cc(NS(=O)(=O)c2cnn([C@@H]3CCOC3)c2)ccc1O 280505666 DECFONIGNLKXQA-LLVKDONJSA-N 339.373 1.360 10 10 EDCE CO[C@@]1(C(=O)NCc2ccc(C)c(Br)c2O)CCNC1 2381140987 SKFRVPYLFYVNMO-AWEZNQCLSA-N 343.221 1.458 10 10 EDCE CC(=O)C(=O)COC(=O)c1nnn(-c2ccc3ncccc3c2)c1C 808516236 FRKGQLFXNIQPPK-UHFFFAOYSA-N 338.323 1.439 10 10 EDCE CNC(=O)N1CCN(c2ccc([C@H](C)O)c(Br)c2)CC1 721694718 DDUMTDNTXXJYTF-JTQLQIEISA-N 342.237 1.964 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]3COCC[C@H]32)cc1 839502757 KVGTVTXRGBKORQ-FUHWJXTLSA-N 331.460 1.870 10 10 EDCE COC[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)C(N)=O 831340522 GBWCXSGWVXNYAT-MRXNPFEDSA-N 329.400 1.253 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@](O)(CO)C1 840485563 URIMAFQKOFZICC-DNVCBOLYSA-N 349.475 1.521 10 10 EDCE C[C@H]1COCC[C@@H]1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852281080 OXAHNJPULWWTCZ-KSSFIOAISA-N 347.459 1.872 10 10 EDCE O=C(NCc1c(O)cccc1F)NC[C@H]1CC2(CCOCC2)CO1 923908326 PYHGRZHLUNYPCY-GFCCVEGCSA-N 338.379 1.916 10 10 EDCE CCO[C@@H]1[C@@H](C)[C@@H]1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 923443113 QUJOZSORZBLGSM-DOPJRALCSA-N 348.443 1.925 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)c3cncnc3)C2)cc1 855227080 WDQQBSLQYPGSNN-ZFWWWQNUSA-N 326.400 1.984 10 10 EDCE COCC1(O)CN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)C1 854753693 FPYUNQWZWXLQJP-UHFFFAOYSA-N 328.412 1.856 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)c1ccc(S(N)(=O)=O)cn1 770505654 KORARNRXBLWSBW-UHFFFAOYSA-N 349.412 1.487 10 10 EDCE CC[C@H]1NC(=O)N(Cc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1=O 777609092 AURDPJHRFLBTTN-DZGCQCFKSA-N 344.415 1.219 10 10 EDCE Fc1cc(CN2CCOC[C@@H]2c2ncon2)ccc1N1CCOCC1 779622508 CBUAOSTVLQUPFB-MRXNPFEDSA-N 348.378 1.619 10 10 EDCE Oc1c(F)cc(Br)cc1CN1C[C@H]2COC[C@@H](C1)O2 894679577 TWWYPOYFTWDLLA-PHIMTYICSA-N 332.169 1.893 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2cn(C)nn2)c1 1300272616 YDRHENOXQYBPEL-UHFFFAOYSA-N 337.383 1.965 10 10 EDCE NC(=O)Cc1ccc(CNC(=O)NCc2c(O)cccc2F)cc1 1229468063 JBASBTOFERQLHT-UHFFFAOYSA-N 331.347 1.559 10 10 EDCE Cc1ccnc2nc(C(=O)NCc3ccc4cccnc4c3O)nn12 1162607500 SPGCGRAPXPQFHQ-UHFFFAOYSA-N 334.339 1.617 10 10 EDCE CNCc1ccc(N(C)C2CC(C(N)=O)C2)cc1Br 703527494 RQCVHQBEFOHNDZ-UHFFFAOYSA-N 326.238 1.869 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CSC3(C)C)ccc21 1324419350 XIMWAIJCPPZXNR-OAHLLOKOSA-N 347.484 1.695 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3CCCNC3=O)CC2)cc1C 1323469797 XXEXVLSHHJVGCU-OAHLLOKOSA-N 345.443 1.268 10 10 EDCE COc1ccc(-n2nnnc2CN[C@H](C)CNC(=O)C=C(C)C)cc1 1265750068 FCLVQKMAPIHPJO-CYBMUJFWSA-N 344.419 1.231 10 10 EDCE COc1cccc(CNC(=O)c2ccc3c(O)ncnc3c2)c1O 1294938162 WXAFIGKLVZZWIF-UHFFFAOYSA-N 325.324 1.980 10 10 EDCE O=C(Cn1ncc(=O)c2ccccc21)NCc1c(O)cccc1F 1471974999 OJUINQANTKNSBI-UHFFFAOYSA-N 327.315 1.558 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)c2nccnc2N)cc1C 1700393072 QJLJDWQZJRWCTD-STQMWFEESA-N 343.431 1.672 10 10 EDCE CC[C@@H]1CN([C@H](CC)C(=O)NCCc2ccc(O)c(O)c2)CCO1 1630335063 JYCUPNXJYHTZQJ-HUUCEWRRSA-N 336.432 1.646 10 10 EDCE C[C@@H](NC(=O)c1cnc2c(c1)NC(=O)CN2C)c1ccccc1O 1635798917 IEUAOKVAQKXAHV-SNVBAGLBSA-N 326.356 1.667 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)C1CCN(CC(F)(F)F)CC1 1631435061 XUVVXBNHVHICAK-UHFFFAOYSA-N 332.322 1.988 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2ncoc2C)cc1C 1571575176 RCWYXUCFNGMNOQ-HNNXBMFYSA-N 347.415 1.523 10 10 EDCE COC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)c1cccc(O)c1O 1644805536 MWOUJNAXLCFLSM-CYBMUJFWSA-N 333.315 1.751 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@H]2CCN(C)C2=O)cc1C 1732356867 OZALANDJKYZMMK-CJNGLKHVSA-N 347.459 1.324 10 10 EDCE NS(=O)(=O)c1sccc1C(=O)NCc1cc(Cl)ccc1O 1583820565 HXFHLYUELRYCMN-UHFFFAOYSA-N 346.817 1.685 10 10 EDCE CCCNC(=O)CN[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1690651998 LAVBJMVDKZYDIJ-LLVKDONJSA-N 348.407 1.083 10 10 EDCE COC(=O)Cc1c(O)cc(O)cc1OC(=O)c1ccc(O)c(O)c1 14817736 LFLJQGHNYLKTBB-UHFFFAOYSA-N 334.280 1.444 10 10 EDCE biogenic CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N(C)CCN=[N+]=[N-] 1985095750 IXPVTFFKDAJOOV-GHMZBOCLSA-N 327.385 1.637 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985104243 HQACDKHLXRGAAT-HBNTYKKESA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NC(=O)Nc1ccc(N)cc1 1999154457 YPHINZAYCPFBGK-STQMWFEESA-N 336.392 1.682 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010398236 VPCDVPLSORRUBY-QJPTWQEYSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)N1CCC(N=[N+]=[N-])CC1 2010405651 KGSSNVLSKSJMFQ-LLVKDONJSA-N 341.412 1.952 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@H](CO)C[C@@H]32)cc1Br 2199786210 MELYCWYFVXTULB-WKPIXPDZSA-N 341.249 1.884 10 10 EDCE O=C1Nc2cc(N3CCOC[C@@H]3CF)c(Br)cc2[C@H]1O 2182598530 SROVYNVXRGWWMP-JVXZTZIISA-N 345.168 1.609 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@@H]4[C@@H]3CO)c(Br)cc2[C@H]1O 2199015500 JTNFPYQSLXHUMM-OJAMJJRASA-N 339.189 1.252 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC(CCO)C3)c(Br)cc21 2095990251 ZWOINBJGAHAPFX-LBPRGKRZSA-N 326.194 1.220 10 10 EDCE COc1ccc(N2CC[C@@H](O)C[C@H]2CO)c(OC)c1Br 2234903269 PZDPCHMTPZWQSO-VHSXEESVSA-N 346.221 1.788 10 10 EDCE NCc1ccc(N2C[C@H](CO)C[C@@H](CO)C2)c(F)c1Br 2236641798 FXGBAQSMKAYTJG-NXEZZACHSA-N 347.228 1.474 10 10 EDCE CCN1CCN([C@@H](C)CNC(=O)C=Cc2ccc(O)c(O)c2)CC1 2307987219 LCVANZKIIDITFP-AWEZNQCLSA-N 333.432 1.253 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2354478848 SPKAAABURTUJKT-MGXFYRGHSA-N 341.249 1.660 10 10 EDCE COc1cccc(CNC(=O)Cn2c(=O)[nH]c3ccccc32)c1O 105651356 OLGYFJSYSJZEDP-UHFFFAOYSA-N 327.340 1.360 10 10 EDCE O=C(O)[C@]12CO[C@H](C1)[C@@H](NCc1cc(Br)ccc1O)C2 2359172468 RAWCWVXHCZJKIP-SUHUHFCYSA-N 342.189 1.877 10 10 EDCE CN1CCO[C@H](CNC(=O)NCc2c(O)ccc3c2CCCC3)C1 176438504 QHDNAKYYLHELCE-CQSZACIVSA-N 333.432 1.401 10 10 EDCE OC[C@H](NO)c1cc(Br)cc(Br)c1O 306672787 MKBKGTGPXAQIGZ-ZETCQYMHSA-N 326.972 1.929 10 10 EDCE Nc1ccc(OCCCn2cc(Br)c(=O)[nH]c2=O)cc1 88452890 LAWQFJQLSJBTSP-UHFFFAOYSA-N 340.177 1.350 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN[C@@H]2CC(=O)N([C@H]3C[C@@H]3C)C2)c1O 376055047 PILZCQZVBZNCEX-NDMJEZRESA-N 335.360 1.408 10 10 EDCE COc1ccc(N2CCN(Cc3nccnc3OC)CC2)cc1F 294701967 FDCOBNBSTQICQY-UHFFFAOYSA-N 332.379 1.955 10 10 EDCE COC1(CF)CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2168888705 LXCCEFMTIOSNDH-NSHDSACASA-N 344.184 1.576 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(S(C)(=O)=O)C2)c([N+](=O)[O-])c1 800871618 XLTHBFXRTAVPFG-GQCTYLIASA-N 340.357 1.014 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccn2c(O)nnc12 819760441 DJNYBDHVPVEYSQ-UHFFFAOYSA-N 333.344 1.556 10 10 EDCE O[C@@H]1C[C@@H]([C@@H]2CCCOC2)N(Cc2ccc(N3CCOCC3)cc2)C1 824653741 GWTWHYPLOHOFRB-RLLQIKCJSA-N 346.471 1.885 10 10 EDCE Cc1cc(CCNC(=O)[C@H](O)C(C)(C)O)c(C)n1-c1ccccc1 900033056 SPPGGWFDJBAUDL-KRWDZBQOSA-N 330.428 1.885 10 10 EDCE CCC/C=C\[C@H](O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 918914104 QSMMAFNRAUGWDZ-XFHJGTJQSA-N 331.460 1.772 10 10 EDCE C[C@H]1CN([C@H](C)CNC(=O)/C=C\c2ccc(O)c(O)c2)C[C@@H](C)O1 848295265 MDFSIYAKGZXLCS-ZJOMEWFRSA-N 334.416 1.725 10 10 EDCE C[C@H](NC(=O)N[C@H]1CNCC[C@H]1C)c1ccc(N2CCOCC2)cc1 841739764 BZVMJLQEWZPKTL-VKJFTORMSA-N 346.475 1.881 10 10 EDCE Oc1cc2c(cc1CN1CCO[C@H](CC(F)(F)F)C1)[C@@H](O)CO2 853614252 SKSQXQZUSKPMPV-MFKMUULPSA-N 333.306 1.971 10 10 EDCE CC(C)(C)NS(=O)(=O)C1(CNC(=O)c2cc(O)cs2)CCC1 927645365 PCINXMZYMJSRAM-UHFFFAOYSA-N 346.474 1.824 10 10 EDCE CCS(=O)(=O)C[C@@H](C)N[C@H]1CCN(c2ccc(OC)cc2)C1 850487072 FEJRFWIITFVUIE-KGLIPLIRSA-N 326.462 1.687 10 10 EDCE CCON(CC)C(=O)CNCc1cc(Cl)cc([N+](=O)[O-])c1O 858219634 UXYCVHJYWZCQOL-UHFFFAOYSA-N 331.756 1.843 10 10 EDCE Cc1cc(CNCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)on1 865423385 IVMXPDPMKFURQJ-HNNXBMFYSA-N 328.416 1.975 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC3(C2)CC(F)(F)C3)c1 763229916 ARPMHKUHHLNHIP-UHFFFAOYSA-N 346.355 1.635 10 10 EDCE NC(=O)N1CCC[C@H](C(=O)NCc2ccc3cccnc3c2O)C1 862028769 KEXKRKCROJFUMB-ZDUSSCGKSA-N 328.372 1.347 10 10 EDCE C[C@@H](NC(=O)C(=O)N[C@@H]1CSC1(C)C)c1ccc(N(C)C)cc1 1117729557 OYPGMVPWYJHETA-BXUZGUMPSA-N 335.473 1.940 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C\C(C)C)nc12 785034480 HTVIYFBCPIEKKA-WAYWQWQTSA-N 333.344 1.867 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)C1CN([C@H]2CCOC2)C1 896693111 ZLFFJYDNEZGEJD-HNNXBMFYSA-N 330.428 1.608 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)N2C[C@H]3C[C@@]3(CO)C2)N(C)C)cc1 899101218 GJIXDAMOWMRTTG-AYBZRNKSSA-N 346.475 1.379 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccc(C(=O)NC2CC2)cc1 1303226146 XZUPJLUBKVHGBH-UHFFFAOYSA-N 326.352 1.920 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@@H](CC(=O)NCCN=[N+]=[N-])C1 1965101640 GCNYESHBGVPADV-WDEREUQCSA-N 327.385 1.875 10 10 EDCE O=C(O)C[C@@H](NCc1ccc(N2CCOCC2)cc1)C1CCOCC1 1345173386 KFCJBRBCYYPIAK-GOSISDBHSA-N 348.443 1.883 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3OC(=O)N[C@@H]3C2)cc1Br 2120414652 CJQGGSAWZONQOH-BPTDKIDVSA-N 327.178 1.799 10 10 EDCE COc1ccc(CNCC2CC(NC(=O)[C@H](C)NC(N)=O)C2)cc1C 1485090481 PQIFNBPIIOIGID-GRTSSRMGSA-N 348.447 1.045 10 10 EDCE CCN1CCOC[C@@H]1C(=O)NC[C@H](C)NCc1ccc(OC)c(C)c1 1714248752 KPQZRZMUOOEHEM-DOTOQJQBSA-N 349.475 1.319 10 10 EDCE COCCOc1cccc(CC(=O)NCc2cc(O)ccc2O)c1 1633595429 VRWIULPLPSOXJO-UHFFFAOYSA-N 331.368 1.982 10 10 EDCE CN(C)C(=O)Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O 1729312447 XYYRCCVBPYVHDN-UHFFFAOYSA-N 343.431 1.976 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2c[nH]c(C(N)=O)c2)cc1C 1567079069 NTDLAXKIDCTGKY-LBPRGKRZSA-N 344.415 1.339 10 10 EDCE CCC(=O)NC[C@H](NCc1nnnn1-c1ccc(OC)cc1)C1CC1 1731386981 BPRMSRNFNCYNLU-HNNXBMFYSA-N 344.419 1.065 10 10 EDCE C[C@H](NC(=O)c1ccc(=O)n(-c2cnn(C)c2)c1)c1ccccc1O 1642831341 XQJJBLFLPUHWOR-LBPRGKRZSA-N 338.367 1.768 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2nn(C)cc2C)cc1C 1691317542 YOASWTMFQNCETM-UHFFFAOYSA-N 330.432 1.907 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)Cn2ccnc2C)cc1C 1690649451 XYHWNBYXDJGSDF-CQSZACIVSA-N 330.432 1.803 10 10 EDCE O=C1CC[C@H](C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)CN1 1889600492 BSAJIOUKRJKPBR-ZOBUZTSGSA-N 327.428 1.818 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1(N(C)C(=O)OC(C)(C)C)COC1 1900612871 PFTJIVUPWBQDPM-UHFFFAOYSA-N 327.385 1.781 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CCO)[C@@H](CO)C2)cc1Br 2149915564 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1.327 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@H]2C1 2087858667 PQAAUAFIXUYTQY-QWRGUYRKSA-N 346.246 1.631 10 10 EDCE CS(=O)(=O)C[C@@H]1CCCN1c1ccc(CO)c(Br)c1 2094923384 KJABZEXIFQLDCY-LBPRGKRZSA-N 348.262 1.955 10 10 EDCE COc1ccc(N(C)C[C@](N)(C(N)=O)C2(Br)CC2)cc1 2206609965 XTWHLCCICUOQNZ-AWEZNQCLSA-N 342.237 1.242 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)C[C@H]3C2)c(Br)c1 2236979100 MBYJIUARNAPVMJ-AGCIHXOGSA-N 341.249 1.476 10 10 EDCE O[C@H]1CN(c2ccc(CNC3CCC3)cc2Br)C[C@@H]1O 2240021123 UBDLOGGCFHBMRJ-GJZGRUSLSA-N 341.249 1.633 10 10 EDCE C[C@H]1CN(Cc2cc(Br)ccc2O)CC2(CNC2)O1 2272928013 ZXAUDHBNLSIMEO-JTQLQIEISA-N 327.222 1.717 10 10 EDCE OCc1ccc(N2C[C@@H]3OCC[C@]3(CO)C2)cc1Br 2278878482 JPKQOQYOZUAOTF-UONOGXRCSA-N 328.206 1.529 10 10 EDCE CNC(=O)[C@H]1CCCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297505694 NWGPMZSDNSXIPI-QGZVFWFLSA-N 343.427 1.273 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)Nc1ccnn1C[C@@H]1CCOC1 2307987036 YBQXQAUPEGVJRZ-ZDUSSCGKSA-N 329.356 1.983 10 10 EDCE CCNCc1ccc(N2CC([C@H](O)CO)C2)c(Br)c1 2336768118 AZMLHUAPHALFET-CQSZACIVSA-N 329.238 1.348 10 10 EDCE C[C@H](O)CN1CCC(CN(C)Cc2cc([N+](=O)[O-])ccc2O)CC1 171588948 JBXMAEWXOHMNHG-ZDUSSCGKSA-N 337.420 1.825 10 10 EDCE Nc1ncncc1C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 185444376 WGFMKYYLVLMDTR-CYBMUJFWSA-N 328.372 1.586 10 10 EDCE C[C@@H]1COCCN1CCN(C)Cc1ccc(N2CCOCC2)cc1 192693019 JNJKWBGREWSLIH-QGZVFWFLSA-N 333.476 1.676 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNCC2(O)Cc3ccccc3C2)c1O 375729595 HGUZULYBRWPIQY-UHFFFAOYSA-N 344.367 1.929 10 10 EDCE CN(CC1CC1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 283858568 CZWGTCLVHSSZMT-UHFFFAOYSA-N 331.416 1.008 10 10 EDCE Cc1ccc(CN2CC[C@](CO)(C(=O)O)C2)c(O)c1Br 2381137851 KJVMHJCUIBYOAE-AWEZNQCLSA-N 344.205 1.732 10 10 EDCE CO[C@H]1C=CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2165073154 HZOVOPFDEQBSFO-ISVAXAHUSA-N 338.205 1.792 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Nc3ncncc3OC)C2)cc1 823411124 IFBXFNWDWTXQIW-LBPRGKRZSA-N 343.387 1.894 10 10 EDCE CN1C[C@H](O)C[C@]1(C)C(=O)NCc1cc(Cl)cc(Cl)c1O 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2236054127 FCQXMJSIBJKSRC-UHIISALHSA-N 346.221 1.527 10 10 EDCE COc1ccc(Br)c(CN2CCOC[C@H]2C(=O)O)c1O 2236041975 RYANOJBFHVKHBJ-JTQLQIEISA-N 346.177 1.449 10 10 EDCE C[C@@H](NCc1nn(C)nc1Br)c1cc(O)ccc1O 2226970784 UUVBOVXLBMEVPD-SSDOTTSWSA-N 327.182 1.840 10 10 EDCE OC[C@@H]1NC[C@H]2CN(Cc3ccc(Br)cc3O)C[C@H]21 2227308849 XOGOHXLMUCOHAY-UHTWSYAYSA-N 327.222 1.167 10 10 EDCE COc1ccc(Br)c(CN(C)C2[C@H]3CNC[C@H]23)c1O 2227749161 BRXMPJSVJVWLQN-IUCAKERBSA-N 327.222 1.813 10 10 EDCE CCNCc1ccc(N2CC[C@@H]2[C@@H](O)CO)cc1Br 2270717900 IOTVJSMNRPYJHN-KGLIPLIRSA-N 329.238 1.491 10 10 EDCE C[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(O)cc2O)SC1=S 2314842227 IZGRNEMRJRSATI-ZCFIWIBFSA-N 325.367 1.772 10 10 EDCE NCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2332602276 SHACYTULFLPQGC-IGJVIKARSA-N 327.222 1.228 10 10 EDCE Cc1ccc(CN2CCC(N)(CO)CC2)c(O)c1Br 2352941729 VAIOUSLRIMVYKG-UHFFFAOYSA-N 329.238 1.749 10 10 EDCE O=C(O)[C@H]1CO[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]21 2354475634 JNFMLTBESKNFRY-NTZNESFSSA-N 342.189 1.686 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@H](O)c2c(Br)ncn2C)cc1 2362530243 XYFAUHGVUYMQJV-YPMHNXCESA-N 339.237 1.982 10 10 EDCE CN(C)c1ccc([C@H](O)[C@@H](N)c2c(Br)ncn2C)cc1 2362541899 HJVYMILZXAHHGP-AAEUAGOBSA-N 339.237 1.982 10 10 EDCE CCNC(=O)[C@@H]1CNCCN1Cc1cc(Cl)cc(Cl)c1O 89088413 YQGCHXMJSGOKBG-LBPRGKRZSA-N 332.231 1.609 10 10 EDCE N[C@@H](c1cccc(I)c1O)C(F)(F)C(=O)O 95780803 LGHLYJHSLLQATL-ZETCQYMHSA-N 343.067 1.717 10 10 EDCE C[C@@H](CN1CCOCC1)N(C)Cc1ccc(N2CCOCC2)cc1 91531000 OCUMGFPPXIYRQL-KRWDZBQOSA-N 333.476 1.676 10 10 EDCE CC(=O)N(C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccc(N)cc1 244417913 YRVYZJRGSDYRLI-UHFFFAOYSA-N 348.384 1.501 10 10 EDCE COC(=O)NS(=O)(=O)c1ccc(N=NN2CCOCC2)cc1 254813712 BNDZHTBREHUQBN-UHFFFAOYSA-N 328.350 1.062 10 10 EDCE CC(C)c1nn(C)cc1NC(=O)C(=O)N(C)Cc1ccccc1O 280328125 LEFYBWFJCSSQIS-UHFFFAOYSA-N 330.388 1.846 10 10 EDCE CN(C[C@H]1CCCO1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 288660800 VMSNQUFGLLUQCP-QGZVFWFLSA-N 343.427 1.316 10 10 EDCE CO[C@H](C)[C@@H](N)CC(=O)NCc1ccc(C)c(Br)c1O 2380747614 WBPPXHSTGNCMRI-KOLCDFICSA-N 345.237 1.832 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(C)c(I)c1 808513389 ATAOXPGEGXYILS-UHFFFAOYSA-N 346.120 1.915 10 10 EDCE C[C@@H](CN(C)C)N(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2379903756 RWJKXYZYBFGVOO-ISVAXAHUSA-N 342.237 1.821 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)[C@H](OC)C2)c(Br)c1 396004357 FZIYFBZGTKMTAV-CUOATXAZSA-N 329.238 1.925 10 10 EDCE C[C@@H](N[C@H]1CCC(=O)N(C)C1=O)c1ccc(N2CCOCC2)c(F)c1 818360713 BRWHZSARQNIGLG-DOMZBBRYSA-N 349.406 1.460 10 10 EDCE CO[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1 823292038 MDMVHLRSAMJOAC-NVXWUHKLSA-N 334.416 1.191 10 10 EDCE COC(=O)c1cnc(SC[C@H]2CCN(S(C)(=O)=O)C2)s1 829677886 PYHZHTKNPOQOTQ-QMMMGPOBSA-N 336.460 1.303 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@H]3CCCN(C)C3=O)CC2)cc1 822655961 FGWJGVLENGHZBM-KRWDZBQOSA-N 345.443 1.602 10 10 EDCE C[C@@H]1CN(CCO)CCN1Cc1cccc(Br)c1O 825338320 OJVHOJUSKVHMKV-LLVKDONJSA-N 329.238 1.653 10 10 EDCE CCN(C)c1ccc(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1 830014504 ZCQUOIVIRWIQKE-QGZVFWFLSA-N 338.473 1.532 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CNc3ccccn3)C2)cc1 912292017 GOTNOSCXYZNKJF-AWEZNQCLSA-N 326.400 1.897 10 10 EDCE COC(=O)[C@H]1C[C@@H](N(C)CC(=O)NCc2ccc(N(C)C)cc2)C1 852695572 BXFNUPPOUHZJOL-FZNQNYSPSA-N 333.432 1.252 10 10 EDCE O=C(NCCCSc1nccs1)NCCCN1CCOC1=O 759571856 AQMVIGBNOJUWRJ-UHFFFAOYSA-N 344.462 1.767 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@](C)(O)C3CC3)C2)cc1 854301863 VJAHPCXEAMDIBG-KSSFIOAISA-N 333.432 1.734 10 10 EDCE COCc1nc(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)n(C)n1 853808273 GAEVPQGQSHVLSD-CYBMUJFWSA-N 345.447 1.697 10 10 EDCE CCS(=O)(=O)C1(CN[C@H](C)c2cc(C(=O)OC)ccc2O)CC1 850558050 PQQXMIXIDGOKMD-LLVKDONJSA-N 341.429 1.797 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCc1cn(C)nn1 854949348 UPDRIZSQIZUIGJ-CQSZACIVSA-N 329.448 1.870 10 10 EDCE COC(=O)c1cc2ccccc2c(CN2C[C@H]3C(=O)OC[C@H]3C2)c1O 863337656 FVKBHGKNBDNTRX-IUODEOHRSA-N 341.363 1.937 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@H]1CCOC[C@@H]1C)c1ccc(N(C)C)cc1 1117508711 IXWKDIAOWTUDGB-XEZPLFJOSA-N 333.432 1.471 10 10 EDCE CCS(=O)(=O)c1ccccc1CC(=O)NCc1cc(O)ccc1O 1153884357 CVLCZQISUXXDDH-UHFFFAOYSA-N 349.408 1.750 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCOC[C@@H]2O)c1O 1964581579 PHPNEOSQYATWRT-MNOVXSKESA-N 332.194 1.403 10 10 EDCE CN1CCN(c2ccc(CN3C[C@@H](O)CC(F)(F)C3)cc2F)CC1 1320642599 BNFVTTNBDSPFEK-AWEZNQCLSA-N 343.393 1.779 10 10 EDCE CO[C@@H]1CC[C@@H]1N(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1332667986 DCYPLJNVKWVQTR-DLBZAZTESA-N 345.443 1.321 10 10 EDCE CCn1ncc(C(=O)N[C@H](C)[C@@H](C)NCc2ccc(OC)c(C)c2)n1 1282124789 QGNDSJMABFYYPG-ZIAGYGMSSA-N 345.447 1.912 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCOC[C@@H]2c2ncon2)cc1 1295078448 PEKHHKPIQOHZMS-LLVKDONJSA-N 330.304 1.446 10 10 EDCE CN1C(=O)O[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@@H]21 2120399034 BDTAJDUSFAWJOH-CMPLNLGQSA-N 327.178 1.790 10 10 EDCE C[C@@H](NC(=O)NCC(C)(C)CS(N)(=O)=O)c1ccccc1O 1479124282 GQTMLXIYYRPAIQ-SNVBAGLBSA-N 329.422 1.067 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CN(c2ccc(F)cc2)C1=O 1632686492 NMCFFUYWUDGNMA-ZDUSSCGKSA-N 330.315 1.311 10 10 EDCE CCn1nc(C)c(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)n1 1731641787 FZDBMWFNFFORSD-ZDUSSCGKSA-N 345.447 1.832 10 10 EDCE C[C@@H]1CN(C[C@@H]2CCCN2C(=O)Cc2ccc(O)c(O)c2)C[C@@H](C)O1 1583525783 IMCHFKUHCCIDGD-FMKPAKJESA-N 348.443 1.741 10 10 EDCE Cc1cccc(OC[C@H](O)CNC(=O)c2c(F)ccc(O)c2O)c1 1650738645 SQVOIWIGXGMVCQ-LLVKDONJSA-N 335.331 1.715 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)CN(C)C(C)=O)cc1C 1676305176 SAFYJDWJQCJLTI-AWEZNQCLSA-N 335.448 1.418 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2CCN(C)C2)cc1C 1670343988 AAPUBIVOCBWREZ-QGZVFWFLSA-N 333.476 1.893 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@H]2CC2(F)F)cc1C 1676529237 IZEHTVNLIIATBP-CHWSQXEVSA-N 328.359 1.226 10 10 EDCE O=C1c2cc(O)cc(O)c2C(=O)c2c1cc1c(c2O)[C@H]2CCO[C@@H]2O1 14828611 BABJNKGTTYCTOO-LWESTGQBSA-N 340.287 1.801 10 10 EDCE biogenic NCc1cc(F)c(N2CC[C@@H](O)C[C@@H]2CO)cc1Br 2136084069 HMBDKRRFJYNWOL-NXEZZACHSA-N 333.201 1.369 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NCCc1ccc(O)c(O)c1 1944566914 RKDZUFZXAKEJRA-OLZOCXBDSA-N 338.404 1.522 10 10 EDCE OCCCO[C@H]1CCN(c2ccc(CO)c(Br)c2)C1 2142046090 HHJWQFBTRRYRPP-ZDUSSCGKSA-N 330.222 1.919 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985094087 JYAWFRUWVOZJCN-MNOVXSKESA-N 326.401 1.353 10 10 EDCE COCCNCc1ccc(N(C)C2CN(C)C2)c(Br)c1 2145481786 SHNOAWAOSGJRGP-UHFFFAOYSA-N 342.281 1.935 10 10 EDCE CON(CCNC(=O)OC(C)(C)C)C(=O)c1cc(O)c(O)c(O)c1 2015118548 BUYNMEKWHNGELI-UHFFFAOYSA-N 342.348 1.332 10 10 EDCE CN1C(=O)N[C@@H]2CN(c3ccc(CO)cc3Br)CC[C@@H]21 2171298605 XHPKBYPBDUHSOK-YPMHNXCESA-N 340.221 1.544 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(CNCc2ccc(O)cc2O)CCOC1 688914425 GPOMZZWBOAAPEP-KRWDZBQOSA-N 338.404 1.871 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)[C@H]3C[C@H](O)C3)c(Br)cc21 2179468203 MRLLORVMIMBFIF-UPFKWVMWSA-N 340.221 1.621 10 10 EDCE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2[C@@H](CN)C(=O)O 2044378798 SVAZRZVVPUVQRP-HNNXBMFYSA-N 349.431 1.876 10 10 EDCE Nc1nc[nH]c(=NCCc2ccc(O)c(O)c2)c1Br 2091749558 YVSWZRYWANXEJN-UHFFFAOYSA-N 325.166 1.309 10 10 EDCE CS(=O)(=O)C[C@H]1CCCN1c1ccc(CO)cc1Br 2094922457 CXWNYPVQUVWPFD-LLVKDONJSA-N 348.262 1.955 10 10 EDCE O=C(O)CN1CC[C@@H](NCc2cc(Br)ccc2O)C1 2113034530 DJPDCHBIFXKCDJ-LLVKDONJSA-N 329.194 1.403 10 10 EDCE OCCO[C@@H]1CCCN(c2ccc(CO)cc2Br)C1 2113855405 CENNIQDEEOGIRC-GFCCVEGCSA-N 330.222 1.919 10 10 EDCE CNCc1ccc(N(C)[C@@H]2CC(=O)NC2=O)c(Br)c1 2114727630 QZWGDJHIPWIUTD-LLVKDONJSA-N 326.194 1.020 10 10 EDCE COc1ccc(Br)c(CNCC2COCCOC2)c1O 2208760485 SXXHVDRLWUONON-UHFFFAOYSA-N 346.221 1.916 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)NCc1ccccc1O 2303200387 XZYHYKCJRBAZEX-UHFFFAOYSA-N 338.404 1.628 10 10 EDCE Cc1ccc(CN2C[C@H](N)[C@H]3COC[C@H]32)c(O)c1Br 2352674871 ABAXBHIZBQBMQE-GRYCIOLGSA-N 327.222 1.621 10 10 EDCE Cc1ccc(CN2CCO[C@@H](C(N)=S)C2)c(O)c1Br 2352945948 DIKACIDBTRORNO-SNVBAGLBSA-N 345.262 1.950 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCCOC1 171599235 TZDDTCBWZPSYFT-CQSZACIVSA-N 337.395 1.641 10 10 EDCE CNC(=O)[C@@H]1C[C@H](NC/C=C/c2ccc(N(C)C)cc2)CN1C(C)C 23363087 VRTWIYAOGUOSSX-XZJTZLQGSA-N 344.503 1.953 10 10 EDCE C[C@@H](CNC(=O)/C=C/c1ccc(N(C)C)cc1)CN1CCOCC1 41530395 RYMLPKZVJKBODF-FSNWXROXSA-N 331.460 1.850 10 10 EDCE CCOC(=O)c1cn(C)nc1NC(=O)NCc1cccc(OC)c1O 272361651 QKFBIGDCFYOHNY-UHFFFAOYSA-N 348.359 1.633 10 10 EDCE Cc1ccc(CNC(=O)[C@H](N)[C@H]2CCOC2)c(O)c1Br 2380742999 XYSJMFDVOTWGMR-CMPLNLGQSA-N 343.221 1.443 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CCC(=O)NC2)c(O)c1Br 2380744163 BXHPRRBCLYMSRA-SNVBAGLBSA-N 341.205 1.606 10 10 EDCE Cc1ccc(CN2CCN([C@@H](C)CN)CC2)c(O)c1Br 2381126842 CBUPCABABNFSSN-LBPRGKRZSA-N 342.281 1.928 10 10 EDCE Cc1ccc(CNC(=O)[C@H](N)[C@@H]2CCCO2)c(O)c1Br 2381129983 SCBAKYHAQQPYHL-CMPLNLGQSA-N 343.221 1.586 10 10 EDCE CC(=O)C(=O)COC(=O)C[C@@H]1CCCN(C(=O)NCC(C)C)C1 808520721 WZYKKFMWOYMLBT-ZDUSSCGKSA-N 326.393 1.155 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CN[C@@H]3C[C@H]3C3CC3)CC2)cc1 819281760 XPJNIWFJKKRFCX-YSIASYRMSA-N 345.487 1.566 10 10 EDCE O=C([C@H]1CCCO1)N1CCOc2ccc(N3CCOCC3)cc2C1 581789046 HGZIEFJUORTIQI-QGZVFWFLSA-N 332.400 1.423 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1CC[C@@H](C2CC2)N1 846673785 WUUINZVWAHMTCT-ZWKOTPCHSA-N 329.444 1.670 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@@H]2CN(C3CC3)C(=O)O2)c1O 848928225 BBEPKHJCCLQVLG-LLVKDONJSA-N 337.332 1.382 10 10 EDCE C[C@@H](NC(=O)C(=O)N[C@H]1CCCCNC1)c1ccc(N(C)C)cc1 842203914 YNRWVCGSNNMESE-HIFRSBDPSA-N 332.448 1.188 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@H](O)c1ccnn1C 919082166 WHRGYBGBMJHIOB-INIZCTEOSA-N 331.420 1.327 10 10 EDCE COc1ccc(N2CC[C@@H](N3C(=O)N4CC5CC4(C5)C3=O)C2)cc1 849357152 KJZOJYCGDZNWKB-HZEYSBKDSA-N 327.384 1.701 10 10 EDCE Cc1ccc(C(=O)NCCS(=O)(=O)CC(F)(F)F)c(O)c1O 855578161 KSARIUDWIONFSW-UHFFFAOYSA-N 341.307 1.113 10 10 EDCE CCS(=O)(=O)C1(CNC(=O)NCc2ccc(N(C)C)cc2)CC1 852650238 ADMHGAAFXFOCKB-UHFFFAOYSA-N 339.461 1.519 10 10 EDCE Cc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)nc(C)n1 856211823 AHUAVLASDAEREJ-UHFFFAOYSA-N 340.427 1.985 10 10 EDCE COCC(COC)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852370871 KYWQITFLFJLYDB-ZDUSSCGKSA-N 337.420 1.235 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CCCN3C(C)=O)C2)cc1 868956104 KLRFGAODVXQBIG-CRAIPNDOSA-N 345.443 1.649 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCCC1CCS(=O)(=O)CC1 768983568 VBDSWLWAZFMOPF-UHFFFAOYSA-N 340.445 1.749 10 10 EDCE Cc1nn(C)c2c1N(C(=O)c1ccc(N=NC(N)=O)cc1)CCO2 1137478523 AOMJTHAUYVULII-UHFFFAOYSA-N 328.332 1.930 10 10 EDCE CCOCCOCC(=O)N1CCN(c2ccc(OCC)cc2)CC1 1319625325 GARPWVZQTQDQFZ-UHFFFAOYSA-N 336.432 1.787 10 10 EDCE CCNC(=O)CN(C)[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1329628251 PJBULJXFEMPYLU-LLVKDONJSA-N 348.407 1.035 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(NC(=O)OC)C2)c([N+](=O)[O-])c1 1320299876 VXCITOXWXIZIRW-GQCTYLIASA-N 335.316 1.326 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@@H](c3cnccn3)C2)cc1 1198163931 AYWWGMXBLYBZSN-MRXNPFEDSA-N 339.443 1.648 10 10 EDCE COc1ccc(CN[C@H]2CN(C(=O)CCCC(N)=O)C[C@H]2C)cc1C 1281474775 DJQBVJSCXZCLKB-ZBFHGGJFSA-N 347.459 1.596 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@H]1CC(=O)N(c2ccccc2)C1 1451770371 PYSZGAQSFODQTO-ZDUSSCGKSA-N 326.352 1.767 10 10 EDCE COc1ccc(O)c([C@@H](C)N[C@@H](C)c2nc(-c3nc[nH]n3)no2)c1 1459848813 HUOJJGQZXACDRW-BDAKNGLRSA-N 330.348 1.981 10 10 EDCE CN1CCC2(CC1)CN(C(=O)c1ccc(N=NC(N)=O)cc1)CCO2 1452153791 SYRDFMZIUZLDPI-UHFFFAOYSA-N 345.403 1.786 10 10 EDCE COc1ccc(N2CCN(C(=O)C3=C[S@@](=O)CCC3)CC2)cc1 1465889495 FHFANGBSWMMLNO-QHCPKHFHSA-N 334.441 1.770 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3NC(=O)O[C@H]3C2)cc1Br 2120414655 CJQGGSAWZONQOH-MKCWBWRRSA-N 327.178 1.799 10 10 EDCE CO[C@H](C)CNC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1483606735 FCDLDOMQACUSMV-IAQYHMDHSA-N 347.419 1.982 10 10 EDCE Cc1nnnn1-c1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1 1636022337 JFKCDUPUAFVVGW-UHFFFAOYSA-N 339.355 1.354 10 10 EDCE CCO[C@@H](C)C(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1494615782 WVFMQRALUGHXOP-QWRGUYRKSA-N 349.391 1.509 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)Cn2cncn2)C(C)C)cc1C 1568469137 RPQJOTYPPYCUJX-MRXNPFEDSA-N 345.447 1.526 10 10 EDCE CNS(=O)(=O)c1csc(C(=O)N[C@H](C)c2ccccc2O)c1 1643738490 CVOHSOMUAIDRIT-SECBINFHSA-N 340.426 1.853 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@@H](C)NC(C)=O)C2)cc1C 1731469368 HDYRYWQVYCUTLD-WQVCFCJDSA-N 333.432 1.265 10 10 EDCE CCOCC(=O)N[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1737468743 NJSZRIXALDNJQQ-BETUJISGSA-N 347.375 1.263 10 10 EDCE O=C1CC[C@@](C(=O)NCc2cc(O)ccc2O)(c2ccccc2)CN1 1651225740 XAQAOOAXDXZWMV-IBGZPJMESA-N 340.379 1.562 10 10 EDCE CC/C(C)=C/C(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1758673441 VFFSBIZQGCIYBZ-LQGRVKISSA-N 347.415 1.832 10 10 EDCE CO[C@@H]1COCC[C@@H]1Cn1c(C)nnc1N(C)Cc1ccccc1O 1697695357 DVBPNHKUHUCOIQ-NVXWUHKLSA-N 346.431 1.980 10 10 EDCE COC(=O)c1ccc(NC(=O)CN2C(=O)[C@H](C)SC2=S)cc1 11635509 IJMOEOWUTBCLNL-QMMMGPOBSA-N 338.410 1.661 10 10 EDCE CN(C)c1ccc(/C=c2\s/c(=C\C(=O)C(C)(C)C)n(C)c2=O)cc1 12554790 MSLMSHYSPAJPIA-OZFCMSLCSA-N 344.480 1.737 10 10 EDCE C[C@H](N[C@H](C)CN1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 154883736 VOUDBDZJMARFSJ-MSOLQXFVSA-N 346.519 1.810 10 10 EDCE OCc1ccc(N2CCN3CCOC[C@H]3C2)cc1Br 2129367885 DDUGUXGVYAHWPG-CYBMUJFWSA-N 327.222 1.462 10 10 EDCE COC(=O)[C@@H](NCCN=[N+]=[N-])c1c(Br)nn(C)c1C 2131551997 NIIXSXRLMGPMIE-QMMMGPOBSA-N 331.174 1.605 10 10 EDCE O=S(=O)(CCNCc1c(O)cccc1Br)C(F)F 2217602536 NVUPUCCKHQCLII-UHFFFAOYSA-N 344.177 1.882 10 10 EDCE NCc1ccc(N2CCN3C(=O)NC[C@H]3C2)c(Br)c1 212983156 AWELGJARABAXRC-JTQLQIEISA-N 325.210 1.122 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C[C@H](N)C(=O)O 1951536937 UOXZSXPDHZARCU-QWRGUYRKSA-N 340.376 1.336 10 10 EDCE CCN[C@@H](c1ccccc1O)[C@H](O)c1c(Br)nnn1C 2148153761 PUDRIDJYJNMYKR-JQWIXIFHSA-N 341.209 1.667 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CO[C@H]1CCN(C(=O)OC(C)(C)C)C1 1985102563 INCMATLFLRDFMG-NSHDSACASA-N 327.385 1.781 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985103647 YNENYFXJKFRURK-KOLCDFICSA-N 327.385 1.562 10 10 EDCE C[C@@H](NC[C@@H](O)CNC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985771339 GXFBTZMFWOKHKT-ZYHUDNBSSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC[C@@]12C[C@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 2004881387 MCHAGWWWFNTFCE-LCTGZXLESA-N 336.432 1.945 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H](O)C(F)(F)C3)c(Br)cc21 2152098632 PTSGYRKPYWDWPL-UWVGGRQHSA-N 348.147 1.217 10 10 EDCE CN[C@@H](C)c1ccc(N(C)[C@@H]2CC(=O)NC2=O)c(Br)c1 2171209986 ZBPYJGBZBDTTDT-QPUJVOFHSA-N 340.221 1.581 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C(C)(C)CCO 688356274 VRPCQQWZHPDMJW-GFCCVEGCSA-N 342.237 1.998 10 10 EDCE CCOC1CN(c2cc3c(cc2Br)[C@H](NC)C(=O)N3)C1 382736149 IFPXGYVWTOLSHI-ZDUSSCGKSA-N 340.221 1.887 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1cccc(O)c1 2067791455 MVYDBPWRPPMZHO-CABCVRRESA-N 348.399 1.939 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2199528277 YFKFCLWSRRRWMZ-QWCIBXROSA-N 341.249 1.789 10 10 EDCE O=C(O)CC1(O)CN(Cc2cc(Br)cc(F)c2O)C1 2110673519 RSGOMHMKUQLTDJ-UHFFFAOYSA-N 334.141 1.315 10 10 EDCE O=S1(=O)C[C@@H]2[C@@H](CCN2c2ccc(CO)cc2Br)C1 2094927402 OLBFKUSUPYWQPW-GXFFZTMASA-N 346.246 1.565 10 10 EDCE CC[C@H](C)NCc1ccc(N2C[C@H](O)[C@H](O)C2)cc1Br 2240082080 RKIGJHNMKBUZPG-NZVBXONLSA-N 343.265 1.879 10 10 EDCE CC(C)NCc1ccc(N2CC[C@@H]2[C@H](O)CO)cc1Br 2286209015 MXDXLEWONIUADT-HUUCEWRRSA-N 343.265 1.879 10 10 EDCE NCc1cc(F)c(N2C[C@@H](O)[C@@H]3COC[C@@H]32)cc1Br 2329193008 FYZUBURQXZNBCJ-OXHMUOHRSA-N 331.185 1.243 10 10 EDCE COc1ccc(Br)c(CN(C)[C@H]2CNC[C@@H]2F)c1O 2343638332 BDRPEPZAILUFNB-QWRGUYRKSA-N 333.201 1.905 10 10 EDCE COc1ccnc(N2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)n1 170913782 WEWJBBCMAVPIRN-UHFFFAOYSA-N 345.359 1.421 10 10 EDCE Cc1csc(CNS(=O)(=O)CCOc2ccc(N)cc2)n1 70490732 CDCAHZDGMRYOKT-UHFFFAOYSA-N 327.431 1.532 10 10 EDCE CC(C)C[C@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)N1CCOCC1 180617692 VNQDIIYAGZXBEM-MQDFFIGUSA-N 348.443 1.974 10 10 EDCE COCCN1CCCN(Cc2cc(Cl)cc(OC)c2O)CC1=O 191699756 YDMAKLCVAVDIQD-UHFFFAOYSA-N 342.823 1.735 10 10 EDCE Cn1nccc1CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 80006648 ZAHIWQPDUGBROT-UHFFFAOYSA-N 347.394 1.395 10 10 EDCE Nc1ccc(CCNS(=O)(=O)c2ccc([N+](=O)[O-])s2)cc1 193337482 AABGGXHRCYHRNE-UHFFFAOYSA-N 327.387 1.760 10 10 EDCE O=C(NCc1nc(-c2ccc(O)c(O)c2)cs1)N1CCOCC1 49699504 JFGQZOCTDKNEHJ-UHFFFAOYSA-N 335.385 1.763 10 10 EDCE CN1CCCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1 254988983 HNQQQHZSDWYBHM-YVMONPNESA-N 329.444 1.701 10 10 EDCE CN(C(=O)/C=C/c1cnccn1)c1ccc(N2CCOCC2)nc1 273389546 JKZWNFIPBPZCPS-GORDUTHDSA-N 325.372 1.384 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC[C@@H]2c2nc(N)n(C)n2)c1O 284402384 WMKSGCWBBKJBSI-CYBMUJFWSA-N 333.367 1.782 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CC[C@H](O)CN2)c(O)c1Br 2380753041 BNMLIMZJVGLYHZ-WDEREUQCSA-N 343.221 1.192 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(C)(C(=O)OC)C2)c([N+](=O)[O-])c1 819954987 FNJFDRVOCRQITC-ALCCZGGFSA-N 334.328 1.780 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NCc3noc(C)n3)C2)cc1 823140666 KUGBFUOZUPSRSY-CYBMUJFWSA-N 345.403 1.712 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N[C@@H](CO)c2ccnn2C)cc1 837723939 AUNSUIQCHYOFMD-INIZCTEOSA-N 345.447 1.799 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(N3CC[C@@H](O)C3)C2)c([N+](=O)[O-])c1 845722854 NDOBRGJDXRUETK-PKXJPQMGSA-N 347.371 1.036 10 10 EDCE CN(C)c1ccc(CNC(=O)NCC[C@@]2(O)CCOC2)cc1F 844935130 RYRWXFQFRQUECU-MRXNPFEDSA-N 325.384 1.232 10 10 EDCE Cn1ccnc1[C@@H]1C[C@@H](NC(=O)NCc2c(O)cccc2F)CCO1 922797605 DIEZZMKAAICMNJ-NHYWBVRUSA-N 348.378 1.984 10 10 EDCE CC1(N2CCC2)CCC(NC(=O)C(=O)Nc2ccc(N)cc2)CC1 927872117 GNAJRYQXIOUFQI-UHFFFAOYSA-N 330.432 1.731 10 10 EDCE C[C@H](NCC[C@H]1CNCCS1(=O)=O)c1ccc(N(C)C)cc1 925801255 XKNDUVIHIQCBSR-BBRMVZONSA-N 325.478 1.180 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NC(=O)c1cc(C)n(-c2ccccn2)c1C 855449888 UZGQLQKCRUGEKG-GOEBONIOSA-N 343.383 1.549 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)Cc3cnc[nH]3)C2)cc1 855225159 OPOUXWFAFIFXTC-UONOGXRCSA-N 328.416 1.992 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCNC(=O)C3CC3)C2)cc1 851972058 UZIYIXUOBQSLBH-CQSZACIVSA-N 346.431 1.099 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)C[C@@](C)(C(F)F)O1 853335523 ALBUYAKILZSUEH-PSLIRLAXSA-N 327.331 1.478 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCCNC(=O)C3CC3)C2)cc1 855233008 VNKXNIGZKQZOCV-HNNXBMFYSA-N 345.443 1.697 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2c[nH]nc2[C@H]2CCNC2)c1 852802142 KTHGXWACPUDGME-QWRGUYRKSA-N 330.388 1.692 10 10 EDCE Cc1ccc(O)c(CNC(=O)C2CCN(Cc3nccn3C)CC2)c1 862757934 JAUILEVIBNFRSX-UHFFFAOYSA-N 342.443 1.963 10 10 EDCE COCc1nc([C@@H]2COCCN2Cc2cc(C)cc(OC)c2O)no1 894427105 JKRQPAYCXKZHNL-ZDUSSCGKSA-N 349.387 1.812 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)N[C@@H](C)C2(S(C)(=O)=O)CC2)c1 797069580 HEBIXEMIUQMPHT-MNOVXSKESA-N 341.429 1.795 10 10 EDCE Cc1cnc(S(C)(=O)=O)nc1C(=O)N[C@@H](C)c1ccccc1O 1151892094 IVMZEYFOYMKJFS-JTQLQIEISA-N 335.385 1.385 10 10 EDCE Cn1ncc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1Cl 1168365724 TVDVMNNANROEFR-UHFFFAOYSA-N 344.780 1.403 10 10 EDCE C[C@@H](c1ccncc1)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1335559369 VANDWVXVNZTFEJ-LBPRGKRZSA-N 325.368 1.849 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@@H]2[C@H]3COC[C@H]32)C2CC2)cc1C 1265367820 DZTZUBRMIKRSHM-NTDBWNAOSA-N 344.455 1.880 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)c2cccnc2)cc(OC)n1 1295399515 BSQYJLQTOJKRCG-NSHDSACASA-N 344.371 1.042 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(CO)nc1 1540536940 YPSSQHHZONJPOZ-UHFFFAOYSA-N 341.411 1.683 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1C[C@@H]2CC[C@H](C1)S2(=O)=O 1472063913 SKHXMQJLFDVXMY-RTCCRHLQSA-N 325.386 1.070 10 10 EDCE CCCN(C)CC(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1637243701 GTLWKSCKQUVZEE-UHFFFAOYSA-N 342.823 1.889 10 10 EDCE Cc1[nH]nc(Br)c1C(=O)NCc1ccc(O)c(O)c1 1566359695 KNHFVHGETOGZJH-UHFFFAOYSA-N 326.150 1.822 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@@](C)(C(=O)NCCN=[N+]=[N-])C1 1965102564 QMXXJHUTLXHSLN-IINYFYTJSA-N 327.385 1.875 10 10 EDCE CC(=O)Nc1ccc(NC(=O)CN2C(=O)[C@H](C)SC2=S)cc1 11635450 BWWDGDNOBPZHNR-QMMMGPOBSA-N 337.426 1.832 10 10 EDCE CC1(C)C[C@@H](O)[C@H](O)CN1c1ccc(CN)c(Br)c1 2132116373 PWSXFJAMZDVPEU-CHWSQXEVSA-N 329.238 1.618 10 10 EDCE CCOc1cccc(CNCCC(=O)NCCc2cnc[nH]2)c1O 1857859738 DFYNFIPAHACBPO-UHFFFAOYSA-N 332.404 1.353 10 10 EDCE CN(CC1(O)CCOCC1)c1ccc(CN)c(Br)c1 228156775 JUZZGDVKJPFVEX-UHFFFAOYSA-N 329.238 1.886 10 10 EDCE NCc1ccc(N2CC[C@@H](OCCCO)C2)cc1Br 2142089583 OCKBLDYYFFIHLJ-CYBMUJFWSA-N 329.238 1.886 10 10 EDCE CNCc1ccc(N2CCC[C@H]3C(=O)NC[C@@H]32)c(Br)c1 234421358 ZNEMUNKOTYOKGN-RISCZKNCSA-N 338.249 1.883 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4[C@@H](CO)[C@@H]4C3)c(Br)cc2[C@H]1O 2146874406 HDYYRNLLETVYAJ-MRCNFZFLSA-N 339.189 1.109 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N(C)C[C@H](C)O)c(Br)cc21 252600848 LYGJZMKQPSIESP-SDBXPKJASA-N 342.237 1.869 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCN=[N+]=[N-])C[C@H]2OCC[C@H]21 1985095895 KMXPWEOKBORWQG-OUAUKWLOSA-N 325.369 1.580 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H](O)C(C)(C)NC(=O)OC(C)(C)C 1985102564 IPALESCQZYXLIC-JTQLQIEISA-N 329.401 1.809 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccccc1O)C1COC1 2010244226 VHNZHZBKERZPHF-AWEZNQCLSA-N 336.388 1.548 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)cc1Br 2158411534 UAJDQIMRZUDMIT-PWFWHMEDSA-N 341.249 1.925 10 10 EDCE Oc1cc(Br)ccc1CN1CCN([C@H]2CCNC2)CC1 701013984 GBUTUPZLYGQSSX-AWEZNQCLSA-N 340.265 1.634 10 10 EDCE CN(CCNCc1ccc(Br)cc1O)S(C)(=O)=O 691441881 CIEANMNCJIUJDX-UHFFFAOYSA-N 337.239 1.136 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H]3COC4(CCCC4)O3)c2n1 2062643592 FJNBMELSLKUDDD-NSHDSACASA-N 332.360 1.159 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@]12CC[C@@H](C1)[C@H](O)[C@@H]2O 2176916918 KTWGTMJEEMUYED-PLVISXMQSA-N 346.196 1.658 10 10 EDCE CCCNCc1ccc(N2CC[C@H](O)[C@H](O)C2)cc1Br 2188625800 AORBTHZEZLSANL-LSDHHAIUSA-N 343.265 1.881 10 10 EDCE C[P@@]1(=O)C[C@@H](NCc2ccc(Br)cc2O)[C@@H](O)C1 2057717504 FSAZETFEEOTBFP-GDAOTKPNSA-N 334.150 1.980 10 10 EDCE Nc1ccc(CC(=O)NC[C@H]2CNCCN2Cc2ccccc2)cc1 2084731520 HIPKXNUPEVTHFH-LJQANCHMSA-N 338.455 1.402 10 10 EDCE CC1(C)CO[C@@H](CO)CN1c1ccc(CN)cc1Br 2111238575 JNLDTMCGGFZYIV-LLVKDONJSA-N 329.238 1.884 10 10 EDCE CCNC(=O)C1CN(c2ccc(CNC)c(Br)c2)C1 2111741880 UKPADGLIKRLJFI-UHFFFAOYSA-N 326.238 1.741 10 10 EDCE O=S1(=O)C[C@@H]2[C@@H](CCN2Cc2cccc(Br)c2O)C1 2094883572 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342.443 1.873 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)cc1 325835569 BAMSNJAAPKHATC-GPMSIDNRSA-N 331.460 1.901 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)[C@H](O)Cc1cnn(C)c1 801545865 FIYUZSCHTQYJLN-QGZVFWFLSA-N 331.416 1.858 10 10 EDCE CN(C)c1ccc(CN[C@H]2CCC[C@@H]2CNS(C)(=O)=O)cc1F 800309931 QBYKPPWMTYQXCS-HIFRSBDPSA-N 343.468 1.699 10 10 EDCE COC[C@@]1(C(=O)O)CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 392780001 DOLHCLOUNZEFRV-OAHLLOKOSA-N 340.332 1.540 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)C2CN(C)CCN(C)C2)cc1 905456841 KBRQWKYNWKTUMY-UHFFFAOYSA-N 346.519 1.985 10 10 EDCE Cc1ncc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)cn1 733330984 WGUIFZFSNQLSNE-UHFFFAOYSA-N 346.456 1.310 10 10 EDCE CCN(CC)c1ccc(CN(C)CCCS(=O)(=O)NC)cc1 734844827 YCJGZSOSJGNURA-UHFFFAOYSA-N 327.494 1.904 10 10 EDCE Cc1cc(C(=O)NC2=NCC(=O)N2)c(C)n1-c1ccc(Cl)cc1 732915001 BSLMNKQYPSNGHL-UHFFFAOYSA-N 330.775 1.963 10 10 EDCE C[C@@H](NC(=O)NCc1c(O)cccc1F)[C@@H](C)N1CCOCC1 917015212 FYLXOUIZISTZSY-VXGBXAGGSA-N 325.384 1.440 10 10 EDCE COC(=O)[C@@H]1CSCCN(C(=O)c2ccc(C)c(O)c2O)C1 840564852 GQTUUGVRMGWLGP-JTQLQIEISA-N 325.386 1.384 10 10 EDCE CCOc1cccc(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)c1O 843426534 YSOZQVJSPCFKEG-MRXNPFEDSA-N 341.429 1.180 10 10 EDCE CC[C@@](C)(CO)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 848221360 RHRNTAPXTNIZJP-KRWDZBQOSA-N 342.386 1.826 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3cnn(C)c3)C2)cc1 852455780 NZRQMMZPERMEJZ-HNNXBMFYSA-N 343.431 1.849 10 10 EDCE COc1ccc(N2CCN(CCN[C@H](C)[C@H]3[C@H]4CN[C@H]3C4)CC2)cc1 925508533 QRAPVUNQHQDSRI-YKCBXCCJSA-N 344.503 1.403 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CC[C@@H](C2CC2)N1 852868292 CWHVYYVZJBOLOI-OALUTQOASA-N 343.471 1.795 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@@H]2COC[C@@H]2C1 852004554 HWCNLDYPKFPXLF-SJORKVTESA-N 345.443 1.701 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)CC2)cc1 870870594 FQTJPXJAOXLHGG-VCBZYWHSSA-N 329.444 1.861 10 10 EDCE CCN(C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)[C@@H]1CCN(C)C1 1118690860 AWOLBRBIPSXRHW-WMLDXEAASA-N 346.475 1.482 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCS(=O)(=O)CC1 896129854 ZSTRHZUZIVXWMG-UHFFFAOYSA-N 327.383 1.183 10 10 EDCE COc1ccc(Br)c(CNCCOCCN(C)C)c1O 1964055043 DPYWMMWXHKQZMO-UHFFFAOYSA-N 347.253 1.831 10 10 EDCE CN(C(=O)C(=O)N1Cc2cccc(O)c2C1)C1CCC(CO)CC1 1329364996 IKCVEBDYUUCUQE-UHFFFAOYSA-N 332.400 1.244 10 10 EDCE CCO[C@H]1C[C@H](NC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1331069251 GDBJPKRDDMGCDF-KOMQPUFPSA-N 333.432 1.395 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(NCc2ccc3c(c2)CCO3)C1 1918437431 ORUJVELNHWNWFY-UHFFFAOYSA-N 334.416 1.693 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2cccnn2)cc1C 1270550868 LBBZNTTVGRJGDJ-ZDUSSCGKSA-N 328.416 1.949 10 10 EDCE CCC(=O)NCC(=O)N(C)C1CC(NCc2ccc(OC)c(C)c2)C1 1279208699 HQSJGGZIDGFDOY-UHFFFAOYSA-N 347.459 1.609 10 10 EDCE COc1ccc(CN[C@@H]2CN(C(=O)CCCC(N)=O)C[C@@H]2C)cc1C 1281474773 DJQBVJSCXZCLKB-GOEBONIOSA-N 347.459 1.596 10 10 EDCE CN1CCc2c(NC(=O)Cc3ccc(O)c(O)c3)cccc2C1=O 1453559868 CFMKOTVTOLRCSS-UHFFFAOYSA-N 326.352 1.907 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(CC(=O)N2CCCC2)CC1 1540959759 OPMMEBWCIWFHHE-UHFFFAOYSA-N 346.427 1.891 10 10 EDCE C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1544115756 UIQSJFGSFHNTJK-VHSXEESVSA-N 338.389 1.497 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H]2CNC(=O)CCCF)cc1 1705230635 MPIRBDDCFLBJEA-CYBMUJFWSA-N 349.366 1.929 10 10 EDCE C[C@H](CNC[C@H]1CCOC1)CNC(=O)c1ccc(N=NC(N)=O)cc1 1715271122 GZRSVQHBJBPUSD-CHWSQXEVSA-N 347.419 1.841 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cnn(C)c2C)cc1C 1568980452 FRSROPJWNUKOHF-CYBMUJFWSA-N 330.432 1.954 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H](C)NC(N)=O)cc1C 1568624665 XUIQGVDGUBMXHB-OLZOCXBDSA-N 336.436 1.045 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2c(C)noc2C)cc1C 1568549992 HLYIRRQOOWMIGZ-OAHLLOKOSA-N 347.415 1.489 10 10 EDCE CC(C)[C@H](NC(N)=O)C(=O)NCc1ccc(N2CCCCC2)cc1 1570581877 MFAXGEIKMOPTMY-INIZCTEOSA-N 332.448 1.986 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(C=O)n(C)n1 1643245595 SSKBADXMGABFSL-UHFFFAOYSA-N 345.355 1.144 10 10 EDCE CNC(=O)[C@]1(C)CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 1773026608 NDOLYSJKZAKFOE-XTKXOIQPSA-N 347.371 1.743 10 10 EDCE O=C(Nc1ccc(O)cc1C(=O)O)c1cc(Br)n[nH]1 2134204959 HDAOZHYMNZALLW-UHFFFAOYSA-N 326.106 1.828 10 10 EDCE C[C@H](NCc1cccc(O)c1O)C1(O)CN(C(=O)OC(C)(C)C)C1 1918681166 ZPCPGQHKUDXGKR-NSHDSACASA-N 338.404 1.558 10 10 EDCE CC[C@@H](NCC(=O)NCCOC)c1cc(Br)ccc1O 228694651 HRNYWKQRUSOFMX-GFCCVEGCSA-N 345.237 1.958 10 10 EDCE CNCc1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)c(Br)c1 2146308618 BNSFXKLDBVKOSY-GASCZTMLSA-N 341.249 1.350 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCc2ccccc2O)C[C@H](O)C1 2017960999 JZUMXNWNQPMVHT-LAUQKZGBSA-N 336.388 1.427 10 10 EDCE C[C@H](OCc1ccccc1)[C@@H](N)C(=O)NCCc1ccc(O)c(O)c1 2031086717 LKHXGFOXXBXHGG-SCLBCKFNSA-N 344.411 1.689 10 10 EDCE NCc1ccc(N2CCN3C[C@H](O)C[C@@H]3C2)cc1Br 405256307 KQGTYTIVYFVNKM-CHWSQXEVSA-N 326.238 1.163 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C[C@@H]1O 387956507 FCQPWWKPXQUSIE-LKXWSVAYSA-N 326.194 1.218 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3CCNNCC3)ccc(N)c2C1 2071597944 SIFDVWOOLJAKHK-UHFFFAOYSA-N 347.463 1.476 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCC(C)(C)c3cccnc3)c2n1 2062832346 DZPFPPDYEWYINN-UHFFFAOYSA-N 325.372 1.846 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3COC[C@@H](C2)C3O)cc1Br 2167779201 ZQQYWFFCVSRUEO-LCONVBBXSA-N 342.233 1.946 10 10 EDCE CNCc1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2199528417 ZKFWKZDXCATQAE-BCZWGYKPSA-N 341.249 1.489 10 10 EDCE CNC(=O)OCCNCc1c(Br)ccc(OC)c1O 2227752159 UTCBVYYXBBQLNH-UHFFFAOYSA-N 333.182 1.609 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](CF)(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2247576553 MMPONQCTCASTPJ-PRXAMGSTSA-N 342.411 1.849 10 10 EDCE Cc1ccc(CNC[C@](C)(O)CN(C)C)c(O)c1Br 2352951547 HUMVDJRQVWIMSJ-AWEZNQCLSA-N 331.254 1.865 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1C[C@@H]2C[C@H]1[C@H](O)[C@@H]2O 2355455538 ZSDARITZVXUPPP-BJFOPFPESA-N 342.233 1.622 10 10 EDCE CN1C(=O)C(=C/C=C\c2ccccc2[N+](=O)[O-])C(=O)N(C)C1=S 6578343 LJRYMGCHYKNKND-ALCCZGGFSA-N 331.353 1.750 10 10 EDCE CC1CCN(c2ccc(CNC(=O)CNS(C)(=O)=O)cc2)CC1 108294258 MDDHMGDBEVQGKB-UHFFFAOYSA-N 339.461 1.088 10 10 EDCE C[C@@H](CNC(=O)NCc1ccc(N2CC=CC2)cc1)N1CCOCC1 125393899 FQSDZANMMKTEQU-INIZCTEOSA-N 344.459 1.583 10 10 EDCE CC(C)[C@@H](CO)N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2367092361 LJTQUPHZEMCOAR-CHWSQXEVSA-N 342.237 1.854 10 10 EDCE Cc1cnc(N)c(S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c1 347123543 NHYLRXJQTVCFDB-UHFFFAOYSA-N 348.428 1.626 10 10 EDCE CCNC(=O)N1CC[C@@H](NC(=O)NCc2cccc(OC)c2O)C1 268563593 SZKAMLNZRRPEHT-GFCCVEGCSA-N 336.392 1.004 10 10 EDCE O=C1C[C@@]2(CCN(Cc3cc(Cl)cc([N+](=O)[O-])c3O)C2)CN1 279337791 DWCMOGKMXNONME-AWEZNQCLSA-N 325.752 1.666 10 10 EDCE COc1nc(=N)[nH]c(=NCc2ccc(C)c(Br)c2O)[nH]1 2380745379 PCIDSTOKXUMMDU-UHFFFAOYSA-N 340.181 1.103 10 10 EDCE Cc1ccc(CN2CCN(C)[C@H](C(=O)O)C2)c(O)c1Br 2381135039 LHYGXTJGCIITBV-NSHDSACASA-N 343.221 1.664 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1 808536670 BWMZRBQBDGQXQM-HNNXBMFYSA-N 347.367 1.737 10 10 EDCE CN(C)c1ccc(CNc2ccc(C(=O)NCC(N)=O)cc2)cc1 802760728 DZOQVXPIIQMKMT-UHFFFAOYSA-N 326.400 1.580 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(NC(=O)N(C)C)cc1Cl 808529787 SRSBUHCSYVBLPL-UHFFFAOYSA-N 326.736 1.748 10 10 EDCE C[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1cscn1 826706095 FXVCSWXJLKOFFX-NSHDSACASA-N 332.429 1.703 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCCC(C)C)C2)cc1 826947323 PJZIQVMBFCFQIJ-OAHLLOKOSA-N 347.459 1.943 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCc4ccccc4CC3)nc12 738702296 HIWWGSONGXCMEG-UHFFFAOYSA-N 338.367 1.734 10 10 EDCE CC[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C(=O)O 927942400 IAZRECMRZNQDLP-VXGBXAGGSA-N 335.404 1.157 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H]3CO[C@@H](C)[C@@H]3C)CC2)cc1 924832182 PRBAVQIBMOFJMP-TXPKVOOTSA-N 333.476 1.830 10 10 EDCE CCOC(=O)c1nc(=N[C@@H]2CCN(c3ccc(OC)cc3)C2)cc[nH]1 853760339 JTQNIPALDSDRFC-CYBMUJFWSA-N 342.399 1.775 10 10 EDCE O=S1(=O)CCN(c2ccc(CNCc3ccnc(F)c3)cc2)CC1 858135948 IHLVOVLLGMXRFF-UHFFFAOYSA-N 349.431 1.745 10 10 EDCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N[C@@H]1CC12CC2 852387453 DJAWJSKCMICGIG-OAHLLOKOSA-N 349.456 1.273 10 10 EDCE Nc1ccc(CCNC(=O)c2cn([C@H]3CCCNCC3)nn2)cc1 852795808 LJGWHPLCPMWLII-HNNXBMFYSA-N 328.420 1.147 10 10 EDCE NC(=O)N1C[C@H]2C[C@H]1CN2Cc1cc(Br)ccc1O 1877020755 ZKMUFDYQCHPHFG-MNOVXSKESA-N 326.194 1.492 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@H](O)Cc2cnn(C)c2)cc1F 786927622 GOQFAVTYTALTLS-QGZVFWFLSA-N 348.422 1.625 10 10 EDCE CN1CC[C@H](Cn2nnnc2Sc2ncc([N+](=O)[O-])s2)C1 799943155 IBHOHHIKXNZZSG-ZETCQYMHSA-N 327.395 1.141 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCNC(=O)c1ccc(F)cc1 1136657204 HNNWPEPDRSIDFB-UHFFFAOYSA-N 332.331 1.326 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@@H]2CCNC2=O)C2CC2)cc1C 1317023754 CALGNDWSVIJJAV-CVEARBPZSA-N 345.443 1.124 10 10 EDCE COCCNC(=O)c1cccc(NC(=O)c2c(F)ccc(O)c2O)c1 1183433764 VVIGFJZHCCCKBT-UHFFFAOYSA-N 348.330 1.865 10 10 EDCE O=C1Nc2cc(N3C[C@H]4COC[C@H]4C3)c(Br)cc2[C@H]1O 718311166 OYIGTMSWCGXKHZ-BFHDXFOESA-N 339.189 1.517 10 10 EDCE CO[C@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 1335761094 WQLYQNWCASHEHT-CVEARBPZSA-N 333.432 1.313 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)Cn2cc(C)cn2)cc1C 1266926384 NPDANODUCWFXDW-HNNXBMFYSA-N 330.432 1.803 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CC(=O)NCCCCN=[N+]=[N-])C1 1964942805 IEOGUSCKHOKUDJ-HNNXBMFYSA-N 341.412 1.955 10 10 EDCE CCN(CCN[C@H](C)COC)C(=O)c1ccc(N=NC(N)=O)cc1 1273778755 PPNGZUDAORANFR-GFCCVEGCSA-N 335.408 1.936 10 10 EDCE CN(C)c1ccc(CNC(=O)c2ccc(-n3cnnn3)cn2)cc1F 1356250079 AFFBMIVRKHTPAJ-UHFFFAOYSA-N 341.350 1.192 10 10 EDCE CN1C(=O)O[C@H]2CN(c3ccc(CO)cc3Br)C[C@@H]21 2120405293 YLZWIABOKAEISP-RYUDHWBXSA-N 327.178 1.581 10 10 EDCE COc1c(O)nc(O)nc1C(=O)NCc1cc(Cl)ccc1O 1628666462 DCZCEVKMZTVOFQ-UHFFFAOYSA-N 325.708 1.185 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cncc(F)c2)cc1C 1482722142 NXQYQGLMPGPNIM-MRXNPFEDSA-N 347.390 1.418 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H]2CCNC(=O)C2)cc1C 1491433140 ZGRGAZZBVYFAKY-UKRRQHHQSA-N 333.432 1.124 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(C2CC2)nc1O 1633817693 AANLLUTWIXQYIA-VIFPVBQESA-N 329.356 1.832 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)C2CN(C(C)=O)C2)cc1C 1568166934 GDZWGKGZXMDOHU-CYBMUJFWSA-N 347.459 1.324 10 10 EDCE Nc1nnc(CC(=O)NCc2cccc(Br)c2O)s1 1640087150 CYAODQGJJDSITP-UHFFFAOYSA-N 343.206 1.447 10 10 EDCE C[C@@H](O)CN1CC[C@H](CCNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1732060070 AUOBLBBCBCLOIL-OLZOCXBDSA-N 347.419 1.672 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CNC(=O)c1ncccc1O 1587405036 NJZNSSUYHKASJD-UHFFFAOYSA-N 342.399 1.242 10 10 EDCE C/C=C(/C)C(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1758699091 NURTVCVQNCKXPI-PXUQJFTDSA-N 333.388 1.442 10 10 EDCE COc1ccc(Br)c(CNCc2cn(C)nn2)c1O 1965904023 QRJZCIPOUCTUOX-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE C[C@@H](O)[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1858592526 RIFIHEFTUCZHRO-TVNLMNMCSA-N 341.385 1.861 10 10 EDCE CC1(C)[C@@H](O)CN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2136633399 YNLADXBBGUCLAB-QWRGUYRKSA-N 327.178 1.394 10 10 EDCE OCc1ccc(N2CC[C@@]3(C[C@@H](O)CO3)C2)c(Br)c1 2137134466 QBGLLFDWTPOQOB-BXUZGUMPSA-N 328.206 1.672 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1C[C@H](N)CO1 1952481903 WVPZJDQBPDMDSF-ZOWXZIJZSA-N 338.404 1.650 10 10 EDCE CC(C)(C)OC(=O)NOCCNC(=O)COc1ccc(N)cc1 1977673191 WMOHROGMHHDAER-UHFFFAOYSA-N 325.365 1.220 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@H](CCO)NC(=O)OC(C)(C)C 2017961423 PLCCYTXOLPXOKS-ZDUSSCGKSA-N 338.404 1.626 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2018047562 QZRLADPADSZLBB-RYUDHWBXSA-N 341.412 1.954 10 10 EDCE O=C(O)C[C@@]1(O)CCCN(Cc2ccc(Br)cc2O)C1 2160865438 RHLGRVDZMAWNSW-AWEZNQCLSA-N 344.205 1.956 10 10 EDCE CNCc1ccc(N2CC(CC(=O)NC)C2)cc1Br 382400709 XMAKYPNDADVIQM-UHFFFAOYSA-N 326.238 1.741 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCO[C@@H](CF)C3)c(Br)cc21 2172041859 QHPSEPCUGITYQE-JVXZTZIISA-N 344.184 1.576 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)cc1Br 2089922014 FRWUMZXKVMXWMG-ZIAGYGMSSA-N 328.254 1.280 10 10 EDCE NCCO[C@H]1CCN(Cc2cc(Br)cc(F)c2O)C1 2112683982 QXBZDCXCBGJYSY-NSHDSACASA-N 333.201 1.843 10 10 EDCE CCN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1cccc(OC)c1 298284779 JQWPKDHHSNQPMS-MDZDMXLPSA-N 343.383 1.159 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1CC[C@H](O)CN1C(=O)OC(C)(C)C 2246452973 ZKLWYNSXAKJOLM-RYUDHWBXSA-N 341.412 1.906 10 10 EDCE C[C@@H](O)CN(CCNC(=O)OC(C)(C)C)Cc1cc(N)ccc1O 2249115900 YFFJENPNDIVDDQ-GFCCVEGCSA-N 339.436 1.682 10 10 EDCE COCCN(Cc1ccccc1)C(=O)[C@@H](N)Cc1ccc(O)c(O)c1 310209478 PBZVOSGSBZWYOS-INIZCTEOSA-N 344.411 1.643 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC(N)(CO)CC2)c([N+](=O)[O-])c1 301256006 FLXXOCGSWWUBMY-HWKANZROSA-N 335.360 1.071 10 10 EDCE Cc1[nH]c(=O)sc1S(=O)(=O)N(C)[C@@H](C)c1ccccc1O 37926729 UVVIFWDHTHMZIJ-VIFPVBQESA-N 328.415 1.832 10 10 EDCE O=C1c2cc(O)cc(O)c2C(=O)c2c1cc1c(c2O)[C@H]2CCO[C@H]2O1 14828615 BABJNKGTTYCTOO-MDTSDYNXSA-N 340.287 1.801 10 10 EDCE biogenic CN(C)c1ccc(CNS(=O)(=O)NCC(F)(F)F)cc1F 195194619 NWQHEXSPWSBVNK-UHFFFAOYSA-N 329.319 1.378 10 10 EDCE COc1cccc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1O 92044945 FASLZTCJDLMZBB-CQSZACIVSA-N 340.445 1.401 10 10 EDCE COc1ccc(N2CCN(C(=O)CCNC[C@@H]3CCCO3)CC2)cc1 243998200 SGSQYTSIBZFSND-SFHVURJKSA-N 347.459 1.503 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)COC(C)(C)C)CC2)cc1 272469945 FJUYGSCYJMBGST-UHFFFAOYSA-N 349.475 1.749 10 10 EDCE Cc1ccc(CN2CCN3CCOC[C@H]3C2)c(O)c1Br 2381130085 UBXLIQRJMXRYCM-CYBMUJFWSA-N 341.249 1.980 10 10 EDCE COC[C@@H](ON)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381130931 GUMDMFXBCDBQNG-SNVBAGLBSA-N 347.209 1.327 10 10 EDCE C[C@@H](C(N)=O)N(C)c1ccc(/C=C/C(=O)O)cc1Br 711183624 FEVXLECESUSVPZ-JQTRYQTASA-N 327.178 1.857 10 10 EDCE CC[C@@H](C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1)C(=O)OC 819586771 BWMLDDVSWDZNST-CJNGLKHVSA-N 334.416 1.837 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N(C)CCCCO 817862318 VOAQHDPRAAQKQA-HNNXBMFYSA-N 349.475 1.339 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCCC3CC3)C2)cc1 828490981 RQGRKVFWTHQBQA-HNNXBMFYSA-N 345.443 1.697 10 10 EDCE CC(C)[C@@H](NC(=O)c1ccccn1)C(=O)NCc1ccc(N)cc1 837302792 HFFJZYJJUJALEJ-MRXNPFEDSA-N 326.400 1.735 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@@H]2CC[C@H](CCC(=O)O)O2)cc1F 911300232 HGXPRXPKGNVWSM-DOMZBBRYSA-N 338.379 1.920 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@]2(C)C[C@@H](O)CN2C)cc1 911890933 DMQZKURDIPMSFY-QAPCUYQASA-N 335.448 1.045 10 10 EDCE CC(C)N(C[C@H]1CCC(=O)N1)C(=O)NCc1ccc(N(C)C)cc1 840245412 URQOCQQWZNVIMK-OAHLLOKOSA-N 332.448 1.951 10 10 EDCE CNC(=O)[C@]1(C(F)(F)F)CCN(C(=O)Cc2ccc(N)cc2)C1 842514994 LNDSFAXIYVLRJR-AWEZNQCLSA-N 329.322 1.338 10 10 EDCE COCCN(C[C@@H]1C[C@H]2COC[C@H]2O1)c1ccc(OC)c(OC)c1 929995152 BGOSQKDTENRRGL-DHSIGJKJSA-N 337.416 1.961 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)Cc1ccc(C(N)=O)nc1 858199469 DJAUQWKWJUBKSU-UHFFFAOYSA-N 326.400 1.448 10 10 EDCE Cn1ccc([C@H]2CCCN(C(=O)C(=O)Nc3ccc(N)cc3)C2)n1 927858049 JRKNQAXQBQUNAW-LBPRGKRZSA-N 327.388 1.347 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)Nc1nn(C)cc1C 850373607 BFZYTIMUTSZFSQ-UHFFFAOYSA-N 329.404 1.358 10 10 EDCE CC[C@@H](C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)N1CCCC1=O 855230008 DNIDHDSNMGFFGJ-PBHICJAKSA-N 345.443 1.791 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3nc(C)no3)C2)cc1 854296951 LRCJDRBGRBDUPH-ZDUSSCGKSA-N 345.403 1.807 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCn3cccn3)C2)cc1 852185528 YZEGOOFLOFFCAP-CQSZACIVSA-N 329.404 1.470 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3C[C@H](C(=O)OC)C3)C2)cc1 854298057 ZRTVCAVKQMIHBD-MGPQQGTHSA-N 347.415 1.525 10 10 EDCE Cc1nnccc1NC(=O)NCc1ccc(N2CCOCC2)cc1 776485604 UMVRBVZNPKLBBC-UHFFFAOYSA-N 327.388 1.943 10 10 EDCE COC(=O)C1=NO[C@]2(CCN(Cc3cc(F)cc(F)c3O)C2)C1 895455638 YWKFMTPJLJRULT-OAHLLOKOSA-N 326.299 1.564 10 10 EDCE CCc1nc[nH]c1C(=O)NC[C@@H](O)CNCc1ccc(OC)c(C)c1 1320304652 RMSLZVPGKQUJQK-AWEZNQCLSA-N 346.431 1.170 10 10 EDCE O=c1nc(CCNCc2cc(Br)cc(F)c2O)[nH]o1 715719165 BGLDCBZADHCUKM-UHFFFAOYSA-N 332.129 1.302 10 10 EDCE CN1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)CC1 92774783 ANOBDWZYDUSAPS-GFCCVEGCSA-N 325.210 1.153 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H]2CCCN2C(C)=O)cc1C 1268716916 NBMHFGBKRPLFLY-WMLDXEAASA-N 347.459 1.609 10 10 EDCE C[C@H](CNC(=O)[C@@H]1C[C@H]1C)NC(=O)c1ccc(N=NC(N)=O)cc1 1358226502 LOAZGWQGNNLZAA-GIPNMCIBSA-N 331.376 1.740 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)C2CC3(C2)CS(=O)(=O)C3)c1 1351666705 NYCMOMNIEMHFSH-JTQLQIEISA-N 339.413 1.403 10 10 EDCE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2C[C@H]2C(N)=O)cc1 1441143778 CTSPANVJTJRWRV-SJORKVTESA-N 341.411 1.996 10 10 EDCE C[C@H](CONC(=O)Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1631953769 IKIFSLZPYFLHRX-SNVBAGLBSA-N 340.376 1.601 10 10 EDCE COc1cccc(CNC(=O)c2ccc(Cn3ccnn3)cc2)c1O 1630365696 DIMFJLVJAJILRZ-UHFFFAOYSA-N 338.367 1.971 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2nnn(C)c2C)cc1C 1498528230 CUVQSAMVYYZHFX-UHFFFAOYSA-N 345.447 1.692 10 10 EDCE O=C(NCc1cccc(O)c1O)c1cc(-n2ccnc2)ccc1O 1637046741 WJCRXEQRPWSDLQ-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE NS(=O)(=O)Cc1cccc(NC(=O)c2c(F)ccc(O)c2O)c1 1648506948 BQSHCXSXTWFKKO-UHFFFAOYSA-N 340.332 1.278 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@H]1CSC(c2ccccc2O)=N1 1643812397 IFNYMUXCGPEAHO-GFCCVEGCSA-N 344.392 1.982 10 10 EDCE CNS(=O)(=O)c1ccc(CNC(=O)Cc2ccc(N)cc2)s1 150812733 JMWSYSYCLLMYNJ-UHFFFAOYSA-N 339.442 1.097 10 10 EDCE CN1CCN(c2ccc(/N=N/N3CCC(C(N)=O)CC3)cc2)CC1 1860492848 MJIXSPMDNXVTDO-FMQUCBEESA-N 330.436 1.634 10 10 EDCE O=C(O)C1CCN(C(=O)CNCc2cc(Cl)ccc2O)CC1 1857868544 ODVBFBFCFBBRLG-UHFFFAOYSA-N 326.780 1.458 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](N(C)C)C2)cc1Br 2146130679 BVSUDTFDYXYVLS-ONERCXAPSA-N 342.281 1.841 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CC(C(=O)Nc2ccc(N)cc2)=C[C@H]1O 2022935887 RDZYYMYLIQLFIV-UONOGXRCSA-N 333.388 1.792 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2199533018 SVGVGHINUXPFQT-MGXFYRGHSA-N 342.233 1.823 10 10 EDCE O=C1C[C@@H]2CCN(c3ccc(CO)cc3Br)C[C@H]2N1 2088803222 GCFWYDYLJRJAQV-CMPLNLGQSA-N 325.206 1.656 10 10 EDCE OCc1ccc(N2[C@H](CO)C[C@@H]3OCC[C@@H]32)cc1Br 2090533206 CVFDKCYKIZDXFZ-UBHSHLNASA-N 328.206 1.670 10 10 EDCE CCCn1nnnc1CNCc1c(O)cccc1Br 2113073063 JOTLKTMVMJGMSV-UHFFFAOYSA-N 326.198 1.841 10 10 EDCE CN(c1ccc(CN)c(Br)c1F)[C@@H]1CCCNC1=O 2114630917 BEKYLXAZGQVRSV-SNVBAGLBSA-N 330.201 1.762 10 10 EDCE CC(C)(C)OC(=O)N1CCCC(C)(C)[C@@H]1COc1nnc(=N)[nH]n1 2213781941 YSWJRMAAGNJMRP-JTQLQIEISA-N 338.412 1.484 10 10 EDCE CCCNCc1ccc(N2CC[C@H]2[C@@H](O)CO)cc1Br 2286228773 QCWWWEOYOSQDOF-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE COC(=O)[C@H]1CN(C(=O)/C=C/c2cnccn2)c2ccccc2O1 491118200 KQMDYCGDGGQXMS-LQYUOIDQSA-N 325.324 1.457 10 10 EDCE Cc1ccc(CN(C)C2=NC[C@@H](O)CN2)c(O)c1Br 2352942922 MODAFOGOGQFBBB-UHFFFAOYSA-N 328.210 1.215 10 10 EDCE Cc1ccc(CN(C)CCOCC(=O)O)c(O)c1Br 2352947787 KMKSIMFGURRKJF-UHFFFAOYSA-N 332.194 1.996 10 10 EDCE CCCNS(=O)(=O)Nc1cc(N2CCOCC2)ccc1OC 62274239 SABVLLZULQFKPX-UHFFFAOYSA-N 329.422 1.188 10 10 EDCE CSCC[C@@H](NC(C)=O)C(=O)NCCc1ccc(O)c(O)c1 33753229 QCDZESBHHYRZDC-GFCCVEGCSA-N 326.418 1.014 10 10 EDCE Nc1ccc(CNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]32)cc1 216817659 AGEWMIKJLGOOBX-YCPHGPKFSA-N 348.472 1.611 10 10 EDCE CC[C@@H](C)[C@H](NC(N)=O)C(=O)NCc1ccc(N2CCCC2)cc1 41365551 KSEASRGZPPBDEI-CJNGLKHVSA-N 332.448 1.986 10 10 EDCE C[C@H](NC[C@@H]1CCN(S(C)(=O)=O)C1)c1ccc(N(C)C)cc1 90796984 UYCPSUJSPGEJPK-KBPBESRZSA-N 325.478 1.685 10 10 EDCE CCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1cc(C)ccc1C 255507774 GUSKPARTMIPHAD-KTKRTIGZSA-N 341.411 1.767 10 10 EDCE COC[C@@](C)(N)CC(=O)NCc1ccc(C)c(Br)c1O 2381127341 XAFKZOQHKBEHCJ-AWEZNQCLSA-N 345.237 1.833 10 10 EDCE Cc1ccc(CNC(=O)[C@H](N)[C@H]2CCCO2)c(O)c1Br 2381129986 SCBAKYHAQQPYHL-ZYHUDNBSSA-N 343.221 1.586 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2COC[C@@H]2N)c(O)c1Br 2380790994 VXIOPQBKCPYASB-QWRGUYRKSA-N 343.221 1.395 10 10 EDCE O=C(Nc1ccccc1N1CCOCC1)c1cc(O)c(O)c(O)c1 586737812 PLMWNPAVSQSJSE-UHFFFAOYSA-N 330.340 1.892 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N2CCC[C@]3(CCCOC3)C2)cc1 842241654 HGYQIIVRESNHLU-IBGZPJMESA-N 345.443 1.347 10 10 EDCE CN1CC[C@@H](NC(=O)C(=O)Nc2ccc(N)cc2)[C@@H]1c1ccccc1 841081566 SZYYGTMVUGKYBA-SJORKVTESA-N 338.411 1.769 10 10 EDCE C[C@@H](CC(=O)NCc1cccc(Br)c1O)NC(N)=O 847927755 BTLNAIOBYOMQMJ-ZETCQYMHSA-N 330.182 1.218 10 10 EDCE COC[C@H](C)CS(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849416305 OLLRGCNLSILDNV-KBPBESRZSA-N 342.461 1.476 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cn3ccccc3=O)C2)cc1 855229692 PLRXIVYOGNMLOU-CQSZACIVSA-N 327.384 1.252 10 10 EDCE CO[C@@H](CNC(=O)NCCCSc1nccs1)[C@@H]1CCOC1 853856188 SPPILECHZNSZNB-NEPJUHHUSA-N 345.490 1.976 10 10 EDCE COc1ccc(N(C)CCN(C)S(=O)(=O)[C@@H]2CCCNC2)cc1 923651129 DODJLNFWXOZSGD-MRXNPFEDSA-N 341.477 1.145 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](CO)C3CCC3)C2)cc1 852386940 NPEWBELQAGOOKV-KBXCAEBGSA-N 347.459 1.982 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)C2)cc1 855225561 KXZRSBKOYNNXOC-QAPCUYQASA-N 347.459 1.941 10 10 EDCE CCn1cc(CNC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)cn1 852328409 DOLGFUCXMSPHIF-OAHLLOKOSA-N 343.431 1.990 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCCNCC3)C2)cc1 851663773 IPFAHHOTUMGCSN-CABCVRRESA-N 332.448 1.715 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CC[C@@H](CN)C3)C2)cc1 851666855 LKGDBZRQIYNMTE-ILXRZTDVSA-N 332.448 1.701 10 10 EDCE COC[C@@H](CCNC(=O)NCc1ccc2c(c1)CCCN2C)OC 852449737 XBVGSCRHGWGBKK-MRXNPFEDSA-N 335.448 1.920 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@H]3CC[C@H]2[C@H](CN)C3)cc1 866694587 IULGJJRJDAKZKW-BQFCYCMXSA-N 330.476 1.428 10 10 EDCE COCCCOCCN(C)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 773257473 DMEPYSTXZLFBFT-UHFFFAOYSA-N 339.348 1.415 10 10 EDCE COC(=O)[C@@H]1CC[C@@H]1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 874197319 QSEQIJCHNUFOJY-RRQGHBQHSA-N 346.427 1.900 10 10 EDCE COC(=O)[C@H]1[C@H]2C=C[C@@H](CC2)[C@H]1C(=O)NCc1cccc(O)c1O 1123978114 QGJYNZMBLJDHDA-AZHAFVHUSA-N 331.368 1.715 10 10 EDCE NCc1ccc(N2CCC(CNC(N)=O)CC2)cc1Br 702150737 QXHVPFUIMHPQFB-UHFFFAOYSA-N 341.253 1.793 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1Cc2cccnc2C1 1348571287 XHOFXOHLFWFDOL-KRWDZBQOSA-N 337.423 1.949 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(O)c1O)C2 1347235806 WQMAJKLOGSDXTL-DRZSPHRISA-N 334.372 1.581 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)Cc2nnc(C)o2)cc1C 1277810299 NDLSARRSDFCGGQ-CYBMUJFWSA-N 346.431 1.874 10 10 EDCE O=C(CNC(=O)c1cc2cc(O)c(O)cc2s1)NCc1ccco1 1441645439 CQOQACNQLKUSCZ-UHFFFAOYSA-N 346.364 1.952 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCN1C(=O)COc2ccccc21 1292425717 MPXQXYFFHQMTBG-UHFFFAOYSA-N 342.351 1.182 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCN(C(N)=O)C1 1297563076 VQPPZUFELLWYFU-LLVKDONJSA-N 326.393 1.285 10 10 EDCE C[C@@H](O)c1ccc(N2CC3(CNC(=O)N3)C2)c(Br)c1 2121183045 ZOEXZVBLQCGSCC-MRVPVSSYSA-N 326.194 1.374 10 10 EDCE CN(Cc1ccccc1O)c1nnc(C2CC2)n1CCOCCCO 1617941245 VITJXSFQQWSBAT-UHFFFAOYSA-N 346.431 1.897 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cc3ccon3)CC2)cc1C 1483722750 RXABJQDJLLKPLN-UHFFFAOYSA-N 329.400 1.973 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)C[C@H]2CCC(=O)N2)cc1C 1714795458 MRVIYXVCTIXJSU-GDBMZVCRSA-N 347.459 1.609 10 10 EDCE CC[C@@H](CNC(=O)[C@H](C)NC(N)=O)NCc1ccc(OC)c(C)c1 1715061375 ULOBYELLPARHOD-JSGCOSHPSA-N 336.436 1.045 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)c2cccnc2O)N(C)C)cc1 1558722756 BRVPERBNRVODHC-INIZCTEOSA-N 328.416 1.886 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2ccn(C)c(=O)c2)cc1C 1713320121 NRIUDHWCLDTUFH-AWEZNQCLSA-N 343.427 1.610 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@H]2CCN(C)C2)cc1C 1568709898 FYHKZKXPJSJYJO-WBVHZDCISA-N 333.476 1.940 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)Cc2nnc(C)o2)cc1C 1567014248 YSJIJMYSVUIKHK-GFCCVEGCSA-N 332.404 1.532 10 10 EDCE C[C@H](C(=O)NCc1cccc(O)c1O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 1633509306 SSIWRYXPBOQLHI-RTXFEEFZSA-N 346.383 1.278 10 10 EDCE Cn1nnnc1C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1644069359 BBBIOZFONXUEEO-UHFFFAOYSA-N 342.363 1.392 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@@H]2C[C@@H]3C[C@@H]3C2)cc1C 1571586960 ARCKQYODOCJISX-MLHJIOFPSA-N 346.471 1.959 10 10 EDCE CO[C@@H](C)CNCC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1668326614 SWJYNGDPXGNBOV-RYUDHWBXSA-N 335.408 1.982 10 10 EDCE Cc1ccc(C(=O)NCC(=O)NCc2c(O)cccc2O)cc1C 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CC(C)(C)OC(=O)NC1(CNC(=O)Cc2ccc(N)cc2)COC1 1999142680 XCMXWAVKFRAZHG-UHFFFAOYSA-N 335.404 1.221 10 10 EDCE COC(=O)[C@H](CNC(=O)OC(C)(C)C)N(C)c1ccc(CN)cc1 1999243326 HSCVDBDNVMNLRU-AWEZNQCLSA-N 337.420 1.648 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](OCC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010405674 KOPRRLRTLJQYTA-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE COc1ccc(CN[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)c(O)c1 2011487941 QXFGNNITQPPRBG-ZFWWWQNUSA-N 338.404 1.471 10 10 EDCE C[C@@H](CN(C)C(=O)OC(C)(C)C)NC(=O)c1cc(O)c(O)c(O)c1 2015123701 VPLKQMRTAGLHCA-VIFPVBQESA-N 340.376 1.789 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCC(N=[N+]=[N-])CC2)C[C@H](O)C1 2018046797 FRIDPVJCDNSFOW-WGRBQBNCSA-N 339.396 1.706 10 10 EDCE O=C(O)C[C@@H](COCc1ccccc1)NC(=O)c1cc(O)nc(O)c1 2035489991 XXPXYPYATCVXRM-ZDUSSCGKSA-N 346.339 1.283 10 10 EDCE CN(CCC(N)=O)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 381998295 PDCRVSXRJYTFCT-UHFFFAOYSA-N 348.447 1.874 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)c(F)c1Br 2173318823 ZACMVFHHEMOBKY-RPZVGCSNSA-N 345.212 1.367 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H]3[C@H]3CCC[C@@H]3O)c2n1 2063504244 QFTJUHUAKROPTB-BNOWGMLFSA-N 330.388 1.509 10 10 EDCE CNCc1ccc(N2CCO[C@@H](CN(C)C)C2)cc1Br 2170362875 QWVVQFCCXYBNIS-AWEZNQCLSA-N 342.281 1.935 10 10 EDCE O=C1C[C@@H]2CCN(Cc3cccc(Br)c3O)C[C@H]2N1 2088806212 NEYMFKCZPMRKOF-JOYOIKCWSA-N 325.206 1.865 10 10 EDCE C[C@H]1CCN(c2cc(Br)c(CN)cc2F)[C@H]1C(N)=O 2090256799 SMFVGFQXJJQTDE-JVXZTZIISA-N 330.201 1.747 10 10 EDCE NCc1cc(F)c(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2236630033 TYMIOJVGSAHYGI-AOOOYVTPSA-N 347.228 1.474 10 10 EDCE COCCNCCCNCc1cc(Br)c(O)cc1O 2267809025 GMAHHOIZYZQDAR-UHFFFAOYSA-N 333.226 1.576 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccc(C)nc2N)s1 2284688187 JONMURIZCPWKCY-UHFFFAOYSA-N 330.460 1.629 10 10 EDCE Cn1cccc1C=C1C(=O)NC(=S)N(Cc2ccc(F)cc2)C1=O 2297060242 LBIKHEQYPNHVFY-UHFFFAOYSA-N 343.383 1.991 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@]2(C(=O)NCCCN=[N+]=[N-])CO[C@H]1C2 2298332379 VFVVPAOXLPZYGH-JRPNMDOOSA-N 339.396 1.875 10 10 EDCE OC[C@@H](O)[C@@H]1COCCN1c1ccc(OCc2ccccc2)cc1 2299515147 OSODPYQDYLPLIZ-RBUKOAKNSA-N 329.396 1.824 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1CC[C@H](O)CN1C(=O)OC(C)(C)C 2300532151 QTFJKMOKLWNAOW-NWDGAFQWSA-N 341.412 1.906 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2329326246 NDGLWLGBOQPOSX-UNVYILGJSA-N 327.222 1.399 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2329326243 NDGLWLGBOQPOSX-MAQCBKMQSA-N 327.222 1.399 10 10 EDCE CN[C@@H](c1ccccc1O)[C@H](O)c1c(Br)ncn1C 2337352368 ZUNCRKVYSZXPRK-JQWIXIFHSA-N 326.194 1.882 10 10 EDCE CN1CCO[C@H](CNC(=O)NCc2ccc(N3CCCC3)cc2)C1 170922736 KDKNTJLLNICZLO-QGZVFWFLSA-N 332.448 1.417 10 10 EDCE O=C(NC[C@H]1C[C@@H](O)CN1Cc1ccccc1)c1cccc(O)c1O 193149441 RLOLTVJLLXPBOI-HUUCEWRRSA-N 342.395 1.463 10 10 EDCE O=C(O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 606441939 DNYGMUALMMAMFW-SBSDFTTDSA-N 330.384 1.612 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C\c3ccnn3C)CC2)cc1 255047313 RNYQDHGDIMAPBN-YVMONPNESA-N 326.400 1.791 10 10 EDCE NC(=O)[C@@H]1CCCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255265428 FULLBDWBCMXKHE-SKHCZCESSA-N 343.427 1.403 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@H](N)CCO2)c(O)c1Br 2380755235 ZLTPWZOFAQLOIY-MNOVXSKESA-N 343.221 1.586 10 10 EDCE CC(=O)C(=O)COC(=O)c1cn(C(C)(C)C)nc1Br 808535199 BVPIBCQAWMSKMQ-UHFFFAOYSA-N 331.166 1.716 10 10 EDCE CSCC1CCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)CC1 903915865 DVAXCPOCRMROKC-UHFFFAOYSA-N 336.417 1.708 10 10 EDCE CC1CCN(c2ccc(CNC(=O)C(=O)NCCCN)cc2)CC1 842212776 BGEXRTNHDXJEBB-UHFFFAOYSA-N 332.448 1.004 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCn3ccnc3)C2)cc1 849224324 CAQZJBHXWPBDGM-AWEZNQCLSA-N 329.404 1.470 10 10 EDCE COc1ccc(N2CCN(C(=O)CONC(=N)[C@H]3C[C@@H]3C)CC2)cc1 848521220 SOWMFJJDSDHYTJ-BBRMVZONSA-N 346.431 1.498 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2C[C@H](C)N(CCO)C[C@H]2C)c1O 841890387 AKFMJIQBMJRZSN-NWDGAFQWSA-N 339.392 1.196 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3[C@H]4CC[C@H]3[C@@H](CO)C4)C2)cc1 854297062 JKJMWABJBROPLG-DEICHXMPSA-N 345.443 1.829 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCNC(=O)CC3)C2)cc1 855225794 MEWIZADYINVKIX-KGLIPLIRSA-N 331.416 1.306 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cn4c(n3)COCC4)C2)cc1 862159967 ZQXMTUYTKGCCQA-ZDUSSCGKSA-N 342.399 1.431 10 10 EDCE Cc1cc(C(=O)NCC(=O)N=S(C)(C)=O)c(C)n1-c1ccccn1 868953554 WLYAJCUMSLSZSP-UHFFFAOYSA-N 348.428 1.473 10 10 EDCE COc1ccc(O)c([C@H](C)NC[C@@H](O)COC[C@H]2CCCO2)c1 775373518 SXJMDCIFYZVYMP-GZBFAFLISA-N 325.405 1.608 10 10 EDCE C[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)CC(=O)N1C 1116917887 OZYLTIIHEHRUKH-CQSZACIVSA-N 334.439 1.240 10 10 EDCE CN1CCN(c2ccc(CN3CCC4(CC3)COCCO4)cc2)CC1 895695979 KRRSPLPHJPDXCI-UHFFFAOYSA-N 345.487 1.820 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cnn3c(=O)cc[nH]c23)c1 1137473811 XCXQNYNSRUNVKF-VIFPVBQESA-N 328.328 1.228 10 10 EDCE CS(=O)(=O)Nc1ccc(C(=O)NCc2c(O)cccc2O)cc1 1304049691 DHYMSINACBROLI-UHFFFAOYSA-N 336.369 1.399 10 10 EDCE COc1cccc([C@H](C)NCc2nc(O)c3c(n2)CCOC3)c1O 1331914118 BNIVFQDAKFUMPZ-JTQLQIEISA-N 331.372 1.820 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)Cn3nccc3N)C2)cc1 1452033828 VJYIRZWODXSYLA-ZDUSSCGKSA-N 329.404 1.117 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1nc(-c2cnccn2)no1 1465031640 QEPJCARIMFKVDM-UHFFFAOYSA-N 338.371 1.831 10 10 EDCE COC(=O)c1nc(=NCc2cccc(Br)c2O)cc[nH]1 1472775520 WHRHXPQIPCTAOK-UHFFFAOYSA-N 338.161 1.765 10 10 EDCE CNC(=O)c1ccc(CN(C)C(=O)Cc2ccc(O)c(O)c2)cc1 1540571131 FEGHXLQUKZIMAS-UHFFFAOYSA-N 328.368 1.659 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCn2ccnn2)cc1C 1715925297 CZJGLUVBPDGPEO-CQSZACIVSA-N 331.420 1.280 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@@]2(C)CCNC2=O)cc1C 1731619472 XCCWIWNPSCPZPP-UGSOOPFHSA-N 333.432 1.124 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2oncc2C)cc1C 1571593193 ALJOGVMSLHJVQE-OAHLLOKOSA-N 347.415 1.523 10 10 EDCE CN1C(=O)C(=Cc2ccc(O)c(Br)c2)C(=O)NC1=S 2293653427 BHLKKCLDFOTKSC-UHFFFAOYSA-N 341.186 1.411 10 10 EDCE CC(C)C(=O)N(C)C[C@@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1739025177 BRPNWRVQJLZSRP-ZDUSSCGKSA-N 349.391 1.054 10 10 EDCE COC1CCN(c2ccc(CN3C[C@H]4C(=O)NC(=O)[C@H]4C3)cc2)CC1 1653668973 CHVYXOUBWLWZSO-CALCHBBNSA-N 343.427 1.006 10 10 EDCE O=C(NCCN1C(=O)Cc2ccccc21)c1c(F)ccc(O)c1O 1654274476 QDSQBMRVAFQYPS-UHFFFAOYSA-N 330.315 1.556 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)CN(C)C(C)=O 1668365960 NMQPEGHSYJEQKC-UHFFFAOYSA-N 335.448 1.420 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)CS(C)(=O)=O)cc1C 1690833388 FGUNSRTUCAYOCU-ZDUSSCGKSA-N 342.461 1.033 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985100624 IEARHZZWCMPUAH-WDEREUQCSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)COC1 1985102726 KZCDKMYLBVITTC-SNVBAGLBSA-N 325.369 1.581 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC(CCO)C3)c(Br)cc21 2152300783 ODIFVPDOQYWUCI-ZDUSSCGKSA-N 340.221 1.480 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C(NC(=O)c3ccc(O)c(O)c3)[C@@H]2C1 2006284064 LWQHYBUZDFLLNX-GHMZBOCLSA-N 334.372 1.693 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CNCc2ccc(F)cc2O)[C@@H](O)C1 2024897323 HKFQVWDQQOEIMW-WFASDCNBSA-N 340.395 1.849 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CCC2(CN(C(=O)OC(C)(C)C)C2)O1 2025157263 VTPRUDZERJJHST-NSHDSACASA-N 339.396 1.924 10 10 EDCE C[C@@H](N)c1ccc(N2CCN3C[C@H](O)C[C@H]3C2)cc1Br 405475097 LRBICTBYEKCTLZ-KGYLQXTDSA-N 340.265 1.724 10 10 EDCE O=C(O)C[C@@H]1CN(Cc2cc(Br)cc(F)c2O)C[C@@H]1O 2174357050 ZCAGSMWNMJVEGN-HQJQHLMTSA-N 348.168 1.561 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)CO1 1906905749 DZNMVFMNEWIERZ-CYDGBPFRSA-N 340.420 1.182 10 10 EDCE CN1CCO[C@H]2CN(Cc3ccc(Br)cc3O)C[C@@H]21 2097750566 JLDQDVFMZWMZDQ-JSGCOSHPSA-N 327.222 1.670 10 10 EDCE COCC1(O)CN(c2ccc(OC)c(Br)c2OC)C1 2226546088 AOZVAVIXWTWYFM-UHFFFAOYSA-N 332.194 1.664 10 10 EDCE COC(=O)C=Cc1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@@H]4O)c([N+](=O)[O-])c1 2312513732 PTCIAUKHTGWFFV-CAAARAIESA-N 344.367 1.987 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2357585980 SVGVGHINUXPFQT-CDAHBRHOSA-N 342.233 1.823 10 10 EDCE Nc1ccc(CC(=O)N2CC(n3cc(Br)cn3)C2)cc1 2361510463 JLOPNKSNWUCSKY-UHFFFAOYSA-N 335.205 1.854 10 10 EDCE CCN(CC)c1ccc(-c2nc3c(c(=O)[nH]c(=O)n3CC)n2C)cc1 195512620 PVKTXTKTSHIZSG-UHFFFAOYSA-N 341.415 1.956 10 10 EDCE COC(=O)[C@@H]1C[C@H]1C(=O)N1CCCN(c2ccc(OC)cc2)CC1 245396195 KICGDMAXQVTNED-HZPDHXFCSA-N 332.400 1.543 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1[C@H]2CC[C@H]1[C@H](CO)C2 289661904 UJRLSPDCXXXEEW-SZMVWBNQSA-N 331.460 1.556 10 10 EDCE Cc1ccc(CNC(=O)C[C@H]2COCCO2)c(O)c1Br 2381135860 XERHMWCZKPTRAZ-NSHDSACASA-N 344.205 1.885 10 10 EDCE CCCc1ccc(N2C[C@H](C(=O)OCC(=O)C(C)=O)CC2=O)cc1 808501916 YBBAFMBGQQPKKY-CQSZACIVSA-N 331.368 1.693 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(CN2C[C@H](C)O[C@@H](C)C2)cc1 808504643 HQFKCPLILMIDQF-STQMWFEESA-N 333.384 1.611 10 10 EDCE Cc1cc(O)c(CNc2ccc(C(=O)NCC(N)=O)cc2)cc1C 802761564 OSLFDVAQIGPTES-UHFFFAOYSA-N 327.384 1.836 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3ccnnc3OC)C2)cc1 823424569 DTIDHHSCMJTFFP-GFCCVEGCSA-N 343.387 1.894 10 10 EDCE CO[C@H](CS(=O)(=O)Nc1ccc(O)c(C)c1)C1CCOCC1 842584892 KUHXQIMPUWDXQZ-OAHLLOKOSA-N 329.418 1.884 10 10 EDCE COC(=O)c1nccnc1N[C@@H]1CCN(c2ccc(OC)cc2)C1 853760005 GSGQDZAHARAHRO-GFCCVEGCSA-N 328.372 1.963 10 10 EDCE O=C(NCCCOC1CCOCC1)NCc1c(O)cccc1F 920296706 WDPWUPYZTJNGFN-UHFFFAOYSA-N 326.368 1.916 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CC[C@H](CN)C3)C2)cc1 851666861 LKGDBZRQIYNMTE-ZNMIVQPWSA-N 332.448 1.701 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)OCCn1nc2ccccn2c1=O 759595371 QVILVHIVCSLJST-FNORWQNLSA-N 341.323 1.164 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CN(C)[C@H]3CCSC3)C2)cc1 855233695 KQWNXIXGLWHQBM-ZBFHGGJFSA-N 349.500 1.827 10 10 EDCE COC[C@H]1CN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCO1 852452607 BPJSAYCEJGPNLN-WMLDXEAASA-N 349.431 1.331 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)c1cn(C[C@H]2CCOC2)nn1 859421001 HEQHRCNZFBSZAX-CQSZACIVSA-N 343.431 1.619 10 10 EDCE CO[C@@H]1CN2C(=O)N(Cc3ccc(N(C)C)c(F)c3)C(=O)[C@@]2(C)C1 865301186 IRWIJAWDQXBOGY-YVEFUNNKSA-N 335.379 1.833 10 10 EDCE Cc1cc(C(=O)NC[C@H]2COCCN2C)c(C)n1-c1ccccn1 862973610 RDWYMAHPDBQOGK-HNNXBMFYSA-N 328.416 1.550 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3nc(C4CC4)no3)C2)cc1 866019938 XWHIYVGMZACBQS-LBPRGKRZSA-N 328.372 1.964 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCCN3C(C)=O)C2)cc1 869228486 JSJQODZDSQHRRG-WMLDXEAASA-N 331.416 1.401 10 10 EDCE O=C(/C=C\c1cncc(O)c1)NCc1ccc(N2CCOCC2)cc1 770487496 SVYDIKAOVDEEOM-UTCJRWHESA-N 339.395 1.953 10 10 EDCE C[C@H](NC(=O)NCc1cn(C)nn1)c1ccc(N2CCOCC2)cc1 782999265 ODGGUBCNQKXWCZ-ZDUSSCGKSA-N 344.419 1.212 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1C(=O)NCCCN=[N+]=[N-] 1895875295 IAYCEPKWQWHAPR-WDEREUQCSA-N 327.385 1.733 10 10 EDCE CN(Cc1nc(-c2cccnc2)no1)C(=O)c1cccc(O)c1O 790704950 UCFCDADUBJWCDJ-UHFFFAOYSA-N 326.312 1.815 10 10 EDCE Oc1c(Br)cccc1CNCCCCc1nn[nH]n1 708182415 FZHQNSDYMPNQET-UHFFFAOYSA-N 326.198 1.780 10 10 EDCE C[C@H](O)c1ccc(N2CCN(C)[C@@H](CO)C2)cc1Br 687588632 JIJCCYIVTFJFMP-CMPLNLGQSA-N 329.238 1.615 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2cc(C)co2)cc1C 1283797529 PUGJNEBZSTUMID-OAHLLOKOSA-N 332.400 1.786 10 10 EDCE CCOCC(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1285660436 TYRHWKPHUGVACZ-SNVBAGLBSA-N 335.364 1.120 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CCn1cc([N+](=O)[O-])cn1 1297562101 BCRWLBKEHVUPLI-UHFFFAOYSA-N 339.348 1.689 10 10 EDCE COC(=O)c1cc2n(n1)CCC[C@@H]2NC(=O)NCc1ccccc1O 1471530434 NXUIZGMMJYQUDS-LBPRGKRZSA-N 344.371 1.710 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)CNC(=O)C2CC2)cc1C 1700394772 WHCBGXQESDLWHP-ZIAGYGMSSA-N 347.459 1.513 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@H](C)n2cncn2)cc1C 1482999607 LZKKHTULWMUUFB-RGDDUWESSA-N 343.431 1.618 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)C[C@@H]2COC(=O)C2)cc1C 1480759317 NLKQOZJPOVGAKX-ZBFHGGJFSA-N 348.443 1.941 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1CCCNC1=O)NCc1ccc(OC)c(C)c1 1481821432 OBHCWJKQUKYWLS-HOTGVXAUSA-N 347.459 1.514 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cccc(=O)n2C)cc1C 1713336996 YWMJNEDMMCAYFL-CQSZACIVSA-N 343.427 1.610 10 10 EDCE CCNC(=O)CN[C@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1713423554 VREMHSIIBYEELM-LLVKDONJSA-N 348.407 1.083 10 10 EDCE O=C(NCc1c(O)cccc1O)C1CCN(CC(F)(F)F)CC1 1558536131 SXRWVBVHYXIHCI-UHFFFAOYSA-N 332.322 1.988 10 10 EDCE CN1CCCc2cc(CNC(=O)Cc3nc(C4CC4)n[nH]3)ccc21 1631322670 NMIDEXXPBZMPEK-UHFFFAOYSA-N 325.416 1.923 10 10 EDCE CN(CCNC(=O)c1ccco1)C(=O)c1ccc(N=NC(N)=O)cc1 1721056448 BFMRXSZWTGWABT-UHFFFAOYSA-N 343.343 1.944 10 10 EDCE C[C@@H](CCN(C)C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1642155210 IPIABMJATCWRJU-HNNXBMFYSA-N 333.476 1.852 10 10 EDCE Cc1nc(S(=O)(=O)N2CC[C@@H](N=[N+]=[N-])C2)c(Br)n1C 1912208788 WAPNZYBUGNCXLB-SSDOTTSWSA-N 349.214 1.564 10 10 EDCE CN(C)C(=O)COc1cccc(NC(=O)Cc2ccc(N)cc2)c1 151273947 DEOPIPROZRSNMA-UHFFFAOYSA-N 327.384 1.917 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1c[nH]nc1Br 2134189614 QQKDURKUHPGNRL-UHFFFAOYSA-N 326.150 1.556 10 10 EDCE CN(Cc1ccccc1)C[C@@H](N)C(=O)NCCc1ccc(O)c(O)c1 1968740027 ZZWRWMQGFLEKEN-MRXNPFEDSA-N 343.427 1.216 10 10 EDCE CN1C[C@H](O)[C@@H](N(C)c2ccc(CNC(=O)OC(C)(C)C)cc2)C1 1999491395 DXVARNJKCVSACQ-HOTGVXAUSA-N 335.448 1.822 10 10 EDCE COc1cc(N)c(N2CC(CNC(=O)C(F)(F)F)C2)cc1OC 1999525337 LCOZPKUNISURDW-UHFFFAOYSA-N 333.310 1.401 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)C(=O)C[C@H]1C[C@H](N)C1 2003168601 VRNPWOQJNOWAJQ-JHJVBQTASA-N 340.420 1.278 10 10 EDCE CN1CCO[C@@H]2CN(c3cc(Br)c(CN)cc3F)C[C@@H]21 2153991242 POKGKUTWZINTSD-UONOGXRCSA-N 344.228 1.566 10 10 EDCE CN1C(=O)N[C@@H]2CN(c3ccc(CN)cc3Br)CC[C@H]21 2171304544 HKEXFDBRTTXMKP-DGCLKSJQSA-N 339.237 1.510 10 10 EDCE Nc1ccc(CC(=O)NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1 702601411 ZBNUNUMYQRDNHN-HXUWFJFHSA-N 339.439 1.565 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@]4(C)CN(C)C[C@]4(C)C3)c2n1 2062005657 CAVTVWWXUCITNW-CALCHBBNSA-N 329.404 1.157 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(F)c1Br 2182552385 CHBLALBFTSXXEC-LPQAMYBRSA-N 345.212 1.225 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](Nc2c(N)cccc2C(=O)O)[C@H](O)C1 1908510565 FUTRYCWPNUUDNJ-NWDGAFQWSA-N 337.376 1.359 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2CN3C(N)=O)cc1Br 2192298799 JZYGOFGIQKCINO-RYUDHWBXSA-N 339.237 1.510 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C[C@@H](O)CN2Cc2cc(N)ccc2O)C1 2066540702 SIYLNNKFSARGSN-CQSZACIVSA-N 349.431 1.531 10 10 EDCE CO[C@H]1C[C@@H](O)CN(c2cc(Br)c(CN)cc2F)C1 2109015063 CKCDDXMWKNMXJH-ZJUUUORDSA-N 333.201 1.633 10 10 EDCE CNCc1ccc(N(C)[C@H]2CC(=O)NC2=O)cc1Br 2114728016 VBNXSDLSAZOXIP-NSHDSACASA-N 326.194 1.020 10 10 EDCE COc1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)c(OC)c1Br 2234901965 JQXFOSJHGIWJQA-RISCZKNCSA-N 346.221 1.788 10 10 EDCE COc1ccc(N2CCN(CCO)CC2)c(OC)c1Br 2234900482 WELCYVXEGWBARO-UHFFFAOYSA-N 345.237 1.581 10 10 EDCE COc1ccc(N2CCO[C@H](CO)C2)c(OC)c1Br 2226541547 QCKCUOZJRIKKDL-VIFPVBQESA-N 332.194 1.664 10 10 EDCE O=C(O)CN(Cc1c(O)cccc1Br)[C@H]1CCOC1 2272418096 DYRGYSQJNMFYPG-VIFPVBQESA-N 330.178 1.830 10 10 EDCE CN1C(=O)C(=Cc2c(N(C)C)nc3ccccn3c2=O)SC1=S 2296541936 PXJRTUWDHDFIHW-UHFFFAOYSA-N 346.437 1.592 10 10 EDCE C[C@@H](O)[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(O)cc2)SC1=S 2323823724 IDDYOOIRZARJAI-RDDDGLTNSA-N 339.394 1.427 10 10 EDCE Cc1ccc(CNCc2cc(=O)n(C)[nH]2)c(O)c1Br 2352945909 CZPAUJVOCAGPJN-UHFFFAOYSA-N 326.194 1.780 10 10 EDCE CC[C@@H](CO)NC(=O)C(=O)N(c1ccccc1)c1ccc(N)cc1 170388642 RMNVYRJAZNBLGC-AWEZNQCLSA-N 327.384 1.821 10 10 EDCE COc1ccc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)c(O)c1 179894967 SITKSDILQMRUMC-OAHLLOKOSA-N 334.416 1.472 10 10 EDCE CC(=O)N1CC[C@H](OC(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 176101111 OENSXSYDMPWMPH-UKTKYZJWSA-N 344.411 1.700 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CC[C@H](N2CCOCC2)C1 121005331 VFDTVRIDTIQBHA-IBGZPJMESA-N 331.460 1.430 10 10 EDCE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H]2CNC(=O)C2)cc1 194698171 QHFZIWVRLBFKBF-RDJZCZTQSA-N 345.443 1.396 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCO[C@@]2(CCCOC2)C1 368046773 ZVBHWGWPRQYZDB-IBGZPJMESA-N 332.444 1.905 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CC2(CCCOC2)C1 376624513 ZJQHDBNWFPTZDH-UHFFFAOYSA-N 345.443 1.845 10 10 EDCE C[C@H](NC(=O)C(=O)N(C)CC1(CO)CC1)c1ccc(N(C)C)cc1 807674430 KUIRZGNOKRMPCF-ZDUSSCGKSA-N 333.432 1.161 10 10 EDCE NC(=O)CC1(NC(=O)c2csc(Cc3ccc(N)cc3)n2)CCC1 817959991 JTRWWSSTFQXDMI-UHFFFAOYSA-N 344.440 1.844 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H](CCF)C2)cc1 826706747 LTEFAIJTBZMRFC-HNNXBMFYSA-N 335.423 1.967 10 10 EDCE O=C(NCCc1nnc2n1CCC2)NCc1cc(Cl)ccc1O 845029782 PZQIOYXKIIIKAI-UHFFFAOYSA-N 335.795 1.625 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C2CN(C)CCN(C)C2)cc1 911892762 NOJITBZGQCQZJK-UHFFFAOYSA-N 348.491 1.083 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CS(=O)(=O)C(C)C)C2)cc1 855228692 DBHXKEWOZQOTMS-ZDUSSCGKSA-N 340.445 1.213 10 10 EDCE COC(=O)CCNC(=O)CCN[C@@H](C)c1ccc(Cl)cc1O 858540819 AZFJQVGKNGPKIW-JTQLQIEISA-N 328.796 1.766 10 10 EDCE O=C(NCc1cc(Br)ccc1O)N[C@@H]1COC(=O)C1 923754037 ZMFGEPQFTGUYOT-VIFPVBQESA-N 329.150 1.269 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@]3(OC)CCOC3)C2)cc1 852256187 SUPKBHBTYVDXGX-KDOFPFPSSA-N 349.431 1.379 10 10 EDCE C[C@H](NC(=O)N[C@@H]1CCc2nnn(C)c2C1)c1ccc(N(C)C)cc1 922054849 MGERIEPQCONPCX-GXTWGEPZSA-N 342.447 1.799 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H]2COC[C@@]2(C)C1 852533461 ZCONSTKOOSJPIY-QFBILLFUSA-N 331.460 1.679 10 10 EDCE C[C@@H]1C[C@H](NC(=O)NCc2ccc(N(C)C)c(F)c2)c2ncnn21 852475967 JQJVCQLWZNHYTA-MFKMUULPSA-N 332.383 1.988 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC(=O)N(C)C[C@@H]3C)C2)cc1 852451160 FFGIMQNVMQXMNY-KBPBESRZSA-N 346.431 1.146 10 10 EDCE Cn1c(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cnc1Cl 775285823 DQDRFGLZEVXAQF-UHFFFAOYSA-N 332.725 1.488 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCCC2CS(=O)(=O)C2)c1 786842136 MPVFAFOOYMFXEV-JTQLQIEISA-N 342.417 1.196 10 10 EDCE NCc1cc(F)c(N2CCO[C@H]3COC[C@@H]32)cc1Br 1877649234 WHXHPWSIGUIZAJ-STQMWFEESA-N 331.185 1.651 10 10 EDCE CCn1nnnc1N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 1351014724 GQWGWMUCLVFMTO-UHFFFAOYSA-N 348.407 1.045 10 10 EDCE CO[C@H](C)CNC[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1330709534 VZSSOTUDJDSGAH-LALPHHSUSA-N 347.419 1.982 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C4CCC3(CO)CC4)C2)cc1 1332365514 SYCPYHUBFCLZKR-ASFAAARLSA-N 345.443 1.973 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)C[C@H]2CCC(=O)N2)cc1C 1331584319 KPGAVRODSFTDNZ-GOEBONIOSA-N 347.459 1.609 10 10 EDCE CC[C@@H](CNC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1)OC 1275046522 WFJREPLDXQCCHS-RISCZKNCSA-N 335.408 1.982 10 10 EDCE Cn1cc(-c2nc(C(=O)NCc3c(O)cccc3O)cs2)cn1 1456235719 NCNOXYJKHUWXKW-UHFFFAOYSA-N 330.369 1.885 10 10 EDCE COC(=O)N1C[C@H]2C=C[C@H]1[C@H](C(=O)NCc1cccc(O)c1O)C2 1520508890 ONAXVWSFEXVCBL-UHTWSYAYSA-N 332.356 1.357 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)Cc1c(C)nc(O)nc1O 1465845997 LFUYQFLLFZDMCU-UHFFFAOYSA-N 331.372 1.883 10 10 EDCE Cc1nnc(N2CCOCC2)n1Cc1ccc(N2CCOCC2)cc1 1612614423 QRYOREQOXMCYCY-UHFFFAOYSA-N 343.431 1.308 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(N2CCCOCC2)CC1 1556931909 LIVQPRVUAWCAES-UHFFFAOYSA-N 334.416 1.354 10 10 EDCE C[C@H](C(=O)NCc1c(O)ccc2ccccc12)N1CCN(C)CC1 1558554223 MVASOKLVVATTEU-CQSZACIVSA-N 327.428 1.798 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@H]2CCC(=O)N2)cc1C 1714768785 UNTXFYVSRDSQLL-OAHLLOKOSA-N 333.432 1.220 10 10 EDCE CN(Cc1ccccc1O)c1nnc(C2CC2)n1Cc1nncn1C 1729419133 OANPCCXXHCKAKS-UHFFFAOYSA-N 339.403 1.674 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@@H]2CCNC(=O)C2)cc1C 1568986887 AHWNQTGJNLXWMD-UKRRQHHQSA-N 333.432 1.124 10 10 EDCE Cc1c(C(=O)N[C@@H](C)c2ccccc2O)cnn1-c1ccc(O)nn1 1632250586 XFUHZLJZJNEKNQ-JTQLQIEISA-N 339.355 1.873 10 10 EDCE Cc1nc2ccnn2cc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1567467234 FFQSFWNLJQNWLX-SNVBAGLBSA-N 326.356 1.810 10 10 EDCE COCC(=O)N[C@@H]1C[C@@H](C)N(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1738956621 GZWXPYVNCALBIZ-ZWNOBZJWSA-N 347.375 1.215 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2ccoc2)cc1C 1571575516 YMNDMWLHZBMGQA-INIZCTEOSA-N 332.400 1.819 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H]3CCN(C)[C@H]3C2)c([N+](=O)[O-])c1 1651869669 VAQJVHLCVIQLNB-BDHHJBHZSA-N 331.372 1.921 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C[C@H](C)C2CC2)cc(OC)n1 1758780482 JMAFJBBLVSCWNB-RYUDHWBXSA-N 349.431 1.770 10 10 EDCE CCOC(=O)[C@H]1CCCN(C(=O)CNCc2cc(C)ccc2O)C1 1857867788 BSNJYDFLAUWBKS-AWEZNQCLSA-N 334.416 1.592 10 10 EDCE CCc1c(OCCCOc2ccc(N)cc2)c(=O)ccn1CCO 1857913461 JXGYKABASYXMOZ-UHFFFAOYSA-N 332.400 1.833 10 10 EDCE Nc1ccc(OCC(=O)NC[C@@]2(Br)CC2(F)F)cc1 2137781332 TXJUYOWUEBLXNK-NSHDSACASA-N 335.148 1.937 10 10 EDCE CC(C)NCc1ccc(N2C[C@H](O)[C@@H](O)C2)cc1Br 232652135 NVQWPHVKNANSKI-KBPBESRZSA-N 329.238 1.489 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H]1NS(=O)(=O)Cc1ccc(N)cc1 1977696670 NPKKYZGEFTVPPG-STQMWFEESA-N 341.433 1.354 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](CO)C[C@H]2CO)cc1Br 2146084072 XHNZZRAIQUBXSX-MDZLAQPJSA-N 343.265 1.909 10 10 EDCE Cn1c(C(=O)NCCCN=[N+]=[N-])cnc1CNC(=O)OC(C)(C)C 2010404460 AQNAHVYOFGXAMC-UHFFFAOYSA-N 337.384 1.875 10 10 EDCE COC(=O)[C@@H](CC(=O)NCCCCN=[N+]=[N-])NC(=O)OC(C)(C)C 2010397817 ULXGUFBPVSYGJW-SNVBAGLBSA-N 343.384 1.650 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010389042 KPDOXLBZDDJRET-MNOVXSKESA-N 343.384 1.759 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H]1C(=O)NCCc1ccc(O)c(O)c1 2010214701 AXHMNARMVPDLKG-RYUDHWBXSA-N 336.388 1.670 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)cc1Br 2158392684 MTUWTOBPKTYHCM-YUELXQCFSA-N 341.249 1.755 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)c(Br)c1 2158392996 OZVKCKBBPCNRCU-CQDKDKBSSA-N 341.249 1.755 10 10 EDCE NCc1cc(F)c(N2CC[C@H](C(CO)CO)C2)cc1Br 2170640722 GQCXVLBNCQWTON-VIFPVBQESA-N 347.228 1.474 10 10 EDCE O=C1OCCN1[C@H]1CCN(c2ccc(CO)cc2Br)C1 2171728836 ATZSDBWGTOYMJC-NSHDSACASA-N 341.205 1.972 10 10 EDCE Cn1cc(C=CC(=O)N2CCCCc3ccccc32)c(=O)n(C)c1=O 2052146341 JDTSNPWVEPIRMV-UHFFFAOYSA-N 339.395 1.467 10 10 EDCE CN[C@@H](C)c1ccc(N(C)Cc2nnnn2C)c(Br)c1 707669669 GIPXGOYFOCOYBZ-VIFPVBQESA-N 339.241 1.889 10 10 EDCE CNCc1ccc(N2CCC[C@@H](CO)[C@H]2CO)cc1Br 709823236 MPKFZDPLQTXOFV-SWLSCSKDSA-N 343.265 1.738 10 10 EDCE NCc1ccc(N2CCC[C@H](CO)[C@H]2CO)c(Br)c1 709803703 DCRBNBVRGIBIGQ-BXUZGUMPSA-N 329.238 1.477 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)c(Br)c1 2173316624 DFDFXLNKVFYRGG-PPMYVGRGSA-N 341.249 1.789 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC(c4ccncn4)CC3)c2n1 2062102116 ABYCNVLDNJXDBK-UHFFFAOYSA-N 338.371 1.553 10 10 EDCE CC1(C(=O)NCc2cc(Cl)ccc2O)CCS(=O)(=O)CC1 2063208994 TVOQERLSUVWQAV-UHFFFAOYSA-N 331.821 1.877 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H](N(C)C)C2)c(Br)c1 2089925583 DNBYXGQAUAXHAV-FZZIBODNSA-N 328.254 1.580 10 10 EDCE CC1(C)CO[C@H](CO)CN1c1ccc(CN)c(Br)c1 2111238647 KBTKWVGIMKSHDC-LBPRGKRZSA-N 329.238 1.884 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]12CCO[C@H]1CN(C(=O)OC(C)(C)C)C2 2253350772 LFTXIWBPDFUZGO-NHYWBVRUSA-N 339.396 1.781 10 10 EDCE Cc1ccc(CNS(=O)(=O)c2ncc[nH]2)c(O)c1Br 2352645513 KOIFOBYHARODIJ-UHFFFAOYSA-N 346.206 1.665 10 10 EDCE Cc1ccc(Cn2cc(C[C@H](C)N)nn2)c(O)c1Br 2352647956 HOYRUYQRBLNVIQ-VIFPVBQESA-N 325.210 1.993 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@H](C(=O)N3CCOCC3)C2)c1 179894351 OFEFNJQBFULZIV-HNNXBMFYSA-N 348.443 1.862 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)Nc1cnn(CC(=O)NC)c1 179460541 INSKYLXIYOXFAB-UHFFFAOYSA-N 345.403 1.779 10 10 EDCE O=C(CNC(=O)c1cccnc1)NCc1ccc(N2CCCC2)cc1 177850473 NNDLKBBLJVBHKL-UHFFFAOYSA-N 338.411 1.728 10 10 EDCE CC[C@H](NCC1CN(S(C)(=O)=O)C1)c1ccc(N(C)C)cc1 187816631 NBTLKIKJSSHYOF-INIZCTEOSA-N 325.478 1.685 10 10 EDCE COc1cc(Cl)cc(CN2CC[C@H](NS(C)(=O)=O)C2)c1O 184696168 HFCQBEKHGCOACT-NSHDSACASA-N 334.825 1.178 10 10 EDCE COc1cccc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1O 92044944 FASLZTCJDLMZBB-AWEZNQCLSA-N 340.445 1.401 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2CCSc3ncccc32)c1 255697170 LDGCUYIEQLFNOI-PLNGDYQASA-N 340.408 1.988 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC(NCCO)CC2)c([N+](=O)[O-])c1 255083856 GMCHTZPGFRYOKI-HYXAFXHYSA-N 349.387 1.332 10 10 EDCE CCOC(=O)c1cc(C(=O)N2CCOc3cc(N(C)C)ccc32)on1 450052596 ZUWMQVJOVUAARB-UHFFFAOYSA-N 345.355 1.957 10 10 EDCE CN[C@@H](c1ccc2c(c1)CCN2C)c1c(Br)nnn1C 2163141723 XLDXTANGSZQTBP-LBPRGKRZSA-N 336.237 1.879 10 10 EDCE CCN[C@H](C)c1ccc(N2CC(NC(N)=O)C2)cc1Br 2163218549 YTHJQNVKAFTEPE-SECBINFHSA-N 341.253 1.977 10 10 EDCE O=C(NCc1cc(Br)ccc1O)C1(O)CCOCC1 804735713 HKYRSWMPPYUASY-UHFFFAOYSA-N 330.178 1.312 10 10 EDCE COC[C@@]1(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)CCOC1 819587945 QWZAXSSIWKIYRC-KXBFYZLASA-N 348.443 1.691 10 10 EDCE CC[C@H]1[C@@H](C(=O)OCC(=O)C(C)=O)CCN1C(=O)OC(C)(C)C 811298734 SOKCJXKZBRAWFT-RYUDHWBXSA-N 327.377 1.723 10 10 EDCE CNC(=O)N1CCN(c2ccc(CO)cc2Br)CC1 721687367 JWMQEPMICRPCDH-UHFFFAOYSA-N 328.210 1.403 10 10 EDCE N[C@@H](c1cc(Br)cc([N+](=O)[O-])c1O)[C@@H](O)C(F)(F)F 725382919 VFJKTKDMFRZLRV-POYBYMJQSA-N 345.071 1.986 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)C(=O)N(C)[C@@H]2CCOC2)cc1 839289174 YFUAMGDTZGOGHQ-QGZVFWFLSA-N 347.459 1.739 10 10 EDCE CC(C)OC[C@H](O)CNCc1ccc(N2CCC(CO)CC2)cc1 843064066 FYRLVBAAGBCPAC-LJQANCHMSA-N 336.476 1.771 10 10 EDCE C[C@H]1CCN(Cc2ccc(N3CCN(C)CC3)cc2)C[C@@H]1C(=O)O 843041612 UICQBYSTYSKPTL-YJBOKZPZSA-N 331.460 1.981 10 10 EDCE CCN[C@H](C)CNC(=O)NCc1cc(Br)ccc1O 841984742 HBBYFDRZUBGAQQ-SECBINFHSA-N 330.226 1.952 10 10 EDCE COc1ccc(N2CCN(CCNc3cc(=O)n(C)cn3)CC2)cc1 848657587 AQRQGDYSKMVFAZ-UHFFFAOYSA-N 343.431 1.023 10 10 EDCE C[C@H]1[C@@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCN1C 923338027 WZXQCNZZJNLINR-KSSFIOAISA-N 346.475 1.540 10 10 EDCE CCn1nc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)ccc1=O 855230719 IPMNMPDMTZRMPP-CYBMUJFWSA-N 342.399 1.281 10 10 EDCE CCN(CC)c1ccc(CNC2CN(S(=O)(=O)N(C)C)C2)cc1 858311914 PQKZLANBXIMLKO-UHFFFAOYSA-N 340.493 1.113 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H]3CCCOC3)C2)cc1 851996425 PYNOAOQUBPLMRD-LSDHHAIUSA-N 333.432 2.000 10 10 EDCE CO[C@@H](CNC(=O)NCCCSc1nccs1)[C@H]1CCOC1 853856190 SPPILECHZNSZNB-RYUDHWBXSA-N 345.490 1.976 10 10 EDCE C[C@H]1CCC[C@@H](CNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)O1 850602267 SREVGVADZSTUQF-YOEHRIQHSA-N 347.459 1.785 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCO[C@H](CC(N)=O)C1 863487430 UISMDPALDJLVOH-CYBMUJFWSA-N 347.440 1.872 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 860194856 YTIOGYOOXBWLGJ-HNNXBMFYSA-N 325.478 1.514 10 10 EDCE C[C@H](NC(=O)NCCCCN1CCN(C)CC1)c1ccccc1O 868049183 SDWYCFMNDHAPKU-HNNXBMFYSA-N 334.464 1.780 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCC[C@H]4COCC[C@@H]43)nc12 1118319530 OJLNWPLRIDBRMK-GWCFXTLKSA-N 332.360 1.134 10 10 EDCE Cc1nocc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1125257027 FTVOVCYMADHBQZ-AWEZNQCLSA-N 342.399 1.615 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)NCC[C@H]3CCCO3)ccc21 786599627 RWQNPIAMKKEQDF-MRXNPFEDSA-N 345.443 1.371 10 10 EDCE C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 897581483 RLIJKMFOGGBJNS-UQOMUDLDSA-N 347.434 1.916 10 10 EDCE COc1cccc(CNC(=O)[C@H]2CC(c3ccccn3)=NO2)c1O 1137473646 QBQBZWJMYZRECU-OAHLLOKOSA-N 327.340 1.605 10 10 EDCE O=C(NCc1ccc(N2CCOC2=O)cc1)c1cccc(O)c1O 790925671 BBXDWXGLHYJLAG-UHFFFAOYSA-N 328.324 1.984 10 10 EDCE CC[C@@H]1CCN1C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 795651440 YTJQJMIHBCIFJU-AEFFLSMTSA-N 333.476 1.662 10 10 EDCE Cn1nc(I)cc1[C@H](N)c1ccccc1O 1899662195 ZOZRUAPCOOYQTL-LLVKDONJSA-N 329.141 1.778 10 10 EDCE CC(C)(C)OC(=O)NC1CCN(CC(=O)NCCN=[N+]=[N-])CC1 1963818633 WYSXHMGTQPCZPQ-UHFFFAOYSA-N 326.401 1.402 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1[C@H]2CCC[C@H]21 1327496616 XROUVPXULDLUQJ-BJWYYQGGSA-N 327.428 1.818 10 10 EDCE COc1cccc(CNC(=O)NCC(C)(C)CS(C)(=O)=O)c1O 1255232511 JODSVHUNUJAFPI-UHFFFAOYSA-N 344.433 1.271 10 10 EDCE COCCCN[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1266570026 WOLRSPAUMPOXTE-AWEZNQCLSA-N 333.392 1.690 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cc2ncc[nH]2)cc1C 1268610096 UQSYFDCWZDVWAJ-ONEGZZNKSA-N 328.416 1.731 10 10 EDCE O=C(C(=O)N1CC[C@@H]2CSC[C@H]2C1)N1Cc2cccc(O)c2C1 1351961301 RCDCYHLIQOHAJO-CHWSQXEVSA-N 332.425 1.446 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H]2CNC(=O)C(F)F)cc1 1285830131 ZYXJLOPAALWDDC-SNVBAGLBSA-N 339.302 1.445 10 10 EDCE CCOC(=O)[C@H](CC(=O)NCCCSc1nccs1)C(C)=O 1292997639 OQXSYUIEGTURGA-LLVKDONJSA-N 344.458 1.900 10 10 EDCE CC1=C(C)C(=O)N(CCC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)C1=O 1466791706 YDNHBKAKYNHOQT-JTQLQIEISA-N 346.383 1.240 10 10 EDCE C[C@@H](NC(=O)c1nsnc1O)c1ccc(N2CCOCC2)cc1 1625882470 JIYDRVFPAJDYKZ-SNVBAGLBSA-N 334.401 1.571 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2ccn(C)n2)cc1C 1482170120 ZIWQGEPPORBMLJ-ZDUSSCGKSA-N 330.432 1.893 10 10 EDCE O=C(CNC(=O)COc1ccccc1)NCc1c(O)cccc1F 1635360669 POUOEJLPWXSHET-UHFFFAOYSA-N 332.331 1.343 10 10 EDCE C[C@H](C(=O)NCc1c(O)cccc1O)c1ccc(S(C)(=O)=O)cc1 1635842900 APBKCFUWYAZSBF-NSHDSACASA-N 349.408 1.921 10 10 EDCE CC[C@H]1CN([C@H](CC)C(=O)NCc2cccc(OC)c2O)CCO1 1630365607 AEXQDWMFDOELDC-LSDHHAIUSA-N 336.432 1.906 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)Cc2cnc[nH]2)cc1C 1731736563 YZPANOPSOFAZSD-CQSZACIVSA-N 330.432 1.954 10 10 EDCE Cc1ccccc1[C@@H](CC(=O)NCc1ccc(O)cc1O)NC(N)=O 1643100577 BSHXMTYVHZALJH-OAHLLOKOSA-N 343.383 1.822 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@]2(C)CCNC2=O)cc1C 1732359706 FMYYLFXLGQXNBO-ORAYPTAESA-N 347.459 1.372 10 10 EDCE [N-]=[N+]=NCCN[C@]1(C(N)=O)C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 1912203193 BXQRUKQCPNKIMC-QLPKVWCKSA-N 328.420 1.937 10 10 EDCE COc1cccc(CNC(=O)/C=C/c2ccc(C(N)=O)cc2)c1O 155692334 YNAWQHSJTXLECC-JXMROGBWSA-N 326.352 1.829 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)CC[C@@H](C)O)c(Br)cc21 219787150 ALLYNTHIBOEYTG-AMIZOPFISA-N 342.237 1.869 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1CNCCO1 1952195404 CTTYUKGMBAHJGS-DOMZBBRYSA-N 338.404 1.522 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCC(=O)N[C@@H]2C)c1O 1971868806 IRFVSEBITXRWKW-KCJUWKMLSA-N 343.221 1.920 10 10 EDCE CN[C@H](C)c1ccc(N2CCO[C@H](CO)C2)c(Br)c1 168117624 LUVJWJMTTMMROW-PWSUYJOCSA-N 329.238 1.927 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCN(CC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010393707 WIKCVQGSCKFNID-RYUDHWBXSA-N 338.412 1.497 10 10 EDCE C[C@@H](N)c1ccc(N2CCC(O)(C(N)=O)CC2)c(Br)c1 380358526 HIEYQOYWYQDFJK-SECBINFHSA-N 342.237 1.285 10 10 EDCE O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)c1ccc(O)c(O)c1 385557244 YQCFUDCNPYWUEE-MRXNPFEDSA-N 342.395 1.729 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@H]2C[C@@H]21 1906905316 WYXKAODXRNRKRJ-LQSBQDLSSA-N 336.432 1.801 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)C[C@@H]1C(=O)NCc1ccc(N)cc1 2080905612 XBXDKHCJUUOUHC-LSDHHAIUSA-N 349.431 1.645 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213593221 VZYSBULYVRQLCD-OPRDCNLKSA-N 340.384 1.103 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1CCOc1nnc(=N)[nH]n1 2213785044 IGQCCEDZCYYEEA-MNOVXSKESA-N 338.412 1.341 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](C(=O)NCCN=[N+]=[N-])O[C@@H]2C1 2251289921 KNBUNTIRBZMYNT-SDDRHHMPSA-N 339.396 1.827 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N1CCC[C@H](CO)C1 2301374574 RPDFUPJFZCXFEW-KRWDZBQOSA-N 330.428 1.767 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H](CCC(N)=O)NC(=O)OC(C)(C)C 2300526568 UWQHQNGOWNUYFQ-SNVBAGLBSA-N 342.400 1.304 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N[C@@H]1CCCN(c2ncccn2)C1 2307990559 YZUHOXLSHMPVET-CQSZACIVSA-N 340.383 1.686 10 10 EDCE Cc1ccc(CN2CC[C@](N)(C(=O)O)C2)c(O)c1Br 2352941520 RNVISXSWKKRNLH-CYBMUJFWSA-N 329.194 1.451 10 10 EDCE CCNCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2354481803 CMBSDFZGKYEOTE-HPEDKQMDSA-N 341.249 1.489 10 10 EDCE COc1ccc(N2CCCN(C(=O)COC[C@H]3CCOC3)CC2)cc1 172059086 YYPPILMELOCCMM-INIZCTEOSA-N 348.443 1.787 10 10 EDCE Cc1cc(/C=C2\NC(=O)N(CC(=O)O)C2=O)c(C)n1-c1cccnc1 96544838 JCHZYEUHFXNMMT-AUWJEWJLSA-N 340.339 1.466 10 10 EDCE Nc1ccc(NC(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1 242749319 DGJJIDIDONZJLE-UHFFFAOYSA-N 340.295 1.412 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 374188595 BPOBIBNMZLCYKU-KMFMINBZSA-N 344.459 1.903 10 10 EDCE C[C@@H]1C[C@@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 706045707 UJZJBGYQGJZTJT-UJVNDKKSSA-N 340.221 1.751 10 10 EDCE CC1(C)OCC[C@@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1 296192886 CJSINJKQMCQIMN-INIZCTEOSA-N 333.432 1.890 10 10 EDCE COCC[C@@H](COC)NC(=O)NCc1ccc(N2CC=CC2)cc1 811884364 FQTXKTVBSXLFAO-INIZCTEOSA-N 333.432 1.914 10 10 EDCE C[C@@H]1CCN1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 820991682 GZJYBMKHRLZEIJ-CYBMUJFWSA-N 337.445 1.225 10 10 EDCE COc1cc(O)c(CNCC[S@@](=O)CC(F)(F)F)cc1OC 826868373 RXJPYDLHCVTQLY-JOCHJYFZSA-N 341.351 1.810 10 10 EDCE CS(C)(=O)=NS(=O)(=O)CCN[C@@H]1CCc2cccc(O)c21 903225967 KKLLCUGZPJXPRZ-LLVKDONJSA-N 332.447 1.027 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)c1cnc2n1CCOC2 830559048 HVASRFMMPVHJOK-UHFFFAOYSA-N 327.384 1.928 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCC1=O 914242701 ROCLAAXDACZALK-CYBMUJFWSA-N 349.406 1.783 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)NCCC1(CN)CC1 846346601 HZFKBPZLSMTXFF-UHFFFAOYSA-N 347.459 1.766 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N[C@@H]1CNCCC1(F)F 841832005 KQGVXHIPJIIZOE-OAHLLOKOSA-N 336.386 1.859 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H]4[C@H](C3)C4(F)F)nc12 844452442 CXCCTBRKBCGQEK-QWRGUYRKSA-N 338.314 1.309 10 10 EDCE Cn1ccnc1CN1CCN(C(=O)NCCc2ccc(N)cc2)CC1 841956356 DHUBSOXLTNAUTC-UHFFFAOYSA-N 342.447 1.072 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 845262238 RJODINKVCBUDGX-FHLIZLRMSA-N 349.475 1.783 10 10 EDCE CCc1ccncc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 845792280 CNJUFTMYCQZZNW-UHFFFAOYSA-N 326.400 1.965 10 10 EDCE CCn1nc(C)c(S(=O)(=O)NCc2c(O)cccc2F)c1C 921452162 GBUMCCGEWRVSLH-UHFFFAOYSA-N 327.381 1.843 10 10 EDCE CSc1ccccc1C(=O)N1CCS(=O)(=O)C[C@H]1CCO 928508653 ATWBOBPMLXUMRO-LLVKDONJSA-N 329.443 1.030 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccn(C)c(=O)c3)C2)cc1 855233002 VNEJDDHFROFEOT-AWEZNQCLSA-N 327.384 1.403 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3=CCN(C)CC3)C2)cc1 854298612 GTGDSOHDXSHZCG-INIZCTEOSA-N 344.459 1.835 10 10 EDCE C[C@H](NC(=O)[C@@H]1[C@H]2CC[C@]3(COC(=O)[C@H]13)O2)c1ccc(N(C)C)cc1 860950264 KPVMCFIGKZJEOO-WHJJEVRWSA-N 344.411 1.650 10 10 EDCE Cc1cc(N(C)C)ccc1CNc1ccc(C(=O)NCCO)nn1 768521845 IILVWXCUNCEMFG-UHFFFAOYSA-N 329.404 1.185 10 10 EDCE CO[C@@H]1CC[C@@H]2OCCN(Cc3cc4c(cc3O)OC[C@@H]4O)[C@@H]2C1 768465439 MRJKDIWMNVNDLX-IRWJRLHMSA-N 335.400 1.586 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H](C)S(N)(=O)=O)cc1 768597067 KCYMEERCBCNGOG-ZDUSSCGKSA-N 335.429 1.501 10 10 EDCE NC(=O)N[C@@H]1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 770379108 IQHBLEHUACNZLG-CQSZACIVSA-N 347.419 1.828 10 10 EDCE C[C@@H](NC(=O)C(=O)NC[C@H]1CCOC1(C)C)c1ccc(N(C)C)cc1 1118631868 PFNJUICMGAAYQK-UKRRQHHQSA-N 347.459 1.861 10 10 EDCE CN1CCN(C)[C@@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)C1 1119457189 YNUTWKUHSXSNHW-NSHDSACASA-N 335.429 1.288 10 10 EDCE C[C@@H]1C[C@@H](NCc2ccc(N3CCN(C)CC3)c(F)c2)c2ncnn21 1118484069 BTZWDAIXGALWJA-CZUORRHYSA-N 344.438 1.965 10 10 EDCE C[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)C1(S(C)(=O)=O)CC1 797070885 NJVVTUWKROOLKY-ZJUUUORDSA-N 328.390 1.917 10 10 EDCE Cc1nn(C)c(Br)c1[C@H](NCCCN=[N+]=[N-])C(N)=O 1890597252 PYWHPHJCIOGOIB-QMMMGPOBSA-N 330.190 1.307 10 10 EDCE CC12CC(CN1C(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)C2 1327946689 MSRLLTQXPPBKMM-UHFFFAOYSA-N 343.427 1.150 10 10 EDCE O=C(O)Cc1csc(CNCc2ccc(N3CCOCC3)cc2)n1 1332269754 NHWINWKCVRVIDK-UHFFFAOYSA-N 347.440 1.897 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@H]2CC(=O)N(C)C2)cc1C 1265781734 KLSHMFVOYALNHP-HIFRSBDPSA-N 333.432 1.076 10 10 EDCE COCCN[C@H]1C[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1264411127 COWISJCRHAVUDX-VDISTLRHSA-N 333.392 1.593 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)c2nnn(C)c2C)cc1C 1503133504 UXPRNDRFLWOWKZ-ZDUSSCGKSA-N 345.447 1.739 10 10 EDCE CC1=C(C)C(=O)N(CCC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)C1=O 1466791707 YDNHBKAKYNHOQT-SNVBAGLBSA-N 346.383 1.240 10 10 EDCE CC(C)(C)n1nnc(CNC(=O)NCc2cccc(Cl)c2O)n1 1478888628 RHSTTWFYXGNXFG-UHFFFAOYSA-N 338.799 1.787 10 10 EDCE O=C(COc1ccsn1)NCc1ccc(N2CCOCC2)cc1 1543818113 YOSGVIPPXYRZAG-UHFFFAOYSA-N 333.413 1.675 10 10 EDCE CN(C)[C@H](CNC(=O)Cc1ccc(O)c(O)c1)Cc1ccccc1 1540527398 JGBRNWIOKOYUCT-INIZCTEOSA-N 328.412 1.929 10 10 EDCE O=C(NCc1nc(O)c2c(n1)CCOC2)NCc1c(O)cccc1F 1471149805 URKBNTTVBAUVLI-UHFFFAOYSA-N 348.334 1.099 10 10 EDCE Cc1ncccc1NC(=O)[C@H](C)NC(=O)/C=C\c1ccc(O)c(O)c1 1625863620 OUHGWSBYFMJLDU-VFFGBVLKSA-N 341.367 1.958 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@H]2COCCO2)cc1C 1482084962 XBYVOIOBTLJYRM-DYVFJYSZSA-N 336.432 1.261 10 10 EDCE CC(C)(O)[C@H](Oc1ccccc1)C(=O)NCc1c(O)cccc1O 1558536171 VJJXBSSGFUNHPN-MRXNPFEDSA-N 331.368 1.933 10 10 EDCE O=C(CCCc1nn[nH]n1)NCc1cccc(Br)c1O 1623364133 OCLHEEZXEBJRAC-UHFFFAOYSA-N 340.181 1.307 10 10 EDCE COC(=O)c1cnc(SCC(=O)[C@@H]2CCS(=O)(=O)C2)s1 1559416553 NUKDKRJCJAPQRD-SSDOTTSWSA-N 335.428 1.026 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)Cn2cncn2)cc1C 1715274105 RYRYWAKUURDPBW-ZDUSSCGKSA-N 331.420 1.137 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCNC(=O)c1ccccc1F 1630209087 FMNUHJUMRXXBMB-UHFFFAOYSA-N 332.331 1.326 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)CCCF)cc(OC)n1 1737578941 UDNLLXRFGADYKN-JTQLQIEISA-N 327.356 1.083 10 10 EDCE C/C=C(/C)C(=O)N(C)C[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1738805482 PETISWVNIHAHFQ-RDQDRAATSA-N 335.404 1.642 10 10 EDCE O=C(CCc1nc(-c2nc[nH]n2)no1)N1Cc2cccc(O)c2C1 1587928601 QCUCKCXNAFCOTP-UHFFFAOYSA-N 326.316 1.035 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H]2CCC(=O)N2C)cc1C 1662310602 ZWEMJBRACANBBL-HIFRSBDPSA-N 333.432 1.219 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)c2cn(C)nn2)cc1C 1674660284 FULNVKGWZMBXDI-STQMWFEESA-N 331.420 1.429 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(C(C)=O)C[C@H]2C)c([N+](=O)[O-])c1 1772897383 HZGQQACIZKEZER-SMYYYNMVSA-N 347.371 1.838 10 10 EDCE COCCNC(=O)[C@@H](C)N(C)Cc1ccc(N2CCOCC2)cc1 16387272 PSOVRCWHHBVRPM-OAHLLOKOSA-N 335.448 1.106 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CCC(=O)NC1=O 153404002 XUZZQXIKHMVPRR-NSHDSACASA-N 331.397 1.691 10 10 EDCE C[C@H](O)c1ccc(N2CC(CNC(N)=O)C2)cc1Br 2130741840 GXMHGQOMAJXEEP-QMMMGPOBSA-N 328.210 1.607 10 10 EDCE COCc1nnc(NC(=O)CNCc2cc(Cl)ccc2O)s1 1857856008 GCFNDBHWPKMNGY-UHFFFAOYSA-N 342.808 1.772 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](O)C[C@@H]2CO)cc1Br 2136089146 XFYQCWKKMLWROW-JLLWLGSASA-N 329.238 1.791 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)[C@](C)(O)C2)c(Br)c1 2136835869 ZSOHQAGAQZGDCM-CUOATXAZSA-N 329.238 1.791 10 10 EDCE C[C@H]1CN(C)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 235690209 YVROJIKQJCNAPQ-ISVAXAHUSA-N 339.237 1.541 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1985100623 IEARHZZWCMPUAH-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE CNc1nc[nH]c(=NCCOc2ccc(N)cc2)c1Br 2173901141 QVPVVEXXHDSGPE-UHFFFAOYSA-N 338.209 1.776 10 10 EDCE C[C@H]1CC[C@H](NC(=O)C(F)(F)F)CN1C(=O)c1ccc(O)c(O)c1 2054401435 RVHFIWCJGSKVFB-WPRPVWTQSA-N 346.305 1.769 10 10 EDCE N=c1cc(Br)[nH]c(=NCCc2ccc(O)c(O)c2)[nH]1 2091753520 ITLNDIKYMCLXBN-UHFFFAOYSA-N 325.166 1.139 10 10 EDCE CN(C[C@H]1CCS(=O)(=O)C1)c1ccc(CN)cc1Br 2092351428 CHDSSXUCRYBXNB-LLVKDONJSA-N 347.278 1.779 10 10 EDCE CCN(c1ccc(CO)cc1Br)[C@@H]1CC(=O)NC1=O 2114730087 PHBDITUPPMMFHA-LLVKDONJSA-N 327.178 1.183 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CC[C@@H]1COc1nnc(=N)[nH]n1)CC2 2213790186 QVYDTKQRLSBALN-SNVBAGLBSA-N 336.396 1.238 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)[C@H](O)CC2)cc1Br 2269122754 XQBVURCKCOKYLS-QCZZGDTMSA-N 330.222 1.824 10 10 EDCE O=C(O)CN1C(=O)C(=Cc2cc([N+](=O)[O-])ccc2O)SC1=S 2293058036 IQMOOQROQJKYOI-UHFFFAOYSA-N 340.338 1.586 10 10 EDCE COc1cc(C=C2C(=O)NC(=O)N(C(C)(C)C)C2=O)cc(OC)c1O 2297327064 SYVVUDNDLGUNAT-UHFFFAOYSA-N 348.355 1.670 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CCc3nnc(C(C)C)n3C2)c(O)c1O 182279272 LWGPWQSJGQMNEV-NSHDSACASA-N 330.388 1.866 10 10 EDCE Cc1ccc(CN2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)c(O)c1Br 2380803120 GIMJKZWMNDJHLN-SDBHATRESA-N 342.233 1.779 10 10 EDCE COCCNCC(=O)N(C)Cc1ccc(C)c(Br)c1O 2381130381 YFKTZFFRPNJVGA-UHFFFAOYSA-N 345.237 1.658 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1[C@@H](C)OC(C)(C)N1C(=O)OC(C)(C)C 808539266 YKTCZZXNVOPXKC-PWSUYJOCSA-N 343.376 1.448 10 10 EDCE COCCn1c([C@H]2COCCO2)nnc1N(C)Cc1ccccc1O 812117165 LRCMXLKCYJYBPI-OAHLLOKOSA-N 348.403 1.354 10 10 EDCE OC1=C(O)Cc2c3c(c4cc(O)c(O)cc4c2=C1)=CC(O)=C(O)C3 575448891 QZMQACSCDSVTCO-UHFFFAOYSA-N 326.304 1.579 10 10 EDCE O=C(c1ccncc1)N1CCOc2ccc(N3CCOCC3)cc2C1 581789058 KBUMSJLULUMMFJ-UHFFFAOYSA-N 339.395 1.953 10 10 EDCE COC(=O)[C@H]1[C@H]2C=C[C@@H](CC2)[C@H]1C(=O)NCc1ccc(O)c(O)c1 907059598 JVJONBNWVOLJEP-RKLWJJNISA-N 331.368 1.715 10 10 EDCE CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2cc3c(cc2O)OCO3)C1 842640580 AGZGHMRYDGLBDT-CQSZACIVSA-N 346.305 1.621 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@@H]2C[C@H]2C2CC2)cc1 929235927 FLFJFSZDBCPGIY-WBVHZDCISA-N 329.444 1.921 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc(C(N)=O)cn3C)C2)cc1 855231557 CKGVLMXDNRTGKJ-CYBMUJFWSA-N 342.399 1.141 10 10 EDCE Cc1cc(CN2CCN(S(C)(=O)=O)[C@H](C)C2)ccc1N(C)C 852529909 OCPKTHFSGMGRDW-CQSZACIVSA-N 325.478 1.527 10 10 EDCE Cc1cc(CNCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccn1 858135632 AONVELYIAJJVPV-UHFFFAOYSA-N 345.468 1.915 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)Cc2cn(C)nn2)c([N+](=O)[O-])c1 853860245 CYUUFQLSAVPARA-ALCCZGGFSA-N 331.332 1.546 10 10 EDCE COC[C@@H](NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)C1CC1 852226158 XDOYJOCPWGLRFX-RHSMWYFYSA-N 333.432 1.998 10 10 EDCE CN1CCN(c2ccc(CN3C[C@H]4C(=O)OC[C@H]4C3)cc2F)CC1 1118944328 XVVFBVIONAHYGF-HUUCEWRRSA-N 333.407 1.182 10 10 EDCE N[C@@H](CO)c1c(O)c(C(=O)O)cc2cc(Br)ccc12 72199908 ZNCCYCAGHYHADW-JTQLQIEISA-N 326.146 1.998 10 10 EDCE COC(=O)[C@H]1[C@@H](CNCc2ccc(N3CCOCC3)cc2)C1(F)F 894199672 BXTSDNKVRKMKQE-HUUCEWRRSA-N 340.370 1.667 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1895874835 CKZCOZMVHVNFPD-MXWKQRLJSA-N 325.369 1.580 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CCO[C@@H](c3nccn3C)C2)c(O)c1O 1161536424 VLQWMQLIMKKEFB-WCQYABFASA-N 331.372 1.790 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NCCCN=[N+]=[N-])C1 1963697297 BOFPJBILWRQVJU-NSHDSACASA-N 327.385 1.829 10 10 EDCE NCc1cc(F)c(N2CC[C@@H](NC(N)=O)C2)cc1Br 690786803 WGAJXULZTKJJSC-MRVPVSSYSA-N 331.189 1.294 10 10 EDCE CS(=O)(=O)NCCCNCc1ccc(Br)cc1O 691394020 YUFGHNSYGUFVDK-UHFFFAOYSA-N 337.239 1.184 10 10 EDCE OCCN1CCC[C@@H](NCc2cc(Br)cc(F)c2O)C1 715804072 LWULXQIOQYUUHR-GFCCVEGCSA-N 347.228 1.840 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H](C)CO3)CC2)c(OC)c1 1332170133 GKWCDOJUYCTMQX-DYVFJYSZSA-N 334.416 1.777 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2cc[n+]([O-])cc2)cc1C 1268780304 QPKSYOHVSNBXBP-UHFFFAOYSA-N 343.427 1.889 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cc(C)on2)cc1C 1272360030 AAXOUHRLOPSMKS-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H]2CCC2(F)F)cc1C 1507199464 CGTFAGFFRIMGEY-KGLIPLIRSA-N 342.386 1.616 10 10 EDCE CN(Cc1ccccc1)C(=O)CNC(=O)Cc1ccc(O)c(O)c1 1441867783 OZEBBVSHJBXETL-UHFFFAOYSA-N 328.368 1.415 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCc2noc3c2COCC3)cc1 1456134757 BJXFRMXUPSVMFA-UHFFFAOYSA-N 329.316 1.840 10 10 EDCE CCN(C)C(=O)[C@@H]1CSCN1C(=O)c1ccc(N=NC(N)=O)cc1 1464719436 ICQBLBVFTSWGFD-LBPRGKRZSA-N 349.416 1.842 10 10 EDCE CN(CCNCCn1cccn1)C(=O)c1ccc(N=NC(N)=O)cc1 1481322265 VAMRPNDFPSSZGC-UHFFFAOYSA-N 343.391 1.407 10 10 EDCE O=C(CNC(=O)Cc1ccc(O)c(O)c1)NCCc1ccccc1 1625672547 NBFCQGZALUDASH-UHFFFAOYSA-N 328.368 1.115 10 10 EDCE CC1CCN(c2ccc(CNC(=O)CN3CCOCC3)cc2)CC1 1627468161 WKQKQSRPZQDKJD-UHFFFAOYSA-N 331.460 1.871 10 10 EDCE CCOC(=O)c1cnn(C)c1NC(=O)CN[C@@H](C)c1ccccc1O 1560074927 LXEFDBFLRWHRKC-NSHDSACASA-N 346.387 1.592 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)C(C)(C)C(N)=O)cc1C 1496082457 DGVDLTPGMGJPSU-ZDUSSCGKSA-N 335.448 1.452 10 10 EDCE CCOC(=O)C1(CC(=O)NCc2ccc(O)c(O)c2)CCOCC1 1631434746 VQRILRDQYXHJLD-UHFFFAOYSA-N 337.372 1.464 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)/C=C\c1ccncn1 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CC(C)(C)OC(=O)N[C@H]1CC[C@@H]1NC(=O)c1cc(O)c(O)c(O)c1 2015121140 AOVSQLBJDHYNFB-UWVGGRQHSA-N 338.360 1.589 10 10 EDCE CNCc1ccc(N2CC3(C2)OCCC[C@@H]3O)c(Br)c1 2159651254 TYDILPNMHUTJNT-AWEZNQCLSA-N 341.249 1.899 10 10 EDCE NC[C@H]1CN(Cc2cc(Cl)cc(Br)c2O)CCO1 708090123 NMGIGTVEHZBBKG-JTQLQIEISA-N 335.629 1.968 10 10 EDCE C[C@@H](N)c1ccc(N2CCN([C@H](C)CO)CC2)c(Br)c1 2169361869 AFQZVQQBTKKJEB-VXGBXAGGSA-N 342.281 1.972 10 10 EDCE CC(C)(C)OC(=O)N[C@]12C[C@@H]1CN(C(=O)COc1ccc(N)cc1)C2 2044622169 ZHHBBBOGHUAKHD-XIKOKIGWSA-N 347.415 1.773 10 10 EDCE C[S@@](=O)CC1CN(c2ccc(CN)c(Br)c2F)C1 2047846459 FOEBMMIFOJTPTO-GOSISDBHSA-N 335.242 1.862 10 10 EDCE CN(C(=O)[C@@H]1C[C@@H](O)CCN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2080895582 CCVRBHQKSOGKPV-GJZGRUSLSA-N 349.431 1.992 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)c(Br)c2)[C@H]2COC[C@@H]12 2102140501 IQHBHXNSUXOSFW-KWCYVHTRSA-N 327.222 1.758 10 10 EDCE C[C@H](O)CN1CCN(c2ccc(CO)cc2Br)CC1 2113864120 MGBBTVOWPWEGJB-NSHDSACASA-N 329.238 1.444 10 10 EDCE CC(C)(C)OC(=O)NCc1n[nH]cc1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2214417664 AINYTZBSQZVDCF-SECBINFHSA-N 335.368 1.959 10 10 EDCE CC(C)(C)OC(=O)N[C@]12CO[C@](C(=O)NCCCN=[N+]=[N-])(C1)C2 2243113175 YBXRMFIYPQGYRJ-HDJSIYSDSA-N 325.369 1.629 10 10 EDCE COc1ccc(N(CCNC(=O)OC(C)(C)C)C[C@H](C)O)c(N)c1 2249012105 RELVVKSQOFOWRE-LBPRGKRZSA-N 339.436 1.989 10 10 EDCE O=C(O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccccn2)SC1=S 2293205525 RLHIQOSZYUOTEZ-QMMMGPOBSA-N 338.366 1.211 10 10 EDCE Cc1ccc(CN2CC(=O)NC(=O)[C@@H]2C)c(O)c1Br 2352940088 BNUNPQNCHUITFL-QMMMGPOBSA-N 327.178 1.310 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@H](O)[C@H]3C4)c(Br)cc2[C@@H]1O 2355623292 FTYCVHZLBYNCJY-BPFMKQPNSA-N 339.189 1.394 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CC[C@H](NS(C)(=O)=O)C2)c1O 177192302 SSZFRXSBWLPTCW-LBPRGKRZSA-N 346.836 1.372 10 10 EDCE CC(C)(C)NC(=O)CSc1nc(-c2ccco2)nc2cc(=O)[nH]n12 21537460 TXAQLVGXLJNTRL-UHFFFAOYSA-N 347.400 1.684 10 10 EDCE CN(Cc1ccccc1O)C(=O)N[C@H]1CCCN(c2cnn(C)c2)C1 74613732 BTCNPOFZWNEOCB-HNNXBMFYSA-N 343.431 1.936 10 10 EDCE CCS(=O)(=O)C1=NSC2=NC(=O)/C(=C/c3ccco3)C(=N)N21 96460319 XOEXUIIWIFLIEQ-YOULEHPWSA-N 338.370 1.291 10 10 EDCE COc1cccc(CN2CC(S(=O)(=O)NC3CCCC3)C2)c1O 378619448 VMDRRXDROQSWDV-UHFFFAOYSA-N 340.445 1.447 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 808508692 HLOUZSSXOJRHPZ-MRVPVSSYSA-N 329.692 1.717 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1 808497913 ICTHHPSZXKWJKI-UHFFFAOYSA-N 347.754 1.865 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3C[C@@H](C(N)=O)C3)ccc21 652795607 UYWFDAIBQPOTEK-GASCZTMLSA-N 343.427 1.898 10 10 EDCE CCOC[C@@H](O)CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 819200124 KPGACZBAPYWNHC-FQEVSTJZSA-N 347.503 1.706 10 10 EDCE Cc1cc(O)c(CN2CCN([C@@H]3CCNC(=O)CC3)CC2)cc1C 825148676 ZJSWVCSKANIHAS-KRWDZBQOSA-N 331.460 1.795 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CO[C@@H](CCC(=O)O)C1 901605316 QYUXRLGBNMPVQW-ZBFHGGJFSA-N 334.416 1.981 10 10 EDCE CN(C)S(=O)(=O)N(C)c1cccc2c1C(=O)c1ccccc1C2=O 586233226 DGIUGBFWSPDVFO-UHFFFAOYSA-N 344.392 1.705 10 10 EDCE CC(C)N(C[C@H](C)O)C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 839289013 USJLWKAUJVJYCC-AWEZNQCLSA-N 335.448 1.329 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@]2(CCNC2)C1 844224894 KKTFDZVSLQYUNF-HXUWFJFHSA-N 344.503 1.787 10 10 EDCE C[C@H](NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)[C@@H]1[C@H]2CN[C@H]1C2 925485498 NTJCKQRPJFAKCY-FVNRHKFKSA-N 342.487 1.474 10 10 EDCE Cc1ccc(C(=O)N[C@]2(C(=O)OC(C)(C)C)CCOC2)c(O)c1O 855641358 WUCOEUZZYIZMJZ-QGZVFWFLSA-N 337.372 1.637 10 10 EDCE CCn1cncc1S(=O)(=O)NCc1ccc(N(C)C)c(F)c1 751244287 BACAYDXACSKIKV-UHFFFAOYSA-N 326.397 1.587 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](NC(C)=O)C3)C2)cc1 852447837 FLJJRMZDTLPCDX-GJZGRUSLSA-N 346.431 1.194 10 10 EDCE COC[C@H](C)OC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 866564088 VPHYVXVWFSNSQQ-ZFWWWQNUSA-N 349.431 1.649 10 10 EDCE C[C@H](CN1CCOCC1)C(=O)NCc1ccc2cccnc2c1O 862026958 FHHWYGYNLYVUMI-CYBMUJFWSA-N 329.400 1.525 10 10 EDCE COc1c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cnn1C 1118737782 MFGWYADZZKOGFL-UHFFFAOYSA-N 344.415 1.320 10 10 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10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2nnn(C)c2C)cc1C 1699241272 KDDWEVPKCKRHPX-WAYWQWQTSA-N 343.431 1.516 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCC4(COC4)C3)c(Br)cc21 1915845453 OECSOYNWRBCBHK-LBPRGKRZSA-N 338.205 1.628 10 10 EDCE CC(C)(C)OC(=O)NC1(CNCc2ccc(F)cc2O)COC1 1967807942 KPZMUTZXTAUDRV-UHFFFAOYSA-N 326.368 1.915 10 10 EDCE C[C@]1(C(=O)O)COCCN1Cc1cc(Br)ccc1O 2136512630 TUOPFVKOOHHLNY-CYBMUJFWSA-N 330.178 1.830 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)NCC1(CN=[N+]=[N-])CC1 1985093687 CXVCTDFYTANIGC-UHFFFAOYSA-N 327.385 1.423 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NC(=O)c1cccc(O)c1O 2006284439 OEXOVXXQZILTEV-QWRGUYRKSA-N 338.360 1.120 10 10 EDCE NCc1ccc(N2CC[C@@H]3C(=O)NC(=O)[C@H]3C2)c(Br)c1 2158786474 WJYWOSQEAKLWNP-UWVGGRQHSA-N 338.205 1.007 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](CO)C2)cc1Br 316975201 IWVZPVCHRVIDER-RULNRJAQSA-N 329.238 1.519 10 10 EDCE CN(Cc1cnn(C)c1Br)C(=O)c1ccc(O)c(O)c1 2173266436 QZLCXYJVRVSCOH-UHFFFAOYSA-N 340.177 1.866 10 10 EDCE CCNCc1ccc(N(C)C[C@H](O)CN(C)C)cc1Br 690256775 ONJSXNHWQHNSGY-CQSZACIVSA-N 344.297 1.917 10 10 EDCE OC[C@@H](O)C1(NCc2cc(Cl)cc(Br)c2O)CC1 2069747843 XRJQUUZVJMHERS-SNVBAGLBSA-N 336.613 1.784 10 10 EDCE O=C1C[C@]2(CCN(c3ccc(CO)cc3Br)C2)CN1 2107032565 OFJAUNGLWGTCAQ-CQSZACIVSA-N 325.206 1.658 10 10 EDCE O=C(O)[C@H]1C[C@H](O)CCN1Cc1cc(Br)cc(F)c1O 2201087811 BUTSGOKUDCAONI-MWLCHTKSSA-N 348.168 1.704 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(NC(=O)c2cccc(O)c2O)C1 2216767649 KVLXQFLRULWPFF-DYZYQPBXSA-N 334.372 1.837 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@H]3COC[C@H]32)c1O 2236089390 DAMVOMIYRPDCND-YPMHNXCESA-N 344.205 1.763 10 10 EDCE COc1ccc(Br)c(CNCCc2ncno2)c1O 2227747288 YJHZBLQXJFAHPU-UHFFFAOYSA-N 328.166 1.879 10 10 EDCE N[C@@H]1[C@H]2C[C@@H](CN(Cc3c(O)cccc3Br)C2)[C@@H]1CO 2239338549 PNJYODBWJQUOOZ-PCVQNBPASA-N 341.249 1.542 10 10 EDCE CSc1ncc(CNC(=O)N[C@H](CC(=O)O)C(F)F)s1 2284503447 CFWHTNOZYNEZMA-ZCFIWIBFSA-N 325.362 1.773 10 10 EDCE COCCCN/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O 101346784 NRHPBVOPESTUCE-FMIVXFBMSA-N 337.763 1.433 10 10 EDCE CC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 132918796 QPPZEBLMODKPBJ-AWEZNQCLSA-N 325.409 1.429 10 10 EDCE CO[C@H]1C[C@@H](c2nc(C)no2)N(Cc2cc([N+](=O)[O-])ccc2O)C1 190101862 VICHFCUAWKGBBA-STQMWFEESA-N 334.332 1.954 10 10 EDCE O=C(CCn1c(=O)oc2ccccc21)NCCc1ccc(O)c(O)c1 96968141 NWAQGXPVJIJDHU-UHFFFAOYSA-N 342.351 1.755 10 10 EDCE CC1(C)CN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CCN1 254992994 QLTKKRSZQSEMLD-YVMONPNESA-N 329.444 1.747 10 10 EDCE CN(C)S(=O)(=O)N1CCCN(Cc2cc(Cl)ccc2O)CC1 368226903 OHPJXKNAGGPQLG-UHFFFAOYSA-N 347.868 1.360 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CC(=O)N(C)[C@@H](C)C2)cc1 282680851 WJNLUMVZGKFXCI-AWEZNQCLSA-N 332.448 1.905 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@H](n3cc(CO)nn3)C2)c1 293556516 FNDDIYBVXZWYBG-HNNXBMFYSA-N 332.404 1.712 10 10 EDCE COC[C@]1(C(=O)O)CCCN1Cc1ccc(N2CCN(C)CC2)cc1 818629558 HOCGHVOJTDWBQO-IBGZPJMESA-N 347.459 1.504 10 10 EDCE CCOC(=O)C[C@H](CO)NC(=O)c1cc(C)n(-c2ccccn2)c1C 820048607 ANQXMPYRSUSZHU-CQSZACIVSA-N 345.399 1.533 10 10 EDCE C[C@@H](NC(=O)CC1(O)CCOCC1)c1ccc(N2CCOCC2)cc1 906418889 CZGMZGFRFRXERS-OAHLLOKOSA-N 348.443 1.632 10 10 EDCE C[C@@]1(C(=O)NCc2ccc(N3CCCC3)cc2)CCCS1(=O)=O 906108873 DEXHWWOPJGBSEP-KRWDZBQOSA-N 336.457 1.870 10 10 EDCE C[C@H](NC(=O)N[C@@H](CO)c1ccnn1C)c1ccc(N(C)C)cc1 838560573 XTMZMLWDDXYLKJ-WFASDCNBSA-N 331.420 1.580 10 10 EDCE COCCN1CCC[C@H]1CNC(=O)NCc1cc(Cl)ccc1O 844969789 WFDBMUQBNZARRM-AWEZNQCLSA-N 341.839 1.956 10 10 EDCE C[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)cc2)[C@H](C)CN1CCO 841891112 IUQBHYGECJJWPK-QZTJIDSGSA-N 346.519 1.325 10 10 EDCE C[C@@H](NC(=O)C(=O)NCCC1(CN)CC1)c1ccc(N(C)C)cc1 846344060 NSGTZERKLKFIPQ-CYBMUJFWSA-N 332.448 1.175 10 10 EDCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cc(C)c(C)cc1O 747830518 WBAXXIFGTUZZRD-JHNDHUHGSA-N 347.411 1.934 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCCCn1ccnn1 840343917 FVPZUTPJEUNDLB-HNNXBMFYSA-N 344.463 1.973 10 10 EDCE CCN(CC)c1ccc(CNC[C@@H](O)CS(C)(=O)=O)cc1F 922820890 HIQKFGAAFWWEQI-CYBMUJFWSA-N 332.441 1.167 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN(C)S1(=O)=O 843819645 DIYOYLMWAYZBIA-AWEZNQCLSA-N 326.418 1.165 10 10 EDCE CC(C)OC[C@H](N)C(=O)NCc1ccc(N2CCSCC2)cc1 852790057 NSBWTYOBJOBBAL-INIZCTEOSA-N 337.489 1.608 10 10 EDCE CC(C)n1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)nn1 856216629 ZIEQFCLTQHBHDG-UHFFFAOYSA-N 343.431 1.750 10 10 EDCE NC(=O)C1CCN(c2ccc(CNCc3ccnc(O)c3)cc2)CC1 922337206 AFCTWHDVUCRPIK-UHFFFAOYSA-N 340.427 1.779 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H]4[C@@H](CO)[C@@H]4C3)C2)cc1 854296553 DXFZIHBSZHGTKE-KKBVYLPWSA-N 331.416 1.154 10 10 EDCE C[C@H](NC[C@@H](O)CC1(O)CCC1)c1ccc(N2CCOCC2)cc1 859230356 VEAFOFDRBKJDHP-YJBOKZPZSA-N 334.460 1.840 10 10 EDCE C[C@@H](NC(=O)Cc1ccnn1C)c1ccc(N2CCOCC2)cc1 766483947 IJDGULDBISBXIG-CQSZACIVSA-N 328.416 1.677 10 10 EDCE C[C@@H]1O[C@H](C)[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H]1C 863001297 FXIHVIDLANEYJT-RZGXBDKHSA-N 342.417 1.305 10 10 EDCE COC(=O)[C@@H]1CO[C@H](CCC(=O)NCc2ccc(N(C)C)cc2)C1 873829935 YGHSRHJCDHPDSX-GOEBONIOSA-N 334.416 1.727 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CCO1 776237758 IJFXSWPDQAIVGF-WFASDCNBSA-N 335.404 1.397 10 10 EDCE CC1(C)COC[C@@H]1NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 894384096 CWUPUUXAGPQBAH-RDJZCZTQSA-N 331.460 1.903 10 10 EDCE CCCN(CCC)c1ccc(CN2C[C@H](C(N)=O)[C@@H](C(N)=O)C2)cc1 895314244 KDJQQZBLYXZBBW-IRXDYDNUSA-N 346.475 1.332 10 10 EDCE O=C(NCc1c(O)cccc1O)c1csc(-c2ncccn2)n1 1304050368 LTARPBBZZKRSPE-UHFFFAOYSA-N 328.353 1.941 10 10 EDCE CN(C)c1ccc(CNc2ccc3nc(N)nn3c2C(=O)O)cc1 82729850 ARQYYZGNCKVVOV-UHFFFAOYSA-N 326.360 1.688 10 10 EDCE O=C(NC[C@@H]1CCC2(CCC2)CO1)C(=O)N1Cc2cccc(O)c2C1 1331887932 VMUXRSSNTZZUGJ-AWEZNQCLSA-N 344.411 1.700 10 10 EDCE CN(C)c1ccc(/C=C\CNCCN2C[C@H](C(=O)O)CC2=O)cc1 1339240538 KDKZSUQUPDWZKP-ABCZVMIZSA-N 331.416 1.289 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@@H]2CCN(C)C(=O)C2)cc1C 1266948945 RUWNZJFWQXHPMP-GOEBONIOSA-N 347.459 1.466 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2c(C)nc(O)nc2S)c1 1445970832 QPNIUBKFWGCTTJ-ZETCQYMHSA-N 335.385 1.985 10 10 EDCE COC1CCN(c2ccc(CN3CC[C@H](NC(N)=O)C3)cc2)CC1 1473349110 PGNURFUJIKUVFU-HNNXBMFYSA-N 332.448 1.544 10 10 EDCE O=[N+]([O-])c1c(NCc2c(O)cccc2F)ncnc1N1CCOCC1 1612950883 YQALOJBBBWFWEP-UHFFFAOYSA-N 349.322 1.678 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C2CCCC2)cc(OC)n1 1704003868 BHHFXYOYQNACAE-LLVKDONJSA-N 335.404 1.524 10 10 EDCE CCC(=O)NCC(=O)N1CCC[C@H]1CNCc1ccc(OC)c(C)c1 1483925163 OUEFBGNYKDSJOL-INIZCTEOSA-N 347.459 1.610 10 10 EDCE CNC(=O)N[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 1624819257 GNDBUMRGZBLLOH-CQSZACIVSA-N 341.415 1.633 10 10 EDCE CC[C@H](CNC(=O)[C@H]1COCCO1)NCc1ccc(OC)c(C)c1 1714061300 VTWYJDGRGUVGKP-NVXWUHKLSA-N 336.432 1.403 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cc3cnc[nH]3)CC2)cc1C 1499361815 HSFFCKJPBJGQTN-UHFFFAOYSA-N 328.416 1.708 10 10 EDCE CC[C@H](O)Cn1cc(C(=O)N[C@H](C)c2cc(OC)ccc2O)nn1 1631541852 BIPMSECINYYIDR-MNOVXSKESA-N 334.376 1.254 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)CCNC(N)=O)cc1C 1725134002 UUDLLSJMASCTEA-CHWSQXEVSA-N 336.436 1.045 10 10 EDCE C[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 1634435580 PABHKJDQUGLJKE-JMSVASOKSA-N 339.461 1.546 10 10 EDCE Cc1nc(O)nc(S)c1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 1632681063 MCMPYUDOVXLMQA-ZETCQYMHSA-N 335.385 1.552 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1ccc(C(=O)OC)n1 1640260246 XHLVCOHVUPFJNH-UHFFFAOYSA-N 338.360 1.177 10 10 EDCE COCc1ccc([C@@H]2COCCN2C(=O)Cc2ccc(O)c(O)c2)o1 1645044007 RMQWTWJXSVYEQU-AWEZNQCLSA-N 347.367 1.980 10 10 EDCE COc1c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c2c1=O 14647251 XWTLYULBWZQAAZ-UHFFFAOYSA-N 332.264 1.997 10 10 EDCE biogenic,in-vitro COCc1nnc(NC(=O)CNCc2ccc(N(C)C)cc2)s1 1857852258 OVSWYZDQMZVSEU-UHFFFAOYSA-N 335.433 1.479 10 10 EDCE CNCc1ccc(N2CCN3C(=O)NC[C@H]3C2)cc1Br 234430017 OUMYDLFZPJLDLJ-LBPRGKRZSA-N 339.237 1.382 10 10 EDCE CC(C)NCc1ccc(N2C[C@H](O)[C@H](O)C2)cc1Br 232652557 NVQWPHVKNANSKI-OKILXGFUSA-N 329.238 1.489 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)CC[C@H]1O 253209611 ZDJJWGCNNXJVNX-BLBGDKDGSA-N 340.221 1.608 10 10 EDCE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCN=[N+]=[N-] 1985102855 MSYKVVWKLDOMDK-SECBINFHSA-N 329.357 1.259 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)COc2ccc(N)cc2)C1 1999491979 LALGCOWCUAISHC-CYBMUJFWSA-N 335.404 1.773 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C(Nc3c(N)cccc3C(N)=O)[C@H]2C1 2000889918 VMDNZTXTEWCLIO-QWRGUYRKSA-N 332.404 1.645 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H](O)C(F)(F)C3)c(Br)cc21 2152098631 PTSGYRKPYWDWPL-NXEZZACHSA-N 348.147 1.217 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010405071 FYZSDGRZGZWNKZ-IJLUTSLNSA-N 339.396 1.516 10 10 EDCE C[C@H](CN(C)C(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 2015124207 AGORJCNLDYVCEI-SECBINFHSA-N 340.376 1.789 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H]1NC(=O)c1cc(O)c(O)c(O)c1 2015124137 ZKECBXRXKGPCAP-VHSXEESVSA-N 338.360 1.446 10 10 EDCE C[C@H](N)c1ccc(N2CCN3C[C@H](O)C[C@@H]3C2)c(Br)c1 405535588 ZPVVOVKNQDMIKG-CYZMBNFOSA-N 340.265 1.724 10 10 EDCE CCCN1C(=O)C(=CNc2cc([N+](=O)[O-])ccc2C)C(=O)NC1=S 2053511295 NOEQMTJSDWJPKA-UHFFFAOYSA-N 348.384 1.852 10 10 EDCE CNCc1ccc(N2CC[C@@]3(CNC(=O)C3)C2)c(Br)c1 2163345225 WKQFQFHLQZAGDK-OAHLLOKOSA-N 338.249 1.885 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@@H](O)[C@@H](CO)C2)cc1Br 396819003 WBFANLLYDNUCAX-UEKVPHQBSA-N 343.265 1.909 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@](C)(O)c3cccs3)c2n1 2062382388 WKQOEVBHALCQSG-HNNXBMFYSA-N 332.385 1.442 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)cc1Br 2178087060 OYPBZGSEPPCXSQ-MJVIGCOGSA-N 342.233 1.946 10 10 EDCE CCOC(=O)c1c(C(F)(F)F)nn2c(O)cc(CC(=O)O)nc12 2080935073 FWEJBEDQGUTMPH-UHFFFAOYSA-N 333.222 1.258 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](N(C)C)[C@H](O)C2)c(Br)c1 2089925580 DNBYXGQAUAXHAV-BIGNPOOSSA-N 328.254 1.580 10 10 EDCE CN[C@@H](c1ccccc1O)[C@H](O)c1nn(C)cc1Br 2093828205 AFVZNFPZGMDUBC-AAEUAGOBSA-N 326.194 1.882 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H](O)C34CCC4)c(Br)cc21 2201413677 QNOUSVRYABICQI-NEPJUHHUSA-N 338.205 1.505 10 10 EDCE CSc1ncc(CN=c2cc(Br)[nH]c(=N)[nH]2)s1 2248699764 FIIQNDBQEBMKBG-UHFFFAOYSA-N 332.252 1.864 10 10 EDCE Cn1cccc1C=C1SC(=S)N([C@H](CC(=O)O)C(=O)O)C1=O 2293039473 ATTLQCXMUVMLOD-MRVPVSSYSA-N 340.382 1.154 10 10 EDCE CC(=O)NN1C(=O)C(=Cc2cc([N+](=O)[O-])ccc2O)SC1=S 2314717037 IFYJAJJMBVEXJL-UHFFFAOYSA-N 339.354 1.553 10 10 EDCE Cc1ccc(CN2CCOC[C@@H]2C(=O)O)c(O)c1Br 2352689620 YXYQYAIMICVAFD-SNVBAGLBSA-N 330.178 1.749 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](C)NC(N)=O)c(O)c1Br 2352932540 OGDYTAVPQYSNNP-SSDOTTSWSA-N 330.182 1.136 10 10 EDCE Cc1ccc(CN2C[C@H]3C[C@H]2CS3(=O)=O)c(O)c1Br 2352946964 FDYKCLDKDRGSKN-WDEREUQCSA-N 346.246 1.834 10 10 EDCE CC(C)c1nc2n(n1)C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)CC2 181186329 RLZUJRMNAYHHRC-FLUIGGAXSA-N 342.399 1.957 10 10 EDCE Cc1cc(C(=O)N2CCN(C(=O)CO)CC2)c(C)n1-c1ccccc1 128729337 TZOWWBWNDISHPE-UHFFFAOYSA-N 341.411 1.371 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCCO2)N2CCOCC2)cc1 36100170 XQCZFMNQUWPEFR-ZWKOTPCHSA-N 347.459 1.421 10 10 EDCE CCOC(=O)C1(O)CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 272635766 LAHPMZVAUUTGKG-GQCTYLIASA-N 335.356 1.028 10 10 EDCE COc1ccc(O)c(CNCc2cccc(N3CCOCC3)n2)c1 274941723 QLQGPMMOXHIYOH-UHFFFAOYSA-N 329.400 1.922 10 10 EDCE O=C1CCC[C@H](C(=O)NCc2cc(Br)ccc2O)N1 804738155 FCGBSBUUYWFVHB-SNVBAGLBSA-N 327.178 1.440 10 10 EDCE COC(=O)C[C@@H](C)C(=O)NCc1cc(Br)ccc1O 804734653 VJNOHNZZMDQSBF-MRVPVSSYSA-N 330.178 1.970 10 10 EDCE CCN1CC[C@H](NC(=O)NCCCSc2nccs2)C1=O 802244642 YTNYNITUTCTTGR-JTQLQIEISA-N 328.463 1.545 10 10 EDCE CC[S@](=O)CCNC(=O)NCc1cc(Br)ccc1O 805125512 MXSKXSUJFVTCBH-IBGZPJMESA-N 349.250 1.723 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H](C[C@H]2CCCOC2)C(=O)O)cc1 908758382 JSIFLLCSTGLKPV-GDBMZVCRSA-N 349.431 1.822 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)C[C@H](C)c2nn[nH]n2)c([N+](=O)[O-])c1 588459567 SWZUKVBFKIVYPF-BXKUYDPTSA-N 346.347 1.534 10 10 EDCE O=C(NCC1=CCNCC1)NCc1cc(Br)ccc1O 841973122 MNBJNWMSERVSDZ-UHFFFAOYSA-N 340.221 1.874 10 10 EDCE COC[C@H]1CCN1Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O 840084855 WSVKINQAMPOQTH-GOSISDBHSA-N 348.443 1.648 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](C)Cn2cncn2)cc1 844940122 OMKXZYOOQZGDKH-AWEZNQCLSA-N 346.435 1.453 10 10 EDCE Cc1cc(CC(=O)N2CC3(CNC(=O)O3)C2)c(C)n1-c1ccccc1 854967561 DAIUGWJNVHCUCQ-UHFFFAOYSA-N 339.395 1.957 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CCC[C@@H]3O)C2)cc1 854296030 AHCJPKAMBTYXBI-KEYYUXOJSA-N 333.432 1.734 10 10 EDCE NCC1(NC(=O)NCc2ccc(N3CCCC3)cc2)CCOCC1 861556769 HLAJGBNXNBPDTK-UHFFFAOYSA-N 332.448 1.594 10 10 EDCE Cc1cc(Br)c(O)c(CNC[C@]2(O)CCN(C)C2)c1 762567143 AUGBZYOVMVGWDS-CQSZACIVSA-N 329.238 1.619 10 10 EDCE CN1CCCc2cc(CNC[C@@H](O)CC3(O)CCOCC3)ccc21 872198929 CXAFGSIMRJEFDU-KRWDZBQOSA-N 334.460 1.451 10 10 EDCE CC(=O)N1CCN(c2ccc(CNc3ncc(C=O)cn3)cc2)CC1 882239712 FQBVJTCOQREPGC-UHFFFAOYSA-N 339.399 1.570 10 10 EDCE COc1ccc(CNC(=O)C(=O)Nc2cn(C)nc2C(C)C)c(O)c1 797390747 PSAIIJNPTGJQPJ-UHFFFAOYSA-N 346.387 1.513 10 10 EDCE O=C(CNC(=O)c1ccccc1Cl)NCc1cc(O)ccc1O 1303223194 DYZZNGSQNHJDRH-UHFFFAOYSA-N 334.759 1.797 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2CCCNC2=O)c1O 1964043472 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336.275 1.840 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3NC(=O)O[C@H]3C2)c(Br)c1 2120416772 QHVCXUDHCYGXNG-VHRDEZTHSA-N 327.178 1.799 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H]2CCC(=O)N2C)cc1C 1485911049 LOXNADZVDKVEEH-HOCLYGCPSA-N 347.459 1.561 10 10 EDCE Cc1cn2nc(C(=O)NCc3ccc(N(C)C)cc3)cc2c(=O)[nH]1 1628708131 INUXTEMRSXQJFF-UHFFFAOYSA-N 325.372 1.327 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)COCC(F)F)C2)cc1C 1490833131 UWPXHLHJRAUKSQ-AWEZNQCLSA-N 342.386 1.976 10 10 EDCE CCC(=O)N[C@H](C)C(=O)N[C@H]1C[C@H](NCc2ccc(OC)c(C)c2)C1 1490894045 YJFPCOVBUUMTTN-FVQBIDKESA-N 347.459 1.655 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N(CCNC(=O)C2CC2)C2CC2)cc1 1721221539 XQCXWUGVEWPORI-UHFFFAOYSA-N 343.387 1.980 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2cncnc2)cc1C 1569930671 BPHDGSJAWMDNPN-UHFFFAOYSA-N 344.415 1.018 10 10 EDCE Cc1ccc(CNC(=O)NCC(=O)NCc2ccc(O)cc2O)cc1 1638352891 WKWUUOSCSZGKAG-UHFFFAOYSA-N 343.383 1.522 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@@H]2CCCCO2)cc1 1736718524 ZKJTUAIUVUNZNP-ZDUSSCGKSA-N 347.375 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CCC(CC)NC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 826617633 ZQHQAPYAJDSYER-AWEZNQCLSA-N 333.432 1.695 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCN(CC(=O)NC3CC3)CC2)cc1 835025757 MVHZXCSYCZGESH-ONEGZZNKSA-N 342.487 1.662 10 10 EDCE COc1cc(N2CCN(C(=O)Nc3ccc(N)cc3)CC2)ncn1 841295724 DKPJGZXBEBTHSB-UHFFFAOYSA-N 328.376 1.422 10 10 EDCE COC(=O)[C@H]1CSCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 840567566 VOBFAIHCGUJLMR-OGOUPESXSA-N 337.397 1.476 10 10 EDCE CCN1C[C@H](CN2CCN(c3ccc(OC)c(F)c3)CC2)OC1=O 846813657 IEQQSEGONQQWJC-AWEZNQCLSA-N 337.395 1.797 10 10 EDCE O=C(NCc1c(O)cccc1F)NC[C@@H]1CCCS(=O)(=O)C1 922482504 MYASJJSJHQNYHL-JTQLQIEISA-N 330.381 1.155 10 10 EDCE COCC[C@H](C)S(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849415665 DLRPCYJCMDARGO-KBPBESRZSA-N 342.461 1.618 10 10 EDCE O=C(NCc1c(O)cccc1F)NC[C@@H]1CC2(CCOCC2)CO1 923908330 PYHGRZHLUNYPCY-LBPRGKRZSA-N 338.379 1.916 10 10 EDCE COc1ccc(F)c(NC(=O)C(=O)NCc2cccc(OC)c2O)c1 756182639 VWMIOBOZTOUJMD-UHFFFAOYSA-N 348.330 1.803 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CN1 861768063 WAMWNZSABSFJDJ-NFAWXSAZSA-N 332.448 1.187 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1C[C@H]1C(C)C 1116669151 IDHSPIXXUVSCBX-IHRRRGAJSA-N 335.400 1.980 10 10 EDCE COC(=O)c1c(CN[C@@H]2CC[C@H](C(N)=O)C2)c2cc(F)ccc2n1C 894939972 KSZGJROYGGOJGK-CMPLNLGQSA-N 347.390 1.848 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1895876758 YIPFGQOXENMIDY-VWYCJHECSA-N 325.369 1.268 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@H]2C[C@H]2C(N)=O)C(C)C)cc1C 1319942948 FYBOOASNMDAXHI-OWCLPIDISA-N 347.459 1.355 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H]2COCCO2)cc1C 1322420618 OYYIMRISHLPFHM-QGZVFWFLSA-N 336.432 1.357 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3C[C@H]4CCC[C@@H]43)ccc21 1340602642 IMEKYHPYMYMQLN-HYVNUMGLSA-N 341.455 1.990 10 10 EDCE CC(C)NCc1ccc(N2CC(O)(CO)C2)c(Br)c1 2115304286 VVTLXDMTDPONCW-UHFFFAOYSA-N 329.238 1.491 10 10 EDCE OCc1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)cc1Br 2121590870 GILHLYUUMSISSF-OSMZGAPFSA-N 328.206 1.385 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)CS(C)(=O)=O)cc1C 1716124896 OWEIHQZWEPTTOM-CYBMUJFWSA-N 342.461 1.033 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2cnnn2C)cc1C 1716539163 UXBHHCAWLAVHDH-UHFFFAOYSA-N 331.420 1.384 10 10 EDCE COCCCN(C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1569152528 CQVMSVVCPKNCGH-LBPRGKRZSA-N 335.408 1.936 10 10 EDCE CC(C)(C)OC(=O)[C@@]1(NC(=O)Cc2ccc(O)c(O)c2)CCOC1 1640947600 OLORVYLHWHXHLK-QGZVFWFLSA-N 337.372 1.257 10 10 EDCE CO[C@H](C)CNC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1733265378 VSMLXDDCAISWMJ-LLVKDONJSA-N 333.392 1.736 10 10 EDCE C[C@@H](Sc1ccccc1C(=O)NCc1c(O)cccc1O)C(N)=O 1645363448 VNWOLMMWQSKBIA-SNVBAGLBSA-N 346.408 1.994 10 10 EDCE CCn1cnnc1Cn1c(C)nnc1N(C)Cc1ccccc1O 1765351274 UOIJBOOBQLVWPZ-UHFFFAOYSA-N 327.392 1.588 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)[C@@H]2CCN(C)C2=O)c([N+](=O)[O-])c1 1773121642 NVFFVCOJWRIAQE-SCXUMTSISA-N 333.344 1.448 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)C(C)(C)CO 126548326 GLGIUQQWVCEMJF-NSHDSACASA-N 328.210 1.608 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)N1CC[C@H](N=[N+]=[N-])C1 1985100258 DKDRHQDTKOOTKQ-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 1985103287 SJXKRNWMHDFEAX-QWRGUYRKSA-N 327.385 1.421 10 10 EDCE Nc1cc2c(cc1N1CC(CNC(=O)C(F)(F)F)C1)OCCO2 1999525360 LNISDEWYUQKXEX-UHFFFAOYSA-N 331.294 1.155 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2010396950 QERMTCIAGNHJKV-RYUDHWBXSA-N 341.412 1.811 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010393787 XPECKAKEIPGZAM-VXGBXAGGSA-N 341.412 1.954 10 10 EDCE C[C@@H](OCc1ccccc1)[C@H](N)C(=O)NCCc1ccc(O)c(O)c1 2031086715 LKHXGFOXXBXHGG-ACJLOTCBSA-N 344.411 1.689 10 10 EDCE CSC1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2036371007 RGCWSGAYAVJKLD-NSHDSACASA-N 329.219 1.986 10 10 EDCE CCNCc1ccc(N2CC(OC)(C(N)=O)C2)cc1Br 2161186211 ZCXDRWUKUWUFFM-UHFFFAOYSA-N 342.237 1.249 10 10 EDCE CC[C@H](NCCc1nn[nH]n1)c1cc(Br)ccc1O 388702905 FWTLAVPUOWWEER-JTQLQIEISA-N 326.198 1.951 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@H]1CCN(C2COC2)C1 2169579071 HJRCDQSSIKZLCL-NSHDSACASA-N 345.212 1.857 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)c(Br)c1 2182555785 WSPDHYHJRLKELL-GMBDUWKCSA-N 342.233 1.680 10 10 EDCE N[C@@H]1CC(C(=O)N2CCCc3ccc(Br)cc32)=C[C@H]1O 2188018579 DSOHFDOACWWQRE-TZMCWYRMSA-N 337.217 1.747 10 10 EDCE Cc1ccc(N(C)C(=O)C2=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C2)cn1 2080944482 YNFMUKWJJCMZEO-HUUCEWRRSA-N 347.415 1.937 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1CO[C@@H]2COC[C@@H]21 2101846072 GBUCDRFJQAOOCW-GLXFQSAKSA-N 328.206 1.906 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)cc1Br 2102181150 NLBQEDUDWLPGEV-BNOWGMLFSA-N 327.222 1.364 10 10 EDCE CSc1ncc(CNS(=O)(=O)[C@H]2CNC3(CCC3)C2)s1 2284498587 MSPANAWBEPUPLA-SNVBAGLBSA-N 333.504 1.569 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@@H](O)CC2)cc1Br 2284552528 PAAPKYDYJHTCGX-GJZGRUSLSA-N 343.265 1.881 10 10 EDCE C[C@@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@H]3O)c(Br)c1 2357057244 VSHVOIBIAJWZBJ-CNSIFVFBSA-N 341.249 1.932 10 10 EDCE NCc1cc(F)c(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2357592998 QPUVPPHNKUMKCM-DQRILILZSA-N 345.212 1.367 10 10 EDCE Cc1cc(C(=O)N[C@H]2CCC(=O)N(C)C2)c(C)n1-c1ccccn1 131159660 NVXQQDMFRLZTOC-AWEZNQCLSA-N 326.400 1.840 10 10 EDCE O=C(C1CCOCC1)N1CCN(c2ccc3c(c2)OCCO3)CC1 243279214 KZMDTKATCOPVTP-UHFFFAOYSA-N 332.400 1.533 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)NCC[C@@H]3CCOC3)ccc21 803687180 WPQCBHCLLYRJDK-CQSZACIVSA-N 345.443 1.228 10 10 EDCE CC(=O)C(=O)COC(=O)CN1c2cccc3cccc(c23)S1(=O)=O 808495743 XFCCFVGAZKJNLF-UHFFFAOYSA-N 347.348 1.050 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CCOC[C@H]2N)c(O)c1Br 2380745242 HWAZIVWFOJWZMJ-WDEREUQCSA-N 343.221 1.443 10 10 EDCE CC(=O)N[C@H](C(=O)NCc1cc(Br)ccc1O)C(C)C 804736409 VBKCIPKPQKVTGP-ZDUSSCGKSA-N 343.221 1.932 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](O)C(C)(C)N)c(O)c1Br 2381134303 ANHWBFZMQKRJJJ-GFCCVEGCSA-N 345.237 1.520 10 10 EDCE Cc1ccc(CN2C[C@H](O)CC[C@@H]2C(=O)O)c(O)c1Br 2381136296 DGANPSQLZPVDJE-GHMZBOCLSA-N 344.205 1.873 10 10 EDCE CC(=O)N[C@@H](CC(=O)OCC(=O)C(C)=O)c1ccc(F)cc1F 808520610 VIUANTJRAYZNIG-ZDUSSCGKSA-N 327.283 1.233 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H](C[C@@H]2CCCO2)C(=O)O)cc1 908759105 YUUBZYMCFAGNNH-LSDHHAIUSA-N 335.404 1.574 10 10 EDCE Cn1nncc1CC(=O)NCc1cccc(Br)c1O 834476210 RHGHGSNLGDTKCE-UHFFFAOYSA-N 325.166 1.142 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(C(=O)O)CCOCC1 911117991 HLKPZAYTYROWCK-UHFFFAOYSA-N 334.416 1.983 10 10 EDCE Cc1cc(Cl)cc(CN2CCC[C@@H](C(=O)NCCN)C2)c1O 843048030 JPAJVEJYTZELFO-GFCCVEGCSA-N 325.840 1.641 10 10 EDCE CN(C)c1ccc(CNC(=O)NCc2noc3c2COCC3)cc1 913926448 CWNWFOZZZWYTNT-UHFFFAOYSA-N 330.388 1.813 10 10 EDCE Cc1cn(C)nc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 850380462 GJCKJVJIZLKVQF-UHFFFAOYSA-N 339.399 1.360 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cc3cn(C)nc3C)C2)cc1 855224026 JXMQHYBIGFSCHI-OAHLLOKOSA-N 328.416 1.675 10 10 EDCE C/C=C\CNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 863120871 UQDYLVJGHTVWOA-RTAKVZRXSA-N 343.427 1.592 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCSC[C@@H]2CO)c([N+](=O)[O-])c1 765639662 AVZGOPOMIRYZPW-PYEVWLCESA-N 338.385 1.695 10 10 EDCE Cn1ncc2c(O)nc(NNC(=S)Nc3ccc(F)cc3)nc21 769793768 NBFNFLQHXHTUQZ-UHFFFAOYSA-N 333.352 1.522 10 10 EDCE COc1cccc(CNC(=O)c2cc(S(C)(=O)=O)cs2)c1O 767793213 AVQVURAUVLDCHZ-UHFFFAOYSA-N 341.410 1.796 10 10 EDCE CN(C1CC1)S(=O)(=O)NCc1cccc(Br)c1O 766206966 KHMJXIKMBGRXDX-UHFFFAOYSA-N 335.223 1.583 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)/C=C/C3CC3)cc2)CC1 894598092 UFYOWGMWAXLTJU-VMPITWQZSA-N 327.428 1.971 10 10 EDCE NS(=O)(=O)c1ccc(C(=O)NCc2ccc3cccnc3c2O)o1 1142728274 PXHZQHYRZLHBFD-UHFFFAOYSA-N 347.352 1.111 10 10 EDCE Cc1cc(O)c(CNC[C@@H]2CCCCN2S(C)(=O)=O)cc1C 796510233 JMEQQXQQPBVQCO-HNNXBMFYSA-N 326.462 1.913 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H]2CCNC(=O)C2)cc1C 1319178740 JCLJDISLWSPKFV-BBRMVZONSA-N 347.459 1.372 10 10 EDCE C[C@H](O)c1ccc(N(C)Cc2nnn(C)n2)cc1Br 1892990512 AARZHDIWYZSJAR-QMMMGPOBSA-N 326.198 1.662 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCN(C)CC3)c(Br)cc21 92774778 HAPMQZBVIHODEV-ZDUSSCGKSA-N 339.237 1.414 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)Cc2cc[nH]n2)cc1C 1267121314 AOMFUFDGCMNSCE-CQSZACIVSA-N 330.432 1.954 10 10 EDCE CN(C1COC1)C1CN(c2ccc(CO)cc2Br)C1 2116487923 LONISOUUQNQSQV-UHFFFAOYSA-N 327.222 1.461 10 10 EDCE COC(=O)[C@H](CC(F)F)NC(=O)c1ccc(N=NC(N)=O)cc1 1466128620 UNCZCZZUBIYLGT-VIFPVBQESA-N 328.275 1.776 10 10 EDCE COc1ccc(-n2nnnc2CN[C@H](C)[C@@H](C)NC(=O)C(C)C)cc1 1700385277 COGXOABNVJQTRX-CHWSQXEVSA-N 346.435 1.310 10 10 EDCE C[C@H](NC(=O)Cc1ccc(O)c(O)c1)C(=O)NCc1ccccc1 1625653642 LZNOECIHYNKBRW-LBPRGKRZSA-N 328.368 1.461 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2cc(=O)n(C)cn2)cc1C 1491486214 CNLDVQJXFWZYRB-CYBMUJFWSA-N 344.415 1.005 10 10 EDCE C[C@H](NC(=O)CNC(=O)COc1ccccc1)c1ccccc1O 1632250473 UPXUQWAHNSLYDK-ZDUSSCGKSA-N 328.368 1.765 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)Cc1nonc1C 1568788738 VEIBTVOKSGCJBY-UHFFFAOYSA-N 346.431 1.876 10 10 EDCE C[C@@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CCS1(=O)=O 1652551443 CWFRPEHMVCUYMQ-SKDRFNHKSA-N 338.389 1.545 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1Cc2cc(F)ccc2NC1=O 1597573827 HMWBHCYHMBSQBI-LLVKDONJSA-N 330.315 1.664 10 10 EDCE COC(=O)NCC(=O)N1CCC[C@H]1CNCc1ccc(OC)c(C)c1 1671271019 VQNDBDOGWFNQDO-HNNXBMFYSA-N 349.431 1.440 10 10 EDCE CN1C[C@H](N(C)Cc2cc(Br)cc(F)c2O)CC1=O 2131933497 DDWBCHISGINDCE-SNVBAGLBSA-N 331.185 1.956 10 10 EDCE CN1CCC(N(C)C(=O)CCNCc2ccc(N(C)C)cc2)CC1 1857862725 CFJYRUYQTQCVJB-UHFFFAOYSA-N 332.492 1.785 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985094840 UZRKACLAIWWIJK-UWVGGRQHSA-N 329.357 1.369 10 10 EDCE CN(CC(=O)NCCN)c1ccc(CNC(=O)OC(C)(C)C)cc1 1999450420 YDKGNSCCKDENCC-UHFFFAOYSA-N 336.436 1.222 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C1)[C@@H]2NC(=O)c1cccc(O)c1O 2011006150 VXTNFSRVUFRWRJ-PTEHBNRSSA-N 334.372 1.693 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H](CC(=O)N2CC(N=[N+]=[N-])C2)C1 2014405330 TXJBVQOLZGASEQ-PWSUYJOCSA-N 339.396 1.970 10 10 EDCE OCc1ccc(N2CCC[C@@H](CO)[C@H]2CO)cc1Br 710091404 OCOLNCAUHKBRCA-SMDDNHRTSA-N 330.222 1.511 10 10 EDCE COC(=O)NCC1CN(c2cc(Br)c(CN)cc2F)C1 2187287931 HEWGGNGXJRFEJW-UHFFFAOYSA-N 346.200 1.839 10 10 EDCE CO[C@@H]1CN(c2ccc(CN)cc2Br)[C@@H]2COC[C@@H]12 2102139857 FDRRRGJLBXDYCB-LERXQTSPSA-N 327.222 1.758 10 10 EDCE C[C@@H](N)c1ccc(N2CC(OCC(N)=O)C2)c(Br)c1 2089135527 OERNMPKLNVIMCR-MRVPVSSYSA-N 328.210 1.159 10 10 EDCE C[C@@H](NCc1c(Br)nnn1C)c1cc(O)ccc1O 2089353145 VBDJKPBEXVWUDW-SSDOTTSWSA-N 327.182 1.840 10 10 EDCE CC[C@H](N[C@H]1CN(C)C[C@H]1O)c1cc(Br)ccc1O 2090335301 YJIRJOGQHVIYIM-SGMGOOAPSA-N 329.238 1.870 10 10 EDCE C[C@H](CO)N1CCN(c2ccc(CO)cc2Br)CC1 2113065258 ZVCZPEVVFAPCST-LLVKDONJSA-N 329.238 1.444 10 10 EDCE C[C@H](CCCCCOc1nnc(=N)[nH]n1)NC(=O)OC(C)(C)C 2210649863 NDMMPPBBJSLWTP-SNVBAGLBSA-N 326.401 1.532 10 10 EDCE COc1ccc(N2CCOC[C@H](O)C2)c(OC)c1Br 2226548214 AHAWRBCEKDSUTR-SECBINFHSA-N 332.194 1.664 10 10 EDCE O=C1Nc2cc(N3CC[C@]4(O)C[C@H]4C3)c(Br)cc2[C@@H]1O 2279953278 WNVXMKWXKKRIOM-FMCKTDMXSA-N 339.189 1.396 10 10 EDCE Cc1cc(=NC=C2C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)[nH]o1 2296566834 PEFKMOQFXXJRHS-UHFFFAOYSA-N 346.730 1.637 10 10 EDCE CCCNC(=O)[C@H]1CCCN(C(=O)C=Cc2ccc(O)c(O)c2)C1 2307986782 BHPYAXLDNKNJHT-AWEZNQCLSA-N 332.400 1.876 10 10 EDCE Cn1cc(C=CC(=O)N2CCC=Cc3ccccc32)c(=O)n(C)c1=O 2311098681 WZSCNPPOIAENFW-UHFFFAOYSA-N 337.379 1.547 10 10 EDCE CC(C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCN(C)CC1 22589299 GRLADROGYKHTIV-GOSISDBHSA-N 332.492 1.813 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)Nc3nocc3C)CC2)cc1 179020803 WJHJIGFAPDJJFX-UHFFFAOYSA-N 344.371 1.279 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CC(NC(=O)C4CC4)C3)ccc21 186648382 OUPUOHHVIOOBTM-UHFFFAOYSA-N 342.443 1.489 10 10 EDCE CCOC(=O)N1CCN(C(=O)Nc2cc(O)c(O)c(O)c2)CC1 217278958 ZORIHSMRVXMYKC-UHFFFAOYSA-N 325.321 1.109 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)C[C@H](O)C(C)C)cc2)CC1 190234211 WDENHRXVIYTBMP-SFHVURJKSA-N 347.459 1.378 10 10 EDCE CCN(CC)CCS(=O)(=O)N1CCOc2cc(N(C)C)ccc21 352247677 OWPREYXQQCYXRW-UHFFFAOYSA-N 341.477 1.623 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](N=[N+]=[N-])[C@H](O)[C@@H]2OC(C)(C)OC[C@H]21 616582330 BGHCGGRUDRVRAI-ZRUFSTJUSA-N 328.369 1.797 10 10 EDCE CC[C@@H](C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(O)c(O)c1 272269119 CWHVBVKEKSSHQA-PWSUYJOCSA-N 338.429 1.662 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1cncnc1 278802107 ZKAHUGBJGKNSEG-UHFFFAOYSA-N 326.400 1.514 10 10 EDCE Cc1ccc(CN2CCOC[C@H]2[C@H](O)CO)c(O)c1Br 2380813038 BSGWRCISVCGWPQ-NWDGAFQWSA-N 346.221 1.017 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCc1cscn1 804021034 QLZMXKKXLFSCCF-UHFFFAOYSA-N 332.429 1.484 10 10 EDCE C[C@H](OCC(=O)N[C@H](C)Cc1ccc(O)c(O)c1)c1nccn1C 813513270 LBEQPWGEDGCAKB-NEPJUHHUSA-N 333.388 1.656 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)CCOC3CNC3)C2)cc1 818613004 AXEAWYKFQPVTCG-AWEZNQCLSA-N 333.432 1.016 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NCC(=O)NCC(F)(F)F)c1 728948883 IOPMOFPBQDDISQ-MRVPVSSYSA-N 349.309 1.440 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)NCC3(C)COC3)C2)cc1 823048485 ZERKWNJVMOZZQQ-AWEZNQCLSA-N 333.432 1.857 10 10 EDCE CC(C)c1nnc2n1C[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)CC2 588406189 JYSWTJQZSUXRTK-UKOWJOKBSA-N 342.399 1.957 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H](CN2CCOCC2)C1 588405032 IVOOGPVJHCKCSJ-DQOPKJQZSA-N 346.427 1.682 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cnn(C2CC2)c1N 906857453 YEJSATDYRIGRAU-UHFFFAOYSA-N 327.388 1.905 10 10 EDCE O=C(/C=C\c1ccncn1)NCc1ccc(N2CCOCC2)c(F)c1 588437156 SLNGOEKTKBQNMY-RQOWECAXSA-N 342.374 1.782 10 10 EDCE CC1(C)[C@@H](N2CCOCC2)C[C@H]1NC(=O)/C=C\c1ccc(O)c(O)c1 911848711 YDFXGEASGZSFNT-FJKMSNPNSA-N 346.427 1.727 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCO[C@@H](c3ccsc3)C2)cc1 841068948 XYMGJJUDCHTCGP-CQSZACIVSA-N 331.397 1.869 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=S)NC[C@@H]3CCOC3)C2)cc1 849270696 MTTQYDNDZLABJT-UONOGXRCSA-N 335.473 1.775 10 10 EDCE COCC1(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 848932211 UVXFXABMGKUZFA-UHFFFAOYSA-N 345.443 1.446 10 10 EDCE NCCCNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 841782403 NEAVCMNVDMFOMC-UHFFFAOYSA-N 342.390 1.905 10 10 EDCE COC[C@@H](C)S(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849416666 UXBIRPZDYXHKGR-CHWSQXEVSA-N 328.434 1.228 10 10 EDCE COc1ccc(-n2cc(CNC(=O)c3cc(O)cs3)nn2)cc1 755859910 HNXBUXXVVHVLAH-UHFFFAOYSA-N 330.369 1.973 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3(C)CCNCC3)C2)cc1 851662841 LNRFBMVPPWGICA-OAHLLOKOSA-N 346.475 1.963 10 10 EDCE CCc1c(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)cnn1C 855230265 FGQPBEQEYSIVFT-CYBMUJFWSA-N 328.416 2.000 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](CO)C[C@H]3C)nc12 860088686 WKHDWLNBNGWROK-VXGBXAGGSA-N 348.403 1.204 10 10 EDCE COCCc1cc(NC(=O)NCc2cc(OC)ccc2O)n(C)n1 768994428 CRSNXWOEOPUIIH-UHFFFAOYSA-N 334.376 1.645 10 10 EDCE CNCc1ccc(N2CCO[C@H]3COC[C@@H]32)cc1Br 1877659726 PABRAXTYBNASPL-KBPBESRZSA-N 327.222 1.773 10 10 EDCE CN(C)c1cc(F)c(CN[C@H]2C(=O)NCC23CCOCC3)cc1F 895765906 PLOHSEYDHDUJFA-HNNXBMFYSA-N 339.386 1.416 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@@H](C)C2(S(C)(=O)=O)CC2)c1 797069581 HEBIXEMIUQMPHT-QWRGUYRKSA-N 341.429 1.795 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2c[nH]c(C)cc2=O)cc1C 1317278315 ZMMNZSABFQMJOW-CQSZACIVSA-N 343.427 1.908 10 10 EDCE COCC[C@@H](COC)NCc1ccc(N2CCN(C)CC2)c(F)c1 1323935343 HCBMUAWELGNJPJ-INIZCTEOSA-N 339.455 1.719 10 10 EDCE CN(Cc1cc(Br)cc(F)c1O)[C@@]1(C(=O)O)CCOC1 715770064 MUOQRJYABIXEFI-ZDUSSCGKSA-N 348.168 1.969 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC4CC3(CO)C4)c(Br)cc21 694602212 BBRFLRBPMDXQEZ-BWQPLIALSA-N 338.205 1.362 10 10 EDCE O=C(O)[C@H](NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCO1 1331846220 RCCZPPZVDHXQFJ-HZPDHXFCSA-N 338.379 1.384 10 10 EDCE O=C(C(=O)N1CCC[C@@H](c2ncc[nH]2)C1)N1Cc2cccc(O)c2C1 1348586382 XRGVRWORUORHPQ-CYBMUJFWSA-N 340.383 1.364 10 10 EDCE CCc1nnc(S)n1CCNC(=O)c1ccc(N=NC(N)=O)cc1 1444293289 UIJNFHBMROFJKX-UHFFFAOYSA-N 347.404 1.722 10 10 EDCE CN(C)CCCOC1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1445340579 VVQUYNXTWINIQH-UHFFFAOYSA-N 336.432 1.600 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCO[C@@H](c3ncon3)C2)cc1 1296312154 ISDBTONIRMOIJE-LLVKDONJSA-N 330.304 1.446 10 10 EDCE C[C@H](NC(=O)NCc1ccnc(-n2cncn2)c1)c1ccccc1O 1471056304 PWSLJZVPQCEUEV-LBPRGKRZSA-N 338.371 1.928 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@]2(C)CCNC2=O)cc1C 1715359523 HRDDEERXSFFGSU-KUHUBIRLSA-N 347.459 1.466 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN(C2CCOCC2)CC1 1629015178 QNAOGDRSPKDRGI-UHFFFAOYSA-N 334.416 1.400 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CCO[C@H]1c1ccc(O)nc1 1557906061 REYQLDZIOVWJCO-FZNBLMQSSA-N 342.351 1.858 10 10 EDCE COC(=O)NCC(=O)NC[C@@H](NCc1ccc(OC)c(C)c1)C1CC1 1713104519 JATFEIDECJWEEF-OAHLLOKOSA-N 349.431 1.344 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)Cc2occc2C)cc1C 1486032475 BVSASHRJDDNTKY-INIZCTEOSA-N 346.427 1.714 10 10 EDCE CNC(=O)C1(C(=O)N[C@@H](C)CCNCc2ccc(OC)c(C)c2)CC1 1716179846 CCGMCDFBRLHVFN-AWEZNQCLSA-N 347.459 1.514 10 10 EDCE C[C@H](NC(=O)[C@H]1COCCN1CC(F)F)c1ccc(N(C)C)cc1 1567777032 HDCPOEIPGROOJN-SWLSCSKDSA-N 341.402 1.896 10 10 EDCE Cn1nnnc1-c1ccccc1NC(=O)/C=C/c1ccc(O)c(O)c1 1646293766 CTHPIBPUUOASIW-VQHVLOKHSA-N 337.339 1.940 10 10 EDCE Cn1cc([C@@H]2CCCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)nn1 1640447726 DFZKXCVKDKAXRQ-SCXUMTSISA-N 328.372 1.646 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)CC(F)(F)F)cc1C 1667794172 CPPYWIORCDJVEU-GFCCVEGCSA-N 334.338 1.523 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(=O)N(CC3CC3)C2)c([N+](=O)[O-])c1 1772974742 NKVVSQNEJPQLDC-ALCCZGGFSA-N 345.355 1.797 10 10 EDCE CC(=O)N[C@H]1CCCN(C(=O)NCCCSc2nccs2)C1 154629613 RMMTUAIWEVPCOL-LBPRGKRZSA-N 342.490 1.935 10 10 EDCE CCOC(=O)N1CCN(C(=O)CNCc2cc(C)ccc2O)CC1 1857867901 HRDOYPUZBCMYGI-UHFFFAOYSA-N 335.404 1.091 10 10 EDCE CNCc1ccc(N2C[C@@H](C)O[C@@H](CO)C2)cc1Br 234378385 OYGSTBDSNQJISA-ZWNOBZJWSA-N 329.238 1.755 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCOC1 1985097004 ZNEGRUDNCZLHPX-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CCN[C@@H](c1ccccc1O)[C@@H](O)c1c(Br)nnn1C 2148153760 PUDRIDJYJNMYKR-CMPLNLGQSA-N 341.209 1.667 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1990031671 BTAYESPMJYXWFA-WDEREUQCSA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)[C@H]1CCCO1 2004956463 DWADSJIEVKIBBV-OXHZDVMGSA-N 340.420 1.324 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2010405876 NDXMCIHYMPDDAJ-MNOVXSKESA-N 339.396 1.733 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3[C@@H](C2)OCCN3C)cc1Br 2153995295 QEKPOECYLYAJLZ-WKPIXPDZSA-N 340.265 1.988 10 10 EDCE CC(C)(C)OC(=O)NCc1nc(=NCc2ccc(O)cc2O)[nH][nH]1 2011843890 ZLMVEJZBAMWUEC-UHFFFAOYSA-N 335.364 1.275 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC(N=[N+]=[N-])C2)C[C@@H](O)C1(C)C 2018046544 BELJYXFSDQXNTM-BMIGLBTASA-N 339.396 1.562 10 10 EDCE CN(c1ccc(CNC2CC2)cc1Br)C(CO)CO 311544092 HOUZGBOLRALDTI-UHFFFAOYSA-N 329.238 1.491 10 10 EDCE CN(CCN1CCOCC1)c1ccc(CN)c(Br)c1F 2170081664 URGLBRIREFZVPY-UHFFFAOYSA-N 346.244 1.815 10 10 EDCE C[C@@]1(NCc2c(O)cccc2Br)CCS(=O)(=O)C1 706874963 DKZISCSKVZGRMA-GFCCVEGCSA-N 334.235 1.822 10 10 EDCE CNCc1ccc(N2C[C@@H]3OC(=O)N(C)[C@H]3C2)c(Br)c1 2176930766 NNACTGQFJJZLOO-STQMWFEESA-N 340.221 1.808 10 10 EDCE CN(C)CCN(C)CCN(C)c1ccc(CN)cc1Br 2179010328 IOPJSZBOBFPVKV-UHFFFAOYSA-N 343.313 1.837 10 10 EDCE CNCc1ccc(N2CC(N(C)CCOC)C2)c(Br)c1 2192545365 BXSAIDMKXHCCMH-UHFFFAOYSA-N 342.281 1.935 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)cc1Br 2189046084 ZQQYWFFCVSRUEO-YYHMBLRTSA-N 342.233 1.946 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2210535388 LSSBBCVUIZHQSQ-DCAQKATOSA-N 327.385 1.610 10 10 EDCE CC(C)(C)OC(=O)N[C@H](COc1nnc(=N)[nH]n1)c1cccs1 2210643097 GXNFJGPWAAXURY-MRVPVSSYSA-N 338.393 1.385 10 10 EDCE COc1ccc(N2C[C@H](CO)C[C@H]2CO)c(OC)c1Br 2234894453 UCKYZZWOSVNVNM-ZJUUUORDSA-N 346.221 1.646 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)C[C@H]3C2)cc1Br 2236991419 XADPFTOVUYOBOF-HGSJOUDDSA-N 342.233 1.509 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2COCC[C@H]2O)c1O 2227749931 HSFXWSGFNVELHY-GHMZBOCLSA-N 332.194 1.403 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2329333926 ZOJRWECEBDIRNK-NZPIUUIZSA-N 327.222 1.099 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H]2CCC[C@H](C1)C2O 361010759 FTAKZVOVQCWDNT-XEWABKELSA-N 345.487 1.804 10 10 EDCE COc1ccc(N2CCC(NC(=O)C(=O)N(C)CC3CC3)CC2)cc1 804314817 AXXPUJYLEYUEKD-UHFFFAOYSA-N 345.443 1.649 10 10 EDCE CCc1c(C(=O)OCC(=O)C(C)=O)nnn1Cc1ccc(F)cc1 808545919 SXFWIAGBTSJMJD-UHFFFAOYSA-N 333.319 1.343 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3CCNC(=O)CC3)CC2)cc1 814722183 NRECBIUPPQFVFC-AWEZNQCLSA-N 331.416 1.260 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(O)c(O)c1)C2 819397440 CPGPFBFJGLJGDO-AVGNSLFASA-N 334.372 1.581 10 10 EDCE COCn1nc(C)c(S(=O)(=O)Nc2ccc(O)c(OC)c2)c1C 818052729 GFMIHZXSEMZYSS-UHFFFAOYSA-N 341.389 1.619 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@H](OC)[C@@H]3CCOC3)CC2)cc1 825425905 OGVWMKHZHXZGSV-RDTXWAMCSA-N 348.443 1.832 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)CN2CCN(C3CC3)C2=O)c1 830541529 ZJRPHVRGTIPFKF-NSHDSACASA-N 333.388 1.478 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCS(=O)(=O)[C@H]3CCC[C@H]32)c1O 832462480 GIFVDEZULHBKQA-CABCVRRESA-N 341.404 1.885 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NC[C@H]1CCCN1 841937188 OTMUYUBAFRFWQM-LLVKDONJSA-N 328.210 1.706 10 10 EDCE CCO[C@@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)C[C@H]1CN 844906342 SMSOSCIHKRQZCW-CRAIPNDOSA-N 337.439 1.458 10 10 EDCE Cc1cc(CC(=O)NC[C@H]2CNC(=O)C2)c(C)n1-c1ccccc1 854932118 YUFHMTAUQSWMRH-OAHLLOKOSA-N 325.412 1.889 10 10 EDCE OC1(C2(CNCc3ccc(N4CCOCC4)cc3)CC2)CCOCC1 922598384 FHDMBICGRWTKPD-UHFFFAOYSA-N 346.471 1.935 10 10 EDCE CC(C)OC[C@H](N)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 851629867 CHKZJERTCUOTMJ-YOEHRIQHSA-N 335.448 1.453 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@]12CCC(=O)N1CCS2 935946180 AHTKOMCLDSKWJZ-MRXNPFEDSA-N 341.429 1.560 10 10 EDCE CN[C@@H](C)c1ccc(N2CCN(C)C[C@H]2CO)cc1Br 699492108 PBVZLQNCUALYCB-AAEUAGOBSA-N 342.281 1.842 10 10 EDCE C[C@H]1CN(Cc2c(O)cccc2Br)CCN1CCO 862332729 KLTAWDKOMURNKA-NSHDSACASA-N 329.238 1.653 10 10 EDCE CN(C)c1ccc(CN2CCO[C@@H](CC(N)=O)C2)c(C(F)(F)F)c1 862535776 YRRHKFSOMUKECQ-ZDUSSCGKSA-N 345.365 1.848 10 10 EDCE CC1=C(C(=O)N2Cc3cccc(O)c3C2)[C@H](C)n2ncnc2N1C 871204590 MCCFIMBYRFGSRJ-NSHDSACASA-N 325.372 1.811 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)NCc1ccc(F)c(F)c1O 1876257019 QSXYSFAKKBDTMW-JTQLQIEISA-N 332.347 1.646 10 10 EDCE C[C@@H]1C[C@@H](COC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 783152009 MCCQZDCRIQZELH-MNOVXSKESA-N 343.401 1.736 10 10 EDCE C[C@H](NCc1cc(Br)ccc1O)c1nnc(O)n1C 895179738 JFKADISFEMHMHT-ZETCQYMHSA-N 327.182 1.840 10 10 EDCE CCn1nc2c(cc1=O)CN(Cc1cc(C)cc(OC)c1O)CC2 894070119 NXSBHSVJNNLHHX-UHFFFAOYSA-N 329.400 1.844 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)O1 1895875315 IKDLDXURCZWXCN-MNOVXSKESA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)[C@@H](N)c1ccccc1O 1899562369 SCZPUMNDOVTQAN-YPMHNXCESA-N 344.433 1.330 10 10 EDCE CC(C)(C)C(=O)N1CCC(NC(=O)Cc2ccc(O)c(O)c2)CC1 1163613886 GNBRMDOUMYZATJ-UHFFFAOYSA-N 334.416 1.794 10 10 EDCE Cn1ncc(Br)c1C(=O)NCCc1ccc(O)c(O)c1 1566369719 RQWZUBVNKGDGNJ-UHFFFAOYSA-N 340.177 1.566 10 10 EDCE COc1ccc(Br)c(CN(C)[C@@H]2CCCNC2=O)c1O 1964599023 HSNOQBAKOLUGFU-LLVKDONJSA-N 343.221 1.874 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H](C)C(C)(F)F)cc1C 1320271869 FQWQOCCBQJIREB-JSGCOSHPSA-N 344.402 1.862 10 10 EDCE CO[C@H]1C[C@H](C(=O)O)N(Cc2cc(Br)cc(F)c2O)C1 1964721551 WKFGGBFBFXJPAM-GXSJLCMTSA-N 348.168 1.968 10 10 EDCE COC(=O)c1cc2n(n1)CCC[C@@H]2NC(=O)c1ccc(C)c(O)c1O 1180099673 ILTOMTVPSCRIBC-NSHDSACASA-N 345.355 1.654 10 10 EDCE CN(CCO)C[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1265401511 WTNARDDUAAMOPW-ZDUSSCGKSA-N 347.419 1.625 10 10 EDCE O=C(Nc1cn[nH]c1)[C@@H]1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 1449967474 HMXMWISCAVSGOX-DTRQGZQOSA-N 342.355 1.321 10 10 EDCE Cc1ccc(C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)c(O)c1O 1296178234 DUPFZDXZGJBOIO-INIZCTEOSA-N 325.361 1.229 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1csnn1 1295590735 PSHIQKMNGVPKSH-UHFFFAOYSA-N 341.776 1.713 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1(n2cnnn2)CC1 1523560887 WXFOJEANGJKUBW-UHFFFAOYSA-N 326.404 1.421 10 10 EDCE O=C(NCc1cccc(Cl)c1O)NCc1nnc(O)n1C1CC1 1471151311 RVDGSONLEKBVSP-UHFFFAOYSA-N 337.767 1.677 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)[C@@H]2COCCO2)C2CC2)cc1C 1498734132 YVIYWQVDHXOTNJ-WMZOPIPTSA-N 348.443 1.403 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2cn(C)c(O)n2)cc1C 1498606594 MDCXVBZUJRVEQW-UHFFFAOYSA-N 346.431 1.695 10 10 EDCE Cc1nn(C)c(-n2ccnc2C)c1C(=O)NCc1c(O)cccc1O 1635848081 ZHZLTZPBYKHMSG-UHFFFAOYSA-N 341.371 1.564 10 10 EDCE C/C=C(\C)C(=O)N(C)C[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1738805485 PETISWVNIHAHFQ-YTRUQHMWSA-N 335.404 1.642 10 10 EDCE CCC[C@H](O)[C@H](CO)NC(=O)c1cc2cc(O)c(O)cc2s1 1642392614 ORBRVWUSWMOJTN-UWVGGRQHSA-N 325.386 1.564 10 10 EDCE COC(=O)c1cc2n(n1)CCC[C@H]2NC(=O)c1c(F)ccc(O)c1O 1654846288 VDYYKEASISNFED-SECBINFHSA-N 349.318 1.485 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cnnc(O)c2)cc1C 1668872169 GDRRPHHDAZGDGZ-ONEGZZNKSA-N 342.399 1.575 10 10 EDCE CC(C)(NS(C)(=O)=O)C(=O)NCc1c(O)ccc2ccccc12 1597737487 YSPZOEQMACLNSD-UHFFFAOYSA-N 336.413 1.489 10 10 EDCE COc1ccc(N2CCCN(C(=O)c3ccc(CO)nc3)CC2)cc1 1596963263 GUVZTTKONBFRNY-UHFFFAOYSA-N 341.411 1.935 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H]2CCCC(=O)N2)cc1C 1699517532 XQBOZBZODTWHBY-MRXNPFEDSA-N 347.459 1.610 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)c2ncn(C)n2)C2CC2)cc1C 1699582113 BRGXYQFWMXYAII-OAHLLOKOSA-N 343.431 1.430 10 10 EDCE CCC(=O)N[C@]1(C)CCN(Cc2nnnn2-c2ccc(OC)cc2)C1 1699811245 ZJGMIAFNUZBAAL-QGZVFWFLSA-N 344.419 1.162 10 10 EDCE O=c1[nH]cnc(NCc2ccccc2O)c1I 164162153 BOWNIZPCTLPCFD-UHFFFAOYSA-N 343.124 1.692 10 10 EDCE C[C@H](c1cccnc1)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 1866303465 YKWMEUWYKNDHEO-GFCCVEGCSA-N 343.383 1.717 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)C(C)(C)O 1900607012 JJOBNECKTPKNOJ-JTQLQIEISA-N 329.401 1.809 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)cc1Br 2136877648 JAUWKGOJWOUQNP-FZZIBODNSA-N 330.222 1.824 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1NCc1ccc(O)c(O)c1 1943954300 FPVDOSVAUIQHCK-OLZOCXBDSA-N 338.404 1.870 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1NCc1cccc(O)c1O 1943955760 UFBKMNZGEBSXME-QWHCGFSZSA-N 338.404 1.870 10 10 EDCE CC(C)(C)OC(=O)NCC1(O)CC(C(=O)NCCCN=[N+]=[N-])C1 1985102728 LCVUOILUBVFMHH-UHFFFAOYSA-N 327.385 1.469 10 10 EDCE CNCc1ccc(N2C[C@H](CO)[C@@H](CCO)C2)c(Br)c1 2149909725 ZYCANLAMLMFIEB-QWHCGFSZSA-N 343.265 1.596 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@H](F)C1 2003169253 ZKSAWULPGCREOK-ZDEQEGDKSA-N 342.411 1.847 10 10 EDCE Cn1cc([C@H](NC(=O)OC(C)(C)C)C(=O)NCCCN=[N+]=[N-])nn1 2010397076 QYFPLPAFJAKQNA-JTQLQIEISA-N 338.372 1.198 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CCOCC1 2010401076 AROIHACHIPATNB-LLVKDONJSA-N 339.396 1.972 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010389922 WCNIOAYCUZPKJG-NEPJUHHUSA-N 340.428 1.743 10 10 EDCE CN(C)c1ccc([C@H](CN)N2CC(NC(=O)C(F)(F)F)C2)cc1 2018846560 QLRDUZOOGRECRW-ZDUSSCGKSA-N 330.354 1.115 10 10 EDCE NCc1ccc(N2CCN3C[C@@H](O)C[C@@H]3C2)c(Br)c1 405273281 SWVKEMVCRZVUEC-NEPJUHHUSA-N 326.238 1.163 10 10 EDCE CC1(C)C(=O)NC(=O)CN1c1cc(Br)c(CN)cc1F 312250974 JCUMTEMHFSFDMG-UHFFFAOYSA-N 344.184 1.288 10 10 EDCE NCc1cc(F)c(N2CCC[C@@H](CO)[C@H]2CO)cc1Br 709806210 LAGMCIITHRASAT-LKFCYVNXSA-N 347.228 1.617 10 10 EDCE C[C@@H](N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2)C(C)(C)O 394998304 IJIZYLQHZXNIHG-KRTXAFLBSA-N 342.237 1.997 10 10 EDCE CNCc1ccc(N(C)CCN2CCOCC2)cc1Br 2170102967 SHUGQNWANXULLB-UHFFFAOYSA-N 342.281 1.937 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1908252869 HLOVJUJLZUWJOB-UTUOFQBUSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N1CC=C[C@H](NC(=O)COc2ccc(N)cc2)C1 2046539084 OWTCRBOXHIVDCT-AWEZNQCLSA-N 347.415 1.939 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1CO[C@H]2COC[C@H]12 2101846075 GBUCDRFJQAOOCW-UDZFHETQSA-N 328.206 1.906 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)C[C@H]2CO)c(Br)c1 2089870483 PUNCRNBOUXCRJE-RYUDHWBXSA-N 329.238 1.348 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213592365 SKEPTMALXFFJTF-SRVKXCTJSA-N 339.396 1.970 10 10 EDCE Cc1ccc(C=C2SC(=S)N(CCS(=O)(=O)O)C2=O)o1 2293223785 MUEUAKXHLILQLO-UHFFFAOYSA-N 333.412 1.677 10 10 EDCE COC(=O)C=Cc1ccc(N(C)C[C@@H](C)c2nn[nH]n2)c([N+](=O)[O-])c1 2308960875 SWZUKVBFKIVYPF-SNVBAGLBSA-N 346.347 1.534 10 10 EDCE O=C(O)COc1ccc([N+](=O)[O-])cc1C=C1SC(=S)NC1=O 2314954899 DBJXGGPHDUTGID-UHFFFAOYSA-N 340.338 1.547 10 10 EDCE COc1ccc(N2CCC(NC(=O)N3CCNC(=O)CC3)CC2)cc1 105228496 SZIMAOOZHVWBPN-UHFFFAOYSA-N 346.431 1.196 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@@H](C)[C@@H]3CCCO3)CC2)cc1 183152397 PGVHCBMCHFHOOB-YJBOKZPZSA-N 347.459 1.501 10 10 EDCE COC(=O)[C@H]1C[C@@H](O)CN1Cc1cc(Br)cc(C)c1O 187570124 GCCQTWGJIAPRJZ-VXGBXAGGSA-N 344.205 1.571 10 10 EDCE CC(C)[C@H](CO)N(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2367104930 WKZFKCTUNPVVSQ-QWHCGFSZSA-N 343.221 1.888 10 10 EDCE Cc1cc(C(=O)N[C@@H](C)CO)c(C)n1-c1ccc2c(c1)OCCO2 97204315 JZGIJYCSXCCHPP-NSHDSACASA-N 330.384 1.976 10 10 EDCE CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)c1ccc(C)c(O)c1O 370419255 UFYDRKUZGLZIQX-VXGBXAGGSA-N 337.372 1.589 10 10 EDCE COc1ccc(N2CCN(C[C@@H]3CCCS(=O)(=O)C3)CC2)cc1 284024848 IAEIGZIFNWWFLP-HNNXBMFYSA-N 338.473 1.642 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CNC[C@@H](O)C2)c(O)c1Br 2381147064 OQYJPCRBNZWOAL-MNOVXSKESA-N 343.221 1.050 10 10 EDCE Cc1c(C(=O)NCc2ccc(N3CCOCC3)cc2)nnn1C(C)C 292243695 SZKHMVJFSPBAED-UHFFFAOYSA-N 343.431 1.934 10 10 EDCE O=C(NCc1cc(Br)ccc1O)[C@H](O)c1cccnc1 804734981 GKCHYHGCIJTIIT-CYBMUJFWSA-N 337.173 1.900 10 10 EDCE CCOc1ccc(O)c(CN[C@H]2CCC[C@@H]2CNS(C)(=O)=O)c1 800310279 VRGRFYKYLOTKMQ-DOMZBBRYSA-N 342.461 1.598 10 10 EDCE COc1ccc(O)c(CNC[C@H]2CCCCN2S(C)(=O)=O)c1 809710343 QLKYFRVRXIWKMM-CYBMUJFWSA-N 328.434 1.305 10 10 EDCE CN1CCC[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)C1=O 822586515 RAZLNEBHTBVLAW-MRXNPFEDSA-N 347.484 1.724 10 10 EDCE Cn1ccc([C@@H]2CCCN(Cc3cc4c(cc3O)OC[C@@H]4O)C2)n1 905716793 WXMSAOYJIGCDHT-PXAZEXFGSA-N 329.400 1.931 10 10 EDCE CCN(OC)C(=O)CNCc1ccc(N2CCOCC2)c(F)c1 842769870 YEYHLHSSVOENIF-UHFFFAOYSA-N 325.384 1.162 10 10 EDCE COC(=O)C1(CS(=O)(=O)NCc2c(O)cccc2F)CCC1 921452039 BBYZVAQWEWWZKA-UHFFFAOYSA-N 331.365 1.294 10 10 EDCE COC(=O)/C=C/c1ccc(N(C)C[C@H]2COCCO2)c([N+](=O)[O-])c1 853829951 PHHNSPXROZUTCV-BPJJOFIESA-N 336.344 1.633 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NCC12CC(CN1)C2 851676998 QYTQJCSSOPEAPX-UHFFFAOYSA-N 340.221 1.706 10 10 EDCE CNCCCC(=O)N1CCC(NCc2cc(OC)ccc2O)CC1 853248743 XXGNIFKMYXHAAL-UHFFFAOYSA-N 335.448 1.481 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](O)CC(C)C)C2)cc1 854299785 LOFOUEQUTFFQSG-HOCLYGCPSA-N 335.448 1.980 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 862551004 JCZNFCZUXWSYDL-LLVKDONJSA-N 332.853 1.807 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)COCc1ccnc(O)c1 860697209 PUYCGVBBMRAIPA-NSHDSACASA-N 332.356 1.462 10 10 EDCE Cc1nccc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 795467811 XLJXLPGMSWWCNG-UHFFFAOYSA-N 337.357 1.219 10 10 EDCE Cc1cnn(CCOC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1 791778400 WPQGTSXTKBJSNB-UHFFFAOYSA-N 339.373 1.126 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H](CO)C[C@@H](O)c1ccccc1 1153511051 ASDGPNKFTSHQPA-GOEBONIOSA-N 331.368 1.241 10 10 EDCE CC(C)c1nnc2n1CCN(C(=O)Cc1ccc(O)c(O)c1)[C@@H]2C 1303928378 JCFLEHUEUSEDPN-LLVKDONJSA-N 330.388 1.959 10 10 EDCE CN(C[C@H](O)COc1ccc(N)cc1)CC1(Br)CC1 1887873203 JTRVIOXAJISQSU-LBPRGKRZSA-N 329.238 1.868 10 10 EDCE CN1CCN(c2ccc(CNC[C@]3(O)C[C@H]4C=C[C@H]3C4)cc2F)CC1 1327583914 WKTCNEHMESTKRS-RIFZZMRRSA-N 345.462 1.994 10 10 EDCE CC[C@H](C)[C@H](C)NC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1327924236 WXIZCLYCXXDOFT-SOUVJXGZSA-N 347.459 1.941 10 10 EDCE CN[C@H](C)c1ccc(N(C)Cc2nnnn2C)cc1Br 707671626 MMOHDEOQHMIRAO-SECBINFHSA-N 339.241 1.889 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)C[C@H]2CO)cc1Br 698118145 XKMGELCTYAXRFF-USWWRNFRSA-N 329.238 1.661 10 10 EDCE C[C@@H](N)[C@@H]1CN(Cc2cc(Br)cc(F)c2O)CCO1 715768893 GJPZNSRXVGOSQV-PELKAZGASA-N 333.201 1.842 10 10 EDCE CC12CC(CN1C(=O)C(=O)NCc1ccc(N3CCCC3)cc1)C2 1330865398 JATKWXCXGISHGG-UHFFFAOYSA-N 327.428 1.914 10 10 EDCE CCOC[C@H]1CCCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1335623432 SYBWZEKKOKDPFJ-CQSZACIVSA-N 332.400 1.652 10 10 EDCE O=C(NC[C@@H]1CCC2(CCC2)O1)C(=O)N1Cc2cccc(O)c2C1 1333027166 STYVKEZRVYQYOJ-ZDUSSCGKSA-N 330.384 1.452 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)CCn2ccnc2)cc1C 1265807279 XIYLDFZJNVSVKZ-HNNXBMFYSA-N 330.432 1.885 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1CCC2(CCC2)O1 1262145580 BBRZUNASGQXTRW-CQSZACIVSA-N 332.400 1.569 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C2[C@@H]3CCC[C@@H]23)cc1C 1700788236 SFEADYGYBAJSBP-ARFHVFGLSA-N 332.444 1.616 10 10 EDCE CCOC(=O)C(C)(C)n1cc(NC(=O)Cc2ccc(O)c(O)c2)cn1 1622247881 GNZAKLKEDVGGSX-UHFFFAOYSA-N 347.371 1.774 10 10 EDCE C[C@H](NCCn1ncc(Br)n1)c1cc(O)ccc1O 2123092681 PXRKNIZKWXVXAA-QMMMGPOBSA-N 327.182 1.803 10 10 EDCE O=C(CCc1nc2ccccc2oc1=O)NCc1cc(O)ccc1O 1558174694 SCBMIRSUMHLDAC-UHFFFAOYSA-N 340.335 1.848 10 10 EDCE CC(C)(F)C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1720212527 DNAMRXXMSQPTOY-UHFFFAOYSA-N 337.355 1.833 10 10 EDCE CC(C)n1cc(CNC(=O)c2c(F)ccc(O)c2O)c(O)nc1=O 1651274428 LJLSDEJJANKFQF-UHFFFAOYSA-N 337.307 1.010 10 10 EDCE CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@@]2(COC(C)(C)O2)OC[C@H]1N=[N+]=[N-] 22049421 YWEMWEKIXSKBDT-BLFANLJRSA-N 329.309 1.038 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)OCC(=O)O 1951423726 KBKMWYREDWQRNE-GFCCVEGCSA-N 327.333 1.592 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(c2cc(O)c(O)c(O)c2)C[C@@H]1C(=O)O 1952775411 OYMYLMZIHREAML-GLEZIHRCSA-N 325.317 1.628 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1985104401 IEHNHYAWPMRTHO-GMTAPVOTSA-N 327.385 1.562 10 10 EDCE NCc1ccc(N2C[C@]3(CO)CC[C@]3(CO)C2)c(Br)c1 2145750139 XPWJFOXBBOMLQQ-GASCZTMLSA-N 341.249 1.479 10 10 EDCE Cn1nnc(Br)c1COC(=O)COc1ccc(N)cc1 2145946119 DHEGUDCEMAFFJQ-UHFFFAOYSA-N 341.165 1.282 10 10 EDCE O=C(O)[C@@H]1[C@H]2OCCN(Cc3cc(Br)cc(F)c3O)[C@H]12 2149275431 HJPKANIKVBIOEI-HOSYDEDBSA-N 346.152 1.578 10 10 EDCE O=C(O)[C@@H]1CO[C@H]2CN(Cc3cc(Br)ccc3O)C[C@H]12 2160870963 JNFMLTBESKNFRY-WZRBSPASSA-N 342.189 1.686 10 10 EDCE CNC(=O)NC1CCN(c2ccc(CN)c(Br)c2)CC1 702142634 CHPKZUJZCZTFMG-UHFFFAOYSA-N 341.253 1.806 10 10 EDCE COc1ccc(N(C)CC(CO)CO)c(OC)c1Br 2226541673 IJJXRTDGHWXJHX-UHFFFAOYSA-N 334.210 1.503 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3C[C@@H]4COC[C@@H]43)c(Br)cc21 2356262281 JKZSAVYEIRCVJC-HYJLZEBJSA-N 338.205 1.497 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cc(C)on2)cc1C 1284382155 VPUJHSWQTAYGJO-HNNXBMFYSA-N 347.415 1.523 10 10 EDCE COc1ccc(N2CCCN(Cc3nnnn3C(C)C)CC2)cc1 195097022 CKWLUYKZWUUTSX-UHFFFAOYSA-N 330.436 1.975 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N[C@@H]1CCCCNC1=O 255278638 MGTXATPOUKTRCT-UXHZXRBQSA-N 343.427 1.321 10 10 EDCE CC(C)NC(=O)COC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255045391 DHWZEUZSXYRHKD-YVMONPNESA-N 332.400 1.604 10 10 EDCE Cc1ccc(C(=O)N2CCOC[C@H]2C[C@@H](O)c2ccco2)c(O)c1O 272770831 SHIUISONQDTSIG-TZMCWYRMSA-N 347.367 1.964 10 10 EDCE O=C(c1cccc(O)c1O)N1CCC(C(=O)N2CCCCC2)CC1 373568833 OYYHFFMRAPCDEF-UHFFFAOYSA-N 332.400 1.963 10 10 EDCE CCOc1cccc(CN2CCN([C@@H]3CCNC(=O)CC3)CC2)c1O 825148109 PVDDGPNWQJDILW-INIZCTEOSA-N 347.459 1.577 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)N(C)[C@H]3CCOC3)C2)cc1 824693182 JSIZTTYIFVPLPV-HOCLYGCPSA-N 333.432 1.952 10 10 EDCE C[C@H]1CN(Cc2ccc(Br)cc2O)CCN1CCO 825568461 YKVLTOQCIPELRF-NSHDSACASA-N 329.238 1.653 10 10 EDCE C[C@H](NC[C@]1(CO)COCCN1C)c1cc2c(cc1O)CCCC2 903283097 WRBGKWLFINWOPK-LIRRHRJNSA-N 334.460 1.615 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCO[C@H](Cn2cccn2)C1 588406468 CYBDKBMFFGAZOD-MFBWXBCUSA-N 329.356 1.235 10 10 EDCE CN1CCCc2cc(CNC(=O)NC[C@H]3C[C@@H]4COC[C@@H]4O3)ccc21 915390827 RPKPKLMOXARWQT-NUJGCVRESA-N 345.443 1.672 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@H]1CCNC1 843489416 NJMZGOGZUUCCSI-LLVKDONJSA-N 340.807 1.547 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@@]2(C)CCC(=O)NC2)cc1 844857226 YDJHZCSEFDXDKX-SFHVURJKSA-N 333.432 1.506 10 10 EDCE COc1ccc(N(C)CCN(C)S(=O)(=O)[C@H]2CCO[C@H]2C)cc1 845988183 WGLVCUKNKLEYRY-BBRMVZONSA-N 342.461 1.570 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCCC1(CN)CC1 846347536 NYOCOAIUBNUYLU-UHFFFAOYSA-N 333.432 1.376 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(C3CC3)C(=O)C2)c([N+](=O)[O-])c1 748285600 YMRKYASTYNTMQJ-CLTKARDFSA-N 345.355 1.592 10 10 EDCE COc1ccc(N2CCC(N3C(=O)N[C@@H](CCF)C3=O)CC2)cc1 844714510 OVPZRIQTGLAZOH-HNNXBMFYSA-N 335.379 1.944 10 10 EDCE COC[C@H]1C[C@@H](O)CN1C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 854296512 JFDCLPKARXNGLG-NUEKZKHPSA-N 349.431 1.065 10 10 EDCE C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@@H]1CN 926288503 MWINYJJBQWRLOT-GOEBONIOSA-N 346.475 1.154 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC(=O)N(C)[C@@H](C)C3)C2)cc1 852450964 AJVHBUYTTUFVAD-KBPBESRZSA-N 346.431 1.146 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)[C@@H]3CCN(C)C3=O)C2)cc1 854296391 CDDWZQNADFMFDZ-CZUORRHYSA-N 346.431 1.146 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)NC2CN(c3ccncn3)C2)c1 866496750 WWTHRJKHPMFIOP-LLVKDONJSA-N 328.372 1.508 10 10 EDCE Cn1ccn2c(CCNCc3cc(Cl)ccc3O)nnc2c1=O 886285723 QHTHQSPXNKANBW-UHFFFAOYSA-N 333.779 1.119 10 10 EDCE COC(=O)[C@H](NCc1cc(Cl)cc(OC)c1O)c1ccn(C)n1 787438109 IKPVYBXQYBVZSV-CYBMUJFWSA-N 339.779 1.792 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 1908254799 VRXWDISSNZSEBO-VXGBXAGGSA-N 341.412 1.763 10 10 EDCE C[C@H]1CN(C(=O)c2cn(C)nc2-c2cnn(C)c2)c2ccnn2C1 893883643 QBICHALXZFKMRO-NSHDSACASA-N 325.376 1.314 10 10 EDCE O=S1(=O)CC[C@@]2(CN(Cc3cc(F)cc(F)c3O)CCO2)C1 895078101 CVMSKIFJGYAAOF-CQSZACIVSA-N 333.356 1.060 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1cn[nH]c1 1138055147 OQMXUZWNOZOJTQ-ZDUSSCGKSA-N 347.371 1.044 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc3c(c2)C(=O)NCCO3)c1 1147962473 VFIFMXDELLGCIL-UHFFFAOYSA-N 326.352 1.753 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2ccc(N3CCCC3)cc2)CCO1 1331792967 AFNDUTGDPVKMIK-KRWDZBQOSA-N 332.448 1.417 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCO[C@H](C)C3)c(Br)cc21 92774819 DRVOPHZKNFHOSO-OQPBUACISA-N 340.221 1.887 10 10 EDCE CN1CCN(c2ccc(CN3CCNC(=O)CC3(C)C)cc2F)CC1 1338273827 IZHSDOXOJILYLO-UHFFFAOYSA-N 348.466 1.678 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)Cc2[nH]cnc2C)cc1C 1268713330 QQBPJZPZZFGPAF-ZDUSSCGKSA-N 330.432 1.872 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2C[C@H]3C(=O)OC[C@H]3C2)cc1 1351331408 RWSSHVAAWMQZCK-GDBMZVCRSA-N 331.416 1.847 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1441134340 WDXIKWPTAWNQMU-INIZCTEOSA-N 334.416 1.558 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@@H]1CCOC1 1466398239 KYYLBGQPVBVEBH-NSHDSACASA-N 341.791 1.974 10 10 EDCE COc1ccc(N2CCC(NC(=O)c3ccnc(CO)c3)CC2)cc1 1611011431 MVGPIBNAQUNMSZ-UHFFFAOYSA-N 341.411 1.981 10 10 EDCE CC(C)COC(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1542703919 IBQDDFBWIHOYKZ-UHFFFAOYSA-N 336.388 1.577 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1CCN(C)C1)NCc1ccc(OC)c(C)c1 1715078894 FGPIGBBWITXVNP-SJORKVTESA-N 333.476 1.940 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)Cc2[nH]cnc2C)cc1C 1714294666 ACVAFMQDGXAOFT-CYBMUJFWSA-N 330.432 1.872 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@H]2CCC(=O)N2)cc1C 1716277992 WZHUGVWUNPBJQH-ABCZVMIZSA-N 331.416 1.044 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccc(Cn2cnnn2)cc1 1860165768 BXVHCXIFPNQPBN-UHFFFAOYSA-N 339.355 1.105 10 10 EDCE COC(=O)N[C@H]1CCN(c2ccc(CN)c(Br)c2F)C1 231840645 GVLHQQAVUOLNKQ-VIFPVBQESA-N 346.200 1.982 10 10 EDCE CN(Cc1ccc(N)cc1)C[C@H](O)CN1C(=O)c2ccccc2C1=O 1929661111 JMVBUXPXEDOBNW-HNNXBMFYSA-N 339.395 1.358 10 10 EDCE CC(C)CNCc1ccc(N2C[C@H](O)[C@@H](O)C2)cc1Br 232638476 IYEABXZZKTYINY-GJZGRUSLSA-N 343.265 1.737 10 10 EDCE Oc1cccc(Br)c1CN[C@H]1COC2(CCC2)[C@H]1O 2141560640 ZMMOJXLQWNKDDT-AAEUAGOBSA-N 328.206 1.927 10 10 EDCE COc1ccc(O)c(CN[C@@H]2COC[C@H]2NC(=O)OC(C)(C)C)c1 1944916679 CABYMNWQXMMVEN-ZIAGYGMSSA-N 338.404 1.783 10 10 EDCE C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)c1cc(O)c(O)c(O)c1 1988122970 JMRRJPFNVABLJD-QMMMGPOBSA-N 326.349 1.446 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C2(CC2)C1 2003171539 XVRRENOQULDYNB-JHJVBQTASA-N 336.432 1.899 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCC(N=[N+]=[N-])CC2)CCOC1 2010405039 FHAIDUWYDPXGMZ-OAHLLOKOSA-N 339.396 1.972 10 10 EDCE C[C@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C[C@@H](C)N1 2053909253 DQBNZGJLRZXQMP-IYBDPMFKSA-N 329.444 1.745 10 10 EDCE COC(=O)N1CCN(c2ccc(CN)c(Br)c2F)CC1 387171757 HTEZIGDCGIOVLT-UHFFFAOYSA-N 346.200 1.935 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3Cc4c[nH]nc4C[C@@H](C)C3)c2n1 2064988336 UMOKOPBSPOQQSK-SECBINFHSA-N 326.360 1.301 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)N2CC[C@H](N=[N+]=[N-])C2)=C[C@@H]1O 1908916882 JFIGNDNGJRRSDC-TUAOUCFPSA-N 337.380 1.482 10 10 EDCE CC(C)NCc1ccc(N2CC[C@@H](O)[C@H](O)C2)c(Br)c1 2188625975 BAQIQMJIKMZBET-HUUCEWRRSA-N 343.265 1.879 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)NCCc1ccc(N)cc1 2080578683 JDSWEHSPPIYTPL-GJZGRUSLSA-N 349.431 1.298 10 10 EDCE CC1(C)[C@@H](CO)OCCN1c1ccc(CN)cc1Br 2103382689 XCDCLYXTHHSGBZ-CYBMUJFWSA-N 329.238 1.884 10 10 EDCE CNCc1ccc(N(C)[C@H]2CC(=O)NC2=O)c(Br)c1 2114727631 QZWGDJHIPWIUTD-NSHDSACASA-N 326.194 1.020 10 10 EDCE CNCc1ccc(N2CC[C@@H]([C@](C)(O)CO)C2)cc1Br 2202853774 RSZAHSSTLXGMOX-IUODEOHRSA-N 343.265 1.738 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@H]1c1ccc(Nc2nnc(=N)[nH]n2)cc1 2219017998 AVACPUYPLIOLJI-RYUDHWBXSA-N 343.391 1.803 10 10 EDCE COc1ccc(N2C[C@H](O)[C@@H](O)C2(C)C)c(OC)c1Br 2234900864 ZQCDYVFTOWCCGL-TVQRCGJNSA-N 346.221 1.787 10 10 EDCE COc1ccc(Br)c(CN2CCC[C@@](O)(CN)C2)c1O 2236046495 VDFYKFLBYMOMCL-CQSZACIVSA-N 345.237 1.449 10 10 EDCE COc1ccc(Br)c(CNC[C@@H]2COC[C@@H]2O)c1O 2227749975 HYOQZNSUFLMTLG-KCJUWKMLSA-N 332.194 1.260 10 10 EDCE O=C1C(=Cc2ccccc2)SC(=S)N1CCS(=O)(=O)O 2293223782 KTGBRADVNKOKNM-UHFFFAOYSA-N 329.424 1.776 10 10 EDCE N=C(NO)c1cnc(Sc2nnnn2CC(F)(F)F)s1 2296265415 WNFJWIPMPSCNPF-UHFFFAOYSA-N 325.301 1.147 10 10 EDCE COC(=O)C1=C(C)NC(=O)C1=Cc1cc(OC)c(OC)c(OC)c1 2297308010 WJFSGQWGAKNJPQ-UHFFFAOYSA-N 333.340 1.673 10 10 EDCE Cn1nc(Br)nc1CNCCc1ccc(O)c(O)c1 2353800462 DUHVHDPSIMTHEZ-UHFFFAOYSA-N 327.182 1.321 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@@H]2O 2355465296 XSTITNZOLDXURF-SPSJUYOASA-N 342.233 1.622 10 10 EDCE CC(=O)NN1C(=O)/C(=C\c2cccc3nccnc23)SC1=S 102720005 ZJJDRRYVOZYLHR-YRNVUSSQSA-N 330.394 1.882 10 10 EDCE O=C1c2ccccc2C(=O)c2c1cccc2C(=O)N1CC[C@H](CO)C1 128833976 TWUAPEAJFFLTGQ-LBPRGKRZSA-N 335.359 1.916 10 10 EDCE C[C@@H](Cn1ncc2ccccc2c1=O)NC(=O)c1cccc(O)c1O 193150331 SPLCDSJEIWFIMA-NSHDSACASA-N 339.351 1.626 10 10 EDCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)N[C@@H]1CC[C@H](C(=O)O)C1 194452468 YLZIWBSPPGHYAR-ABUMPJRPSA-N 344.411 1.906 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN[C@@H]2CC(=O)N([C@@H]3C[C@@H]3C)C2)c1O 376055048 PILZCQZVBZNCEX-UFGOTCBOSA-N 335.360 1.408 10 10 EDCE C[C@@H]1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC(=O)N1C 282284533 VXTBAYYAESDCPF-CQSZACIVSA-N 328.416 1.435 10 10 EDCE COc1nc(=NCc2ccc(C)c(Br)c2O)[nH]cc1N 2380724209 YPKLXNRMMHJWQQ-UHFFFAOYSA-N 339.193 1.878 10 10 EDCE Cc1ccc(Cn2cc(C3(O)COC3)nn2)c(O)c1Br 2380789298 ISYODSZBNRSJAZ-UHFFFAOYSA-N 340.177 1.321 10 10 EDCE O=C(O)/C=C\c1ccc(N2CC(=O)NC(=O)C2)c(Br)c1 394443097 YXSBLJPNNDRLTC-RQOWECAXSA-N 339.145 1.010 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@H](OC)[C@@H]2CCOC2)c1O 826822017 IXTCNNLGAHORLA-YPMHNXCESA-N 326.349 1.450 10 10 EDCE Cc1cc(CC(=O)NCCc2nnnn2C)c(C)n1-c1ccccc1 831632403 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EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cnnn1C1CCNCC1 852774991 KPZLXSKAXQMQCM-UHFFFAOYSA-N 342.447 1.541 10 10 EDCE CCOC(=O)C[C@H](O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 859230501 ZRYRISIBGLCUEX-YOEHRIQHSA-N 336.432 1.488 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H]4COC[C@H]4C3)nc12 852669498 STIIXLBRZREIIC-VXGBXAGGSA-N 346.387 1.080 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CNCC3(CCOCC3)C2)c1 925793850 SHWDVZJSYLJOII-ZFWWWQNUSA-N 348.443 1.988 10 10 EDCE COC(=O)C(C)(C)CS(=O)(=O)NNc1nc2cccnc2s1 857225695 QOMNZIDFLNATCB-UHFFFAOYSA-N 344.418 1.137 10 10 EDCE CCOc1ccc(CN2CCN(c3nccn(C)c3=O)CC2)c(O)c1 769467611 YJBLJYBFKOVRJT-UHFFFAOYSA-N 344.415 1.207 10 10 EDCE Cc1ccc([C@@H](C)NC[C@]23COCCN2C(=O)COC3)c(O)c1C 866551837 CRSDPLUSPKYHBD-RDTXWAMCSA-N 334.416 1.287 10 10 EDCE COc1ccc(N2CCCN(C(=O)C(=O)NC[C@@H]3C[C@@H]3C)CC2)cc1 1117084910 UDIHAFFIFAETSS-GJZGRUSLSA-N 345.443 1.506 10 10 EDCE Cc1nn(C)c([C@@H](O)[C@@H](N)c2ccccc2O)c1Br 1877195187 VMGDNCMNZRIOBW-AAEUAGOBSA-N 326.194 1.930 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCO[C@@H]3COCC[C@@H]32)c([N+](=O)[O-])c1 897053564 CFHWYRQTHXSHAI-ICGFCLIJSA-N 348.355 1.775 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3[C@@H](C)C[C@H]3C)CC2)cc1 791567308 JJPWVWLWELRDGQ-JZXOWHBKSA-N 333.476 1.661 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@H]3COC(=O)[C@H]3C2)c([N+](=O)[O-])c1 1307179640 ILXFJWKGJPJDJR-OPUZMVJGSA-N 332.312 1.390 10 10 EDCE O=C(N1CCC(CNCc2ccc(O)c(O)c2)CC1)C(F)(F)F 397726260 NHHXFBOVBJVVIZ-UHFFFAOYSA-N 332.322 1.988 10 10 EDCE Oc1c(F)cc(Br)cc1CN1C[C@@H]2OCCO[C@@H]2C1 1964602614 MJKRCZKACWLFBD-TXEJJXNPSA-N 332.169 1.893 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)C(=O)C(F)F 1334352293 CCCVBNYKKHNUMJ-QMMMGPOBSA-N 341.318 1.691 10 10 EDCE Cn1c(S)nnc1CCNC(=O)c1ccc(N=NC(N)=O)cc1 1443673705 ZFIULFIYMBJOJA-UHFFFAOYSA-N 333.377 1.239 10 10 EDCE Cc1nn(-c2cccnc2)nc1C(=O)NCCc1ccc(O)c(O)c1 1294914491 ZSMIOYUBIFCJSN-UHFFFAOYSA-N 339.355 1.354 10 10 EDCE C[C@H]1C[C@H](NC(=O)Cc2ccc(O)c(O)c2)C(=O)N1c1ccccc1 1465464270 QQWXKXYOGBYNDZ-WFASDCNBSA-N 340.379 1.951 10 10 EDCE Cc1nnc(Cn2nnc(C(=O)NCc3c(O)cccc3F)c2C)o1 1471976141 RRDAFTUYONNNSC-UHFFFAOYSA-N 346.322 1.101 10 10 EDCE CNC(=O)C1(C(=O)N[C@H](C)CCNCc2ccc(OC)c(C)c2)CC1 1716179847 CCGMCDFBRLHVFN-CQSZACIVSA-N 347.459 1.514 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCc2nccn2C)cc1C 1716405704 PPONVJAVEYLONB-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@@H]2[C@H](O)CO)c(Br)c1 2123209225 HCKUAYORHSPPIJ-CUOATXAZSA-N 329.238 1.791 10 10 EDCE Cn1c(CC(=O)NCc2ccc(O)cc2O)nnc1-c1ccccc1 1557084525 CTCVKCOXIZHCLA-UHFFFAOYSA-N 338.367 1.752 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)[C@H]2CCCN2C)cc1C 1717047074 UWVQHWGPMHHFEY-QGZVFWFLSA-N 349.475 1.008 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@H](C)NC(N)=O)C2CC2)cc1C 1566708605 SMYDVPXBLIAYAM-SWLSCSKDSA-N 348.447 1.045 10 10 EDCE CCC(=O)N[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1744231095 XLYFGFPBZABGAS-CYBMUJFWSA-N 331.376 1.884 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCn2ccnc2)cc1C 1669364330 ALAHCBLHLYEKPO-OAHLLOKOSA-N 330.432 1.885 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C[C@@H]2C=CCC2)cc1C 1676499516 NCBMLHSMEHGGIN-NVXWUHKLSA-N 332.444 1.927 10 10 EDCE CCN(c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-])[C@@H]1CCNC1=O 1773050564 WLXVWYYYKBLMEB-VUDGCMKMSA-N 333.344 1.496 10 10 EDCE COc1ccc(NC(=O)CCN2C(=O)CSC2=S)c(OC)c1 1865768318 KAUVHSMDQMDSIT-UHFFFAOYSA-N 340.426 1.893 10 10 EDCE CCNCc1ccc(N(C)[C@@H]2CCNC2=O)c(Br)c1 1916817086 YEHUPEOGCUDOAC-CYBMUJFWSA-N 326.238 1.883 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(NCc2cc(F)cc(F)c2O)C1 1918577710 VRMWEQSIUSLHAN-UHFFFAOYSA-N 344.358 1.742 10 10 EDCE CCOC(=O)[C@H]1C[C@@]1(N)c1cc(I)ccc1O 1952774464 HSFLWYJSHHQEIQ-BXKDBHETSA-N 347.152 1.734 10 10 EDCE NCc1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)c(F)c1Br 2146317382 AQBQWSWTECTUDX-ZIAGYGMSSA-N 345.212 1.228 10 10 EDCE CC(C)(C)OC(=O)N1CCn2ncc(C(=O)N3CC(N=[N+]=[N-])C3)c21 2010391672 UIXXDYXVKNPXGR-UHFFFAOYSA-N 333.352 1.773 10 10 EDCE CCCNCc1ccc(N2CC[C@](O)(CO)C2)c(Br)c1 313684078 QZWKLAGFGHGMOV-OAHLLOKOSA-N 343.265 1.882 10 10 EDCE O=C1NC(=O)[C@H]2CN(c3ccc(CO)cc3Br)CC[C@H]12 2158789543 MOFIYHBFLZLDHB-UWVGGRQHSA-N 339.189 1.040 10 10 EDCE COC(=O)C1(O)CN(c2ccc([C@@H](C)N)c(Br)c2)C1 714425918 IVUFDQPCJRTHNT-MRVPVSSYSA-N 329.194 1.193 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2199533016 SVGVGHINUXPFQT-AISOMTMTSA-N 342.233 1.823 10 10 EDCE N[C@H]1CN(Cc2ccc(Br)cc2O)[C@@]2(CCOC2)C1 2098287997 SSXJQAKAFKRMIY-OCCSQVGLSA-N 327.222 1.847 10 10 EDCE CC(C)(C)OC(=O)NC[C@@]12CCC[C@]1(COc1nnc(=N)[nH]n1)C2 2213781305 QEBNGAJDCKNCQP-LSDHHAIUSA-N 336.396 1.143 10 10 EDCE COc1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)c(OC)c1Br 2234903786 SJWVFWIIEFRKEU-SMDDNHRTSA-N 346.221 1.788 10 10 EDCE NCc1ccc(N2C[C@@H]3OCCC[C@]3(CO)C2)cc1Br 2238821278 UMIUNVITLKOIGB-LSDHHAIUSA-N 341.249 1.886 10 10 EDCE COCCN1C(=O)C(=Cc2ccc(C(=O)O)cc2)C(C(=O)OC)=C1C 2294082163 KGZIYQNYFIMAJP-UHFFFAOYSA-N 345.351 1.704 10 10 EDCE CC(=O)NN1C(=O)C(=C2C(=O)N(C)c3ccccc32)SC1=S 2297295605 MAGKQUGVMCSRBP-UHFFFAOYSA-N 333.394 1.286 10 10 EDCE Cc1ccc(CN[C@@H](C)CS(C)(=O)=O)c(O)c1Br 2327618480 KXEZMNZUVBGBNK-VIFPVBQESA-N 336.251 1.986 10 10 EDCE CCn1nnnc1CNCc1ccc(C)c(Br)c1O 2352673451 WYCJDXQSYCDDGF-UHFFFAOYSA-N 326.198 1.759 10 10 EDCE Cc1ccc(CNC(=O)C2CS(=O)(=O)C2)c(O)c1Br 2352639979 DRDPGBPNAFKLCO-UHFFFAOYSA-N 348.218 1.124 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1C[C@@H]2C[C@H]1[C@H](O)[C@H]2O 2355455539 ZSDARITZVXUPPP-NEVCATMESA-N 342.233 1.622 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC(n3cncn3)CC2)cc1 101601652 DXXCTMBAUZSASJ-UHFFFAOYSA-N 328.420 1.891 10 10 EDCE CN(C)/C=C1/SC(=S)N(N2C(=O)c3ccccc3C2=O)C1=O 33336617 XQJGLYVWYNOVLP-JXMROGBWSA-N 333.394 1.461 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2358208210 PKWAXLVCYODCSR-XAGKMFGPSA-N 347.228 1.609 10 10 EDCE C[C@H](NC[C@]1(CCO)CCOC1)c1ccc(N2CCOCC2)cc1 125437665 AWOXUNDFJZGDHC-LPHOPBHVSA-N 334.460 1.963 10 10 EDCE CCc1nc2n(n1)C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)CC2 181087117 FMDYQSVDIQCACQ-WNPFHQFXSA-N 328.372 1.396 10 10 EDCE Cc1oc2c(c1C(=O)NCCCC(=O)O)C(=O)c1ccccc1C2=O 39853792 OQNUAGBTGGZYGD-UHFFFAOYSA-N 341.319 1.958 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@H]3CCCCNC3=O)CC2)cc1 45669471 VRNMTHPGCGXWKY-INIZCTEOSA-N 346.431 1.196 10 10 EDCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)CCN2CCCC2)c1 189649420 OTWUYKNUQGFQIJ-GFCCVEGCSA-N 328.434 1.477 10 10 EDCE O=C1CN(c2ccc(CNC(=O)Nc3cccnc3)cc2)CCN1 40520742 AHLRBZUITYCHPD-UHFFFAOYSA-N 325.372 1.340 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnc4nc[nH]c4c3)CC2)cc1 82320413 UXWOUEGMMRTGKH-UHFFFAOYSA-N 337.383 1.929 10 10 EDCE COCCC(=O)N1C[C@@H]2CN(Cc3ccc(N(C)C)cc3)C[C@H]2C1 96080893 TUVHSYCHEXMQSS-IRXDYDNUSA-N 331.460 1.679 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)/C=C/C3CC3)CC2)cc1 266258685 KGZOCDUZMVSEAO-RUDMXATFSA-N 329.444 1.900 10 10 EDCE CCNC(=O)N1CC[C@H](N[C@H](C)c2cc(C(=O)OC)ccc2O)C1 273536134 XKZNLPXBGWHSIF-YPMHNXCESA-N 335.404 1.633 10 10 EDCE Cc1ccc(CN(C)CC2(O)CC(CN)C2)c(O)c1Br 2381129334 ISTFBWLHWZTTHS-UHFFFAOYSA-N 343.265 1.995 10 10 EDCE COCCNC(=O)CN(C)c1ccc([C@@H](C)N)c(Br)c1 723185092 HCUQNBBXAGFXJE-SNVBAGLBSA-N 344.253 1.668 10 10 EDCE Cc1cc(CC(=O)N2CCNC(=O)CC2)c(C)n1-c1ccccc1 825933976 DALKGNUOVDNGGO-UHFFFAOYSA-N 325.412 1.985 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1CCC[C@](O)(CO)C1 837627807 ZZNBQXNJNHCROM-GOSISDBHSA-N 333.432 1.316 10 10 EDCE CCCNC(=O)[C@@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 588404524 BHPYAXLDNKNJHT-IQCBXXCUSA-N 332.400 1.876 10 10 EDCE O=C1O[C@@H](CNCc2ccc(N3CCOCC3)cc2)CN1C1CC1 848578265 PTYTVEXMLBTQNJ-KRWDZBQOSA-N 331.416 1.596 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)[C@H]1CCN(C)S1(=O)=O 843819646 DIYOYLMWAYZBIA-CQSZACIVSA-N 326.418 1.165 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1CNCC[C@@H]1C)c1ccc(N(C)C)cc1 842203174 QCFKPRXYLSBLKX-HEHGZKQESA-N 332.448 1.044 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@]3(C)C[C@H](O)CN3C)C2)cc1 911276999 QLTDDMUESKHTMY-ALKREAHSSA-N 347.459 1.093 10 10 EDCE C[C@H]1CN(CCCNC(=O)NCc2c(O)cccc2F)C[C@H](C)O1 913987842 CFHPQSGQUXZWOP-STQMWFEESA-N 339.411 1.830 10 10 EDCE COc1ccc(N(Cc2cc(=O)n3nc(N)[nH]c3n2)CC(C)C)cc1 856729798 VHHOTCFYSGDODS-UHFFFAOYSA-N 342.403 1.671 10 10 EDCE CCN1CC[C@@H]1CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 925094714 CIYQYEXATKABOJ-CYBMUJFWSA-N 337.807 1.904 10 10 EDCE C[C@@H](O)[C@@H]1CCN(c2cc(N3Cc4cccc(O)c4C3)ncn2)C1 866117785 RBMKAZVLWRYYLT-CHWSQXEVSA-N 326.400 1.910 10 10 EDCE Cc1ccc(O)c(CNC(=O)C(=O)Nc2cnc(C)nc2C2CC2)c1 862024891 JFVIDAJDJKWMQS-UHFFFAOYSA-N 340.383 1.931 10 10 EDCE C[C@H](NC[C@@]12COCCN1C(=O)COC2)c1ccc(Cl)cc1O 866554873 OHBNQVSJRJTFFF-ZBEGNZNMSA-N 340.807 1.324 10 10 EDCE Cn1ccc([C@@H]2NC(=O)N(Cc3ccc(N4CCCC4)cc3)C2=O)n1 761089069 DIDXAUPWAQRNLU-INIZCTEOSA-N 339.399 1.813 10 10 EDCE O=C(NC[C@]1(O)[C@H]2[C@H]3C[C@@H]4[C@H]5[C@@H](C[C@H]42)[C@@H]1[C@@H]53)c1cccc(O)c1O 787680223 BBPKBDLWUNNSBV-UDCIDDOOSA-N 327.380 1.337 10 10 EDCE COC(=O)[C@H]1[C@H](CNCc2ccc(N3CCOCC3)cc2)C1(F)F 894199673 BXTSDNKVRKMKQE-LSDHHAIUSA-N 340.370 1.667 10 10 EDCE CN[C@@H](C)c1ccc(N2CCC2(CO)CO)c(Br)c1 1879986635 LABKTZPHFOXBRL-JTQLQIEISA-N 329.238 1.663 10 10 EDCE CC(C)N(C)S(=O)(=O)NCc1cc(Br)ccc1O 796190401 HBGLXANWWPXHFN-UHFFFAOYSA-N 337.239 1.829 10 10 EDCE Cc1ccc(O)c(CNC(=O)[C@H](CO)NC(=O)c2ccc(F)cc2)c1 1147961414 DJRKMJUMWRPZEY-HNNXBMFYSA-N 346.358 1.247 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H]2[C@@H]1[C@H]2C(=O)NCCCN=[N+]=[N-] 1964884952 VBLDXOFKEKQLCH-OUAUKWLOSA-N 325.369 1.437 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@](O)(CN(C)C)C2)c(Br)c1 713712737 SIHNZVUKGACPCQ-ABAIWWIYSA-N 342.281 1.972 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(C)C[C@H]2CO)c(Br)c1 699431922 HGYGEWDMFONQJD-PWSUYJOCSA-N 329.238 1.615 10 10 EDCE CC[C@@H](C)C(=O)NC1CN(Cc2nnnn2-c2ccc(OC)cc2)C1 1267636433 CTHOUZZTZMZVNP-GFCCVEGCSA-N 344.419 1.017 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H](C)NC(C)=O)cc1C 1274669583 GCYPSNGUOCKECA-KBPBESRZSA-N 335.448 1.513 10 10 EDCE CC(=O)N(C)CCOCCNC(=O)c1ccc(N=NC(N)=O)cc1 1510205627 RICREAWTBZHFRV-UHFFFAOYSA-N 335.364 1.074 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H]2CCS(=O)(=O)[C@@H]2C)c1 1479095798 CTQMNJAIKPDMQY-GIPNMCIBSA-N 342.417 1.337 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)Cc2cccnc2)cc1C 1482722186 OMQSICMYWLEARQ-KRWDZBQOSA-N 343.427 1.208 10 10 EDCE C[C@H](NCCCO)[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1716975278 KZZMVNXOSDERSB-GXTWGEPZSA-N 347.419 1.672 10 10 EDCE CCc1noc(COCC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n1 1556158278 WKLPBCHCEUWSDL-SNVBAGLBSA-N 335.360 1.307 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@H](C)c2ccco2)cc1C 1725545637 UJVNIIJILNPJJS-ZBFHGGJFSA-N 346.427 1.967 10 10 EDCE C[C@H](NC(=O)c1cnn2c(=O)cc[nH]c12)c1ccc(N(C)C)cc1 1556260606 OGITUXQCBYDXAS-NSHDSACASA-N 325.372 1.580 10 10 EDCE CO[C@H](C)C(=O)NC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1721805122 DAJGGPWZZPKAEW-ZLMLVOMNSA-N 347.375 1.286 10 10 EDCE O=C(NCc1cccc(Br)c1O)c1ccc(CO)nc1 1634724538 DONJOJJSHLYGQT-UHFFFAOYSA-N 337.173 1.972 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)Cn2cccn2)cc1C 1569181168 JGTXPXCYRIZTBJ-UHFFFAOYSA-N 330.432 1.838 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)Cc2nnc(C)o2)cc1C 1498038917 IJMSQZYUHOZFST-LBPRGKRZSA-N 332.404 1.532 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2oc(C)nc2C)cc1C 1568554944 SPJODDDNAJKOON-OAHLLOKOSA-N 347.415 1.489 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)NCc1cc(O)ccc1O 1637126373 VUIMMNPJPHDDSW-UHFFFAOYSA-N 340.376 1.255 10 10 EDCE CCC(=O)N[C@@H](C)C(=O)NCC1(NCc2ccc(OC)c(C)c2)CC1 1733244661 SWYBWWRHDAMVCD-AWEZNQCLSA-N 347.459 1.657 10 10 EDCE CN(CCF)C[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1734547682 VMXOVKRRAGOMIE-CYBMUJFWSA-N 339.371 1.183 10 10 EDCE OCc1ccc(N2CC[C@@]3(C[C@H](O)CO3)C2)c(Br)c1 2137134471 QBGLLFDWTPOQOB-SMDDNHRTSA-N 328.206 1.672 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCO[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2010392371 FWFFGNTWTSNREQ-SDDRHHMPSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(C(=O)N1CC[C@H](N=[N+]=[N-])C1)C(C)(C)O 2010404154 PAUKFCLOORMTEP-BONVTDFDSA-N 341.412 1.952 10 10 EDCE O=C1NC[C@@H]2CN(Cc3cc(Br)cc(F)c3O)CC[C@@H]12 2157179451 PBIIZBXHEUTSJI-MWLCHTKSSA-N 343.196 1.862 10 10 EDCE OC[C@@H]1CN(c2ccc(CNC3CC3)cc2Br)C[C@H]1O 316251380 DTSKJBORWQHJER-XHDPSFHLSA-N 341.249 1.491 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)C[C@H](O)C2)cc1Br 2161358127 WWJBQOAPOZGXKN-KBPBESRZSA-N 343.265 1.881 10 10 EDCE CN1CCN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)[C@@H]2C[C@H]21 2168397034 VBPZWWVWZYXLED-UPJWGTAASA-N 338.205 1.327 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)C1(NC(=O)OC(C)(C)C)CC(O)C1 2073274267 XNNWLTIYWZYYIR-UHFFFAOYSA-N 349.431 1.645 10 10 EDCE Oc1cc(Br)ccc1CNC[C@@H]1CO[C@@H]2COC[C@@H]21 2101846494 IQKATOWNLYJHJI-MPKXVKKWSA-N 328.206 1.906 10 10 EDCE CC[C@H](O)CN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2106620251 IBSKDLYJBCLDIM-JVXZTZIISA-N 328.210 1.608 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213593220 VZYSBULYVRQLCD-LPEHRKFASA-N 340.384 1.103 10 10 EDCE CO[C@@H](CCNC(=O)OC(C)(C)C)C(=O)NCc1ccc(N)cc1 2302453084 GSIQSEYMNNFIGM-AWEZNQCLSA-N 337.420 1.815 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2329195229 XJSYVIIMEXTKMQ-UMGHXEBTSA-N 328.206 1.698 10 10 EDCE CSc1nc2n(n1)[C@@H](c1ccc(N(C)C)cc1)C(C(N)=O)=C(C)N2 20413599 SAYSZTYPMXWQIW-ZDUSSCGKSA-N 344.444 1.840 10 10 EDCE CC[C@@H](CO)N1CCN(Cc2cc(Cl)cc(OC)c2O)CC1 184699789 UDQOJMXEZCUGOF-AWEZNQCLSA-N 328.840 1.943 10 10 EDCE CN(C)c1noc([C@H]2CCCN(Cc3cc4c(cc3O)OCO4)C2)n1 194932023 LVXDPYXYIJKZSY-NSHDSACASA-N 346.387 1.950 10 10 EDCE C[C@H]1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)C[C@@H]1N(C)C 266141741 FSBQAFQXLCPNQB-GZWGRDOWSA-N 343.471 1.945 10 10 EDCE CC[C@@H]1NC(=O)CN(Cc2ccc(C)c(Br)c2O)C1=O 2380812521 WQDRQAXKTGMCOQ-JTQLQIEISA-N 341.205 1.700 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCCCS1(=O)=O 808094135 BVOLYXPHUDVARI-GFCCVEGCSA-N 332.418 1.461 10 10 EDCE CN(C)S(=O)(=O)N1CCC[C@@H](NCc2cccc(Cl)c2O)C1 809726389 HXIRPUFHHJRRJD-GFCCVEGCSA-N 347.868 1.406 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CCCN(C)C3=O)C2)cc1 819589875 HMUORMASUMVGFS-PBHICJAKSA-N 345.443 1.506 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@H]3CCNC(=O)CC3)CC2)cc1 815258966 OTPGCYSTEIGMDA-CQSZACIVSA-N 345.443 1.697 10 10 EDCE CCOc1ccncc1S(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1 821198029 JTUVPYLRVGZVSN-UHFFFAOYSA-N 339.329 1.895 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Nc3cncnc3OC)C2)cc1 821883453 GQZUALNENOQFLG-LBPRGKRZSA-N 343.387 1.894 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCC(C(=O)NCCCO)CC2)cc1 835026693 ZSMDJOQYFLIMGW-HWKANZROSA-N 345.487 1.976 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)[C@@H]4CSCCN4C3=O)C2)cc1 849356646 GGHLGSXCEYITRP-ZFWWWQNUSA-N 347.440 1.654 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1CCCNC1=O 840283712 FZULECFBMGXZLH-CJNGLKHVSA-N 332.448 1.570 10 10 EDCE C[C@@H](NC(=O)COC1(C)CNC1)c1ccc(N2CCOCC2)cc1 844176284 NRFKTFYDOYBZQB-CQSZACIVSA-N 333.432 1.079 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)N(C)C(C)C)C2)cc1 849416291 OEBWIOIDOAHMLP-ZDUSSCGKSA-N 327.450 1.449 10 10 EDCE CCO/C=C\C(=O)OCC(=O)N1CCN(c2ccc(OC)cc2)CC1 840586785 KLXSLNSMHFRIMO-JYRVWZFOSA-N 348.399 1.437 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H](C)[C@@](C)(CO)C3)C2)cc1 854296987 MGQNBZPAXZVJNN-YZVOILCLSA-N 347.459 1.934 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCC(C)(C)CS(C)(=O)=O 926731827 LFDXWVNCRKJEEF-UHFFFAOYSA-N 328.434 1.604 10 10 EDCE C[C@H](NC(=O)[C@@H](O)c1cnc[nH]1)c1ccc(N2CCOCC2)cc1 865019179 NNYDFKWYLZEUFK-LRDDRELGSA-N 330.388 1.157 10 10 EDCE CCc1nc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)no1 775397184 SMAZHJLWAVQOFO-UHFFFAOYSA-N 334.351 1.742 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCO[C@H](C(N)=O)C2)c1 781904008 DSPRTXHOXNGRDH-NSHDSACASA-N 329.194 1.149 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCOCC2(CC2)C1 782538308 DBYCWIKYZVKLGH-UHFFFAOYSA-N 331.460 1.823 10 10 EDCE C[C@H]1CN(c2ccc(CNC(=O)[C@H]3C[C@H]3C(N)=O)cc2F)C[C@H](C)O1 1136310944 BHSIMQZWPPSCMC-VTPLQMEGSA-N 349.406 1.177 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@H]2CCN(C)C(=O)C2)cc1C 1317602142 MHCKHKPIZBFPBV-INIZCTEOSA-N 347.459 1.420 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)[C@H](CO)C2)cc1Br 704778023 KMLAYWLHNODFLZ-RYUDHWBXSA-N 329.238 1.206 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)C2(C(N)=O)CC2)cc1C 1283664734 OHKSFUBWYLYEOI-ZDUSSCGKSA-N 333.432 1.206 10 10 EDCE CC[C@H](O)Cn1cc(C(=O)NCc2ccc3cccnc3c2O)nn1 1451957804 UWHVSNXQVQITCJ-ZDUSSCGKSA-N 341.371 1.233 10 10 EDCE O=C1NC[C@]2(CCN(Cc3cc(Br)ccc3O)C2)N1 2121192911 JMWAKEUMUDBUQV-ZDUSSCGKSA-N 326.194 1.412 10 10 EDCE CCCCNC(=O)[C@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1629042200 DSMPKYIKAHGKBP-GFCCVEGCSA-N 338.429 1.458 10 10 EDCE Cc1cc(C(=O)N[C@H](CO)[C@H]2CCOC2)c(C)n1-c1ccccn1 1624224759 GCOJUEZUIYRAIQ-GOEBONIOSA-N 329.400 1.616 10 10 EDCE Cc1noc([C@@H]2OCC[C@@H]2NC(=O)NCc2c(O)cccc2F)n1 1565160286 KTRAWKIAPQPACE-WCQYABFASA-N 336.323 1.552 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cc2cncn2C)cc1C 1568951211 NISSRUKAYITCAA-SNAWJCMRSA-N 342.443 1.742 10 10 EDCE COCCCN(C(=O)Cc1ccc(O)c(O)c1)C1CCN(C)CC1 1642099125 JLWJYUABNUKVLN-UHFFFAOYSA-N 336.432 1.600 10 10 EDCE C[C@@H](CC(=O)NCc1cc(O)ccc1O)NC(=O)c1ccccc1 1644752787 UYYMHQXLKIJZRG-LBPRGKRZSA-N 328.368 1.923 10 10 EDCE C[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CCS1(=O)=O 1652551441 CWFRPEHMVCUYMQ-CABZTGNLSA-N 338.389 1.545 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2CN(C)CCO2)cc1C 1676324803 XSICCOBNIRSDRE-MAUKXSAKSA-N 349.475 1.271 10 10 EDCE CC[C@@H](OC)C(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1688152972 CCHZYBOEEFTEGU-ZWNOBZJWSA-N 349.391 1.509 10 10 EDCE O=C(O)Cc1ccc(NC(=O)CCN2C(=O)CSC2=S)cc1 1865769379 YUUBOEVRDRIPKH-UHFFFAOYSA-N 338.410 1.503 10 10 EDCE NC[C@H]1CN(C(=O)c2ccc(O)c(O)c2)CCN1Cc1ccccc1 1914862542 NHHNJJUPCFRYRB-INIZCTEOSA-N 341.411 1.383 10 10 EDCE Oc1cccc(Br)c1CN1[C@H]2CCNC[C@H]1COC2 2139775359 JWXSZBZUONOSHK-QWRGUYRKSA-N 327.222 1.717 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@@H](CCO)C3)c(Br)cc21 123540742 CPHHVNBMUPXYFV-ISVAXAHUSA-N 340.221 1.610 10 10 EDCE Cn1nnc(Br)c1CNCc1ccc(F)c(F)c1O 1973335192 QGNPDSVXGSZWBQ-UHFFFAOYSA-N 333.136 1.851 10 10 EDCE C[C@H](NC[C@H](O)CNC(=O)OC(C)(C)C)c1ccc(O)cc1O 1985771337 GXFBTZMFWOKHKT-JQWIXIFHSA-N 326.393 1.634 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@]2(COCCN2CCN=[N+]=[N-])C1 2006177593 SJYOWIWRRPUYLD-OAHLLOKOSA-N 341.412 1.635 10 10 EDCE C[C@@H](O)c1ccc(N2CC(S(C)(=O)=O)C2)cc1Br 2034833196 PTRRJMJBFZCILY-MRVPVSSYSA-N 334.235 1.736 10 10 EDCE Nc1ccc(N2CCN(C[C@H](O)COCc3ccccc3)CC2)cc1 2038127009 ZWASYPMDXISWEG-FQEVSTJZSA-N 341.455 1.969 10 10 EDCE CN(C)C[C@H]1CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2160881883 ITMBMKHWMKTGNE-AMIZOPFISA-N 339.237 1.541 10 10 EDCE COc1ccc(N2[C@H](C(=O)O)CC[C@@H]2C(=O)O)cc1Br 703438874 LLDICGPXXUZUKD-AOOOYVTPSA-N 344.161 1.964 10 10 EDCE COc1ccc(N2C[C@H](N)[C@H]3COC[C@@H]32)c(OC)c1Br 2162633861 BZPJQMGOENOYNL-YWVKMMECSA-N 343.221 1.629 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC4(CC[C@@H]4O)C3)c(Br)cc21 2179703367 KZJXGIVXKOALCE-NWDGAFQWSA-N 338.205 1.362 10 10 EDCE CCN(c1ccc(CNC)cc1Br)[C@H]1CC(=O)NC1=O 2171190324 NFXYFIAPKWNDAU-LBPRGKRZSA-N 340.221 1.410 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2182546348 AQYLSLHUOHQBAB-PZSFLXJQSA-N 342.233 1.680 10 10 EDCE CN1CCO[C@H]2CCN(c3ccc(CO)cc3Br)C[C@H]21 2185528212 GFXDMZKQGKYFMI-CABCVRRESA-N 341.249 1.851 10 10 EDCE COCCNCc1ccc(N2CC(CO)C2)cc1Br 2092552886 RBEGRJRHQSSEJS-UHFFFAOYSA-N 329.238 1.614 10 10 EDCE CCNCc1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)c(Br)c1 2201283467 FQIROOSATCSOAG-YABSGUDNSA-N 338.249 1.726 10 10 EDCE CN(C)c1ccc([C@@H](O)C(=O)c2nn(C)nc2Br)cc1 2235692116 RDGFPZJOHSXOQW-LLVKDONJSA-N 339.193 1.560 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CCN(C(N)=O)C2)c1O 2236048239 AFGSOASKXQIYDZ-QMMMGPOBSA-N 344.209 1.406 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCN=[N+]=[N-])[C@H](O)C(F)(F)F 2242876553 TVHZOXXUNSGMDS-RQJHMYQMSA-N 341.290 1.229 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CNC(=O)C2(C)C)c1O 2281187221 YRFPHKVPLMYFMN-LLVKDONJSA-N 343.221 1.778 10 10 EDCE O=S1(=O)C[C@H]2CN(Cc3cccc(Br)c3O)C[C@H]21 2314965114 TYEJMWLAUWKPMP-MWLCHTKSSA-N 332.219 1.384 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2333234162 PIEOMJKLILKFAE-KQXJFYCDSA-N 334.185 1.382 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2CCCn3ncnc32)c1 177321819 PPWNVZILSDNHNK-GWCFXTLKSA-N 331.376 1.888 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N(C)C)cc1)C(=O)NCc1ccco1 65985102 OEDIWYLJBSMSMA-CYBMUJFWSA-N 344.415 1.850 10 10 EDCE C[C@H](O)CN1CCC(CN(C)Cc2cc3c(cc2O)OCO3)CC1 121146723 LYDTYINHVWCOSB-ZDUSSCGKSA-N 336.432 1.646 10 10 EDCE CC(C)CN1CCO[C@@H](CNC(=O)CN(C)Cc2ccccc2O)C1 264627208 TXEBIZBDRLKZNX-KRWDZBQOSA-N 349.475 1.297 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@H](C(=O)OC)C2)c([N+](=O)[O-])c1 298695062 CYBFNYPQTKOTRK-FUEXJSSKSA-N 334.328 1.780 10 10 EDCE O=C(CN1CCSC1=O)NCc1cc(Br)ccc1O 804737282 MXYKYNUBFFRGOD-UHFFFAOYSA-N 345.218 1.940 10 10 EDCE C[C@H](NC(=O)C(=O)N1CCCSCC1)c1ccc(N(C)C)cc1 807670908 IVUZATVMNCTNLW-ZDUSSCGKSA-N 335.473 1.895 10 10 EDCE CN(C)c1ncccc1CN1C(=O)CN(Cc2ccccc2O)C1=O 819163985 DHEOHVLXMURWHP-UHFFFAOYSA-N 340.383 1.818 10 10 EDCE NS(=O)(=O)C1(CNCc2c(O)cccc2Br)CCC1 721515480 GWDUBRQCBWLDAR-UHFFFAOYSA-N 349.250 1.456 10 10 EDCE COc1ccc(CN(C)c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)cn1 747842075 WFSKAYWJZKMCFU-UHFFFAOYSA-N 344.327 1.966 10 10 EDCE COc1ccc(N2CCCN(C(=O)N[C@@H]3CNCC[C@@H]3C)CC2)cc1 841975428 FVTPQRDIXIHKBQ-MAUKXSAKSA-N 346.475 1.915 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C[C@@H]1CN(CC)C(=O)O1 847001504 JMBMTUPIGXLZIT-CQSZACIVSA-N 336.388 1.598 10 10 EDCE CO[C@@H](CS(=O)(=O)NC[C@H](N)c1ccc(N(C)C)cc1)C1CC1 842784998 JWRXGEUHGJQUDJ-HOTGVXAUSA-N 341.477 1.097 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)CCc2cnn(C)n2)cc1 844856712 MRLHOMCOEJNOPF-UHFFFAOYSA-N 331.420 1.351 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1C[C@H](O)CC2(CCOCC2)C1 922897657 BEMMXXUTKLIVLG-KWEXDPCDSA-N 333.384 1.501 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3conc3C(C)(C)N)C2)cc1 852900065 HQQZRZMSBJOTBI-LBPRGKRZSA-N 344.415 1.886 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3CSC[C@]3(C)C2)cc1 929237812 MGPCWFPMWKHAQC-KDOFPFPSSA-N 347.484 1.580 10 10 EDCE Cc1ccc(C(=O)NCCN2C[C@H]3CCCCN3C2=O)c(O)c1O 856142892 IAARLJBWIQWILF-GFCCVEGCSA-N 333.388 1.426 10 10 EDCE CC12CC(CN1CC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2 852785221 CNSDGZSHWAVNNL-UHFFFAOYSA-N 347.434 1.763 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)c3ccnn3C)C2)cc1 855226754 TZEAUZZBQUGNIG-KGLIPLIRSA-N 328.416 1.927 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCN3CCCC3=O)C2)cc1 854213525 HWBRNMCIPKJPEP-AWEZNQCLSA-N 346.431 1.196 10 10 EDCE CNC(=O)c1cccc(OCC(=O)NCc2cc(OC)ccc2O)c1 759617196 BPXRESTWUPPFFZ-UHFFFAOYSA-N 344.367 1.456 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cc3c(O)ncnc3cn2)c1 779000793 GGKVTQJIDZZXTP-UHFFFAOYSA-N 326.312 1.375 10 10 EDCE O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)N1Cc2cccc(O)c2C1 871199696 SNQSDQAWOKLSCU-CHWSQXEVSA-N 328.368 1.410 10 10 EDCE COc1ccc(N2CCCN(C(=O)NCc3cn(C)nn3)CC2)cc1 783014777 ZOTGGSKONNDVME-UHFFFAOYSA-N 344.419 1.246 10 10 EDCE CCN1CCN(Cc2c(C(=O)OC)n(C)c3ccc(F)cc23)CC1=O 894460681 WTONLXQEGKDKJO-UHFFFAOYSA-N 347.390 1.768 10 10 EDCE CN1CCN(c2ccc(CN(C)Cc3cnccn3)cc2F)CC1 1323304607 TZANWYMTNQYGPW-UHFFFAOYSA-N 329.423 2.000 10 10 EDCE COC1(OC)CCOC[C@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1470329060 XNKYOFDJLBUSOZ-GFCCVEGCSA-N 336.348 1.357 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CCC(=O)N2C)cc1C 1496143971 GLJVZLSSXRYRTE-GOEBONIOSA-N 347.459 1.561 10 10 EDCE CCOC(=O)N1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1567783021 UECPWIVFAPSKMR-GFCCVEGCSA-N 333.348 1.810 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2n[nH]c(C)c2C)cc1C 1734362122 SCORFALKSACKIO-OAHLLOKOSA-N 346.431 1.224 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1cc(S(N)(=O)=O)oc1Cl 1588155278 DAHDNECMCNNMNH-UHFFFAOYSA-N 344.776 1.558 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3n[nH]cc3F)cc2)C1 1597004582 SQKQLXCXQZWMOC-LBPRGKRZSA-N 345.378 1.181 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H]2CN3CCC2CC3)cc1C 1690575736 ZMMPQJQMWZJIJU-YJBOKZPZSA-N 345.487 1.940 10 10 EDCE OCc1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2134819411 GCMYFCKATAJJFG-VGSLSFOHSA-N 328.206 1.262 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)cc1Br 2140659150 RHQVGWUBMMLDSR-GIMBAOAISA-N 333.201 1.349 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)cc1Br 2140661886 JFTCJQKUGNUTEL-RWMBFGLXSA-N 333.201 1.048 10 10 EDCE CN(C)c1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)cc1 1997764577 BNURZHZIIFXQCS-HZPDHXFCSA-N 335.448 1.822 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)NCc1ccccc1O 269144009 NOQZQJAAUCTAOM-CHWSQXEVSA-N 336.388 1.379 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C(F)(F)C1 2003172255 IHJLYZASYNNCAW-GMTAPVOTSA-N 346.374 1.754 10 10 EDCE COC1(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 2010403485 FCYJGXGLBLRFLS-LLVKDONJSA-N 339.396 1.781 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NCc2cccc(F)c2O)C1 2011917901 MSCLUBZENNCWAY-UONOGXRCSA-N 340.395 1.991 10 10 EDCE CN(C)C(=O)CN(Cc1ccccc1)c1ccc2c(c1)NC(=O)[C@H]2O 2034786990 JEXSOKJNAPKPPW-SFHVURJKSA-N 339.395 1.767 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@](O)(CO)C2)cc1Br 314018323 RFFUFCRZCIAQSU-IINYFYTJSA-N 329.238 1.792 10 10 EDCE C[C@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C[C@H](C)N1 2053909251 DQBNZGJLRZXQMP-HOTGVXAUSA-N 329.444 1.745 10 10 EDCE CNCc1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)c(Br)c1 2178081053 BNGGFDNZIAYFMA-ZOWXZIJZSA-N 341.249 1.612 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)c(Br)c1 2182559132 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337.239 1.831 10 10 EDCE Cc1ccc(CN2CCC(O)(CO)CC2)c(O)c1Br 2352687718 QNLOHZOJWDGPCB-UHFFFAOYSA-N 330.222 1.782 10 10 EDCE COCCN(Cc1ccc(C)c(Br)c1O)C1CNC1 2352942949 MXSSRFPMTCKZGB-UHFFFAOYSA-N 329.238 1.883 10 10 EDCE C[C@@H](CN[C@H](C)c1ccc(N2CCOCC2)cc1)N1CCOCC1 123213799 FKJGYCQFAMDKLV-DLBZAZTESA-N 333.476 1.895 10 10 EDCE C[C@@H](NC(=O)c1cccc(O)c1O)c1nnnn1-c1ccccc1 193073639 KWQABHPBGCNPAS-SNVBAGLBSA-N 325.328 1.565 10 10 EDCE CC[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)CCN1C[C@H](C)O 247567392 RJMHPBGBTDQRSV-DOTOQJQBSA-N 348.491 1.739 10 10 EDCE COCc1nc(=NCc2ccc(C)c(Br)c2O)n(C)[nH]1 2381129898 QZDBITWEFCVRCJ-UHFFFAOYSA-N 341.209 1.772 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2[C@@H]3NCCO[C@H]32)c(O)c1Br 2381141983 HINFTHKJORRWGZ-CDMKHQONSA-N 341.205 1.066 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC34CC4)CC2)cc1 817525251 ZMTFBNRWDBCUAH-KRWDZBQOSA-N 329.444 1.734 10 10 EDCE CN(C)c1ccc(/C=C/CN[C@H]2CCCN(S(C)(=O)=O)C2)cc1 835037635 RRKYRZGHVHAOAH-NBUZRDOWSA-N 337.489 1.779 10 10 EDCE COc1ccc(N2CC[C@H](N[C@H](Cc3ccccc3)C(N)=O)C2)cc1 849321717 KTWRRMHEGJLMSP-QFBILLFUSA-N 339.439 1.960 10 10 EDCE COc1ccc(N2CC[C@@H](CN3C(=O)N[C@@H](CCF)C3=O)C2)cc1 844725276 KFNDVXKDQYBZCX-DOMZBBRYSA-N 335.379 1.802 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)N(C)CC3CC3)C2)cc1 849416297 OGRPOVKQNCZTJX-CQSZACIVSA-N 339.461 1.450 10 10 EDCE Cn1nnc2c1C[C@@H](NCc1ccc(N3CCOCC3)cc1)CC2 922997643 DUTBYMQTMRHFBK-HNNXBMFYSA-N 327.432 1.299 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C/c1ccnn1-c1ccncc1 853002842 WZPXFMWIRFHISO-SDNWHVSQSA-N 341.396 1.570 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC2C[C@H]3C[C@@H]3C2)c1 853893058 HJNIKDRNZCAMEM-QWRGUYRKSA-N 325.386 1.967 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@@H]1COCCN1C 858544174 QWCPAZMCCBQCDI-CRAIPNDOSA-N 348.491 1.622 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N2CCC(C3CCC3)CC2)cc1 851688221 TVYKLTMNTMDODB-UHFFFAOYSA-N 329.444 1.966 10 10 EDCE C[C@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)C[C@@H](CC(F)(F)F)O1 850864282 CYSGGTHVSGXNSW-JOYOIKCWSA-N 345.321 1.776 10 10 EDCE NC(=O)C1CCC(NC(=O)NCCCSc2nccs2)CC1 759585857 VOUYHQWBNLMWII-UHFFFAOYSA-N 342.490 1.969 10 10 EDCE CC(=O)N1CCC[C@H](C(=O)NCc2ccc3cccnc3c2O)C1 862029515 XYIYGQTZIGKIPM-HNNXBMFYSA-N 327.384 1.815 10 10 EDCE C[C@@H](NC[C@]12COCCN1C(=O)COC2)c1cc(Cl)ccc1O 866551972 FAGXLXAVMZHQAG-BDJLRTHQSA-N 340.807 1.324 10 10 EDCE Nc1ccc(CS(=O)(=O)NC2CCC3(CC2)OCCO3)cc1 1876527216 MCZPPMUOQFKXAL-UHFFFAOYSA-N 326.418 1.374 10 10 EDCE COCCN(CC(=O)OC)C(=O)c1cc2cc(O)c(O)cc2s1 897226736 NKOMJQYJYWVISO-UHFFFAOYSA-N 339.369 1.574 10 10 EDCE CON(CCNC(=O)c1cccc(O)c1O)C(=O)OC(C)(C)C 1963487966 DGGXDZFKATYPTP-UHFFFAOYSA-N 326.349 1.626 10 10 EDCE CN1C(=O)[C@H](N)c2ccc(N3CC4(CN(Cc5ccccc5)C4)C3)cc21 706642937 IXIBIRUGSVAXSI-LJQANCHMSA-N 348.450 1.985 10 10 EDCE C[C@H](NC(=O)C(=O)N1CC[C@]12CCOC2)c1ccc(N(C)C)cc1 1331649513 MWOSXYIEGMHQGZ-SCLBCKFNSA-N 331.416 1.321 10 10 EDCE O=C(C(=O)N1CCC[C@@H](n2ccnc2)C1)N1Cc2cccc(O)c2C1 1330414905 JYMNKHBAMXKXAJ-CQSZACIVSA-N 340.383 1.295 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@@H](C)N(C)C(=O)C2CC2)cc1 1270870659 NPVMRVWNHGFMEN-GFCCVEGCSA-N 344.419 1.017 10 10 EDCE CCN(CCN[C@@H](C)COC)C(=O)c1ccc(N=NC(N)=O)cc1 1273778757 PPNGZUDAORANFR-LBPRGKRZSA-N 335.408 1.936 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCO1 1351363147 MBRAMWIDNPUGFU-ZIAGYGMSSA-N 333.432 1.567 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(C(=O)N2CCCCC2)CC1 1440889151 WXIDHWNUWPJBBS-UHFFFAOYSA-N 347.415 1.390 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)Cc2ccoc2)cc1 1292673047 YDEPNIHQVRAOCK-UHFFFAOYSA-N 343.343 1.531 10 10 EDCE C[C@H](C(=O)NCc1c(O)cccc1O)N1Cc2ccccc2C1=O 1472063372 JDSUPXTZBGUBSA-LLVKDONJSA-N 326.352 1.759 10 10 EDCE CCNC(=O)CN[C@@H](C)[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1717440257 BFKVPMAXMFOJHJ-QWRGUYRKSA-N 348.407 1.082 10 10 EDCE CNC(=O)N[C@@H]1CCN(Cc2ccc(N3CCC(OC)CC3)cc2)C1 1559733688 UFYQHXYOUZSZPJ-MRXNPFEDSA-N 346.475 1.805 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1cccc(CN2CC[C@@H](O)C2)c1 1556738675 PEWQOBFCHPWCNM-MRXNPFEDSA-N 342.395 1.846 10 10 EDCE 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335.287 1.368 10 10 EDCE CC(C)(C)OC(=O)N1CC(NCc2cccc(F)c2O)(C(=O)O)C1 1913941448 MEFUZGQKHWAPFD-UHFFFAOYSA-N 340.351 1.695 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1NCc1ccc(O)cc1O 1943955391 QXYZVACTYPVEMF-KBPBESRZSA-N 338.404 1.870 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1CNC(=O)C1 1951702654 ZWQLTRJJWWOLAG-RYUDHWBXSA-N 336.388 1.670 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C[C@@H](N)CO 1952205586 YYHYYKKWQAOUMA-VXGBXAGGSA-N 326.393 1.243 10 10 EDCE CO[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980371803 XJAUGOIPGWYDEO-ZPFDUUQYSA-N 328.409 1.180 10 10 EDCE C[C@H]1COC[C@H](C(=O)N(C)CCN=[N+]=[N-])N1C(=O)OC(C)(C)C 1985095265 BQWJCUZJCVRMSH-WDEREUQCSA-N 327.385 1.780 10 10 EDCE C[C@H](COCC(=O)NCc1ccccc1O)NC(=O)OC(C)(C)C 2010249368 CIVMFRPPCGUPFR-GFCCVEGCSA-N 338.404 1.938 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](OCC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010403846 KOPRRLRTLJQYTA-NWDGAFQWSA-N 339.396 1.924 10 10 EDCE NC(=O)CCN(Cc1ccccc1)c1ccc(CO)c([N+](=O)[O-])c1 2014909545 DCISOUSDDOWTSG-UHFFFAOYSA-N 329.356 1.969 10 10 EDCE C[C@@H](O)c1ccc(N(C)C2CS(=O)(=O)C2)cc1Br 2034770810 XMMCJVHPBBEQNS-MRVPVSSYSA-N 334.235 1.736 10 10 EDCE O=C(O)[C@]12CN(Cc3cc(Br)ccc3O)C[C@H]1CCO2 705101222 ROFYXEFIBNLRMQ-YGRLFVJLSA-N 342.189 1.830 10 10 EDCE COc1ccc(CNC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)cc1C 715547571 FLISIWBWDQZXQW-UHFFFAOYSA-N 349.431 1.568 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2182555738 KPPRLZPSHLZPNP-TXFSYDTDSA-N 341.249 1.647 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)C[C@H]2CO)cc1Br 2200832603 LKUKIXCLJGJZAA-KBPBESRZSA-N 343.265 1.881 10 10 EDCE CC(C)(C)OC(=O)NCC1(COc2nnc(=N)[nH]n2)CCCCC1 2213787784 OSLADGNTYXBBBH-UHFFFAOYSA-N 338.412 1.533 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2C[C@@H](CO)c3ccccc32)c1 492940252 IPIZVYXEMZAJKP-LFAOLKIESA-N 337.379 1.577 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2357585979 SVGVGHINUXPFQT-AMPPCDIJSA-N 342.233 1.823 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@H](C)[C@H]3CCCO3)CC2)cc1 183152447 PGVHCBMCHFHOOB-CRAIPNDOSA-N 347.459 1.501 10 10 EDCE Cc1ccc(O)c([C@@H](C)NCCN2CCN(c3ncccn3)CC2)c1 185065185 QSDYIRLYPYQPEC-MRXNPFEDSA-N 341.459 1.963 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@@H](O)CN2CCCCC2)cc1 49174506 AHLDUMXHKCSPHA-QGZVFWFLSA-N 334.464 1.399 10 10 EDCE Cc1ccc(C(=O)N2CCOC[C@@H]2C[C@H](O)c2ccco2)c(O)c1O 272770826 SHIUISONQDTSIG-JSGCOSHPSA-N 347.367 1.964 10 10 EDCE COc1ccc(N2CCC(NC(=O)NCc3cnn(C)n3)CC2)cc1 805999944 HCUDZPMHXNTFFZ-UHFFFAOYSA-N 344.419 1.292 10 10 EDCE NC(=O)C1(C(=O)NCc2cc(Br)ccc2O)CCC1 804739613 LRSBKEARTPSLOO-UHFFFAOYSA-N 327.178 1.427 10 10 EDCE C[C@@H](C[S@@](C)=O)NC(=O)NCc1cc(Br)ccc1O 805280074 YINNLDHYUAUWSL-WPCRTTGESA-N 349.250 1.721 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(S(=O)(=O)N(C)C(C)C)cc1 808500014 RUGQAXVPGWVCQM-UHFFFAOYSA-N 341.385 1.030 10 10 EDCE CCN(CC)c1ccc(CNC[C@H](O)CN2CCOCC2)cc1F 819043855 WFCRZVCIQYHAPC-INIZCTEOSA-N 339.455 1.455 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CN1CCN(C2CC2)C1=O 827956397 OLXNZXYZEUYIFN-UHFFFAOYSA-N 330.432 1.577 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NCc1ccc(Br)cc1O 826959156 ZADZSUNJJDOCEG-CMPLNLGQSA-N 330.178 1.575 10 10 EDCE CN1CCCc2cc(CNC(=O)c3cnc4n3CCOC4)ccc21 824676885 VGBJCAMALUBASA-UHFFFAOYSA-N 326.400 1.726 10 10 EDCE Cc1cc(CC(=O)N[C@@H]2CC(=O)N(C)C2)c(C)n1-c1ccccc1 825222912 RXDYYWCCQPZSFX-MRXNPFEDSA-N 325.412 1.984 10 10 EDCE C[C@@H](NC(=O)NCc1ccc2c(c1)CCCN2C)c1nnc(O)n1C 915390183 IMHWVRSIMMDSOD-LLVKDONJSA-N 344.419 1.464 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCC[C@@H](C(=O)NCCN)C2)cc1 843048089 MNFWZCQXBBWWSR-MAVJXHJTSA-N 330.476 1.553 10 10 EDCE COC[C@H](CO)N[C@@H](C)c1cc(Br)cc(OC)c1O 848548854 GQELSLUPAIDYJA-WPRPVWTQSA-N 334.210 1.821 10 10 EDCE C[C@H]1C(=O)N(CCN(C)C)CN1Cc1cc(Cl)cc(F)c1O 843429144 RYDIBHUEDMTCRR-JTQLQIEISA-N 329.803 1.737 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@]34CNC[C@H]3COC4)CC2)cc1 846673492 QETHISZKVJYSKY-LIRRHRJNSA-N 345.443 1.016 10 10 EDCE OC1CCN(c2ccc(CN[C@@H]3CN4CCC[C@H]3C4)cc2F)CC1 924762116 XYTZQPSBVGXOLC-MAUKXSAKSA-N 333.451 1.971 10 10 EDCE O=C(NCc1ccccc1O)N[C@@H]1CCCN(c2cccnc2)C1=O 753146554 BWZKOPNYUMGKRH-OAHLLOKOSA-N 340.383 1.782 10 10 EDCE COc1cc(N2CCN(c3nccnn3)CC2)c([N+](=O)[O-])cc1OC 858662690 HBGSUOGIPIKMAC-UHFFFAOYSA-N 346.347 1.124 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](C(=O)O)C(C)C)C2)cc1 851651525 LZCHFFCOYKHSGY-CJNGLKHVSA-N 349.431 1.930 10 10 EDCE O=C1CC[C@H](C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)O1 865953174 YRZTWNCRPAZFRW-MRXNPFEDSA-N 332.400 1.217 10 10 EDCE CCS(=O)(=O)C1(CNC(=O)N[C@@H](C)c2ccccc2O)CC1 868785198 OHSWSNCHKNTPSV-NSHDSACASA-N 326.418 1.720 10 10 EDCE CO[C@H](C(=O)O)C1CN(Cc2cc(Br)ccc2O)C1 1875989647 WFADPQFIEAAAPX-LBPRGKRZSA-N 330.178 1.686 10 10 EDCE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(OC)c1O 770374300 LBGJQHWHSBNGQR-GBOPCIDUSA-N 349.383 1.326 10 10 EDCE CNC(=O)CCCNCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894206657 IOKVRJTYDZHDHZ-UHFFFAOYSA-N 335.379 1.720 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)NCc2ccc(OC)cc2O)c1 794381114 LCPMUBPDUZUMQQ-UTCJRWHESA-N 341.367 1.485 10 10 EDCE CN(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCN=[N+]=[N-] 1963698160 IMJSPCWSBNVCAR-NSHDSACASA-N 328.417 1.648 10 10 EDCE O=C(CCN1CSCCSC1)NCc1cc(O)ccc1O 1176754731 GDGYUUFGJMLVGV-UHFFFAOYSA-N 328.459 1.801 10 10 EDCE O=C(C(=O)N1CCC[C@H]1[C@@H]1CCCOC1)N1Cc2cccc(O)c2C1 1329866065 OTVZPJRTKMMNNQ-ZBFHGGJFSA-N 344.411 1.652 10 10 EDCE CCc1cc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)nn1C 1334471234 NHNLWUVRWXMWNJ-ZDUSSCGKSA-N 328.416 2.000 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@]2(CCCCN2)C1 1262202897 GGQAZQKOEYWLQY-SFHVURJKSA-N 331.416 1.095 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC3CC(OC)(OC)C3)C2)cc1 1346437502 RPNYSTJLOTXJEQ-ZDUSSCGKSA-N 349.431 1.725 10 10 EDCE COC[C@H](C)NCCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1276411399 QBPXJXVODIICNC-LBPRGKRZSA-N 335.408 1.936 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@H]1CCN(Cc2ccccc2)C1=O 1528779431 CRFQALISNFQXTH-OAHLLOKOSA-N 340.379 1.763 10 10 EDCE C[C@H]1C[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C(=O)N1c1ccccc1 1465464269 QQWXKXYOGBYNDZ-SWLSCSKDSA-N 340.379 1.951 10 10 EDCE CN1CC[C@H](C(=O)NCc2cc(O)ccc2O)[C@H](c2cnn(C)c2)C1 1633599309 WYYZYLKJCMPAIZ-HOTGVXAUSA-N 344.415 1.183 10 10 EDCE CCOC(=O)[C@H](F)[C@H]1CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1643842686 AJPOEDWOTSXQBZ-XHDPSFHLSA-N 325.336 1.390 10 10 EDCE CC(C)N1C(=O)C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1=O 1587273398 NBQYPJNXNCQWKQ-NSHDSACASA-N 331.332 1.115 10 10 EDCE Cc1ccc(CNC(=O)NCC(=O)NCc2c(O)cccc2O)cc1 1597569337 OMZNWYCISSFCHY-UHFFFAOYSA-N 343.383 1.522 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCn3cnnc3[C@H]2C)c([N+](=O)[O-])c1 1772930820 CFZIGGGFEHQAKF-VLWUPBBWSA-N 343.343 1.954 10 10 EDCE C[C@H](N[C@@H]1CCC(=O)N(C)C1)c1ccc(N2CCOCC2)c(F)c1 152491746 XRSLZWLELCGJON-DZGCQCFKSA-N 335.423 1.934 10 10 EDCE COC(=O)NCC1CN(c2ccc(CN)c(Br)c2)C1 2130737932 KOTRYFXMWQTRNC-UHFFFAOYSA-N 328.210 1.700 10 10 EDCE C[C@@]1(CO)COCCN(c2ccc(CN)cc2Br)C1 2135106970 ZPICJFRVRFNWMY-CQSZACIVSA-N 329.238 1.743 10 10 EDCE C[C@@H](NCc1cccc(Br)c1O)C1CS(=O)(=O)C1 1967840110 LYWLYAGRNBPHNI-MRVPVSSYSA-N 334.235 1.677 10 10 EDCE CC(=O)N1C[C@@H]2C[C@H]1CN2Cc1cccc(Br)c1O 1970760159 OBBUYIWVJBBOMP-RYUDHWBXSA-N 325.206 1.960 10 10 EDCE COC1(CNCc2cccc(O)c2O)CN(C(=O)OC(C)(C)C)C1 1996221331 CTCQBVIHTJNLDT-UHFFFAOYSA-N 338.404 1.823 10 10 EDCE O=C(O)[C@@H]1[C@@H]2OCCN(Cc3cc(Br)cc(F)c3O)[C@H]21 2149275433 HJPKANIKVBIOEI-NHCYSSNCSA-N 346.152 1.578 10 10 EDCE C[C@@](NCCCN=[N+]=[N-])(C(N)=O)c1ccnn1Cc1ccccc1 2024697807 VBBMKMGXCXPAGX-INIZCTEOSA-N 327.392 1.922 10 10 EDCE CCN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](CO)C2)c(Br)c1 316500842 YYWFUGZHCMJEIO-HCKVZZMMSA-N 343.265 1.909 10 10 EDCE NCc1cc(F)c(N2CCC(NC(N)=O)CC2)cc1Br 702143550 BOGJEZDDLFMOTC-UHFFFAOYSA-N 345.216 1.684 10 10 EDCE CNCc1ccc(N2C[C@H](O)C[C@@]2(C)CO)c(Br)c1 698226794 HLNMWDSUCAHSRT-RISCZKNCSA-N 329.238 1.491 10 10 EDCE OCc1ccc(N2CCCN(C3COC3)CC2)cc1Br 2169579151 PVMIKVLWCCBCQR-UHFFFAOYSA-N 341.249 1.852 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(CCO)C(=O)C2)c(Br)c1 2171074125 IUJVRTQWINBLCO-SNVBAGLBSA-N 343.221 1.143 10 10 EDCE CCN(Cc1cc(Br)cc(C)c1O)[C@H]1CC(=O)NC1=O 2171201115 IKBCALMAVJMGGZ-NSHDSACASA-N 341.205 1.700 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCO[C@H]4C[C@H]43)c(Br)cc21 2171803820 YVUGCHDNWIHRBC-AGIUHOORSA-N 338.205 1.639 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H]2CN3C(N)=O)c(Br)c1 2192284241 XOBJSWBAHUMLAQ-DVVUODLYSA-N 339.237 1.810 10 10 EDCE NCc1ccc(N2CCOC[C@H](CO)C2)c(F)c1Br 2098221652 XQPIMKKQXUPSJV-VIFPVBQESA-N 333.201 1.492 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@]4(CO)C3)c(Br)cc2[C@H]1O 2200842243 ALWAGYHDFYHEBU-QVCNTJRGSA-N 339.189 1.253 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])C1 2213585991 SYWAUIFSUFOQRP-VXGBXAGGSA-N 339.396 1.970 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2C[C@H](CO)c3ccccc32)c1 492940251 IPIZVYXEMZAJKP-IDTUSYRASA-N 337.379 1.577 10 10 EDCE Cc1ccccc1N1C(=O)NC(=O)C(=CN[C@@H]2NC=CS2)C1=O 2313577440 VJSRECGPQIYZJG-AWEZNQCLSA-N 330.369 1.143 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CNC(=O)C2)c(O)c1Br 2352635834 AZDPTZLVMHYAHD-VIFPVBQESA-N 327.178 1.215 10 10 EDCE FC(F)(F)c1cc(N2CCOCC2)ccc1CNC1=NCCCN1 303263288 QVJLNKLYWSFELO-UHFFFAOYSA-N 342.365 1.981 10 10 EDCE O=C(NN1CCOCC1)c1cccc2c1C(=O)c1ccccc1C2=O 175283827 ADXCNIHAAZDPJT-UHFFFAOYSA-N 336.347 1.439 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)cc1Br 2357051981 DWQRSCAAJRNHQH-IKRVOCLZSA-N 342.233 1.965 10 10 EDCE CSC1(C(N)=S)CCN(C(=O)c2cccc(O)c2O)CC1 126161506 BOFVIVFOUDPPCT-UHFFFAOYSA-N 326.443 1.722 10 10 EDCE Cc1ccc(C(=O)N2CCCC[C@H](N3CCN(C)CC3)C2)c(O)c1O 182519794 VPBVFUNPNFFOHY-HNNXBMFYSA-N 347.459 1.648 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(-c2nc(C[C@@H]3CCCO3)no2)c1 273388323 HMUVVKYNRMPYCM-JTQLQIEISA-N 339.373 1.535 10 10 EDCE CN(C)c1ccc(CN2CCN(CC(N)=O)CC2)c(C(F)(F)F)c1 279597687 ICMVJZZEPDJARS-UHFFFAOYSA-N 344.381 1.374 10 10 EDCE COc1cc(NS(=O)(=O)c2cnn(CC(F)F)c2)ccc1O 284042270 XFXGZGDVFRZFTF-UHFFFAOYSA-N 333.316 1.663 10 10 EDCE Cc1cc(Br)cc(CN2CC3(CNC(=O)O3)C2)c1O 817416987 QANWZXDCYMPWAP-UHFFFAOYSA-N 327.178 1.757 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@H](OC)[C@H]2CCOC2)c1O 826822014 IXTCNNLGAHORLA-AAEUAGOBSA-N 326.349 1.450 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CCCN(C)C1=O 839922379 SJQQXJOYJUHOIG-WMLDXEAASA-N 331.460 1.977 10 10 EDCE COc1ccc(N2CCC(NC(=O)C[C@H](C)NC(N)=O)CC2)cc1 847425569 NCQBCFBIEVLKFF-LBPRGKRZSA-N 334.420 1.227 10 10 EDCE C[C@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@@H]1CCCO1 918906557 PGRKCYJKDCAPCF-YJBOKZPZSA-N 331.460 1.870 10 10 EDCE CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2c(O)cccc2OC)C1 843432600 NZVPQBMVNXUPQU-AWEZNQCLSA-N 332.322 1.901 10 10 EDCE C[C@H](NC(=O)NCC[C@@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 922055149 MYLCRZCHKPIKMW-UONOGXRCSA-N 332.448 1.981 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CCO)C3CC3)C2)cc1 854298997 DJKLSWSQZRZIKQ-YOEHRIQHSA-N 333.432 1.734 10 10 EDCE Cc1cnn(C)c1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 850359986 AKLYUFXNMHTSEA-UHFFFAOYSA-N 341.415 1.366 10 10 EDCE C[C@H]1CN(CCO)[C@H](C)CN1Cc1cc(F)c(N(C)C)cc1F 862396742 YAHKAECMMXCRLR-OLZOCXBDSA-N 327.419 1.918 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC(C)(C(N)=O)C1 862091022 GFGSZYPFQUKFQO-UHFFFAOYSA-N 339.395 1.854 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](C)[C@H](CN)C1 868377704 CJTFHATVTKTALS-GDBMZVCRSA-N 347.459 1.574 10 10 EDCE O=C(CN1CCN(C2CC2)C1=O)NCc1ccc2cccnc2c1O 862025156 NWDUGVJYOXHFLV-UHFFFAOYSA-N 340.383 1.457 10 10 EDCE Cn1nccc1CNC(=O)NCc1cccc(Br)c1O 764762420 RALUGMYHBALYNJ-UHFFFAOYSA-N 339.193 1.888 10 10 EDCE CCS(=O)(=O)c1cccc(C(=O)NCCc2ccc(O)c(O)c2)c1 763224815 PEOOZNGSWXKETC-UHFFFAOYSA-N 349.408 1.864 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCO[C@H]3C)CC2)cc1 770721828 AMAPTGGXLMLDQE-MAUKXSAKSA-N 347.459 1.358 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CNC(=O)c1ccsc1 773761828 JCWQSECYVCRDFS-JTQLQIEISA-N 334.397 1.637 10 10 EDCE NC(=O)[C@@H]1CC[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 896271156 ZVSJSALJXKOQDD-IJEWVQPXSA-N 346.427 1.801 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1895875707 MRLWDJRPISUSAS-GARJFASQSA-N 325.369 1.437 10 10 EDCE C[C@@H]1OCC[C@H]1N(CCO)CC(=O)N(C)Cc1ccc(N(C)C)cc1 796580818 SWYOJBYOOPAPMG-MAUKXSAKSA-N 349.475 1.183 10 10 EDCE COC(=O)c1cc2n(n1)CCC[C@H]2NC(=O)Cc1ccc(O)c(O)c1 1158573014 GDHQFOPJDITKPD-LLVKDONJSA-N 345.355 1.275 10 10 EDCE NCc1nccnc1NCc1ccc(N2CCC(CO)CC2)cc1 1339535609 IFLXCRKQLRFXEA-UHFFFAOYSA-N 327.432 1.756 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)[C@@H](CO)C2)cc1Br 704792536 AIMUGLQIYVAPMM-GARJFASQSA-N 329.238 1.506 10 10 EDCE C[C@@H](O)c1ccc(N(C)Cc2nnnn2C)c(Br)c1 707629789 GVUVEINCZKHDHK-MRVPVSSYSA-N 326.198 1.662 10 10 EDCE C[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H](C2CC2)O1 1335602134 KHNXTWIOWDRYQR-MEDUHNTESA-N 330.384 1.260 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2CCNC(=O)C2)cc1C 1268786815 FRHMZQVENOBVRP-MRXNPFEDSA-N 347.459 1.468 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@]3(C)CCOC3=O)C2)cc1 1263794157 NPDMHNRSSSJPMI-YVEFUNNKSA-N 333.388 1.279 10 10 EDCE Cc1cc(CNC(=O)C(=O)N(C)[C@@H](C)CO)c(C)n1-c1ccccc1 1351407141 HVIXRSUMBXKLQQ-AWEZNQCLSA-N 343.427 1.550 10 10 EDCE CO[C@H](C(=O)O)C1CN(Cc2c(O)cccc2Br)C1 2115722224 VFQYASLPEVLAKU-LBPRGKRZSA-N 330.178 1.686 10 10 EDCE CC1=C(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)Cn2nnnc2N1C 1616834363 DUBSRZBRQHBCNA-NSHDSACASA-N 341.419 1.340 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)c2nccnc2N)cc1C 1700393064 QJLJDWQZJRWCTD-CHWSQXEVSA-N 343.431 1.672 10 10 EDCE Cn1c(CCNC(=O)Cc2ccc(O)c(O)c2)nc2ccccc21 1617548157 GLNUHJYJJNZLFO-UHFFFAOYSA-N 325.368 1.886 10 10 EDCE CCOCCN1CC([C@@H](C)NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1717565083 SQGLSGMQHZBGRG-GFCCVEGCSA-N 347.419 1.936 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2cnnc(O)c2)cc1C 1715341697 VJNBLCOJABHJOI-ZDUSSCGKSA-N 344.415 1.750 10 10 EDCE COC(=O)C1(O)CN(C(=O)c2cc(C)ccc2-n2c(C)ccc2C)C1 1558061193 ZPZQIBPJRVEWHW-UHFFFAOYSA-N 342.395 1.762 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(OCC(N)=O)cc1 1568736174 YVLFFOXISYXPIH-UHFFFAOYSA-N 349.383 1.672 10 10 EDCE CC[C@H](CNC(=O)Cc1nc[nH]n1)NCc1ccc(OC)c(C)c1 1665873110 ZAYDOYRBEOVVBY-CQSZACIVSA-N 331.420 1.349 10 10 EDCE C[C@H](O)CCCN[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1690651721 FSHKSQUOUZLLBV-RYUDHWBXSA-N 335.408 1.718 10 10 EDCE CCN1C(=O)/C(=C\c2c(NC)nc3ccccn3c2=O)SC1=S 5895749 DIICFIHTWDUHKX-CSKARUKUSA-N 346.437 1.957 10 10 EDCE CCN(CCS(C)(=O)=O)C(=O)c1c(C)oc(-n2cccc2)c1C#N 151956318 VQHSARSCTYHWDH-UHFFFAOYSA-N 349.412 1.757 10 10 EDCE CN1CCO[C@H](CNC(=O)NCCCSc2nccs2)C1 153284190 ZIESLOZHKNGRQJ-LLVKDONJSA-N 330.479 1.255 10 10 EDCE C[C@H]1CN(Cc2ccc(Br)cc2O)[C@H](C(=O)O)CO1 1968205379 INZNXVDFBRTNSM-KWQFWETISA-N 330.178 1.829 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 1985102677 KLRBOOTXIOJGEA-WDEREUQCSA-N 325.369 1.534 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@]1(N)CCN(Cc2ccccc2)C1 693964259 MGDLWIKVKXEBHN-FQEVSTJZSA-N 339.439 1.954 10 10 EDCE CNC(=O)[C@H]1CCN(Cc2cc(Br)cc(F)c2O)C1 715798205 WAGJYYMXOIZSTF-QMMMGPOBSA-N 331.185 1.862 10 10 EDCE C[C@H](N)c1ccc(N2CCN(C3COC3)CC2)cc1Br 2169592513 UFXGFEYTBUHNQL-NSHDSACASA-N 340.265 1.990 10 10 EDCE CN(C[C@H]1CCN1C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2186467994 AYBUXJTXNIEOCF-AMIZOPFISA-N 340.221 1.575 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)C[C@@H](O)C2)c(Br)c1 2105069883 GZQXKDBDKXBDIP-TXEJJXNPSA-N 329.238 1.491 10 10 EDCE CC[C@@H]1[C@H](O)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2288917893 WYDSHDYKWIDMMP-RTXFEEFZSA-N 341.205 1.784 10 10 EDCE Oc1cc(Br)ccc1CNC[C@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2296820119 PLZSZCKUIKHJMQ-DTFMEENKSA-N 342.233 1.622 10 10 EDCE CCCOc1ccc(C=C2C(=O)NC(=O)N(C)C2=O)cc1OCC 2313548700 CJBAAJSYHOXVPS-UHFFFAOYSA-N 332.356 1.966 10 10 EDCE COC(=O)NC1CN(c2ccc(CN)c(Br)c2F)C1 2351822095 SVAXTFJYMPSFRB-UHFFFAOYSA-N 332.173 1.592 10 10 EDCE COC(=O)c1ccc(NC(=O)[C@@]23CC[C@@H](C(=O)C2=O)C3(C)C)cc1 101104218 LZPISEOPJLFCKF-KPZWWZAWSA-N 329.352 1.986 10 10 EDCE CCCn1nc(C(=O)N2CCOc3cc(N(C)C)ccc32)ccc1=O 173203479 AKBRBNPPZAPBCZ-UHFFFAOYSA-N 342.399 1.759 10 10 EDCE CC[C@H](NCCS(N)(=O)=O)c1cc(Br)ccc1O 36745284 IYZZWQSIXOLLMR-JTQLQIEISA-N 337.239 1.484 10 10 EDCE O=C(O)CN(Cc1cc(Cl)ccc1O)[C@@H]1CCS(=O)(=O)C1 86736639 KCGAKNVTJNVYBC-LLVKDONJSA-N 333.793 1.119 10 10 EDCE CC[C@@H]1CN(Cc2cc(OC)c(OC)cc2O)CCN1C[C@H](C)O 246014274 ZBNMGAOLZJWZKZ-DZGCQCFKSA-N 338.448 1.686 10 10 EDCE COc1ccc(N2CCN(C(=O)CNCc3ccncc3)CC2)cc1 243358256 LYVGVRRNXVXYGJ-UHFFFAOYSA-N 340.427 1.529 10 10 EDCE Cc1cccc(N(CCC(N)=O)C(=O)/C=C\c2cnn(C)c2C)c1 255056751 WUPFFVBDOXGYQG-FPLPWBNLSA-N 326.400 1.959 10 10 EDCE Cc1ccc(CN(C)[C@H]2CC(=O)N(C)C2=O)c(O)c1Br 2381129762 OSMQSZVCNNKYCO-JTQLQIEISA-N 341.205 1.652 10 10 EDCE CCn1nnc(C)c1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 294518849 TUHNEHZLPLLMKL-UHFFFAOYSA-N 343.431 1.715 10 10 EDCE CS(=O)(=O)N1CCCC[C@H]1CNC(=O)NCc1ccccc1O 805834114 DACYEVMNLZNLRU-ZDUSSCGKSA-N 341.433 1.006 10 10 EDCE COc1ccc(N2CCN(CCN[C@H]3CO[C@H](C4CC4)C3)CC2)cc1 825155934 LZUYRSWNJBBDOT-XLIONFOSSA-N 345.487 1.974 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC[C@@H](OC)[C@@H]2CCOC2)c1O 826822015 IXTCNNLGAHORLA-DGCLKSJQSA-N 326.349 1.450 10 10 EDCE O=C(CC1(O)CCOCC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 907106116 ZYBOHBHQMPGQCO-INIZCTEOSA-N 349.427 1.831 10 10 EDCE C[C@@H](O)c1cn(C2CN(C/C=C\c3ccc(N(C)C)cc3)C2)nn1 835045045 RKEOABIRBAJZJH-ZRUQZJFASA-N 327.432 1.968 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCO[C@@H](C2CC2)C1 839219822 UDMRDEZCUDAWRN-QGZVFWFLSA-N 345.443 1.348 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1 841137162 FKOSXZFRSPZNQR-ARFHVFGLSA-N 331.416 1.749 10 10 EDCE COC(=O)[C@H]1CSCCN(C(=O)c2ccc(C)c(O)c2O)C1 840564855 GQTUUGVRMGWLGP-SNVBAGLBSA-N 325.386 1.384 10 10 EDCE COC[C@H]1COCCN1C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 923188583 SCTXHDUIDMGIPK-HOCLYGCPSA-N 349.431 1.331 10 10 EDCE COc1cccc(O)c1CNC[C@@H]1CS(=O)(=O)c2ccccc2O1 842721471 IAAPYHCDUJZGFJ-GFCCVEGCSA-N 349.408 1.725 10 10 EDCE COc1ccc(CNC(=O)NC[C@@]2(OC(C)C)CCOC2)c(O)c1 925761546 XDZDSLAURMUCLW-KRWDZBQOSA-N 338.404 1.784 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@](O)(C3CC3)C2)cc1 852502468 HPNPKDWNRMIWBR-LJQANCHMSA-N 331.460 1.606 10 10 EDCE Cc1cc(Cl)cc([C@@H](C)NCC[C@@H]2CNCCS2(=O)=O)c1O 925788994 NBYQFKZEKJRORG-DGCLKSJQSA-N 346.880 1.781 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](O)CC[C@H]3C)C2)cc1 852448164 HAMGFWKPKYOZBF-YCPHGPKFSA-N 333.432 1.829 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N3CCC(C)CC3)C2)cc1 855227877 QUCQFFWHRFSMAN-HNNXBMFYSA-N 345.443 1.649 10 10 EDCE O=C1OC[C@]2(CNCc3cc(Cl)c(F)cc3O)COCCN12 872260867 FRZYYCGDQRYQPE-AWEZNQCLSA-N 330.743 1.496 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nccc(C)n3)CC2)c(OC)c1 870167368 HQGJHXMKZUUSJJ-UHFFFAOYSA-N 342.399 1.765 10 10 EDCE Cn1cc([C@H](NC(=O)Cc2ccc(O)c(O)c2)C(F)(F)F)cn1 1139541345 PTSLYGBMKQCOOK-ZDUSSCGKSA-N 329.278 1.794 10 10 EDCE C[C@H]1C[C@H](COC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 783152014 MCCQZDCRIQZELH-WDEREUQCSA-N 343.401 1.736 10 10 EDCE COc1cccc(O)c1CNC[C@H]1CCCCN1S(C)(=O)=O 796514024 UFPJWSQEYYXCLM-GFCCVEGCSA-N 328.434 1.305 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cc(S(C)(=O)=O)ccc2N)cc1 1135643099 PTMOOZBTNXKMQX-UHFFFAOYSA-N 347.440 1.668 10 10 EDCE C[C@H]1C(=O)Nc2cc(C(=O)NCc3ccc(O)cc3O)ccc2N1C 1142532951 ALHHWVCVCOQGME-JTQLQIEISA-N 341.367 1.805 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1CC(=O)N(C)C1)NCc1ccc(OC)c(C)c1 1318531601 VSWJLUFONDDNCH-HOTGVXAUSA-N 347.459 1.466 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)Cc2ccoc2)cc1C 1320213651 IKVODRYZOQGGFE-MRXNPFEDSA-N 332.400 1.406 10 10 EDCE COC(=O)[C@]1(N2CCN(Cc3cc(C)c(C)cc3O)CC2)CCOC1 1329067765 PKSJEBZITNPMOD-IBGZPJMESA-N 348.443 1.459 10 10 EDCE O=C(O)c1cnn2c(O)cc(CN3CCO[C@H](c4ccco4)C3)nc12 1327340078 DXLBPEUJXCJWLH-ZDUSSCGKSA-N 344.327 1.300 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2c[nH]nc2C)cc1C 1326069630 DSBCFZMDUPCUSZ-UHFFFAOYSA-N 346.431 1.259 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@]3(C2)CC3(F)F)cc1 1326614956 AGOUWMWSQKTSQR-MRXNPFEDSA-N 337.370 1.627 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@@H]2COCCO2)cc1C 1268511184 CXPCLLXEHDLLBN-IDOMTICXSA-N 334.416 1.181 10 10 EDCE COCCNC[C@H]1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1278618054 GKYALTHANAOSBY-WFASDCNBSA-N 347.419 1.984 10 10 EDCE CCCN[C@]1(CO)CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1273935730 IPKBFXXBOLWQHT-QGZVFWFLSA-N 347.419 1.816 10 10 EDCE CC(C)(C)N1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CC1=O 1545304990 YBJNCEVYGAUNBM-GFCCVEGCSA-N 331.376 1.978 10 10 EDCE C[C@H]1CN(c2ccc(CO)cc2Br)C[C@@H](CCO)O1 2122800627 REGTWRAWSTVXIC-CMPLNLGQSA-N 330.222 1.918 10 10 EDCE CCCC(=O)NCCN(C)Cc1nnnn1-c1ccc(OC)cc1 1492184180 RRDIUGIGCQVCLN-UHFFFAOYSA-N 332.408 1.019 10 10 EDCE CN(Cc1ccccc1O)C(=O)CNc1ccc(S(C)(=O)=O)cc1 1631151035 ABLQJEHVFUZBGZ-UHFFFAOYSA-N 348.424 1.866 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCCS(=O)(=O)C[C@H]1C1CC1 1636377155 ADTHWNRYKHCVHE-ZDUSSCGKSA-N 339.413 1.066 10 10 EDCE CCC(=O)N[C@H](C)C(=O)N(C)[C@@H](C)CNCc1ccc(OC)c(C)c1 1732421566 VSBQYYXJBZCKFX-LSDHHAIUSA-N 349.475 1.855 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)c2ccnc(CO)c2)N(C)C)cc1 1648477722 BBCDJKXZHCOPHO-SFHVURJKSA-N 342.443 1.673 10 10 EDCE CN(Cc1ccccc1O)c1nnc(C2CC2)n1Cc1ncn(C)n1 1767111682 BHHUWRQDCQRVLV-UHFFFAOYSA-N 339.403 1.674 10 10 EDCE COC(=O)[C@@H]1CCC[C@H]1NCC(=O)N(C)Cc1ccc(N(C)C)cc1 1116835329 HGNYCTSMEAFKRF-IAGOWNOFSA-N 347.459 1.642 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NCc1c(O)cccc1F 1894379430 WAAVHKFDLYZFSD-QWHCGFSZSA-N 326.368 1.913 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H](COC)ONC(=O)OC(C)(C)C 1900609510 ODHLOTAMLKBRKH-JTQLQIEISA-N 331.373 1.617 10 10 EDCE CO[C@H](C(=O)O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951836396 YSPUVPDEDOQVML-MFKMUULPSA-N 341.360 1.633 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C[C@H](N)CO 1952205584 YYHYYKKWQAOUMA-NWDGAFQWSA-N 326.393 1.243 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1[C@H]2CNC[C@H]21 1952692366 QITSEUXMPMTVLC-RSUWNVLCSA-N 334.416 1.999 10 10 EDCE COC1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CN(C(=O)OC(C)(C)C)C1 1985106110 WKEBXHYLAAPMKF-SNVBAGLBSA-N 325.369 1.534 10 10 EDCE Nc1ccc(O)c(CN2CCC[C@H](CNC(=O)C(F)(F)F)C2)c1 1999433490 AWVUXUHUVXIABP-SNVBAGLBSA-N 331.338 1.865 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NCC2(CN=[N+]=[N-])CC2)C1 2010405404 ZBLDLDDXYBAZTH-NSHDSACASA-N 339.396 1.829 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CN(Cc2ccc(N)cc2)CC[C@@H]1CO 2009096139 LRHCLWIMRAEHEL-ZBFHGGJFSA-N 335.448 1.976 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(C(F)(F)C(=O)NCCCN=[N+]=[N-])C1 2010392840 KGKYJVOJSWTEQF-UHFFFAOYSA-N 349.338 1.420 10 10 EDCE Nc1ccc(CS(=O)(=O)N(OCc2ccccc2)C2CNC2)cc1 2016999269 ZSLRWKMBSOQAOH-UHFFFAOYSA-N 347.440 1.504 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2C[C@H](C(=O)NCCN=[N+]=[N-])C[C@H]21 2022253696 MWDHXKZYCSPNHG-IJLUTSLNSA-N 339.396 1.827 10 10 EDCE O=C1NC[C@H]2CN(Cc3cc(Br)cc(F)c3O)CC[C@@H]12 2157179446 PBIIZBXHEUTSJI-GXSJLCMTSA-N 343.196 1.862 10 10 EDCE O=C1Nc2cc(N3CC(O)(C(F)F)C3)c(Br)cc2[C@H]1O 2172113267 CKVLRDMEQMCCKO-SECBINFHSA-N 349.131 1.251 10 10 EDCE CNCc1ccc(N2CC[C@@]3(C[C@H](O)CO3)C2)cc1Br 2201781007 SZTSVBIQJNPNLE-DZGCQCFKSA-N 341.249 1.899 10 10 EDCE CCN(Cc1cccc(Br)c1O)[C@H]1CC(=O)NC1=O 2114731901 IGLBAUCJFHNZRB-JTQLQIEISA-N 327.178 1.392 10 10 EDCE COc1ccc(Br)c(CNCCc2nnnn2C)c1O 2236051985 AFMLGTIGQHIELH-UHFFFAOYSA-N 342.197 1.019 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cnc(Br)cn1 2237278577 KVIVEQKGKYWSAQ-UHFFFAOYSA-N 338.161 1.623 10 10 EDCE CC(C)(C)OC(=O)N1CCOC(C)(C)[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2246653998 QFVDPSZWPOMLIR-LLVKDONJSA-N 339.396 1.922 10 10 EDCE CCNC[C@@H](C1CC1)S(=O)(=O)NCc1cnc(SC)s1 2284687837 IGRYPGAHDFBMRX-NSHDSACASA-N 335.520 1.673 10 10 EDCE Cc1cccc(N2C(=O)NC(=O)C(=CNC[C@H]3CCCO3)C2=O)c1C 2296940688 AGFJDUYYJSFBNR-CYBMUJFWSA-N 343.383 1.539 10 10 EDCE CCN(C(=O)C=Cc1cn(C)c(=O)n(C)c1=O)c1cc(C)ccc1C 2297375159 GUSKPARTMIPHAD-UHFFFAOYSA-N 341.411 1.767 10 10 EDCE Cn1nc(Br)nc1N1CCc2cc(O)c(O)cc2C1 2341215778 DAQQBDFFBGFXHS-UHFFFAOYSA-N 325.166 1.552 10 10 EDCE Cc1ccc(CN2CC[C@H](O)C[C@H]2CO)c(O)c1Br 2352677742 CLNYGEOKENVYMS-RYUDHWBXSA-N 330.222 1.781 10 10 EDCE Cc1ccc(CN(C)c2nnc(=N)[nH]n2)c(O)c1Br 2352932995 URUJAJQIPPUGMK-UHFFFAOYSA-N 325.170 1.092 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H]2CCC[C@@H](C(N)=O)C2)cc1F 172571750 KARQASKNHLLCGB-OLZOCXBDSA-N 336.411 1.735 10 10 EDCE CN1CCCc2cc(CNC(=O)NC[C@@]3(CCO)CCOC3)ccc21 129007517 LAWCGXKYKJFTTP-LJQANCHMSA-N 347.459 1.657 10 10 EDCE Nc1ccc(OCCS(=O)(=O)Nc2ccnc(Cl)n2)cc1 227971990 AHINKXXBOLMYMT-UHFFFAOYSA-N 328.781 1.533 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@H]3O 249371944 ATIZYDKLJVRSJX-QHOFPYNOSA-N 343.471 1.412 10 10 EDCE CNS(=O)(=O)[C@H]1CCCN(Cc2cc(Cl)cc(C)c2O)C1 362236880 GQOCTGUIVAXECT-ZDUSSCGKSA-N 332.853 1.868 10 10 EDCE COC(=O)CN(C)C(=O)NCc1ccc(C)c(Br)c1O 2381147487 RVDDVOMGBBNBKD-UHFFFAOYSA-N 345.193 1.778 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CC[C@]2(CNCCO2)C1 719952747 ZBBXUCORGPPUPW-AWEZNQCLSA-N 345.212 1.858 10 10 EDCE COc1ccc(N2CCC(NC[C@@H](O)Cn3cccn3)CC2)cc1 819002679 NEXWTBSUWXKVKR-QGZVFWFLSA-N 330.432 1.511 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@@H]2CCC[C@H](C1)N2 817919426 SKAGECUVUKISLD-IYBDPMFKSA-N 344.459 1.064 10 10 EDCE O=S(=O)(NCc1ccc(N2CCOCC2)cc1)c1cscn1 827032590 HCSZESKSDQCCRM-UHFFFAOYSA-N 339.442 1.458 10 10 EDCE CN(C)c1ccc(CNC(=O)CN(C)[C@H]2CCN(C3CC3)C2)cc1 839490001 ABWDRIQLTXVKCT-SFHVURJKSA-N 330.476 1.537 10 10 EDCE Cc1nccc(O[C@H]2CCCN(C(=O)c3cc(O)nc(O)c3)C2)n1 585346510 PMGIQYHJVSODQV-LBPRGKRZSA-N 330.344 1.275 10 10 EDCE COc1ccc(N(C)CCN(C)C[C@H](C)CS(C)(=O)=O)cc1 844402044 SJEQUAALBQZKCH-AWEZNQCLSA-N 328.478 1.744 10 10 EDCE COc1cc(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)c(O)cc1C 842633332 PYOQGVTYBFXTNV-MRXNPFEDSA-N 341.429 1.099 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H](C[C@H]3CCCO3)C2=O)cc1F 924544341 XUAKDUVCAJSJGF-TZMCWYRMSA-N 335.379 1.881 10 10 EDCE OC1CCN(c2ccc(CNC[C@H]3C[C@@H]4COC[C@@H]4O3)cc2)CC1 922727130 ZHGQLXHHZSIJBU-LZQZEXGQSA-N 332.444 1.541 10 10 EDCE CS(=O)(=O)N1CCCC[C@@H]1CNC(=O)Nc1ccc(N)cc1 841300679 ZLRHBRNMXSJBRP-CYBMUJFWSA-N 326.422 1.204 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@@H]3CCOC[C@@H]3OC)C2)cc1 855226229 OKMHNOWABNHCQH-MPGHIAIKSA-N 348.443 1.832 10 10 EDCE Cn1nccc1[C@@H](O)CNCc1ccc(N2CCC(O)CC2)cc1 922969553 DPIGNHLBFAPWKC-SFHVURJKSA-N 330.432 1.204 10 10 EDCE CC[C@@H](NCC[C@H]1CNCCS1(=O)=O)c1ccc(C)cc1O 925787957 DNTRBFRFXOHJMJ-DZGCQCFKSA-N 326.462 1.518 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCCN2CCSC[C@@H]12 928088311 GGMYPXTVVGQTSG-HXINVUTJSA-N 334.441 1.807 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCCNC(C)=O)C2)cc1 851935985 HTWHUUJCUKTJCR-CQSZACIVSA-N 334.420 1.099 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cn(C4CC4)nn3)C2)cc1 862159131 OQTLXIAIUFCKPA-LBPRGKRZSA-N 327.388 1.630 10 10 EDCE COc1cccc(O)c1CN1CCC[C@H](C(=O)N2CCOCC2)C1 768235243 YUYPVCQMJQMQDB-AWEZNQCLSA-N 334.416 1.472 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\COC1CCOCC1 867301982 IHUCPCVUDQYKKP-ZRMMWKCHSA-N 335.400 1.897 10 10 EDCE Nc1ccccc1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 767725369 UAFRVUWYYCSJHH-UHFFFAOYSA-N 347.440 1.584 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H](C)S(N)(=O)=O)cc1 768597060 KCYMEERCBCNGOG-CYBMUJFWSA-N 335.429 1.501 10 10 EDCE COCc1nc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)co1 775807367 SAUOLXWIKLFBID-UHFFFAOYSA-N 349.362 1.727 10 10 EDCE O=C1OC[C@@]2(CNCc3cc(Cl)cc(F)c3O)COCCN12 872262643 LNYHNRFUMSWFDT-CQSZACIVSA-N 330.743 1.496 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3CC=CCC3)C2)cc1 1118621078 SYSKJEZYGASYFZ-HUUCEWRRSA-N 343.427 1.615 10 10 EDCE COCc1cc(NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ncn1 789846021 XMUSAKOCAYLASK-SNVBAGLBSA-N 332.360 1.787 10 10 EDCE C[C@H](NCc1ccc(N2CCOCC2)c(F)c1)c1nnc(O)n1C 895182305 WEOTZPJPCXPNBR-NSHDSACASA-N 335.383 1.347 10 10 EDCE C[C@H](NC(=O)N(C)CC1(CO)CC1)c1ccc(N2CCOCC2)cc1 782950749 TUJJRGVOEIRAQH-HNNXBMFYSA-N 347.459 1.998 10 10 EDCE CC[C@@H]1[C@@H](C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCN1C 899211390 LIRVECOKQNIDFE-RBUKOAKNSA-N 344.503 1.785 10 10 EDCE Cn1cc(N2CCN(C(=O)c3ccc(N=NC(N)=O)cc3)CC2)cn1 1149045901 XREPDOSLLMACCJ-UHFFFAOYSA-N 341.375 1.545 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCc2nnc(O)n2C1 1142730826 FHRKQFNLIDRJHO-GFCCVEGCSA-N 339.355 1.116 10 10 EDCE CCS(=O)(=O)c1ccccc1C(=O)NCc1cc(O)ccc1O 1303223171 DAIVYLJIMDPNLV-UHFFFAOYSA-N 335.381 1.821 10 10 EDCE O=C1C[C@](C(=O)NCc2cccc(O)c2O)(c2ccccc2)CN1 1176576933 UXGVHKBDCYVBMM-GOSISDBHSA-N 326.352 1.172 10 10 EDCE O=S1(=O)C[C@H]2C[C@H]1CN2Cc1c(O)cccc1Br 707129804 TUNPXAMZNISYSI-BDAKNGLRSA-N 332.219 1.526 10 10 EDCE COc1ccc(N2CCN(C(=O)C(=O)NC[C@H]3C[C@@H]3C)CC2)cc1F 1321886465 VFGUOSWZNASCEH-QWHCGFSZSA-N 349.406 1.255 10 10 EDCE C[C@H](c1ccncc1)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1335559368 VANDWVXVNZTFEJ-GFCCVEGCSA-N 325.368 1.849 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(C)C[C@@H]2CO)c(Br)c1 699491584 LZHHXVMWVQKFDU-DGCLKSJQSA-N 342.281 1.842 10 10 EDCE C[C@@H]1[C@H](O)CCCN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1332814594 UXIYSMTZMDKWQG-CXAGYDPISA-N 345.443 1.057 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)C(C)(C)NC(C)=O)cc1C 1268407284 AWRJKMHOKHSPLA-AWEZNQCLSA-N 349.475 1.903 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1ccnn1C 1265872926 JLHMIQRFGJKPPR-NSHDSACASA-N 343.391 1.491 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)cc1Br 2116694059 IXPJZKOPCGBOAU-NGSVMEPUSA-N 327.222 1.228 10 10 EDCE O=C1NN(c2ccccc2)C(=O)/C1=C/c1coc2ccc(O)cc2c1=O 2198290 KDAWRGNYZOSWEM-OVCLIPMQSA-N 348.314 1.960 10 10 EDCE O=C1C[C@@H](C(F)(F)F)[C@H](C(=O)NCc2c(O)cccc2O)CN1 1558536168 VIWDRSFTELRTOW-VXNVDRBHSA-N 332.278 1.029 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@@H]1C(=O)NCc1c(O)cccc1O 1558536447 YIGXAZSDDWTQCK-ZIBATOQPSA-N 348.399 1.969 10 10 EDCE COCCOCCc1ncc(C(=O)N[C@@H](C)c2ccccc2O)[nH]1 1635803798 KCPXPJAOJNMJKZ-LBPRGKRZSA-N 333.388 1.812 10 10 EDCE CC[C@H](F)C(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1720919816 XUQYBFBIZQBADD-SKDRFNHKSA-N 337.355 1.832 10 10 EDCE Cc1c(C(=O)NCc2c(O)cccc2F)cnn1-c1ccc(O)nn1 1635361141 XSRHBXQQPGVJLL-UHFFFAOYSA-N 343.318 1.451 10 10 EDCE C[C@@H](CNCc1cnns1)NC(=O)c1ccc(N=NC(N)=O)cc1 1569100425 XRNFARSCPKIVSE-VIFPVBQESA-N 347.404 1.609 10 10 EDCE Cc1ccc(S(C)(=O)=O)cc1C(=O)NCc1ccc(O)cc1O 1639441536 XPXULOLCQZXIOO-UHFFFAOYSA-N 335.381 1.740 10 10 EDCE COc1ccc(CNC[C@@H]2CCCN2C(=O)CNC(C)=O)cc1C 1733334021 RDQUZWTWWRGCQI-INIZCTEOSA-N 333.432 1.220 10 10 EDCE CC[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)[C@H](CC)CN1C(C)=O 1587395189 UOYKHRHJFMOHRW-HUUCEWRRSA-N 334.416 1.888 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)Cc2cc[nH]n2)C2CC2)cc1C 1661117869 UZBIDKXVOCZIPL-KRWDZBQOSA-N 342.443 1.954 10 10 EDCE NCc1ccc(N2CCC(C(N)=O)CC2)c(F)c1Br 231838817 DGVICNTWMFOYQP-UHFFFAOYSA-N 330.201 1.749 10 10 EDCE CO[C@@H](C(=O)O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951836395 YSPUVPDEDOQVML-GXFFZTMASA-N 341.360 1.633 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985103834 AWFFHYWPECTCTE-AXFHLTTASA-N 327.385 1.419 10 10 EDCE CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC(N=[N+]=[N-])CC1 1986368255 DNLQSXIIBVGEIO-NSHDSACASA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N1[C@H]2C[C@@H]1CN(C(=O)c1cccc(O)c1O)C2 2006293104 MBXBYVNSMYLCML-PHIMTYICSA-N 334.372 1.932 10 10 EDCE CC(C)(C)OC(=O)NCC1(NC(=O)c2ccc(O)c(O)c2)COC1 2006280222 SBOFSRXVUCLOHR-UHFFFAOYSA-N 338.360 1.121 10 10 EDCE CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010404633 BIHLCZSOQJPLIE-NXEZZACHSA-N 341.368 1.354 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)c1c(CNC(=O)OC(C)(C)C)cnn1C 2010391991 WLGLDTJRBRHOPZ-UHFFFAOYSA-N 337.384 1.827 10 10 EDCE NC(=O)CCN(CCC(=O)Nc1ccc(N)cc1)Cc1ccccc1 2034748623 INWNTNCDWLCLDB-UHFFFAOYSA-N 340.427 1.975 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)C[C@@H](O)C2)c(Br)c1 2161354138 GQZQYJDCSBJGDM-BETUJISGSA-N 343.265 1.881 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H](C3)O4)c(Br)cc21 2198586821 XIGDHCLUWDYXSS-DAROEXNTSA-N 338.205 1.639 10 10 EDCE CN1CCO[C@@H]2CN(c3ccc(CO)cc3Br)C[C@H]21 2097691767 CGAJYRMMTGZIFG-ZIAGYGMSSA-N 327.222 1.461 10 10 EDCE O=C1Nc2cc(N3C[C@@H](O)C34CCC4)c(Br)cc2[C@H]1O 2201417318 UJZZNLRBRZTSET-VXGBXAGGSA-N 339.189 1.538 10 10 EDCE CNCc1ccc(N2CCN(C)C[C@@H]2CCO)cc1Br 2202834521 KRNYMEVPLJYEOI-AWEZNQCLSA-N 342.281 1.671 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2205614828 SGKFDEFGWYDMJV-IHRRRGAJSA-N 347.228 1.439 10 10 EDCE O=C(NCc1conc1Br)c1cc(O)c(O)c(O)c1 2230641715 DNCYCONQYAWZMG-UHFFFAOYSA-N 329.106 1.484 10 10 EDCE OCc1ccc(N2C[C@@H]3CCO[C@@]3(CO)C2)c(Br)c1 2231313530 KRXLTYOYJZFWHW-SMDDNHRTSA-N 328.206 1.529 10 10 EDCE O=C(O)[C@H]1CC[C@@H](O)CN1Cc1c(O)cccc1Br 2264529379 RKOJZEIAPVNBDA-LDYMZIIASA-N 330.178 1.565 10 10 EDCE O=C(N[C@H](CCO)COCc1ccccc1)c1ccc(O)c(O)c1 2303568414 VZOSDUKXAHKZCB-OAHLLOKOSA-N 331.368 1.795 10 10 EDCE CCc1nc2n(n1)C[C@H](NC(=O)C=Cc1ccc(O)c(O)c1)CC2 2308001163 FMDYQSVDIQCACQ-GFCCVEGCSA-N 328.372 1.396 10 10 EDCE COc1ccc(N2CC([C@H](O)CO)C2)c(OC)c1Br 2336875651 ZYECSDWMVVROGA-SNVBAGLBSA-N 332.194 1.256 10 10 EDCE Cc1ccc(CN2C[C@@H](O)[C@@H](O)[C@H]2CF)c(O)c1Br 2352949709 IKHMIOLVNCZKRZ-BREBYQMCSA-N 334.185 1.339 10 10 EDCE Cc1ccc(CN2CCN3C[C@H](O)C[C@@H]3C2)c(O)c1Br 2381132432 AVHZAVSBQBBTJV-CHWSQXEVSA-N 341.249 1.714 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cn(C(C)C)nn1 819699184 YQFLAYJFOUBWNT-UHFFFAOYSA-N 346.387 1.770 10 10 EDCE CN1CCC[C@@H](C(=O)NCc2ccc(N3CCSCC3)cc2)C1=O 822586514 RAZLNEBHTBVLAW-INIZCTEOSA-N 347.484 1.724 10 10 EDCE C[C@H](NC(=O)CC(F)(F)CN)c1ccc(N2CCOCC2)cc1 846673147 OFPIZRFECMEBER-LBPRGKRZSA-N 327.375 1.685 10 10 EDCE CCO[C@@H]1C[C@@H](NC(=O)NCCc2ccc(N)cc2)[C@@H]1n1cccn1 841907060 ILMSVGBJYDRPIN-ZACQAIPSSA-N 343.431 1.726 10 10 EDCE C[C@@H]1[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)CCN1C 914336500 ZMKBWMQVHIAQAZ-RHSMWYFYSA-N 332.448 1.415 10 10 EDCE Cc1cc(O)c(CN2CCC[C@H](N3CCNCC3=O)C2)c(Cl)c1 843065374 LJCNHNDMVDQORG-ZDUSSCGKSA-N 337.851 1.750 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC1CC(CC(N)=O)C1 922912468 INCFAOAPYOEPPR-VQCLRJIVSA-N 346.475 1.945 10 10 EDCE O=S(=O)(NCc1c(O)cccc1F)c1cnn(CC(F)F)c1 921452324 LUJUCVLZSCZEGB-UHFFFAOYSA-N 335.307 1.471 10 10 EDCE COc1cccc(CNC(=O)NC[C@@]2(OC(C)C)CCOC2)c1O 925749258 WKNZVABCBUWRQS-KRWDZBQOSA-N 338.404 1.784 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H]3C[C@@H]4C[C@@H]4C3)nc12 850263474 JQSJPLZASJJOLZ-URLYPYJESA-N 345.355 1.701 10 10 EDCE C[C@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1ccc(F)cc1O 858488926 NWEYELNFVDBKEA-AAEUAGOBSA-N 342.378 1.899 10 10 EDCE O=C(C[C@H]1CCNC1=O)NCc1ccc(N2CCC(CO)CC2)cc1 878302455 NNANIDCJEKQLFZ-MRXNPFEDSA-N 345.443 1.038 10 10 EDCE C[C@@H](NC(=O)NCc1cn(C)nn1)c1ccc(N2CCOCC2)cc1 782999261 ODGGUBCNQKXWCZ-CYBMUJFWSA-N 344.419 1.212 10 10 EDCE C[C@@H](CS(C)(=O)=O)N(C)C(=O)c1cc2cc(O)c(O)cc2s1 896315749 UEEXWVVWABPBKK-QMMMGPOBSA-N 343.426 1.818 10 10 EDCE CC(C)(C)[C@@H](O)C[C@@H](CO)NCc1ccc(N2CCOCC2)cc1 790618876 IUHDJOTUCLIQKG-WMZOPIPTSA-N 336.476 1.771 10 10 EDCE COC(=O)CCNC(=O)c1ccc(NC(=O)c2cc(O)cs2)cc1 1143531657 IXPHVOMAVAMRRE-UHFFFAOYSA-N 348.380 1.999 10 10 EDCE C[C@H](N)c1ccc(N(C)CCN(C)CCO)c(Br)c1 691341582 AATCJKDMEVBFDI-NSHDSACASA-N 330.270 1.829 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@H]1CCN1C1CCCC1 1331590154 JCNFPGDYOZJERU-MRXNPFEDSA-N 345.443 1.484 10 10 EDCE COC(C)(C)[C@H](C)NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1333430907 YIBFVXTTYYIDMN-STQMWFEESA-N 335.448 1.860 10 10 EDCE O=C(/C=C/c1ccc2c(c1)NC(=O)CO2)NCc1ccc(O)c(O)c1 1465954326 OVFGKAPRBMZIFV-ZZXKWVIFSA-N 340.335 1.758 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cc(C)c(C(N)=O)cn2)c1 1545684159 LWJZMHJBSPKVQO-JTQLQIEISA-N 329.356 1.694 10 10 EDCE C[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)[C@H](C)S(C)(=O)=O 1611430492 DHZXODHPASCTSQ-MXWKQRLJSA-N 329.418 1.214 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2nc(OC)cc(OC)n2)c1 1622779783 WBOGBEBSTDHPRC-VIFPVBQESA-N 333.344 1.699 10 10 EDCE C[C@@]1(CC(=O)NCc2ccc3cccnc3c2O)CCS(=O)(=O)N1 1557124303 ZOBKVYOVXVOCBR-INIZCTEOSA-N 349.412 1.029 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)/C=C/C(C)(C)C)cc(OC)n1 1720901173 DMJPCOWPILLTHQ-ABZNLYFFSA-N 349.431 1.936 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1CN(C)C(=O)N1)NCc1ccc(OC)c(C)c1 1495035923 DGPDXWXESKTQPG-LSDHHAIUSA-N 348.447 1.012 10 10 EDCE O=C(NCc1c(O)cccc1O)C1CCN([C@H]2CCSC2)CC1 1639292767 PVOCQEOKHMZGPY-ZDUSSCGKSA-N 336.457 1.932 10 10 EDCE Nc1ncnc2c1ncn2CCC(=O)NCc1cccc(Cl)c1O 1640405406 TYRQJLMKDSAETC-UHFFFAOYSA-N 346.778 1.474 10 10 EDCE CO[C@H](C)C(=O)NCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1747762258 VFJDFBHTBUWECW-SNVBAGLBSA-N 347.375 1.263 10 10 EDCE NC(=O)c1ccc(OCC(=O)NCc2cc(Cl)ccc2O)cc1 1583816995 PIAJFJRCMZPGSL-UHFFFAOYSA-N 334.759 1.840 10 10 EDCE CC[C@H](CNC(=O)C1(CC)CC1)NC(=O)c1cc(OC)nc(OC)c1 1759351504 PXEBZJOSOOCRTM-CYBMUJFWSA-N 349.431 1.914 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)c2cncnc2O)cc1C 1674681631 UBUOCEKMDLTXNN-STQMWFEESA-N 344.415 1.796 10 10 EDCE CC1(C)C[C@@H]1C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1686538826 BYMIUTZCSLWGBP-GFCCVEGCSA-N 331.376 1.741 10 10 EDCE CCC(=O)NCC(=O)NC[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1691430025 MQNFNJXPIQJGFA-IYBDPMFKSA-N 347.459 1.514 10 10 EDCE CC[C@@H](CNC(=O)C(C)(C)NC(C)=O)NCc1ccc(OC)c(C)c1 1698614772 LCKTWDBFAHIPKR-INIZCTEOSA-N 349.475 1.903 10 10 EDCE O=C(O)[C@H]1CCCN1C(=O)CCNCc1cc(Cl)ccc1O 1857864885 LUORUBYWGDPSSF-GFCCVEGCSA-N 326.780 1.601 10 10 EDCE NCc1ccc(N2CCC[C@H](C(N)=O)C2)c(F)c1Br 231838722 ANCDHMOBKYUQFQ-VIFPVBQESA-N 330.201 1.749 10 10 EDCE O=C(N[C@H](C(=O)O)c1cc(O)c(O)c(O)c1)OCc1ccccc1 1951380942 FCTKZTCPZJUSIX-ZDUSSCGKSA-N 333.296 1.856 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1COCCN1 1952551679 NFYRBEKHMYFQEH-CHWSQXEVSA-N 338.404 1.522 10 10 EDCE 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334.416 1.680 10 10 EDCE O=C(NCc1cc(Br)ccc1O)N[C@H]1[C@@H]2CNC[C@@H]21 841999364 HWJRURXFOJNGBS-IAZYJMLFSA-N 326.194 1.172 10 10 EDCE Nc1ccc(CCNC(=O)N2CCC(Cn3cnnc3)CC2)cc1 846173405 QEDSFUXVRNMHJC-UHFFFAOYSA-N 328.420 1.525 10 10 EDCE COc1cc(N(C)CC2CN(S(C)(=O)=O)C2)cc(OC)c1OC 929708488 VIMSTXHIGMAEMU-UHFFFAOYSA-N 344.433 1.040 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)C)C2)cc1 855228945 HWCRIAXEWUQFSJ-YOEHRIQHSA-N 333.432 1.551 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CCCc3c2ccc(=O)n3C)c(O)c1O 855030419 LNMQRQFWLRTXGU-CYBMUJFWSA-N 328.368 1.912 10 10 EDCE COC(=O)CCc1nnc(NC(=O)/C=C/c2ccc(O)c(O)c2)s1 779518196 JSCUNAYNPPDQPC-HWKANZROSA-N 349.368 1.707 10 10 EDCE COc1ncc(/C=C\C(=O)N2CCCc3ccnc(N(C)C)c32)cn1 894156087 KOAOWAOVMDOMOF-SREVYHEPSA-N 339.399 1.939 10 10 EDCE C[C@H]1CCCN1S(=O)(=O)NCc1cc(Br)ccc1O 796190662 COMIIJKWWFHHKX-VIFPVBQESA-N 349.250 1.973 10 10 EDCE COC(=O)c1ccc(CNC(=O)c2ccc(N=NC(N)=O)cc2)nc1 1138814785 YWTIKLMVPXFANJ-UHFFFAOYSA-N 341.327 1.961 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1146530769 UHOFERNEYNVIBU-LBPRGKRZSA-N 336.388 1.766 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@@H]2CCNC(=O)C2)cc1C 1319178742 JCLJDISLWSPKFV-CZUORRHYSA-N 347.459 1.372 10 10 EDCE C[C@@H]1C[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 1325662079 ARDPAPMMIPIGQQ-HIFRSBDPSA-N 347.484 1.628 10 10 EDCE CN[C@H](C)c1ccc(N(C)[C@H]2COC[C@@H]2O)c(Br)c1 709229260 XIPFXBLPKDBZRI-IIMNLJJBSA-N 329.238 1.925 10 10 EDCE NCc1ccc(N2C[C@@H]3OC(=O)N[C@@H]3C2)c(F)c1Br 2120407782 FOZLVYVKRDJRQJ-APPZFPTMSA-N 330.157 1.344 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)C3(C(N)=O)CC3)C2)cc1C 1707069419 JIOHPURCQVOBBK-GASCZTMLSA-N 345.443 1.254 10 10 EDCE CN(C)C[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)c2ccccc2O1 1545762061 BZYDKVDSNCRGHX-CQSZACIVSA-N 342.395 1.996 10 10 EDCE CS(=O)(=O)N1CC(C(=O)NCc2c(O)ccc3ccccc23)C1 1647790971 DSDPIIOEKVPKLM-UHFFFAOYSA-N 334.397 1.053 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)c2nonc2C)cc1C 1732755718 AYQXDYKUEKMCFM-LBPRGKRZSA-N 332.404 1.993 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H](O)C2(C)C)c(Br)c1 2124799973 JGHGNYOVVNNBEM-HJIKLVIJSA-N 329.238 1.789 10 10 EDCE C[C@@H](C(=O)NCc1c(O)cccc1O)N1CSCCSC1 1652628697 JRDFBXICFYPOLZ-JTQLQIEISA-N 328.459 1.800 10 10 EDCE C[C@](CNCCCO)(NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1666044160 QKRILDNGETXQCT-QGZVFWFLSA-N 347.419 1.720 10 10 EDCE Cn1cc(CNC(=O)Cc2ccc(O)c(O)c2)c(Br)n1 1965318600 JTTSXQAGYMGTCN-UHFFFAOYSA-N 340.177 1.453 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](O)CC(=O)O 1951839539 LRJWWXPDTXSHEY-ZYHUDNBSSA-N 341.360 1.369 10 10 EDCE CO[C@@H](CCNC(=O)OC(C)(C)C)[C@H](N)Cc1ccc(O)c(O)c1 1952754355 DOVLWYYDJOOOJK-DOMZBBRYSA-N 340.420 1.897 10 10 EDCE COc1ccc(Br)c(CNCC(F)(F)C(N)=O)c1O 1973355820 SZPGEQGTBAQYRK-UHFFFAOYSA-N 339.136 1.374 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]1(C)CN(C(=O)OC(C)(C)C)CCO1 1985093715 DISKQNMVOAKZDN-AWEZNQCLSA-N 327.385 1.781 10 10 EDCE CN(C[C@H](O)CNC(=O)OC(C)(C)C)C(=O)c1ccc(O)c(O)c1 2006281823 RROAZSUVKPMVHS-LLVKDONJSA-N 340.376 1.055 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CCC[C@H]2CN=[N+]=[N-])CCOC1 2010405017 FAJOLXGOKIZGLI-NHYWBVRUSA-N 339.396 1.972 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccnn1C 2010390939 KLNXRXTUXMPQBK-NSHDSACASA-N 337.384 1.755 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2012305778 KVTKTXPXXQSGFP-LOIXOFCESA-N 339.396 1.706 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(CCO)C(=O)C2)cc1Br 2171074816 SHXBRUXOUGQUMV-SNVBAGLBSA-N 342.237 1.110 10 10 EDCE CNC(=O)CN1CCN(Cc2c(O)cccc2Br)CC1 707166435 PRJOUYJQLAMIQU-UHFFFAOYSA-N 342.237 1.018 10 10 EDCE O=C(O)CN1CCCN(Cc2ccc(Br)cc2O)CC1 691423474 OQHVVMUVJCVYJV-UHFFFAOYSA-N 343.221 1.747 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CC[C@@H](N4CCCC4)[C@@H]3C)c2n1 2064593199 OXNXQGODMIDFBP-GXTWGEPZSA-N 329.404 1.442 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cccc(O)c2O)[C@@H]2C[C@@H]21 884842918 GZMBMTZBPCWOII-NEPJUHHUSA-N 334.372 1.932 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H]3[C@@H](C)O)c(Br)cc21 2182238078 CBKSIHKHTDBMTH-RESLBDFXSA-N 340.221 1.621 10 10 EDCE C[C@H](O)[C@@H]1CCCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2193587786 ZOCAZPYTPVTWIA-XDYOCTJHSA-N 340.221 1.751 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@@H]4[C@@H]3CO)c(Br)cc2[C@@H]1O 2199015502 JTNFPYQSLXHUMM-SVSUNVRHSA-N 339.189 1.252 10 10 EDCE C[C@@]1(CO)COCCN(c2cc(Br)c(CN)cc2F)C1 2199846539 WSOAGRYLWSBGCC-CQSZACIVSA-N 347.228 1.882 10 10 EDCE Nc1ccc(CS(=O)(=O)N2CCC[C@H](C3OCCO3)C2)cc1 2089610127 WJIBVKCARKZRRE-ZDUSSCGKSA-N 326.418 1.184 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@@]2(COc2nnc(=N)[nH]n2)C1 2213783180 NADNMGCLMMLZCJ-BONVTDFDSA-N 336.396 1.095 10 10 EDCE COc1ccc(N2C[C@@H](CO)[C@@H](CO)C2)c(OC)c1Br 2234892970 NHMHTIZIAZWNSR-AOOOYVTPSA-N 346.221 1.503 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)C[C@H]3C2)cc1Br 2236980683 RNUAVDCAECKPJW-HGSJOUDDSA-N 341.249 1.476 10 10 EDCE CCN(CCO)C(=O)CN1C(=O)C(=Cc2ccco2)SC1=S 2294872027 NFLUKXLMGAXYPK-UHFFFAOYSA-N 340.426 1.322 10 10 EDCE Cc1ccc(CN2CCN[C@H](CCO)C2)c(O)c1Br 2352683611 JJSCUBVZPGYFIW-GFCCVEGCSA-N 329.238 1.619 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2NC[C@H]3C[C@H]32)c(O)c1Br 2352954579 ZKZGJTDAQDEIPG-CKYFFXLPSA-N 325.206 1.687 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)N3CCC[C@H]3C)CC2)cc1 184845529 LASIDFCDOXSDTH-CQSZACIVSA-N 339.461 1.546 10 10 EDCE CC1(C(=O)O)CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 324819985 VUNHNTFZMPWKCU-UHFFFAOYSA-N 335.316 1.617 10 10 EDCE O=C1NC(=O)[C@]2(CCCN(Cc3ccc(N4CCCCC4)cc3)C2)N1 193465151 PJXMZOSEQLSKDD-LJQANCHMSA-N 342.443 1.851 10 10 EDCE Cc1ccc(CNC(=O)CO[C@@H]2CCNC2)c(O)c1Br 2380746774 WVSARXLEEKMBCX-LLVKDONJSA-N 343.221 1.458 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2CNCCO2)c(O)c1Br 2380759875 RYDCNZLLNXIIDU-LLVKDONJSA-N 343.221 1.410 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N[C@H]3CC[C@H]3C)CC2)cc1 805013889 JKLNHGCPSHXVEE-QAPCUYQASA-N 346.475 1.915 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN[C@H]3CC[C@@H]3C)CC2)cc1 819311873 PPOCYWUYMLSBIM-WDYCEAGBSA-N 333.476 1.566 10 10 EDCE Cc1cc(O)nc(C(=O)NCc2ccc(N3CCOCC3)cc2)c1 814357700 CLAWYEXQNHPSDU-UHFFFAOYSA-N 327.384 1.862 10 10 EDCE CN1CCCc2cc(CNC(=O)NCCN=c3cc[nH]cc3)ccc21 729605674 URRWUMODYBVGPE-UHFFFAOYSA-N 339.443 1.797 10 10 EDCE C[C@H](N)c1ccc(N2CCN3C(=O)NC[C@@H]3C2)c(Br)c1 723182803 OWJKTIFYWKWGGR-GXSJLCMTSA-N 339.237 1.683 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)NCCC2(CN)CC2)cc1 846345935 ZHIHCTPTDNAQGD-UHFFFAOYSA-N 346.475 1.394 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@](O)(CO)C1 840485565 URIMAFQKOFZICC-KXBFYZLASA-N 349.475 1.521 10 10 EDCE C[C@H](NC(=O)N1C[C@@H]2COC[C@]2(C(=O)O)C1)c1ccc(N(C)C)cc1 851651084 NSGYPAHFYQBSGD-WPKBUWHJSA-N 347.415 1.556 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)COc3cccnc3)C2)cc1 855228487 BENIIOKZNVPNLR-AWEZNQCLSA-N 327.384 1.864 10 10 EDCE CCN(CCC(N)=O)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 922951331 VSDHUQNVVNXCLE-AWEZNQCLSA-N 348.447 1.428 10 10 EDCE NC[C@@H]1CC(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)=NO1 852882502 JBEUDFKPJZBIRA-KGLIPLIRSA-N 333.388 1.003 10 10 EDCE CNCCCC(=O)N1CCC(NCc2c(O)cccc2OC)CC1 853247486 QZIVAMWVDPBQKZ-UHFFFAOYSA-N 335.448 1.481 10 10 EDCE COC(=O)[C@H]1CCN(C(=O)NCCCSc2nccs2)C1 759591092 UZKSSDBRZGOJKV-JTQLQIEISA-N 329.447 1.830 10 10 EDCE CCS(=O)(=O)C1(CNC(=O)/C=C/c2ccc(O)c(O)c2)CC1 856126088 YVHLCKIZYBPDFU-GQCTYLIASA-N 325.386 1.195 10 10 EDCE CC[C@@H](NC(C)=O)C(=O)NCc1cc(Br)ccc1O 868307287 WKJRBHHWIFQNNB-LLVKDONJSA-N 329.194 1.686 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)CN2CCCCC(=O)C2=O)c1 866763447 DVKXAAKMEBESGK-LLVKDONJSA-N 334.372 1.160 10 10 EDCE Cn1nc2c(c1S(=O)(=O)N1Cc3cccc(O)c3C1)CCCC2 867690161 AWSTWMWLMBWAMJ-UHFFFAOYSA-N 333.413 1.709 10 10 EDCE COc1ccc(O)c([C@H](C)NCC(=O)N2CCOC[C@@H]2C2CC2)c1 775377512 GPQPQIUUJQUMTG-BLLLJJGKSA-N 334.416 1.689 10 10 EDCE CO[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC[C@H]1C 785424857 VZKWSEHUCZAIAC-CJNGLKHVSA-N 333.432 1.252 10 10 EDCE CC(=O)N1CCC[C@@H]1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891246808 POLIWVBZBPGCJJ-QZTJIDSGSA-N 346.475 1.482 10 10 EDCE COC(=O)c1c(CN2CC[C@@H](CC(N)=O)C2)c2cc(F)ccc2n1C 894787865 WOSOTCFNDHXAFD-NSHDSACASA-N 347.390 1.801 10 10 EDCE C[C@H](c1nc(-c2nc[nH]n2)no1)N1CCOc2cc(N(C)C)ccc21 1307648495 PHDRPUAZIQIWFS-SNVBAGLBSA-N 341.375 1.881 10 10 EDCE CCOc1ccc(C(=O)NCC(=O)NCc2c(O)cccc2O)cc1 1304050669 PPJOAXSOUWHQNI-UHFFFAOYSA-N 344.367 1.543 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CC(=O)NCCCN=[N+]=[N-])C1 1964880976 UNIWPNCCKREWRA-CQSZACIVSA-N 327.385 1.565 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)Cc2ccco2)cc1C 1332588803 SFWQGKLHUXMVOH-MRXNPFEDSA-N 346.427 1.748 10 10 EDCE COc1ccc(-n2nnnc2CN2CC[C@@H](CCNC(C)=O)C2)cc1 1267550771 ZOXYHWBVWUGYHD-CQSZACIVSA-N 344.419 1.019 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cc2cnoc2)cc1C 1268581803 BWXWQXCQHNQBHP-ARJAWSKDSA-N 329.400 1.996 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)C1(C(=O)NC)CC1 1273659822 AHHOFCNEPMRYDO-UHFFFAOYSA-N 347.459 1.468 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@@H](C)C2CC2)cc(OC)n1 1354320564 PWJUBPFMGKVTGK-MNOVXSKESA-N 335.404 1.379 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CCO[C@H]1C 1466398040 GVIHVOVZFVEZSK-GWCFXTLKSA-N 341.791 1.972 10 10 EDCE CNC(=O)C1(C(=O)N[C@@H](C)CNCc2ccc(OC)c(C)c2)CC1 1483275058 GXEPZSKJHOOBCC-ZDUSSCGKSA-N 333.432 1.124 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H]2CCCCO2)cc1C 1482722283 LAIIODXMWSAZSN-RDJZCZTQSA-N 336.432 1.139 10 10 EDCE C/C(=C/C(=O)N1CCc2ccc(S(N)(=O)=O)cc21)c1cnccn1 1628947162 VGPVZPSTSZJXLU-FLIBITNWSA-N 344.396 1.117 10 10 EDCE CN1CC[C@@H](C(=O)NCc2c(O)cccc2O)[C@@H](c2cnn(C)c2)C1 1558536060 RPNNARCLFIDVCB-UKRRQHHQSA-N 344.415 1.183 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@H]3CCNC(=O)C3)CC2)cc1C 1499200010 ZOSIXPYNFNSBFX-HNNXBMFYSA-N 345.443 1.268 10 10 EDCE CCn1cccc1C(=O)NC[C@H](O)CNCc1ccc(OC)c(C)c1 1732664408 JEWYVLRBYOOUOO-MRXNPFEDSA-N 345.443 1.706 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCc2cc(O)ccc2O)s1 1643881765 DKVIGMFENOUSAB-UHFFFAOYSA-N 327.383 1.493 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2nnn(C)n2)cc1 1584998955 XHKIORIJYHLMEW-UHFFFAOYSA-N 338.371 1.611 10 10 EDCE COC(=O)c1c(NC(=O)[C@@H](N)CO)sc(C)c1-c1ccccc1 1865952119 ORAVJGURSMYAIS-NSHDSACASA-N 334.397 1.768 10 10 EDCE O=C(CNCc1cc(Cl)ccc1O)N1CCCC[C@H]1CCO 1857868632 TWCDAZMDEOEYCE-AWEZNQCLSA-N 326.824 1.899 10 10 EDCE CN[C@H](c1ccccc1O)[C@](O)(CNC(=O)OC(C)(C)C)COC 1921803925 LXKCXLIBMHDHEF-PBHICJAKSA-N 340.420 1.555 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]([C@H](N)Cc2ccc(O)c(O)c2)C1 1952914703 UUBROPPLTFFHTE-IUODEOHRSA-N 338.404 1.604 10 10 EDCE COc1ccc(CNC[C@@H](CO)NC(=O)OC(C)(C)C)c(O)c1 1985853627 CZQWPYKBIKBKOK-LBPRGKRZSA-N 326.393 1.376 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2010391781 UVZSODQXAQDLQV-WDEREUQCSA-N 339.396 1.875 10 10 EDCE OCc1ccc(N2CCC[C@@H](CO)[C@@H]2CO)c(Br)c1 710090437 KFGIDIDBRKRUAV-FZMZJTMJSA-N 330.222 1.511 10 10 EDCE C[C@@]1(C(=O)O)CN(Cc2c(O)cccc2Br)CCO1 711580568 NSWBULCDBDHTPB-ZDUSSCGKSA-N 330.178 1.830 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)cc1Br 2173317249 KCBSCCLWQDNUQP-XSXLEWDISA-N 341.249 1.789 10 10 EDCE CC[C@H](CO)N(C)c1cc2c(cc1Br)[C@H](NC)C(=O)N2 380809925 MQVJDURIOGHRIO-OQPBUACISA-N 342.237 1.869 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2NC(=O)COc1ccc(N)cc1 2044202397 PJNLOZACAXUMLG-WPGHFRTFSA-N 347.415 1.772 10 10 EDCE CC(C)(C)OC(=O)N1CC(OCC(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213585988 SYWAUIFSUFOQRP-NEPJUHHUSA-N 339.396 1.970 10 10 EDCE COC[C@@H]1[C@H](O)[C@H](O)CN1c1ccc([C@H](C)O)cc1Br 2233867573 ZSKXPSZEDBDLNX-IYMWITQMSA-N 346.221 1.059 10 10 EDCE CNCc1ccc(N2C[C@H]3COC[C@@]3(CO)C2)c(Br)c1 2234553199 WQKUPGKQJOCZFY-WFASDCNBSA-N 341.249 1.614 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](O)[C@H](C)N)c(O)c1Br 2352650001 GTGFBIXUCNTFDZ-KWQFWETISA-N 331.210 1.130 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccncc1O 177312153 ANWJHPSEFZWLKN-UHFFFAOYSA-N 345.374 1.817 10 10 EDCE COc1cc(N2CCN([C@H]3CCC(=O)N3)CC2)cc(OC)c1OC 33610500 CIQFQRJWSVVNOX-HNNXBMFYSA-N 335.404 1.071 10 10 EDCE O=C(CN1C[C@H]2CC[C@H]1C2)NCc1ccc(N2CCOCC2)c(F)c1 249777568 XFVLSMVGNIIKML-HOTGVXAUSA-N 347.434 1.763 10 10 EDCE CCN1CC[C@H](CNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 255000275 ZHNZPHURDNWIOD-GNJLHFKMSA-N 343.471 1.994 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@]12CCN(C(=O)OC(C)(C)C)C2 808539206 WAJUAXQSXGSRKG-ZBEGNZNMSA-N 325.361 1.335 10 10 EDCE CN(C)c1ncc(N2C(=O)CN(Cc3ccccc3O)C2=O)cn1 819008038 KEHCFSNRBDYIAY-UHFFFAOYSA-N 327.344 1.217 10 10 EDCE CN1CCN(c2ccc(CN(C)[C@H]3CCN4CCO[C@H]3C4)cc2)CC1 824501635 QUQAUFMCRHCVMT-PMACEKPBSA-N 344.503 1.343 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C)[C@H](C)CO)C2)cc1 824354785 RCKVPQJNQWHVTG-RBSFLKMASA-N 335.448 1.838 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1ccccc1O)C1CCOCC1 827187948 PBFGYKGXSOGLSY-OAHLLOKOSA-N 329.418 1.253 10 10 EDCE CCN1C[C@@H](CN2CCN(c3ccc(OC)c(F)c3)CC2)OC1=O 846813658 IEQQSEGONQQWJC-CQSZACIVSA-N 337.395 1.797 10 10 EDCE C[C@]1(CCNC(=O)C(=O)NCCc2ccc(N)cc2)C[C@]1(F)Cl 846345527 YHTDQRQIIANYQW-JKSUJKDBSA-N 341.814 1.748 10 10 EDCE C[C@H]1C[C@H](NC(=O)NCc2ccc(N(C)C)c(F)c2)c2ncnn21 852475965 JQJVCQLWZNHYTA-GWCFXTLKSA-N 332.383 1.988 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CC[C@H](C(=O)O)C3)C2)cc1 851651011 ICTCPIPBFKJRKE-MJBXVCDLSA-N 347.415 1.826 10 10 EDCE CCn1ccc(CNC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1 852380354 BSUFNAKJGFVKED-OAHLLOKOSA-N 343.431 1.990 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCSC3)CC2)cc1 762109852 GMWURFIQOBQHFP-HNNXBMFYSA-N 349.500 1.687 10 10 EDCE Oc1cc2c(cc1CNCCn1ncc(Br)n1)OCO2 1875998599 XNLDNJUEIIHUGW-UHFFFAOYSA-N 341.165 1.265 10 10 EDCE CN(C)c1ccc(CNC[C@H](O)CC2(O)CCOCC2)cc1F 872200046 VFYUFADVEKQULO-CQSZACIVSA-N 326.412 1.274 10 10 EDCE C[C@@H]1O[C@H](C)CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1C 785427590 DDWUGPVNNGXBMW-MCIONIFRSA-N 333.432 1.393 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3C[C@@H](C)CO3)cc2)CC1 890129160 CVWFLLJLVPUWJR-RDTXWAMCSA-N 345.443 1.396 10 10 EDCE COC(=O)[C@@](C)(NC(=O)Cc1ccc(O)c(O)c1)c1ccccc1 1136593549 GSCKWVUVYKSOAV-SFHVURJKSA-N 329.352 1.845 10 10 EDCE C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1136768447 CRJRIFBGXGKOCQ-VHSXEESVSA-N 340.405 1.743 10 10 EDCE COc1cccc(CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)c1O 1137473184 BIDLYQRGVRRGCM-HNNXBMFYSA-N 332.312 1.659 10 10 EDCE Cc1cc(C(=O)N[C@H](C)Cc2cn(C)nn2)c(C)n1-c1ccccn1 1176836286 RPUOQQURPVHIPV-GFCCVEGCSA-N 338.415 1.979 10 10 EDCE CN(CCNCc1cccc(Br)c1O)S(C)(=O)=O 709587264 LFMXNCJXYJCTTB-UHFFFAOYSA-N 337.239 1.136 10 10 EDCE COc1ccc(CN[C@@H]2C[C@H](C)N(C(=O)CN(C)C(C)=O)C2)cc1C 1331953515 KCLTXLFSULRIIG-WMLDXEAASA-N 347.459 1.561 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(O)c1 1342914667 HPUBADVAPOMZHS-AWEZNQCLSA-N 345.351 1.708 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cncc(C)c2)cc1C 1272388264 BZZWMTPJQSKBMA-QGZVFWFLSA-N 343.427 1.588 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@H](C[C@H]1COCCO1)C(F)(F)F 1350935424 IJEZQBHPMUVQJT-QWRGUYRKSA-N 349.305 1.698 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CCO[C@H]1C 1466398042 GVIHVOVZFVEZSK-GXFFZTMASA-N 341.791 1.972 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)Cc2cncn2C)cc1C 1480803704 LPXUIKUZHSHJDX-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE COC(=O)[C@@H](C[C@@H]1CCCO1)NC(=O)c1ccc(N=NC(N)=O)cc1 1637825824 UHLWZGGDKAOIMP-QWHCGFSZSA-N 348.359 1.690 10 10 EDCE C[C@H](NCCO)[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1496459479 IYIXFJZPCYTQOV-GXTWGEPZSA-N 347.419 1.672 10 10 EDCE C[C@H]1C(=O)Nc2cc(C(=O)NCc3cc(O)ccc3O)ccc2N1C 1643881665 AAJLMFBFDLGTPU-JTQLQIEISA-N 341.367 1.805 10 10 EDCE N=C1NC(=O)[C@H](CC(=O)NCc2ccc3cccnc3c2O)S1 1643283172 JRVQYUJMYWNWDE-JTQLQIEISA-N 330.369 1.113 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3ncccn3)CC2)cc1C 1733256830 HHIYPZRJOUPXEV-UHFFFAOYSA-N 326.400 1.846 10 10 EDCE C[C@@H]1C[C@@H]1C(=O)NCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1738726381 ORVLKUVYTPLFMA-MFKMUULPSA-N 343.387 1.884 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cccc(N2CCOC2=O)c1 1652622933 KJOBISGUDSZZNX-UHFFFAOYSA-N 328.324 1.984 10 10 EDCE CN1C(=O)COc2ccc(C(=O)NCc3c(O)cccc3F)cc21 1596916159 BAUHGUZFZIHHHX-UHFFFAOYSA-N 330.315 1.817 10 10 EDCE CN(Cc1ccccc1O)c1nnc([C@H]2CCOC2)n1CC1(O)CC1 1696701185 WNAFDDCHDYFJKJ-AWEZNQCLSA-N 344.415 1.649 10 10 EDCE NCc1cc(F)c(N2CC(OCCCO)C2)cc1Br 2141973656 PKBVLGCCNMHUNV-UHFFFAOYSA-N 333.201 1.635 10 10 EDCE CC(=O)[C@@H](N)C[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952117450 AEKSDKWPFOXWOA-STQMWFEESA-N 338.404 1.840 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C[C@@H](O)CN 1952314901 JSRVMEFIDZDIET-VXGBXAGGSA-N 326.393 1.243 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CN(Cc2cc(N)ccc2O)CCO1 1999482993 JJCDANZCOKDYLY-AWEZNQCLSA-N 337.420 1.700 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010405207 XONIKSJIUWWPSP-PWSUYJOCSA-N 341.412 1.809 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2010406122 QERMTCIAGNHJKV-NWDGAFQWSA-N 341.412 1.811 10 10 EDCE CO[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2012170479 IHAZZCISVZJEGD-VXGBXAGGSA-N 339.396 1.780 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@H]1CCc2nncn2C1 2159981541 IZBRHDZJPSZBSY-JTQLQIEISA-N 341.184 1.990 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CC(N=[N+]=[N-])C3)O2)C1 2025156076 LCWOSKGQJDUENL-LLVKDONJSA-N 337.380 1.676 10 10 EDCE NCc1ccc(N2CC(=O)N3CCC[C@@H]3C2)c(F)c1Br 2158197640 USQQYTSFCALJDC-SNVBAGLBSA-N 342.212 1.858 10 10 EDCE CN(CCNC(=O)[C@@H](N)Cc1ccc(O)c(O)c1)Cc1ccccc1 386806746 RAOOZWWBLDDDJQ-INIZCTEOSA-N 343.427 1.216 10 10 EDCE C[C@@H](COCc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)c(O)c1 390697634 AWOPQXXFKHWAGQ-BBRMVZONSA-N 344.411 1.689 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@]3(O)CCc4ccccc43)c2n1 2062431361 HXSAHVUVQXXOME-SFHVURJKSA-N 338.367 1.307 10 10 EDCE CNC(=O)c1cn(Cc2cccc(Br)c2O)nc1O 2070620881 BGGATWHMZZCSLO-UHFFFAOYSA-N 326.150 1.465 10 10 EDCE C[C@H](C(=O)O)N1CC(NCc2cc(Br)cc(F)c2O)C1 2188306801 BHAQCVJGBGBHRQ-SSDOTTSWSA-N 347.184 1.541 10 10 EDCE CNC(=O)[C@@H]1[C@H](C)CCN1c1ccc(CN)cc1Br 2090258550 JHEHOXASOBIPBV-RNCFNFMXSA-N 326.238 1.869 10 10 EDCE CC1(C)CO[C@H](CO)CN1c1ccc(CO)c(Br)c1 2111216553 AUUBCDQAQLVCJY-LBPRGKRZSA-N 330.222 1.918 10 10 EDCE CC(C)(C)OC(=O)N[C@H](COc1nnc(=N)[nH]n1)Cc1ccccc1 2219021102 OGAINGHEZALQQT-LBPRGKRZSA-N 346.391 1.194 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](N)C[C@@H](O)C2)c1O 2227749533 DFXGZCWTPBFWLM-RKDXNWHRSA-N 331.210 1.057 10 10 EDCE CSc1ncc(CNC(=O)N2CCS[C@H](C(=O)O)C2)s1 2284503939 IBDWSYMQKLXABF-QMMMGPOBSA-N 333.460 1.577 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3cccc(Br)c3O)C[C@@H]21 2314965116 TYEJMWLAUWKPMP-ONGXEEELSA-N 332.219 1.384 10 10 EDCE Cc1ccc(CN(C)[C@](C)(CN)C(=O)O)c(O)c1Br 2352652638 SRLWWCVXWGHEJT-CYBMUJFWSA-N 331.210 1.697 10 10 EDCE Cc1ccc(CN[C@@H]2COC[C@@H]2N(C)C)c(O)c1Br 2352681553 SQKSWWCURDVGLK-NEPJUHHUSA-N 329.238 1.882 10 10 EDCE CCN(CC)CCCN/C=C1\C(=O)N(Cc2ccco2)C(=O)N=C1O 102520284 MOZJLAOQRUIXCN-KAMYIIQDSA-N 348.403 1.904 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H]2C(=O)NC)cc1 179248382 QKHQTAPMDQPCHQ-MRXNPFEDSA-N 332.448 1.953 10 10 EDCE CCNS(=O)(=O)[C@@H]1CCN(Cc2cc(Cl)cc(C)c2O)C1 181557764 PNPJKPFYXHMDDX-CYBMUJFWSA-N 332.853 1.868 10 10 EDCE COc1ccc(O)c(CN[C@@H]2CCCN(c3cc(C)nn3C)C2=O)c1 182483009 QLBUMDOQSYWFIU-OAHLLOKOSA-N 344.415 1.728 10 10 EDCE O=C(O)CN(Cc1cc(Cl)ccc1O)[C@H]1CCS(=O)(=O)C1 86736641 KCGAKNVTJNVYBC-NSHDSACASA-N 333.793 1.119 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@@H](C3CC3)C2)c1 375330628 ZABINBKVYBGJBH-CQSZACIVSA-N 340.401 1.015 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C)Oc1ccc(Br)cc1 808547565 AJTDAQCKWBAKTB-VIFPVBQESA-N 329.146 1.918 10 10 EDCE C[C@@H]1CN(C(=O)NCCCSc2nccs2)CC(=O)N1C 800711198 DLTCDOJAEDLRCI-SNVBAGLBSA-N 328.463 1.497 10 10 EDCE CCCc1ccc(N2C[C@@H](C(=O)OCC(=O)C(C)=O)CC2=O)cc1 808501915 YBBAFMBGQQPKKY-AWEZNQCLSA-N 331.368 1.693 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H]2CCC[C@H](C1)N2 817949114 HTIVGRDMXYCBRZ-IYBDPMFKSA-N 345.443 1.484 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)C(C)(C)C)C2)cc1 829763403 PBDCYLNYYWDUFV-ZIAGYGMSSA-N 347.459 1.941 10 10 EDCE CC(C)N(C[C@H](C)O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823548562 QVYAWUVVIINGNH-HNNXBMFYSA-N 349.475 1.949 10 10 EDCE CC(=O)N(C)CCOCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1282304507 REVVKLSXBCBQST-UHFFFAOYSA-N 349.391 1.416 10 10 EDCE C/C(=C/C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)CN1CCOCC1 907271627 BQLNKHBQXXMXKQ-RNQWEJQRSA-N 334.416 1.424 10 10 EDCE CC[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCN1CCOC 588407944 CFNUBAYAWQZMBR-ZQMJAJRESA-N 334.416 1.680 10 10 EDCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCCCN 842222640 NNZJXFZQPLZISP-UHFFFAOYSA-N 332.448 1.100 10 10 EDCE C[C@@H]1OCCO[C@@H]1C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 911360002 KFRNVBPQOBPFRQ-XPTSAGLGSA-N 343.763 1.263 10 10 EDCE C[C@H]1CN([C@@H](C)CNC(=O)c2c(F)ccc(O)c2O)C[C@@H](C)O1 848390629 DCRPHQXFZRIWQO-GARJFASQSA-N 326.368 1.464 10 10 EDCE CC[C@]1(COC)NC(=O)N([C@@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849356960 INASBVRULFPDHK-RDTXWAMCSA-N 347.415 1.621 10 10 EDCE CCCC(=O)NCC(=O)OC[C@@H]1CCN(c2ccc(OC)cc2)C1 842877446 DPQVAOPFSLQUCY-CQSZACIVSA-N 334.416 1.981 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)NCCNC(N)=O)CCCC1 845533840 DUAGCSAFNKGYOP-UHFFFAOYSA-N 344.415 1.313 10 10 EDCE O=C([C@@H](O)C1CCOCC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 752152033 SJJSPBXKOMAYQD-WMZOPIPTSA-N 349.427 1.687 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@]3(O)CCOC3)C2)cc1 852396684 BWLGWPWEQCIEHE-KDOFPFPSSA-N 349.431 1.115 10 10 EDCE 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COc1ccc(N2CCN(C(=O)[C@]3(C)CCC(=O)NC3)CC2)cc1 798350416 IDLOTXQGZKFIDV-GOSISDBHSA-N 331.416 1.260 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3C[C@H](O)[C@H](O)C3)ccc21 1155983637 FTVDZWZNYQVNAN-GJWQZFMSSA-N 346.427 1.519 10 10 EDCE CC(C)(C)OC(=O)C1=NO[C@@H](C(=O)NCc2cc(O)ccc2O)C1 1153885878 QQMHMUNUGUNWIX-CYBMUJFWSA-N 336.344 1.201 10 10 EDCE COC(=O)C1(O)CN(C(=O)c2cc(C)n(-c3ccccc3C)c2C)C1 1152814063 SNFCJPQALPLSBI-UHFFFAOYSA-N 342.395 1.762 10 10 EDCE Cc1ccc(C(=O)NCCNC(=O)c2c(F)ccc(O)c2O)cc1 1306584917 AZVLWXOJNRTMBJ-UHFFFAOYSA-N 332.331 1.705 10 10 EDCE COC[C@@H](CNCc1c(Br)ccc(OC)c1O)OC 1964076029 DQSXVCHPPWVRJE-SECBINFHSA-N 334.210 1.914 10 10 EDCE COC[C@H](O)CCNCc1c(Br)ccc(OC)c1O 1964054590 XSPBUMULSOENKL-SECBINFHSA-N 334.210 1.650 10 10 EDCE C[C@H](NC(=O)N1C[C@@H](CCO)[C@@H](CO)C1)c1ccc(N(C)C)cc1 1346411278 GQSILQRCEWQWLS-NUEKZKHPSA-N 335.448 1.446 10 10 EDCE CC/C=C(\C)C(=O)NC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1354268167 FLPJQHLLEAGTBO-VNKGSWCUSA-N 335.404 1.690 10 10 EDCE 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COc1ccc(CN[C@@H](CNC(=O)c2cnn(C)n2)C2CC2)cc1C 1713120745 LQBGPWIFYWLFNB-HNNXBMFYSA-N 343.431 1.430 10 10 EDCE CN(C)C(=O)O[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1637217905 MYVRPUQLBNRULO-GFCCVEGCSA-N 333.348 1.762 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@@H](O)C2(C)C)cc1Br 2124804275 QZHGZSFXNNFZOW-CHWSQXEVSA-N 329.238 1.489 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2cnc(O)n2C)cc1C 1571401232 ZGQXZTWPDDEVJN-ZDUSSCGKSA-N 346.431 1.693 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)[C@H]2CCN(C)C2)C2CC2)cc1C 1733189107 AWEKFAHDOOVNQP-ZWKOTPCHSA-N 345.487 1.940 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccc(F)cn2)cc1C 1667814885 XJHORVGTXLGMSM-HNNXBMFYSA-N 347.390 1.418 10 10 EDCE C[C@@H](Oc1ccc(N)cc1)C(=O)N1CCN(c2ccccn2)CC1 1860082724 SCTGBTCXIYVWHI-CQSZACIVSA-N 326.400 1.780 10 10 EDCE CNC(=O)CN(CC(=O)Nc1ccc(N)cc1)Cc1ccccc1 1946870274 SHLIONZIXWETRM-UHFFFAOYSA-N 326.400 1.456 10 10 EDCE CC(C)(C)OC(=O)Nc1[nH]nnc1C(=O)NCc1ccccc1O 2010184234 ZFDCEKJHUBPMAE-UHFFFAOYSA-N 333.348 1.787 10 10 EDCE COc1ccc([C@H](C)NC[C@H](O)CNC(=O)OC(C)(C)C)c(O)c1 2011422861 VYXCHWUUBQDBKE-RYUDHWBXSA-N 340.420 1.937 10 10 EDCE CCNCc1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2160713384 CMBSDFZGKYEOTE-KAOXEZKKSA-N 341.249 1.489 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)CC[C@H]3O)cc1Br 2161354680 MSVMDHXZZGCCAM-BYNSBNAKSA-N 341.249 1.761 10 10 EDCE Oc1ccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1O 702604113 QJFQHOMIOPCVHT-IBGZPJMESA-N 328.412 1.824 10 10 EDCE O=C(O)[C@H]1OCC[C@@H]1CNCc1ccc(Br)cc1O 716293905 YZWMQHBRZMLHGC-SKDRFNHKSA-N 330.178 1.734 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H](C3CCOCC3)C3CC3)c2n1 2063398672 XEIVSDCIILHVDV-HNNXBMFYSA-N 330.388 1.678 10 10 EDCE CNCc1ccc(N2CC[C@H](C(CO)CO)C2)cc1Br 2170660146 OACUQSUNHBSSTN-LBPRGKRZSA-N 343.265 1.596 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)cc1Br 2190457647 KNLOKVZNYDKAAK-VJMWFJFBSA-N 341.249 1.932 10 10 EDCE CC(C)(O)[C@H]1CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2191157892 VGPJHDNPMCDNIX-VXGBXAGGSA-N 341.205 1.784 10 10 EDCE O=C(O)C[C@@]1(O)CCN(Cc2cc(Br)ccc2O)C1 2104562664 MDISBQXWBVCJEU-ZDUSSCGKSA-N 330.178 1.566 10 10 EDCE CN(c1ccc(CO)cc1Br)[C@H]1CS(=O)(=O)C1(C)C 2097547771 FMZPIXNQUHGIDO-LBPRGKRZSA-N 348.262 1.953 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3[C@H](C(=O)O)[C@@H]3C2)c1O 2236047074 XSWCLDOIRYGRTC-IJBDUVHLSA-N 342.189 1.926 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CN3CC[C@H]2C3)c1O 2227751947 STSODVFVBAQCFL-CABZTGNLSA-N 327.222 1.957 10 10 EDCE OCc1ccc(N2CC(O)(C(F)(F)CO)C2)c(Br)c1 2272875470 XNMOLGUOUOZMSC-UHFFFAOYSA-N 338.148 1.120 10 10 EDCE CN(C)CCCNC=C1C(=O)NC(=O)N(CCC2=CCCCC2)C1=O 2296933290 CFLAIKCCTMEXQV-UHFFFAOYSA-N 348.447 1.381 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2298024087 XRLISTYTHFYEHZ-WISYIIOYSA-N 339.396 1.874 10 10 EDCE COC(=O)[C@H]1C[C@@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 171187719 JRGPXKRERMPLFM-IRXDYDNUSA-N 346.427 1.321 10 10 EDCE CCc1noc([C@@H](C)N2CCN(C(=O)c3cccc(O)c3O)CC2)n1 193065077 NUZULZJHLMBPEU-LLVKDONJSA-N 346.387 1.562 10 10 EDCE O=C1C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2CN1c1ccccc1 247300773 DYVCFRMFCDARQA-CQSZACIVSA-N 336.307 1.960 10 10 EDCE CC(C)CN1C(=O)/C(=C/NCc2ccc(F)cc2)C(=O)NC1=S 255071998 GSLSSGHIPWXZQA-MDWZMJQESA-N 335.404 1.699 10 10 EDCE Cc1c(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nnn1C 266413564 CWCYTAFYTNUAMP-AWEZNQCLSA-N 330.388 1.651 10 10 EDCE CN1CC[C@]2(CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)C2)C1 368305300 UKKVFCCUZAYRSV-INIZCTEOSA-N 332.360 1.458 10 10 EDCE COc1ccc(O)c(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)c1 289345053 IKHBJQKSXGWTOV-AWEZNQCLSA-N 328.434 1.257 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C[C@@](O)(CN)C2)c(O)c1Br 2380751888 PJRAGPLWHZAJKJ-YPFXGUDJSA-N 343.221 1.179 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@H]1CCCN1CC(F)(F)F 291964598 RUGUFXXQMUOSAG-LLVKDONJSA-N 332.322 1.783 10 10 EDCE COCCNCc1ccc(N2CC=C[C@@H](O)C2)cc1Br 2165072797 BXLOQXFXCMPBDH-CQSZACIVSA-N 341.249 1.922 10 10 EDCE C[C@H](C(N)=O)N(C)c1ccc(/C=C/C(=O)O)cc1Br 711183626 FEVXLECESUSVPZ-YZCDNWJKSA-N 327.178 1.857 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC34CC4)cc2)C1 817428350 JEMSLAIXKDEOQU-ZBFHGGJFSA-N 327.428 1.805 10 10 EDCE COc1ccc(O)c(CNC(=O)c2ccnn2C2CCOCC2)c1 830543786 FGYZAHHODWLISZ-UHFFFAOYSA-N 331.372 1.879 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CCCN(c2ncccn2)C1 588405996 YZUHOXLSHMPVET-BRLPQQTGSA-N 340.383 1.686 10 10 EDCE Cc1cc(CC(=O)NCC2(CO)COC2)c(C)n1-c1ccccc1 830748817 NIJGJPBJTKLKCC-UHFFFAOYSA-N 328.412 1.762 10 10 EDCE CCO[C@@H]1C[C@@H](NC(=O)NCc2ccccc2O)[C@H]1n1cccn1 836495936 OZRJRZXFZXJPIJ-FVQBIDKESA-N 330.388 1.807 10 10 EDCE COCc1cc(O)ccc1NS(=O)(=O)c1cn(C)c(Cl)n1 840918435 SVHQXNVLMKEKRA-UHFFFAOYSA-N 331.781 1.726 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@@H](C4CCC4)C3)cc2N1 840359301 SWBKFBCPDPFUIG-OAHLLOKOSA-N 333.344 1.931 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCc1nnc(O)n1C1CC1 923867861 GGFSOXJYHHWRCI-UHFFFAOYSA-N 344.419 1.692 10 10 EDCE CC(C)(C)C(=O)Cn1cc(C(=O)NCc2c(O)cccc2F)nn1 928704809 DIZPXOCYXBVVRJ-UHFFFAOYSA-N 334.351 1.668 10 10 EDCE Cc1cc(CC(=O)N2CC[C@H](O)[C@@H](CO)C2)c(C)n1-c1ccccc1 854946308 KEAJNWHEASVOEW-MJGOQNOKSA-N 342.439 1.838 10 10 EDCE COC[C@]1(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CCNC1 851639113 BHGLVOSQVPLCOL-KDOFPFPSSA-N 333.432 1.016 10 10 EDCE CCO[C@@H](CS(=O)(=O)NCc1ccc(OC)cc1O)C1CC1 859143910 JNFGHPPTZNQFMI-HNNXBMFYSA-N 329.418 1.635 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCCN(C(C)=O)C3)C2)cc1 855228419 CAJDRHYSNDRBNV-CVEARBPZSA-N 345.443 1.649 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C3(OC)CCNCC3)C2)cc1 851639760 LGROVHQHZMCFAV-AWEZNQCLSA-N 333.432 1.159 10 10 EDCE CCn1ccnc1CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852370332 WOOZXALMKFMNEQ-CQSZACIVSA-N 343.431 1.990 10 10 EDCE CN(CCCCS(C)(=O)=O)Cc1ccc(N2CCOCC2)cc1 759689521 NCASYIYNVPEGIF-UHFFFAOYSA-N 340.489 1.780 10 10 EDCE CO[C@@H]1CC[C@@H]2OCCN(C(=O)/C=C\c3ccc(O)c(O)c3)[C@@H]2C1 779542738 SFICWCCNYCJJKS-QQUJTJGYSA-N 333.384 1.906 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)NCC[C@H]2CCCO2)cc1 786600483 WTGBGXQZAPRRCB-QGZVFWFLSA-N 347.459 1.834 10 10 EDCE 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COC(=O)c1ccc(CC(=O)NCc2cccc(OC)c2O)cn1 1595800379 WHKKRYILJXXDJB-UHFFFAOYSA-N 330.340 1.441 10 10 EDCE CN(C)CCC(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 169813604 XHYZIDNWRGBIPU-QGZVFWFLSA-N 329.448 1.643 10 10 EDCE CN1CCCC[C@@H]1CN1CCN(Cc2cc3c(cc2O)OCO3)CC1 152589713 AFKCXOUPYQIEAE-MRXNPFEDSA-N 347.459 1.723 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)/C(=C\c2cccc(O)c2)SC1=S 1858595398 BBXLPVMAFFCZJA-RAJVOEEQSA-N 325.367 1.039 10 10 EDCE NCc1ccc(N2CC(CNC(N)=O)C2)c(F)c1Br 2130740398 YOFVQWBUMDCYSF-UHFFFAOYSA-N 331.189 1.151 10 10 EDCE CN(C)C[C@@H]1COC[C@@H]1NCc1ccc(Br)cc1O 2141464581 KJZIDJMWKUUOMI-YPMHNXCESA-N 329.238 1.821 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2140662025 JVENZGIMUWSRLJ-VFFVRTRHSA-N 334.185 1.382 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2CC(=O)N(C)C2)c1O 1969786596 AVFCEQRWXOOQFO-SECBINFHSA-N 343.221 1.731 10 10 EDCE CO[C@@H](CN)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951695564 IYFUXVRLAAWSQF-FZMZJTMJSA-N 326.393 1.507 10 10 EDCE CNC[C@H](O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951829432 JCLDBPJQRFAJIV-RISCZKNCSA-N 326.393 1.114 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)C3CN(C)C3)c(Br)cc21 2145484547 LKKPOTDLDUMUMI-ZDUSSCGKSA-N 339.237 1.412 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCC(N=[N+]=[N-])CC1 1985094028 JBFLOXQTTHIDPH-NSHDSACASA-N 327.385 1.563 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@H](O)CCN1C(=O)OC(C)(C)C 1985102933 NVYKECABVYXLMB-GHMZBOCLSA-N 327.385 1.516 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)c(Br)c1 2146307010 VTVNOJHMBODHDY-COLVAYQJSA-N 341.249 1.650 10 10 EDCE CN(C(=O)CN1CC(NC(=O)OC(C)(C)C)C1)c1ccc(N)cc1 1999476789 CRMJYXYUJVHBOW-UHFFFAOYSA-N 334.420 1.441 10 10 EDCE C[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)N1CCN(C(=O)OC(C)(C)C)CC1 2010393721 WOEKVWHOAOACKP-NSHDSACASA-N 338.412 1.449 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@H](O)CNC(=O)OC(C)(C)C)c1 2011422463 SGHCEUJPNAIHOU-NEPJUHHUSA-N 340.420 1.937 10 10 EDCE CNCc1ccc(N2CC[C@H](CC(N)=O)C2)cc1Br 690765314 XIKVULIUTBKQGL-SNVBAGLBSA-N 326.238 1.870 10 10 EDCE COc1ccc(Cn2ncnc2I)c(O)c1 2070049911 IDWVAFZMDPVRJD-UHFFFAOYSA-N 331.113 1.645 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)cc1Br 2178087056 OYPBZGSEPPCXSQ-ACGQPVHCSA-N 342.233 1.946 10 10 EDCE COC[C@H]1C=CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2182334189 XCDSBHYDVINVQF-OQPBUACISA-N 339.189 1.826 10 10 EDCE O=S1(=O)C[C@@H]2[C@H](NCc3cccc(Br)c3O)[C@@H]2C1 2054271822 ZSDBAXPPXQENGK-DOFRTFSJSA-N 332.219 1.287 10 10 EDCE COC[C@@H]1CNCCN1Cc1cc(Br)cc(F)c1O 2088493872 IYALNWLQPRSXFB-NSHDSACASA-N 333.201 1.714 10 10 EDCE CNCc1ccc(N2CC[C@H](C)[C@H]2C(N)=O)c(Br)c1 2090262600 PUPJOLHMMADSJE-ZANVPECISA-N 326.238 1.869 10 10 EDCE COc1ccc(Br)c(CN(C)C2(C(=O)O)COC2)c1O 2236042435 JWBUPAJIROXICJ-UHFFFAOYSA-N 346.177 1.449 10 10 EDCE CC(C)(NC(=O)c1cc(O)nc(O)c1)c1cc(Br)no1 2284096793 TTXDIHNZAKLZKD-UHFFFAOYSA-N 342.149 1.908 10 10 EDCE O=C1NC(=O)N(c2ccccc2F)C(=O)C1=CNN1CCCCCC1 2296931437 MOZTYRDVTSSDQD-UHFFFAOYSA-N 346.362 1.673 10 10 EDCE COc1cc(C=C2SC(=S)N(C[C@@H](C)O)C2=O)ccc1O 2318684258 WPCWGGFCMFPCHE-MRVPVSSYSA-N 325.411 1.983 10 10 EDCE Cc1ccc(CNC[C@@H]2C[C@@H](CO)CO2)c(O)c1Br 2352692627 JUGURLLPLRKYBZ-JQWIXIFHSA-N 330.222 1.950 10 10 EDCE COC[C@H]1[C@@H](O)[C@@H](O)CN1c1ccc([C@H](C)N)c(Br)c1 2358565926 PVLJDVFDKLTYOB-PWURMNTRSA-N 345.237 1.026 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NCCc2cscn2)cc1 70490907 XMVHPINUEQMUPR-UHFFFAOYSA-N 327.431 1.266 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nccnc3C(=O)O)CC2)cc1 95215298 JAZUOUDPMNWQTQ-UHFFFAOYSA-N 342.355 1.146 10 10 EDCE CCCN1C(=O)COc2cc3nnc(CC(=O)OCC)nc3cc21 248320155 RVNXFXPKIQVBBJ-UHFFFAOYSA-N 330.344 1.266 10 10 EDCE COC(=O)N1CCN(C(=S)N(C(C)=O)c2ccc(N)cc2)CC1 242719658 DAZLYYVNTHVUFK-UHFFFAOYSA-N 336.417 1.291 10 10 EDCE CC(=O)O[C@@H]1[C@H](N=[N+]=[N-])CO[C@@]2(COC(C)(C)O2)[C@@H]1OC(C)=O 256014543 YWEMWEKIXSKBDT-PRULPYPASA-N 329.309 1.038 10 10 EDCE CN(Cc1cnccn1)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 265499455 XLDFKMYGGVLZSC-QPJJXVBHSA-N 338.411 1.985 10 10 EDCE Cc1ccc(CNC(=O)CCn2cncn2)c(O)c1Br 2380722508 QDYHSBUFCVTQCD-UHFFFAOYSA-N 339.193 1.761 10 10 EDCE CN(C)c1ccc(CN[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)cc1 800309209 JKXONBSXVUVNGV-GDBMZVCRSA-N 325.478 1.560 10 10 EDCE CC(C)OC[C@@H](O)CNCc1ccc(N2CCC(O)CC2)c(F)c1 819122122 QYWXDQFCRQFFIT-INIZCTEOSA-N 340.439 1.662 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)C3CC(C)(O)C3)cc2)CC1 829993573 KRDOTSGZMJVFCW-UHFFFAOYSA-N 345.443 1.132 10 10 EDCE c1cn(C[C@H]2CCN(Cc3ccc(N4CCOCC4)cc3)C2)nn1 826845814 LWKSRIDETBMDTP-KRWDZBQOSA-N 327.432 1.637 10 10 EDCE C[C@@]1(C2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)COC(=O)N1 905710277 HTIQHEVAYRNKIF-QAPCUYQASA-N 348.399 1.529 10 10 EDCE CN1CCN(c2ccc(CNCC[C@H]3CC(=O)N(C)C3)cc2)CC1 922486099 GOHDAQTZSYOLEG-KRWDZBQOSA-N 330.476 1.396 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cccc4ncnn34)CC2)cc1 753614204 QIEUVULRDGQKNY-UHFFFAOYSA-N 337.383 1.700 10 10 EDCE CC[C@@]1(O)CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 854299731 REJYYAGNSFVQRA-KBXCAEBGSA-N 333.432 1.830 10 10 EDCE CN1CCCc2cc(CN3C(=O)N[C@H](CC4OCCO4)C3=O)ccc21 924543737 SRRFWVJIVYHRQN-CQSZACIVSA-N 345.399 1.252 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCCN(C(C)=O)C3)C2)cc1 855228420 CAJDRHYSNDRBNV-HOTGVXAUSA-N 345.443 1.649 10 10 EDCE CO[C@]1(CO)CCCN(C(=O)NCCCSc2nccs2)C1 853855766 FUDSTTYCXRYSMS-CQSZACIVSA-N 345.490 1.808 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCCN(C)C3)C2)cc1 852186764 HZEYBYGOOIJLJS-HUUCEWRRSA-N 332.448 1.667 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCc4nc[nH]c4C3)C2)cc1 855226674 PRXHCYMMCLETGR-KBPBESRZSA-N 340.427 1.918 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@@H](CCF)C3)cc2N1 858797109 JIYZHGYMXNCCGR-VIFPVBQESA-N 325.296 1.491 10 10 EDCE C[C@@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)Cc2c[nH]nc21 931458366 RPEDQRAAXIBHFR-CYBMUJFWSA-N 327.432 1.711 10 10 EDCE O=C(CCc1nn[nH]n1)NCc1ccc(N2CCSCC2)cc1 864918509 HTVDBFMDNYOHIS-UHFFFAOYSA-N 332.433 1.002 10 10 EDCE C[C@H](NC(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1)c1ccccc1O 868290318 LSKWEDCNZVQVRZ-LSDHHAIUSA-N 346.475 1.921 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)CC3CC3)CC2)c(OC)c1 867732029 WKJWQKNJWUYKLX-UHFFFAOYSA-N 340.445 1.566 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cncc(N2CCCC2=O)c1 860235159 PHXXLEQEZSDAII-UHFFFAOYSA-N 341.367 1.592 10 10 EDCE CN(C)c1cc(F)c(CN2CCC[C@@H](CS(N)(=O)=O)C2)cc1F 862242774 QNKMIGWSFHWOBH-LLVKDONJSA-N 347.431 1.531 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@H](O)c3cnc[nH]3)C2)cc1 868955127 IXXDZFOLCAYRNT-MLGOLLRUSA-N 330.388 1.094 10 10 EDCE CN1CC(CN(C)c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 692189691 GYBDEUIIVZQOSB-ZDUSSCGKSA-N 339.237 1.399 10 10 EDCE CNC(=O)[C@H](C)CN(C)Cc1c(C(=O)OC)n(C)c2ccc(F)cc12 894085232 NJSRWZGRWSWGAL-LLVKDONJSA-N 349.406 1.918 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1ccc(CN2CCOCC2)cn1 798161949 IBMZOLHDUBEKFD-UHFFFAOYSA-N 341.411 1.892 10 10 EDCE CCOC(=O)c1c[nH]nc1S(=O)(=O)Nc1ccc(O)c(OC)c1 797820021 CAABYJFPSMCUJF-UHFFFAOYSA-N 341.345 1.101 10 10 EDCE COc1cnccc1N1CCN(C(=O)c2ccc(C)c(O)c2O)CC1 794343780 LBTGCUBEMSQQLN-UHFFFAOYSA-N 343.383 1.772 10 10 EDCE CNC(=O)C1(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)CCC1 1317279851 NOWUVGUFHWVFAQ-AWEZNQCLSA-N 347.459 1.514 10 10 EDCE CS(=O)(=O)N[C@H]1CCN(c2ccc(CN)c(Br)c2)C1 703008170 WTBYWBVBTVUFQS-JTQLQIEISA-N 348.266 1.036 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@H]1COCCN1C 1254220993 BGEFZTQBMRVZEA-SFHVURJKSA-N 346.475 1.759 10 10 EDCE CC(C)(C)OC(=O)N1CCC(O)(CC(=O)NCCN=[N+]=[N-])CC1 1965103241 ZEZGOTOSXJWCEG-UHFFFAOYSA-N 327.385 1.565 10 10 EDCE COC1CCN(c2ccc(CN3C[C@H]4COC(=O)[C@H]4C3)cc2)CC1 1196675563 NLBIQXDJHOODHJ-YJBOKZPZSA-N 330.428 1.907 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@H]2COCCO2)cc1C 1268511177 CXPCLLXEHDLLBN-CWIOURORSA-N 334.416 1.181 10 10 EDCE O=C(C[C@H](O)C(Cl)(Cl)Cl)NCc1cccc(O)c1O 1348048430 SXLGBMMOMWTZHR-QMMMGPOBSA-N 328.579 1.835 10 10 EDCE CCN(CC)C(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1293618748 OKPIDPLUVRALIH-UHFFFAOYSA-N 335.404 1.246 10 10 EDCE COc1cccc(CNC(=O)NCc2nc(CSC)n[nH]2)c1O 1479344297 QNDUBMWMASTBNY-UHFFFAOYSA-N 337.405 1.381 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCC[C@@H](N2CCCC2=O)CC1 1558995158 CXVMOBTZFRBMCW-LLVKDONJSA-N 336.363 1.854 10 10 EDCE COCCOCCc1ncc(C(=O)NCc2ccc(N(C)C)cc2)[nH]1 1624401261 BJSOXYKTHQQHPJ-UHFFFAOYSA-N 346.431 1.611 10 10 EDCE CN(C(=O)c1cccc(O)c1O)c1ccc(N2CCOCC2)nc1 1633648315 JJDXRJKFNRJXHN-UHFFFAOYSA-N 329.356 1.606 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1648932551 IHFRNORAERHEAG-ZYHUDNBSSA-N 334.332 1.157 10 10 EDCE C[C@@H](c1cccnc1)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 1866303466 YKWMEUWYKNDHEO-LBPRGKRZSA-N 343.383 1.717 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)CC(C)(C)O)c(Br)cc21 118775082 XBDAXPVVTRMUMH-LBPRGKRZSA-N 342.237 1.869 10 10 EDCE COCC[C@H](N)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951943174 KFTLXMLEPXPEKQ-QWHCGFSZSA-N 340.420 1.897 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985100256 DKDRHQDTKOOTKQ-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NCc2c(O)cccc2F)C1 1985827620 NKYRPSGXSJPTRN-TZMCWYRMSA-N 326.368 1.601 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010406435 UTRUTKKPSHIVST-VXGBXAGGSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010401907 JLDQNGCHSIWJSU-IJLUTSLNSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010406623 WVNSWYDSFMBNEL-WOPDTQHZSA-N 339.396 1.827 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1CC(=O)C(=O)C[C@H]1C[C@H](N)C1 2014421766 FHBSZKXGWGUHSB-FDYHWXHSSA-N 340.420 1.182 10 10 EDCE CNC(=O)[C@H]1CCCN1c1cc(Br)c(CN)cc1F 311388964 CLVXPCHIBSQHHJ-LLVKDONJSA-N 330.201 1.762 10 10 EDCE CN1CCO[C@@H](CN(C)c2ccc(CO)c(Br)c2)C1 707869526 SMURWBWWMIINON-CYBMUJFWSA-N 329.238 1.708 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@](C)(O)c3ccsc3)c2n1 2062085328 DRVXQRCXJNBKIY-HNNXBMFYSA-N 332.385 1.442 10 10 EDCE CN(C)C(=O)c1cn(Cc2c(O)cccc2Br)nc1O 2070598940 SWWKOCBFYAUPAJ-UHFFFAOYSA-N 340.177 1.807 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 1648689414 AFVWSDURYKMPDW-IAGOWNOFSA-N 329.352 1.291 10 10 EDCE CNCc1ccc(N2CC(CNC(=O)OC)C2)c(Br)c1 2187299260 ZNRPHUPKLVKIBO-UHFFFAOYSA-N 342.237 1.961 10 10 EDCE COC[C@@]1(O)CCN(c2ccc(CN)c(Br)c2F)C1 2095538190 IMYHVNJUYUAXOQ-CYBMUJFWSA-N 333.201 1.635 10 10 EDCE C[C@@H](c1ccccc1O)N(C)S(=O)(=O)C1CC2(C1)OCCO2 2277964306 DOGGKFWJVJKXLC-NSHDSACASA-N 327.402 1.620 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3CCO[C@@]3(CO)C2)cc1Br 2239919740 YBCVCHQTEQRCLT-IINYFYTJSA-N 345.212 1.635 10 10 EDCE Cn1nccc1C=CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 2297358171 WUBPBTAJZYHIEW-UHFFFAOYSA-N 344.390 1.725 10 10 EDCE COCCn1nc(Br)nc1OCc1ccc(N)cc1 2353598635 QRTYLBQILWXHIZ-UHFFFAOYSA-N 327.182 1.848 10 10 EDCE Cc1ccccc1N1C(=O)NC(=O)/C(=C\N[C@H]2NC=CS2)C1=O 100103999 VJSRECGPQIYZJG-QSYFUGGGSA-N 330.369 1.143 10 10 EDCE COCc1cc(N[C@H](C)Cc2ccc(O)c(O)c2)n2ncnc2n1 183599676 DROYTSQOUWKKMQ-SNVBAGLBSA-N 329.360 1.725 10 10 EDCE COc1ccc(N2CCC(Nc3cncc(OCCO)n3)CC2)cc1 133294498 WMORIZKFHBTGNY-UHFFFAOYSA-N 344.415 1.937 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cn4ncsc4n3)CC2)cc1 82320431 UYBGVDDRXYEAGU-UHFFFAOYSA-N 343.412 1.762 10 10 EDCE COC(=O)CC[C@@H](N)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 377531807 YKNCCLZDTBNHBP-MRXNPFEDSA-N 349.431 1.014 10 10 EDCE CC[C@@H](Cn1cncn1)NCc1ccc(N2CCOCC2)c(F)c1 810211092 MEFITDHDWZBPSW-HNNXBMFYSA-N 333.411 1.822 10 10 EDCE CCNCc1ccc(N2CCN(C(N)=O)CC2)cc1Br 722175920 CMZVGWJJWWZHQD-UHFFFAOYSA-N 341.253 1.759 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(CC2CCOCC2)CC1 588407345 ZJXLUPBJIQQDJB-RQOWECAXSA-N 346.427 1.682 10 10 EDCE CN1CC[C@H](C(=O)NCc2ccccc2O)[C@H](c2cnn(C)c2)C1 849565296 SRUFBSLJEAETOD-HOTGVXAUSA-N 328.416 1.477 10 10 EDCE CN(C)CCN1CCN(Cc2c(O)ccc(Cl)c2F)CC1=O 846015175 WCHJRRIOJCBGJQ-UHFFFAOYSA-N 329.803 1.391 10 10 EDCE O=S1(=O)CC[C@@]2(CN(Cc3cc(Cl)ccc3O)CCO2)C1 843425914 JVBVUWFKMUXIDI-CQSZACIVSA-N 331.821 1.435 10 10 EDCE CS(=O)(=O)CC1(CNC(=O)NCc2c(O)cccc2F)CC1 921314312 MJRSZYKJAYHRSB-UHFFFAOYSA-N 330.381 1.155 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@@H]3CCOC[C@H]3OC)C2)cc1 855226230 OKMHNOWABNHCQH-RLFYNMQTSA-N 348.443 1.832 10 10 EDCE Oc1ccccc1CN(C[C@@H]1CCCO1)C[C@H]1CC2(CNC2)CO1 923298823 KWVVWUPTTQMYGD-DLBZAZTESA-N 332.444 1.752 10 10 EDCE O=C1N[C@@H](CC2OCCO2)C(=O)N1CCCSc1nccs1 924639186 DSLRHJHPSXSJRR-VIFPVBQESA-N 343.430 1.309 10 10 EDCE C[C@H](NC(=O)N1CCO[C@@H](CC(N)=O)C1)c1ccc(N(C)C)cc1 858368583 MISZLHQZQVTDBR-WFASDCNBSA-N 334.420 1.099 10 10 EDCE CNC(=O)C[C@H](C)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852374748 XQCGHVSPQHERSQ-STQMWFEESA-N 334.420 1.098 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3nc[nH]n3)C2)cc1 852449848 XJSIWXCYHKFSMD-GFCCVEGCSA-N 330.392 1.234 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CCCNC3=O)C2)cc1 852379768 CEOCXHNXOJOFHQ-KGLIPLIRSA-N 346.431 1.099 10 10 EDCE Cc1cc(CNC(=O)[C@H]2CN(C)C(=O)N2)c(C)n1-c1ccccc1 863163381 AHDWIMJOMXZXMB-MRXNPFEDSA-N 326.400 1.734 10 10 EDCE COc1ccc(N2CCN(Cc3nc(C)cc(O)n3)CC2)c(OC)c1 879462443 OMTCBISJFKMPMG-UHFFFAOYSA-N 344.415 1.830 10 10 EDCE C[C@H]1CCn2cc(C(=O)NC[C@H](N)c3ccc(N(C)C)cc3)nc2C1 870932453 FQYDBOVNKROFNP-BBRMVZONSA-N 341.459 1.961 10 10 EDCE COc1cccc(O)c1CNc1ccc2c(c1)CN(CC(N)=O)CC2 788529965 SAWSIGQQPNVFJA-UHFFFAOYSA-N 341.411 1.856 10 10 EDCE O=C(CC[C@@H]1CC[C@H](C2OCCO2)O1)N1Cc2cccc(O)c2C1 899173122 JTJRPQGGSUTGBF-XJKSGUPXSA-N 333.384 1.935 10 10 EDCE CC(C)C(=O)N1CCC[C@@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 783314556 BKWGODGORBANMI-GFCCVEGCSA-N 335.356 1.471 10 10 EDCE COC(=O)c1cnc(CCNC(=O)c2ccc(C)c(O)c2O)s1 1179664365 SKKRTFPHQQOOPU-UHFFFAOYSA-N 336.369 1.622 10 10 EDCE CCC(CC)[C@H](C(=O)NCc1cccc(O)c1O)N1CCOCC1 1263894658 PVZJQIDJKLFAJD-MRXNPFEDSA-N 336.432 1.851 10 10 EDCE CN(CCc1cccs1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1348613868 VPMYYPRZPDOBJM-UHFFFAOYSA-N 330.409 1.997 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)Cc2cccs2)cc1C 1507169215 ZIRALVPOMULOCC-HNNXBMFYSA-N 348.468 1.875 10 10 EDCE COc1ccc(N2CCN(C(=O)Cc3ncccc3OC)CC2)cc1 1545556408 HVMAQOQHYDMRSJ-UHFFFAOYSA-N 341.411 1.990 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2ccc(C)o2)cc(OC)n1 1494586180 XBGSLCNWOFLZLY-SNVBAGLBSA-N 347.371 1.549 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)CCC(F)F)cc(OC)n1 1494855319 UPNJCUSDKOQYOI-SECBINFHSA-N 345.346 1.379 10 10 EDCE CC(C)N(CCN(C)CCO)C(=O)c1ccc(N=NC(N)=O)cc1 1725733067 NRXGNXCPPMKFBD-UHFFFAOYSA-N 335.408 1.624 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CC(=O)N(Cc2ccco2)C1 1635843412 QRIQRVGZNRQVDS-NSHDSACASA-N 330.340 1.356 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1C[C@]2(CO)CCCC[C@]2(CO)C1 1646210205 RSUZJOCPCZCVJT-HAKIGUCZSA-N 347.411 1.485 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(C)[C@@H]3CCCC[C@H]3O)nc12 1659691288 NUSDLCIBZPNAJS-ZIAGYGMSSA-N 348.403 1.347 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)C[C@@H]2CCC(=O)N2)cc1C 1662988853 KNQGZENLBLKXOS-HOCLYGCPSA-N 347.459 1.657 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)Cc1ncc[nH]1 1668597226 WMIJYKGOLDAEHA-UHFFFAOYSA-N 330.432 1.908 10 10 EDCE COCCNC[C@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1661841740 DTSUHCRKDMMIPF-CYBMUJFWSA-N 347.419 1.937 10 10 EDCE C[C@H](O)CCCN[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1690651719 FSHKSQUOUZLLBV-NEPJUHHUSA-N 335.408 1.718 10 10 EDCE C[C@@]1(O)Cc2ccc3c(c2C(=O)[C@@H]1O)C(=O)c1cccc(O)c1C3=O 5553521 ZGIMJLWQWQRQNJ-RBUKOAKNSA-N 338.315 1.018 10 10 EDCE biogenic CC1(C)O[C@@H]2[C@@H](CN=[N+]=[N-])O[C@@H](n3cnc4c(N)ncnc43)[C@@H]2O1 16953706 QWAPXRJZRIFMTR-WOUKDFQISA-N 332.324 1.136 10 10 EDCE O=C1Nc2cc(N3CC[C@@]34CCOC4)c(Br)cc2[C@H]1O 1915351190 SAGXAYPLHWBRJF-OCCSQVGLSA-N 339.189 1.804 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1990023282 UWFUHWHPCTXYGR-WDEREUQCSA-N 327.385 1.563 10 10 EDCE CNCc1ccc(N2CC3(C2)OCCC[C@H]3O)cc1Br 2159648822 VNJFVOBEJSDXGB-CQSZACIVSA-N 341.249 1.899 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 2010392258 YNJDVLJQEZUCLO-LBPRGKRZSA-N 340.428 1.743 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCc2ccc(N)cc2)C1 2020665236 FMLHUBCMPUPOCN-KRWDZBQOSA-N 335.404 1.257 10 10 EDCE C[C@H]1[C@@H](NCc2c(O)cccc2Br)CCS1(=O)=O 706875232 QUERAOGXLNURTE-KWQFWETISA-N 334.235 1.820 10 10 EDCE NCc1cc(F)c(N2CC[C@H](O)[C@H](CO)C2)cc1Br 396922453 KGPLQYYQFNJPRJ-ZANVPECISA-N 333.201 1.226 10 10 EDCE COc1ccc2c(n1)N(C)CCN2C(=O)Cc1ccc(O)c(O)c1 1596623804 IRKFERAFEXGKLT-UHFFFAOYSA-N 329.356 1.527 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)C[C@H]2CO)cc1Br 2089863704 MKNWCVXJVTXWFA-NHCYSSNCSA-N 329.238 1.648 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]12CO[C@@H](C1)[C@@H](NC(=O)OC(C)(C)C)C2 2247343910 FAABWIPQJXOWNB-ZIBATOQPSA-N 339.396 1.827 10 10 EDCE COc1ccc(OC)c(C=C2SC(N3CCN(C)CC3)=NC2=O)c1 2293769091 XJAIOEJCPCHSEJ-UHFFFAOYSA-N 347.440 1.922 10 10 EDCE CCNS(=O)(=O)N(C)Cc1ccc(C)c(Br)c1O 2327792863 OMRSXITWCRNUHU-UHFFFAOYSA-N 337.239 1.749 10 10 EDCE CN(CC1(O)CC1)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2340181695 WHJLMAQXHLECPV-NSHDSACASA-N 327.178 1.396 10 10 EDCE Oc1cc(Br)ccc1CNC[C@@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2355457771 PLZSZCKUIKHJMQ-UCTJBKIYSA-N 342.233 1.622 10 10 EDCE CN(Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O 310209481 PLTHWWPHKDXVQN-AWEZNQCLSA-N 344.367 1.935 10 10 EDCE Cc1ccc(CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)o1 55106452 OOQDYIXCNYCWNT-UHFFFAOYSA-N 338.385 1.937 10 10 EDCE C[C@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)cc1Br 2357056515 KNLOKVZNYDKAAK-IDNCBAHPSA-N 341.249 1.932 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CCOC[C@H]2C(N)=O)cc1 180270664 IVOSFSICKRCEGP-INIZCTEOSA-N 327.384 1.420 10 10 EDCE O=C(CCC(=O)c1ccccc1)NCCN1C(=O)CSC1=S 71500699 UQJGULBKBHLFQL-UHFFFAOYSA-N 336.438 1.626 10 10 EDCE Cc1ccc2c(n1)OCCN2C(=O)c1cn(C)nc1-c1cnn(C)c1 355868450 OQHDGMNDWVRHQT-UHFFFAOYSA-N 338.371 1.563 10 10 EDCE O=C1N[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CS1 269791621 JPPOJGHCFJNKDB-OLZOCXBDSA-N 336.413 1.725 10 10 EDCE CN1CC[C@@]2(CCN(CC(=O)NCc3ccc(N(C)C)cc3)C2)C1 292215800 UMTCJOLOSSUKTJ-LJQANCHMSA-N 330.476 1.396 10 10 EDCE COC(=O)[C@H](NCc1cc(Cl)c(F)cc1O)c1ccn(C)n1 816588953 GXFLQUXZSXWNQS-CYBMUJFWSA-N 327.743 1.922 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2C[C@H]3CC[C@H]2[C@@H]2CNC[C@@H]32)c1O 903962864 LOIKYYARPCTXMA-CABNGKKXSA-N 333.388 1.739 10 10 EDCE CC1(C)[C@H](O)C[C@H]1NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588530408 GURKMGYFCDKGPN-LVXHKSIOSA-N 330.428 1.812 10 10 EDCE CON1CCC(N(C)c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 840319644 HQAKZMWYDISFLC-UHFFFAOYSA-N 336.348 1.388 10 10 EDCE COc1ccc(N(C)CCN(C)CN2CC(F)(F)CC2=O)cc1 844726815 XGNQHEOSXDKTPJ-UHFFFAOYSA-N 327.375 1.888 10 10 EDCE C[C@@H](C1CC1)n1[nH]ccc1=NC(=O)COC(=O)c1cc(O)cs1 745003095 XAXSUQOHONXHBB-VIFPVBQESA-N 335.385 1.839 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)c3cccc(N)c3)C2)cc1 849415905 HPLUXDXKFJHTMH-AWEZNQCLSA-N 347.440 1.835 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)c3cnn(C)c3)C2)cc1 855232414 TTWLMGSHHNMLIO-HIFRSBDPSA-N 328.416 1.927 10 10 EDCE Cn1cc([C@@H](NC(=O)c2c(F)ccc(O)c2O)C2(CO)CCC2)cn1 857264294 UXUSDDULMAZYBY-OAHLLOKOSA-N 349.362 1.604 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3cnn(C)c3)C2)cc1 852004616 IQCVJPGNVXFTGE-CQSZACIVSA-N 329.404 1.507 10 10 EDCE COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(C(=O)c2cccc(O)c2O)C1 855331134 OKIXAFLGQRVGQY-BDAKNGLRSA-N 347.289 1.911 10 10 EDCE CC[C@H](CCO)CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 854300659 XRUIWDKWMVUCSQ-CABCVRRESA-N 335.448 1.982 10 10 EDCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 861766069 LCZSWDHYHOBPRB-DLBZAZTESA-N 344.459 1.160 10 10 EDCE C[C@@H]1CC[C@@H](C(N)=O)[C@@H](C)N1CC(=O)NCc1ccc(N(C)C)cc1 930918427 YTTIQGZREOVTFR-CKEIUWERSA-N 346.475 1.343 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1C[C@H]2[C@H]3CC[C@@H](NC3)[C@H]2C1 863653016 XYHUCTXNILCZOS-FRYIKTPZSA-N 327.472 1.953 10 10 EDCE COC(=O)[C@@H]1CCCC[C@H]1S(=O)(=O)N1Cc2cccc(O)c2C1 867691298 VEXFJWJWAXBHCK-IUODEOHRSA-N 339.413 1.769 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)CCCO1 1116669252 LMKUMPXUXHVOMQ-SJCJKPOMSA-N 337.372 1.257 10 10 EDCE Cc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 788148323 RBMFSGRCBZMUQS-CQSZACIVSA-N 340.427 1.950 10 10 EDCE CN(C1CC1)S(=O)(=O)NCc1cc(Br)ccc1O 796191477 VGEIEKGBRBVUSF-UHFFFAOYSA-N 335.223 1.583 10 10 EDCE CN(C)CCNC(=S)NCc1cc(Br)ccc1O 795154758 UOJOUHYEXSMFRO-UHFFFAOYSA-N 332.267 1.680 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cnn(CCN(C)C)c1 797631968 QXVUALZWWFPOBI-GFCCVEGCSA-N 347.419 1.609 10 10 EDCE O=C(NCc1cccc(O)c1O)c1ccnc(O[C@H]2CCOC2)c1 1153798968 ZATKQXNDNUIQQF-ZDUSSCGKSA-N 330.340 1.591 10 10 EDCE Cc1nn(C)c(Br)c1[C@H](O)[C@H](N)c1ccccc1O 1890613621 XIEWNDKXJAPZEY-NEPJUHHUSA-N 326.194 1.930 10 10 EDCE COC(=O)[C@H]1[C@H]2C=C[C@@H](CC2)[C@H]1C(=O)NCc1cc(O)ccc1O 1176755049 LJLJEBPXUFKSTH-QMMBQJITSA-N 331.368 1.715 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1267140141 NAPQVKIZVPADNU-KMANFZQXSA-N 332.444 1.880 10 10 EDCE CC/C=C(\F)C(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCC 1351823714 WTBTYXGOCHHLAM-QJGQKNTRSA-N 325.336 1.952 10 10 EDCE Cc1cc(Br)cc(CN2C[C@H]3NC(=O)O[C@@H]3C2)c1O 2120406533 RJXUFJYENZSEPL-GHMZBOCLSA-N 327.178 1.756 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cocn2)cc1C 1486264573 GUNPGGJDEWCYGY-CQSZACIVSA-N 333.388 1.214 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2ncccc2O)cc1C 1481223834 VXFQPWVCDGOEAF-UHFFFAOYSA-N 329.400 1.966 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H](N1CCOCC1)C(F)(F)F 1626992041 AIEIDXYGFPOLMH-CYBMUJFWSA-N 348.321 1.020 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(Cc2cn[nH]c2)CC1 1630370068 UBWVFCFUDFPLBC-DUXPYHPUSA-N 328.372 1.179 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCO[C@H](c2noc(C3CC3)n2)C1 1633867365 QHZCTGHAPMDICF-AWEZNQCLSA-N 345.355 1.501 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1nnn(C)c1C(F)(F)F 1633819510 QQLPYZLYPRXRSA-ZETCQYMHSA-N 344.293 1.606 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)C[C@@H]2CCC(=O)N2)cc1C 1662988855 KNQGZENLBLKXOS-ZBFHGGJFSA-N 347.459 1.657 10 10 EDCE CC(=O)Nc1ccc(S(=O)(=O)NC(=O)Oc2ccc(N)cc2)cc1 1858615915 MCVZQOJSRPVXOR-UHFFFAOYSA-N 349.368 1.705 10 10 EDCE O=C(CCN1C(=O)CSC1=S)NCc1ccc2c(c1)OCO2 1865765163 SPIBNCNNDOVNQG-UHFFFAOYSA-N 338.410 1.282 10 10 EDCE CC[C@H]1C(=O)NC(=O)CN1c1ccc(CN)cc1Br 212928120 SUHLSWNOBHRLMX-JTQLQIEISA-N 326.194 1.149 10 10 EDCE Oc1c(Br)cccc1CNCCN1CC2(COC2)C1 1967702590 GANXNNRQMWXUTK-UHFFFAOYSA-N 327.222 1.577 10 10 EDCE COc1cc([C@@]2(NC(=O)OC(C)(C)C)C[C@@H]2C(=O)O)cc(O)c1O 1952888697 WNEYYETYGLIJFI-ABKXIKBNSA-N 339.344 1.931 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)N1CCC(CN=[N+]=[N-])CC1 1985102425 GTCQWXCJYOWXRD-LLVKDONJSA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CN2C(=O)c1ccc(O)c(O)c1 2006281428 LOFYMYCGFKAYOF-NEPJUHHUSA-N 334.372 1.932 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)CCOC1 2010405475 INRDQGDUWODWAV-NHYWBVRUSA-N 339.396 1.829 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@](C)(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010388609 DXMZNWAUKOSDQT-XHDPSFHLSA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)([C@@H](F)C(=O)Nc2ccc(N)cc2)C1 2022826259 HLYJEHMSZSMZAA-LBPRGKRZSA-N 339.367 1.527 10 10 EDCE CCNCc1ccc(N(C)[C@H]2COC[C@H]2O)c(Br)c1 708091792 XUUNLJNBIQEQHW-UONOGXRCSA-N 329.238 1.755 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)c(Br)c1 2173316622 DFDFXLNKVFYRGG-LFNVJSRFSA-N 341.249 1.789 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)[C@@H](CO)C2)cc1Br 396816660 UERQJWLPKASNPL-IMSIIYSGSA-N 329.238 1.648 10 10 EDCE COCCn1nnnc1CNCc1ccc(Br)cc1O 2169361833 FHTMTHVTNCENLH-UHFFFAOYSA-N 342.197 1.077 10 10 EDCE O=C1Nc2cc(N3CCOC[C@H]3CF)c(Br)cc2[C@H]1O 2182598529 SROVYNVXRGWWMP-JMCQJSRRSA-N 345.168 1.609 10 10 EDCE CC[C@]1(CO)COCCN1c1ccc(CO)cc1Br 2112721386 VEMGLYFIECGPOT-AWEZNQCLSA-N 330.222 1.919 10 10 EDCE N[C@@H]1CCCC[C@@H]1NC=C1C(=O)NC(=S)N(c2ccccc2)C1=O 2296116215 VMNVYGXDZFTPSS-KGLIPLIRSA-N 344.440 1.178 10 10 EDCE CN1C(=O)C(=CNc2ccccc2Br)C(=O)NC1=S 2296917072 FJXJBDJNTYUSCX-UHFFFAOYSA-N 340.202 1.618 10 10 EDCE Cc1ccc(CNC[C@@H](C)S(C)(=O)=O)c(O)c1Br 2327626866 PTAROZLZVPTAMH-SECBINFHSA-N 336.251 1.986 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2329326112 MELQUKUGBSFLIO-KUCHZILPSA-N 327.222 1.399 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2329326110 MELQUKUGBSFLIO-DHQAPWOJSA-N 327.222 1.399 10 10 EDCE COC(=O)[C@](C)(O)CNCc1ccc(C)c(Br)c1O 2352634715 XOFPFJOLHIEPCH-CYBMUJFWSA-N 332.194 1.477 10 10 EDCE Cc1ccc(Cn2nnc(C(=O)O)c2N)c(O)c1Br 2352693569 QAUBDXKJCTTZIE-UHFFFAOYSA-N 327.138 1.383 10 10 EDCE CN(C)C(=O)CCc1cccc(NC=C2C(=O)OC(C)(C)OC2=O)c1 30766685 MCCRVFFNQDVVHH-UHFFFAOYSA-N 346.383 1.839 10 10 EDCE CCOCCOCC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 177279511 AIYICNGTZSAUQO-UHFFFAOYSA-N 340.395 1.536 10 10 EDCE COc1ccc(O)c(CN2CCCN(Cc3noc(C)n3)CC2)c1 183395078 FCMXYBLMSVIAQY-UHFFFAOYSA-N 332.404 1.800 10 10 EDCE COC(=O)[C@@]1(C)CCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 186339515 MAEOKOBXBZOIEV-LJQANCHMSA-N 347.459 1.739 10 10 EDCE CC1(C)CCN(Cc2cc([N+](=O)[O-])ccc2O)CCS1(=O)=O 194973942 RXOGWXSDTCZMAW-UHFFFAOYSA-N 328.390 1.700 10 10 EDCE Oc1ccccc1CN(C[C@@H]1CCCO1)C[C@@H](O)Cn1cccn1 245820329 VGWVBEDTTOYNKY-SJORKVTESA-N 331.416 1.631 10 10 EDCE Cc1ccc(CN2C(=O)[C@H]3CC[C@@H](O3)C2=O)c(O)c1Br 2381143384 QKCPMMGYSKHBRN-NXEZZACHSA-N 340.173 1.880 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](NC(=O)c1ccco1)c1ccccc1 808494455 ZNLABUFBKUULPL-OAHLLOKOSA-N 329.308 1.452 10 10 EDCE CS(=O)(=O)NC[C@H]1CCC[C@H]1NCc1c(O)cccc1Cl 800308826 BBJDXOGGXOMSBP-ZWNOBZJWSA-N 332.853 1.853 10 10 EDCE CCNC(=O)N1CCN(c2ccc(CN)cc2Br)CC1 721809177 XLWNHLQRIKGDIW-UHFFFAOYSA-N 341.253 1.759 10 10 EDCE Cc1ccc(C(=O)OCC(=O)N2CCO[C@@H]3CCCC[C@H]32)c(O)c1O 727004372 UKKPYTUSNNJHFR-ZIAGYGMSSA-N 349.383 1.733 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)NC3COCCOC3)C2)cc1 823734550 ZYKVAUUJHAMPQF-CQSZACIVSA-N 349.431 1.236 10 10 EDCE CNC[C@@H]1CCCCN1C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 903780702 BWJUCCJBBPMEDC-KRWDZBQOSA-N 346.475 1.312 10 10 EDCE N[C@@H]1CCCC[C@@H]1NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588458173 LYLIOVGNDUYQSF-JWJFLKPDSA-N 329.444 1.923 10 10 EDCE C[C@@H](NC(=O)N1CCN2C[C@H](O)C[C@H]2C1)c1ccc(N(C)C)cc1 847357527 ZCCJDXFMYNZWQJ-XOKHGSTOSA-N 332.448 1.274 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCCN(C)C2)cc1 844905522 CXKTZVGLYKLKLV-HNNXBMFYSA-N 334.464 1.867 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(C)CCCN3)cc2)CC1 843498945 AIVOAIWILZFLIE-IBGZPJMESA-N 344.459 1.113 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)c2ccc3c(n2)OCCO3)cc1 848394056 MKSAXKOGJSOTIF-CQSZACIVSA-N 342.399 1.349 10 10 EDCE CC[C@H](NC1CN(S(=O)(=O)N(C)C)C1)c1cccc(Cl)c1O 858571935 MRTXJTGMSLMNQZ-ZDUSSCGKSA-N 347.868 1.577 10 10 EDCE CN(C)c1ccc(CNS(=O)(=O)c2cnc(O)s2)cc1F 866672142 HKLPAIUPDBZCFT-UHFFFAOYSA-N 331.394 1.532 10 10 EDCE C[C@H](NC[C@@H]1C[C@H]2COC[C@H]2O1)c1ccc(N2CCOCC2)cc1 930211783 WNJYYTJCVMVMQE-OYSPMZIOSA-N 332.444 1.978 10 10 EDCE Cc1ccc(C(=O)N2CCC(N3CCCOCC3)CC2)c(O)c1O 861985636 ZMQXHYCJRZIHDW-UHFFFAOYSA-N 334.416 1.733 10 10 EDCE CN(Cc1cc(Cl)cn1C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1119017504 CGXRKQYJZFYFDQ-UHFFFAOYSA-N 347.802 1.885 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@]1(C)CCCCO1 1119809520 BJDTYPDTTJKYNG-LJQANCHMSA-N 347.459 1.753 10 10 EDCE O=C(C(=O)N1CCC[C@H]1CN1CCCC1)N1Cc2cccc(O)c2C1 1119003574 JDWHZRQQFSFSOP-HNNXBMFYSA-N 343.427 1.321 10 10 EDCE CCOC(=O)C1=NN(c2ccc(C(=O)OC)cc2OC)C(=O)[C@@H]1C 871955058 QDVWSUDNQDJLMS-SECBINFHSA-N 334.328 1.384 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N(C)CCCCO)cc1 788951573 MBOWAHSFVMAWJQ-UHFFFAOYSA-N 335.448 1.380 10 10 EDCE CS(=O)(=O)c1cccnc1CNC(=O)/C=C\c1ccc(O)c(O)c1 787713112 QODQIYBMYUWNBI-ALCCZGGFSA-N 348.380 1.226 10 10 EDCE Cn1cc(C(=O)NCc2c(O)cccc2F)c(=O)c2cnn(C)c21 1156171234 YOVMYCJRYYKFAK-UHFFFAOYSA-N 330.319 1.047 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(NC)CC2)cc1 1261381355 HIAJJHSXNWQUMA-UHFFFAOYSA-N 346.475 1.359 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@@H]2CCN(C)C(=O)C2)cc1C 1266948944 RUWNZJFWQXHPMP-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE Cc1ccc(C(=O)N2C[C@@H](C(N)=O)[C@H](c3ccccc3)C2)c(O)c1O 1299396748 BTPFCOLDBMUESU-LSDHHAIUSA-N 340.379 1.747 10 10 EDCE COC(=O)c1ccn(CCCC(=O)NCc2cccc(OC)c2O)n1 1465993921 YVMRCPMZKHODFW-UHFFFAOYSA-N 347.371 1.481 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2ncn(C)c2n1 1611431251 LLRFWNHGDYMQKY-SNVBAGLBSA-N 326.356 1.741 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2ncn(C)n2)cc1C 1482099439 QHTFHACTIKFIAS-LBPRGKRZSA-N 331.420 1.288 10 10 EDCE NC(=O)COc1cccc(C(=O)NCc2cccc(Cl)c2O)c1 1637226855 CBTZLCCTVAJOAQ-UHFFFAOYSA-N 334.759 1.840 10 10 EDCE CCOCCC(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1494636483 HCPGHSGIRCYWTN-NSHDSACASA-N 349.391 1.510 10 10 EDCE C[C@@H](NC(=O)Cc1ccc(S(N)(=O)=O)s1)c1ccccc1O 1635793712 FBKVEQWJRNAKBZ-SECBINFHSA-N 340.426 1.521 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](CO)[C@H]3C)C2)cc1 1565055929 NONHVFFVAKJRPZ-KFWWJZLASA-N 333.432 1.686 10 10 EDCE CCc1ocnc1C(=O)NC[C@@H](O)CNCc1ccc(OC)c(C)c1 1568554459 OJVGEOZMZQCBFM-AWEZNQCLSA-N 347.415 1.435 10 10 EDCE CS[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1569753642 VHJVFCIHEZSOPJ-JTQLQIEISA-N 330.431 1.341 10 10 EDCE CNC(=O)[C@@H](C)N[C@@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1734357115 OCCPSFHKBYSWDE-WDEREUQCSA-N 348.407 1.034 10 10 EDCE O=C(NCc1c(O)cccc1O)C(=O)c1cnn(-c2ccccc2)c1 1647270402 RHHRDCCUMHXZLG-UHFFFAOYSA-N 337.335 1.783 10 10 EDCE COc1ccc(CNC[C@H]2C[C@H](NC(=O)[C@H](C)CC(N)=O)C2)cc1C 1734214409 VSERBOXEBYJKGF-FVQBIDKESA-N 347.459 1.500 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCS(=O)(=O)CCO2)c1O 1648641919 QTJCKTRCZVAKFE-UHFFFAOYSA-N 333.793 1.410 10 10 EDCE O=C1CC[C@](C(=O)NCc2cc(O)ccc2O)(c2ccccc2)CN1 1651225741 XAQAOOAXDXZWMV-LJQANCHMSA-N 340.379 1.562 10 10 EDCE COc1cc(C(=O)N[C@@H]2CCN(C(=O)CCCF)C2)cc(OC)n1 1687175370 AYUJHGPCTSVFQZ-GFCCVEGCSA-N 339.367 1.179 10 10 EDCE CN(C)C[C@H]1COC[C@H]1NCc1cc(Br)ccc1O 2141467206 XEFNJFAZQMVBKC-WCQYABFASA-N 329.238 1.821 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(NCc2cccc(F)c2O)C1 1918434975 HTQAWDCCIABRHC-UHFFFAOYSA-N 326.368 1.603 10 10 EDCE O=C(NC[C@@]1(Br)CC1(F)F)c1cc(O)c(O)c(O)c1 2137776368 HMZWBBWJDXZVFJ-JTQLQIEISA-N 338.104 1.706 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](O)CCN 1951473220 WQLDPCLDDMMFRE-NEPJUHHUSA-N 326.393 1.243 10 10 EDCE C[C@H](N)[C@](C)(O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952209565 VWJGYGARLGTDRX-IXBGWNDUSA-N 340.420 1.632 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)NCCCCN=[N+]=[N-])C1 1985094381 NZGSFUNHHBDMMD-UHFFFAOYSA-N 327.385 1.423 10 10 EDCE C[C@H](C(=O)N(C)CCN=[N+]=[N-])N1CC(NC(=O)OC(C)(C)C)C1 1987822135 RXUQCTBYEIVAMD-SNVBAGLBSA-N 326.401 1.353 10 10 EDCE C[C@H](CS(N)(=O)=O)NCc1cc(Br)cc(F)c1O 2035454007 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CSc1ncc(CNS(=O)(=O)c2csc(CO)c2)s1 2269123539 JSHDUUNSMPJTBC-UHFFFAOYSA-N 336.485 1.897 10 10 EDCE CSc1ncc(C=C2C(=O)NC(=O)N(C3CCCCC3)C2=O)cn1 2297346978 PMPHHXZPZXBCSK-UHFFFAOYSA-N 346.412 1.993 10 10 EDCE O=C1N=C(N2CCOCC2)SC1=Cc1ccc(N2CCOCC2)o1 2314646566 CVCVFKJFGITWJB-UHFFFAOYSA-N 349.412 1.419 10 10 EDCE CNCC(F)(F)C(=O)NCc1ccc(C)c(Br)c1O 2352643779 SEAKKUZTWJWFIJ-UHFFFAOYSA-N 337.164 1.934 10 10 EDCE CN1CCCc2cc(CNC(=O)N[C@@H]3CCCn4ncnc43)ccc21 177342940 IFQHDXUTPPMWRH-OAHLLOKOSA-N 340.431 1.995 10 10 EDCE COC[C@@H](O)CN1CCC(N[C@@H](C)c2ccc(F)c(F)c2O)CC1 187808884 PUKJPEQKGRAYAW-AAEUAGOBSA-N 344.402 1.793 10 10 EDCE CC(C)[C@H](C(=O)NCc1ccc(O)c(O)c1)N1C[C@H](C)O[C@H](C)C1 246550919 GVMPJJJGKCDWEO-IIYDPXPESA-N 336.432 1.848 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3C(=O)NC3CC3)CC2)cc1 242806400 FGWFXTNTPNHKCN-IAGOWNOFSA-N 343.427 1.259 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C[C@H](O)COC[C@H]1CCCO1 245647486 UIFOONYCICTPIF-JKSUJKDBSA-N 336.432 1.508 10 10 EDCE CC[C@@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)OC 276569799 AZPMOMMWJUDJFV-KRWDZBQOSA-N 348.443 1.711 10 10 EDCE Cc1ccc(CNC(=O)C2(N)CC(CO)C2)c(O)c1Br 2381131459 NROPENZWSDSSGZ-UHFFFAOYSA-N 343.221 1.179 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccccc1N(C)C(=O)c1ccco1 808516952 RYLZVEVXPMSXBV-UHFFFAOYSA-N 329.308 1.871 10 10 EDCE CC(=O)N1CCO[C@@H](C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C1 822832128 JZPVMLGQBWTZMA-KBXCAEBGSA-N 347.459 1.356 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CCC[C@H](C)O1 828438672 ZIGIILRDWIAEBJ-WMLDXEAASA-N 347.459 1.751 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@H]3COCC3(C)C)nc12 832170804 VGASBZNZGYTDEM-LBPRGKRZSA-N 334.376 1.126 10 10 EDCE COc1ccc(N2CCCN(C(=O)[C@]3(C)C[C@H](O)CN3C)CC2)cc1 900294900 NWTKYBPECQNWQT-LPHOPBHVSA-N 347.459 1.189 10 10 EDCE C[C@H]1CN(CCO)CCN1C(=O)NCc1ccc(N2CC=CC2)cc1 838486822 SWEVFIZOKNFKRE-INIZCTEOSA-N 344.459 1.271 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CO)CC(F)F)C2)cc1 854299330 OEYVOIXQHUCRJE-RYUDHWBXSA-N 343.374 1.589 10 10 EDCE Cc1noc([C@@H]2OCC[C@@H]2NCc2ccc(N3CCOCC3)cc2)n1 858326800 FICMNWWHTXMWAU-DLBZAZTESA-N 344.415 1.834 10 10 EDCE COc1ccc(N2CCCN(C(=O)c3cc(C=O)n(C)n3)CC2)cc1 930310437 YPGQNVLDMAKPKS-UHFFFAOYSA-N 342.399 1.594 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3(O)CCCC3)C2)cc1 854301685 SDRMKEQWSGWCMZ-CQSZACIVSA-N 333.432 1.878 10 10 EDCE O=C(NC[C@H]1CN(Cc2ccncc2)CCO1)c1cccc(O)c1O 863496482 DWANSZAEFYSIJL-AWEZNQCLSA-N 343.383 1.124 10 10 EDCE CCC(=O)N1CC[C@H](C(=O)NCc2ccc3cccnc3c2O)C1 862027220 NBUSMBRPZDDSAP-AWEZNQCLSA-N 327.384 1.815 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H](c3ccn(C)n3)C2=O)cc1F 761175203 ANOYXZDQGJNJOX-AWEZNQCLSA-N 331.351 1.418 10 10 EDCE COCCN1CCCN(Cc2c(O)ccc3ccncc23)CC1=O 787245651 JYPJDEQZLOGIMY-UHFFFAOYSA-N 329.400 1.621 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CC(=O)N(c2ccccc2F)C1 1153879645 SPIHVSPMSQDZGL-LBPRGKRZSA-N 344.342 1.906 10 10 EDCE CO[C@H](C)CN(C)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1316866806 CZNWYZPSZOJVCR-GFCCVEGCSA-N 335.408 1.936 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@]12CCOC2 1325807653 BELMPCUPSIDCPA-SFHVURJKSA-N 331.416 1.102 10 10 EDCE Nc1ccc(OCC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1 706182587 VRYNCPQGECBPBY-UHFFFAOYSA-N 337.423 1.992 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)CC(C)C)C2)cc1 1261700658 MCIFOBNPOVVKGA-GJZGRUSLSA-N 347.459 1.941 10 10 EDCE C[C@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1346767619 FKXVIWNZYCNSDN-BBRMVZONSA-N 345.443 1.226 10 10 EDCE C[C@H](NC[C@H]1CN=C(c2cnn(C)c2)O1)c1ccc(N(C)C)cc1 1354624805 AAHXNHOHUYPYQD-GUYCJALGSA-N 327.432 1.982 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2CC(=O)N(C)C2)cc1C 1507083451 SGVNOOPGUXKVNU-ZBFHGGJFSA-N 347.459 1.418 10 10 EDCE Cn1c(C(=O)NCc2cccc(Br)c2O)cnc1O 1297440242 KMXHCDSHMFNEEW-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE CC(=O)N/C(=C/c1ccccc1)C(=O)NCc1ccc(O)cc1O 1299570981 OGSWRMQQUVQZOX-CXUHLZMHSA-N 326.352 1.891 10 10 EDCE Cn1cnc(C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1=O 1298841768 PVZJMSUQTSNJGU-UHFFFAOYSA-N 328.155 1.723 10 10 EDCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ncn(C)n2)c1 1466110745 UORXVFUVUIKEDB-UHFFFAOYSA-N 337.383 1.965 10 10 EDCE COC(=O)[C@H](Cc1cncs1)NC(=O)/C=C/c1ccc(O)c(O)c1 1471710441 BIOYVWMDWXMSIR-PYEVWLCESA-N 348.380 1.468 10 10 EDCE O=C1NC[C@]2(CCN(Cc3cccc(Br)c3O)C2)N1 2121192990 KTDOKQKQQUJJHH-ZDUSSCGKSA-N 326.194 1.412 10 10 EDCE COC(=O)c1cc(C(=O)NCc2ccc(O)cc2O)cc([N+](=O)[O-])c1 1557084888 RRLVQGNAXLOWGC-UHFFFAOYSA-N 346.295 1.723 10 10 EDCE CCCC(=O)N(C)[C@@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1715319201 MZIQYSOLNNOKAU-ZDUSSCGKSA-N 346.435 1.408 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccc3nn[nH]c23)c1 1637131823 LYNPOYRVYCNBMX-UHFFFAOYSA-N 347.356 1.287 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)C(C)(C)C(N)=O)cc1C 1496082454 DGVDLTPGMGJPSU-CYBMUJFWSA-N 335.448 1.452 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1C[C@@H]1C(=O)OC 1568727779 ABKQWTPFOWOUPR-HOTGVXAUSA-N 348.443 1.751 10 10 EDCE CCOCC(=O)N[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1491845621 IIJYICTWLJFKBK-CYBMUJFWSA-N 347.375 1.216 10 10 EDCE CC[C@@H](F)C(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1584302594 XUQYBFBIZQBADD-JOYOIKCWSA-N 337.355 1.832 10 10 EDCE CN(Cc1nnc2n1CCC2)C(=O)c1ccc(N=NC(N)=O)cc1 1588044633 WWLWFYLHJSCNMV-UHFFFAOYSA-N 327.348 1.659 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1666972124 JOJUBXKDIZMFQZ-KMANFZQXSA-N 332.444 1.833 10 10 EDCE COc1cccc(CNC(=O)NCc2ccc3nonc3c2)c1O 1687799519 PPDKTTISZSAYIN-UHFFFAOYSA-N 328.328 1.936 10 10 EDCE COC(=O)[C@H]1C[C@@H]1C(=O)N(C)CCCNCc1ccc(OC)c(C)c1 1699498232 OREHVXZRXLYFPZ-HOTGVXAUSA-N 348.443 1.751 10 10 EDCE O=C(c1cc(O)c(O)c(O)c1)N1CCCN(C(=O)c2ccco2)CC1 169845211 HPYNPYFBYYZHFU-UHFFFAOYSA-N 346.339 1.385 10 10 EDCE O=C(CCN1C(=O)CSC1=S)Nc1ccc(O)c(C(=O)O)c1 1865768710 PLHPSQSWFCZYII-UHFFFAOYSA-N 340.382 1.279 10 10 EDCE CC(=O)C(=O)[C@]1(O)[C@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C1(C)C 1919201479 SKKXHGJCZUPSPS-NVGCLXPQSA-N 325.405 1.931 10 10 EDCE [N-]=[N+]=NCCCN1CCO[C@@]2(CCCN(C(=O)C(F)(F)F)C2)C1 2006171532 ORKBYHWLZFDYEA-LBPRGKRZSA-N 335.330 1.943 10 10 EDCE CON(CCNC(=O)OC(C)(C)C)C(=O)c1ccc(O)c(O)c1 1982310602 XVBSLIICGXUVHB-UHFFFAOYSA-N 326.349 1.626 10 10 EDCE CO[C@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)N(C)CCN=[N+]=[N-])C1 1985101448 SLMCWJFXDNBABQ-WJONMLJTSA-N 327.385 1.827 10 10 EDCE CCNCc1ccc(N2C[C@@H](CO)C[C@H]2CO)c(Br)c1 2146080181 URQOUAMIGAAPLE-STQMWFEESA-N 343.265 1.738 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC(N(C)C)C3)c(Br)cc21 382275842 JTBBLYCSNXWCQF-ZDUSSCGKSA-N 339.237 1.412 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@@H](O)[C@@H](CO)C2)c(Br)c1 396790445 AEXZNCVNIGAEGZ-IXPVHAAZSA-N 343.265 1.909 10 10 EDCE CCCC(=O)NC1CCN(C(=O)c2cnn3c(O)cc(C)nc23)CC1 2062475566 CAEOHEGYGYRGIF-UHFFFAOYSA-N 345.403 1.264 10 10 EDCE CCCNC(=O)C1CCN(C(=O)c2cnn3c(O)cc(C)nc23)CC1 2064535505 ONZDAGLFBQVMMM-UHFFFAOYSA-N 345.403 1.122 10 10 EDCE CC(=O)N1C[C@H]2C[C@H]1CN2c1ccc(CN)c(Br)c1F 2192279042 NXWSBCAFMHSOFT-WDEREUQCSA-N 342.212 1.856 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(O)C[C@H](C(=O)NCc2ccc(N)cc2)C1 2080907172 MHJOTTXAQYCDFB-KTXOBNNYSA-N 349.431 1.551 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccc(N)cc1)C1(O)CCC1 2080947674 RGUBLOARLSVVMJ-AWEZNQCLSA-N 349.431 1.693 10 10 EDCE O=C1C[C@H]2CCN(Cc3c(O)cccc3Br)C[C@H]2N1 2088806650 RWEGELXWMQQNDB-BXKDBHETSA-N 325.206 1.865 10 10 EDCE Nc1ccc(CS(=O)(=O)N2CCC(C3OCCO3)CC2)cc1 2089594608 QVTBHJINJVSDGF-UHFFFAOYSA-N 326.418 1.184 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)C[C@H](CO)C2)c(Br)c1 2236633662 RCHZCWDGGKWHCR-SRVKXCTJSA-N 343.265 1.896 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)NCCC(=O)NCc1ccccc1 2307996592 VOXSCWRUTWXMDW-UHFFFAOYSA-N 340.379 1.934 10 10 EDCE COc1ccc(O)c(CNC(=O)Cn2c(=O)[nH]c3ccccc32)c1 114544077 OVHQTEORSRSWSF-UHFFFAOYSA-N 327.340 1.360 10 10 EDCE CN1CCCN(C(=O)NCc2ccc3c(c2)CCCN3C)CC1=O 189960348 SKBCURIHZFEPPX-UHFFFAOYSA-N 330.432 1.443 10 10 EDCE COCCCN/C=C1\C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O 198841638 MJMNZBVGXLJRPA-FMIVXFBMSA-N 337.763 1.433 10 10 EDCE NCc1ccc(N2CC3(CCOCC3)[C@@H]2CO)c(Br)c1 2381067997 UGTAYAKMURZQDS-AWEZNQCLSA-N 341.249 1.886 10 10 EDCE CC(=O)C(=O)COC(=O)c1cncc(-c2ccc3c(c2)CCO3)c1 808529013 AVDAMJJLFIOFID-UHFFFAOYSA-N 325.320 1.998 10 10 EDCE C[C@@H](NC(=O)C(=O)N(C)C[C@H]1CCCO1)c1ccc(N(C)C)cc1 807672881 JVVOYHFZVHAOPC-CZUORRHYSA-N 333.432 1.567 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@H](CO)c2cccnc2)cc1 806324394 HCTPIKWQRBQGAD-MRXNPFEDSA-N 328.416 1.723 10 10 EDCE Cc1cc(C(=O)Nn2c(O)nnc2O)c(C)n1-c1ccc(F)cc1 820287988 GUZZNRALMQHRDQ-UHFFFAOYSA-N 331.307 1.620 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCO[C@@H](Cn2cccn2)C1 588406469 CYBDKBMFFGAZOD-PKXJPQMGSA-N 329.356 1.235 10 10 EDCE NC(=O)CCCn1nc(Cc2ccc(N)cc2)c2ccccc2c1=O 821186607 HJNVWYMCXCLCHB-UHFFFAOYSA-N 336.395 1.835 10 10 EDCE COC(=O)[C@](C)(CCF)NCc1ccc(N2CCN(C)CC2)cc1 827352940 ULVRNIDZVSVXCK-SFHVURJKSA-N 337.439 1.819 10 10 EDCE CN(C)c1ccc(CN(C(=O)Cc2c(O)ncnc2O)C2CC2)cc1 900123538 FBWDAPQJEYGDJU-UHFFFAOYSA-N 342.399 1.688 10 10 EDCE CC(C)C[C@H](C(N)=O)C(=O)NCc1cc(Br)ccc1O 839761721 KCMOMNFBWAQRHA-LLVKDONJSA-N 343.221 1.919 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CCO)C[C@@H]1C 838479598 RUOGXKLCCMHVFI-HNNXBMFYSA-N 334.464 1.269 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1coc(CO)c1 845392108 ISHKZBCBFOCFSB-UHFFFAOYSA-N 346.383 1.653 10 10 EDCE CCc1cccc(CN[C@H]2CCCN(Cc3nccn3C)C2=O)c1O 848902127 LCFWRGIJUOIGRR-INIZCTEOSA-N 342.443 1.969 10 10 EDCE CN(C)c1ccc(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1F 843426514 XWZCFWBXWJUVAF-MRXNPFEDSA-N 342.436 1.281 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](CO)CC3CC3)C2)cc1 854296596 KKQBVJRCMNPWSR-JKSUJKDBSA-N 347.459 1.982 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnc4[nH]cnc4c3)C2)cc1 855233454 HGCGPIVUKDPJEU-CYBMUJFWSA-N 337.383 1.975 10 10 EDCE O=S(=O)(C[C@H]1CCCOC1)NNc1nc2cccnc2s1 857224974 BWVFHCQRXJKKBY-VIFPVBQESA-N 328.419 1.364 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](O)C3CCC3)C2)cc1 854297243 LDSJALZFZXUMGI-WMLDXEAASA-N 333.432 1.734 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 862550639 GGHNNDVOTQYKFX-CQSZACIVSA-N 343.468 1.653 10 10 EDCE CC[C@@H]1NCC[C@H]1NC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 861647996 OVYRKBKEQXVEDL-JCGIZDLHSA-N 346.475 1.961 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3C[C@@H]3C(C)C)nc12 772509551 WSUXEUFIRKETTH-NEPJUHHUSA-N 347.371 1.947 10 10 EDCE C[C@](O)(C[C@@H](O)CNCc1ccc(N2CCC(O)CC2)cc1)C1CC1 872215914 LFPOZTRTJJWWEX-UXHICEINSA-N 348.487 1.649 10 10 EDCE O=C(NCc1cccc(Br)c1O)c1nsnc1O 1139975029 RPOLJCDEMLGMFW-UHFFFAOYSA-N 330.163 1.642 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H](O)Cc1ccc(F)cc1 1155514794 YRBLCPHILFJJKW-LWUPOJRFSA-N 331.343 1.970 10 10 EDCE CCOc1cc(OCC)c(C=C2C(=O)NC(=O)NC2=O)c(OCC)c1 1088697309 XDYZNCHIZZAUDB-UHFFFAOYSA-N 348.355 1.632 10 10 EDCE CNC(=O)[C@H](C)NCC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1320651789 FRFCAERXRKAUFO-QWRGUYRKSA-N 348.407 1.082 10 10 EDCE CO[C@@H]1C[C@H](C(=O)O)N(Cc2ccc(Br)cc2O)C1 1964722107 ZKHXAUNWGQPORU-GHMZBOCLSA-N 330.178 1.829 10 10 EDCE CCC1(CNC(=O)C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 1330916697 BRWUKTVSHFGIQV-CQSZACIVSA-N 345.443 1.697 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)Cc2cnn(C)c2)cc1C 1267120798 IHFTUNSUTZRIAE-HNNXBMFYSA-N 344.459 1.964 10 10 EDCE O=C(O)[C@@H](NCc1c(O)cccc1Br)[C@@H]1CCCO1 1351742992 USSCUYHBNBKGMF-RYUDHWBXSA-N 330.178 1.877 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC=C(Cl)Cl)c1 1452541228 ANOVRXKTMBXCDN-UHFFFAOYSA-N 339.200 1.813 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC[C@H](NC(=O)OC)C2)c([N+](=O)[O-])c1 1472874899 OCDCVGOMYLGTSU-FUEXJSSKSA-N 349.343 1.716 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H]2CCC(=O)NC2)cc1C 1482302261 DVTMRQCBAKGKDB-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE N[C@H]1CN(Cc2cc(Br)cc(F)c2O)CC[C@H]1CO 2122340560 CLUJVUQPTWASNT-UFBFGSQYSA-N 333.201 1.435 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@@H]2CC2(C)C)cc1C 1717913999 HKXMUOZHTVVENX-HOTGVXAUSA-N 334.460 1.959 10 10 EDCE N=C1NC(=O)[C@@H](CC(=O)NCc2c(O)ccc3ccccc23)S1 1558554343 PNAVSDZQXAZGAW-CYBMUJFWSA-N 329.381 1.718 10 10 EDCE NCc1ccc(N2CCC[C@H]2[C@H](O)CO)c(F)c1Br 2123233406 CYKDBDHZVQTQIO-GXSJLCMTSA-N 333.201 1.369 10 10 EDCE C[C@H](NC(=O)c1cn(C)c2c(cnn2C)c1=O)c1ccccc1O 1557967801 LPVALYDUUFUXOS-JTQLQIEISA-N 326.356 1.469 10 10 EDCE CC[C@H](CNC(=O)C(C)(C)C)NC(=O)c1cc(OC)nc(OC)c1 1499355650 VXSCEIVHIKKUCR-GFCCVEGCSA-N 337.420 1.770 10 10 EDCE Nc1nnc([C@@H]2CCCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)o1 1641506952 KLHSUUMOGRUSCX-VLWUPBBWSA-N 330.344 1.482 10 10 EDCE CCOC(=O)[C@H]1CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CCO1 1640506292 QHMCYDDKGIAVCY-CQSZACIVSA-N 340.332 1.380 10 10 EDCE CN1CCc2cc([C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)O)ccc21 1917191328 RIOXYDSDQOVKDL-UONOGXRCSA-N 336.388 1.690 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1C(=O)NCCCCN=[N+]=[N-] 1985096258 OTQIOPDFDYVSIA-GHMZBOCLSA-N 327.385 1.875 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2199533017 SVGVGHINUXPFQT-HMUFECAUSA-N 342.233 1.823 10 10 EDCE CO[C@H]1CCN(CCNCc2c(O)cccc2Br)C1 2267885957 HIPJZGQBJLYKTE-NSHDSACASA-N 329.238 1.965 10 10 EDCE CC(C)(C)OC(=O)NCCc1ccc(Nc2nnc(=N)[nH]n2)cc1 2213789142 FMELWAVMMQBQHC-UHFFFAOYSA-N 331.380 1.490 10 10 EDCE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)Cn1cc(Br)ccc1=O 2234175282 BAVFICTWZYNKRB-NXEZZACHSA-N 340.181 1.958 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@H]1COC2(COC2)C1 2270768042 IVFGHAXJIFBMLM-SNVBAGLBSA-N 332.169 1.941 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H](C3)[C@@H]4O)c(Br)cc21 2286234592 DAZLYAGUJLXESX-LKZXMLMSSA-N 338.205 1.218 10 10 EDCE O=C(O)[C@H]1CC[C@H](c2cccc(I)c2O)N1 309568336 UUBFAEOXZXWLCB-RKDXNWHRSA-N 333.125 1.875 10 10 EDCE C[C@@H]1CN(Cc2cc(Br)ccc2O)CCS1(=O)=O 127813638 KTSBVGMLMGOGQV-SECBINFHSA-N 334.235 1.774 10 10 EDCE COCCN([C@@H]1CCSC1)S(=O)(=O)Cc1ccc(N)cc1 40319195 MCTIAYBPUWWMOO-CQSZACIVSA-N 330.475 1.553 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@]1(C)CCC(=O)NC1 281401124 YQFGZKXHJAXWFV-IBGZPJMESA-N 345.443 1.398 10 10 EDCE COC(=O)[C@H]1C[C@H]1C(=O)NCc1ccc(C)c(Br)c1O 2380744677 LKUZTBOBLRMNEL-ZJUUUORDSA-N 342.189 1.888 10 10 EDCE CN(C)c1ccc(CNc2ccc(C(=O)NCC(N)=O)cc2)cc1F 802761004 IIESDSGAHYCUMC-UHFFFAOYSA-N 344.390 1.719 10 10 EDCE CN1CCc2cc([C@@H](NN)c3ncn(C)c3Br)ccc21 2163140033 FFZRLEPCQOLVGB-GFCCVEGCSA-N 336.237 1.728 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@@H](NC(C)=O)C2)c([N+](=O)[O-])c1 817126444 UYZMHSBKIJFIRW-RYWCDNDXSA-N 333.344 1.496 10 10 EDCE CCN(CC)c1ccc(CNC[C@@H](O)CN2CCOCC2)cc1F 819043856 WFCRZVCIQYHAPC-MRXNPFEDSA-N 339.455 1.455 10 10 EDCE CO[C@H]1C[C@@H](N(C)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 823524408 UALAKVUGJOAUCT-MAEOIBBWSA-N 347.459 1.967 10 10 EDCE COc1ccc(N2CCC(NC(=O)CCc3cn(C)nn3)CC2)cc1 825425866 NJRUVOPEYWJVHX-UHFFFAOYSA-N 343.431 1.542 10 10 EDCE C[C@H](NC(=O)COC1(C)CNC1)c1ccc(N2CCOCC2)cc1 844176283 NRFKTFYDOYBZQB-AWEZNQCLSA-N 333.432 1.079 10 10 EDCE Oc1cc2c(cc1CN1CCC(Cn3cnnc3)CC1)[C@H](O)CO2 844734987 AGDOOJJOOLQIPA-MRXNPFEDSA-N 330.388 1.322 10 10 EDCE CCOCc1cc(CN[C@@H](C(=O)O)c2cnn(C)c2)ccc1OC 841807309 QBXMOUCRBLKZBF-MRXNPFEDSA-N 333.388 1.881 10 10 EDCE C[C@H](NCCc1nnnn1C)c1cc(Br)cc(F)c1O 756678692 XHVKMDSDJPFODJ-ZETCQYMHSA-N 344.188 1.711 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3[C@H]4CC[C@H]3[C@@H](CO)C4)C2)cc1 854297065 JKJMWABJBROPLG-OAOQPFQOSA-N 345.443 1.829 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C[C@@H](O)CC1(O)CCC1 859060255 PPPKMFQBXFJILL-SFHVURJKSA-N 334.460 1.621 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](CO)CC(C)C)C2)cc1 852450435 MHJXVGNBHKIYQJ-HUUCEWRRSA-N 335.448 1.980 10 10 EDCE CCOc1cccc(CN2CCC[C@@H](CS(=O)(=O)NC)C2)c1O 862552027 RKGZTCCQQWIXGK-CYBMUJFWSA-N 342.461 1.552 10 10 EDCE CCN(CC)C(=O)C1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768441165 WVIFUSHFARMVCL-KRWDZBQOSA-N 348.443 1.898 10 10 EDCE Cc1cc(CCNC(=O)N2CCNC(=O)C2)c(C)n1-c1ccccc1 789918293 WCFYBKXKVCTWIA-UHFFFAOYSA-N 340.427 1.778 10 10 EDCE CCCCC(=O)N1CSC[C@@H]1C(=O)NCc1cccc(O)c1O 1123977923 MQINVJSUFHIDRA-GFCCVEGCSA-N 338.429 1.806 10 10 EDCE CC(=O)NCc1ccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)s1 783246776 NZYBIZOOZSMBGL-UHFFFAOYSA-N 349.364 1.835 10 10 EDCE O=C1CN(C(=O)c2cc3cc(O)c(O)cc3s2)CN1CC1CC1 897606668 RZQZXSSYWROFCF-UHFFFAOYSA-N 332.381 1.964 10 10 EDCE COCCOC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 885009814 DLAYAHJJBVNLBH-UHFFFAOYSA-N 337.420 1.190 10 10 EDCE C[C@H]1OCC[C@@H]1N(CCO)CC(=O)N(C)Cc1ccc(N(C)C)cc1 796580821 SWYOJBYOOPAPMG-QAPCUYQASA-N 349.475 1.183 10 10 EDCE COc1cc(N2CCN(CC3=NOCC3)CC2)cc(OC)c1OC 1307664059 AVEGHHUAEYNSMX-UHFFFAOYSA-N 335.404 1.611 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](CNC(=O)Cc3cnc[nH]3)C2)cc1C 1316637365 YOOJWQMMXQAGRI-WKILWMFISA-N 342.443 1.954 10 10 EDCE O=C(Cc1ccc(-n2cnnn2)cc1)NCc1c(O)cccc1F 1178409357 DRGPRZUYJGOMNS-UHFFFAOYSA-N 327.319 1.366 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC3CC(C)(C)C3)C2)cc1 1328321088 IVAIUPRFERHKPD-CYBMUJFWSA-N 345.443 1.695 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@H](C)n2cncn2)cc1C 1268788949 VCRQLDQCGYTMBG-HNNXBMFYSA-N 345.447 1.794 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)[C@@H]2CC(=O)N(C)C2)cc1C 1268372108 VNGZNTCSKPFFHK-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE CC[C@@H](CNC(=O)Cc1ncc[nH]1)NCc1ccc(OC)c(C)c1 1267823403 HZWAXQCJAMDLKD-HNNXBMFYSA-N 330.432 1.954 10 10 EDCE COC[C@@H](C)N[C@@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1266192052 PUJVYYPGXCKODV-NWDGAFQWSA-N 335.408 1.982 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)Cc2ccn(C)n2)cc1C 1282128121 HFJUUQWJAKCZEI-HUUCEWRRSA-N 344.459 1.963 10 10 EDCE COC[C@@H](OC)C(=O)Nc1c(-c2ccccn2)nc2ccccn12 1515043806 PWBOQOHKEOLUBC-CYBMUJFWSA-N 326.356 1.996 10 10 EDCE O=C1NCCC[C@@H]1C(=O)Nc1c(-c2ccccn2)nc2ccccn12 1298830765 ZKSDDRRWYCCWCQ-LBPRGKRZSA-N 335.367 1.861 10 10 EDCE CN1CCN(CCCCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1464071351 DJMUPJPWMGEVFN-UHFFFAOYSA-N 346.435 1.606 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)c2ccc(O)cn2)N(C)C)cc1 1472280736 LQCAIRSGKHRLOG-KRWDZBQOSA-N 328.416 1.886 10 10 EDCE COc1cc2c(cc1O)[C@H](c1ccc(O)c(O)c1)[C@H](CO)[C@@H](CO)C2 14435201 GQLVRVYXAHDDLB-TVZGQMOCSA-N 346.379 1.717 10 10 EDCE biogenic COc1cccc(CNC(=O)c2cc3c(nc2O)CCOC3)c1O 1622779822 WYFJUZCIFHSFJT-UHFFFAOYSA-N 330.340 1.504 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2[nH]nnc2C)cc1C 1715351830 LMUCQONQSOUNGW-GFCCVEGCSA-N 331.420 1.680 10 10 EDCE O=C(NCCCN1C(=O)CCC1=O)c1cc2cc(O)c(O)cc2s1 1632597760 IUQYRYCIEBQTFA-UHFFFAOYSA-N 348.380 1.581 10 10 EDCE COCC(=O)NCCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1737087267 AKFXMHGUIBRRNB-UHFFFAOYSA-N 335.364 1.074 10 10 EDCE C[C@H](C(=O)NCc1cc(Cl)ccc1O)n1cnc2c(N)ncnc21 1644590504 CPHGGGWQTCWNIL-MRVPVSSYSA-N 346.778 1.645 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H]3COC(=O)N[C@@H]3C2)cc1 1640797959 KZONYYCCLJRVFS-CMPLNLGQSA-N 331.332 1.420 10 10 EDCE Cn1ncc(Br)c1S(=O)(=O)N1CC[C@H](CN=[N+]=[N-])C1 1912156600 NFBWXUNEMFXGBJ-SSDOTTSWSA-N 349.214 1.504 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)Nc1ccc2c(c1)C[C@H](O)[C@H](O)C2 201383845 FHFVXMMQJSARHG-ZBJVWZGCSA-N 329.396 1.961 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3[C@H](C(N)=O)[C@@H]3C2)cc1Br 2136584469 CGEKIXYICGTKPM-DRYIUFOISA-N 325.206 1.670 10 10 EDCE NCc1cc(F)c(N2C[C@@H](CO)[C@@H](CCO)C2)cc1Br 2149899516 AJXYECBNTSHLGJ-ONGXEEELSA-N 347.228 1.474 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCC(N=[N+]=[N-])CC1 1985094027 JBFLOXQTTHIDPH-LLVKDONJSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOCC[C@@H]1C(=O)NCCN=[N+]=[N-] 1985103521 WNZDLWOTUWZIQI-QWRGUYRKSA-N 327.385 1.733 10 10 EDCE COC(=O)c1cnn(Cc2ccc(Br)cc2O)c1N 2070447037 HBZHDWWNTAKMOC-UHFFFAOYSA-N 326.150 1.768 10 10 EDCE C[C@H](N)c1ccc(N2CCN([C@@H](C)CO)CC2)c(Br)c1 2169361868 AFQZVQQBTKKJEB-RYUDHWBXSA-N 342.281 1.972 10 10 EDCE CNCc1ccc(N2CCO[C@@H](CN(C)C)C2)c(Br)c1 2170358187 DUBSSXSJFULYJB-ZDUSSCGKSA-N 342.281 1.935 10 10 EDCE O=S1(=O)C[C@H]2[C@@H](C1)[C@@H]2NCc1ccc(Br)cc1O 2054272647 JHVFUAUUQXQOEX-IAZYJMLFSA-N 332.219 1.287 10 10 EDCE CC(C)(C)OC(=O)NC[C@@]12CCC[C@@]1(COc1nnc(=N)[nH]n1)C2 2213781303 QEBNGAJDCKNCQP-GJZGRUSLSA-N 336.396 1.143 10 10 EDCE CC(C)(C)OC(=O)NCc1cn(CCNCc2ccccc2O)nn1 2259006069 HYUWGPNNKSPYDG-UHFFFAOYSA-N 347.419 1.798 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NC[C@]1(O)CCSC1 2297772923 ZHHHASUQRNCQAY-GOSISDBHSA-N 348.468 1.521 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N(C)c2ccc(OC)cn2)c1 492644304 SKZNTYVQTGYXKI-QPJJXVBHSA-N 326.356 1.521 10 10 EDCE Cc1cnn(C[C@H]2CN(C(=O)C=Cc3ccc(O)c(O)c3)CCO2)c1 2308001187 HUTOPXIZKOOZJA-OAHLLOKOSA-N 343.383 1.544 10 10 EDCE O=C(N[C@@H](CCO)COCc1ccccc1)c1cc(O)c(O)c(O)c1 2320377047 RQLYPAZFNBSIIC-AWEZNQCLSA-N 347.367 1.501 10 10 EDCE NCc1cc(F)c(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)cc1Br 2355333840 HDXPFVQBJUVOMP-DUDQEUOJSA-N 345.212 1.367 10 10 EDCE COc1ccc(N2CCCN(C(=O)COC[C@@H]3CCOC3)CC2)cc1 172059084 YYPPILMELOCCMM-MRXNPFEDSA-N 348.443 1.787 10 10 EDCE Cc1cccc(CN2CCN(c3ccc4nnc(C)n4n3)CC2)c1O 180081683 GPXGQXLEAJTKSR-UHFFFAOYSA-N 338.415 1.769 10 10 EDCE COCCCNC(=O)C1CCN(Cc2ccc(OC)cc2O)CC1 92362130 AHXBLKSNZBDZDJ-UHFFFAOYSA-N 336.432 1.766 10 10 EDCE CC(=O)NC1CN(c2ccc(/C=C\C(=O)O)cc2Br)C1 388314217 FXFKZGVNIVWZDA-HYXAFXHYSA-N 339.189 1.872 10 10 EDCE CCOc1ccc(CN[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)c(O)c1 800309412 ITLUZCLKMMCZOK-IUODEOHRSA-N 342.461 1.598 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C[C@@H](O)CCN2)c(O)c1Br 2380751082 HLSBBEHNHHZAHB-QWRGUYRKSA-N 343.221 1.192 10 10 EDCE CN1CCN(c2ccc(CN3CCO[C@H](C(F)F)C3)cc2)CC1 802653776 SLYOBCWGFFJDBD-INIZCTEOSA-N 325.403 1.904 10 10 EDCE COc1cc(N2CCN(C[C@@H](O)C3CC3)CC2)cc(OC)c1OC 838932012 LFSJHZRGUQGROL-OAHLLOKOSA-N 336.432 1.605 10 10 EDCE CC[C@@H](NC[C@@]1(CO)COCCN1C)c1cccc(Cl)c1O 903277416 GZZVNVYCYCZHAC-GDBMZVCRSA-N 328.840 1.779 10 10 EDCE Cc1cc(CC(=O)N[C@H]2CN(C)NC2=O)c(C)n1-c1ccccc1 831686180 NEXVLIBWWBBMOO-INIZCTEOSA-N 326.400 1.098 10 10 EDCE Cc1cc(C(=O)NC[C@@H]2CCO[C@@H]2C(=O)O)c(C)n1-c1ccccn1 910348617 SYAWLKQZSCFYOV-BBRMVZONSA-N 343.383 1.709 10 10 EDCE COC[C@@H](CCNC(=O)NCc1ccc(N2CC=CC2)cc1)OC 852138257 LLMSJZJPPQUDMD-QGZVFWFLSA-N 333.432 1.914 10 10 EDCE CC1=C(C(=O)NCc2c(O)cccc2F)[C@H](C)n2ncnc2N1C 928707194 BYRKPRSJSOSSBK-JTQLQIEISA-N 331.351 1.724 10 10 EDCE CC(C)OC[C@H](N)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 852860149 LFDGUVRPVXPQRO-SFHVURJKSA-N 349.475 1.264 10 10 EDCE Cc1cc(CC(=O)NS(=O)(=O)N(C)C)c(C)n1-c1ccccc1 1118578362 DNAHNWRGHVSJPH-UHFFFAOYSA-N 335.429 1.559 10 10 EDCE O=S1(=O)CC(CCNCc2ccc(N3CCOCC3)c(F)c2)C1 786825626 XIOLLZYKOQDWFN-UHFFFAOYSA-N 342.436 1.187 10 10 EDCE COC(=O)c1c(CN2C[C@H]3C[C@@]3(CO)C2)c2cc(F)ccc2n1C 894535884 XPQKYYSKIKEORK-ZMZPIMSZSA-N 332.375 1.918 10 10 EDCE CN1CCN(c2ccc(CN[C@@H](CO)C[C@H](O)C(C)(C)C)cc2)CC1 790618507 IJHMNAGMTHALSF-MJGOQNOKSA-N 349.519 1.686 10 10 EDCE Cc1ccc(C(=O)NCc2ccc(O)cc2O)cc1S(C)(=O)=O 1162278917 NMRKHPRRPUAWHH-UHFFFAOYSA-N 335.381 1.740 10 10 EDCE Cc1c(C(=O)N[C@H](C)c2ccccc2O)cnn1-c1ccc(O)nn1 1302530704 XFUHZLJZJNEKNQ-SNVBAGLBSA-N 339.355 1.873 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)Cc2ncc[nH]2)cc1C 1320588399 VTARSPUMJZLXHW-CQSZACIVSA-N 330.432 1.954 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)CC[C@H](C)N)cc2)CC1 1332156161 HRIRUSYORPUKCN-AWEZNQCLSA-N 332.448 1.099 10 10 EDCE CN(C[C@H]1CCCS1(=O)=O)c1ccc(CN)cc1Br 694094242 LMILYIYRUNRFPI-LLVKDONJSA-N 347.278 1.921 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N[C@@H]2CC[C@H]3[C@@H](C2)C3(F)F)cc1 1333544590 WVFSJMRFHHQBBV-HZSPNIEDSA-N 337.370 1.478 10 10 EDCE C[C@H](O)CNCC[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1272651250 CEJYZFOGYFMFKZ-STQMWFEESA-N 347.419 1.672 10 10 EDCE CCCC(=O)N[C@@H](C)C[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1512188521 CZIRZSHREUTKPF-RYUDHWBXSA-N 337.420 1.912 10 10 EDCE Cc1cc(C(=O)NCc2c(O)cccc2F)c2c(O)nn(C)c2n1 1456083155 DESSYTRZCZUMPW-UHFFFAOYSA-N 330.319 1.757 10 10 EDCE C[C@H](O)CCCN1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1479972070 MFIYRGNFKMSUBU-WFASDCNBSA-N 347.419 1.814 10 10 EDCE O=C(CN1Cc2ccccc2OC1=O)NCCc1ccc(O)c(O)c1 1622753052 DMDSSWJOTOFDFP-UHFFFAOYSA-N 342.351 1.771 10 10 EDCE NS(=O)(=O)c1ccc(C(=O)NCc2cc(Cl)ccc2O)cc1 1557385441 CXQVZINVJXHKFC-UHFFFAOYSA-N 340.788 1.623 10 10 EDCE COC(=O)C(C)(C)n1cc(NC(=O)Cc2ccc(O)c(O)c2)cn1 1630542848 ZZAFEWDHBRHOFJ-UHFFFAOYSA-N 333.344 1.384 10 10 EDCE COc1cccc(CNC(=O)c2nn(-c3cccnc3)nc2C)c1O 1566374656 PFJGJGRHWUBSFZ-UHFFFAOYSA-N 339.355 1.615 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@]2(C)CCNC2=O)cc1C 1732359704 FMYYLFXLGQXNBO-BFUOFWGJSA-N 347.459 1.372 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cccn1CCN1CCOCC1 1651225809 ZDZMZIJZSKOJPD-UHFFFAOYSA-N 345.399 1.162 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cc3n(n2)CCC[C@H]3O)cc1F 1598028857 OWGRMVAYSMSWQT-MRXNPFEDSA-N 332.379 1.845 10 10 EDCE COC(=O)c1cnc(CNC(=O)NCc2cc(C)ccc2O)s1 1687620575 PTQXQLLICVOBKY-UHFFFAOYSA-N 335.385 1.943 10 10 EDCE COC(=O)NC[C@@H]1CCN1c1ccc(CN)c(Br)c1 2130738691 VGGHVRWPYHAHOG-NSHDSACASA-N 328.210 1.843 10 10 EDCE COc1cccc(O)c1CNCc1c(Br)nnn1C 1967834109 IBXURWQCSDEUSN-UHFFFAOYSA-N 327.182 1.582 10 10 EDCE CN(C)[C@H]1COC[C@@H]1CNCc1cc(Br)ccc1O 1924687187 MPPVHZICYVFINS-AAEUAGOBSA-N 329.238 1.821 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H](O)CCN 1951473222 WQLDPCLDDMMFRE-RYUDHWBXSA-N 326.393 1.243 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@@H](c4ncc[nH]4)C3)c2n1 2063258718 VVSJMEVOWQZFNW-LLVKDONJSA-N 326.360 1.486 10 10 EDCE COC(=O)c1cn(Cc2cc(Br)ccc2O)nc1O 2070619422 XQVNURDQAOXFSF-UHFFFAOYSA-N 327.134 1.892 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H](C3)O4)c(Br)cc21 2198588624 XIGDHCLUWDYXSS-BFHDXFOESA-N 338.205 1.639 10 10 EDCE CN(c1cc2c(cc1N)OCC(=O)N2)C1CN(C(=O)OC(C)(C)C)C1 2044637656 KHMPPAXDGXXBED-UHFFFAOYSA-N 348.403 1.655 10 10 EDCE CS(=O)(=O)[C@H]1CCN(c2ccc(CN)cc2Br)C1 2059360844 YWSFRTBLMFLBOD-JTQLQIEISA-N 333.251 1.531 10 10 EDCE C[C@H](N=c1nc(CNC(=O)OC(C)(C)C)[nH][nH]1)c1c(O)cccc1O 2063196322 QQHSRZLAFZRQBR-VIFPVBQESA-N 349.391 1.836 10 10 EDCE O=C1C[C@@H]2CCN(c3ccc(CO)c(Br)c3)C[C@H]2N1 2088803497 JAKGKTKORZYMCW-TVQRCGJNSA-N 325.206 1.656 10 10 EDCE O=C(O)[C@@H]1[C@@H]2OCCN(Cc3cc(Br)ccc3O)[C@H]21 2092840763 HYFTZFJWTNFUKA-SRVKXCTJSA-N 328.162 1.439 10 10 EDCE OCc1ccc(N2CCC([C@@H](O)CO)CC2)c(Br)c1 2096159188 XPGOYGOGDIIACI-AWEZNQCLSA-N 330.222 1.511 10 10 EDCE COc1cc(N(C)Cc2c(Br)nnn2C)ccc1CO 2204551045 QJPTTXGULRQXPU-UHFFFAOYSA-N 341.209 1.715 10 10 EDCE CN(C1CSCCSC1)S(=O)(=O)Cc1ccc(N)cc1 2237079138 RUMIZRKNTBALRA-UHFFFAOYSA-N 332.516 1.879 10 10 EDCE COc1ccc(Br)c(CN[C@H](C(N)=O)C(C)C)c1O 2227748210 LJYFAGMRWUFVBS-NSHDSACASA-N 331.210 1.763 10 10 EDCE CSc1ncc(CNC(=O)c2sc(N(C)C)nc2N)s1 2284700817 WQWHWPJILLWAGD-UHFFFAOYSA-N 329.476 1.900 10 10 EDCE CCOc1ccc(N2C(=O)NC(=O)C(=CN[C@H](C)CC)C2=O)cc1 2297315548 QJCKRIIEHFPPAD-LLVKDONJSA-N 331.372 1.940 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2298023708 GRHXEXVOVAIDNT-VWYCJHECSA-N 341.412 1.998 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2354367587 ARVXRDCFODMUEU-OCVOHJKQSA-N 341.249 1.925 10 10 EDCE COC(=O)CC1=NN(c2ccc(OC)cc2)C(=O)/C1=C(\C)NC1CC1 101842220 AAMCNXOAJLWMSC-GZTJUZNOSA-N 343.383 1.987 10 10 EDCE O=C1NN(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(O)c([N+](=O)[O-])c1 83327064 RACSTANOGTYUIR-KPKJPENVSA-N 343.270 1.901 10 10 EDCE CN1CCC[C@@H]2CN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC[C@@H]21 133487488 ZDMKJCLVFSTZCQ-YPMHNXCESA-N 346.387 1.846 10 10 EDCE Cc1cc(C(=O)N[C@H](C)CO)c(C)n1-c1ccc2c(c1)OCCO2 97204316 JZGIJYCSXCCHPP-LLVKDONJSA-N 330.384 1.976 10 10 EDCE Cc1nn(C)c(C)c1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 276257372 ZQWCTOZXIZUILA-SECBINFHSA-N 346.387 1.134 10 10 EDCE Cc1ccc(Cn2cc(CC3CNC3)nn2)c(O)c1Br 2380812685 YCKMVCHAWHDLEW-UHFFFAOYSA-N 337.221 1.865 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccc(C(N)=O)cn3)CC2)cc1 299471127 ATMUNMNUEOYQNM-UHFFFAOYSA-N 340.383 1.152 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@@H](C(=O)C3CC3)C2)cc1 801542996 NXOCQODXPKYOSK-QGZVFWFLSA-N 345.443 1.049 10 10 EDCE CC(=O)C(=O)COC(=O)c1cnn(CCO[C@H]2CCCCO2)c1C 808531399 OWUBUEQBAYICIG-HNNXBMFYSA-N 338.360 1.050 10 10 EDCE COc1cccc(O)c1CN[C@@H]1CCC[C@H]1CNS(C)(=O)=O 800309926 QAQDKOGBFQIKRZ-WCQYABFASA-N 328.434 1.208 10 10 EDCE CCOC(=O)C(=O)[C@@H](N)c1cc(Br)cc(Cl)c1O 725274862 RUAAXCLCPFUANA-QMMMGPOBSA-N 336.569 1.940 10 10 EDCE Nc1ccc(OCCON2C(=O)COc3cc(C=O)ccc32)cc1 821299178 IIVCBDQKVHBVEM-UHFFFAOYSA-N 328.324 1.817 10 10 EDCE O=C1CC[C@@H](N2CCN(Cc3cccc(Cl)c3O)CC2)CCN1 825148134 QLDCSLARSSKXOA-CQSZACIVSA-N 337.851 1.832 10 10 EDCE CC[C@H](CNS(C)(=O)=O)NC/C=C\c1ccc(N(C)C)cc1 835053561 DHYSEDGFEGUPRQ-IDTUSYRASA-N 325.478 1.683 10 10 EDCE O=C(NC[C@H]1CN2CCCN1CC2)c1cc2cc(O)c(O)cc2s1 908029472 RKMXECTXZBEYSU-LBPRGKRZSA-N 347.440 1.432 10 10 EDCE C[C@H](C(=O)NCCc1ccc(O)c(O)c1)N1Cc2ccccc2C1=O 907057588 QCZFJGDFCGPDLA-GFCCVEGCSA-N 340.379 1.801 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](N)C(F)(F)F)CC2)cc1F 831147213 WJHQRQUKZYZYCZ-LBPRGKRZSA-N 335.301 1.373 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)NCCc1nnc2n1CCC2 914542843 KEILXNBJJDJGPB-UHFFFAOYSA-N 342.447 1.674 10 10 EDCE CCO[C@@H]1CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C[C@H]1CN 846159279 FQMVGQBNKFLLPC-FRFSOERESA-N 334.464 1.819 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H]4COC[C@@H]4C3)nc12 852669495 STIIXLBRZREIIC-NEPJUHHUSA-N 346.387 1.080 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@H]2COC[C@H]2C1 852004547 HWCNLDYPKFPXLF-DLBZAZTESA-N 345.443 1.701 10 10 EDCE C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)c1ccnn1C 868130793 RZAVPVFBDSJMSE-CQSZACIVSA-N 343.431 1.817 10 10 EDCE O=C(CCc1cnn[nH]1)NCc1cc(Br)ccc1O 868306935 IECGBVIMJQNAKY-UHFFFAOYSA-N 325.166 1.522 10 10 EDCE O=C(N[C@@H](CO)C[C@H]1CCCO1)c1cc2cc(O)c(O)cc2s1 899277556 NQLBHSIWQBFVHJ-GHMZBOCLSA-N 337.397 1.972 10 10 EDCE Cc1ccc(O)c(CNC(=O)NCc2cc(=O)n3ccccc3n2)c1 1230550681 PVSKSZXZZAPAAX-UHFFFAOYSA-N 338.367 1.708 10 10 EDCE CCNCc1ccc(N2CCC(CO)(CO)C2)c(Br)c1 694683403 WJBVVYYZUYEAAD-UHFFFAOYSA-N 343.265 1.740 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H]2CC[C@@H](C1)S2 1348222261 PSMQQYBTBLTFCQ-KGLIPLIRSA-N 334.441 1.847 10 10 EDCE CNC(=O)CCCC(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)C1 1265427463 KOKBXHZFGOISHS-INIZCTEOSA-N 347.459 1.610 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@H](O)CNCC2CCCC2)cc1 1268335628 WJXXRUMNMYKDBB-OAHLLOKOSA-N 347.419 1.720 10 10 EDCE C[C@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1261089480 OJJKEPIVOOZVND-YOEHRIQHSA-N 343.427 1.220 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)Cn2cccn2)cc1C 1272649821 ZWDYVWYHAGWHEO-HNNXBMFYSA-N 330.432 1.885 10 10 EDCE COCC(=O)N[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@H]1C 1281140039 JYJDOFPFCSQLRQ-GXFFZTMASA-N 347.375 1.215 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(-c2cccnc2)nn1 1447562676 MEBYJJWKROTMAR-LLVKDONJSA-N 339.355 1.435 10 10 EDCE Cc1c(NC(=O)Cc2ccc(O)c(O)c2)cccc1-n1cnnc1O 1450744864 SDQVZTJWTAHERV-UHFFFAOYSA-N 340.339 1.874 10 10 EDCE C[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1nc(C(F)(F)F)n[nH]1 1456401263 RYWHFGPJRZIHQC-LURJTMIESA-N 330.266 1.655 10 10 EDCE O=C(Cc1nc(C2CC2)n[nH]1)NCc1ccc(N2CCOCC2)cc1 1543816535 DASSHDUICCPZNB-UHFFFAOYSA-N 341.415 1.378 10 10 EDCE C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1544115754 UIQSJFGSFHNTJK-UWVGGRQHSA-N 338.389 1.497 10 10 EDCE Cc1cc(C)n2nc(C(=O)NCc3ccc4cccnc4c3O)nc2n1 1627069104 IOHAPTQYMOXHFE-UHFFFAOYSA-N 348.366 1.925 10 10 EDCE Cc1ccc(O)c(CNC(=O)Cc2ccccc2NS(C)(=O)=O)c1 1557554041 WAHHLYFZGMPSNL-UHFFFAOYSA-N 348.424 1.931 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC(=O)N[C@@H]3CCCC[C@@H]32)cc1 1622868995 LVIBZBOZDVIRIJ-OLZOCXBDSA-N 329.360 1.732 10 10 EDCE CC[C@H](CN1CCOCC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1558423747 YCMCXFMBZMQMBU-CYBMUJFWSA-N 333.392 1.690 10 10 EDCE CC(=O)Nc1ccc(CNC(=O)NCc2c(O)cccc2F)cn1 1634813150 FRWSTFLGPIFBQN-UHFFFAOYSA-N 332.335 1.884 10 10 EDCE O=C(CCN1CC[C@@H](F)C1)NCc1ccc(N2CCC(O)CC2)cc1 1646434323 CPVFGUKJCVNDPQ-MRXNPFEDSA-N 349.450 1.698 10 10 EDCE CCOCCN[C@@H](C)[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1570655954 VBYLGMVFJPFINL-RYUDHWBXSA-N 335.408 1.982 10 10 EDCE CCS(=O)(CC)=NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1645095768 NWQULNYGEWYREQ-UHFFFAOYSA-N 334.419 1.412 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CO[C@@H]2CCOC2)cc1C 1669288895 MVLNRVKJWFZUHR-GDBMZVCRSA-N 336.432 1.403 10 10 EDCE COCCNC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1670561120 BROWEEOFCJECIR-CQSZACIVSA-N 333.392 1.593 10 10 EDCE COc1ccc(N2CCN(C(=O)c3c([N+](=O)[O-])cnn3C)CC2)cc1 160118933 AXVPHTSLKXXDNP-UHFFFAOYSA-N 345.359 1.299 10 10 EDCE NCc1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2134818006 WAZJBIYQYVWNLI-VGSLSFOHSA-N 327.222 1.228 10 10 EDCE O=C(N[C@H](CCc1cc(O)nc(O)c1)C(=O)O)OCc1ccccc1 1951868958 CEARGPTWTQBHRP-CYBMUJFWSA-N 346.339 1.805 10 10 EDCE NCc1cc(F)c(N2C[C@H](CO)[C@@H](CCO)C2)cc1Br 2149899513 AJXYECBNTSHLGJ-GXSJLCMTSA-N 347.228 1.474 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985101871 YYHJZPKNEARRBG-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE C[C@H](N)c1ccc(N2CCOC[C@@H]2[C@@H](O)CO)c(Br)c1 2146333619 HLXQZBBCVVQLHF-FZZIBODNSA-N 345.237 1.027 10 10 EDCE NCc1cc(F)c(N2CC[C@H]3C(=O)NC[C@@H]3C2)cc1Br 2157183394 IHVSGGVFRXDCOV-NXEZZACHSA-N 342.212 1.619 10 10 EDCE CNCc1ccc(N2CC[C@H](N3CC(O)C3)C2)c(Br)c1 2158750382 DYPXVIOOLVMJDJ-LBPRGKRZSA-N 340.265 1.424 10 10 EDCE CN[C@@H](C)c1ccc(N(C)[C@H]2CC(=O)NC2=O)cc1Br 2171205702 RBJFRFZANQUNIB-UFBFGSQYSA-N 340.221 1.581 10 10 EDCE CN(C)C[C@]1(O)CCN(c2ccc(CO)cc2Br)C1 713703827 BECJLKHYMNXNIV-CQSZACIVSA-N 329.238 1.444 10 10 EDCE C[C@H](N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2)C(C)(C)O 394998305 IJIZYLQHZXNIHG-MADCSZMMSA-N 342.237 1.997 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2190452454 DWQRSCAAJRNHQH-MOLYSANOSA-N 342.233 1.965 10 10 EDCE C[C@@H](O)CN(C[C@@H](C)O)c1ccc(CN)c(Br)c1F 2103484837 OYYSUSBAQGJOHP-RKDXNWHRSA-N 335.217 1.615 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H](N(C)C)C2)c(Br)c1 2089925703 FGOQVWKSNGFUFI-IIMNLJJBSA-N 329.238 1.614 10 10 EDCE OCc1ccc(N2CC[C@H](C(CO)CO)C2)c(Br)c1 2114243997 FAXOCEDESIARGO-NSHDSACASA-N 330.222 1.369 10 10 EDCE COc1ccc(Br)c(CN2C[C@H]3C(C(=O)O)[C@@H]3C2)c1O 2236047068 XSWCLDOIRYGRTC-HTQZYQBOSA-N 342.189 1.926 10 10 EDCE C[C@H]1CN(CCNCc2cc(Br)cc(F)c2O)C(=O)N1 2239293788 JUXGUINHUFDQBR-QMMMGPOBSA-N 346.200 1.797 10 10 EDCE O=C(O)[C@H]1CC[C@@H](O)CN1Cc1ccc(Br)cc1O 2264528101 FTBAAZFAYFXLES-GHMZBOCLSA-N 330.178 1.565 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2329329707 XNRMVXRKWXLDSE-SLZGKSLHSA-N 328.206 1.433 10 10 EDCE CO[C@H]1CN(c2cc(Br)c(CN)cc2F)[C@@H]2COC[C@@H]21 2354358079 HGGKNXOFUMJRGF-FZZIBODNSA-N 345.212 1.897 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2355336017 KCBSCCLWQDNUQP-ZAJSEHCFSA-N 341.249 1.789 10 10 EDCE O=C(CNC(=O)c1ccccn1)NCc1ccc(N2CCCC2)cc1 172511465 DURPHEFSMGPUHD-UHFFFAOYSA-N 338.411 1.728 10 10 EDCE O=C1NCCCN1C1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1 178473703 JGZQOFAXJZRECI-UHFFFAOYSA-N 334.376 1.680 10 10 EDCE COc1ccc2ccc(O)c(CN3C[C@@H](C)O[C@@H](C(N)=O)C3)c2c1 120220330 IXBSASHKJAKCBH-PIGZYNQJSA-N 330.384 1.629 10 10 EDCE COC(=O)[C@@H](C)CC(=O)N1CCCN(c2ccc(OC)cc2)CC1 178257260 AAERVLNRHGTVBP-AWEZNQCLSA-N 334.416 1.933 10 10 EDCE COc1cc(N2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)ncn1 184074342 BAXCQMUDWQWDME-UHFFFAOYSA-N 345.359 1.421 10 10 EDCE COc1cc(O)c(CN2C[C@H](C)[C@@H](N3CCOCC3)C2)cc1OC 180655217 YGMRQKWPRURRRM-ZFWWWQNUSA-N 336.432 1.562 10 10 EDCE CCN(CC)c1ccc(CN2CC[C@H](NS(C)(=O)=O)C2)cc1F 93531017 MINPSNBXHNWPNX-AWEZNQCLSA-N 343.468 1.795 10 10 EDCE CC(=O)N1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H](C)C1 268750036 SHARGFXYWLCTLK-HNNXBMFYSA-N 342.443 1.825 10 10 EDCE CNC(=O)c1ccc(N(C)Cc2ccc(N3CCOCC3)cc2)nn1 266868063 ZLEGXIBLNAWVIE-UHFFFAOYSA-N 341.415 1.309 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNC2CCC(NC(C)=O)CC2)c1O 278882528 OISGGEPRHHINOS-UHFFFAOYSA-N 337.376 1.846 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@H]2COCCN2CC(F)F)cc1F 287619610 HYASHPGJJHYLBD-CQSZACIVSA-N 345.365 1.474 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccn(S(=O)(=O)c2ccc(C)cc2)c1 808518566 DGACPGZILWMRKN-UHFFFAOYSA-N 349.364 1.348 10 10 EDCE Cc1ccc(CN2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(O)c1Br 2380803115 GIMJKZWMNDJHLN-AVNXNWIJSA-N 342.233 1.779 10 10 EDCE COC(=O)C[C@@H](N)c1ccc(I)c(N)c1O 390049100 FUDIAOQDSWPBGY-SSDOTTSWSA-N 336.129 1.142 10 10 EDCE CC[C@H](Cn1cncn1)NCc1ccc(N2CCOCC2)c(F)c1 810211093 MEFITDHDWZBPSW-OAHLLOKOSA-N 333.411 1.822 10 10 EDCE CN[C@H](C)c1ccc(N2CCN(C(N)=O)CC2)c(Br)c1 722196209 KTLVWVTUSNRAOQ-SNVBAGLBSA-N 341.253 1.930 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1C[C@H]2CC[C@@H](C2)C1 828497585 ZSGZIGZOSUBPJQ-IRXDYDNUSA-N 339.439 1.938 10 10 EDCE Cn1ccc(C2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)n1 905721549 FOHSDWGBJBQPPV-KRWDZBQOSA-N 329.400 1.931 10 10 EDCE CNC(=O)CN1CCC(NC/C=C\c2ccc(N(C)C)cc2)CC1 835034669 ADYHXRZIKDIKDI-PLNGDYQASA-N 330.476 1.566 10 10 EDCE Oc1ccc(Cl)cc1CNC(=S)NCCN1CCOCC1 844584977 ZRZKWBUEDYNUDA-UHFFFAOYSA-N 329.853 1.342 10 10 EDCE COc1ccc(N2CCN(C(=O)COC(=O)/C=C\C3CC3)CC2)cc1 745555181 DHXYOFWHPDTIHN-WTKPLQERSA-N 344.411 1.853 10 10 EDCE CSC[C@@H](NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)O 929046431 UCOHANSXMZXNMD-GXFFZTMASA-N 325.434 1.929 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](OC)c3cnn(C)c3)C2)cc1 855225442 NHFYXQCONOVADP-RHSMWYFYSA-N 344.415 1.511 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@H]3CCNC3)C2)cc1 851664507 CQSNEOLSVKFOGD-HUUCEWRRSA-N 332.448 1.573 10 10 EDCE CCO[C@@H](CNC(=O)NCc1cc(Cl)ccc1O)CN(C)C 926848283 SMQIYUGNDJYKSL-ZDUSSCGKSA-N 329.828 1.812 10 10 EDCE C[C@@H](NC[C@H]1COCCN1C)c1ccc(N2CCOCC2)c(F)c1 858519902 AZDALPMYPFBBKF-ZBFHGGJFSA-N 337.439 1.644 10 10 EDCE COc1ccc(N2CC[C@H](N[C@@H](C3CC3)[C@H]3CNCCO3)C2)cc1 854216933 HLXXEIZFYGLBNT-IPELMVKDSA-N 331.460 1.631 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](O)c3ccco3)C2)cc1 854301191 KMQFGOYSKYXRNH-CZUORRHYSA-N 345.399 1.900 10 10 EDCE O=C(O[C@@H]1CCCNC1=O)c1cccc2c1C(=O)c1ccccc1C2=O 767245459 DGMWTBYRHIFOTF-OAHLLOKOSA-N 349.342 1.897 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)C[C@@]2(C)CO)c(Br)c1 698159137 XDQLDBRQFQNASB-PUYPPJJSSA-N 330.222 1.824 10 10 EDCE C[C@@H](Oc1cccc(CO)c1)C(=O)NCCc1ccc(O)c(O)c1 764849506 RSMQDLHBPBCCLG-GFCCVEGCSA-N 331.368 1.716 10 10 EDCE COc1cc(N(C)CC(=O)NC(C)(C)C)c([N+](=O)[O-])cc1OC 766925292 IIKBAWTUYVAJSR-UHFFFAOYSA-N 325.365 1.963 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cccc(Nc2nn[nH]n2)c1 1137464902 VIINUPIBQHQVKA-UHFFFAOYSA-N 340.343 1.327 10 10 EDCE COC(=O)[C@H]1C[C@@H]2C[C@H](NC(=O)NCc3c(O)cccc3F)[C@@H]2C1 897745737 OQSVBCONHJAAHV-DEKYYXRVSA-N 336.363 1.918 10 10 EDCE COC(=O)[C@H](NC(=O)c1ccc(C)c(O)c1O)c1ccc(O)cc1 1138091943 TXILFPVUWCDBGA-CYBMUJFWSA-N 331.324 1.756 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(C(=O)C2CCCCC2)CC1 1142720454 OXCXHPOIVNXZFM-UHFFFAOYSA-N 346.427 1.891 10 10 EDCE NC(=O)c1cnn2c(C(=O)NCc3cc(Cl)ccc3O)ccnc12 1300395657 AOVKANUVMITYCY-UHFFFAOYSA-N 345.746 1.117 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cnn(C)c2N)cc1C 1317235459 QPDDMWGBXZSSOM-LBPRGKRZSA-N 331.420 1.227 10 10 EDCE O=C(O)[C@H]1COCCN1Cc1cc(Br)cc(F)c1O 715763702 XPZBBLRWWYLZAP-SNVBAGLBSA-N 334.141 1.579 10 10 EDCE C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C)C1O 1330333040 HRFTUCYCEKCCFR-ZIAGYGMSSA-N 347.459 1.186 10 10 EDCE CCN1CC[C@@H](N(CC)C(=O)C(=O)N(C)Cc2ccccc2O)C1 1261625114 KJSLMKNCQDGXFJ-OAHLLOKOSA-N 333.432 1.293 10 10 EDCE CCNC(=O)CN[C@@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1503651465 VREMHSIIBYEELM-NSHDSACASA-N 348.407 1.083 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)C2=CCOCC2)cc1 1282983809 SVDYLDGVPPXMKX-UHFFFAOYSA-N 345.359 1.042 10 10 EDCE Cn1c(CO)nc2cc(C(=O)NCCc3ccc(O)c(O)c3)ccc21 1445939525 RRLGYQYMSKJUHP-UHFFFAOYSA-N 341.367 1.449 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1ccoc1C1(O)CCOCC1 1545637538 WBYFDFMQQMJSST-UHFFFAOYSA-N 333.340 1.619 10 10 EDCE CN(C)c1ccc(CNC(=O)C2=CS(=O)(=O)CCC2)cc1F 1627046259 OGKRKFYTSGHSIU-UHFFFAOYSA-N 326.393 1.600 10 10 EDCE CO[C@H](C)C(=O)N(C)[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1718173529 VFSYLMMQFKFFQP-WDEREUQCSA-N 349.391 1.461 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc(C)c(S(N)(=O)=O)c2)c1 1629737082 RPUXBWXYUFVCPR-UHFFFAOYSA-N 334.397 1.586 10 10 EDCE COc1cnc([C@H]2CCCN2C(=O)c2ccc(C)c(O)c2O)nc1O 1636888620 PCZOXGVYJOQSQM-LLVKDONJSA-N 345.355 1.888 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)CCCn1c(O)nnc1O 1635662890 GVDAFIBGEZCQNT-UHFFFAOYSA-N 334.376 1.614 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC(Cc3nn[nH]n3)CC2)c1O 1560114721 YKNROSATTVEBBY-UHFFFAOYSA-N 333.367 1.702 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)C1CCS(=O)(=O)CC1 1645441022 RMUGTGYXPSDKGN-UHFFFAOYSA-N 333.409 1.986 10 10 EDCE COC(=O)c1cccc2c1CCN2C(=O)c1ccoc1CC(N)=O 1647761354 PLYHREZHDYMIHM-UHFFFAOYSA-N 328.324 1.297 10 10 EDCE O=C(NCc1c(O)cccc1F)c1cc2c(nc1O)CCC[C@H]2O 1646034504 KIMBRBNARNCKTI-CQSZACIVSA-N 332.331 1.932 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H]2CC2(F)F)cc1C 1676529243 IZEHTVNLIIATBP-OLZOCXBDSA-N 328.359 1.226 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C[C@H]2CCCC(=O)N2)cc1C 1690600112 OPBYMRIORQYPMT-GDBMZVCRSA-N 347.459 1.657 10 10 EDCE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@H](O)CNC(=O)OC(C)(C)C 1968792941 UFCSIGIRSAHFLJ-FZMZJTMJSA-N 338.404 1.797 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H]1[C@@H](N)Cc1ccc(O)c(O)c1 1953007515 CJDDIAOWXZBWCE-YWPYICTPSA-N 338.404 1.650 10 10 EDCE Oc1cccc(Br)c1CN[C@@H]1C[C@H]2C[C@H]1[C@@H](O)[C@@H]2O 1974164003 WERSDYMGGMPIPL-WOYODEERSA-N 328.206 1.375 10 10 EDCE COC[C@@](C)(NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 1980368656 APNMBSGAEAOQNK-GLKRBJQHSA-N 328.409 1.182 10 10 EDCE CNCc1ccc(N2[C@H](CO)C[C@@H]3OCC[C@@H]32)c(Br)c1 2146685191 MHDPLCOPJKMRKK-CQDKDKBSSA-N 341.249 1.897 10 10 EDCE Nc1ccc(CCN=c2cc(I)cn[nH]2)cc1 2012242964 DOTNYLPFOZTFKH-UHFFFAOYSA-N 340.168 1.740 10 10 EDCE CO[C@@H]1CN(c2cc(Br)c(CN)cc2F)[C@@H]2COC[C@@H]12 2158361210 HGGKNXOFUMJRGF-OWYVNGRQSA-N 345.212 1.897 10 10 EDCE O=C1NC(=O)[C@H]2CN(c3ccc(CO)c(Br)c3)CC[C@@H]12 2158790179 SSKLZUKBWUJKKY-MNOVXSKESA-N 339.189 1.040 10 10 EDCE C[C@@]1(C(=O)O)CN(Cc2cc(Br)cc(F)c2O)CCO1 715790716 VSAZFHDVQRKBKS-ZDUSSCGKSA-N 348.168 1.969 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H](CNCc2ccc(O)c(O)c2)C1 397477986 YFELICDPVGSJIU-CYBMUJFWSA-N 338.404 1.823 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N(C)CCNc3ccccn3)c2n1 2062925883 HMRXQGUBAOUZQB-UHFFFAOYSA-N 326.360 1.322 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCCC[C@H]3c3ncccn3)c2n1 2065097774 NKZUPEJTMUOYAJ-ZDUSSCGKSA-N 338.371 1.901 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC=C[C@@H]3CO)c(Br)cc21 2176343606 PZPSFHVEVYVFMF-OQPBUACISA-N 338.205 1.399 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@@H]1NC(=O)Cc1ccc(N)cc1 2044229785 ACXRFGVFZXLONX-GJZGRUSLSA-N 349.431 1.610 10 10 EDCE NCc1cc(F)c(N2CCN3CCOC[C@H]3C2)cc1Br 2185888850 YAHYBUGNHYRFDJ-LLVKDONJSA-N 344.228 1.568 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)C1(O)CC(NC(=O)OC(C)(C)C)C1 2080888716 RUSQRODYMMDGFE-UHFFFAOYSA-N 349.431 1.645 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2102177881 OVMUHTDCNYSKMY-SWHYSGLUSA-N 327.222 1.364 10 10 EDCE CN(Cc1cc(Br)cc(F)c1O)C[C@H]1COCCN1 2104241693 MEUCMLHZLVVUID-NSHDSACASA-N 333.201 1.714 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2210541435 QISIQDSDWPIREE-DCAQKATOSA-N 327.385 1.874 10 10 EDCE NCc1ccc(N2CCN3C(=O)OC[C@@H]3C2)c(Br)c1 2114271919 MKIUYADOUMBYFY-JTQLQIEISA-N 326.194 1.549 10 10 EDCE CCN(c1ccc(CN)c(Br)c1)[C@H]1CC(=O)NC1=O 2114733006 SLXNFZZKPMRFFW-NSHDSACASA-N 326.194 1.149 10 10 EDCE Cc1cc(Br)nc(NC(=O)c2cc(O)c(O)c(O)c2)n1 2287611279 PWNSZWOGVGQHFV-UHFFFAOYSA-N 340.133 1.917 10 10 EDCE CCS(=O)(=O)C1=NSC2=NC(=O)C(=Cc3ccco3)C(=N)N21 2297345451 XOEXUIIWIFLIEQ-UHFFFAOYSA-N 338.370 1.291 10 10 EDCE CSc1ccc(N(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)cc1 491882347 CPUWGXZKJVWQCO-BJMVGYQFSA-N 345.424 1.482 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(c2nccs2)CC1 2307981947 FXDPQTFIHROTFG-UHFFFAOYSA-N 331.397 1.916 10 10 EDCE CNCc1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2357595938 ZKFWKZDXCATQAE-KYQLBWAOSA-N 341.249 1.489 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@H]2CNC[C@@H]2O)c1C 262382359 XDYBWDKWOADTJS-YJBOKZPZSA-N 327.428 1.713 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C1(N2CCOCC2)CCC1 376267738 UDWSVNNJSLHRDU-UHFFFAOYSA-N 331.460 1.966 10 10 EDCE Cc1ccc(CN2CC[C@](O)(CN(C)C)C2)c(O)c1Br 2381135018 LDEWIWHKDKFUEL-HNNXBMFYSA-N 343.265 1.962 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCCC2(F)F)c1 807853618 NAMQCBQQMCUEGE-NSHDSACASA-N 334.344 1.681 10 10 EDCE CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)OCC(=O)C(C)=O 808517900 RFYFLFZYIOGVOQ-LRDDRELGSA-N 345.395 1.687 10 10 EDCE COC(=O)N1CCC[C@H]([C@@H](C)NC(=O)c2c(F)ccc(O)c2O)C1 828857436 CBSQAECYCCMMSV-ZJUUUORDSA-N 340.351 1.834 10 10 EDCE O=C(CN1CCCCCC1=O)NCc1ccc2cccnc2c1O 843513817 CXWDRGDXMYHTIE-UHFFFAOYSA-N 327.384 1.959 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2)cc1 841846698 SKSHLRJAGSVMCW-RANZSIQMSA-N 330.476 1.789 10 10 EDCE C[C@]1(F)CNCCN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 841832401 NHZIUUXRBQSWKO-SFHVURJKSA-N 332.423 1.906 10 10 EDCE O=C1C[C@@H](CCNCc2cc(Br)cc(F)c2O)CN1 922783204 ZXCLZPZYUXSEHE-MRVPVSSYSA-N 331.185 1.910 10 10 EDCE COC(=O)C[C@H](CNC(=O)NCc1ccc(OC)cc1O)C1CC1 852602891 JMNFQHMGLWPJAS-CYBMUJFWSA-N 336.388 1.789 10 10 EDCE CO[C@H](CNC(=O)NCc1ccc2c(c1)CCCN2C)[C@@H]1CCOC1 852438997 ARIIEXJJQQNIIX-SJLPKXTDSA-N 347.459 1.920 10 10 EDCE CN(C)Cc1csc(CNC(=O)/C=C/c2ccc(O)c(O)c2)n1 927768837 NFFOGZGUOOLIQI-GQCTYLIASA-N 333.413 1.946 10 10 EDCE C[C@H]1CC[C@@H](NCc2ccc(N3CCOCC3)cc2)CS1(=O)=O 850367984 GMCAZWQXQDWAAW-GOEBONIOSA-N 338.473 1.579 10 10 EDCE NCC12CC(CN1C(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2 851654900 JGRGIWGDHULARC-UHFFFAOYSA-N 348.422 1.295 10 10 EDCE C[C@H](NC(=O)NCCC1(CS(C)(=O)=O)CC1)c1ccccc1O 868760693 BLFVMSBYRNDKTO-LBPRGKRZSA-N 340.445 1.967 10 10 EDCE N[C@@]1(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1(F)F 867961774 HJZSLEAUWWFJFK-CQSZACIVSA-N 329.322 1.015 10 10 EDCE CCN1CC[C@@H](N(CC)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1119022452 CHTCBCUXMWYNRJ-CQSZACIVSA-N 331.416 1.177 10 10 EDCE Cc1cc(O)c(CNCCc2nnc3c(=O)n(C)ccn23)cc1C 886283681 DQXAAUDZFQXJSR-UHFFFAOYSA-N 327.388 1.083 10 10 EDCE COC(=O)[C@H]1COCCN1Cc1cc(C)cc(Br)c1O 781914692 ZRINHUVXSHOSOW-GFCCVEGCSA-N 344.205 1.837 10 10 EDCE C[C@@H]1CN(CCO)CCN1Cc1cc(Br)cc(F)c1O 894959392 RZYLXLZNCZKRAC-SNVBAGLBSA-N 347.228 1.792 10 10 EDCE CC(C)OCc1nc([C@H](C)NC(=O)Cc2ccc(O)c(O)c2)no1 1160667165 KOMHIWWQCSSFHB-JTQLQIEISA-N 335.360 1.826 10 10 EDCE COC(=O)CN1C(=O)[C@@H](Cc2ccc(N)cc2)Oc2ccccc21 62495996 SPSZBGWXLHLYAF-MRXNPFEDSA-N 326.352 1.779 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@H]2CCNC(=O)C2)cc1C 1317390334 OESYPYVAIGRMJK-HOCLYGCPSA-N 347.459 1.514 10 10 EDCE CCOC(=O)CC[C@@H](C)NC(=O)C(=O)N(C)Cc1ccccc1O 1346753435 LSPOYNNCVDONDG-GFCCVEGCSA-N 336.388 1.199 10 10 EDCE CC[C@@H](CNC(=O)c1cc[n+]([O-])cc1)NCc1ccc(OC)c(C)c1 1269366856 WAHBMVZITBQAIR-KRWDZBQOSA-N 343.427 1.935 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCCCc1ncn(C)n1 1349069446 SYQCRHLCVCOBFI-UHFFFAOYSA-N 330.436 1.622 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C2=C3CCCN=C3NN2)cc1F 1293225490 WSLQWPQBQAVSEP-UHFFFAOYSA-N 345.422 1.842 10 10 EDCE C[C@@]1(C(=O)NCc2cccc(O)c2O)Cc2ccccc2C(=O)O1 1455321031 WGBMTISQGWQIMC-SFHVURJKSA-N 327.336 1.886 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1cc(O)ncc1Br 1465955621 ZSBSHRIJAPTPJE-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE Cc1nc(Cn2nnc(C(=O)NCc3c(O)cccc3F)c2C)no1 1471975821 IRUBCYMAUZEIQY-UHFFFAOYSA-N 346.322 1.101 10 10 EDCE C[C@H](O)c1ccc(N2CC3(CNC(=O)N3)C2)cc1Br 2121181940 RAQNDRMBBCSUKT-QMMMGPOBSA-N 326.194 1.374 10 10 EDCE O=C1CCN(C(=O)CSC(=S)NCc2ccc(Cl)cc2)N1 1616047354 GWTOFJIHDANFRP-UHFFFAOYSA-N 343.861 1.711 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CNC(=O)C2CC2)cc1C 1481210458 XYVVAQNJPKZNQZ-UHFFFAOYSA-N 333.432 1.078 10 10 EDCE COc1cccc(CNC(=O)c2coc(S(C)(=O)=O)c2)c1O 1636061648 USOLUHZLIKGHEK-UHFFFAOYSA-N 325.342 1.327 10 10 EDCE Cc1c[nH]c(CC(N)=O)c1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 1632681909 XGRYPLJJTKPFPC-JTQLQIEISA-N 331.372 1.123 10 10 EDCE CS(=O)(=O)c1ccc(/C=C\C(=O)NCc2c(O)cccc2O)o1 1639292804 RHNCZJMMPWUXFS-ALCCZGGFSA-N 337.353 1.424 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)c2occc2C)cc(OC)n1 1720896886 YWDIJPVSXJADRS-LLVKDONJSA-N 347.371 1.549 10 10 EDCE C[C@@H]1C[C@@H]1C(=O)NC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1585023593 MEHVXKIXPWDARR-MFKMUULPSA-N 343.387 1.884 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)Cc2cc[nH]n2)cc1C 1674648575 VIGVSVRROWVXHV-KBPBESRZSA-N 330.432 1.952 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NCCOCC(=O)OC)cc1 1684406283 MMBVXXIZHZBEIP-UHFFFAOYSA-N 337.420 1.522 10 10 EDCE COCCN(C)CCN[C@@H](C)c1ccc(N2CCC(O)CC2)cc1 159310050 BJCGWPWKTXXJFE-INIZCTEOSA-N 335.492 1.877 10 10 EDCE CC[C@H](NC(=O)C(C)C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1862299304 ACCFMMGLVBFJKX-KRWDZBQOSA-N 347.459 1.895 10 10 EDCE Oc1ccccc1N=c1nc(N2CCCC2)[nH]c(N2CCCC2)n1 1871730228 MWISBLWOMZRUDV-UHFFFAOYSA-N 326.404 1.943 10 10 EDCE COc1ccc(Br)c(CNC2CC(CC(N)=O)C2)c1O 1967819686 LNBMFKAGSDYEHM-UHFFFAOYSA-N 343.221 1.907 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C[C@H](O)CN 1952314898 JSRVMEFIDZDIET-NEPJUHHUSA-N 326.393 1.243 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCCCCN=[N+]=[N-])C1 1986139466 AJLQBNFNHPEDTE-AWEZNQCLSA-N 327.385 1.565 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](OCC(N)=O)C2)c(Br)c1 2145370959 JNYOIOPDXRJZBI-ONGXEEELSA-N 343.221 1.583 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2C[C@]2(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2003172100 GIMUGWFCGBQIKE-HXBQNGOUSA-N 336.432 1.945 10 10 EDCE O=C1Nc2cc(N3CC[C@H]4C[C@H]3CO4)c(Br)cc2[C@H]1O 2153087620 SLOBQQHOBBCPRV-UVPNAGLESA-N 339.189 1.802 10 10 EDCE CCN(CCCCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2159108023 HTBDNXCQLONZKF-CYBMUJFWSA-N 342.237 2.000 10 10 EDCE CS(=O)(=O)c1cnn(Cc2cc(C(F)(F)F)ccc2O)c1N 2070220516 WHGQXOMCSCEVRX-UHFFFAOYSA-N 335.307 1.642 10 10 EDCE NC[C@]1(O)CCCN(Cc2cc(Br)cc(F)c2O)C1 2101317233 NPZRBNAYAVPSPY-CYBMUJFWSA-N 333.201 1.579 10 10 EDCE NCc1ccc(N2CCO[C@@H]3COCC[C@@H]32)cc1Br 2087489319 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1.638 10 10 EDCE CN[C@@H]1COCCN(Cc2ccc(C)c(Br)c2O)C1 2352948931 WMEKDTDMABRQEH-LBPRGKRZSA-N 329.238 1.883 10 10 EDCE COC(=O)CC1=NN(c2ccccc2)C(=O)/C1=C(\C)NCCCO 103525670 MGNPFJGDGGWTJB-FOWTUZBSSA-N 331.372 1.198 10 10 EDCE C[C@@H](NC(=O)c1ccco1)C(=O)NCc1ccc(N(C)C)c(F)c1 58975303 GECBYTWNDXTSMU-LLVKDONJSA-N 333.363 1.919 10 10 EDCE CN(Cc1ccccc1)S(=O)(=O)NCCOc1ccc(N)cc1 302997172 IDKCIZISYWJUPP-UHFFFAOYSA-N 335.429 1.614 10 10 EDCE CCNCc1ccc(OC)c(C[S@@](=O)CCS(C)(=O)=O)c1 81992636 HZEJDLOJUOGFMU-HXUWFJFHSA-N 333.475 1.098 10 10 EDCE COc1ccc(N2CCN(C(=O)CNc3cc(C)on3)CC2)cc1 244145829 URYHXZVADHISMY-UHFFFAOYSA-N 330.388 1.752 10 10 EDCE CCN(C(=O)N(C(C)=O)c1ccc(N)cc1)[C@@H]1CCS(=O)(=O)C1 243385402 MJBVLOORRAMHOW-CQSZACIVSA-N 339.417 1.251 10 10 EDCE CC(=O)C(=O)COC(=O)Cn1nc(C(F)(F)F)c(Cl)c1C 811245248 NHEGAZGBUXNOTJ-UHFFFAOYSA-N 326.658 1.565 10 10 EDCE O=C(Nc1nc(C2=S=CC=C2)n[nH]1)c1ccnn1C1CCOCC1 825779927 RWYSLPYGBZMYRJ-UHFFFAOYSA-N 344.400 1.231 10 10 EDCE CC[C@@H](NC[C@@]1(CO)COCCN1C)c1cc(Cl)ccc1O 903278672 MRDIGGANMNODFC-GDBMZVCRSA-N 328.840 1.779 10 10 EDCE Cc1cc(N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)n[nH]1 588550742 RWDQXFLILDNCTE-HYXAFXHYSA-N 328.372 1.491 10 10 EDCE CN(C)C(=O)CCN1CCN(C/C=C/c2ccc(N(C)C)cc2)CC1 835028614 NFZUDWSHWMIJIZ-AATRIKPKSA-N 344.503 1.862 10 10 EDCE O=S1(=O)CC[C@]2(CN(Cc3c(O)cccc3Cl)CCO2)C1 843425736 HLMVNJLIHDYGKU-AWEZNQCLSA-N 331.821 1.435 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)/C=C\c1cnccn1 918216514 SAYRDPKBHYSVJM-DAXSKMNVSA-N 338.411 1.985 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCNC[C@@H]1C 842264912 FMMJPORTWZGIDJ-GOEBONIOSA-N 347.459 1.635 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)C3(CO)CC3)C2)cc1 923183341 KSBVHLOXIFLBGE-UONOGXRCSA-N 333.432 1.734 10 10 EDCE O=C(NCc1ccccc1O)NC1CCC(N2CCNCC2)CC1 841997219 MVYUKBPGOOLPHV-UHFFFAOYSA-N 332.448 1.408 10 10 EDCE CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)NCc3c(O)cccc3F)[C@H]2C1 922506631 LYSNHWCXUVLZME-NOLJZWGESA-N 349.406 1.978 10 10 EDCE COC1(CS(=O)(=O)Nc2ccc(O)c(F)c2F)CCOCC1 844664708 UJOPMZISWOYEOM-UHFFFAOYSA-N 337.344 1.608 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cnnn2C2CCNCC2)c1 852802531 PGUHYXAYYMOSJM-NSHDSACASA-N 345.403 1.408 10 10 EDCE CC[S@@](=O)CCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852117916 BIGZQCOFJMULJG-ZAMGYDSWSA-N 339.461 1.342 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN3CCOC[C@H]3C2)c1 757927583 GTRCMSSNFALZLZ-CYBMUJFWSA-N 341.249 1.980 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H]4COC[C@@H](C3)O4)C2)cc1 852451795 PNKZVAXKRGXLIS-RRQGHBQHSA-N 347.415 1.083 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](OC)[C@H]3CCOC3)CC2)cc1 854198901 SMMIQNRTBCEUFF-YOEHRIQHSA-N 334.416 1.395 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N[C@@H]1CCN[C@H]1C 861814369 ZFPPQIIXSVMWEH-DZGCQCFKSA-N 333.432 1.388 10 10 EDCE Oc1nnc([C@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)o1 930305439 DBQPSQGMBUNKJT-HNNXBMFYSA-N 344.415 1.991 10 10 EDCE CCC[C@H](O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 930940415 FSWKKJJDQCTDAF-KRWDZBQOSA-N 335.448 1.094 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CCC[C@@H]3O)C2)cc1 875678407 AKOKEMVRMAULLA-COXVUDFISA-N 333.432 1.734 10 10 EDCE CNC(=O)[C@H]1CCC[C@@H]1NC(=O)c1cc2cc(O)c(O)cc2s1 897268552 MIBXKRSSIZFLQN-UWVGGRQHSA-N 334.397 1.957 10 10 EDCE CN[C@H](C)c1ccc(N2CCC2(CO)CO)cc1Br 1879986235 GGEQCXLVZCQENR-SNVBAGLBSA-N 329.238 1.663 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCN=[N+]=[N-])C[C@H](O)C1(C)C 1896905763 PWBYYHNZEWPAKW-XPTSAGLGSA-N 327.385 1.467 10 10 EDCE CC(C)(C)OC(=O)[C@]1(C(=O)NCc2ccc(O)cc2O)CCCO1 1142533136 DQDXOGVWAGOZRR-QGZVFWFLSA-N 337.372 1.605 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC1(N2CCCCC2)CCOCC1 1144049568 LTZOPNNRESAAGL-UHFFFAOYSA-N 348.443 1.792 10 10 EDCE Cc1cc(S(N)(=O)=O)oc1C(=O)NCc1c(O)cccc1F 1178413262 PLZAXAWGSDYZEC-UHFFFAOYSA-N 328.321 1.010 10 10 EDCE CN1CCN(c2ccc(CN[C@@H]3C[C@@H](O)C34CCC4)cc2F)CC1 1330298838 GVXGOKRYTKOIQD-QZTJIDSGSA-N 333.451 1.971 10 10 EDCE Cn1c(=O)n(CCC(=O)NCc2cccc(O)c2O)c2ccccc21 1455316309 HIWBMVPHPWCPSO-UHFFFAOYSA-N 341.367 1.458 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@@H]2CC23CC3)cc1 1292893754 BZVKFWQKAPWNIX-LBPRGKRZSA-N 329.360 1.495 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCN1CC[C@@H](F)C1 1463773414 BKECWGHGMXVOTG-QGZVFWFLSA-N 349.450 1.916 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3NC(=O)O[C@H]3C2)cc1Br 2120402309 GHUOBSUOHQBVJB-MKCWBWRRSA-N 326.194 1.766 10 10 EDCE Nc1ccc(NC(=O)NCCn2ncc(Br)n2)cc1 2123099615 UDJQSXQQPLMXJS-UHFFFAOYSA-N 325.170 1.445 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CN(Cc2ccccc2)CCO1 1558533281 BBBNAVAJGCIMCP-GOSISDBHSA-N 342.395 1.615 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C2(F)CCCC2)cc1C 1725536664 KFWRQWMBXRTJBC-OAHLLOKOSA-N 338.423 1.853 10 10 EDCE COC(=O)c1cc(C(=O)NCc2ccc3cccnc3c2O)on1 1643283155 IVTLKFBWLUJSBT-UHFFFAOYSA-N 327.296 1.645 10 10 EDCE [N-]=[N+]=NC[C@@H]1CCCN(C[C@H](O)CN2C(=O)c3ccccc3C2=O)C1 1912173621 OOODYAFAYUYYIX-STQMWFEESA-N 343.387 1.666 10 10 EDCE CC(C)(C)C(=O)N1CCC[C@@H](C(=O)NCc2cc(O)ccc2O)C1 1643879398 OBGILWXQHSISKR-GFCCVEGCSA-N 334.416 1.999 10 10 EDCE COCCn1c([C@H]2CCC(=O)N2)nnc1N(C)Cc1ccccc1O 1749844735 YWVJDZUCFXTLGW-CYBMUJFWSA-N 345.403 1.218 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1C[C@H](O)[C@H](O)C1 1596711494 OSHRARGVZFCGRQ-GJWQZFMSSA-N 342.395 1.521 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccnc(C)c2)cc1C 1676592443 LNIRSNIENOPTPP-KRWDZBQOSA-N 343.427 1.588 10 10 EDCE CC1(C)CN(c2ccc(CN)c(Br)c2)C[C@H](CO)O1 228156705 SJVGCWXOHDYDSC-GFCCVEGCSA-N 329.238 1.884 10 10 EDCE CN(C)[C@H]1COC[C@H]1CNCc1cc(Br)cc(F)c1O 1924641112 PCSXVZHENBGIBW-MFKMUULPSA-N 347.228 1.960 10 10 EDCE COc1ccc(Br)c(CN(C)[C@@H]2CCC(=O)NC2)c1O 1970965180 CGOGFTVPDIJQNH-SECBINFHSA-N 343.221 1.874 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(CC(=O)N2CC(N=[N+]=[N-])C2)C1 1985099430 NHUUZKKTKWRSPG-CQSZACIVSA-N 325.369 1.270 10 10 EDCE CN1CCc2cc([C@]3(N)COC[C@H]3NC(=O)OC(C)(C)C)ccc21 1999527804 SEYMDQMDGCGTJI-CRAIPNDOSA-N 333.432 1.756 10 10 EDCE O=C1NC(=O)[C@@H]2CCN(c3ccc(CO)c(Br)c3)C[C@@H]12 2158790178 SSKLZUKBWUJKKY-GHMZBOCLSA-N 339.189 1.040 10 10 EDCE C[C@@H](OCc1ccccc1)[C@@H](N)C(=O)NCCc1ccc(O)c(O)c1 2031086716 LKHXGFOXXBXHGG-FZKQIMNGSA-N 344.411 1.689 10 10 EDCE C[C@@H]1CN(C)C[C@H](CNCc2cccc(Br)c2O)O1 697317540 SCIFRMXUTXSCGJ-PWSUYJOCSA-N 329.238 1.963 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 866756140 QPRIWGIVXUTEEL-ZDUSSCGKSA-N 337.420 1.463 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2060611415 SYCXTCYXMSDUFG-CMPLNLGQSA-N 349.395 1.757 10 10 EDCE Nc1cc2c(cc1N(Cc1ccccc1)CC1(O)CNC1)OCCO2 2071586234 IVFONTXNSRDILJ-UHFFFAOYSA-N 341.411 1.381 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@H]3COC[C@H]32)cc1Br 2102192522 YCRCVZPOACPPDE-VAYSNVFOSA-N 327.222 1.665 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC4(CSC4)C3)c(Br)cc21 2090182979 XAAOEJAWOMJSLU-LLVKDONJSA-N 340.246 1.954 10 10 EDCE CN[C@@H](c1ccccc1O)[C@H](O)c1c(Br)cnn1C 2091868553 SPHSISFSRAHEPT-AAEUAGOBSA-N 326.194 1.882 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213586265 ABSHRHKSYDFOGK-DDHJBXDOSA-N 339.396 1.704 10 10 EDCE COc1ccc(Br)c(CNC2(CO)CC(O)C2)c1O 2208891892 QVZSEAPTSWJPJC-UHFFFAOYSA-N 332.194 1.139 10 10 EDCE OCc1ccc(N2C[C@@H]3OCCC[C@]3(CO)C2)cc1Br 2239155205 JDOZWGBZUNQMRY-LSDHHAIUSA-N 342.233 1.919 10 10 EDCE NCc1ccc(N2C[C@H]3OCC[C@@]3(CO)C2)c(Br)c1 2278920989 GXZKSNWJTHTHMU-KGLIPLIRSA-N 327.222 1.495 10 10 EDCE O=C(O)[C@@H]1CCOCCN1Cc1ccc(Br)cc1O 2269864901 GVFCHVQZCQLVJU-NSHDSACASA-N 330.178 1.830 10 10 EDCE Cc1cc(N2CCN(Cc3cc(F)ccc3O)CC2)n2ncnc2n1 179931849 QWMLWQRVEIJQJC-UHFFFAOYSA-N 342.378 1.600 10 10 EDCE CCN(C)c1ccc([C@H](C)NCC2CN(S(C)(=O)=O)C2)cc1 187825809 UJVBGXYEZREBTD-ZDUSSCGKSA-N 325.478 1.685 10 10 EDCE CC(=O)N1CCO[C@]2(CCCN(Cc3ccc(N(C)C)cc3)C2)C1 96268784 NCLHSQJBPWVXKR-IBGZPJMESA-N 331.460 1.966 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCOC3)CC2)cc1 263902790 FNWALLNEDOWWTJ-INIZCTEOSA-N 347.459 1.360 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3[C@@H](C)C[C@H](O)C[C@H]3C)nc12 276420067 IJXWGKJTJLZEOG-PTEHBNRSSA-N 348.403 1.345 10 10 EDCE Cc1ccc(CN(C)[C@@H]2COC[C@@H]2C(=O)O)c(O)c1Br 2380812681 YBVPCRIFLVGGSE-WDEREUQCSA-N 344.205 1.995 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1[C@H](C)OC(C)(C)N1C(=O)OC(C)(C)C 808539264 YKTCZZXNVOPXKC-CMPLNLGQSA-N 343.376 1.448 10 10 EDCE O=C(CCCn1cncn1)NCc1cc(Br)ccc1O 804735503 BJQPNOZCBXCZOT-UHFFFAOYSA-N 339.193 1.843 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@]2(O)CCNC2)c(O)c1Br 2381135543 SEFBOTJNTAAXER-AWEZNQCLSA-N 343.221 1.146 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@]23[C@H]4C(=O)[C@H]5[C@H]6C[C@@H]([C@@H]52)[C@@H]3[C@H]64)c1 800518705 IBFWGEOIZGGOIS-QWVFQBROSA-N 339.391 1.905 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@H]2CCOC2)cc1F 803663783 ZVRBBHJCZPKXFV-LBPRGKRZSA-N 337.395 1.051 10 10 EDCE COc1ccc(O)c(CN[C@H]2CCC[C@@H]2CNS(C)(=O)=O)c1 800541945 WWAMEKYIKDXJMC-RISCZKNCSA-N 328.434 1.208 10 10 EDCE CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)OCC(=O)C(C)=O 808517899 RFYFLFZYIOGVOQ-BLLLJJGKSA-N 345.395 1.687 10 10 EDCE CCN(C)c1ccc(CN2CCN([C@@H]3CCNC(=O)CC3)CC2)cc1 832369068 HLWIVTWAQREXSF-IBGZPJMESA-N 344.503 1.929 10 10 EDCE COc1ccnc(N(C)C(=O)c2cn(C)nc2-c2cnn(C)c2)c1 583259572 GCFHWLFJLMWFAN-UHFFFAOYSA-N 326.360 1.501 10 10 EDCE Cn1nncc1CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 830899751 LGMCYVYDSMIZAM-OAHLLOKOSA-N 330.388 1.271 10 10 EDCE Nc1ccc(CNC(=O)[C@@H]2CSCN2C(=O)C2CCCC2)cc1 837302889 LIYPQHOTHWAIMT-HNNXBMFYSA-N 333.457 1.977 10 10 EDCE CCO[C@H](CNC(=O)NCc1ccc(N(C)C)cc1C)CN(C)C 919081263 JCPLTXIIDZDWGB-QGZVFWFLSA-N 336.480 1.827 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)[C@@]12C[C@H]3C[C@H](C(=O)N1)[C@H]2C3 844396781 QVTXFQBJQOFHGC-XJTZBENFSA-N 327.428 1.592 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C[C@@]1(O)CCCN(C)C1 910557449 ASLYGUKPBAAHKI-UZLBHIALSA-N 347.503 1.955 10 10 EDCE CCOC(=O)[C@@H]1CN(Cc2cc3c(cc2O)CCC3)CC12COC2 840099526 QVEKREIWPDKCDD-INIZCTEOSA-N 331.412 1.892 10 10 EDCE Cc1cc(N(C)C)ccc1CN1CCN(c2nccn(C)c2=O)CC1 840918714 ZTSVSSFXRTXRBK-UHFFFAOYSA-N 341.459 1.477 10 10 EDCE CCN(CC)c1ccc(CN(C)[C@H]2CCN(CC(=O)O)C2=O)cc1 852726555 SFIJKEPSKNKLED-INIZCTEOSA-N 333.432 1.650 10 10 EDCE C[C@@H]1CN(C)C[C@H]1NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 756103993 XRUFCIJKCVOCDI-UWWQBHOKSA-N 330.476 1.428 10 10 EDCE CCn1cc(CNC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)cn1 852328408 DOLGFUCXMSPHIF-HNNXBMFYSA-N 343.431 1.990 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CN[C@@H]3CN4CCC[C@H]3C4)cc2)C1 924726884 RNTJEDOCIGNGNQ-JENIJYKNSA-N 342.487 1.572 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCC3=CCNCC3)C2)cc1 851666531 HQDHBEDYDLEDTK-MRXNPFEDSA-N 344.459 1.883 10 10 EDCE CCN1CCO[C@@H](C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 855229860 CJAFHZXEQXOKKG-RHSMWYFYSA-N 333.432 1.111 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H]4NC(=O)CC[C@H]4C3)cc2N1 853829985 PQPFSALFYXSOSR-VHSXEESVSA-N 346.343 1.031 10 10 EDCE CS(=O)(=O)N1CCC[C@@H](Nc2c(N)cccc2Br)C1 697448534 WJZZWQFRZPIVFH-SECBINFHSA-N 348.266 1.867 10 10 EDCE CN(C)C(=O)Cn1ccc(NC(=O)N2Cc3cccc(O)c3C2)n1 930104973 JDGLMXZSSWLEKK-UHFFFAOYSA-N 329.360 1.225 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)COCc2ccnc(O)c2)c1 860241241 GXGQUFUYXAOGPT-NSHDSACASA-N 332.356 1.895 10 10 EDCE C[C@H](C(=O)NCc1cc(Br)ccc1O)[C@H]1CCC(=O)N1 861687344 MKDCXTBBHINZBF-GZMMTYOYSA-N 341.205 1.686 10 10 EDCE COC(OC)C(=O)N1CCN(Cc2ccc(N(C)C)c(C)c2)CC1 930956846 HFAGUOQQOJCYOG-UHFFFAOYSA-N 335.448 1.324 10 10 EDCE O=C1N=C(N2CCCCC2)S/C1=C/c1cn(C[C@@H]2CCOC2)nn1 865219260 XMXSOYBAJFHQCU-ACLQVGRQSA-N 347.444 1.771 10 10 EDCE Cn1cnc2cc(S(=O)(=O)Nc3ccc(O)c(C(=O)O)c3)ccc21 776434446 GEDOIJVYQFVOJO-UHFFFAOYSA-N 347.352 1.778 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCOCC3(CC3)C2)c1 782844860 DMSQSSZRQBUODF-UHFFFAOYSA-N 340.401 1.016 10 10 EDCE O[C@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)CC(F)(F)C1 787438069 GVBROTCNGQSIAV-CYBMUJFWSA-N 330.350 1.864 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C1CN(C2CCOCC2)C1 896402051 JKXASVMMDYTGPP-UHFFFAOYSA-N 331.460 1.788 10 10 EDCE Cc1nc(C2CN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)n[nH]1 1154652917 RNZYWMJRRPBMRS-UHFFFAOYSA-N 330.369 1.979 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CNCc2cccc(O)c2O)C1 705693429 BFGLFEBEYZAHPY-OCCSQVGLSA-N 338.404 1.415 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)c2cncnc2O)cc1C 1320459316 OVYDHXSAQHTQDH-CYBMUJFWSA-N 344.415 1.797 10 10 EDCE C[C@H](N)c1ccc(N(C)C[C@H](O)CN(C)C)cc1Br 690174034 XLVMRWJMHPAIAT-CMPLNLGQSA-N 330.270 1.828 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCC[C@@H]3CO)c(Br)cc21 92775397 NXGPAWIUDCIVBP-JMCQJSRRSA-N 326.194 1.362 10 10 EDCE Cc1cc(CN2CCN(CC(F)(F)CO)CC2)ccc1N(C)C 1195670149 OGMARRODNPKWEB-UHFFFAOYSA-N 327.419 1.806 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2c[nH]c(=O)cn2)cc1C 1275472502 XCOWFVKBTXDRBZ-QWHCGFSZSA-N 344.415 1.384 10 10 EDCE COC[C@@H](C)NCCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1276411394 QBPXJXVODIICNC-GFCCVEGCSA-N 335.408 1.936 10 10 EDCE COc1cc(N2CCC(CO)(CO)CC2)c([N+](=O)[O-])cc1OC 1458578798 JAEWDCDBMMXWJT-UHFFFAOYSA-N 326.349 1.183 10 10 EDCE COc1cccc(CNC(=O)[C@H]2COc3ccc(O)cc3O2)c1O 1465993567 TWRHUIWQUHKIRU-OAHLLOKOSA-N 331.324 1.563 10 10 EDCE COCCC(=O)NC[C@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1534641072 JPTNKZGAEFVREJ-CYBMUJFWSA-N 347.375 1.216 10 10 EDCE C[C@@H]1CN(c2ccc(CO)c(Br)c2)C[C@@H](CCO)O1 2122797932 GEHXJZUMCMBRHV-ZWNOBZJWSA-N 330.222 1.918 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CCN1CCOCC1 1623550272 VZGLYHNOZFTPET-UHFFFAOYSA-N 331.460 1.968 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)C[C@@H]2COC(=O)C2)cc1C 1482089444 JZHJEDMWYPPXDS-BBRMVZONSA-N 348.443 1.799 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cn(C)nc2OC)cc1C 1713621217 DIJMDOYPFYYBLW-UHFFFAOYSA-N 346.431 1.608 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cccc(=O)n2C)cc1C 1713336994 YWMJNEDMMCAYFL-AWEZNQCLSA-N 343.427 1.610 10 10 EDCE C[C@@H](C(=O)N[C@H](C)c1ccccc1O)n1cnc2c(N)ncnc21 1557966447 BMUUWCWEWACJJT-ZJUUUORDSA-N 326.360 1.553 10 10 EDCE CC(=O)NN1C(=O)/C(=C2/C(=O)N(C)c3ccccc32)SC1=S 1090138 MAGKQUGVMCSRBP-KHPPLWFESA-N 333.394 1.286 10 10 EDCE CN(C)[C@@]1(C(=O)NCc2c(O)cccc2O)COc2ccccc2C1 1635847434 NWQVIBXHJXJCRU-LJQANCHMSA-N 342.395 1.650 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC(=O)N(Cc2ccccc2)C1 1631853937 UQXCHPAHBPFYQY-UHFFFAOYSA-N 326.352 1.469 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cc(C)n(NC(N)=O)c2C)c1 1566374863 WNQGIRFEGALHTB-JTQLQIEISA-N 346.387 1.932 10 10 EDCE O=C(CCN1C(=O)c2ccccc2C1=O)NCc1ccc(O)cc1O 1639441042 HIZKJYXJAIMFEQ-UHFFFAOYSA-N 340.335 1.400 10 10 EDCE CC[C@@H](CNC(=O)C1CC=CC1)NC(=O)c1cc(OC)nc(OC)c1 1738112860 RKPQPBQIAGOMLY-AWEZNQCLSA-N 347.415 1.690 10 10 EDCE CNC(=O)NCC(=O)N1CC[C@@H](NCc2ccc(OC)c(C)c2)[C@H]1C 1734393126 FUXDLBXETNIXFG-UKRRQHHQSA-N 348.447 1.012 10 10 EDCE CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NCc1cc(O)ccc1O 1651225244 BPJSQSKDWJXVDG-NSHDSACASA-N 334.294 1.417 10 10 EDCE O=C(CCn1c(=O)oc2ccccc21)NCc1ccc(O)c(O)c1 159123203 GURHUUZOKAIMNG-UHFFFAOYSA-N 328.324 1.712 10 10 EDCE NC(=O)CN(Cc1ccccc1)c1cc2c(cc1Cl)[C@H](O)C(=O)N2 1946829964 CSWRJKAZHPMTEA-INIZCTEOSA-N 345.786 1.817 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCCN(CC(=O)N2CC(N=[N+]=[N-])C2)C1 2010390084 YQYZKRZKZNUOBM-NSHDSACASA-N 338.412 1.497 10 10 EDCE CCN(CC)C[C@H]1CCN(C(=O)c2cnn3c(O)cc(C)nc23)C1 2064213719 TZSXOMCYSZMQSU-CYBMUJFWSA-N 331.420 1.547 10 10 EDCE CC(C)(C)OC(=O)NOCCCNC(=O)c1cccc(O)c1O 1157470206 WAZDWKAUAAUBRK-UHFFFAOYSA-N 326.349 1.674 10 10 EDCE COc1ccc(Br)c(CNC[C@]2(CO)CCCO2)c1O 2208798683 AQOKARLSFNZDJA-AWEZNQCLSA-N 346.221 1.794 10 10 EDCE NCc1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2228400550 UQFUXIGPFSOZMR-PHIMTYICSA-N 329.238 1.335 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)CO1 2246585113 LXKLRJLCZOVCNV-ZYHUDNBSSA-N 339.396 1.827 10 10 EDCE O=C(O)[C@@]12CO[C@@H](C1)[C@@H](NCc1c(O)cccc1Br)C2 2280791330 PQGXPQXTWQKCBI-VHRBIJSZSA-N 342.189 1.877 10 10 EDCE COC(=O)C=Cc1ccc(N2CCN(CCO)[C@@H](C)C2)c([N+](=O)[O-])c1 2310199096 HUYRTQICBYXZEX-ZDUSSCGKSA-N 349.387 1.284 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](O)[C@@H](C)N)c(O)c1Br 2352650000 GTGFBIXUCNTFDZ-KCJUWKMLSA-N 331.210 1.130 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)c(Br)c1 2355335598 DFDFXLNKVFYRGG-UDQBKAKJSA-N 341.249 1.789 10 10 EDCE CNC(=O)CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 187378286 MDVATDYQLJYKDL-NSHDSACASA-N 341.358 1.509 10 10 EDCE CC1(C)Oc2ccc(N)nc2N(CCOc2ccc(N)cc2)C1=O 75259216 KGEXGIQQQXZIIF-UHFFFAOYSA-N 328.372 1.829 10 10 EDCE Cn1cc(/C=C/C(=O)N2CCC=Cc3ccccc32)c(=O)n(C)c1=O 190113756 WZSCNPPOIAENFW-ZHACJKMWSA-N 337.379 1.547 10 10 EDCE N[C@H](c1cccc(I)c1O)C(F)(F)C(=O)O 95769567 LGHLYJHSLLQATL-SSDOTTSWSA-N 343.067 1.717 10 10 EDCE N[C@@H](CO)c1cc(O)c(O)c(Br)c1Br 238589638 ZMVJCBSILFLXNL-BYPYZUCNSA-N 326.972 1.615 10 10 EDCE COc1ccc(N2CCCN(C(=O)c3cccn(C)c3=O)CC2)cc1 363015454 AAJJPKUBPKSIBY-UHFFFAOYSA-N 341.411 1.746 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@]3(C)CCC(=O)NC3)CC2)cc1F 282926478 YDLRTDUKULXTKV-GOSISDBHSA-N 349.406 1.399 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1[C@H]2CC[C@H]1[C@@H](CO)C2 289661900 UJRLSPDCXXXEEW-NJAFHUGGSA-N 331.460 1.556 10 10 EDCE COC(=O)[C@H]1C[C@@H](O)CN1Cc1ccc(C)c(Br)c1O 2380674207 UIXOOYVQEOARKY-GHMZBOCLSA-N 344.205 1.571 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](N)CN(C)C)c(O)c1Br 2380792822 MFTQHSRJTPKMFX-NSHDSACASA-N 344.253 1.310 10 10 EDCE CNC(=O)[C@H]1COCCN1Cc1ccc(C)c(Br)c1O 2381140362 JMXPMXQBUGKJIC-LLVKDONJSA-N 343.221 1.410 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1ccc([N+](=O)[O-])cc1Br 808527143 ZIEFSHHYCGKRQO-UHFFFAOYSA-N 344.117 1.601 10 10 EDCE CN(Cc1cc[nH]n1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807287698 MHCWWDUZVLVZAH-UHFFFAOYSA-N 339.399 1.061 10 10 EDCE C[C@H]1CN(C/C=C\c2ccc(N(C)C)cc2)CCN1S(C)(=O)=O 835043425 UEQAPNYCGBCBPZ-YVACAVLKSA-N 337.489 1.732 10 10 EDCE C/C=C\C[C@H](CO)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 588495080 PYPFQFJLNQUIQD-KSSTYHTISA-N 330.428 1.980 10 10 EDCE COc1cnc(F)c(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)c1 848393022 MSFREJAYBJFSFF-OAHLLOKOSA-N 332.379 1.725 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)Cc2cc(C3CC3)no2)cc1 852791281 FWOZVSNTMBAKQM-INIZCTEOSA-N 328.416 1.977 10 10 EDCE CO[C@H](C(=O)NCc1cc(Br)ccc1O)[C@@H]1CCOC1 854442422 RJQWTFHUBOARNN-RNCFNFMXSA-N 344.205 1.822 10 10 EDCE COC[C@H]([C@H]1CCCOC1)N1C(=O)CN(Cc2ccccc2O)C1=O 925142509 OGAJNIALJQAJQF-LSDHHAIUSA-N 348.399 1.598 10 10 EDCE COCC1(C)CN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 854296475 DQTUUPVJTGKQMV-AWEZNQCLSA-N 333.432 1.952 10 10 EDCE NC(=O)c1cccc2c1CCN(Cc1cc3c(cc1O)OCO3)C2 853621519 SSNKSIMSEBFWCG-UHFFFAOYSA-N 326.352 1.778 10 10 EDCE Cc1ccc(C(=O)N[C@H]2CCNC2=O)cc1-n1c(C)cc(C=O)c1C 862154043 XWDDXFJHEDJRRT-INIZCTEOSA-N 339.395 1.833 10 10 EDCE CN(C)c1cc(F)c(CN2CC(C3CS(=O)(=O)C3)C2)cc1F 895424168 PQGFHZYSORSHGJ-UHFFFAOYSA-N 330.400 1.507 10 10 EDCE COc1ccc(CNC(=O)C(=O)Nc2cc(OC)ccc2F)c(O)c1 797388008 SBLCBLUUNDXDRY-UHFFFAOYSA-N 348.330 1.803 10 10 EDCE COc1ccc(CNS(=O)(=O)c2nc(C)c(C)s2)c(O)c1 795357073 AFYOHLBCRRPXEL-UHFFFAOYSA-N 328.415 1.953 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)N1CC[C@@]12CCOC2 1327668087 NDINALXIYJURGM-AWEZNQCLSA-N 341.458 1.133 10 10 EDCE CCN1C[C@@H](C)N(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@@H]1C 1329437594 OCEYEKBBPNZSBP-QWHCGFSZSA-N 331.416 1.176 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@H](O)C(F)(F)C3)cc2F)CC1 1327939165 GCHBAGADKQWQEO-INIZCTEOSA-N 343.393 1.779 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](C)N(C(=O)CN(C)C(C)=O)C2)cc1C 1331953513 KCLTXLFSULRIIG-PBHICJAKSA-N 347.459 1.561 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2n[nH]c(C)c2O)cc1C 1267980602 LKQOCZOPVQIRMI-LLVKDONJSA-N 346.431 1.896 10 10 EDCE CC/C=C(/C)C(=O)NC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1354268165 FLPJQHLLEAGTBO-RDQDRAATSA-N 335.404 1.690 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CCO[C@@H]1C 1466398044 GVIHVOVZFVEZSK-MFKMUULPSA-N 341.791 1.972 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cn(C)nn2)cc1C 1716289378 HCTIHPTZFUBWSP-PLNGDYQASA-N 329.404 1.208 10 10 EDCE CCCc1nnc(SCC(=O)N[C@H](C)c2ccccc2O)n1N 1557966879 RYKGFQKIONOYPZ-SNVBAGLBSA-N 335.433 1.620 10 10 EDCE CN1CC[C@H](C(=O)NCc2c(O)cccc2O)[C@@H](c2cnn(C)c2)C1 1558536056 RPNNARCLFIDVCB-DZGCQCFKSA-N 344.415 1.183 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](NC(N)=O)C(C)C)C2)cc1 1638649223 DYBPRHCLTBQUQS-BBRMVZONSA-N 348.447 1.331 10 10 EDCE CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NCc1ccc(N)cc1 1120588728 CVOFDSUMSMRKLH-MRXNPFEDSA-N 347.463 1.011 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)[C@@H](N)Cc1ccc(O)c(O)c1 1952710795 OIFGMXXQVOWPQP-SMDDNHRTSA-N 326.393 1.507 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)O)C(C)(C)c1cc(O)nc(O)c1 1952887234 FFCYNWVMFFAVKW-NSHDSACASA-N 326.349 1.748 10 10 EDCE C[C@@H](C(=O)NCCN=[N+]=[N-])N1CCN(C(=O)OC(C)(C)C)CC1 1985094310 NDRSVMHIYRMSBT-NSHDSACASA-N 326.401 1.354 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NCc2c(O)cccc2F)[C@@H](O)C1 2005089251 ODFUDFZLJKKZMU-ZFWWWQNUSA-N 340.395 1.991 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@H](O)C(C)(C)C 2017669842 RFQUDDAVKMWWQZ-QWRGUYRKSA-N 341.412 1.808 10 10 EDCE OCCN(Cc1c(O)cccc1Br)C[C@@H]1CCCN1 706830367 SUGCINCPBGLJQV-NSHDSACASA-N 329.238 1.701 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3[C@H]4CCO[C@H]4C34CCCC4)c2n1 2064908317 WYXBKZLOWUAXRX-KCPJHIHWSA-N 342.399 1.821 10 10 EDCE OCc1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)c(Br)c1 2090115019 BGHVUJUYBCVCQV-ZIAGYGMSSA-N 328.206 1.123 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213586267 ABSHRHKSYDFOGK-IRCOFANPSA-N 339.396 1.704 10 10 EDCE COc1ccc(Br)c(CNC2(CN(C)C)COC2)c1O 2236041329 DSOZNJWVMSXDMW-UHFFFAOYSA-N 345.237 1.584 10 10 EDCE NC(=O)c1ccc(C=CC(=O)NCCc2ccc(O)c(O)c2)cc1 2301398129 CSRPWAWSEHAJGN-UHFFFAOYSA-N 326.352 1.569 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)cc1Br 2355334682 RJDMAUDHQFQHBI-KYQLBWAOSA-N 341.249 1.489 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@H]2CCC2(F)F)cc1C 1507199465 CGTFAGFFRIMGEY-UONOGXRCSA-N 342.386 1.616 10 10 EDCE CNC(=O)CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 184343994 JAPXWASGWQDNMR-MRXNPFEDSA-N 333.432 1.396 10 10 EDCE C[C@@H](N[C@@H]1CCc2ncnn2C1)c1ccc(N2CCOCC2)cc1 180578967 MXEKWOJJHAVMQB-GDBMZVCRSA-N 327.432 1.780 10 10 EDCE Cc1noc([C@H]2COCCN2Cc2ccc(N3CCOCC3)cc2)n1 188481803 WHRDTDYNMVUODU-QGZVFWFLSA-N 344.415 1.788 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NC[C@H]2CSCCS2)cc1 229577389 WMUDKGDZXXTGGA-ZDUSSCGKSA-N 348.515 1.416 10 10 EDCE COCCN1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])CC1 255292664 KNAVMDIOGJGMFB-XQRVVYSFSA-N 349.387 1.549 10 10 EDCE Cc1ccc(CN2CCN(CC(N)=O)CC2)c(O)c1Br 2381140268 IGWOZWHGLLXTGF-UHFFFAOYSA-N 342.237 1.066 10 10 EDCE COc1ccc(N(C)C[C@H]2CCN(S(C)(=O)=O)C2)cc1OC 801512678 YAIUGBVHAQEPJS-GFCCVEGCSA-N 328.434 1.422 10 10 EDCE CCOc1ccc(CN[C@@H]2CCC[C@H]2CNS(C)(=O)=O)c(O)c1 800309413 ITLUZCLKMMCZOK-SWLSCSKDSA-N 342.461 1.598 10 10 EDCE O[C@H]1CCN(C2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)C1 827700851 YESDBNPVUNTVDH-FQEVSTJZSA-N 345.487 1.554 10 10 EDCE CC1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CO1 827159176 YOSVIWOFYQIMFF-HNNXBMFYSA-N 345.443 1.587 10 10 EDCE Cc1ccc(O)c(CNC(=O)[C@@H]2CC[C@H](CN3CCOCC3)O2)c1 827165763 AQYLVPDGNXFAHK-WBVHZDCISA-N 334.416 1.197 10 10 EDCE Cn1ncc(CCC(=O)NCc2cc(Br)ccc2O)n1 831933076 SOYPVZXEUNPHIN-UHFFFAOYSA-N 339.193 1.532 10 10 EDCE COC(=O)[C@H](NCc1cc(F)cc(C(C)=O)c1O)c1ccnn1C 830383603 URTOQXFFGYLGLK-CQSZACIVSA-N 335.335 1.471 10 10 EDCE C[C@@H]1CN(CCO)CCN1C(=O)NCc1ccc(N2CCCC2)cc1 837627505 VXXBGHHQFXQIEN-MRXNPFEDSA-N 346.475 1.495 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]3COCC[C@@H]32)cc1 839502759 KVGTVTXRGBKORQ-WMZOPIPTSA-N 331.460 1.870 10 10 EDCE COc1ccc(N2CCN(C(=O)CCSCC(=O)O)CC2)cc1 911093836 CGUZPUMHMJTDQV-UHFFFAOYSA-N 338.429 1.552 10 10 EDCE COc1cccc(N2CCN(CCSCC(=O)C(C)=O)CC2)c1 918730679 MAECTWKWDXMBPY-UHFFFAOYSA-N 336.457 1.709 10 10 EDCE COc1cc(Br)cc(CN2CCO[C@H]([C@H](C)O)C2)c1O 840979108 YZKZRAJVMKUSOD-ZANVPECISA-N 346.221 1.745 10 10 EDCE O=C(NCc1ccc(N2CCSCC2)cc1)[C@]12CNC[C@H]1COC2 846673463 UFYQHGNLEAYKMT-YJBOKZPZSA-N 347.484 1.092 10 10 EDCE Cc1cc(N2CC[C@@H](OC(=O)c3cccc(O)c3O)C2=O)n(C)n1 758582988 VFNHOWSPDPJLNI-GFCCVEGCSA-N 331.328 1.102 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)Cn3cncn3)C2)cc1 852061365 RMTIOQGBPWZDFQ-KBPBESRZSA-N 344.419 1.253 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3c(C)nn(C)c3OC)C2)cc1 855230717 IKHKTCDBNJZDEF-CYBMUJFWSA-N 344.415 1.754 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@]3(C)CCCNC3)C2)cc1 851662906 NMNGIKZKYJKLAK-BEFAXECRSA-N 346.475 1.963 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCC[S@@](=O)CC(F)(F)F 854307626 RBNSDTILYCDGII-JOCHJYFZSA-N 338.351 1.845 10 10 EDCE COC[C@@H](NC(=O)NCc1ccc(N(C)C)cc1)C1CCOCC1 852468225 MCAWRVLCNLMIEA-QGZVFWFLSA-N 335.448 1.993 10 10 EDCE CCOc1ccc(NC(=O)C(=O)NCCc2ccc(N)cc2)nc1C 850822971 YMEZYZIWOXTVDL-UHFFFAOYSA-N 342.399 1.668 10 10 EDCE CCOc1cc(O)ccc1NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 863408899 STXWWFNGUDZDRR-UHFFFAOYSA-N 342.333 1.233 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@](O)(C4CC4)C3)C2)cc1 1118545088 IFZADAZVBQXAET-DNVCBOLYSA-N 345.443 1.830 10 10 EDCE C[C@H](NC(=O)c1ccccc1)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773755558 DFPNQJSPNYSPEK-OLZOCXBDSA-N 342.395 1.964 10 10 EDCE COC(=O)c1c(CN2CCn3cnnc3C2)c2cc(F)ccc2n1C 894013500 QSVKDJYJRRHUQM-UHFFFAOYSA-N 343.362 1.711 10 10 EDCE Cn1nccc1S(=O)(=O)NCc1cc(Br)ccc1O 796191630 YDVSECXAUWKGLA-UHFFFAOYSA-N 346.206 1.367 10 10 EDCE Nc1c(C(=O)NCc2cc(O)ccc2O)cnn1-c1ccccn1 1153886143 YDHFYXRDFWUKDA-UHFFFAOYSA-N 325.328 1.191 10 10 EDCE O=C1NC(=S)S/C1=C/c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1 1088671248 ZYLBSRQJJMACGN-XVNBXDOJSA-N 327.299 1.697 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCCN=[N+]=[N-])[C@H]1CCOC1 1964880596 RNOCTMHDFHFNLR-WDEREUQCSA-N 327.385 1.733 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@H](C)C2CC2)cc1C 1332487271 GBJVUDYYWJCRSX-RHSMWYFYSA-N 334.460 1.959 10 10 EDCE O=C1C[C@H](C(F)(F)F)[C@H](C(=O)NCc2cccc(O)c2O)CN1 1347542166 KSQXKPSRENIWKF-BDAKNGLRSA-N 332.278 1.029 10 10 EDCE CN(CCNCc1cnn(C)c1)C(=O)c1ccc(N=NC(N)=O)cc1 1267476516 GFPDEADHMQZEIA-UHFFFAOYSA-N 343.391 1.444 10 10 EDCE CC(C)[C@H](NS(C)(=O)=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1264827375 ZRDFMVNVORCIFF-AWEZNQCLSA-N 345.440 1.082 10 10 EDCE COC(=O)[C@H]1CN(C(=O)/C=C/c2cn(C)cn2)c2ccccc2O1 1352671117 MUCUELVPJIHKMX-MVGZEHJDSA-N 327.340 1.401 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)CC1CC1 1285616027 SYQOWAIIIUBILC-SNVBAGLBSA-N 331.376 1.884 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3OC(=O)N[C@@H]3C2)c(Br)c1 2120416770 QHVCXUDHCYGXNG-KOLSJAJHSA-N 327.178 1.799 10 10 EDCE COC(=O)c1cnc(SC[C@](O)(C(N)=O)c2ccccc2)s1 1559416276 CFILBKUBKMWWAH-CQSZACIVSA-N 338.410 1.395 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@H]2CCC(=O)N2)C2CC2)cc1C 1490642393 QPPDHRPUWNNRFB-HZPDHXFCSA-N 345.443 1.267 10 10 EDCE CS(=O)(=O)c1ccccc1CCNC(=O)c1cc(O)cs1 1637702495 ADLOVCRKSGVZLL-UHFFFAOYSA-N 325.411 1.830 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2oncc2C)cc1C 1568585991 DKMUCVGDBQDGEM-AWEZNQCLSA-N 333.388 1.181 10 10 EDCE Cn1nc(Br)cc1C(=O)NCc1c(O)cccc1F 1638862592 CHUFNPKMGOHPQL-UHFFFAOYSA-N 328.141 1.957 10 10 EDCE O=C(CCN1CC[C@H](F)C1)NCc1ccc(N2CCC(O)CC2)cc1 1646434322 CPVFGUKJCVNDPQ-INIZCTEOSA-N 349.450 1.698 10 10 EDCE CO[C@H](C)C(=O)NC[C@@H](C)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1678095789 IDVUMJUAIOACKH-GHMZBOCLSA-N 349.391 1.461 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)[C@@H](C)CO)c(Br)cc21 122535602 CMHFNTZKWREQSS-MADCSZMMSA-N 328.210 1.479 10 10 EDCE CCO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCCN=[N+]=[N-] 1985095607 GUTXLJPUUIMVRI-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCC(CN=[N+]=[N-])CC1 1985102061 BDWADJSNERLEAU-NSHDSACASA-N 327.385 1.421 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CN1CCC[C@H](NC(=O)OC(C)(C)C)C1 2010388722 GEJRAVMOQOHFGX-LBPRGKRZSA-N 340.428 1.744 10 10 EDCE O=C1NC[C@H]2CN(Cc3cc(Br)cc(F)c3O)CC[C@H]12 2157179454 PBIIZBXHEUTSJI-ONGXEEELSA-N 343.196 1.862 10 10 EDCE NCc1ccc(N2C[C@@H]3[C@@H](CO)CO[C@H]3C2)c(F)c1Br 2178086807 NQIHTPWGYXDVFC-UMNHJUIQSA-N 345.212 1.490 10 10 EDCE CCNCc1ccc(N2C[C@@H]3OC(=O)N[C@@H]3C2)cc1Br 2176921560 SBMYLGSOVSFWNX-OLZOCXBDSA-N 340.221 1.856 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)C(F)(F)F)CN1C(=O)c1ccc(O)c(O)c1 2054401433 RVHFIWCJGSKVFB-SCZZXKLOSA-N 346.305 1.769 10 10 EDCE C[C@]1(CO)COCCN1c1cc(Br)c(CN)cc1F 2112705633 MAAUIHCOZRDHGV-ZDUSSCGKSA-N 333.201 1.635 10 10 EDCE CN(C)c1ccc([C@@H](NN)c2nc(Br)nn2C)cc1 2116535187 ZTORNWYDLQOZOF-SNVBAGLBSA-N 325.214 1.196 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213589542 GRHXEXVOVAIDNT-HBNTYKKESA-N 341.412 1.998 10 10 EDCE COc1ccc(Br)c(CN[C@H]2C[C@H](OC)[C@H](O)C2)c1O 2236052417 HFYBABHAEWEUQM-DYLAAIIWSA-N 346.221 1.791 10 10 EDCE COc1ccc(Br)c(CN2CCOC[C@H](N)C2)c1O 2227740716 FUTATCSISKXABO-SECBINFHSA-N 331.210 1.323 10 10 EDCE Nc1ccc(NC(=O)N2CCC(NC(=O)C(F)(F)F)CC2)cc1 2249487773 JMHYVEJTFPBZQT-UHFFFAOYSA-N 330.310 1.944 10 10 EDCE CNCc1ccc(N2CC[C@H](O)[C@H](O)CC2)c(Br)c1 2269139554 TYZDHCHBLBVIQB-OKILXGFUSA-N 329.238 1.491 10 10 EDCE COc1ccc(N2C(=O)C(=Cc3cccn3C)C(=O)NC2=S)cc1 2296376884 RQBAEMOPAPRGNU-UHFFFAOYSA-N 341.392 1.865 10 10 EDCE Cc1ccc(CN2CC(=O)N[C@@H]3CC[C@H]32)c(O)c1Br 2352652056 OLGHSWJRSBBZMM-GHMZBOCLSA-N 325.206 1.926 10 10 EDCE Cc1ccc(CNCCc2cn(C)nn2)c(O)c1Br 2352678925 JLTCETLCWBLZAM-UHFFFAOYSA-N 325.210 1.924 10 10 EDCE Cc1ccc(CN2C[C@H](O)[C@H](O)[C@H]2CF)c(O)c1Br 2352686040 IKHMIOLVNCZKRZ-GBIKHYSHSA-N 334.185 1.339 10 10 EDCE Cc1ccc(CN[C@H]2CS(=O)(=O)C[C@H]2C)c(O)c1Br 2352692604 JREQKZUWPCGUQV-KOLCDFICSA-N 348.262 1.986 10 10 EDCE Cc1cc(CN2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)on1 170906613 GCECDPBBSNBCPN-UHFFFAOYSA-N 332.360 1.915 10 10 EDCE COc1ccc(N2CCN(C(=O)CN3[C@H](C)COC[C@H]3C)CC2)cc1 77365674 WZEBKWYRFQNXEP-HZPDHXFCSA-N 347.459 1.453 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)NC2CC2)N2CCOCC2)cc1 36075785 PPYHXZZJBQJDOL-KRWDZBQOSA-N 332.448 1.588 10 10 EDCE CNC(=O)COc1ccc(/C=C2\SC(=S)NC2=O)cc1OC 39794041 UZXIXGWZBZGKJJ-WDZFZDKYSA-N 338.410 1.309 10 10 EDCE C[C@H](N[C@H]1CCc2ncnn2C1)c1ccc(N2CCOCC2)cc1 180578984 MXEKWOJJHAVMQB-HOCLYGCPSA-N 327.432 1.780 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)NCC(F)(F)F 192009443 OVXAELFSXBTKNA-UHFFFAOYSA-N 339.383 1.971 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@@H]2CCCn3nc(C)nc32)c1 83724432 QWPIOJJKEAFJAH-CYBMUJFWSA-N 331.376 1.635 10 10 EDCE CC(=O)N(c1ccc(N)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 244054973 TVISMFOAGULMBE-UHFFFAOYSA-N 335.341 1.919 10 10 EDCE CN(C)S(=O)(=O)N1CCCN(Cc2c(O)cccc2Cl)CC1 367973225 OGPLNNNSMOCOQW-UHFFFAOYSA-N 347.868 1.360 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cc(C)cc(C)c1 808533594 RZQVTLDKFGVBIP-MRXNPFEDSA-N 345.395 1.999 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)C2C[C@H]3CNC[C@@H](C2)C3=O)c1 828666774 IIDFEQBZFZKKNF-WODVXLOZSA-N 332.400 1.393 10 10 EDCE CNS(=O)(=O)CCCN(Cc1ccc(N(C)C)cc1)C(C)C 734847128 DEUUEIDSROFDIL-UHFFFAOYSA-N 327.494 1.902 10 10 EDCE O=C(O)[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CC1 849364479 KXOOQHVKBAANMF-HNNXBMFYSA-N 336.363 1.389 10 10 EDCE COc1cc(NS(=O)(=O)C[C@@H](OC)C2CCOCC2)ccc1O 842586547 VGJYKKVVXWBCNA-OAHLLOKOSA-N 345.417 1.584 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)C12CCN(CC1)C2 911304638 XESUEXQGHHXQCW-UHFFFAOYSA-N 332.400 1.380 10 10 EDCE COC(=O)[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1ccc(O)cc1 1153804282 WPCCMOMTUHWZFO-SIHDSBSPSA-N 343.335 1.847 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC3CCN(OC)CC3)C2)cc1 852385178 LSANUACZTNIODD-OAHLLOKOSA-N 348.447 1.599 10 10 EDCE C[C@H](NC(=O)NCC[C@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 922055147 MYLCRZCHKPIKMW-KBPBESRZSA-N 332.448 1.981 10 10 EDCE CC(=O)N1CCO[C@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)C1 935994208 WNCUNIGBBDOCGR-LBPRGKRZSA-N 347.198 1.563 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)C1(n2cccn2)CC1 930519615 MNKOGCGIDZSBGT-UHFFFAOYSA-N 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C[C@@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)N1CC(NC(=O)OC(C)(C)C)C1 2014687020 UBIIKVIWFSDURT-QWRGUYRKSA-N 338.412 1.495 10 10 EDCE OC[C@H]1C[C@@H](O)CN1c1ccc(CNC2CC2)cc1Br 698202117 VWTDUTWXLZUEOE-CHWSQXEVSA-N 341.249 1.633 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@H]4COC[C@@H]43)c(Br)cc21 2186370561 JKZSAVYEIRCVJC-PAWXDDDFSA-N 338.205 1.497 10 10 EDCE CN(C)[C@@H]1CN(c2ccc(CN)c(Br)c2F)C[C@H]1O 2089923892 ROJRAFNVCFVROH-GHMZBOCLSA-N 332.217 1.158 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2213582457 HXLLZFNGIYSHEK-SSOKKCIESA-N 339.396 1.752 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(NC(=O)Cc2ccc(N)cc2)C1 2216758669 XJDFCOMDRDBJQD-SCLBCKFNSA-N 331.416 1.937 10 10 EDCE O=C(O)CN(Cc1cc(Br)ccc1O)[C@H]1CCOC1 2272415824 PFGBQCAHEZHQOP-NSHDSACASA-N 330.178 1.830 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H](O)C[C@@H](F)C3)c(Br)cc21 2234659204 DVEBTMDLUKSWRU-KEHGIVTQSA-N 344.184 1.310 10 10 EDCE NCc1ccc(N2C[C@H]3COC[C@@]3(CO)C2)cc1Br 2226162594 DSWJFAUXYQHODO-FZMZJTMJSA-N 327.222 1.353 10 10 EDCE COc1ccc(C=C2C(=O)NC(=O)N(C(C)(C)C)C2=O)c(OC)c1 2297312823 CJKYNSZRILSZMR-UHFFFAOYSA-N 332.356 1.964 10 10 EDCE CNC(=O)C(C)(C)CNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2302552867 CMASNLBIXJHYSP-UHFFFAOYSA-N 345.443 1.425 10 10 EDCE COCCNC(=O)C1=C2CCCN2c2ccc(F)cc2S1(=O)=O 65239751 YJORCJROWPQFSO-UHFFFAOYSA-N 340.376 1.187 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@](O)(C(F)(F)F)C3)cc2N1 301679467 IXJVGQRNBSMDMU-GFCCVEGCSA-N 347.249 1.429 10 10 EDCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NCC(=O)N1CCCC1 121330069 ZHBAPXCVMCTBOU-UHFFFAOYSA-N 326.356 1.603 10 10 EDCE C[C@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@@H]1N1CCOCC1 180229045 PJPBBIRPWMPIIM-PXNSSMCTSA-N 345.487 1.676 10 10 EDCE CCN(CC)C(=O)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 41428783 HJOATKOJYUQCPV-UHFFFAOYSA-N 348.447 1.395 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)c3ccnnc3)cc2F)CC1 131556978 TZQSJCOQZBMDPE-UHFFFAOYSA-N 343.406 1.688 10 10 EDCE CC1C[C@H](C)N(C[C@@H]2SC(=S)N(C3=NCCN3)C2=O)[C@@H](C)C1 255973373 GBGCKHIHKBAUFI-SRVKXCTJSA-N 340.518 1.683 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@@H]3CCOC3(C)C)CC2)cc1 295331002 XDBNNPHOQVYUFD-QGZVFWFLSA-N 347.459 1.501 10 10 EDCE Cc1cc(Br)cc(CN2CCC(CO)(CO)C2)c1O 827475315 WYUKTDNVCXHSIR-UHFFFAOYSA-N 330.222 1.640 10 10 EDCE O=C(OCC(=O)N1CCO[C@H]2CCCC[C@@H]21)c1cc(O)cs1 732355118 DGLVODGZOBPFGJ-RYUDHWBXSA-N 325.386 1.781 10 10 EDCE COC[C@@H]1CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])C[C@H](C)O1 844212037 OVNPZIUTFCLHQU-RKLVJPFCSA-N 336.344 1.933 10 10 EDCE O=C(O)/C=C/c1ccc(N2CCC(OCCO)CC2)c([N+](=O)[O-])c1 844212336 GCVAUFYTVXZRNO-DUXPYHPUSA-N 336.344 1.670 10 10 EDCE CNC(=O)Cc1nc(CN2CCCc3cc(CN)ccc32)cs1 844220639 ZWVVMSJDQGKYMI-UHFFFAOYSA-N 330.457 1.843 10 10 EDCE C[C@@H]1C[C@H]1N1C[C@H](NC(=O)NCc2cc(Cl)ccc2O)CC1=O 845025778 ISWBCZBLDRQRGQ-OASPWFOLSA-N 337.807 1.854 10 10 EDCE C[C@H](NC[C@@H](O)c1ccnn1C)c1ccc(N2CCOCC2)c(F)c1 927135309 XSVMKCSHUTYSKI-SCLBCKFNSA-N 348.422 1.780 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccoc3CC(N)=O)C2)cc1 855224380 FUZJZGJJCBVOKS-LBPRGKRZSA-N 343.383 1.325 10 10 EDCE CCON(CC)C(=O)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 858368278 HSBHDULYMUYAFV-CYBMUJFWSA-N 336.436 1.913 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc(=O)n(C)c3)C2)cc1 855229900 APPWVQHDJVNQBQ-AWEZNQCLSA-N 327.384 1.403 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3nnn(C(C)(C)C)n3)C2)cc1 855224499 KZVDBQAHXPPDMJ-GFCCVEGCSA-N 344.419 1.445 10 10 EDCE CCN(CC)c1ccc(CNC(=O)CC2CS(=O)(=O)C2)cc1F 865637018 TTYJUJOWVNIKFM-UHFFFAOYSA-N 342.436 1.723 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2cc3c(cc2O)CCC3)C1 863339676 FIJQHKFXCWNYEJ-CYBMUJFWSA-N 338.473 1.642 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)Cc2ccccc2C(=O)O)cc1 864609334 SHPPMQYITMPXNH-QGZVFWFLSA-N 341.411 1.810 10 10 EDCE CN(Cc1cc2c(cc1O)OC[C@H]2O)CC(C)(C)S(C)(=O)=O 768465406 LAIKANZWVUPHTM-CYBMUJFWSA-N 329.418 1.073 10 10 EDCE Cc1c(C(=O)N[C@@H](C)c2ccccc2O)nnn1C1CCNCC1 870988438 PJGFQTYREWIGCI-NSHDSACASA-N 329.404 1.708 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc(O)cs2)[C@@H](O)C1 871181306 PANOLDXOFCSCGL-QWRGUYRKSA-N 342.417 1.554 10 10 EDCE 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O=C(C(=O)N1CCC[C@H]1c1ccncc1)N1Cc2cccc(O)c2C1 1351816582 CACGSDQSMPKOPS-INIZCTEOSA-N 337.379 1.993 10 10 EDCE CCN(CCS(C)(=O)=O)C(=O)c1ccc(N=NC(N)=O)cc1 1446278205 NSSCSTREYZUDFJ-UHFFFAOYSA-N 326.378 1.356 10 10 EDCE COC(=O)c1ccccc1OC(=O)CCN1C(=O)CSC1=S 1865774522 MUQLHABORQRNLR-UHFFFAOYSA-N 339.394 1.629 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CC[C@H]1CC[C@@H](C(N)=O)O1 1627028439 HQZVTSMIVKPJTC-FZMZJTMJSA-N 341.404 1.307 10 10 EDCE C[C@H](O)CCCN1CC(CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1714982681 SSKPMBLIQAVBNE-LBPRGKRZSA-N 347.419 1.672 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)C[C@H](C)NC(N)=O)C2)cc1C 1713922684 NLCYTSLLNIXHSJ-ZFWWWQNUSA-N 348.447 1.141 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C1=C2CCCN=C2NN1 1624322139 OWABQMPGFGSYLJ-UHFFFAOYSA-N 325.416 1.457 10 10 EDCE C[C@H]1CN(C(C)(C)CNC(=O)Cc2ccc(O)c(O)c2)C[C@@H](C)O1 1629103196 MBAUSGSODRZDOM-BETUJISGSA-N 336.432 1.644 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(C=O)c[nH]1 1638529784 VRQGTQIWKLDVGR-UHFFFAOYSA-N 330.340 1.738 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccc2nnc(S)n2c1 1631509937 IBOGLHFBLVTAOA-UHFFFAOYSA-N 330.369 1.402 10 10 EDCE CCS(=O)(=O)c1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1 1568417775 GNQCXVWKAHTSMU-UHFFFAOYSA-N 349.408 1.750 10 10 EDCE C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cnccn1 1570802678 PJISSWUKVISNGN-VIFPVBQESA-N 336.373 1.045 10 10 EDCE COc1ccc(NC(=O)CN2C(=O)[C@@H](C)SC2=S)c(OC)c1 11635482 LMRSTVRSYNADTK-MRVPVSSYSA-N 340.426 1.891 10 10 EDCE CNCc1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)cc1Br 2146322214 YDQCSPXPLLUVDJ-GASCZTMLSA-N 341.249 1.350 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C[C@H](CO)C1 2018277823 GYHZRVWEGHRHDX-ZIBATOQPSA-N 339.396 1.563 10 10 EDCE CNCc1ccc(N2CC[C@H]3C(=O)NC[C@@H]3C2)c(Br)c1 2157188839 APOCRGUODUFJAV-VXGBXAGGSA-N 338.249 1.741 10 10 EDCE CNCc1ccc(N2CCC(O)(CO)CC2)c(Br)c1 314341296 HEXGZCVJLSQUCY-UHFFFAOYSA-N 329.238 1.492 10 10 EDCE C[C@@H](N)c1ccc(N2CCC(O)(CO)CC2)cc1Br 314408962 PFTURFOCVSGBKP-SNVBAGLBSA-N 329.238 1.792 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](N3CC(O)C3)C2)c(Br)c1 2158747522 YQXVDLBHQYNXCY-PWSUYJOCSA-N 341.249 1.758 10 10 EDCE NCc1ccc(N2CC[C@H](N3CC(O)C3)C2)c(F)c1Br 2158751930 TXJUHGZSHRTCSK-JTQLQIEISA-N 344.228 1.302 10 10 EDCE CNC(=O)CN1CCN(Cc2ccc(Br)cc2O)CC1 700802511 TYCPUEHDYZYJJZ-UHFFFAOYSA-N 342.237 1.018 10 10 EDCE NCc1ccc(N2CC[C@@H](N3CCOC3=O)C2)cc1Br 2171696386 LBENVMRKZYVOFO-GFCCVEGCSA-N 340.221 1.939 10 10 EDCE CO[C@H]1CN(Cc2ccc(Br)cc2O)C[C@@H]1C(=O)O 691436443 IFIUFUULOXPTHS-JQWIXIFHSA-N 330.178 1.686 10 10 EDCE C[C@H](N)c1ccc(N2CC3(CNC(=O)N3C)C2)cc1Br 2177693132 FOFJXRGXUHLEBM-VIFPVBQESA-N 339.237 1.683 10 10 EDCE O=S1(=O)CC[C@@H]2CN(Cc3cccc(Br)c3O)C[C@H]21 2088813732 BLTSQKBRXAWTTQ-BXKDBHETSA-N 346.246 1.774 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213589022 CXXCWAVJCIRJQV-WOPDTQHZSA-N 340.428 1.789 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@@H]3CNC[C@H]32)c1O 2236053597 XCPFAUSIDIXTMU-DGCLKSJQSA-N 343.221 1.336 10 10 EDCE CC(=O)NCCCOC(=O)/C=C/c1ccc(N2CCOCC2)cc1 66656275 OPKZPESVHAVZIE-VMPITWQZSA-N 332.400 1.606 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CN2CCC[C@@H](CN3CCOCC3)C2)c1 69859049 ZIKABZBTTYMBDC-AWEZNQCLSA-N 335.404 1.845 10 10 EDCE O=C(O)/C=C\c1ccc(N2CCNC(=O)CC2)c(Br)c1 312202018 OCLTXCYFJYIDFT-RQOWECAXSA-N 339.189 1.873 10 10 EDCE COc1ccc(/C=C2/SC(=S)N(CCO)C2=O)cc1OC 210386536 LEOWXLVKXBGRGZ-XYOKQWHBSA-N 325.411 1.897 10 10 EDCE COc1cccc(CNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3C)C2)c1O 374201221 IAOQBSUVMVLICI-CYZMBNFOSA-N 333.388 1.209 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC[C@H](c3nc(=O)[nH][nH]3)C2)c1O 289525632 VYNOLECXLSPONS-JTQLQIEISA-N 334.351 1.525 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C=C[C@H]2C(=O)O)c(O)c1Br 2380721469 KUCBECGDDKUTTA-VHSXEESVSA-N 340.173 1.966 10 10 EDCE CNc1cc(=NCc2ccc(C)c(Br)c2O)[nH]c(=N)[nH]1 2380745326 OSXINOHPRJVIRO-UHFFFAOYSA-N 338.209 1.741 10 10 EDCE COc1ccc(CN[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)cc1C 808424733 UUUMLYKPWCRDDY-OAHLLOKOSA-N 341.477 1.364 10 10 EDCE CCOC1(C)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 833331260 YLCAWGIWTBLSLS-UHFFFAOYSA-N 328.390 1.015 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C[C@]1(O)CCCN(C)C1 910557447 ASLYGUKPBAAHKI-OXJNMPFZSA-N 347.503 1.955 10 10 EDCE CN1CCC[C@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 919657624 SKEIDNRUKUQDIM-KRWDZBQOSA-N 346.475 1.759 10 10 EDCE COc1ccc(N(C)CCN(C)CCCCS(C)(=O)=O)cc1 844400629 DVHGGRQGZCOOBD-UHFFFAOYSA-N 328.478 1.888 10 10 EDCE COc1ccc(N2CCC(N3C(=O)N[C@H](CCF)C3=O)CC2)cc1 844714511 OVPZRIQTGLAZOH-OAHLLOKOSA-N 335.379 1.944 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@]1(O)CCOC1 845447224 BCGJJMFPCCRING-SFHVURJKSA-N 335.448 1.826 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)C(OC)OC)C2)cc1 923186843 KDKGETKNSABNMH-CHWSQXEVSA-N 337.420 1.581 10 10 EDCE O=C(NCC[C@]1(O)CCOC1)NCc1c(O)ccc2c1CCCC2 845453460 RZKUIBUXOUTTNP-SFHVURJKSA-N 334.416 1.612 10 10 EDCE CCN(CC)c1ccc(CNC[C@]2(OC)CCS(=O)(=O)C2)cc1 922615258 MLBKEDOCOPTOCU-QGZVFWFLSA-N 340.489 1.826 10 10 EDCE CCOC(=O)[C@H]1CCCN(CC(=O)NCc2c(O)cccc2F)C1 928710504 UANMZGNDBKKPRJ-LBPRGKRZSA-N 338.379 1.423 10 10 EDCE O=C(NCc1c(O)cccc1F)N[C@H]1CCCN2CCSC[C@H]12 925169821 LILQISKUWKTDQW-UONOGXRCSA-N 339.436 1.910 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCCN(C)C3)C2)cc1 852186766 HZEYBYGOOIJLJS-LSDHHAIUSA-N 332.448 1.667 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(N2CCOCC2)CC1 865026890 BZOHKTJOGOUUCE-UHFFFAOYSA-N 331.460 1.966 10 10 EDCE C[C@]1(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1(F)F 1118625639 JQAMCRVNZLYKHL-QGZVFWFLSA-N 349.381 1.841 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCN(CC(F)(F)CO)CC2)c1O 878832516 NZSDOBFNQCSARU-UHFFFAOYSA-N 346.349 1.479 10 10 EDCE COC(=O)[C@]1(N2CCN(Cc3cc(C)ccc3O)CC2)CCOC1 1118884395 WTJCKJLGWNFTSH-SFHVURJKSA-N 334.416 1.150 10 10 EDCE COC[C@@H](NCc1cc(OC)c(OC)cc1O)[C@H]1CCCOC1 895854950 OGIWWSYJWKDWIY-GXTWGEPZSA-N 325.405 1.941 10 10 EDCE CN1CCN(c2ccc(CNC(=O)Cc3ccnc(F)c3)cc2)CC1 1303084367 FURGZBUKVUQBET-UHFFFAOYSA-N 342.418 1.831 10 10 EDCE NC(=O)[C@H]1C[C@H](NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 1313020982 JAGUHIZYGMBNQO-KKUMJFAQSA-N 347.415 1.347 10 10 EDCE CCC(=O)N[C@H](C)C(=O)NC[C@H](C)NCc1ccc(OC)c(C)c1 1317242292 QGTBRMFWTAZNFV-UONOGXRCSA-N 335.448 1.513 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC2(CC1)CC2(F)F 1329497342 NMUAQYGAMICNNH-UHFFFAOYSA-N 336.338 1.882 10 10 EDCE CNS(=O)(=O)Nc1ccc(NC(=O)c2cccc(O)c2O)cc1 1297139271 DAYMRAOCHZTGGZ-UHFFFAOYSA-N 337.357 1.226 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1ccc(N2CCCC2)nc1 1464015435 NAZNHEJJUCTWOM-UHFFFAOYSA-N 327.384 1.952 10 10 EDCE O=C(/C=C/[C@H]1CCOC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1465420635 KIYVYNJUEHOBSG-PMUGQKEBSA-N 348.418 1.996 10 10 EDCE C[C@@H]1C[C@@H]1C(=O)NC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1533354803 PACUKZYJJURHFK-FCAQMBHFSA-N 343.387 1.907 10 10 EDCE Cc1nc([C@H](NC(=O)c2cccc(O)c2O)c2cnn(C)c2)no1 1628637042 HBDXVIAKANHCPJ-GFCCVEGCSA-N 329.316 1.042 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cccc(-n3cncn3)n2)c1 1566374302 CGOSLWLWSMTDLB-NSHDSACASA-N 339.355 1.868 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C[C@@H]2CCC(=O)N2)cc1C 1732913155 VSPNESBOYSTFIZ-CWDCEQMOSA-N 345.443 1.434 10 10 EDCE CCCC(=O)NC[C@H]1CC[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1736084478 TWMJAFUOFZURFU-GXTWGEPZSA-N 349.431 1.914 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCN(Cc3ccnn3C)CC2)c1O 1655108714 BAXVVDNHAJWSRY-UHFFFAOYSA-N 346.406 1.785 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCC(C(N)=O)CC2)c([N+](=O)[O-])c1 1772821448 RWEAIQODWNPLEN-HYXAFXHYSA-N 333.344 1.483 10 10 EDCE CCOC(=O)N1CCC(NC(=O)[C@@H](C)Oc2ccc(N)cc2)CC1 1860082791 UGICOLRYPDJQOC-GFCCVEGCSA-N 335.404 1.773 10 10 EDCE CN1C(=O)C(=Cc2ccc(OC[C@H]3CCCO3)cc2)C(=O)N(C)C1=O 14175570 FVKFABQBHSXUOZ-CQSZACIVSA-N 344.367 1.678 10 10 EDCE O=C1N[C@@]2(CNCc3cc(Br)ccc3O)CC[C@H]1C2 1967817533 QDOAIGPNILUTEJ-XPTSAGLGSA-N 325.206 1.913 10 10 EDCE O=C(O)C[C@H](NC(=O)OCc1ccccc1)c1cc(O)nc(O)c1 1951656632 DWFTVDCVPLTXRT-LBPRGKRZSA-N 332.312 1.935 10 10 EDCE CO[C@@H](c1cc(O)c(O)c(O)c1)[C@@H](NC(=O)OC(C)(C)C)C(=O)O 1952306355 LAVDYNVUYQTULM-PWSUYJOCSA-N 343.332 1.469 10 10 EDCE CCO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)N1CC(N=[N+]=[N-])C1 1985102651 KBIIDOCZSNJQHP-LLVKDONJSA-N 327.385 1.827 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3[C@@H](C2)OCCN3C)cc1Br 2153995291 QEKPOECYLYAJLZ-NZVBXONLSA-N 340.265 1.988 10 10 EDCE CN(Cc1ccc(N)cc1)C(=O)[C@H](CO)CNC(=O)OC(C)(C)C 2022916627 KDUAUENFEGJOQQ-ZDUSSCGKSA-N 337.420 1.360 10 10 EDCE O=C(O)CN(CCNC(=O)c1cccc(O)c1O)Cc1ccccc1 2035463818 WAFBLXQBPHSILA-UHFFFAOYSA-N 344.367 1.414 10 10 EDCE CNC(=O)NC1CCN(c2ccc(CN)cc2Br)CC1 702142372 AMCAVDQXRWICQP-UHFFFAOYSA-N 341.253 1.806 10 10 EDCE Nc1ccc(CS(=O)(=O)NCC2CN(Cc3ccccc3)C2)cc1 716251703 NWDCPCXZJZXLGD-UHFFFAOYSA-N 345.468 1.820 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H]3CC[C@@H](C(F)(F)F)O3)c2n1 2062333008 ZJPBUYLDWGXCNN-SCZZXKLOSA-N 344.293 1.583 10 10 EDCE COc1cccc2c1CCN(C(=O)c1cnn3c(O)cc(C)nc13)C2 2064869916 IVOKTNYVCMXTDY-UHFFFAOYSA-N 338.367 1.950 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)c(Br)c1 2178085179 CXGPSLOCZFIQAO-LIBKGXAOSA-N 341.249 1.912 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H]1Cc2nc[nH]c2CN1C(=O)OC(C)(C)C 2060616590 CLLLVHSAIPUNER-GFCCVEGCSA-N 349.395 1.840 10 10 EDCE CN1C[C@@H]2C[C@H](C1)N2c1cc2c(cc1Br)[C@H](N)C(=O)N2 2187625399 QIWANPFMTZWDHF-DAROEXNTSA-N 337.221 1.294 10 10 EDCE O=C(NCc1nccn1Cc1ccccc1)c1cc(O)c(O)c(O)c1 2068624599 QVLNCGIBXUVQJC-UHFFFAOYSA-N 339.351 1.978 10 10 EDCE O=S1(=O)CC[C@H]2CN(Cc3cccc(Br)c3O)C[C@@H]21 2088813733 BLTSQKBRXAWTTQ-CABZTGNLSA-N 346.246 1.774 10 10 EDCE Oc1cccc(Br)c1CN1CCOCCC12CNC2 2111334873 YVLVIHLXQVDRHJ-UHFFFAOYSA-N 327.222 1.719 10 10 EDCE Oc1ccc(CCN=c2[nH]c(F)ncc2Br)cc1O 2091743115 LSZQKZZKHOWMFT-UHFFFAOYSA-N 328.141 1.866 10 10 EDCE CN(c1cc(Br)c(CN)cc1F)[C@@H]1CCCNC1=O 2114631327 GUBNCQDYCVPMFX-LLVKDONJSA-N 330.201 1.762 10 10 EDCE CNCc1ccc(N2CC[C@H]([C@@](C)(O)CO)C2)c(Br)c1 2202851683 CTAVENYAPMTZAL-WFASDCNBSA-N 343.265 1.738 10 10 EDCE CNCc1ccc(N2C[C@@H]3COC[C@]3(CO)C2)cc1Br 2234553369 XPNUXSWQRSHUHR-IUODEOHRSA-N 341.249 1.614 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCC[C@H](O)[C@H]2O)c1O 2236054126 FCQXMJSIBJKSRC-SUNKGSAMSA-N 346.221 1.527 10 10 EDCE CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)/C=C\c1cccnc1 491302464 AYZUHXNHMKBQLO-DAXSKMNVSA-N 343.408 1.592 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)[C@@H](O)[C@H]2CF)cc1Br 2333234163 PIEOMJKLILKFAE-LDICSKNTSA-N 334.185 1.382 10 10 EDCE Cc1ccc(CN[C@H]2CCN(C(N)=O)C2)c(O)c1Br 2352682387 ZUBHJXHAKGRGBK-JTQLQIEISA-N 328.210 1.706 10 10 EDCE COc1ccc(C2(CC(N)=O)C(=O)c3ccccc3C2=O)cc1OC 59366707 DMHJSDMQKJWVLK-UHFFFAOYSA-N 339.347 1.896 10 10 EDCE CC(C)(C)c1cc(O)c(O)c(CN2CC[C@H](NS(C)(=O)=O)C2)c1 116870090 IFSVMJTXRPTKBH-ZDUSSCGKSA-N 342.461 1.519 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)CN(C)Cc2nnc(C)n2C)c1 121734353 NCBHEZOEAOVYPT-LLVKDONJSA-N 347.419 1.147 10 10 EDCE CO[C@@H]1O[C@H](CN=[N+]=[N-])[C@@H](O)[C@@H](N=[N+]=[N-])[C@H]1NC(=O)c1ccccc1 32107377 BXZZELVEUAWUOZ-CYRBOEJBSA-N 347.335 1.506 10 10 EDCE Nc1ccc(OCCS(=O)(=O)NCC2CCSCC2)cc1 229180833 XQOCEKDYXFFJQL-UHFFFAOYSA-N 330.475 1.710 10 10 EDCE C[C@@H]1C[C@H](N2CCCC2)CN1c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 376206578 ZUHWYTSRNDZAKO-NEPJUHHUSA-N 346.387 1.989 10 10 EDCE CC(=O)N[C@H](C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380775551 WGXPRFYVBLCVIA-SECBINFHSA-N 343.221 1.946 10 10 EDCE Cc1ccc(CN2CCC[C@]2(CO)C(=O)O)c(O)c1Br 2380804186 KWNQODCKJIRDGP-AWEZNQCLSA-N 344.205 1.875 10 10 EDCE CN(CCCO)C(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 297838776 NMVKTLUJSGYKEC-UHFFFAOYSA-N 347.459 1.476 10 10 EDCE O=C1N[C@@H](C(=O)NCc2cc(Br)ccc2O)CS1 804735096 LCLKCAHWHPQGQJ-MRVPVSSYSA-N 331.191 1.596 10 10 EDCE CCOC(=O)[C@H](F)[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 912250407 AKJKFLGWIZAWDI-PCFSSPOYSA-N 337.347 1.861 10 10 EDCE C[C@H](NCC[C@@H]1CNCCS1(=O)=O)c1cc(F)cc(F)c1O 925800594 VTYSOOAQPGJSKT-GXSJLCMTSA-N 334.388 1.098 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@H]3C[C@H](O)C34CCC4)nc12 852584963 VMHMULZEADIWFO-STQMWFEESA-N 346.387 1.005 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H]3C[C@@H](N(C)C)C3)C2)cc1 852401189 HVHCZUIUCDMBTI-INMHGKMJSA-N 346.475 1.913 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H]3CCCOC3)C2)cc1 851996424 PYNOAOQUBPLMRD-HUUCEWRRSA-N 333.432 2.000 10 10 EDCE CCN(CC)c1ccc(CNS(=O)(=O)N=[S@@](C)(=O)CC)cc1 866538603 TYJDRNUOVZUART-NRFANRHFSA-N 347.506 1.985 10 10 EDCE CN(C)c1ccc([C@@H](N)CNS(=O)(=O)C[C@@H]2CCC2(F)F)cc1 866756963 FAZVLEQJDTWKCE-JSGCOSHPSA-N 347.431 1.717 10 10 EDCE CCNC(=O)CN1CCN(Cc2cc(Cl)cc(C)c2O)CC1 775649363 ORYMEHQVMKETEH-UHFFFAOYSA-N 325.840 1.608 10 10 EDCE CC(C)(O)C[C@@H](O)CNCc1ccc(N2CCC(O)CC2)c(F)c1 872203206 DBVCRYSAQXKYNI-OAHLLOKOSA-N 340.439 1.398 10 10 EDCE COC(=O)[C@@]1(O)CCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 882843650 ZYCZFVUKXUEGNH-LJQANCHMSA-N 342.395 1.844 10 10 EDCE COC(=O)CSCCNC(=O)c1cc2cc(O)c(O)cc2s1 896190059 SROVSLCANVSBAW-UHFFFAOYSA-N 341.410 1.949 10 10 EDCE OC[C@@H]1COCC[C@@H]1NCc1cc(Br)cc(F)c1O 1878773176 BERICPNYAQDWDE-SKDRFNHKSA-N 334.185 1.781 10 10 EDCE C[C@]1(C(=O)NCc2ccc(O)cc2O)Cc2ccccc2C(=O)O1 1142531246 ZBIAWPBWJFIZQG-GOSISDBHSA-N 327.336 1.886 10 10 EDCE CN(C)C(=O)c1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)cn1 1154430012 YYDOJCGRURYBKC-YWEYNIOJSA-N 327.340 1.847 10 10 EDCE O=C1NCC2(CCN(Cc3ccc(Br)cc3O)CC2)N1 1964581698 RPGGGWYINLWLSU-UHFFFAOYSA-N 340.221 1.802 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CCO[C@H](c3nccn3C)C2)c(O)c1O 1161536425 VLQWMQLIMKKEFB-YPMHNXCESA-N 331.372 1.790 10 10 EDCE COC1CN(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)C1 1963455986 ZKSMGUGMGQMBMY-UHFFFAOYSA-N 327.189 1.686 10 10 EDCE CN1CCN(c2ccc(CN)c(Br)c2F)C[C@@H]1CO 687597712 JZJIHTUFWGESLN-SNVBAGLBSA-N 332.217 1.160 10 10 EDCE CC(C)(C)[C@H]1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)C[C@H]1O 1327545177 MOEGWFKNCDJWTL-JKSUJKDBSA-N 347.459 1.183 10 10 EDCE C[C@H](NC(=O)NCc1nc(O)c2c(n1)CCOC2)c1ccccc1O 1254496429 ACSMOHCRQZSZQO-JTQLQIEISA-N 344.371 1.521 10 10 EDCE CCn1cc(CNC(=O)N[C@@H](C)c2ccccc2O)c(O)nc1=O 1251691630 RFBYLIGPPZJJOU-JTQLQIEISA-N 332.360 1.235 10 10 EDCE CC(C)C[C@@]1(CO)CCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1261865659 JBUKEEXGSDVPLK-LJQANCHMSA-N 346.427 1.634 10 10 EDCE CC(C)c1nnc(N(C)Cc2ccccc2O)n1Cc1cnnn1C 1287182819 ZPWVQPIJMJQFAW-UHFFFAOYSA-N 341.419 1.920 10 10 EDCE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CC[C@@H](C(N)=O)C1 1510671676 DPQCVKAITDVETL-OAHLLOKOSA-N 342.447 1.321 10 10 EDCE Cn1ncc([N+](=O)[O-])c1C(=O)NCc1ccc2cccnc2c1O 1469248981 KPCVVCLFRQOTAC-UHFFFAOYSA-N 327.300 1.512 10 10 EDCE O=C(NCC(=O)N1Cc2cccc(O)c2C1)c1cccc([N+](=O)[O-])c1 1471355520 JSGKQJCYRUFLTF-UHFFFAOYSA-N 341.323 1.573 10 10 EDCE COC(=O)c1ccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)nc1 1625909123 GUUQKFCNSZZDJM-XVNBXDOJSA-N 328.324 1.609 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cnc[nH]3)cc2)CC1 1558395460 ABDIXLWGIWSOEK-UHFFFAOYSA-N 327.388 1.041 10 10 EDCE Cn1ncc(C(=O)NCc2c(O)cccc2F)c1Br 1646035548 YMQQOGDMZQIQLZ-UHFFFAOYSA-N 328.141 1.957 10 10 EDCE COCCNCc1ccc(N2C[C@@H](O)[C@@H]2C)c(Br)c1 2126118976 HLENFMUKGLFBDV-IINYFYTJSA-N 329.238 1.755 10 10 EDCE CCc1ccc(N(CC)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)cc1 1772821794 GBGBZLMSSZLQBO-XFXZXTDPSA-N 341.411 1.713 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](O)CNCC2CCC2)cc1 1699071825 AZINPFCVOVZPBT-AWEZNQCLSA-N 333.392 1.329 10 10 EDCE C[C@H](O)C[C@@H]1COCCN1c1ccc(CN)cc1Br 2128868265 VMGQKCRRPSCIGJ-CMPLNLGQSA-N 329.238 1.884 10 10 EDCE COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Cc1ccc(N)cc1 1865956823 HBDNCAKBPMZAIY-INIZCTEOSA-N 328.368 1.417 10 10 EDCE COc1ccc(N2CCN(C(=O)CC[C@H]3C(=O)NN=C3C)CC2)cc1 1873831578 UMMHBPHTELBBBB-MRXNPFEDSA-N 344.415 1.246 10 10 EDCE COc1ccc(Br)c(CN2CC[C@@H](CC(N)=O)C2)c1O 1967793656 OGDINMDRPBXYRM-VIFPVBQESA-N 343.221 1.861 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](CO)(C(=O)N2CC(N=[N+]=[N-])C2)C1 1985104578 JRKZACHLDMCLJI-CQSZACIVSA-N 325.369 1.127 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 1985103537 WXVBKYCYAWQGNC-MNOVXSKESA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)CNCc1ccc(F)c(F)c1O 1985858721 LHJNCRNZZIMATC-SNVBAGLBSA-N 332.347 1.646 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]1(C)COCCN1C(=O)OC(C)(C)C 1993372582 OVTBRCOSUMEGMN-AWEZNQCLSA-N 327.385 1.781 10 10 EDCE CC(C)(C)OC(=O)N[C@]12C[C@@H]1CN(C(=O)c1ccc(O)c(O)c1)C2 2006285557 YKIWXNMBFKRHPC-DIFFPNOSSA-N 334.372 1.837 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)C[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010404702 BYVWXZCVHHCTBW-GRYCIOLGSA-N 339.396 1.658 10 10 EDCE CN(C)C[C@@H]1COCCN1c1cc(Br)c(CN)cc1F 2153250226 YDTCXLWPCANUGG-LLVKDONJSA-N 346.244 1.814 10 10 EDCE CCOC(=O)Cc1cc(O)n2nc(C(F)F)c(C(=O)OCC)c2n1 2080917843 HWVJLWIJFASYAP-UHFFFAOYSA-N 343.286 1.655 10 10 EDCE N[C@H]1CC(C(=O)N2CCCc3cc(Br)ccc32)=C[C@H]1O 2188028359 YSCROLZMRIGBTP-GXTWGEPZSA-N 337.217 1.747 10 10 EDCE CS(=O)(=O)[C@@H]1CCN(c2ccc(CN)c(Br)c2)C1 2059358619 GEZNFHYNLCNSBA-LLVKDONJSA-N 333.251 1.531 10 10 EDCE Cn1ncc(CNC(=O)OC(C)(C)C)c1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2060619325 LQHMOEPQXKQUDE-NSHDSACASA-N 349.395 1.970 10 10 EDCE Cn1cc(/C=C/C(=O)N2CCCCc3ccccc32)c(=O)n(C)c1=O 103258921 JDTSNPWVEPIRMV-ZHACJKMWSA-N 339.395 1.467 10 10 EDCE OCc1ccc(N2C[C@H]3CCO[C@]3(CO)C2)cc1Br 2231313537 KVMFOHYQEAZZHZ-RISCZKNCSA-N 328.206 1.529 10 10 EDCE O=C1NC(=O)N(Cc2ccc(F)cc2)C(=O)C1=CNC[C@@H]1CCCO1 2296931596 XWCRTORVLPZOGD-ZDUSSCGKSA-N 347.346 1.057 10 10 EDCE Cn1cc(/C=C/C(=O)N2CCCc3cc(F)ccc32)c(=O)n(C)c1=O 491213643 ZDUWRMGJIWCYMJ-VMPITWQZSA-N 343.358 1.216 10 10 EDCE C[C@]1(O)CCCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2305542936 OZSXTQHRSVLEIJ-IBGZPJMESA-N 330.428 1.910 10 10 EDCE OCc1ccc(N2CC3(CC[C@@H](CO)O3)C2)c(Br)c1 2336717948 CJFIAOQDNZAHOI-NSHDSACASA-N 328.206 1.672 10 10 EDCE [N-]=[N+]=NCCN[C@@H](C(N)=O)c1ccc(I)cc1 304592997 ZWGBPNMQMNFAAD-SECBINFHSA-N 345.144 1.718 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)CNC(=O)c1ccsc1 126189704 AXIKBBNNWRMNFE-UHFFFAOYSA-N 345.424 1.970 10 10 EDCE C[C@H](NCCNC(=O)c1ccn[nH]1)c1ccc(N2CCOCC2)cc1 180224039 ARVBHHVRNYUDFA-AWEZNQCLSA-N 343.431 1.327 10 10 EDCE Cc1[nH]c(=O)sc1S(=O)(=O)N(C)[C@H](C)c1ccccc1O 37926730 UVVIFWDHTHMZIJ-SECBINFHSA-N 328.415 1.832 10 10 EDCE COc1cccc(CNC[C@]2(CO)COCC3(CCC3)N2C)c1O 527754629 PPKFHLVNXNENOY-SFHVURJKSA-N 336.432 1.106 10 10 EDCE C[C@@H]1OCC[C@@H]1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 274945030 NYBCHEDZXZTOEI-BBRMVZONSA-N 340.445 1.120 10 10 EDCE COC(=O)[C@H]1C[C@@H](O)CN1Cc1ccc(N(C)C)cc1C(F)(F)F 280482997 DTBNBSOFHKOIQM-TZMCWYRMSA-N 346.349 1.880 10 10 EDCE CCOC(=O)[C@@H](O)CN(C)Cc1ccc(C)c(Br)c1O 2381138593 WUMSAIJPSLIHGC-NSHDSACASA-N 346.221 1.819 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCC[C@H]1CCOC1 807325273 FHVGRWSXTYKCIA-AWEZNQCLSA-N 334.416 1.674 10 10 EDCE COc1cc(O)c(CN2CC[C@H](CN3CCOC3=O)C2)cc1OC 824454842 LLBKRIXHKJOZJU-LBPRGKRZSA-N 336.388 1.684 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(CCO)[C@@H](C)C2)c([N+](=O)[O-])c1 588524568 HUYRTQICBYXZEX-AGLBCWCQSA-N 349.387 1.284 10 10 EDCE Cc1cc(CC(=O)N[C@@H]2CCC(=O)NC2=O)c(C)n1-c1ccccc1 830656846 SETGKTFKHMACEF-MRXNPFEDSA-N 339.395 1.558 10 10 EDCE COC(=O)[C@]12C[C@H](N)C[C@H]1CN(C/C=C/c1ccc(N(C)C)cc1)C2 903977380 QARQEVJFYVBLSY-JNEWFMBGSA-N 343.471 1.978 10 10 EDCE Cc1cc(O)c(CN2CCN(S(=O)(=O)N(C)C)CC2)c(Cl)c1 840910778 RTOWKFPAMBMALF-UHFFFAOYSA-N 347.868 1.278 10 10 EDCE C[C@H]1CNCC[C@@H]1NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 841987125 GGGRBHDOJPRLFK-YJBOKZPZSA-N 346.475 1.663 10 10 EDCE CN(C(=O)c1cc2cc(O)c(O)cc2s1)C1CS(=O)(=O)C1 913135741 BQTRUTPMPPUDPV-UHFFFAOYSA-N 327.383 1.182 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@H]1CCNC[C@H]1C)c1ccc(N(C)C)cc1 842201779 BZKYJOXPRKIRJU-WWGRRREGSA-N 332.448 1.044 10 10 EDCE CO[C@](C)(C(=O)NCc1c(O)cccc1F)C(=O)OC(C)(C)C 928712662 TWUWCBHIEVEJJK-MRXNPFEDSA-N 327.352 1.894 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCCC(=O)NC(C)C)C2)cc1 851973068 YQASVPWYQOQTQA-AWEZNQCLSA-N 348.447 1.488 10 10 EDCE Cc1ccc(C(=O)N2CCC([C@@]3(C)COC(=O)N3)CC2)c(O)c1O 928162466 IIHAUHWAQKOYMX-QGZVFWFLSA-N 334.372 1.757 10 10 EDCE COc1ccc(N2CCN(C[C@]3(O)CCCOC3)CC2)c(OC)c1 879461856 NRDJUFASWZHXQP-GOSISDBHSA-N 336.432 1.367 10 10 EDCE CN(C)c1ccc(CN(C(=O)NCCc2nnnn2C)C2CC2)cc1 772574118 BTDFRLSTDXXKTH-UHFFFAOYSA-N 343.435 1.193 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2C(=O)OC[C@H]2C1 897007763 OGMRCIWUWCEGKN-SECBINFHSA-N 334.353 1.589 10 10 EDCE O=C(N[C@@H]1CC(=O)N(C2CC2)C1)c1cc2cc(O)c(O)cc2s1 896838443 QLSZTPKBDJWXQV-SECBINFHSA-N 332.381 1.806 10 10 EDCE COc1ccc(Br)c(CNC[C@@]2(O)CCN(C)C2)c1O 1964054388 USIKBPKFLKPMKV-AWEZNQCLSA-N 345.237 1.320 10 10 EDCE CCC(=O)NCCNCc1c(Br)ccc(OC)c1O 1964598653 ZBVRHXFTUFMQCS-UHFFFAOYSA-N 331.210 1.779 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)Cc1cnon1 1329628459 RMOHITXBEDBPSP-JTQLQIEISA-N 345.363 1.482 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CC[C@@H](CS(N)(=O)=O)C2)c1O 1176699402 KRJBXGHVIRYIRQ-SNVBAGLBSA-N 346.836 1.359 10 10 EDCE C[C@H](N)c1ccc(N2CC(NS(C)(=O)=O)C2)cc1Br 703155587 GRKGTPCTENVEDW-QMMMGPOBSA-N 348.266 1.207 10 10 EDCE COC(=O)C1(O)CN(c2ccc([C@H](C)N)c(Br)c2)C1 714425921 IVUFDQPCJRTHNT-QMMMGPOBSA-N 329.194 1.193 10 10 EDCE CCn1nncc1C(=O)N[C@H](C)[C@H](C)NCc1ccc(OC)c(C)c1 1505598974 HTOHPUAJWIIFDP-UONOGXRCSA-N 345.447 1.912 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1CC1(C)C)NC(=O)c1cc(OC)nc(OC)c1 1285047902 SMPHNIAMLYHOOO-QWHCGFSZSA-N 349.431 1.770 10 10 EDCE 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OCC12COC(CNCc3cc(Br)cc(F)c3O)(C1)C2 1967801385 GSROJDOFBYNZAQ-UHFFFAOYSA-N 346.196 1.925 10 10 EDCE CC(C)(C)OC(=O)N(CCO)[C@H](C(=O)O)c1c(O)cccc1F 1976860099 DDRNCHYUUVPKEY-LBPRGKRZSA-N 329.324 1.886 10 10 EDCE CCN(C(=O)OC(C)(C)C)[C@H]1COC[C@@H]1C(=O)NCCN=[N+]=[N-] 1985093737 DRAMRODVROUFSV-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)NCCONC(=O)CCOc1ccc(N)cc1 1999149500 WDPDJHUBQVFPOU-UHFFFAOYSA-N 339.392 1.610 10 10 EDCE CC(C)(C)OC(=O)N1CCN(C(=O)CNc2ccc(N)cc2)CC1 1999139634 FYQFVVCBWKUENH-UHFFFAOYSA-N 334.420 1.760 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 2010388460 BUFCSZZXERLNCY-NSHDSACASA-N 343.384 1.759 10 10 EDCE C[C@H]1CN(c2ccc(CN)c(Br)c2)C[C@@H](C)S1(=O)=O 400860721 XMYUYPRFWJKYNM-AOOOYVTPSA-N 347.278 1.920 10 10 EDCE CCN(c1ccc(CNC)cc1Br)[C@@H]1CC(=O)NC1=O 2171190323 NFXYFIAPKWNDAU-GFCCVEGCSA-N 340.221 1.410 10 10 EDCE C[C@@H](CS(C)(=O)=O)N(C)c1ccc(CN)cc1Br 688566863 NUYOSTUDFDEWGP-VIFPVBQESA-N 335.267 1.777 10 10 EDCE NCc1ccc(N2CCC3(CC2)CNC(=O)N3)c(Br)c1 2177693184 GJBXSEAGFMDRJI-UHFFFAOYSA-N 339.237 1.560 10 10 EDCE COc1cccc(O)c1[C@@H](C)NC[C@H]1CCN(S(C)(=O)=O)C1 2064102615 UEGRFRTWMROPFY-VXGBXAGGSA-N 328.434 1.333 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)c(F)c1Br 2190461609 UTEZVASQUAKTMP-CBRVECNMSA-N 345.212 1.510 10 10 EDCE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CCN1C(=O)Cc1ccc(N)cc1 2044626470 IAFOGSREPLOJQL-GWCFXTLKSA-N 343.349 1.869 10 10 EDCE O=C1NC[C@@H]2CN(Cc3c(O)cccc3Br)CC[C@@H]12 2100942975 HADHYJNLIAMEOE-NXEZZACHSA-N 325.206 1.723 10 10 EDCE O=S1(=O)CC[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]21 2088814980 MYNBUMLLEPOVNO-RNCFNFMXSA-N 346.246 1.774 10 10 EDCE CC(C)(C)OC(=O)N1[C@H](COc2nnc(=N)[nH]n2)CCC12CCC2 2213778357 GBCKGLVAVKUMND-JTQLQIEISA-N 336.396 1.380 10 10 EDCE C[C@@H]1CCC[C@](COc2nnc(=N)[nH]n2)(NC(=O)OC(C)(C)C)C1 2213783190 NCHHPNJFGGHMSI-BMIGLBTASA-N 338.412 1.532 10 10 EDCE Cc1cccc(N2C(=O)C(=CNC[C@H]3CCCO3)C(=O)NC2=S)c1 2297317904 HJIQVVQRSWLPON-CYBMUJFWSA-N 345.424 1.395 10 10 EDCE N=C1C(=Cc2ccco2)C(=O)N=C2SC(N3CCOCC3)=NN12 2297352588 DDJVQOFSGJTAIF-UHFFFAOYSA-N 331.357 1.188 10 10 EDCE COC(=O)C=Cc1ccc(N2CC(NC(=O)C3CC3)C2)c([N+](=O)[O-])c1 2310197253 KPNMFDWSRJYGBP-UHFFFAOYSA-N 345.355 1.496 10 10 EDCE C[C@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C[C@H](CO)O1 2311236421 UPGZNNYRGPUYQI-MAUKXSAKSA-N 346.427 1.145 10 10 EDCE Cc1ccc(CNC(=O)[C@@]23C[C@H](N)[C@@H]2C3)c(O)c1Br 2352639487 YZTOZCHOGGGBEJ-BHDSKKPTSA-N 325.206 1.817 10 10 EDCE Cc1ccc(CNN(C)S(=O)(=O)C2CC2)c(O)c1Br 2352679779 LEYLHAZZFYXBRJ-UHFFFAOYSA-N 349.250 1.892 10 10 EDCE CCC(=O)NCC1[C@@H]2CN(C(=O)c3ccc(N=NC(N)=O)cc3)C[C@@H]12 1509614157 YIVXHKBPQODQSN-KBPBESRZSA-N 343.387 1.693 10 10 EDCE Cc1ccc(CN2C[C@H]3[C@@H](C2)OCCN3C)c(O)c1Br 2380717001 JSSCLZPUQNROFI-QWHCGFSZSA-N 341.249 1.978 10 10 EDCE Cc1ccc(CNc2cncc3nnnn23)c(O)c1Br 2380736764 GKRCUUROCMKCEL-UHFFFAOYSA-N 335.165 1.908 10 10 EDCE O=C(COC[C@H]1CCCO1)NCc1cc(Br)ccc1O 804733648 WVQJGGKXSPKAJX-GFCCVEGCSA-N 344.205 1.967 10 10 EDCE COc1cccc(CN[C@H]2CCC[C@@H]2CNS(C)(=O)=O)c1O 800309534 KNHZBCRLLZFUMH-YPMHNXCESA-N 328.434 1.208 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@H](O)C3CCOCC3)C2)cc1 819584116 DIJIIKQSJNVXCO-RDTXWAMCSA-N 348.443 1.425 10 10 EDCE CN(C)c1ccc(/C=C/CNCC(C)(C)NS(C)(=O)=O)cc1 835036676 KTVIWEFLSUMLHQ-VOTSOKGWSA-N 325.478 1.683 10 10 EDCE O=C(O)CN(Cc1ccccc1O)C(=O)c1cnn2c1CCCC2 911491301 NDESIGWOBWTCDR-UHFFFAOYSA-N 329.356 1.652 10 10 EDCE C[C@H]1CN(C(=N)NCc2cccc(Br)c2O)CCO1 849093863 MQUIRHOJHUKMSF-VIFPVBQESA-N 328.210 1.900 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](O)C1CCOCC1 840557143 PMUFDRRVKQEVIH-KBXCAEBGSA-N 334.460 1.896 10 10 EDCE Cc1cc(C(=O)N2C[C@@H](O)C[C@@H](O)C2)c(C)n1-c1ccc(F)cc1 755437450 YSEQVOPMSGJOFQ-IYBDPMFKSA-N 332.375 1.801 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1[C@H](C)NCc1ccc(N2CCOCC2)c(F)c1 850034284 KKIZXAYRBRHBPR-NWANDNLSSA-N 336.407 1.950 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCC[C@@H]1CNC(=O)C1 922916471 UURUNOZURNGMBU-GJZGRUSLSA-N 346.475 1.817 10 10 EDCE CCn1ccc(CC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)n1 855222850 BKXXILKXIGBSOW-HNNXBMFYSA-N 328.416 1.849 10 10 EDCE O=C1CN(C2CCC2)C(=O)N1Cc1ccc(N2CCOCC2)cc1 761069707 NBDYJJGJYSNVCX-UHFFFAOYSA-N 329.400 1.840 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H]4CC[C@@H](C4)C3)nc12 761082628 RCFBIFYHCNQUES-RYUDHWBXSA-N 330.388 1.844 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1C[C@H]2COC[C@@H](C1)C2=O 773740384 LJDSXYZFCHMUBA-NDNKKMJESA-N 333.384 1.387 10 10 EDCE COc1cc(C)cc(CN2CCC[C@H](CS(N)(=O)=O)C2)c1O 894016670 HRUOQMHIDYIKOH-LBPRGKRZSA-N 328.434 1.210 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(C(=O)c2cccnc2)CC1 1137728858 BNYBUHYHODGDJG-UHFFFAOYSA-N 341.367 1.020 10 10 EDCE C[C@@H]1CO[C@@H](C(F)(F)F)CN1Cc1cc2c(cc1O)OC[C@H]2O 795688686 DMDAWJJLNNMVLQ-IHPUGEDLSA-N 333.306 1.970 10 10 EDCE COc1ccc(CNC(=O)c2cccc(-c3nc(=O)o[nH]3)c2)c(O)c1 1155574585 MLABFBCZCSPWJH-UHFFFAOYSA-N 341.323 1.674 10 10 EDCE COc1ccc(Br)c(CNC[C@@H](O)C(F)F)c1O 1964557280 BCLSMFAZBGICQQ-MRVPVSSYSA-N 326.137 1.879 10 10 EDCE NC(=O)[C@@H]1CN(C(=O)c2cccc(O)c2O)C[C@H]1c1ccccc1 1161893978 FTCYAIUOVQHACM-UONOGXRCSA-N 326.352 1.439 10 10 EDCE C[C@@H]1CCOCCN1C(=O)C(=O)NCCCSc1nccs1 1332569211 SRIFSARZOLAMRE-LLVKDONJSA-N 343.474 1.379 10 10 EDCE CO[C@H]1C[C@@H](C(=O)NCCN=[N+]=[N-])CN(C(=O)OC(C)(C)C)C1 1965102717 SNAICFAHJFAPBB-MNOVXSKESA-N 327.385 1.685 10 10 EDCE O=C(C(=O)N1CC[C@H]2CSC[C@H]2C1)N1Cc2cccc(O)c2C1 1351961304 RCDCYHLIQOHAJO-QWHCGFSZSA-N 332.425 1.446 10 10 EDCE COc1ccc(CNC(=O)c2cnn3c(OC)cccc23)c(O)c1 1296969088 WRVXRNMJWNSMLE-UHFFFAOYSA-N 327.340 1.987 10 10 EDCE Cc1ccc(O)c(CNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])c1 1458500713 ZEHSESWKPICANX-UHFFFAOYSA-N 337.357 1.868 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCn2ccnc2)cc1C 1714740637 DUQJAFRIAQYCEL-UHFFFAOYSA-N 330.432 1.838 10 10 EDCE C[C@@H](NC(=O)c1ccc(CO)nc1)c1ccc(N2CCOCC2)cc1 1626978195 LWESBLNJAXNYEJ-CQSZACIVSA-N 341.411 1.902 10 10 EDCE CNCc1ccc(N2CCC[C@@H]2[C@H](O)CO)c(Br)c1 2123224000 XDAQRSNZIVMWQC-ZIAGYGMSSA-N 329.238 1.491 10 10 EDCE CO[C@@H](C)CNC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1483606739 FCDLDOMQACUSMV-XHDPSFHLSA-N 347.419 1.982 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H]2CCC(=O)NC2)cc1C 1714477017 ZWIZBGHCOSTGFK-ZBFHGGJFSA-N 347.459 1.514 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](NC(=O)CN(C)C(C)=O)C2)cc1C 1490993825 AIOCNSNHQIKYGQ-IYBDPMFKSA-N 333.432 1.219 10 10 EDCE Cc1nc2cc(NC(=O)c3cc(O)cs3)ccc2n1C(CO)CO 1569050965 QDAXLOTVRHWLSO-UHFFFAOYSA-N 347.396 1.890 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)/C=C/C(C)(C)C)cc(OC)n1 1720901174 DMJPCOWPILLTHQ-GUOLPTJISA-N 349.431 1.936 10 10 EDCE CC(C)(C)OC(=O)[C@@H]1COCCN1C(=O)Cc1ccc(O)c(O)c1 1632839972 PGTAYVBADDTVBF-LBPRGKRZSA-N 337.372 1.209 10 10 EDCE CCn1cccc1C(=O)NC[C@@H](O)CNCc1ccc(OC)c(C)c1 1732664405 JEWYVLRBYOOUOO-INIZCTEOSA-N 345.443 1.706 10 10 EDCE CCCC(=O)NCC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1582121222 BGVVGOPBDWIIAU-UHFFFAOYSA-N 331.376 1.837 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN(C)CC3CCC3)CC2)cc1 1655796982 DYPSAUBPSFVVRF-LJQANCHMSA-N 347.503 1.910 10 10 EDCE CCOC(=O)c1n[nH]c([C@@H](C)NC(=O)c2ccc(C)c(O)c2O)n1 1584175692 FQJUQXGIMPYRHD-MRVPVSSYSA-N 334.332 1.192 10 10 EDCE O=C(NCc1cccc(O)c1O)c1ccc2c(c1)C(=O)NCCO2 1651175773 MAQGDJPTGCYYPX-UHFFFAOYSA-N 328.324 1.150 10 10 EDCE O=C(NC[C@@H](O)COc1cccc(F)c1)c1c(F)ccc(O)c1O 1650705493 GVQMWRNJZVNEET-SNVBAGLBSA-N 339.294 1.546 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cnc(O)n2C)cc1C 1664116309 SXFBKHRJCYOMSI-UHFFFAOYSA-N 332.404 1.305 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2ccncn2)cc1C 1666635981 RLNFPFQPXVIPNR-CYBMUJFWSA-N 328.416 1.949 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)Cc2cnn(C)c2)cc1C 1690557817 XKZFMQPCXJKAKX-CQSZACIVSA-N 330.432 1.574 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2ccc(O)nn2)cc1C 1699226714 HPQORHQNXDYJPI-ARJAWSKDSA-N 342.399 1.575 10 10 EDCE CCOC(=O)c1c(NC(=O)[C@@H](N)CC(=O)OC)sc2c1CCC2 1865966346 WQANRGZDFOSZEH-VIFPVBQESA-N 340.401 1.242 10 10 EDCE Cn1cc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nn1 1866162224 OILKPZFMMBTXFO-UHFFFAOYSA-N 332.319 1.843 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@H](O)C2)cc1Br 2132134727 QFAAJCBYVKKLBI-UONOGXRCSA-N 329.238 1.491 10 10 EDCE OCC1(CO)CN(c2ccc(CNC3CC3)cc2Br)C1 1914984399 BGZYBLLEQAENJE-UHFFFAOYSA-N 341.249 1.492 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1 1900613547 ZXHHFEVMGZYOME-AWEZNQCLSA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1C(=O)NCCCCN=[N+]=[N-] 1985103233 RYOIVZNLHKFQLF-MNOVXSKESA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)NCCN=[N+]=[N-])OCC12CC2 1986284443 IVPYFEVLOIZZNT-JTQLQIEISA-N 325.369 1.581 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)CC(O)C1 2018045696 IICYZCFUGLRRQG-RWWNRMGGSA-N 339.396 1.706 10 10 EDCE NCc1ccc(N2C[C@@H](CO)[C@@H](CO)C2)c(F)c1Br 704702124 KLQKHFTXQZOCLA-AOOOYVTPSA-N 333.201 1.084 10 10 EDCE CN(C[C@@H]1CCCS1(=O)=O)c1ccc(CN)c(Br)c1 694093209 CHBFPWLJZXLEDD-LBPRGKRZSA-N 347.278 1.921 10 10 EDCE Cn1ncc(C(=O)NCCCCN=[N+]=[N-])c1I 383264304 UFHRXMODDYSYII-UHFFFAOYSA-N 348.148 1.845 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](O)CN(C(=O)Cc2ccc(N)cc2)C1 2049115581 BLMHRGXEJCMVGT-HUUCEWRRSA-N 349.431 1.298 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)NCCc1ccc(N)cc1 2080578682 JDSWEHSPPIYTPL-CABCVRRESA-N 349.431 1.298 10 10 EDCE COC(=O)N[C@@H](C)CNCc1c(Br)ccc(OC)c1O 2290406654 KIDJOWDNIKPQLA-QMMMGPOBSA-N 347.209 1.997 10 10 EDCE CCOc1cc(C=C2SC(=S)N(CCO)C2=O)ccc1O 2293343959 FVGZRMNTHDUBNF-UHFFFAOYSA-N 325.411 1.984 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCN(c2cnccn2)CC1 2307986320 NIBKBITWIDGUSJ-UHFFFAOYSA-N 326.356 1.250 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H](O)[C@@H](C)N)c(O)c1Br 2352650002 GTGFBIXUCNTFDZ-LDYMZIIASA-N 331.210 1.130 10 10 EDCE COC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1cc(O)c(O)c(O)c1 1148588571 UZEGYGVGFWIWQB-CYBMUJFWSA-N 343.335 1.544 10 10 EDCE COC(=O)c1ccc(S(=O)(=O)NCCc2ccc(N)cc2)cc1 171531833 HSHUTXVOQXDGLT-UHFFFAOYSA-N 334.397 1.576 10 10 EDCE COc1cc(I)cc([C@@H](N)CCCO)c1O 309377062 HXJDONJYTCIYSA-VIFPVBQESA-N 337.157 1.778 10 10 EDCE CC[C@@H](O)CN1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 123513854 PDUCJBFXDQJYMY-CYBMUJFWSA-N 343.811 1.842 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](NC(N)=O)C(C)C)CC2)cc1 42047429 COPJSSRESOTUDF-HNNXBMFYSA-N 334.420 1.037 10 10 EDCE C[C@H](NC[C@H]1CCCS1(=O)=O)c1ccc(N2CCOCC2)cc1 90465983 JWYXUAGOMQIOBT-WMLDXEAASA-N 338.473 1.751 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3C[C@H]3C(=O)NC3CC3)CC2)cc1 242806402 FGWFXTNTPNHKCN-SJORKVTESA-N 343.427 1.259 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCc1ccc(O)nc1 255191112 SUARIZQOBGRLHO-CLTKARDFSA-N 339.395 1.953 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CC(=O)N(c2c(C)cc(C)cc2C)C1 808501287 HORZVPVSHHEDGU-CQSZACIVSA-N 331.368 1.666 10 10 EDCE CN1C[C@H](C(=O)NCc2cc(Br)ccc2O)CC1=O 804739624 MJQDHXJBBIQQMU-SECBINFHSA-N 327.178 1.249 10 10 EDCE C[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)C1(S(C)(=O)=O)CC1 804539986 RGNBFQBPZJVYRC-AYYIZTPMSA-N 325.386 1.193 10 10 EDCE CSCCCCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803685464 AZAICOKRPFAUDJ-UHFFFAOYSA-N 349.500 1.945 10 10 EDCE O=CN1CCC(OC(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1 588402329 JHWKDHJCAMJLQB-UTCJRWHESA-N 344.411 1.700 10 10 EDCE C/C=C\[C@H](O)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 900014278 HWVBXWUCMCIDBJ-AJNOYIKESA-N 347.459 1.261 10 10 EDCE CN1CCCc2cc(CNC(=O)NC[C@H](O)c3ccnn3C)ccc21 915390745 OPDRWZOMSFRSSX-KRWDZBQOSA-N 343.431 1.335 10 10 EDCE CCN(CC(=O)N(C)C)c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 747621548 WIOHPRUXKJDXHV-VQHVLOKHSA-N 335.360 1.696 10 10 EDCE O=C(O)/C=C\c1ccc(N2CCC(OCCO)CC2)c([N+](=O)[O-])c1 844212337 GCVAUFYTVXZRNO-RQOWECAXSA-N 336.344 1.670 10 10 EDCE CN(CC1(O)CCOCC1)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 844214407 PWQCBUIYGGXCML-HYXAFXHYSA-N 336.344 1.670 10 10 EDCE CS(=O)(=O)N1CCC[C@H](Nc2c(N)cccc2Br)C1 697448537 WJZZWQFRZPIVFH-VIFPVBQESA-N 348.266 1.867 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@H]2NCC[C@H]21 866722981 BFRJRRFFYMPLQS-QZTJIDSGSA-N 330.476 1.537 10 10 EDCE Cc1ccc(S(=O)(=O)NCCCSc2nccs2)nn1 866782437 TZXZLHJHGHVHCA-UHFFFAOYSA-N 330.460 1.702 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CO[C@@H](C3CC3)C2)c1 863284749 CYBYOPWMAJANTO-BXUZGUMPSA-N 340.401 1.061 10 10 EDCE CN1CCN(c2ccc(CNC(=O)/C=C/c3ccncn3)cc2)CC1 893607752 KNCKREBUXQAPIB-QPJJXVBHSA-N 337.427 1.558 10 10 EDCE O=C(N[C@@H](CO)C[C@@H]1CCCO1)c1cc2cc(O)c(O)cc2s1 899277558 NQLBHSIWQBFVHJ-MNOVXSKESA-N 337.397 1.972 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1COCCN1CC(F)F 1136743557 VGHCXCNQISZJAH-HNNXBMFYSA-N 341.402 1.643 10 10 EDCE CCN(CC)C(=O)[C@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1136075711 GFONEJVYBKNNKH-GFCCVEGCSA-N 338.429 1.410 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCc1nc[nH]n1 1141335059 NZGDMNVUZUHCIR-UHFFFAOYSA-N 337.383 1.997 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCC[S@@](=O)CC(F)(F)F 1166437736 XFAQQNQMIBOJHM-OAQYLSRUSA-N 325.308 1.068 10 10 EDCE CC(=O)C(=O)[C@@]1(O)C[C@@H](C(C)C)N(C(=O)OCc2ccccc2)C1 1892802282 ZIZWLJJDLAAJQQ-MAUKXSAKSA-N 333.384 1.943 10 10 EDCE CCNCc1ccc(N2CCN(C)C[C@H]2CO)c(Br)c1 699460435 YJZBWIDILFLAGY-ZDUSSCGKSA-N 342.281 1.671 10 10 EDCE Cc1ccc(O)c(CNC(=O)C(=O)Nc2cc(C3CC3)nn2C)c1 1335297692 VFAZPFDIQLGXBC-UHFFFAOYSA-N 328.372 1.566 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC=C[C@@H]2CO)cc1F 1338502568 UOPWXXIKEIYXOZ-CQSZACIVSA-N 349.406 1.047 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C2CCN(C)CC2)cc1C 1268700989 SOZKYRRJRQAAPW-HNNXBMFYSA-N 333.476 1.940 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CN2CCCCC2=O)cc1C 1267395603 UERSLGVJGUQRAG-UHFFFAOYSA-N 347.459 1.564 10 10 EDCE COCC(=O)N[C@H]1C[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1509798949 XOYHAGHMJWKDEP-MJHDQNEOSA-N 347.375 1.120 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)CC(C)(F)F)cc1C 1284445949 XFJMPFLRCJPYAP-AWEZNQCLSA-N 344.402 1.958 10 10 EDCE CNCc1ccc(N2CCO[C@@H]([C@H](C)O)C2)c(Br)c1 2117532581 UKWQGBXCTBMCLC-IINYFYTJSA-N 329.238 1.755 10 10 EDCE O=C(CSc1nnc2ccccn12)NCc1ccc(O)cc1O 1451765799 HUYGSBSZIOUESW-UHFFFAOYSA-N 330.369 1.549 10 10 EDCE CS(=O)(=O)NCc1ccc(C(=O)NCc2c(O)cccc2F)o1 1456031012 VTNIWTBDZMGGEL-UHFFFAOYSA-N 342.348 1.104 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(=O)n(C)cn1 1628954629 NWJQPEDHONKUDT-UHFFFAOYSA-N 326.400 1.653 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CS(=O)(=O)CC(C)C 1623574205 MFUVOPFJMJXDAK-UHFFFAOYSA-N 334.434 1.565 10 10 EDCE O=C(NCc1cc(O)ccc1O)C1CCN(CC(F)(F)F)CC1 1558175594 WWYGABFYTQZUEB-UHFFFAOYSA-N 332.322 1.988 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CN2CC[C@@H](C)C2)cc1C 1714273850 RIXRZAKXWIXHTJ-GDBMZVCRSA-N 333.476 1.940 10 10 EDCE COC(=O)C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 1628981682 HRXUTNQYWCULAA-GFCCVEGCSA-N 334.332 1.253 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1cc(-n2ccnc2)ccc1O 1631434377 QPZTZNRMVQBVOM-UHFFFAOYSA-N 325.324 1.919 10 10 EDCE CC[C@H](O)Cn1cc(C(=O)N[C@@H](C)c2cc(OC)ccc2O)nn1 1631541853 BIPMSECINYYIDR-QWRGUYRKSA-N 334.376 1.254 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3CCNC3=O)CCC2)cc1C 1724795825 ZIBGTDDPKIDJBM-OAHLLOKOSA-N 345.443 1.268 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@]3(F)CCOC3)CC2)cc1C 1733254369 VQFIIMJNHANIAX-GOSISDBHSA-N 336.407 1.871 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)C2=C[S@@](=O)CCC2)N(C)C)cc1 1640231781 BRMSJAPWAOTRTC-XDHUDOTRSA-N 349.500 1.898 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)c2nc[nH]n2)C(C)C)cc1C 1732568022 MZHRTIQYCXUUPV-CQSZACIVSA-N 331.420 1.666 10 10 EDCE Cn1c(=O)n(CCC(=O)NCc2c(O)cccc2F)c2ccccc21 1652295493 LPQLTYQQWMAZJB-UHFFFAOYSA-N 343.358 1.891 10 10 EDCE CCS(=O)(=O)c1ccc(C(=O)N2Cc3cccc(O)c3C2)c(N)c1 1587933161 MDHHAYDACHRBGI-UHFFFAOYSA-N 346.408 1.924 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@@H]2COC(=O)N2)C(C)C)cc1C 1698964673 IOIBXVGPWACLOT-CABCVRRESA-N 349.431 1.342 10 10 EDCE CN(C)C[C@@H]1CN(Cc2cc(Br)ccc2O)CCO1 128223373 PKYLPJHUBSEHLD-CYBMUJFWSA-N 329.238 1.917 10 10 EDCE C[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CN(Cc2cc(N)ccc2O)C1 1999475058 MPCRRHPUMMSVLX-BXKDBHETSA-N 331.338 1.863 10 10 EDCE Nc1ccc(CCC(=O)N2CC(CNC(=O)C(F)(F)F)C2)cc1 1999443103 QZSXZJCABIWZRF-UHFFFAOYSA-N 329.322 1.338 10 10 EDCE O=C1NCCCN(c2ccc(CO)c(Br)c2)CC1(F)F 2152790667 PRKMCSDYWWJDEB-UHFFFAOYSA-N 349.175 1.903 10 10 EDCE CO[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 2012170478 IHAZZCISVZJEGD-RYUDHWBXSA-N 339.396 1.780 10 10 EDCE CN(C)C[C@H]1CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2160848120 TVUZPEGTGMVVTJ-AMIZOPFISA-N 340.221 1.575 10 10 EDCE NCc1cc(F)c(N2CC[C@@H]3C(=O)NC[C@@H]3C2)cc1Br 2157183397 IHVSGGVFRXDCOV-ZJUUUORDSA-N 342.212 1.619 10 10 EDCE CN[C@@H](C)c1ccc(N2CC(OC)(C(N)=O)C2)c(Br)c1 2161183093 FDOTYDFIYPGVFO-VIFPVBQESA-N 342.237 1.420 10 10 EDCE Oc1cccc(Br)c1CN1CC[C@@H](N2CCNCC2)C1 706843109 MOIVFGUSGSETEQ-GFCCVEGCSA-N 340.265 1.634 10 10 EDCE CNC(=O)C1CN(c2ccc(CNC3CC3)c(Br)c2)C1 382072285 XUOAOIOQEYPWPR-UHFFFAOYSA-N 338.249 1.883 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCOC[C@H](C4CCC4)C3)c2n1 2063513326 UIFYYEAGQZXMJD-CYBMUJFWSA-N 330.388 1.632 10 10 EDCE CS(=O)(=O)c1cnn(Cc2ccc(Br)cc2O)c1N 2070219760 FHYBPJXLQRAZMR-UHFFFAOYSA-N 346.206 1.385 10 10 EDCE O=C1CO[C@@H]2CCN(c3ccc(CO)c(Br)c3)C[C@@H]2N1 2185521780 KVCIMKJBKYRSOB-QWHCGFSZSA-N 341.205 1.035 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@@H]1NC(=O)Cc1ccc(N)cc1 2044229784 ACXRFGVFZXLONX-CABCVRRESA-N 349.431 1.610 10 10 EDCE CNCc1ccc(N2CCCNC(=O)CC2)cc1Br 2089101938 RHZODJHQZHTFDI-UHFFFAOYSA-N 326.238 1.885 10 10 EDCE C[C@H]1CCN(c2ccc(CN)c(Br)c2F)[C@H]1C(N)=O 2090256049 LKCRLEPRYZOFBT-JVXZTZIISA-N 330.201 1.747 10 10 EDCE COc1ccc(Br)c(CN2C[C@H]3OCCO[C@@H]3C2)c1O 2236088237 DYASCCJHLMAOGU-CHWSQXEVSA-N 344.205 1.763 10 10 EDCE NCc1ccc(N2C[C@@H]3CCO[C@@]3(CO)C2)c(F)c1Br 2239915032 GVIMJYHCYJWWTB-IINYFYTJSA-N 345.212 1.635 10 10 EDCE CC(C)(C)OC(=O)NC[C@]12C[C@H](C1)[C@H](C(=O)NCCN=[N+]=[N-])CO2 2303352659 MQSMISBASWEBFI-HFAKWTLXSA-N 339.396 1.733 10 10 EDCE CC(=O)N1CC(NC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)C1 175782458 RABDEKNELYCECS-UHFFFAOYSA-N 348.358 1.423 10 10 EDCE Cc1ccc(C(=O)NC[C@H](CC(C)C)N2CCOCC2)c(O)c1O 177667354 YPLWNSITTNLMHC-AWEZNQCLSA-N 336.432 1.883 10 10 EDCE O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1nccs1 173395221 VBGXTYUYYXBCCZ-UHFFFAOYSA-N 331.397 1.982 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCc1ccc(Cl)s1 71308219 DFMTYAPFPKFYFO-JTQLQIEISA-N 326.805 1.999 10 10 EDCE C[C@@](NC(=O)/C=C/c1ccc(N2CCOCC2)cc1)(C(=O)O)C1CC1 191063063 UCKWCHJPEFKMTF-QFXLTXBMSA-N 344.411 1.906 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@H](C(=O)N3CCOCC3)C2)c(O)c1O 370219850 OGBLWSRQCNXOTN-ZDUSSCGKSA-N 348.399 1.117 10 10 EDCE CN(C)S(=O)(=O)[C@H]1CCCN(Cc2c(O)cccc2Cl)C1 289374757 LVDVMDDLSPTSJQ-NSHDSACASA-N 332.853 1.901 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCC(O)CC3)c(Br)cc21 92774912 UIXPRHYZWZCLGE-ZDUSSCGKSA-N 340.221 1.623 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 808504812 NHJHEQULMQPGKG-UHFFFAOYSA-N 349.217 1.851 10 10 EDCE CN1CCN(c2ccc(CN[C@H]3CCc4nc[nH]c4C3)cc2)CC1 810171702 QLRFXMDXWWNXGU-INIZCTEOSA-N 325.460 1.809 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CNCC[C@@H]3C)C2)cc1 818655922 QBIMRYDTEUIHJL-HDMKZQKVSA-N 346.475 1.819 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN[C@H]3CC[C@H]3C)CC2)cc1 819311870 PPOCYWUYMLSBIM-SUMDDJOVSA-N 333.476 1.566 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CNCC3(C)CCC3)CC2)cc1 819138071 LTYJFOWAZPQXEO-GOSISDBHSA-N 347.503 1.958 10 10 EDCE CNC(=O)C1CN(c2ccc([C@H](C)NC)cc2Br)C1 723159060 WKPOJXNJAZTUKB-VIFPVBQESA-N 326.238 1.912 10 10 EDCE CN1C[C@H](O)C[C@@]1(C)C(=O)NCc1ccc(N2CCSCC2)cc1 900254343 GSNMYCWTUKNJDU-AEFFLSMTSA-N 349.500 1.311 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnc(O)n(C)c1=O 839920164 MEZUJRORQSYEFP-GFCCVEGCSA-N 344.415 1.221 10 10 EDCE C[C@@H](NC(=O)N[C@H]1C[C@@H](C(N)=O)C1)c1ccc(N2CCOCC2)cc1 844925098 AKPQZUYZUCIWFB-YUELXQCFSA-N 346.431 1.147 10 10 EDCE O=S1(=O)CC[C@@]2(CN(Cc3c(O)cccc3Cl)CCO2)C1 843425737 HLMVNJLIHDYGKU-CQSZACIVSA-N 331.821 1.435 10 10 EDCE CCN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCCOC1 846446270 ODMNOWOKHPSKOC-GFCCVEGCSA-N 342.417 1.405 10 10 EDCE COCc1cc(O)ccc1NS(=O)(=O)c1cnc(Cl)n1C 840918449 TUTIBHJCGJBCAV-UHFFFAOYSA-N 331.781 1.726 10 10 EDCE O=C(Nc1ccc(O)c(CNC(=O)[C@@H]2CCOC2)c1)[C@H]1CCOC1 923124208 VEIZJGPVVWDNKT-NEPJUHHUSA-N 334.372 1.020 10 10 EDCE CC[C@@H](NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)C(=O)NC 852448172 HFJQIVDFCRWKQY-IUODEOHRSA-N 334.420 1.098 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnc4[nH]cnc4c3)C2)cc1 855233455 HGCGPIVUKDPJEU-ZDUSSCGKSA-N 337.383 1.975 10 10 EDCE C[C@@H](NC[C@@H](O)CS(C)(=O)=O)c1ccc(N2CCCCC2)cc1 927032987 NUTVBSZAUYADRZ-RHSMWYFYSA-N 340.489 1.733 10 10 EDCE CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1cccc(O)c1O 856410912 PNFBRUYHQBCWNB-ZDUSSCGKSA-N 334.416 1.813 10 10 EDCE CC1CCN(c2ccc(CNC(=O)N[C@H]3C[C@H](C(N)=O)C3)cc2)CC1 858205226 UKTRLABIVXPYHG-WKILWMFISA-N 344.459 1.986 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cnc4n3CCOC4)C2)cc1 855227182 UDSVLYZOMBAMMS-CYBMUJFWSA-N 342.399 1.431 10 10 EDCE CCN(C)C(=O)[C@@H](C)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852273933 AGCVLEMLPREPAI-ZIAGYGMSSA-N 348.447 1.440 10 10 EDCE Oc1c(Cl)cccc1CN[C@H]1CCN(c2ccc3nncn3n2)C1 862481813 LZCCBGLODFWPDJ-LBPRGKRZSA-N 344.806 1.852 10 10 EDCE NC(=O)[C@H](F)C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 931218617 DWHMNPWMTBIAGM-QGZVFWFLSA-N 335.423 1.559 10 10 EDCE CNC(=O)COC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 766593193 RYKRGQDHUOLHAZ-UHFFFAOYSA-N 343.427 1.697 10 10 EDCE CCOc1ccc(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)c(O)c1 872255489 YKICYWGOUCEJBA-LXZKKBNFSA-N 347.415 1.158 10 10 EDCE CNC(=O)Cn1cc(NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cn1 775709153 PHUQYPSWMXPFAE-GFCCVEGCSA-N 344.419 1.578 10 10 EDCE Cc1ccc(C(=O)NC[C@@]2(O)[C@@H]3[C@@H]4[C@H]5[C@H]6C[C@@H]4[C@H]2[C@@H]6C[C@H]53)c(O)c1O 787668371 FNTJMYKIXQORJT-YPGUHIKESA-N 341.407 1.645 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2C(=O)OC[C@@H]2C1 897007765 OGMRCIWUWCEGKN-VIFPVBQESA-N 334.353 1.589 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1cc2c(nc1O)CCC[C@@H]2O 1137443044 AAJLFCMMHZIJKD-ZDUSSCGKSA-N 330.340 1.498 10 10 EDCE CN(C)Cc1cc(C(=O)NCc2ccc3cccnc3c2O)no1 1142728183 NKHYIBOOBNVYFS-UHFFFAOYSA-N 326.356 1.920 10 10 EDCE CN1CCN(c2ccnc(NC(=O)Cc3ccc(O)c(O)c3)c2)CC1 1151291522 XJUBUAYJIORJHL-UHFFFAOYSA-N 342.399 1.426 10 10 EDCE O=C(C(=O)N1CCC[C@@H](c2cc[nH]n2)C1)N1Cc2cccc(O)c2C1 1329786757 LRJXSAVGUQYOCL-CYBMUJFWSA-N 340.383 1.364 10 10 EDCE CC(C)(C)OC(=O)NCCN1CCC(C(=O)NCCN=[N+]=[N-])CC1 1965101265 AXRSTWJAQNPBBM-UHFFFAOYSA-N 340.428 1.650 10 10 EDCE C[C@@H]1COC[C@H]1N(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 688222902 MQYSRRDBZAOZOK-BLBGDKDGSA-N 341.205 1.906 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCC(C)(C)O2)cc1 1321921791 PCSFRCBBLQYETL-HNNXBMFYSA-N 333.432 1.443 10 10 EDCE COC(CN(CCCO)Cc1ccc(N2CCOCC2)cc1)OC 1332848203 IVYLPXLOCNBJSG-UHFFFAOYSA-N 338.448 1.327 10 10 EDCE COc1cc(N2CCC[C@H](CNC(N)=O)C2)c([N+](=O)[O-])cc1OC 1184856939 PRQSUOBBQLUYDZ-SNVBAGLBSA-N 338.364 1.497 10 10 EDCE CCC1(N(C)C)CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1335638661 FQGMQKVVHAZCQB-UHFFFAOYSA-N 345.443 1.567 10 10 EDCE CC[C@H](F)C(=O)NC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1356783780 SWOZKEZYKZLWPR-LBPRGKRZSA-N 335.339 1.538 10 10 EDCE CN(C)CCC1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1351828113 XCOFRJPTBWCTRQ-UHFFFAOYSA-N 345.443 1.425 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)Cc2ccsc2)cc1C 1272351271 HGJQALVQIVMZKZ-MRXNPFEDSA-N 348.468 1.875 10 10 EDCE C[C@H](NC(=O)c1cnn(C)c1-n1cnnc1)c1ccc(N(C)C)cc1 1296648750 NCUPDDPPCSRARC-LBPRGKRZSA-N 339.403 1.558 10 10 EDCE COC(=O)c1ccn(CCCC(=O)NCc2ccc(O)c(O)c2)n1 1294869417 MAOWNRJUANDGPO-UHFFFAOYSA-N 333.344 1.178 10 10 EDCE N=C(O)OC[C@@H](Cc1ccccc1)NC(=O)c1cccc(O)c1O 1469023892 IWKRIDKQMYGUEA-GFCCVEGCSA-N 330.340 1.948 10 10 EDCE CN(C)C(=O)c1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1 1540679992 QMGXRWRBHSBUAU-UHFFFAOYSA-N 328.368 1.659 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(C)COCCO1 1709038439 INXHUAKHOMPFSC-GOSISDBHSA-N 346.431 1.988 10 10 EDCE COc1cc(N2CCN3C[C@@H](F)C[C@H]3C2)c([N+](=O)[O-])cc1OC 1613022826 KVJWPCBBCMUQOA-QWRGUYRKSA-N 325.340 1.844 10 10 EDCE COCCCN1CC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1483707143 QPEHIAOGHJBNAZ-CQSZACIVSA-N 333.392 1.690 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cc2c(nc1O)CCCC2=O 1558534206 PTKRPIHGRJSXHR-UHFFFAOYSA-N 328.324 1.647 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1C[C@@H](C)[C@H](C(=O)OC)O1 1623581598 SUIYTDOBECFWCZ-IXPVHAAZSA-N 342.388 1.461 10 10 EDCE C[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@@H]1CNCCO 1482502162 XTHYMFLWEOLVDM-IUODEOHRSA-N 347.419 1.672 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)Cc2ccoc2)cc1C 1571426907 GNQRBFDXAHLZDN-INIZCTEOSA-N 332.400 1.406 10 10 EDCE COc1ccc(CNCC2(NC(=O)c3nc[nH]n3)CCCC2)cc1C 1732234565 QUCBUZAPNJHROQ-UHFFFAOYSA-N 343.431 1.954 10 10 EDCE CC1(C)[C@H](O)[C@@H](O)CN1c1ccc(CN)c(Br)c1F 2124800332 KHOYHRYLOQGXLZ-JOYOIKCWSA-N 333.201 1.367 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)C[C@H]2CCC(=O)N2)cc1C 1662988852 KNQGZENLBLKXOS-GOEBONIOSA-N 347.459 1.657 10 10 EDCE O=C(O)[C@@H](CO)N1C(=O)/C(=C\c2ccc(Cl)cc2)SC1=S 1858596555 WEPWHLZSRMKRFC-RAJVOEEQSA-N 343.813 1.987 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)C1(CO)CCC1 1914981556 JTKIFMFEBUKOPV-LBPRGKRZSA-N 340.221 1.752 10 10 EDCE CCCNCc1ccc(N2CC(=O)NC(=O)C2)cc1Br 233102292 FWQOTJBWDGINHD-UHFFFAOYSA-N 340.221 1.412 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 1986143069 LXOZNAQNFYUKQN-IINYFYTJSA-N 325.369 1.270 10 10 EDCE C[C@@H](CC(N)=O)N(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2151341164 WAKUEUKXOKEDSA-QTTZVWFDSA-N 342.193 1.135 10 10 EDCE Cn1nc(C(=O)C(=O)C[C@H]2C[C@H](N)C2)cc1NC(=O)OC(C)(C)C 2003167430 NIMDTNDAJVJHKB-MGCOHNPYSA-N 336.392 1.646 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)c1cnn(C)c1 2010402198 NITZABSEPQCSTR-LLVKDONJSA-N 337.384 1.755 10 10 EDCE N[C@H]1C(=O)Nc2cc(N(C3CC3)C3COC3)c(Br)cc21 2161345180 JOFSBZXTZVVOHV-CYBMUJFWSA-N 338.205 1.769 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2OCC[C@@]2(C(=O)N2CC(N=[N+]=[N-])C2)C1 2253375457 KNPXYAZNHZCTQC-XHDPSFHLSA-N 337.380 1.534 10 10 EDCE CN(C)CCN1CCC(CNC(=O)C=Cc2ccc(O)c(O)c2)CC1 2308001208 JPISUIHVYAQAPX-UHFFFAOYSA-N 347.459 1.501 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CSCCN2)c(O)c1Br 2352619798 JTJFUDVTMLIPDQ-SNVBAGLBSA-N 345.262 1.784 10 10 EDCE CCc1nc2n(n1)C[C@@H](NC(=O)N(C)Cc1ccccc1O)CC2 114978453 CXFZRSNHZXWQQJ-ZDUSSCGKSA-N 329.404 1.703 10 10 EDCE CCc1nc2n(n1)C[C@H](NC(=O)NCc1ccc(N(C)C)cc1)CC2 114875423 PBRYFUOIQOFMDX-CQSZACIVSA-N 342.447 1.721 10 10 EDCE CCNC(=O)C1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 178129076 CPWGCUZZXNHZSM-VMPITWQZSA-N 343.427 1.131 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2357593605 YFKFCLWSRRRWMZ-TYWRASTISA-N 341.249 1.789 10 10 EDCE CCNC(=O)[C@H]1CNCCN1Cc1cc(Cl)cc(Cl)c1O 89088414 YQGCHXMJSGOKBG-GFCCVEGCSA-N 332.231 1.609 10 10 EDCE O=C1c2cccc(OCCO)c2C(=O)c2c(OCCO)cccc21 90741382 VGBFJIMBMGKBOH-UHFFFAOYSA-N 328.320 1.204 10 10 EDCE NC(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255333171 ZSHVRTLGPXLAJV-SBSDFTTDSA-N 329.400 1.013 10 10 EDCE COCCN(CCOC)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 254942904 RXEZSSMCTOTVNN-YVMONPNESA-N 348.443 1.658 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1CCN(C2CCOCC2)C1=O 364982320 FESDWPNMWUXTAW-PMUGQKEBSA-N 346.383 1.007 10 10 EDCE C[C@@H]1CN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)CC(=O)N1C 282385604 NZANWNAZZDMQCU-SBJJXXPASA-N 343.427 1.226 10 10 EDCE c1cc(N2CCOCC2)ccc1CN[C@@H]1CCO[C@]2(CCOC2)C1 371407473 QJUGUYRFKJHZRN-IEBWSBKVSA-N 332.444 1.951 10 10 EDCE Cc1ccc(CNC(=O)c2c[nH]nc2CN)c(O)c1Br 2380754037 MGTBCYXVIWFDOB-UHFFFAOYSA-N 339.193 1.575 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H](N)C2COC2)c(O)c1Br 2380767611 HJTWNDSFVDVZFK-GFCCVEGCSA-N 343.221 1.395 10 10 EDCE CC(=O)N[C@H](CC(=O)OCC(=O)C(C)=O)c1ccc(F)cc1F 808520608 VIUANTJRAYZNIG-CYBMUJFWSA-N 327.283 1.233 10 10 EDCE COc1cc(Br)cc(CN2CCC(=O)N(C)CC2)c1O 827359477 OJKKWFQDJICTLZ-UHFFFAOYSA-N 343.221 1.827 10 10 EDCE O[C@@H]1C[C@@H]([C@H]2CCCOC2)N(Cc2ccc(N3CCOCC3)cc2)C1 824653742 GWTWHYPLOHOFRB-SXLOBPIMSA-N 346.471 1.885 10 10 EDCE Cc1cc(C)n(CC(=O)N2CCOc3ccc(N(C)C)cc3C2)n1 575541683 XKNALIBUCGPJMO-UHFFFAOYSA-N 328.416 1.987 10 10 EDCE C[C@@H]1C[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)c2ncnn21 849360248 ZWQNGWXOUZEGNV-PWSUYJOCSA-N 327.344 1.454 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H](C(C)C)[C@@H](C)NC(=O)OC(C)(C)C 842135770 RHJGLUVBGQYJFB-MFKMUULPSA-N 329.393 1.873 10 10 EDCE C[C@H](CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)NC(N)=O 847604927 RQPYAXYUWVVFPG-OCCSQVGLSA-N 335.404 1.347 10 10 EDCE Cn1ccnc1[C@H]1C[C@@H](NC(=O)NCc2c(O)cccc2F)CCO1 922797606 DIEZZMKAAICMNJ-XHDPSFHLSA-N 348.378 1.984 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@@H]2CC[C@H]3C[C@@H]23)c1 927481274 CATSQPGRWAIRJG-GVXVVHGQSA-N 338.429 1.930 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCc3nc(C)no3)C2)cc1 855231272 JPXMFWKBKGAFND-ZDUSSCGKSA-N 330.388 1.714 10 10 EDCE CCOCCO[C@H](C)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855231918 YPPJJHZVERBJEK-HUUCEWRRSA-N 336.432 1.832 10 10 EDCE C[C@]1(C2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)COC(=O)N1 928158933 ACDRPDQPYOKKDE-LKIHTYOGSA-N 346.383 1.848 10 10 EDCE CCN1CC[C@H](NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1=O 852315544 YJVDAGJRPGWQFP-BBRMVZONSA-N 346.431 1.194 10 10 EDCE COc1ccc(N2CC[C@H](N[C@H]3C(=O)NCC34CCOCC4)C2)cc1 926680786 RMXPGDZOSGWDOT-YOEHRIQHSA-N 345.443 1.159 10 10 EDCE CCS(=O)(=O)C1(CNCc2ccc(N3CCOCC3)cc2)CC1 850397916 KEPSPWNMDIGVCW-UHFFFAOYSA-N 338.473 1.580 10 10 EDCE COc1cccc(CNC(=O)NC[C@]2(OC)CCSC2)c1O 925365779 XJBLQMMMWVLTOW-OAHLLOKOSA-N 326.418 1.722 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)C(C)(C)n2cc(N)cn2)cc1 852792311 VKLIUYFMSAMUKL-OAHLLOKOSA-N 330.436 1.083 10 10 EDCE Cc1cc(NC(=O)C(=O)N(C)Cc2ccccc2O)c(N(C)C)nn1 850352253 PWIGIGPZOMSJIC-UHFFFAOYSA-N 343.387 1.154 10 10 EDCE CN1C(=O)[C@H](NC(=O)NCCc2ccc(N)cc2)Cc2ccccc21 851663104 SSSUATIYTRUBMD-MRXNPFEDSA-N 338.411 1.698 10 10 EDCE NC(=O)c1cccc(NS(=O)(=O)c2cc(F)cc(F)c2O)c1 753020689 UHZJWJJNRGPAQX-UHFFFAOYSA-N 328.296 1.570 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCn3c(O)nnc3C2)c([N+](=O)[O-])c1 763207783 YPHSDBPCWLPKGV-HYXAFXHYSA-N 345.315 1.098 10 10 EDCE CN1CCC2(CC1)CCN(C(=O)C(=O)Nc1ccc(N)cc1)CC2 868291185 DVUHTWQBWIFQIU-UHFFFAOYSA-N 330.432 1.542 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCO[C@H]3C)CC2)cc1 770721839 AMAPTGGXLMLDQE-YJBOKZPZSA-N 347.459 1.358 10 10 EDCE Cc1cc(C(=O)NC2(c3nn[nH]n3)CCC2)c(C)n1-c1ccccn1 1153872701 SGIASAVCNCKQSC-UHFFFAOYSA-N 337.387 1.811 10 10 EDCE COc1ccc(Br)c(CNCC(=O)NCC2CC2)c1O 1964078473 XLTDYQJRFLZYGY-UHFFFAOYSA-N 343.221 1.779 10 10 EDCE CNCc1ccc(N2CC[C@](C)(O)[C@H](O)C2)c(Br)c1 1893331992 NSXPEHSWSRFTDY-KGLIPLIRSA-N 329.238 1.491 10 10 EDCE C[C@H](N)c1ccc(N2CCN(C)[C@@H](CO)C2)cc1Br 687619180 ALPYUSLICUEPFE-CMPLNLGQSA-N 328.254 1.582 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1C[C@H]1C1CCOCC1 1335547879 HQFKJACKYJTYCR-HOTGVXAUSA-N 346.427 1.530 10 10 EDCE CO[C@@H](C)C(=O)N(C)C[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1280987822 ZJLRHTHWBGSHGR-QWRGUYRKSA-N 349.391 1.461 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)C(=O)C1CC1 1280504733 WUOYDEZJLATZAU-SNVBAGLBSA-N 331.376 1.836 10 10 EDCE COC1CCN(C(C)(C)CNC(=O)Cc2ccc(O)c(O)c2)CC1 1293588965 BOYDKZRWXBSDCI-UHFFFAOYSA-N 336.432 1.646 10 10 EDCE CC(=O)N/C(=C/C1=S=CC=C1)C(=O)Nc1cccc2nonc12 1627242884 KJVLDRSFPRAHGA-MDWZMJQESA-N 328.353 1.459 10 10 EDCE CC(C)Cn1[nH]c(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1=O 1556158185 UHZRWEWDLDMMDC-LBPRGKRZSA-N 347.415 1.534 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccccc1Cn1ccnn1 1630335383 ONKMJTSRPVWWBA-UHFFFAOYSA-N 338.367 1.710 10 10 EDCE Cn1cnc(C(=O)NCc2cccc(Br)c2O)cc1=O 1568605785 UTDMIWGZJFWSMS-UHFFFAOYSA-N 338.161 1.178 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCc1noc(C(F)(F)F)n1 1568299107 HYRFQPSXPPOLLP-DUXPYHPUSA-N 329.234 1.829 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](C(=O)N3CCCC3)C2)cc1 1569885049 HZKQFTAHQWHPAL-ZDUSSCGKSA-N 343.387 1.934 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)NCc2cc(O)ccc2O)C1 1643881800 GDYUQNCLRQBMRK-CYBMUJFWSA-N 348.399 1.971 10 10 EDCE NC(=O)c1ccc(OCCC(=O)NCc2c(O)cccc2O)cc1 1652626278 VWZRTRZIPKQAMX-UHFFFAOYSA-N 330.340 1.282 10 10 EDCE C[C@@H]1C[C@H]1C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1686871234 RIRAFZVKBWRANF-ZWNOBZJWSA-N 331.376 1.741 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCCN1CCNC1=O 1687629059 RIDYIUJBHQRJPV-UHFFFAOYSA-N 345.447 1.453 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)C[C@H]2CN(C)C)c(Br)c1 250911716 VGEPKWLCWXHWJI-KGYLQXTDSA-N 342.281 1.970 10 10 EDCE CNS(=O)(=O)c1ccc(C(=O)NCCc2ccc(N)cc2)cc1 152495852 GMSBWYQOJPALIS-UHFFFAOYSA-N 333.413 1.149 10 10 EDCE CCOc1ccc(O)c(CN(C2CC2)[C@@H]2CCS(=O)(=O)C2)c1 157080566 DPJSYCUTLMYFHV-CQSZACIVSA-N 325.430 1.942 10 10 EDCE C[C@H](N)c1ccc(N2CC(CNC(N)=O)C2)c(Br)c1 2130742938 HFNDECKIKIXGHQ-QMMMGPOBSA-N 327.226 1.573 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)C[C@H]2CO)cc1Br 2136081163 BBTBFOBAGBKRHJ-DLOVCJGASA-N 330.222 1.824 10 10 EDCE CN[C@H](c1ccccc1O)[C@]1(O)COC[C@H]1NC(=O)OC(C)(C)C 1920513111 MNNHNCFUBPRYFU-CPUCHLNUSA-N 338.404 1.307 10 10 EDCE Cn1ncc([C@H](N)c2ccccc2O)c1I 1936977344 UICVHTKMHNPGRQ-SNVBAGLBSA-N 329.141 1.778 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)[C@@H](C(=O)N(C)CCN=[N+]=[N-])CO1 1985094512 PYOZOXRLDKUELV-WDEREUQCSA-N 327.385 1.780 10 10 EDCE COC[C@H](ONC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010389957 WJLLWSLKUFDELK-QWRGUYRKSA-N 343.384 1.759 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010404686 BXBAVMBABCNAJA-GHMZBOCLSA-N 341.412 1.952 10 10 EDCE C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010406684 XUGGWDWSODQNEG-QJPTWQEYSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CC(=O)NCc2ccc(N)cc2)C1 2022803143 CEHKSRHLKOHDSP-UHFFFAOYSA-N 335.404 1.257 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NCc2ccc(F)cc2O)C1 2024891749 BICTYMIGNIWUDC-UONOGXRCSA-N 340.395 1.991 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC(C)(CO)C3)c(Br)cc21 2157304979 WSGPJIWYCRSFBZ-GFCCVEGCSA-N 340.221 1.480 10 10 EDCE NC(=O)NC1CN(c2ccc(CNC3CC3)c(Br)c2)C1 2163217701 VDMRMGHRYBSGRP-UHFFFAOYSA-N 339.237 1.558 10 10 EDCE NCc1ccc(N2CC[C@H](O)[C@H](CO)C2)c(F)c1Br 396912548 DPGUAWPFHGETLW-ONGXEEELSA-N 333.201 1.226 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC4(CCO4)C3)c(Br)cc21 2171804549 FYSPHZCNYRSJEK-GFCCVEGCSA-N 338.205 1.641 10 10 EDCE Oc1ccc(CNC[C@@H]2COCCN2Cc2ccccc2)c(O)c1O 2074174209 MCRCEGSGQFLTIV-MRXNPFEDSA-N 344.411 1.794 10 10 EDCE OCc1ccc(N2CCN(C3COC3)CC2)cc1Br 2113269181 QRFUWGJTLOLUIE-UHFFFAOYSA-N 327.222 1.462 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CN(c3ccc(N)cc3)C[C@H]2[C@@H]1CO 2214630010 DBQGIOMROXLQGA-MAZHCROVSA-N 333.432 1.933 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3COC[C@@]3(CO)C2)c(Br)c1 2234565790 ILQNWDVJPSZQPC-GMXABZIVSA-N 342.233 1.948 10 10 EDCE OCc1ccc(N2CC(O)(C(F)(F)CO)C2)cc1Br 2272877699 KJODXEXJTZAUFI-UHFFFAOYSA-N 338.148 1.120 10 10 EDCE CN1CCN(C2=NC(=O)C(=Cc3ccc(N(C)C)cc3)S2)CC1 2296680758 RRNSVDBLPXFNEG-UHFFFAOYSA-N 330.457 1.970 10 10 EDCE COC[C@@H]1[C@@H](O)[C@@H](O)CN1c1ccc(OCc2ccccc2)cc1 2299508020 NYTPZIUDDRJSGL-CEXWTWQISA-N 329.396 1.822 10 10 EDCE CCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1ccc(OC)cc1 490577933 VRDXAKDJPRSOPI-WDZFZDKYSA-N 343.383 1.159 10 10 EDCE COc1ncc(/C=C\C(=O)N2Cc3cnnn3Cc3ccccc32)cn1 491994439 VLCVVEIPEQJPCO-SREVYHEPSA-N 348.366 1.685 10 10 EDCE Cc1nn(Cc2ccccc2)c(C)c1C=C1C(=O)NC(=O)N(C)C1=O 2313548544 XZWMJOQWTZGBFR-UHFFFAOYSA-N 338.367 1.640 10 10 EDCE Cc1ccc(CN2CCC[C@@](N)(CO)C2)c(O)c1Br 2352683887 MAGLYVJTLUMIHN-AWEZNQCLSA-N 329.238 1.749 10 10 EDCE Cc1ccc(CN2CC[C@H](O)[C@@](C)(O)C2)c(O)c1Br 2352949485 FKJMQKXCDQAUTF-FZMZJTMJSA-N 330.222 1.781 10 10 EDCE CN(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCOC1 106537621 YLXXBFRLYLJBRF-CQSZACIVSA-N 337.395 1.593 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)Cn1nnc2ccccc21 173185818 LOWPXSUAGOSBNA-UHFFFAOYSA-N 337.383 1.923 10 10 EDCE Cc1cc(Cl)cc(CN2CCN(c3cnn(C)c3)C(=O)C2)c1O 180332723 UMYPDYWPSVWLNV-UHFFFAOYSA-N 334.807 1.936 10 10 EDCE COc1ccc(N2CCN(C(=O)Cn3ccc([C@H](C)O)n3)CC2)cc1 133732901 GGJUWOHAHSKKPH-AWEZNQCLSA-N 344.415 1.294 10 10 EDCE CN(Cc1ccccc1O)C(=O)[C@H]1CN(C(=O)C(C)(C)C)CCO1 369763590 PRDWVCCNEBUPKN-OAHLLOKOSA-N 334.416 1.624 10 10 EDCE Cc1ccc(CN=c2ccc3nnnn3[nH]2)c(O)c1Br 2380736472 COXZSFOHFHMDHM-UHFFFAOYSA-N 335.165 1.330 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@H]3CCOC3(C)C)nc12 295248994 QFRQDUHLWFRJLL-LBPRGKRZSA-N 334.376 1.269 10 10 EDCE NC(=O)c1c[nH]c(C(=O)NCc2cc(Br)ccc2O)c1 804733157 KKRZBOFRAGXCOC-UHFFFAOYSA-N 338.161 1.512 10 10 EDCE CCOc1cccc(CN2C[C@@H]3C[C@@H](N)C[C@]3(C(=O)OC)C2)c1O 903978226 BAJCIRSRUQBHNY-IYOUNJFTSA-N 334.416 1.503 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NCCN=c1cc[nH]cc1 734687260 QSLKXBFYHMGOSZ-UHFFFAOYSA-N 327.432 1.789 10 10 EDCE Cc1ccc([C@H](C)NCCS(=O)(=O)N=S(C)(C)=O)c(O)c1C 903228317 YLGNRVNICKJFBJ-LBPRGKRZSA-N 348.490 1.717 10 10 EDCE CC(C)[C@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)N1CCOCC1 588403307 JQUTWPMCTPFWBX-VOKGJARPSA-N 334.416 1.584 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@]12C[C@H]3C[C@H](C(=O)N1)[C@H]2C3 845113586 BILIOTRFUZENBY-AMVTXUCVSA-N 327.428 1.626 10 10 EDCE CN1CCCc2cc(CN3C(=O)N[C@@H](c4ccnn4C)C3=O)ccc21 843308736 ZSADXFRDWNGGMT-INIZCTEOSA-N 339.399 1.596 10 10 EDCE CC1(C)C[C@H]1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 751642482 FDHSBEGXPJOKRP-HNNXBMFYSA-N 336.457 1.584 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1ccc(C(N)=O)nc1 858826312 HECNDQGIBVOTOC-UHFFFAOYSA-N 340.427 1.838 10 10 EDCE O=[S@@](CCNCc1cc2c(cc1O)OCO2)CC(F)(F)F 850348641 QGOQCVVSDFNBGI-NRFANRHFSA-N 325.308 1.522 10 10 EDCE C[C@H](NCCc1nnnn1C)c1cc(Br)c(F)cc1O 756677581 RDYWNMWBTFDCMT-ZETCQYMHSA-N 344.188 1.711 10 10 EDCE CNC(=O)[C@@H](NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)C(C)C 852220700 HFSFVHYAVZYJLE-BBRMVZONSA-N 348.447 1.344 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)[C@H]3CCCN3C(C)=O)C2)cc1 868956106 KLRFGAODVXQBIG-MAUKXSAKSA-N 345.443 1.649 10 10 EDCE CC(=O)Nc1ccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)nc1 773756623 KXPYYRBWJBWNTC-JTQLQIEISA-N 329.356 1.812 10 10 EDCE CS(=O)(=O)c1csc(C(=O)NCc2ccc(O)c(O)c2)c1 778915823 WCZDAGVEYOYLDU-UHFFFAOYSA-N 327.383 1.493 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CC[C@@H](n2cncn2)C1 897441651 XEGSAQXQOPIZFI-SNVBAGLBSA-N 330.369 1.991 10 10 EDCE COC(=O)c1c(CN2CC3(CNC(=O)O3)C2)c2cc(F)ccc2n1C 895037000 YFBOYFDXYHZDKP-UHFFFAOYSA-N 347.346 1.398 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1C(=O)N(C)CCNCc1ccc(OC)c(C)c1 1317573603 JSOZOTZYQOHYSW-LSDHHAIUSA-N 334.416 1.361 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2ccco2)cc1C 1279638954 FPMIDSFZRLIIIN-UHFFFAOYSA-N 332.400 1.821 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1Cc1cnn(C)c1 1292839828 CNYASARCKMJOHS-UHFFFAOYSA-N 326.404 1.964 10 10 EDCE CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1293690610 ISLNFJNXZHGIMW-VXGBXAGGSA-N 327.402 1.112 10 10 EDCE CC1(C(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)CCC1 1522716308 LSMLSQHUROAFSS-UHFFFAOYSA-N 331.376 1.885 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2cnnc(O)c2)cc1C 1715341690 VJNBLCOJABHJOI-CYBMUJFWSA-N 344.415 1.750 10 10 EDCE CCC1(CC)CNC(=O)[C@@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1558541616 DVBDLRNCCSNUQI-LBPRGKRZSA-N 331.376 1.884 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@H]2COC(=O)C2)cc1C 1567010626 XQAPUNLQWFBKDR-DZGCQCFKSA-N 334.416 1.551 10 10 EDCE CC[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)C[C@H](C)S1(=O)=O 1636136207 DQRCIIPAAKFWJC-CMPLNLGQSA-N 327.402 1.064 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@@H](CCNCCCO)C2)cc1 1733678819 ZJMAQOUXIMBRQG-CYBMUJFWSA-N 347.419 1.673 10 10 EDCE CC(C)(C)OC(=O)[C@@]1(C(=O)NCc2cc(O)ccc2O)CCCO1 1644753542 CWDDGITYJPQIMX-KRWDZBQOSA-N 337.372 1.605 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2CCC(=O)NC2)cc1C 1734332408 UGKQLWDPRUVTPU-HOCLYGCPSA-N 347.459 1.466 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1C[C@H](c2ccccc2)[C@@](F)(CO)C1 1641673922 UYLQXDYREMTWDW-BEFAXECRSA-N 345.370 1.967 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](O)C[C@@H]2CO)c(Br)c1 2136087376 DHPXBKGOIBVMNE-MVWJERBFSA-N 329.238 1.791 10 10 EDCE C[C@H](NCc1cc(F)ccc1O)C1(O)CN(C(=O)OC(C)(C)C)C1 1918695542 YIAHULAATTWFRB-NSHDSACASA-N 340.395 1.991 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@@H]1C(=O)NCc1ccccc1O 2010044320 CRHKVCLERODXJJ-JSGCOSHPSA-N 336.388 1.691 10 10 EDCE CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2020666794 TYVSLJXXIUHHQD-KRWDZBQOSA-N 335.404 1.604 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2C[C@@H](C(=O)NCCN=[N+]=[N-])C[C@@H]21 2022253698 MWDHXKZYCSPNHG-SDDRHHMPSA-N 339.396 1.827 10 10 EDCE CN(C)C[C@@]1(O)CCN(c2cc(Br)c(CN)cc2F)C1 713662933 QDOUTLGYNZRYSR-AWEZNQCLSA-N 346.244 1.550 10 10 EDCE COC(=O)c1c(C2CCCCC2)nn2c(O)cc(CC(=O)O)nc12 2080933734 SNRMKGZEJXHNFA-UHFFFAOYSA-N 333.344 1.896 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C(=O)NCc1ccccc1O 1186926797 WIQMEEAQTMZBDY-QWHCGFSZSA-N 336.388 1.548 10 10 EDCE CCn1nnc(CN(C)c2cc(Br)c(CN)cc2F)n1 2197845560 ISOSUIJCESBCEZ-UHFFFAOYSA-N 343.204 1.690 10 10 EDCE CC(C)(C)OC(=O)NCc1nc(NC(=O)c2cccc(O)c2O)n[nH]1 2063177041 MONBHLIONNYNSA-UHFFFAOYSA-N 349.347 1.493 10 10 EDCE COCC1(C(=O)N2CC(N=[N+]=[N-])C2)CC(NC(=O)OC(C)(C)C)C1 2213235221 SKRPVEOVONSFTB-UHFFFAOYSA-N 339.396 1.827 10 10 EDCE NCc1cc(F)c(N2C[C@H]3COC[C@@]3(CO)C2)cc1Br 2234557517 BPMMKXGNUOJMSR-HZMBPMFUSA-N 345.212 1.492 10 10 EDCE C[C@]1(CO)C=CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2237169742 HZYKHJWZFGFIKS-GXTWGEPZSA-N 338.205 1.528 10 10 EDCE CCNCc1ccc(N2CC[C@@H]2[C@H](O)CO)cc1Br 2270717902 IOTVJSMNRPYJHN-ZIAGYGMSSA-N 329.238 1.491 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2OCC[C@H]2N)c(O)c1Br 2352629907 ZGRSQOUBJNXTSC-SKDRFNHKSA-N 329.194 1.196 10 10 EDCE Cc1ccc(CN2CC[C@H](O)[C@H](O)CC2)c(O)c1Br 2352690600 SHFFLJPUVYHZDO-TXEJJXNPSA-N 330.222 1.781 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CN2CCn3c(nnc3C(F)(F)F)C2)c1 172656422 AYBHJWOUQIXRJD-UHFFFAOYSA-N 343.265 1.927 10 10 EDCE CC[C@H](C)[C@@H](NC(N)=O)C(=O)NCc1ccc(N2CCCC2)cc1 41365560 KSEASRGZPPBDEI-XJKSGUPXSA-N 332.448 1.986 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCO[C@@H]([C@H]2CCCO2)C1 247240059 WSZKGECLNPNHJQ-RTBURBONSA-N 332.444 1.903 10 10 EDCE CN1CCC[C@@H]1CNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 264888480 JJGAGVSHJCBYJV-AHKGRUIUSA-N 329.444 1.747 10 10 EDCE COC[C@H](N)CC(=O)N(C)Cc1ccc(C)c(Br)c1O 2380759831 RRHPYMNOBNIEPX-LLVKDONJSA-N 345.237 1.785 10 10 EDCE Cc1ccc(CN2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(O)c1Br 2380804213 LBNQUONOGCUAFL-QFEPDWEUSA-N 342.233 1.779 10 10 EDCE Cc1ccc(CNC2CCN(CCN)CC2)c(O)c1Br 2381139058 ZTGFJKYKLIFXSC-UHFFFAOYSA-N 342.281 1.976 10 10 EDCE CN1CCN(C[C@H](O)CNc2ccccc2OCC(F)F)CC1 819460993 YKJPKZMKZXINMA-CYBMUJFWSA-N 329.391 1.351 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)N[C@@H](CN)C(F)(F)F 655924961 UEZLLNLWITZXFM-LBPRGKRZSA-N 332.326 1.551 10 10 EDCE COCCN1CCC[C@@H]1CN1C(=O)CN(Cc2ccccc2O)C1=O 819169159 YUVQRJBPEHDNMF-OAHLLOKOSA-N 347.415 1.267 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCC1(CCO)CC1 823537450 NXZMIDJDDCJMLI-UHFFFAOYSA-N 347.459 1.610 10 10 EDCE COc1cc(O)c(CNC2CCC(N3CCNCC3)CC2)cc1OC 841086398 AEFSESOYBBGJLD-UHFFFAOYSA-N 349.475 1.715 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC(C)(C)O[C@@H]3COC[C@H]32)cc1 844470225 MQLMFMWPSRLRFD-IAGOWNOFSA-N 347.459 1.247 10 10 EDCE Cc1cc(CC(=O)N2CC(S(C)(=O)=O)C2)c(C)n1-c1ccccc1 854891552 NQOQVISNKZCHDY-UHFFFAOYSA-N 346.452 1.892 10 10 EDCE CC[C@@H](NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)C(=O)NC 852448173 HFJQIVDFCRWKQY-SWLSCSKDSA-N 334.420 1.098 10 10 EDCE COCCn1ccc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1 855228336 ZZJKJCXXWCEGPO-CQSZACIVSA-N 344.415 1.547 10 10 EDCE C[C@@H](NC(=O)C(=O)NCC1(C(=O)O)CCC1)c1ccc(N(C)C)cc1 851680319 GJXXARTUJRAROG-GFCCVEGCSA-N 347.415 1.301 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cc(C(C)(C)N)no3)CC2)cc1 852854627 LKFSOMMINQHPTI-UHFFFAOYSA-N 344.415 1.839 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)COCc3nccn3C)C2)cc1 855223988 DGUMIDDJZZEEPZ-CQSZACIVSA-N 344.415 1.340 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C2)cc1 855232540 RSDRZVOWIZJBTC-ZIAGYGMSSA-N 347.459 1.941 10 10 EDCE O=C1[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CCN1C1CCC1 863540164 ROGXBAYVXANOHO-CQSZACIVSA-N 343.383 1.310 10 10 EDCE Cc1cccc(=O)n1C[C@](C)(O)C(=O)N1Cc2cccc(O)c2C1 871204644 NHNBTJCJCOLMRE-SFHVURJKSA-N 328.368 1.156 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC(O)(COCCO)CC2)c1O 886743216 XRYWVTUNEWPTIB-UHFFFAOYSA-N 341.379 1.070 10 10 EDCE CN1CCCc2cc(CNC(=O)[C@@H](O)Cc3cnn(C)c3)ccc21 786848713 OPZXDCIAWGBDOH-KRWDZBQOSA-N 328.416 1.022 10 10 EDCE C[C@@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1O 1151886198 ZDOIRAHUVXHIQX-LLVKDONJSA-N 343.339 1.908 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2[C@H](C(=O)NCCCN=[N+]=[N-])[C@H]21 1964884950 VBLDXOFKEKQLCH-GMTAPVOTSA-N 325.369 1.437 10 10 EDCE COC[C@H](OC)C(=O)Nc1c(-c2ccccn2)nc2ccccn12 1515043810 PWBOQOHKEOLUBC-ZDUSSCGKSA-N 326.356 1.996 10 10 EDCE CC[C@@H](CNC(=O)c1cnco1)NC(=O)c1cc(OC)nc(OC)c1 1704662188 CHKVGKBJZIWILR-NSHDSACASA-N 348.359 1.025 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2c(C)cnn2C)cc1C 1713623843 SNTNWQZOYMEQDA-UHFFFAOYSA-N 330.432 1.907 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C2CC=CC2)cc(OC)n1 1720903478 IXKJVYJTZYEZBY-LLVKDONJSA-N 333.388 1.300 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)C2=COCCO2)cc1C 1567205974 NJPDSMOIYMDRMC-CQSZACIVSA-N 334.416 1.876 10 10 EDCE COc1cccc(CNC(=O)c2ccc(-n3nnnc3C)cc2)c1O 1566373946 NDYRRDDOMPTKKQ-UHFFFAOYSA-N 339.355 1.615 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2nocc2C)cc1C 1568586528 NRRCMNWEBMZYNF-CQSZACIVSA-N 333.388 1.181 10 10 EDCE CS(=O)(=O)c1ccc(N)c(C(=O)NCc2cc(O)ccc2O)c1 1644756827 INDZEDNOQPIEOF-UHFFFAOYSA-N 336.369 1.014 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@H]2CN3CCC2CC3)cc1C 1690575735 ZMMPQJQMWZJIJU-QAPCUYQASA-N 345.487 1.940 10 10 EDCE COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1cc(O)c(O)c(O)c1 1865876039 OCIKZQNOKCPEMB-LBPRGKRZSA-N 347.323 1.023 10 10 EDCE COc1cc(O)c2c(c1)O[C@H](O)[C@@]1(Cc3cc4c(cc31)OCO4)C2=O 14692689 HQNATRVFSYNBMS-ZWKOTPCHSA-N 342.303 1.517 10 10 EDCE biogenic CN(C)c1ccc(CNCCC(=O)NCCCN2CCOCC2)cc1 1857858679 CGQYHVSYUBJCCJ-UHFFFAOYSA-N 348.491 1.071 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2303236282 CZODPBSCTQCOPZ-LBPRGKRZSA-N 341.412 1.765 10 10 EDCE COCCNC(=O)CN(C)c1ccc(CN)c(Br)c1 228150222 NOTYCMVYYYLVFC-UHFFFAOYSA-N 330.226 1.107 10 10 EDCE CC(C)(C)NCc1ccc(N2C[C@@H](O)[C@H](O)C2)cc1Br 232494391 DAIPDNVPNOPXRI-ZIAGYGMSSA-N 343.265 1.879 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CC(=O)O)c1ccc(O)c(O)c1O 1951478594 UURDNVPUDPYODO-QMMMGPOBSA-N 327.333 1.886 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@@H]1COC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985101560 UOQABOZKKBAJIT-WDEREUQCSA-N 325.369 1.389 10 10 EDCE COc1ccc(O)c(CNC[C@@H](CO)NC(=O)OC(C)(C)C)c1 1985852625 FYDXWNOANVASNU-LBPRGKRZSA-N 326.393 1.376 10 10 EDCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)NCC2(CN=[N+]=[N-])CC2)C1 2010392362 FTDPHQTYWOUFHW-UHFFFAOYSA-N 339.396 1.423 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1C[C@H](O)CCN1C(=O)OC(C)(C)C 2010405834 MKPVYZLZPNMOJS-VXGBXAGGSA-N 341.412 1.906 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@@H](O)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2010404687 BXBAVMBABCNAJA-MNOVXSKESA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccccc1O)C1COC1 2010244227 VHNZHZBKERZPHF-CQSZACIVSA-N 336.388 1.548 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)CC(O)C1 2018045695 IICYZCFUGLRRQG-NLTNOIMHSA-N 339.396 1.706 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1ccncc1 2022928577 XZAMFJIPVSVGEQ-KGLIPLIRSA-N 333.388 1.629 10 10 EDCE NCc1ccc(N2CCN3C[C@H](O)C[C@H]3C2)c(Br)c1 405273282 SWVKEMVCRZVUEC-NWDGAFQWSA-N 326.238 1.163 10 10 EDCE CN=c1[nH]cc(Br)c(=NCc2ccc(N(C)C)cc2)[nH]1 2160471117 XOLAHDPEGJERTI-UHFFFAOYSA-N 336.237 1.803 10 10 EDCE NCc1ccc(N2C3COCC2COC3)c(F)c1Br 399765137 HBDRXNZPKNOWEG-UHFFFAOYSA-N 331.185 1.651 10 10 EDCE CCn1cnc2c1CCN(C(=O)c1cnn3c(O)cc(C)nc13)C2 2062280568 AWXPGGSVRBZELI-UHFFFAOYSA-N 326.360 1.158 10 10 EDCE COC(OC)C(=O)N1CCN(Cc2cc(Cl)ccc2O)CC1 2063943628 JOVOVRUYAJMWDQ-UHFFFAOYSA-N 328.796 1.309 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H](C)CN3CCC[C@@H](C)C3)c2n1 2064763067 MDKPKLOIWZVONS-DGCLKSJQSA-N 331.420 1.594 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(O)c(O)c2)CC[C@H]1NC(=O)C(F)(F)F 2054398426 YDQFRGMNKFYNDJ-WCBMZHEXSA-N 346.305 1.627 10 10 EDCE CN1CCc2cc(CN[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O)ccc21 2062449523 AHNFHSCIAQNMIH-WBVHZDCISA-N 347.459 1.749 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCN(C(N)=O)C2)c1O 2236048237 AFGSOASKXQIYDZ-MRVPVSSYSA-N 344.209 1.406 10 10 EDCE NCc1ccc(N2C[C@@H]3CC[C@@H](CO)O[C@@H]3C2)c(Br)c1 2289196876 GTYUSLNTZAFNSA-SLEUVZQESA-N 341.249 1.884 10 10 EDCE NCc1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2332599611 SHACYTULFLPQGC-PCDDKUFXSA-N 327.222 1.228 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3[C@H](C2)CS3(=O)=O)cc1Br 2336345755 RMAJIXSWFZUIQL-JRKPZEMJSA-N 346.246 1.736 10 10 EDCE COCC[C@@H](N)C(=O)NCc1ccc(C)c(Br)c1O 2352949038 XQNCFOOTAALLQA-SNVBAGLBSA-N 331.210 1.443 10 10 EDCE O=C([C@@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2O)C1)N1CCOCC1 170908052 ZUVJQBQPFSKNKZ-CYBMUJFWSA-N 349.387 1.371 10 10 EDCE C[C@H]1CN(CCCNC(=O)CN(C)Cc2ccccc2O)C[C@H](C)O1 171936607 CMZLROYESAMYGT-HOTGVXAUSA-N 349.475 1.440 10 10 EDCE CCOC(=O)CN(CC)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 170998172 SUOXWHJBCHLUDR-JXMROGBWSA-N 346.427 1.948 10 10 EDCE O=C(CC1(O)C(=O)c2ccccc2C1=O)c1ccc2c(c1)OCCO2 33865655 AIBMYJZNUBFCQN-UHFFFAOYSA-N 338.315 1.841 10 10 EDCE CNC(=O)c1ccc(N[C@@H](C)c2ccc(N3CCOCC3)cc2)nn1 74743428 QSTIJSDNXKZQFN-ZDUSSCGKSA-N 341.415 1.846 10 10 EDCE CC(C)[C@H](CO)N(C)c1cc2c(cc1Br)[C@H](O)C(=O)N2 2367104931 WKZFKCTUNPVVSQ-STQMWFEESA-N 343.221 1.888 10 10 EDCE N[C@H](c1cc(I)ccc1O)C(F)(F)C(=O)O 95769533 ZBXTYYXYWDAPTK-SSDOTTSWSA-N 343.067 1.717 10 10 EDCE NC(=O)[C@H]1CCN(c2ccc(/C=C/C(=O)O)cc2Br)C1 236284004 AUFYSLQJVUXNGH-YWNRKNDBSA-N 339.189 1.859 10 10 EDCE CCCS(=O)(=O)NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255031956 MFCRMWKYASZFBS-YVMONPNESA-N 338.429 1.392 10 10 EDCE CCN(CC(=O)O)C1CC(NC(=O)N(C)Cc2ccccc2O)C1 263503566 WHKFFCFZFOYELN-UHFFFAOYSA-N 335.404 1.471 10 10 EDCE CN1CCc2cc([C@@H](NN)c3cc(Br)n(C)n3)ccc21 2163140708 MKDRCTHUURACPL-CQSZACIVSA-N 336.237 1.728 10 10 EDCE O=C(COC1CCOCC1)NCc1cc(Br)ccc1O 804738188 GKXMRWYQKJAPFE-UHFFFAOYSA-N 344.205 1.967 10 10 EDCE COC(=O)CCS(=O)(=O)Nc1ccc(O)c(COC(C)C)c1 290552321 QOPLXHYJKWYFQC-UHFFFAOYSA-N 331.390 1.622 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CC(C)C 808513966 RALIFBYWVNIYPD-INIZCTEOSA-N 345.395 1.687 10 10 EDCE O=C1CN(Cc2ccc(Br)cc2O)CCN1C1CC1 824818563 ICWFGANKJLHFGA-UHFFFAOYSA-N 325.206 1.961 10 10 EDCE C[C@]1([C@@H]2CCCN(Cc3cc4c(cc3O)OC[C@H]4O)C2)COC(=O)N1 905700629 IPUPHPWZJLPFQY-CDHAZOANSA-N 348.399 1.529 10 10 EDCE C[C@@H](NC(=O)N[C@H](CO)c1ccnn1C)c1ccc(N(C)C)cc1 838560490 XTMZMLWDDXYLKJ-IUODEOHRSA-N 331.420 1.580 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCO[C@H](C3CCC3)C2)cc1 839622356 CBXYHHJTUSYWRK-SFHVURJKSA-N 331.460 1.870 10 10 EDCE C[C@@H](NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)C(C)(C)C 846721731 OZAAJRIJSKGSMK-CQSZACIVSA-N 347.459 1.690 10 10 EDCE Cc1nn(CC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c(=O)o1 849983130 CONAXQODLFEGPI-UHFFFAOYSA-N 332.404 1.648 10 10 EDCE CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)NCCc1ccc(N)cc1 841960116 VHDOOGQRAXHYQK-HOTGVXAUSA-N 349.431 1.563 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCCc1nnnn1C 840337539 ZPIRUNBLUWXDDI-CYBMUJFWSA-N 345.451 1.057 10 10 EDCE CCNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nn1 853759432 UONLJJNULPFFEE-ZDUSSCGKSA-N 341.415 1.926 10 10 EDCE CC(C)(C)OC(=O)[C@@]1(NC(=O)/C=C\c2ccc(O)c(O)c2)CCOC1 855639092 ADKOCSGOJULBAS-LZCIBIBXSA-N 349.383 1.728 10 10 EDCE CCN1CN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 852451342 IMKVGKWYUHPPSN-CYBMUJFWSA-N 332.404 1.105 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2ccc(N(C)C)c(C)c2)C1 860193862 PVOLORNQMSCHPE-INIZCTEOSA-N 339.505 1.822 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CC[C@@H](C)NC2)cc1 861767589 SXMDXMXNQSHEPB-ZBFHGGJFSA-N 346.475 1.406 10 10 EDCE COC[C@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C(C)C 1119756380 KARVGPMJSZWRNJ-HOCLYGCPSA-N 349.475 1.965 10 10 EDCE COC(=O)[C@H](NCc1cc2c(cc1O)OCO2)c1cccc(O)c1 792178299 BDRABKFBIPSMNS-MRXNPFEDSA-N 331.324 1.830 10 10 EDCE COC(=O)c1cn(CC(=O)NCc2c(O)ccc3ccccc23)nn1 1304089536 AHWZSDDYBRIAGP-UHFFFAOYSA-N 340.339 1.240 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2cnc(O)n2C)cc1C 1319224931 LPSIHQAYRXMLHF-GFCCVEGCSA-N 346.431 1.598 10 10 EDCE CCOC[C@H](C)NC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1324371449 MUZDOFRXVIDBDV-AWEZNQCLSA-N 347.459 1.785 10 10 EDCE CCOc1ccc(N2CCN(C(=O)c3cnn(C)c3OC)CC2)cc1 1325565619 SYOFSVFWRJJXJZ-UHFFFAOYSA-N 344.415 1.790 10 10 EDCE CCNCc1ccc(N(C)Cc2nnnn2C)c(Br)c1 707677554 RPJPGZMWITUCOF-UHFFFAOYSA-N 339.241 1.719 10 10 EDCE CN[C@H](C)CCNC(=O)NCc1cc(Br)ccc1O 1326131772 DEWDIXWGCHALPA-SECBINFHSA-N 330.226 1.952 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)[C@@H]2C[C@@H]3C[C@@H]3C2)cc1C 1279801093 SHZDTBIPPGCVAU-PIIMJCKOSA-N 346.471 1.960 10 10 EDCE CNC(=O)NCC(=O)NCC1(NCc2ccc(OC)c(C)c2)CCC1 1273091209 RLUSGWUTIGTGBY-UHFFFAOYSA-N 348.447 1.061 10 10 EDCE NC[C@]12CN(Cc3c(O)cccc3Br)C[C@H]1CCO2 2118554302 DGRFCVXSWVUSIP-YGRLFVJLSA-N 327.222 1.704 10 10 EDCE C[C@@H](NC(=O)c1ccnc(CO)c1)c1ccc(N2CCOCC2)cc1 1464528913 MAFCVHVPRZMQLF-CQSZACIVSA-N 341.411 1.902 10 10 EDCE NC(=O)c1ccc(CNC(=O)c2cc3cc(O)c(O)cc3s2)cn1 1465973372 CMTVCLMVVATAAJ-UHFFFAOYSA-N 343.364 1.736 10 10 EDCE Cc1cc(Br)cc(CN2C[C@@H]3OC(=O)N[C@@H]3C2)c1O 2120406534 RJXUFJYENZSEPL-MNOVXSKESA-N 327.178 1.756 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCN1CCSCC1 1612537332 CKUHAVJPGIJZNU-UHFFFAOYSA-N 347.488 1.977 10 10 EDCE C[C@H](O)c1ccc(N2CCC[C@@H]2[C@@H](O)CO)c(Br)c1 2123168639 BPJNJGQJIPALFV-FZZIBODNSA-N 330.222 1.824 10 10 EDCE CC[C@H](CNC(=O)[C@H]1CCN(C)C1=O)NCc1ccc(OC)c(C)c1 1481841910 DUZXWNUAVUXSLB-HZPDHXFCSA-N 347.459 1.466 10 10 EDCE CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1621215701 BBMAWSYUNLYKIN-VJBOLBCHSA-N 325.430 1.836 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cccnc2)cc1C 1496927156 GTWBWBVMEXOSJF-MRXNPFEDSA-N 329.400 1.279 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2cn(C)c(O)n2)cc1C 1733011600 GSUYAVOGNQZOFV-LBPRGKRZSA-N 332.404 1.351 10 10 EDCE CC(C)(C)C(=O)N1CCC[C@@H](C(=O)NCc2c(O)cccc2O)C1 1645360694 FRLCEVSFBDOVDW-GFCCVEGCSA-N 334.416 1.999 10 10 EDCE COCCN[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@H]1C 1676694950 UXMVCKFSCFXLCK-SMDDNHRTSA-N 333.392 1.688 10 10 EDCE C[C@@H](CNCC[C@@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1699434075 UDGQKGFAJQJVNM-QWHCGFSZSA-N 347.419 1.984 10 10 EDCE C[C@@H](CCO)N(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 1917089915 DZVDZOFLPQNMKY-JVXZTZIISA-N 329.194 1.642 10 10 EDCE CNCc1ccc(N2CC[C@H](O)[C@](C)(O)C2)cc1Br 2136833222 NPOBMMYGZMMQJY-UONOGXRCSA-N 329.238 1.491 10 10 EDCE CN1CCN(c2ccc(CNC3CC3)c(Br)c2)CC1=O 234357850 CVJUVIJWNNTNRZ-UHFFFAOYSA-N 338.249 1.980 10 10 EDCE C[C@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)Cc1ccc(N)cc1 1977685693 WJUJAINXVWWPFK-LLVKDONJSA-N 343.449 1.601 10 10 EDCE CC1(C)C[C@H](O)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2154834265 ZXZISQSURMRQAX-JVXZTZIISA-N 340.221 1.751 10 10 EDCE Cc1cccc(O)c1CN=c1nc(CNC(=O)OC(C)(C)C)[nH][nH]1 2011844616 YNERAEBWHLYEDN-UHFFFAOYSA-N 333.392 1.877 10 10 EDCE C[C@H](C(=O)N(C)CCCN=[N+]=[N-])N1CC(NC(=O)OC(C)(C)C)C1 2014687252 VHOAQQQDIZYKRC-LLVKDONJSA-N 340.428 1.743 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H](C)[C@@H](O)C3)c(Br)cc21 388158544 SXZBFVOQDGQIKF-RDZIJCNDSA-N 340.221 1.479 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H]3c3ccnn3C)c2n1 2065177305 PKHLGVCTFYNYPT-ZDUSSCGKSA-N 326.360 1.454 10 10 EDCE CCN(C)C1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2169443416 SKARTBDHGSIHJE-ZDUSSCGKSA-N 340.221 1.575 10 10 EDCE NCc1cc(F)c(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2199532602 QPUVPPHNKUMKCM-BFFTYQLQSA-N 345.212 1.367 10 10 EDCE O=C(O)CCN1C(=O)C(=Cc2ccc(O)c(O)c2)SC1=S 2293031152 VKFKRUBGSQHJSA-UHFFFAOYSA-N 325.367 1.774 10 10 EDCE CCNC[C@H]1C[C@H](S(=O)(=O)NCc2cnc(SC)s2)C1 2284689355 NQDAHWHECNXFPZ-HOMQSWHASA-N 335.520 1.673 10 10 EDCE CNC(=O)c1cncc(C=CC(=O)N2CCOc3ncc(C)cc32)c1 2304838078 LOZHSLLFSHTAHD-UHFFFAOYSA-N 338.367 1.583 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)cc1Br 2329194023 YCRCVZPOACPPDE-DQBQHTNRSA-N 327.222 1.665 10 10 EDCE Cc1ccc(CNC[C@@H]2CNCCOC2)c(O)c1Br 2352947793 KNZGXKSVYKJSCW-NSHDSACASA-N 329.238 1.789 10 10 EDCE CC1=NN(c2nc(C)cc(=O)[nH]2)C(=O)/C1=C/c1ccc(N(C)C)cc1 8462492 ALQJJEDCOWZHSI-XNTDXEJSSA-N 337.383 1.950 10 10 EDCE COCCN1CCN(CC(=O)NCc2ccc(N(C)C)cc2)C[C@@H]1C 105832717 BXYVRTKTUWIZNR-INIZCTEOSA-N 348.491 1.021 10 10 EDCE CCOc1ccccc1[C@H]1CC(=O)NC(NC(=O)c2cccnc2)=N1 20924913 HRFMXZSHLJYSCJ-CQSZACIVSA-N 338.367 1.827 10 10 EDCE Cc1noc(CCNC(=O)c2c(C)oc(-n3cccc3)c2C#N)n1 64315373 GAMREUOQCVTYLM-UHFFFAOYSA-N 325.328 1.914 10 10 EDCE CN1CCCc2cc(CNC(=O)C3CCN(C(N)=O)CC3)ccc21 60456247 KYUIONUXJPNNEZ-UHFFFAOYSA-N 330.432 1.476 10 10 EDCE CNCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)cc1Br 2357054312 GTYRXKYPZQGHPF-BEAPCOKYSA-N 341.249 1.631 10 10 EDCE COc1ccc(N2CCOCC2)cc1NC(=O)Cc1noc(C)n1 62274219 KESGVQGJHMJGCQ-UHFFFAOYSA-N 332.360 1.404 10 10 EDCE C[C@@H](Nc1cncc(C(N)=O)n1)c1ccc(N2CCOCC2)cc1 301496276 BYWCTDSTCGFACD-GFCCVEGCSA-N 327.388 1.585 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@@H]3[C@@H]4CO)c(Br)cc2[C@H]1O 2358060595 VKVFVBGIRNGYLT-VHQAPHLWSA-N 339.189 1.252 10 10 EDCE COc1cc(C)cc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)c1O 120838548 OAMNREOLUYZFLM-OAHLLOKOSA-N 348.443 1.780 10 10 EDCE C[C@H](O)C1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 78643121 WUSXERQZMMAULB-HNNXBMFYSA-N 333.476 1.804 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)[C@H](C)C[S@@](C)=O)c([N+](=O)[O-])c1 182945318 MSJSCLSYZOVYBB-ZIZZFCHSSA-N 340.401 1.984 10 10 EDCE COc1ccc(N2CCN(CCC(=O)NC[C@@H]3CCCO3)CC2)cc1 243583971 OQBOSQYHFPFUDQ-SFHVURJKSA-N 347.459 1.503 10 10 EDCE Cc1ccc(C(=O)N(C)C2CCN(c3cnccn3)CC2)c(O)c1O 366092497 NKTHKIFTTIKVLK-UHFFFAOYSA-N 342.399 1.937 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@@H](CO)C[C@@H](O)C(C)(C)C)c1 284543167 XOKGPLJEWJTKQP-NORZTCDRSA-N 339.432 1.987 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCO[C@H]([C@@H]4CCCO4)C3)cc2N1 376192458 ZFGUVKRJXPAYEC-ZFWWWQNUSA-N 349.343 1.310 10 10 EDCE Cc1ccc(CN[C@@H]2CCn3nnnc3C2)c(O)c1Br 2380798808 SRZJUJMLERJZEZ-SNVBAGLBSA-N 338.209 1.554 10 10 EDCE Cc1ccc(CN2C[C@@H](N)CC[C@H]2C(=O)O)c(O)c1Br 2380800791 LNBJZMMENKSXDE-QWRGUYRKSA-N 343.221 1.839 10 10 EDCE Cn1ncc(CNC(=O)NCc2cc(Br)ccc2O)n1 805994103 BSQJQJPJVDOQOH-UHFFFAOYSA-N 340.181 1.283 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)NCc1cc(Cl)cc(Cl)c1O 813686261 XGJVTZQJHSYISY-JTQLQIEISA-N 336.171 1.629 10 10 EDCE CN(C)c1ccc(CN2CCC(CO)(CO)C2)c(C(F)(F)F)c1 827474689 JNYRTDXEWQMGDY-UHFFFAOYSA-N 332.366 1.948 10 10 EDCE O[C@@H]1C[C@H]([C@@H]2CCCOC2)N(Cc2ccc(N3CCOCC3)cc2)C1 824653740 GWTWHYPLOHOFRB-MISYRCLQSA-N 346.471 1.885 10 10 EDCE CCC(CC)CNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 826834782 XBDYGOULVWCRCY-OAHLLOKOSA-N 347.459 1.943 10 10 EDCE COC(=O)c1cn(CN(C)CCN(C)c2ccc(OC)cc2)nn1 844725213 IHOQHPFPKXOPDG-UHFFFAOYSA-N 333.392 1.099 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1CC[C@H](C(=O)O)C1)c1ccc(N(C)C)cc1 843256792 HYPWVWQBFKIJIC-FPMFFAJLSA-N 347.415 1.299 10 10 EDCE COC(=O)[C@@H]1CSCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 840567567 VOBFAIHCGUJLMR-PYEVWLCESA-N 337.397 1.476 10 10 EDCE C[C@H](NC[C@H](O)[C@H]1CCCO1)c1ccc(N2CCOCC2)c(F)c1 858469668 XXALTDHPLAGWHO-DOPJRALCSA-N 338.423 1.853 10 10 EDCE CC[C@@H]1C[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CO1 850135933 SKPOQPYPISMCBB-NVXWUHKLSA-N 338.473 1.579 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3c[nH]cc(C)c3=O)C2)cc1 855227914 RLQWTAJWZPEXIW-ZDUSSCGKSA-N 327.384 1.701 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCCc4nn[nH]c43)C2)cc1 855226965 RQFUPLAVNCYXMV-WFASDCNBSA-N 341.415 1.628 10 10 EDCE Cn1nc(C2CC2)nc1CC(=O)NCc1ccc2cccnc2c1O 862024528 ADHIESLWDSFRNP-UHFFFAOYSA-N 337.383 1.805 10 10 EDCE C[C@@H](O)CN1CCN(Cc2c(O)cccc2Br)CC1 862239023 RZVZWCHUDYDWIA-LLVKDONJSA-N 329.238 1.653 10 10 EDCE C[C@@H](NC(=O)c1cn(C[C@H]2CCOC2)nn1)c1ccc(N(C)C)cc1 860951039 XAYOXZRCQJPPOL-ZIAGYGMSSA-N 343.431 1.872 10 10 EDCE O=C(CN(C[C@@H]1CCCO1)C(=O)c1cc(O)cs1)N1CCCC1 765203570 UMNBZMLHWPYLMZ-ZDUSSCGKSA-N 338.429 1.697 10 10 EDCE CCOc1ccc(N2CCN(C(=O)CCc3cnn(C)n3)CC2)cc1 1117795114 QKGRCERVYZQEPI-UHFFFAOYSA-N 343.431 1.495 10 10 EDCE CCOCc1cc(CN[C@@H](C(=O)OC)c2ccn(C)n2)ccc1OC 787437699 AFGSQADJRZAAQZ-QGZVFWFLSA-N 347.415 1.969 10 10 EDCE COc1nn(C)cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 789558852 CUEZKFUENMRSDO-UHFFFAOYSA-N 345.403 1.092 10 10 EDCE C[C@H](CN1CCOCC1)NC(=O)c1cc2cc(O)c(O)cc2s1 895739619 DPCOKBRZURZBBL-SNVBAGLBSA-N 336.413 1.763 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](N3CC[C@@H](O)C3)C2)cc1 1140117134 QDXITKCXJHUWRJ-UONOGXRCSA-N 331.376 1.130 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CCCC[C@@H]1N1CCCC1=O 1153884378 DCFJKWYBDMBGPM-CABCVRRESA-N 332.400 1.895 10 10 EDCE O=C(NCCCNC(=O)c1c(F)ccc(O)c1O)c1cccc(O)c1 1182569736 RSNHJULWFNFGPO-UHFFFAOYSA-N 348.330 1.492 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cc[nH]c2)cc1C 1332517581 MBIAHYQQEPZSQO-INIZCTEOSA-N 331.416 1.554 10 10 EDCE O=C(Cn1nnnc1-c1ccccc1)NCc1cccc(O)c1O 1471642435 UAAACKHBQZJBNC-UHFFFAOYSA-N 325.328 1.068 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCc2cnn(C)c2)cc1C 1714308685 IASYLNWUUOABBM-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE CCNC(=O)CC(=O)N1C[C@H](NCc2ccc(OC)c(C)c2)C[C@@H]1C 1717810358 USOJOECMWXTZLU-GOEBONIOSA-N 347.459 1.609 10 10 EDCE COc1ccc(CNC[C@H]2CCCCN2C(=O)CNC(C)=O)cc1C 1566932755 FBFGUBQNPBMYGP-QGZVFWFLSA-N 347.459 1.610 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)c1nccnc1N 1568732461 VYAZWLKKNQNFDB-UHFFFAOYSA-N 343.431 1.628 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)[C@@H](O)C2(C)C)c(Br)c1 2124799977 JGHGNYOVVNNBEM-ZEGGKSINSA-N 329.238 1.789 10 10 EDCE COc1cc(/C=C2/C(=O)NC(=O)N(C(C)(C)C)C2=O)cc(OC)c1O 13583680 SYVVUDNDLGUNAT-POHAHGRESA-N 348.355 1.670 10 10 EDCE Cc1ccc(C)n1[C@@H](CC(=O)N[C@@H]1CONC1=O)c1ccc(F)cc1 1851356971 AULQXRFOYQEPKG-CVEARBPZSA-N 345.374 1.770 10 10 EDCE CN(C)c1ccc(CNCCC(=O)Nc2ccc(C(N)=O)cc2)cc1 1857851393 QCNDLVKJMRZGPJ-UHFFFAOYSA-N 340.427 1.970 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H](O)C[C@H]2CO)cc1Br 2136081162 BBTBFOBAGBKRHJ-ADEWGFFLSA-N 330.222 1.824 10 10 EDCE NCc1ccc(N2CC[C@@]3(C[C@H](O)CO3)C2)c(Br)c1 2137139569 ZGNPHHJGRKYEIH-SMDDNHRTSA-N 327.222 1.638 10 10 EDCE CC[C@H]1C(=O)NC(=O)CN1c1ccc(CNC)cc1Br 233945792 HZWUYVSYVAFDFM-NSHDSACASA-N 340.221 1.410 10 10 EDCE COC(=O)[C@@H](CCNCc1ccccc1O)NC(=O)OC(C)(C)C 1941213579 FVWJOMOLPZTRNB-CYBMUJFWSA-N 338.404 1.938 10 10 EDCE C[C@H]1CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NCCCN=[N+]=[N-])CO1 1985096628 ULMUXPZBOXKYSX-WDEREUQCSA-N 327.385 1.827 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1COC[C@@H]1NC(=O)OC(C)(C)C 1985102033 AWIGCYJLCGIWCS-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@]1(O)CCCN(C(=O)OC(C)(C)C)C1 2010403522 FKFNJFKYLWWJQL-OAHLLOKOSA-N 341.412 1.907 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NCc2c(O)cccc2F)C1 2011920030 LOGAPIUYMMVBTF-HIFRSBDPSA-N 340.395 1.991 10 10 EDCE CCN([C@@H]1CC(=O)NC1=O)[C@H](C)c1cc(Br)ccc1O 2171203995 OLGYYNXDZGZGEC-LDYMZIIASA-N 341.205 1.953 10 10 EDCE COCCNCc1ccc(N2CC(N(C)C)C2)c(Br)c1 382185732 ODJSCJYFJUFMGV-UHFFFAOYSA-N 342.281 1.935 10 10 EDCE O=C(NCc1c(O)cccc1O)c1occc1CN1CCOCC1 2063288259 KUQSVDPQMFHUBT-UHFFFAOYSA-N 332.356 1.453 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NCc2c(O)cccc2F)C1 1908633403 LOGAPIUYMMVBTF-UKRRQHHQSA-N 340.395 1.991 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2199533021 SVGVGHINUXPFQT-PFKCXJIQSA-N 342.233 1.823 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2199528274 YFKFCLWSRRRWMZ-KBZKQINZSA-N 341.249 1.789 10 10 EDCE CCN1CCN(c2ccc(CNC)c(Br)c2)CC1=O 2102565120 WNIOULKVMRBYNA-UHFFFAOYSA-N 326.238 1.837 10 10 EDCE OCC[C@H]1CN(c2ccc(CO)cc2Br)C[C@@H]1CO 2093501326 LBPPCUBUHFYCOU-NWDGAFQWSA-N 330.222 1.369 10 10 EDCE Oc1c(F)cc(Br)cc1CNC1CN(C2COC2)C1 2114708214 MGXVITWUYHCIHB-UHFFFAOYSA-N 331.185 1.466 10 10 EDCE CC(C)(C)OC(=O)NC1CN(CC(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])C1 2213584330 CBGJHAHVUHIDGM-NWDGAFQWSA-N 338.412 1.543 10 10 EDCE CNCc1ccc(N2C[C@@H]3COC[C@@]3(CO)C2)c(Br)c1 2234553196 WQKUPGKQJOCZFY-DOMZBBRYSA-N 341.249 1.614 10 10 EDCE CC(=O)Nc1ccc(C=C2SC(N3CCOCC3)=NC2=O)cc1 2294359225 XZNHWIDEDCVPTG-UHFFFAOYSA-N 331.397 1.948 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccc(CN)cc2)s1 2284493935 HLBRCORGEHZZPN-UHFFFAOYSA-N 329.472 1.802 10 10 EDCE OC[C@@]1(O)CCN(c2ccc(OCc3ccccc3)cc2)C[C@@H]1O 2299509534 AZPWYHPZUPYEDQ-OALUTQOASA-N 329.396 1.560 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2C=CCCN2)c(O)c1Br 2352941098 MGWWDCGZPUCUHE-NSHDSACASA-N 325.206 1.997 10 10 EDCE Cc1ccc(CN2CCN(CCO)CC2)c(O)c1Br 2352944069 CFSAWJPPADHLNI-UHFFFAOYSA-N 329.238 1.573 10 10 EDCE CN1CCN(CCCCN2Cc3ccc(N(C)C)cc3[C@@H]2CN)CC1 71683351 PQYMWNLMSBRGEI-FQEVSTJZSA-N 345.535 1.596 10 10 EDCE CC(=O)N1CCN(CCNC(=O)/C=C\c2ccc(N(C)C)cc2)CC1 96258949 CJCKCWOAKDMASS-TWGQIWQCSA-N 344.459 1.046 10 10 EDCE CCCN(CCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 92775435 AQJBFSCPFPPIGP-GFCCVEGCSA-N 328.210 1.610 10 10 EDCE CCCCN(C)C(=O)C(=O)N1CCN(c2ccc(OC)cc2)CC1 243705360 PMIZGSUWJUNKEQ-UHFFFAOYSA-N 333.432 1.602 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCN(C(=O)C(C)C)CC2)c1O 278263369 QVLJKJXYTSXQRO-UHFFFAOYSA-N 337.376 1.609 10 10 EDCE Cc1cccc(CN2CCCN(S(=O)(=O)N(C)C)CC2)c1O 368222709 IICIABJDLPXQTA-UHFFFAOYSA-N 327.450 1.015 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccc(C(=O)OC)n1 808095451 GCNJXDIRLVEBPS-UHFFFAOYSA-N 335.356 1.990 10 10 EDCE COc1cccc(CNC(=O)C(=O)Nc2cn(C)nc2C2CC2)c1O 291280860 IBWFTKGVDPCMJP-UHFFFAOYSA-N 344.371 1.267 10 10 EDCE C[C@H](N[C@H]1CCC(=O)N(C)C1=O)c1cc(Br)ccc1O 818362246 SMYORFKEAOMTOZ-KWQFWETISA-N 341.205 1.953 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)N3CCOC[C@@H]3CO)c2C)cc1 824695098 FSKKUJXYROIOHA-INIZCTEOSA-N 344.411 1.936 10 10 EDCE CO[C@@H](COC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CC1 820301548 IVGQNTXDSOCLPO-ZDUSSCGKSA-N 329.374 1.346 10 10 EDCE CO[C@]1(CO)CCCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 826952826 UPEYZMRUFBJYDZ-GOSISDBHSA-N 338.423 1.636 10 10 EDCE CNS(=O)(=O)[C@@H]1CCCN(C/C=C\c2ccc(N(C)C)cc2)C1 835028133 JSGZCLLLFJDTLB-XQDHMALISA-N 337.489 1.779 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CCNC(=O)CC2)cc1 846444973 IHZBTKMFBFWPET-AWEZNQCLSA-N 333.432 1.506 10 10 EDCE CC(C)N1[C@H]2CC[C@H]1CN(C(=O)C(=O)Nc1ccc(N)cc1)CC2 841056882 XLLYHIMYIDOALP-HOTGVXAUSA-N 330.432 1.681 10 10 EDCE CC(C)[C@@H](CNC(=O)NCc1c(O)cccc1F)N1CCOCC1 913992597 DCODKNOLMVSQBE-OAHLLOKOSA-N 339.411 1.687 10 10 EDCE C[C@@H]1CN(C(=N)NCc2cccc(Br)c2O)CCO1 849093862 MQUIRHOJHUKMSF-SECBINFHSA-N 328.210 1.900 10 10 EDCE C[C@@H](NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1[C@H]2CN[C@H]1C2 925504538 PUINMSQUFPJGEU-FXMYGGSYSA-N 333.451 1.873 10 10 EDCE C[C@H](NCC[C@@H]1CNCCS1(=O)=O)c1ccc2ccccc2c1O 925794250 MAIVDZSAIYHASX-DZGCQCFKSA-N 348.468 1.973 10 10 EDCE COc1ccc(O)c(CN[C@@H]2CCN(c3ccc4nncn4n3)C2)c1 862482358 SIFUJKKEYYYPJJ-CYBMUJFWSA-N 340.387 1.207 10 10 EDCE COc1ccc(N2CCN(C(=O)N[C@@H]3CCCOC3)CC2)c(OC)c1 868283173 QVFKICCVTFWJHC-CQSZACIVSA-N 349.431 1.714 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)Cn3cncc3C)C2)cc1 862034982 FQRANOWNLJOTNV-HNNXBMFYSA-N 328.416 1.843 10 10 EDCE Cn1ccc([C@H]2NC(=O)N(Cc3ccc(N4CCCC4)cc3)C2=O)n1 761089070 DIDXAUPWAQRNLU-MRXNPFEDSA-N 339.399 1.813 10 10 EDCE CNC(=O)Cn1cc(NC(=O)N[C@@H](C)c2cc(OC)ccc2O)cn1 772458921 ZLPCODQJLRVWFG-JTQLQIEISA-N 347.375 1.226 10 10 EDCE C[C@@H]1C[C@@H](C)CN(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)C1 775289287 UDZXYMSXRYYCIN-NXEZZACHSA-N 329.378 1.935 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2C[C@H](C)Cn3nccc32)c1 893889417 AAGUYTNAMLSPGD-PCAWENJQSA-N 325.372 1.334 10 10 EDCE COc1ccc(CNC(=O)C(=O)Nc2c(C)nn(C)c2C)c(O)c1 797389034 MJSFZIZORGRTQD-UHFFFAOYSA-N 332.360 1.006 10 10 EDCE C[C@H](CN1CCN(C)CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1144612913 KCCAFTCNDUCNOL-GFCCVEGCSA-N 332.408 1.215 10 10 EDCE CS(=O)(=O)Nc1ccc(C(=O)NCc2cc(O)ccc2O)cc1 1153879682 URJKZIKNBNVFQX-UHFFFAOYSA-N 336.369 1.399 10 10 EDCE CCC(CC)[C@H](C(=O)NCc1cc(O)ccc1O)N1CCOCC1 1153886138 XPOBUDNNFKMUCS-QGZVFWFLSA-N 336.432 1.851 10 10 EDCE O=C(CCNC(=O)c1c(F)ccc(O)c1O)NCc1ccccc1 1160646994 XVQVNRRZZHOGBA-UHFFFAOYSA-N 332.331 1.673 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)Cc2nonc2C)cc1C 1319557233 GQHQSSGCGXRKOK-ZDUSSCGKSA-N 346.431 1.874 10 10 EDCE C[C@H](O)c1ccc(N2CC(NS(C)(=O)=O)C2)c(Br)c1 703017020 YCGAQMWWVDDGFQ-QMMMGPOBSA-N 349.250 1.240 10 10 EDCE COCCC1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329440560 BCVQPMJALLMJSK-UHFFFAOYSA-N 332.400 1.510 10 10 EDCE COC(=O)[C@@H](CF)NCc1ccc(N2CCN(C)CC2)c(F)c1 1323768643 UXHSXYRQLIHFHG-CQSZACIVSA-N 327.375 1.178 10 10 EDCE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1cn(C)nc1Br 712435609 SMCMHSBVROWDKR-MRVPVSSYSA-N 331.174 1.687 10 10 EDCE NC(=O)N1CCC(NCc2ccc(Br)cc2O)CC1 691396211 RHJSWNLEZNRGOA-UHFFFAOYSA-N 328.210 1.787 10 10 EDCE O=C(CO[C@@H]1CCOC1)NCc1cc(Br)ccc1O 1341862545 DCCRIPJSNFCNOZ-LLVKDONJSA-N 330.178 1.576 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1cn(C(F)(F)CO)nn1 1469251221 YXOWVUJLMHULKK-UHFFFAOYSA-N 349.297 1.004 10 10 EDCE NCc1ccc(N2CC[C@]3(CNC(=O)N3)C2)cc1Br 2121210389 CLSSETBGMWVIQN-ZDUSSCGKSA-N 325.210 1.170 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN(C(=O)c2ccsc2)CC1 1544848044 JUVVINSCDROTRL-UHFFFAOYSA-N 346.408 1.686 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C2[C@H]3CCC[C@H]23)cc1C 1716081841 FZAGXHUGUXHRAK-JYJNAYRXSA-N 332.444 1.616 10 10 EDCE C[C@@H](NC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1)c1ccccc1O 1557966996 SXNOJQSKJUBCEA-MEBBXXQBSA-N 347.396 1.300 10 10 EDCE C[C@H](NC(=O)c1nsnc1O)c1ccc(N2CCOCC2)cc1 1625882469 JIYDRVFPAJDYKZ-JTQLQIEISA-N 334.401 1.571 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2cc(C)sn2)cc1C 1485990682 KNXFWZMTUDJMLK-CQSZACIVSA-N 349.456 1.649 10 10 EDCE CONC(=O)CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1645952450 AIQGOUYBHHCFDL-UHFFFAOYSA-N 329.356 1.314 10 10 EDCE Cc1ccc(C(=O)Nc2nc(-c3cnn(C)c3)ns2)c(O)c1O 1640000625 BRHXORNMFGHEIS-UHFFFAOYSA-N 331.357 1.911 10 10 EDCE CCCC(=O)NC[C@@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1739044117 DOIZKBWOSVQQMX-CYBMUJFWSA-N 349.391 1.198 10 10 EDCE C[C@H](NC(=O)CC1(n2cnnn2)CCOCC1)c1ccccc1O 1643745561 SCEBXMXZPCFQOD-LBPRGKRZSA-N 331.376 1.152 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2Cc3ccc(O)cc3C2)c1 1640835418 OXSSKLBNGBVICC-UHFFFAOYSA-N 348.380 1.625 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)CN2CCOCC2)cc1C 1570597822 CXZVXTXJCAQVDD-JKSUJKDBSA-N 349.475 1.319 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)[C@@H]2C[C@H]2C2CC2)cc1 1686660856 GFODWKXJDOEJRK-UONOGXRCSA-N 343.387 1.741 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)[C@@H](C)NC(C)=O)cc1C 1699227891 QZFNLVBHQOWQFW-GEXIGZQTSA-N 333.432 1.290 10 10 EDCE Nc1ccc(OCCNC(=O)c2n[nH]cc2Br)cc1 2134187995 BOPNLUIRZDPGAV-UHFFFAOYSA-N 325.166 1.563 10 10 EDCE C[C@@H](Oc1ccc(N)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1 1860079209 XKCLTBQLECHSSI-SNVBAGLBSA-N 335.385 1.322 10 10 EDCE O=C(O)c1ccc([N+](=O)[O-])c(OCC(=O)c2ccc(O)c(O)c2)c1 1865754882 NUNHUKRVBWJVSX-UHFFFAOYSA-N 333.252 1.966 10 10 EDCE CN(C)C[C@@H]1CN(Cc2cccc(Br)c2O)CCO1 128197455 LUVQPFVPXOMTHI-GFCCVEGCSA-N 329.238 1.917 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)O)CCN(Cc2ccc(N)cc2)C1 1999436695 IXCFSIHTLOQPTC-KRWDZBQOSA-N 335.404 1.823 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CCC(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010402813 WGSJQAGJUUGFCW-RYUDHWBXSA-N 341.412 1.954 10 10 EDCE OCc1ccc(N2CCn3c(CO)nnc3C2)c(Br)c1 2171798218 LYTQDIBPNWFNBA-UHFFFAOYSA-N 339.193 1.045 10 10 EDCE C[C@@H]1[C@H](CO)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 385832634 UICCHGUZWAQDGE-BFHDXFOESA-N 340.221 1.608 10 10 EDCE CN[C@@H](C)c1ccc(N(C)Cc2nnn(C)n2)c(Br)c1 2197844918 FTTZLXSXEBITAH-VIFPVBQESA-N 339.241 1.889 10 10 EDCE O=C(NCC1CCN(C(=O)C(F)(F)F)CC1)c1ccc(O)c(O)c1 2054401168 OFQUMBXEWQNWTI-UHFFFAOYSA-N 346.305 1.629 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2199527169 OMMZMMCTXLEQQK-MOLYSANOSA-N 341.249 1.789 10 10 EDCE C[C@@]1(CO)C=CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 2237169743 HZYKHJWZFGFIKS-JSGCOSHPSA-N 338.205 1.528 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C12CC(NC(=O)OC(C)(C)C)(CO1)C2 2247286642 KMWPEDLBUKGURZ-UHFFFAOYSA-N 339.396 1.972 10 10 EDCE O=C1NC(=O)N(C[C@H]2CCCO2)C(=O)C1=CNc1ccccc1Cl 2297317995 WHMKZDCNZZHVDS-SNVBAGLBSA-N 349.774 1.893 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1CC[C@H](O)CN1C(=O)OC(C)(C)C 2300532152 QTFJKMOKLWNAOW-RYUDHWBXSA-N 341.412 1.906 10 10 EDCE CO[C@@H](C(=O)O)C(=O)NCc1ccc(C)c(Br)c1O 2352633586 KRWVOKRKGALEKV-SNVBAGLBSA-N 332.150 1.179 10 10 EDCE Cc1ccc(CN2C[C@@H](CO)C[C@H]2CO)c(O)c1Br 2352686193 JJRSKOZPJNRLHH-JQWIXIFHSA-N 330.222 1.638 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2355340213 NRYWULHGYCXGKD-BHGZDDGQSA-N 342.233 1.823 10 10 EDCE COc1ccc(N2CCN(C(=O)NC[C@H]3CCCOC3)CC2)cc1 57162779 QTJJEINZJXWUOW-OAHLLOKOSA-N 333.432 1.953 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)c2cn(C)c(O)n2)cc1C 1505687038 YEZLVNZNCQVOOQ-STQMWFEESA-N 346.431 1.739 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)CN(C)Cc2nnc(C)n2C)c1 121734206 NCBHEZOEAOVYPT-NSHDSACASA-N 347.419 1.147 10 10 EDCE C[C@@H](N[C@@H]1CCc2ncnn2C1)c1ccc(N2CCC(O)CC2)cc1 180580413 LDOBWXYEKVNUOW-GDBMZVCRSA-N 341.459 1.905 10 10 EDCE COCCN1CCN(Cc2ccc(N3CCOCC3)cc2)C[C@H]1C 120808341 AQFWDZYGRFQRFT-QGZVFWFLSA-N 333.476 1.676 10 10 EDCE CN1CC[C@@H](NC(=O)/C=C/c2ccc(N3CCOCC3)cc2)CC1=O 190149035 DZVHZYZOTLDIFR-IEXSPKMKSA-N 343.427 1.273 10 10 EDCE CN(Cc1cc(Br)ccc1O)[C@@H]1COC[C@@H]1C(=O)O 234281527 QVTMPUAMZIGONX-WDEREUQCSA-N 330.178 1.686 10 10 EDCE C[C@@H](NC(=O)C(=O)N(C)CC1CC1)c1ccc(N2CCOCC2)cc1 803297632 BMPKSIYFBCQNEC-CQSZACIVSA-N 345.443 1.569 10 10 EDCE COC(=O)[C@@H]1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)C1 299400421 BVJJLRHATADRKX-OAHLLOKOSA-N 331.416 1.774 10 10 EDCE CN1C[C@@H](NC(=O)c2csc(Cc3ccc(N)cc3)n2)CCC1=O 817939061 YIZVDZLWBIYLOF-ZDUSSCGKSA-N 344.440 1.667 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)/C=C/[C@@H]1CCCO1 821409624 IQCIUKZKTSCCCP-DVQDXYAYSA-N 346.427 1.989 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@H](N)C(F)(F)F)CC2)cc1 828352969 HEMKHCYWYYNZFO-ZDUSSCGKSA-N 331.338 1.670 10 10 EDCE CN1CCCc2cc(CNC(=O)c3cn([C@@H]4CC[C@H]4O)nn3)ccc21 900432874 IJVUHOQVXFWWCL-IAGOWNOFSA-N 341.415 1.286 10 10 EDCE COc1ccc(N2CCN(CN3C(=O)CC4(CCC4)C3=O)CC2)cc1 839946679 ARMCFXFHWLDPKR-UHFFFAOYSA-N 343.427 1.704 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)Cc1cc[nH]n1 839220729 ORTISBCLHHJLJK-UHFFFAOYSA-N 343.431 1.483 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCn2c(CC3CC3)nnc2C1 846659194 QWRJFQKCFRFUGC-UHFFFAOYSA-N 332.335 1.437 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)N[C@]4(CCSC4)C3=O)C2)cc1 849356597 FRXVLXHWWADGJX-GUYCJALGSA-N 347.440 1.701 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)N1C(=O)[C@@H]2[C@H](O)CCCN2C1=O 842264548 KFGNNPRRUAIAMR-XKQJLSEDSA-N 345.443 1.780 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc(C(N)=O)s3)C2)cc1 855230920 QVNSROYDOJSPCM-NSHDSACASA-N 345.424 1.864 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@]3(C)CCCNC3)C2)cc1 851662909 NMNGIKZKYJKLAK-KXBFYZLASA-N 346.475 1.963 10 10 EDCE O=C(NCc1c(O)cccc1F)[C@]1(O)CCN(Cc2ccccc2)C1 928705810 NJVCQGDAMFCJNM-IBGZPJMESA-N 344.386 1.785 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)N2C[C@@H](O)C[C@@H](O)C2)c1C 755431508 CNRNASVPWDFROB-IYBDPMFKSA-N 328.412 1.970 10 10 EDCE CC[C@](COC)(NCc1ccc(N2CCOCC2)cc1)C(=O)OC 930682938 DCOAYYJJHLIQGO-GOSISDBHSA-N 336.432 1.581 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCc2ncsc2C1 1119013688 FBKFWSFIIBLJAS-UHFFFAOYSA-N 329.381 1.276 10 10 EDCE COc1cc(CN2CCN(c3nccn(C)c3=O)CC2)c(O)cc1C 768465773 KZHGYQOEROBNFK-UHFFFAOYSA-N 344.415 1.125 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(O)(C(F)F)CC3)cc2N1 777827271 DIQQCIMDISTYBH-UHFFFAOYSA-N 343.286 1.522 10 10 EDCE CCOC(=O)[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1118934897 BPQCLHGFBSCKJG-ZDUSSCGKSA-N 346.383 1.036 10 10 EDCE CCN(CC(=O)NCc1ccc(N(C)C)cc1)Cc1cn(C)nn1 782100595 UEKUVSFQOHXCSB-UHFFFAOYSA-N 330.436 1.019 10 10 EDCE CCN(Cc1cn(C)nn1)C(=O)NCc1ccc(N(C)C)c(F)c1 781934298 QXRXFQLUEVLKFK-UHFFFAOYSA-N 334.399 1.752 10 10 EDCE CN1CCN([C@H]2CC[C@@H](NC(=O)c3cccc(O)c3O)CC2)CC1 1138626676 VDOLVDAQTCOLPQ-OKILXGFUSA-N 333.432 1.386 10 10 EDCE COC(=O)[C@H](Cc1ccccc1O)NC(=O)Cc1ccc(O)c(O)c1 1167470592 VUNFNQRTBWVHKH-ZDUSSCGKSA-N 345.351 1.246 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NCCCN=[N+]=[N-] 1963697842 FWDOMAZRMLXKBV-LLVKDONJSA-N 327.385 1.829 10 10 EDCE CN(Cc1cc(Br)cc(F)c1O)[C@@H]1COC[C@@H]1C(=O)O 715772053 YAFZDYDUEKGLOY-GXSJLCMTSA-N 348.168 1.825 10 10 EDCE CO[C@@H]1CN(Cc2cc(Br)ccc2O)C[C@H]1C(=O)O 690085750 FPTZHSFXOPNGOS-ZYHUDNBSSA-N 330.178 1.686 10 10 EDCE COc1ccccc1CN(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1261855463 VNBHNRVHAZCRHC-UHFFFAOYSA-N 340.379 1.902 10 10 EDCE C[C@@H]1OCCO[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1354688530 MPYMLVDHCKXEDX-LRDDRELGSA-N 338.379 1.082 10 10 EDCE COc1ccc(CN[C@H]2CN(C(=O)CCCC(N)=O)C[C@@H]2C)cc1C 1281474774 DJQBVJSCXZCLKB-HOCLYGCPSA-N 347.459 1.596 10 10 EDCE Cn1ncc(Br)c1C(=O)NCc1ccc(O)cc1O 1451763926 CEPXEBAICYEPRA-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE CO[C@]1(Cn2c(C)nnc2N(C)Cc2ccccc2O)CCOC1 1299797366 MKETXEOJXAQIDP-KRWDZBQOSA-N 332.404 1.734 10 10 EDCE CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(O)c(O)c1 1616338113 GFKODPQLKBZMHK-HNNXBMFYSA-N 342.395 1.456 10 10 EDCE C[C@H](CNCc1cnn(C)c1)NC(=O)c1ccc(N=NC(N)=O)cc1 1715965613 UPWBFMIVUMYIND-LLVKDONJSA-N 343.391 1.491 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](CO)NC/C=C/Cl)cc1 1717785050 RZURYSVSCKOMIO-IJAVWUSQSA-N 339.783 1.282 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)C2CC3(CC3)C2)cc1C 1717776807 UJTHJHBVHBJKRQ-MRXNPFEDSA-N 332.444 1.761 10 10 EDCE O=C(CCCc1nn[nH]n1)NCc1cc(Cl)cc(Cl)c1O 1556885098 TWCUMDUTCNVSRG-UHFFFAOYSA-N 330.175 1.851 10 10 EDCE CCS(=O)(=O)c1ccc(C(=O)NCc2c(O)cccc2O)cc1 1635843308 LMFNQABUBAJBMU-UHFFFAOYSA-N 335.381 1.821 10 10 EDCE COC(=O)C[C@@](C)(NC(=O)Cc1ccc(O)c(O)c1)c1ccncc1 1633618545 BAJBSZVHILWGNF-GOSISDBHSA-N 344.367 1.630 10 10 EDCE O=C(NCc1cc(O)ccc1O)C1CN(C(=O)C2CCCCC2)C1 1643882572 ZHXSVKMPTWWSGH-UHFFFAOYSA-N 332.400 1.753 10 10 EDCE Cn1cc(-c2nn(C)cc2C(=O)NCc2c(O)cccc2F)cn1 1652298384 ITOCKMTVPAHBSE-UHFFFAOYSA-N 329.335 1.595 10 10 EDCE CC(C)(C)NC(=O)[C@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1598443417 RFEXEYZLAOUMJV-LLVKDONJSA-N 338.429 1.457 10 10 EDCE COc1cc(N2CCC(NS(C)(=O)=O)CC2)cc(OC)c1OC 1858044355 PDVSTKIUBSDGLN-UHFFFAOYSA-N 344.433 1.230 10 10 EDCE Nc1ccc(NC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 1866025256 WJWGRRLYSWBSGR-UHFFFAOYSA-N 340.295 1.412 10 10 EDCE OCCCO[C@@H]1CCN(c2ccc(CO)cc2Br)C1 2142047639 OBVSCMYMYWDFGV-GFCCVEGCSA-N 330.222 1.919 10 10 EDCE CN(C)[C@H]1COC[C@H]1NCc1cc(Br)cc(F)c1O 1921989614 CROTXZFRQMUVID-NEPJUHHUSA-N 333.201 1.712 10 10 EDCE C[C@@H]1CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C[C@@H]1O 230260554 MESRSFMXDOFXHS-HYJLZEBJSA-N 340.221 1.608 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@H]1C(=O)NCCCN=[N+]=[N-] 1985102514 IAYCEPKWQWHAPR-GHMZBOCLSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C1)CN(C(=O)c1ccc(O)c(O)c1)C2 2006279814 JRXXQKZFWFNZSU-UHFFFAOYSA-N 334.372 1.791 10 10 EDCE CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010388616 FAGYMNRJZUXASO-NEPJUHHUSA-N 338.412 1.449 10 10 EDCE Oc1c(Br)cc(Cl)cc1CN1CCO[C@H]2CNC[C@@H]21 708134198 PCVHHBFTFWQPJC-RYUDHWBXSA-N 347.640 1.981 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@@H]([C@@H](O)C(F)(F)F)C1 2064271072 WQORIVNFWICVJG-QMTHXVAHSA-N 333.306 1.802 10 10 EDCE NCc1cc(F)c(N2C[C@H]3OCCO[C@@H]3C2)cc1Br 2093343062 BHBZQASZBBBYRP-CHWSQXEVSA-N 331.185 1.651 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)c(Br)c1 2102192911 RDRXOLSOWGROBM-LMVZTGKYSA-N 327.222 1.665 10 10 EDCE O=C1NC(=S)SC1=CN1N=C(c2cccs2)C[C@H]1C(=O)O 2294778289 JFACAXQFEQOQLE-ZETCQYMHSA-N 339.423 1.600 10 10 EDCE OCc1ccc(N2C[C@@H]3CC[C@@H](CO)O[C@@H]3C2)cc1Br 2289170905 ZIRSEQXFBSRCEL-VZJVUDMVSA-N 342.233 1.918 10 10 EDCE COC(=O)[C@H](C)CN(C)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297555325 JLZBQXZZCVRPFL-OAHLLOKOSA-N 346.427 1.804 10 10 EDCE O[C@H]1[C@H](O)COC12CN(c1ccc(OCc3ccccc3)cc1)C2 2299525788 QWYUDVYVWYHXNN-MSOLQXFVSA-N 327.380 1.576 10 10 EDCE Cc1ccc(CN2CCN(C)[C@H](CO)C2)c(O)c1Br 2352679284 KQTKGMPSELFXOM-LBPRGKRZSA-N 329.238 1.571 10 10 EDCE Cc1ccc(CN2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(O)c1Br 2352685755 GRAFMKXBAITUOD-DUBDDPSESA-N 328.206 1.389 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CNC[C@H]2F)c(O)c1Br 2352940513 FJTMJUHISZYQIG-VHSXEESVSA-N 331.185 1.637 10 10 EDCE CC(=O)N(C(=O)C(=O)Nc1cccnc1Cl)c1ccc(N)cc1 170318485 APKIDGYCONTQPD-UHFFFAOYSA-N 332.747 1.835 10 10 EDCE COc1ccc(N2CCN(CC(=O)NCC(F)(F)F)CC2)cc1 68678553 ALKUVQAWHFVZNM-UHFFFAOYSA-N 331.338 1.496 10 10 EDCE 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CN(C)c1ccc(/C=C\CNCCCN2CCC[C@@H](C(N)=O)C2)cc1 835037775 MREHBVDCGKCWBA-VDNIUXDYSA-N 344.503 1.943 10 10 EDCE Nc1ccc(CCNC(=O)N2CCCC[C@@H]2CN2CCOCC2)cc1 841953696 BJPFZQMJLPZUBN-GOSISDBHSA-N 346.475 1.708 10 10 EDCE CC(=O)C(=O)COC(=O)C1=CCCN(C(=O)OC(C)(C)C)CC1 924443716 WVTMHDQGZAJZGD-UHFFFAOYSA-N 325.361 1.645 10 10 EDCE CO[C@@]1(CNCc2ccc(N(C)C)c(F)c2)CCS(=O)(=O)C1 922616812 TXEZCSHTSDTKIO-OAHLLOKOSA-N 330.425 1.185 10 10 EDCE CC(C)[C@H](N)CCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 851684209 BVJZVZVGOZEMQK-QGZVFWFLSA-N 344.459 1.169 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCCN(C)C3=O)C2)cc1 855227778 YUFAIKFDJIMAMY-XJKSGUPXSA-N 331.416 1.259 10 10 EDCE Nc1ccc(NC(=O)N[C@@H]2CCN(c3ccc4nncn4n3)C2)cc1 859697564 INKYKWITEOEKCF-CYBMUJFWSA-N 338.375 1.107 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2C[C@H](C(N)=O)C2)cc1 858772844 FRJRVAYXPQTJDI-SHTZXODSSA-N 332.448 1.938 10 10 EDCE CN(C)Cc1csc(CNC(=O)/C=C\c2ccc(O)c(O)c2)n1 927768838 NFFOGZGUOOLIQI-XQRVVYSFSA-N 333.413 1.946 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccn4nnnc4c3)CC2)cc1 854198159 DWRUYWIZPDYNLK-UHFFFAOYSA-N 338.371 1.095 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCN(CCCF)CC2)cc1 860009680 ZOOLFNZSEYJJPQ-UHFFFAOYSA-N 336.455 1.346 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@H](OC)C(=O)OC(C)(C)C)c1 866765678 YPEHKQSWDDWINM-HZMBPMFUSA-N 339.388 1.935 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O 863049107 BDYUDVSIRVGYDJ-JXHFCSHNSA-N 337.397 1.289 10 10 EDCE NC(=O)N1C[C@@H]2C[C@H]1CN2Cc1cccc(Br)c1O 1877018219 XAXIFHYMICUQRC-UWVGGRQHSA-N 326.194 1.492 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(N2CCNC2=O)CC1 779498569 HRXUWIAOHOAALJ-DUXPYHPUSA-N 331.372 1.127 10 10 EDCE CC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 893606812 AKXLKPJUCFYACH-SFHVURJKSA-N 344.459 1.066 10 10 EDCE O=C(O)[C@@]12CN(Cc3ccc(Br)cc3O)C[C@H]1CCO2 707652281 SMUQAEFBYLAZOM-QMTHXVAHSA-N 342.189 1.830 10 10 EDCE CCn1nncc1C(=O)N[C@@H](C)[C@@H](C)NCc1ccc(OC)c(C)c1 1505598973 HTOHPUAJWIIFDP-KGLIPLIRSA-N 345.447 1.912 10 10 EDCE 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2128771015 KJCRVPYXJUVJAO-UHFFFAOYSA-N 329.173 1.755 10 10 EDCE CCN(CC)CCNC(=O)c1ccc(/N=N/N2CCNCC2)cc1 1860481364 VKWNCHBVDBFFOJ-QZQOTICOSA-N 332.452 1.662 10 10 EDCE COCCN(CCOC)C(=O)CNCc1cc(Cl)ccc1O 1857868554 OMPGHMSOMKQPKA-UHFFFAOYSA-N 330.812 1.257 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1CC(=O)CN1 1952233190 FXPUOAVBIKAUKV-STQMWFEESA-N 336.388 1.465 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)O)C1(c2cc(O)c(O)c(O)c2)CC1 1952542825 KMCXYDVPTARQNW-LBPRGKRZSA-N 339.344 1.813 10 10 EDCE CNCc1ccc(N2CC[C@H]3CC(=O)N[C@@H]3C2)cc1Br 2145056388 ZUWFLURCNQNPAX-IINYFYTJSA-N 338.249 1.883 10 10 EDCE CC(C)(C)OC(=O)NCCN(CCO)CCOc1ccc(N)cc1 1999479273 BGQXZMFTHZBOJJ-UHFFFAOYSA-N 339.436 1.467 10 10 EDCE CN(C)c1ccc([C@@H](O)[C@H](N)c2nc(Br)nn2C)cc1 2173169105 RTDCGUICVIIMGN-WDEREUQCSA-N 340.225 1.377 10 10 EDCE CN1C(=O)O[C@@H]2CN(c3cc(Br)c(CN)cc3F)C[C@H]21 2176925303 YPSILNKSJXBJMZ-VXGBXAGGSA-N 344.184 1.686 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@](C)(O)C2)cc1Br 2201511046 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331.460 1.477 10 10 EDCE COC[C@@H](CNCc1c(C(=O)OC)n(C)c2ccc(F)cc12)OC 894433785 CBZFZCAOERJWDC-GFCCVEGCSA-N 338.379 1.855 10 10 EDCE CN(C)c1ccc(CN2CCC(O)(COCCO)CC2)cc1F 895826987 GYKWUWXYQWWLDZ-UHFFFAOYSA-N 326.412 1.228 10 10 EDCE O=C(NCc1ccccc1O)C(=O)Nc1ccc(N2CCC2=O)cc1 799253046 NWGIUXCINKRMOC-UHFFFAOYSA-N 339.351 1.384 10 10 EDCE COc1ccc(Br)c(CNCC(F)(F)CO)c1O 1964050044 XKBKJHQVOLTVCD-UHFFFAOYSA-N 326.137 1.881 10 10 EDCE CO[C@H]1C[C@H](C(=O)O)N(Cc2ccc(Br)cc2O)C1 1964722110 ZKHXAUNWGQPORU-WDEREUQCSA-N 330.178 1.829 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2[C@@H](C(=O)NCCCCN=[N+]=[N-])[C@H]21 1964944424 PUOQIQCURGFEHG-QJPTWQEYSA-N 339.396 1.827 10 10 EDCE O=C(N1CCC[C@H](CNCc2cccc(O)c2O)C1)C(F)(F)F 709741095 DDIQMPKYONQAKY-SNVBAGLBSA-N 332.322 1.988 10 10 EDCE CN1CCN(c2ccc(CN3CCc4nccnc4C3)cc2F)CC1 1330413351 VFSMFGVCSQTDIQ-UHFFFAOYSA-N 341.434 1.926 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H]2CN(C)CCO2)cc1C 1267984617 QODKMIWWPAAGOU-KSSFIOAISA-N 349.475 1.176 10 10 EDCE C[C@H]1COC2(CCC2)CN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1348661373 DNQYCNBWMRGARC-LBPRGKRZSA-N 330.384 1.404 10 10 EDCE CC[C@H](CNC(=O)C1(C)CCC1)NC(=O)c1cc(OC)nc(OC)c1 1704667051 FOCUAQNUYZSQHB-CYBMUJFWSA-N 349.431 1.914 10 10 EDCE C/C(=C\C(=O)N1CCc2ccc(S(N)(=O)=O)cc21)c1cnccn1 1628947161 VGPVZPSTSZJXLU-DHZHZOJOSA-N 344.396 1.117 10 10 EDCE COC(=O)c1ccc2c(c1)CN(C(=O)Cc1ccc(O)c(O)c1)C2 1627360673 OWUJYLMSLATMOV-UHFFFAOYSA-N 327.336 1.969 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC(N[C@@H]3CCOC3)C2)c([N+](=O)[O-])c1 1640465321 SXDXBCMVQXHOPA-HSBHDXMMSA-N 347.371 1.348 10 10 EDCE C[C@@H](CCNC[C@H]1CCOC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1699161750 AMIVZVWHOFCKBS-QWHCGFSZSA-N 347.419 1.984 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](NC(C)=O)C(C)C)CC2)cc1 6967665 GGSNKCTVDPCUFO-KRWDZBQOSA-N 333.432 1.505 10 10 EDCE C[C@H](C(=O)O)N1CC(NCc2ccc(Br)cc2O)C1 2131772667 YWAUNBGWFQZRPR-MRVPVSSYSA-N 329.194 1.402 10 10 EDCE CC(C)(C)OC(=O)N1CC(Cc2ccc(O)c(O)c2O)(C(=O)O)C1 1952065137 WBAPJFOILZMROW-UHFFFAOYSA-N 339.344 1.668 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@H](C1)OC[C@@H]2C(=O)NCCN=[N+]=[N-] 1985100107 DASXYSNLSXGBDM-VWYCJHECSA-N 325.369 1.295 10 10 EDCE CNCc1ccc(N2[C@H](CO)C[C@@H]3OCC[C@@H]32)cc1Br 2146698665 KXDHDHDPNWZLEC-QEJZJMRPSA-N 341.249 1.897 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCC3(C4(O)CCC4)CCC3)c2n1 2063932066 NGFYJLCUTVVIBI-UHFFFAOYSA-N 330.388 1.558 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@@H]2O 2174414781 ZSDARITZVXUPPP-TXFSYDTDSA-N 342.233 1.622 10 10 EDCE C[C@H](O)[C@@H]1CCCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2193595452 HXJSSPGGYPJXCA-LCHGKGQCSA-N 341.205 1.784 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1Nc1c(N)cccc1C(N)=O 1906317279 WXBDCCTUTGJEGW-NWDGAFQWSA-N 336.392 1.072 10 10 EDCE CN(C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)c1ccc(N)cc1 2080723487 WTXIGDUMAAJZKR-SWLSCSKDSA-N 349.431 1.850 10 10 EDCE C[C@@H](O)c1ccc(N2CC(=O)N[C@@H]3CC[C@@H]32)cc1Br 2112060449 FFBULDRWFRCFFD-WQHBLYJGSA-N 325.206 1.970 10 10 EDCE O=S1(=O)C[C@@H]2CCN(Cc3cccc(Br)c3O)[C@H]2C1 2094883573 WYZCNVCFARBKCU-JQWIXIFHSA-N 346.246 1.774 10 10 EDCE NCc1ccc(N2CC[C@H](O)[C@H](O)CC2)c(F)c1Br 2269148596 RPSQUKAWSIPHSY-PHIMTYICSA-N 333.201 1.369 10 10 EDCE CC(C)NCc1ccc(N2CC[C@@H]2[C@H](O)CO)c(Br)c1 2286207765 GVSUTICYSMWPME-HUUCEWRRSA-N 343.265 1.879 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)CN1CC[C@H](NC(=O)OC(C)(C)C)C1 2300532675 ZJOLTXYFXKDYQY-LBPRGKRZSA-N 340.428 1.744 10 10 EDCE CN[C@H](c1ccccc1O)[C@@H](O)c1nc(Br)nn1C 2353741210 ZHGIOGYCGKZNBJ-NXEZZACHSA-N 327.182 1.277 10 10 EDCE CN1CCO[C@@H](CNC(=O)NCc2ccc(N3CC=CC3)cc2)C1 126699521 VKUMADSCORUDRL-KRWDZBQOSA-N 330.432 1.193 10 10 EDCE CCCNCc1ccc(N2CC([C@H](O)CO)C2)c(Br)c1 2361909427 WHANZOHBAZFAIM-OAHLLOKOSA-N 343.265 1.738 10 10 EDCE CNC(=O)[C@@H]1CCCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])C1 78619600 UXSSTSWVMIPRQS-STMXVASLSA-N 347.371 1.743 10 10 EDCE Cn1nnc(Br)c1CN1CCc2cc(O)c(O)cc2C1 2366929139 XIECTNIGGQTJBN-UHFFFAOYSA-N 339.193 1.547 10 10 EDCE Cn1cc(/C=C\C(=O)N2CCc3ccc(Cl)cc32)c(=O)n(C)c1=O 255678226 NBTZWJIIYHXJRW-XQRVVYSFSA-N 345.786 1.340 10 10 EDCE CCC(=O)N1CSC[C@H]1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 273180063 OEDXVSOXGKUNRG-JQWIXIFHSA-N 338.429 1.457 10 10 EDCE CNC1(C(=O)N(C)Cc2ccc(C)c(Br)c2O)COC1 2381135856 XDCBWIAZZZAULU-UHFFFAOYSA-N 343.221 1.410 10 10 EDCE CC(=O)C(=O)COC(=O)C1CCC(NC(=O)CC2CCCC2)CC1 808512859 ZCGAGXCZVOCABW-UHFFFAOYSA-N 337.416 1.943 10 10 EDCE COCc1n[nH]c(CNC(=O)NCc2cc(Cl)ccc2O)n1 821160524 OCCLQEVRLUFDIE-UHFFFAOYSA-N 325.756 1.310 10 10 EDCE C[C@H](NCCS(=O)(=O)N=S(C)(C)=O)c1ccc(N(C)C)cc1 903230332 ZUDABICNSOEDJN-LBPRGKRZSA-N 347.506 1.461 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@@H]2CCC[C@H](C1)N2 841730644 UBDSXRXWYNKHNL-CALCHBBNSA-N 344.459 1.559 10 10 EDCE COc1ccc(CNC(=O)CCCCCCS(N)(=O)=O)c(O)c1 846951645 ZIWNXGMFWLTCNT-UHFFFAOYSA-N 344.433 1.256 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1C(=O)c1cc(C)n(-c2ccccn2)c1C 846435349 VNWMWDIDMINYEW-LSDHHAIUSA-N 329.400 1.711 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CCc3ccnn3C)C2)cc1 855223598 BDADCWPGMPZAEW-CQSZACIVSA-N 328.416 1.756 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H]4COC[C@@]4(C)C3)nc12 852534403 LVKSRASHFJAXJA-APPDUMDISA-N 346.387 1.080 10 10 EDCE C[C@H](NC(=O)NCC(=O)N=S(C)(C)=O)c1ccc(N(C)C)cc1 922052993 ZQJKXOMTKFZMEX-NSHDSACASA-N 340.449 1.367 10 10 EDCE CN(C)C(=O)C1(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 856213362 IVSRREZMZXRUMS-UHFFFAOYSA-N 345.443 1.132 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CCCN2C(C)=O)cc1 869143054 VUJUOPOSTAUYIZ-QGZVFWFLSA-N 333.432 1.601 10 10 EDCE O=C1CCN(S(=O)(=O)c2cccc3nonc23)c2ccccc2N1 765090468 TVKVQUKOXYWJQQ-UHFFFAOYSA-N 344.352 1.760 10 10 EDCE CN(C)c1ccc(/C=C/CN[C@@H](Cc2ncccn2)C(=O)O)cc1 1119550882 YQUZTNDQTQMRIZ-WMHVBEDNSA-N 326.400 1.841 10 10 EDCE Cc1cccc(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)n1 785427208 ALKQQCJJOOOKGP-UHFFFAOYSA-N 326.400 1.389 10 10 EDCE C[C@H]1C(=O)N(C)[C@H](C)[C@H](C)N1C(=O)c1ccc(N=NC(N)=O)cc1 1163829692 ZNMQYEIADAMMBU-VWYCJHECSA-N 331.376 1.929 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCC[C@@H](CO)C3)c(Br)cc21 92775280 RRRRQHHEILKXHS-AMIZOPFISA-N 340.221 1.610 10 10 EDCE C[C@H]1CN(C)CC[C@H]1N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1332018396 GBBACTJVXDJTFD-SWLSCSKDSA-N 331.416 1.033 10 10 EDCE CC(C)NC(=O)CN[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1266995958 LKOIWWUEACWYGN-LLVKDONJSA-N 348.407 1.082 10 10 EDCE CN1CC(N2CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)C1 1349327757 SZAVDNPOTMDJCW-UHFFFAOYSA-N 347.440 1.384 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCC[C@@H]1CCOC1 1480602029 JANJVGJYGJFUOB-CHWSQXEVSA-N 347.419 1.984 10 10 EDCE C[C@H](O)CN[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1480067953 CMYOZTCEONHNCZ-IINYFYTJSA-N 333.392 1.328 10 10 EDCE CCC(=O)NCC[C@@H](C)NCc1nnnn1-c1ccc(OC)cc1 1713400992 KJONKWBUTCHFNU-GFCCVEGCSA-N 332.408 1.065 10 10 EDCE CC[C@@H](OC)C(=O)NCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1491626678 FTFUOQYMJKZNCC-CYBMUJFWSA-N 349.391 1.510 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CC(=O)N(C)CC 1498674858 KEBNAYQUDYYMAQ-UHFFFAOYSA-N 331.420 1.661 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)Cn2cccn2)C2CC2)cc1C 1723274029 UODJYXUCLXPOJC-KRWDZBQOSA-N 342.443 1.885 10 10 EDCE O=C(CNC(=O)c1ccc(F)cc1F)NCc1ccc(O)cc1O 1639444191 AKWODGYOTCAQFG-UHFFFAOYSA-N 336.294 1.422 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@]2(C)CCC(=O)NC2)cc1C 1569076522 VUSYHIJQCDJSMC-LIRRHRJNSA-N 347.459 1.514 10 10 EDCE Cn1nnc2c1CC[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C2 1640192726 VWTWSJJJIDEPBF-LLVKDONJSA-N 327.348 1.265 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CO[C@H]2CCOC2)cc1C 1663927552 DIQNPFHIDROJBL-INIZCTEOSA-N 336.432 1.357 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC[C@@H](O)[C@H]3C)c(Br)cc21 1914311974 UJGNXBZJQBXORL-KEMBBXRSSA-N 340.221 1.621 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC1CCN([C@@H]2CCOC2=O)CC1 1597147904 KTTUXYGWINNWHM-KWEXDPCDSA-N 346.383 1.007 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(CC(F)(F)F)C(=O)C1 1773122043 NJHVOWIUXYVATK-RQOWECAXSA-N 344.289 1.344 10 10 EDCE Cc1cc(C(=O)NC[C@@H]2CC[C@@H](C(N)=O)O2)c(C)n1-c1ccccc1 161311922 WVGWJTMXUKBUPL-RDJZCZTQSA-N 341.411 1.857 10 10 EDCE COc1ccc(/C=C2/SC(=S)N([C@@H](CO)C(=O)O)C2=O)cc1 1858595845 JMSINZGMROQXFS-OTXQMUPVSA-N 339.394 1.342 10 10 EDCE C[C@H](CCO)N(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 1917089914 DZVDZOFLPQNMKY-JMCQJSRRSA-N 329.194 1.642 10 10 EDCE NCc1cc(F)c(N2CCCCC2(CO)CO)cc1Br 2146126373 XOJIIIXRIXIHFL-UHFFFAOYSA-N 347.228 1.761 10 10 EDCE COc1ccc(N2CCN(C(=O)OC(C)(C)C)C[C@@H](O)C2)c(N)c1 1999542518 RXUBFNSJIBFAMO-LBPRGKRZSA-N 337.420 1.695 10 10 EDCE CC(C)(C)OC(=O)NCC1(O)CC(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2010403543 FRIRXTATPRZNHC-LOIXOFCESA-N 339.396 1.563 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)c1cn(C)nn1 2010401957 JYHJRWDLHVVCRG-JTQLQIEISA-N 338.372 1.150 10 10 EDCE CN(C)c1ccc(CN=c2nc(CO)c(Br)c[nH]2)cc1 2160471746 HLSROUNWOORNIO-UHFFFAOYSA-N 337.221 1.831 10 10 EDCE CN(Cc1nnnn1C)c1ccc(CN)c(Br)c1F 707664158 BLCYZWGSDHSCIK-UHFFFAOYSA-N 329.177 1.207 10 10 EDCE CNCc1ccc(N(C)C[C@@H]2CN(C)CCO2)c(Br)c1 707887544 UOSRITSTIODOJD-ZDUSSCGKSA-N 342.281 1.935 10 10 EDCE NCc1cc(F)c(N2CC[C@H](CC(N)=O)C2)cc1Br 690770180 HDHVDKDECVZKTQ-MRVPVSSYSA-N 330.201 1.749 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC(F)(CO)C3)c(Br)cc21 2172924718 MBGJSJRTICHTSN-NSHDSACASA-N 344.184 1.182 10 10 EDCE CC(C)(C)OC(=O)NCC1(CNC(=O)Cc2ccc(N)cc2)COC1 2056738394 YLLJTXLJRMVOCZ-UHFFFAOYSA-N 349.431 1.469 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3COC[C@@H](C2)[C@H]3O)c(Br)c1 2189046068 ZMZUDKQGPMEGAS-BTABJRDXSA-N 342.233 1.946 10 10 EDCE CN1CC(N(C)c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2089242275 YBKXDLHPMCOUEL-GFCCVEGCSA-N 325.210 1.151 10 10 EDCE NCc1ccc(N2CC[C@H]3OCCO[C@@H]3C2)cc1Br 2095385774 IMLKXOSPVBBSKK-ZIAGYGMSSA-N 327.222 1.902 10 10 EDCE CC(C)(C)OC(=O)NCC12CC(C1)[C@H](C(=O)NCCN=[N+]=[N-])CO2 2303344490 MQSMISBASWEBFI-LOIXOFCESA-N 339.396 1.733 10 10 EDCE CN1C(=O)NC(=O)C(=Cc2cc([N+](=O)[O-])ccc2N2CCCC2)C1=O 2313526713 CGPBUNSWZXIILZ-UHFFFAOYSA-N 344.327 1.287 10 10 EDCE COc1ccc(N2N=C(C)C(=C(C)NN3CCN(C)CC3)C2=O)cc1 2313682287 ZFFPVVZHVHTYGF-UHFFFAOYSA-N 343.431 1.444 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H](CCO)COCc1ccccc1 2320371373 SJWCSDBUVISWLD-MRXNPFEDSA-N 345.395 1.724 10 10 EDCE CO[C@H]1CN(c2ccc(CO)cc2Br)[C@@H]2COC[C@@H]21 2329191068 BWORXZHNPBZSCR-GDLCADMTSA-N 328.206 1.791 10 10 EDCE CN1C(=O)Cc2cc(N3CCN(C(=O)[C@@H]4CCCO4)CC3)ccc21 62575995 IBZVDOFLXQEXBC-INIZCTEOSA-N 329.400 1.033 10 10 EDCE O=C(CSc1nnc(O)[nH]c1=O)c1sc2ccccc2c1O 72261578 ROFQEKZTNTWBOB-UHFFFAOYSA-N 335.366 1.766 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CC[C@@]3(CNC(=O)C3)C2)cc1 279456836 KXVLLXLGHLTHFL-LJQANCHMSA-N 344.459 1.954 10 10 EDCE Cc1ccc(CN(C)c2ncnc(NN)n2)c(O)c1Br 2380741172 DHMVCOOELATKTN-UHFFFAOYSA-N 339.197 1.570 10 10 EDCE OCc1ccc(N2CC3(CCOCC3)[C@@H]2CO)cc1Br 2381116866 HDSQMQAUILXEPE-AWEZNQCLSA-N 342.233 1.919 10 10 EDCE Cc1ccc(CNC(=O)[C@@]2(N)CCCOC2)c(O)c1Br 2381129415 JYRNHNPRDNLMFP-CQSZACIVSA-N 343.221 1.587 10 10 EDCE Cc1ccc(CN2CC[C@@](CO)(C(=O)O)C2)c(O)c1Br 2381137852 KJVMHJCUIBYOAE-CQSZACIVSA-N 344.205 1.732 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)NCc1cc(Br)ccc1O 804734323 AVFGIZZPCMEKJB-LLVKDONJSA-N 346.177 1.085 10 10 EDCE CC(=O)C(=O)COC(=O)CCn1cnc2sc(C)c(C)c2c1=O 808492731 CRDBOCHAKRCVFE-UHFFFAOYSA-N 336.369 1.166 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1 808501065 CWQZKIDRUKMMAR-OAHLLOKOSA-N 331.368 1.169 10 10 EDCE OC[C@@]12CC[C@@](NCc3c(O)cccc3Br)(CO1)C2 2133659139 FGVGBUKCPKEQBT-KBPBESRZSA-N 328.206 1.928 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3ccoc3)C2)cc1 827044403 MLTLOQVIKRSVQQ-AWEZNQCLSA-N 343.383 1.300 10 10 EDCE Cc1cc(O)c(CN2CCN(S(C)(=O)=O)[C@H](C)C2)cc1Cl 827266129 PEWARVOPRDCKCV-LLVKDONJSA-N 332.853 1.820 10 10 EDCE CN1CCC[C@@](O)(CC(=O)NCc2c(O)ccc3c2CCCC3)C1 901130561 CZJQEYQHMQFODU-LJQANCHMSA-N 332.444 1.734 10 10 EDCE CN(C)c1ccc([C@H](N)CNC(=O)COC2CCC(N)CC2)cc1 832265911 BKNQUTYQLAERTM-BDVYOWHSSA-N 334.464 1.155 10 10 EDCE NC[C@H](NC(=O)NCc1ccc(N2CCCC2)cc1)C(F)(F)F 848595566 LXJDNKAIANSZMF-ZDUSSCGKSA-N 330.354 1.976 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@@H](CC3OCCO3)C2=O)cc1F 924543188 QGCBHEDREVGOPV-LBPRGKRZSA-N 337.351 1.075 10 10 EDCE c1cc(N2CCN(CC3CC3)CC2)ccc1CN[C@H]1CNCCOC1 925633031 YGMVMIWEQBZFLT-IBGZPJMESA-N 344.503 1.297 10 10 EDCE Cc1cc(CC(=O)O[C@H](C)C(=O)NC(N)=O)c(C)n1-c1ccccc1 853935132 WXWNODDGFDFSOQ-CYBMUJFWSA-N 343.383 1.763 10 10 EDCE CNC(=O)CCN(C)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 854301588 QGSZHZOBIFOBAZ-CYBMUJFWSA-N 334.420 1.051 10 10 EDCE Cn1nccc1[C@@H](O)CNC(=O)NCCCSc1nccs1 921447974 ZGQZZBOJDYVCPP-NSHDSACASA-N 341.462 1.392 10 10 EDCE COC[C@@H](NCc1ccc(N2CCN(C)CC2)cc1)C1CCOCC1 850351877 WFSZREAIIXWDDS-HXUWFJFHSA-N 347.503 1.970 10 10 EDCE C[C@H](NCCCN1CCCS1(=O)=O)c1cc([N+](=O)[O-])ccc1O 756688450 OEVJCOQEWRYGEH-NSHDSACASA-N 343.405 1.377 10 10 EDCE O=C(COCC(F)F)NCc1ccc(N2CCC(CO)CC2)cc1 859460732 ZVFVZFCONUYKPJ-UHFFFAOYSA-N 342.386 1.793 10 10 EDCE CN1CCN(c2ccc(CNc3ncc4c(n3)COC4)cc2)CC1 865294333 IKRJBWUZVYEMPM-UHFFFAOYSA-N 325.416 1.871 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](O)[C@@H](C)O 871143718 RGXBAPSCMFVWTG-CXAGYDPISA-N 330.384 1.378 10 10 EDCE COCCN1CC[C@@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C1 896259960 WUGKKYOUIXMBOQ-LLVKDONJSA-N 336.413 1.763 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cn(C)nc2OC)cc1C 1317253544 CYNRRXVHMPFLHI-ZDUSSCGKSA-N 346.431 1.654 10 10 EDCE O=C(NCc1cc(=O)n2ccccc2n1)N1Cc2cccc(O)c2C1 1252521087 JQAUGIKNMYVWQG-UHFFFAOYSA-N 336.351 1.626 10 10 EDCE CN1C(=O)Cc2cc(CNC(=O)Cc3ccc(O)c(O)c3)ccc21 1180832393 IYFFNHMGDCGJQP-UHFFFAOYSA-N 326.352 1.476 10 10 EDCE CCN1C[C@H](C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)CC1=O 1268648252 ZWKIKAFCCIWHTJ-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE CCS(=O)(=O)c1cccc(CC(=O)NCc2c(O)cccc2O)c1 1456232868 CGPVQBJZRORVNR-UHFFFAOYSA-N 349.408 1.750 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2(NCCCO)CCCC2)cc1 1715308676 GLKNXORNNDVCHG-UHFFFAOYSA-N 347.419 1.864 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)NCc1c(O)cccc1O 1558535275 DUBDOUNOHPAXDE-JYAVWHMHSA-N 348.399 1.827 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)Cn2ccnc2)cc1C 1482906437 XZFRJYWSNBYYJZ-OAHLLOKOSA-N 330.432 1.885 10 10 EDCE COC(=O)[C@@H](CNC(=O)Cc1ccc(O)c(O)c1)c1ccccc1 1633915338 QAKLGAFURYIFRD-AWEZNQCLSA-N 329.352 1.713 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCOCCN(C)C 1492781852 NJAJFBLVPVTVHB-UHFFFAOYSA-N 333.436 1.507 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H](F)C(C)C)cc1C 1568574228 BXIQGBMNFXXVBV-GDBMZVCRSA-N 326.412 1.564 10 10 EDCE O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCc1ccc(O)cc1O 1643101068 URLOHHLGHMCCSZ-KBPBESRZSA-N 346.383 1.279 10 10 EDCE COC(=O)COc1ccc(N(C)CC(=O)Nc2ccccn2)cc1 1642689359 PPPFIFUJNPWWNC-UHFFFAOYSA-N 329.356 1.708 10 10 EDCE COc1ccc(CN[C@H]2C[C@@H](CNC(=O)[C@@H](C)CC(N)=O)C2)cc1C 1691107559 HUAXMEYDKROFJO-CWRNSKLLSA-N 347.459 1.500 10 10 EDCE CCCCC(=O)N1CCCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169846330 ZGLABCUCRUZOKQ-UHFFFAOYSA-N 336.388 1.668 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H]4OCCC[C@@H]4C3)cc2N1 152433504 ALSDWARYGBMAIH-QMTHXVAHSA-N 333.344 1.931 10 10 EDCE CNC(=O)c1ccc(/C=C/C(=O)NCCc2ccc(O)c(O)c2)cc1 156656237 CALIHKZPMAVMMW-WEVVVXLNSA-N 340.379 1.830 10 10 EDCE C[C@@H](O)[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 1858592166 IDDYOOIRZARJAI-TVNLMNMCSA-N 339.394 1.427 10 10 EDCE C[C@H](O)CN(Cc1ccccc1)c1cc2c(cc1N)OCC(=O)N2 1914656519 IGWSHNODTDEVKU-LBPRGKRZSA-N 327.384 1.987 10 10 EDCE COc1ccc(N(C)C[C@H](O)CN(C)C(=O)OC(C)(C)C)c(N)c1 1999533954 XYUBOTFMILKKTB-LBPRGKRZSA-N 339.436 1.941 10 10 EDCE CC(C)(C)OC(=O)N1Cc2[nH]cnc2C[C@H]1C(=O)NCCN=[N+]=[N-] 2010393069 NNHYCCWAUCPKLB-NSHDSACASA-N 335.368 1.498 10 10 EDCE CN(Cc1c(Br)nnn1C)C(=O)c1cccc(O)c1O 2156463908 UUQSEMJEHULVLH-UHFFFAOYSA-N 341.165 1.261 10 10 EDCE CNCc1ccc(N2CCC[C@](O)(CO)C2)c(Br)c1 314255566 WHCAEIHSQJQFRK-CQSZACIVSA-N 329.238 1.492 10 10 EDCE CCNCc1ccc(N2CC3(CNC(=O)N3)C2)cc1Br 2177698925 PGVCDXCARDCKLS-UHFFFAOYSA-N 339.237 1.430 10 10 EDCE O=C(Nc1ccc(O)c(O)c1)C1CCN(C(=O)N2CCCC2)CC1 2063854624 QFLZTBOUFFZRJL-UHFFFAOYSA-N 333.388 1.964 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H](CO)[C@@H](F)C3)c(Br)cc21 2177144357 RGRIKHMFQZPONH-HQLZOWSPSA-N 344.184 1.168 10 10 EDCE C[C@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)c(Br)c1 2190454893 WBKOJJOQHYHSTD-VJMWFJFBSA-N 342.233 1.965 10 10 EDCE O=C(c1ccc(O)c(O)c1)N1CCC(CNC(=O)C(F)(F)F)CC1 2054400154 BCJKJQRRHJLXDU-UHFFFAOYSA-N 346.305 1.629 10 10 EDCE Cc1cc(Br)cc(CN2C[C@H]3C[C@H]2CN3C(N)=O)c1O 2192235638 OTLTVYCOCCYFIC-NWDGAFQWSA-N 340.221 1.800 10 10 EDCE N[C@@H]1CC(C(=O)N2CCCc3cccc(Br)c32)=C[C@@H]1O 2188025610 GVFKYPJVPLQXOQ-OLZOCXBDSA-N 337.217 1.747 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@@H](CO)C[C@H]32)c(Br)c1 2199785561 ICKCRPOLYJJSLZ-NILFDRSVSA-N 341.249 1.884 10 10 EDCE NCc1ccc(N2CCO[C@@H]3COCC[C@H]32)cc1Br 2087489320 ZQOIEHAYYMOXLH-ZIAGYGMSSA-N 327.222 1.902 10 10 EDCE O=S1(=O)C[C@H]2CN(Cc3c(O)cccc3Br)C[C@@H]2C1 2087858106 ICKSYCVNMZZJJD-NXEZZACHSA-N 346.246 1.631 10 10 EDCE CC[C@H](N[C@@H]1CN(C)C[C@H]1O)c1cc(Br)ccc1O 2090335299 YJIRJOGQHVIYIM-OUCADQQQSA-N 329.238 1.870 10 10 EDCE CC(C)(C)OC(=O)Nc1cccc(CCOc2nnc(=N)[nH]n2)c1 2213781312 QGIPNSRGNMIYJU-UHFFFAOYSA-N 332.364 1.648 10 10 EDCE Nc1ccc(OCC(=O)NCCc2cc(Br)no2)cc1 2237168009 ALBIGSIXWMDTCX-UHFFFAOYSA-N 340.177 1.757 10 10 EDCE O=C(O)C[C@H](C(=O)O)N1C(=O)C(=Cc2ccncc2)SC1=S 2293031244 TUUIBVDOMQVQRI-MRVPVSSYSA-N 338.366 1.211 10 10 EDCE OCC[C@@H](COCc1ccccc1)NCc1ccc(O)c(O)c1O 2303620179 WAFSNHXXDQKDLJ-HNNXBMFYSA-N 333.384 1.861 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2333237783 RHQVGWUBMMLDSR-VGYUKGMSSA-N 333.201 1.349 10 10 EDCE Cc1ccc(CNC(=O)C2[C@H]3COC[C@H]23)c(O)c1Br 2352942055 YZPJCCLEZJQFNP-UWVGGRQHSA-N 326.190 1.972 10 10 EDCE CCNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2354483725 RKJIWZVBRAZGGQ-BSLXNSKLSA-N 341.249 1.489 10 10 EDCE CC[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)CCN1C[C@@H](C)O 173270152 RJMHPBGBTDQRSV-WBVHZDCISA-N 348.491 1.739 10 10 EDCE CN(C[C@@H]1CCCO1)C(=O)NCc1ccc(N2CCOCC2)cc1 102904709 IGIKDAMDBOTJSU-KRWDZBQOSA-N 333.432 1.844 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](CC(C)C)NC(N)=O)CC2)cc1 70719023 OZPISVBWEQZXKQ-MRXNPFEDSA-N 348.447 1.427 10 10 EDCE O=C1c2cc(O)cc(O)c2C(=O)c2c1cc1c(c2O)[C@@H]2CCO[C@H]2O1 14828613 BABJNKGTTYCTOO-VIIUKITBSA-N 340.287 1.801 10 10 EDCE biogenic CCn1cccc1-c1noc(CNC(=O)c2cc(O)nc(O)c2)n1 238822121 CWYFUWRATNBDJU-UHFFFAOYSA-N 329.316 1.294 10 10 EDCE COc1ccc(N2CCN([C@H](C)c3nc(N)nc(Cl)n3)CC2)cc1 289012961 ADYSBMIXYCFUNB-LLVKDONJSA-N 348.838 1.999 10 10 EDCE COc1cc(N(C)C[C@H]2CCCS(=O)(=O)C2)cc(OC)c1OC 283991220 GGGWUKQCTGFDLT-GFCCVEGCSA-N 343.445 1.973 10 10 EDCE CCCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)C(C)=O)c1 808493447 DPGGKEPNVPGVNI-UHFFFAOYSA-N 327.358 1.153 10 10 EDCE Cc1ccc(O)c([C@@H](C)N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)c1 806171033 PIVIPDNGCFHJMZ-ZIAGYGMSSA-N 341.477 1.622 10 10 EDCE COc1ccc(N2CCCN(C(=O)c3cn(C)c(O)n3)CC2)cc1 822918802 FCZXMBMSGSHGNN-UHFFFAOYSA-N 330.388 1.487 10 10 EDCE COc1cc(O)c(CN2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)cc1OC 824654372 NPCJFGAWTIIPLM-NWANDNLSSA-N 337.416 1.771 10 10 EDCE CSC[C@@H](NC(=O)NCc1ccc(N(C)C)c(F)c1)C(=O)O 905521782 PVZOSSCMJMTXIQ-LLVKDONJSA-N 329.397 1.507 10 10 EDCE Cn1nc2c(c1CNC(=O)NCCc1ccc(N)cc1)CCCC2 841911340 NHHSZYQJXDHDMT-UHFFFAOYSA-N 327.432 1.923 10 10 EDCE CCOCCS(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849415979 JCBMMIYEBZBOFW-ZDUSSCGKSA-N 328.434 1.230 10 10 EDCE CN1CC[C@@H](C(=O)NCc2ccc(O)c(O)c2)[C@H](c2cnn(C)c2)C1 849562753 HAGGHNOAXPGMOO-CABCVRRESA-N 344.415 1.183 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@@](O)(C4CC4)C3)cc2N1 853833165 MCJPJCGPGLNPMV-INIZCTEOSA-N 333.344 1.667 10 10 EDCE CNC(=O)CCCN(C)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852453413 JAYWYPQBLYMAJT-AWEZNQCLSA-N 348.447 1.442 10 10 EDCE CN(c1ccc(CNS(=O)(=O)C2CNC2)cc1)C1CCCCC1 923595105 GMTBKLBCMORQRV-UHFFFAOYSA-N 337.489 1.847 10 10 EDCE C[C@H](CNC(=O)C(=O)NCCc1ccc(N)cc1)c1ccccn1 851688206 SMKHNPDFGFQPSQ-CYBMUJFWSA-N 326.400 1.242 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3nncn3C)C2)cc1 854297283 LRJDBCZNYUSKJJ-CYBMUJFWSA-N 344.419 1.244 10 10 EDCE COc1ccc(O)c(CNC(=O)N[C@@H]2CC[C@@H](C)S(=O)(=O)C2)c1 853736640 ISMJKCZJXBKTBN-ZYHUDNBSSA-N 342.417 1.166 10 10 EDCE COCCC1CN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 854297959 YKKXDCSYPHZUHC-OAHLLOKOSA-N 333.432 1.952 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)c1ccc2c(c1)B(O)OC2 863876213 QOEMEEHEXXCZGK-UHFFFAOYSA-N 325.173 1.662 10 10 EDCE O=C1N[C@]2(CCSC2)C(=O)N1Cc1ccc(N2CCOCC2)cc1 761067298 AYPDFVZYZHEISX-KRWDZBQOSA-N 347.440 1.451 10 10 EDCE C[C@@H]1COCC[C@@H]1C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 769259071 QSESOLVOISNKFM-PBHICJAKSA-N 348.443 1.927 10 10 EDCE C[C@H](NC(=O)C(=O)NC[C@@H]1CCOC1(C)C)c1ccc(N(C)C)cc1 1118631869 PFNJUICMGAAYQK-ZFWWWQNUSA-N 347.459 1.861 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)[C@@H](C)O)CCCC1 871141624 SHUIKKUZDPHVKG-XIKOKIGWSA-N 346.427 1.387 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)c2cccn(C3CC3)c2=O)cc1 870932744 IWAKGXVKTVPVSG-KRWDZBQOSA-N 340.427 1.679 10 10 EDCE CC(C)(C)C(=O)Cn1cc(C(=O)N2Cc3cccc(O)c3C2)nn1 871203237 VBWBUUXWJWKBQL-UHFFFAOYSA-N 328.372 1.755 10 10 EDCE CN(C)c1ccc(CN(C(=O)[C@@H](O)Cc2cnn(C)c2)C2CC2)cc1 786741265 DDPUUBPRODMTLZ-SFHVURJKSA-N 342.443 1.581 10 10 EDCE O=S1(=O)CCCN1CCCNCc1c(O)ccc(Cl)c1F 790959932 LUSIOFPJMJQHIX-UHFFFAOYSA-N 336.816 1.700 10 10 EDCE CNC(=O)[C@H](C)NCC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1320651788 FRFCAERXRKAUFO-MNOVXSKESA-N 348.407 1.082 10 10 EDCE CC1(C)COC[C@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1338250911 WGAFTGCNRUSDER-MRXNPFEDSA-N 338.473 1.436 10 10 EDCE Cc1cc([C@@H]2CCCN2C(=O)C(=O)N2Cc3cccc(O)c3C2)on1 1335549048 VHVRJUJCUZKFQV-AWEZNQCLSA-N 341.367 1.895 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCc1ccccc1Cn1cncn1 1296906581 XEWCPPWFIMXFKE-UHFFFAOYSA-N 338.367 1.597 10 10 EDCE Nc1ccnn1CC(=O)NCc1ccc(N2CCSCC2)cc1 1541079946 AQGGRSOJWWACDR-UHFFFAOYSA-N 331.445 1.335 10 10 EDCE NC(=O)[C@@H](O)CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1612339035 CVEOLSPAPILWNP-AWEZNQCLSA-N 329.312 1.084 10 10 EDCE CCN(C(=O)Cc1ccc(O)c(O)c1)[C@@H](C)CS(=O)(=O)CC 1543663134 NUBSFOOWOVQRFQ-NSHDSACASA-N 329.418 1.312 10 10 EDCE O=C1C[C@@H](c2ccccc2)N(C(=O)Cc2ccc(O)c(O)c2)CCN1 1542075576 SMWLTGUHWKEGPT-HNNXBMFYSA-N 340.379 1.730 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)[C@H](C)NC(C)=O)C2)cc1C 1713939047 HDYRYWQVYCUTLD-RCBQFDQVSA-N 333.432 1.265 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C(C)(C)C(F)F)cc1C 1717777055 XEYCCONYVRURKD-ZDUSSCGKSA-N 344.402 1.862 10 10 EDCE C[C@H]1CCS(=O)(=O)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1625135300 LXXAKZBYGKMEOK-JTQLQIEISA-N 338.389 1.498 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C[C@H]2CCC(=O)N2)cc1C 1716416050 SLGPVYMFRHMQCJ-UKRRQHHQSA-N 333.432 1.267 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CCCS1(=O)=O 1624954313 HNEQVDSCNXQXIE-PWSUYJOCSA-N 327.402 1.112 10 10 EDCE O=C(Cn1nnnc1-c1ccsc1)NCc1ccc(O)c(O)c1 1630273432 NRNKTSQDYVVBRP-UHFFFAOYSA-N 331.357 1.129 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](NS(C)(=O)=O)C(C)C 1640260056 PHGYPYFCATVHRU-CYBMUJFWSA-N 349.449 1.068 10 10 EDCE COC(=O)Cc1ccccc1CNC(=O)c1c(F)ccc(O)c1O 1641553370 NLLLLMKUADLYMV-UHFFFAOYSA-N 333.315 1.882 10 10 EDCE CCOC(=O)[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 1648419458 CQRZHRQCIZFDEN-GFCCVEGCSA-N 334.332 1.253 10 10 EDCE Cn1cnn(-c2ccc(NC(=O)c3c(F)ccc(O)c3O)cc2)c1=O 1650914888 NAVIRYNKCFSLJV-UHFFFAOYSA-N 344.302 1.374 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)c(Br)c1 2126155920 AVRXTJXJPKRRAT-RDBQEKCUSA-N 328.206 1.119 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)[C@@H]2COC(=O)N2)C(C)C)cc1C 1698964674 IOIBXVGPWACLOT-GJZGRUSLSA-N 349.431 1.342 10 10 EDCE O=C(O)[C@H]1C[C@H](O)CN1Cc1cc(Br)cc(F)c1O 2136126533 ZOEAPSTTXULBJW-WCBMZHEXSA-N 334.141 1.314 10 10 EDCE CC[C@H]1C(=O)NC(=O)CN1c1ccc([C@H](C)N)c(Br)c1 233947405 CJTZNWGKOIHQJE-UFBFGSQYSA-N 340.221 1.710 10 10 EDCE CC(=O)[C@@H](N)C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952117448 AEKSDKWPFOXWOA-OLZOCXBDSA-N 338.404 1.840 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 1985099822 SJXKRNWMHDFEAX-WDEREUQCSA-N 327.385 1.421 10 10 EDCE COCCNCc1ccc(N(C)C2CN(C)C2)cc1Br 2145479248 AAFJJTDOYHCIAM-UHFFFAOYSA-N 342.281 1.935 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010406055 PLLKYVTUSHSSDL-RYUDHWBXSA-N 339.396 1.924 10 10 EDCE CN[C@H](C)c1ccc(N2CCO[C@@H](CO)C2)cc1Br 300517904 REOGYKRUPDGWKG-ZYHUDNBSSA-N 329.238 1.927 10 10 EDCE NCc1ccc(N2C[C@H](CO)[C@@H](CO)C2)c(F)c1Br 704702128 KLQKHFTXQZOCLA-NXEZZACHSA-N 333.201 1.084 10 10 EDCE COCCNC(=O)CN(C)Cc1c(O)cccc1Br 707144218 MANAJNREWWOKHX-UHFFFAOYSA-N 331.210 1.349 10 10 EDCE C[C@]1(CO)CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 381807995 VBBGOCZQKIGGMY-OCCSQVGLSA-N 340.221 1.610 10 10 EDCE Cc1cc(Br)cc(CN2C[C@@H]3OCCN(C)[C@@H]3C2)c1O 775716584 DKWYGUFCOJRYLV-KGLIPLIRSA-N 341.249 1.978 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@H]3O)cc1Br 2182558068 AQYLSLHUOHQBAB-TZDNBKRZSA-N 342.233 1.680 10 10 EDCE CC(C)(C)OC(=O)NC1[C@@H]2CN(c3cc4c(cc3N)OCCO4)C[C@@H]12 2045672316 WJADOGNYHUDZPX-GHMZBOCLSA-N 347.415 1.999 10 10 EDCE NCc1cc(F)c(N2C[C@@H](CO)C[C@H]2CO)cc1Br 2089907894 ONESDYNXGPFXLB-WPRPVWTQSA-N 333.201 1.226 10 10 EDCE COCCN1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)C(C(=O)OC)=C1C 2297358661 BDGKBMPVLQCALN-UHFFFAOYSA-N 346.339 1.914 10 10 EDCE CCOC(=O)c1ccccc1NC=C1C(=O)NC(=S)N(C)C1=O 2297365296 QNXRUKVBCBQAEX-UHFFFAOYSA-N 333.369 1.032 10 10 EDCE COC[C@@H](OC)C(=O)NCc1ccc(C)c(Br)c1O 2352943312 RMGLBZAWCLHOJS-SNVBAGLBSA-N 332.194 1.741 10 10 EDCE Cc1nn(C)c(C)c1N/C=C1/C(=O)NC(=O)N(c2ccccc2)C1=O 59858242 DFYVFFBGOLAFAI-LCYFTJDESA-N 339.355 1.616 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1[C@H]2CC[C@H]1CC(O)C2 171976276 ZEEOBPPRHWDURN-IRXDYDNUSA-N 331.460 1.699 10 10 EDCE COC(=O)c1cccc(S(=O)(=O)NCCc2ccc(N)cc2)c1 171531630 SNLICLSIWJHMOU-UHFFFAOYSA-N 334.397 1.576 10 10 EDCE C[C@@H](CN[C@H](C)c1ccc(N2CCOCC2)cc1)N1CCN(C)CC1 127305060 DOCGLPAHHLRYMM-ZWKOTPCHSA-N 346.519 1.810 10 10 EDCE Nc1ccc(CCNS(=O)(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1 193338249 VKXPOTNKLOTNJO-UHFFFAOYSA-N 339.348 1.837 10 10 EDCE CCOC(=O)N1CCN(C(=O)N(C(C)=O)c2ccc(N)cc2)CC1 243526275 OASDNQJTMYEVII-UHFFFAOYSA-N 334.376 1.516 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N1CCC[C@H](CO)C1 255088370 RPDFUPJFZCXFEW-AFCDSYGPSA-N 330.428 1.767 10 10 EDCE CCOc1cccc(CNC[C@H]2CCC[C@@]23NC(=O)N(C)C3=O)c1O 360017447 DABYZDYYWMGQAP-FZKQIMNGSA-N 347.415 1.601 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN3CCOC[C@@H]3C2)c([N+](=O)[O-])c1 371808526 JCVBLQCXSSFVJG-KQIUPUNMSA-N 347.371 1.302 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2COCC[C@@H]2N)c(O)c1Br 2380749499 PFFJRKBLDIFUNB-QWRGUYRKSA-N 343.221 1.443 10 10 EDCE CO[C@H]1CN[C@H](C(=O)NCc2ccc(C)c(Br)c2O)C1 2380758569 WLLZZWRWKBTHEM-MNOVXSKESA-N 343.221 1.456 10 10 EDCE COc1ccc2c(c1)c1c(n2CC(=O)NC(C)(C)C(N)=O)CCCC1 649728506 WDLRSJQVLYRGES-UHFFFAOYSA-N 343.427 1.909 10 10 EDCE CC(=O)C(=O)COC(=O)Cc1cn2cc(Cl)cc(Cl)c2n1 808517739 LSPBFCRPHKOUMZ-UHFFFAOYSA-N 329.139 1.885 10 10 EDCE Nc1ccc(OCCCOn2c(=O)c(=O)oc3c(N)cccc32)cc1 821297119 MYTISOBHBSSZFY-UHFFFAOYSA-N 343.339 1.017 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H](N)C(F)(F)F 826030988 ZTHBPLMMDDHBKL-ZDUSSCGKSA-N 331.338 1.371 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)N(C)CC3CC3)CC2)cc1 738342801 IASLIPYJDNGZNI-UHFFFAOYSA-N 339.461 1.404 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCCC(=O)N3C)CC2)cc1 905103751 DAMGZWIMKXFWQL-MRXNPFEDSA-N 331.416 1.355 10 10 EDCE CN1C[C@H](O)C[C@]1(C)C(=O)NCc1ccc(N2CCSCC2)cc1 900254346 GSNMYCWTUKNJDU-SJLPKXTDSA-N 349.500 1.311 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CCC[C@](O)(CO)C3)ccc21 838031708 NCOAGJQQHMBKJK-GOSISDBHSA-N 333.432 1.098 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)N3CCCC3)C2)cc1 849416681 VAOVCBLHPINIIU-ZDUSSCGKSA-N 325.434 1.204 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1cnc(C)o1 911303457 IZJXRBGKZYMBOI-UHFFFAOYSA-N 332.356 1.823 10 10 EDCE COC(=O)[C@H]1CN(C(=O)NCCCSc2nccs2)CCO1 759601181 KPMOIZAMQNHOFR-SNVBAGLBSA-N 345.446 1.209 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2C[C@@]34CCCC[C@]3(COC4)C2)cc1 850866650 CXEHRCUGENWYAJ-QZTJIDSGSA-N 329.400 1.627 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc4n(n3)CCCO4)C2)cc1 855224241 JGSCAHHYCZLADR-CYBMUJFWSA-N 342.399 1.683 10 10 EDCE CCS(=O)(=O)N(C)CCCNC(=O)N[C@@H](C)c1ccccc1O 868111584 LEHFKJSUZADWLN-LBPRGKRZSA-N 343.449 1.424 10 10 EDCE C[C@H](NS(=O)(=O)c1cnc(O)s1)c1ccc(N(C)C)cc1 867125845 NQYJGFGZOLITOB-VIFPVBQESA-N 327.431 1.954 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCc2nnnn2CC1 862025079 MQTSXIFDMPGRRB-GFCCVEGCSA-N 338.371 1.196 10 10 EDCE COc1ccc(CNC(=O)c2cn3c(n2)C[C@@H](OC)CC3)c(O)c1 867956031 KKQVFTABLQRKCF-ZDUSSCGKSA-N 331.372 1.489 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1C[C@@H]2[C@H]3CC[C@@H](NC3)[C@H]2C1 863653019 XYHUCTXNILCZOS-OJAHFUOMSA-N 327.472 1.953 10 10 EDCE CCCN(CCN(CC)CC)C(=O)C(=O)N1Cc2cccc(O)c2C1 1118946057 PWBJUQPCMLECIA-UHFFFAOYSA-N 347.459 1.815 10 10 EDCE COCCN(C)C1CN(c2ccc(CO)c(Br)c2)C1 1877431374 WDDIUWPMANZYET-UHFFFAOYSA-N 329.238 1.708 10 10 EDCE O=C(NCC[C@]1(O)CCCOC1)c1cc2cc(O)c(O)cc2s1 898295025 SNYKGCISXWRKIF-MRXNPFEDSA-N 337.397 1.974 10 10 EDCE COc1cc(Br)cc([C@@H]2C=C(C(=O)O)NC(=O)N2)c1O 76257548 SMBPRKOGRZTJDM-ZETCQYMHSA-N 343.133 1.486 10 10 EDCE CNCc1ccc(N2CCN(C)[C@H](CO)C2)c(Br)c1 687617155 ZTLBLNCBSXCDEJ-LBPRGKRZSA-N 328.254 1.281 10 10 EDCE CN(c1ccc(CNC2CC2)c(Br)c1)[C@@H]1COC[C@@H]1O 708112347 FYCNYZBOQYRVGG-CABCVRRESA-N 341.249 1.897 10 10 EDCE C[C@@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)N(C)Cc1ccccc1O 1332092621 BVUAOLVTKKMZLQ-ADSMDIBLSA-N 332.400 1.111 10 10 EDCE Nc1ccc(CS(=O)(=O)NCc2cc(Br)no2)cc1 718849372 LIMPLFHWTBVCNK-UHFFFAOYSA-N 346.206 1.639 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@H](OC)C2)cc1 1257176840 PBJGOBXHIQZVRY-WBVHZDCISA-N 347.459 1.833 10 10 EDCE CN1CC2(CN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)OC1=O 1331744776 DXQAWTFBXGEQCR-UHFFFAOYSA-N 334.353 1.589 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)NCc1nnc(O)n1C 1254518567 WMYPRSHSQRLICY-UHFFFAOYSA-N 333.392 1.738 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2cc[nH]c2C)cc1C 1268302774 UVNXIYKMLRIACL-HNNXBMFYSA-N 331.416 1.521 10 10 EDCE Cc1ccc2c(c1)c(C)c(C(=O)N(C)C[C@@H]1COC[C@@H](O)[C@@H]1O)n2C 1615149421 QPGUFCPQZNQIJQ-MZMPZRCHSA-N 346.427 1.235 10 10 EDCE Cn1cc([C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)c2ncon2)cn1 1625165057 DCIUGZWUSMFOOA-UJAVWCLSSA-N 341.327 1.133 10 10 EDCE COc1ccc(CNC2(CNC(=O)CNC(C)=O)CCCC2)cc1C 1482208361 BEWHERDLZHXYKH-UHFFFAOYSA-N 347.459 1.658 10 10 EDCE Cc1cccc([C@@H](CC(=O)NCc2ccc(O)cc2O)NC(N)=O)c1 1557084637 ICEJFLJSYJTCEW-OAHLLOKOSA-N 343.383 1.822 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CCCS1(=O)=O 1624954312 HNEQVDSCNXQXIE-JQWIXIFHSA-N 327.402 1.112 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCc3ncnc(O)c3C2)cc1 1634396950 MHZKCQVSBQLHKJ-UHFFFAOYSA-N 326.316 1.543 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2nnc(S)n2c1 1632681083 MRQOWEGZRXLDDD-SECBINFHSA-N 344.396 1.790 10 10 EDCE CCOC(=O)c1[nH]nc(NC(=O)/C=C/c2ccc(O)c(O)c2)c1C 1639431537 IZSHZIOTRJZZIW-FNORWQNLSA-N 331.328 1.958 10 10 EDCE CC(C)(C)OC(=O)[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CCO1 1566239680 OCZGPBMFFSUPFM-CQSZACIVSA-N 337.372 1.209 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc([N+](=O)[O-])cc1N 1632680635 ARONGKSBGUVEOC-SECBINFHSA-N 331.328 1.949 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)CN2CCCC2=O)cc1C 1725086524 ZWXQGMQOCGSCSH-GJZGRUSLSA-N 347.459 1.609 10 10 EDCE CC[C@H](CNS(C)(=O)=O)NC(=O)N[C@H](C)c1ccccc1O 1635393924 HEBVGAJUUYVWEH-GHMZBOCLSA-N 329.422 1.080 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H](C)c2ccco2)cc1C 1568579459 BOVAOOJGNRANKX-GDBMZVCRSA-N 346.427 1.967 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)C=C2CCC2)cc(OC)n1 1738804708 OBMAEFUSULKWMD-LBPRGKRZSA-N 347.415 1.786 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H]2CCCNC2=O)cc1C 1662249748 PJHKVVHTAPDYEL-ZFWWWQNUSA-N 333.432 1.124 10 10 EDCE CO[C@@H](C)C(=O)NC[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1688860325 WFTWYWDUONBVHC-MNOVXSKESA-N 349.391 1.366 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2nnn(C)c2C)cc1C 1699241269 KDDWEVPKCKRHPX-AATRIKPKSA-N 343.431 1.516 10 10 EDCE Cn1c(Br)nnc1CCNCc1cccc(O)c1O 2128769061 FOLDWZORXNEOKY-UHFFFAOYSA-N 327.182 1.321 10 10 EDCE Cc1cc(=O)c(O[C@H](C)C(N)=O)cn1CCOc1ccc(N)cc1 1857916544 AKTKMJLCYKZWIH-GFCCVEGCSA-N 331.372 1.071 10 10 EDCE C[C@H](c1cc(O)ccc1O)N(Cc1ccccc1)CC1(O)CNC1 1915510591 PWFLEMHSXSOUEF-CQSZACIVSA-N 328.412 1.995 10 10 EDCE COC(=O)[C@H](O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951701046 VKIYAILWRSSUJE-ZWNOBZJWSA-N 341.360 1.068 10 10 EDCE CO[C@H](c1cc(O)c(O)c(O)c1)[C@H](NC(=O)OC(C)(C)C)C(=O)O 1952306353 LAVDYNVUYQTULM-CMPLNLGQSA-N 343.332 1.469 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985095837 JYAWFRUWVOZJCN-MNOVXSKESA-N 326.401 1.353 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)CN1CC(NC(=O)OC(C)(C)C)C1 1985094698 SLHBYTFQZVYZEK-UHFFFAOYSA-N 326.401 1.354 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@@]1(C)C(=O)N1CC(N=[N+]=[N-])C1 1985101466 SUOVRDFHCOLXAA-IINYFYTJSA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)N1[C@@H](COc2ccc(N)cc2)CCS1(=O)=O 1992465422 NUVHPABOCQLOBU-GFCCVEGCSA-N 342.417 1.987 10 10 EDCE COCC1(NCc2ccc(O)cc2O)CN(C(=O)OC(C)(C)C)C1 2016208657 JZJBKKWHJQALIO-UHFFFAOYSA-N 338.404 1.823 10 10 EDCE CNCc1ccc(N2CC[C@@H]3C(=O)NC[C@@H]3C2)c(Br)c1 2157188836 APOCRGUODUFJAV-NEPJUHHUSA-N 338.249 1.741 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@@H](CO)C2)cc1Br 316654198 DTHIXAUFKJWBSS-BXUZGUMPSA-N 329.238 1.348 10 10 EDCE CC[C@H](NCc1nnnn1C)c1cc(Br)ccc1O 389393946 XQRCXDPTYZHZHC-JTQLQIEISA-N 326.198 1.919 10 10 EDCE Cc1cc(O)n2ncc(C(=O)Nc3ccc(CN(C)C)cn3)c2n1 2062052556 YFKKOHPGJNUSFE-UHFFFAOYSA-N 326.360 1.452 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@H](O)C[C@H]32)c(F)c1Br 2185305612 GOQVOXGEOPYHRY-YUSALJHKSA-N 345.212 1.775 10 10 EDCE O=C1NCCN(c2ccc(CO)cc2Br)CC1(F)F 2090580586 RGOOUEAZQHZJSG-UHFFFAOYSA-N 335.148 1.513 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1C[C@H](N)C[C@@H](O)C1 2111819718 PEMADUPPJGVJIK-NQBHXWOUSA-N 329.238 2.000 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213582289 GKJQBRQODIZHEN-QJPTWQEYSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N(CCOc1nnc(=N)[nH]n1)C1CCCCC1 2213786338 WVARZAAWXNJLFK-UHFFFAOYSA-N 338.412 1.628 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2329333928 ZOJRWECEBDIRNK-WTDIUWLJSA-N 327.222 1.099 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2329332182 JJRCKHCJHBKQSZ-OLRMPSLUSA-N 327.222 1.099 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2333233764 JVENZGIMUWSRLJ-LDICSKNTSA-N 334.185 1.382 10 10 EDCE COC[C@]1(CO)C=CCN1c1ccc(CN)cc1Br 2351695383 BHGHCTUNXSFSLE-CQSZACIVSA-N 327.222 1.662 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C[C@@H](F)CN2)c(O)c1Br 2352628117 SNCNPMHSMUWCGJ-NXEZZACHSA-N 331.185 1.779 10 10 EDCE O[C@@H](CN1CCOCC1)CN1CCCc2cc(OC(F)F)ccc21 305173664 AJMUAVBZTBURBQ-AWEZNQCLSA-N 342.386 1.734 10 10 EDCE CN1CCCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1=O 188176006 VNRUZIWVEZKECA-UHFFFAOYSA-N 328.416 1.437 10 10 EDCE Cc1c(/N=N/c2cccc(S(=O)(=O)O)c2)c(O)n(C)c(=O)c1C#N 83312988 PZKYBEDPWOMRPT-WUKNDPDISA-N 348.340 1.933 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCCNC(C)=O)CC2)cc1 45137683 SWEDUFPBYKAKOH-UHFFFAOYSA-N 334.420 1.053 10 10 EDCE CNC(=O)[C@@H](C)CN(C)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255767389 FTMCKRWESINAIE-AJHXJQRKSA-N 345.443 1.377 10 10 EDCE CCOc1ccc(O)c(CN2CCN(CC(F)(F)F)C(=O)C2)c1 289262639 FUDUSLJKSLCDJW-UHFFFAOYSA-N 332.322 1.997 10 10 EDCE COCCNC(=O)CN(C)Cc1ccc(C)c(Br)c1O 2381136352 DZXQSGWFGKHZJI-UHFFFAOYSA-N 345.237 1.658 10 10 EDCE COc1ccc(N2CCN(CCN[C@@H](C)[C@H]3CCCCN3)CC2)cc1 817892589 BFZKJFYYKPOLTJ-FXAWDEMLSA-N 346.519 1.937 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCc1cnn(C)n1 819698473 MCFJCXNASHYDFY-UHFFFAOYSA-N 346.387 1.045 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H]2CCc3nnn(C)c3C2)cc1F 915367052 VCZZQVBKYIELLL-LBPRGKRZSA-N 346.410 1.377 10 10 EDCE CN(C)c1ccc(CNC(=O)CS(=O)(=O)Cc2ccccc2)cc1 842647938 SDJBPOUJPATIPR-UHFFFAOYSA-N 346.452 1.984 10 10 EDCE NC(=O)[C@H]1C[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 845446126 OZEQYOAIWOZPHQ-OKILXGFUSA-N 343.383 1.961 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCC[C@]1(O)CCOC1 845263193 ZCCUXDPVFCVQFM-BEFAXECRSA-N 349.475 1.833 10 10 EDCE C[C@]1(F)CNCCN(C(=O)NCCCSc2nccs2)C1 841856361 IYCGULFQJNJDEK-ZDUSSCGKSA-N 332.470 1.968 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)NC[C@@H]2CCCN2C)cc1 844923385 FVQYJOLGGZBUFO-INIZCTEOSA-N 334.464 1.867 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@H]2C(F)(F)F)c1 854519405 BTJBFTUKKOZACF-SNVBAGLBSA-N 338.307 1.541 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](CCO)C(C)C)C2)cc1 854300027 ORYOTBUWIDHKTI-RHSMWYFYSA-N 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1.651 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCC[C@H]1N1CCC(O)CC1 1302835094 NYNIRVWJWXGMKV-LSDHHAIUSA-N 334.416 1.134 10 10 EDCE COC(=O)COc1ccc(C(=O)NCc2c(O)cccc2O)cc1 1156881188 TVHOFACUTCGCRC-UHFFFAOYSA-N 331.324 1.580 10 10 EDCE COC(=O)c1cc2n(n1)CCC[C@@H]2NC(=O)Cc1ccc(O)c(O)c1 1158573015 GDHQFOPJDITKPD-NSHDSACASA-N 345.355 1.275 10 10 EDCE COc1ccc(Br)c(CNCCCn2cncn2)c1O 1964578385 DZCUGBIEFFRZKT-UHFFFAOYSA-N 341.209 1.935 10 10 EDCE C[C@H]1c2cccn2CCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1329392958 SMOHETYXVYJDCR-LBPRGKRZSA-N 325.368 1.639 10 10 EDCE CN1CCN(Cc2ccc(Br)cc2O)C[C@@H]1C(=O)O 686105285 UQNZCOPQUPQYGO-LLVKDONJSA-N 329.194 1.355 10 10 EDCE CNC(=O)C1(C(=O)NC/C=C\CNCc2ccc(OC)c(C)c2)CC1 1321289724 JJHBGAQWFVBKSX-PLNGDYQASA-N 345.443 1.292 10 10 EDCE CO[C@@]1(C(=O)O)CCN(Cc2cc(Br)cc(F)c2O)C1 715793552 WNOLQGYIXSOBQM-ZDUSSCGKSA-N 348.168 1.969 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)Cc2cnn(C)c2)cc1C 1268641184 WCDXDKWTMFHDGB-CQSZACIVSA-N 330.432 1.574 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1 1261856600 JOIKSLVFQICWPV-UONOGXRCSA-N 334.441 1.562 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)Cc2ccn(C)n2)cc1C 1272773983 QPBMKFKTCUDZNF-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE C[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCN1c1cnccn1 1607977487 ASTMUUFCHRLOML-HSBHDXMMSA-N 340.383 1.638 10 10 EDCE CO[C@@H](C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1703164624 AQPHTPQJBXOQCI-CYBMUJFWSA-N 347.375 1.120 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)C1CCCC1)C(=O)N(C)Cc1ccccc1O 1629954718 ALPJHLLWTNQELH-MLGOLLRUSA-N 334.416 1.406 10 10 EDCE Cc1nc(O)nc(O)c1CC(=O)NCc1c(O)ccc2ccccc12 1558553972 ACOYGBWCSPCYDJ-UHFFFAOYSA-N 339.351 1.914 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)c2ccoc2)cc(OC)n1 1494592198 DSVAAFZLDJRXOU-JTQLQIEISA-N 333.344 1.240 10 10 EDCE COc1ccc(CNC(=O)c2cn(-c3cccnc3)nn2)c(O)c1 1556354459 KQHSSIILVLMTNZ-UHFFFAOYSA-N 325.328 1.307 10 10 EDCE Cn1cc([C@@H](CO)NC(=O)c2cc3cc(O)c(O)cc3s2)cn1 1633107280 JWDRLBPWHRVVFG-SNVBAGLBSA-N 333.369 1.509 10 10 EDCE CCN1CCN(CCCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1566646382 UNVDJESPHCVMBO-UHFFFAOYSA-N 346.435 1.606 10 10 EDCE CCN(CC)C(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169902575 FZMOZDAQLKWOEB-UHFFFAOYSA-N 337.376 1.023 10 10 EDCE COc1ccc(/C=C2/SC(=S)N([C@H](CO)C(=O)O)C2=O)cc1 1858595846 JMSINZGMROQXFS-VUUNSECVSA-N 339.394 1.342 10 10 EDCE Cc1cc(=O)c(OCC(=O)O)cn1CCCOc1ccc(N)cc1 1857916508 YIAPGAOFQSKHMG-UHFFFAOYSA-N 332.356 1.671 10 10 EDCE CNC(=O)C1(NCc2c(Br)ccc(OC)c2O)CC1 1967772123 QIGKSGDRGGDLJR-UHFFFAOYSA-N 329.194 1.532 10 10 EDCE CN(C)[C@H]1COC[C@@H]1CNCc1cccc(Br)c1O 1924701048 AYAJSBKJYCQMIQ-AAEUAGOBSA-N 329.238 1.821 10 10 EDCE CN(C)c1ccc([C@H](NN)c2c(Br)nnn2C)cc1 234253982 ZMCGPABBKFHVRN-JTQLQIEISA-N 325.214 1.196 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3C[C@H](O)[C@H](F)C3)c(Br)cc21 2149255950 ACHDUCCXPJNQLH-ZHAHWJHGSA-N 344.184 1.181 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1CCNC1=O 1952209582 VYZMGTJZIGHKSY-NWDGAFQWSA-N 336.388 1.670 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOC[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2007216224 PHZIKVVOWQFVCK-LPWJVIDDSA-N 340.420 1.182 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2010406051 PHIKWKWRUGVWIN-VXGBXAGGSA-N 341.412 1.811 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCN(Cc2ccc(N)cc2)C[C@@H]1CO 2009100636 YELHYEBNCAZYQO-ZBFHGGJFSA-N 335.448 1.976 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCO[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010390707 HLOVJUJLZUWJOB-GRYCIOLGSA-N 339.396 1.970 10 10 EDCE C[C@H](C(=O)N(C)CCN=[N+]=[N-])N1CCN(C(=O)OC(C)(C)C)CC1 2010393306 QOBCIZQTHWMQON-GFCCVEGCSA-N 340.428 1.696 10 10 EDCE CN1CCC(NC(=O)C=Cc2ccc(N3CCOCC3)cc2)CC1 2043017655 KTPAYIFQRLYUEQ-UHFFFAOYSA-N 329.444 1.747 10 10 EDCE Oc1cccc(Br)c1CNC[C@@H]1CN2CCN1CC2 706872155 JKKPQLTYLPCUMS-LLVKDONJSA-N 326.238 1.244 10 10 EDCE O=C(N1CCC[C@H](CNCc2ccc(O)c(O)c2O)C1)C(F)(F)F 689435128 WBCFSTIURHRNFC-SECBINFHSA-N 348.321 1.694 10 10 EDCE CC(C)N(C[C@@H](C)O)c1cc2c(cc1Br)[C@H](N)C(=O)N2 691418553 UTUZXDRTMFDDBR-OQPBUACISA-N 342.237 1.997 10 10 EDCE CC[C@@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C[C@@H]1O 399885502 HKOZYTVBBCKXNL-HYJLZEBJSA-N 340.221 1.608 10 10 EDCE C[C@H](c1cc([N+](=O)[O-])ccc1O)n1ncc(S(C)(=O)=O)c1N 2070217520 PVACPPOIBXOSKA-SSDOTTSWSA-N 326.334 1.092 10 10 EDCE Nc1ccc(CS(=O)(=O)N[C@@H]2CCCC3(CC2)OCCO3)cc1 2191629667 PQASZZZKJPCENH-OAHLLOKOSA-N 340.445 1.764 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1CCOc1nnc(=N)[nH]n1 2213785043 IGQCCEDZCYYEEA-GHMZBOCLSA-N 338.412 1.341 10 10 EDCE NCc1ccc(N2C[C@H]3CCO[C@]3(CO)C2)c(F)c1Br 2239915037 GVIMJYHCYJWWTB-YGRLFVJLSA-N 345.212 1.635 10 10 EDCE C[C@@H]1CN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CC[C@@H]1O 2310369559 OZZWVAHJNLHLPE-QAPCUYQASA-N 330.428 1.766 10 10 EDCE O=C1NC(=O)N(c2ccc3c(c2)OCO3)C(=O)C1=Cc1ccncc1 2313556673 IAFRRZCTCQLBQI-UHFFFAOYSA-N 337.291 1.477 10 10 EDCE Cc1nn(C)cc1NC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 179108943 YEUTVCAPGXBYFI-UHFFFAOYSA-N 329.404 1.392 10 10 EDCE CN1C(=O)N=C(O)/C(=C2/C[C@@H](c3ccc(N(C)C)cc3)NN2)C1=O 102697255 MYCIBIURGYRFNH-UMAGAQSHSA-N 329.360 1.094 10 10 EDCE CN(C)CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 122762774 YBCJQSREEGJXHX-UHFFFAOYSA-N 330.476 1.396 10 10 EDCE C[C@H](NC(=O)N[C@H]1CCCN(C)C1)c1ccc(N2CCOCC2)cc1 139955999 DDTPZGHIBNERIV-RDJZCZTQSA-N 346.475 1.978 10 10 EDCE COC(=O)[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 325820097 TVGPSAZTXDTCNO-VIFPVBQESA-N 335.316 1.315 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2OCC[C@@H]2CN)c(O)c1Br 2380740096 RFJDMURMYGWLBO-NOZJJQNGSA-N 343.221 1.443 10 10 EDCE Cc1noc(CNC(=O)NCc2cc(Br)ccc2O)n1 805182052 BVDCJSQUHWDJCI-UHFFFAOYSA-N 341.165 1.846 10 10 EDCE C[C@@H]1C[C@H](O)CCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 705985615 UJZJBGYQGJZTJT-RBDZCENOSA-N 340.221 1.751 10 10 EDCE COc1ccc(N2CCN[C@H](CCO)C2)c(OC)c1Br 2162665513 CENVMDMTLHXKMJ-SNVBAGLBSA-N 345.237 1.627 10 10 EDCE Cn1nc(COC(=O)COc2ccc(N)cc2)cc1Br 2168325832 XYBJNTVKPPABAL-UHFFFAOYSA-N 340.177 1.887 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](C)CF)CC2)cc1 817119201 XBDDPBNVJOZRPF-NPQIQWPPSA-N 349.406 1.374 10 10 EDCE O=C(C[C@@H]1CCCC(=O)N1)NCc1cc(Br)ccc1O 811523903 RDURENOCKDKEGK-NSHDSACASA-N 341.205 1.830 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(OC)cc1O)C2 819520368 GLWREUJFPIZIPT-GLQYFDAESA-N 348.399 1.884 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C2 819792019 HWZGJLCZLYKSSM-JRDZMOLYSA-N 346.383 1.847 10 10 EDCE O=C1NN(c2ccccc2)C(=O)/C1=C\c1ccc(-n2cncn2)cc1 728699358 SJGMJURAPURDQX-YBEGLDIGSA-N 331.335 1.729 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC3(C2)OCCO3)c([N+](=O)[O-])c1 731209281 UURCYUCKKXACIC-HWKANZROSA-N 334.328 1.734 10 10 EDCE Cn1cc(N2CCC[C@@H](NC(=O)/C=C\c3ccc(O)c(O)c3)C2)cn1 588406641 VSYGIYIHNCJDIF-BRLPQQTGSA-N 342.399 1.630 10 10 EDCE COCCCS(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849416597 SSZQJVFMUFNWGA-ZDUSSCGKSA-N 328.434 1.230 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCO[C@H]([C@@H](C)O)C1 840484533 PLKMHHXJXJIDKD-DAYGRLMNSA-N 349.475 1.783 10 10 EDCE Nc1ccc(CCNC(=O)N2CC[C@H]([C@@H](O)C(F)(F)F)C2)cc1 841955582 HIZALXHXJRRIBA-WCQYABFASA-N 331.338 1.766 10 10 EDCE COc1ccc(N2CC[C@H](N3C(=O)N[C@@]4(CCSC4)C3=O)C2)cc1 849356598 FRXVLXHWWADGJX-SUMWQHHRSA-N 347.440 1.701 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)N[C@H]2CCc3ccccc3C2)cc1 842036886 QYEKQWNNSUIYAH-SFHVURJKSA-N 337.423 1.601 10 10 EDCE C[C@H](NC(=O)N[C@@H]1CCNC[C@H]1C)c1ccc(N2CCOCC2)cc1 841739974 CUIYTEZNUCYYOI-RVKKMQEKSA-N 346.475 1.881 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N[C@H]2C[C@H](C(N)=O)C2)cc1F 858205620 BRHPZWOAFHAZMJ-JOCQHMNTSA-N 336.411 1.735 10 10 EDCE CN(C)c1ccc(CN[C@@H]2CCN(c3ccc4nncn4n3)C2)cc1 858244790 HSYRAPFFZDXKQB-OAHLLOKOSA-N 337.431 1.559 10 10 EDCE CNC(=O)c1cccc(NS(=O)(=O)c2cc(F)cc(F)c2O)c1 753022557 YMSNJSIMILCXSH-UHFFFAOYSA-N 342.323 1.831 10 10 EDCE CN(C)c1ccc(CNC(=O)c2cnc3c(c2)NC(=O)CN3C)cc1 858161333 MMJBVIOAJJIDSO-UHFFFAOYSA-N 339.399 1.466 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCn4ccnc4C3)C2)cc1 855223855 IOQRAZJPTCKOFU-GJZGRUSLSA-N 340.427 1.849 10 10 EDCE CNC(=O)NC[C@H]1CN(Cc2c(O)ccc3ccncc23)CCO1 863287440 SIJUEUMBRZOMNQ-ZDUSSCGKSA-N 330.388 1.070 10 10 EDCE Oc1cc2c(cc1CN1CCN(c3ccc(F)cn3)CC1)[C@H](O)CO2 774646543 NAUCGUWRUJYIQO-MRXNPFEDSA-N 345.374 1.674 10 10 EDCE CC[C@@H](NCCCN1CCCS1(=O)=O)c1ccc(F)cc1O 796811656 OLSBDFDGQQDUNL-CQSZACIVSA-N 330.425 1.998 10 10 EDCE COc1ccc(CNC(=O)[C@@H]2CC(c3ccccn3)=NO2)c(O)c1 1155574427 KRULTCCDXCWGTG-INIZCTEOSA-N 327.340 1.605 10 10 EDCE O=C(CN1Cc2ccccc2OC1=O)NCc1cccc(O)c1O 1303195149 QWHWUNAYCGSETB-UHFFFAOYSA-N 328.324 1.729 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1ccc(=O)n(-c2ccccc2)n1 1303223617 XMNABHMYQWWDHC-UHFFFAOYSA-N 337.335 1.574 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc(CN(C)C)on3)C2)cc1 1328758842 UWYWYPNVDXHKHI-CYBMUJFWSA-N 344.415 1.754 10 10 EDCE COCCNC(=O)[C@H](C)NCc1cc(Br)cc(F)c1O 715711168 DKKYRZNOGMQANV-QMMMGPOBSA-N 349.200 1.535 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCO[C@H](C(F)F)CC1 1330521481 RBQIJKDLMRNROI-ZDUSSCGKSA-N 340.326 1.117 10 10 EDCE CSc1ncc(CN=c2[nH]cc(Br)c(=N)[nH]2)s1 2248601242 NILIXRQRVLETJR-UHFFFAOYSA-N 332.252 1.864 10 10 EDCE CCc1nnc(N2CCOCC2)n1Cc1ccc(N(C)C)c(F)c1 1293167758 JBWGQYUZYJIEHN-UHFFFAOYSA-N 333.411 1.931 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](NS(C)(=O)=O)C(C)C 1293284815 YBPQWTSCFMWEMH-HNNXBMFYSA-N 341.477 1.251 10 10 EDCE C[C@H](NC(=O)c1ccnc(CO)c1)c1ccc(N2CCOCC2)cc1 1464528911 MAFCVHVPRZMQLF-AWEZNQCLSA-N 341.411 1.902 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)c1cccn(CC(F)(F)F)c1=O 1465954531 QCOZVWGUKHHLKK-UHFFFAOYSA-N 342.273 1.752 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)Cc2cnn(C)c2)cc1C 1700388841 BOGGTASTINKQSI-LSDHHAIUSA-N 344.459 1.963 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)C2=C(C)OCCS2(=O)=O)c1 1622779888 XVEBVUFSVCZEKE-SECBINFHSA-N 341.385 1.255 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cc(Br)cnc1O 1626850238 SENUFBIBYSXWBE-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE CS(=O)(=O)CCCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1556275274 JDJIGHFFVVZHNK-UHFFFAOYSA-N 340.405 1.794 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@]2(C)CCC(=O)NC2)cc1C 1714748299 KBTYHWOPUBZAHT-IBGZPJMESA-N 347.459 1.468 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](O)C(C)(C)C 1631530933 AXPLSRWYMNKYKN-CQSZACIVSA-N 343.807 1.954 10 10 EDCE O=C(CCN1CSCCSC1)NCc1c(O)cccc1O 1647290175 OIFOWFJLLNQUPP-UHFFFAOYSA-N 328.459 1.801 10 10 EDCE C[C@@H](NCC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1O 1654532177 JOBRQFCRDFQEEN-LLVKDONJSA-N 349.412 1.329 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@](C)(C(N)=O)C2)c([N+](=O)[O-])c1 1773003273 STGUZBRKADFLAB-LEXSJLIMSA-N 333.344 1.483 10 10 EDCE COc1cc(O)c(CN2CCO[C@@H](Cn3cccn3)C2)cc1OC 160260932 NWTUAHJDDIPNHK-CQSZACIVSA-N 333.388 1.507 10 10 EDCE Nc1ccc(-n2nnc(C(=O)NCc3ccc(Cl)cc3)n2)cc1 1857878499 FBSRAJCAFQRMLB-UHFFFAOYSA-N 328.763 1.828 10 10 EDCE CN[C@@H](C)c1ccc(N2CCN(CCO)CC2)cc1Br 234452570 VAEWAGLBMMBLBV-LBPRGKRZSA-N 342.281 1.844 10 10 EDCE CCOC1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CN(C(=O)OC(C)(C)C)C1 2004148031 XOTQUZRGPVQJOY-HAQNSBGRSA-N 340.420 1.278 10 10 EDCE C[C@@H](CCNC(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 2015121823 GRVNTZVIWSUHCG-VIFPVBQESA-N 340.376 1.837 10 10 EDCE N[C@H]1COCCN(Cc2cc(Cl)cc(Br)c2O)C1 2034722378 HDKFYNUMDGENKP-SNVBAGLBSA-N 335.629 1.968 10 10 EDCE CNCc1ccc(N2C[C@@H]3OC(=O)N(C)[C@@H]3C2)c(Br)c1 2176930764 NNACTGQFJJZLOO-OLZOCXBDSA-N 340.221 1.808 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1908252896 IDGYWYZDTWLQLK-WOPDTQHZSA-N 339.396 1.658 10 10 EDCE C[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(C(=O)c2ccc(O)c(O)c2)C1 2054420769 XWBRYENERLGJRM-WCBMZHEXSA-N 346.305 1.627 10 10 EDCE CS(=O)(=O)[C@H]1CCN(c2ccc(CO)c(Br)c2)C1 2059357648 WJBNPXXDTTXYIY-NSHDSACASA-N 334.235 1.565 10 10 EDCE O[C@H]1CCN(c2ccc(CNC3CC3)cc2Br)C[C@H]1O 2188633093 NIFHJKGQGIMRNT-LSDHHAIUSA-N 341.249 1.633 10 10 EDCE CN(C(=O)[C@@H]1C[C@H](O)CN(C(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2080778900 PZEWHNUBIKRLNE-DOMZBBRYSA-N 349.431 1.850 10 10 EDCE CS(=O)(=O)[C@H]1COC[C@H]1NCc1cc(Cl)cc(Cl)c1O 2207470563 MJQHAYDLPCMKNC-MNOVXSKESA-N 340.228 1.601 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3COC[C@]3(CO)C2)c(Br)c1 2234565798 ILQNWDVJPSZQPC-IXPVHAAZSA-N 342.233 1.948 10 10 EDCE COc1ccc(Br)c(CN2CC[C@H](CO)[C@@H](N)C2)c1O 2236039764 DHITXGCJCGFTKF-SKDRFNHKSA-N 345.237 1.305 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@@H]2[C@@H](O)CO)cc1Br 2270701223 OVZATDQFEAFRQP-FZQKWOKYSA-N 329.238 1.661 10 10 EDCE OCc1ccc(N2C[C@H]3OCC[C@@]3(CO)C2)c(Br)c1 2278868099 ZCWVKTHRISNGPN-KGLIPLIRSA-N 328.206 1.529 10 10 EDCE COC(=O)C=Cc1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@H]4O)c([N+](=O)[O-])c1 2312513731 PTCIAUKHTGWFFV-AFSSITGASA-N 344.367 1.987 10 10 EDCE CCN(CCN=[N+]=[N-])S(=O)(=O)c1cc(Br)nn1C 2315993169 XWGKUMAXEPALHA-UHFFFAOYSA-N 337.203 1.504 10 10 EDCE CN(CC(=O)NC(C)(C)C)C(=O)NCc1ccc(N(C)C)c(F)c1 60589368 NOLYODQQFTYKGG-UHFFFAOYSA-N 338.427 1.948 10 10 EDCE CN(C)S(=O)(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 39891618 SHVHFOKIDLRKFL-UHFFFAOYSA-N 330.365 1.680 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H]2CNC(=O)C2)cc1 126964371 OLORJVZIMCUVRD-RDJZCZTQSA-N 344.459 1.953 10 10 EDCE COC(=O)[C@H]1C[C@@H](OC)CN1Cc1cccc(Br)c1O 125806472 ZEDNMIGLCRQCRM-ZYHUDNBSSA-N 344.205 1.917 10 10 EDCE Nc1ccc(CCNS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)cc1 193341925 TUMFRLXSLZHQFV-UHFFFAOYSA-N 335.385 1.839 10 10 EDCE Cc1ccc(CN(C)c2cc(N)[nH]c(=N)n2)c(O)c1Br 2381128558 WIBFGVYHYKSQLZ-UHFFFAOYSA-N 338.209 1.884 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C2 819792017 HWZGJLCZLYKSSM-JGUMUOKQSA-N 346.383 1.847 10 10 EDCE C[C@H]1CCNC[C@@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 817891393 BMIFSXARUMLAAT-YOEHRIQHSA-N 337.489 1.009 10 10 EDCE CO[C@H](CS(=O)(=O)NCc1ccc(N(C)C)c(F)c1)C1CC1 827072160 NZXFQTLNMVKYDQ-OAHLLOKOSA-N 330.425 1.736 10 10 EDCE CC(C)[C@](C)(CO)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 823524952 ZRQUAFOLZAHPHD-IBGZPJMESA-N 349.475 1.854 10 10 EDCE O=C(NCCCOC[C@@H]1CCCO1)NCc1c(O)cccc1F 913944234 IRQVDJRPBHJVND-LBPRGKRZSA-N 326.368 1.916 10 10 EDCE O=S1(=O)CC[C@@]2(CN(Cc3c(O)ccc(Cl)c3F)CCO2)C1 843425917 JZISWNMCSBPKAW-CQSZACIVSA-N 349.811 1.574 10 10 EDCE O=C1[C@H]2[C@H]3C[C@H]4[C@@H]2[C@@]2(C(=O)NCc5cc(Cl)ccc5O)[C@@H]4[C@H]3[C@@H]12 846477084 QAHOZHUHTNVOAH-PAIFALCGSA-N 329.783 1.989 10 10 EDCE Nc1ccc(CCNC(=O)NC[C@@H]2COc3ccccc3O2)cc1 841621419 FSAFUSIGKGAMAZ-OAHLLOKOSA-N 327.384 1.951 10 10 EDCE CN1CCC2(CC1)CCN2C(=O)C(=O)NCc1ccc(N(C)C)cc1 929237507 KDSVLNYANYTIBN-UHFFFAOYSA-N 344.459 1.066 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCNC(=O)CC3)C2)cc1 855225798 MEWIZADYINVKIX-ZIAGYGMSSA-N 331.416 1.306 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3noc4c3COCC4)C2)cc1 857869434 OCYRLVMSZYCANM-GFCCVEGCSA-N 343.383 1.765 10 10 EDCE NC(=O)c1ccc(CC(=O)NCCCSc2nccs2)cn1 859351019 IWKOXINSBNNSKU-UHFFFAOYSA-N 336.442 1.478 10 10 EDCE COc1ccc(N(Cc2cc(=O)n3nc(N)[nH]c3n2)C(C)C)cc1F 856729639 OJJGQPVDZFVRNB-UHFFFAOYSA-N 346.366 1.563 10 10 EDCE Cc1cc(CC(=O)NCCc2nc(N)n[nH]2)c(C)n1-c1ccccc1 854516541 HWMFRTPFQKCGMU-UHFFFAOYSA-N 338.415 1.696 10 10 EDCE Cc1cc(CN2C[C@@H](C)[C@H](CS(N)(=O)=O)C2)ccc1N(C)C 933696846 MEVYFUPMENBAHW-HIFRSBDPSA-N 325.478 1.417 10 10 EDCE Cc1cnc(N)c(S(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)c1 769752985 RHQHCRHQGGZLRC-UHFFFAOYSA-N 334.445 1.859 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nc(C)ns3)CC2)c(OC)c1 866128144 WRZNICJYOQFAJM-UHFFFAOYSA-N 348.428 1.826 10 10 EDCE O=C1C[C@@H](C(=O)N2Cc3cccc(O)c3C2)CN1Cc1ccco1 871198788 OWJXMCULMXMUKX-CYBMUJFWSA-N 326.352 1.876 10 10 EDCE CCN1CC[C@H]1CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 897866168 SCLVZIYWOOAMFI-CJNGLKHVSA-N 332.448 1.140 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc2nc(CO)[nH]c12 1138152964 ULHXWSHHTUVALW-SNVBAGLBSA-N 341.367 1.827 10 10 EDCE COc1ccc(N2C[C@@H](NC(=O)c3cccc(O)c3O)CC2=O)cc1 1146704449 WPUZQAYCLFQBJL-NSHDSACASA-N 342.351 1.642 10 10 EDCE O=CC1=S=C(c2ccc(C(=O)Nc3cc([N+](=O)[O-])n[nH]3)cc2)C=C1 1155043236 LIBKVOWUSFRYCW-UHFFFAOYSA-N 342.336 1.765 10 10 EDCE CS(=O)(=O)C[C@@H](C(=O)NCc1cccc(O)c1O)c1ccccc1 1303195122 QGRYAQABHHRZNR-CQSZACIVSA-N 349.408 1.542 10 10 EDCE COc1cc(N2CCC([C@@H](F)C(N)=O)CC2)c([N+](=O)[O-])cc1OC 1163929913 LJVGNSMMTABEHS-CQSZACIVSA-N 341.339 1.652 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@](CN)(C(C)(C)C)C1 1329506615 AXDWDLHVMTWDRA-LJQANCHMSA-N 347.459 1.574 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)c2cncnc2O)cc1C 1320459318 OVYDHXSAQHTQDH-ZDUSSCGKSA-N 344.415 1.797 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)c1ccc(-n2ccnc2)nn1 1299721329 GYBVPXZPGPVVNO-UHFFFAOYSA-N 346.350 1.846 10 10 EDCE CCS(=O)(=O)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1469015435 HOCTYIXYVFKGSG-UHFFFAOYSA-N 326.378 1.404 10 10 EDCE COc1ccc(N2CCCN(C(=O)NC[C@H]3CNC(=O)C3)CC2)cc1 1478820527 ONCCPAJXCSCHLX-CQSZACIVSA-N 346.431 1.053 10 10 EDCE CO[C@H](C)CNC/C=C\CNC(=O)c1ccc(N=NC(N)=O)cc1 1732938229 DBFAFQGJIYAKDJ-MOYBGKDOSA-N 333.392 1.760 10 10 EDCE COC(=O)c1nc(CNC(=O)c2cccc(O)c2O)ccc1Cl 1584068187 CWSIDSVOMTYZSI-UHFFFAOYSA-N 336.731 1.863 10 10 EDCE CS(=O)(=O)Nc1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1 1650672132 GSAKSYJHKXZXSN-UHFFFAOYSA-N 332.381 1.920 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cccnc1N1CCOCC1 1652626522 XJXRUFZBRZHFEC-UHFFFAOYSA-N 329.356 1.259 10 10 EDCE CC(C)[C@@H](N)C(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 1865916664 NMKUBTAKZPOBIE-HZPDHXFCSA-N 329.448 1.675 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@H](O)[C@@H]2CF)c(Br)c1 2140662526 MIRHUDLBPKEIJZ-RWMBFGLXSA-N 333.201 1.048 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1[C@H](N)Cc1ccc(O)c(O)c1 1953007513 CJDDIAOWXZBWCE-JMSVASOKSA-N 338.404 1.650 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2014509737 QYEYQFHTTNSZFR-VXGBXAGGSA-N 341.412 1.669 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC3CCN(CC4CC4)CC3)c2n1 2063194012 PSWNEGDUFBIGEG-UHFFFAOYSA-N 329.404 1.348 10 10 EDCE CNC(=O)c1cn(Cc2ccc(Br)cc2O)nc1O 2070623752 AMXDXWUGEMPBAJ-UHFFFAOYSA-N 326.150 1.465 10 10 EDCE CC(=O)N1C[C@H]2C[C@H]1CN2c1cc(Br)c(CN)cc1F 2192278606 LQKSHPTVHXYQEZ-WDEREUQCSA-N 342.212 1.856 10 10 EDCE O=C1CO[C@@H]2CCN(c3ccc(CO)cc3Br)C[C@@H]2N1 2185523850 ZFCXWJQMDHBEHP-WCQYABFASA-N 341.205 1.035 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@@H]1COC2(COC2)C1 2270768041 IVFGHAXJIFBMLM-JTQLQIEISA-N 332.169 1.941 10 10 EDCE C[C@H](O)c1ccc(N2C[C@@H]3COC[C@@]3(CO)C2)c(Br)c1 2234565800 ILQNWDVJPSZQPC-NVBFEUDRSA-N 342.233 1.948 10 10 EDCE COc1ccc(Br)c(CN2CCC[C@](O)(CN)C2)c1O 2236046489 VDFYKFLBYMOMCL-AWEZNQCLSA-N 345.237 1.449 10 10 EDCE COCCNCc1cnc(SCC2(S(C)(=O)=O)CC2)s1 2237876319 VNUHDCFYVMVWPD-UHFFFAOYSA-N 336.504 1.548 10 10 EDCE CNCc1ccc(N2C[C@@H]3CCO[C@]3(CO)C2)c(Br)c1 2239802238 XPVRXJHQOMFYFH-WFASDCNBSA-N 341.249 1.756 10 10 EDCE O=C(O)[C@@]12CO[C@@H](C1)[C@H](NCc1ccc(Br)cc1O)C2 2280795603 HKFZQDOGRWEDAQ-SCDSUCTJSA-N 342.189 1.877 10 10 EDCE COc1ccc(NC=C2C(=O)N(c3ccc4nncn4n3)N=C2C)cc1 2296891415 ULAWTACJNQFRMY-UHFFFAOYSA-N 349.354 1.851 10 10 EDCE O=S(=O)(c1cccc2nonc12)N(CCCO)c1ccccc1 122265072 RSRBEQUQJIRAGT-UHFFFAOYSA-N 333.369 1.801 10 10 EDCE O=C(CNC(=O)c1cccnc1)NCc1c(O)ccc2c1CCCC2 128035206 FRTDJYQGGOBOCP-UHFFFAOYSA-N 339.395 1.712 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)N2CCOC[C@@H]2C(N)=O)c1C 180219805 MNHNBWARMYNXKQ-QGZVFWFLSA-N 341.411 1.729 10 10 EDCE CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(N)cs2)cc1 41068303 NQKMDFMGUOPCFP-UHFFFAOYSA-N 347.443 1.503 10 10 EDCE Cc1ccc(C(=O)N2CCC[C@H](c3nc(N(C)C)no3)C2)c(O)c1O 194482011 YPHHVVGGJYNVPM-NSHDSACASA-N 346.387 1.875 10 10 EDCE COC[C@H](O)CN1CCC(N[C@@H](C)c2ccc(N(C)C)cc2)CC1 90915325 APTNRCBOPAMURX-HNAYVOBHSA-N 335.492 1.875 10 10 EDCE CCS(=O)(=O)N1CCC2(CN(Cc3ccc(N(C)C)cc3)C2)C1 96089421 ZQWCNOOVVMRXJP-UHFFFAOYSA-N 337.489 1.610 10 10 EDCE COCCNc1cc(N2CCN(c3ccc(OC)cc3)CC2)ncn1 243755855 PYXSLODFBXPTTH-UHFFFAOYSA-N 343.431 1.870 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H]1CCC2(CCOCC2)[C@H]1O 283719090 UYMPXWUSVWHGDR-FPASBZTISA-N 347.411 1.795 10 10 EDCE Cc1ccc(CN(C)c2cn[nH]c(=NN)c2)c(O)c1Br 2380742244 PIONLTIPAYEBOE-UHFFFAOYSA-N 338.209 1.597 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCC[C@@H](CO)C2)c1 298125650 AFQNAIBEXAXIBG-GHMZBOCLSA-N 342.417 1.045 10 10 EDCE CC(=O)C(=O)COC(=O)CCc1c(C)nc2c(c(C)nn2C)c1C 808493950 RMCSXVZUVQLSLH-UHFFFAOYSA-N 331.372 1.527 10 10 EDCE CO[C@@H]1CN(c2ccc(CNC3CC3)cc2Br)C[C@H]1O 396032387 WVHYPQUWIFUFSB-HUUCEWRRSA-N 341.249 1.897 10 10 EDCE COc1cccc(C(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)n1 811156580 NWDSTWUEZXHQRO-VURMDHGXSA-N 329.308 1.941 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCCC3CC3)C2)cc1 828490982 RQGRKVFWTHQBQA-OAHLLOKOSA-N 345.443 1.697 10 10 EDCE CN1CC[C@@H](C(=O)N(C)Cc2ccccc2O)[C@H](c2cnn(C)c2)C1 849561196 HRAHDYUGYRPBRH-SJORKVTESA-N 342.443 1.820 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CNCC[S@](=O)CC(F)(F)F)c1 850347898 ABOAEBDMQCLLNV-NRFANRHFSA-N 326.296 1.701 10 10 EDCE C[C@@H](NC1CN(S(=O)(=O)N(C)C)C1)c1ccc(Cl)cc1O 858572955 YGZDXHFYUORPOC-SECBINFHSA-N 333.841 1.187 10 10 EDCE CO[C@@H](CS(=O)(=O)NCc1c(O)cccc1F)[C@H]1CCOC1 921450605 BNZSXYZDNRZEOK-HZMBPMFUSA-N 333.381 1.002 10 10 EDCE CCN(C(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCN(C)C1 853474485 JJEDALPGLLVLLU-GOSISDBHSA-N 346.475 1.759 10 10 EDCE CCCS(=O)(=O)CC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855228979 GUQYXHGUPYZMLL-CYBMUJFWSA-N 340.445 1.215 10 10 EDCE COc1ccc2c(c1)CCN2S(=O)(=O)c1cccc2nonc12 765070489 KACYBZAPOCYJIT-UHFFFAOYSA-N 331.353 1.983 10 10 EDCE CNCCOCCN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 863541741 BICJAZGAFOHVAS-AWEZNQCLSA-N 325.428 1.549 10 10 EDCE CCOC[C@@H](C(=O)OC)N(C)Cc1cc(F)cc(C(C)=O)c1O 764345731 DDTXLZUUYPVXOV-AWEZNQCLSA-N 327.352 1.744 10 10 EDCE Cc1cc(=O)n(Cc2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 877889526 KYPSEZDIYICLHQ-UHFFFAOYSA-N 329.356 1.950 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)COC3CC3)CC2)cc1 878829324 HQJMABHLJDDBHE-UHFFFAOYSA-N 333.432 1.112 10 10 EDCE Cn1nnnc1CCNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 771875439 ZOHHHPQUNIZUPG-UHFFFAOYSA-N 345.407 1.441 10 10 EDCE COc1cccc(CNC(=O)C(=O)Nc2ncn(C(C)(C)C)n2)c1O 784717808 RMHPAHZSERWRAS-UHFFFAOYSA-N 347.375 1.002 10 10 EDCE C[C@@H]1OCC[C@@H]1N(CCO)CC(=O)N(C)Cc1ccc(N(C)C)cc1 796580823 SWYOJBYOOPAPMG-YJBOKZPZSA-N 349.475 1.183 10 10 EDCE C[C@@H](NCc1c(O)cccc1Br)[C@@H]1CN(C)CCN1C 1462587049 DRWBLPZQQMHEMA-RISCZKNCSA-N 342.281 1.879 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC(=O)NCC(C)C)C2)cc1 1327882952 XPIXIDGFDVYHHJ-CQSZACIVSA-N 348.447 1.345 10 10 EDCE C[C@@H](NC(=O)C(=O)N[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21)c1ccc(N(C)C)cc1 1335882878 CDOSKIAKWHLWNI-BJVWSHKESA-N 343.427 1.222 10 10 EDCE O=C(C(=O)N1CC[C@H](c2cccnc2)C1)N1Cc2cccc(O)c2C1 1332073710 JHJDNVRMDXICPV-AWEZNQCLSA-N 337.379 1.646 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2cccnn2)cc1C 1332589522 XLZWOBQPGPZNSA-HNNXBMFYSA-N 344.415 1.016 10 10 EDCE CN(C)c1ccc(CNC(=O)CC[C@H]2CC[C@@H](C(N)=O)O2)cc1F 1356251713 TWUIRQVAMAGSLH-DOMZBBRYSA-N 337.395 1.321 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccc(C)o2)cc1C 1283731657 AKVVCTIADAQTCR-HNNXBMFYSA-N 332.400 1.786 10 10 EDCE COC(=O)[C@@H](Cc1ccccc1O)NC(=O)c1cccc(O)c1O 1470336135 SLJKEFVCYSWFJM-GFCCVEGCSA-N 331.324 1.318 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CC(=O)N(C2CCCCC2)C1 1622936048 MZDQFYCIYKQBRD-ZDUSSCGKSA-N 332.400 1.690 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)CNC(C)=O)C2CC2)cc1C 1483541179 RYIDFRZBFMKLED-MRXNPFEDSA-N 333.432 1.124 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@](O)(CC)C3)nc12 1620487932 KADSOLSGPJZPCJ-KRWDZBQOSA-N 348.403 1.349 10 10 EDCE O=C(CCCCCO)NCc1cc(F)c(N2CCOCC2)c(F)c1 1629488249 BXJNAVWFHUMVAV-UHFFFAOYSA-N 342.386 1.970 10 10 EDCE Cn1cc([C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)c2ncon2)cn1 1625165056 DCIUGZWUSMFOOA-SJDLMVEWSA-N 341.327 1.133 10 10 EDCE Cc1ccc(CNC(=O)NCC(=O)NCc2cc(O)ccc2O)cc1 1558174136 FONVGSZNPOXRLT-UHFFFAOYSA-N 343.383 1.522 10 10 EDCE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CCN(C)C(=O)C1 1742139838 WXFIRSIKUVIHHF-UHFFFAOYSA-N 342.447 1.288 10 10 EDCE CCS(=O)(=O)N(C)CC(=O)Nc1c(Cl)ccc2nonc12 1586677015 KXOMWXKGGIMTAK-UHFFFAOYSA-N 332.769 1.096 10 10 EDCE NC(=O)CN1CCC(NCc2cc(Br)ccc2O)CC1 218322466 MVIZYQQMJJXZAT-UHFFFAOYSA-N 342.237 1.194 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1CCC[C@@H]1CO 1687155649 SMWVONFCORFVOD-CRAIPNDOSA-N 347.459 1.608 10 10 EDCE O=C(CCN1C(=O)CSC1=S)Nc1cc([N+](=O)[O-])ccc1O 1865768063 IBTXBBRULZAQHZ-UHFFFAOYSA-N 341.370 1.489 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1 1900613476 YUKSUNYQQDZMBV-LLVKDONJSA-N 327.385 1.781 10 10 EDCE NCc1ccc(N2CCCN(CCO)CC2)c(Br)c1 227229397 AGIUKRKCGFDBAV-UHFFFAOYSA-N 328.254 1.412 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@@H](O)[C@H]2CF)c(Br)c1 2140662523 MIRHUDLBPKEIJZ-AGIUHOORSA-N 333.201 1.048 10 10 EDCE CC[C@@]1(O)CCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2150756277 BOFWXCMLGJRZPX-TZMCWYRMSA-N 340.221 1.752 10 10 EDCE C[C@@H](CN(C)C(=O)c1cc(O)c(O)c(O)c1)NC(=O)OC(C)(C)C 2015124208 AGORJCNLDYVCEI-VIFPVBQESA-N 340.376 1.789 10 10 EDCE CCCNCc1ccc(N2C[C@H](O)[C@@H](CO)C2)c(Br)c1 316840755 ZYELELPVEMKUAW-DOMZBBRYSA-N 343.265 1.738 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC3(C(=O)N(C)C)CCCCC3)c2n1 2064298162 FTMATFRLIGZBGR-UHFFFAOYSA-N 345.403 1.264 10 10 EDCE CC(C)(C)OC(=O)N1[C@H]2C[C@H]1CN(CC(=O)Nc1ccc(N)cc1)C2 2053412690 QDIUMEABEHDAFL-GJZGRUSLSA-N 346.431 1.901 10 10 EDCE Cn1ncc(CNCCc2ccc(O)c(O)c2)c1Br 2091756165 QJWPIFSUAVADCE-UHFFFAOYSA-N 326.194 1.926 10 10 EDCE COC[C@@]1(O)CCCN(c2ccc(CN)c(Br)c2)C1 2095480464 OJZIPSRYOSQSQC-CQSZACIVSA-N 329.238 1.886 10 10 EDCE COC[C@@]1(O)CCCN(c2ccc(CO)cc2Br)C1 2095485224 ZKSJPIRHUYKMDG-CQSZACIVSA-N 330.222 1.919 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213582288 GKJQBRQODIZHEN-IJLUTSLNSA-N 339.396 1.970 10 10 EDCE COc1ccc(N2CC[C@@H]2[C@H](O)CO)c(OC)c1Br 2270692701 BVGJECRNCFFYQT-PSASIEDQSA-N 332.194 1.398 10 10 EDCE COC[C@H]1C[C@H](CN)N(Cc2ccc(Br)cc2O)C1 2273884571 CVMDCJGTIVZSRT-GXFFZTMASA-N 329.238 1.950 10 10 EDCE NC(=O)[C@H]1CCCN1C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297553989 ZSHVRTLGPXLAJV-MRXNPFEDSA-N 329.400 1.013 10 10 EDCE Cc1ccc(Cn2cncc2[C@H](N)CO)c(O)c1Br 2352947047 PCZVAKBANIMZTJ-SNVBAGLBSA-N 326.194 1.700 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2[C@H]3CNC[C@H]32)c(O)c1Br 2352949239 AWZHHDFKINPTFU-JGPRNRPPSA-N 325.206 1.545 10 10 EDCE CN1CCC(CNC(=O)/C=C/c2ccc(N3CCOCC3)cc2)CC1 108792821 VMNZUWASSXMXJI-QPJJXVBHSA-N 343.471 1.994 10 10 EDCE O=S(=O)(c1cccnc1)N1CCN(Cc2ccccc2O)CC1 179558887 RRYCLKLDRQYXGF-UHFFFAOYSA-N 333.413 1.294 10 10 EDCE CN(C)[C@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)c1cnn(C)c1 181097882 HVVGLWPZUFJFKQ-HZRUHFOJSA-N 330.388 1.264 10 10 EDCE Cc1nn(-c2ccc(F)cc2)c(O)c1/C=C1\C(=O)N(C)C(=O)N=C1O 34222291 KCUYCBJWTOLUNP-GHXNOFRVSA-N 344.302 1.957 10 10 EDCE COc1cc(OC)cc(C(=O)NCCN2C(=O)CSC2=S)c1 49755566 OOKUSUHRLXLKHX-UHFFFAOYSA-N 340.426 1.294 10 10 EDCE COc1cccc(CNC[C@@H]2CCC[C@@]23NC(=O)N(C)C3=O)c1O 371083965 FJMAWXZVPNGIMT-YVEFUNNKSA-N 333.388 1.211 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H](O)C(C)(C)N)c(O)c1Br 2381134304 ANHWBFZMQKRJJJ-LBPRGKRZSA-N 345.237 1.520 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CNCC2(F)F)c(O)c1Br 2381141493 ZZDWRXQJGXQIPC-SECBINFHSA-N 349.175 1.934 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CNCCOC2)c(O)c1Br 2380740079 RBBJBYISIFBBSX-NSHDSACASA-N 343.221 1.315 10 10 EDCE Cc1c(Br)cc(C(N)=O)c(O)c1CN1CCOCC1 642880139 JUEXIDURRJWSQN-UHFFFAOYSA-N 329.194 1.394 10 10 EDCE C[C@H](NC(=O)C(=O)N1CCC2(CCN2)CC1)c1ccc(N(C)C)cc1 817910656 XQLLVUWFNHWDCU-AWEZNQCLSA-N 344.459 1.284 10 10 EDCE C[C@@H]1Cc2ccccc2N(C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)C1 729424208 OASHIMUBPNHGEI-LJTDUEICSA-N 339.395 1.323 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](NC(N)=O)C2)c(Br)c1 723173869 RQCSSJRHROCIDW-SCZZXKLOSA-N 327.226 1.716 10 10 EDCE COC(=O)N1CCC(NC(=O)NCc2c(O)cccc2F)CC1 914369302 UHGQEUPBQJDUER-UHFFFAOYSA-N 325.340 1.561 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H]2CCc3nnn(C)c3C2)cc1 913926499 FALYTYIQPDQFQM-ZDUSSCGKSA-N 328.420 1.238 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 840554332 GBHVQYRTUVKHQS-CZUORRHYSA-N 336.432 1.422 10 10 EDCE Nc1nccc([C@H]2CCCN(C(=O)c3c(F)ccc(O)c3O)C2)n1 846650910 NHERYNHBPLQIOZ-VIFPVBQESA-N 332.335 1.629 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)c3cnccn3)C2)cc1 912292990 RMRXVYNGGKIEST-KBPBESRZSA-N 326.400 1.984 10 10 EDCE CCn1nnc(C)c1C(=O)N(C)CCN(C)c1ccc(OC)cc1 844857288 RZBLPJMUTICKTF-UHFFFAOYSA-N 331.420 1.823 10 10 EDCE O=C1CC[C@@](C(=O)NCc2c(O)cccc2F)(c2ccccc2)CN1 928705984 NDVFEFWJDMPFAL-IBGZPJMESA-N 342.370 1.996 10 10 EDCE C[C@@H](O)[C@H]1CN(C(=O)NCCCSc2nccs2)CCO1 840324868 HWACMGWXAJZQQR-GHMZBOCLSA-N 331.463 1.417 10 10 EDCE COc1cc(N(C)C[C@@H](C)CS(C)(=O)=O)cc(OC)c1OC 757845282 SMTOPFUDWVSLOL-LLVKDONJSA-N 331.434 1.829 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCc3cnn(C)c3)C2)cc1 855228671 CSHWYIDRJFJLMJ-HNNXBMFYSA-N 328.416 1.756 10 10 EDCE O=C(CC(=O)NCC(F)(F)F)NCc1ccc2cccnc2c1O 862027188 LMDMJUMKOJGEBU-UHFFFAOYSA-N 341.289 1.625 10 10 EDCE O=C1O[C@H]2CNC[C@H]2N1[C@H]1CCN(Cc2c(O)cccc2Cl)C1 872254970 HEEUSICSAUYDOF-ZBINZKHDSA-N 337.807 1.413 10 10 EDCE CN(C)c1ncnc2c1cc(C(=O)N1Cc3cccc(O)c3C1)n2C 871203671 PMZSIYQOCPKVRP-UHFFFAOYSA-N 337.383 1.896 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCC[C@H](OCCO)C1 1119465584 UKNGTFZSNNYEOI-NSHDSACASA-N 337.397 1.926 10 10 EDCE CN1CCO[C@@H]2CN(Cc3c(O)cccc3Br)C[C@@H]21 862391441 CIFQHFMRLBEFQS-GXTWGEPZSA-N 327.222 1.670 10 10 EDCE O=C1CC2(CCC2)N(Cc2ccc(N3CCOCC3)cc2)CCN1 895929177 XUGDZMOIKUWACU-UHFFFAOYSA-N 329.444 1.768 10 10 EDCE C[C@H]1[C@H](C(N)=O)CC[C@@H](C)N1C(=O)c1ccc(N=NC(N)=O)cc1 1143584511 CIDIBOBSZHYYTC-GBIKHYSHSA-N 331.376 1.964 10 10 EDCE Nc1ccc(CCNC(=O)C(=O)NCCC2CC(F)(F)C2)cc1 1345165765 BDJCDFBDNUKNPU-UHFFFAOYSA-N 325.359 1.479 10 10 EDCE COC(OC)C(=O)N1CCN(Cc2c(O)ccc(Cl)c2F)CC1 1462610446 XINYTWSZMMQILO-UHFFFAOYSA-N 346.786 1.448 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](C)CCN(C)C)CC2)c(OC)c1 1169991586 ZSZWZUWWDUYXAL-HNNXBMFYSA-N 349.475 1.940 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CC=C(C(F)(F)F)CC1 1329435744 MEXXCEOZBQZPET-UHFFFAOYSA-N 340.301 1.955 10 10 EDCE CN(CCN1CCNCC1)Cc1ccc(Br)cc1O 691496106 ITKOZXJAXMTXTA-UHFFFAOYSA-N 328.254 1.492 10 10 EDCE CC1(C)COC[C@@H]1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1338250910 WGAFTGCNRUSDER-INIZCTEOSA-N 338.473 1.436 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)Cn2cccn2)cc1C 1270356592 WFPDCBVYMXZUSI-CQSZACIVSA-N 330.432 1.742 10 10 EDCE COC(=O)NCC(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)[C@H]1C 1278232417 ISZQVVXHEIITEE-HIFRSBDPSA-N 349.431 1.439 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H](C(=O)NC3CC3)C2)cc1 1442676368 VELBULOZZMGBDV-GFCCVEGCSA-N 343.387 1.980 10 10 EDCE Cc1cc(/C=C2/NC(=O)NC2=O)c(C)n1-c1cccc(C(=O)O)c1 331729 FSDWSHJQSYDHPN-RIYZIHGNSA-N 325.324 1.973 10 10 EDCE COC(=O)[C@H]1CN(C(=O)/C=C(/C)c2cnccn2)c2ccccc2O1 1532446113 MMDWXTSLVCONCW-HMWXGYMHSA-N 339.351 1.847 10 10 EDCE NCc1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)c(Br)c1 2121591591 JFQIQAZMLYMMKF-GYSYKLTISA-N 327.222 1.351 10 10 EDCE COc1ccc(CN[C@@H](C)[C@H]2CCN(C(=O)CNC(C)=O)C2)cc1C 1484326507 KVSZPAMXLFLIMB-YOEHRIQHSA-N 347.459 1.466 10 10 EDCE COC(=O)c1ccn(CCCC(=O)NCc2ccc(OC)cc2O)n1 1626079568 HBOBAUTXUQJDKL-UHFFFAOYSA-N 347.371 1.481 10 10 EDCE CC[C@H](CNC(=O)c1ccc(O)nn1)NCc1ccc(OC)c(C)c1 1481786322 IPGWQTKGLATNIF-CQSZACIVSA-N 344.415 1.797 10 10 EDCE O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NCc1c(O)cccc1O 1558534758 XRWFSPJIUCFANG-TXEJJXNPSA-N 346.383 1.279 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2cnc(O)n2C)cc1C 1568291424 JFGZQLMDJGBVQX-ZDUSSCGKSA-N 346.431 1.693 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)c2nonc2C)C2CC2)cc1C 1723355839 MEMCNSXMKIIGHD-OAHLLOKOSA-N 344.415 1.993 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)CN(C)C(C)=O)cc1C 1732410870 ORNFCZJPHVEJPF-CQSZACIVSA-N 335.448 1.418 10 10 EDCE CNC(=O)[C@H]1CCCN1C(=O)NCc1ccc2c(c1)CCCN2C 157549472 OIMZZZBOKHBHNP-MRXNPFEDSA-N 330.432 1.489 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@H](O)C2)c(Br)c1 2132135729 SZSSSAPJVZMDOK-ZIAGYGMSSA-N 329.238 1.491 10 10 EDCE C[C@@H](N)c1ccc(N2CCCN(CCO)CC2)cc1Br 235214270 HEZKCSFWNHIOEP-GFCCVEGCSA-N 342.281 1.973 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)OCC(=O)O 1951423730 KBKMWYREDWQRNE-LBPRGKRZSA-N 327.333 1.592 10 10 EDCE COC(=O)[C@H](CN)N(C)c1ccc(CNC(=O)OC(C)(C)C)cc1 1999353936 RCOLWUMQKYMMSI-AWEZNQCLSA-N 337.420 1.648 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010404914 VPCDVPLSORRUBY-SDDRHHMPSA-N 341.412 1.952 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)NCc2ccccc2O)COC1 2010177011 ASLKUHOKXVKVQJ-UHFFFAOYSA-N 336.388 1.644 10 10 EDCE COc1ccc([C@H](C)NC[C@@H](O)CNC(=O)OC(C)(C)C)c(O)c1 2011423663 VYXCHWUUBQDBKE-NWDGAFQWSA-N 340.420 1.937 10 10 EDCE COC(=O)C=Cc1ccc(N2CCN(C[C@@H](C)O)CC2)c([N+](=O)[O-])c1 2053541841 BZYJZDWMYRRWKP-CYBMUJFWSA-N 349.387 1.284 10 10 EDCE CO[C@@H]1CN(c2ccc(CO)cc2Br)[C@H]2COC[C@H]12 2102132793 BWORXZHNPBZSCR-LEWSCRJBSA-N 328.206 1.791 10 10 EDCE OCCO[C@H]1CCCN(c2ccc(CO)c(Br)c2)C1 2113857596 ZFQHIRHDSUMZIK-ZDUSSCGKSA-N 330.222 1.919 10 10 EDCE CC(=O)Oc1ccc(/C=C2/SC(=S)N(CC(=O)O)C2=O)cc1 59245273 YUPWCMSDBGFJLZ-IZZDOVSWSA-N 337.378 1.898 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CCc3nc(C(C)C)nn3C2)c(O)c1O 182597050 BMNQGUIVOBOAEB-LLVKDONJSA-N 330.388 1.866 10 10 EDCE NC(=O)c1coc(CNC(=O)NCc2c(O)ccc3c2CCCC3)c1 187987486 CPOOMGSEEYVLKT-UHFFFAOYSA-N 343.383 1.962 10 10 EDCE O=S(=O)(NCCCSc1nccs1)NCC(F)(F)F 195250959 XCVUSHLGJZVJQG-UHFFFAOYSA-N 335.398 1.612 10 10 EDCE COc1ccc(CNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3C)C2)c(O)c1 373398723 HYCFNJNCOWMGME-QKCSRTOESA-N 333.388 1.209 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCCSCC1 807094961 GFTREPWBVWODFG-UHFFFAOYSA-N 335.473 1.643 10 10 EDCE CN(c1ccc(CN)c(Br)c1F)[C@H]1C[C@@H](C(N)=O)C1 703505303 CNICXXLKHLXFEX-DTORHVGOSA-N 330.201 1.747 10 10 EDCE CC(=O)C(=O)CSc1nnc(-c2ccc(OC(F)F)cc2)n1N 808015609 NGXFPYDZUYNPTH-UHFFFAOYSA-N 342.327 1.511 10 10 EDCE CC(=O)Nc1cc(C(=O)OCC(=O)C(C)=O)cc(C(F)(F)F)c1 808526654 UGVPUAVIXRHXHR-UHFFFAOYSA-N 331.246 1.979 10 10 EDCE CC(=O)C(=O)COC(=O)c1cnnn1-c1c(Cl)cccc1Cl 808547910 SYEBYWUHHZFVDG-UHFFFAOYSA-N 342.138 1.889 10 10 EDCE CNC(=O)[C@H]1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 817124506 HAXBIQTYEVDAPR-RNZFLTOJSA-N 333.344 1.353 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cc(OC)ccc1O)C2 819399895 YRFRWXPGYQGRFY-GLQYFDAESA-N 348.399 1.884 10 10 EDCE COc1ccc(CNC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)c(O)c1 832178670 VTTHLNXLDNBMMA-JCKWVBRZSA-N 334.416 1.550 10 10 EDCE COc1ccc(O)c(CNC(=O)NC[C@@]2(OC(C)C)CCOC2)c1 918745488 MONNGBZYKRSZIR-KRWDZBQOSA-N 338.404 1.784 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)/C=C/Cn3cncn3)C2)cc1 911275404 DXECTRQMMBOWKO-FAAWYNLUSA-N 341.415 1.486 10 10 EDCE CC(C)(C)OC(=O)NCCNC(=O)NCc1c(O)cccc1F 915643346 OWKCUGIGCWTNOC-UHFFFAOYSA-N 327.356 1.855 10 10 EDCE Cc1cc(O)c(CN(C)C[C@@H](O)CN2CCOCC2)c(Cl)c1 840918669 XWOGLIFXKVVVKM-CYBMUJFWSA-N 328.840 1.479 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN3C[C@H](O)C[C@H]3C2)c1 848926092 LDTZGMAMQDOQAS-QWHCGFSZSA-N 341.249 1.714 10 10 EDCE COC(=O)c1cn(C2CN(Cc3c(O)cc(C)cc3Cl)C2)nn1 840938115 XRMRQBPWFPZWPE-UHFFFAOYSA-N 336.779 1.789 10 10 EDCE COC(=O)CC1CC(N2C(=O)CN(Cc3ccccc3O)C2=O)C1 925186035 RQHBJBFJKYLLQE-UHFFFAOYSA-N 332.356 1.498 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@H]3C(=O)OC[C@H]3C2)c([N+](=O)[O-])c1 858848842 ILXFJWKGJPJDJR-USKJLILSSA-N 332.312 1.390 10 10 EDCE C[C@H](NC(=O)N[C@H](C)c1ccc(N(C)C)cc1)c1nnc(O)n1C 922050598 CTOOKGMUEFSRHJ-MNOVXSKESA-N 332.408 1.708 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC3(N)CCOCC3)C2)cc1 861665657 CFMOYCSVJJTQTG-CQSZACIVSA-N 348.447 1.081 10 10 EDCE CS(=O)(=O)CC1(CC(=O)NCc2ccc3cccnc3c2O)CC1 862027353 OOGUKPLXOONIID-UHFFFAOYSA-N 348.424 1.772 10 10 EDCE C[C@@H]1CCCN1S(=O)(=O)NCc1ccc(N2CCOCC2)cc1 770241284 MJAMITDHMRSSCU-CQSZACIVSA-N 339.461 1.342 10 10 EDCE COC(=O)c1c(CNC[C@@H]2COCCO2)c2cc(F)ccc2n1C 894197543 VNCLWRSNMVCTBT-GFCCVEGCSA-N 336.363 1.609 10 10 EDCE COCCN1CC[C@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C1 896259961 WUGKKYOUIXMBOQ-NSHDSACASA-N 336.413 1.763 10 10 EDCE COC(=O)N[C@H]1CCN(c2ccc(CN)cc2Br)C1 133599121 RWQYCRJTAKUZMQ-JTQLQIEISA-N 328.210 1.843 10 10 EDCE CC(C)(C)c1cc(C(=O)NCc2c(O)cccc2O)nc2ncnn12 1304050104 JDCFXOCWENBCRY-UHFFFAOYSA-N 341.371 1.763 10 10 EDCE Cn1nccc1[C@H]1COCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1300154718 TYGSAIVYSJAILE-CQSZACIVSA-N 342.359 1.796 10 10 EDCE C[C@H]1C(=O)Nc2cc(C(=O)NCc3c(O)cccc3O)ccc2N1C 1304053082 BTMWMVSYHYYLJH-JTQLQIEISA-N 341.367 1.805 10 10 EDCE CNCc1ccc(N2CCN(C)[C@@H](CO)C2)c(Br)c1 687617154 ZTLBLNCBSXCDEJ-GFCCVEGCSA-N 328.254 1.281 10 10 EDCE C[C@]1(O)CCN(c2cc(Br)c(CN)cc2F)C[C@@H]1O 1893300275 MBHAYJPKKGDUKA-STQMWFEESA-N 333.201 1.369 10 10 EDCE CN1CCN(c2ccc(CN3CC(F)(F)C[C@H]3CO)cc2F)CC1 1320699314 PGJVCEYALWRLKR-AWEZNQCLSA-N 343.393 1.779 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2[C@H]3COC[C@H]32)cc1C 1267140140 NAPQVKIZVPADNU-KBEGMRNHSA-N 332.444 1.880 10 10 EDCE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCC[C@H]1CNCCS1(=O)=O 1340064125 NHQYXXFZCRICEE-HZSPNIEDSA-N 338.473 1.615 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)NC[C@@]34CCC[C@@H]3C4)ccc21 1351145320 XSWHYFDXSXQHFS-UZLBHIALSA-N 341.455 1.992 10 10 EDCE O=C(NC[C@@H]1CC2(CCC2)CO1)C(=O)N1Cc2cccc(O)c2C1 1353841284 UGBZEMTVIYEPDY-ZDUSSCGKSA-N 330.384 1.310 10 10 EDCE CO[C@@H](C(=O)O)C1CN(Cc2c(O)cccc2Br)C1 2115722223 VFQYASLPEVLAKU-GFCCVEGCSA-N 330.178 1.686 10 10 EDCE C[C@@H](N)c1ccc(N2CCC[C@@H]2[C@@H](O)CO)cc1Br 2123209824 JUVDWNYYPMTEGR-FZQKWOKYSA-N 329.238 1.791 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCC2(NCCO)CCCC2)cc1 1714513334 CYZRCXGTSUAGCS-UHFFFAOYSA-N 333.392 1.474 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1CNCCO 1569855897 OXOKILDGFZXAHY-AAEUAGOBSA-N 333.392 1.139 10 10 EDCE NC(=O)CCC1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1632153419 MNOFVPFHKDOBHO-UHFFFAOYSA-N 331.376 1.967 10 10 EDCE NS(=O)(=O)c1ccc(CC(=O)NCc2c(O)cccc2F)cc1 1638864072 SZUKZKFWXAXWEU-UHFFFAOYSA-N 338.360 1.038 10 10 EDCE C[C@@H](NC(=O)[C@H](NC(=O)C1CCCC1)[C@@H](C)O)c1ccccc1O 1643738627 JVHGYUFJHDHRKR-XHBSWPGZSA-N 334.416 1.625 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)C(N)=O)C2CCCC2)cc1C 1733381940 GFVBVQGVQIFOTH-HNNXBMFYSA-N 333.432 1.254 10 10 EDCE O=C1CC[C@@H](c2ccc(C(=O)NCc3c(O)cccc3O)cc2)N1 1645363305 QABBNNQTCBQXMT-AWEZNQCLSA-N 326.352 1.979 10 10 EDCE COc1ccc2c(c1)OC[C@H](C(=O)NCc1c(O)cccc1O)C2 1597568601 HKFCSEBMNIEJTR-GFCCVEGCSA-N 329.352 1.974 10 10 EDCE O=C(CN1CCc2ccccc2C1=O)NCc1c(O)cccc1F 1596913021 SEUKMVYTBGWLAP-UHFFFAOYSA-N 328.343 1.846 10 10 EDCE Cn1ccnc1S(=O)(=O)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1890715999 BZLLUYRZHJYKNR-HOCLYGCPSA-N 346.456 1.887 10 10 EDCE C[C@@]1(O)CN(c2cc(Br)c(CN)cc2F)CC[C@H]1O 2136847608 NRNPHVLSTGZIKN-CHWSQXEVSA-N 333.201 1.369 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)CC[C@H](C)O)c(Br)cc21 253009075 ALLYNTHIBOEYTG-ISVAXAHUSA-N 342.237 1.869 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(C(=O)N1CC(N=[N+]=[N-])C1)C(C)(C)O 1985104664 LAIDPAFAKKZGRB-AWEZNQCLSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1990031662 BTAYESPMJYXWFA-GHMZBOCLSA-N 327.385 1.421 10 10 EDCE CNCc1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)c(Br)c1 2146308620 BNSFXKLDBVKOSY-HUUCEWRRSA-N 341.249 1.350 10 10 EDCE C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)Nc2ccc(N)cc2)C1 1999442205 LIFTXAKZUOCKRE-ZDUSSCGKSA-N 330.310 1.944 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CN(Cc2ccc(N)cc2)[C@H]2COC[C@H]12 1999483041 FKRGMXABGAOJLW-OAGGEKHMSA-N 333.432 1.993 10 10 EDCE COC(=O)[C@@H](CC(=O)NCCCCN=[N+]=[N-])NC(=O)OC(C)(C)C 2010402672 ULXGUFBPVSYGJW-SNVBAGLBSA-N 343.384 1.650 10 10 EDCE CC(C)(C)OC(=O)NCC=CC(=O)NCCc1ccc(O)c(O)c1 2010247944 RAHZMVFFXQWTCG-UHFFFAOYSA-N 336.388 1.837 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CC1(F)F 2019930382 GJSKNUHDEOSOCT-YHAQOWFVSA-N 346.374 1.802 10 10 EDCE NS(=O)(=O)CCCCNCc1cccc(Br)c1O 386775485 JAFJLMZIHKKVCE-UHFFFAOYSA-N 337.239 1.313 10 10 EDCE CNCc1ccc(N2C[C@@H]3OC[C@@H](CO)[C@@H]3C2)c(Br)c1 2178081052 BNGGFDNZIAYFMA-XUJVJEKNSA-N 341.249 1.612 10 10 EDCE NCc1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)c(F)c1Br 2178086805 NQIHTPWGYXDVFC-NHCYSSNCSA-N 345.212 1.490 10 10 EDCE NCc1ccc(N2CCCNC(=O)CC2)c(F)c1Br 2089098942 JIMXEQNYOHHFST-UHFFFAOYSA-N 330.201 1.763 10 10 EDCE COc1ccc(Br)c(CN[C@H]2COC[C@H]2OC)c1O 2227736780 LACQEIKUYHMTNM-CMPLNLGQSA-N 332.194 1.667 10 10 EDCE COc1ccc(Br)c(CNCC[C@H](O)CCO)c1O 2351739544 JVELOWAOPBOKQW-VIFPVBQESA-N 334.210 1.386 10 10 EDCE Cc1ccc(CN[C@H]2CCOC[C@H]2CO)c(O)c1Br 2352677591 BEMFVPKDXQPWEF-NEPJUHHUSA-N 330.222 1.950 10 10 EDCE Cc1ccc(CNC(=O)Cn2ccnn2)c(O)c1Br 2352932605 OZZLGFVEIBSVGY-UHFFFAOYSA-N 325.166 1.371 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(Br)c1 2355338499 BVUPWACLWUUMEU-FWYKCERLSA-N 342.233 1.823 10 10 EDCE Cc1cc(Br)ccc1N1C(=O)NC(=O)/C(=C\O)C1=O 101350095 FXXQBISRVZMQCC-VMPITWQZSA-N 325.118 1.782 10 10 EDCE O=C(/C=C\c1cccnc1)NCc1ccc(N2CCNC(=O)C2)cc1 103449489 JGKAHWNFUNVCOL-YVMONPNESA-N 336.395 1.347 10 10 EDCE C[C@H](NC(=O)N[C@@H](C)[C@H](C)CO)c1ccc(N2CCOCC2)cc1 77796539 YZKGIOKPWSWXSI-ILXRZTDVSA-N 335.448 1.900 10 10 EDCE Cn1nc(Br)c(CN2CCc3cc(O)c(O)cc3C2)n1 2366920539 HIRXAACYTCRBNQ-UHFFFAOYSA-N 339.193 1.547 10 10 EDCE CCC(=O)N[C@@H](CCSC)C(=O)NCc1cccc(OC)c1O 264237334 BDQBIBQYVHOHPW-LBPRGKRZSA-N 340.445 1.665 10 10 EDCE COc1cc(O)c(CN[C@H](CO)C[C@H](O)C(C)(C)C)cc1OC 284284020 ATHTUWDNLDYQLJ-LRDDRELGSA-N 327.421 1.657 10 10 EDCE Cc1ccc(CNC(=O)c2ncc[nH]c2=O)c(O)c1Br 2380753969 LONOMGNHXRIJAM-UHFFFAOYSA-N 338.161 1.476 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2COCCN2)c(O)c1Br 2380759342 NDYOGAFLYLQPLR-LLVKDONJSA-N 343.221 1.410 10 10 EDCE CS[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@@H]1N1CCCC1 294885680 GKKLDNGILPPYAZ-WCQYABFASA-N 340.420 1.889 10 10 EDCE COc1cccc(CNC(=O)NCCc2cccnc2OC)c1O 291184638 IZRLDPGUAUXIJM-UHFFFAOYSA-N 331.372 1.846 10 10 EDCE COc1ccc(N2CCN(C(=O)CCc3cnn(C)n3)CC2)cc1F 826778746 YGAJJONGEKHVOP-UHFFFAOYSA-N 347.394 1.244 10 10 EDCE CC(C)(C)CC(=O)N1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 825427978 SQKICCIKNGCNMP-UHFFFAOYSA-N 338.379 1.958 10 10 EDCE C[C@]1(C(=O)NCc2ccc(N3CCCC3)cc2)CCCS1(=O)=O 906108877 DEXHWWOPJGBSEP-QGZVFWFLSA-N 336.457 1.870 10 10 EDCE O=c1cc(/C=C\c2ccc(N3CCC(O)CC3)cc2)nc2nc[nH]n12 905070819 NVZWRHHRXFMHQQ-RJRFIUFISA-N 337.383 1.549 10 10 EDCE Cc1cc(O)c(CNCCS(=O)(=O)N2CCOCC2)c(Cl)c1 840889918 JLRYUNRYQKVVRC-UHFFFAOYSA-N 348.852 1.106 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)CN3CC(C)(C)C3)C2)cc1 848230285 VHKWFEOXJMKTJW-HNNXBMFYSA-N 331.460 1.980 10 10 EDCE OC1CCN(c2ccc(CNCCOC3CCOCC3)cc2)CC1 922928241 MDEPWBAJXJYSIZ-UHFFFAOYSA-N 334.460 1.933 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCC[C@@H]1CNC(=O)C1 922916470 UURUNOZURNGMBU-CABCVRRESA-N 346.475 1.817 10 10 EDCE CON1CC[C@@H](OC(=O)c2cc(C)n(-c3ccccn3)c2C)C1=O 922324048 XCKCPEAPISKANW-CQSZACIVSA-N 329.356 1.808 10 10 EDCE COc1ccc(N2CCN(CCNc3nccnc3F)CC2)cc1 858366935 FDHBJYCWZDZHRV-UHFFFAOYSA-N 331.395 1.858 10 10 EDCE O=C(NCCN1C[C@H]2CCCCN2C1=O)NCc1ccccc1O 852651891 KNUJMHWCYPXODP-CQSZACIVSA-N 332.404 1.482 10 10 EDCE COC1(CS(=O)(=O)N[C@H](C)c2ccccc2O)CCOCC1 867833998 CCCIXGMMQBTARW-GFCCVEGCSA-N 329.418 1.568 10 10 EDCE CO[C@@H](C)c1noc(CN(C)Cc2cc3c(cc2O)OC[C@@H]3O)n1 768463666 LCYXLCWUTVWQOT-ZANVPECISA-N 335.360 1.540 10 10 EDCE COc1cnc(C(=O)NCc2ccc(N3CCOCC3)cc2)c(F)c1 864984313 NKVIBLWMSGLZHZ-UHFFFAOYSA-N 345.374 1.996 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1CNC(=O)N(C)Cc1ccc(N(C)C)cc1 876140633 IBYBGOYGWSPWFD-GDBMZVCRSA-N 349.431 1.472 10 10 EDCE Cc1cc(Br)cc(CNCCC2CS(=O)(=O)C2)c1O 787417052 IFKLZMALSIWFQO-UHFFFAOYSA-N 348.262 1.987 10 10 EDCE COc1ccc(N2CCN(C(=O)C[C@]3(O)CCCN(C)C3)CC2)cc1 899940499 PFTLYSATNHAQIA-LJQANCHMSA-N 347.459 1.191 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NCc1cc(Br)cc(F)c1O 895250322 IBEKGAZAOVSMBQ-CMPLNLGQSA-N 348.168 1.714 10 10 EDCE COc1ccc(N2CCN(C(=O)C3CN([C@@H]4CCOC4)C3)CC2)cc1 895444649 OMCUKMZMRZOTFG-QGZVFWFLSA-N 345.443 1.065 10 10 EDCE COc1ccc(CNS(=O)(=O)c2cccc(N(C)C)c2)c(O)c1 795358671 ROXZWKDMCHBHNH-UHFFFAOYSA-N 336.413 1.945 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(O)cn1 1138054982 LTNHLDAQTWXLQC-ZDUSSCGKSA-N 346.339 1.103 10 10 EDCE CN(C)CC(=O)Nc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1148573408 UKBQVUZMMGMIJH-UHFFFAOYSA-N 343.383 1.779 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@H]1CCOC1 1317290310 QVMFRWJAHPTOIK-VXGBXAGGSA-N 333.392 1.593 10 10 EDCE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC1CN(S(=O)(=O)N(C)C)C1 1329192885 URYRMHTVHBCNJA-DGCLKSJQSA-N 339.461 1.329 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H]2[C@@H](C(=O)NCc3ccccc3O)[C@H]21 1964890118 PYMSMIBMLRWBOY-RRFJBIMHSA-N 348.399 1.643 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@@]34CCOC4)ccc21 1325822623 LFQWGZNVTIVWPJ-IBGZPJMESA-N 343.427 1.077 10 10 EDCE O=C(O)[C@@H]1CO[C@@H](CNCc2ccc(Br)cc2O)C1 714014633 KIJHXHHBYSJLPE-GXSJLCMTSA-N 330.178 1.734 10 10 EDCE CC[C@H](CO)N1CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 1185555266 MYAVBLAIGGNLDM-GFCCVEGCSA-N 339.392 1.505 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@@H](C)NC(=O)C2(C)CC2)cc1 1268646664 HIYOVXUCTIUIRO-GFCCVEGCSA-N 344.419 1.065 10 10 EDCE O=C(NCc1c(O)ccc2ccccc12)[C@H]1CCc2nnc(O)n2C1 1456309945 NKLYSXIZOHXPFI-LBPRGKRZSA-N 338.367 1.721 10 10 EDCE COc1cc(C(=O)N[C@H]2CCN(C(=O)CCCF)C2)cc(OC)n1 1703894237 AYUJHGPCTSVFQZ-LBPRGKRZSA-N 339.367 1.179 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)Cc1cnn(C)c1 1716209381 WETGKZUTJQDNKV-UHFFFAOYSA-N 344.459 1.918 10 10 EDCE CN1C[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)NC1=O 1625657477 QDCWSVUWVZNHIL-LBPRGKRZSA-N 336.355 1.358 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)C[C@H](C)NC(N)=O)C2)cc1C 1713160542 OQOPOLVQOKYRDJ-QEJZJMRPSA-N 348.447 1.187 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)c2nc(C)c[nH]2)cc1C 1717929746 JMHWGNRUGFWICR-HNNXBMFYSA-N 346.431 1.258 10 10 EDCE Cc1noc(C2(C)CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)n1 1624970355 OTJSGBCLBSDADO-UHFFFAOYSA-N 331.372 1.912 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)CN2CCCC2=O)cc1C 1498511983 VGUOJXSSQWRGML-UHFFFAOYSA-N 347.459 1.564 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(N)ncnc2c1 1638347797 MMQKSVJSAGLVPL-JTQLQIEISA-N 338.367 1.984 10 10 EDCE CC[C@H](F)C(=O)NC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1744722398 GVTPWFIFESSICU-KOLCDFICSA-N 327.356 1.081 10 10 EDCE CCO/C=C\C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1596355522 RYPBSSXSIILMSF-XFXZXTDPSA-N 331.416 1.555 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2c(C)ccn2C)cc1C 1676525141 VAROJPNLNKSQJK-MRXNPFEDSA-N 345.443 1.531 10 10 EDCE O=C(CCN1C(=O)/C(=C\c2ccccc2)SC1=S)NCCO 1766003 KASLOOWPEAMXLK-ZRDIBKRKSA-N 336.438 1.386 10 10 EDCE NCC1(CO)CCN(Cc2ccc(Br)cc2O)CC1 2138157429 VWMQJECBKOSGAL-UHFFFAOYSA-N 329.238 1.688 10 10 EDCE CC(C)(C)OC(=O)N1CC(NC(=O)CCOc2ccc(N)cc2)C1 1999127212 ZAQGFGHEXXKRKT-UHFFFAOYSA-N 335.404 1.773 10 10 EDCE C[C@@H]1CCN(Cc2cc(N)ccc2O)C[C@H]1NC(=O)C(F)(F)F 1999433471 AUKHTJQGYKSDIB-BXKDBHETSA-N 331.338 1.863 10 10 EDCE CCN(c1ccc(CN)cc1Br)[C@@H]1CCS(=O)(=O)C1 387436828 YERYGRRPOZGMLX-LLVKDONJSA-N 347.278 1.921 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCC[C@@H](O)CC3)c(Br)cc21 393232691 XUXDGNOFTZYKHV-AMIZOPFISA-N 340.221 1.752 10 10 EDCE CC[C@@H]1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C[C@H]1O 399885498 HKOZYTVBBCKXNL-BLBGDKDGSA-N 340.221 1.608 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@@H](O)C2(C)C)cc1Br 2181215226 QQZIDNVORKOLMU-ZIAGYGMSSA-N 343.265 1.879 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCO[C@@H](c4ccco4)C3)c2n1 2063332254 NIUBYSNOLAKTFT-CYBMUJFWSA-N 328.328 1.550 10 10 EDCE CCNCc1ccc(N2C[C@H]3C(C(N)=O)[C@@H]3C2)c(Br)c1 2201292393 FQIROOSATCSOAG-GHMZBOCLSA-N 338.249 1.726 10 10 EDCE CN[C@@H](c1ccccc1O)[C@@H](O)c1cnn(C)c1Br 2091863221 LYDNBHFHQGDGSE-RYUDHWBXSA-N 326.194 1.882 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2C[C@@H]2C(=O)O)c1O 2227741123 KXNDFPKXLFLLQT-SFYZADRCSA-N 330.178 1.974 10 10 EDCE CC(C)NCc1ccc(N2CC[C@@H]2[C@@H](O)CO)cc1Br 2286209011 MXDXLEWONIUADT-CABCVRRESA-N 343.265 1.879 10 10 EDCE OC[C@@]1(O)CCN(c2ccc(OCc3ccccc3)cc2)C[C@H]1O 2299509533 AZPWYHPZUPYEDQ-MOPGFXCFSA-N 329.396 1.560 10 10 EDCE COC[C@]1(C(=O)N(C)CCN=[N+]=[N-])C=CCN1C(=O)OC(C)(C)C 2299699450 DLNSHJDMUCVPAH-HNNXBMFYSA-N 339.396 1.947 10 10 EDCE Cc1ccc(CN2C[C@@H]3NC(=O)O[C@@H]3C2)c(O)c1Br 2352601817 OQCJVTHXEIGYQP-VHSXEESVSA-N 327.178 1.756 10 10 EDCE CNC(=O)NCCCNCc1ccc(C)c(Br)c1O 2352690442 BLGNCODEXPQAIB-UHFFFAOYSA-N 330.226 1.872 10 10 EDCE Cc1ccc(CN2CC[C@H](N)[C@H](CO)C2)c(O)c1Br 2352945127 REDTXRHTVOIEJR-RYUDHWBXSA-N 329.238 1.605 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NCc2ncnn2C)cc1F 176576838 WIYULQXZIUJYAU-UHFFFAOYSA-N 334.399 1.800 10 10 EDCE CNC(=O)[C@@H](NC(=O)NCc1c(O)ccc2c1CCCC2)C(C)C 178412037 RXQGRRBVOMVREL-INIZCTEOSA-N 333.432 1.841 10 10 EDCE C[C@H](NC[C@H](C)N1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 127304583 DOCGLPAHHLRYMM-ROUUACIJSA-N 346.519 1.810 10 10 EDCE Cc1ccc(C(=O)NCc2cccnc2-n2cncn2)c(O)c1O 182010873 SYVDLMNKLPULGR-UHFFFAOYSA-N 325.328 1.312 10 10 EDCE CCN(CC)c1ccc(CNC(=O)[C@H]2C[C@@H](O)CN2C(C)=O)cc1 192778775 BYNGBBYJPAIVJF-IAGOWNOFSA-N 333.432 1.131 10 10 EDCE NCc1cc(F)c(N2C[C@H](C(N)=O)C3(CC3)C2)cc1Br 2370326012 QWSGRRUDTYZFEP-SECBINFHSA-N 342.212 1.749 10 10 EDCE CS(=O)(=O)C[C@@H](N)c1cc(Br)cc(Cl)c1O 95780849 GMYQMJOXBIKNAU-MRVPVSSYSA-N 328.615 1.853 10 10 EDCE O=C1CN(Cc2ccc(N3CCOCC3)cc2)[C@@H]2CCCC[C@H]2N1 245556839 JKANCWLTDQRYRV-QZTJIDSGSA-N 329.444 1.766 10 10 EDCE Cc1nc(CNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)no1 255866361 ORTKOCJBSHMGMP-DAXSKMNVSA-N 328.372 1.544 10 10 EDCE COC[C@H](NCc1ccc([N+](=O)[O-])c(OC)c1O)C1CCOCC1 826872696 SHLYAINDIYTNDS-ZDUSSCGKSA-N 340.376 1.840 10 10 EDCE CCOc1ccc(O)c(CN2CCN([C@@H]3CCNC(=O)CC3)CC2)c1 825148269 RYCWTXQDDKPJEZ-INIZCTEOSA-N 347.459 1.577 10 10 EDCE CCOC(=O)[C@H](F)[C@H]1CCN(C(=O)c2ccc(C)c(O)c2O)C1 912251809 CNCVGGJNVORUNL-CMPLNLGQSA-N 325.336 1.770 10 10 EDCE COc1ccc(N2CCN(CN3CC(F)(F)CC3=O)CC2)cc1 841674934 UFGVHIBSEMVWHB-UHFFFAOYSA-N 325.359 1.642 10 10 EDCE COCCN1CCC[C@@H]1CNC(=O)NCc1cc(Cl)ccc1O 844969790 WFDBMUQBNZARRM-CQSZACIVSA-N 341.839 1.956 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)c3nncn3C)C2)cc1 849224937 MJKZWRJYKYTWTC-CHWSQXEVSA-N 344.419 1.463 10 10 EDCE COc1ccc(N2CCN(C(=O)CC[C@]3(C)CCC(=O)N3)CC2)cc1 753375749 ACXYBPIMBCJYRP-IBGZPJMESA-N 345.443 1.793 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCCN(C)C3=O)C2)cc1 855227772 YUFAIKFDJIMAMY-BBRMVZONSA-N 331.416 1.259 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C[C@H](OC)[C@@H]1CCOC1 852192536 SHIPUBDZLAAUPQ-WBVHZDCISA-N 337.416 1.809 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H]2COC[C@]2(C)C1 852533459 ZCONSTKOOSJPIY-APWZRJJASA-N 331.460 1.679 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCc3c[nH]nc3C)C2)cc1 853405569 SKLDGEFBUXLQHF-CQSZACIVSA-N 329.404 1.805 10 10 EDCE C[C@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)C[C@@](C)(C(F)F)O1 853335528 ALBUYAKILZSUEH-VFZGTOFNSA-N 327.331 1.478 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)C34CC(C3)C4)cc2)CC1 861212882 FNBXXLZIVSCIHY-UHFFFAOYSA-N 327.428 1.771 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C3(N4CCOCC4)CC3)C2)cc1 869228522 KPNLYGFRGGEHOU-HNNXBMFYSA-N 345.443 1.255 10 10 EDCE CN(C)c1ccc(CN(C(=O)C2CN([C@H]3CCOC3)C2)C2CC2)cc1 895634255 XTKFJDISKKEIPX-IBGZPJMESA-N 343.471 1.964 10 10 EDCE CCNC(=O)COc1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 1141577040 NZDZMTJNOXAQLU-UHFFFAOYSA-N 344.367 1.794 10 10 EDCE COc1ccc(Br)c(CN(C)Cc2nncn2C)c1O 1964568023 HBHVEMRMUGMQRZ-UHFFFAOYSA-N 341.209 1.924 10 10 EDCE CCOC(=O)c1cc(CNC(=O)NCc2ccc(OC)cc2O)on1 1235337382 SOROJTOHRONZCM-UHFFFAOYSA-N 349.343 1.565 10 10 EDCE CN(CC1(C)COC1)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 702959866 YHNFARQSTOVILY-GFCCVEGCSA-N 341.205 1.907 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)c2cnn(C)c2N)cc1C 1268643685 YYBRUXOJPOGPBC-GFCCVEGCSA-N 331.420 1.227 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@]2(C)CCC(=O)N2)cc1C 1274786410 QKESEZCRPPLXBG-LIRRHRJNSA-N 347.459 1.657 10 10 EDCE CC(C)[C@@H]1C(=O)NCCN1C(=O)c1cc2cc(O)c(O)cc2s1 1350344777 SDVNUACEXXIORG-CQSZACIVSA-N 334.397 1.909 10 10 EDCE C[C@H]1C[C@@H]1C(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1358319136 RIYVTHOGDJZLCC-CWSCBRNRSA-N 331.376 1.740 10 10 EDCE COc1ccc(CNCCC[C@H](C)NC(=O)[C@@H]2COC(=O)N2)cc1C 1277177923 KRYJQBWDOFZPDZ-ZFWWWQNUSA-N 349.431 1.487 10 10 EDCE NCc1cc(F)c(N2CCO[C@H](CCO)C2)cc1Br 2116236085 JQSINQKCIMALLW-SNVBAGLBSA-N 333.201 1.635 10 10 EDCE CN(C)c1ccc(CNC(=O)Cc2ccc(C(N)=O)nc2)cc1F 1528619340 LDLNJWMMYMROAO-UHFFFAOYSA-N 330.363 1.245 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CN1CCC(CO)CC1 1463803729 AZJBPBVMGGYGKW-UHFFFAOYSA-N 345.487 1.950 10 10 EDCE C[C@H]1CN(c2ccc(CN)c(Br)c2)C[C@H](CCO)O1 2122799872 NVXRMKPLTSDKOK-GWCFXTLKSA-N 329.238 1.884 10 10 EDCE O=C(C[C@H]1C(=O)Nc2c(F)cccc21)NCc1ccc(O)c(O)c1 1622663987 BPVRMXBCUOZUMV-LLVKDONJSA-N 330.315 1.979 10 10 EDCE CC(C)(C)S(=O)(=O)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1628051994 CZXURWNQAFNHOC-UHFFFAOYSA-N 340.405 1.792 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)c2c(C)cnn2C)cc1C 1715989709 GWEBHINXFKSIHJ-AWEZNQCLSA-N 330.432 1.954 10 10 EDCE CCN(C)CCC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1491393753 UIEOASVJUUGAGU-UHFFFAOYSA-N 348.407 1.037 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@H](C)C(C)C)cc(OC)n1 1495101990 YAHJPBKGJHIVIN-NWDGAFQWSA-N 337.420 1.625 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCC[C@@H]1CNC(=O)C1 1638211848 VEDKBQUFEYOOII-INIZCTEOSA-N 344.459 1.954 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cnc(-c2ccccn2)nc1 1630335360 NXVKCLPPXSHDBN-UHFFFAOYSA-N 336.351 1.922 10 10 EDCE Cn1cc([C@H]2CCCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)nn1 1640447725 DFZKXCVKDKAXRQ-IYNGYCSASA-N 328.372 1.646 10 10 EDCE [N-]=[N+]=NC1CCN(C[C@@H](O)CN2C(=O)c3ccccc3C2=O)CC1 1912201253 RNFSLAQQZTWDJC-GFCCVEGCSA-N 329.360 1.418 10 10 EDCE CC1(C(N)=O)CN(c2ccc(C=CC(=O)O)cc2Br)C1 1914226440 FPMIISOBMRCIOB-UHFFFAOYSA-N 339.189 1.859 10 10 EDCE COC(=O)/C=C\c1ccc(N(C)CC(C)(CO)CO)c([N+](=O)[O-])c1 1772899852 OUBMYEVJNYZVSN-ALCCZGGFSA-N 338.360 1.208 10 10 EDCE CCNC(=S)N[C@H]1CCCN(CCCOc2ccc(N)cc2)C1 586071117 SVJPLZIDWGTRQI-HNNXBMFYSA-N 336.505 1.986 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CCC[C@@H](O)C3)c(Br)cc21 221242549 BWVNFYWRDCMUGZ-OQPBUACISA-N 340.221 1.623 10 10 EDCE OC[C@H]1COCCN1c1ccc(CNC2CC2)cc1Br 236503506 GAWGVOSLKRKLGW-ZDUSSCGKSA-N 341.249 1.899 10 10 EDCE CO[C@](C)(CNC(=O)OC(C)(C)C)[C@@H](N)Cc1ccc(O)c(O)c1 1952913265 XTQNXSWSQYLKSI-WMLDXEAASA-N 340.420 1.897 10 10 EDCE CO[C@H]1C[C@@H](C(=O)N(C)CCN=[N+]=[N-])N(C(=O)OC(C)(C)C)C1 1985093682 CXKMCOLAQNRLGN-QWRGUYRKSA-N 327.385 1.780 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](CC(=O)NCCN=[N+]=[N-])OCC12CC2 2012859504 ISYQZEDWPIGACW-NSHDSACASA-N 339.396 1.972 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C1CSC1 2028430583 SYKNATJUKKJMMM-LLVKDONJSA-N 328.235 1.953 10 10 EDCE Cc1cc(Br)cc(CN2C[C@H]3C[C@H]2CS3(=O)=O)c1O 319828603 KTEYXFZCITWARF-NWDGAFQWSA-N 346.246 1.834 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)cc1Br 2182553216 KPPRLZPSHLZPNP-XKSWNSKZSA-N 341.249 1.647 10 10 EDCE Cn1c(Br)nnc1CCNCCCc1ccc(N)cc1 2185382626 NRAWQUHHZYFQEZ-UHFFFAOYSA-N 338.253 1.925 10 10 EDCE CC(C)(C)CN(CCOc1nnc(=N)[nH]n1)C(=O)OC(C)(C)C 2210648429 BNYFMJGSMNYZGS-UHFFFAOYSA-N 326.401 1.341 10 10 EDCE COc1ccc(N2CCCC2(CO)CO)c(OC)c1Br 2234891469 HJHISBKBKMLXNK-UHFFFAOYSA-N 346.221 1.790 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C(=O)NCCN=[N+]=[N-])O[C@H]2C1 2251289923 KNBUNTIRBZMYNT-TUAOUCFPSA-N 339.396 1.827 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2329329704 XNRMVXRKWXLDSE-MOJTXTBVSA-N 328.206 1.433 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H](N)[C@H](C)O)c(O)c1Br 2352648743 BANKYBXKJOJRQB-KWQFWETISA-N 331.210 1.130 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N[C@H]2CCCNC2=O)cc1F 66978097 WCNFMKXRTQWWKU-AWEZNQCLSA-N 336.411 1.750 10 10 EDCE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(=O)[nH]n1 170565661 PZCIANQWIJRPBH-UHFFFAOYSA-N 345.314 1.798 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)[C@@H]2CCCNC2=O)cc1C 1281726578 YNFPOJGPTUPORT-GOEBONIOSA-N 347.459 1.514 10 10 EDCE O=C1O[C@H](c2ccc(O)c(O)c2)[C@@H](C(=O)O)c2cc(O)c(O)cc21 33414021 DAUFPQLHQHWOJS-UONOGXRCSA-N 332.264 1.589 10 10 EDCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[C@H]1C(=O)O 326296463 HRZSMRGOTRFLFK-DTWKUNHWSA-N 335.316 1.473 10 10 EDCE COc1cc(NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)ncn1 255074850 LQTUQYDDEVXAMN-DAXSKMNVSA-N 340.383 1.974 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)NCc2ccnn2C)cc1 284093316 MJMYTQZIEWSRRZ-UHFFFAOYSA-N 343.431 1.199 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CF)CC2)cc1 287092982 DCAOMXPGUGMXFJ-CQSZACIVSA-N 338.427 1.474 10 10 EDCE CC[C@@]1(C(=O)OCC(=O)C(C)=O)CCCN1C(=O)OC(C)(C)C 808532941 ARCKYQXZCDDTKC-INIZCTEOSA-N 327.377 1.867 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CNCC[C@H](C)F)CC2)cc1 819334146 VTSMQSMBDDFUFQ-DOTOQJQBSA-N 339.455 1.516 10 10 EDCE COCn1nc(C)c(S(=O)(=O)Nc2ccc(O)cc2F)c1C 818047858 KUGKMEZOELNTHL-UHFFFAOYSA-N 329.353 1.749 10 10 EDCE C=CC(=O)N(CC)CC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 912291972 GHLQTUIZMYRUEG-CQSZACIVSA-N 331.416 1.425 10 10 EDCE CCNS(=O)(=O)[C@H]1CCN(C/C=C/c2ccc(N(C)C)cc2)C1 835045648 XPDWKEBYUWYSDY-RTRPANQVSA-N 337.489 1.779 10 10 EDCE CN(C)c1ccc(CNC(=O)c2ccc3c(n2)OCCO3)cc1F 846841404 BSVIGSXJAVYVIR-UHFFFAOYSA-N 331.347 1.988 10 10 EDCE CC(=O)NCC(C)(C)C(=O)NCc1cc(Br)ccc1O 846138843 IGZSVZUNISVEGV-UHFFFAOYSA-N 343.221 1.933 10 10 EDCE CO[C@](C)(CO)CN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 848557588 GEBYHRCFVJRVGF-DYVFJYSZSA-N 326.412 1.710 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc(C(N)=O)cs3)C2)cc1 855228730 FBSPAVISSKLRML-LBPRGKRZSA-N 345.424 1.864 10 10 EDCE CCn1nnc(C)c1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856215627 NFBCZRKRYIDEBD-UHFFFAOYSA-N 343.431 1.498 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H](OC)[C@H](OC)C3)C2)cc1 854300145 VIPJHQVEMUHAAC-RRQGHBQHSA-N 349.431 1.329 10 10 EDCE C[C@]1([C@@H]2CCCN(C(=O)/C=C\c3ccc(O)c(O)c3)C2)COC(=O)N1 928022340 DDLBLYZPBCXBCE-SXPDJVLSSA-N 346.383 1.848 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cn4cccnc4n3)C2)cc1 855230372 CPMGLULILYZRMQ-ZDUSSCGKSA-N 337.383 1.747 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)CS(=O)(=O)N(C)C)cc1 785084357 BUARJRIMFWEBRO-UHFFFAOYSA-N 341.477 1.383 10 10 EDCE COC(=O)c1c(CNCCCOCCO)c2cc(F)ccc2n1C 894433210 DSLLCZQVTQQSFV-UHFFFAOYSA-N 338.379 1.593 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)C2(C(N)=O)CC2)cc1C 1319232681 KQOSNYAREOEELL-LBPRGKRZSA-N 333.432 1.111 10 10 EDCE CN(CC[S@](C)=O)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 399049377 XGPGZQMQLKLRAZ-WYRIXSBYSA-N 346.250 1.216 10 10 EDCE CN(C[C@H](O)COCc1ccccc1)C(=O)Cc1ccc(O)c(O)c1 1916341143 CSMYNBDZWJTLSJ-INIZCTEOSA-N 345.395 1.676 10 10 EDCE COc1ccc(-n2nnnc2CN2CC[C@H](CCNC(C)=O)C2)cc1 1267550769 ZOXYHWBVWUGYHD-AWEZNQCLSA-N 344.419 1.019 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)c2cc[n+]([O-])cc2)cc1C 1267976785 ZNBFUQFWFOGDFG-CQSZACIVSA-N 343.427 1.793 10 10 EDCE COc1ccc(CNC[C@@H]2CCN(C(=O)CCNC(N)=O)C2)cc1C 1267069316 UGIMDEIHUVOBDI-HNNXBMFYSA-N 348.447 1.000 10 10 EDCE CC[C@@H]1COCCN1CCNC(=O)c1ccc(N=NC(N)=O)cc1 1455484333 SZGCYZJMVWVXIK-CQSZACIVSA-N 333.392 1.690 10 10 EDCE O=C(N[C@@H]1CCN(c2ccc(F)cc2)C1=O)c1c(F)ccc(O)c1O 1457866121 RDRHPGACIAFBEF-GFCCVEGCSA-N 348.305 1.911 10 10 EDCE O=C(Nc1ccc(-c2ncon2)cc1)C1=S=c2c(cc[nH]c2=O)=C1 1464708453 SDKMUWJMYGGZBB-UHFFFAOYSA-N 338.348 1.014 10 10 EDCE CN1C(=O)NCC12CCN(C(=O)c1ccc(N=NC(N)=O)cc1)CC2 1469278917 GIMOZWNEMYZQMB-UHFFFAOYSA-N 344.375 1.479 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CNC(=O)C2CCC2)cc1C 1713667066 OFRJDIGOMIRAQV-UHFFFAOYSA-N 347.459 1.468 10 10 EDCE NCc1cc(F)c(N2CCC[C@H]2[C@@H](O)CO)cc1Br 2123239210 NQHYDZJVLXVDOU-AAEUAGOBSA-N 333.201 1.369 10 10 EDCE O=C(NCc1c(O)cccc1O)C1CCC(N2CCOCC2)CC1 1639296084 LNCJXRUTRUBFNT-UHFFFAOYSA-N 334.416 1.605 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCS(=O)(=O)c2ccccc2C1 1633556660 JGWWPUVAJHSYCC-UHFFFAOYSA-N 347.392 1.456 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H](C)S(C)(=O)=O)cc1C 1491499069 BKSZWXLXOHGPLZ-STQMWFEESA-N 342.461 1.031 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)Cc2ccco2)cc(OC)n1 1744728453 YDYWPYYPAVQMFP-LLVKDONJSA-N 347.371 1.169 10 10 EDCE CN1CCN(c2cc(C(=O)NCc3c(O)cccc3O)ccn2)CC1 1597574188 JTYURYNQIFCYFO-UHFFFAOYSA-N 342.399 1.175 10 10 EDCE CCOCCNC[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1675832746 XFNSQVFKESZZNP-NNUKFRKNSA-N 347.419 1.984 10 10 EDCE C[C@H]1[C@@H](O)CCN1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1675580402 MKTFBOOSWNKMQC-YOEHRIQHSA-N 332.448 1.103 10 10 EDCE O=C(NC1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1)c1ccco1 169856138 XPNKZQXCGBTZOV-UHFFFAOYSA-N 346.339 1.431 10 10 EDCE COc1c(-c2ccc(O)c(O)c2)oc2c(O)c(O)cc(O)c2c1=O 6403318 WLHKPDQFOBROCS-UHFFFAOYSA-N 332.264 1.997 10 10 EDCE biogenic CCOC[C@@H](O)CNCc1c(Br)ccc(OC)c1O 1969427871 OMRINUODYKQUSR-VIFPVBQESA-N 334.210 1.650 10 10 EDCE CCNC(=O)[C@@H]1CNCCN1Cc1cc(Br)ccc1O 233492532 LDVBRYBIQOTUJE-LBPRGKRZSA-N 342.237 1.065 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H]1CNC(=O)O1 1951992694 IZKLRBXUBXIRFW-GXFFZTMASA-N 338.360 1.642 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H](CN)CO 1952116551 ZSMKZQYWHILHNF-NEPJUHHUSA-N 326.393 1.101 10 10 EDCE CN(C)c1ccc([C@H](CN)N2CC(NC(=O)OC(C)(C)C)C2)cc1 2018794845 GBVRIOFGCVIKSM-INIZCTEOSA-N 334.464 1.961 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@H]([C@@H](O)[C@H](N)c2ccccc2O)C1 2022706687 JIPIMLVEHCYVOG-RRFJBIMHSA-N 338.404 1.389 10 10 EDCE CCNCc1ccc(N(C)[C@@H]2CC(=O)NC2=O)c(Br)c1 2171189386 CWOAOQKNLKCCJF-GFCCVEGCSA-N 340.221 1.410 10 10 EDCE O=C(O)[C@@]12CN(Cc3cc(Br)ccc3O)C[C@@H]1CCO2 705101218 ROFYXEFIBNLRMQ-IINYFYTJSA-N 342.189 1.830 10 10 EDCE COC(=O)N1CCN(c2ccc(CN)c(Br)c2)CC1 387209118 PSMKOCUTPWGNQA-UHFFFAOYSA-N 328.210 1.796 10 10 EDCE CC(C)(C)OC(=O)N1CC(CCO)(NCc2cccc(F)c2O)C1 398089268 IWVFKEUSJOTYEG-UHFFFAOYSA-N 340.395 1.993 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC3CC(Cn4cccn4)C3)c2n1 2064972186 JDKVVWWKLKGQSB-UHFFFAOYSA-N 326.360 1.148 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](N(C)C)[C@H](O)C2)cc1Br 2089926823 NJKURMXCQGZJMC-BIGNPOOSSA-N 329.238 1.614 10 10 EDCE COc1ccc(N(C)C[C@H](O)CN(C)C)c(OC)c1Br 2234882583 XTJYIVLUOSGXOV-SNVBAGLBSA-N 347.253 1.825 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)CN(C(=O)OC(C)(C)C)[C@@H]1CCOC1 2244946354 BBTOZVUVBWOMRW-LLVKDONJSA-N 327.385 1.781 10 10 EDCE CSc1ncc(CN=c2[nH]nc(SCC(=O)O)s2)s1 2269089772 GJPUSOBBPXSCHT-UHFFFAOYSA-N 334.473 1.927 10 10 EDCE C[C@H]1CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)[C@@H]1CO 2310988525 OUILPAKJLPNHIP-MAUKXSAKSA-N 330.428 1.766 10 10 EDCE NC(=O)[C@H]1CN(c2ccc(CO)c(Br)c2)CC12CC2 2344329698 BLKLRSFAIRKVSO-LLVKDONJSA-N 325.206 1.643 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)CSC)cc2F)CC1 171520299 KBLSUFXKGNZTAH-UHFFFAOYSA-N 325.453 1.947 10 10 EDCE NC(=O)[C@@H]1CCC[C@@H](NC(=O)NCCCSc2nccs2)C1 177833235 OLPPJCMAYVWWAN-GHMZBOCLSA-N 342.490 1.969 10 10 EDCE O=C1/C(=C\c2cc([N+](=O)[O-])ccc2O)SC(=S)N1CCCO 210385352 QVSGGXXBWFLJAC-YRNVUSSQSA-N 340.382 1.884 10 10 EDCE CN1C2(CCC2)COC[C@]1(CO)CN[C@@H]1CCc2cccc(O)c21 527949488 LMGWHXMKDIBXKV-DNVCBOLYSA-N 332.444 1.585 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N3CC(C)(OC)C3)c(Br)cc21 382929834 JJOKIRIUIVWHRH-LBPRGKRZSA-N 340.221 1.887 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@H](C)[C@H]3C)CC2)cc1 815163880 RWTGYYKLLOINNH-JZXOWHBKSA-N 333.476 1.518 10 10 EDCE CN(C)c1ccc(CN2CCN([C@H]3CCNC(=O)CC3)CC2)cc1 825148030 OYPCYEYRCVDFSJ-GOSISDBHSA-N 330.476 1.539 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CC[C@@H](C)N 843489073 CQSWEOLWJATOEJ-SNVBAGLBSA-N 328.796 1.675 10 10 EDCE COc1ccc(O)c(CNC(=O)NC[C@]2(OC(C)C)CCOC2)c1 918745489 MONNGBZYKRSZIR-QGZVFWFLSA-N 338.404 1.784 10 10 EDCE CNC(=O)[C@]1(C(F)(F)F)CCN(C(=O)c2ccc(C)c(O)c2O)C1 844096869 KMGTXSKZKFQAJZ-AWEZNQCLSA-N 346.305 1.547 10 10 EDCE COC(=O)C1CCC(S(=O)(=O)N(C)Cc2ccccc2O)CC1 914145080 NRJDQNZRJXBEAO-UHFFFAOYSA-N 341.429 1.886 10 10 EDCE CC[C@H]1C[C@@H](NCCN2CCN(c3ccc(OC)cc3)CC2)CO1 850091150 ZEVHKMBXZLJJLJ-AEFFLSMTSA-N 333.476 1.974 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2c[nH]nc2[C@H]2CCNC2)c1 852802141 KTHGXWACPUDGME-MNOVXSKESA-N 330.388 1.692 10 10 EDCE COCCOc1cc2c(cc1/C=C1/SC(=S)NC1=O)OCO2 920755274 IFMSQFWGXSIDDH-LFYBBSHMSA-N 339.394 1.929 10 10 EDCE O=S(=O)(NNc1nc2cccnc2s1)c1cnc2n1CCC2 857225518 OCPPPQSHWFWZSP-UHFFFAOYSA-N 336.402 1.139 10 10 EDCE O=C(NCC[S@](=O)CC(F)(F)F)NCc1c(O)cccc1F 923188887 TULQHEODBWMREI-QFIPXVFZSA-N 342.314 1.642 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(C)(O)CC3)C2)cc1 852449625 VDRKZTLDJCUIRV-CQSZACIVSA-N 333.432 1.830 10 10 EDCE COC[C@@H](C)OC(=O)NCc1ccc(N2CCOCC2)c(F)c1 866541814 BFJAEKAEBNMNDW-GFCCVEGCSA-N 326.368 1.923 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@H]2NCC[C@@H]21 866722980 BFRJRRFFYMPLQS-MSOLQXFVSA-N 330.476 1.537 10 10 EDCE C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 897361980 XPJKQTUGJFQRMM-IRWJRLHMSA-N 329.444 1.777 10 10 EDCE CN1CCN(c2ccc(CN[C@@H](CO)C[C@@H](O)C(C)(C)C)cc2)CC1 790618506 IJHMNAGMTHALSF-IEBWSBKVSA-N 349.519 1.686 10 10 EDCE Nc1c(C(=O)NCc2ccc(O)cc2O)cnn1-c1ccccn1 1142532987 BMBOFJKHTJVMIE-UHFFFAOYSA-N 325.328 1.191 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1cc(-c2nn[nH]n2)ccc1F 1161425576 CFBLEAGFQNBFCF-UHFFFAOYSA-N 329.291 1.598 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCS(=O)(=O)C[C@H]1C1CCC1 1469085296 CVPHNKRSJXTNCQ-ZDUSSCGKSA-N 339.413 1.066 10 10 EDCE COc1ccc(C(=O)NCc2ccccc2O)cc1S(C)(=O)=O 1194248216 ZEEBBQCZQHTYLT-UHFFFAOYSA-N 335.381 1.734 10 10 EDCE CCOC(=O)[C@H](C[C@@H]1CCCO1)NC(=O)c1ccc(C)c(O)c1O 1177476341 QFWNXTQOJUUTRD-AAEUAGOBSA-N 337.372 1.637 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)c2cncnc2O)cc1C 1317400429 ZQLGNQASJMFSDW-ZDUSSCGKSA-N 344.415 1.797 10 10 EDCE COC(=O)CCCCNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1322150508 XBIFWERTJRZXLX-ZDUSSCGKSA-N 349.431 1.389 10 10 EDCE NC(=O)C1CCN(c2ccc(CNc3ncc(C=O)cn3)cc2)CC1 1187640043 LFIOWLLPCNKYBB-UHFFFAOYSA-N 339.399 1.603 10 10 EDCE CCc1ocnc1C(=O)NC[C@H](CO)NCc1ccc(OC)c(C)c1 1331685678 SQAXXSHUEMQOMJ-CQSZACIVSA-N 347.415 1.435 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1 1261856601 JOIKSLVFQICWPV-ZIAGYGMSSA-N 334.441 1.562 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CNCc2ccc(O)c(O)c2)C1 1251457871 OJQRVKDALMFBDN-KRWDZBQOSA-N 338.404 1.559 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C(C)(C)NC(C)=O)cc1C 1266898035 XJYQMFIZKZUXEX-UHFFFAOYSA-N 335.448 1.466 10 10 EDCE COc1ccc(CN2CC[C@H]2C(=O)NCc2cccc(O)c2O)cc1 1263895796 GWWZGHXCJDIVER-INIZCTEOSA-N 342.395 1.997 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CCOC1(C)C 1347534809 OTWIDTKXZLQHKL-OAHLLOKOSA-N 347.459 1.609 10 10 EDCE COc1ccc(CNC[C@H](O)CN(C)C(=O)[C@@H]2[C@H]3CCC[C@H]32)cc1C 1278743254 MMDUPQNYJLPRJW-IMBTUZDBSA-N 346.471 1.959 10 10 EDCE CCC(=O)NC[C@H]1[C@@H]2CN(C(=O)c3ccc(N=NC(N)=O)cc3)C[C@H]12 1509614172 YIVXHKBPQODQSN-ZSOGYDGISA-N 343.387 1.693 10 10 EDCE CCOC(=O)[C@](C)(O)CNC(=O)c1cc2cc(O)c(O)cc2s1 1296091929 IXSMRGHEWUWWDA-OAHLLOKOSA-N 339.369 1.356 10 10 EDCE Cn1ccnc1-c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2)n[nH]1 1452414277 OJWAKYQDSVZNRX-HWKANZROSA-N 325.328 1.873 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)C(C)(C)C(N)=O)C(C)C)cc1C 1482535937 IGIYDYIAXAKCDG-OAHLLOKOSA-N 349.475 1.746 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@@H](C)S(C)(=O)=O)cc1C 1491499067 BKSZWXLXOHGPLZ-QWHCGFSZSA-N 342.461 1.031 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)Cc2ncc[nH]2)cc1C 1498633326 NLDHMWANQZPVSG-UHFFFAOYSA-N 330.432 1.908 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@H]2COC(=O)N2)cc1C 1568627110 MOLNPFCBDPGNHA-GXTWGEPZSA-N 335.404 1.096 10 10 EDCE CC(=O)N1C[C@@H](C(=O)NCc2ccc(O)cc2O)Oc2ccccc21 1630302309 XGSGHQOQCUHIFI-KRWDZBQOSA-N 342.351 1.528 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc2nnc(O)n2c1 1640259758 CGXJTMSRQHLXRK-UHFFFAOYSA-N 333.344 1.556 10 10 EDCE CC(C)(C)C(=O)N1CCC[C@H](C(=O)NCc2cc(O)ccc2O)C1 1643879399 OBGILWXQHSISKR-LBPRGKRZSA-N 334.416 1.999 10 10 EDCE Cc1cccc(OC[C@@H](O)CNC(=O)c2c(F)ccc(O)c2O)c1 1650738646 SQVOIWIGXGMVCQ-NSHDSACASA-N 335.331 1.715 10 10 EDCE CCOc1ccc(N2CCN(C(=O)c3ns[nH]c3=O)CC2)cc1 1596732551 DMOCLHWWBQXCFQ-UHFFFAOYSA-N 334.401 1.193 10 10 EDCE O=S1(=O)CC[C@H](CNCc2cc(Cl)cc(Cl)c2O)N1 1965981058 WOHAKIUFZBBJPX-SECBINFHSA-N 325.217 1.480 10 10 EDCE COc1cc(O)c(CN2CCO[C@@H](Cn3cc(C)cn3)C2)cc1OC 160183749 ORMPMXRJHGCJMA-OAHLLOKOSA-N 347.415 1.815 10 10 EDCE COc1ccccc1[C@H](CNC(=O)c1cc(O)c(O)c(O)c1)C(=O)O 1865876068 PMFQCEUONJXQGM-NSHDSACASA-N 347.323 1.410 10 10 EDCE O=C1NC(=O)[C@H](CCCNCc2ccc(Br)cc2O)N1 2150333473 YXOVRQBUGHXBMQ-JTQLQIEISA-N 342.193 1.233 10 10 EDCE CCN(CCCO)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 165208513 NHHUDOSRHOZRTK-GFCCVEGCSA-N 328.210 1.610 10 10 EDCE CN[C@H](C)c1ccc(N2CCOC[C@@H]2CO)c(Br)c1 168243143 OYNPLXMVGQTMMC-PWSUYJOCSA-N 329.238 1.927 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010393342 QYZNBINZIDTOOR-VXGBXAGGSA-N 341.412 1.811 10 10 EDCE OC[C@H]1CN(c2ccc(CNC3CC3)c(Br)c2)C[C@@H]1O 316630889 ZJCRODJUNFVJHA-ABAIWWIYSA-N 341.249 1.491 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3COC[C@@H](C2)C3O)c(Br)c1 2167790664 AAZJOKLLIZPUBA-KSAAVIKPSA-N 341.249 1.912 10 10 EDCE CN1C(=O)N[C@H]2CN(c3ccc(CO)c(Br)c3)CC[C@@H]21 2171297999 SZWMSDPIKDSVCG-STQMWFEESA-N 340.221 1.544 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC(O)(C(F)F)C3)c(Br)cc21 2172118732 SXZRIITZEXCKBD-VIFPVBQESA-N 348.147 1.217 10 10 EDCE C[C@]1(CO)COCCN(c2cc(Br)c(CN)cc2F)C1 2199846538 WSOAGRYLWSBGCC-AWEZNQCLSA-N 347.228 1.882 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1C[C@@H](N)C[C@@H](O)C1 2111819716 PEMADUPPJGVJIK-DMDPSCGWSA-N 329.238 2.000 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])C1 2213583568 TZWKPMIUBKWDBF-FIXISWKDSA-N 339.396 1.706 10 10 EDCE Cc1ncnc(NC(=O)c2cc(O)nc(O)c2)c1Br 2230190786 CESLMLYAAVJORB-UHFFFAOYSA-N 325.122 1.606 10 10 EDCE O=C(O)CCNC(=O)CN1C(=O)C(=Cc2ccco2)SC1=S 2294872121 VCHKLIYEJPWSGC-UHFFFAOYSA-N 340.382 1.072 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(Br)c1 2355334494 OWCRJFDWJUDZFB-SDJAHQOYSA-N 341.249 1.489 10 10 EDCE CN1CCCC[C@@H]1CN1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1 171933610 SLNZDOBAKYXOBI-QGZVFWFLSA-N 348.447 1.902 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2357586326 XIFMLNQOXXTTIK-BHGZDDGQSA-N 342.233 1.823 10 10 EDCE Cc1cnn(Cc2cc(C(=O)NCCc3ccc(O)c(O)c3)no2)c1 122803045 CVIQMVXWMKFUSG-UHFFFAOYSA-N 342.355 1.612 10 10 EDCE Cc1noc(COCC(=O)NCc2ccc3c(c2)CCCN3C)n1 74536815 TZXSTFKOWQBCGC-UHFFFAOYSA-N 330.388 1.593 10 10 EDCE COC[C@H](C)C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 188122073 VASGEMCIVRCAPI-AWEZNQCLSA-N 333.432 1.254 10 10 EDCE CCn1cc([N+](=O)[O-])c(C(=O)N2CCOc3cc(N(C)C)ccc32)n1 191646388 XTVKMSIXZWVDKT-UHFFFAOYSA-N 345.359 1.916 10 10 EDCE CC(=O)C(=O)COC(=O)c1sc(Br)cc1[N+](=O)[O-] 808542880 KAYOQXVPXAJEJI-UHFFFAOYSA-N 336.119 1.734 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CN(C)C(=O)[C@H]1C 826979255 KKSXVMHUDUYFGM-UONOGXRCSA-N 332.448 1.822 10 10 EDCE Cc1nccc(N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)n1 588456150 DTBWGMFEMUHKKG-HYXAFXHYSA-N 340.383 1.558 10 10 EDCE CCN(C)C(=O)CNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588513544 ZJEVVIVRGBZHTE-TWGQIWQCSA-N 331.416 1.131 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](C)C[C@H](CO)C3)C2)cc1 854296867 HEGXBIGMZHUKCR-JYJNAYRXSA-N 347.459 1.934 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 855232509 RIEULVRNYCVASQ-GFCCVEGCSA-N 345.359 1.195 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CCC4(COC4)C3)C2)cc1 854188033 VCLYXGWKNPWYEK-OAHLLOKOSA-N 345.443 1.953 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(CCO)CC3CC3)C2)cc1 854298301 ZZLAEDJVQVMQKR-HNNXBMFYSA-N 333.432 1.688 10 10 EDCE COC(=O)c1cc(S(=O)(=O)N2Cc3cccc(O)c3C2)c(C)o1 867690172 BLYZMQZNRHZBNL-UHFFFAOYSA-N 337.353 1.785 10 10 EDCE C[C@@H](NC(=O)CC[C@@H]1CC[C@H](C(N)=O)O1)c1ccc(N(C)C)cc1 867504480 WMQAASXRKGRZHI-UHOFOFEASA-N 333.432 1.743 10 10 EDCE Cc1ccc([C@H](C)NC[C@]23COCCN2C(=O)COC3)c(O)c1C 866551834 CRSDPLUSPKYHBD-KBXCAEBGSA-N 334.416 1.287 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](O)[C@@H](C)O)c2C)cc1 871125414 NGZNJQAXCDPFCB-CXAGYDPISA-N 332.400 1.574 10 10 EDCE C[C@H](NC(=O)N1CCN2CCOC[C@H]2C1)c1ccc(N(C)C)cc1 776244166 FKWVWIBSJWYOPS-WMLDXEAASA-N 332.448 1.540 10 10 EDCE NC(=O)[C@@H]1C[C@@H](O)CN1Cc1cc(Cl)cc(Br)c1O 895370345 CPSZXXKJGVEEKD-SCZZXKLOSA-N 349.612 1.229 10 10 EDCE COC(=O)c1c(CNC[C@]2(O)CCN(C)C2)c2cc(F)ccc2n1C 894469655 OUMZIPMCAXLUSE-GOSISDBHSA-N 349.406 1.260 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccnc2c1CC(=O)N2 1154027397 ULHZHOHLKQNGIU-SECBINFHSA-N 327.340 1.348 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(C=O)[nH]1 1162539718 LUOOCDNJAWBCMR-UHFFFAOYSA-N 330.340 1.738 10 10 EDCE CCN(OC)C(=O)CNC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1312915888 KNHQMIIHVUSCQI-UHFFFAOYSA-N 348.447 1.838 10 10 EDCE CN(C(=O)Cc1ccc(O)c(O)c1)C1CN(C(=O)OC(C)(C)C)C1 1160265488 CHGQVUAYRDDLII-UHFFFAOYSA-N 336.388 1.718 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)NCC[C@@H]1CC1(F)F 1331078132 QEFIMWWRHAFGKI-SECBINFHSA-N 349.428 1.903 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H](C)c2ccco2)cc1C 1725545634 UJVNIIJILNPJJS-HOCLYGCPSA-N 346.427 1.967 10 10 EDCE CCOCC(=O)N[C@@H](CC)CNC(=O)c1ccc(N=NC(N)=O)cc1 1721478905 IHTNDVAMTUBHQK-LBPRGKRZSA-N 349.391 1.510 10 10 EDCE COc1ccc(CNC[C@H](NC(=O)c2cnon2)C2CC2)cc1C 1498847826 VUUCKROAAOAHDU-AWEZNQCLSA-N 330.388 1.685 10 10 EDCE C[C@H](O)CNC[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1567155330 OTGBEZLGDRZVHO-NWDGAFQWSA-N 333.392 1.282 10 10 EDCE C[C@@H](Sc1ccccc1C(=O)NCc1ccc(O)cc1O)C(N)=O 1639444286 FSSOJTMXYDCTGM-SNVBAGLBSA-N 346.408 1.994 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCC[C@H](c2nn[nH]n2)C1 1566693086 JIQXSXKJGHOGQI-QMMMGPOBSA-N 345.384 1.845 10 10 EDCE C[C@@H](O)CNC1(CNC(=O)c2ccc(N=NC(N)=O)cc2)CCC1 1733728503 YSZGHGMLMCQGDP-LLVKDONJSA-N 333.392 1.472 10 10 EDCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)[C@H]2CC23CC3)cc(OC)n1 1572305259 RIUCILYWVXAHCR-DGCLKSJQSA-N 347.415 1.476 10 10 EDCE Cc1nc2ccccc2c(=O)n1CC(=O)NCc1c(O)cccc1F 1646033722 CGVDRDUADMUWRF-UHFFFAOYSA-N 341.342 1.866 10 10 EDCE CCOC(=O)C[C@H](NC(=O)Cc1ccc(O)c(O)c1)C(F)(F)F 1640926800 NWBSLUNQVMTGKZ-NSHDSACASA-N 335.278 1.641 10 10 EDCE COC(=O)c1cccc(NC(=O)CN[C@@H](C)c2ccccc2O)n1 1654532357 PLNMNXONFUGEID-NSHDSACASA-N 329.356 1.863 10 10 EDCE COCC(=O)NC[C@@H]1CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1759029423 AIAVBWPIVXWHRU-ZDUSSCGKSA-N 347.375 1.216 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@H](C)SC)cc(OC)n1 1758771297 BMJQKBJICKFEBX-ZJUUUORDSA-N 341.433 1.085 10 10 EDCE COc1ccc(/C=C2\SC(=S)N(CCO)C2=O)c(OC)c1 16904857 RZDKSBQMTZEQKW-GHXNOFRVSA-N 325.411 1.897 10 10 EDCE CN[C@H](C)c1ccc(N2CC(OCC(N)=O)C2)cc1Br 2145378329 XVIZKKYSJMMJJY-SECBINFHSA-N 342.237 1.420 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CCC(N=[N+]=[N-])CC1 2010406765 YSDPMPSWBRGETN-SNVBAGLBSA-N 340.384 1.056 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010389391 PGDSEUPCSDKLQS-GFCCVEGCSA-N 341.412 1.907 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC[C@@H]1CN=[N+]=[N-])C(C)(C)O 2014482261 HXPYTMSPPQGFBV-GHMZBOCLSA-N 341.412 1.952 10 10 EDCE CN1CCN(C(=O)c2c[nH]nc2[C@@H]2CCNC2)c2ccc(F)cc21 2062486724 ZAZGIVOORXIDNJ-LLVKDONJSA-N 329.379 1.722 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@@H](O)C2(C)C)c(Br)c1 2181207164 OFTUBUQTASMXJS-UONOGXRCSA-N 343.265 1.879 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CNC(=O)Cc2ccc(N)cc2)C1 2044205548 ACGGMIDHESMTLW-HIFRSBDPSA-N 349.431 1.155 10 10 EDCE CC(C)NCc1ccc(N2CC[C@@H](O)[C@@H](O)C2)c(Br)c1 2188625973 BAQIQMJIKMZBET-CABCVRRESA-N 343.265 1.879 10 10 EDCE O=S1(=O)CC[C@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]21 2088814981 MYNBUMLLEPOVNO-ZANVPECISA-N 346.246 1.774 10 10 EDCE CNC(=O)[C@H]1[C@H](C)CCN1c1ccc(CO)c(Br)c1 2090261514 ICJBCGBGEMGBJM-NOZJJQNGSA-N 327.222 1.902 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](COc2nnc(=N)[nH]n2)CC1 2213788304 WAHTXIMCAPUWKX-XYPYZODXSA-N 338.412 1.389 10 10 EDCE O=C(O)COc1ccccc1C=C1SC(=S)N(CCO)C1=O 2294874634 LAGDFFNSMVMFFO-UHFFFAOYSA-N 339.394 1.344 10 10 EDCE CN1CCN(C2=NC(=O)C(=C3C(=O)N(C)c4ccccc43)S2)CC1 2297325742 XOHMPPVFGVYPFH-UHFFFAOYSA-N 342.424 1.251 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1 2300530672 UUOLSHHZCBUVNI-NWDGAFQWSA-N 339.396 1.730 10 10 EDCE Cc1ccc(CN2C[C@@H]3NC(=O)O[C@H]3C2)c(O)c1Br 2352601816 OQCJVTHXEIGYQP-UWVGGRQHSA-N 327.178 1.756 10 10 EDCE COCc1cc(N[C@@H](C)Cc2ccc(O)c(O)c2)n2ncnc2n1 183599660 DROYTSQOUWKKMQ-JTQLQIEISA-N 329.360 1.725 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)cc1 325835565 BAMSNJAAPKHATC-FRQCXROJSA-N 331.460 1.901 10 10 EDCE CCc1cc(O)ccc1NS(=O)(=O)c1cc(C(=O)NC)n(C)c1 276805815 FIPCKMMSADCAGV-UHFFFAOYSA-N 337.401 1.454 10 10 EDCE COc1cc(O)c(CN[C@H](C)C2(S(C)(=O)=O)CC2)cc1OC 809703155 GEVFKZWIMDPWGR-SNVBAGLBSA-N 329.418 1.465 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NC1CCN(c2ccc(OC)cc2)CC1 826962349 DGHMPMUPFJRFHQ-DLBZAZTESA-N 334.416 1.584 10 10 EDCE COc1c(Br)ccc(F)c1C(=O)OCC(=O)C(C)=O 830554756 VUFPUDKHLLMWLT-UHFFFAOYSA-N 333.109 1.912 10 10 EDCE CN(C)c1ccc(/C=C/CN2CCC[C@H](N3CCNCC3=O)C2)cc1 843063365 ABDHNHMPXMQJDY-JUGMSXHOSA-N 342.487 1.662 10 10 EDCE CCCNCCNC(=O)NCc1cc(Br)ccc1O 841965435 TWNCBUZLHDADPN-UHFFFAOYSA-N 330.226 1.954 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)C[C@H](C)NC(N)=O)C2)cc1 848229188 KUVUPDANRLQAOX-QWHCGFSZSA-N 334.420 1.085 10 10 EDCE CCc1nc[nH]c1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 912709427 LBDLISZFNGSIID-UHFFFAOYSA-N 328.416 1.863 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)C34CCN(CC3)C4)C2)cc1 911277028 RIVWMPKVLIRRLS-HNNXBMFYSA-N 329.444 1.734 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2C[C@H]3CC[C@H]2[C@H](CO)C3)cc1 852775497 WHRHEZCNJMCQDD-BQFCYCMXSA-N 331.460 1.462 10 10 EDCE C[C@@H]1CCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 920043365 HCPCPGWDQGQYKI-HIFRSBDPSA-N 330.432 1.692 10 10 EDCE CSc1ccccc1C(=O)N1CCS(=O)(=O)C[C@@H]1CCO 928508655 ATWBOBPMLXUMRO-NSHDSACASA-N 329.443 1.030 10 10 EDCE CC[C@@H](NC1CN(S(=O)(=O)N(C)C)C1)c1ccc(C)cc1O 858572256 RGBXYQSVCMYZBY-CQSZACIVSA-N 327.450 1.232 10 10 EDCE COCc1n[nH]c(CNC(=O)NCc2ccc(N3CCCC3)cc2)n1 853412319 YCOWTYBLCWGUPE-UHFFFAOYSA-N 344.419 1.551 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H](O)CC[C@H]3C)C2)cc1 852448162 HAMGFWKPKYOZBF-IJEWVQPXSA-N 333.432 1.829 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1c(C)cc(C)nc1=O 935947923 HXSFTWYFXSVCSR-UHFFFAOYSA-N 336.388 1.368 10 10 EDCE CO[C@H]1CCn2cc(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)nc2C1 867302548 RHGAGQHLJOWDGW-AAEUAGOBSA-N 345.399 1.617 10 10 EDCE CN(C)c1ccc(CNC(=O)N2C[C@H]3[C@H]4CC[C@@H](NC4)[C@H]3C2)cc1 861549412 HYWKEKXLGYQNLW-LEUOFYLZSA-N 328.460 1.892 10 10 EDCE OCc1nnc2n1CCN(Cc1cc(Br)ccc1O)C2 769514743 BDPOTHPVTVJMPW-UHFFFAOYSA-N 339.193 1.254 10 10 EDCE C[C@@H](NCCn1cc(Br)nn1)c1c(O)cccc1O 1878208540 SJIWDVLHDIJPPX-MRVPVSSYSA-N 327.182 1.803 10 10 EDCE COc1cccc(CNC(=O)c2cc(C)n(NC(N)=O)c2C)c1O 1137473502 LOQYJHIAMOPSJF-UHFFFAOYSA-N 332.360 1.371 10 10 EDCE Cc1cccc(OC[C@H](O)CNC(=O)Cc2ccc(O)c(O)c2)c1 1149569181 BBJCOEJTZUABQJ-CQSZACIVSA-N 331.368 1.505 10 10 EDCE O=C(CNC(=O)c1cc(F)cc(F)c1)NCc1cc(O)ccc1O 1303225496 JLMOCUFHQJQLDF-UHFFFAOYSA-N 336.294 1.422 10 10 EDCE COC1=C(C(=O)O)NC(=S)N[C@H]1c1ccc(N2CCCC2)cc1 76260609 KDYOLVVRBVPTHI-LBPRGKRZSA-N 333.413 1.748 10 10 EDCE COCCN(CC1CCN(C)CC1)C(=O)Cc1ccc(O)c(O)c1 1170686784 MLDMBVGGFJRLSH-UHFFFAOYSA-N 336.432 1.457 10 10 EDCE CCOC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1325651865 XGMFRUVWGDVDLR-AWEZNQCLSA-N 333.432 1.444 10 10 EDCE CCn1ncc(C(=O)N(C)C[C@H](C)NCc2ccc(OC)c(C)c2)n1 1507074653 KTTLSCUIPMLILT-AWEZNQCLSA-N 345.447 1.865 10 10 EDCE Cc1ccc(-c2nnn(CC(=O)NCc3c(O)cccc3F)n2)cc1 1456094313 QXBSXUXWFHVXTM-UHFFFAOYSA-N 341.346 1.810 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3NC(=O)O[C@@H]3C2)c(Br)c1 2120405829 NVYPCSUYCIWANM-INNHCVQGSA-N 326.194 1.766 10 10 EDCE C[C@@H]1CN(c2ccc(CN)cc2Br)C[C@H](CCO)O1 2122800136 OWYSZVCWXIGQOR-PWSUYJOCSA-N 329.238 1.884 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@@H]1Cc2cc(F)ccc2NC1=O 1622664048 DTOBHPWAGCYSKT-LBPRGKRZSA-N 330.315 1.664 10 10 EDCE Cn1cc(C[C@H]2CCC[C@@H]2NC(=O)Cc2ccc(O)c(O)c2)cn1 1629623390 IMCDEUVSBUVCDS-CABCVRRESA-N 329.400 1.901 10 10 EDCE CC(=O)N1CCc2cc(C(=O)NCc3c(O)cccc3O)ccc21 1558534672 WNJHDKCBISVEAF-UHFFFAOYSA-N 326.352 1.937 10 10 EDCE CC1(C)CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1NCCCO 1734507674 NQYZDKSUHXWDRS-CQSZACIVSA-N 347.419 1.672 10 10 EDCE Nc1nnc([C@H]2CCCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)o1 1641506949 KLHSUUMOGRUSCX-MALLOTDXSA-N 330.344 1.482 10 10 EDCE C[C@H](NC(=O)c1cc(S(N)(=O)=O)c(Cl)o1)c1ccccc1O 1643745223 IZBVTFRDBAIFDW-ZETCQYMHSA-N 344.776 1.777 10 10 EDCE CN1C[C@@H](N(C)c2cc(Br)c(CN)cc2F)CC1=O 2131951738 DSAGIEGMZGBQKQ-VIFPVBQESA-N 330.201 1.714 10 10 EDCE CC[C@H](c1cc(Br)ccc1O)N1C[C@@H](O)C[C@@H]1CN 2131042473 ZWARYJRLDOVZSF-NTZNESFSSA-N 329.238 2.000 10 10 EDCE COC(=O)C1CCN(C(=O)CCNCc2cc(C)ccc2O)CC1 1857864495 REYGZASLSYSUQV-UHFFFAOYSA-N 334.416 1.592 10 10 EDCE OC[C@H]1CN(c2ccc(CNC3CC3)c(Br)c2)CCO1 236501147 BZMZUQXHGNVEIX-CQSZACIVSA-N 341.249 1.899 10 10 EDCE CCNCc1ccc(N2CC(OCC(N)=O)C2)c(Br)c1 2145377136 KETAFPVXMWCFNK-UHFFFAOYSA-N 342.237 1.249 10 10 EDCE CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985096825 WZCZAUCWQYTTCX-VWYCJHECSA-N 327.385 1.826 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C2(CC2)C1 2003171538 XVRRENOQULDYNB-AVGNSLFASA-N 336.432 1.899 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(=O)NCC2(CN=[N+]=[N-])CC2)COC1 2010402217 NSWAMFPJZOJPJB-UHFFFAOYSA-N 339.396 1.829 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1CC(=O)N1CC[C@H](N=[N+]=[N-])C1 2014442305 LSRPZKLPWOWFGT-GRYCIOLGSA-N 339.396 1.827 10 10 EDCE CO[C@@H](C)CN(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 387954163 NEOMXADIUWJUHS-JVXZTZIISA-N 328.210 1.872 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)cc1Br 2182553213 KPPRLZPSHLZPNP-TXFSYDTDSA-N 341.249 1.647 10 10 EDCE CCNCc1ccc(N(C)[C@H]2CC(=O)NC2=O)cc1Br 2171191628 AXLWZAGPXBTZNK-LBPRGKRZSA-N 340.221 1.410 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](C(=O)NCc2ccc(N)cc2)C[C@@H](O)C1 2080781004 ZZCOKJDYZLMEIB-DZGCQCFKSA-N 349.431 1.503 10 10 EDCE C[C@@H](N)c1ccc(N2CCOC[C@@H](CO)C2)cc1Br 2098209434 SBFSBFFATFNANT-GHMZBOCLSA-N 329.238 1.914 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](CO)C[C@@H](CO)C2)c(Br)c1 2236633653 RCHZCWDGGKWHCR-QJPTWQEYSA-N 343.265 1.896 10 10 EDCE O=C(O)[C@@H]1CCOCCN1Cc1cc(Br)cc(F)c1O 2285385673 FCFZSRUKDZPHTM-NSHDSACASA-N 348.168 1.969 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(n4ccnc4)CC3)cc2N1 301623139 OMWLKYCMBBFFML-UHFFFAOYSA-N 343.343 1.964 10 10 EDCE Cc1noc(COCC(=O)NCc2ccc(N3CCCC3)cc2)n1 74692850 CTEHSLCZNPUFBL-UHFFFAOYSA-N 330.388 1.811 10 10 EDCE C[C@@H](Cn1cncn1)NC(=O)NCc1ccc(N2CC=CC2)cc1 126678563 WQMQKLMHXAGVPF-AWEZNQCLSA-N 326.404 1.542 10 10 EDCE COc1cccc(CN2CCN([C@@H](C)c3nc(C)no3)CC2)c1O 121312999 ABFLWQYVKIYMHT-LBPRGKRZSA-N 332.404 1.971 10 10 EDCE CCSc1nc2c(c(=O)[nH]1)[C@@H](c1ccc(O)c(O)c1)CC(=O)N2 96515405 JUHDZXNXIMTDAQ-MRVPVSSYSA-N 333.369 1.767 10 10 EDCE CN(CC(=O)NC1CC1)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255416831 GSKUQNVKSLCIQF-WTKPLQERSA-N 343.427 1.273 10 10 EDCE CCn1nccc1S(=O)(=O)NCc1ccc(N(C)C)c(F)c1 274421677 CCFYEEPYIDXWAS-UHFFFAOYSA-N 326.397 1.587 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CNC[C@@H](O)C2)c(O)c1Br 2380745312 OQYJPCRBNZWOAL-QWRGUYRKSA-N 343.221 1.050 10 10 EDCE CNC(=O)C1CN(c2ccc(/C=C\C(=O)O)c(Br)c2)C1 381877899 CVAMYYCSQJKZDT-HYXAFXHYSA-N 339.189 1.729 10 10 EDCE Cc1cc(O)c(CN[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)cc1C 808424505 ISSLRVGWQOIOMH-OAHLLOKOSA-N 341.477 1.369 10 10 EDCE Cc1c(Br)cc(CN)c(O)c1CN1CCN(C)CC1 642879929 FGPDCYZSBISVOV-UHFFFAOYSA-N 328.254 1.669 10 10 EDCE CNC(=O)c1ccc(NC[C@H]2CCN(c3ccc(OC)cc3)C2)nn1 819934475 FUARDLISQOZKJV-CYBMUJFWSA-N 341.415 1.783 10 10 EDCE CN(C)CC1(O)CCN(c2ccc(CO)c(Br)c2)CC1 710607262 NEQAYLWXVHGVIK-UHFFFAOYSA-N 343.265 1.834 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1CCNC(=O)CC1 819698551 NFPCOPCLQAMXEJ-ZDUSSCGKSA-N 348.399 1.200 10 10 EDCE COC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(N2CCN(C)CC2)cc1 827843659 GCOTXKUWEOYUCC-MSOLQXFVSA-N 331.460 1.870 10 10 EDCE Cc1cc(Cl)cc([C@H](C)NC[C@]2(CO)COCCN2C)c1O 903281292 XLMGIZUYAVIJMP-LRDDRELGSA-N 328.840 1.698 10 10 EDCE COc1ccc(O)c([C@H](C)NS(=O)(=O)[C@@H]2CCO[C@@H](C)C2)c1 830623333 KSBMZXWJPFUCRX-GMXVVIOVSA-N 329.418 1.949 10 10 EDCE COc1ccc(O)c(CNC(=O)NC[C@]2(OC)CCSC2)c1 918745179 FGZVZPKTTLIOHI-OAHLLOKOSA-N 326.418 1.722 10 10 EDCE COC1(CS(=O)(=O)NCc2cc(Cl)ccc2O)CCOCC1 845995874 IKSKCGKSLLLBAG-UHFFFAOYSA-N 349.836 1.661 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](C)Cn1cncn1 840276161 AFLXSEJFHOJNMI-HUUCEWRRSA-N 344.463 1.971 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CC[C@]3(CCCNC3)C2)cc1 844224632 RYFBTTYWYFSNPE-IBGZPJMESA-N 330.476 1.444 10 10 EDCE COC(=O)C(C)(C)n1ccc(NC(=O)c2ccc(C)c(O)c2O)n1 855897932 TWSSRLYIKKUHKP-UHFFFAOYSA-N 333.344 1.763 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cccn(C)c3=O)C2)cc1 855229354 JEASMRNWXASDNO-ZDUSSCGKSA-N 327.384 1.403 10 10 EDCE COc1ccc(N(C)CCN(C)C[C@@H]2CCCS2(=O)=O)cc1 930850881 ZFOVRYZEBMYWKL-INIZCTEOSA-N 326.462 1.640 10 10 EDCE Cc1ccc(/C=C2/SC(=S)N(CCN3CCOCC3)C2=O)cn1 764890888 FLQRAFKNRQRVQG-GXDHUFHOSA-N 349.481 1.923 10 10 EDCE CC(=O)NC1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761887424 YHDYBBCNOYFAEM-UHFFFAOYSA-N 334.332 1.031 10 10 EDCE COC(=O)c1cc(OCC(=O)Nc2cc(C)no2)ccc1N(C)C 865395963 GXXXFTNGSAODQR-UHFFFAOYSA-N 333.344 1.853 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3C[C@H]3C(C)C)nc12 772509554 WSUXEUFIRKETTH-RYUDHWBXSA-N 347.371 1.947 10 10 EDCE C[C@@H]1C[C@H](NCc2ccc(N3CCN(C)CC3)c(F)c2)c2ncnn21 1118484067 BTZWDAIXGALWJA-CJNGLKHVSA-N 344.438 1.965 10 10 EDCE COC(=O)[C@@H](NCc1cc(Cl)cc(F)c1O)c1ccn(C)n1 787439071 ZTSULGQDMDRHLH-LBPRGKRZSA-N 327.743 1.922 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@H]1CC(c2ccccn2)=NO1 1137464593 HCWNWBYMHHXFER-MRXNPFEDSA-N 327.340 1.345 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)CCCn2c(O)nnc2O)c1 1137473706 SDZDPSIKOHGMJF-SECBINFHSA-N 336.348 1.061 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1[C@H]2COC[C@H]21 792882218 POFYTBKQEVBFTQ-HALDLXJZSA-N 349.406 1.231 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCS(=O)(=O)C[C@@H]1C1CCC1 1469085295 CVPHNKRSJXTNCQ-CYBMUJFWSA-N 339.413 1.066 10 10 EDCE CC(C)(C)C(=O)Cn1cc(C(=O)NCc2c(O)cccc2O)nn1 1178910735 HKPHDRNTMLLXEE-UHFFFAOYSA-N 332.360 1.235 10 10 EDCE CN1CC[C@H](N(C)c2cc(Br)c(CN)cc2F)C1=O 690232537 JMAUAGYTERJBEZ-NSHDSACASA-N 330.201 1.714 10 10 EDCE NCc1ccc(N2CC[C@@H](CC(N)=O)C2)c(F)c1Br 690772650 RTKLHEZSPITLLZ-QMMMGPOBSA-N 330.201 1.749 10 10 EDCE O=C(O)[C@@H]1CO[C@H](CNCc2c(O)cccc2Br)C1 714016159 OKGBHAOKZBGHSE-IUCAKERBSA-N 330.178 1.734 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1 1261856599 JOIKSLVFQICWPV-KGLIPLIRSA-N 334.441 1.562 10 10 EDCE C[C@](CNCCO)(NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1267865693 YJXGVCQXHDKDGZ-MRXNPFEDSA-N 333.392 1.329 10 10 EDCE O=C(CCn1cnnn1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1350628687 KSVKSCPOEHMMAJ-UHFFFAOYSA-N 347.334 1.477 10 10 EDCE C[C@H]1C[C@H](C(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)CO1 1283079814 YJDLMNWMHPIWID-JQWIXIFHSA-N 347.375 1.120 10 10 EDCE COCC(=O)N[C@H]1C[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1514867073 XOYHAGHMJWKDEP-GSJFWJNXSA-N 347.375 1.120 10 10 EDCE COC[C@H](C)C(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1295441842 AXCCUAMIHKMZOJ-QWRGUYRKSA-N 349.391 1.366 10 10 EDCE CCOc1ccc(N2CCN(C(=O)c3ccc(CO)nc3)CC2)cc1 1295275153 HRPWAXQBOAGQFM-UHFFFAOYSA-N 341.411 1.935 10 10 EDCE COC1(OC)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1O 1452119368 SFGWXQOACQQHKK-LBPRGKRZSA-N 336.348 1.045 10 10 EDCE Cc1cc(CC(=O)OC[C@H]2OCCNC2=O)c(C)n1-c1ccccc1 1526568590 IJBPCSJLIMVKLX-QGZVFWFLSA-N 342.395 1.695 10 10 EDCE C=CCOCC(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1705140750 SPFGYVOMQSCYPS-NSHDSACASA-N 347.375 1.286 10 10 EDCE O=C(NCc1cc(O)ccc1O)C1(S(=O)(=O)c2ccccc2)CC1 1558174243 IBTFFZDOUGGTHP-UHFFFAOYSA-N 347.392 1.721 10 10 EDCE CCCn1cc(C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)nn1 1716416878 AMMREUXHIXJHDA-CQSZACIVSA-N 345.447 1.913 10 10 EDCE O=C1C[C@@](C(=O)NCc2c(O)cccc2F)(c2ccccc2)CN1 1635367103 ZAOXREVDPHRFME-SFHVURJKSA-N 328.343 1.605 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)c2cnc(O)n2C)cc1C 1568898435 MESYBSMAMDHDFX-SNAWJCMRSA-N 344.415 1.519 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cc3cnn(C)c3)CC2)cc1C 1569393140 HANSRPATYKQEBF-UHFFFAOYSA-N 342.443 1.718 10 10 EDCE CCCNC(=O)COc1cn(Cc2ccc(N)cc2)c(C)cc1=O 1857915066 DTMILRAMZAXIQL-UHFFFAOYSA-N 329.400 1.692 10 10 EDCE CO[C@H]1C[C@@H](C(=O)O)N(Cc2c(O)cccc2Br)C1 2136357818 OIIJXTKDLHQKSU-KWQFWETISA-N 330.178 1.829 10 10 EDCE CCNCc1ccc(N2CCOC[C@H]2CO)c(Br)c1 233532128 AXZGFVBPXAREFX-GFCCVEGCSA-N 329.238 1.756 10 10 EDCE CNCc1ccc(N2CCN3C(=O)NC[C@@H]3C2)c(Br)c1 234430270 NCZDKPBYHBRHGB-LLVKDONJSA-N 339.237 1.382 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCOC[C@H]1NCc1ccc(O)c(O)c1 1943954299 FPVDOSVAUIQHCK-CHWSQXEVSA-N 338.404 1.870 10 10 EDCE CO[C@H](CN)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951695563 IYFUXVRLAAWSQF-BXUZGUMPSA-N 326.393 1.507 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@]1(C)CC(=O)N1 1952208959 PBCSRURWBNWKRI-GUYCJALGSA-N 336.388 1.812 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(CCc2ccc(N)cc2)C1 2002704907 XMZYJJGWDIZJHK-CVEARBPZSA-N 335.448 1.771 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CO1 2010388560 DAZNJQIBZMBFQE-UTUOFQBUSA-N 339.396 1.827 10 10 EDCE C[C@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)N1CC(NC(=O)OC(C)(C)C)C1 2014687018 UBIIKVIWFSDURT-GHMZBOCLSA-N 338.412 1.495 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNCc2ccc(F)cc2O)C1 2024897320 HKFQVWDQQOEIMW-IUODEOHRSA-N 340.395 1.849 10 10 EDCE CC(C)NCc1ccc(N2C[C@@H](O)C[C@H](O)C2)c(Br)c1 2161357848 UHMLBZZUXTWSRZ-STQMWFEESA-N 343.265 1.879 10 10 EDCE CN1CCc2cc([C@@H](NN)c3ncc(Br)cn3)ccc21 2163161745 ZPPPMJSEYXDFOS-CYBMUJFWSA-N 334.221 1.784 10 10 EDCE C[C@H]1COCCN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 399073724 PLZYSTNKCUPMGT-OQPBUACISA-N 340.221 1.874 10 10 EDCE CCNCc1ccc(N2CCOC[C@@H](O)C2)c(Br)c1 399952831 VYNNWDGAFXXRLB-LBPRGKRZSA-N 329.238 1.756 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCC(C)(C)c3ccccn3)c2n1 2062307865 LHIIEHGDXBSVLO-UHFFFAOYSA-N 325.372 1.846 10 10 EDCE O=C(CC1CC(=O)NC(=O)C1)NCc1c(O)ccc2ccccc12 2064053866 XIEMPKYQJRCYAF-UHFFFAOYSA-N 326.352 1.605 10 10 EDCE CNCc1ccc(N2CC(N3CCOCC3)C2)c(Br)c1 2169512240 PODWOQQKVXGKTG-UHFFFAOYSA-N 340.265 1.689 10 10 EDCE OCc1ccc(N2C[C@@]3(CO)C[C@]3(CO)C2)cc1Br 2090117380 WCHXTNPXUGUHBU-ZIAGYGMSSA-N 328.206 1.123 10 10 EDCE NCc1ccc(N2CC[C@H]3CS(=O)(=O)C[C@@H]32)c(Br)c1 2094931691 VAWVXERABSFYFM-GWCFXTLKSA-N 345.262 1.531 10 10 EDCE C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2210536658 HWQWDABXWCNVRP-LMLFDSFASA-N 327.385 1.608 10 10 EDCE CCCn1nnnc1CNCc1cccc(Br)c1O 2113073914 WXIRPXCDICLJCR-UHFFFAOYSA-N 326.198 1.841 10 10 EDCE COc1ccc(Br)c(CNCCCn2cnnc2)c1O 2208733939 QKCUYVVNQDNPQZ-UHFFFAOYSA-N 341.209 1.935 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)c(Br)c1 2355338497 BVUPWACLWUUMEU-BHGZDDGQSA-N 342.233 1.823 10 10 EDCE CC[C@H](C)[C@@H](NC(N)=O)C(=O)NCc1ccc2c(c1)CCCN2C 57558777 IKASLCGGSYTVSV-BLLLJJGKSA-N 332.448 1.768 10 10 EDCE Cc1nc(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)no1 175675093 AGXXYBJVUJOGHO-UHFFFAOYSA-N 349.366 1.353 10 10 EDCE CCS(=O)(=O)C1=NN2C(=N)/C(=C\c3ccco3)C(=O)N=C2S1 20208258 ASDIMGSFIAFMRG-YOULEHPWSA-N 338.370 1.291 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@@H](O)C(F)(F)F 121594305 KPFXELKDEFRANN-LLVKDONJSA-N 341.713 1.944 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCCn1ccnn1 182468463 NMTZRQIVAOJREG-UHFFFAOYSA-N 330.436 1.966 10 10 EDCE OCCn1nccc1C1CCN(Cc2cc3c(cc2O)OCO3)CC1 92811362 GLTJXXKSBSGZPY-UHFFFAOYSA-N 345.399 1.689 10 10 EDCE Cc1nn(C)c(C)c1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 271183253 CYEMJPLSXKWCOG-UHFFFAOYSA-N 338.389 1.366 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCC(c3nc(=O)[nH][nH]3)CC2)c1O 281122313 XSDOMQKINPQUGD-UHFFFAOYSA-N 334.351 1.525 10 10 EDCE CC(=O)C(=O)COC(=O)c1sccc1S(=O)(=O)C(F)F 808516984 TZQYSDBLQQPUSF-UHFFFAOYSA-N 326.298 1.059 10 10 EDCE C=CC(=O)NCCC(=O)NCc1cc(Br)ccc1O 804734254 GRIQOPXANCAJHB-UHFFFAOYSA-N 327.178 1.463 10 10 EDCE Cc1cc(C(=O)N2CC3(CNC(=O)O3)C2)c(C)n1-c1ccccn1 817681633 BXWDRUWLYVNEEQ-UHFFFAOYSA-N 326.356 1.424 10 10 EDCE C[C@H](O)c1ccc(N2CCN(C(N)=O)CC2)c(Br)c1 721685468 YCQGFMIOZGESKH-VIFPVBQESA-N 328.210 1.703 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)C1CN([C@H]2CCOC2)C1 827771333 WFKZYBVIUSMGEU-HNNXBMFYSA-N 327.384 1.277 10 10 EDCE COc1cccc(CNC(=O)Nc2ccc3c(n2)OCCO3)c1O 825027594 ZXHBODQBCIOZRB-UHFFFAOYSA-N 331.328 1.889 10 10 EDCE COC(=O)[C@H]1CSCCN(C(=O)c2c(F)ccc(O)c2O)C1 839936047 YTVMVMGHKIYKFB-MRVPVSSYSA-N 329.349 1.215 10 10 EDCE O=C(NCC1CC1)[C@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 588403686 VSGZEXOPLTXNQO-LYASGUKUSA-N 344.411 1.876 10 10 EDCE C[C@H](NC(=O)C(=O)NC[C@H]1C[C@@H](N(C)C)C1)c1ccc(N(C)C)cc1 848933935 GWYOZKBDVPOAFK-GRDNDAEWSA-N 346.475 1.386 10 10 EDCE NC(=O)[C@@H]1CC[C@@H]1C(=O)NCc1cc(Br)ccc1O 848067800 CEWMWFZGFMHXEP-ZJUUUORDSA-N 327.178 1.282 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN(CC)[C@@H]3CCCOC3)nc12 844403194 DIQSMFDQGBMRQZ-CYBMUJFWSA-N 348.403 1.613 10 10 EDCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccnnc3)cc2)C1 756759883 STRRMPCSEOMIPS-OAHLLOKOSA-N 339.399 1.108 10 10 EDCE COC(=O)N(C)CCN(C)C(=O)NCc1ccc(N2CC=CC2)cc1 852138226 KBRMAGZFTAPMIL-UHFFFAOYSA-N 346.431 1.902 10 10 EDCE CCCC(=O)N1CSC[C@H]1C(=O)NCc1c(O)cccc1F 928710438 DOGIFNWHFGGJCN-LBPRGKRZSA-N 326.393 1.849 10 10 EDCE COc1ccc(N2CC[C@@H](Nc3cncc(-n4cncn4)n3)C2)cc1 853758909 MNEDKAYXLDLMRT-CYBMUJFWSA-N 337.387 1.757 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CC[C@@]2(O)C[C@H]2C1 853452717 LDVDRXHDTOAURT-KBXCAEBGSA-N 349.406 1.329 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCC1COC1 1118869962 YHKBGALMZYAJCT-UHFFFAOYSA-N 333.432 1.341 10 10 EDCE Cc1nc([C@@H]2COCCN2C(=O)NCc2ccc(N(C)C)cc2)no1 779641197 HECORELFZTWZSN-HNNXBMFYSA-N 345.403 1.727 10 10 EDCE COC(=O)[C@@]1(O)CCN(Cc2cc(C)cc(Br)c2O)C1 895704820 YVRLZOYYCBMOSC-CQSZACIVSA-N 344.205 1.573 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C[C@@H]2COC(=O)C2)cc1C 1321024901 OXIOWYZJFMTYCR-CWDCEQMOSA-N 346.427 1.719 10 10 EDCE CN1C[C@@H](NCc2cc(Cl)cc(Br)c2O)C(=O)N1 708196123 GHNZQIJHMWJORF-SECBINFHSA-N 334.601 1.243 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2c(C)noc2C)cc1C 1331663482 GMRIBUVIRKABIK-HNNXBMFYSA-N 347.415 1.489 10 10 EDCE COc1ccc(CN[C@@H]2CCN(C(=O)CN(C)C(C)=O)[C@@H]2C)cc1C 1331859368 HMSJYAUGUWPSHP-RHSMWYFYSA-N 347.459 1.561 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3C[C@H](C)CO3)CC2)c(OC)c1 1332170135 GKWCDOJUYCTMQX-SUMWQHHRSA-N 334.416 1.777 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H]2C[C@H]2C2CC2)cc1 1332813332 AOQXOHAWCISGMM-DLBZAZTESA-N 345.443 1.505 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@]2(CCCCN2)C1 1262202896 GGQAZQKOEYWLQY-GOSISDBHSA-N 331.416 1.095 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CCCS1(=O)=O 1351162106 CXMRHKJWGOSPSI-MRXNPFEDSA-N 336.457 1.822 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1Cc2cnccc2NC1=O 1455338527 INIDHPRYCVOHOF-LSYFEZSPSA-N 325.324 1.186 10 10 EDCE C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1nc(C(F)(F)F)n[nH]1 1456401267 RYWHFGPJRZIHQC-ZCFIWIBFSA-N 330.266 1.655 10 10 EDCE CCO/C=C\[C@@](O)(CNC(=O)Cc1ccc(O)c(O)c1)C(F)(F)F 1450334271 BYRCOEXYZSDCFM-GEXIGZQTSA-N 349.305 1.600 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)/C=C/c1ccc(C(N)=O)o1 1539107514 IMCJUWIOOKQSJX-VMPITWQZSA-N 341.367 1.883 10 10 EDCE Cc1cn2nc(C(=O)NCc3cc(Cl)ccc3O)cc2c(=O)[nH]1 1469877074 MKJJBMFJNIKKQD-UHFFFAOYSA-N 332.747 1.620 10 10 EDCE CC[C@H](CNC(=O)C(F)F)NC(=O)c1ccc(N=NC(N)=O)cc1 1531038277 VZOXZQLMXZLVEI-SECBINFHSA-N 341.318 1.739 10 10 EDCE CN(C(=O)Cc1ccc(O)c(O)c1)[C@H]1CCN(CC(F)(F)F)C1=O 1543305924 HZKDYSRIKFWOCI-JTQLQIEISA-N 346.305 1.262 10 10 EDCE C[C@@H]1C[C@@H](N2CCOCC2)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1623811169 YLLALICUFCJEBK-IUODEOHRSA-N 345.403 1.784 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@@H](O)c3cnn(C)c3)CC2)cc1 1623430306 YECOXIGFAGVNID-KRWDZBQOSA-N 344.415 1.201 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccnc2[nH]c(O)nc12 1636058571 HWPCURUQHRGPOM-UHFFFAOYSA-N 333.344 1.785 10 10 EDCE CCc1ncoc1C(=O)NC[C@H](CO)NCc1ccc(OC)c(C)c1 1725540914 LHVHNOIMPKUGSX-CQSZACIVSA-N 347.415 1.435 10 10 EDCE CS(=O)(=O)c1ccc(/C=C\C(=O)NCc2cc(O)ccc2O)o1 1643882146 PCLWYNVRZQMGKO-UTCJRWHESA-N 337.353 1.424 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]2c2nncn2C)cc1 1642580234 JRJVTPJAXHQQJP-INIZCTEOSA-N 342.447 1.334 10 10 EDCE O=C(NCCC[C@H]1C=NNC1=O)c1cc2cc(O)c(O)cc2s1 1642448566 MRCRVTPHCGVRAT-QMMMGPOBSA-N 333.369 1.554 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@H](O)C2(C)C)c(Br)c1 2124803112 UIPCYXPXAVEGMT-WQHBLYJGSA-N 330.222 1.823 10 10 EDCE Cc1cc(C(=O)N2CC(NC3COC3)C2)c(C)n1-c1ccccn1 1652949456 QFGWNZZQOVJLQE-UHFFFAOYSA-N 326.400 1.302 10 10 EDCE O=C1CCCN1C1CN(c2ccc(CO)c(Br)c2)C1 2125804557 LGYYIGZALIBHAF-UHFFFAOYSA-N 325.206 1.752 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@@H](C)NC(C)=O)cc1C 1699080031 UKKJGLRZXSIADS-UONOGXRCSA-N 335.448 1.513 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](O)C[C@H]2CO)c(Br)c1 2136084259 ZVGPQEIQFOHTKU-USWWRNFRSA-N 330.222 1.824 10 10 EDCE CC[C@H](NCc1c(Br)ccc(OC)c1O)C(=O)NC 1970854619 KEBJEXBMLFFLOI-JTQLQIEISA-N 331.210 1.778 10 10 EDCE COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N=[N+]=[N-])CC1 1985094465 PGRLAVXNKHSUGF-NSHDSACASA-N 327.385 1.827 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4C[C@]4(CO)C3)c(Br)cc21 2146313600 LFZDFPLYDGVCNQ-FDHQVAJDSA-N 338.205 1.220 10 10 EDCE CN1CCCc2cc([C@H](N)[C@@H](O)CNC(=O)OC(C)(C)C)ccc21 1999584954 ROTYUXKFCVYRNM-HOTGVXAUSA-N 335.448 1.954 10 10 EDCE CNCc1ccc(N2CCC([C@@H](O)CO)CC2)cc1Br 2152466788 FHHPQAFHNYHHJY-HNNXBMFYSA-N 343.265 1.738 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1CCOCC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010405813 MDMCPKXRUWJQRB-RYUDHWBXSA-N 339.396 1.827 10 10 EDCE NC(=O)CCN(Cc1ccccc1)C(=O)c1cc(O)c(O)c(O)c1 2015121071 ZVEGXCNQBDTKOF-UHFFFAOYSA-N 330.340 1.321 10 10 EDCE C[C@@H](O)c1ccc(N(C)Cc2c(Br)nnn2C)cc1O 2156477576 YXAQURYOISCIRR-MRVPVSSYSA-N 341.209 1.973 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@H]2C3)c(Br)c1 2173356261 BVUPWACLWUUMEU-REYDYLPWSA-N 342.233 1.823 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C3COC3)CC2)c(Br)c1 2169590401 ACGZOZMCUSGYDW-LLVKDONJSA-N 340.265 1.990 10 10 EDCE CCN(Cc1cc(Br)cc(F)c1O)[C@H]1CC(=O)NC1=O 2171207593 QZSHMBGLSPVUHQ-JTQLQIEISA-N 345.168 1.531 10 10 EDCE 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COC(=O)[C@]12C[C@H](N)C[C@H]1CN(Cc1ccc(N3CCCC3)cc1)C2 1339224770 PYLJJVWSVRRBON-QKLQHJQFSA-N 343.471 1.999 10 10 EDCE O=C(C(=O)N1CCC[C@H]1c1cccnc1)N1Cc2cccc(O)c2C1 1335549315 YSOCEQSXYHATOH-INIZCTEOSA-N 337.379 1.993 10 10 EDCE CC(C)(C)[C@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H]1O 1348640901 UURUUNVNAUMRDL-GOEBONIOSA-N 346.427 1.490 10 10 EDCE CCCN(C)C[C@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1284519575 KOFVDUIHCVXHBW-AWEZNQCLSA-N 335.408 1.624 10 10 EDCE COC(=O)[C@H](Cc1ccncc1)NC(=O)/C=C/c1ccc(O)c(O)c1 1450218316 WQGFJNPQSJKZFJ-KQIUPUNMSA-N 342.351 1.407 10 10 EDCE NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)Cc1ccc(O)c(O)c1 1467820423 FFWJXBJKLLOHGX-ZDUSSCGKSA-N 348.786 1.507 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)[S@]3=O)cc1 1631992869 OMQBPASSAGBJFA-PSVOKBTDSA-N 334.401 1.975 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2cccnc2C)cc1C 1497052772 XWRYPJNXBFYZGI-MRXNPFEDSA-N 343.427 1.588 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H]2CCCCN2C)cc1C 1568575096 RNWUVPGVUZWYDE-IRXDYDNUSA-N 349.475 1.055 10 10 EDCE CN(CCCN=[N+]=[N-])S(=O)(=O)c1cc(Br)nn1C 1912209054 YIOSGTLKZJBOJC-UHFFFAOYSA-N 337.203 1.504 10 10 EDCE COc1ccc(CNCCN(C)C(=O)Cc2[nH]cnc2C)cc1C 1731978172 MZLQUXRPUVZLFD-UHFFFAOYSA-N 330.432 1.826 10 10 EDCE NC(=O)C12CCC(CC1)N2C(=O)c1cc2cc(O)c(O)cc2s1 1653005447 DQSHWMCKFMEFQE-UHFFFAOYSA-N 332.381 1.935 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@@H](CNCCCO)C2CC2)cc1 1670563317 XIOXNNGSQSCNKR-AWEZNQCLSA-N 333.392 1.329 10 10 EDCE COc1ccccc1OCC(=O)NC1=NN(c2ccccc2)C(=O)C1 18019572 RMPWCJKQJJUDDM-UHFFFAOYSA-N 339.351 1.941 10 10 EDCE CC(C)NCc1ccc(N2C[C@H](O)[C@@H](O)C2)c(Br)c1 232651838 CMCAXCALWJFNAS-KBPBESRZSA-N 329.238 1.489 10 10 EDCE CN(C)C(=O)[C@@H]1CNCCN1Cc1cc(Br)ccc1O 234237627 DLBNNYQVLVEEHP-LBPRGKRZSA-N 342.237 1.017 10 10 EDCE CCCNCc1ccc(N(C)CC(CO)CO)c(Br)c1 2150420309 XJJOBFYQSYOWJL-UHFFFAOYSA-N 345.281 1.986 10 10 EDCE C[C@@H](NC[C@@H](O)CNC(=O)OC(C)(C)C)c1c(O)cccc1O 1985772571 YKQNICVUWGONOY-GHMZBOCLSA-N 326.393 1.634 10 10 EDCE NC(=O)CN(Cc1ccc(N)cc1)c1ccc(Br)cn1 37672415 KKSBGFYJDDZLES-UHFFFAOYSA-N 335.205 1.918 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)NCCCN=[N+]=[N-])C1 2010403246 BIALTXYSMQKIJU-NHYWBVRUSA-N 339.396 1.687 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010393786 XPECKAKEIPGZAM-RYUDHWBXSA-N 341.412 1.954 10 10 EDCE C[C@H](N)c1ccc(N(C)Cc2c(Br)nnn2C)cc1O 2156470843 WXMSJVQDEPDGMS-QMMMGPOBSA-N 340.225 1.939 10 10 EDCE C[C@H]1CC(=O)NCCN1c1cc(Br)c(CN)cc1F 687900152 URCGOAANXNDCLG-QMMMGPOBSA-N 330.201 1.762 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@H](C)O[C@]4(CCO[C@@H]4C)C3)c2n1 2064412447 PRTLWGJRGYEZEU-XWCIJXRUSA-N 346.387 1.152 10 10 EDCE O=C(O)CN1CC[C@@H](NCc2cc(Br)cc(F)c2O)C1 2169328150 VMVMEVMBTKBNNT-SNVBAGLBSA-N 347.184 1.542 10 10 EDCE NCc1cc(F)c(N2CCN(C3COC3)CC2)cc1Br 2169593170 YTPOAMBJNFDQDE-UHFFFAOYSA-N 344.228 1.568 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H]2CN(c3ccc(N)cc3)CCN2C1=O 2053193876 GQHPMQWANAVQFN-CABCVRRESA-N 346.431 1.583 10 10 EDCE CS(=O)(=O)[C@@H]1CCN(c2ccc(CO)cc2Br)C1 2059356322 KPLABFWEKZSQHC-SNVBAGLBSA-N 334.235 1.565 10 10 EDCE NCc1ccc(N2CCNC(=O)C(F)(F)C2)cc1Br 2090579053 GOUJARJXFBZWTC-UHFFFAOYSA-N 334.164 1.479 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@]4(CO)C3)c(Br)cc2[C@@H]1O 2200842242 ALWAGYHDFYHEBU-FDHQVAJDSA-N 339.189 1.253 10 10 EDCE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](COc1nnc(=N)[nH]n1)C2 2213789596 JXMVVBIQTJMBBL-JGPRNRPPSA-N 336.396 1.236 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2CCC[C@]2(COc2nnc(=N)[nH]n2)C1 2213783181 NADNMGCLMMLZCJ-MEBBXXQBSA-N 336.396 1.095 10 10 EDCE CCC[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1COc1nnc(=N)[nH]n1 2213779855 YCXRYHZROCFPRV-QWRGUYRKSA-N 338.412 1.341 10 10 EDCE C[C@H]1CCC[C@@](COc2nnc(=N)[nH]n2)(NC(=O)OC(C)(C)C)C1 2213783193 NCHHPNJFGGHMSI-ZUZCIYMTSA-N 338.412 1.532 10 10 EDCE CCN1CC[C@@H](NCc2c(Br)ccc(OC)c2O)C1=O 2208764513 NAAQOUHNJAHRPT-LLVKDONJSA-N 343.221 1.874 10 10 EDCE COc1ccc(Br)c(CN[C@@H](C)c2nc(=O)o[nH]2)c1O 2236056852 YALZPIXDSSJMKQ-LURJTMIESA-N 344.165 1.690 10 10 EDCE Cn1nc(Br)c(CNC(=O)Nc2ccc(N)cc2)n1 2226966299 PWYKZCPFGNBGLM-UHFFFAOYSA-N 325.170 1.482 10 10 EDCE COc1ccc(Br)c(CNC[C@@H](O)CN(C)C)c1O 2227748136 KHBIPIKSKMHUII-SECBINFHSA-N 333.226 1.175 10 10 EDCE CN=c1[nH]cc(Br)c(=NCc2cnc(SC)s2)[nH]1 2257117513 OKKSODAHBYYNNF-UHFFFAOYSA-N 346.279 1.915 10 10 EDCE CNCc1ccc(N2CC(NC(=O)OC)C2)c(Br)c1 2351879401 CRAZURMTBRVWKX-UHFFFAOYSA-N 328.210 1.713 10 10 EDCE Cc1ccc(CN2C[C@@H](O)C[C@@H]2C(=O)O)c(O)c1Br 2352678047 FAXJJDMWFRTNGM-VHSXEESVSA-N 330.178 1.483 10 10 EDCE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@H]1CCC[C@H]1O 172551247 SVRIMZKWTQKMTO-JKSUJKDBSA-N 335.473 1.952 10 10 EDCE COc1ccc(O)c(CNC(=O)NC[C@H](c2cnn(C)c2)N(C)C)c1 118076257 SYERSDALLWBDTQ-OAHLLOKOSA-N 347.419 1.236 10 10 EDCE CC[C@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCN1CCOC 181096709 CFNUBAYAWQZMBR-ZKKXHLJNSA-N 334.416 1.680 10 10 EDCE COC(=O)[C@@H]1C[C@H](OC)CN1Cc1cc(Br)ccc1O 125714341 IGBSASNNWPHEHO-RYUDHWBXSA-N 344.205 1.917 10 10 EDCE O=C(CCCNC(=O)c1cccs1)NCc1ccc(O)c(O)c1 182537151 WDIBTWDFEKDKHK-UHFFFAOYSA-N 334.397 1.986 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3ccnnc3)CC2)cc1 270423196 KXUPMFNHPVWEHT-UHFFFAOYSA-N 341.415 1.037 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3CCOC[C@@H]3C)nc12 277316386 DFHHHYQMIGGXLQ-GXFFZTMASA-N 334.376 1.126 10 10 EDCE Cc1ccc(CN2CCOC[C@@H]2[C@H](O)CO)c(O)c1Br 2380813040 BSGWRCISVCGWPQ-VXGBXAGGSA-N 346.221 1.017 10 10 EDCE CCOCc1nc([C@H](C)NC(=O)c2c(F)ccc(O)c2O)no1 296301659 ZUWMCZKCFIPNLN-ZETCQYMHSA-N 325.296 1.647 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](N)C2(O)CCC2)c(O)c1Br 2381128837 AGWBLVSITXTUEA-GFCCVEGCSA-N 343.221 1.322 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)CN1C(=O)[C@@H]2CCC[C@@H]21 839957642 RXBJGKDJKBYASH-MSOLQXFVSA-N 329.444 1.923 10 10 EDCE CO[C@]1(CN[C@@H]2C[C@H](C)c3c(F)ccc(O)c32)CCS(=O)(=O)C1 903367128 XSXFKDXUOUXJEK-IETSOEAISA-N 343.420 1.873 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCC([C@@H]3COC(=O)N3)CC2)cc1 913927190 XBDAPUPJPWAANE-INIZCTEOSA-N 346.431 1.783 10 10 EDCE CCOC(=O)CN1C(=O)/C(=C\c2cnn(CC)n2)c2ccccc21 840735729 SGEPMHXWXZRUNP-ZROIWOOFSA-N 326.356 1.748 10 10 EDCE COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2C2CCOCC2)c1 918745629 PPDXJVJTWCUMJJ-HNNXBMFYSA-N 349.431 1.453 10 10 EDCE COc1ccc(N2CCC(NC[C@@H](O)c3ccnn3C)CC2)cc1 922969092 AATANBJZNAATSA-GOSISDBHSA-N 330.432 1.721 10 10 EDCE CC(C)(C)OCC(=O)NC(C)(C)C(=O)NCc1c(O)cccc1F 928706659 UHNVDWCOJQBSNR-UHFFFAOYSA-N 340.395 1.857 10 10 EDCE CO[C@H](CS(=O)(=O)NNc1nc2cccnc2s1)C1CC1 857225683 QAAGFMWLOSSBED-SNVBAGLBSA-N 328.419 1.363 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](N)COC(C)C)CC2)cc1F 852812804 BPUKQDFMEYSXJS-HNNXBMFYSA-N 339.411 1.235 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCNC[C@@H]3C)C2)cc1 851664416 ZDUGFKHKDYZZLJ-GRDNDAEWSA-N 332.448 1.571 10 10 EDCE CCOC(=O)c1cn(C)nc1NC(=O)NCc1cc(OC)ccc1O 752803633 FBZOKXSPOSOTQH-UHFFFAOYSA-N 348.359 1.633 10 10 EDCE CC(C)(CCS(=O)(=O)N1Cc2cccc(O)c2C1)S(C)(=O)=O 867691464 XBIPTMXMAHXKKK-UHFFFAOYSA-N 347.458 1.251 10 10 EDCE O=C([C@@H](O)c1cnc[nH]1)N(Cc1ccccc1O)C[C@@H]1CCCO1 866899144 DTUNWZACJIXAPY-BBRMVZONSA-N 331.372 1.357 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](C)C(=O)N(C)OC 875898472 IDSYJHDKWWPPDA-ZDUSSCGKSA-N 336.436 1.692 10 10 EDCE Cn1c(O)nc2ccc(NS(=O)(=O)c3cccc4nonc34)cc21 799555722 DIQXVGVEGMXACT-UHFFFAOYSA-N 345.340 1.616 10 10 EDCE CC(=O)c1cc(F)cc(CN2CC[C@H](c3cc(O)nc(O)n3)C2)c1O 1307891821 XKOXQMZVXKLQQM-JTQLQIEISA-N 347.346 1.925 10 10 EDCE CCc1nnc(N2CCNC(=O)C2)n1Cc1ccc(N(C)C)cc1C 1306215097 KWCXIGMSSILKPJ-UHFFFAOYSA-N 342.447 1.199 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@H]2CC=CCC2)cc1C 1331668598 SREQNMPIEXNSRL-IRXDYDNUSA-N 332.444 1.927 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2ccn(C)c2)cc1C 1332503363 GGHDUMMKULKSDE-QGZVFWFLSA-N 345.443 1.565 10 10 EDCE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC[C@@]12COCCN1C(=O)COC2 1351794313 MIEHLNCZQKQKKC-LPMFXHHGSA-N 346.427 1.466 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCC(=O)OC 1299698683 KGKNWFGPVRIKLY-UHFFFAOYSA-N 337.372 1.627 10 10 EDCE CC(C)OCC(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1298746137 HCLHXBMOWYHIDZ-NSHDSACASA-N 349.391 1.509 10 10 EDCE NC(=O)CCNC(=O)c1ccccc1NC(=O)c1cc(O)cs1 1611326452 YQDJOHUPUMTPLP-UHFFFAOYSA-N 333.369 1.311 10 10 EDCE CC[C@@H](CNC(=O)c1cnn(C)n1)NCc1ccc(OC)c(C)c1 1714111618 BXCLGAXOXDKADJ-AWEZNQCLSA-N 331.420 1.430 10 10 EDCE CO[C@@H](C)CN[C@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1566814886 ATTHMQCSVXDMSG-BPNCWPANSA-N 333.392 1.734 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2CCNC2=O)cc1C 1723091788 HVGVUQIGIPKNOK-OAHLLOKOSA-N 333.432 1.078 10 10 EDCE COC(=O)/C=C/c1ccc(N2CC(N[C@H]3CCOC3)C2)c([N+](=O)[O-])c1 1640465322 SXDXBCMVQXHOPA-LQPUYASZSA-N 347.371 1.348 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCc2nccn2C)cc1C 1662293968 WDTPELCMJJVMDI-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE CCC(=O)N1CCN(c2ccc(CO)cc2Br)CC1 2126209251 QRJYNDZEVBCQGX-UHFFFAOYSA-N 327.222 2.000 10 10 EDCE CCn1nc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1=O 11780867 GBRIEGCJDXWSQE-UHFFFAOYSA-N 342.399 1.234 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)CC[C@H](O)CNC(=O)OC(C)(C)C 1900607490 NLGILEHRHXWAMO-NSHDSACASA-N 329.401 1.811 10 10 EDCE CNC[C@@H](O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951829433 JCLDBPJQRFAJIV-SMDDNHRTSA-N 326.393 1.114 10 10 EDCE CO[C@@H](CNC(=O)OC(C)(C)C)[C@H](N)Cc1ccc(O)c(O)c1 1952710794 OIFGMXXQVOWPQP-RISCZKNCSA-N 326.393 1.507 10 10 EDCE Cn1ncc(NCCOc2ccc(N)cc2)c(Br)c1=O 159319549 WUYRSBJUNVHQQR-UHFFFAOYSA-N 339.193 1.616 10 10 EDCE CN[C@H](C)c1ccc(N2CC(OCC(N)=O)C2)c(Br)c1 2145377089 JQCBRXZMMNMWFM-SECBINFHSA-N 342.237 1.420 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCc2ccc(N)cc2)C[C@H](O)C1 1999475120 MYOYKENFNKPBGP-INIZCTEOSA-N 335.448 1.725 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010404843 CRHCRXLUUVAPBA-VHSXEESVSA-N 340.384 1.056 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)cc1Br 2178087057 OYPBZGSEPPCXSQ-BILRFKGYSA-N 342.233 1.946 10 10 EDCE O=C1Nc2cc(N3CC=CC[C@@H]3CO)c(Br)cc2[C@@H]1O 2176377906 MUXSZXVCXFGNGZ-OQPBUACISA-N 339.189 1.562 10 10 EDCE CN(CCn1cc(C(=O)N2CC(N=[N+]=[N-])C2)cn1)C(=O)OC(C)(C)C 2218301124 JTLDTRHFABPDMT-UHFFFAOYSA-N 349.395 1.885 10 10 EDCE CN1CCCN(C2=NC(=O)C(=Cc3ccc(C(=O)O)cc3)S2)CC1 2328662200 MZNIDOKGVNSOBA-UHFFFAOYSA-N 345.424 1.993 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2[C@@H]3NCCO[C@@H]32)c(O)c1Br 2381141985 HINFTHKJORRWGZ-SUZMYJTESA-N 341.205 1.066 10 10 EDCE COc1ccc(N2CCN(C(=O)C[C@H]3CCOC[C@H]3OC)CC2)cc1 294251295 FRXKHFKCIYIWIN-CRAIPNDOSA-N 348.443 1.785 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](C)NC(=O)c1ccco1 808093013 DICYROKARLRBMN-NSHDSACASA-N 337.372 1.906 10 10 EDCE CCOC(=O)C1(C(=O)NCc2cccc(OC)c2O)CCOCC1 802782489 VUBHSFFVRKTNGL-UHFFFAOYSA-N 337.372 1.377 10 10 EDCE CCn1nncc1C(=O)NCc1cc(Br)ccc1O 816654080 SSAJJXKIFFJTCR-UHFFFAOYSA-N 325.166 1.696 10 10 EDCE COc1ccc(N2CCN(CCN[C@H](C)[C@H]3CCCN3)CC2)cc1 817892465 AEGASODEPWMWSR-VQIMIIECSA-N 332.492 1.547 10 10 EDCE COC[C@@H](O)CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 819199953 IGJWNKCPCZQBGS-IBGZPJMESA-N 333.476 1.316 10 10 EDCE C[C@@H]1CC[C@H](NC(=O)NCc2cc(Cl)ccc2O)CS1(=O)=O 821968524 GYAQXBGDAXANSE-SKDRFNHKSA-N 346.836 1.811 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)cc2N1 828948230 YZFKYTHFRISFCS-HZZFPTLFSA-N 329.312 1.315 10 10 EDCE CO[C@@H]1C[C@H]1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 822360116 MMRUXLFEXYVSJN-BXUZGUMPSA-N 326.343 1.453 10 10 EDCE C[C@H](OC(=O)c1cc(O)cs1)C(=O)NC(=O)NCC(F)(F)F 732352723 DEFNJYZYZSYRGF-YFKPBYRVSA-N 340.279 1.387 10 10 EDCE CN(C)c1ccc(CN(C[C@@H](O)CN2CCOCC2)C2CC2)cc1 917014202 OHTOBZCCRNYHPL-IBGZPJMESA-N 333.476 1.410 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC1COCCOC1 840381198 GDGPWGZQSDXKCP-AWEZNQCLSA-N 335.448 1.707 10 10 EDCE COC[C@@]1(C)NC(=O)N([C@@H]2CCN(c3ccc(OC)cc3)C2)C1=O 849356098 CGOJEKXWQREOHF-CXAGYDPISA-N 333.388 1.231 10 10 EDCE CN(C)c1ccc(CNC(=O)N[C@H]2CNCCC2(F)F)cc1F 841760817 LVRYPZBVAHUWTD-ZDUSSCGKSA-N 330.354 1.688 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](N)Cc3ccccc3)C2)cc1 851639898 MTFUHHNKAOZTAT-VQIMIIECSA-N 339.439 1.960 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cccc(=O)n3C)C2)cc1 855234357 XZIXMPFCTCOZEB-CYBMUJFWSA-N 327.384 1.403 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N(C)C[C@H]3CCOC3)C2)cc1 852456469 YIFANTQLZLZWQZ-HUUCEWRRSA-N 333.432 1.952 10 10 EDCE CCON(CC)C(=O)CNCc1ccc(N2CCN(C)CC2)cc1 858220306 SNNPTNPBPKOJJL-UHFFFAOYSA-N 334.464 1.328 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCc4nc[nH]c4C3)C2)cc1 855226677 PRXHCYMMCLETGR-ZIAGYGMSSA-N 340.427 1.918 10 10 EDCE CC[S@](C)(=O)=NS(=O)(=O)NCc1ccc2c(c1)CCCN2C 866674212 VMGFRMQLNMURKV-NRFANRHFSA-N 345.490 1.521 10 10 EDCE Cc1cc(N(C)C)ccc1CN1CCN(C(=O)N2CCNCC2)CC1 863642712 WAVOUVOILMONSE-UHFFFAOYSA-N 345.491 1.204 10 10 EDCE C[C@@H](NC[C@]12COCCN1C(=O)COC2)c1ccc(N(C)C)cc1 866555840 OONJFDGOMPXYKB-RDTXWAMCSA-N 333.432 1.031 10 10 EDCE Cn1ccnc1CN1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779513222 FZCPRENXDQPJQL-HYXAFXHYSA-N 342.399 1.189 10 10 EDCE CO[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)c1ccc(O)cc1 784730549 VLWICQZNNHKCMB-MRXNPFEDSA-N 332.308 1.917 10 10 EDCE COc1ccc(N2CCC(NCCC3CS(=O)(=O)C3)CC2)cc1 786949769 IUUKTKMKCQVXSS-UHFFFAOYSA-N 338.473 1.688 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NCc2cn(C)nn2)cc1F 783002974 LQKYICYZGHIYHY-UHFFFAOYSA-N 334.399 1.800 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1[C@@H]2CN(C(=O)c3cccc(O)c3O)C[C@@H]21 1962871885 KGBZNRNOCOAQKH-PJXYFTJBSA-N 334.372 1.693 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)Cn3nnn(C)c3=O)c2C)c1 1166542493 UZLMTKFPCAJUML-UHFFFAOYSA-N 325.372 1.576 10 10 EDCE CC(C)(C)[C@H]1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)C[C@@H]1O 1327545175 MOEGWFKNCDJWTL-HOTGVXAUSA-N 347.459 1.183 10 10 EDCE C[C@@H]1CCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1F 1325838290 ZJCTYEHEZGSTPW-CZUORRHYSA-N 335.423 1.918 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H](F)[C@H](F)C3)c(Br)cc21 714733755 IJXRFKJLCTUZKM-VHSKPIJISA-N 332.148 1.897 10 10 EDCE COc1ccc(CNCC2CC(NC(=O)[C@@H](C)CC(N)=O)C2)cc1C 1505512636 VSERBOXEBYJKGF-JEYLPNPQSA-N 347.459 1.500 10 10 EDCE COc1ccc(CN[C@@H](CCN(C)C(=O)C(N)=O)C(C)C)cc1C 1282563579 XBHXHSYLIRPYRK-HNNXBMFYSA-N 335.448 1.452 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2c(C)c[nH]c2CC(N)=O)c1 1566374906 YFMPKPALQGHKMT-JTQLQIEISA-N 331.372 1.556 10 10 EDCE CCC(=O)NCC1(NCc2nnnn2-c2ccc(OC)cc2)CCC1 1724781129 WUVHZENPKQFJKL-UHFFFAOYSA-N 344.419 1.209 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCCC(=O)NC1CC1 1726358131 VLGSEUYEVOCHQM-UHFFFAOYSA-N 343.431 1.987 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1[C@H]2CCCO[C@H]21 1632356616 QWARIPWNBANICR-NOXHYTERSA-N 349.383 1.113 10 10 EDCE O=C(NCc1ccc(O)cc1O)c1cn(Cc2cccc(F)c2)nn1 1643103971 KDVSUCJCAHOGJM-UHFFFAOYSA-N 342.330 1.807 10 10 EDCE C[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H](C)CO 153806916 MYKRVZSVWJANTB-STQMWFEESA-N 339.411 1.478 10 10 EDCE COC(OC)C(=O)N1CCN(Cc2cccc(Cl)c2O)CC1 1660043272 KKPMRPKCIAUGJH-UHFFFAOYSA-N 328.796 1.309 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COCC[C@]1(O)[C@@H](N)c1ccccc1O 1919860796 HBCGJUPXSNZVKA-JKIFEVAISA-N 338.404 1.437 10 10 EDCE CN(C(=O)OC(C)(C)C)[C@H]1COC[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 1985101558 UOQABOZKKBAJIT-MNOVXSKESA-N 325.369 1.389 10 10 EDCE CC(C)(C)OC(=O)N1CC(C[C@H](F)C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2008892910 QDCAZHAZBRWLED-DRZSPHRISA-N 342.411 1.847 10 10 EDCE Nc1ccc(CC(=O)N[C@H](COCc2ccccc2)CC(=O)O)cc1 2035480963 DLSSFKKSLGZXFX-KRWDZBQOSA-N 342.395 1.988 10 10 EDCE CN(C)C1(C)CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2160654013 LIKUKSUTXIWQHD-LBPRGKRZSA-N 340.221 1.575 10 10 EDCE CC1(C)CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C[C@H]1O 387973576 MHSFZJQOAZGUCW-NEPJUHHUSA-N 340.221 1.608 10 10 EDCE C[C@@]1(NC(=O)C(F)(F)F)CCN(c2cc3c(cc2N)OCCO3)C1 2044632507 FFXKUEBYGJUAJY-CQSZACIVSA-N 345.321 1.687 10 10 EDCE O=C1NC[C@@H]2CN(Cc3ccc(Br)cc3O)CC[C@H]12 2100944467 NLVNNZOYWDLNQO-PWSUYJOCSA-N 325.206 1.723 10 10 EDCE O=S1(=O)CC[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@H]21 2088815203 ORDFFAFRYXRJEL-ZWNOBZJWSA-N 346.246 1.774 10 10 EDCE C[C@@H]1CCN(c2cc(Br)c(CN)cc2F)[C@H]1C(N)=O 2090256798 SMFVGFQXJJQTDE-JMCQJSRRSA-N 330.201 1.747 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](COc1nnc(=N)[nH]n1)c1cccs1 2210643098 GXNFJGPWAAXURY-QMMMGPOBSA-N 338.393 1.385 10 10 EDCE CSc1ncc(CNC(=O)N[C@@H](CC(F)F)C(=O)O)s1 2284506990 JYNVHCPBBYIPND-LURJTMIESA-N 325.362 1.773 10 10 EDCE CS(=O)(=O)[C@H]1CC[C@H]1NCc1c(O)cccc1Br 2319821361 APYWOKWZWHLCMI-PWSUYJOCSA-N 334.235 1.820 10 10 EDCE CN[C@H](c1ccccc1O)[C@H](O)[C@@H](CNC(=O)OC(C)(C)C)OC 2307259262 JNOLKHLJBZKLIF-RBSFLKMASA-N 340.420 1.553 10 10 EDCE NCc1ccc(N(CCO)C2CCOCC2)c(Br)c1 2353584482 UMQNBABINJKTPM-UHFFFAOYSA-N 329.238 1.886 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H](n3cncn3)C2)cc1 105898417 XUVHDOODOHTATK-QGZVFWFLSA-N 342.447 1.297 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCC[C@@H]1O 172554694 OHLVQBWXAFRTFH-ZBFHGGJFSA-N 337.395 1.375 10 10 EDCE N[C@@]1(C(=O)O)CCOc2c(I)ccc(O)c21 309526832 BXJNMDBKIUZWGU-JTQLQIEISA-N 335.097 1.018 10 10 EDCE CC(C)(C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@H](c1ccccc1O)N[C@]2(C)C(=O)O 248229249 KJFBWRKYRZLXEA-TVUHYWCHSA-N 346.383 1.280 10 10 EDCE Cc1ccc(CNCc2nc(C(=O)O)no2)c(O)c1Br 2380740529 XDDZUHGOYOUCOS-UHFFFAOYSA-N 342.149 1.834 10 10 EDCE CCn1nnc(C)c1C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 295018824 DHYJPWSVVCMGGY-UHFFFAOYSA-N 347.394 1.717 10 10 EDCE C[C@@H]1CC[C@@](CO)(N(C)CC(=O)NCc2ccc(N(C)C)cc2)C1 299345811 PARRXLCKAKZIQR-DNVCBOLYSA-N 333.476 1.852 10 10 EDCE C[C@H]1CN(c2ccc(/C=C\C(=O)O)cc2Br)CC(=O)N1 387340824 TZWYOIOFUMLFMZ-LVCFMKKZSA-N 339.189 1.872 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)NOCC3CC3)CC2)cc1 297175574 BHNGMFBMSIKRMP-UHFFFAOYSA-N 348.447 1.458 10 10 EDCE CCOC(=O)COCCN(C)Cc1ccc(N2CCOCC2)cc1 809932932 KHCVPVRGQKKWCP-UHFFFAOYSA-N 336.432 1.535 10 10 EDCE COC(=O)[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1 299109905 OTXICKKBAIGOSR-HNNXBMFYSA-N 347.415 1.228 10 10 EDCE COC(C)(C)CS(=O)(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 842786351 YTTAAYJLNLPOLP-CQSZACIVSA-N 329.466 1.097 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@H](C(=O)N3CCNCC3)C2)c1 843046890 HTIUWDYRSYEEOV-HNNXBMFYSA-N 347.459 1.435 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CN3CCSC3=O)C2)cc1 855229289 MDLMAGKWVKKZER-GFCCVEGCSA-N 335.429 1.559 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC4(COC4)C3)C2)cc1 854295740 AMOADNAFGIFAIG-CQSZACIVSA-N 331.416 1.706 10 10 EDCE Cn1ncc(S(=O)(=O)NCCc2ccc(N)cc2)c1C(F)(F)F 866760580 DAFVASDYQLVLSM-UHFFFAOYSA-N 348.350 1.542 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[C@H]1CCSC1 867302108 JFSCOXUXXBSCEK-HNNXBMFYSA-N 349.500 1.970 10 10 EDCE CO[C@@H]1CC[C@@H]2OCCN(Cc3cc4c(cc3O)OC[C@H]4O)[C@@H]2C1 768465442 MRJKDIWMNVNDLX-WNOSKKOXSA-N 335.400 1.586 10 10 EDCE CN1CCCc2cc(CNC[C@H](O)CC3(O)CCOCC3)ccc21 872198932 CXAFGSIMRJEFDU-QGZVFWFLSA-N 334.460 1.451 10 10 EDCE CNC(=O)[C@@H]1CN(Cc2cc(C)cc(Br)c2O)CCO1 781927094 SEVNFRZLOYOKCE-LBPRGKRZSA-N 343.221 1.410 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@H](N4CCCC4=O)C3)cc2N1 790793602 JSMBTWNNVPHNJL-SNVBAGLBSA-N 346.343 1.127 10 10 EDCE CS(=O)(=O)N1CCCC[C@@H]1CNCc1c(O)cccc1Cl 796512350 XYZDYTHSCQQFNZ-LLVKDONJSA-N 332.853 1.949 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)Cn2c(C)cc(C)nc2=O)c1 1137473533 MINGCWAGHHXRRO-GFCCVEGCSA-N 331.372 1.452 10 10 EDCE C[C@@H]1C[C@@H](C)N1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 791565103 FBVHSHZMDGFXEB-ZIAGYGMSSA-N 335.423 1.761 10 10 EDCE COc1ccc(CNC(=O)c2cc3c(O)ncnc3cn2)c(O)c1 794376396 DXFFBEACJZRERW-UHFFFAOYSA-N 326.312 1.375 10 10 EDCE O=C(Cn1ncc2ccccc2c1=O)NCc1c(O)cccc1O 1156880921 HHDGQFVVRFVPOD-UHFFFAOYSA-N 325.324 1.124 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@H](C)[C@@H](O)C3)C2)cc1 1312901764 HSOCGZFTFJGXSL-DAYGRLMNSA-N 347.459 1.934 10 10 EDCE CC(=O)C(=O)[C@]1(O)C[C@@H](C(C)C)N(C(=O)OCc2ccccc2)C1 1892802284 ZIZWLJJDLAAJQQ-YJBOKZPZSA-N 333.384 1.943 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)[C@@H]1[C@H]2CC[C@]3(COC(=O)[C@H]13)O2 1328992500 KTEVWSFKJFZOKS-OAFZBRQQSA-N 345.395 1.851 10 10 EDCE CN(C)C[C@@H](O)CN(C)c1ccc(CN)c(Br)c1F 690202065 HZWPHHFIBLWJQJ-SNVBAGLBSA-N 334.233 1.406 10 10 EDCE CCC1(CNC(=O)C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 1330916694 BRWUKTVSHFGIQV-AWEZNQCLSA-N 345.443 1.697 10 10 EDCE COC(=O)NCC(=O)N(C)C1CC(NCc2ccc(OC)c(C)c2)C1 1508096212 CKSVXUPGGZEFAZ-UHFFFAOYSA-N 349.431 1.439 10 10 EDCE C[C@H](NC(=O)[C@H]1CN(C(=O)C(C)(C)C)CCO1)c1ccccc1O 1454815509 GLHUDAQOLOWEEO-SWLSCSKDSA-N 334.416 1.843 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCOC[C@@H]1c1ncon1 1295079195 VPYVBNRJKMRAMI-SECBINFHSA-N 347.352 1.909 10 10 EDCE COC(=O)[C@@H](CC(F)F)NC(=O)c1ccc(N=NC(N)=O)cc1 1466128619 UNCZCZZUBIYLGT-SECBINFHSA-N 328.275 1.776 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@H](O)c1cccc([N+](=O)[O-])c1 1465981343 KJYUARVVRYPZHW-OAHLLOKOSA-N 332.312 1.398 10 10 EDCE O=C(N[C@H]1CCS(=O)(=O)C2(CCC2)C1)c1c(F)ccc(O)c1O 1611668840 AMQLHALZWPEWIZ-VIFPVBQESA-N 343.376 1.467 10 10 EDCE C[C@H](N)c1ccc(N2CCC[C@H]2[C@@H](O)CO)cc1Br 2123209827 JUVDWNYYPMTEGR-HERUPUMHSA-N 329.238 1.791 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)Cc2n[nH]c(C)n2)cc1C 1717410641 LYVOCTUIRQOXMI-QWHCGFSZSA-N 345.447 1.656 10 10 EDCE COC(=O)c1ccc(CC(=O)NCCc2ccc(O)c(O)c2)cc1 1622753348 RYZOFBVPUVDHSI-UHFFFAOYSA-N 329.352 1.786 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@H](N2CCCC2=O)CC1 1557016293 HNJZJWYCCPFHCS-AWEZNQCLSA-N 332.400 1.644 10 10 EDCE CC(=O)Nc1cnccc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1638348100 ONDGGGWTWMTHSU-SNVBAGLBSA-N 329.356 1.812 10 10 EDCE CCS(=O)(=O)c1ccc(C(=O)NCc2ccccc2O)c(N)c1 1566373790 FLFWUFKOVNMXPD-UHFFFAOYSA-N 334.397 1.698 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@H](c2ncon2)C1 1567518502 GAMQBXRSEOWYLT-NSHDSACASA-N 347.352 1.909 10 10 EDCE O=C(CN1C(=O)c2ccccc2C1=O)NCc1cc(O)ccc1O 1651222274 DFDXIFHHUPGFOW-UHFFFAOYSA-N 326.308 1.010 10 10 EDCE CC[C@@H](CNC(=O)C1CCCC1)NC(=O)c1cc(OC)nc(OC)c1 1582371900 KDRJYBXMTITORA-AWEZNQCLSA-N 349.431 1.914 10 10 EDCE CCC(=O)N[C@H](CCSC)C(=O)NCc1cc(O)ccc1O 1593872897 FTNJXBSCXXSTLD-GFCCVEGCSA-N 326.418 1.362 10 10 EDCE Cc1cc(C(=O)NCc2cc(O)ccc2O)n(C2CCOCC2)n1 1593881237 HQYMDSXISBWGMI-UHFFFAOYSA-N 331.372 1.884 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@@H]2CN(C)CCO2)cc1C 1676324805 XSICCOBNIRSDRE-YJBOKZPZSA-N 349.475 1.271 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@]1(C(=O)O)c1ccc(O)c(O)c1O 1952723830 LEBNBWMMBKEKRG-BJOHPYRUSA-N 325.317 1.423 10 10 EDCE C[C@H](NC[C@H](CO)NC(=O)OC(C)(C)C)c1c(O)cccc1O 1985853820 DWEBLAZWBZGUPH-WDEREUQCSA-N 326.393 1.634 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 2010402765 VRXWDISSNZSEBO-RYUDHWBXSA-N 341.412 1.763 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)C1 2012305731 KINYEXUMNQFOBS-RWWNRMGGSA-N 339.396 1.563 10 10 EDCE O=C1Nc2cc(N3Cc4conc4C3)c(Br)cc2[C@@H]1O 2160447706 UKOOUQWWAMNGMB-LBPRGKRZSA-N 336.145 1.943 10 10 EDCE Nc1ccc(CNc2c(O)nc(=O)n(Cc3ccccc3)c2N)cc1 2043974518 OBTVGHWHBYXTDK-UHFFFAOYSA-N 337.383 1.774 10 10 EDCE C[C@H](N)c1ccc(N2CCN(C)C[C@@H]2CCO)cc1Br 2202830158 JUUXCCZEIOEEGY-AAEUAGOBSA-N 342.281 1.972 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3C[C@H](CN3)C2)c1O 2227750962 KZQXPYAYVLASFU-ZJUUUORDSA-N 327.222 1.957 10 10 EDCE Cc1ccc(CN2CC[C@@H](CO)[C@@H](N)C2)c(O)c1Br 2352680601 RIQZPQSELPNGNZ-RYUDHWBXSA-N 329.238 1.605 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(Br)c1 2355334491 OWCRJFDWJUDZFB-FBUXBERBSA-N 341.249 1.489 10 10 EDCE CNC(=O)[C@@H](NC(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)C 178395105 PWNADLAJIFVNDL-INIZCTEOSA-N 348.447 1.297 10 10 EDCE NCCN(Cc1ccccc1)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 305826439 SVCKRVLPXMSUJY-UHFFFAOYSA-N 342.355 1.891 10 10 EDCE CC(=O)NCCCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 68536165 YOWZYUGCUDRRLY-UHFFFAOYSA-N 333.432 1.398 10 10 EDCE C[C@H](N)c1ccc(N2CCS(=O)(=O)CC2)c(Br)c1 61695441 XGTZZAYKMQNRBN-VIFPVBQESA-N 333.251 1.704 10 10 EDCE CC(=O)c1cc(F)cc(CN2CCN(c3cccnn3)CC2)c1O 175626884 FIRULNYCXYOVQE-UHFFFAOYSA-N 330.363 1.846 10 10 EDCE Cc1cccc(CN2CCN(C[C@H]3CN(C(C)C)CCO3)CC2)c1O 180089473 NEXSPIXHYWDESL-IBGZPJMESA-N 347.503 1.927 10 10 EDCE O=C(NCCn1cc(Br)cn1)c1ccc(O)c(O)c1 382189084 WLBBUYQEFFCPJN-UHFFFAOYSA-N 326.150 1.487 10 10 EDCE O=C(O)CN1CCN(Cc2cc(Br)ccc2O)CC1 236417701 QDRHVJAUJKJMCX-UHFFFAOYSA-N 329.194 1.357 10 10 EDCE CN1C(=O)[C@H](N=N[C@@H]2CCC[C@H]([N+](=O)[O-])C2)[C@H](O)[C@@H]2CCCC[C@H]21 299804214 IWFZIMAGKPMOOH-RBTXIFOQSA-N 338.408 1.787 10 10 EDCE CN1CC[C@]2(CCN(CC(=O)N(C)Cc3ccc(N(C)C)cc3)C2)C1 292255331 YBIQNBOVTSBIDM-FQEVSTJZSA-N 344.503 1.739 10 10 EDCE CN1CC[C@H](C(=O)NCc2cc(Br)ccc2O)C1=O 804739650 NNDVKVFLQIGKOG-SNVBAGLBSA-N 327.178 1.249 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 808522772 YVQMITFKBDMQTN-CQSZACIVSA-N 349.383 1.996 10 10 EDCE C[C@H](N[C@@H]1CCC(=O)N(C)C1=O)c1ccc(Br)cc1O 818362195 RIQAIIIJTOYQAZ-GZMMTYOYSA-N 341.205 1.953 10 10 EDCE C[C@H]1CN(CCO)CCN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 825338327 OKXIEWRPENKIHC-JTQLQIEISA-N 329.784 1.452 10 10 EDCE CC(C)C(=O)N1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 728299802 QYCXGEDIFDCJIJ-UHFFFAOYSA-N 349.450 1.963 10 10 EDCE CO[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2C)[C@@](C)(C(=O)O)C1 909042577 HLYVXKNXZOSSJT-CRAIPNDOSA-N 349.431 1.835 10 10 EDCE CN(C)c1ccc(/C=C/CNCCCN2CCCS2(=O)=O)cc1 835037657 JVZGVZDSJYJKEB-ZZXKWVIFSA-N 337.489 1.781 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@@H]2C[C@H]1CS2 837817559 SGSOVYDNMPHTJZ-HOTGVXAUSA-N 333.457 1.923 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)COC3(C)CNC3)C2)cc1 843504795 HUPICLRAIJBXSY-AWEZNQCLSA-N 333.432 1.016 10 10 EDCE CC(C)(C)OC(=O)C1=NO[C@@H](C(=O)NCc2c(O)cccc2F)C1 928708757 SOIHTSODNCDCQO-CYBMUJFWSA-N 338.335 1.634 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H]2CC[C@H]1[C@@H](CO)C2 852775427 UHMFPIGNHDZBLI-SCTDSRPQSA-N 345.487 1.804 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCN(C)[C@H]3C)C2)cc1 923185928 QOKGDINDJIIZGW-ZQIUZPCESA-N 332.448 1.666 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NCc2cscn2)cc1 853004476 JOVWVKOOMWOTQU-UHFFFAOYSA-N 335.385 1.359 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)N1CC(CC2CC2)C1 1118756848 UWTVOYIWQVIMLD-UHFFFAOYSA-N 339.486 2.000 10 10 EDCE C[C@@]1(C(F)(F)F)CCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)C1 872166990 ZFOHARIOFYRXQT-CYBMUJFWSA-N 344.293 1.907 10 10 EDCE CCN1CC[C@@H]1CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 897866170 SCLVZIYWOOAMFI-XJKSGUPXSA-N 332.448 1.140 10 10 EDCE CC(=O)N/C(=C/c1ccccc1)C(=O)NCc1cc(O)ccc1O 1153879361 LVJZQNMXHGVFGF-CXUHLZMHSA-N 326.352 1.891 10 10 EDCE O=C(NC[C@@H](O)c1c(F)cccc1F)c1c(F)ccc(O)c1O 1306895141 MIPVTMPTMWOHLT-LLVKDONJSA-N 327.258 1.979 10 10 EDCE CC(C)(C)OC(=O)NCC1(C(=O)NCc2ccccc2O)COC1 1963717325 VBSJFUYJMIUSHX-UHFFFAOYSA-N 336.388 1.550 10 10 EDCE NCc1cc(F)c(N2CCOC[C@H]2CCO)cc1Br 694924215 SMCBWYRZHULKIZ-SNVBAGLBSA-N 333.201 1.635 10 10 EDCE CO[C@@H](C)CN[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1266734863 ATTHMQCSVXDMSG-LEWSCRJBSA-N 333.392 1.734 10 10 EDCE CCCNC(=O)[C@@H](C)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1346292115 YGMRMKLVLCVWHR-ZIAGYGMSSA-N 348.447 1.488 10 10 EDCE CN(Cc1cnn(C)n1)c1cc(Br)c(CN)cc1F 2115773393 ABFQZWOUKGWVKA-UHFFFAOYSA-N 328.189 1.812 10 10 EDCE CCC(CC)C(=O)N[C@H]1C[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1703900678 LRIQXDUFNHXZSG-HDJSIYSDSA-N 349.431 1.912 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(CO)nc3)C2)cc1 1639682571 HAHGKJFPZJQZHH-CQSZACIVSA-N 341.411 1.839 10 10 EDCE COc1ccc(CNC2(CNC(=O)Cc3nnc(C)o3)CC2)cc1C 1499217565 YPVLIARGLJQJOP-UHFFFAOYSA-N 344.415 1.676 10 10 EDCE C[C@@H](NC(=O)[C@H]1COCCN1CC(F)F)c1ccc(N(C)C)cc1 1567777031 HDCPOEIPGROOJN-IUODEOHRSA-N 341.402 1.896 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccc(-c2nncnn2)cc1 1631904978 MVYXJHUYMMCHAX-XBXARRHUSA-N 349.350 1.674 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](c1cncn1C)N(C)C 1567465663 XBLKTCMBTFNCRQ-BDJLRTHQSA-N 332.404 1.181 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)C2CC=CC2)cc1C 1677065780 PFUFZFKXXDHCBZ-QGZVFWFLSA-N 332.444 1.879 10 10 EDCE Cc1nn(C)c(C)c1S(=O)(=O)Nc1ccc(O)cc1C(=O)O 13463974 VRADTXAZBDWJBY-UHFFFAOYSA-N 325.346 1.242 10 10 EDCE CNCc1ccc(N(C)[C@@H]2CC(=O)N(C)C2)cc1Br 2131952309 JYJBCYAPPPILAW-GFCCVEGCSA-N 326.238 1.835 10 10 EDCE CNCc1ccc(N2CC[C@H]3CC(=O)N[C@H]3C2)cc1Br 2145056387 ZUWFLURCNQNPAX-HZMBPMFUSA-N 338.249 1.883 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1985099819 SJXKRNWMHDFEAX-GHMZBOCLSA-N 327.385 1.421 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@H]1CCOC1 2010389091 LGFUUQOQZDWMOI-JQWIXIFHSA-N 339.396 1.685 10 10 EDCE CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2012344311 YDPPOQDXTCXTQH-VXGBXAGGSA-N 341.412 1.811 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCO[C@H](CF)C3)c(Br)cc21 2172041858 QHPSEPCUGITYQE-JMCQJSRRSA-N 344.184 1.576 10 10 EDCE COC(=O)N[C@H]1CCN(c2cc(Br)c(CN)cc2F)C1 380516738 QNEXDYSJRJFITO-VIFPVBQESA-N 346.200 1.982 10 10 EDCE O=S1(=O)C[C@@H]2CN(Cc3ccc(Br)cc3O)C[C@H]2C1 2087857916 FMHNLHCDWDFLGW-QWRGUYRKSA-N 346.246 1.631 10 10 EDCE C[C@H](N)c1ccc(N(CCO)CCN(C)C)c(Br)c1 2099358236 YDIFHHSOFRQVJR-NSHDSACASA-N 330.270 1.829 10 10 EDCE CN(C)C(=O)[C@H]1C=CCN1c1cc(Br)c(CN)cc1F 2280238013 RWMZDPURHVXBJF-GFCCVEGCSA-N 342.212 1.880 10 10 EDCE Oc1cc(O)c(CNCCCN2CCOCC2)cc1Br 2282990032 MVMDEIXQZMRUTL-UHFFFAOYSA-N 345.237 1.672 10 10 EDCE O=C(O)[C@]12CCO[C@@H]1CN(Cc1c(O)cccc1Br)C2 2296418540 LDYIEQBWLGUAAC-OCCSQVGLSA-N 342.189 1.830 10 10 EDCE O=C(O)CCN1C(=O)C(=Cc2ccc([N+](=O)[O-])o2)SC1=S 2296882992 HTHQDHPDPQMZLP-UHFFFAOYSA-N 328.327 1.864 10 10 EDCE CNC(=O)[C@@H](C)CN(C)c1ccc(C=CC(=O)OC)cc1[N+](=O)[O-] 2297778679 HHQFZLMLFZSRPC-NSHDSACASA-N 335.360 1.599 10 10 EDCE Cc1ccc(CN[C@@H]2CO[C@@H]3COC[C@H]23)c(O)c1Br 2352944535 JFJCETUDRSAWDD-IJLUTSLNSA-N 328.206 1.967 10 10 EDCE Cc1ccc(CN(C)CC2(O)CC(N)C2)c(O)c1Br 2352954095 XKICKTXIXSGUHO-UHFFFAOYSA-N 329.238 1.747 10 10 EDCE COC[C@@]1(C(=O)O)C=CCN1Cc1cc(Br)ccc1O 2361556903 GXGIXGYAUARGSY-CQSZACIVSA-N 342.189 1.996 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CCO[C@]3(CCOC3)C2)cc1F 187238134 XPUAMWJXHZEJFJ-QGZVFWFLSA-N 337.395 1.593 10 10 EDCE COc1ccc(N2CCN(CCCNCc3nccn3C)CC2)cc1 272897730 OYMLHSCXRBTXJZ-UHFFFAOYSA-N 343.475 1.731 10 10 EDCE COc1ccc(O)c(CN[C@H](C(=O)OCc2ccccc2)[C@H](C)O)c1 293954018 PJIHHOVAAUFHNB-UGSOOPFHSA-N 345.395 1.983 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)C[C@@H]1CCCO1 297902338 RTZNHIJMBNMLEI-INIZCTEOSA-N 333.432 1.348 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Nc3cn(C)nc3OC)C2)cc1 822901972 OVXQCZWHWJXJBA-GFCCVEGCSA-N 345.403 1.838 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)/C=C\[C@@H]1CCCO1 821409625 IQCIUKZKTSCCCP-MQNTZWLQSA-N 346.427 1.989 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCC(=O)NCC(F)(F)F)c1 728948884 IOPMOFPBQDDISQ-QMMMGPOBSA-N 349.309 1.440 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1c2n(c(=O)n1C)CCCC2 822265129 KCFNATVOCVRUQB-UHFFFAOYSA-N 342.443 1.861 10 10 EDCE C[C@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCN1CC(C)(C)O 588540779 LMMIIMIZZZKPIT-VGVVRCBHSA-N 334.416 1.415 10 10 EDCE CC[C@@H]1[C@@H](CO)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1 837818058 XYKHUIQCEDKWMH-SJLPKXTDSA-N 347.459 1.826 10 10 EDCE CO[C@@H](CS(=O)(=O)Nc1ccc(O)cc1C)C1CCOCC1 842585093 RFANNHKIGRNDNC-HNNXBMFYSA-N 329.418 1.884 10 10 EDCE COc1cc(CN2CCS(=O)(=O)[C@@H]3CCC[C@H]32)c(O)cc1C 840146517 PXZPYNUEPDAOOD-CZUORRHYSA-N 325.430 1.861 10 10 EDCE Oc1cc2c(cc1CN1CCn3c(CC4CC4)nnc3C1)[C@H](O)CO2 844719182 NCRJMXZHDBVIIC-OAHLLOKOSA-N 342.399 1.378 10 10 EDCE COc1cc(Cl)cc(CN2C[C@@H](C)N(CCO)C[C@H]2C)c1O 841890406 AKRKGSLDPDPDPE-VXGBXAGGSA-N 328.840 1.941 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3cc[nH]n3)C2)cc1 852456576 ZAECGLTWAYFWCO-ZDUSSCGKSA-N 329.404 1.839 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3C)C2)c1 750657064 LVXCCSOUDZANPR-NWJSVONSSA-N 347.415 1.770 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCc3c[nH]nc3C)C2)cc1 853405568 SKLDGEFBUXLQHF-AWEZNQCLSA-N 329.404 1.805 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)N3CCN(C)CC3)C2)cc1 855230294 FVKGPUOLQLJOJL-HOTGVXAUSA-N 346.475 1.026 10 10 EDCE CC(C)CN1CCO[C@H](CNC(=O)CN(C)c2ccc(N)cc2)C1 863558476 KGYZJQBJBWJYOG-QGZVFWFLSA-N 334.464 1.178 10 10 EDCE COCC(=O)N[C@H](C(=O)NCc1ccc2cccnc2c1O)C(C)C 862027838 HKOWDCNNMTZUOM-HNNXBMFYSA-N 345.399 1.344 10 10 EDCE COC(=O)C1=CC[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1 863522594 WASVFPKRKVWZQN-CYBMUJFWSA-N 330.340 1.418 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@H]2CCCS2)c1 871033270 ZFNYGUDFPLWHGM-LLVKDONJSA-N 344.458 1.779 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2C[C@@H](C)Cn3nccc32)c1 893889418 AAGUYTNAMLSPGD-VSQXVHSFSA-N 325.372 1.334 10 10 EDCE COc1cc(NS(=O)(=O)c2ccc(-n3cnnn3)cc2)ccc1O 797819788 SNWHPHFEVGVDOK-UHFFFAOYSA-N 347.356 1.177 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC(=O)Cc3ccc(O)c(O)c3)[C@H]2C1 1141550666 HLJZMLIIZFQUQQ-ATCWAGBWSA-N 348.399 1.622 10 10 EDCE CC(C)C[C@@H](CNC[C@H](C)O)NC(=O)c1ccc(N=NC(N)=O)cc1 1319644136 WKBVMGFWTDPMNO-WFASDCNBSA-N 349.435 1.964 10 10 EDCE C[C@@H](NC(=O)c1ccnc2c(C(N)=O)cnn12)c1ccccc1O 1171723048 LFSCWBYFFQHELT-SECBINFHSA-N 325.328 1.025 10 10 EDCE NCc1cn(C2CN(Cc3ccc(Br)cc3O)C2)nn1 713316553 VUYVCMBXHUQGIV-UHFFFAOYSA-N 338.209 1.262 10 10 EDCE CN1CCOC[C@@H]1CNC(=O)NCc1ccc(N2CCCC2)cc1 1331504099 NJSGSNMWRMJCKX-KRWDZBQOSA-N 332.448 1.417 10 10 EDCE CNCCC1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1332127408 GZDZPNJCFKIFCM-UHFFFAOYSA-N 331.416 1.083 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CC[C@H](C)C3)C2)cc1 1332163281 BZXLIZZGOXXNHZ-ZNMIVQPWSA-N 345.443 1.695 10 10 EDCE CC[C@@H](CNC(=O)[C@H]1CCNC(=O)C1)NCc1ccc(OC)c(C)c1 1269390323 LHGAULDKLPELLQ-HOTGVXAUSA-N 347.459 1.514 10 10 EDCE COCC(=O)Nc1ccc(OC(=O)Cc2ccc(O)c(O)c2)cc1 1293214164 CZXUOHFRSTVBJK-UHFFFAOYSA-N 331.324 1.831 10 10 EDCE COc1cccc(-n2cc(C(=O)NCc3cc(O)ccc3O)nn2)c1 1455354462 NLVJRGFIJXMBTH-UHFFFAOYSA-N 340.339 1.617 10 10 EDCE Cc1ccc(S(=O)(=O)CCC(=O)NCc2ccc(O)c(O)c2)cc1 1465955628 ZYEOTWDQXGZMSN-UHFFFAOYSA-N 349.408 1.886 10 10 EDCE CC(C)(C)C(=O)N1CSC[C@H]1C(=O)NCc1cc(O)ccc1O 1471661335 NRHQPODJNSYRNV-LBPRGKRZSA-N 338.429 1.662 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C[C@@H]1CC(=O)NC1=O 1540488100 DKPOEZJXZLMXRU-AWEZNQCLSA-N 329.400 1.298 10 10 EDCE CN1CC(=O)N(CC(=O)NCc2c(O)ccc3ccccc23)C1=O 1635965063 KMKCJVKLTJLKLE-UHFFFAOYSA-N 327.340 1.056 10 10 EDCE CNC(=O)NCC(=O)N1CCC[C@H]1CNCc1ccc(OC)c(C)c1 1733341106 ZVVYCKUGBZHFHV-HNNXBMFYSA-N 348.447 1.013 10 10 EDCE CP(C)(=O)c1ccc(C(=O)Nc2nc(C3=S=CC=C3)n[nH]2)cc1 1648456695 GLPIOICBQGZOSV-UHFFFAOYSA-N 346.352 1.931 10 10 EDCE CCS(=O)(=O)c1cccc(CC(=O)NCc2cc(O)ccc2O)c1 1643882442 XNXNTYUZBRGTLZ-UHFFFAOYSA-N 349.408 1.750 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H]2CCC2(F)F)cc1C 1667843942 YTSQPWJMOYVEJB-ZIAGYGMSSA-N 342.386 1.616 10 10 EDCE C[C@H]1C[C@@H](O)CN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C1 1684608015 YUOSPTYSVNJDNL-BMGDILEWSA-N 348.491 1.768 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3[nH]nnc3C)CC2)cc1C 1699659501 SXROZERVILQOJB-UHFFFAOYSA-N 329.404 1.482 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCCC[C@@H](C)O 1690651720 FSHKSQUOUZLLBV-NWDGAFQWSA-N 335.408 1.718 10 10 EDCE CC[C@H]1SC(=S)N(CCCC(=O)NC[C@@H]2CCCO2)C1=O 11636353 IBWHGGHCYNPWEL-WDEREUQCSA-N 330.475 1.701 10 10 EDCE CNCc1ccc(N2CC(=O)N(C)[C@@H](C)C2)c(Br)c1 1925953053 XCEZVMUVFLIOEJ-JTQLQIEISA-N 326.238 1.835 10 10 EDCE COc1ccc(N2C[C@@H](O)C[C@@H]2CNC(=O)OC(C)(C)C)c(N)c1 2014240238 UZEFAPNGVJDUJY-NEPJUHHUSA-N 337.420 1.742 10 10 EDCE CC(C)(C)OC(=O)N1CC(CNC(=O)c2cc(O)c(O)c(O)c2)C1 2015120253 QYBZSLSYJDFYPN-UHFFFAOYSA-N 338.360 1.400 10 10 EDCE Cn1ncc(CNC(=O)Cc2ccc(O)c(O)c2)c1Br 2173120025 KIEZQEOQUMCAMY-UHFFFAOYSA-N 340.177 1.453 10 10 EDCE CN(C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)c1ccc(N)cc1 2080723488 WTXIGDUMAAJZKR-WFASDCNBSA-N 349.431 1.850 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213586271 ABSHRHKSYDFOGK-NOOOWODRSA-N 339.396 1.704 10 10 EDCE CCNCc1ccc(N2CC[C@@H]2[C@H](O)CO)c(Br)c1 2270719162 TXAXHLMUWDIDJQ-ZIAGYGMSSA-N 329.238 1.491 10 10 EDCE CN1CCC(CNC(=O)C=Cc2ccc(N3CCOCC3)cc2)CC1 2297505725 VMNZUWASSXMXJI-UHFFFAOYSA-N 343.471 1.994 10 10 EDCE Cc1ccc(CNC[C@H](O)CCC(=O)O)c(O)c1Br 2352950284 QFIAYKBDSKCXFS-SNVBAGLBSA-N 332.194 1.778 10 10 EDCE COc1ccc(N2CCN(CCCNC(=O)C(F)(F)F)CC2)cc1 101629348 HXSPICLUANQKFS-UHFFFAOYSA-N 345.365 1.886 10 10 EDCE CCc1ccc(OCCCN/C=C2/C(=O)NC(=O)N(C)C2=O)cc1 59383125 YIKCNUCXPRUQCU-KAMYIIQDSA-N 331.372 1.200 10 10 EDCE Cc1c(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)nnn1C 266413565 CWCYTAFYTNUAMP-CQSZACIVSA-N 330.388 1.651 10 10 EDCE Cc1ccc(CN[C@]2(C)CCC(=O)NC2=O)c(O)c1Br 2380796312 RQDFLGPAZYRDSF-CQSZACIVSA-N 341.205 1.748 10 10 EDCE OCc1cnc(NCc2ccc(N3CCC(O)CC3)c(F)c2)cn1 820634683 PSJMBQYCTQFHHE-UHFFFAOYSA-N 332.379 1.681 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)Cc1nccnc1OC 822512194 XGTWOUYZJUIFRQ-UHFFFAOYSA-N 331.372 1.756 10 10 EDCE C[C@@H]1NCCC[C@@H]1NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 588595560 PZZPXJPLXZVXFN-AVECDBLKSA-N 329.444 1.793 10 10 EDCE COc1ccc(N2CCN(C(=O)c3c[nH]c(C(N)=O)c3)CC2)cc1 916723139 GDIHVLCBRMSSGQ-UHFFFAOYSA-N 328.372 1.085 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCCCC[C@@H]2CCO)cc1 839595647 KJQFEFQNTQWFER-GOSISDBHSA-N 333.476 1.996 10 10 EDCE C[C@@H](CNC(=O)NCc1cc(Br)ccc1O)N(C)C 836623546 NUWCRQJBQRCCJV-VIFPVBQESA-N 330.226 1.904 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)NCc1cncc(O)c1 914334894 HMMONRXOSYXKRQ-UHFFFAOYSA-N 342.399 1.623 10 10 EDCE CN(C)c1ccc(CNC(=O)NCc2ncc3c(n2)CCOC3)cc1 844778318 ZOWIWZGMTNRGQU-UHFFFAOYSA-N 341.415 1.615 10 10 EDCE CO[C@H](CCNC(=O)C(=O)NCCc1ccc(N)cc1)C(F)(F)F 842148061 PONQXFLNVHCIFW-GFCCVEGCSA-N 347.337 1.011 10 10 EDCE Cc1ccc([C@@H](C)NCC[C@H]2CNCCS2(=O)=O)c(O)c1C 925796375 OJHLCZYQWQTRNX-KGLIPLIRSA-N 326.462 1.436 10 10 EDCE O=C(NCc1cc(NC(=O)C2CSC2)ccc1O)C1CSC1 923118684 KABMSFVQECSYDW-UHFFFAOYSA-N 338.454 1.673 10 10 EDCE COc1cccc(O)c1CNC[C@H]1CN(Cc2ccncc2)CCO1 858306520 OUFBUFQEUVPJKY-INIZCTEOSA-N 343.427 1.786 10 10 EDCE COc1ccc(N2CCC(NC(=O)N3CC[C@@]4(O)C[C@H]4C3)CC2)cc1 853643704 LPHLVGWFZWLPRU-IFXJQAMLSA-N 345.443 1.830 10 10 EDCE CCCC[C@@H](NC(N)=O)C(=O)NCc1ccc2cccnc2c1O 862028030 NPMRBRTZYIPXOX-CYBMUJFWSA-N 330.388 1.784 10 10 EDCE CN(C)c1ccc(CN2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1 863642079 JOQCEJNQSROKTM-MSOLQXFVSA-N 344.459 1.510 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)C[C@@H]2NC(=O)NC2=O)cc1 763435211 VDDSCASXPKLKME-AWEZNQCLSA-N 332.404 1.089 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C)O[C@H](C)[C@@H]3C)nc12 782628934 OXJLANMWPLBJDX-SDDRHHMPSA-N 348.403 1.609 10 10 EDCE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](O)Cc1cnn(C)c1 786801548 JJSWJBBXDSJIJE-SFHVURJKSA-N 344.459 1.827 10 10 EDCE CN1CCN(c2ccc(CNC(=O)[C@@]34C[C@@H]3COC4(C)C)cc2)CC1 893608485 VDKQDDMTQDUZGX-OXQOHEQNSA-N 343.471 1.870 10 10 EDCE COC(=O)c1c(CN2CCc3nn[nH]c3C2)c2cc(F)ccc2n1C 895352896 DWDTUQYTAOTQLZ-UHFFFAOYSA-N 343.362 1.780 10 10 EDCE COc1ccc(N2CCN(C[C@H](O)CN3CC(C(C)C)C3)CC2)cc1 795542765 AJQMCGOYFFSIDV-IBGZPJMESA-N 347.503 1.766 10 10 EDCE NS(=O)(=O)c1ccc(N2Cc3cccc(O)c3C2)c([N+](=O)[O-])c1 1163967123 HPTSCUXKZYFTQZ-UHFFFAOYSA-N 335.341 1.468 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cc(C)nn2C)cc1C 1317570786 RTTPATCJJOULJI-UHFFFAOYSA-N 330.432 1.907 10 10 EDCE O=C(CN1CCCC2(CC2)S1(=O)=O)N1Cc2cccc(O)c2C1 1347150167 AJIBBYKQSLPYAL-UHFFFAOYSA-N 336.413 1.193 10 10 EDCE Cc1sc(S(N)(=O)=O)cc1C(=O)N(C)Cc1ccccc1O 1294673877 UAWCXEYLTQNOJW-UHFFFAOYSA-N 340.426 1.682 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cc3n(n2)CCC[C@@H]3O)c1 1545684060 ISFLQGYFOZHREZ-QFYYESIMSA-N 331.372 1.916 10 10 EDCE CCOC(=O)Cn1nc(C)cc1NC(=O)Cc1ccc(O)c(O)c1 1557310654 ZYOHHWWJQHPZAU-UHFFFAOYSA-N 333.344 1.347 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)Cc2cncn2C)cc1C 1496207580 QSADWBXWAPEHBX-HNNXBMFYSA-N 344.459 1.916 10 10 EDCE C[C@H](NC(=O)NCCN1CCNC1=S)c1ccc(N(C)C)cc1 1564598031 XMUGQQBQFMSUOS-LBPRGKRZSA-N 335.477 1.303 10 10 EDCE C[C@@H]1CCN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C[C@@H]1O 1638917651 JKEBJJNHSVGCDJ-OLMNPRSZSA-N 348.491 1.768 10 10 EDCE CN(Cc1ccccc1)C1CN(C(=O)Cc2ccc(O)c(O)c2)C1 1640480556 VZQRTBPTDJLJGL-UHFFFAOYSA-N 326.396 1.983 10 10 EDCE CCCCN(Cc1ccccc1O)[C@H]1CS(=O)(=O)C[C@H]1OC 1645424844 TZXPMAXEHMTSIQ-GOEBONIOSA-N 327.446 1.806 10 10 EDCE CCOC(=O)[C@H](C[C@H]1CCCO1)NC(=O)/C=C\c1ccc(O)c(O)c1 1644419738 BRHXEDACPYUNHR-APMKWMSLSA-N 349.383 1.728 10 10 EDCE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCNC(=O)C2)cc1 1746089873 WLJYBAZAYFCTQI-UHFFFAOYSA-N 342.447 1.417 10 10 EDCE CO[C@](C)(C(=O)NCc1c(O)cccc1O)C(=O)OC(C)(C)C 1652629150 YDAABGCHCKBTBV-MRXNPFEDSA-N 325.361 1.461 10 10 EDCE CCNCc1ccc(N2CCN(S(C)(=O)=O)CC2)c(Cl)c1 164059594 PFTXOAMXBXXAFV-UHFFFAOYSA-N 331.869 1.531 10 10 EDCE Cc1noc(C)c1CN1C(=O)COc2ccc(N3CCNCC3)cc21 31947280 XINCCWXKCQCQNZ-UHFFFAOYSA-N 342.399 1.627 10 10 EDCE NC(=O)CO[C@@H]1CCCN(c2ccc(CO)cc2Br)C1 2145380693 BSYOVSVNISTNET-LLVKDONJSA-N 343.221 1.412 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985102031 AWFFHYWPECTCTE-HBNTYKKESA-N 327.385 1.419 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC(N=[N+]=[N-])CC1 1990033728 YHZIWFYWXMHQAH-LLVKDONJSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NC(=O)Nc1ccc(N)cc1 1999154455 YPHINZAYCPFBGK-CHWSQXEVSA-N 336.392 1.682 10 10 EDCE CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CC[C@H](CN=[N+]=[N-])C2)C1 2010402818 WIEOVMCDCRQURA-VXGBXAGGSA-N 339.396 1.781 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@H](CNC(=O)OC(C)(C)C)[C@H]1CCOC1 2010388996 KABZPYXAZBDJCR-NWDGAFQWSA-N 341.412 1.933 10 10 EDCE C[C@H](O)c1ccc(N(C)Cc2c(Br)nnn2C)cc1O 2156477577 YXAQURYOISCIRR-QMMMGPOBSA-N 341.209 1.973 10 10 EDCE O=C(C=Cc1cccnc1)NCc1ccc(N2CCNC(=O)C2)cc1 2041107203 JGKAHWNFUNVCOL-UHFFFAOYSA-N 336.395 1.347 10 10 EDCE COCCN(CC(=O)O)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2053779066 DPRQTABLAUFTSB-UHFFFAOYSA-N 348.399 1.096 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)c(Br)c1 2173320394 OWCRJFDWJUDZFB-JUDXGUMMSA-N 341.249 1.489 10 10 EDCE C[C@@H](CO)N1CCN(c2ccc([C@@H](C)N)cc2Br)CC1 2169361867 AFQZVQQBTKKJEB-NWDGAFQWSA-N 342.281 1.972 10 10 EDCE Cc1nn(C)c(Br)c1CNCc1ccc(O)c(O)c1O 2185787830 RCALJIHWRVNCNZ-UHFFFAOYSA-N 342.193 1.898 10 10 EDCE OCc1ccc(N2[C@H](CO)C[C@H]3OCC[C@H]32)cc1Br 2090533205 CVFDKCYKIZDXFZ-IACUBPJLSA-N 328.206 1.670 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1 2300526334 RHHMIYAQMIOIRA-UHFFFAOYSA-N 340.428 1.698 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)Nc1ccnn1C[C@H]1CCOC1 2307987035 YBQXQAUPEGVJRZ-CYBMUJFWSA-N 329.356 1.983 10 10 EDCE CC1(C)[C@@H](O)C[C@H]1NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2310366436 GURKMGYFCDKGPN-SJORKVTESA-N 330.428 1.812 10 10 EDCE Cn1ncnc1CNC(=O)NCc1ccc(N2CCSCC2)cc1 175675954 HRBSSMKTBMJCQB-UHFFFAOYSA-N 346.460 1.368 10 10 EDCE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CNC(=O)C1 175841917 FOMKPGIGARNIBI-VIFPVBQESA-N 341.205 1.639 10 10 EDCE Cc1ccccc1/C=C1/SC(=S)N(CC(=O)NCCO)C1=O 210393423 RLLMKTLATFABSS-XYOKQWHBSA-N 336.438 1.305 10 10 EDCE Oc1c(Cl)cccc1CN1CCN(c2ccc3nncn3n2)CC1 180081504 KEVHYPRMKZXMHM-UHFFFAOYSA-N 344.806 1.806 10 10 EDCE COc1cc(O)c(CN2CCC[C@@H](Cn3cncn3)C2)cc1OC 183406149 PBXOSCKCEWJVCZ-CYBMUJFWSA-N 332.404 1.913 10 10 EDCE CC(=O)N1CCN(C(=O)c2c(C)oc(-n3cccc3)c2C#N)CC1 198644443 DSXKPTMFERFYJG-UHFFFAOYSA-N 326.356 1.555 10 10 EDCE O=C(Cc1ccccc1[N+](=O)[O-])NCCN1C(=O)CSC1=S 49756748 FNKXPNMLDWWIDX-UHFFFAOYSA-N 339.398 1.114 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCCC[C@@H]2[C@@H]2CNC(=O)C2)c1O 373209244 KIDNSVISXZCJFC-QWHCGFSZSA-N 349.387 1.800 10 10 EDCE CN(C)c1ccc(CN2CCCN(S(=O)(=O)C3CC3)CC2)cc1 374773146 DAZGCAQMYJVVTM-UHFFFAOYSA-N 337.489 1.753 10 10 EDCE O=C(NCc1cc(Br)ccc1O)c1cnc2[nH]nnc2c1 804741430 YHGBDVBRLDKZOE-UHFFFAOYSA-N 348.160 1.751 10 10 EDCE CCCCN(Cc1ccccc1O)C(=O)Cn1cnc([N+](=O)[O-])n1 801548724 NMOXRTTXJYROMW-UHFFFAOYSA-N 333.348 1.721 10 10 EDCE CN(C)c1ccc(CN2CCN([C@@H]3CCNC(=O)CC3)CC2)cc1 825148034 OYPCYEYRCVDFSJ-SFHVURJKSA-N 330.476 1.539 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N(C)C[C@@H]1CCCO1 839270406 DEANAVCLNZKNIY-HNNXBMFYSA-N 334.416 1.768 10 10 EDCE Cn1nccc1[C@@H]1COCCN1Cc1ccc(N2CCOCC2)cc1 846116635 WACVGQYKJUKOLG-IBGZPJMESA-N 342.443 1.830 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@@H]2C[C@H]1C[S@]2=O 845002194 HMLLZVMKIGXMLR-PBPSECFOSA-N 331.441 1.478 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N(C1CC1)[C@@H]1CCNC1 841731154 YZWXYMYPCJPOPM-GOSISDBHSA-N 344.459 1.559 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCn4ccnc43)C2)cc1 852360652 JOMKCORODPIPTD-XJKSGUPXSA-N 341.415 1.915 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cc(F)cnc3O)C2)cc1 857302204 JBEPPLHXKCHLAY-GFCCVEGCSA-N 331.347 1.944 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCCC34OCCO4)C2)cc1 855224395 KISLXMYEEFVTSZ-RHSMWYFYSA-N 346.427 1.933 10 10 EDCE CCO[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)[C@H]1CCOC1 864984674 ZGRKGGUAMDFDAE-FUHWJXTLSA-N 348.443 1.581 10 10 EDCE CS(=O)(=O)C1(C(=O)NCc2ccc3cccnc3c2O)CCCC1 862027714 CTWJWVQZDDYWER-UHFFFAOYSA-N 348.424 1.914 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H](CO)OC[C@H]2C)c([N+](=O)[O-])c1 765537937 ZUSYXWLDWSRBPY-CBHWHFHUSA-N 336.344 1.367 10 10 EDCE O=C(O)[C@@H](F)C1(O)CN(Cc2ccc(Br)cc2O)C1 1875537893 DXKHJPGIPALDFV-SNVBAGLBSA-N 334.141 1.124 10 10 EDCE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@@H]1[C@H]2COC[C@H]21 792864422 FLYRCTMAGYGYCC-ZSHCYNCHSA-N 333.457 1.684 10 10 EDCE Nc1ccc(CC(=O)NC2CN(C(=O)OCc3ccccc3)C2)cc1 1959370418 GILMKTHVJSCQPO-UHFFFAOYSA-N 339.395 1.949 10 10 EDCE Nc1ccc(Cn2nc(Cc3ccc(F)cc3)c(O)nc2=O)cc1 82720957 WYFBIFYXDARXBZ-UHFFFAOYSA-N 326.331 1.704 10 10 EDCE Cc1nc2c(cc1C(=O)NCc1cc(O)ccc1O)c(C)nn2C 1176747935 FXGZLGIZBYJROX-UHFFFAOYSA-N 326.356 1.926 10 10 EDCE COc1ccc(CNCC2(NC(=O)CC(N)=O)CCCCC2)cc1C 1329815213 XJFFXGDXKZOAJV-UHFFFAOYSA-N 347.459 1.788 10 10 EDCE NC(=O)N[C@@H](CC(=O)NCc1c(O)cccc1O)c1cccs1 1178904899 CHSIRKHNWJXINE-JTQLQIEISA-N 335.385 1.575 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1CCC2(CCCC2)O1 1326860701 BYGBZLPCVCDOTI-HNNXBMFYSA-N 346.427 1.959 10 10 EDCE COc1ccc(CNC[C@H]2CN(C(=O)CCN(C)C)CCO2)cc1C 1327033121 BXLMKZXRJAAOIE-KRWDZBQOSA-N 349.475 1.272 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)C[C@H]2CCN(C)C2)cc1C 1275406675 PJYYKRKGIPDGOG-DOTOQJQBSA-N 333.476 1.940 10 10 EDCE C[C@H](CNC(=O)CC1CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1354213092 YVSFMFPAWVEYKD-SNVBAGLBSA-N 331.376 1.884 10 10 EDCE O=C(N[C@H]1CCc2nnnn2CC1)c1cc2cc(O)c(O)cc2s1 1451703119 ZZDANIDTRBGAAU-VIFPVBQESA-N 345.384 1.434 10 10 EDCE COc1cccc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)c1 1540344218 MDYKEDAWMRSHHB-UHFFFAOYSA-N 342.395 1.998 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CC(=O)N(C2CCCCC2)C1 1558175059 ZLAGXCYLRMGXIW-CYBMUJFWSA-N 332.400 1.895 10 10 EDCE COc1ccc(CN[C@H]2CCN(C(=O)CNC(C)=O)C[C@H]2C)cc1C 1715408657 YEWDIGRXJLLMAZ-PBHICJAKSA-N 347.459 1.466 10 10 EDCE Cc1nc(O)c2c(n1)CN(C(=O)c1ccc(N=NC(N)=O)cc1)C2 1557741633 OHDCHXNYEYQUQJ-UHFFFAOYSA-N 326.316 1.809 10 10 EDCE CC(=O)N/C(=C/C1=S=CC=C1)C(=O)Nc1ccc([S@@](C)=O)cc1 1629045307 ADXRDKBDFGTZFV-WIJYMUHASA-N 348.449 1.660 10 10 EDCE CC(C)[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cccc(O)c1O 1628785622 VYUHBQZEHVZOMX-JQWIXIFHSA-N 338.429 1.774 10 10 EDCE CNc1nccc(C(=O)NCCc2ccc(O)c(O)c2)c1[N+](=O)[O-] 1630335175 MCSAVEYBBMQBFY-UHFFFAOYSA-N 332.316 1.415 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 1639289360 OQTHLARCEPTUJZ-CQSZACIVSA-N 340.379 1.763 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CCn2c(nnc2C(F)(F)F)C1 1638377367 PMAZJBCFMLPKRK-UHFFFAOYSA-N 346.240 1.503 10 10 EDCE COc1ccc(CNC2(CNC(=O)c3[nH]c(O)nc3C)CC2)cc1C 1723529400 NSMMNGYBOQSRQO-UHFFFAOYSA-N 344.415 1.793 10 10 EDCE COC(=O)C1=NO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3)C2)C1 1649042571 SRRBMSXENJMZHG-NJELEJDNSA-N 346.339 1.031 10 10 EDCE Cn1cc([C@H](O)C(=O)NCc2cccc(Br)c2O)cn1 1640083818 IQHRKRHZIPOROC-LBPRGKRZSA-N 340.177 1.238 10 10 EDCE Cc1cc(Cn2nnc(C(=O)NCc3c(O)cccc3O)c2C)on1 1597574171 JDXFTIYSCDGCKY-UHFFFAOYSA-N 343.343 1.272 10 10 EDCE Cc1nnc(N2CC[C@@H](C(N)=O)C2)n1Cc1ccc(N(C)C)c(F)c1 1751899255 XQSISDLGCBOZDO-CYBMUJFWSA-N 346.410 1.152 10 10 EDCE O=C1C[C@H](N(C(=O)c2cc3cc(O)c(O)cc3s2)C2CC2)C(=O)N1 1598388416 UUEJHAQDTWLWKT-VIFPVBQESA-N 346.364 1.332 10 10 EDCE Cc1cc(C)n2nc(C)c(C(=O)NCc3cc(O)ccc3O)c2n1 1593872749 CKQCAIDLEVCOBO-UHFFFAOYSA-N 326.356 1.996 10 10 EDCE CN(CCNC(=O)C(F)F)C(=O)c1ccc(N=NC(N)=O)cc1 1688303329 VKEMHHPGXDUDRU-UHFFFAOYSA-N 327.291 1.302 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H]2CCC(=O)N2)cc1C 1698736755 ASCXOAZRZXGNIQ-SWLSCSKDSA-N 333.432 1.124 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N1CC[C@H](N=[N+]=[N-])C1 1902571820 TVMGNYYCVMUNJK-NSHDSACASA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2012309330 KVTKTXPXXQSGFP-LOIXOFCESA-N 339.396 1.706 10 10 EDCE CN[C@H](C)c1ccc(N2CC[C@H](O)[C@@H](CO)C2)cc1Br 396819001 WBFANLLYDNUCAX-HFAKWTLXSA-N 343.265 1.909 10 10 EDCE NCc1ccc(N2CC[C@@H](O)[C@@H](CO)C2)c(F)c1Br 396912547 DPGUAWPFHGETLW-MWLCHTKSSA-N 333.201 1.226 10 10 EDCE CC(C)(C)OC(=O)N[C@@]12C[C@H]1CN(CC(=O)Nc1ccc(N)cc1)C2 2044675847 CNTHVZXQOYOJQT-KPZWWZAWSA-N 346.431 1.806 10 10 EDCE O=C(NCc1cncc(Br)c1)c1cc(O)c(O)c(O)c1 2188874543 IEXDGXVTYWFJGD-UHFFFAOYSA-N 339.145 1.891 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213582292 GKJQBRQODIZHEN-TUAOUCFPSA-N 339.396 1.970 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H](O)C[C@@H](F)C3)c(Br)cc21 2234668169 DVEBTMDLUKSWRU-QHMRUWFYSA-N 344.184 1.310 10 10 EDCE Cn1nc(Br)c(COC(=O)CCc2ccc(N)cc2)n1 2235269376 MKHSZQSOJJKZBX-UHFFFAOYSA-N 339.193 1.836 10 10 EDCE Cn1nc(Br)c(CNC(=O)CCc2ccc(N)cc2)n1 2235258426 KWFAAFWWFIQBNJ-UHFFFAOYSA-N 338.209 1.409 10 10 EDCE OCc1ccc(N2C[C@H]3OCCC[C@@]3(CO)C2)cc1Br 2239155202 JDOZWGBZUNQMRY-CABCVRRESA-N 342.233 1.919 10 10 EDCE O[C@H]1CN(c2ccc(CNC3CCC3)c(Br)c2)C[C@H]1O 2239987125 GAFDLSQVIGWEQM-GASCZTMLSA-N 341.249 1.633 10 10 EDCE O=C(O)C1CN(C2CN(Cc3c(O)cccc3Br)C2)C1 2284230549 LPXLBKSZEZGRFV-UHFFFAOYSA-N 341.205 1.355 10 10 EDCE CCN[C@H]1CC[C@@H]1CS(=O)(=O)NCc1cnc(SC)s1 2284693842 ZCMKKBQVHLLNHO-KOLCDFICSA-N 335.520 1.673 10 10 EDCE CN1C(=O)NC(=O)C(=Cc2cccn2-c2cccc([N+](=O)[O-])c2)C1=O 2297056936 AOLLMUCGNRVSFP-UHFFFAOYSA-N 340.295 1.477 10 10 EDCE Cc1ccc(CN(C)C(=O)NCC(=O)O)c(O)c1Br 2352949157 ZQUGTRRIRPKRHD-UHFFFAOYSA-N 331.166 1.689 10 10 EDCE COc1ccccc1N1CCN(C(=O)c2cc(O)nc(O)c2)CC1 170223460 YEBWOSWUEJFLGE-UHFFFAOYSA-N 329.356 1.464 10 10 EDCE COc1ccc(CN2CCN(c3nccc(OC)n3)CC2)c(O)c1 129607247 SAQFWAMVKMOBBY-UHFFFAOYSA-N 330.388 1.522 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@H]2CCc3nn(C)c(=O)cc3C2)cc1 238828841 FKKWSBZKYZGBAB-AWEZNQCLSA-N 340.427 1.268 10 10 EDCE COC(=O)[C@@H]1C[C@H](O)CN1Cc1cc(Br)cc(C)c1O 248879966 GCCQTWGJIAPRJZ-RYUDHWBXSA-N 344.205 1.571 10 10 EDCE CN(Cc1ccccc1O)C(=O)N[C@H]1CCN(C2CCOCC2)C1=O 365851103 HKVLSMSXSAMYGD-HNNXBMFYSA-N 347.415 1.314 10 10 EDCE c1cc(N2CCOCC2)ccc1CNC[C@@H]1CN2CCC[C@@H]2CO1 378903903 YDAZTDGWADXNFA-RTBURBONSA-N 331.460 1.476 10 10 EDCE C[C@H]1C[C@H](N(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2)CCN1C 283564619 RLEPBNFVTALSGS-WMLDXEAASA-N 346.475 1.310 10 10 EDCE O=[N+]([O-])c1cc([C@@H](C2CCOCC2)N2CCNCC2)cc(O)c1O 575269273 NDQHEBAMGXZIDY-OAHLLOKOSA-N 337.376 1.379 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1CCOC[C@H]1C 819698920 TYAFJZPKJQRYCX-UKRRQHHQSA-N 335.400 1.957 10 10 EDCE CC[C@@H](NC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)OC 817910316 QDEMMOIVUGBCBM-GFCCVEGCSA-N 333.413 1.998 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)C[C@@H]3CCCN3)CC2)cc1 829504617 GPXASGZSVAQANL-INIZCTEOSA-N 346.475 1.076 10 10 EDCE COC(=O)[C@@H]1CO[C@H](CCC(=O)NCc2cccc(OC)c2O)C1 821064896 INRKEVTURUNOJU-QWHCGFSZSA-N 337.372 1.375 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)C3CCC3)C2)cc1 828309568 LEUCQCXDTYWRRN-HIFRSBDPSA-N 345.443 1.695 10 10 EDCE CN(C)C(=O)CN1CCN(C/C=C/c2ccc(N(C)C)cc2)CC1 835025228 GNVRDBKKORHPDB-AATRIKPKSA-N 330.476 1.472 10 10 EDCE C[C@@H]1C[C@@H]1N1C[C@@H](NC(=O)NCc2cc(Cl)ccc2O)CC1=O 845025774 ISWBCZBLDRQRGQ-ICCXJUOJSA-N 337.807 1.854 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NC[C@@H]1CCCNC1 841923505 JDHLEWZHSYULAN-SNVBAGLBSA-N 342.237 1.954 10 10 EDCE Oc1cc2c(cc1CN1CCc3cc(Cl)nnc3C1)[C@H](O)CO2 842620848 SMZUGRTWSJLQMD-CQSZACIVSA-N 333.775 1.820 10 10 EDCE CC[C@@H](CS(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)OC 849416479 AQMLIHZLAGLFIB-ZFWWWQNUSA-N 342.461 1.618 10 10 EDCE O=C(NCCCSc1nccs1)N1CCN2C[C@H](O)C[C@H]2C1 847335551 FLDPYINRHYLVNQ-NWDGAFQWSA-N 342.490 1.086 10 10 EDCE CNS(=O)(=O)[C@H]1CCCN(Cc2c(O)cc(C)cc2Cl)C1 840915291 NXTWEVICPVFORO-NSHDSACASA-N 332.853 1.868 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1ccc(O)nc1 854987848 LCGNUKSTSUCEFE-UHFFFAOYSA-N 344.367 1.627 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CCCNC3=O)C2)cc1 852379767 CEOCXHNXOJOFHQ-KBPBESRZSA-N 346.431 1.099 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)COC[C@H]3CCCO3)C2)cc1 855230734 IURSDVLBMWHCHB-WMLDXEAASA-N 334.416 1.586 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](O)CC(C)C)C2)cc1 854299783 LOFOUEQUTFFQSG-GDBMZVCRSA-N 335.448 1.980 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3C[C@@H](O)C34CCC4)C2)cc1 854297158 NTHSFVKMVZYOQX-RRQGHBQHSA-N 345.443 1.877 10 10 EDCE CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C=C1CCNCC1)CC2 852847181 PJLOUFMSERXZAM-UHFFFAOYSA-N 349.456 1.184 10 10 EDCE COc1cc(N2CCC[C@@](O)(CN(C)C)C2)c([N+](=O)[O-])cc1OC 865923719 AIXFXUFGIMKLLA-MRXNPFEDSA-N 339.392 1.505 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)C1(N2CCOCC2)CC1 864862310 JIULKYPUBWFYSP-UHFFFAOYSA-N 329.444 1.768 10 10 EDCE CC(C)(C)S(=O)(=O)CC(=O)NCc1ccc2cccnc2c1O 862026844 AMNCLELSRWUKHY-UHFFFAOYSA-N 336.413 1.770 10 10 EDCE COCCOCCN(CCO)Cc1cc(Br)ccc1O 862468533 KNIAJPDOWBVPBZ-UHFFFAOYSA-N 348.237 1.612 10 10 EDCE Cc1cc(C(=O)N(C)[C@H]2C[C@@H](C(N)=O)C2)c(C)n1-c1ccccn1 863360422 OWHPBXOAIOPFLR-OKILXGFUSA-N 326.400 1.825 10 10 EDCE NS(=O)(=O)C[C@H]1CCCN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 769427612 KYGSRXQFZCSAHV-SNVBAGLBSA-N 349.796 1.207 10 10 EDCE CCO[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)C1CCOCC1 867302900 WDNSBGTVJWYNNR-SJKOYZFVSA-N 337.416 1.977 10 10 EDCE CN(C)c1ccc(CN2C(=O)N[C@H](c3ccn(C)n3)C2=O)cc1F 761175204 ANOYXZDQGJNJOX-CQSZACIVSA-N 331.351 1.418 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC12CCOCC2 765476878 METFMZGSOUMDPG-UHFFFAOYSA-N 345.443 1.988 10 10 EDCE COC(=O)c1c(CNC[C@@](C)(CO)OC)c2cc(F)ccc2n1C 895183144 IQDUFCUKPFOLCY-KRWDZBQOSA-N 338.379 1.591 10 10 EDCE COC[C@@H](O)CCNCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894369425 UUWRFENWGQWJPV-LBPRGKRZSA-N 338.379 1.591 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCN(C3CCOCC3)CC2)cc1 1137170024 FGAWEVRHQNVFMR-UHFFFAOYSA-N 345.403 1.786 10 10 EDCE COC(=O)COc1ccc(C(=O)NCc2ccc(O)cc2O)cc1 1142529901 INEKISODNRPUQN-UHFFFAOYSA-N 331.324 1.580 10 10 EDCE O=C1CCCC[C@H]1[C@H]1COCCN1C(=O)Cc1ccc(O)c(O)c1 1151960793 PPRWHVWPNDGXGM-UONOGXRCSA-N 333.384 1.627 10 10 EDCE Nc1ccc(Cn2nc(-c3c[nH]c4ccccc34)c(=O)[nH]c2=O)cc1 82720964 DPRPCCHNRSAAJB-UHFFFAOYSA-N 333.351 1.710 10 10 EDCE Cc1cn(CC(=O)NCc2c(O)cccc2O)nc1C(F)(F)F 1178917692 QUDHEOXUYRGVPT-UHFFFAOYSA-N 329.278 1.938 10 10 EDCE O=C(N1CCC[C@H](CNCc2ccc(O)c(O)c2)C1)C(F)(F)F 689448004 ZKBPXPWGMOCDTD-LLVKDONJSA-N 332.322 1.988 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](NC(N)=O)C2)cc1Br 690738155 NEZFMODVBQFJAG-BDAKNGLRSA-N 328.210 1.749 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2cncnc2O)cc1C 1331473095 DFTUGTQCZIGWTF-ZDUSSCGKSA-N 344.415 1.750 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@@](C)(NC(C)=O)C2CC2)cc1 1269596242 LKONMMMFAAVARK-QGZVFWFLSA-N 344.419 1.065 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@H](c2cncn2C)N(C)C)cc1F 1464551662 XHNZFDFPOCCFRQ-INIZCTEOSA-N 333.411 1.544 10 10 EDCE Cn1cc([C@H]2C[C@H](NC(=O)Cc3ccc(O)c(O)c3)CCO2)cn1 1636573415 JRXXNNUKVZUMFR-CZUORRHYSA-N 331.372 1.410 10 10 EDCE COc1cccc([C@@H](NCCN=[N+]=[N-])C(N)=O)c1Br 1912176641 BTDVIJXNZDECKT-SNVBAGLBSA-N 328.170 1.884 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)Cc2nc[nH]n2)cc1C 1732921184 CROLSYMDXMQHBH-ONEGZZNKSA-N 329.404 1.126 10 10 EDCE CCC[C@@H](C)C(=O)N1CC[C@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1737432758 PPOYIENBMGCNED-OCCSQVGLSA-N 349.431 1.866 10 10 EDCE COc1ccc(-n2nnnc2CNC[C@@H](C)NC(=O)CC2CC2)cc1 1669229047 GIMMPYCEWPARND-GFCCVEGCSA-N 344.419 1.065 10 10 EDCE Cc1cc(O)c(CN2CCN(c3ccc4nncn4n3)CC2)cc1C 152596732 SUAFCXQHPXEWNY-UHFFFAOYSA-N 338.415 1.769 10 10 EDCE CO[C@@H]1C[C@H](NCc2cc(Br)cc(F)c2O)C[C@@H]1O 2130803954 FGHAUIAETLCTLK-ADEWGFFLSA-N 334.185 1.922 10 10 EDCE CC(C)(C)OC(=O)N1CCCN1C[C@@H](O)COc1ccc(N)cc1 1999441979 ODWJWXDODHPQJQ-CQSZACIVSA-N 337.420 1.866 10 10 EDCE O=C(O)[C@@H]1[C@@H]2OCCN(Cc3cc(Br)cc(F)c3O)[C@@H]21 2149275434 HJPKANIKVBIOEI-UMNHJUIQSA-N 346.152 1.578 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CC[C@@H]2C[C@H]21 2003167213 MTQXAQOSNRBGMJ-QMQUXMOJSA-N 336.432 1.945 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CC[C@H]2C[C@H]21 2003167216 MTQXAQOSNRBGMJ-TWDLFLEPSA-N 336.432 1.945 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2010404183 PLLKYVTUSHSSDL-NEPJUHHUSA-N 339.396 1.924 10 10 EDCE CN(C)CCN(CC(=O)N1CC[C@@H](N=[N+]=[N-])C1)C(=O)OC(C)(C)C 2010393404 RWNVUSPYPREVRS-GFCCVEGCSA-N 340.428 1.696 10 10 EDCE O=C(O)[C@@H]1CO[C@@H]2CN(Cc3cc(Br)ccc3O)C[C@@H]21 2160870962 JNFMLTBESKNFRY-NQBHXWOUSA-N 342.189 1.686 10 10 EDCE OCCN1CCC[C@@H](NCc2c(O)cccc2Br)C1 706835368 XEZQEUZWRVFTQZ-LLVKDONJSA-N 329.238 1.701 10 10 EDCE CCNCc1ccc(N(C)[C@@H]2COC[C@H]2O)c(Br)c1 708073109 XUUNLJNBIQEQHW-ZIAGYGMSSA-N 329.238 1.755 10 10 EDCE C[C@@H](CS(C)(=O)=O)N(C)c1ccc(CO)cc1Br 688587547 QUNVSQFPZZJVHW-VIFPVBQESA-N 336.251 1.811 10 10 EDCE OCc1nnc(CNCc2ccc(Br)cc2O)s1 2072468555 FTOGKCLEAJZYJM-UHFFFAOYSA-N 330.207 1.788 10 10 EDCE C[C@@H](O)[C@H]1CCCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2193592500 HXJSSPGGYPJXCA-QUUYKZCZSA-N 341.205 1.784 10 10 EDCE C[C@@H]1CC[C@@H](NC(=O)C(F)(F)F)CN1C(=O)Cc1ccc(N)cc1 2044625732 YMPRWTCWMFLMMG-ZWNOBZJWSA-N 343.349 1.869 10 10 EDCE CNCc1ccc(N2CC[C@]3(C[C@@H](O)CO3)C2)cc1Br 2201781009 SZTSVBIQJNPNLE-HIFRSBDPSA-N 341.249 1.899 10 10 EDCE NCc1cc(F)c(N2C[C@H](O)[C@H]3COC[C@H]32)cc1Br 2102186377 FYZUBURQXZNBCJ-CKLFPEKLSA-N 331.185 1.243 10 10 EDCE CNCc1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(Br)c1 2104414313 JJRCKHCJHBKQSZ-IGJVIKARSA-N 327.222 1.099 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)C[C@@H](O)C2)c(Br)c1 2105075450 RCNWLOYXEMVBBB-ZMLRMANQSA-N 329.238 1.661 10 10 EDCE CC(C)NC(=O)NCCNCc1ccc(Br)cc1O 2092417828 CQLOWQUDOPPASU-UHFFFAOYSA-N 330.226 1.952 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])CC(O)C1 2213587631 JSVWLSSTQBRDNY-WWALYXLFSA-N 339.396 1.752 10 10 EDCE NCc1cc(F)c(N2C[C@H]3CCO[C@]3(CO)C2)cc1Br 2239919743 YBCVCHQTEQRCLT-YGRLFVJLSA-N 345.212 1.635 10 10 EDCE CN(C(=O)[C@@H]1CC[C@@H](O)CN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2253625882 XVPIMDPOWNDCKJ-CABCVRRESA-N 349.431 1.992 10 10 EDCE CCN(CC)CCNC=C1C(=O)NC(=O)N(c2ccccc2F)C1=O 2296135860 FKYIZNNMFSNECQ-UHFFFAOYSA-N 348.378 1.224 10 10 EDCE CSc1ncc(CNC(=O)[C@@H]2CNC[C@@H]2C(F)(F)F)s1 2284638147 FTYMNIUGTOXDTQ-SFYZADRCSA-N 325.381 1.879 10 10 EDCE Cc1ccc(CN2C(=O)C(C)(C)S2(=O)=O)c(O)c1Br 2352693717 PLVJDLLVEBAPGQ-UHFFFAOYSA-N 348.218 1.914 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC(NC(C)=O)CC2)c([N+](=O)[O-])c1 50933063 WQEWDGAGWXSFLK-GQCTYLIASA-N 347.371 1.886 10 10 EDCE NC(=O)NCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 174596860 DUNRSSRGEBCFQB-SNVBAGLBSA-N 342.346 1.041 10 10 EDCE C[C@H]1C(=O)NCCN1c1ccc(/C=C\C(=O)O)c(Br)c1 312185302 IMYARQIJDQPOAG-LVCFMKKZSA-N 339.189 1.872 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)Nc3cn[nH]c3)cc2)CC1 191738458 WOSYXKVRDUVKJF-UHFFFAOYSA-N 342.403 1.400 10 10 EDCE COCCCN(C)[C@H](C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 247825269 FLQJKNSGTPGMNA-MRXNPFEDSA-N 349.475 1.701 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)OCC(=O)N1CCCC1 255376082 IGLGQRHYRWMVOK-YVMONPNESA-N 344.411 1.702 10 10 EDCE CC(=O)N(C)CC(=O)N(C)Cc1ccc(C)c(Br)c1O 2380771397 ILGOFQPXOUWYBB-UHFFFAOYSA-N 343.221 1.900 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cn([C@H]2CCCNC2)nn1 818208830 MYXOTZFDYAJWEO-INIZCTEOSA-N 342.447 1.541 10 10 EDCE CCN(CC)CCS(=O)(=O)NCc1ccc2c(c1)CCCN2C 810044915 VARTVSMNXKYNFS-UHFFFAOYSA-N 339.505 1.830 10 10 EDCE COC[C@H](CCCN)NCc1ccc(N2CCOCC2)c(F)c1 817888006 IKCZCCNQQMXNJQ-HNNXBMFYSA-N 325.428 1.506 10 10 EDCE CCOc1ccc(O)c(CN2CCN(S(C)(=O)=O)[C@H](C)C2)c1 827270556 BHBKLGLYGOQVMH-GFCCVEGCSA-N 328.434 1.257 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1c(O)ncnc1O 900399743 IPFARBVWQPPVRQ-UHFFFAOYSA-N 330.388 1.545 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCOC[C@H]2C(F)(F)F)cc1 839531863 IAXURNQKWHXMSR-AWEZNQCLSA-N 345.365 1.632 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cnn(C4CC4)c3N)C2)cc1 912292061 ICRYCRZTVMESFL-LBPRGKRZSA-N 341.415 1.818 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1C[C@@H](C(N)=O)C1 845260526 BKNHPTOWXAKZGB-AEGPPILISA-N 332.448 1.555 10 10 EDCE O=C(NCCc1nnc2n1CCCCC2)NCc1c(O)cccc1F 913978909 DDGVNMZYXSGYHB-UHFFFAOYSA-N 347.394 1.891 10 10 EDCE C[C@H](O)[C@H]1CN(C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 840259872 SWBOHGCSHVYHKI-WMLDXEAASA-N 333.432 1.578 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)C[C@H]3CCOC3)C2)cc1 849415547 BRULXENUYZGCCP-UONOGXRCSA-N 340.445 1.230 10 10 EDCE COc1cc(Br)cc([C@H](C)NC[C@@]2(O)CCOC2)c1O 848535598 DWTUPGALMXHCLH-XPTSAGLGSA-N 346.221 1.965 10 10 EDCE C[C@@H](NCC[C@@H]1CNCCS1(=O)=O)c1ccc(N(C)C)cc1 925801258 XKNDUVIHIQCBSR-CZUORRHYSA-N 325.478 1.180 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC3(CO)CCCC3)C2)cc1 854299017 DVGULPAGESHBBH-AWEZNQCLSA-N 333.432 1.878 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@]3(C)CCCO3)nc12 756549300 ASEJAPPJFJIFOE-MRXNPFEDSA-N 349.343 1.224 10 10 EDCE CCC(=O)N1CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 852447883 GDMUEAKDYMZCTA-CQSZACIVSA-N 346.431 1.495 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NCC[C@@H]2CC2(F)F)cc1 856717618 GBWXDAPSAYTMLL-LLVKDONJSA-N 342.342 1.748 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cncc(OC)n3)C2)cc1 855225398 MRZHIHAWDSSQKT-LBPRGKRZSA-N 328.372 1.503 10 10 EDCE CN1CC(=O)N(CCN(Cc2ccco2)Cc2ccccc2O)C1=O 851841730 XSQBGARGASSDGD-UHFFFAOYSA-N 343.383 1.881 10 10 EDCE CC(=O)c1cc(F)cc(CN2CC[C@H]3[C@@H]2CCCN3CCO)c1O 934258205 DKCSCTPBZDYXBK-IRXDYDNUSA-N 336.407 1.765 10 10 EDCE CNC(=O)NC[C@@H]1CN(Cc2cc(F)c(N(C)C)cc2F)CCO1 862463013 WMLUQMGTSXXWJP-GFCCVEGCSA-N 342.390 1.161 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN1Cc1cc(Cl)cc(C)c1O 775734770 ZQJBPJICXJHIDN-CYBMUJFWSA-N 332.853 1.868 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H]4CC[C@@H](O)[C@@H]43)C2)cc1 875716979 SWHFEJJVOZJECT-LBTBCDHLSA-N 345.443 1.829 10 10 EDCE CN(C)C(=O)C1(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CC1 788266148 NYPFCEHNFSOXLU-UHFFFAOYSA-N 345.443 1.350 10 10 EDCE CNC(=O)[C@@H]1CCN(c2nnc(-c3sccc3O)n2CC2CC2)C1 1123518198 BXGQLYLQTJGUNI-LLVKDONJSA-N 347.444 1.695 10 10 EDCE CCCN(CC(N)=O)Cc1c(C(=O)OC)n(C)c2ccc(F)cc12 894849839 IBEUESGYTBACPB-UHFFFAOYSA-N 335.379 1.801 10 10 EDCE CN(C)S(=O)(=O)[C@@H]1CCCN(Cc2c(O)ccc3ccncc23)C1 795650185 FSZSECUSVOCVKP-CQSZACIVSA-N 349.456 1.796 10 10 EDCE Cn1nccc1[C@@H]1C[C@H](NC(=O)NCc2ccccc2O)CCO1 1228458813 LTVBKTQHIKTPIY-CJNGLKHVSA-N 330.388 1.845 10 10 EDCE O=C(O)C1(O)CCN(Cc2ccc(Br)cc2O)CC1 1890256811 PQUZAMWIGHGURZ-UHFFFAOYSA-N 330.178 1.566 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NCCC2CC=CC2)cc1F 1332652179 GTIBCBMRROQROK-UHFFFAOYSA-N 333.407 1.980 10 10 EDCE COC1CC(CCNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 1330520125 HVDUWCLNWHATHW-CBCUQQMYSA-N 347.459 1.861 10 10 EDCE COCC1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 1916896111 GGNOGOPDNMUARI-LBPRGKRZSA-N 326.194 1.484 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)CC(C)(F)F)cc1C 1283803689 KWDRUDATTNXTMI-ZDUSSCGKSA-N 330.375 1.616 10 10 EDCE COc1cccc(C2=NO[C@H](C(=O)NCc3cc(O)ccc3O)C2)c1 1455351255 FCHQXEBKXOXRNW-KRWDZBQOSA-N 342.351 1.916 10 10 EDCE COc1ccc(-n2nnnc2CNCC[C@H](C)NC(=O)C2CC2)cc1 1715617793 XWYOEBIOJVYKDY-LBPRGKRZSA-N 344.419 1.065 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccccc1O[C@@H]1CC(=O)N1 1557101929 DIUJWTJEULEHCW-JHTBKMLMSA-N 340.335 1.975 10 10 EDCE O=C(Cn1cc([N+](=O)[O-])cn1)NCc1c(O)ccc2ccccc12 1639384888 ZBMLADFAXZRTHS-UHFFFAOYSA-N 326.312 1.967 10 10 EDCE CN(C)c1ccc(/C=C/c2c([N+](=O)[O-])c(=O)n(C)c(=O)n2C)cc1 4116774 FMSNSFZRTNIQNG-JXMROGBWSA-N 330.344 1.229 10 10 EDCE C[C@H]1C(=O)N(CCN(C)C)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1570632006 DAUDKGLIIWWGHU-NSHDSACASA-N 346.391 1.041 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)c3nsnc3O)C2)cc1 1570563297 MFHRROBHDCSOSQ-SNVBAGLBSA-N 334.401 1.509 10 10 EDCE Cc1c(C(=O)NCc2ccc(O)cc2O)cnn1-c1ccc(O)nn1 1570462272 LYUYKYYMYYFWOX-UHFFFAOYSA-N 341.327 1.018 10 10 EDCE CO[C@H](C)C(=O)N(C)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1747920465 DCJFUBRHIRSOSS-SNVBAGLBSA-N 347.375 1.167 10 10 EDCE O=C(Cn1cnc2sccc2c1=O)NCc1cc(O)ccc1O 1593868422 JOTNLWQLIQCHCH-UHFFFAOYSA-N 331.353 1.186 10 10 EDCE C[C@]1(O)Cc2ccc3c(c2C(=O)[C@@H]1O)C(=O)c1cccc(O)c1C3=O 5553519 ZGIMJLWQWQRQNJ-OALUTQOASA-N 338.315 1.018 10 10 EDCE biogenic CNC(=O)[C@@H]1CCCN1c1ccc(CN)c(Br)c1F 231839462 MQEUMSBRJHLGGM-JTQLQIEISA-N 330.201 1.762 10 10 EDCE CNCc1ccc(N2C[C@H](O)[C@H](O)[C@H]2CF)cc1Br 2140661885 JFTCJQKUGNUTEL-FRRDWIJNSA-N 333.201 1.048 10 10 EDCE CO[C@@](C)(CN)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952207484 UNBJNKGYPSEWBY-YOEHRIQHSA-N 340.420 1.897 10 10 EDCE CC(C)(C)OC(=O)NCCONS(=O)(=O)Cc1ccc(N)cc1 1977700916 SWCZLEPOXDJRFK-UHFFFAOYSA-N 345.421 1.145 10 10 EDCE CC(C)(C)OC(=O)NCCN(CCO)Cc1cc(N)ccc1O 1977927805 WRFQOPAFMSYFBO-UHFFFAOYSA-N 325.409 1.293 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](CO)[C@@H](CCO)C2)cc1Br 2149915565 VRBIFQZRKGOFMU-SDDRHHMPSA-N 343.265 1.896 10 10 EDCE C[C@@H]1CC[C@@H]([C@H](NC(=O)OC(C)(C)C)C(=O)NCCN=[N+]=[N-])O1 1985101566 UQTHWMLDSMKOQP-VWYCJHECSA-N 327.385 1.874 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CNCc1ccc(F)c(F)c1O 1985777475 MXIVXFUPLHMUIU-SNVBAGLBSA-N 332.347 1.646 10 10 EDCE CC(C)(C)OC(=O)NCCN(CCO)C(=O)Nc1ccc(N)cc1 1999442831 OUZPMEOHKLQXGV-UHFFFAOYSA-N 338.408 1.620 10 10 EDCE COC1CC(C(=O)N2CC(N=[N+]=[N-])C2)(N(C)C(=O)OC(C)(C)C)C1 2010388925 IWYRWJOYMVFSRG-UHFFFAOYSA-N 339.396 1.922 10 10 EDCE NCc1ccc(N2CCN3C[C@H](O)C[C@H]3C2)c(F)c1Br 405226671 DKVYWTDSTNZSMO-WDEREUQCSA-N 344.228 1.302 10 10 EDCE CCNCc1ccc(N2C[C@H](O)[C@H]3COC[C@@H]32)cc1Br 2158392682 MTUWTOBPKTYHCM-QEJZJMRPSA-N 341.249 1.755 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@H]3CCCO[C@H]3C(C)C)c2n1 2063383870 LZTNTTSGJVKAQD-DOMZBBRYSA-N 332.404 1.924 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C1CC(CO)C1 2193580205 GNOKFZQZOWAAKR-KTRLOWJHSA-N 341.205 1.642 10 10 EDCE C[S@](=O)CC1CN(c2cc(Br)c(CN)cc2F)C1 2047848516 UKIMBGTYTVDGED-SFHVURJKSA-N 335.242 1.862 10 10 EDCE Nc1ccc(CS(=O)(=O)N[C@H]2CCCC3(CC2)OCCO3)cc1 2191629666 PQASZZZKJPCENH-HNNXBMFYSA-N 340.445 1.764 10 10 EDCE NCc1ccc(N2C[C@H]3C[C@@]2(CO)CO3)c(F)c1Br 2094652195 YCCMLKORJGJITO-NOZJJQNGSA-N 331.185 1.387 10 10 EDCE C[C@@H](CO)N1CCN(c2ccc(CO)c(Br)c2)CC1 2113064729 UFAZVESJHLAYEM-NSHDSACASA-N 329.238 1.444 10 10 EDCE C[C@H]1CCC[C@](COc2nnc(=N)[nH]n2)(NC(=O)OC(C)(C)C)C1 2213783191 NCHHPNJFGGHMSI-BONVTDFDSA-N 338.412 1.532 10 10 EDCE CN(NCc1c(O)cccc1Br)S(=O)(=O)C1CC1 2317480478 TXJJEIVNABIGFQ-UHFFFAOYSA-N 335.223 1.583 10 10 EDCE OCc1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2332589692 ATUZWXHLQBEMMT-PCDDKUFXSA-N 328.206 1.262 10 10 EDCE Cc1ccc(CN(CCO)CCC(=O)O)c(O)c1Br 2352679940 NYASHFOKYKSLOZ-UHFFFAOYSA-N 332.194 1.732 10 10 EDCE Cc1ccc(CNC[C@H](C)c2nn[nH]n2)c(O)c1Br 2352680487 QHXLWVYACAZQFW-QMMMGPOBSA-N 326.198 1.870 10 10 EDCE Cc1ccc(CN2C[C@@H]3C(C(N)=O)[C@H]3C2)c(O)c1Br 2352943357 SCDOAJPRMARKOK-UWVGGRQHSA-N 325.206 1.626 10 10 EDCE CCN(CC)c1ccc(CNC(=O)CN(C)S(=O)(=O)CC)cc1 176047343 OWTRGOVYZQDTHA-UHFFFAOYSA-N 341.477 1.431 10 10 EDCE C[C@@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@H]3O)c(Br)c1 2357053418 VSHVOIBIAJWZBJ-MAMIUBEXSA-N 341.249 1.932 10 10 EDCE Cc1noc([C@H](C)N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)n1 182418762 YGTRBCTUJBPHHW-NSHDSACASA-N 346.387 1.617 10 10 EDCE Cc1cc(NS(=O)(=O)c2cc(C(=O)N(C)C)n(C)c2)ccc1O 182477095 SURMEIGHYQCWHP-UHFFFAOYSA-N 337.401 1.542 10 10 EDCE O=C(NC[C@@H]1CCCO1)N1CCN(c2ccc3c(c2)OCCO3)CC1 242973395 HOILHDLTFLRTAV-HNNXBMFYSA-N 347.415 1.468 10 10 EDCE Oc1ccccc1CN(C[C@@H](O)Cn1cccn1)C[C@H]1CCCO1 245820321 VGWVBEDTTOYNKY-IAGOWNOFSA-N 331.416 1.631 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3C(=O)NC(C)C)CC2)cc1 242945503 HEACIZGQMRHHCI-DLBZAZTESA-N 345.443 1.505 10 10 EDCE C[C@@H](NC[C@]1(CO)COCC2(CCC2)N1C)c1ccc(F)cc1O 527955317 NOMCYCOXACIFHO-ACJLOTCBSA-N 338.423 1.798 10 10 EDCE COC(=O)C(C)(C)CNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255864296 PEHXKJPINNYULO-TWGQIWQCSA-N 346.427 1.852 10 10 EDCE O=C(O)/C=C\c1ccc(N2CCNC(=O)CC2)cc1Br 379760851 ZFBKDWPZLVKDAE-RQOWECAXSA-N 339.189 1.873 10 10 EDCE C[C@H]1C[C@@H](C(=O)O)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 398838346 JIBJLUVHODPBII-DTWKUNHWSA-N 335.316 1.473 10 10 EDCE Oc1ccc(Br)cc1CN=c1nc2[nH][nH]cc-2c(O)n1 804828765 ZLSKCQILSRDCDP-UHFFFAOYSA-N 336.149 1.512 10 10 EDCE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C1CNC1 817917073 MWRDZOFVXHDISC-MRXNPFEDSA-N 328.504 1.916 10 10 EDCE C[C@H]1C(=O)N(C)CN1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 825775755 AOADCOXDEHKYNV-KGLIPLIRSA-N 346.431 1.414 10 10 EDCE CC(C)N1C(=O)CN(C(=O)C(=O)Nc2ccc(N)cc2)CC1(C)C 841051571 RHWZAOHBNIPAHA-UHFFFAOYSA-N 332.404 1.065 10 10 EDCE C[C@@]12CCN(Cc3cc(O)n4ncc(C(=O)O)c4n3)C[C@H]1C2(F)F 851708306 CUXYIWOHAKZXTM-QMTHXVAHSA-N 338.314 1.610 10 10 EDCE C[C@@]1(C2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)COC(=O)N1 928158932 ACDRPDQPYOKKDE-AJNOYIKESA-N 346.383 1.848 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)[C@H]3CCOC3)C2)cc1 852146821 IWZWBGMGAUYUHV-ILXRZTDVSA-N 333.432 1.998 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)Cc3cncc(O)c3)C2)cc1 855226952 REJAKUBJRSWRER-CQSZACIVSA-N 327.384 1.733 10 10 EDCE CO[C@H](CNC(=O)NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCOC1 852440585 SCEPBIVALGAQNI-CZUORRHYSA-N 339.411 1.742 10 10 EDCE C[C@@H]1CN(c2ccncc2)CCN1C(=O)Cc1ccc(O)c(O)c1 1455927580 CDXQTAOQFLBJKU-CYBMUJFWSA-N 327.384 1.773 10 10 EDCE C[C@H](NS(=O)(=O)c1cnn(CC(F)F)c1)c1ccccc1O 867834077 KOGWREUDBOTSQK-VIFPVBQESA-N 331.344 1.893 10 10 EDCE CN(OCC(F)(F)F)C(=O)c1cc(NS(C)(=O)=O)ccc1O 863846262 DVXPKHKGAKSTCM-UHFFFAOYSA-N 342.295 1.330 10 10 EDCE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NCCCN=[N+]=[N-])CO1 1895876306 ULMUXPZBOXKYSX-GHMZBOCLSA-N 327.385 1.827 10 10 EDCE Cc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1 788148317 RBMFSGRCBZMUQS-AWEZNQCLSA-N 340.427 1.950 10 10 EDCE COc1cc(C)cc(CNC[C@@H]2CCCCN2S(C)(=O)=O)c1O 894752075 HAHYJPGIWHFGPN-AWEZNQCLSA-N 342.461 1.613 10 10 EDCE COc1cc(NS(=O)(=O)c2cnc3c(c2)c(C)nn3C)ccc1O 797820214 LTJGATKKLADZBT-UHFFFAOYSA-N 348.384 1.792 10 10 EDCE CN(C)c1ccc(CNc2cc(C(=O)O)c3nc(N)nn3c2)cc1 82729812 ABABHWHHOSGZSF-UHFFFAOYSA-N 326.360 1.688 10 10 EDCE NCc1ccc(N2CCC[C@@H](NC(N)=O)C2)c(F)c1Br 702152073 WZCWNOGRJVLHLI-SECBINFHSA-N 345.216 1.684 10 10 EDCE C[C@]1(O)CCN(c2cc(Br)c(CN)cc2F)C[C@H]1O 1893300273 MBHAYJPKKGDUKA-OLZOCXBDSA-N 333.201 1.369 10 10 EDCE COc1ccc(C(=O)NCc2cccc(O)c2O)cc1-n1cnnn1 1176565202 IQAXRDGHNCOULF-UHFFFAOYSA-N 341.327 1.012 10 10 EDCE Oc1c(Br)cccc1CN1CCN2CCOC[C@H]2C1 757928718 WOWMBZODXGTXLW-GFCCVEGCSA-N 327.222 1.671 10 10 EDCE CO[C@@H]1CC[C@H]1N(C)C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1262270440 WOTGSHGAZYAYFN-APHBMKBZSA-N 333.432 1.566 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C(F)F 1284265524 CYOGZJBADFSRMT-ZETCQYMHSA-N 327.291 1.349 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc([C@H]2CCCN2C)[nH]n1 1447560056 FHZRVSUVCGEZKK-IAQYHMDHSA-N 344.415 1.949 10 10 EDCE C[S@](=O)Cc1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1 1449217258 RYPTVALAIOTNNL-QHCPKHFHSA-N 333.409 1.835 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCNC(=O)C2CCC2)cc1 1293095336 QCIZQUPCFIFCLM-UHFFFAOYSA-N 331.376 1.885 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)cc1 1296520755 OXGNDEANDNXDBJ-DRZSPHRISA-N 329.360 1.575 10 10 EDCE CCOc1ccc(N2CCN(C(=O)[C@H]3CC[C@H]3C(=O)OC)CC2)cc1 1295275244 LQHNWTUBFCVNEM-DLBZAZTESA-N 346.427 1.933 10 10 EDCE C[C@@H](NC(=O)COCC(=O)NCc1cccnc1)c1ccccc1O 1454803818 GTVHOSVPOPXHNT-CYBMUJFWSA-N 343.383 1.297 10 10 EDCE C[C@@H]1C[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C(=O)N1c1ccccc1 1465464268 QQWXKXYOGBYNDZ-IUODEOHRSA-N 340.379 1.951 10 10 EDCE Cc1n[nH]cc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1471912631 RCZRFDVIERMDAA-UHFFFAOYSA-N 341.415 1.350 10 10 EDCE COC1CCN(c2ccc(CN3CC[C@@H](NC(N)=O)C3)cc2)CC1 1473349111 PGNURFUJIKUVFU-OAHLLOKOSA-N 332.448 1.544 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)[C@@H]2CN(C)CCO2)cc1C 1716533918 OUZJTSYIPLWKCG-SFHVURJKSA-N 349.475 1.272 10 10 EDCE COC(=O)c1ccn(CC(=O)NCc2c(O)ccc3ccccc23)n1 1639388160 WKUWROFMHMNLLB-UHFFFAOYSA-N 339.351 1.845 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCN[C@H](c2ccc(O)cc2)C1 1631048477 SSXNIBRWZLAMOT-HNNXBMFYSA-N 328.368 1.519 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CN2CC[C@@H](C)C2)cc1C 1498118284 QNDATTGRUNQVQU-ZBFHGGJFSA-N 333.476 1.940 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C2CC3(CC3)C2)cc1C 1568580175 RIJDSSURQWASIL-INIZCTEOSA-N 332.444 1.761 10 10 EDCE CC[C@H]1CN([C@@H](CC)C(=O)NCc2cccc(OC)c2O)CCO1 1630365605 AEXQDWMFDOELDC-GJZGRUSLSA-N 336.432 1.906 10 10 EDCE CCS(=O)(=O)CCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1632301672 QHLNVGYLGGOMPO-UHFFFAOYSA-N 326.378 1.356 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H](C)C(F)(F)F)cc1C 1571437024 LVRWMLWNHBTOEU-DGCLKSJQSA-N 348.365 1.769 10 10 EDCE CCOC(=O)c1c[nH]nc1[C@H]1CCN(C(=O)c2cccc(O)c2O)C1 1641514841 PSSQSPGGYRIZFB-JTQLQIEISA-N 345.355 1.627 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)c(CO)c1 1651178137 PLQLZYPSDBBJKZ-ZZXKWVIFSA-N 329.352 1.668 10 10 EDCE C[S@](=N)(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1594850443 YLNCQEKMBNBJQJ-HSZRJFAPSA-N 338.393 1.198 10 10 EDCE CCN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C1COC1 1915657208 PWXWLRGOMDODPY-GFCCVEGCSA-N 326.194 1.626 10 10 EDCE OCc1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c(Br)c1 2134818744 ATUZWXHLQBEMMT-OLRMPSLUSA-N 328.206 1.262 10 10 EDCE Nc1snnc1-c1nc(-c2ccc(Br)cn2)no1 1923196713 CWHGPRUNPGZKIG-UHFFFAOYSA-N 325.151 1.995 10 10 EDCE C[C@@](O)(CO)[C@@H]1CCN(c2ccc(CN)cc2Br)C1 2138099705 BXEXAKGVAHXJEH-BXUZGUMPSA-N 329.238 1.477 10 10 EDCE COC[C@@](C)(N)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1951993114 MFISJYMOEJZTNG-RHSMWYFYSA-N 340.420 1.897 10 10 EDCE CC(C)(C)OC(=O)N1CCS[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 1980376970 KBOXTYLVFDYIDL-GVXVVHGQSA-N 342.461 1.605 10 10 EDCE CC(C)(C)OC(=O)N1CCNC(=O)CCN(CCN=[N+]=[N-])CC1 1982248328 SQBQGCSRKQBPON-UHFFFAOYSA-N 326.401 1.356 10 10 EDCE COC1(C(=O)N(C)CCCN=[N+]=[N-])CN(C(=O)OC(C)(C)C)C1 1985102678 KMYKLHRGUCGDKB-UHFFFAOYSA-N 327.385 1.781 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@@H]1COC[C@H]1NC(=O)OC(C)(C)C 1987648280 YYGUIPCNPQBCPX-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)NC[C@]12CO[C@](C(=O)NCCN=[N+]=[N-])(C1)C2 1995274411 QKGMNZOSTPLXOM-OKILXGFUSA-N 325.369 1.487 10 10 EDCE CN(OCC(=O)NCCc1ccc(O)c(O)c1)C(=O)OC(C)(C)C 2010073505 YDDTXIHGDSHJFE-UHFFFAOYSA-N 340.376 1.555 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C[C@@H](O)CN2Cc2ccc(N)cc2)C1 2013645836 SXDFTWMNPCAJTD-OAHLLOKOSA-N 333.432 1.825 10 10 EDCE C[C@@H](NC(=O)CN(CCO)C(=O)OC(C)(C)C)c1ccccc1O 2017519596 VDERYTIZDVEIBP-GFCCVEGCSA-N 338.404 1.799 10 10 EDCE Cc1cccc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@H](C)O)c1O 2024812151 PDBVWXAEUPMZOT-AAEUAGOBSA-N 338.404 1.591 10 10 EDCE Cc1cccc(CNC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)c1O 2024813229 UJAYBYRSEBAZSV-CYBMUJFWSA-N 338.404 1.593 10 10 EDCE Cn1ncc(Br)c1CNC(=O)COc1ccc(N)cc1 693499852 LKYDFWJQQRXMGB-UHFFFAOYSA-N 339.193 1.460 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC(n4cccn4)CC3)c2n1 2063953965 NSAPYRZCEVNJDC-UHFFFAOYSA-N 326.360 1.417 10 10 EDCE COc1ccc(N2CCOC[C@H](CO)C2)c(OC)c1Br 2234896507 CFEIPJNAXWEMAJ-JTQLQIEISA-N 346.221 1.911 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2247135060 YVYHYRUNYCDSLG-PSTGCABASA-N 342.411 1.991 10 10 EDCE CCCNCc1ccc(N2CC[C@@H]2[C@@H](O)CO)c(Br)c1 2286214820 PRIYPNXCYRGAKE-CABCVRRESA-N 343.265 1.881 10 10 EDCE COC[C@@]1(C(=O)NCCCN=[N+]=[N-])C=CCN1C(=O)OC(C)(C)C 2299700170 LZMGQXVQGTYXQJ-OAHLLOKOSA-N 339.396 1.995 10 10 EDCE CN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1ccc2cc[nH]c2c1 491979539 DMPDEFMGHZNSTC-FNORWQNLSA-N 338.367 1.242 10 10 EDCE O=C(NCC1CC1)[C@@H]1CCCN(C(=O)C=Cc2ccc(O)c(O)c2)C1 2307986412 VSGZEXOPLTXNQO-OAHLLOKOSA-N 344.411 1.876 10 10 EDCE CC(C)(C)OC(=O)N1CC([C@@H]2C(=O)NCCN2c2ccc(N)cc2)C1 2326748841 RYYUVJWNWWMRRM-OAHLLOKOSA-N 346.431 1.441 10 10 EDCE Cc1ccc(CN2[C@H]3CC[C@H]2C(=O)NC3)c(O)c1Br 2352648522 ABSSIYRNVJNXIR-QWRGUYRKSA-N 325.206 1.926 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2354374137 OZVKCKBBPCNRCU-BYCMXARLSA-N 341.249 1.755 10 10 EDCE CC(C)N1CCO[C@@H](CN2CCN(Cc3ccccc3O)CC2)C1 179571941 QISXSVQRLVHSBG-SFHVURJKSA-N 333.476 1.619 10 10 EDCE COCCCOc1cccc(C=C2C(=O)N(C)C(=O)N(C)C2=O)c1 63866725 HDWPSHWFQCFWIL-UHFFFAOYSA-N 332.356 1.536 10 10 EDCE C[C@@]1(CNS(=O)(=O)CCOc2ccc(N)cc2)CCCS1 121990213 QHHUAYDECXDCOT-AWEZNQCLSA-N 330.475 1.853 10 10 EDCE C[C@@H]1C[C@H]1N1C[C@H](NC(=O)NCc2ccc(N(C)C)c(F)c2)CC1=O 78918014 KZZIIJXVXBEFOS-AXAPSJFSSA-N 348.422 1.700 10 10 EDCE CCCC(=O)NCC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 84814424 KNAIHEFSFXNZKK-UHFFFAOYSA-N 337.395 1.399 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@H]3CCCCC(=O)N3)CC2)cc1 193991124 LJBANEKUSOCXTR-KRWDZBQOSA-N 345.443 1.839 10 10 EDCE COc1cc(/C=C2\SC(=S)N(NC(N)=O)C2=O)ccc1O 96569221 PPPRCNXKMQMBIU-UITAMQMPSA-N 325.371 1.185 10 10 EDCE COC(=O)[C@@H]1C[C@@H](O)CN1Cc1ccc(N(C)C)cc1C(F)(F)F 279554789 DTBNBSOFHKOIQM-OCCSQVGLSA-N 346.349 1.880 10 10 EDCE COCCc1nc(CN2CCN(c3ccc(OC)cc3)CC2)no1 289705568 FTZYSNBAPYONOV-UHFFFAOYSA-N 332.404 1.589 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1CCC[C@@H](CO)C1 298249530 MVAPPRRDDLQYKS-IAGOWNOFSA-N 347.459 1.874 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N(C)C[C@H]1CCCCO1 297701867 CQHGQKIMDPAVIN-QGZVFWFLSA-N 347.459 1.739 10 10 EDCE COC(=O)/C=C\c1ccc(N2CCN(CCO)C[C@@H]2C)c([N+](=O)[O-])c1 829577016 IFIQDLJUPREYBQ-AGLBCWCQSA-N 349.387 1.284 10 10 EDCE CC(=O)C(=O)COC(=O)C12CCC(CC1)N2C(=O)OC(C)(C)C 909838131 QUIZMRUYJHYDCX-UHFFFAOYSA-N 325.361 1.620 10 10 EDCE CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3CC[C@H]4C[C@H]4C3)ccc21 834677059 CYRUKIMXVPFQFA-BHYGNILZSA-N 341.455 1.990 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NC[C@H]1CCCNC1 841923504 JDHLEWZHSYULAN-JTQLQIEISA-N 342.237 1.954 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCN(c3nncn3C)CC2)c1O 847037385 HHOALXUAAUBQDA-UHFFFAOYSA-N 349.822 1.699 10 10 EDCE CC[C@H](NCC[C@H]1CNCCS1(=O)=O)c1cccc(Cl)c1O 925788321 HNOVUACXWIQDEO-FZMZJTMJSA-N 346.880 1.863 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC(C)(C)CCO)C2)cc1 854300541 VKSHGDMWKMOJBM-CQSZACIVSA-N 335.448 1.982 10 10 EDCE Cn1ncc(C(F)(F)F)c1S(=O)(=O)NCc1ccccc1O 866830760 VZMHHDQIQZWFJK-UHFFFAOYSA-N 335.307 1.623 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)Cc1ccc(C(N)=O)nc1 860049462 VOVRJEQPPVMJGJ-UHFFFAOYSA-N 327.384 1.867 10 10 EDCE Cc1nc(NCc2ccc(N3CCOCC3)cc2)nc(N(C)C)n1 764393346 IPKGZIRZFDBNJM-UHFFFAOYSA-N 328.420 1.695 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1cc(N2CCOCC2)ncn1 866596554 HGKYJWFSUKSCPE-UHFFFAOYSA-N 328.372 1.291 10 10 EDCE O=C(CN(C[C@H]1CCCO1)C(=O)c1cc(O)cs1)N1CCCC1 765203568 UMNBZMLHWPYLMZ-CYBMUJFWSA-N 338.429 1.697 10 10 EDCE CCN(CC)c1ccc(CN2CCC[C@H]2CS(N)(=O)=O)cc1F 769427761 MJFPMLPJGNEUFY-AWEZNQCLSA-N 343.468 1.925 10 10 EDCE CN(CCC1CCOCC1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1118946248 UZWDPXYWQYFJEZ-UHFFFAOYSA-N 332.400 1.510 10 10 EDCE CC(C)(O)C[C@H](O)CNCc1cc(F)c(N2CCOCC2)c(F)c1 872209847 XSPNXRUVJBEDNG-ZDUSSCGKSA-N 344.402 1.413 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@]34C[C@@H](N)C[C@@H]3C4)CC2)cc1 870879183 XVVNHSLCXRNNTE-TYILLQQXSA-N 329.444 1.908 10 10 EDCE C[C@]1(O)CN(c2ccc(CO)c(Br)c2)CC[C@@]1(C)O 1880703317 NUJPOFUMYOLTHB-KGLIPLIRSA-N 330.222 1.654 10 10 EDCE Cc1cc(C)c(O)c(CN2CCC(CNS(C)(=O)=O)CC2)c1 795671167 MUGHRDWOZJXPKN-UHFFFAOYSA-N 326.462 1.770 10 10 EDCE O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1154950505 YWIDDRNFBOJUAN-JTQLQIEISA-N 346.305 1.167 10 10 EDCE COc1ccc(Br)c(CNC[C@@](C)(O)CN(C)C)c1O 1964060035 XAHFREWOEYOYDZ-CQSZACIVSA-N 347.253 1.566 10 10 EDCE CC[C@H](C)[C@@H](C)NC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1327924237 WXIZCLYCXXDOFT-ZNMIVQPWSA-N 347.459 1.941 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC(C)(F)C2)cc1 1326566071 GXDDCIGBBBRWJY-UHFFFAOYSA-N 337.395 1.160 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC([C@H](C)O)C3)c(Br)cc21 719762761 DORTUMYONSJOEI-WPPNPWJKSA-N 340.221 1.479 10 10 EDCE CNC(=O)C1(C(=O)NCC[C@H](C)NCc2ccc(OC)c(C)c2)CC1 1274804422 VADOTBFCPGNFMQ-AWEZNQCLSA-N 347.459 1.514 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)c2cnccn2)cc1C 1507461860 VBPBDYIKTCDPFX-OAHLLOKOSA-N 344.415 1.016 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)CS(C)(=O)=O)cc1C 1505572477 ZJWXDTCFGQEBMB-OLZOCXBDSA-N 342.461 1.031 10 10 EDCE COc1cc(C(=O)N[C@@H](C)C[C@H](C)NC(=O)C(F)F)cc(OC)n1 1288499895 AOYNPZCPWOAWQU-IUCAKERBSA-N 345.346 1.377 10 10 EDCE O=C(O)C[C@@H]1CN(Cc2cc(Br)ccc2O)C[C@@H]1O 2117724600 MHEXEGLCQAKRKE-SKDRFNHKSA-N 330.178 1.422 10 10 EDCE COC(=O)NCC(=O)N1C[C@H](NCc2ccc(OC)c(C)c2)C[C@@H]1C 1700830506 LRAISQAMYPGOAC-DZGCQCFKSA-N 349.431 1.439 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)c2cnnn2C)cc1C 1485720333 RQALMDGSMNBMDI-CQSZACIVSA-N 345.447 1.820 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)c2cn(-c3cccnc3)nn2)c1 1622779512 QGLXWTUCQTTXFO-LLVKDONJSA-N 339.355 1.868 10 10 EDCE CCNC(=O)CC(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)C1 1490818350 HDSBBYSTBHPVKK-HNNXBMFYSA-N 333.432 1.220 10 10 EDCE CN(CC(=O)NCc1cc(O)ccc1O)C(=O)OCc1ccccc1 1633599356 YEKHDIPONZGPMY-UHFFFAOYSA-N 344.367 1.983 10 10 EDCE [N-]=[N+]=N[C@@H]1CCN(C(=O)CNC(=O)c2ccc(Br)o2)C1 1912156051 NEMNDKCTZBARCB-SSDOTTSWSA-N 342.153 1.683 10 10 EDCE CCOCC(=O)NCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1738725936 GNRAPSVCJFIKBA-UHFFFAOYSA-N 347.375 1.264 10 10 EDCE CCOC(=O)C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)C(F)(F)F 1640926738 NWBSLUNQVMTGKZ-LLVKDONJSA-N 335.278 1.641 10 10 EDCE COCCN[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1C 1698899270 AYMMFQJZRNJZQF-SWLSCSKDSA-N 347.419 1.936 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)[C@@H]2CCCNC2)c2nccn2C)cc1 1865975447 CUSCAFUPTVHGSE-WBVHZDCISA-N 341.459 1.691 10 10 EDCE CC(C)(C)OC(=O)NOCCCNC(=O)COc1ccc(N)cc1 1999144616 YILZPPQMVXYUSG-UHFFFAOYSA-N 339.392 1.610 10 10 EDCE C[C@@H]1CC[C@H](C2OCCO2)N(S(=O)(=O)Cc2ccc(N)cc2)C1 2152088374 NVLOVZOUMJGBJL-IUODEOHRSA-N 340.445 1.572 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)C1(NC(=O)OC(C)(C)C)CC(CO)C1 2018282691 UASCPLXASZHDMA-UHFFFAOYSA-N 341.412 1.811 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3CC(N(C)C)C3)c(Br)cc21 382275841 JTBBLYCSNXWCQF-CYBMUJFWSA-N 339.237 1.412 10 10 EDCE CS(=O)(=O)C[C@H]1CCN(c2ccc(CN)c(Br)c2)C1 2087365508 XBBIKXGXBHPNBE-JTQLQIEISA-N 347.278 1.779 10 10 EDCE COc1ccc(N2C[C@@H](CO)[C@H](CO)C2)c(OC)c1Br 2234893001 NHMHTIZIAZWNSR-UWVGGRQHSA-N 346.221 1.503 10 10 EDCE COc1ccc(N2CC(CO)(CO)C2)c(OC)c1Br 2226548491 DKXLCAKQTVBERB-UHFFFAOYSA-N 332.194 1.257 10 10 EDCE Nc1ccc(CS(=O)(=O)Nc2ncncc2Br)cc1 2230095083 MVNHZBXLPZXWOJ-UHFFFAOYSA-N 343.206 1.763 10 10 EDCE CN1CC2(CCC1=O)CN(c1ccc(CO)cc1Br)C2 2289667418 BDHSUMHKDHNELO-UHFFFAOYSA-N 339.233 2.000 10 10 EDCE COCCNC(=O)C(=Cc1ccc(N(C)C)cc1)n1ccccc1=O 2293453493 ZRJUGXXMRQUZTH-UHFFFAOYSA-N 341.411 1.675 10 10 EDCE O=C(O)[C@]12CCO[C@@H]1CN(Cc1ccc(Br)cc1O)C2 2296424745 IRDLFTWAJVRLTK-OCCSQVGLSA-N 342.189 1.830 10 10 EDCE CC1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)C1=CN1CCc2ccccc21 2296601871 KZZVESONJTZCJX-CQSZACIVSA-N 345.424 1.338 10 10 EDCE CNC(=O)[C@@H]1CNCCN1c1ccc(OCc2ccccc2)cc1 2299527385 HLNSWLVUKYAZGH-SFHVURJKSA-N 325.412 1.790 10 10 EDCE CC(C)CN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1ccccc1 493353028 MWBGPMBXCHWPFL-KHPPLWFESA-N 341.411 1.786 10 10 EDCE Cc1ccc(CN2CC[C@H](O)[C@H](CO)C2)c(O)c1Br 2352687730 QRIPLYABMXQMOE-RYUDHWBXSA-N 330.222 1.638 10 10 EDCE CC(=O)N(C(=O)C(=O)NCc1ccccc1F)c1ccc(N)cc1 170318951 JQTPNBNHGSZMOB-UHFFFAOYSA-N 329.331 1.604 10 10 EDCE COc1cc(N2CCN(CCO)[C@H](C)C2)c([N+](=O)[O-])cc1OC 302460478 ULUKJUYCVWTNFS-LLVKDONJSA-N 325.365 1.115 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)c(Br)c1 2357585985 SVGVGHINUXPFQT-MAMIUBEXSA-N 342.233 1.823 10 10 EDCE NC(=O)c1coc(CNC(=O)NCc2ccc(N3CC=CC3)cc2)c1 187229364 IRXLCQNIKANREU-UHFFFAOYSA-N 340.383 1.754 10 10 EDCE C[C@H](O)CN1CCN(C(=O)NCc2ccc(N(C)C)cc2)C[C@@H]1C 247577322 SJNXOSJYGSBTEO-GJZGRUSLSA-N 334.464 1.349 10 10 EDCE COCCOCCNC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255388388 KDEIWOKNAVLJTO-DAXSKMNVSA-N 334.416 1.316 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)COCc1nccn1C 611649926 LDDALPWTLMISPR-UHFFFAOYSA-N 330.388 1.428 10 10 EDCE Cc1ccc(CNC(=O)[C@H](N)CCC(=O)O)c(O)c1Br 2380736920 IFFSJZICEUWIBV-SECBINFHSA-N 345.193 1.271 10 10 EDCE CN(C)c1ccc(CN(C)c2ncc([N+](=O)[O-])cc2C(N)=O)cc1 298310350 OSHFDHSWSNSTOW-UHFFFAOYSA-N 329.360 1.791 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](C(C)C)n1nnc(-c2ccccc2)n1 808508260 XXCWIURQRJRCTL-AWEZNQCLSA-N 330.344 1.239 10 10 EDCE Cc1cc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)ccc1N(C)C 293717094 YEFXVASMRMLPDM-MRXNPFEDSA-N 339.505 1.917 10 10 EDCE C[C@H](C[S@](C)=O)N(C)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 398920872 LHTZIARHPNXUCW-VYZBHICRSA-N 326.374 1.896 10 10 EDCE Nc1cccc(OCCOn2c(=O)c(=O)oc3ccc(Cl)cc32)c1 821297901 YQXCHGFGYILJIR-UHFFFAOYSA-N 348.742 1.698 10 10 EDCE CC1(O)CC(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1 822660149 LAQDRXBPEUDQQW-XVTSOASTSA-N 345.443 1.166 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cn(C)c(O)n3)CC2)cc1F 829869383 OSEPOFHYRGWWGZ-UHFFFAOYSA-N 334.351 1.236 10 10 EDCE CCO[C@@H]1CN(C(=O)NCc2ccc(N(C)C)c(F)c2)C[C@H]1CN 846145766 QENOJDZCHLQFPG-CZUORRHYSA-N 338.427 1.397 10 10 EDCE C[C@@]1(F)CNCCN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1 841832400 NHZIUUXRBQSWKO-GOSISDBHSA-N 332.423 1.906 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H]2COC[C@]2(C)C1 852533460 ZCONSTKOOSJPIY-LPHOPBHVSA-N 331.460 1.679 10 10 EDCE COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2CCc3nnn(C)c3C2)c1 927145924 MCQRCPBOIPXKBL-PWSUYJOCSA-N 330.388 1.515 10 10 EDCE CCn1nccc1CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852448081 BTJZVQRSXCCBIP-CQSZACIVSA-N 343.431 1.990 10 10 EDCE CC[C@H](COCC1CC1)NC(=O)C(=O)NCCc1ccc(N)cc1 851687935 LWAMUQLGUNEXEU-MRXNPFEDSA-N 333.432 1.249 10 10 EDCE COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCN(CC(C)(C)O)C2)c1 866412472 JKKPELIWTIBNLD-JSGCOSHPSA-N 336.432 1.675 10 10 EDCE C[C@H]1C[C@H]1c1noc(C(=O)NCc2ccc(N3CCOCC3)cc2)n1 865910958 FPAXWIHCPPFNAL-SWLSCSKDSA-N 342.399 1.960 10 10 EDCE C[C@@H]1CCCN1S(=O)(=O)NCc1cccc(Br)c1O 766201409 SUMBCCSZIAOLQN-SECBINFHSA-N 349.250 1.973 10 10 EDCE COC(=O)c1cc(OCc2nnn(C(C)(C)C)n2)ccc1N(C)C 865395462 QOSLMUQONQNFDT-UHFFFAOYSA-N 333.392 1.860 10 10 EDCE COC[C@H](O)C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 766147889 QRCVXKBGCWTLFC-KRWDZBQOSA-N 349.358 1.966 10 10 EDCE C[C@@H](NC(=O)NCCc1nnc2n1CCC2)c1ccc(N(C)C)cc1 776160563 VOKFQMRZKQFLAX-CYBMUJFWSA-N 342.447 1.893 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CO[C@@H](CCC(=O)OC(C)(C)C)C1 884995669 YKZAOCNAGGWMPW-NEPJUHHUSA-N 328.361 1.215 10 10 EDCE CS(=O)(=O)CC1CCC(NC(=O)Cc2ccc(O)c(O)c2)CC1 1159346010 WLYGQGTYOLEMKZ-UHFFFAOYSA-N 341.429 1.360 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccccc1N1CCOCC1 1178912360 SGLCEPQULPJURQ-UHFFFAOYSA-N 328.368 1.864 10 10 EDCE COCCNC(=O)[C@H](C)NCc1ccc(Br)cc1O 691501959 RRJUYXNVBZARQX-VIFPVBQESA-N 331.210 1.395 10 10 EDCE CN1CCOC[C@H]1CNC(=O)NCc1ccc(N2CCCC2)cc1 1331504100 NJSGSNMWRMJCKX-QGZVFWFLSA-N 332.448 1.417 10 10 EDCE C[C@@H](CS(C)(=O)=O)N(C)c1ccc(CN)c(Br)c1 688567818 RBINXDPERJTPOJ-VIFPVBQESA-N 335.267 1.777 10 10 EDCE CN(C[C@@H](O)COCc1ccccc1)c1ccc2c(c1)NC(=O)[C@@H]2O 1916383244 GFGJKTQNSREFIY-CRAIPNDOSA-N 342.395 1.686 10 10 EDCE CN(CC1(O)CCOCC1)C(=O)c1cc2cc(O)c(O)cc2s1 1332097150 UALGYPQTGKFGLT-UHFFFAOYSA-N 337.397 1.926 10 10 EDCE CCOc1ccc(N2CCN(C[C@H]3CCCS3(=O)=O)CC2)cc1 1333142096 HZDORLGBDNHPOP-QGZVFWFLSA-N 338.473 1.785 10 10 EDCE C[C@@]1(CCCO)CCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1348641004 WCDROKFSZXTSOL-SFHVURJKSA-N 332.400 1.388 10 10 EDCE COc1ccc(CNCC2CC(NC(=O)CNC(C)=O)C2)cc1C 1275190879 PHEMUDOGUQGZGM-UHFFFAOYSA-N 333.432 1.124 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)[C@H]2CCCCN2C)cc1C 1507200315 FMMZZDAORLZFEE-DLBZAZTESA-N 349.475 1.055 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)CN2CCCC2=O)cc1C 1283572942 PINOLBMODLKEKB-HNNXBMFYSA-N 347.459 1.563 10 10 EDCE CNCc1ccc(N2CCO[C@H]([C@H](C)O)C2)cc1Br 2117532796 VFGDMQNURXZBEP-HZMBPMFUSA-N 329.238 1.755 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCCS(=O)(=O)c1ccccc1 1464579915 GSVWCQGBJBPCJA-UHFFFAOYSA-N 349.408 1.621 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)[C@@H]2CCC(=O)NC2)cc1C 1482847867 JLUZOJSILCDIJV-GOEBONIOSA-N 347.459 1.514 10 10 EDCE CC1(C)[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C[C@H]1N1CCOCC1 1557316140 LSOVYTQQENCOSC-JKSUJKDBSA-N 334.416 1.256 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@@H]2CCC(=O)NC2)cc1C 1714477014 ZWIZBGHCOSTGFK-GDBMZVCRSA-N 347.459 1.514 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)Cc2ccn(C)n2)cc1C 1483007167 GKSIGBSWVIGSGL-PLNGDYQASA-N 342.443 1.742 10 10 EDCE CCOCCN1CC[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1493265929 AINMVMOKXQBRBL-CYBMUJFWSA-N 347.419 1.937 10 10 EDCE CC[C@@H](O)Cn1cc(C(=O)NCc2c(O)ccc3c2CCCC3)nn1 1631438904 OVBSPVVJZQBIPE-CYBMUJFWSA-N 344.415 1.563 10 10 EDCE Cn1cc([C@H](NC(=O)Cc2ccc(O)c(O)c2)C2(CO)CCC2)cn1 1569506629 SBKYVKVOZCIJAQ-KRWDZBQOSA-N 345.399 1.394 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@H]2CCNC(=O)C2)cc1C 1569051690 AHWNQTGJNLXWMD-ZFWWWQNUSA-N 333.432 1.124 10 10 EDCE CCC(=O)N[C@H](C)C(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)C1 1491729016 IMVQUFPZLKCPNP-ZBFHGGJFSA-N 347.459 1.609 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](CO)[C@@H]3C)C2)cc1 1565055931 NONHVFFVAKJRPZ-ZNMIVQPWSA-N 333.432 1.686 10 10 EDCE Cc1ccc(C(=O)NCC(=O)NCc2cc(O)ccc2O)cc1C 1644752769 UCKVBGUXOMCROG-UHFFFAOYSA-N 328.368 1.761 10 10 EDCE Cc1ccc(C(=O)NCc2c(O)cccc2O)cc1S(C)(=O)=O 1652623105 NXXOYMOHOHRGGO-UHFFFAOYSA-N 335.381 1.740 10 10 EDCE COc1ccc(CNC[C@H]2CCN(C(=O)CN(C)C(C)=O)C2)cc1C 1662597152 PLBYPDMDAYXRQD-QGZVFWFLSA-N 347.459 1.420 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2cn([C@@H]3CC[C@H]3O)nn2)c1 1595806438 KPSGEQLHDKHIMW-JBCWJZNQSA-N 332.360 1.179 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)C[C@H](C)C2CC2)cc(OC)n1 1758780481 JMAFJBBLVSCWNB-NWDGAFQWSA-N 349.431 1.770 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)Cc2cc[nH]n2)cc1C 1674648577 VIGVSVRROWVXHV-UONOGXRCSA-N 330.432 1.952 10 10 EDCE CCn1ncc(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)n1 1690570533 GUGYCVVCUCJQSI-ZDUSSCGKSA-N 331.420 1.523 10 10 EDCE CN1NC(=O)[C@H](CC(=O)Nc2ccccc2Oc2ccccc2)C1=O 169996290 FJTQMTABNOFSFI-ZDUSSCGKSA-N 339.351 1.927 10 10 EDCE O=C1C(=O)c2c(ccc3c2CCC[C@]3(O)CO)-c2occ(CO)c21 110135652 YTHYRTDSBSMJLI-SFHVURJKSA-N 328.320 1.334 10 10 EDCE biogenic CCOC(=O)CCN(CC)C(=O)CNCc1cc(Cl)ccc1O 1857868708 XRDZRRNEDFZRFP-UHFFFAOYSA-N 342.823 1.937 10 10 EDCE CN[C@@H](C)c1ccc(N(CCO)C2COC2)c(Br)c1 1915544367 AJDCDAHCYPNVIE-JTQLQIEISA-N 329.238 1.927 10 10 EDCE COCC[C@H](NC(=O)OC(C)(C)C)[C@H](N)Cc1ccc(O)c(O)c1 1952829918 QNQZQDWXUIBRSI-OLZOCXBDSA-N 340.420 1.897 10 10 EDCE CC(C)(C)OC(=O)NCCOCC(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985099708 AUEKVTLBVPKTJN-NSHDSACASA-N 327.385 1.829 10 10 EDCE COc1ccc([C@H](C)NC[C@H](CO)NC(=O)OC(C)(C)C)c(O)c1 2011516528 IYWSKLFPETXPDC-NWDGAFQWSA-N 340.420 1.937 10 10 EDCE [N-]=[N+]=NCCN[C@]1(C(=O)O)CN(Cc2ccccc2)[C@]2(CCOC2)C1 2038666308 PUUYEFRVIMJTIE-SJORKVTESA-N 345.403 1.775 10 10 EDCE C[C@@H]1CS(=O)(=O)C[C@H]1NCc1cccc(Br)c1O 711724746 XDXSMHXBUIXYOY-LDYMZIIASA-N 334.235 1.677 10 10 EDCE C[C@H]1CN(C)C[C@H](CNCc2ccc(Br)cc2O)O1 691446751 TVXMTENNLQCIFI-GWCFXTLKSA-N 329.238 1.963 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@@](C)(O)c3ccsc3)c2n1 2062085329 DRVXQRCXJNBKIY-OAHLLOKOSA-N 332.385 1.442 10 10 EDCE COCCn1nnnc1CNCc1c(O)cccc1Br 2169369209 WPOFHMAPPWRWCF-UHFFFAOYSA-N 342.197 1.077 10 10 EDCE CCN([C@H]1CC(=O)NC1=O)[C@@H](C)c1cc(Br)ccc1O 2171203993 OLGYYNXDZGZGEC-KWQFWETISA-N 341.205 1.953 10 10 EDCE CNCc1ccc(N2C[C@@H]3C[C@H]2CN3C(C)=O)cc1Br 2192285098 AMHGLECSPMOCMN-KBPBESRZSA-N 338.249 1.978 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NC(=O)Cc2ccc(N)cc2)C1 2063348644 OMAJHFRBSSLVSK-GJZGRUSLSA-N 349.431 1.298 10 10 EDCE CN1CC(N(C)c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2089242276 YBKXDLHPMCOUEL-LBPRGKRZSA-N 325.210 1.151 10 10 EDCE NCc1ccc(N2C[C@]3(CO)C[C@]3(CO)C2)c(Br)c1 2090117874 AFSLECHVYHUYIL-OKILXGFUSA-N 327.222 1.089 10 10 EDCE O=C(O)COc1cccc(C=C2SC(=S)N(CCO)C2=O)c1 2294874456 DRGUPGOOWJUZNO-UHFFFAOYSA-N 339.394 1.344 10 10 EDCE CC(C)c1cccc(N(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c1 62527415 AHIAZYYOYQVEGN-MDZDMXLPSA-N 341.411 1.884 10 10 EDCE COc1ccc(N2CCC(NC(=O)c3cncnc3N)CC2)cc1 185441743 CLFXRSHFKYDMAM-UHFFFAOYSA-N 327.388 1.466 10 10 EDCE Cn1nncc1CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 92855803 NDFIDHJPRORWSN-UHFFFAOYSA-N 340.475 1.637 10 10 EDCE CCN(CC)c1ccc(C=c2sc3nc(=O)c(C)nn3c2=O)cc1 254821908 PGYVIYIAFNCFGP-UHFFFAOYSA-N 342.424 1.214 10 10 EDCE CN(C)c1ccc(CNC(=O)C2C[C@H]3COC[C@@H](C2)C3=O)cc1F 369577360 PJQOUWHWQJDNGC-AGUYFDCRSA-N 334.391 1.750 10 10 EDCE CSc1ncc(CN[C@@]2(C(=O)O)CSC3(CNC3)C2)s1 2376929545 QBRHYJBMIZXTDQ-GFCCVEGCSA-N 331.488 1.257 10 10 EDCE CCNCc1ccc(N2CC(=O)N[C@H](C)C2)cc1Br 386868050 DAPQBSRUBSUSJF-SNVBAGLBSA-N 326.238 1.883 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCC[C@@](O)(CO)C2)c1 839160100 QCTUVMSSMBXUBS-AWEZNQCLSA-N 330.222 1.782 10 10 EDCE Cc1cc(Br)cc(CN2CCC[C@@](O)(CO)C2)c1O 839153757 HFOTXGUWFFZJCQ-AWEZNQCLSA-N 330.222 1.782 10 10 EDCE C[C@@H](OC(=O)c1cc(O)cs1)C(=O)NC(=O)NCC(F)(F)F 732352722 DEFNJYZYZSYRGF-RXMQYKEDSA-N 340.279 1.387 10 10 EDCE COC(=O)N1CCC[C@H](NC(=O)NCc2c(O)cccc2F)C1 916186423 GKMWIHQNYRTTQD-JTQLQIEISA-N 325.340 1.561 10 10 EDCE O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@@H]2C[C@H]1C[S@]2=O 844887498 HMCHDSOFBSBXTA-PBPSECFOSA-N 333.457 1.702 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C[C@]3(C(=O)O)CCOC3)C2)cc1 849183763 UHAINHJRTFYCBA-SCLBCKFNSA-N 348.399 1.272 10 10 EDCE CCOCCO[C@H](C)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855231916 YPPJJHZVERBJEK-CABCVRRESA-N 336.432 1.832 10 10 EDCE C[C@H](NC(=O)NCCN(C)CCCN(C)C)c1ccc(N(C)C)cc1 854003267 GXYAMYKHAXCQNJ-INIZCTEOSA-N 349.523 1.996 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)COC[C@@H]3CCCO3)C2)cc1 855230736 IURSDVLBMWHCHB-YOEHRIQHSA-N 334.416 1.586 10 10 EDCE Cc1cc(Cl)cc([C@H](C)NCC[C@H]2CNCCS2(=O)=O)c1O 925788993 NBYQFKZEKJRORG-AAEUAGOBSA-N 346.880 1.781 10 10 EDCE Cc1cc(O)c(CNCCCN2CCC[C@H]2C(N)=O)c(Cl)c1 858225610 HOSKXAPCBWMQLU-AWEZNQCLSA-N 325.840 1.783 10 10 EDCE CCc1nc(CNC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)n[nH]1 854094779 DZXVLLIOGDREAU-GFCCVEGCSA-N 344.419 1.454 10 10 EDCE CN(C)C(=O)N(C)[C@@H]1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 856086479 AFDIDJMMRCJZMW-SCXUMTSISA-N 333.388 1.325 10 10 EDCE CC(C)N(CCN1C(=O)CN(C)C1=O)Cc1ccc(N(C)C)cc1 851731953 DUCIQHSVCYXWLV-UHFFFAOYSA-N 332.448 1.857 10 10 EDCE CC1(N2CCCC2)CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 868264206 GWLBIHYMKJUJGD-UHFFFAOYSA-N 330.432 1.684 10 10 EDCE COc1ccc(N2CC[C@@H](NCc3c(C)nn(CCO)c3C)C2)cc1 1118420616 SDZIAJPBWZAOQM-MRXNPFEDSA-N 344.459 1.869 10 10 EDCE CS(=O)(=O)c1cccc2c1CCCN2C(=O)/C=C/c1cnccn1 1115934759 MTFBBAMQQXEZAR-BQYQJAHWSA-N 343.408 1.873 10 10 EDCE CCNC(=O)N1CC[C@H](NC(=O)NCc2ccc(OC)cc2O)C1 792998705 BKGKSQUAPUMREH-LBPRGKRZSA-N 336.392 1.004 10 10 EDCE C[C@]1(O)CN(c2ccc(CN)cc2Br)CC[C@@]1(C)O 1880696788 BZPNIUIHASQXTH-KGLIPLIRSA-N 329.238 1.620 10 10 EDCE O=C(CN1CCC(=O)NC1=O)NCc1c(O)ccc2ccccc12 1157041530 IJKBORPZQLYQMS-UHFFFAOYSA-N 327.340 1.104 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccnc(O[C@@H]2CCOC2)c1 1304053853 UHRYLHDKHYHKIP-GFCCVEGCSA-N 330.340 1.591 10 10 EDCE CC(C)OCc1nc([C@@H](C)NC(=O)Cc2ccc(O)c(O)c2)no1 1160667167 KOMHIWWQCSSFHB-SNVBAGLBSA-N 335.360 1.826 10 10 EDCE CN1C(=O)CCc2cc(C(=O)NCc3c(O)cccc3O)ccc21 1178911655 OLNRCRWPOYXLTP-UHFFFAOYSA-N 326.352 1.937 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H]2COC[C@]2(C)C1 1327330234 PRYRADNBABQQMQ-KXBFYZLASA-N 346.427 1.626 10 10 EDCE CO[C@@H]1CC[C@H]1N(C)C(=O)C(=O)NCCCSc1nccs1 1335598478 NNOOVNRORMGDDN-GHMZBOCLSA-N 343.474 1.377 10 10 EDCE Cc1nonc1CNCCN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1267137582 SFBPLWXKWGRQAW-UHFFFAOYSA-N 345.363 1.402 10 10 EDCE O=C(O)CN(Cc1ccccc1O)C(=O)[C@H]1Cc2cccnc2C1 1349953658 FBMSHWVNTANLKR-AWEZNQCLSA-N 326.352 1.615 10 10 EDCE CC[C@@H](F)C(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1298625979 JZJFKMRVHLVOBG-BXKDBHETSA-N 337.355 1.832 10 10 EDCE CO[C@@H](C)C(=O)N[C@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1527613513 DOUKZXSMRKNJNV-MNOVXSKESA-N 349.391 1.509 10 10 EDCE O=C(NCc1ccccc1O)c1c[nH]nc1I 1294925020 LEKDQPUJDBFGDA-UHFFFAOYSA-N 343.124 1.650 10 10 EDCE CCOCC(=O)N1CC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1299051393 LFZBPLREDYFMGW-CYBMUJFWSA-N 347.375 1.216 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1C[C@@H](C(N)=O)C1 1478920338 WTIBCSQSPRXLHX-GASCZTMLSA-N 330.432 1.692 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CS(=O)(=O)N(C)C 1540567346 ISYJDFUUIFBCAA-UHFFFAOYSA-N 339.461 1.137 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CC[C@@H](C(N)=O)C3)CC2)cc1F 1622578826 IMVXQIWAZIVXIZ-OLZOCXBDSA-N 349.406 1.385 10 10 EDCE CN1C(=O)COc2ccc(C(=O)NCc3c(O)cccc3O)cc21 1558535332 GQYAQJZQAIEPJD-UHFFFAOYSA-N 328.324 1.383 10 10 EDCE CN(C)C(=O)/C=C/C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1623639994 BXMDWVQSAZYTGS-BOLDSZDNSA-N 332.400 1.544 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C[C@@H]2CCNC2=O)cc1C 1568863569 XDVDMWQCQUCGBK-CWDCEQMOSA-N 345.443 1.292 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1=CS(=O)(=O)CCC1 1632680935 IYUPDSAHLXEDKT-JTQLQIEISA-N 325.386 1.238 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H](NC(N)=O)C(C)(C)C)CC2)cc1 1566326560 QRQZMOBIMFGHAH-OAHLLOKOSA-N 348.447 1.427 10 10 EDCE CCS(=O)(=O)c1cccc(C(=O)NCc2ccc(O)cc2O)c1 1643103658 DUOLSIONOVQTMH-UHFFFAOYSA-N 335.381 1.821 10 10 EDCE CC(=O)N1CCc2cc(C(=O)NCc3cccc(O)c3O)ccc21 1644707802 AQICNZHLWYMDLS-UHFFFAOYSA-N 326.352 1.937 10 10 EDCE COC1CCN(c2ccc(CN3C[C@H](CO)[C@@H](CCO)C3)cc2)CC1 1655900526 XKRZNSFFOVJCPW-ZWKOTPCHSA-N 348.487 1.725 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)Cn1cncn1 1699218363 SRLDMRKVCDLDAW-UHFFFAOYSA-N 331.420 1.233 10 10 EDCE COc1ccc(CNC[C@@H]2CCCN2C(=O)CCCC(N)=O)cc1C 1699766864 XAZOFVGKTJOPSU-INIZCTEOSA-N 347.459 1.740 10 10 EDCE COc1ccc(N2CCN(Cc3nsc(N(C)C)n3)CC2)cc1 161073677 AXWOTQDEZJOTBT-UHFFFAOYSA-N 333.461 1.935 10 10 EDCE COC(=O)NCC1CN(c2ccc(CN)cc2Br)C1 2130738834 ONUFYLDJNCBUNG-UHFFFAOYSA-N 328.210 1.700 10 10 EDCE O=C1CC[C@@H](C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)CN1 1889600491 BSAJIOUKRJKPBR-UXLLHSPISA-N 327.428 1.818 10 10 EDCE O=C1C[C@]2(CCN(Cc3c(O)cccc3Br)C2)CN1 862351465 LRQUZJBVXROBNU-CQSZACIVSA-N 325.206 1.867 10 10 EDCE COCC[C@@H](NC(=O)OC(C)(C)C)[C@@H](N)Cc1ccc(O)c(O)c1 1952829919 QNQZQDWXUIBRSI-QWHCGFSZSA-N 340.420 1.897 10 10 EDCE Nc1ccc(CS(=O)(=O)Nc2nc(Cl)nc(Cl)n2)cc1 2145173877 OHDMIQVZVUDNGD-UHFFFAOYSA-N 334.188 1.703 10 10 EDCE O=S(=O)(Nc1cc(Cl)c(O)c(Cl)c1)N1CCCNCC1 2145854193 ZPOXMENLQMHBBZ-UHFFFAOYSA-N 340.232 1.651 10 10 EDCE CN1CCc2cc([C@]3(O)COC[C@H]3NC(=O)OC(C)(C)C)ccc21 1999512267 NZRBFNAFCHBEAX-CRAIPNDOSA-N 334.416 1.790 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(O)C[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010401597 FRIRXTATPRZNHC-PGUXBMHVSA-N 339.396 1.563 10 10 EDCE C[C@@H](C(=O)NCCCCN=[N+]=[N-])N1CC(NC(=O)OC(C)(C)C)C1 2014682730 FSUUEMZHJCLHIT-NSHDSACASA-N 340.428 1.791 10 10 EDCE Oc1cc(O)c(Cn2nccc2I)c(O)c1 2069926062 WHJRQAGNMXJCJY-UHFFFAOYSA-N 332.097 1.653 10 10 EDCE CCNCc1ccc(N2CC[C@@](C)(O)[C@H](O)C2)cc1Br 2197957261 ABIXFVKQVRHIBP-HUUCEWRRSA-N 343.265 1.881 10 10 EDCE Cn1[nH]c(CCNC(=O)OC(C)(C)C)nc1=NCc1ccc(N)cc1 2063178450 GTQONUBVWSTUNY-UHFFFAOYSA-N 346.435 1.499 10 10 EDCE COC1(C(N)=O)CN(c2ccc([C@@H](C)O)cc2Br)C1 2104898856 RLOFHJZZPIFKJM-MRVPVSSYSA-N 329.194 1.193 10 10 EDCE NCc1ccc(N2CCO[C@H]3COCC[C@@H]32)c(Br)c1 2087484394 JZZRIUMDTFFHAA-KBPBESRZSA-N 327.222 1.902 10 10 EDCE OCc1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)cc1Br 2090117378 WCHXTNPXUGUHBU-KBPBESRZSA-N 328.206 1.123 10 10 EDCE CC(C)(C)OC(=O)NC1(COc2nnc(=N)[nH]n2)CC2(CCC2)C1 2213783104 MDAPUSAXCLPDKY-UHFFFAOYSA-N 336.396 1.286 10 10 EDCE CC(C)CN(CC(N)=O)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297505825 YWKVWJUNTRGYRL-UHFFFAOYSA-N 345.443 1.506 10 10 EDCE O=C(/C=C\c1cnccn1)N(CCN1CCOCC1)c1ccccc1 491416906 MQPMIYIGXFNCMU-SREVYHEPSA-N 338.411 1.855 10 10 EDCE O=S1(=O)C[C@@H]2CN(c3ccc(CO)c(Br)c3)C[C@H]21 2314891881 QWZNLFOFXBFKQP-JOYOIKCWSA-N 332.219 1.175 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2329329708 XNRMVXRKWXLDSE-VIUKWPJHSA-N 328.206 1.433 10 10 EDCE CN(CC1(O)CC1)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2340181694 WHJLMAQXHLECPV-LLVKDONJSA-N 327.178 1.396 10 10 EDCE Cc1ccc(CNC(=O)[C@H](N)C2COC2)c(O)c1Br 2352932603 OZQUKPHKOVKCHU-LLVKDONJSA-N 329.194 1.053 10 10 EDCE C[C@@H](NCCS(=O)(=O)N1CCSCC1)c1ccc(F)cc1O 185395147 FLHBBJIJBGFYAX-LLVKDONJSA-N 348.465 1.561 10 10 EDCE CC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 132918594 QPPZEBLMODKPBJ-CQSZACIVSA-N 325.409 1.429 10 10 EDCE COc1ccc(N2CCN(S(=O)(=O)N(C)C)CC2)cc1Cl 244212448 VVABZUSXZRVYJG-UHFFFAOYSA-N 333.841 1.277 10 10 EDCE 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COc1ccc(CN[C@H](C)CN(C)C(=O)c2cn(C)nn2)cc1C 1283605763 JUVFGWGFMXMJJX-CYBMUJFWSA-N 331.420 1.382 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)/C=C/c2cn(C)cn2)c2ccc(F)cc2O1 1530902164 SUWXTXFCBIOQIR-DRDHIDPGSA-N 345.330 1.540 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC(c2n[nH]c3c2COCC3)C1 1607645813 DNXVVLZRNVHTID-UHFFFAOYSA-N 329.356 1.062 10 10 EDCE COC(=O)c1cc2n(n1)CCC[C@H]2NC(=O)c1cccc(O)c1O 1636928635 DMIALZQTXUXEDW-SNVBAGLBSA-N 331.328 1.346 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H](C)c2ccco2)cc1C 1568579460 BOVAOOJGNRANKX-GOEBONIOSA-N 346.427 1.967 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](CO)[C@H]3C)C2)cc1 1565055928 NONHVFFVAKJRPZ-ILXRZTDVSA-N 333.432 1.686 10 10 EDCE CCC(=O)N[C@@H](C)C(=O)N(C)[C@H](C)CNCc1ccc(OC)c(C)c1 1732421563 VSBQYYXJBZCKFX-CABCVRRESA-N 349.475 1.855 10 10 EDCE Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)c(C)n1NC(N)=O 1595752522 RNXAZIGYCDQDIN-UHFFFAOYSA-N 332.360 1.111 10 10 EDCE CN(CC(=O)Nc1ccc(N)cc1)C[C@@H](O)COCc1ccccc1 1916359801 DVTFHNKLLAEWPK-GOSISDBHSA-N 343.427 1.717 10 10 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332.097 1.653 10 10 EDCE N[C@H]1CC(C(=O)N2CCCc3cccc(Br)c32)=C[C@H]1O 2188025611 GVFKYPJVPLQXOQ-QWHCGFSZSA-N 337.217 1.747 10 10 EDCE CC(C)(C)OC(=O)N1CC2(C[C@H](O)CN2Cc2cc(N)ccc2O)C1 2066540701 SIYLNNKFSARGSN-AWEZNQCLSA-N 349.431 1.531 10 10 EDCE NCc1ccc(N2CC[C@H]3CS(=O)(=O)C[C@H]32)c(Br)c1 2094931692 VAWVXERABSFYFM-GXFFZTMASA-N 345.262 1.531 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H]3CCN[C@@H]3C2)c1O 2227742758 JLHVMNKRMLVORH-JOYOIKCWSA-N 327.222 1.957 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H](F)[C@H](F)C3)c(Br)cc21 2330041373 IJXRFKJLCTUZKM-SOCHQFKDSA-N 332.148 1.897 10 10 EDCE O=C(c1cccnc1)N1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1 178715641 CLBYMWMBXBOLJH-UHFFFAOYSA-N 342.355 1.653 10 10 EDCE OCc1nnc2n1CCN(Cc1ccc(N3CCCCC3)cc1)C2 59886400 AHYJRRWUTHVMML-UHFFFAOYSA-N 327.432 1.777 10 10 EDCE NS(=O)(=O)c1ccc(CNCc2cc(Cl)ccc2O)cc1 20552843 JOCMAGZNPBNNNV-UHFFFAOYSA-N 326.805 1.983 10 10 EDCE CC1(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)COC1 112717405 AZVKWABOSYEUTQ-UHFFFAOYSA-N 337.395 1.498 10 10 EDCE CCC1(CO)CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 301908035 RHQFBWNVGALQDI-UHFFFAOYSA-N 335.360 1.915 10 10 EDCE CCN(CC)c1ccc(CNC(=O)NC[C@H]2CN(C)CCO2)cc1 170922754 QHWZUCJCVOEWLT-KRWDZBQOSA-N 334.464 1.663 10 10 EDCE C[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@H]1N1CCOCC1 180825514 NPBCHQGCZFBYDE-UFYXKPLISA-N 332.400 1.290 10 10 EDCE C[C@H]1CN(Cc2ccc(N3CCOCC3)cc2)CCN1C[C@@H](C)O 120610505 WGACVTZPMINLJM-DLBZAZTESA-N 333.476 1.410 10 10 EDCE COc1cccc(CNC(=O)c2cc(S(C)(=O)=O)c(C)o2)c1O 528858333 CEMRWUGXZXTIGD-UHFFFAOYSA-N 339.369 1.636 10 10 EDCE CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NCc1ccccc1O 263646537 BTWIKOBXQFEFIX-HNNXBMFYSA-N 348.447 1.134 10 10 EDCE NC(=O)C[C@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1 367468622 BGTNWKJBFRTQTQ-OAHLLOKOSA-N 330.432 1.694 10 10 EDCE CO[C@H](C)[C@H](N)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380792474 JFROTUWXEOUTLO-SKDRFNHKSA-N 345.237 1.784 10 10 EDCE Cc1ccc(CN=c2cc[nH]c(C(N)=O)c2)c(O)c1Br 2381129728 OFWBSKZKFVUTTN-UHFFFAOYSA-N 336.189 1.991 10 10 EDCE 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CCOC(=O)C[C@H](O)C(=O)N(C)Cc1ccc(N(CC)CC)cc1 1623452476 WUZWUTNUECYQQU-INIZCTEOSA-N 336.432 1.805 10 10 EDCE CCNC(=O)CC(=O)N1C[C@@H](NCc2ccc(OC)c(C)c2)C[C@@H]1C 1717810359 USOJOECMWXTZLU-HOCLYGCPSA-N 347.459 1.609 10 10 EDCE CN1CC(=O)Nc2cc(C(=O)NCc3cc(Cl)ccc3O)cnc21 1628680428 IEHPTIGQJQVZKM-UHFFFAOYSA-N 346.774 1.759 10 10 EDCE CN(C)c1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1C=O 1630335143 LJNAQSAIHZAJAT-UHFFFAOYSA-N 328.368 1.949 10 10 EDCE CS(=O)(=O)c1ccccc1CC(=O)N1Cc2cccc(O)c2C1 1636230925 KETATPGSKNRJET-UHFFFAOYSA-N 331.393 1.881 10 10 EDCE CC(=O)Nc1cnccc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 1638348099 ONDGGGWTWMTHSU-JTQLQIEISA-N 329.356 1.812 10 10 EDCE COCCN[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1731412385 ARDYJLNTHGDEDN-AWEZNQCLSA-N 333.392 1.593 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)c2ccnc(F)c2)cc1C 1571425054 XEZBQJWPKRIQKT-OAHLLOKOSA-N 347.390 1.418 10 10 EDCE CCCN(C)CC(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1758044965 ZKYRBZLUUCDXFJ-UHFFFAOYSA-N 348.407 1.037 10 10 EDCE Cc1c(O)nc(CCN(C)C(=O)/C=C/c2ccc(O)c(O)c2)nc1O 1597548603 ISEVMOVTLUJSPE-GQCTYLIASA-N 345.355 1.322 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCC(Cc2nn[nH]n2)CC1 1660008641 KFQLQXUTNSNNEU-UHFFFAOYSA-N 342.447 1.491 10 10 EDCE C[C@H](NC(=O)NCc1cccc(Cl)c1O)c1nnnn1C1CC1 1687371483 NMIVEPHNYVWHGQ-QMMMGPOBSA-N 336.783 1.927 10 10 EDCE CN(C)c1ccc([C@H](CN)N2CCN(c3ncccn3)CC2)cc1 32087404 GKDLMRWFXIFTOM-KRWDZBQOSA-N 326.448 1.365 10 10 EDCE O=C1C[C@@]2(CCN(Cc3c(O)cccc3Br)C2)CN1 862351464 LRQUZJBVXROBNU-AWEZNQCLSA-N 325.206 1.867 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@H](O)[C@](C)(O)C2)cc1Br 2136877652 JAUWKGOJWOUQNP-QCZZGDTMSA-N 330.222 1.824 10 10 EDCE CNCc1ccc(N2CC[C@H](O)[C@](C)(O)C2)c(Br)c1 2136832833 MTVKIJQZCBOXRF-UONOGXRCSA-N 329.238 1.491 10 10 EDCE Cn1ncc(-c2noc(-c3nnsc3N)n2)c1Br 1923224176 DFRQGXZYPCNVMK-UHFFFAOYSA-N 328.155 1.333 10 10 EDCE CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1985096823 WZCZAUCWQYTTCX-MXWKQRLJSA-N 327.385 1.826 10 10 EDCE C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985102468 HQACDKHLXRGAAT-AXFHLTTASA-N 327.385 1.562 10 10 EDCE C[C@@H]1CN(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)CCN1 2159528908 OGQSPBSJMAUDLO-SSDOTTSWSA-N 340.232 1.649 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C[C@H](O)C1 2018045694 IICYZCFUGLRRQG-HFAKWTLXSA-N 339.396 1.706 10 10 EDCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CCC=C(Br)C1 404184647 FRAOGOIXYFMFIV-NSHDSACASA-N 341.205 1.479 10 10 EDCE C[C@H]1[C@H](NCc2c(O)cccc2Br)CCS1(=O)=O 706875223 QUERAOGXLNURTE-GZMMTYOYSA-N 334.235 1.820 10 10 EDCE CCNCc1ccc(N(C)[C@@H]2COC[C@H]2O)cc1Br 708070213 GWTIHJFGLADKLJ-ZIAGYGMSSA-N 329.238 1.755 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)cc1Br 2173357570 NRYWULHGYCXGKD-WBGBGRJVSA-N 342.233 1.823 10 10 EDCE COc1cccc(O)c1[C@H](C)N[C@@H]1CCCN(S(C)(=O)=O)C1 2064901839 NQKJHRDNGNVAIA-NWDGAFQWSA-N 328.434 1.475 10 10 EDCE CC(C)(C)OC(=O)N1CC=C[C@@H]1CNC(=O)COc1ccc(N)cc1 2078290492 UVWDMRIVVMSEHY-CQSZACIVSA-N 347.415 1.939 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@@H](N(C)C)C2)cc1Br 2089926808 NCAPQIIAOFDPEH-IIMNLJJBSA-N 328.254 1.580 10 10 EDCE OCC[C@]1(CO)CCN(c2ccc(CO)c(Br)c2)C1 2097024869 OWWDHGJZGQRBBK-CQSZACIVSA-N 330.222 1.513 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CC(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210534674 JIOKVEFSARXRHV-GHMZBOCLSA-N 327.385 1.563 10 10 EDCE CCN(Cc1cc(Br)ccc1O)[C@@H]1CC(=O)NC1=O 2114733028 SOEZBWYZHBSEHN-SNVBAGLBSA-N 327.178 1.392 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(NCc2ccc(O)c(O)c2O)C1 2216824195 QJLJEJWKBGNCTC-DIFFPNOSSA-N 336.388 1.902 10 10 EDCE O=C1NC(=S)N(Cc2ccccc2)C(=O)C1=CNCc1ccco1 2296145157 XTMWVAPHBIOIDM-UHFFFAOYSA-N 341.392 1.697 10 10 EDCE NC(=O)c1ccc(N=NN2CCN(C(=O)c3ccco3)CC2)cc1 2330154821 QZKWIWKRSDCTAV-UHFFFAOYSA-N 327.344 1.835 10 10 EDCE Cc1ccc(CN2CCC(O)(CN)CC2)c(O)c1Br 2352931619 AZGRDUACNKCSSQ-UHFFFAOYSA-N 329.238 1.749 10 10 EDCE COc1ccc(O)c(CN2CCC[C@H](C(=O)N3CCOCC3)C2)c1 179659815 TVUQCOZQYVDRRC-AWEZNQCLSA-N 334.416 1.472 10 10 EDCE N[C@@H](c1cc(I)ccc1O)C(F)(F)CO 95780786 ZCMDFVQVPZAOHK-QMMMGPOBSA-N 329.084 1.624 10 10 EDCE COc1ccc(N2CCN(c3cnnc(N4CCCC4)n3)CC2)cc1 243527243 OBFRADSXDHNPIB-UHFFFAOYSA-N 340.431 1.807 10 10 EDCE Cc1nc(CNC(=O)NCc2cccc(Br)c2O)no1 277349011 GELZNAICHQFJPP-UHFFFAOYSA-N 341.165 1.846 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@H](C)C(C)C)C2)cc1 828490302 BBHQFCIKQXTGNS-LSDHHAIUSA-N 347.459 1.798 10 10 EDCE OCc1nnc2n1CCN(Cc1ccc(Br)cc1O)C2 824895188 SDXFFPFZLIUKKK-UHFFFAOYSA-N 339.193 1.254 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC3CCCCC3)C2)cc1 826601135 XVPVPMBFESKFIK-OAHLLOKOSA-N 345.443 1.839 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)C1(N2CCOCC2)CCC1 582847695 BMALQCZPODPUPW-UHFFFAOYSA-N 345.443 1.733 10 10 EDCE CC(=O)N1CCN(c2ccc(CNC(=O)c3n[nH]cc3F)cc2)CC1 907642167 XVRNLTYFFJPANH-UHFFFAOYSA-N 345.378 1.147 10 10 EDCE COc1ccc(N2CCN(C(=O)CN[C@@H]3COCC3(C)C)CC2)cc1 832165522 ZGILFMFCSDCTIA-QGZVFWFLSA-N 347.459 1.358 10 10 EDCE C[C@@H](NC(=O)c1ccnc(S(C)(=O)=O)n1)c1ccc(N(C)C)cc1 839333518 OCSNRENWWUGJLK-LLVKDONJSA-N 348.428 1.437 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCNC[C@@H]2C)cc1 842208524 WIWPXCLYDJEAIL-YOEHRIQHSA-N 346.475 1.263 10 10 EDCE O=C(NCCCCN1CCOCC1)NCc1cc(Cl)ccc1O 844880632 ANXLSPGYNWSHCJ-UHFFFAOYSA-N 341.839 1.957 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCNC[C@H]2C)cc1 846172412 MFELBAFNDAYAQZ-PBHICJAKSA-N 334.464 1.771 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)c3cccn3C)C2)cc1 855224845 HNUWUJQYNZHQAD-CYBMUJFWSA-N 327.384 1.612 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H]4COC[C@]4(C)C3)nc12 852534405 LVKSRASHFJAXJA-GTNSWQLSSA-N 346.387 1.080 10 10 EDCE C[C@@]1(C2CC2)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 853766175 PWVHFINTGROEMJ-INIZCTEOSA-N 333.344 1.931 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnc4n3CCOC4)CC2)cc1 854198745 QDXWNRIMRRYIMR-UHFFFAOYSA-N 342.399 1.384 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])[nH]3)C2)cc1 855230878 FXISMGBGCGETFR-NSHDSACASA-N 330.344 1.940 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CC[C@@H](C)NC1 861806273 ZXMSYONIYCJCIA-GDBMZVCRSA-N 346.475 1.358 10 10 EDCE C[C@H](NC(=O)N[C@@H](C)C1(S(C)(=O)=O)CC1)c1ccccc1O 868601296 MQVRHPGVQQYOQJ-QWRGUYRKSA-N 326.418 1.718 10 10 EDCE CCOc1ccc(O)c(CN2CCC[C@@H]2CS(=O)(=O)NC)c1 769531456 ATOBNUKOFIYSPK-CYBMUJFWSA-N 328.434 1.305 10 10 EDCE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H](O)[C@H](C)O)ccc21 871131549 XWIXYMFTGAUFRN-SUMWQHHRSA-N 334.416 1.376 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H]3CC(C)=NO3)C2)cc1 875954364 HHQAGZDZHUSCAG-CZUORRHYSA-N 332.404 1.738 10 10 EDCE CN1CCC[C@@H]2CN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC[C@H]21 1118953515 UCUNETHRAFHEIL-GDBMZVCRSA-N 343.427 1.177 10 10 EDCE COc1cc(NC(=O)N2CCOc3cc(N(C)C)ccc32)n(C)n1 881245131 LQRGMYZDXBFKIQ-UHFFFAOYSA-N 331.376 1.926 10 10 EDCE COc1ccc(N2CCN(C(=O)CSc3cccnn3)CC2)cc1 781384911 JWCLAGRHNDPJOA-UHFFFAOYSA-N 344.440 1.926 10 10 EDCE COCCO[C@]12CCC[C@@]1(NC(=O)c1cccc(O)c1O)CCO2 889938440 IDBDRPPNSURJLG-IAGOWNOFSA-N 337.372 1.530 10 10 EDCE CS(=O)(=O)C[C@@H](C(=O)NCc1ccc(O)c(O)c1)c1ccccc1 1137443304 KQPJZPPCHREDBJ-CQSZACIVSA-N 349.408 1.542 10 10 EDCE CC[C@@H](NCc1c(C(=O)OC)n(C)c2ccc(F)cc12)C(=O)NC 894945977 CFMARKRDPMFUHR-CYBMUJFWSA-N 335.379 1.718 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1ccc(C(N)=O)nc1 1140198763 RGBDKBBOXDNHLO-UHFFFAOYSA-N 334.372 1.231 10 10 EDCE CCOC(=O)C1([C@@H](C)NC(=O)c2cccc(O)c2O)CCOCC1 1179532367 SWANVYCGQRNRLS-LLVKDONJSA-N 337.372 1.576 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCOC[C@@H]1C 1323276419 FMICPNYQPMAFNP-BBRMVZONSA-N 333.432 1.218 10 10 EDCE COCCNCc1ccc(N(C)[C@@H](C)C(N)=O)cc1Br 711089675 BFNGDJHJIDQWOJ-JTQLQIEISA-N 344.253 1.495 10 10 EDCE CN(Cc1cc(Br)cc(F)c1O)[C@]1(C(=O)O)CCOC1 715770063 MUOQRJYABIXEFI-CYBMUJFWSA-N 348.168 1.969 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)[C@H]2COCCO2)cc1C 1268511189 CXPCLLXEHDLLBN-REMYHPOOSA-N 334.416 1.181 10 10 EDCE O=C(NCCCSc1nccs1)N1C[C@H](CO)[C@@H](CCO)C1 1348591849 PPDATIILDQPKSE-NWDGAFQWSA-N 345.490 1.258 10 10 EDCE COc1cc(C(=O)N[C@H](C)C[C@H](C)NC(=O)C2CCC2)cc(OC)n1 1288501524 MVLQNOZEEOJUJJ-NWDGAFQWSA-N 349.431 1.912 10 10 EDCE Oc1ccccc1CN[C@@H]1CO[C@H](CN2CCC(F)(F)CC2)[C@H]1O 1615259230 CVPMMTGUTIEZQH-BMFZPTHFSA-N 342.386 1.341 10 10 EDCE COC(=O)[C@@H](COC1CCC1)N(C)C(=O)/C=C\c1ccc(O)c(O)c1 1622942089 PFOLTARQBANQPC-IUCKJTJTSA-N 349.383 1.680 10 10 EDCE CN(CC(=O)NCc1ccc(N2CCCC2)cc1)[C@@H]1CCC[C@H]1O 1624322280 RAPAQKKHTCIYSX-QZTJIDSGSA-N 331.460 1.748 10 10 EDCE COc1ccc(CNC[C@H]2CN(C(=O)CNC(C)=O)C[C@H]2C)cc1C 1724569670 JAOANRVARQMYMI-PBHICJAKSA-N 347.459 1.324 10 10 EDCE CCC(=O)N[C@@H](C)C(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)C1 1491729015 IMVQUFPZLKCPNP-HOCLYGCPSA-N 347.459 1.609 10 10 EDCE CNC(=O)C1(C(=O)N[C@@H](C)[C@H](C)NCc2ccc(OC)c(C)c2)CC1 1733994523 SQASBICMZILUDZ-KBPBESRZSA-N 347.459 1.513 10 10 EDCE CCC(=O)NCC(=O)N1C[C@@H](NCc2ccc(OC)c(C)c2)C[C@H]1C 1734409871 LVWQTMQFMVRWEA-ZBFHGGJFSA-N 347.459 1.609 10 10 EDCE Cc1oc2ncn(C)c(=O)c2c1C(=O)NCc1cc(O)ccc1O 1643879391 NVCIQFGLVOUAIX-UHFFFAOYSA-N 329.312 1.176 10 10 EDCE Cc1ccc(O)c(CNC(=O)CN(C)S(=O)(=O)c2ccccc2)c1 1645800488 GNIOZBMJYBQCKY-UHFFFAOYSA-N 348.424 1.638 10 10 EDCE COCC1(C(=O)NCCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1758043861 CDAZQJQXGDRIGG-UHFFFAOYSA-N 347.375 1.122 10 10 EDCE COC(=O)[C@@H](F)CNC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1685173586 PQBITWXJSLVSNC-HNNXBMFYSA-N 337.395 1.939 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCCOC1 1985093851 GFOPBEBFBWVTBU-AWEZNQCLSA-N 325.369 1.581 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C[C@H]1CCCO1)C(=O)NCCN=[N+]=[N-] 1985102790 LXRZOOAXJYRGAI-GHMZBOCLSA-N 327.385 1.875 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H]1C(=O)NCCc1ccc(O)c(O)c1 2010214705 AXHMNARMVPDLKG-VXGBXAGGSA-N 336.388 1.670 10 10 EDCE CCNCc1ccc(N(CCO)CCN(C)C)c(Br)c1 2155580179 GSVMENAIRFEGOP-UHFFFAOYSA-N 344.297 1.919 10 10 EDCE NCc1cc(F)c(N2C[C@H]3C[C@H]2CS3(=O)=O)cc1Br 321581468 JIODCQJXCZWWDK-DTWKUNHWSA-N 349.225 1.423 10 10 EDCE CNCc1ccc(N2C[C@@H]3OC[C@H](CO)[C@@H]3C2)c(Br)c1 2178081050 BNGGFDNZIAYFMA-HUBLWGQQSA-N 341.249 1.612 10 10 EDCE CS(=O)(=O)c1cnn(Cc2cccc(Br)c2O)c1O 2070262444 UWQQESFFPQQGKZ-UHFFFAOYSA-N 347.190 1.509 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(Br)c1 2182548777 WSPDHYHJRLKELL-MUVVKYGDSA-N 342.233 1.680 10 10 EDCE NCc1ccc(N2CC[C@@H](N3CC(O)C3)C2)c(Br)c1 2102527903 OOJXWNLQZHBCFQ-LLVKDONJSA-N 326.238 1.163 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C)C[C@@H]2CCO)c(Br)c1 2202830092 JHCBJIIPTFJGES-YPMHNXCESA-N 342.281 1.972 10 10 EDCE COc1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)c(OC)c1Br 2234892046 JRVPLYUCSFLBMY-GHMZBOCLSA-N 345.237 1.577 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@@H]([C@@H](C)N)C2)c1O 2236033284 ORPKKEIIUMPPHI-NOZJJQNGSA-N 345.237 1.711 10 10 EDCE COc1ccc(Br)c(CN2CC(C3CNC3)C2)c1O 2227743190 PNKVVZOWTHNSJU-UHFFFAOYSA-N 327.222 1.815 10 10 EDCE CCCCN1C(=O)C(=CNCCCN(CC)CC)C(=O)NC1=S 2296079437 NOXICRQEEMCLRB-UHFFFAOYSA-N 340.493 1.235 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@@H](O)[C@H]2CF)cc1Br 2333234165 PIEOMJKLILKFAE-YAUNCSCZSA-N 334.185 1.382 10 10 EDCE Cc1ccc(CNCCc2ncn(C)n2)c(O)c1Br 2352684594 SCQNDZHVJDMMCU-UHFFFAOYSA-N 325.210 1.924 10 10 EDCE Cc1ccc(CN2CC[C@@H](O)[C@](C)(O)C2)c(O)c1Br 2352949484 FKJMQKXCDQAUTF-BXUZGUMPSA-N 330.222 1.781 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCC[C@@H]1CC(N)=O 103286438 HYCDQZOCUOARLP-QGZVFWFLSA-N 346.475 1.441 10 10 EDCE CCOC(=O)C1=C(COC)Nc2ncnn2[C@@H]1c1ccc(O)c(O)c1 8476534 SIQDDPVLNGWWLJ-CQSZACIVSA-N 346.343 1.168 10 10 EDCE CNC(=O)[C@H]1CCCN1c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 301235816 CZTQENZJLMJENC-STMXVASLSA-N 333.344 1.496 10 10 EDCE CCN1C(=O)/C(=C\c2cn(CC(=O)O)c3ccccc23)C(=O)N=C1O 33285878 VRZKPYNHYJWCJM-GHXNOFRVSA-N 341.323 1.412 10 10 EDCE O=C1NC(=O)N(C2CCCCC2)C(=O)/C1=C/c1ccc(O)c(O)c1 38170454 FBIBVERQBBHAKA-XYOKQWHBSA-N 330.340 1.892 10 10 EDCE COc1cc(O)c(CN2CC[C@H]3CC[C@@H](C2)[S@]3=O)cc1OC 529675818 JRXZFGULMJKRRQ-IFMYKAFSSA-N 325.430 1.895 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@]2(CCOC2)O1 366491418 KPKNCHAIMBDYOH-QLJPJBMISA-N 349.343 1.310 10 10 EDCE COC(=O)CC[C@@H](O)CNCc1ccc(C)c(Br)c1O 2380741721 KFEBJOXAFJSCAC-LLVKDONJSA-N 346.221 1.867 10 10 EDCE CC1(C)C[C@@H](O)CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 395383712 SAMXDQBAHLGQBN-JTQLQIEISA-N 335.360 1.913 10 10 EDCE CCc1ccc(N(CC)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)cc1 298274350 GBGBZLMSSZLQBO-FMIVXFBMSA-N 341.411 1.713 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@]1(C)CCCS1(=O)=O 906855161 ISABPNWFALDDGK-INIZCTEOSA-N 338.429 1.445 10 10 EDCE O=C(NCc1cc(Br)ccc1O)C12CCN(CC1)C2 908170716 SPHLYNFBBWILQU-UHFFFAOYSA-N 325.206 1.867 10 10 EDCE CCOC(=O)[C@H](F)[C@H]1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 912250408 AKJKFLGWIZAWDI-VMADHQJXSA-N 337.347 1.861 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)N(C)CC(C)C)C2)cc1 849416183 LXJHQDPFJSCKTR-CQSZACIVSA-N 341.477 1.696 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCCCNC1 842240185 NXTYSGQVFRSHSK-INIZCTEOSA-N 346.475 1.359 10 10 EDCE C[C@H]1CCNC[C@@H]1NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 841975451 GEXHUYZWTFZIFX-YJBOKZPZSA-N 346.475 1.663 10 10 EDCE COc1ccc(N2CC[C@H](NCc3c4c(nn3C)CCOC4)C2)cc1 922237425 KKNFEJFTWJBHIO-AWEZNQCLSA-N 342.443 1.870 10 10 EDCE COC(=O)CCNC(=O)CCNCc1c(O)ccc(Cl)c1F 858292838 GFYWQQQACBKWNX-UHFFFAOYSA-N 332.759 1.344 10 10 EDCE COC(=O)CCNC(=O)CCNCc1cc(Cl)cc(Cl)c1O 858292143 BYJPSHVBLDCYMO-UHFFFAOYSA-N 349.214 1.858 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NC[C@@H]2C[C@H]2C2CC2)cc1 853010488 CYXWSLILCPTWLD-BBRMVZONSA-N 332.400 1.749 10 10 EDCE COc1ccc(N2CCN(CC(=O)N3CCOC(C)(C)C3)CC2)cc1 929152874 HJGHGJJQJDEFAU-UHFFFAOYSA-N 347.459 1.455 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](CN)C(F)(F)F)C2)cc1 850754204 LFPIXQWCTBKLGV-ZWNOBZJWSA-N 346.353 1.463 10 10 EDCE COc1ccc(N(CC(=O)O)CC(=O)NCC2=CCOCC2)cc1 853010666 IYRBQWLGXJUVGO-UHFFFAOYSA-N 334.372 1.049 10 10 EDCE Cc1ccc(O)c(CNC(=O)c2ccc(CN3CCOCC3)cn2)c1 862756086 PPXCOOMOMQOHNX-UHFFFAOYSA-N 341.411 1.858 10 10 EDCE CC(C)C[C@]1(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CCNC1=O 867302494 PWFQPOQTIURZAH-KPZWWZAWSA-N 334.416 1.697 10 10 EDCE C[C@@H](NC(=O)NC[C@@]1(CCO)CCOC1)c1ccc(N(C)C)cc1 776238327 IYIZBCMJJVRGBC-RDTXWAMCSA-N 335.448 1.902 10 10 EDCE CCOC(=O)[C@]1(C)CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCO1 871224282 HAFNUJJEQCLNKQ-WVRJYTFGSA-N 335.356 1.292 10 10 EDCE COC(=O)c1cncc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1 782344627 JANSYVLTHZBXJZ-UHFFFAOYSA-N 346.362 1.738 10 10 EDCE NC(=O)CN1C(=O)/C(=C/c2ccnn2-c2ccccc2)SC1=S 790626755 ANYZDJPDZUYYAG-WQLSENKSSA-N 344.421 1.559 10 10 EDCE Nc1n[nH]c(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)n1 1235043924 COTNGIQEVBVFHO-UHFFFAOYSA-N 331.163 1.399 10 10 EDCE COc1ccc(Br)c(CNCC2(O)CCOCC2)c1O 1964047152 AKDIEYRKNRWIRH-UHFFFAOYSA-N 346.221 1.794 10 10 EDCE Cc1cccc(NC(=O)NCC(=O)NCc2cc(O)ccc2O)c1 1176747901 DTWBEPGXBSFPII-UHFFFAOYSA-N 329.356 1.844 10 10 EDCE O=C(O)CN1CCCN(Cc2c(O)cccc2Br)CC1 706655362 FIGBWJNWTWXANJ-UHFFFAOYSA-N 343.221 1.747 10 10 EDCE CN1CC[C@H](C(=O)N2Cc3cccc(O)c3C2)[C@H](c2cnn(C)c2)C1 1330662155 JHGPZBPNISOMGY-HOTGVXAUSA-N 340.427 1.703 10 10 EDCE Cn1cc(C(=O)NCCOc2ccc(N)cc2)nc1Br 698478620 PRCIJHVFBULPCP-UHFFFAOYSA-N 339.193 1.574 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NCC(C)(C)F)cc1 1335621757 ISOLUIZITHLMCJ-UHFFFAOYSA-N 339.411 1.454 10 10 EDCE COc1ccc(CNC[C@@](C)(NC(=O)c2cnn[nH]2)C2CC2)cc1C 1267856001 MNCOTWKBCMWBEV-GOSISDBHSA-N 343.431 1.810 10 10 EDCE CCN1CCOC[C@@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1349118174 NQSKRHPVVPZCRR-GOSISDBHSA-N 331.460 1.966 10 10 EDCE CC(=O)N(CCc1ccccc1)CC(=O)NCc1cc(O)ccc1O 1455355532 BUIVJABGSLDDBL-UHFFFAOYSA-N 342.395 1.805 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@]2(CCS(=O)(=O)C2)C1 1468116482 MUQHRYWLTCXBLQ-INIZCTEOSA-N 339.413 1.068 10 10 EDCE Cn1nccc1C1(O)CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 1528809391 FRWCUNZDZUCUEE-HWKANZROSA-N 343.383 1.355 10 10 EDCE COc1ccc(CNC2CC(CNC(=O)Cn3cccn3)C2)cc1C 1479753603 MBUJEWXTZJBPAB-UHFFFAOYSA-N 342.443 1.885 10 10 EDCE CN(C)CCN1CCC(CNC(=O)Cc2ccc(O)c(O)c2)CC1 1615921287 HWBZVFTXKZXWQR-UHFFFAOYSA-N 335.448 1.030 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)Cc2ccccc2)cc1C 1716094309 VCEQBYMWTVVWAJ-SFHVURJKSA-N 342.439 1.813 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(O)cn1 1639587811 GWVMYIPSSCNOOA-UHFFFAOYSA-N 330.340 1.698 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)Cc2cnn(C)c2)cc1C 1568259012 FDMJUJLAQIJFSW-OAHLLOKOSA-N 344.459 1.916 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CC(=O)N(c2cn[nH]c2)C1 1640259717 AYCAKQWCKMFVCH-NSHDSACASA-N 349.387 1.270 10 10 EDCE CNC(=O)N[C@@H]1CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])C1 1642550860 FXMWTENRAFWLMA-FVOPLDGLSA-N 348.359 1.289 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@@H]2CCC(=O)N2C)cc1C 1662310603 ZWEMJBRACANBBL-ZFWWWQNUSA-N 333.432 1.219 10 10 EDCE CCOCC(=O)N[C@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1758867214 ANLUAGODGAITMA-LLVKDONJSA-N 349.391 1.510 10 10 EDCE CCC[C@H](N)C(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1866017620 JXFMCQTZPHKLAK-HOTGVXAUSA-N 329.448 1.819 10 10 EDCE COc1ccc(N2CCN(C(=O)CC[C@@H]3C(=O)NN=C3C)CC2)cc1 1873831577 UMMHBPHTELBBBB-INIZCTEOSA-N 344.415 1.246 10 10 EDCE OCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)cc1Br 2132543832 NSCJBGFTKBJWDM-YABSGUDNSA-N 328.206 1.385 10 10 EDCE CC(=O)[C@@H](C[C@H](N)Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952894730 ZBDLOSSHFLQUCF-CHWSQXEVSA-N 338.404 1.840 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCC1(CN=[N+]=[N-])CC1 1985100665 YGBYZFDUQHUHBX-SNVBAGLBSA-N 327.385 1.733 10 10 EDCE CC(C)(C)OC(=O)NC[C@]12CO[C@](C(=O)N3CC(N=[N+]=[N-])C3)(C1)C2 2026195889 SLSGCMGYMVQXRO-GASCZTMLSA-N 337.380 1.581 10 10 EDCE NCc1ccc(N2CC[C@H]3C(=O)NC(=O)[C@H]3C2)c(Br)c1 2158786478 WJYWOSQEAKLWNP-ZJUUUORDSA-N 338.205 1.007 10 10 EDCE CNC(=O)CN1CCN(Cc2cc(Br)ccc2O)CC1 700799971 ATLBKXKWVHSYEM-UHFFFAOYSA-N 342.237 1.018 10 10 EDCE C[C@@H](N)c1ccc(N(C)C[C@@H](O)CN(C)C)c(Br)c1 690171671 MYVRGSZWCPCGDD-PWSUYJOCSA-N 330.270 1.828 10 10 EDCE COC(=O)C1(O)CN(c2ccc([C@@H](C)O)cc2Br)C1 714489544 YOWKELGZUHHVFX-MRVPVSSYSA-N 330.178 1.227 10 10 EDCE C[C@@H]1C[C@H](O)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 385095307 NOAARCXUXMKTNS-LTMDPNIMSA-N 326.194 1.361 10 10 EDCE C[C@@H]1CN(C)C[C@@H](CNCc2cc(Br)ccc2O)O1 697316942 NBTNSVBZQQTSKS-ZWNOBZJWSA-N 329.238 1.963 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@]4(C)CN(C)C[C@@]4(C)C3)c2n1 2062005659 CAVTVWWXUCITNW-IRXDYDNUSA-N 329.404 1.157 10 10 EDCE NCc1ccc(N2CC(c3nc(O)[nH]c3O)C2)cc1Br 2184941254 PKWJKAYKGKRPMT-UHFFFAOYSA-N 339.193 1.646 10 10 EDCE C[C@@]1(O)CCN(c2ccc(CN)c(Br)c2F)C[C@@]1(C)O 2194598962 CHMORQVDINKSJF-ZIAGYGMSSA-N 347.228 1.759 10 10 EDCE COC(=O)NCC1CN(c2ccc(CN)c(Br)c2F)C1 2187289361 REFPHIMTNXSZPQ-UHFFFAOYSA-N 346.200 1.839 10 10 EDCE CCNC(=O)C1CN(c2cc(Br)c(CN)cc2F)C1 2111749174 AWWILLIHESGKFG-UHFFFAOYSA-N 330.201 1.619 10 10 EDCE COc1ccc(Br)c(CN2CCCO[C@@H](CN)C2)c1O 2236032367 LACOMWXFPJWSIY-JTQLQIEISA-N 345.237 1.713 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)C[C@@H](CO)C2)cc1Br 2236636030 LISXGMPLLIRXTB-UTUOFQBUSA-N 344.249 1.930 10 10 EDCE C[S@](=O)CCCNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 110861899 ANOVKFUOZNGPNT-NPOAWEEOSA-N 336.457 1.421 10 10 EDCE C[C@@H](Nc1cnn(CC(=O)NCCO)c1)c1ccc(F)c(F)c1O 187909623 QOCXFAMFLBVABW-SECBINFHSA-N 340.330 1.149 10 10 EDCE CO[C@@H]1C[C@H](c2nc(C)no2)N(Cc2cc([N+](=O)[O-])ccc2O)C1 190101905 VICHFCUAWKGBBA-CHWSQXEVSA-N 334.332 1.954 10 10 EDCE COc1cc([C@@H]2N[C@H](C(=O)O)C(C)(C)S2)c(O)c([N+](=O)[O-])c1 83236929 GFRNTDCJDZAKAT-GHMZBOCLSA-N 328.346 1.876 10 10 EDCE COCCN1CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])CC1 192511979 KNAVMDIOGJGMFB-GQCTYLIASA-N 349.387 1.549 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCC(NC(N)=O)CC2)c([N+](=O)[O-])c1 267071162 DOTJMNPZPJIGNG-HWKANZROSA-N 348.359 1.418 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CC(F)(F)C[C@@H]1CO 368722623 QXKGOQCKBYRUJV-OAHLLOKOSA-N 337.370 1.974 10 10 EDCE CN(CC1(CO)CC1)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 284264817 SCSYVEFOTAGACL-UHFFFAOYSA-N 345.443 1.134 10 10 EDCE CC(=O)NC1CN(c2ccc(/C=C\C(=O)O)c(Br)c2)C1 388339803 MQAAIENHMJVBLF-HYXAFXHYSA-N 339.189 1.872 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](CNC(=O)c1cccc(O)c1O)C2 819615942 JJOQLELRUFDVPK-GVXVVHGQSA-N 334.372 1.695 10 10 EDCE CN[C@@H](C)c1ccc(N2CCOC[C@@H]2C(N)=O)c(Br)c1 723151363 XRJDYOJFEIDIBD-TVQRCGJNSA-N 342.237 1.420 10 10 EDCE CC(=O)N(C)Cc1cn(Cc2ccc(N3CCOCC3)cc2)nn1 900604296 LJNXPIDTZOQBEV-UHFFFAOYSA-N 329.404 1.141 10 10 EDCE CCN1CC[C@H](N(CC)C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 826707418 UFHOPKZMQLSBSV-KRWDZBQOSA-N 346.475 1.312 10 10 EDCE CN(C)c1ccc(/C=C/CNCC2(OCCO)CCOCC2)cc1 835050228 QJYBBTUWVWKRSK-ONEGZZNKSA-N 334.460 1.914 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCC[C@@]1(O)CCOC1 845263195 ZCCUXDPVFCVQFM-DNVCBOLYSA-N 349.475 1.833 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@@H]3CSC(=O)N3)CC2)cc1 740743589 VKUXCBMMOHHWJH-AWEZNQCLSA-N 335.429 1.605 10 10 EDCE CC(C)CN1CCO[C@H](CNC(=O)NCc2c(O)cccc2F)C1 913919856 BAUARPSQUUCFSH-CYBMUJFWSA-N 339.411 1.687 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C1CC1)[C@H]1CCNC1 844220761 ANHLXGCZNFJRQC-SFHVURJKSA-N 330.476 1.537 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](O)C1CCOCC1 840557150 PMUFDRRVKQEVIH-RDTXWAMCSA-N 334.460 1.896 10 10 EDCE COC(=O)[C@@H]1CO[C@H](CCC(=O)NCc2c(O)cccc2F)C1 928710240 QZPCCPADICDOEX-WDEREUQCSA-N 325.336 1.506 10 10 EDCE O=S1(=O)Cc2ccccc2[C@@H](NCc2cc3c(cc2O)OCO3)C1 857061726 USLPABHEYZHIJX-AWEZNQCLSA-N 347.392 1.880 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@@H]2CCSC2)c1 869602431 PQOBYVDOWITWEC-SNVBAGLBSA-N 344.458 1.637 10 10 EDCE COC(=O)CCNC(=O)CCNCc1cc(Cl)cc(F)c1O 862527474 ATHXJZRJVKRTAG-UHFFFAOYSA-N 332.759 1.344 10 10 EDCE CO[C@@H]1CC[C@H](C)N(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 867721395 UVVJIHPQOJCLQB-WMLDXEAASA-N 347.459 1.737 10 10 EDCE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](C)S(N)(=O)=O 768613625 JJBKTCCANBGKDV-NSHDSACASA-N 341.458 1.562 10 10 EDCE CNC(=O)COc1cccc(CC(=O)N2Cc3cccc(O)c3C2)c1 871202566 ATBUJQVDCDMLKW-UHFFFAOYSA-N 340.379 1.602 10 10 EDCE COc1ccc(N2CCN(C(=O)c3nn(C)cc3[N+](=O)[O-])CC2)cc1 772906293 KXRMOPJSWDVHBR-UHFFFAOYSA-N 345.359 1.299 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)[C@@]12CCCN(CC1)C2 898983483 UWKCLERQHITQAG-FQEVSTJZSA-N 343.471 1.750 10 10 EDCE CO[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)C(=O)OC(C)(C)C 1138153000 VJYPVNYFGLAGHR-YGRLFVJLSA-N 339.388 1.502 10 10 EDCE COc1ccc(N2CCN(C(=O)c3ccoc3CC(N)=O)CC2)cc1 794763497 FVKFMACRTHVFPD-UHFFFAOYSA-N 343.383 1.278 10 10 EDCE 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1.462 10 10 EDCE O=C(CN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCCO 16905435 WWKNMWQCOBKPOH-XFFZJAGNSA-N 340.401 1.135 10 10 EDCE NCc1ccc(N2CCO[C@@H]3C[C@@H](O)C[C@H]32)c(Br)c1 2128873931 FOPXAEYEMXRXML-ZLKJLUDKSA-N 327.222 1.636 10 10 EDCE CCOC(=O)C(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 169813615 FNURXFBYFHDDQM-CQSZACIVSA-N 330.388 1.255 10 10 EDCE Nc1ccc(CN2CCC(NC(=O)c3ccnc(O)c3)CC2)cc1 586051569 BIOMPBWSIQKYSU-UHFFFAOYSA-N 326.400 1.764 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 1900612651 LSBQMJGICZCBET-QWRGUYRKSA-N 327.385 1.516 10 10 EDCE CN(C)C[C@@H]1C[C@H](O)CN1c1ccc(CN)cc1Br 212891645 PVUCAVUKHKXTQK-RYUDHWBXSA-N 328.254 1.409 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@H](O)[C@H]2CF)c(Br)c1 2140662026 JVENZGIMUWSRLJ-WXVIEYFRSA-N 334.185 1.382 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@]1(C)COC[C@H]1NC(=O)OC(C)(C)C 1985101442 SIVKZHQATFIYKK-QMTHXVAHSA-N 327.385 1.685 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985102475 HQACDKHLXRGAAT-VWYCJHECSA-N 327.385 1.562 10 10 EDCE CO[C@@H](C(=O)N(C)CCN=[N+]=[N-])C1CN(C(=O)OC(C)(C)C)C1 1985100758 ILMWIXUKTKMFSD-LLVKDONJSA-N 327.385 1.637 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3OCCN(C)[C@@H]3C2)c(Br)c1 2153997501 YQNSBPDMBZRLGV-VCTAVGKDSA-N 340.265 1.988 10 10 EDCE COc1cccc(O)c1CNC[C@@](C)(CO)NC(=O)OC(C)(C)C 2010533703 GTKJHYSZZSMHEY-KRWDZBQOSA-N 340.420 1.766 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC(N=[N+]=[N-])C2)OCC1(C)C 2010402825 WLBOHPMFROFIAA-LLVKDONJSA-N 339.396 1.922 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H](C(=O)Nc2ccc(N)cc2)C1 2022857835 NFOKXZXRBWCLBH-RISCZKNCSA-N 335.404 1.825 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)NCCc1ccc(N)cc1 2022874263 XUXFDEGWMMXPFK-AWEZNQCLSA-N 337.420 1.203 10 10 EDCE O=S(=O)(Nc1cc(Cl)c(O)c(Cl)c1)N1CCC[C@H]1CO 2161901645 CGNBHEFRHNUMHB-QMMMGPOBSA-N 341.216 1.812 10 10 EDCE C[C@@H](O)CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C1CC1 691473300 WBJYDLYWMXMHHT-UHLUBPPHSA-N 341.205 1.784 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC[C@]3(C)CCO[C@@H]3C3CC3)c2n1 2062658868 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C[C@@H]1O[C@H](C)CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)[C@H]1C 807677068 LAZXAPVNJIFTTE-KBXIAJHMSA-N 347.459 1.954 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N(C)c2cccnc2OC)c1 132845062 WNGVMGFWSPLNJD-VOTSOKGWSA-N 326.356 1.521 10 10 EDCE CCn1nnc(C)c1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 822786139 KTSADCKTVRAJNJ-ZDUSSCGKSA-N 343.431 1.934 10 10 EDCE COCCN(Cc1cc(C)cc(OC)c1O)[C@@H]1CCS(=O)(=O)C1 732473294 RVDWPOGFXZTRNE-CQSZACIVSA-N 343.445 1.345 10 10 EDCE C[C@H]1CN(CCO)CCN1C(=O)NCc1ccc2c(c1)CCCN2C 838032205 YBDDMYMKZIMFKK-HNNXBMFYSA-N 346.475 1.277 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H](CN)[C@@H](C)C1 926327954 KOGAVVJVXUFCTC-GJZGRUSLSA-N 347.459 1.574 10 10 EDCE CCN(CC)c1ccc(CNC[C@H](O)CS(C)(=O)=O)cc1F 922820891 HIQKFGAAFWWEQI-ZDUSSCGKSA-N 332.441 1.167 10 10 EDCE Cc1ccc(C(=O)NCC(=O)N(C)OCC(F)(F)F)c(O)c1O 857744357 DLWDZTZXIYEZLS-UHFFFAOYSA-N 336.266 1.088 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](OC)C3CC3)C2)cc1 852357820 IIMAETHYBJGRMI-PBHICJAKSA-N 333.432 1.998 10 10 EDCE 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CC(C)(C)CCNC[C@@H](O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1272591231 FIQHXJBWRYMKSR-CQSZACIVSA-N 349.435 1.966 10 10 EDCE COC(=O)c1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)no1 1519586668 PTTLRZRCDRMFKX-UHFFFAOYSA-N 345.355 1.432 10 10 EDCE Oc1cccc(Br)c1CN[C@@]12CC[C@@H](C1)[C@@H](O)[C@@H]2O 2120393813 HELKHUPRAWSIAM-ISTUKMMPSA-N 328.206 1.519 10 10 EDCE O=C(NCCCSc1nccs1)c1cnn2c(=O)cc[nH]c12 1628325568 KMJZFJUVHSSWHO-UHFFFAOYSA-N 335.414 1.391 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)CCC(F)(F)F)cc1C 1717761040 BWNVKRZYLQINAU-CYBMUJFWSA-N 348.365 1.913 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C[C@@H]2CCCC(=O)N2)cc1C 1714734097 VPLLMQCUOXLVTL-INIZCTEOSA-N 347.459 1.610 10 10 EDCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccnc1OCCO 1632681624 SAUOTOIUTFXXKM-NSHDSACASA-N 332.356 1.225 10 10 EDCE CCn1nncc1C(=O)NCC[C@@H](C)NCc1ccc(OC)c(C)c1 1492019507 BJVCEDCBSNVOSE-CQSZACIVSA-N 345.447 1.913 10 10 EDCE O=C1C[C@H](C(=O)NCc2cccc(O)c2O)c2ccc(F)cc2N1 1637036020 ZSUNIOZGJQVFHD-LBPRGKRZSA-N 330.315 1.979 10 10 EDCE 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1.316 10 10 EDCE CC(C)(C)OC(=O)NC[C@@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCCOC1 2010393868 YLTJPRYABNFQJZ-HNNXBMFYSA-N 339.396 1.829 10 10 EDCE COc1ccc(O)c([C@@H](C)N[C@H](CO)CNC(=O)OC(C)(C)C)c1 2011424357 HRZMTXWGQUBANC-NEPJUHHUSA-N 340.420 1.937 10 10 EDCE CCN[C@H]1C(=O)Nc2cc(N3CC(OC)C3)c(Br)cc21 312328551 ZEGVHCPYMUNMRC-CYBMUJFWSA-N 340.221 1.887 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3COc4c(C)cccc4C3)c2n1 2065023391 AEBLGHFESMSYNF-ZDUSSCGKSA-N 338.367 1.785 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CCCC[C@H](O)C3)c(Br)cc21 2169207512 YGDJVABDCKBUMQ-SDBXPKJASA-N 340.221 1.752 10 10 EDCE CC(C)(C)OC(=O)N1CCN(Cc2cc(N)ccc2O)[C@H]2COC[C@@H]21 2068826771 OTAOLUBKUZBGCN-GJZGRUSLSA-N 349.431 1.795 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)NCc2ccc(N)cc2)CC(CO)C1 2073697864 DRWWMPZSZFXFTE-UHFFFAOYSA-N 349.431 1.551 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)[C@@](C)(O)C2)c(Br)c1 2201495352 BQGSKIDDZKKLHI-CABCVRRESA-N 343.265 1.881 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](O)[C@H](N(C)C)C2)c(Br)c1 2089925582 DNBYXGQAUAXHAV-FZQKWOKYSA-N 328.254 1.580 10 10 EDCE CSc1ncc(CN[C@H]2CS(=O)(=O)C[C@@H]2OC(C)C)s1 2284498720 JXSOACTYPDHXJL-QWRGUYRKSA-N 336.504 1.545 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccc(=N)[nH]c2C)s1 2284703301 NKTUCNFELFUZKM-UHFFFAOYSA-N 330.460 1.459 10 10 EDCE Oc1cccc(Br)c1CNC[C@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2296994374 ZSDARITZVXUPPP-XUAZIFSCSA-N 342.233 1.622 10 10 EDCE CC(C)(C)[C@H](NC(=O)C=Cc1ccc(N2CCOCC2)cc1)C(N)=O 2297526565 CFMGYKXUWMSPHQ-QGZVFWFLSA-N 345.443 1.553 10 10 EDCE Cn1cccc(NC(=O)C=Cc2ccc(N3CCOCC3)cc2)c1=O 2297573734 GYJCPECZKAFMOD-UHFFFAOYSA-N 339.395 1.874 10 10 EDCE Nc1ccc(OCC(=O)N[C@H](CCO)COCc2ccccc2)cc1 2320381286 PKFXNIQRDIBDLG-QGZVFWFLSA-N 344.411 1.732 10 10 EDCE Cc1ccc(CN2C(=O)CCS2(=O)=O)c(O)c1Br 2327615409 LEBCLPXNEOQASP-UHFFFAOYSA-N 334.191 1.525 10 10 EDCE Oc1c(F)cc(Br)cc1CN[C@H]1CO[C@@H]2COC[C@@H]21 2329408055 GJWNYXPYVOOIDW-ADEWGFFLSA-N 332.169 1.797 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2C[C@H]2C(N)=O)c(O)c1Br 2352646700 XFNAUVJFVUASMH-BDAKNGLRSA-N 327.178 1.201 10 10 EDCE CNC(=O)[C@@H]1CCCN1C(=O)c1cc(C)n(-c2ccccn2)c1C 104359151 FZLNIRGDUIMEDA-HNNXBMFYSA-N 326.400 1.840 10 10 EDCE CN(Cc1ccccc1O)S(=O)(=O)c1csc(C(=O)O)c1 113250581 NGZCLDODCOVGHX-UHFFFAOYSA-N 327.383 1.973 10 10 EDCE CC[C@@H](C)NC(=O)Nc1cc(N2CCN(C=O)CC2)ccc1OC 62275226 USYNUGPKZWLDQQ-CYBMUJFWSA-N 334.420 1.894 10 10 EDCE O=c1[nH]c2ccc(NS(=O)(=O)c3cccc4nsnc34)cc2[nH]1 75340397 RIPBIGQCRXWLGY-UHFFFAOYSA-N 347.381 1.662 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)C[C@H]3CCO3)c(Br)cc21 2366919372 QZAMACSGSSBBTQ-AMIZOPFISA-N 340.221 1.887 10 10 EDCE COc1ccc(N(C)CCn2nc3ccccn3c2=O)c(OC)c1 131899919 ALONEKUPAXKQKN-UHFFFAOYSA-N 328.372 1.650 10 10 EDCE COc1ccc(N2CCN(Cc3nc(N(C)C)no3)CC2)cc1F 192740734 YZRJJTAILDBQKT-UHFFFAOYSA-N 335.383 1.606 10 10 EDCE COc1ccc(N2CCN(C(=O)NCCCC(=O)N(C)C)CC2)cc1 193837216 FCYRHUMHQBKPRH-UHFFFAOYSA-N 348.447 1.395 10 10 EDCE CC(=O)c1cc(F)cc(CN2C[C@@H](N3CCOCC3)[C@H](C)C2)c1O 246300619 BUZXXFGVOYSVCQ-SJKOYZFVSA-N 336.407 1.886 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC(c3ncc[nH]3)CC2)cc1 265487665 MHGKDGDBWUZBFM-UHFFFAOYSA-N 341.459 1.972 10 10 EDCE CCOc1cccc(CN2CCC[C@@H](CS(N)(=O)=O)C2)c1O 271182289 MNAZDAPMKIUIBV-GFCCVEGCSA-N 328.434 1.291 10 10 EDCE COC(=O)c1coc(C(=O)NCc2ccc(N3CCOCC3)cc2)c1 273584131 RBTRVTYAIPBCEI-UHFFFAOYSA-N 344.367 1.833 10 10 EDCE COCCn1cc(S(=O)(=O)Nc2ccc(O)c(OC)c2)cn1 280604528 PRHHNRDDCPPHOJ-UHFFFAOYSA-N 327.362 1.045 10 10 EDCE Cc1ccc(CN2C(=O)[C@H](C)NC(=O)[C@H]2C)c(O)c1Br 2381140091 FPTSRXAFRGSQDN-DTWKUNHWSA-N 341.205 1.699 10 10 EDCE Cn1ncc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n1 807569549 PTHCCTFMYKMLKO-OAHLLOKOSA-N 345.403 1.412 10 10 EDCE Cn1nnc2c1CCN(c1cc(Br)c(CN)cc1F)C2 2170404662 AURVSJDPKMEABS-UHFFFAOYSA-N 340.200 1.738 10 10 EDCE Cc1ccc(O)c(CN[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)c1 808424735 UWUBTHRUDUFHGY-CQSZACIVSA-N 327.450 1.061 10 10 EDCE CC(C)(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)n1cccn1 822688171 LTAGERQGOAUZRA-UHFFFAOYSA-N 346.406 1.910 10 10 EDCE C[C@@H](NC(=O)Cc1cnnn1C)c1ccc(N2CCOCC2)cc1 823834890 PUIBNGDZFJDPLC-CYBMUJFWSA-N 329.404 1.072 10 10 EDCE CCc1cc(NC(=O)C(=O)NCCCSc2nccs2)no1 749730058 HVIXGMVREYHWRB-UHFFFAOYSA-N 340.430 1.931 10 10 EDCE Nc1ccc(Cc2nc(C(=O)N3CC[C@H](C(=O)O)C3)cs2)cc1 844931255 CIMUAPOPTDZIOW-NSHDSACASA-N 331.397 1.863 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@@H]3CNCC[C@@H]3C)CC2)cc1 841778429 BBFPUXMKPDHCQH-KBXCAEBGSA-N 346.475 1.961 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@]1(C)CC1(Br)Br 849965672 HIBQTCPWPLGUFI-MRVPVSSYSA-N 341.983 1.584 10 10 EDCE C[C@H]1CN([C@H](C)CNC(=O)NCc2c(O)cccc2F)C[C@@H](C)O1 923118573 WYHQOQIAXYPJJF-UPJWGTAASA-N 339.411 1.828 10 10 EDCE N[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC[C@H]1F 851654712 GIRHTLFZLAULMJ-HZPDHXFCSA-N 336.411 1.104 10 10 EDCE CCOC(=O)C[C@H](O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 859230498 ZRYRISIBGLCUEX-PBHICJAKSA-N 336.432 1.488 10 10 EDCE COCCn1ncc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1C 867303124 ZJRWZPHQWWVRAX-NSHDSACASA-N 333.388 1.610 10 10 EDCE CCN1C[C@@H](S(=O)(=O)NCc2ccc(N(C)C)cc2C)CC1=O 866797218 PYPXRWLIVVSYMM-HNNXBMFYSA-N 339.461 1.101 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@@H]2COC[C@]2(C)C1 1118494581 IPLSGMBIHKESQJ-BEFAXECRSA-N 345.443 1.206 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H]3CCN(C)C3)CC2)c(OC)c1 870163783 GFPQGIZJWBFXSJ-AWEZNQCLSA-N 333.432 1.304 10 10 EDCE Cc1cc(Br)c(O)c(CNC[C@@H](C)S(C)(=O)=O)c1 781636151 OGBSOBMTNCMGQS-SECBINFHSA-N 336.251 1.986 10 10 EDCE O=C1C[C@]2(CCN(Cc3ccc(N4CCOCC4)c(F)c3)C2)CN1 789766837 AIPAYICUGVZISV-GOSISDBHSA-N 333.407 1.374 10 10 EDCE O=C(NCCNc1ncccn1)c1cc2cc(O)c(O)cc2s1 1144594768 ANXGJYQYYCBPHH-UHFFFAOYSA-N 330.369 1.944 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)N[C@H]2CCC[C@@H]2O)N(C)C)cc1 899097655 DSIHMOFZIFAYHI-BBWFWOEESA-N 334.464 1.568 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cc(-n2ccnn2)ccc1F 1153885952 UKRVMFKSVYJPRQ-UHFFFAOYSA-N 328.303 1.748 10 10 EDCE Cc1cc(=O)cc(C)n1CCCC(=O)NCc1cc(O)ccc1O 1153884754 HGMALICKXKOGLQ-UHFFFAOYSA-N 330.384 1.973 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccccc1 1320393752 MNKBVROXGSZPOY-HNNXBMFYSA-N 343.379 1.931 10 10 EDCE COCCN(CCF)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1330498930 FVQAJIFQZCHFNQ-UHFFFAOYSA-N 349.406 1.124 10 10 EDCE C[C@@H](NC(=O)C(=O)NCCc1ccns1)c1ccc(N(C)C)cc1 1332139484 AGLPLXCIIGVYTC-GFCCVEGCSA-N 346.456 1.745 10 10 EDCE COC(=O)C[C@H](CNC(=O)C(=O)N(C)Cc1ccccc1O)C1CC1 1331089248 JXVCIJUMTVRTPF-CQSZACIVSA-N 348.399 1.056 10 10 EDCE COc1cc(C(=O)N[C@@H](C)CNC(=O)C2(C)CC=CC2)cc(OC)n1 1354695779 RCHXWHZFASGDAU-LBPRGKRZSA-N 347.415 1.690 10 10 EDCE O=C(Cn1ncc(=O)c2ccccc21)NCc1ccc(O)cc1O 1299569106 BGKWSDRCQZVXIO-UHFFFAOYSA-N 325.324 1.124 10 10 EDCE COCC(=O)N[C@H](C)C[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1701980052 LZNWWWJXCODCFM-GHMZBOCLSA-N 349.391 1.509 10 10 EDCE CN1CCC[C@@H]1c1cc(C(=O)NCCc2ccc(O)c(O)c2)n[nH]1 1566370228 RGDKAFWLVXURHR-CQSZACIVSA-N 330.388 1.560 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccc(C(=O)NC2CC2)cc1 1635846829 BVKSIOSTGGJYFB-UHFFFAOYSA-N 326.352 1.920 10 10 EDCE O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)c1cccc(O)c1O 1587733786 XSWAQPBZGVRKOG-UHFFFAOYSA-N 348.380 1.791 10 10 EDCE CC[C@@H](F)C(=O)NC[C@H](C)NC(=O)c1cc(OC)nc(OC)c1 1744722397 GVTPWFIFESSICU-GXSJLCMTSA-N 327.356 1.081 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)c2ccnc(CO)c2)cc1 1583623210 ZZKUNINSPFGMSB-UHFFFAOYSA-N 329.400 1.791 10 10 EDCE CN(c1cc(Br)c(CN)cc1F)[C@H]1CCC(=O)NC1 2127090014 GFWMLBHYZGBXKE-VIFPVBQESA-N 330.201 1.762 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(C)COCCO1 1762515567 BENXBXHVBFIDMA-KRWDZBQOSA-N 332.404 1.734 10 10 EDCE COc1ccc([C@H](CNC(=O)c2cc(O)c(O)c(O)c2)N(C)C)cc1 1865876041 OKCSLBOIPIZLQC-AWEZNQCLSA-N 346.383 1.845 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CCNCc2cccc(O)c2O)C1 1940383856 WFWIRYJDWBORTO-UHFFFAOYSA-N 338.404 1.559 10 10 EDCE CC(C)(C)OC(=O)Nc1ccc([C@H]2CS(=O)(=O)CCN2)c(O)c1 1952957105 TURHUNNULOOBJG-GFCCVEGCSA-N 342.417 1.798 10 10 EDCE C[C@H](COCC(=O)C(=O)C[C@H]1C[C@H](N)C1)NC(=O)OC(C)(C)C 1982091424 NUZAWFGDQCXNSA-IJLUTSLNSA-N 328.409 1.182 10 10 EDCE CCNCc1ccc(N2CCCC2(CO)CO)cc1Br 2146070915 CASJCVUFWRAHCB-UHFFFAOYSA-N 343.265 1.882 10 10 EDCE C[C@H](N)c1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)cc1Br 2146307292 YSCRJTQUVFJYTP-LKTVYLICSA-N 341.249 1.650 10 10 EDCE CC1(NC(=O)COc2ccc(N)cc2)CN(C(=O)OC(C)(C)C)C1 1999132291 TXGCAMMLHLACLI-UHFFFAOYSA-N 335.404 1.773 10 10 EDCE CN(CCOCCNC(=O)OC(C)(C)C)Cc1cc(N)ccc1O 1999438186 AHWZCIBUMCLXCI-UHFFFAOYSA-N 339.436 1.948 10 10 EDCE Cn1[nH]c(CNC(=O)OC(C)(C)C)nc1=NCc1ccccc1O 2011813913 SRLSNXBTZYWKCG-UHFFFAOYSA-N 333.392 1.579 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@](O)(C(=O)NCCCCN=[N+]=[N-])C1 2011939409 LVFBPVXFDSHAKY-HNNXBMFYSA-N 341.412 1.955 10 10 EDCE CCNCc1ccc(N(C)[C@@H]2COC[C@@H]2O)c(Br)c1 708091788 XUUNLJNBIQEQHW-KGLIPLIRSA-N 329.238 1.755 10 10 EDCE O=C(NC[C@H]1COCCN1Cc1ccccc1)c1ccc(O)c(O)c1 2074173978 LLTPUQLNDGNPQI-INIZCTEOSA-N 342.395 1.729 10 10 EDCE CNC(=O)c1cncc(/C=C/C(=O)N2CCSc3ccncc32)c1 125137323 LAQXMQAOZIRKAV-NSCUHMNNSA-N 340.408 1.988 10 10 EDCE COc1ccc(Br)c(CNCCc2nn[nH]n2)c1O 2227746968 UCOPEAVZYWDSTD-UHFFFAOYSA-N 328.170 1.009 10 10 EDCE CSc1ncc(CNS(=O)(=O)c2ccccc2NN)s1 2284698807 KNVMNQQFZGRDBV-UHFFFAOYSA-N 330.460 1.629 10 10 EDCE CCCN(C[C@H](C)O)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2288047027 FBGGYXCHTSFMMY-SDBXPKJASA-N 342.237 1.998 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCC[C@@H]1CN1CCOCC1 2307987848 OQMZYTLUNBHIHV-OAHLLOKOSA-N 332.400 1.434 10 10 EDCE CCCS(=O)(=O)N(C)Nc1nc(Cl)c(C(=O)OC)s1 2339716058 MGFPMXCDSDVBIN-UHFFFAOYSA-N 327.815 1.582 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(Br)c1 2355335594 DFDFXLNKVFYRGG-KBZKQINZSA-N 341.249 1.789 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@@]4(O)C[C@H]4C3)c(Br)cc21 2359031717 OFESZZXLVSTCKU-AAAAQAOESA-N 338.205 1.362 10 10 EDCE C[C@@H]1CN(c2ccc(CN)cc2Br)C[C@@H](C)S1(=O)=O 400845125 NHJSVKSVPDBEDM-NXEZZACHSA-N 347.278 1.920 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNC(=O)/C=C(/C)C2CC2)cc(OC)n1 1284202467 COGCDMRFMZEKNV-SEVUFMINSA-N 347.415 1.690 10 10 EDCE Cc1[nH]c(=O)sc1S(=O)(=O)NCc1ccc(N(C)C)cc1 40431622 UCIQNJDIIPBZLH-UHFFFAOYSA-N 327.431 1.289 10 10 EDCE C[C@H](CN1CCOCC1)N(C)Cc1ccc(N2CCOCC2)cc1 91531002 OCUMGFPPXIYRQL-QGZVFWFLSA-N 333.476 1.676 10 10 EDCE CC[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)CCN1C[C@H](C)O 247567396 RJMHPBGBTDQRSV-RDJZCZTQSA-N 348.491 1.739 10 10 EDCE O=C(NC[C@H]1CCCO1)N1CCN(c2ccc3c(c2)OCO3)CC1 244059486 TXXBNCMHPUKBRG-CQSZACIVSA-N 333.388 1.426 10 10 EDCE C[C@@](CN)(NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C1CC1 255437745 XKQVOSFDKPUJGT-JAFJLQOXSA-N 329.444 1.780 10 10 EDCE CC1(CNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)OCCO1 255188398 PWDITYKXZGBACU-DAXSKMNVSA-N 332.400 1.416 10 10 EDCE NC(=O)CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 266123525 IKMPELFLHCWVCP-UHFFFAOYSA-N 345.321 1.034 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCS3)CC2)cc1 266419511 FFGHNKROZPKPIV-KRWDZBQOSA-N 349.500 1.829 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC(F)(F)C[C@@H]2CO)cc1F 368709751 KZJKVOQIENWFIU-LLVKDONJSA-N 331.338 1.803 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@]3(C)CCC(=O)NC3)C2)cc1 819589704 GDFYOSBUOLKDNQ-AUUYWEPGSA-N 345.443 1.554 10 10 EDCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cc(OC)ccc1O)C2 819399893 YRFRWXPGYQGRFY-CQDKDKBSSA-N 348.399 1.884 10 10 EDCE COc1cc(N2CC(CN3CCOCC3)C2)c([N+](=O)[O-])cc1OC 820591555 LKNQQCISNGBRNN-UHFFFAOYSA-N 337.376 1.380 10 10 EDCE CC[C@@H](O)CC(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 828519363 NTKAAGNRGQUPJJ-GFCCVEGCSA-N 329.780 1.708 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)[C@]2(C)CCCS2(=O)=O)c1 907060502 MSWNAXVDAIJSSQ-BONVTDFDSA-N 327.402 1.545 10 10 EDCE CC1(C)[C@@H](N2CCOCC2)C[C@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 911848714 YDFXGEASGZSFNT-UPXOEVQQSA-N 346.427 1.727 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCNC[C@](C)(F)C1 844224474 FREDWKKCNPLLDQ-SFHVURJKSA-N 336.455 1.344 10 10 EDCE C[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 914336493 ZIAWYCJHBLUFNW-OAHLLOKOSA-N 333.432 1.844 10 10 EDCE Cc1nonc1CC(=O)NCc1cc(Br)ccc1O 846139843 VIUKRLVANRIQMK-UHFFFAOYSA-N 326.150 1.705 10 10 EDCE COC(=O)CNC(=O)[C@H]1CCCN1Cc1cc(Cl)cc(C)c1O 841892621 OLQMXGNPLIINPR-CYBMUJFWSA-N 340.807 1.608 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)C[C@@H]3CCCO3)C2)cc1 849416410 QWLWFMWQBNCXAL-BBRMVZONSA-N 340.445 1.372 10 10 EDCE O=C(NCc1c(O)cccc1F)c1cncc(N2CCOCC2)c1 928705303 JEUVAXLBEPENEL-UHFFFAOYSA-N 331.347 1.693 10 10 EDCE CC(C)(C)[S@@](C)(=O)=NS(=O)(=O)NCc1c(O)cccc1F 921451013 IYAUBKQYXQIPHB-HXUWFJFHSA-N 338.426 1.762 10 10 EDCE CCO[C@@H]1COC[C@H]1NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852374463 NESDWCUOCHYFPK-KBRIMQKVSA-N 349.431 1.377 10 10 EDCE CCc1c(C(=O)NCCc2ccc(O)c(O)c2)[nH]c(C)c1C(N)=O 762267981 XNZAGPDKCBCOEA-UHFFFAOYSA-N 331.372 1.368 10 10 EDCE O=C(COC(=O)c1ccccc1OCCO)c1ccc(O)c(O)c1 783150213 BFDUKPXUSFXPII-UHFFFAOYSA-N 332.308 1.509 10 10 EDCE CCCN(C(=O)Cc1ccc(O)c(O)c1)[C@H]1CCS(=O)(=O)C1 1136139473 HSTJAIWZRSOQNP-LBPRGKRZSA-N 327.402 1.066 10 10 EDCE COC(=O)c1ccccc1S(=O)(=O)Nc1ccc(O)c(OC)c1 797820100 GIYGNOLEVUYEQA-UHFFFAOYSA-N 337.353 1.988 10 10 EDCE C[C@@]1(O)CCN(c2ccc(CN)cc2Br)C[C@@]1(C)O 1880696790 BZPNIUIHASQXTH-ZIAGYGMSSA-N 329.238 1.620 10 10 EDCE COc1ccc(N2CCN(CN3C[C@H](C(F)F)CC3=O)CC2)cc1 795401395 OYODCONQNDPIGI-CYBMUJFWSA-N 339.386 1.888 10 10 EDCE CCn1cccc(CNC(=O)c2ccc(N=NC(N)=O)cc2)c1=O 1156391793 DBDPNWHBFHICOU-UHFFFAOYSA-N 327.344 1.961 10 10 EDCE CCOC(=O)Cc1nnc2ccc(S(=O)(=O)C(F)F)cc2n1 1088707524 XHEPIBCPRSJVPK-UHFFFAOYSA-N 331.300 1.127 10 10 EDCE CN(C)C(=O)c1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)cn1 1154430010 YYDOJCGRURYBKC-XBXARRHUSA-N 327.340 1.847 10 10 EDCE C[C@H](NC(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1)c1ccccc1O 1302532883 SXNOJQSKJUBCEA-BONVTDFDSA-N 347.396 1.300 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CNCc1ccc2c(c1)CCCO2 1962871208 WQSMUQRIFFZUPS-OAHLLOKOSA-N 336.432 1.987 10 10 EDCE C[C@@H](NC(=O)CN(C)S(=O)(=O)c1ccccc1)c1ccccc1O 1302530378 NKFNADRSTGNZQN-CYBMUJFWSA-N 348.424 1.890 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@](O)(CC(=O)NCCN=[N+]=[N-])C1 1963815618 ATORAXPKCVHWBH-AWEZNQCLSA-N 327.385 1.565 10 10 EDCE C[C@@]1(O)CCN(c2cc(Br)c(CN)cc2F)C[C@@H]1O 1893300274 MBHAYJPKKGDUKA-QWHCGFSZSA-N 333.201 1.369 10 10 EDCE COC(=O)[C@H]1C[C@@H](O)CN1Cc1cc(OC)cc(C(C)(C)C)c1O 1328200286 HQUIKUWMVRXEFP-IUODEOHRSA-N 337.416 1.807 10 10 EDCE O=C(C(=O)N1CC[C@H](c2ccccn2)C1)N1Cc2cccc(O)c2C1 1330396459 LLCZYTPNFGFDHW-AWEZNQCLSA-N 337.379 1.646 10 10 EDCE COc1ccc(O)c([C@@H](C)NC[C@H](O)CN(C)CC(F)(F)F)c1 1192780993 ODEWWAWIAPSWLE-MNOVXSKESA-N 336.354 1.906 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(CO)nc1 1543233260 IJOSCWBMHFGAKI-UHFFFAOYSA-N 345.374 1.480 10 10 EDCE C[C@H](NC(=O)C1(CO)CCOCC1)c1ccc(N2CCOCC2)cc1 1544214873 HJABSSDSYRMPAK-HNNXBMFYSA-N 348.443 1.490 10 10 EDCE CCN(CC)c1ccc(CNC(=O)CCCn2c(O)nnc2O)cc1 1625014056 KHRAQQSXPQQIOD-UHFFFAOYSA-N 347.419 1.632 10 10 EDCE C[C@H](O)[C@H](NC(=O)C1CCCC1)C(=O)N(C)Cc1ccccc1O 1629954717 ALPJHLLWTNQELH-LRDDRELGSA-N 334.416 1.406 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H]2COCCO2)cc1C 1482084964 XBYVOIOBTLJYRM-GUYCJALGSA-N 336.432 1.261 10 10 EDCE CC1(C)CN=C(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)S1 1623124403 MPIMHLIZPHGHQZ-UHFFFAOYSA-N 349.456 1.666 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2nc(C)no2)cc1C 1567540623 MROIXEHFYMRFEW-UHFFFAOYSA-N 346.431 1.876 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1CC[C@H](Nc2ncccn2)C1 1639943420 QHYANTYIPKRRPK-DXTPNHAXSA-N 326.356 1.614 10 10 EDCE NC(=O)[C@@]1(c2ccccc2)CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1642832443 YKHDVGYQFCDLHV-IBGZPJMESA-N 340.379 1.296 10 10 EDCE CC(C)n1cc(CNC(=O)N[C@@H](C)c2ccccc2O)c(O)nc1=O 1687882990 XYRYSMJZQJNLEN-NSHDSACASA-N 346.387 1.796 10 10 EDCE Cc1cc(=O)c(O[C@H](C)C(=O)O)cn1CCOc1ccc(N)cc1 1857917051 ZQZKAZWREHSUDW-GFCCVEGCSA-N 332.356 1.670 10 10 EDCE CC(C)(C)OC(=O)NC[C@]1(CO)COCCN1c1ccc(N)cc1 1999450496 YSMANODUKWQOPR-KRWDZBQOSA-N 337.420 1.361 10 10 EDCE CCN1CCc2cc([C@H](N)[C@H](O)CNC(=O)OC(C)(C)C)ccc21 1999537371 XXTZDLQFCRAEQS-CVEARBPZSA-N 335.448 1.954 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C[C@H](O)C1 2018045796 KLWVDIONZVQQMF-ZIBATOQPSA-N 339.396 1.563 10 10 EDCE CC(C)(C)OC(=O)NCc1nnc2n1CCN(CCCN=[N+]=[N-])C2 2024148753 DWNOCSVTMLDSED-UHFFFAOYSA-N 336.400 1.819 10 10 EDCE O=C(NCCCn1cc(Br)cn1)c1cc(O)nc(O)c1 312230057 ACYPJJHYWDBNSN-UHFFFAOYSA-N 341.165 1.272 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)[C@H]3C[C@H](O)C3)c(Br)cc21 2179468200 MRLLORVMIMBFIF-OTPXZMOZSA-N 340.221 1.621 10 10 EDCE COCCNC(=O)CNCc1cc(Br)cc(F)c1O 715813408 ODIQUTWCYDBXJO-UHFFFAOYSA-N 335.173 1.146 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@H](N4CCCCC4)C3)c2n1 2064191899 PGTPDICPZJYGCY-AWEZNQCLSA-N 343.431 1.834 10 10 EDCE O=C1NC[C@H]2CN(Cc3c(O)cccc3Br)CC[C@H]12 2100942977 HADHYJNLIAMEOE-UWVGGRQHSA-N 325.206 1.723 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H](O)[C@@H]3COC[C@H]32)c(Br)c1 2102178885 XJSYVIIMEXTKMQ-OIUVXRBSSA-N 328.206 1.698 10 10 EDCE CN[C@H](c1ccccc1O)[C@@H](O)c1c(Br)nnn1C 2091867681 NOGCCNHLYGYYIN-MWLCHTKSSA-N 327.182 1.277 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@]4(CO)C3)c(Br)cc21 2200840878 LFZDFPLYDGVCNQ-AAAAQAOESA-N 338.205 1.220 10 10 EDCE NCc1ccc(N2CC(N3CCOCC3)C2)cc1Br 2113196602 GPWNVXBKCSZKSP-UHFFFAOYSA-N 326.238 1.429 10 10 EDCE Cc1nn(C)cc1C=C1SC(N2CCN3CCC[C@H]3C2)=NC1=O 2328652450 YHGIDYSCOVSMBA-ZDUSSCGKSA-N 331.445 1.479 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H](O)C3)c(Br)c1 2330386773 QHNJPIXZZBHJMM-PCDDKUFXSA-N 328.206 1.262 10 10 EDCE Cc1ccc(-n2nc(C)c(C=C3C(=O)NC(=O)NC3=O)c2O)cc1C 100535390 PWNXVCZKYSVYKM-UHFFFAOYSA-N 340.339 1.253 10 10 EDCE Cc1cc(O)c(O)cc1CCNC(=O)[C@@H]1CC(=O)N(C(C)(C)C)C1 170196261 GWKVPDKZLJUANL-CYBMUJFWSA-N 334.416 1.712 10 10 EDCE O=C(CN1C(=O)CSC1=S)NC[C@@H]1Cc2ccccc2CO1 219819016 PQLYUMFYDZBNLB-LBPRGKRZSA-N 336.438 1.104 10 10 EDCE CN1CCCc2cc(CNC(=O)NC[C@]3(CCO)CCOC3)ccc21 129007276 LAWCGXKYKJFTTP-IBGZPJMESA-N 347.459 1.657 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3ccncc3)nc12 182875363 SKVONFDVTGRYTK-LLVKDONJSA-N 341.371 1.857 10 10 EDCE CC[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCN1C[C@@H](C)O 181133358 DKMFXTAGDICOQI-RLWBPUTGSA-N 334.416 1.415 10 10 EDCE CN(C)c1ccc(CNC(=O)Cc2ccccc2C(N)=O)cc1F 192036193 FYTAVXIKARQVCD-UHFFFAOYSA-N 329.375 1.850 10 10 EDCE CC1(C)CN(Cc2ccc(N3CCOCC3)cc2)CCS1(=O)=O 93735415 HKNXFNXFYIROBE-UHFFFAOYSA-N 338.473 1.532 10 10 EDCE C[C@@H]1CN(S(=O)(=O)NCc2ccc(N(C)C)cc2)C[C@@H](C)O1 248136358 RWARCOXYFVCWJG-CHWSQXEVSA-N 327.450 1.196 10 10 EDCE COc1cccc(CNC(=O)/C=C\c2ccc(C(N)=O)cc2)c1O 254988220 YNAWQHSJTXLECC-YFHOEESVSA-N 326.352 1.829 10 10 EDCE CCOc1ccc(O)c(CN[C@H]2CCC[C@H]2CNS(C)(=O)=O)c1 800310282 VRGRFYKYLOTKMQ-WFASDCNBSA-N 342.461 1.598 10 10 EDCE C[C@H]1CC[C@@H](NC(=O)N(C)Cc2ccccc2O)CS1(=O)=O 822005298 LFAWVOCRHDKZOO-WCQYABFASA-N 326.418 1.499 10 10 EDCE C[C@H]1OCC[C@@H]1N(CCO)Cc1cc(Cl)cc([N+](=O)[O-])c1O 825130037 KUBRIXLDDRLKPB-SKDRFNHKSA-N 330.768 1.926 10 10 EDCE C[C@@H](NC(=O)C12CCN(CC1)C2)c1ccc(N2CCOCC2)cc1 900386665 BWQBKEDRWLTVFW-OAHLLOKOSA-N 329.444 1.796 10 10 EDCE CN(C)c1ccc(/C=C\CN[C@H]2CCCN(S(C)(=O)=O)C2)cc1 835037633 RRKYRZGHVHAOAH-LEXSJLIMSA-N 337.489 1.779 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@H]1CCCCN1CCO 838477247 FPKYWRDYKGGMTD-SFHVURJKSA-N 348.491 1.707 10 10 EDCE COC(=O)/C(C)=C/CNC(=O)NCc1ccc2c(c1)CCCN2C 915390765 PNJOBVSCMKQQBN-MDWZMJQESA-N 331.416 1.988 10 10 EDCE C[C@@H]1C(=O)N(CCN(C)C)CN1C/C=C\c1ccc(N(C)C)cc1 843429429 VNGAXGLKUBJMED-MWWKQMNYSA-N 330.476 1.818 10 10 EDCE CN1CCCc2cc(CNC(=O)[C@]34C[C@H]5C[C@@H](C(=O)N3)[C@H]4C5)ccc21 844356374 HNVOPGWOORVQIQ-NOUYOMCBSA-N 339.439 1.600 10 10 EDCE O=C(NCC[C@H]1CCNC1)NCc1ccc(N2CCC(O)CC2)cc1 851663545 BTDMVOYAMKHYQY-MRXNPFEDSA-N 346.475 1.447 10 10 EDCE COCc1nc(C(=O)NCc2ccc(N3CC=CC3)cc2)n(C)n1 853801843 KWTKMONXASBNHM-UHFFFAOYSA-N 327.388 1.268 10 10 EDCE Cc1cc(O)c(CNC[C@]23COCCN2C(=O)COC3)c(Cl)c1 865796663 ZFBANINVGOCYSP-MRXNPFEDSA-N 340.807 1.071 10 10 EDCE CCOc1ccc(CN2CCC[C@H](CS(=O)(=O)NC)C2)c(O)c1 862552388 XMFLHRVZCRZHHD-ZDUSSCGKSA-N 342.461 1.552 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2 867735718 KUDQDKSDARVMPK-OIISXLGYSA-N 345.443 1.083 10 10 EDCE CCN1CC[C@H](N(CC)C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1119022451 CHTCBCUXMWYNRJ-AWEZNQCLSA-N 331.416 1.177 10 10 EDCE CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](CO)[C@H]2CO)c1O 879362389 DJCNIIQMJCTHFQ-XHDPSFHLSA-N 327.808 1.813 10 10 EDCE COc1ccc(O)c(CNC[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@H]6[C@@H](C[C@H]53)[C@@H]2[C@@H]64)c1 787304092 QFZCINWSMOPFEG-NDEYGXKGSA-N 327.424 1.999 10 10 EDCE Fc1cc(CN2CCCn3nncc3C2)ccc1N1CCOCC1 895756776 KOPHOTUWVUBSLH-UHFFFAOYSA-N 331.395 1.660 10 10 EDCE CN(Cc1ccccc1O)c1nnc(C2CC2)n1C[C@H]1CCC(=O)N1 1314753544 QUIWYASKUJGNDY-CQSZACIVSA-N 341.415 1.776 10 10 EDCE CCN(CCNC[C@@H](C)OC)C(=O)c1ccc(N=NC(N)=O)cc1 1320928971 KJJWOESCNNNHKH-GFCCVEGCSA-N 335.408 1.936 10 10 EDCE O=C(CCc1nnc(C(F)F)o1)NCCc1ccc(O)c(O)c1 1294913133 MGTUJROPXSXNCF-UHFFFAOYSA-N 327.287 1.710 10 10 EDCE Cc1cc(Cn2nnc(C(=O)NCc3ccc(O)cc3O)c2C)on1 1299573546 KWOQAWZYDILENG-UHFFFAOYSA-N 343.343 1.272 10 10 EDCE O=C(CCN1C(=O)CSC1=S)Nc1cccc([N+](=O)[O-])c1 1865767711 BWYCWONGBZMMTF-UHFFFAOYSA-N 325.371 1.784 10 10 EDCE COCCNc1nc(CC(=O)NCc2ccc(O)c(O)c2)cs1 1465954233 NUEOJMCUFQMQLD-UHFFFAOYSA-N 337.401 1.472 10 10 EDCE COc1ccc([C@H](CO)CNC(=O)Cc2ccc(O)c(O)c2)cc1 1468845926 AQUVGVOQOJSLMC-AWEZNQCLSA-N 331.368 1.541 10 10 EDCE C[C@H](O)CCCN(C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1713479454 VJAQTUKYUQJUCB-LBPRGKRZSA-N 335.408 1.672 10 10 EDCE CN(C)C(=O)[C@H]1CSCN1C(=O)c1ccc(N=NC(N)=O)cc1 1626241503 SKQRAVYWWGGBLQ-LLVKDONJSA-N 335.389 1.452 10 10 EDCE C[C@@H](CN(C)C(=O)C1CC1)NC(=O)c1ccc(N=NC(N)=O)cc1 1718519119 DVBLNFLYGPYHNC-JTQLQIEISA-N 331.376 1.836 10 10 EDCE O=C(CCN1C(=O)COc2ccccc21)NCc1c(O)cccc1O 1645361119 XEZBSCLQYJZZEP-UHFFFAOYSA-N 342.351 1.530 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@@H]2COCCO2)cc1C 1698819331 XBXOPRSRERJRHV-PBHICJAKSA-N 336.432 1.356 10 10 EDCE COCCN1[C@H](C)CN(Cc2cc(OC)c(OC)cc2O)C[C@H]1C 160476990 XXCVMDSOSBPAKI-ZIAGYGMSSA-N 338.448 1.950 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CCC4(COC4)C3)c(Br)cc21 1915845452 OECSOYNWRBCBHK-GFCCVEGCSA-N 338.205 1.628 10 10 EDCE COc1cccc(O)c1CN[C@@H]1COC[C@@H]1NC(=O)OC(C)(C)C 1905904512 XHQZUDIQMFIONY-OLZOCXBDSA-N 338.404 1.783 10 10 EDCE Nc1ccc(CC(=O)N[C@@H](COCc2ccccc2)C(=O)O)cc1 1946580154 UBZDVTWTCBKBTQ-INIZCTEOSA-N 328.368 1.598 10 10 EDCE Cn1cc([C@@H](NC(=O)OC(C)(C)C)[C@@H](N)c2ccccc2O)nn1 2001804802 TZJWRVUGSVXHBY-UONOGXRCSA-N 333.392 1.787 10 10 EDCE CC(C)(C)OC(=O)NC(C)(C)[C@H](O)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2010405600 JNSWKSVBEANJED-WDEREUQCSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H](CO)C(=O)N1CCC(CN=[N+]=[N-])CC1 2014508131 AIRJKAUITWUGAK-LBPRGKRZSA-N 341.412 1.669 10 10 EDCE CNC(=O)CN(Cc1ccccc1)[C@H](C)C(=O)Nc1ccc(N)cc1 2034782215 JOMZFYAYCNZPFQ-CQSZACIVSA-N 340.427 1.844 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@H](CO)C2)cc1Br 316975200 IWVZPVCHRVIDER-ISTVAULSSA-N 329.238 1.519 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@@H](O)c2c(Br)cnn2C)cc1 2163131739 UPPQIDQKKAFHOA-TZMCWYRMSA-N 339.237 1.982 10 10 EDCE Cn1cc(Br)c(CNC(=O)c2ccc(O)c(O)c2)n1 393658151 BDXAEWCDDUVDGN-UHFFFAOYSA-N 326.150 1.524 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@@H](C(CO)CO)C2)cc1Br 2170673712 KTVMOOVXPCOBDT-WDEREUQCSA-N 343.265 1.896 10 10 EDCE CN(C[C@@H]1CCN1C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2186456658 DKHZEPFYENFAMO-ISVAXAHUSA-N 339.237 1.541 10 10 EDCE Oc1cc(Br)ccc1CNC[C@@H]1CO[C@H]2COC[C@@H]12 2101846495 IQKATOWNLYJHJI-OSMZGAPFSA-N 328.206 1.906 10 10 EDCE NCc1ccc(N2CCO[C@H]3COCC[C@H]32)cc1Br 2087489318 ZQOIEHAYYMOXLH-KGLIPLIRSA-N 327.222 1.902 10 10 EDCE CN(CCn1cncn1)c1cc(Br)c(CN)cc1F 2113774857 OHZVVEZFEYBMRL-UHFFFAOYSA-N 328.189 1.775 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H]3[C@@H]4CO)c(Br)cc21 2203132137 REIXOHBKYWUFLF-HGAATKPUSA-N 338.205 1.218 10 10 EDCE CSc1ncc(CNCC2CCN(S(C)(=O)=O)CC2)s1 2208615709 DAYKADWVWSNGJB-UHFFFAOYSA-N 335.520 1.626 10 10 EDCE NCc1cc(F)c(N2C[C@H]3COC[C@]3(CO)C2)cc1Br 2234557518 BPMMKXGNUOJMSR-IINYFYTJSA-N 345.212 1.492 10 10 EDCE O=C(O)[C@@H]1CC[C@@H](O)CN1Cc1cc(Br)ccc1O 2264533751 QPPUZNAOANZJPO-MNOVXSKESA-N 330.178 1.565 10 10 EDCE COC(=O)CN1C(=O)NC(=Cc2ccc(N3CCCC3)cc2F)C1=O 2294371416 UKKNVVIRIKNKAL-UHFFFAOYSA-N 347.346 1.492 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)/C=C\c2cncc(O)c2)c2ccccc2O1 492521747 RBPINBAYEJCQPY-WLMCBFPDSA-N 340.335 1.768 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2C[C@H](O)Cc3ccccc32)c1 493237950 JQFNWQKLCPEDSW-MWWKQMNYSA-N 337.379 1.405 10 10 EDCE Nc1ncncc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 185427868 BELARBSOZWBYRC-UHFFFAOYSA-N 345.378 1.089 10 10 EDCE Cc1cccn(CC(=O)NCc2ccc3c(c2)CCCN3C)c1=O 180104289 FLYYPPNZXYKYLZ-UHFFFAOYSA-N 325.412 1.856 10 10 EDCE C[C@@H](CN1CCOCC1)C(=O)NCc1ccc(N2CCCC2)cc1 273082870 MRBSYIZFFCMBJD-INIZCTEOSA-N 331.460 1.871 10 10 EDCE COC(=O)[C@H]1C[C@H](O)CN1Cc1ccc(C)c(Br)c1O 2380674210 UIXOOYVQEOARKY-WDEREUQCSA-N 344.205 1.571 10 10 EDCE Cc1ccc(CN(C)C(=O)c2cc(=N)[nH][nH]2)c(O)c1Br 2380746697 PXXJBZKZYKTNNX-UHFFFAOYSA-N 339.193 1.871 10 10 EDCE Cc1ccc(CN2C[C@H](O)C[C@H]2CN(C)C)c(O)c1Br 2380813365 FXXKLYLCGBVMRS-QWHCGFSZSA-N 343.265 1.960 10 10 EDCE CC(=O)C(=O)COC(=O)c1cn(-c2nc(C)cc(C)n2)nc1C(C)C 808521767 CVBIAYOOUGLNFK-UHFFFAOYSA-N 344.371 1.717 10 10 EDCE OC[C@]1([C@H](NCc2ccc(N3CCOCC3)cc2)C2CC2)CCCO1 816667052 BBGATKICBQLSKS-UXHICEINSA-N 346.471 1.933 10 10 EDCE COC[C@H]1CCN1C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 823733859 ULHMSLMFYFZOIR-GDBMZVCRSA-N 333.432 1.952 10 10 EDCE CC[C@H](NC[C@@]1(OC)CCS(=O)(=O)C1)c1ccc(F)cc1O 903363677 QPQJWLXYPAPMKA-ZFWWWQNUSA-N 331.409 1.776 10 10 EDCE CCN(CC)c1ccc(CNC(=O)c2cc(C(=O)O)nn2C)cc1 901934644 PLXVAENKTZGXDP-UHFFFAOYSA-N 330.388 1.895 10 10 EDCE CNS(=O)(=O)[C@@H]1CCCN(C/C=C/c2ccc(N(C)C)cc2)C1 835028132 JSGZCLLLFJDTLB-UKINESCASA-N 337.489 1.779 10 10 EDCE C[C@H]1CN(C)C[C@@H]1NCc1cc(F)c(N2CCOCC2)c(F)c1 839146874 YPEPNWDWLUPAES-LRDDRELGSA-N 325.403 1.841 10 10 EDCE COc1ccc(N2CCN(CCCNCc3cn[nH]c3)CC2)cc1 749917448 ZDLBCLBLKITJSN-UHFFFAOYSA-N 329.448 1.720 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)NCCc2nc(C)no2)cc1 844942915 IQLAEIMWCSJGRT-UHFFFAOYSA-N 347.419 1.707 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)N3CCCCC3)C2)cc1 849415938 ILZFNVJQEAYJAL-CQSZACIVSA-N 339.461 1.594 10 10 EDCE O=C1CN(Cc2ccccc2O)C(=O)N1C[C@H]1CN(C2CC2)C(=O)O1 846793181 XSURBUGHNHBLID-CYBMUJFWSA-N 345.355 1.140 10 10 EDCE CNC(=O)c1ccc(N(C)CCN(C)c2ccc(OC)cc2)nn1 845671720 DLLMYUMHKJIKFB-UHFFFAOYSA-N 329.404 1.417 10 10 EDCE COC(OC)[C@@H](C)NC(=O)NCc1cccc(Br)c1O 923659496 VBCFFOIKKOGEQZ-MRVPVSSYSA-N 347.209 1.961 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N(C)C[C@H]3COCCO3)C2)cc1 852450460 MQRZYFSBSSLUFQ-YOEHRIQHSA-N 349.431 1.331 10 10 EDCE O=C(NCc1c(O)cccc1F)c1cc(N2CCOCC2)ncn1 928711732 OTXAUSKAQHRVSL-UHFFFAOYSA-N 332.335 1.088 10 10 EDCE C[C@@H]1CN(C)C[C@H]1NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 756103992 XRUFCIJKCVOCDI-QGPMSJSTSA-N 330.476 1.428 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)Cc3cnnn3C)C2)cc1 854981676 YPDCUODNECSSCB-CYBMUJFWSA-N 329.404 1.009 10 10 EDCE COC(=O)[C@H](NCc1ccc(N2CCOCC2)cc1)C1CCOCC1 931692792 ZFZAVDHKTJXMHV-GOSISDBHSA-N 348.443 1.581 10 10 EDCE CN(Cc1ccccc1O)C(=O)c1ccnc(N2CCOCC2)n1 860049005 NPVUVOWUSSVFHW-UHFFFAOYSA-N 328.372 1.291 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(Cc2c(O)cccc2Cl)C1 862551604 OSGKNIHNHSNWTG-NSHDSACASA-N 332.853 1.807 10 10 EDCE COC(=O)[C@H](NCc1cc(F)c(N(C)C)cc1F)c1ccnn1C 862400038 KZZSDJHBAAIJQD-OAHLLOKOSA-N 338.358 1.768 10 10 EDCE C[C@@](O)(C[C@@H](O)CNCc1ccc(N2CCOCC2)cc1)C1CC1 872200090 SXLWZWPAJZKZDF-RTBURBONSA-N 334.460 1.525 10 10 EDCE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(C)c1O 775739221 NBQVODSSTPYQNY-TUVASFSCSA-N 333.384 1.626 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@H](O)CC(F)(F)C1 786777865 OOIWYQHOGHXECW-OAHLLOKOSA-N 337.370 1.974 10 10 EDCE COc1cc(Cl)cc(CN2CC(C3CS(=O)(=O)C3)C2)c1O 895429346 YPKCWEQFYYZKLN-UHFFFAOYSA-N 331.821 1.531 10 10 EDCE CN(C)CCN1CCN(Cc2cc(Br)ccc2O)CC1 133872567 OIQPPQHVLLKDGS-UHFFFAOYSA-N 342.281 1.834 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@H]1CSC(c2ccccc2O)=N1 1304053429 KTTNJDVEWKCFFS-GFCCVEGCSA-N 344.392 1.982 10 10 EDCE CCN(C[C@@H](C)O)c1cc2c(cc1Br)[C@H](NC)C(=O)N2 691437294 WYVNUCNNVKNWIT-OQPBUACISA-N 342.237 1.869 10 10 EDCE CN(Cc1cc(Br)cc(F)c1O)[C@H]1COC[C@H]1C(=O)O 715772060 YAFZDYDUEKGLOY-KOLCDFICSA-N 348.168 1.825 10 10 EDCE CC[C@H](C)CNC[C@H](O)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1278838193 HECGRCJSLSJRJB-WFASDCNBSA-N 349.435 1.918 10 10 EDCE CN(C)c1cnn(C2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)c1 1450272055 DYHVVJDWGUNXIY-UHFFFAOYSA-N 344.415 1.767 10 10 EDCE CCCCNC(=O)C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1464991220 UWNMVGDQYZSTFX-UHFFFAOYSA-N 334.416 1.795 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@]2(C(=O)C(=O)C[C@H]3C[C@H](N)C3)C[C@@H]2C1 1910248903 ZZPOLBNJNYPWIV-TVUHYWCHSA-N 336.432 1.899 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@H]2COCCO2)cc1C 1482084966 XBYVOIOBTLJYRM-SUMWQHHRSA-N 336.432 1.261 10 10 EDCE CN(CCNCc1nccn1C)C(=O)c1ccc(N=NC(N)=O)cc1 1481321854 HCQUYDPOVJMGOU-UHFFFAOYSA-N 343.391 1.444 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)CN1CCN(C)CC1 1627135260 ULZOAFODYSVKAH-ZDUSSCGKSA-N 346.435 1.462 10 10 EDCE Cc1cc(CN2CCC(O)(c3ncnn3C)CC2)ccc1N(C)C 1644370079 HJDFUUYBIKLYGL-UHFFFAOYSA-N 329.448 1.673 10 10 EDCE CCC(=O)N[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1744231096 XLYFGFPBZABGAS-ZDUSSCGKSA-N 331.376 1.884 10 10 EDCE O=C(CNC(=O)c1cc(Cl)ccn1)NCc1c(O)cccc1F 1651240140 RWLZEVSZKZTGIJ-UHFFFAOYSA-N 337.738 1.626 10 10 EDCE COCC(=O)N(C)[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1678218949 KRQVSAZEUMFOAT-JTQLQIEISA-N 335.364 1.072 10 10 EDCE C[C@H](NCc1c(O)cccc1Br)C1CS(=O)(=O)C1 1966009617 GITCHSNBEWTPRY-QMMMGPOBSA-N 334.235 1.677 10 10 EDCE C[C@@H]1CN(C2CCN(Cc3cc4c(cc3O)OCO4)CC2)CCO1 152004040 AAZIMIUKDHQOBW-CYBMUJFWSA-N 334.416 1.806 10 10 EDCE CCn1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1=O 1861867493 JISDTKDIEPDMKZ-UHFFFAOYSA-N 341.411 1.839 10 10 EDCE CN(c1ccc(CN)c(Br)c1)[C@@H]1CCS(=O)(=O)C1 228148721 PHTUXTVCXQVHAR-LLVKDONJSA-N 333.251 1.531 10 10 EDCE NCc1ccc(N2CC[C@]3(C[C@@H](O)CO3)C2)cc1Br 2137138900 UNBGOJXXVTZSNL-OCCSQVGLSA-N 327.222 1.638 10 10 EDCE COc1cccc(CN[C@H](CO)CNC(=O)OC(C)(C)C)c1O 1985776699 ASDLJAHGMLCNLP-LBPRGKRZSA-N 326.393 1.376 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@@H]1COC[C@@H]1NC(=O)OC(C)(C)C 1987648281 YYGUIPCNPQBCPX-MNOVXSKESA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)NC[C@@]1(CO)COCCN1CCCCN=[N+]=[N-] 2006171257 PSVWKRSINFJJNA-OAHLLOKOSA-N 343.428 1.665 10 10 EDCE CC(C)(C)OC(=O)N1CCC(C(=O)O)(C(=O)NCCN=[N+]=[N-])CC1 2010403981 MWDREOSBCGPSRZ-UHFFFAOYSA-N 341.368 1.515 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NCCN=[N+]=[N-])[C@H]1OC 2025208065 PYUZVWFGFDSKKR-MXWKQRLJSA-N 343.384 1.062 10 10 EDCE NCc1cc(F)c(N2CCC[C@H](NC(N)=O)C2)cc1Br 702151442 URVGBSLEUQXCQX-VIFPVBQESA-N 345.216 1.684 10 10 EDCE O=C(O)C[C@@H]1CN(Cc2cc(Br)cc(F)c2O)C[C@H]1O 2174357051 ZCAGSMWNMJVEGN-RDDDGLTNSA-N 348.168 1.561 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4CCO[C@H]4C3)c(Br)cc21 2172045187 PGCMTGDVCLPVOF-PAWXDDDFSA-N 338.205 1.626 10 10 EDCE CCn1nnc(CN(C)c2ccc(CNC)c(Br)c2)n1 2197857722 GVRKTLOFUBGXBY-UHFFFAOYSA-N 339.241 1.811 10 10 EDCE O=C(O)CO[C@H]1CCN(Cc2cc(Br)ccc2O)C1 2096817940 GWKYWVQWRCLEJU-NSHDSACASA-N 330.178 1.830 10 10 EDCE C[C@H](COc1nnc(=N)[nH]n1)[C@H]1CCCCN1C(=O)OC(C)(C)C 2213789473 ITCBACPJYGEYGL-GHMZBOCLSA-N 338.412 1.484 10 10 EDCE O=C(NCCc1conc1Br)c1cccc(O)c1O 2230541733 UARLKXHWZQKWPF-UHFFFAOYSA-N 327.134 1.821 10 10 EDCE NCc1cc(F)c(N2CC(N3CCOC3=O)C2)cc1Br 2235667866 XOYGDMWYPSNMGD-UHFFFAOYSA-N 344.184 1.688 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCC[C@@H]2C(N)=O)c1O 2236054472 IOFNPZQZGJXYCD-GZMMTYOYSA-N 343.221 1.907 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N[C@H]1CCN(CC(F)(F)F)C1=O 2307987263 OCJXBYOKPLSUHA-JTQLQIEISA-N 344.289 1.390 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NOC[C@H]1CCOC1 2311286502 SDOHPFOBZGWAJM-INIZCTEOSA-N 332.400 1.621 10 10 EDCE CNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCN1c1ccc(N)cc1 2320236362 XRNGOTQOFRTBJT-HNNXBMFYSA-N 348.447 1.831 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)c(Br)c1 2336470993 NNANWOXQXLYXCX-JQEORGNBSA-N 345.262 1.702 10 10 EDCE Cc1ccc(CN(C)C(=O)N2CC(N)C2)c(O)c1Br 2352647373 CKYKZLGZVSLUNE-UHFFFAOYSA-N 328.210 1.658 10 10 EDCE Cc1ccc(CNC[C@H]2CN(C)CCO2)c(O)c1Br 2352692385 LRFZTDWZPDMQMM-LBPRGKRZSA-N 329.238 1.883 10 10 EDCE Cc1ccsc1/C=C1/SC(N2CCN(CCO)CC2)=NC1=O 20289630 GOUFKQZTZLYDNZ-JLHYYAGUSA-N 337.470 1.637 10 10 EDCE O=C1Nc2cc(N3CCOC[C@H](F)C3)c(Br)cc2[C@@H]1O 2361814278 FQXGJJYELLICBP-KRTXAFLBSA-N 345.168 1.609 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)cc1Br 2357586329 XIFMLNQOXXTTIK-PTPDJHTLSA-N 342.233 1.823 10 10 EDCE O=C1N=C(N2CCOCC2)S/C1=C\c1ccc(N2CCOCC2)o1 38704486 CVCVFKJFGITWJB-QBFSEMIESA-N 349.412 1.419 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCCNC(=O)[C@H]2C)cc1 191255824 RFDKQFCGCPJGOP-CQSZACIVSA-N 332.448 1.953 10 10 EDCE O=C(CCN1CCCC1=O)NCc1cc(Br)ccc1O 804735149 MYMOGRDCQDQRAC-UHFFFAOYSA-N 341.205 1.783 10 10 EDCE COc1nn(C)c2nc(C)c(CCC(=O)OCC(=O)C(C)=O)c(C)c12 808502063 WEMMXQMNZFJKOW-UHFFFAOYSA-N 347.371 1.228 10 10 EDCE COC[C@@H]1CCN(C(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 800890301 DTZCVASRFAOIHJ-OAHLLOKOSA-N 333.432 1.906 10 10 EDCE COc1ccc(CNS(=O)(=O)CCOCC2CCC2)c(O)c1 827540001 WUVJYWAMTRNWTA-UHFFFAOYSA-N 329.418 1.637 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN(CCO)C[C@H]2C)c1 825337198 DUADVXVGPMQCQW-GFCCVEGCSA-N 343.265 1.962 10 10 EDCE Cn1nccc1[C@H]1NC(=O)N(Cc2ccc(N3CCCC3)cc2)C1=O 843307507 QOZJLEANZDCFEU-MRXNPFEDSA-N 339.399 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O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(c2cccnn2)CC1 588406206 MOAINZJZRQZITO-XQRVVYSFSA-N 326.356 1.250 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@@H]4[C@H](C(=O)O)[C@@H]4C3)cc2)CC1 902554133 PGNHSLGTPGEPFC-KSZLIROESA-N 329.444 1.591 10 10 EDCE COCCN1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 900684043 HUZVYDZQRFQJGH-UHFFFAOYSA-N 336.413 1.717 10 10 EDCE CC(C)(C)OCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 746890262 KBMLZZCRBZHVTM-UHFFFAOYSA-N 330.406 1.309 10 10 EDCE CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CNC1 843385158 BBAYLSTZEFHSDA-UHFFFAOYSA-N 349.390 1.304 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCC(CO)(C(F)(F)F)CC2)cc1 927924249 SWYUSVVPOCVAOO-UHFFFAOYSA-N 345.321 1.371 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[C@H]1CCCOC1 859275742 ATJOACZTGRZEQA-MRXNPFEDSA-N 347.459 1.644 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@](C)(O)C(C)C)C2)cc1 854301838 UWRMYBGSJUODKZ-KDOFPFPSSA-N 335.448 1.980 10 10 EDCE CC(C)Cn1cnc(S(=O)(=O)NCc2c(O)cccc2F)c1 921452109 DMXHSMAWCYZPKI-UHFFFAOYSA-N 327.381 1.862 10 10 EDCE COC(=O)CCNC(=O)CCN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 858541068 GFAPMCCJPHOKRJ-JQWIXIFHSA-N 338.379 1.739 10 10 EDCE COCCn1cc(CN[C@@H]2CCN(c3ccc(OC)cc3)C2)cn1 850347830 YMHBSIMRWIJHFZ-MRXNPFEDSA-N 330.432 1.907 10 10 EDCE Cn1cc(N2C[C@H](C(=O)N3Cc4cccc(O)c4C3)CC2=O)cn1 871207320 NAXHQNHJEJLHCZ-GFCCVEGCSA-N 326.356 1.021 10 10 EDCE C[C@@H]1CC[C@H](C(N)=O)CN1Cc1ccc(N2CCN(C)CC2)cc1 775648851 GRBJSWKBZKLUHE-WBVHZDCISA-N 330.476 1.524 10 10 EDCE CO[C@H]1CC[C@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 870714838 ANASXUAEAZHGLC-JQWIXIFHSA-N 342.417 1.403 10 10 EDCE CN1CCN(c2ccc(CN3CC[C@](O)(C(F)(F)F)C3)cc2)CC1 775714989 ACRYTKXGTJGCDE-MRXNPFEDSA-N 343.393 1.938 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCCn2nncc2C1 899334473 DEKIOWIOENKHRK-UHFFFAOYSA-N 330.369 1.950 10 10 EDCE C[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)[C@@H]1CN(C)CCO1 897077988 RERMOLWXHPKUFC-RNCFNFMXSA-N 336.413 1.761 10 10 EDCE COC(=O)[C@@]1(CNCc2cc(Cl)ccc2O)C[C@@H]1S(C)(=O)=O 895509111 PNYHQLRZTATKGK-GXTWGEPZSA-N 347.820 1.112 10 10 EDCE COC(=O)[C@@H](NCc1cc2c(cc1O)OCO2)c1cccc(O)c1 792178298 BDRABKFBIPSMNS-INIZCTEOSA-N 331.324 1.830 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnn2c(=O)cc[nH]c12 1157102683 OYLLLHZKFCKZHZ-UHFFFAOYSA-N 333.344 1.144 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H]2CCN(C)C2=O)cc1C 1317402822 LWIZFTAMPQHQNI-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE CCS(=O)(=O)c1ccccc1CC(=O)NCc1cccc(O)c1O 1176576390 KCOMLBZIBLWKFN-UHFFFAOYSA-N 349.408 1.750 10 10 EDCE CCOC(=O)[C@@H](NCCN=[N+]=[N-])c1cn(C)nc1Br 712435612 SMCMHSBVROWDKR-QMMMGPOBSA-N 331.174 1.687 10 10 EDCE NCc1cc(F)c(N2CCC(CO)(CO)C2)cc1Br 694680393 FTYQXRCYHBMUFV-UHFFFAOYSA-N 333.201 1.228 10 10 EDCE CN(C)c1ccc(/C=C\CN2CCN(Cc3nc[nH]n3)CC2)cc1 1338287611 FXLKDPKWVNHSLR-ARJAWSKDSA-N 326.448 1.702 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H](C)n2cncn2)cc1C 1331426778 KJQJFYIBOJOFOK-CABCVRRESA-N 345.447 1.793 10 10 EDCE CCCNC(=O)Cn1c(CC)nnc1N(C)Cc1ccccc1O 1501208091 QHROWJWTEYCBIK-UHFFFAOYSA-N 331.420 1.709 10 10 EDCE O=C1N[C@@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CO1 1527058251 USNRQDSNENVMKH-CQSZACIVSA-N 336.303 1.509 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NCCOc1ccc2c(c1)OCO2 1290960435 BBOISNRZQLWAHX-UHFFFAOYSA-N 331.324 1.564 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)c3ncccn3)cc2)CC1 1537839394 KXWOYVUSJVVCKZ-UHFFFAOYSA-N 339.399 1.108 10 10 EDCE O=C(NCc1cccc(O)c1O)c1ccc(N2CCOC2=O)cc1 1471644166 OBMNCEDYUNQZKU-UHFFFAOYSA-N 328.324 1.984 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(C(N)=O)s1 1556516074 YTBMDSZLWSNZLD-UHFFFAOYSA-N 325.386 1.968 10 10 EDCE CCC(=O)N[C@@H](C)CCNCc1nnnn1-c1ccc(OC)cc1 1482800591 BSQWKVSUKNOKOJ-LBPRGKRZSA-N 332.408 1.065 10 10 EDCE CN(CCCO)C[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1494178452 KBRIKHFTKIZSEL-ZDUSSCGKSA-N 347.419 1.625 10 10 EDCE CC[C@H](C)C(=O)NC[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1684190248 GIHTWOWDHAGMQA-SGMGOOAPSA-N 349.431 1.770 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC4(CCOC4)C3)c(Br)cc21 1915831404 HJAUONBYWRKCEM-GFCCVEGCSA-N 338.205 1.628 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)CC[C@@H]1O 229388213 ZDJJWGCNNXJVNX-HYJLZEBJSA-N 340.221 1.608 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1cc2c(cc1N)OCCO2 1946864123 WGWYJZGWNWIJLW-UHFFFAOYSA-N 327.384 1.793 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1CNC(=O)C1 1951702649 ZWQLTRJJWWOLAG-NWDGAFQWSA-N 336.388 1.670 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)O1 1985099162 IKDLDXURCZWXCN-QWRGUYRKSA-N 327.385 1.827 10 10 EDCE COC[C@](C)(CC(=O)N1CC(N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1985102695 KRTUJZZMYDHABT-AWEZNQCLSA-N 327.385 1.827 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@H]1COC[C@@H]1NC(=O)OC(C)(C)C 1987648282 YYGUIPCNPQBCPX-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@H](CO)C3)c(Br)cc21 162028374 JEBHLMKFYQNXHH-JVXZTZIISA-N 326.194 1.220 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1(F)F 2003170369 QCRGKAUPNAKSGY-GMOBBJLQSA-N 346.374 1.658 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1ccnnc1 2022929008 HWAHCSXZIGCELJ-OLZOCXBDSA-N 334.376 1.024 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C)[C@@H](CO)C2)c(Br)c1 687618232 HBTOMSITVWVGRR-ZYHUDNBSSA-N 328.254 1.582 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NCc1cccc(O)c1O 382730239 AEJSHJLEPIIDTH-OCCSQVGLSA-N 338.404 1.822 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N3C[C@H](O)[C@H]3C)c(Br)cc21 2182523004 JMUPSLVPABZBNA-RDZIJCNDSA-N 340.221 1.621 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)O1 1906905195 UYEJRORNPJVIRV-ZJQBRPOHSA-N 340.420 1.324 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCO[C@H]2CCNC[C@H]21 2185534429 UVEDHHUMJXNIBU-OLZOCXBDSA-N 345.212 1.857 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H](CO)C[C@@H]2CO)c(Br)c1 2089863108 HCSGPJONNQDXIF-JFGNBEQYSA-N 330.222 1.682 10 10 EDCE COC[C@@H]1[C@H](O)[C@@H](O)CN1c1ccc([C@@H](C)O)cc1Br 2233867574 ZSKXPSZEDBDLNX-NGSVMEPUSA-N 346.221 1.059 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2C[C@@H](O)CCO2)c1O 2236056820 XSHBUOBMAOPQCP-VHSXEESVSA-N 346.221 1.793 10 10 EDCE Cn1nc(Br)c(C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)n1 2226978109 ICEWMGOOXXFCDM-ZETCQYMHSA-N 328.174 1.883 10 10 EDCE CC(=O)C(=O)[C@@]1(O)[C@H]2CCC[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C2 2244178335 XHEJEFJABZUXHY-FQAFMMTASA-N 325.405 1.979 10 10 EDCE CN1C(=O)C(=CC=Cc2ccc(N(C)C)cc2)C(=O)N(C)C1=S 2294196289 LHXNFDGSZVTQAW-UHFFFAOYSA-N 329.425 1.908 10 10 EDCE N[C@H]1CCCC[C@H]1NC=C1C(=O)NC(=S)N(c2ccccc2)C1=O 2296116217 VMNVYGXDZFTPSS-UONOGXRCSA-N 344.440 1.178 10 10 EDCE CC[C@H](C)N1C(=O)C(=CNc2cccc(C(=O)O)c2)C(=O)NC1=S 2296937139 WLIXYTUYCDWULI-VIFPVBQESA-N 347.396 1.722 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)[C@@]1(CO)CCN(C(=O)OC(C)(C)C)C1 2300530640 UHLAPIPLBVRQQK-HNNXBMFYSA-N 341.412 1.765 10 10 EDCE O=C(N[C@@H](CCO)COCc1ccccc1)c1cccc(O)c1O 2303617118 FNJWWWLVNCDEPS-AWEZNQCLSA-N 331.368 1.795 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)[C@@H]3O)c(Br)c1 2357053466 WBKOJJOQHYHSTD-RMROANFSSA-N 342.233 1.965 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H](Cn2cncn2)C1 181107737 NBSLKHBQESKUOU-YVARQFDVSA-N 328.372 1.641 10 10 EDCE CC[C@@H](C)NCc1ccc(N2C[C@@H](O)[C@H](O)C2)c(Br)c1 2358920831 VDMUGIQOADDXMF-VCTAVGKDSA-N 343.265 1.879 10 10 EDCE COc1cccc(CNC(=O)N[C@H](C)c2nnc3n2CCCC3)c1O 121441771 OXTUCMXDTDMGJA-LLVKDONJSA-N 345.403 1.889 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCC(c3ccn[nH]3)CC2)cc1 195505819 BFTOJHLDIODGNM-UHFFFAOYSA-N 341.459 1.972 10 10 EDCE CC1(C)CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCS1(=O)=O 272369878 DDOARLVURAYGDL-GQCTYLIASA-N 325.386 1.147 10 10 EDCE CC(=O)C(=O)COC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 808545167 QZFTXJQXEQBWEY-UHFFFAOYSA-N 332.268 1.223 10 10 EDCE CC1(C)NC(=O)CC[C@@H]1NCc1ccc(N2CCOCC2)c(F)c1 801735154 MUWIEFWLFYJTHA-INIZCTEOSA-N 335.423 1.809 10 10 EDCE COc1ccc(N2CCN(CCCNC[C@@H](O)C3CC3)CC2)cc1 818943439 TZWHHIRTTHMRJT-LJQANCHMSA-N 333.476 1.568 10 10 EDCE CC[C@@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 817637804 BZCSNVNUNATSOR-CMPLNLGQSA-N 342.417 1.451 10 10 EDCE N[C@@H]1CC[C@@H]2CN(C(=O)/C=C\c3ccc(N4CCOCC4)cc3)C[C@@H]21 588450519 PLOPMPNXOXYWJD-ATGFEADCSA-N 341.455 1.732 10 10 EDCE CCOCCOCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 735520181 XPTBYDKDAXSXTG-INIZCTEOSA-N 337.416 1.953 10 10 EDCE C[C@H]1CC2(CCOCC2)CN1Cc1cc(O)n2ncc(C(=O)O)c2n1 846259912 CAMBWUXDMDXBKY-NSHDSACASA-N 346.387 1.524 10 10 EDCE Cn1cc(NC(=O)C(=O)NCc2cc(Cl)ccc2O)c(C2CC2)n1 846122100 RMWJUCXFCPHIGP-UHFFFAOYSA-N 348.790 1.911 10 10 EDCE COC(=O)c1cn(CN(Cc2ccc(N(C)C)cc2)C(C)C)nn1 920757937 KFLXDZXHBPIFIA-UHFFFAOYSA-N 331.420 1.999 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3c(O)nnc(C)c3C)C2)cc1 855231825 MMNRLGKDNLBJHR-CYBMUJFWSA-N 342.399 1.816 10 10 EDCE COC[C@@H](CCNCc1ccc(N2CCOCC2)c(F)c1)OC 850345606 FYCFPPJTVXXJHP-OAHLLOKOSA-N 326.412 1.803 10 10 EDCE C[C@H]1CCN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 920043368 HCPCPGWDQGQYKI-ZFWWWQNUSA-N 330.432 1.692 10 10 EDCE NC(=O)[C@H]1CCCN(c2ccc(CN[C@@H]3CCNC34CCC4)cc2)C1 925484972 JNZQWVNRXZEGPW-FUHWJXTLSA-N 342.487 1.763 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC[C@]3(C)CCC(=O)N3)C2)cc1 852379503 RHRXNGMBJXTTKW-UGSOOPFHSA-N 346.431 1.242 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C[C@H]1C 867504452 VUWGQHPXFJRNLB-NOXHYTERSA-N 334.416 1.896 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](CC(C)C)N(C)C(=O)OC(C)(C)C 885020849 PPJMMPUKZQMLRH-LBPRGKRZSA-N 329.393 1.969 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CC[C@H](C(N)=O)C2)cc1 892378927 WVBLPZTUIUACJY-UONOGXRCSA-N 333.432 1.491 10 10 EDCE COC(=O)[C@H](C[C@@H]1CCCO1)NCc1cc(OC)c(OC)cc1O 895865594 TTZYFCFKNSFWBY-STQMWFEESA-N 339.388 1.610 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@]3(OC)CCSC3)C2)cc1 892686081 YHMSJBSZKBXKEN-GUYCJALGSA-N 336.457 1.912 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CC(=O)N(c2ccccc2F)C1 1153879644 SPIHVSPMSQDZGL-GFCCVEGCSA-N 344.342 1.906 10 10 EDCE COC(=O)c1ccccc1N/C=C1/C(=O)NC(=O)N(C(C)(C)C)C1=O 1084245752 IOFISEXSSOXQDD-LUAWRHEFSA-N 345.355 1.646 10 10 EDCE Cc1c(CC(=O)NCc2c(O)cccc2O)nnn1-c1ccccc1 1178910593 GBXQKQMUZROJQH-UHFFFAOYSA-N 338.367 1.846 10 10 EDCE C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H](C)C1O 1330333038 HRFTUCYCEKCCFR-KBPBESRZSA-N 347.459 1.186 10 10 EDCE CN1CCN(c2ccc(CNC[C@H]3C[C@@H]4COC[C@@H]4O3)cc2F)CC1 1332319436 UUVCPYVOBRDSFP-MDZRGWNJSA-N 349.450 1.471 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)N1C2CCC1(CO)CC2 1332286216 YVKYFKLQGHOUDT-UHFFFAOYSA-N 345.443 1.722 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)[C@H]2CCCN2C)cc1C 1267998999 OJYJBCRCAUYAMG-RHSMWYFYSA-N 333.476 1.940 10 10 EDCE COc1ccc(CN[C@@H](C(=O)O)[C@H]2CCCO2)cc1Cn1cccn1 1352081005 IRLUKQWZFZENEV-IAGOWNOFSA-N 345.399 1.662 10 10 EDCE COCCC(=O)N1CC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1283329409 VFLRYYFHXPJAOB-CYBMUJFWSA-N 347.375 1.216 10 10 EDCE COc1ccc(CNC(=O)c2cccc3ncnc(O)c23)c(O)c1 1626080043 UKTGJTUWTLOVOS-UHFFFAOYSA-N 325.324 1.980 10 10 EDCE Cc1cc(CC(=O)NCc2nc(O)n[nH]2)c(C)n1-c1ccccc1 1621865983 HQLKWEOKYVRXLP-UHFFFAOYSA-N 325.372 1.777 10 10 EDCE CC(C)[C@H]1CNC(=O)CN1c1ccc(CO)c(Br)c1 2124760345 YGWZOPRSZMUEKG-CYBMUJFWSA-N 327.222 1.902 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1C[C@@H](c2ccccc2)[C@](F)(CO)C1 1641673924 UYLQXDYREMTWDW-HNAYVOBHSA-N 345.370 1.967 10 10 EDCE Cc1cc(C(=O)Cn2cc(C(N)=O)nn2)c(C)n1-c1ccc(F)cn1 1641021634 DPPLXNQYHCCKQT-UHFFFAOYSA-N 342.334 1.202 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)C[C@H]2CCC(=O)N2)cc1C 1662988850 KNQGZENLBLKXOS-GDBMZVCRSA-N 347.459 1.657 10 10 EDCE COCCNC[C@@H]1CCC[C@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1699037439 VAYFZACXXIWBNG-DZGCQCFKSA-N 347.419 1.984 10 10 EDCE COc1ccc(CN[C@@H](CNC(=O)Cn2cccn2)C2CC2)cc1C 1690142567 IDPSWBWOOSLLQS-KRWDZBQOSA-N 342.443 1.885 10 10 EDCE CN(C)c1ccc([C@@H](NC(=O)[C@H]2CCCO2)c2nccn2C)cc1 169813579 BTMXCMUEPZRPKE-HZPDHXFCSA-N 328.416 1.871 10 10 EDCE C[C@H](Oc1ccc(N)cc1)C(=O)N1CCN(C(=O)c2ccco2)CC1 1860081655 BDZJLGWSWPSACO-ZDUSSCGKSA-N 343.383 1.614 10 10 EDCE C[C@H](Oc1ccc(N)cc1)C(=O)N1CCN(c2ccccn2)CC1 1860082723 SCTGBTCXIYVWHI-AWEZNQCLSA-N 326.400 1.780 10 10 EDCE O=C(N[C@@H](Cc1cc(O)c(O)c(O)c1)C(=O)O)OCc1ccccc1 1951401415 FPNBLBZVFOHOFB-LBPRGKRZSA-N 347.323 1.726 10 10 EDCE COc1ccc(Br)c(CNC[C@H](CCO)OC)c1O 1972502831 GSFYIRCYLBLUFO-VIFPVBQESA-N 334.210 1.650 10 10 EDCE CN(C(=O)OC(C)(C)C)C1(C(N)=O)CN(CCCCN=[N+]=[N-])C1 1982242750 QYHBCFGKKIWXQV-UHFFFAOYSA-N 326.401 1.484 10 10 EDCE Nc1ccc(CNS(=O)(=O)c2cncc(Br)c2)cc1 44242814 GNARDCCBTOOWGU-UHFFFAOYSA-N 342.218 1.905 10 10 EDCE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2010393518 TVIYHSYECQLZRS-IJLUTSLNSA-N 339.396 1.780 10 10 EDCE CC(C)(C)OC(=O)N1CC(C)(OCC(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010401296 CNPWKWLAEPYBQW-NSHDSACASA-N 339.396 1.924 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2010404238 PZHBOEDHHPSLKX-NSHDSACASA-N 339.396 1.829 10 10 EDCE CN(C(=O)C1=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1ccnnc1 2022929009 HWAHCSXZIGCELJ-STQMWFEESA-N 334.376 1.024 10 10 EDCE CNC(=O)CN(Cc1ccccc1)c1cc2c(cc1F)[C@H](O)C(=O)N2 2034790985 YBLMLYPXZPADKT-KRWDZBQOSA-N 343.358 1.564 10 10 EDCE C[C@H](O)c1ccc(N2CC[C@@]3(CNC(=O)N3)C2)c(Br)c1 2177669315 VBOMLNKCNMXGHL-LKFCYVNXSA-N 340.221 1.764 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NC3(C)CCC4(CC3)OCCO4)c2n1 2063288526 TZDRAAWKXYOKEK-UHFFFAOYSA-N 346.387 1.549 10 10 EDCE CNCc1ccc(N2CCN3C(=O)OC[C@@H]3C2)cc1Br 2170718013 TZTXZWIGTSBSDE-LBPRGKRZSA-N 340.221 1.809 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C1CC(CO)C1 2193580206 GNOKFZQZOWAAKR-ROKYYSGWSA-N 341.205 1.642 10 10 EDCE CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)Cc1ccc(N)cc1 2058673109 QLUHEKDBAGMHEQ-CABCVRRESA-N 349.431 1.562 10 10 EDCE Nc1ccc(NC(=O)NC[C@@H]2CNCCN2Cc2ccccc2)cc1 2084721725 KJDRXUGCGMYGSK-SFHVURJKSA-N 339.443 1.864 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@H](N(C)C)C2)cc1Br 2089926825 NJKURMXCQGZJMC-FZQKWOKYSA-N 329.238 1.614 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N3C[C@H](O)C3(C)C)c(Br)cc21 2201308109 HYQPACJJCFEYJV-NWDGAFQWSA-N 340.221 1.621 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213589365 VZYSBULYVRQLCD-UTLUCORTSA-N 340.384 1.103 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](COc1nnc(=N)[nH]n1)[C@H]1CC=CCC1 2213789463 IRNBUYKTXHJCMF-QWRGUYRKSA-N 336.396 1.308 10 10 EDCE CN(C(=O)OC(C)(C)C)C1CCC(COc2nnc(=N)[nH]n2)CC1 2213789336 HITOJQPTLOLNPQ-UHFFFAOYSA-N 338.412 1.484 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@H]([C@H](C)N)C2)c1O 2236033291 ORPKKEIIUMPPHI-ZANVPECISA-N 345.237 1.711 10 10 EDCE CC(C)(C)OC(=O)N(CC(=O)N1CC(N=[N+]=[N-])C1)[C@@H]1CCOC1 2244947932 YQAODFXHHCVTKP-LLVKDONJSA-N 325.369 1.534 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2246444084 BLWZQSBBUOFDFO-IJLUTSLNSA-N 339.396 1.658 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)CC[C@@H]1C(=O)Nc1ccc(N)cc1 2246471438 TZEBLQSQBNBINJ-UONOGXRCSA-N 335.404 1.968 10 10 EDCE COc1ccc(C=C2SC(=S)N(CCOCCO)C2=O)cc1 2323767948 QHLAICSDAHQACN-UHFFFAOYSA-N 339.438 1.905 10 10 EDCE N[C@H](COCc1ccccc1)C(=O)N1CCc2cc(O)c(O)cc2C1 2318666710 CWDIAKKJZVAUSA-MRXNPFEDSA-N 342.395 1.527 10 10 EDCE Cc1ccc(CN(C)CCS(C)(=O)=O)c(O)c1Br 2327797147 RNVFXKRIFGUECF-UHFFFAOYSA-N 336.251 1.940 10 10 EDCE CNC(=O)[C@@H]1CCCN1C(=O)NCc1ccc(N2CCCC2)cc1 179241474 BFEJAWGJBJLPQC-INIZCTEOSA-N 330.432 1.707 10 10 EDCE O=C1Nc2cc(N3C[C@H]4C[C@H]4[C@H]3CO)c(Br)cc2[C@H]1O 2357563276 JTNFPYQSLXHUMM-DANUVHOZSA-N 339.189 1.252 10 10 EDCE Nc1ccc(CC(=O)N2CCN(Cc3nccn3C(F)F)CC2)cc1 237892137 DIECKRHBOFDBMU-UHFFFAOYSA-N 349.385 1.747 10 10 EDCE CC(=O)N(C)c1ccc(N=N[C@@H]2C(=O)N(C(N)=S)N=C2C)cc1 253961287 QZKUTISYFKZPGN-LBPRGKRZSA-N 332.389 1.583 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2CC[C@@H](O)CN2)c(O)c1Br 2380753038 BNMLIMZJVGLYHZ-GHMZBOCLSA-N 343.221 1.192 10 10 EDCE CC[C@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 817637806 BZCSNVNUNATSOR-PWSUYJOCSA-N 342.417 1.451 10 10 EDCE N[C@@H](C(=O)NCc1ccc(N2CCSCC2)cc1)C(F)(F)F 827321044 SSSFWSJEAOLHSG-LBPRGKRZSA-N 333.379 1.746 10 10 EDCE COC(=O)c1cn(C2CN(C/C=C/c3ccc(N(C)C)cc3)C2)nn1 835044537 LPZSCLQXCFUVLJ-SNAWJCMRSA-N 341.415 1.701 10 10 EDCE O=C1[C@H](NCc2cc([N+](=O)[O-])ccc2O)CCN1C1CCOCC1 747621838 AURNACOBKZOQBE-CQSZACIVSA-N 335.360 1.170 10 10 EDCE C[C@H](NC(=O)N[C@H]1C[C@@H](C(N)=O)C1)c1ccc(N2CCOCC2)cc1 844925096 AKPQZUYZUCIWFB-AEGPPILISA-N 346.431 1.147 10 10 EDCE Cc1cccc(-n2c(C)cc(C(=O)N3CC(S(N)(=O)=O)C3)c2C)c1 910510989 ACNHQCQAINSRPC-UHFFFAOYSA-N 347.440 1.515 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)/C=C\Cn3cncn3)C2)cc1 912291867 FFBTZHXNUGXHFF-PYLYLYNFSA-N 327.388 1.238 10 10 EDCE CCOC(=O)c1cc(NS(=O)(=O)C[C@@H](OC)C2CC2)ccc1O 842586633 OUECRTUHRBMATL-CQSZACIVSA-N 343.401 1.736 10 10 EDCE CCN1C[C@H](C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 855230495 DPNDFXOCYWHSTF-KGLIPLIRSA-N 331.416 1.259 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCCO[C@@H]3CCOC3)C2)cc1 923185308 FFQJEBQWXXAMKT-RHSMWYFYSA-N 349.431 1.379 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3csc(CCN)n3)C2)cc1 852899991 FSIFBVMWRSQYIU-LBPRGKRZSA-N 346.456 1.662 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCC[C@H](N)C3)C2)cc1 851664083 QODDCRDMKFHQCJ-ZNMIVQPWSA-N 332.448 1.843 10 10 EDCE O=C(O)c1cc(NS(=O)(=O)C2Cc3ccccc3C2)ccc1O 776434687 JVMBTDLODRALML-UHFFFAOYSA-N 333.365 2.000 10 10 EDCE COC(=O)c1ccc2c(c1)NC(=O)CN2C(=O)/C=C\c1cccnc1 1129292287 HZYAYGXCDJYLMT-DAXSKMNVSA-N 337.335 1.867 10 10 EDCE CC1(C)[C@@H](O)C[C@]1(CO)NCc1cccc(Br)c1O 1879557869 FEMSJMFYIQLNDX-SMDDNHRTSA-N 330.222 1.766 10 10 EDCE Cn1ncnc1C1(O)CN(Cc2cc(-c3ccccc3)ccc2O)C1 895620483 GQVLOGRMRVTCDB-UHFFFAOYSA-N 336.395 1.891 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)c1cn(C(F)(F)CO)nn1 1137346737 JRZMCHUEJHSZOR-UHFFFAOYSA-N 340.330 1.578 10 10 EDCE NC(=O)N[C@@H](CC(=O)NCc1c(O)cccc1F)c1ccccc1 1156171068 WSBFIRSAHKLQNF-AWEZNQCLSA-N 331.347 1.947 10 10 EDCE C[C@@H](C(=O)NCc1cc(O)ccc1O)n1nnc(-c2ccccc2)n1 1153885902 RSGDGSCZNJUBGD-NSHDSACASA-N 339.355 1.629 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)CCN2CCOCC2)cc1C 1317274519 BRGBSEFJZZBKKT-MRXNPFEDSA-N 349.475 1.320 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\[C@@H]1CCCO1 1331970252 HXOOXMAULHEQRX-KQYOJSHESA-N 349.383 1.423 10 10 EDCE CCOC(=O)C[C@@H](O)C(=O)N(Cc1ccco1)Cc1ccccc1O 1445639536 WYLAZKNAHOCQBA-MRXNPFEDSA-N 347.367 1.828 10 10 EDCE CN1C[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)NC1=O 1625657476 QDCWSVUWVZNHIL-GFCCVEGCSA-N 336.355 1.358 10 10 EDCE CC[C@@H](C)C(=O)N[C@@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1715967327 IPCFYFXJNMQGTO-OLZOCXBDSA-N 346.435 1.311 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NCc1nncs1 1480602010 IUUQMTAJCWRJBU-VIFPVBQESA-N 347.404 1.609 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)CCn2cnnn2)cc1C 1714791744 BWAFRUVAMGRLAC-AWEZNQCLSA-N 346.435 1.017 10 10 EDCE C/C=C(/C)C(=O)NC[C@@H](CC)NC(=O)c1cc(OC)nc(OC)c1 1498994930 HPVGJBQMTUCNHY-TUOYRWMMSA-N 335.404 1.690 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cn(C)c(O)n2)cc1C 1568914072 RDQDEFGPXPGKRF-PLNGDYQASA-N 344.415 1.519 10 10 EDCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@@H]2CCN(C)C2)cc1C 1734353731 CNFTXWRMDBFBTM-NVXWUHKLSA-N 333.476 1.892 10 10 EDCE O=C(NC1CN(C(=O)OCc2ccccc2)C1)c1cccc(O)c1O 1637826653 CTWGJELAHWHSDY-UHFFFAOYSA-N 342.351 1.849 10 10 EDCE Nc1ccc(OC[C@H](O)CN(Cc2ccccc2)C2COC2)cc1 1915707307 OFSMHSKVMVZPQQ-GOSISDBHSA-N 328.412 1.910 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1CCC(=O)N1 1952208831 NQBHSHOAADZQJX-NWDGAFQWSA-N 336.388 1.812 10 10 EDCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1[C@H]2CNC[C@H]21 1952692364 QITSEUXMPMTVLC-IATRGZMQSA-N 334.416 1.999 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@H](CN=[N+]=[N-])C1 1985093744 DXAJVOHMOLYXFI-GHMZBOCLSA-N 327.385 1.421 10 10 EDCE CCO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)NCCN=[N+]=[N-] 1985095608 GUTXLJPUUIMVRI-QWRGUYRKSA-N 327.385 1.685 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCCCN=[N+]=[N-])C1COC1 1985100903 KTJGCHGWVNCFAQ-LLVKDONJSA-N 327.385 1.733 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@]1(O)CCCN(C(=O)OC(C)(C)C)C1 1986144737 RDRDGWRKWWFYRS-CQSZACIVSA-N 327.385 1.517 10 10 EDCE CC(C)(C)OC(=O)N1CCN(Cc2ccc(N)cc2)[C@@H](C(=O)O)C1 1999443024 VCUFDUABSYXWCR-CQSZACIVSA-N 335.404 1.775 10 10 EDCE O=C(O)C[C@@H](COCc1ccccc1)NC(=O)c1ccc(O)c(O)c1 2035477618 MNKUNROBWRMUJE-AWEZNQCLSA-N 345.351 1.888 10 10 EDCE C[C@@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)c(Br)c1 2190454886 WBKOJJOQHYHSTD-AISOMTMTSA-N 342.233 1.965 10 10 EDCE COCCN1CCN(c2ccc(CO)cc2Br)CC1 2098518010 ZTKRTLVMHONVKH-UHFFFAOYSA-N 329.238 1.710 10 10 EDCE COc1ccc(Br)c(CNCCc2c[nH]nc2O)c1O 2240551280 PUQPHLPBNOLOPH-UHFFFAOYSA-N 342.193 1.924 10 10 EDCE CCNCc1ccc(N2CC[C@@H]2[C@@H](O)CO)c(Br)c1 2270719160 TXAXHLMUWDIDJQ-KGLIPLIRSA-N 329.238 1.491 10 10 EDCE CCNCC(C)(C)CS(=O)(=O)NCc1cnc(SC)s1 2290076223 RMJHSONLPWSFEV-UHFFFAOYSA-N 337.536 1.920 10 10 EDCE CC(C)(C)OC(=O)N(CCO)CCC(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2303240231 IQSUFQTYBZYMQZ-NWDGAFQWSA-N 341.412 1.954 10 10 EDCE CONCCC(=O)N(C)Cc1ccc(C)c(Br)c1O 2352647791 GJZDUMHCWIJUAN-UHFFFAOYSA-N 331.210 1.963 10 10 EDCE Cc1ccc(CN2C(=O)CNC(=O)[C@@H]2C)c(O)c1Br 2352694607 WDNZNVNBDLUPAM-QMMMGPOBSA-N 327.178 1.310 10 10 EDCE CN(C)c1ccc([C@@H]2CC(c3c(O)[nH]c(=S)n(C)c3=O)=NN2)cc1 101763376 STEXCXYLCSPPKW-NSHDSACASA-N 345.428 1.653 10 10 EDCE COc1ccc(N2CCC(NC(=O)[C@H]3CCCN3C(C)=O)CC2)cc1 102382190 HCLCIRGNWQFPTO-GOSISDBHSA-N 345.443 1.791 10 10 EDCE COc1ccc(O)c(CNC(=O)CCCNC(=O)c2ccco2)c1 114542807 CXKIGVGEUBDIAK-UHFFFAOYSA-N 332.356 1.820 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCCOC1 171599555 UEXWNYZLFLMVEH-KRWDZBQOSA-N 347.459 1.874 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1ccc2c(O)ncnc2c1 1445936685 FPTAZKBULVZMQW-UHFFFAOYSA-N 325.324 1.719 10 10 EDCE NC(=O)c1coc(CNC(=O)NCCCSc2nccs2)c1 187554483 RPDQADKOKHKVNW-UHFFFAOYSA-N 340.430 1.817 10 10 EDCE CCCn1nccc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 133547398 UWLOYCNCAGTYEH-UHFFFAOYSA-N 329.404 1.614 10 10 EDCE N#Cc1c(F)cccc1S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 320585066 OZIVPJDYJAAPCK-UHFFFAOYSA-N 336.300 1.902 10 10 EDCE CN(C)c1noc([C@H]2CCCN(C(=O)c3cccc(O)c3O)C2)n1 194482969 DMFGIIBJMUYINC-JTQLQIEISA-N 332.360 1.567 10 10 EDCE Cc1[nH]c(=O)sc1S(=O)(=O)Nc1ccc(O)cc1[N+](=O)[O-] 40830664 VXJQOBVAXMPZCJ-UHFFFAOYSA-N 331.331 1.159 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1C[C@H]2CC[C@H]1O2 246913000 BOFGZGZTZOQMGM-FRFSOERESA-N 349.406 1.781 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3N)CC2)cc1 246725470 OTGAQSDCESFFCE-LBTBCDHLSA-N 329.444 1.717 10 10 EDCE Cc1cc(C(=O)NC[C@@H]2CNC[C@H]2O)c(C)n1-c1ccc(F)cc1 262252128 LQSDPPUHJHPXDF-SUMWQHHRSA-N 331.391 1.543 10 10 EDCE Cc1c(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)nnn1C 266047120 FFFJPJGEDPTMOU-UHFFFAOYSA-N 329.404 1.232 10 10 EDCE CNC(=O)CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 375366611 CNGLPJSHRKLFMT-ZDUSSCGKSA-N 339.823 1.262 10 10 EDCE COC[C@@]1(CO)C=CCN1c1cc(Br)c(CN)cc1F 2379823540 VBDMDZUFSPXUBH-AWEZNQCLSA-N 345.212 1.801 10 10 EDCE Cn1nnnc1CCNC(=O)NCc1cc(Cl)cc(Cl)c1O 805252194 BLVCDRIILXAONL-UHFFFAOYSA-N 345.190 1.264 10 10 EDCE C[C@H](NC(=O)NCc1cnn(C)n1)c1ccc(N2CCOCC2)cc1 804988569 FCUUPTBTLODSMS-ZDUSSCGKSA-N 344.419 1.212 10 10 EDCE COC[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 817275307 ZAXSLVNCLWEUTL-MRXNPFEDSA-N 347.459 1.644 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@@H](n4ccnn4)C3)cc2N1 819947293 YDITWLKPWOVEQA-SNVBAGLBSA-N 344.331 1.359 10 10 EDCE COCC(=O)NC1CCN(C/C=C/c2ccc(N(C)C)cc2)CC1 835026686 ZQLMIQKSSCFPJY-SNAWJCMRSA-N 331.460 1.993 10 10 EDCE CCN1C(=O)[C@H]2CN(Cc3c(O)cc(C)cc3Cl)CCN2C1=O 840922110 IELPJVSRFGALRH-CYBMUJFWSA-N 337.807 1.822 10 10 EDCE CN1CCCc2cc(CNC(=O)N3CCNC[C@](C)(F)C3)ccc21 841760748 YOHPVSQGEREOAV-SFHVURJKSA-N 334.439 1.912 10 10 EDCE COC[C@@H](CCNC(=O)NCc1ccc(N(C)C)c(F)c1)OC 852449294 RPJIGPNYKMWRCW-CYBMUJFWSA-N 327.400 1.742 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)COCc3ncc(C)o3)C2)cc1 855225741 LXOAZZNWKJDASX-CQSZACIVSA-N 345.399 1.903 10 10 EDCE C[C@H](NCCN1C(=O)CN(C)C1=O)c1ccc(N2CCOCC2)cc1 851898666 XAPKOSKLDIXUGM-AWEZNQCLSA-N 346.431 1.068 10 10 EDCE CCN(C)c1ccc([C@H](C)NC2CN(S(=O)(=O)N(C)C)C2)cc1 858569837 OCUXHAZBAGTQLL-ZDUSSCGKSA-N 340.493 1.284 10 10 EDCE CCn1nc(C)cc1NC(=O)C(=O)NCc1cc(Cl)ccc1O 861899670 OZVGVCAAPFUWIM-UHFFFAOYSA-N 336.779 1.825 10 10 EDCE CCOC(=O)[C@@H](Cc1ccccn1)NC(=O)c1cccc(O)c1O 760629837 WPBZTQYGWFTZPU-CYBMUJFWSA-N 330.340 1.397 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNCc1ccc(F)cc1O 1876124193 ZIRYBABOUNQHJY-MRXNPFEDSA-N 328.384 1.897 10 10 EDCE O=S(=O)(NCCCSc1nccs1)c1cnc2n1CCC2 772674844 GWUKBNFXEMPTOA-UHFFFAOYSA-N 344.487 1.747 10 10 EDCE NS(=O)(=O)c1ccc(C(=O)NCc2ccccc2O)cc1Cl 1137471662 VLLPEFLGAHOOGQ-UHFFFAOYSA-N 340.788 1.623 10 10 EDCE OCCOCC1(O)CCN(Cc2cc(Cl)cc(F)c2O)CC1 895828605 CRXNNTBPXRJUKK-UHFFFAOYSA-N 333.787 1.521 10 10 EDCE O=C1NCC[C@H]1CCNCc1cc(Br)cc(F)c1O 1887179162 FZJUUGQRAPFFKU-MRVPVSSYSA-N 331.185 1.910 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)c2cn(C)nn2)cc1C 1317395430 WMQVEJDLCPRVIE-ZDUSSCGKSA-N 331.420 1.430 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2CNC(=O)O2)c1O 1964062941 JIJYGUJQGKARAP-ZETCQYMHSA-N 331.166 1.361 10 10 EDCE COCC[C@H](CO)NCc1c(Br)ccc(OC)c1O 1964043236 SLYLWIZRWQSKAP-SECBINFHSA-N 334.210 1.650 10 10 EDCE COc1ccc(CNCCN(C)C(=O)CCc2cncn2C)cc1C 1317652864 FAFWWKHSAFMBSA-UHFFFAOYSA-N 344.459 1.918 10 10 EDCE COc1ccc(CN[C@H]2C[C@H](NC(=O)CCc3cnn[nH]3)C2)cc1C 1317089594 ZNEVZIFXKRASMH-WKILWMFISA-N 343.431 1.491 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)[C@H](CO)C2)cc1Br 704773249 AIMUGLQIYVAPMM-DCAQKATOSA-N 329.238 1.506 10 10 EDCE CN1CC(CN(C)c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 709352116 BPOABOMUEPVCEK-ZDUSSCGKSA-N 340.221 1.432 10 10 EDCE C[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C[C@H]1F 1346326543 INRSVNWJLCHERM-WDEREUQCSA-N 345.465 1.948 10 10 EDCE C[C@@H](O)C(C)(C)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1348861175 RGIKPPZIPMOYIE-CQSZACIVSA-N 349.475 1.854 10 10 EDCE CN1CCCc2cc(CNC(=O)N3C[C@H](CO)[C@@H](CCO)C3)ccc21 1518889465 JGBFSBXZLGAUNB-DLBZAZTESA-N 347.459 1.201 10 10 EDCE O=C(NCc1cc(Cl)ccc1O)c1ccc(-n2cncn2)nc1 1452940998 FDZVRWPQJUVRLS-UHFFFAOYSA-N 329.747 1.951 10 10 EDCE NC(=O)[C@H]1OCC[C@H]1NCc1cc(Br)cc(F)c1O 2117459076 ISHVUMAPESULCG-KOLCDFICSA-N 333.157 1.026 10 10 EDCE COCCC(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1533783396 RVNXGQFFTVLKNE-SNVBAGLBSA-N 335.364 1.120 10 10 EDCE CN(C)C(=O)/C=C/C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1465423652 XAXODOKTBXHPQZ-AATRIKPKSA-N 349.406 1.047 10 10 EDCE Cn1nccc1[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 1558599934 LKMKHKGJSGVUSX-CQSZACIVSA-N 342.359 1.796 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCc2ccn(C)n2)cc1C 1716397903 ZNLGDNJRNUMXBO-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE Nc1ccnn1CC(=O)NCc1cccc(Br)c1O 1635840265 QULNXJKENADPDE-UHFFFAOYSA-N 325.166 1.250 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H](F)C(C)C)cc1C 1568574230 BXIQGBMNFXXVBV-HOCLYGCPSA-N 326.412 1.564 10 10 EDCE CCn1nc(C)c(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C)c2)n1 1731641786 FZDBMWFNFFORSD-CYBMUJFWSA-N 345.447 1.832 10 10 EDCE Cc1cc(C)n2nc(C)c(C(=O)NCc3c(O)cccc3O)c2n1 1652622660 DIBKRQYXZDJQRK-UHFFFAOYSA-N 326.356 1.996 10 10 EDCE CCc1nnc(N(C)Cc2ccccc2O)n1CC[S@@](=O)CC 1762870608 ABHNWWVSYNZDGT-QHCPKHFHSA-N 336.461 1.951 10 10 EDCE CC(C)CC(=O)N1CCCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169844732 FEJWQGNRRIZSCR-UHFFFAOYSA-N 336.388 1.524 10 10 EDCE Nc1ccc(NC(=O)c2nc3ncc(Br)cn3n2)cc1 160384866 APKLITNSYNTZDQ-UHFFFAOYSA-N 333.149 1.721 10 10 EDCE CCC[C@@H](N)C(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1866017616 JXFMCQTZPHKLAK-CVEARBPZSA-N 329.448 1.819 10 10 EDCE OCc1ccc(N2C[C@H]3COC[C@@H](C2)[C@@H]3O)c(Br)c1 2132542200 GWYGRBWXKOTKGA-YABSGUDNSA-N 328.206 1.385 10 10 EDCE CCCN(CCC(=O)OCC)C(=O)CNCc1cc(C)ccc1O 1857867947 JWNBKRGVRMYNPI-UHFFFAOYSA-N 336.432 1.982 10 10 EDCE C[C@@H](c1c(O)cccc1O)N(Cc1ccccc1)CC1(O)CNC1 1915510585 PUOGSSMPNZYWBR-AWEZNQCLSA-N 328.412 1.995 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@@H](O)C[C@@H]2CO)c(Br)c1 2136087379 DHPXBKGOIBVMNE-YUSALJHKSA-N 329.238 1.791 10 10 EDCE CC(=O)N1C[C@@H]2C[C@H]1CN2Cc1c(O)cccc1Br 1970769635 POYHJTATYZPAFY-QWRGUYRKSA-N 325.206 1.960 10 10 EDCE C[C@H](O)[C@@H](N)C[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952234088 MWALDXSZLGOLSU-DRZSPHRISA-N 340.420 1.632 10 10 EDCE C[C@@H](N[C@@H](CO)CNC(=O)OC(C)(C)C)c1cc(O)ccc1O 1985776995 GDAKXRBRCPDADK-GHMZBOCLSA-N 326.393 1.634 10 10 EDCE CNCc1ccc(N2CC[C@](CO)(CCO)C2)c(Br)c1 2153355882 MSCPWBAAFVGPSZ-HNNXBMFYSA-N 343.265 1.740 10 10 EDCE CN1CCC(NCc2cccc(Br)c2O)(C(N)=O)CC1 2154498508 QSNONITUTIHIQG-UHFFFAOYSA-N 342.237 1.194 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)O[C@H](C)C2)cc1Br 300494027 OYGSTBDSNQJISA-MFKMUULPSA-N 329.238 1.755 10 10 EDCE CN(Cc1cn(C)nc1Br)C(=O)Cc1ccc(N)cc1 2173266322 OYULFYHXHBCMSL-UHFFFAOYSA-N 337.221 1.966 10 10 EDCE CCNCc1ccc(N2CC[C@H](O)[C@@H](CO)C2)c(Br)c1 396893959 WZCVZYRNFDLKHQ-DOMZBBRYSA-N 343.265 1.738 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)cc1Br 2182553215 KPPRLZPSHLZPNP-UZGCMYEVSA-N 341.249 1.647 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@H](F)[C@@H](CO)C3)c(Br)cc21 2177144360 RGRIKHMFQZPONH-ZIGWGHGNSA-N 344.184 1.168 10 10 EDCE OCc1ccc(N2CCN([C@@H]3CCOC3)CC2)c(Br)c1 2171299512 DJASQDRYPSXQFP-CYBMUJFWSA-N 341.249 1.852 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)O1 1908254751 UWZKBIBNBGNWHX-GRYCIOLGSA-N 339.396 1.970 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)O)CCN(CCc2ccc(N)cc2)C1 2044611463 OQXAPVMAJZMGKL-SFHVURJKSA-N 349.431 1.865 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2210535390 LSSBBCVUIZHQSQ-GMTAPVOTSA-N 327.385 1.610 10 10 EDCE CCC[C@H](CCOc1nnc(=N)[nH]n1)CNC(=O)OC(C)(C)C 2210652249 SZPZDRHVXWNKAZ-SNVBAGLBSA-N 326.401 1.389 10 10 EDCE CNCc1ccc(N2CCOC[C@H](CO)C2)c(Br)c1 2098207654 NLPGFXVECJZKQD-LBPRGKRZSA-N 329.238 1.614 10 10 EDCE O=C(O)[C@@H]1CCC2(CN(Cc3cc(Br)ccc3O)C2)O1 2205376786 FNYYZXQZYDLOPJ-LBPRGKRZSA-N 342.189 1.973 10 10 EDCE CCOC(=O)CN(C)C(=O)C=Cc1ccc(N2CCOCC2)cc1 2297505881 MWLXYGHZDHQAOF-UHFFFAOYSA-N 332.400 1.558 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N[C@@H]1CCN(CC(F)(F)F)C1=O 2307987264 OCJXBYOKPLSUHA-SNVBAGLBSA-N 344.289 1.390 10 10 EDCE Cc1ccc(CN(C)C[C@@](C)(O)C(=O)O)c(O)c1Br 2352639922 DDLCQXJJTFHLBX-CYBMUJFWSA-N 332.194 1.731 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)NCc1cscn1 101991010 KAYYYGLISBPYNG-UHFFFAOYSA-N 332.429 1.979 10 10 EDCE COc1cc(Br)c(Br)c([C@H](N)CO)c1O 72199925 SDZVASBUSQDVHQ-RXMQYKEDSA-N 340.999 1.918 10 10 EDCE CN(CCCC(=O)O)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 606442158 ZVDIOYDJJHGDCJ-TWGQIWQCSA-N 332.400 1.860 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2COCCN2)c(O)c1Br 2380789912 NDYOGAFLYLQPLR-NSHDSACASA-N 343.221 1.410 10 10 EDCE Cc1ccc(CN[C@@]2(C)CCC(=O)NC2=O)c(O)c1Br 2380796311 RQDFLGPAZYRDSF-AWEZNQCLSA-N 341.205 1.748 10 10 EDCE CC(=O)C(=O)COC(=O)/C=C\c1ccc(I)o1 808487599 OIDOGGCORCRRSA-HYXAFXHYSA-N 348.092 1.599 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN[C@@](C)(CO)C(C)C)nc12 810076035 ZFZUILMZUVNDOK-INIZCTEOSA-N 336.392 1.108 10 10 EDCE CC[C@@H](NC[C@]1(CO)COCCN1C)c1cc(Cl)ccc1O 903278675 MRDIGGANMNODFC-ZBFHGGJFSA-N 328.840 1.779 10 10 EDCE C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCC1=O 914335467 HLWKLPSBBOUDRE-AWEZNQCLSA-N 331.416 1.644 10 10 EDCE C[C@@]1(Br)C[C@@H]1C(=O)N(CC(=O)O)Cc1ccccc1O 911488750 NOGHAMUVHGEDRI-QMTHXVAHSA-N 342.189 1.979 10 10 EDCE COc1ccc(N2CC[C@H](NC(=S)NC3CCN(C)CC3)C2)cc1 849270318 BKNZBUZTYQJEBU-HNNXBMFYSA-N 348.516 1.832 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)[C@H](O)C1CCOCC1 856211614 XAYAJVZAQNNONN-GOSISDBHSA-N 348.443 1.051 10 10 EDCE CCn1cc(CNC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)nn1 852450486 NDJPCHRBOXRMFB-ZDUSSCGKSA-N 344.419 1.385 10 10 EDCE CCc1noc(C[C@]2(O)CCCN(C(=O)c3cccc(O)c3O)C2)n1 856710212 IDZZYUANVLWAAK-QGZVFWFLSA-N 347.371 1.253 10 10 EDCE CCn1nc(C)cc1NC(=O)C(=O)NCc1cccc(OC)c1O 861753171 RJEZWCBETXPPPR-UHFFFAOYSA-N 332.360 1.181 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)/C=C/CN3CCOCC3)C2)cc1 869228231 FNGCEFOFFBYHGW-WOMSROEHSA-N 345.443 1.279 10 10 EDCE CC[C@@H](NC[C@@]12COCCN1C(=O)COC2)c1ccc(C)cc1O 866553810 OAMRKPQUUOKMFH-QAPCUYQASA-N 334.416 1.369 10 10 EDCE COc1ccc(N2CC[C@@H](CNC(=O)c3coc(OC)n3)C2)cc1 862035631 ZVPUAIPYCSRFLJ-LBPRGKRZSA-N 331.372 1.948 10 10 EDCE COC(=O)[C@@H]1CC[C@H](C(=O)NCc2ccc3cccnc3c2O)O1 862026280 YEBZMGYYABOANX-OLZOCXBDSA-N 330.340 1.277 10 10 EDCE C[C@H](NC(=O)C(=O)N1CCC2(COC2)C1)c1ccc(N(C)C)cc1 1118691811 JATTUQSHBHEYJB-ZDUSSCGKSA-N 331.416 1.179 10 10 EDCE C[C@@H](NC(=O)N1CC[C@@]2(CNC(=O)C2)C1)c1ccc(N(C)C)cc1 789213738 SCYFFBVHCIOGRA-FZKQIMNGSA-N 330.432 1.735 10 10 EDCE CC(C)(C)OC(=O)N1CC(O)(CNCc2ccc(F)cc2O)C1 1964590559 VJYKDNMWEWCIGD-UHFFFAOYSA-N 326.368 1.603 10 10 EDCE C[C@H](N)c1ccc(N2CC[C@](C)(O)[C@H](O)C2)cc1Br 1893330955 GOTYXHNCWZRQDJ-FZZIBODNSA-N 329.238 1.791 10 10 EDCE COC[C@@H]1C[C@@H](O)CN1Cc1ccc(N2CCN(C)CC2)c(F)c1 1329659494 POCUBRAJIGUASD-JKSUJKDBSA-N 337.439 1.159 10 10 EDCE O=C(C(=O)N1CCC[C@H]1C1CCOCC1)N1Cc2cccc(O)c2C1 1332035939 GYSYSNTWKCLBBL-INIZCTEOSA-N 344.411 1.652 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)Cc2cnn(C)c2)cc1C 1267120799 IHFTUNSUTZRIAE-OAHLLOKOSA-N 344.459 1.964 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)C1(C(N)=O)CC1 1268477056 XIFSIWWHJVERSC-UHFFFAOYSA-N 333.432 1.207 10 10 EDCE COc1ccc(-n2nnnc2CN[C@@H](C)CNC(=O)CC2CC2)cc1 1266918176 STIJHRMWPAUBIE-LBPRGKRZSA-N 344.419 1.065 10 10 EDCE Cc1nc2n(n1)C[C@@H](NC(=O)c1cc3cc(O)c(O)cc3s1)CC2 1292751142 QABILPKNNQXXKS-JTQLQIEISA-N 344.396 1.957 10 10 EDCE CCc1nc([C@@H]2C[C@@H](O)CN2Cc2cc(F)cc(C(C)=O)c2O)n[nH]1 1460953449 DYCDWAHCMNAGAG-OCCSQVGLSA-N 348.378 1.722 10 10 EDCE CCn1c(=O)c2c(nc(/C=C/c3cn(C)nc3C)n2C)n(CC)c1=O 205564358 REBPNIDGSCEANY-CMDGGOBGSA-N 342.403 1.149 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccnc(NC(=O)C2CC2)c1 1558535854 QQOMDKOZXRSVQI-UHFFFAOYSA-N 327.340 1.771 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)C[C@@H]2CCN(C)C2)cc1C 1483184543 PJYYKRKGIPDGOG-WBVHZDCISA-N 333.476 1.940 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H]2CC[C@@H]2C(N)=O)cc1C 1493654469 BSZMCZIBNMIWEO-LSDHHAIUSA-N 333.432 1.063 10 10 EDCE CCNC(=O)CN(CC)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1493062539 FFIWACYIAQXAJS-UHFFFAOYSA-N 348.407 1.037 10 10 EDCE O=C1Cc2c(C(=O)N3CCOc4c3ccc(F)c4F)ccnc2N1 1639718238 WARQRHWSSQEXFN-UHFFFAOYSA-N 331.278 1.894 10 10 EDCE COC(=O)[C@@H]1C[C@@H]1C(=O)NC/C=C/CNCc1ccc(OC)c(C)c1 1732828623 DFURRAXYVWJHTH-CGFBPQRUSA-N 346.427 1.575 10 10 EDCE CC1(C)[C@@H](O)[C@H](O)CN1c1ccc(CN)c(Br)c1F 2124800333 KHOYHRYLOQGXLZ-SKDRFNHKSA-N 333.201 1.367 10 10 EDCE CNC(=O)C1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])CC1 1772821508 WMQSSBXDTBOUOF-XQRVVYSFSA-N 347.371 1.743 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C\c3cnccn3)CC2)cc1F 1772839231 PVFNXRSBFQNFOC-DJWKRKHSSA-N 342.374 1.986 10 10 EDCE C[C@@H]1CN(C)CCN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 235330233 YVROJIKQJCNAPQ-AMIZOPFISA-N 339.237 1.541 10 10 EDCE O=C1Nc2cc(N3C[C@H](O)C(F)(F)C3)c(Br)cc2[C@H]1O 2152094311 LWRWFHMPDZZOAO-VHSXEESVSA-N 349.131 1.251 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@H](O)C(C)(C)NC(=O)OC(C)(C)C 1985102565 IPALESCQZYXLIC-SNVBAGLBSA-N 329.401 1.809 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1CCN1CC(=O)Nc1ccc(N)cc1 1999465628 WRMFCAQUVYGOTB-CQSZACIVSA-N 334.420 1.806 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCO[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003172863 RAMVKXPDIPBGLV-JUFZMCDQSA-N 340.420 1.182 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CCc2ccc(N)cc2)[C@@H](C(=O)O)C1 2030001809 WYTQAMRRVUDMTO-OAHLLOKOSA-N 349.431 1.817 10 10 EDCE CSC1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2036370879 PTGGUFHHOWELQR-NSHDSACASA-N 328.235 1.953 10 10 EDCE Nc1ccc(CC(=O)NCCCn2cc(Br)cn2)cc1 380326004 VMCXHBLHFHDFDJ-UHFFFAOYSA-N 337.221 1.977 10 10 EDCE [N-]=[N+]=NCC1(CNC(=O)Cn2cc(Br)ccc2=O)CC1 2174355308 NGTLEGDAHXNWSH-UHFFFAOYSA-N 340.181 1.818 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@H]4C[C@@]4(O)C3)c(Br)cc21 2171028044 NVBXZVQKHTYPSI-ATMGAIRJSA-N 338.205 1.362 10 10 EDCE CC(C)(C)OC(=O)NC1[C@H]2CN(CC(=O)Nc3ccc(N)cc3)C[C@H]12 2045669026 YZCNSZPDSVHWMI-KBPBESRZSA-N 346.431 1.662 10 10 EDCE Oc1cccc(Br)c1CNC1CN([C@H]2CCOC2)C1 2113054484 IFUUVGCVBKWKTG-NSHDSACASA-N 327.222 1.717 10 10 EDCE COc1ccc(Br)c(CN2CC[C@H](OCCN)C2)c1O 2236038461 AIRAUVMQACIBPP-JTQLQIEISA-N 345.237 1.713 10 10 EDCE CNC[C@@H]1CC[C@@H](S(=O)(=O)NCc2cnc(SC)s2)C1 2284692766 WGYIRQFNPSMHRD-MWLCHTKSSA-N 335.520 1.673 10 10 EDCE C[C@H](N)c1ccc(N2CC3(CNC(=O)CO3)C2)c(Br)c1 2289723794 BPZOIPWAIHXBGD-VIFPVBQESA-N 340.221 1.174 10 10 EDCE C[C@@H](O)[C@H](C(=O)O)N1C(=O)C(=Cc2cccc(F)c2)SC1=S 2323823488 MCNIRAFVAUGWKE-RDDDGLTNSA-N 341.385 1.861 10 10 EDCE Cc1ccc(CNC(=O)COC2CNC2)c(O)c1Br 2352634906 ZHBVEQGAGSONAU-UHFFFAOYSA-N 329.194 1.068 10 10 EDCE Cc1ccc(C(=O)N2CCC(Nc3cccnn3)CC2)c(O)c1O 179500849 BRIQIZXPFJXZCS-UHFFFAOYSA-N 328.372 1.913 10 10 EDCE CN(C)c1ccc(CNC(=O)N2CC(NC(=O)C3CCC3)C2)cc1 186477428 ZOXCNALLFASLQN-UHFFFAOYSA-N 330.432 1.563 10 10 EDCE COc1ccc(N(C)C[C@@H]2CCCN(S(C)(=O)=O)C2)c(OC)c1 132182151 ZWLSFYZWACEDBT-ZDUSSCGKSA-N 342.461 1.812 10 10 EDCE CCOc1ccc(O)c(CN2CCN(Cc3noc(C)n3)CC2)c1 93274429 FXMSIDITZVWQTN-UHFFFAOYSA-N 332.404 1.800 10 10 EDCE Nc1ccc(OC[C@H](O)CN2CCN(Cc3ccccc3)CC2)cc1 384256395 DFWVPCFGIRZOQR-LJQANCHMSA-N 341.455 1.826 10 10 EDCE CN1CCO[C@@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 246260564 UTECHFSEZVNHLQ-NVXWUHKLSA-N 334.416 1.230 10 10 EDCE C[C@@H](NC[C@@]1(CO)COCC2(CCC2)N1C)c1ccc(F)cc1O 527955322 NOMCYCOXACIFHO-FZKQIMNGSA-N 338.423 1.798 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@@H]1CCC[C@H]1O 266787562 SLMUNVMMARTVNW-DOTOQJQBSA-N 333.432 1.483 10 10 EDCE CN(C)CCCCNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 264843957 AYRSVUUMWHUPAB-JXMROGBWSA-N 331.460 1.994 10 10 EDCE COc1ccc(N2CC[C@H](CNc3cncc(OCCO)n3)C2)cc1 819936339 RWYNZHUCMMXVOO-CQSZACIVSA-N 344.415 1.795 10 10 EDCE C[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)c1ccccn1 826707277 RURZSQRXOIVTFJ-AWEZNQCLSA-N 340.427 1.684 10 10 EDCE CCOc1ccc(CN2CCS(=O)(=O)[C@H]3CCC[C@H]32)c(O)c1 825201371 JYQQRQGPSARCHO-ZBFHGGJFSA-N 325.430 1.942 10 10 EDCE Cc1cc(C(=O)N2CCO[C@@H]([C@H](C)O)C2)c(C)n1-c1ccccn1 839924996 JGCOBMUPAICVJA-GOEBONIOSA-N 329.400 1.711 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CC[C@@H]2C[C@H]2C1 834770360 HOHKVULFUHJTRA-VNQPRFMTSA-N 329.444 1.982 10 10 EDCE COc1ccc(N2CCC(NC(=O)N[C@H]3CNCC[C@@H]3C)CC2)cc1 841778433 BBFPUXMKPDHCQH-KSSFIOAISA-N 346.475 1.961 10 10 EDCE COc1ccc(N2CCN(C(=O)COc3ccnnc3)CC2)cc1 853713068 MNBFFGCTZYGTLV-UHFFFAOYSA-N 328.372 1.213 10 10 EDCE C[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 928538704 LHXZQEUPBITFFP-SNVBAGLBSA-N 328.390 1.015 10 10 EDCE C[C@@H](NCC[C@@H]1CNCCS1(=O)=O)c1ccc2ccccc2c1O 925794252 MAIVDZSAIYHASX-UKRRQHHQSA-N 348.468 1.973 10 10 EDCE CO[C@H](CNC(=O)NCc1ccc(N(C)C)c(F)c1)[C@H]1CCOC1 852440586 SCEPBIVALGAQNI-XJKSGUPXSA-N 339.411 1.742 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Cc3ccc(N)cn3)C2)cc1 851639923 NDCFGSXVSRJXJV-HNNXBMFYSA-N 326.400 1.610 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC(=O)NC(C)C)C2)cc1 851924906 PXHBLMHNZSGAND-ZDUSSCGKSA-N 334.420 1.098 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2C[C@@H]3C[C@H]2CN3C(=O)C2CC2)cc1 936149912 XZSQOXRLZURFGF-KBPBESRZSA-N 341.371 1.684 10 10 EDCE CC(=O)C(=O)COC(=O)c1cc2nc(C)cc(C(F)(F)F)n2n1 869689337 VYNQIFIWWLOQRA-UHFFFAOYSA-N 329.234 1.371 10 10 EDCE COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(C)c1O 775739219 NBQVODSSTPYQNY-KBUPBQIOSA-N 333.384 1.626 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCN(C[C@H](C)O)CC2)c1 779190578 LJQSZJMOWYWEHW-LBPRGKRZSA-N 343.265 1.962 10 10 EDCE C[C@@H]1OC[C@]2(CC[C@@H](CNC(=O)c3c(F)ccc(O)c3O)O2)[C@@H]1C 899485990 XMUKHUMMANQJRV-IBXUITPSSA-N 339.363 1.939 10 10 EDCE COC(=O)[C@@]12C[C@@H](NC(=O)c3ccc(N=NC(N)=O)cc3)C[C@@H]1C2 1302570056 LRMUUBBKRJLTCZ-XAGWURHQSA-N 330.344 1.921 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC([C@@H]2CCOC2)C1 1325139473 HMWUACKDUFHBID-OAHLLOKOSA-N 345.443 1.206 10 10 EDCE C[C@H]1CS(=O)(=O)C[C@H]1NCc1ccc(Br)cc1O 711774614 NFVOWZBFVSZPMQ-GZMMTYOYSA-N 334.235 1.677 10 10 EDCE CCNC(=O)[C@H]1CNCCN1Cc1ccc(Br)cc1O 691388518 RHDQQWVJPKUDPV-GFCCVEGCSA-N 342.237 1.065 10 10 EDCE CO[C@]1(CNCc2ccc(N3CCCC3)cc2)CCS(=O)(=O)C1 1332351063 BFVWRIPKTOFZPN-KRWDZBQOSA-N 338.473 1.580 10 10 EDCE CN[C@@H]1C(=O)Nc2cc(N(C)CCOC)c(Br)cc21 92775448 MEDRQMQBGZGRHU-LBPRGKRZSA-N 328.210 1.744 10 10 EDCE COc1cc(O)c(CNCC[C@@H]2CCCS2(=O)=O)cc1OC 1332725838 VSIPSIFGXHXYHL-LBPRGKRZSA-N 329.418 1.466 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@]2(C)CC2(F)F)cc1 1333957558 XZGFOPSLYUQTCS-HNNXBMFYSA-N 325.359 1.530 10 10 EDCE CN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H]1CCC2(CCC2)O1 1262145579 BBRZUNASGQXTRW-AWEZNQCLSA-N 332.400 1.569 10 10 EDCE COc1ccc(-n2nnnc2CN[C@@H](C)CNC(=O)C=C(C)C)cc1 1265750069 FCLVQKMAPIHPJO-ZDUSSCGKSA-N 344.419 1.231 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCC(=O)N(C)OCC(F)(F)F 1347931076 MPBUEJXZQLXQFF-UHFFFAOYSA-N 349.309 1.486 10 10 EDCE COc1ccc(CNC[C@@H](O)CN(C)C(=O)[C@H]2CC2(F)F)cc1C 1284399819 IQMNBVKAPDPJRO-ZIAGYGMSSA-N 342.386 1.568 10 10 EDCE COc1cnc(C(=O)NC[C@H](C)NCc2ccc(OC)c(C)c2)nc1 1480499372 NFXYPPPVUNONSN-ZDUSSCGKSA-N 344.415 1.710 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C2(CN(C)C)CC2)cc1C 1480523757 DSHPZRJONZGXFC-OAHLLOKOSA-N 333.476 1.940 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)[C@@H](O)CC 1632356658 TVIQWLPIJCXICV-WXHSDQCUSA-N 339.388 1.095 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H]2C[C@@H]3C[C@@H]3C2)cc1C 1497037550 NDJQLXFQQKROCE-LTIDMASMSA-N 332.444 1.616 10 10 EDCE NC(=O)C1CCN(c2ccc(CNC(=O)NC3CSC3)cc2)CC1 1565363959 CGMCIKXLPPUAKG-UHFFFAOYSA-N 348.472 1.303 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2CS(=O)(=O)C[C@H]2C)c1 1685295632 UFAJGRKNYOBRMW-NRUUGDAUSA-N 342.417 1.194 10 10 EDCE O=C(NCCNC(=O)c1ccccc1S)c1cc(O)c(O)c(O)c1 169839030 PLKOICXMDBGFNS-UHFFFAOYSA-N 348.380 1.252 10 10 EDCE Cc1c([C@H](O)[C@H](N)c2ccccc2O)c(Br)nn1C 2131551836 LZIUDCYNUOYHPX-NEPJUHHUSA-N 326.194 1.930 10 10 EDCE Cn1cc(S(=O)(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cn1 1890687131 MJOSLTKCIZNUSU-HOCLYGCPSA-N 346.456 1.887 10 10 EDCE CO[C@H](CNC(=O)OC(C)(C)C)[C@@H](O)[C@@H](N)c1ccccc1O 1904964615 UUSJPOIVNJWDSQ-HZSPNIEDSA-N 326.393 1.293 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@](C)(O)CCN 1951832809 JEEGMUZFIRVUAW-YOEHRIQHSA-N 340.420 1.633 10 10 EDCE C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)Cc2ccc(N)cc2)C1 1999440530 HBPAWDPXMYFWSO-AWEZNQCLSA-N 329.322 1.481 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1Nc1c(N)cccc1C(N)=O 2000872662 WXBDCCTUTGJEGW-NEPJUHHUSA-N 336.392 1.072 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)[C@@H]1CCOC1 2003172209 HXAAKUFTHZLZQE-BYNQJWBRSA-N 340.420 1.182 10 10 EDCE CO[C@@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)C1CN(C(=O)OC(C)(C)C)C1 2010396294 MXYUAPDULVCRDH-NWDGAFQWSA-N 339.396 1.780 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@@H]4C[C@H]3CN4c3ccccc3)c2n1 2062360758 FXAVNBKEDKRHBV-GJZGRUSLSA-N 349.394 1.847 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCc4ccccc4[C@H]3CO)c2n1 2062667267 DZJNZJMNYUFFEA-OAHLLOKOSA-N 338.367 1.475 10 10 EDCE Cc1ccc(CN(CCO)C(=O)c2cnn3c(O)cc(C)nc23)cc1 2063206455 MATMXSPMEBRFGC-UHFFFAOYSA-N 340.383 1.686 10 10 EDCE CN(C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1cccnc1 1910965314 HXWZGEIZVRLOFL-UONOGXRCSA-N 333.388 1.629 10 10 EDCE O=S1(=O)C[C@H]2[C@@H](C1)[C@@H]2NCc1c(O)cccc1Br 2054267856 PGJMBELZYXBIPH-GDGBQDQQSA-N 332.219 1.287 10 10 EDCE C[C@@H](O)CN1CCN(c2ccc(CN)c(Br)c2)CC1 2113860097 ZEVVGIWDFFGCBY-LLVKDONJSA-N 328.254 1.411 10 10 EDCE CN(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213589015 CXXCWAVJCIRJQV-SRVKXCTJSA-N 340.428 1.789 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCNCCNCC1 2227925278 YSMZHEPEWMCTKN-UHFFFAOYSA-N 332.217 1.289 10 10 EDCE CSc1ncc(CNC(=O)N[C@H](C(=O)O)C(F)(F)F)s1 2284505780 YYDPMMCDFXULAU-RXMQYKEDSA-N 329.325 1.680 10 10 EDCE C[S@@](=O)CCCNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297527956 ANOVKFUOZNGPNT-HSZRJFAPSA-N 336.457 1.421 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2329329375 UEWXVWRUKHUVPS-QLHATJFASA-N 328.206 1.433 10 10 EDCE O=C(O)C[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccccc2)SC1=S 1908123 ZTDKNVSCNHFUTP-CMWXKVOJSA-N 337.378 1.816 10 10 EDCE Cc1ccc(C(=O)N[C@@H]2CCCN(c3cccnn3)C2)c(O)c1O 179504779 AEJYRQBCLZMCDV-GFCCVEGCSA-N 328.372 1.595 10 10 EDCE C[C@H](O)CN(CCNCc1ccc(O)c(O)c1)C(=O)OC(C)(C)C 305881231 BATBBIPCKYEGSL-LBPRGKRZSA-N 340.420 1.805 10 10 EDCE C[C@H](CNC(=O)NCc1ccc(N2CC=CC2)cc1)N1CCOCC1 125394117 FQSDZANMMKTEQU-MRXNPFEDSA-N 344.459 1.583 10 10 EDCE COC(C)(C)CS(=O)(=O)NCc1ccc(N2CCOCC2)cc1 283532997 MLQZJZIVQVLLGC-UHFFFAOYSA-N 342.461 1.368 10 10 EDCE Cc1ccc(CNCc2cnn(CCO)c2)c(O)c1Br 2380812112 RVTLBNGKZCJPJK-UHFFFAOYSA-N 340.221 1.942 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@H]2CNC[C@@H]2F)c(O)c1Br 2381135715 VAVIBGBPQYAMBN-QWRGUYRKSA-N 345.212 1.979 10 10 EDCE CN(C)c1ccc([C@@H](N)[C@H](O)c2c(Br)cnn2C)cc1 2163131738 UPPQIDQKKAFHOA-OCCSQVGLSA-N 339.237 1.982 10 10 EDCE C[C@H](NC1(C(N)=O)CN(C(=O)OC(C)(C)C)C1)c1ccccc1O 715576205 SLMWRKQSPWAHKI-NSHDSACASA-N 335.404 1.518 10 10 EDCE CCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1ccc(C)cc1 914761325 RNVZERNQADGYCC-FLIBITNWSA-N 327.384 1.459 10 10 EDCE CCNC(=O)CN1CCN(C/C=C/c2ccc(N(C)C)cc2)CC1 835025313 HYJUCIYPYIMMRG-AATRIKPKSA-N 330.476 1.520 10 10 EDCE O=C(NCCCSc1nccs1)N1CCOC2(CNC2)C1 841855986 DVLXVBVLBJMBKN-UHFFFAOYSA-N 328.463 1.009 10 10 EDCE CC(=O)C(=O)COC(=O)c1nn(-c2ccc(F)cc2F)c2c1CCC2 842112058 OTNKOYYZNFNUAA-UHFFFAOYSA-N 348.305 1.954 10 10 EDCE C[C@@H]1CN(C(=N)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 849095953 UJUYRVNCALHBAA-CYBMUJFWSA-N 336.411 1.407 10 10 EDCE COc1ccc(N2CCN(C(=O)C34CCN(CC3)C4)CC2)c(OC)c1 913482763 VSBXOYHYSBZPEV-UHFFFAOYSA-N 345.443 1.448 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@@H](C[C@H]1COCCO1)C(F)(F)F 910942852 HFTBEOPUNHKGLD-NWDGAFQWSA-N 349.305 1.698 10 10 EDCE COc1ccc(N2CC[C@H](NS(=O)(=O)c3cnccc3C)C2)cc1 849416651 UNDHGEQBPXCVCJ-AWEZNQCLSA-N 347.440 1.956 10 10 EDCE Cc1cc(O)c(CN(CCO)CCN2CCOCC2)c(Cl)c1 840911558 HIFDRMQQUBYXAI-UHFFFAOYSA-N 328.840 1.481 10 10 EDCE CN1CCOC[C@H]1CNC(=O)NCc1cc(Cl)cc(Cl)c1O 858838907 PWDVZJFQMATSOW-LLVKDONJSA-N 348.230 1.829 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3cc([N+](=O)[O-])c[nH]3)C2)cc1 853817756 MFYXEYXSGKVONX-NSHDSACASA-N 330.344 1.940 10 10 EDCE CN(C)c1cc(F)c(CNC[C@@]2(OCCO)CCOC2)cc1F 858188489 UNVSHQOPEUNKPF-INIZCTEOSA-N 330.375 1.288 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@]3(C)CO)C2)cc1 854300038 TYMMFYBAGZVSNN-KBXCAEBGSA-N 333.432 1.830 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@H]2CC[C@H]1[C@@H](CN)C2 866696261 XYWWRKUDYMMPQT-SCTDSRPQSA-N 344.503 1.770 10 10 EDCE Cc1cc(O)c(CNC[C@@]23COCCN2C(=O)OC3)c(Cl)c1 865771163 SIOGEZRVXSEQNL-HNNXBMFYSA-N 326.780 1.665 10 10 EDCE Cc1ccc(O)c(CNC(=O)N[C@H]2CCCN(c3ncccn3)C2)c1 1118801877 WVGHIAJRFOGSGM-HNNXBMFYSA-N 341.415 1.959 10 10 EDCE CC(=O)c1cc(F)cc(CN2C[C@@]3(C)C(=O)NC(=O)[C@]3(C)C2)c1O 879158176 OGFUTPSMTKSOGH-IRXDYDNUSA-N 334.347 1.219 10 10 EDCE CCOCc1cc(CN[C@@H]2C(=O)NCC23CCOCC3)ccc1OC 895773786 SVHOHEGTQIYODK-QGZVFWFLSA-N 348.443 1.617 10 10 EDCE CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cn(C)nc1OC 789590001 OTNOAGZYLOAHNY-UHFFFAOYSA-N 346.387 1.512 10 10 EDCE O=C(c1ns[nH]c1=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1151903908 XTNLUJZEGXBMPH-NSHDSACASA-N 335.385 1.358 10 10 EDCE C[C@H](NCC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1O 1308010176 JOBRQFCRDFQEEN-NSHDSACASA-N 349.412 1.329 10 10 EDCE COC(=O)[C@H]1C[C@H](O)CN1Cc1cc(C)cc(Br)c1O 1320674002 DHCHCEZJTGLWSU-CMPLNLGQSA-N 344.205 1.571 10 10 EDCE CO[C@H](C)CNCC1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1328961718 VZSSOTUDJDSGAH-XIKARTHZSA-N 347.419 1.982 10 10 EDCE CCOC[C@H](C)NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1322535688 HHVPGILZPZJGMW-NSHDSACASA-N 325.384 1.049 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC1C[C@@H]2C[C@H]2C1 1329204933 NASXIQCQZYFULT-GJZGRUSLSA-N 325.412 1.594 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCC[C@H]2CNCCO)cc1 1268293427 BVZSODLNBXKPJE-JSGCOSHPSA-N 333.392 1.329 10 10 EDCE C[C@@H](NC(=O)C1(CO)CCOCC1)c1ccc(N2CCOCC2)cc1 1544214874 HJABSSDSYRMPAK-OAHLLOKOSA-N 348.443 1.490 10 10 EDCE CC(C)[C@H](F)C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1 1703234525 BRGLHGQLQZOEOQ-LBPRGKRZSA-N 337.355 1.689 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC(CCNCCO)CC2)cc1 1482010130 LELVAAVOGKURIA-UHFFFAOYSA-N 347.419 1.673 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC(c2ccccn2)=NO1 1556157741 IWWHCNOVUYNOHL-DIFFPNOSSA-N 341.367 1.733 10 10 EDCE CC(C)(C)OC(=O)NC/C=C/CNC(=O)Cc1ccc(O)c(O)c1 1631506672 KIRFPKJRYDQYOY-SNAWJCMRSA-N 336.388 1.837 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@H](OCc2ccncc2)C1 1632814521 HLVIUXLUXKUCCK-HNNXBMFYSA-N 328.368 1.853 10 10 EDCE NC(=O)N[C@H](CC(=O)NCc1cccc(O)c1O)c1ccccc1 1633508173 LHDWZFDUDBOXBH-CYBMUJFWSA-N 329.356 1.514 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@@H]2CCN(C)C2)cc1C 1568317411 OFJCQYOFOHTCAP-DOTOQJQBSA-N 333.476 1.892 10 10 EDCE COCC(=O)N[C@H](C)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1678595572 AGEGAONAOXCGLE-SNVBAGLBSA-N 347.375 1.072 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)NCC[C@@H](C)[S@](C)=O)c1 166533540 IIKMXHJLRCPFQC-NFULHVNHSA-N 328.434 1.918 10 10 EDCE COC[C@@H]([C@H](N)Cc1ccc(O)c(O)c1)N(C)C(=O)OC(C)(C)C 1952908315 CMRVLHUQDDQQOJ-OLZOCXBDSA-N 340.420 1.850 10 10 EDCE COCCNC(=O)CN(C)Cc1cc(Br)cc(C)c1O 158022627 GUGMUPYFPUFINF-UHFFFAOYSA-N 345.237 1.658 10 10 EDCE CO[C@H](C(=O)NCCCN=[N+]=[N-])C1CN(C(=O)OC(C)(C)C)C1 1985101914 ZORFTRJXUSBMMP-NSHDSACASA-N 327.385 1.685 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)cc1Br 2146314277 QYWHJJIBZJZETI-ONERCXAPSA-N 342.233 1.684 10 10 EDCE CN[C@@](CSc1nccs1)(C(N)=O)C1(Br)CC1 2025895453 LEMVNSGAWBJLCN-JTQLQIEISA-N 336.280 1.606 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@H]2C3)cc1Br 2173357564 NRYWULHGYCXGKD-COXYCDLLSA-N 342.233 1.823 10 10 EDCE O=C1Nc2cc(N3CC=C(CO)CC3)c(Br)cc2[C@H]1O 2171012618 FRFIQRVSVKOFNI-CYBMUJFWSA-N 339.189 1.563 10 10 EDCE C[C@@H]1C[C@H]2CN(c3ccc(CO)c(Br)c3)CCN2C1=O 2181182201 KYPJXLZGPJTVKR-MFKMUULPSA-N 339.233 1.998 10 10 EDCE Cn1[nH]c(CCNC(=O)OC(C)(C)C)nc1=NCc1ccccc1O 2063176572 GAPKDQLNSZEJAC-UHFFFAOYSA-N 347.419 1.622 10 10 EDCE CC1(C)CN(c2ccc(CN)c(Br)c2)CCNC1=O 2093987992 FZKPFTNPAAVZIL-UHFFFAOYSA-N 326.238 1.870 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213586268 ABSHRHKSYDFOGK-KKOKHZNYSA-N 339.396 1.704 10 10 EDCE CN(C)C(=O)[C@@H]1C=CCN1c1ccc(CO)cc1Br 2265498662 LOHPNFKZXJNVIH-ZDUSSCGKSA-N 325.206 1.774 10 10 EDCE CN1CC2(CCC1=O)CN(c1ccc(CO)c(Br)c1)C2 2289663796 BZGDNYTZYWLPBB-UHFFFAOYSA-N 339.233 2.000 10 10 EDCE CCCN1C(=O)C(=Cc2ccc(OCC(=O)O)cc2)C(=O)N(C)C1=O 2297578641 UMUPXQSEGOYGIM-UHFFFAOYSA-N 346.339 1.364 10 10 EDCE Cc1ccc(CN2CC[C@](C)(O)[C@@H](O)C2)c(O)c1Br 2352677628 BJLQERHIVTWSJD-FZMZJTMJSA-N 330.222 1.781 10 10 EDCE COc1ccccc1N1C(=O)[C@H](CN2CCOCC2)SC1=S 59397367 LZXSRHUOPGWNCQ-ZDUSSCGKSA-N 338.454 1.761 10 10 EDCE COC(=O)/C=C/c1ccc(N2C[C@H]3OCCN(C)[C@@H]3C2)c([N+](=O)[O-])c1 301639243 GAYOOTSJDUQVMI-RKIWFNSJSA-N 347.371 1.300 10 10 EDCE COC(=O)[C@H]1C[C@H](OC)CN1Cc1ccc(N2CCOCC2)cc1 125781863 CUOSWAOLTHAGBW-DLBZAZTESA-N 334.416 1.286 10 10 EDCE COc1ccc(O)c(CNC(=O)c2cnoc2-c2cnn(C)c2)c1 189385381 KTKKQBPAMVWEHQ-UHFFFAOYSA-N 328.328 1.719 10 10 EDCE COc1ccc(N2CCN(C(=O)C3(C(=O)NC4CC4)CC3)CC2)cc1 242776033 DUPTVTCQDONRJK-UHFFFAOYSA-N 343.427 1.403 10 10 EDCE O=C(c1cccc(O)c1O)N1CCOC[C@H]1C[C@H](O)c1ccco1 279867924 QKJJFSGYLNDGAJ-RISCZKNCSA-N 333.340 1.656 10 10 EDCE COc1cc(O)c(CN2CCN(CC(F)(F)F)C(=O)C2)cc1OC 285235291 VUBFWCGVQSDGMP-UHFFFAOYSA-N 348.321 1.616 10 10 EDCE CCOC(=O)C[C@H](O)C(=O)NCc1cc(Br)ccc1O 804734325 AVFGIZZPCMEKJB-NSHDSACASA-N 346.177 1.085 10 10 EDCE O=C1NC(=O)C2(CCC(NCc3cc(Cl)c(F)cc3O)CC2)N1 293795007 CTOILKHVFDZKEF-UHFFFAOYSA-N 341.770 1.795 10 10 EDCE C[C@@]1(CO)CCCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 722983553 XKRCMTLHKWZHIY-JSGCOSHPSA-N 340.221 1.752 10 10 EDCE C[C@H](NC(=O)/C=C\Cn1cncn1)c1ccc(N2CCOCC2)cc1 900386984 NDUZYHZQTRMBTN-GWQWAINWSA-N 341.415 1.548 10 10 EDCE CC[C@@H](NC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)C1CC1 830303685 LNHHUYXTBLZOFI-WMLDXEAASA-N 345.443 1.695 10 10 EDCE NC(=O)Cc1occc1C(=O)N1C[C@H](CO)Cc2cccc(F)c21 911687827 HMBBLAJNZPWMFK-SNVBAGLBSA-N 332.331 1.258 10 10 EDCE Cc1ncc(Cl)c(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)n1 832274568 VYZLVPDQFQYRHS-AWEZNQCLSA-N 333.823 1.934 10 10 EDCE CNS(=O)(=O)[C@@H]1CCCN(Cc2c(O)cc(C)cc2Cl)C1 840915290 NXTWEVICPVFORO-LLVKDONJSA-N 332.853 1.868 10 10 EDCE CN=[S@@](C)(=O)CCNC(=O)c1cc(C)n(-c2ccccn2)c1C 912797463 WWKKDFCCLXKUNW-QHCPKHFHSA-N 334.445 1.947 10 10 EDCE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@H]2CN(C3CC3)C(=O)O2)c1 847456970 RLKGKOHCCCMKRW-MFKMUULPSA-N 349.387 1.744 10 10 EDCE C[C@H](NC[C@@H](O)CS(C)(=O)=O)c1ccc(Cl)c(Cl)c1O 927024468 KZAWBGDVPDNUGD-JGVFFNPUSA-N 342.244 1.755 10 10 EDCE Cc1cc(Br)c(O)c(CN2CCOC3(CNC3)C2)c1 853248639 ICNHTYLMMGEBKD-UHFFFAOYSA-N 327.222 1.637 10 10 EDCE COC(=O)C[C@@H](CNC(=O)NCc1cc(OC)ccc1O)C1CC1 853736760 NIEPALYDEATTAW-LBPRGKRZSA-N 336.388 1.789 10 10 EDCE OC1CCN(c2ccc(CN[C@H]3CN4CCC[C@H]3C4)cc2F)CC1 924762118 XYTZQPSBVGXOLC-YJBOKZPZSA-N 333.451 1.971 10 10 EDCE NC(=O)N1CCC[C@@H](C(=O)NCc2ccc3cccnc3c2O)C1 862028768 KEXKRKCROJFUMB-CYBMUJFWSA-N 328.372 1.347 10 10 EDCE CN(Cc1ccccc1O)S(=O)(=O)c1cnn(C)c1C(F)(F)F 866834472 LTICFOUJKHGAQO-UHFFFAOYSA-N 349.334 1.965 10 10 EDCE COC(=O)c1c(CN2CC[C@@H](O)[C@@H](O)C2)c2cc(F)ccc2n1C 895460118 JMYNZAITIPSGSD-CABCVRRESA-N 336.363 1.032 10 10 EDCE CCOC(=O)C1(C(=O)NCc2ccc(N(C)C)cc2)CCOCC1 794619120 QJDXMESXSFEXME-UHFFFAOYSA-N 334.416 1.729 10 10 EDCE CN(C)c1ccc([C@H](CNC(=O)N2C[C@@H]3C[C@@]3(CO)C2)N(C)C)cc1 899101222 GJIXDAMOWMRTTG-IEZWGBDMSA-N 346.475 1.379 10 10 EDCE COc1ccc(Br)c(CNCCS(C)(=O)=O)c1O 1964553202 BLFVUTRSYJTPBK-UHFFFAOYSA-N 338.223 1.298 10 10 EDCE CN(C)c1ccc(Cn2nc(C(=O)O)c3c(O)cc(=O)[nH]c32)cc1 82822673 DGOMYOOIKPUFFD-UHFFFAOYSA-N 328.328 1.243 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)C[C@H]2CCNC2=O)cc1C 1319471818 FRRNWQHRAJGAFW-GDBMZVCRSA-N 347.459 1.466 10 10 EDCE CN1CCN(Cc2cc(Br)cc(F)c2O)C[C@H]1C(=O)O 715782452 ZIIOQWSKVYXOBX-NSHDSACASA-N 347.184 1.494 10 10 EDCE CC(C)NCc1ccc(N2C[C@H](O)C[C@@H]2CO)cc1Br 698196424 GQIGVGPRRXGUBV-ZIAGYGMSSA-N 343.265 1.879 10 10 EDCE CNC(=O)[C@@H]1CN(C(=O)/C=C(\C)c2cnccn2)c2ccccc2O1 1350994210 BJMQIFJMCXDAIS-YHVDPYDOSA-N 338.367 1.420 10 10 EDCE Cn1cc(-n2cc(C(=O)NCc3c(O)cccc3F)ccc2=O)cn1 1456030992 VCZMTGYMJXDQJM-UHFFFAOYSA-N 342.330 1.346 10 10 EDCE CNCc1ccc(N2CC(=O)NCC2(C)C)c(Br)c1 2119100563 KIBAIEVHKKYDTD-UHFFFAOYSA-N 326.238 1.883 10 10 EDCE C[C@@H](NC(=O)c1ccc(S(N)(=O)=O)s1)c1ccccc1O 1471195081 BDKUSUNFERLYRM-MRVPVSSYSA-N 326.399 1.592 10 10 EDCE COc1ccc(CNCCN(C)C(=O)c2cnnc(C)c2)cc1C 1481224533 UTXBBELZDSXSRW-UHFFFAOYSA-N 328.416 1.964 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)c2cccnc2O)N(C)C)cc1 1558722757 BRVPERBNRVODHC-MRXNPFEDSA-N 328.416 1.886 10 10 EDCE O=C(NCc1cccc(O)c1O)C1(S(=O)(=O)c2ccccc2)CC1 1558159871 OHYZGOMDGMJGES-UHFFFAOYSA-N 347.392 1.721 10 10 EDCE CNS(=O)(=O)Nc1ccc(NC(=O)c2cc(O)cs2)cc1 1568266988 FZBYAKYJCHMFLG-UHFFFAOYSA-N 327.387 1.582 10 10 EDCE CCOC(=O)c1[nH]nnc1[C@@H]1CCCN1C(=O)c1cccc(O)c1O 1595492609 KYQSMKCWOUHZBB-JTQLQIEISA-N 346.343 1.370 10 10 EDCE COC(=O)CCC(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 1865957522 NHIJYVNTWUBTKG-QGZVFWFLSA-N 344.415 1.645 10 10 EDCE C[C@H]1CCN1C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1119960988 HDSBDVTWIMGFFF-BBRMVZONSA-N 332.448 1.092 10 10 EDCE CNC(=O)[C@@H](C)N(C)c1cc2c(cc1Br)[C@@H](O)C(=O)N2 1916788481 TUKCXCHQIAGILB-KSBSHMNSSA-N 342.193 1.005 10 10 EDCE CC(=O)N1CCCN(c2ccc(CN)cc2Br)CC1 212901740 HFDWDCMZXTYWQO-UHFFFAOYSA-N 326.238 1.966 10 10 EDCE C[C@@](O)(CO)[C@H]1CCN(c2ccc(CO)cc2Br)C1 2138090713 BHKUSXUXRXAGLM-SMDDNHRTSA-N 330.222 1.511 10 10 EDCE COC(=O)[C@H](CCNCc1ccccc1O)NC(=O)OC(C)(C)C 1941213580 FVWJOMOLPZTRNB-ZDUSSCGKSA-N 338.404 1.938 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CC[C@]12C[C@H]2C(=O)C(=O)C[C@H]1C[C@H](N)C1 2004881388 MCHAGWWWFNTFCE-LUIWMBBWSA-N 336.432 1.945 10 10 EDCE CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCC[C@H]1CN=[N+]=[N-] 1985093899 HARBKRUZRZAOTK-WDEREUQCSA-N 327.385 1.563 10 10 EDCE COC(=O)[C@@H](CC(=O)N(C)CCN=[N+]=[N-])NC(=O)OC(C)(C)C 1985099336 LVXYPKYMFLPRFB-SECBINFHSA-N 329.357 1.212 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)CC[C@H](O)CNC(=O)OC(C)(C)C 1985101781 XNDGWSFVIVVNDC-NSHDSACASA-N 329.401 1.811 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1CCN1C(=O)COc1ccc(N)cc1 1999446434 XJYYQSILVKXNBN-ZDUSSCGKSA-N 335.404 1.773 10 10 EDCE CCO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010392718 ISWUINQYNNLHPJ-RYUDHWBXSA-N 339.396 1.780 10 10 EDCE CC(C)(C)OC(=O)NCC1(O)CC(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2010403544 FRIRXTATPRZNHC-VTWZXRTESA-N 339.396 1.563 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])CC(O)C1 2018045641 HHEIXWDAJGVMGG-RWWNRMGGSA-N 339.396 1.706 10 10 EDCE C[C@H](N)c1ccc(N2CCN3C[C@H](O)C[C@H]3C2)cc1Br 405388421 LRBICTBYEKCTLZ-WCFLWFBJSA-N 340.265 1.724 10 10 EDCE O=C(O)[C@H]1CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)C1 2048478002 ILFBLSDZMPXDTG-HNNXBMFYSA-N 330.384 1.470 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)[C@H]1CCC[C@H]1O 709198547 UMISZWKBUMMLFW-UHTWSYAYSA-N 340.221 1.751 10 10 EDCE CN=c1[nH]cc(Br)c(=NCCOc2ccc(N)cc2)[nH]1 2173901575 XSMRSVXAHXMMEA-UHFFFAOYSA-N 338.209 1.198 10 10 EDCE CCCNCc1ccc(N2CC(C(N)=O)C2)cc1Br 382056857 AQUGBFQCZTVYFO-UHFFFAOYSA-N 326.238 1.870 10 10 EDCE CCN(c1ccc([C@H](C)O)c(Br)c1)[C@@H]1CC(=O)NC1=O 2171209464 YHMMIYHACOJCFW-QPUJVOFHSA-N 341.205 1.744 10 10 EDCE CC(C)(C)OC(=O)NC1[C@H]2CN(C(=O)COc3ccc(N)cc3)C[C@H]12 2045668478 REDPZAXDVCGDSK-KBPBESRZSA-N 347.415 1.629 10 10 EDCE OCc1ccc(N2[C@H](CO)C[C@@H]3OCC[C@H]32)c(Br)c1 2090533811 IBAIITOHLWSTID-GDLCADMTSA-N 328.206 1.670 10 10 EDCE O=C(O)CN1CC[C@H](NCc2cc(Br)ccc2O)C1 2113034531 DJPDCHBIFXKCDJ-NSHDSACASA-N 329.194 1.403 10 10 EDCE CC(C)(O)[C@@H]1CN(c2ccc(CN)cc2Br)CCO1 2117534098 QXMPYQZTNKNTLR-ZDUSSCGKSA-N 329.238 1.884 10 10 EDCE COC[C@@H]1[C@@H](O)[C@@H](O)CN1c1ccc([C@H](C)N)c(Br)c1 2234068684 PVLJDVFDKLTYOB-ZLCVWYCYSA-N 345.237 1.026 10 10 EDCE NCc1ccc(N2C[C@@H]3COC[C@@]3(CO)C2)cc1Br 2226162595 DSWJFAUXYQHODO-RISCZKNCSA-N 327.222 1.353 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](O)CC[C@H]1C(=O)NCCCCN=[N+]=[N-] 2246447283 OVKDXZQBADPJJU-RYUDHWBXSA-N 341.412 1.954 10 10 EDCE O=C(O)[C@@]12CO[C@@H](C1)[C@H](NCc1cc(Br)ccc1O)C2 2280799429 RAWCWVXHCZJKIP-SCDSUCTJSA-N 342.189 1.877 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N1CCCC[C@@H]1CN1CCOCC1 2307987162 IHXPSHXRDYOZTD-MRXNPFEDSA-N 346.427 1.824 10 10 EDCE Oc1c(Br)cccc1CNC[C@@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2355465294 XSTITNZOLDXURF-KAEXTRBYSA-N 342.233 1.622 10 10 EDCE Cc1ccccc1N1C(=O)NC(=O)/C(=C/N[C@@H]2NC=CS2)C1=O 100103997 VJSRECGPQIYZJG-GDAGCXPBSA-N 330.369 1.143 10 10 EDCE Cc1cc(C(=O)NC[C@H]2CN3CCN2CC3)c(C)n1-c1ccccc1 178729503 OBKAUZIMXWTJJM-SFHVURJKSA-N 338.455 1.824 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@H](O)[C@H](O)[C@H]2CF)cc1Br 2140663742 PIEOMJKLILKFAE-WXVIEYFRSA-N 334.185 1.382 10 10 EDCE COc1cc([N+](=O)[O-])cc([C@@H]2N[C@H](C(=O)O)C(C)(C)S2)c1O 83236944 ZLUBVFJCYFVRGW-GHMZBOCLSA-N 328.346 1.876 10 10 EDCE C[C@H]1C[C@H](C)N(C[C@H]2SC(=S)N(C3=NCCN3)C2=O)[C@H](C)C1 255973374 GBGCKHIHKBAUFI-WISYIIOYSA-N 340.518 1.683 10 10 EDCE Cc1ccc(C(=O)N2CCC(c3nnc4n3CCC4)CC2)c(O)c1O 366788608 VLIXHUYNHHZLHH-UHFFFAOYSA-N 342.399 1.964 10 10 EDCE Cc1ccc(CN(C)C(=O)[C@@H]2CNC[C@H]2F)c(O)c1Br 2380767121 VAVIBGBPQYAMBN-GHMZBOCLSA-N 345.212 1.979 10 10 EDCE COc1cccc(CNC(=O)N[C@@H](C)C2(S(C)(=O)=O)CC2)c1O 807478171 SABORVPKGYYQJJ-JTQLQIEISA-N 342.417 1.166 10 10 EDCE COC(=O)c1cnc(SC[C@@H]2CCN(S(C)(=O)=O)C2)s1 829677885 PYHZHTKNPOQOTQ-MRVPVSSYSA-N 336.460 1.303 10 10 EDCE Cc1ccc([N+](=O)[O-])c([C@H](C2CCOCC2)N2CCNCC2)c1O 575275855 USFLWULZKMSJAH-INIZCTEOSA-N 335.404 1.982 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1C[C@H]1c1cnc[nH]1 824711902 KXAHUFJZWNZYDM-IAGOWNOFSA-N 340.427 1.791 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CNCC[C@@H]2C)cc1 846173864 UQDFRYSBYQGHGA-YOEHRIQHSA-N 334.464 1.771 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@H](C)Cn2cncn2)cc1 844940123 OMKXZYOOQZGDKH-CQSZACIVSA-N 346.435 1.453 10 10 EDCE NC(=O)[C@H]1C[C@@H](NC(=O)NCc2cccc(Br)c2O)C1 845449646 RNEXHAYRBFLTIV-DTORHVGOSA-N 342.193 1.218 10 10 EDCE O=C(NC[C@H]1CCN1C1CCOCC1)N1Cc2cccc(O)c2C1 927630664 OVVMCMXFEYHYBH-OAHLLOKOSA-N 331.416 1.671 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCC(=O)N(C)C3)C2)cc1 852134343 YAWJDYPWODZFMZ-KBPBESRZSA-N 346.431 1.194 10 10 EDCE COc1ccc(O)c([C@H](C)NC(=O)c2c[nH]nc2[C@@H]2CCNC2)c1 852802143 KTHGXWACPUDGME-WDEREUQCSA-N 330.388 1.692 10 10 EDCE COc1ccc(N(C)Cc2coc(S(N)(=O)=O)c2)cc1OC 851735447 WIRUFALKPVXNKY-UHFFFAOYSA-N 326.374 1.581 10 10 EDCE COC(=O)C12CC(C(=O)N[C@H]3CCN(c4ccc(OC)cc4)C3)(C1)C2 855227281 WXLRIIFREVFLIV-MDAWKPQNSA-N 344.411 1.733 10 10 EDCE C[C@@H](NC(=O)N1CCO[C@H](CC(N)=O)C1)c1ccc(N(C)C)cc1 858368580 MISZLHQZQVTDBR-IUODEOHRSA-N 334.420 1.099 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)c3cccnn3)CC2)cc1 858839918 LTQDQIIXGJXPBC-UHFFFAOYSA-N 341.415 1.037 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC(F)(F)CO)C2)cc1 854298521 DPTHFISNKHAVRE-NSHDSACASA-N 329.347 1.201 10 10 EDCE O=C(NCCc1nc(-c2ccccc2)n[nH]1)c1c(F)ccc(O)c1O 764661959 YTPBMWUWACGIQM-UHFFFAOYSA-N 342.330 1.995 10 10 EDCE CN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)C[C@@H]1CCS(=O)(=O)C1 769469251 VDSVTSYQEAJDMJ-VIFPVBQESA-N 348.808 1.820 10 10 EDCE C[C@H](NC(=O)C(=O)N[C@@H]1CSC1(C)C)c1ccc(N(C)C)cc1 1117729560 OYPGMVPWYJHETA-SMDDNHRTSA-N 335.473 1.940 10 10 EDCE COc1ccc(C(=O)NCc2cc(O)ccc2O)cc1OCCO 1176755273 NWLNKSPLHMYYTC-UHFFFAOYSA-N 333.340 1.408 10 10 EDCE O=C(C(=O)N1CCC[C@@H]1c1cccnc1)N1Cc2cccc(O)c2C1 1335549317 YSOCEQSXYHATOH-MRXNPFEDSA-N 337.379 1.993 10 10 EDCE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC[C@@H](C)OC 1714124933 KMTYNYPNERBNGV-DGCLKSJQSA-N 335.408 1.982 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)[C@H]2CC(=O)N(C)C2)cc1C 1497822275 HCKBMBYJHJJALI-HIFRSBDPSA-N 333.432 1.076 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCNC(=O)C2(CCF)CC2)cc1 1491393531 OJGPVBHZIRKING-UHFFFAOYSA-N 349.366 1.835 10 10 EDCE Cc1occc(=O)c1OCC(=O)NCc1ccc2cccnc2c1O 1643285206 UAASAFNNOOJVKK-UHFFFAOYSA-N 340.335 1.897 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H]2C[C@@H]2C(F)F)cc1C 1732640031 FEQJIIRKWKMUGA-IHRRRGAJSA-N 342.386 1.472 10 10 EDCE Cc1cc(C(=O)Nn2ccc(O)nc2=O)c(C)n1-c1ccccn1 1641662454 GYEDIYWLFYGNBC-UHFFFAOYSA-N 325.328 1.135 10 10 EDCE COCCC(=O)N[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1579748704 USLRCBFBAAFUQS-JTQLQIEISA-N 335.364 1.120 10 10 EDCE C/C=C(\C)C(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1758699090 NURTVCVQNCKXPI-LJNAXZBRSA-N 333.388 1.442 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)c2cnn(C)c2)cc1C 1666848971 CAROQYAEPKBGSM-AWEZNQCLSA-N 330.432 1.987 10 10 EDCE O=C(Cn1cnc2ccsc2c1=O)NCCc1ccc(O)c(O)c1 1860305640 DLHOSWGRBJFAJI-UHFFFAOYSA-N 345.380 1.228 10 10 EDCE CNCc1ccc(N2CC[C@H](NC(C)=O)C2)c(Br)c1 234376364 IZZBBYFRKUPPMD-LBPRGKRZSA-N 326.238 1.883 10 10 EDCE CO[C@](C)(CN)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1952207483 UNBJNKGYPSEWBY-WMLDXEAASA-N 340.420 1.897 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@]1(C(=O)O)c1cc(O)c(O)c(O)c1 1952678685 UZTXYMPHNFGERX-ZUZCIYMTSA-N 325.317 1.423 10 10 EDCE COC(=O)[C@@H]1C[C@@]1(N)c1cc(I)ccc1O 1952776017 SAOYNRPZASRDJO-GZMMTYOYSA-N 333.125 1.344 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)C1(O)CCC1 1987680267 KMFJZZLJIOWNDB-SNVBAGLBSA-N 327.385 1.563 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2C(NC(=O)Cc3ccc(N)cc3)[C@H]2C1 1999122910 SDERZRLPVHPTKQ-KBPBESRZSA-N 331.416 1.793 10 10 EDCE CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CCOCC1 2010401077 AROIHACHIPATNB-NSHDSACASA-N 339.396 1.972 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2COC[C@@]2(C(=O)N2CC(N=[N+]=[N-])C2)C1 2010404947 VWOZTTPBMRTQRH-BMIGLBTASA-N 337.380 1.391 10 10 EDCE C[C@@H](N)c1ccc(N2CC(S(C)(=O)=O)C2)c(Br)c1 2034840155 WRRDVOBRAKOPMD-MRVPVSSYSA-N 333.251 1.702 10 10 EDCE O=C1CN[C@@H](c2cc(Br)cc(Br)c2O)N1 308942803 QXKGVNDJISHGMO-SECBINFHSA-N 335.983 1.635 10 10 EDCE COC[C@H]1CN(c2ccc(CN)c(Br)c2F)CCO1 705818184 FTCNLSNZKYSJLZ-SNVBAGLBSA-N 333.201 1.899 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)cc1Br 2199533681 XIFMLNQOXXTTIK-QWCIBXROSA-N 342.233 1.823 10 10 EDCE COc1ccc(Br)c(CNCc2nc(=O)o[nH]2)c1O 2227751683 PXRRMBBOZOIMCQ-UHFFFAOYSA-N 330.138 1.129 10 10 EDCE CC(C)(C)OC(=O)N1CC(N2CCC[C@H]2C(=O)NCCN=[N+]=[N-])C1 2250169737 PNPUCUGMWOSXTG-LBPRGKRZSA-N 338.412 1.497 10 10 EDCE CN[C@@H]1CCCC[C@H]1S(=O)(=O)NCc1cnc(SC)s1 2284502411 WWHMFKYDBBELMF-GHMZBOCLSA-N 335.520 1.815 10 10 EDCE Cc1c(NC=C2SC(=S)NC2=O)c(=O)n(-c2ccccc2)n1C 2297535167 HYOVIUUCAPAHKZ-UHFFFAOYSA-N 346.437 1.886 10 10 EDCE NCC(F)(F)CNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2310292126 URNVFDOIVYVVFZ-UHFFFAOYSA-N 325.359 1.247 10 10 EDCE O=S1(=O)C[C@H]2CN(Cc3ccc(Br)cc3O)C[C@H]21 2314955701 JVZXQUJABNTFIM-BXKDBHETSA-N 332.219 1.384 10 10 EDCE Cn1nnc(Br)c1N1CCc2cc(O)c(O)cc2C1 2341214870 PXPXMPREOMXWRV-UHFFFAOYSA-N 325.166 1.552 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)c(Br)c1 2355335599 DFDFXLNKVFYRGG-VWQNXBSZSA-N 341.249 1.789 10 10 EDCE COCCN(CCO)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255345448 ZPJPFQXLLYTDMQ-DAXSKMNVSA-N 334.416 1.004 10 10 EDCE COc1ccc(N2CCN(C(=O)/C=C/c3cnccn3)CC2)cc1F 267986656 PVFNXRSBFQNFOC-GORDUTHDSA-N 342.374 1.986 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCCC[C@@H]2[C@H]2CNC(=O)C2)c1O 373209241 KIDNSVISXZCJFC-CHWSQXEVSA-N 349.387 1.800 10 10 EDCE Cc1ccc(C(=O)NC[C@@H]2CCC3(CCOCC3)[C@@H]2O)c(O)c1O 283753757 ZONCXTWBVORDFH-BLLLJJGKSA-N 335.400 1.704 10 10 EDCE C[C@@H]1CC[C@H]1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 805864054 OTJWHMHXROYVQD-FRFSOERESA-N 344.459 1.986 10 10 EDCE C[C@H](C[S@@](C)=O)N(C)c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 398920866 LHTZIARHPNXUCW-MINIFFCBSA-N 326.374 1.896 10 10 EDCE CN(C)c1ccc(CNC(=O)c2c3n(c(=O)n2C)CCCC3)cc1 822226719 DSDVTDYOPQKUDX-UHFFFAOYSA-N 328.416 1.519 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)Nc3nnn(C)c3C)C2)cc1 823804270 LYLHYKVMOQXXAW-LBPRGKRZSA-N 330.392 1.533 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)/C=C\c2cnccn2)c2ccccc2O1 491118201 KQMDYCGDGGQXMS-XHPSBEMXSA-N 325.324 1.457 10 10 EDCE CN1CCCc2cc(CNC(=O)COC3CCC(N)CC3)ccc21 827914117 XLFUBMHTAVWMKS-UHFFFAOYSA-N 331.460 1.972 10 10 EDCE CN1CCCC[C@H]1CN1CCN(C(=O)Cc2ccc(N)cc2)CC1 828932228 NVEWZYLGOGEYNB-SFHVURJKSA-N 330.476 1.440 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CN(C)C(=O)[C@@H]1C 826979253 KKSXVMHUDUYFGM-KGLIPLIRSA-N 332.448 1.822 10 10 EDCE Cc1ccc(O)c([C@@H](C)NCCS(=O)(=O)N=S(C)(C)=O)c1 903228408 ZJAMSAHCRAFRKP-LLVKDONJSA-N 334.463 1.409 10 10 EDCE Nc1ccc(CNC(=O)[C@H]2CSCN2C(=O)C2CCCC2)cc1 837302890 LIYPQHOTHWAIMT-OAHLLOKOSA-N 333.457 1.977 10 10 EDCE Cc1nccc(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)n1 585334373 DVAYFFURJSTBBM-UHFFFAOYSA-N 330.344 1.275 10 10 EDCE CCN1C(=O)[C@H]2CN(C/C=C\c3ccc(N(C)C)cc3)CCN2C1=O 835027974 FRMOZULLIRHHTM-KEGWNNHHSA-N 342.443 1.734 10 10 EDCE Nc1ccc(NC(=O)C(=O)N2CCCC[C@H](N3CCCC3)C2)cc1 841032643 INWQRURRVWZTAR-INIZCTEOSA-N 330.432 1.684 10 10 EDCE Cn1ccc(N2CCC[C@H](N3CCCc4cc(CN)ccc43)C2=O)n1 844218939 GBQAYTXUHHUTBE-KRWDZBQOSA-N 339.443 1.827 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(COC(=O)/C=C/C3CC3)nc12 745556084 YGEJIZOVSBBQMS-AATRIKPKSA-N 331.328 1.621 10 10 EDCE CCOC(=O)c1cc(NS(=O)(=O)C[C@H](OC)C2CC2)ccc1O 842586632 OUECRTUHRBMATL-AWEZNQCLSA-N 343.401 1.736 10 10 EDCE CO[C@@]1(CO)CCCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1 853411320 GFRSGAFDWPEKFP-IBGZPJMESA-N 347.459 1.970 10 10 EDCE C[C@]1(C2CC2)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 853766176 PWVHFINTGROEMJ-MRXNPFEDSA-N 333.344 1.931 10 10 EDCE O=C(NCc1c(O)cccc1F)NC[C@@H]1CCCCS1(=O)=O 921906503 COUHLZLPRUQWFF-JTQLQIEISA-N 330.381 1.298 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](O)Cc3ccccc3)C2)cc1 855223376 GESIXOYKPABHIO-LPHOPBHVSA-N 340.423 1.994 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](c1cncn1C)N(C)C 935945589 CXCMHIVKQNIRAY-HNNXBMFYSA-N 337.420 1.531 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)C3CCN(OC)CC3)C2)cc1 868954703 BDGHYFDDIDVFPH-OAHLLOKOSA-N 347.459 1.911 10 10 EDCE CCNC(=O)N1CC[C@@H](NC(=O)NCc2cc(OC)ccc2O)C1 761688274 DRMACXVGIQTLJN-GFCCVEGCSA-N 336.392 1.004 10 10 EDCE CCOc1ccc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)c(O)c1 768235238 YQQLCLYFACEIJI-INIZCTEOSA-N 348.443 1.862 10 10 EDCE CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)N1Cc2cccc(O)c2C1 871204733 JDTOWMFWUSZDIG-OAHLLOKOSA-N 338.429 1.341 10 10 EDCE O=c1n(Cc2ccc(N3CCOCC3)cc2)nnn1-c1ccccc1 877874017 HLHRIPQTCFWVFW-UHFFFAOYSA-N 337.383 1.314 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H](C(=O)N2CCCC2)C1 779517348 QBCFXXAHLKBBAM-PMGBHYCQSA-N 344.411 1.972 10 10 EDCE CCOC(=O)[C@]1(C)CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCO1 871224281 HAFNUJJEQCLNKQ-UABRLCRWSA-N 335.356 1.292 10 10 EDCE COc1ccc(O)c(CNS(=O)(=O)c2cnn(CC3CC3)c2)c1 777967922 PVOWIRCNLWEIBI-UHFFFAOYSA-N 337.401 1.486 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2C[C@H](O)C[C@H]2C1 898436649 HDRPDDQIQIXTPJ-WDEREUQCSA-N 334.397 1.204 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)C3CN([C@H]4CCOC4)C3)C2)cc1 898580110 BSRCJFNLSJUZQB-RDJZCZTQSA-N 345.443 1.111 10 10 EDCE COc1cc(CN2CC(O)(c3ncnn3C)C2)c(O)c(C(C)(C)C)c1 895617213 XWZATFRDDXHHTL-UHFFFAOYSA-N 346.431 1.530 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(O)cn1 1136960867 GXLPNUSDUMSQCL-UHFFFAOYSA-N 341.411 1.926 10 10 EDCE Cc1noc([C@@H](C)N(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)n1 1329436953 RMUQKEPDMYSFLK-SECBINFHSA-N 330.344 1.145 10 10 EDCE COc1cc(O)c(CNCC[C@H]2CCCS2(=O)=O)cc1OC 1332725837 VSIPSIFGXHXYHL-GFCCVEGCSA-N 329.418 1.466 10 10 EDCE C[C@H](NC(=O)N1C[C@@H](CO)[C@H](CCO)C1)c1ccc(N(C)C)cc1 1346411277 GQSILQRCEWQWLS-IMJJTQAJSA-N 335.448 1.446 10 10 EDCE O=C(Cc1cccc(F)c1)NCC(=O)N1Cc2cccc(O)c2C1 1455036866 KQHLPYSWHSKANC-UHFFFAOYSA-N 328.343 1.732 10 10 EDCE CCN1CCN(C[C@@H](C)CNC(=O)Cc2ccc(O)c(O)c2)CC1 1464886800 HRFOMTRXXDSUCK-AWEZNQCLSA-N 335.448 1.030 10 10 EDCE CC[C@@H](F)C(=O)NC[C@@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1705230777 PBVOFDCSGSGLJD-QWHCGFSZSA-N 349.366 1.928 10 10 EDCE O=C(Cn1c(O)nnc1O)NCc1cc(Cl)cc(Cl)c1O 1629137053 UXCJBSXBYQGFMT-UHFFFAOYSA-N 333.131 1.018 10 10 EDCE C[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CCS1(=O)=O 1556184413 RBGNWAQZDCAZEQ-SNVBAGLBSA-N 338.389 1.498 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCO[C@@]3(CCCOC3)C2)cc1 1635177263 CCCLUMJXTISNOF-INIZCTEOSA-N 332.360 1.871 10 10 EDCE CCOCC(=O)N[C@H](CC)CNC(=O)c1ccc(N=NC(N)=O)cc1 1721478904 IHTNDVAMTUBHQK-GFCCVEGCSA-N 349.391 1.510 10 10 EDCE CN1CCCc2cc(CNC(=O)C3=CS(=O)(=O)CCC3)ccc21 1631322996 VWCNSXNZRCRTRQ-UHFFFAOYSA-N 334.441 1.778 10 10 EDCE COC[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(C)C 1639184595 ZADQKSLMYKJQGJ-NSHDSACASA-N 344.433 1.412 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 1631915276 RNZWWRSXAIXNLZ-SQYJXRJJSA-N 341.363 1.762 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2[nH]c(C)cc2C)cc1C 1568568134 SXNYNPRBLXHCQI-MRXNPFEDSA-N 345.443 1.829 10 10 EDCE COCCC(=O)N[C@@H](C)CN(C)C(=O)c1ccc(N=NC(N)=O)cc1 1572269714 MHBYKTPQBVFCKG-NSHDSACASA-N 349.391 1.462 10 10 EDCE CNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)c2ccccc2O)c1 1642827867 SXYQFTFQSZOMKE-NSHDSACASA-N 334.397 1.791 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1CCCC(=O)N(C)C 1742755202 YZKFYJLXMPFYRF-UHFFFAOYSA-N 331.420 1.797 10 10 EDCE O=C(NC1CCN(C(=O)c2ccco2)CC1)c1cc(O)c(O)c(O)c1 169859633 CSNZKHNAEFTXIP-UHFFFAOYSA-N 346.339 1.431 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1[C@H](N)Cc1ccc(O)c(O)c1 1953010005 TXMVQKWLVILPJP-OLZOCXBDSA-N 338.404 1.604 10 10 EDCE CO[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 2010169392 DAHKNHCQBMAPGX-BXUZGUMPSA-N 338.404 1.937 10 10 EDCE CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)CCCN=[N+]=[N-] 2010406200 QZTMHYPFXPAJHS-JTQLQIEISA-N 343.384 1.602 10 10 EDCE CN(Cc1nc(=NCc2ccc(N)cc2)[nH][nH]1)C(=O)OC(C)(C)C 2012985717 MLUILGYTXWAACT-UHFFFAOYSA-N 332.408 1.788 10 10 EDCE CC1(NC(=O)c2cc(O)c(O)c(O)c2)CN(C(=O)OC(C)(C)C)C1 2015120110 PLGSTQNSNPRGAN-UHFFFAOYSA-N 338.360 1.543 10 10 EDCE Oc1ccc(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)c(O)c1 702605751 WHCJPNREZCDXNS-IBGZPJMESA-N 328.412 1.824 10 10 EDCE C[C@@H]1CC(=O)NCCN1c1cc(Br)c(CN)cc1F 687900151 URCGOAANXNDCLG-MRVPVSSYSA-N 330.201 1.762 10 10 EDCE CC[C@H](CO)N(C)c1cc2c(cc1Br)[C@@H](NC)C(=O)N2 380809923 MQVJDURIOGHRIO-AMIZOPFISA-N 342.237 1.869 10 10 EDCE C[P@]1(=O)C[C@H](O)[C@@H](NCc2ccc(Br)cc2O)C1 2057717506 FSAZETFEEOTBFP-KWFDTGPKSA-N 334.150 1.980 10 10 EDCE CN1C[C@@H]2C[C@H]1CN2c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2187589474 YRVRMHFOVODCJC-UVPNAGLESA-N 337.221 1.294 10 10 EDCE CNCc1ccc(N2CCCC2(CO)CO)c(Br)c1 2089863777 MZLAQAJANCHBDJ-UHFFFAOYSA-N 329.238 1.492 10 10 EDCE NCc1ccc(N2CC(N3CCOCC3)C2)c(Br)c1 2113196846 KLKJIZUFGTZSKL-UHFFFAOYSA-N 326.238 1.429 10 10 EDCE COc1ccc(N2CC[C@@H](O)[C@H](CO)C2)c(OC)c1Br 2234903069 OSVYTGOYPAJDKM-GXSJLCMTSA-N 346.221 1.646 10 10 EDCE NCc1cc(F)c(N2CC[C@@H](O)[C@H](O)CC2)cc1Br 2269146937 BPZFETSEUJONKQ-CHWSQXEVSA-N 333.201 1.369 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@]2(C(=O)N3CC(N=[N+]=[N-])C3)CO[C@H]1C2 2298336788 ZPPJFHARKLOYFL-ZIBATOQPSA-N 337.380 1.580 10 10 EDCE CC(C)(C)OC(=O)N[C@@]1(C(=O)NCCN=[N+]=[N-])C[C@@H]2OCCC[C@@H]21 2298661624 LUTRSIFQOQKSCS-PGUXBMHVSA-N 339.396 1.875 10 10 EDCE CN[C@H](C)c1ccc(N2CC([C@H](O)CO)C2)c(Br)c1 2336781729 YFJGOYDBBVHRAN-YMTOWFKASA-N 329.238 1.519 10 10 EDCE COCCNC(=O)Cn1cc(N[C@@H](C)c2cc(C)ccc2O)cn1 186498161 BWAFEBHFKKQZQS-ZDUSSCGKSA-N 332.404 1.833 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc2c(c1)ncn2C 186443237 PQIMZLHXWVEKGM-SNVBAGLBSA-N 326.356 1.741 10 10 EDCE Cc1cnn(C[C@@H]2CN(C(=O)c3ccc(C)c(O)c3O)CCO2)c1 182430720 VQSBUJSPUAWAMI-ZDUSSCGKSA-N 331.372 1.452 10 10 EDCE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@H]2CNC[C@H]2O)c1C 262382350 XDYBWDKWOADTJS-CRAIPNDOSA-N 327.428 1.713 10 10 EDCE CNC(=O)CCCC(=O)NCc1cc(Br)ccc1O 804737005 IDPIYPLNZVOPFO-UHFFFAOYSA-N 329.194 1.687 10 10 EDCE COc1ccc(N2CCN(C(=O)c3cnn4c3CCC4)CC2)cc1 294280126 HHQLWPGHOYSSFR-UHFFFAOYSA-N 326.400 1.800 10 10 EDCE O=C(NCc1ccccc1O)N[C@@H]1CCCN(c2ncccn2)C1 299506206 MTGRGNBWLLQHQO-CQSZACIVSA-N 327.388 1.650 10 10 EDCE CC1(C)CN(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 816890938 CPMGYMDZQFRBCH-UHFFFAOYSA-N 349.450 1.745 10 10 EDCE CCN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1ccccc1C 491186794 QJYNYXWWFYLEDJ-ZHACJKMWSA-N 327.384 1.459 10 10 EDCE O=C(CCOC1CNC1)N(Cc1ccccc1O)C[C@H]1CCCO1 829003503 OSXLQZOLFYIJTL-OAHLLOKOSA-N 334.416 1.278 10 10 EDCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)C[C@H](OC)C2CC2)c1 827195302 YPUJATFBDWUBCR-BMIGLBTASA-N 329.418 1.806 10 10 EDCE CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1cscn1 584467351 IONKBLAVLIHOLG-UHFFFAOYSA-N 325.415 1.797 10 10 EDCE COc1c(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cnn1C 839580548 ZLKCAUXIMTXECG-ZDUSSCGKSA-N 344.415 1.756 10 10 EDCE O=C(OCC(=O)N1CCO[C@H]2CCCC[C@H]21)c1cc(O)cs1 732355116 DGLVODGZOBPFGJ-NEPJUHHUSA-N 325.386 1.781 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCN(CCO)C[C@@H]2C)cc1 837724450 HRIJEOJHCYLHQY-INIZCTEOSA-N 348.491 1.741 10 10 EDCE CCO[C@@H]1[C@@H](C)[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 912709654 RNHSAHXYSFKGLF-DOPJRALCSA-N 332.444 1.935 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CN3CCCCCC3=O)C2)cc1 855230342 VNGXOPVLOVOOGT-HNNXBMFYSA-N 345.443 1.793 10 10 EDCE CC(C)NC(=O)[C@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 853602295 QRCRYEXAIDNPQO-LRDDRELGSA-N 334.416 1.555 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H]([C@H](C)O)C3)C2)cc1 854298559 FSQYGRKYYAKCAY-ZNMIVQPWSA-N 333.432 1.686 10 10 EDCE COCCCOCCC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855222931 DJDJRLNRVCLCQB-HNNXBMFYSA-N 336.432 1.833 10 10 EDCE C[C@@H](CN(C)CCCN(C)C)NCc1ccc(N2CCOCC2)cc1 850353628 IYLYGHPQHXNQNM-SFHVURJKSA-N 348.535 1.885 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)CO[C@@H]3CCCNC3)C2)cc1 852900653 OOSYFYWKSCUUKH-RHSMWYFYSA-N 333.432 1.159 10 10 EDCE CCOC(=O)[C@H](CC(=O)NCc1ccc2cccnc2c1O)C(C)=O 862026517 QXOIJXPDEHFQIB-CQSZACIVSA-N 344.367 1.715 10 10 EDCE C[C@H]1CN(S(=O)(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C[C@@H](C)O1 773086597 DXEGYVLACHPNHO-MJBXVCDLSA-N 341.477 1.757 10 10 EDCE O=C(NCCOCC(=O)N1Cc2cccc(O)c2C1)c1ccccc1 871203447 AKKPORZTCVAIPY-UHFFFAOYSA-N 340.379 1.681 10 10 EDCE COc1cc(OC)nc(C(=O)NCc2ccc(N(C)C)cc2C)n1 1126004878 PMKSNSCDTWGUKW-UHFFFAOYSA-N 330.388 1.798 10 10 EDCE CN(C)c1ccc([C@@H](CNC(=O)N[C@@]23COC[C@@H]2C3)N(C)C)cc1 899098029 KQVXZFUJFUUNPQ-LESCRADOSA-N 332.448 1.443 10 10 EDCE C[C@@H]1C[C@]2(CCO1)CN(Cc1cc3c(cc1O)OC[C@H]3O)C[C@@H](C)O2 797418372 RZZCQGYPNKNSDE-FYMGVEODSA-N 349.427 1.976 10 10 EDCE Cc1cc(O)c(CN2CCC(O)(COCCO)CC2)c(Cl)c1 895830536 WTMOGWIPAZQXAD-UHFFFAOYSA-N 329.824 1.690 10 10 EDCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1nnc(O)nc1O 1136025291 FGXAYPIUVXJLET-UHFFFAOYSA-N 329.360 1.155 10 10 EDCE CCC(CC)[C@@H](C(=O)NCc1cc(O)ccc1O)N1CCOCC1 1153886137 XPOBUDNNFKMUCS-KRWDZBQOSA-N 336.432 1.851 10 10 EDCE Cc1cccc(N2C(=O)NC(=O)/C(=C\Nc3c(C)n[nH]c3C)C2=O)c1 1084381771 JYFNUNKWEFRXNS-MDWZMJQESA-N 339.355 1.914 10 10 EDCE COc1ccc(Br)c(CNCc2nnc(C)n2C)c1O 1964043661 RXIGRNFINKDJRT-UHFFFAOYSA-N 341.209 1.890 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)Cc2ccoc2)cc1C 1320213650 IKVODRYZOQGGFE-INIZCTEOSA-N 332.400 1.406 10 10 EDCE C[C@@H](NCc1c(O)cccc1Br)C(=O)N1CCOCC1 706843365 SZDOANWRPIAYCC-SNVBAGLBSA-N 343.221 1.492 10 10 EDCE COc1ccc(CNCCN(CCO)C(=O)c2ccn(C)c2)cc1C 1279687612 SXIURCWDJVHBSI-UHFFFAOYSA-N 345.443 1.566 10 10 EDCE Cc1ccnc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)c1 1445527749 FHCYLWDKAVCKIS-UHFFFAOYSA-N 327.384 1.693 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](OC)C(=O)OC(C)(C)C 1467840140 JEFIVTXKXZORRF-CQSZACIVSA-N 344.404 1.851 10 10 EDCE O=C1NC[C@]2(CCN(Cc3ccc(Br)cc3O)C2)N1 2121193947 CJVMIKVBFTXRMO-ZDUSSCGKSA-N 326.194 1.412 10 10 EDCE Cc1cc(C)n(CC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(=O)n1 1467260872 VPUAWBBMRUGFRF-AWEZNQCLSA-N 328.416 1.804 10 10 EDCE O=C(CN1C(=O)c2ccccc2C1=O)NCc1cccc(Cl)c1O 1472316331 NFBSEOUXIMVWRC-UHFFFAOYSA-N 344.754 1.958 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN(C[C@@H]2CCCO2)CC1 1628307352 SQMMYAWRURYHNQ-HNNXBMFYSA-N 334.416 1.400 10 10 EDCE O=C(Nc1ccc(S(=O)(=O)CCO)cc1)c1cccc(O)c1O 1631335550 RYXPYRRXNUSZEZ-UHFFFAOYSA-N 337.353 1.116 10 10 EDCE C[C@@H](NC(=O)c1ccc(S(C)(=O)=O)cc1N)c1ccccc1O 1635799097 OSDKSCGUCOVNTN-SNVBAGLBSA-N 334.397 1.869 10 10 EDCE COc1ccc(CN[C@H](C)CCNC(=O)[C@H]2CCC(=O)N2)cc1C 1491992539 XHRUWLWVRQXNCC-UKRRQHHQSA-N 333.432 1.267 10 10 EDCE COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)c2cnc(O)n2C)cc1C 1725132774 MIJLONXZWSJIHD-QWHCGFSZSA-N 346.431 1.739 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)NCc1nc(C2CCOCC2)n[nH]1 1635254620 IQWCVGMIEQKJIA-DUXPYHPUSA-N 344.371 1.440 10 10 EDCE O=C(CCNC(=O)c1ccc(F)cc1)NCc1cc(O)ccc1O 1644752804 VKEBYRBFNMYLEG-UHFFFAOYSA-N 332.331 1.673 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@@H](CNC(=O)CC3CC3)C2)cc(OC)n1 1736059408 NQEYUCQKEVXWMO-XBXGTLAGSA-N 347.415 1.524 10 10 EDCE COc1ccc(-n2nnnc2CN(C)[C@@H](C)CNC(=O)C(C)C)cc1 1674896920 ZMFANEQDAKPXQQ-ZDUSSCGKSA-N 346.435 1.263 10 10 EDCE NC(=O)C[C@H](C(=O)O)N1C(=O)/C(=C\c2ccsc2)SC1=S 1858590471 RYJVQEQNJDEDDN-KOERYYGSSA-N 342.423 1.278 10 10 EDCE CCN(CC)c1ccc(/C=c2\sc3nc([C@H](C)N)nn3c2=O)cc1 1857924726 PJHMIAZHMUPRHS-HKLRHMNMSA-N 343.456 1.565 10 10 EDCE CC(=O)C(=O)C1(O)[C@H]2CSC[C@H]1CC(NC(=O)OC(C)(C)C)C2 1901968225 GLPVYPJHIVNQGC-YGNMJOSFSA-N 343.445 1.542 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](CO)[C@@H](CCO)C2)c(Br)c1 2149912511 DKSXBNDNUFDIQM-DRZSPHRISA-N 343.265 1.896 10 10 EDCE COC[C@H]([C@@H](N)Cc1ccc(O)c(O)c1)N(C)C(=O)OC(C)(C)C 1952908316 CMRVLHUQDDQQOJ-QWHCGFSZSA-N 340.420 1.850 10 10 EDCE CCNCc1ccc(N2C[C@@H](CO)C[C@H]2CO)cc1Br 2146073998 VCVWEKAAEGSPDZ-FZMZJTMJSA-N 343.265 1.738 10 10 EDCE CC(C)(C)OC(=O)N1C[C@]2(C(=O)C(=O)C[C@H]3C[C@H](N)C3)C[C@@]2(C)C1 2003166199 DHZQSCRNAJDHRA-BMEPFDOTSA-N 336.432 1.899 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CO)CNC(=O)CCc1ccc(N)cc1 2011517367 YQCHJOSIUXGEQX-CQSZACIVSA-N 337.420 1.203 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCC2(CN=[N+]=[N-])CC2)C1 2011939038 HDTRJBGEJDBFIW-OAHLLOKOSA-N 339.396 1.565 10 10 EDCE O=C(O)C[C@H](COCc1ccccc1)NC(=O)c1ccc(O)c(O)c1 2035473337 MNKUNROBWRMUJE-CQSZACIVSA-N 345.351 1.888 10 10 EDCE CN(c1ccc(CN)c(Br)c1F)C1CC(C(N)=O)C1 703527682 CNICXXLKHLXFEX-UHFFFAOYSA-N 330.201 1.747 10 10 EDCE OCCN[C@@H]1CCCN(Cc2c(O)cccc2Br)C1 708612866 OEUKQXREBNTJKD-LLVKDONJSA-N 329.238 1.701 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCCn3ccnc3C(C)C)c2n1 2062161950 JUUGUSNBMHHEQQ-UHFFFAOYSA-N 328.376 1.493 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC(OC4CCC4)CC3)c2n1 2062216480 NDGCNTFSTKGHIZ-UHFFFAOYSA-N 330.388 1.917 10 10 EDCE O=C(Nc1nc(O)nc(O)c1Br)c1ccc(O)c(O)c1 2182324582 MHVSWGYREWJNLC-UHFFFAOYSA-N 342.105 1.314 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCCN=[N+]=[N-])C[C@H](O)C1(C)C 1909748586 QWHVHGZKACOUSE-BONVTDFDSA-N 341.412 1.857 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2205602375 UEOTVNLBCAGXMR-AIUZOBBOSA-N 347.228 1.609 10 10 EDCE COc1ccc(Br)c(CNC[C@H]2COC[C@H]2O)c1O 2227749973 HYOQZNSUFLMTLG-GZMMTYOYSA-N 332.194 1.260 10 10 EDCE CNC(=O)c1cncc(C=CC(=O)N(C)c2cccnc2N(C)C)c1 2297813661 NZMVRVQIQZJDPC-UHFFFAOYSA-N 339.399 1.578 10 10 EDCE CCN(CC(=O)NCc1ccc(N(C)C)cc1)CC(=O)NC(C)C 7355692 QJQOTNFIXNFWOV-UHFFFAOYSA-N 334.464 1.215 10 10 EDCE Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N(C)C)c(O)c1O 179489346 MSTPZPCDPJJIOF-OAHLLOKOSA-N 342.395 1.836 10 10 EDCE CCOc1cccc(CN2CCC[C@H](CS(N)(=O)=O)C2)c1O 271182290 MNAZDAPMKIUIBV-LBPRGKRZSA-N 328.434 1.291 10 10 EDCE CN(C)c1ccc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)cc1F 289369385 LGRLKJZEYJAOOO-CQSZACIVSA-N 343.468 1.748 10 10 EDCE Fc1cc(CNCc2cn3cccnc3n2)ccc1N1CCOCC1 298466232 OROFLFFKCOTPJA-UHFFFAOYSA-N 341.390 1.995 10 10 EDCE CC(=O)C(=O)COC(=O)CCc1nc(O)c2c3c(sc2n1)CCC3 808492827 HCSCWRKGHFFJRY-UHFFFAOYSA-N 348.380 1.520 10 10 EDCE CN1CC2(CN(Cc3cc(Br)ccc3O)C2)OC1=O 817414147 TVESIGOLHPYDHW-UHFFFAOYSA-N 327.178 1.791 10 10 EDCE O=[N+]([O-])c1cc([C@@H](CC(F)(F)F)N2CCNCC2)cc(O)c1O 575287655 JYXQTIKQTVPZHG-SNVBAGLBSA-N 335.282 1.905 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@H](O)C3)cc1Br 2133921659 YCGLKCYBBGONCR-DEQVHRJGSA-N 327.222 1.371 10 10 EDCE CC/C(C)=C/C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 822620980 GJQNMMGVZZMCKI-WYMLVPIESA-N 336.457 1.894 10 10 EDCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC[C@@]2(O)C[C@H]2C1 823518998 DTOBQZOEVNUYPR-HNAYVOBHSA-N 345.443 1.314 10 10 EDCE c1cc(N2CCOCC2)ccc1Cn1cc(C[C@@H]2CCNC2)nn1 900605641 URALRNZGIWXCBF-INIZCTEOSA-N 327.432 1.315 10 10 EDCE CN(C)CCN1CCN(Cc2ccc3ccccc3c2O)CC1=O 846014014 PANLRBHNHSJTSL-UHFFFAOYSA-N 327.428 1.751 10 10 EDCE C[C@@]1(CCNC(=O)C(=O)NCCc2ccc(N)cc2)C[C@@]1(F)Cl 846345524 YHTDQRQIIANYQW-CVEARBPZSA-N 341.814 1.748 10 10 EDCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cn2c(n1)CCC2 843907787 AUBUAAUIWQAFDK-UHFFFAOYSA-N 343.383 1.740 10 10 EDCE COC(OC)[C@H](C)NC(=O)NCc1cc(Br)ccc1O 923655002 NIEPFVHEMSYIBG-QMMMGPOBSA-N 347.209 1.961 10 10 EDCE CCC[C@H](C)[C@@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 846359022 GFSOVGKYVRINSR-GXFFZTMASA-N 344.433 1.291 10 10 EDCE COC(=O)CN(CCO[C@@H]1CCOC1)Cc1cc(Cl)ccc1O 929974799 AYLNPDMLWNDXEW-CQSZACIVSA-N 343.807 1.826 10 10 EDCE O=C(c1cccc(O)c1O)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 856614786 YGNUBZBHLBKTDR-QWHCGFSZSA-N 341.367 1.088 10 10 EDCE COc1ccc(N2CCCN(C[C@H]3CC4(CNC4)CO3)CC2)cc1 923321312 CAZHYZXDDOHSIX-GOSISDBHSA-N 331.460 1.586 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NC(C)(C)CN(C)C)C2)cc1 854296837 HBGDZVFKMZQCFP-AWEZNQCLSA-N 334.464 1.913 10 10 EDCE C[C@@H]1OCCO[C@@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 929537533 OTHXIPGMHWYVSN-YOEHRIQHSA-N 334.416 1.286 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2CCOC[C@H]2CCO)cc1 758385954 ZDGQYVKAHUCDHS-QGZVFWFLSA-N 335.448 1.826 10 10 EDCE C[C@@H](O)c1ccc(N2CCN(C)C[C@@H]2CO)cc1Br 699437771 ZDDFXMULPJSDCV-ZYHUDNBSSA-N 329.238 1.615 10 10 EDCE C[C@H]1CC[C@@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CN1 861652667 JVLQCPAGKWALIW-GOEBONIOSA-N 346.475 1.587 10 10 EDCE Cc1ccc(C(=O)NC[C@@](C)(O)CO)cc1-n1c(C)cc(C=O)c1C 861486361 VJKMOCPTOFIAFF-LJQANCHMSA-N 344.411 1.688 10 10 EDCE CN1CCC[C@H]2CN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC[C@@H]21 1118953522 UCUNETHRAFHEIL-HOCLYGCPSA-N 343.427 1.177 10 10 EDCE O=C(c1ccc(CN2CCOCC2)cn1)N1Cc2cccc(O)c2C1 871205603 VQOUGORKYKSMBS-UHFFFAOYSA-N 339.395 1.775 10 10 EDCE Cc1cc(CN2C[C@@H](C(N)=O)[C@H](C(N)=O)C2)ccc1N1CCCCC1 878972139 GTEYTZSXRVOGJV-HZPDHXFCSA-N 344.459 1.004 10 10 EDCE COc1cccc(CNC(=O)Cn2ncc3cc(C)cnc32)c1O 1137473251 DEBVTOPFHXUTJP-UHFFFAOYSA-N 326.356 1.770 10 10 EDCE CS(=O)(=O)[C@@H]1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 897670742 HVKKXKQBWGAQFX-SECBINFHSA-N 341.410 1.572 10 10 EDCE O=C(NCCCSc1nccs1)C1CN([C@H]2CCOC2)C1 896333315 FQQZFKMCIYLWGB-LBPRGKRZSA-N 327.475 1.462 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 1150771312 SKRJBIRBUTVYFR-HZPDHXFCSA-N 348.443 1.524 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCO[C@H]1c1ccc(O)nc1 1302327797 CHRVBUVJBINNPJ-PXAZEXFGSA-N 330.340 1.387 10 10 EDCE CCc1ccc(S(C)(=O)=O)cc1C(=O)NCc1c(O)cccc1O 1178912651 VSYMMUWTIAJIAE-UHFFFAOYSA-N 349.408 1.994 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@H]1CCN(C(=O)c2ccccc2)C1 1176755424 OYZNDTDBIQKPIA-AWEZNQCLSA-N 340.379 1.876 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(CCC(=O)NCCN=[N+]=[N-])CCOC1 1965101872 INPDVAWWNBTNDJ-CQSZACIVSA-N 327.385 1.877 10 10 EDCE CC(C)c1nc([C@@H]2COCCN2C(=O)Cc2ccc(O)c(O)c2)no1 1556161823 YOOGNUHOAWOQHG-LBPRGKRZSA-N 347.371 1.747 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)c1cc(-n2ccnc2)ccc1O 1622753186 KTKSXKXRBHYWDX-UHFFFAOYSA-N 339.351 1.962 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCCc2ccc(O)c(O)c2)s1 1636022866 RUTIFRDJOKTQOA-UHFFFAOYSA-N 341.410 1.535 10 10 EDCE CNC(=O)c1ccc(C(=O)NCc2ccc3cccnc3c2O)cn1 1638573400 VSYDQBKAHFJKHY-UHFFFAOYSA-N 336.351 1.625 10 10 EDCE Cc1ccc(C(=O)NCc2nc(-c3ccccn3)n[nH]2)c(O)c1O 1569078626 UMUYWUPZTRTURU-UHFFFAOYSA-N 325.328 1.516 10 10 EDCE O=C(NCc1c(O)cccc1O)c1ccc2c(c1)C(=O)NCCO2 1647291237 VBIQBGGJJJVMPR-UHFFFAOYSA-N 328.324 1.150 10 10 EDCE COC(=O)c1ccc(CNC(=O)c2ccc(N=NC(N)=O)cc2)cn1 1587351117 IQGJEZWREVEDQW-UHFFFAOYSA-N 341.327 1.961 10 10 EDCE CC[C@@H]1C[C@H]1C(=O)NCC[C@@H](C)NC(=O)c1cc(OC)nc(OC)c1 1688277863 BJLFZBCPWHQVOP-YRGRVCCFSA-N 349.431 1.770 10 10 EDCE CC[C@H](OC)C(=O)N[C@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1688152971 CCHZYBOEEFTEGU-MFKMUULPSA-N 349.391 1.509 10 10 EDCE C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(N)cc1 160347231 YGZYSPWAVCDRRY-SNVBAGLBSA-N 328.328 1.934 10 10 EDCE NC(=O)[C@H]1CCC[C@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)C1 155400481 DPESZSSSTBOTPD-HOTGVXAUSA-N 342.443 1.906 10 10 EDCE CC(=O)C(=O)[C@]1(O)C[C@H]2CC[C@H]1C[C@]2(C)NC(=O)OC(C)(C)C 1905174219 CSQVACWLDWHMGC-YIFBXAAPSA-N 325.405 1.979 10 10 EDCE C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1(NCCN=[N+]=[N-])C(N)=O 1949744193 JSTVGRYKWBNUMU-ZIAGYGMSSA-N 330.436 1.898 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(C(=O)O)C1(c2cc(O)nc(O)c2)CC1 1952432326 XJBBHAHBDYRRGM-HNNXBMFYSA-N 338.360 1.892 10 10 EDCE C[C@@H]1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)CC[C@H]1O 253209613 ZDJJWGCNNXJVNX-KEMBBXRSSA-N 340.221 1.608 10 10 EDCE C[C@@H](N)c1ccc(N2CC[C@H](OCC(N)=O)C2)cc1Br 2145374765 GVJAQKFIMKPNIJ-KOLCDFICSA-N 342.237 1.549 10 10 EDCE C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1985100563 HQACDKHLXRGAAT-MXWKQRLJSA-N 327.385 1.562 10 10 EDCE CCn1nnc(Br)c1[C@H](O)[C@@H](NC)c1ccccc1O 2156519834 FYKPAMDTRQOSEL-CMPLNLGQSA-N 341.209 1.760 10 10 EDCE NC(=O)C1CCN(C2=NC(=O)C(=Cc3ccc(F)cc3)S2)CC1 2053493989 JZYHQKCRWYMLPR-UHFFFAOYSA-N 333.388 1.993 10 10 EDCE CCN(c1ccc(CN)c(Br)c1)[C@@H]1CCS(=O)(=O)C1 387170323 AJJGKXNUQPRXNI-GFCCVEGCSA-N 347.278 1.921 10 10 EDCE Oc1c(Br)cccc1CNC[C@H]1CN2CCCN1CC2 394798050 LKUKNFOGCGQRSD-ZDUSSCGKSA-N 340.265 1.634 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCN(c4ccccn4)C3)c2n1 2062144470 NJAQXZVNMTVWRT-GFCCVEGCSA-N 338.371 1.147 10 10 EDCE NCc1ccc(N2CC[C@]3(O)CCOC[C@@H]3C2)cc1Br 2194549545 CVLPLIYQUZGTQH-WFASDCNBSA-N 341.249 1.886 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H](CO)C[C@@H]2CO)c(Br)c1 2089862705 CEBRDCZIVFIULX-CKYFFXLPSA-N 329.238 1.648 10 10 EDCE O=C(c1ccc(O)c(O)c1)N1CCC(NC(=O)C(F)(F)F)CC1 2249498650 LEGZCOLDCWFLFG-UHFFFAOYSA-N 332.278 1.381 10 10 EDCE O=C1NC(=O)N(CCc2ccccc2)C(=O)C1=CNN1CCCCC1 2297510358 XVVBXVNRKTXDSY-UHFFFAOYSA-N 342.399 1.182 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)c(Br)c1 2333235599 MIRHUDLBPKEIJZ-XQQFMLRXSA-N 333.201 1.048 10 10 EDCE Cc1ccc(CN2C[C@H]3C[C@H]2[C@@H](O)[C@H]3O)c(O)c1Br 2352946156 GRAFMKXBAITUOD-XXSPCDMZSA-N 328.206 1.389 10 10 EDCE CC[C@H](C)N1C(=O)/C(=C\Nc2cccc3nonc23)C(=O)NC1=S 102698382 NASGDXJYSRVWFW-FZGDARCMSA-N 345.384 1.560 10 10 EDCE CC[C@@H](NCCS(N)(=O)=O)c1cc(Br)ccc1O 36745285 IYZZWQSIXOLLMR-SNVBAGLBSA-N 337.239 1.484 10 10 EDCE CCNC(=O)NC(=O)[C@H](C)N1CCN(c2ccc(OC)cc2)CC1 39561433 BJFVWCJMLFACCT-ZDUSSCGKSA-N 334.420 1.051 10 10 EDCE C[C@H](CN1CCOCC1)CN1Cc2ccc(N(C)C)cc2[C@@H]1CN 71683346 YSPXTHIHSRUVFR-BEFAXECRSA-N 332.492 1.536 10 10 EDCE NCc1ccc(N2CCCS(=O)(=O)CC2)cc1Br 236214025 ZBYATWPBPYUVTO-UHFFFAOYSA-N 333.251 1.533 10 10 EDCE CN1CCCc2cc(/C=C\C(=O)N[C@@H]3CCS(=O)(=O)C3)ccc21 96187988 SHFZVRLJROMRKM-ZQMJAJRESA-N 334.441 1.386 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCOC3)CC2)cc1 263902792 FNWALLNEDOWWTJ-MRXNPFEDSA-N 347.459 1.360 10 10 EDCE COC(=O)/C=C/c1ccc(N2CCN(C(C)C)C(=O)C2)c([N+](=O)[O-])c1 272480554 OJSJZMJFSHQSSM-FNORWQNLSA-N 347.371 1.838 10 10 EDCE Cc1ccc(CNC(=O)[C@H]2OCCO[C@H]2C)c(O)c1Br 2380746803 QBMKJVVWYCOADO-ZANVPECISA-N 344.205 1.883 10 10 EDCE CCN1CC[C@@H](NC(=O)NCc2ccc(N3CCCC3)cc2)C1=O 801745692 QQKNPVJOAMZZLH-MRXNPFEDSA-N 330.432 1.707 10 10 EDCE CC(C)(O)c1cccc(NC(=O)C(=O)NCc2ccccc2O)c1 806880133 NPOCNIRLBQIQPQ-UHFFFAOYSA-N 328.368 1.875 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)c([N+](=O)[O-])c1 828988270 VAQJVHLCVIQLNB-MMYIBNFYSA-N 331.372 1.921 10 10 EDCE COC1(C[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)C(=O)O)CCC1 908758594 NZWWFCSUZQDIJK-OAHLLOKOSA-N 349.431 1.964 10 10 EDCE CCN(CC)c1ccc(CNC(=O)c2c(C(=O)O)cnn2C)cc1 901934636 PEOLAQHTVTYRPQ-UHFFFAOYSA-N 330.388 1.895 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)CC1(C(=O)O)CCOCC1 911408154 AMMFBZMPQIBYSP-UHFFFAOYSA-N 334.416 1.949 10 10 EDCE Cc1cc(C(=O)N(C)C2CS(=O)(=O)C2)c(C)n1-c1ccccn1 913144890 UMWGYNUBJIEFAN-UHFFFAOYSA-N 333.413 1.358 10 10 EDCE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H]2COC(=O)N2)cc1 912109661 KMBNQTADFAWAPP-GFCCVEGCSA-N 345.321 1.752 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1CCn2c(C(=O)c3ccccc3)ccc21 849839855 OUEDAIDGVGFOIX-CQSZACIVSA-N 339.347 1.908 10 10 EDCE CN1CC[C@H](C(=O)NCc2ccc(O)cc2O)[C@@H](c2cnn(C)c2)C1 910942929 ISNRJFONBLNMOE-JKSUJKDBSA-N 344.415 1.183 10 10 EDCE CCN1C[C@H](CN(CCOC)c2ccc(OC)c(OC)c2)OC1=O 846829053 PORJLZMUTNEYSB-CQSZACIVSA-N 338.404 1.997 10 10 EDCE NCc1ccc2c(c1)CCCN2CC(=O)NC1CCN(C2CC2)CC1 844218501 BDJUWEZIFCNWPF-UHFFFAOYSA-N 342.487 1.641 10 10 EDCE CC[C@H](NC1CN(S(=O)(=O)N(C)C)C1)c1ccc(N(C)C)cc1 858569307 DKPXWGOALWFMBV-INIZCTEOSA-N 340.493 1.284 10 10 EDCE C[C@@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCCO1 755213162 SFDVWTFNXSLBRG-KXBFYZLASA-N 345.443 1.574 10 10 EDCE O=C1[C@@H](NCc2ccc(N3CCOCC3)cc2)CCN1C1CCC1 858341019 VWLVWROOGBEHMN-SFHVURJKSA-N 329.444 1.766 10 10 EDCE CN(C)c1cc(F)c(CN2CCC[C@H]2CS(N)(=O)=O)cc1F 862245323 NBSYTWGYIVWJRR-NSHDSACASA-N 333.404 1.284 10 10 EDCE CC(C)(C)OC(=O)[C@H]1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 768463344 HHTNPWQEWZVJKF-NHYWBVRUSA-N 335.400 1.982 10 10 EDCE O=C(CCN1C(=O)NC2(CCCC2)C1=O)N1Cc2cccc(O)c2C1 871198219 HNBNKZSREBHRAV-UHFFFAOYSA-N 343.383 1.489 10 10 EDCE CN1CCN(c2ccc(CN3CC4(C3)CN(C)C(=O)O4)cc2F)CC1 1117995217 UUELKEQIMXOKOV-UHFFFAOYSA-N 348.422 1.214 10 10 EDCE O=S(=O)(NCc1ccc(N2CCCC2)cc1)c1cnc2n1CCC2 772414213 LTAZESACJGHLBG-UHFFFAOYSA-N 346.456 1.908 10 10 EDCE CN(C)S(=O)(=O)C1(CNCc2cc(Cl)c(F)cc2O)CC1 895811285 VDQOZQLPOVRUNN-UHFFFAOYSA-N 336.816 1.698 10 10 EDCE CC1(C)[C@H](O)C[C@@]1(CO)NCc1ccc(Br)cc1O 1879557810 DTBSGHIJYGUVEU-OCCSQVGLSA-N 330.222 1.766 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)c2cnnn2C)C2CC2)cc1C 1322990860 LCRRXXZJOQDYHJ-OAHLLOKOSA-N 343.431 1.430 10 10 EDCE C/C=C\CNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 1331511123 RPHNBDNKJQWJAG-ARJAWSKDSA-N 332.448 1.693 10 10 EDCE C[C@H](N)c1ccc(N2CCC(CO)(CO)C2)c(Br)c1 694724256 SYTBQPLURMPJCM-JTQLQIEISA-N 329.238 1.650 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4CC[C@H](C3)O4)c(Br)cc21 92776081 RPAJIEIXWMAJKN-BFHDXFOESA-N 338.205 1.769 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H](O)C[C@@]2(C)CO)cc1Br 698136302 FZGPXVUUTRIXQZ-PXWWUCIGSA-N 329.238 1.791 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)c2n[nH]c(C)c2O)cc1C 1267980603 LKQOCZOPVQIRMI-NSHDSACASA-N 346.431 1.896 10 10 EDCE CNC(=O)c1cncc(/C=C\C(=O)N2CCc3cc(F)cnc32)c1 1533980152 IHTXSVJNUWODMV-IHWYPQMZSA-N 326.331 1.578 10 10 EDCE COc1ccc(N2CCC(NC(=O)Cn3nccc3N)CC2)cc1 1542703994 LMLRONSAEOZTRN-UHFFFAOYSA-N 329.404 1.259 10 10 EDCE O=C(NCc1cc(O)ccc1O)[C@@H]1CCCN1C(=O)C(F)(F)F 1471661373 PQHOGLHNEVRGEL-JTQLQIEISA-N 332.278 1.267 10 10 EDCE CCOC(=O)[C@H](NC(=O)c1cccc(O)c1O)c1cccc(O)c1 1545637328 RCJWEHVYKNEBBJ-CQSZACIVSA-N 331.324 1.838 10 10 EDCE COc1cccc(CNC(=O)NCC[C@H]2CCCS2(=O)=O)c1O 1471206040 LNNCJIIEDKFKGL-GFCCVEGCSA-N 342.417 1.167 10 10 EDCE CC(C)[C@H](C)NC(=O)[C@H]1CSCN1C(=O)c1cccc(O)c1O 1628785621 VYUHBQZEHVZOMX-CMPLNLGQSA-N 338.429 1.774 10 10 EDCE C[C@@H](O)CNC[C@@](C)(NC(=O)c1ccc(N=NC(N)=O)cc1)C1CC1 1714177574 JVIGUBZFQOVWGA-PIGZYNQJSA-N 347.419 1.718 10 10 EDCE CS(=O)(=O)C[C@H](C(=O)NCc1ccc(O)cc1O)c1ccccc1 1638353036 ZWXRYIVJEUFXDY-HNNXBMFYSA-N 349.408 1.542 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)Cc2n[nH]c(C)n2)cc1C 1567015360 MRAANYLMDPNTIH-LBPRGKRZSA-N 331.420 1.267 10 10 EDCE Cn1nnc2c1CC[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C2 1640192727 VWTWSJJJIDEPBF-NSHDSACASA-N 327.348 1.265 10 10 EDCE C[C@H](CNC[C@H]1CCOC1)N(C)C(=O)c1ccc(N=NC(N)=O)cc1 1732461939 YJHMNLWYIGNYMO-CHWSQXEVSA-N 347.419 1.936 10 10 EDCE CC[C@@H](CNC(=O)Cc1nc[nH]n1)NCc1ccc(OC)c(C)c1 1665873109 ZAYDOYRBEOVVBY-AWEZNQCLSA-N 331.420 1.349 10 10 EDCE CN(CC1(O)CCC1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 1914583691 QSXXNFCEWHDMJF-GFCCVEGCSA-N 340.221 1.752 10 10 EDCE CN(C[C@@]1(O)CCOC1)c1cc(Br)c(CN)cc1F 2129438198 WDLKUHBSTGYHLZ-ZDUSSCGKSA-N 333.201 1.635 10 10 EDCE CCOC(=O)CCN(C)C(=O)CNCc1cccc(OCC)c1O 1857866996 NYQZXTHGGQUCDW-UHFFFAOYSA-N 338.404 1.292 10 10 EDCE CCc1c(OCCCOc2ccc(N)cc2)c(=O)ccn1CC(=O)O 1857913553 OAGAOMGZPYXKIM-UHFFFAOYSA-N 346.383 1.925 10 10 EDCE O=C(O)[C@@]1(CO)CCCN1Cc1cc(Br)ccc1O 2136360566 VOZTVBBKWKHEMT-ZDUSSCGKSA-N 330.178 1.566 10 10 EDCE COc1cccc(O)c1CNC[C@@H](CO)NC(=O)OC(C)(C)C 1985861119 ZVVIYUAWCHSPSP-NSHDSACASA-N 326.393 1.376 10 10 EDCE C[C@H](N)c1ccc(N2C[C@]3(CO)C[C@@]3(CO)C2)c(Br)c1 2146307012 VTVNOJHMBODHDY-LKTVYLICSA-N 341.249 1.650 10 10 EDCE CN(C[C@](C)(O)C(=O)O)c1ccc(CNC(=O)OC(C)(C)C)cc1 1999353136 GMNWDVYSDWKGBM-KRWDZBQOSA-N 338.404 1.983 10 10 EDCE CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCCN=[N+]=[N-] 2010406258 RPHQFICELFJTBX-JTQLQIEISA-N 343.384 1.650 10 10 EDCE CN1CCCc2cc(C=CC(=O)Nc3cnn(CC(N)=O)c3)ccc21 2041674264 LTXXISZTJVJFHW-UHFFFAOYSA-N 339.399 1.403 10 10 EDCE CCNCc1ccc(N2C[C@@H](CO)[C@@H](O)C2)cc1Br 316654200 DTHIXAUFKJWBSS-FZMZJTMJSA-N 329.238 1.348 10 10 EDCE NCc1ccc(N2CCC[C@@]3(CNC(=O)N3)C2)c(Br)c1 2177692184 SRPBZMUXWJKICF-CQSZACIVSA-N 339.237 1.560 10 10 EDCE CN(Cc1ccc(Br)cc1O)[C@H]1COC[C@H]1C(=O)O 691422896 LMXJRJIHFQHBKS-MNOVXSKESA-N 330.178 1.686 10 10 EDCE CNC(=O)C1CN(c2ccc(CNC3CC3)cc2Br)C1 382061430 MVMIZJZJFNBFMW-UHFFFAOYSA-N 338.249 1.883 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCc3cccc(N(C)C)n3)c2n1 2062610876 RFIGYKFJARNLMS-UHFFFAOYSA-N 326.360 1.134 10 10 EDCE COCc1cc(O)nc(=NCc2c(O)cccc2Br)[nH]1 2192813806 PJKLWHPWCLNXFY-UHFFFAOYSA-N 340.177 1.831 10 10 EDCE Cn1nc(Br)cc1S(=O)(=O)NCc1ccc(N)cc1 2089750962 JYYPSSSYIDRYQT-UHFFFAOYSA-N 345.222 1.243 10 10 EDCE CNC(=O)[C@@H]1[C@H](C)CCN1c1ccc(CO)cc1Br 2090263080 TYXCUSHZSWZKPW-RNCFNFMXSA-N 327.222 1.902 10 10 EDCE NCc1ccc(N2CCN(C3COC3)CC2)c(Br)c1 2113285337 XVDSCNGWKWHSCD-UHFFFAOYSA-N 326.238 1.429 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1[C@H]2C[C@@H](CN(CCN=[N+]=[N-])C2)[C@@H]1CO 2212449659 CQCQLUUESIHBQU-ZDEQEGDKSA-N 325.413 1.750 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])C1 2213583570 TZWKPMIUBKWDBF-UEKVPHQBSA-N 339.396 1.706 10 10 EDCE CO[C@@H]1[C@H](OC)CN(c2ccc(CO)cc2Br)[C@@H]1CO 2233362846 WVCRWAGQKGFTMB-MCIONIFRSA-N 346.221 1.152 10 10 EDCE CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)[C@H]1C[C@@H](O)C1 2224218826 NANMZSJHCWDPIJ-KEHGIVTQSA-N 327.178 1.394 10 10 EDCE CC(C)(C)OC(=O)NC/C=C\CNC(=O)c1cc(O)c(O)c(O)c1 2248323854 SUFXALPYBXMPFI-PLNGDYQASA-N 338.360 1.614 10 10 EDCE O=S1(=O)C[C@@H]2CN(c3ccc(CO)cc3Br)C[C@@H]21 2314882065 ZQDPSNIYAWGEEL-CABZTGNLSA-N 332.219 1.175 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)c(Br)c1 2336558862 NNANWOXQXLYXCX-PLMOITTCSA-N 345.262 1.702 10 10 EDCE Cc1ccc(CNC(=O)[C@]2(C)C=CCN2)c(O)c1Br 2352642128 BAGHNRQLIBAPQJ-AWEZNQCLSA-N 325.206 1.997 10 10 EDCE Cc1ccc(CNCC[C@@H]2CNCCO2)c(O)c1Br 2352944497 ISRYNIVANFSHPY-GFCCVEGCSA-N 329.238 1.931 10 10 EDCE Cc1ccc(CN2CC[C@@H](NC(N)=O)C2)c(O)c1Br 2352946997 FOWRKCIOFBQKNP-SNVBAGLBSA-N 328.210 1.706 10 10 EDCE C[C@H](O)c1ccc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@@H]2C3)c(Br)c1 2355338505 BVUPWACLWUUMEU-VWQNXBSZSA-N 342.233 1.823 10 10 EDCE C[C@@]1(NCc2cc(Br)ccc2O)CCS(=O)(=O)C1 227636288 DTZHNIJIGZPTLO-GFCCVEGCSA-N 334.235 1.822 10 10 EDCE CC(=O)[C@]1(O)CCc2c(cc3c(c2O)C(=O)c2ccccc2C3=O)C1 39382181 MGCYXYQPFUKLTA-FQEVSTJZSA-N 336.343 1.976 10 10 EDCE C[C@](NC(=O)/C=C/c1ccc(N2CCOCC2)cc1)(C(=O)O)C1CC1 191063047 UCKWCHJPEFKMTF-ROSSNEFBSA-N 344.411 1.906 10 10 EDCE Cc1sc(C(=O)O)cc1S(=O)(=O)NCc1ccccc1O 228403077 LWCLSEGGWREMIX-UHFFFAOYSA-N 327.383 1.939 10 10 EDCE C[C@H]1COCCN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 92775192 RYHQAIRGCLNEHZ-MADCSZMMSA-N 326.194 1.626 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCCn1cccn1 255840649 HKHSVBGLFKITIW-DAXSKMNVSA-N 326.400 1.549 10 10 EDCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@@]12CCN(C(=O)OC(C)(C)C)C2 808539205 WAJUAXQSXGSRKG-MEDUHNTESA-N 325.361 1.335 10 10 EDCE O=C(COC[C@@H]1CCCO1)NCc1cc(Br)ccc1O 804733650 WVQJGGKXSPKAJX-LBPRGKRZSA-N 344.205 1.967 10 10 EDCE CCNCc1ccc(N2C[C@@H](O)[C@H](OC)C2)cc1Br 395968499 NQTADSHOPKTJQO-ZIAGYGMSSA-N 329.238 1.755 10 10 EDCE OC[C@]1([C@@H](NCc2ccc(N3CCOCC3)cc2)C2CC2)CCCO1 816667051 BBGATKICBQLSKS-PMACEKPBSA-N 346.471 1.933 10 10 EDCE COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@H]3C3CC3)CC2)cc1 834383514 UJXIZSOZTHGFFL-QUCCMNQESA-N 345.487 1.662 10 10 EDCE COc1cccc(CN2CCN(C(=O)c3cc(C)[nH]n3)C[C@H]2C)c1O 835073285 KWMATYYSBMAEEL-CYBMUJFWSA-N 344.415 1.779 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)c3ccn4nccc4n3)C2)cc1 912292640 NWVIXWUVRVBHKZ-ZDUSSCGKSA-N 337.383 1.747 10 10 EDCE C[C@@H](O)[C@@H]1CN(C(=O)NCCCSc2nccs2)CCO1 840324870 HWACMGWXAJZQQR-MNOVXSKESA-N 331.463 1.417 10 10 EDCE CC1CCN(c2ccc(CNC(=O)N[C@H]3C[C@@H](C(N)=O)C3)cc2)CC1 844965094 UKTRLABIVXPYHG-IYBDPMFKSA-N 344.459 1.986 10 10 EDCE CCO[C@@H](C)C(=O)NCc1cc(NC(=O)[C@@H](C)OCC)ccc1O 923124336 KXEZGFJUYXKRRK-NWDGAFQWSA-N 338.404 1.797 10 10 EDCE C[C@H](NC(=O)NC[C@@H](O)c1ccnn1C)c1ccc(N(C)C)cc1 922053983 HWAKCBHFHPNZLC-BLLLJJGKSA-N 331.420 1.580 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@H]3CCOC3)C2)cc1 852250829 FDQRZOAAAWYTGP-LSDHHAIUSA-N 333.432 2.000 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](OC)[C@@H]3CCOC3)C2)cc1 854980483 CAPIVGXLGJBHHL-RKVPGOIHSA-N 348.443 1.689 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCN(C(C)=O)C3)C2)cc1 856871604 SYTLMWRTSHPZEH-HUUCEWRRSA-N 346.431 1.194 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCCCC[C@@H](N)C1 868357414 WYHRHODJBQAHIY-MRXNPFEDSA-N 346.475 1.441 10 10 EDCE O=C([C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1)N1CCCC1 768447373 OQUFLGWLKKJRHV-CXAGYDPISA-N 346.427 1.652 10 10 EDCE Oc1cccc(Br)c1CN1CCn2c(O)nnc2C1 862326287 MHJUZGSCKZKCCO-UHFFFAOYSA-N 325.166 1.468 10 10 EDCE C[C@H](NC(=O)NCCS(=O)(=O)C(C)(C)C)c1ccccc1O 868247734 GFIDCNCWHGZOQU-NSHDSACASA-N 328.434 1.966 10 10 EDCE CCOC(=O)C1=NN(c2ccc(C(=O)OC)cc2OC)C(=O)[C@H]1C 871955065 QDVWSUDNQDJLMS-VIFPVBQESA-N 334.328 1.384 10 10 EDCE CNC(=O)[C@@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 896293771 FPYLNKTWQQEKPI-SECBINFHSA-N 334.397 1.911 10 10 EDCE CCCCC(=O)N1CSC[C@@H]1C(=O)NCc1cc(O)ccc1O 1153879078 DCTPFPSPJVYJOS-CYBMUJFWSA-N 338.429 1.806 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1CNCc1ccc(O)c(O)c1 393898986 DJFUXVRWVYUQIF-CYBMUJFWSA-N 338.404 1.823 10 10 EDCE Cc1ncsc1CN(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1331960992 TZSSFNVUVIQUOE-UHFFFAOYSA-N 331.397 1.658 10 10 EDCE CC[C@@H](CNC(=O)[C@@H]1CN(C)CCO1)NCc1ccc(OC)c(C)c1 1269384812 WXUPWCPXYNFBQZ-WMZOPIPTSA-N 349.475 1.319 10 10 EDCE COc1ccc(CN[C@@H](CO)CNC(=O)Cc2cccs2)cc1C 1507169216 ZIRALVPOMULOCC-OAHLLOKOSA-N 348.468 1.875 10 10 EDCE COC(=O)/C=C\c1ccc(C(=O)NCCc2ccc(O)c(O)c2)o1 1445939285 QXWTZGOCAAFGOB-DAXSKMNVSA-N 331.324 1.850 10 10 EDCE CCOC1(CO)CN(c2cc(Br)c(CN)cc2F)C1 2116364035 MBOHLYNVSKLTKB-UHFFFAOYSA-N 333.201 1.635 10 10 EDCE CC(C)[C@@H](NS(C)(=O)=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1442477245 ZRDFMVNVORCIFF-CQSZACIVSA-N 345.440 1.082 10 10 EDCE O=C(NCC1CC1)[C@H]1CSCN1C(=O)Cc1ccc(O)c(O)c1 1440726460 XZMDBZGVQLHGFE-GFCCVEGCSA-N 336.413 1.068 10 10 EDCE CS(=O)(=O)Nc1ccccc1C(=O)N1Cc2cccc(O)c2C1 1455036639 HYKABFHTSLQPGN-UHFFFAOYSA-N 332.381 1.920 10 10 EDCE CN1C(=O)O[C@H]2CN(c3ccc(CN)c(Br)c3)C[C@H]21 2120409958 MQVRRJICYJZJAP-NEPJUHHUSA-N 326.194 1.547 10 10 EDCE CN1C(=O)O[C@@H]2CN(c3ccc(CO)cc3Br)C[C@H]21 2120405294 YLZWIABOKAEISP-VXGBXAGGSA-N 327.178 1.581 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1C[C@@H](CO)[C@@H](CCO)C1 1558826427 PKTRJCMQYMRBBP-ONGXEEELSA-N 337.397 1.375 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H]2C(=O)NC2CC2)cc1 1624884457 LZSQXVUBPMMMIZ-CYBMUJFWSA-N 329.360 1.732 10 10 EDCE COc1ccc(CNC(=O)c2cnc3cc(OC)ccn23)c(O)c1 1626079329 AIJKLNPYPZKLJF-UHFFFAOYSA-N 327.340 1.987 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ncccn1 1623928568 PLWNZWDNELNUIU-UHFFFAOYSA-N 335.747 1.651 10 10 EDCE C[C@H](NC(=O)CCc1nc(-c2nc[nH]n2)no1)c1ccccc1O 1632250084 JEMDBOLNTIHIKO-VIFPVBQESA-N 328.332 1.370 10 10 EDCE O=C1NCCN(C(=O)Cc2ccc(O)c(O)c2)[C@@H]1c1ccccc1F 1631440315 LLCRJDTXVDPSRW-QGZVFWFLSA-N 344.342 1.479 10 10 EDCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCn1ccnn1 1639232562 LGNWDOAXLOXLTI-UHFFFAOYSA-N 337.383 1.928 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)Nc1c[nH]c(C(=O)N2CCCC2)c1 1638041211 BVHKRGWQYVCDMU-UHFFFAOYSA-N 329.356 1.843 10 10 EDCE CC[C@H]1C(=O)N(CC)CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1567850905 DVXGVSCOGKOXAW-ZDUSSCGKSA-N 331.376 1.932 10 10 EDCE COc1cc(C(=O)N[C@H](C)CNCc2ccc(OC)c(C)c2)on1 1497807567 ZFZAAVZHAWJTMU-GFCCVEGCSA-N 333.388 1.908 10 10 EDCE CC[C@H](CNC(=O)C=C(C)C)NC(=O)c1cc(OC)nc(OC)c1 1582383080 XYDAHDHLQKFALS-CYBMUJFWSA-N 335.404 1.690 10 10 EDCE CC(=O)N1C[C@@H](C(=O)NCc2cccc(O)c2O)Oc2ccccc21 1651173233 VCZWBVKDCHZORI-INIZCTEOSA-N 342.351 1.528 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)C[C@@H]2C=CCC2)cc1C 1676499519 NCBMLHSMEHGGIN-WBVHZDCISA-N 332.444 1.927 10 10 EDCE C[C@@H](O)c1ccc(N2CC[C@H](O)C[C@H]2CO)cc1Br 2136081166 BBTBFOBAGBKRHJ-USWWRNFRSA-N 330.222 1.824 10 10 EDCE NCc1cc(F)c(N2CC[C@H](O)C[C@H]2CO)cc1Br 2136084072 HMBDKRRFJYNWOL-UWVGGRQHSA-N 333.201 1.369 10 10 EDCE O=C1Nc2cc(N3CC[C@H](O)[C@@H](F)C3)c(Br)cc2[C@@H]1O 2144566453 LJNWEDCEEHWNSV-UWJYBYFXSA-N 345.168 1.344 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1990023281 UWFUHWHPCTXYGR-QWRGUYRKSA-N 327.385 1.563 10 10 EDCE CN1CCc2cc([C@]3(O)COC[C@@H]3NC(=O)OC(C)(C)C)ccc21 1999512268 NZRBFNAFCHBEAX-MAUKXSAKSA-N 334.416 1.790 10 10 EDCE CCO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC(N=[N+]=[N-])C1 2010392716 ISWUINQYNNLHPJ-NEPJUHHUSA-N 339.396 1.780 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC[C@H]1CN=[N+]=[N-])C(C)(C)O 2014478748 HXPYTMSPPQGFBV-WDEREUQCSA-N 341.412 1.952 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)c2cc(O)c(O)c(O)c2)CO1 2015126053 QINOPBBWMJOMIW-SECBINFHSA-N 340.332 1.084 10 10 EDCE CNCc1ccc(N2CC(S(C)(=O)=O)C2)cc1Br 2034839008 OJCGOSJKTGVNCY-UHFFFAOYSA-N 333.251 1.402 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@H]3C[C@H](Cn4ccnc4)C3)c2n1 2062117975 ZPXINZVPINRSGG-HAQNSBGRSA-N 326.360 1.148 10 10 EDCE COC1(CF)CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2168733912 XAWLMZFURUXALN-NSHDSACASA-N 345.168 1.609 10 10 EDCE CNCc1ccc(N2C[C@@H](CO)OCC23CC3)cc1Br 2183982096 ZJRWLWZMDLPKEH-ZDUSSCGKSA-N 341.249 1.899 10 10 EDCE Cn1c(C(=O)N2CC[C@H](N=[N+]=[N-])C2)cnc1CNC(=O)OC(C)(C)C 2060637273 JFFSMCLLSATNIV-JTQLQIEISA-N 349.395 1.970 10 10 EDCE O=C1C[C@@H]2CCN(Cc3cc(Br)ccc3O)C[C@H]2N1 2088805002 ASNXOLUUAKPTQA-JOYOIKCWSA-N 325.206 1.865 10 10 EDCE COC[C@@H]1[C@@H](O)[C@H](O)CN1c1ccc([C@H](C)N)cc1Br 2234066914 LODCVMCVWFOERD-OKVQYTGBSA-N 345.237 1.026 10 10 EDCE COc1ccc(N2C[C@H](O)C[C@H]2CO)c(OC)c1Br 2226538480 NPCONWQAUCPDLS-DTWKUNHWSA-N 332.194 1.398 10 10 EDCE O=C1NC(=O)N(Cc2ccccc2)C(=O)C1=Cc1ccc([N+](=O)[O-])o1 2297358191 QJHNHZDMOWIDCL-UHFFFAOYSA-N 341.279 1.850 10 10 EDCE Oc1c(Br)cccc1CNC[C@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2355457763 XSTITNZOLDXURF-VIDBKGRSSA-N 342.233 1.622 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4C[C@@H](O)[C@H]3C4)c(Br)cc2[C@H]1O 2355623291 FTYCVHZLBYNCJY-AAGLOMFBSA-N 339.189 1.394 10 10 EDCE O=C1NC(=S)N(c2ccc(F)cc2)C(=O)/C1=C/N1CCCCC1 113839970 HRJCCPMGMFKCLY-JLHYYAGUSA-N 333.388 1.943 10 10 EDCE OC[C@@H](O)C1CN(c2ccc(CNC3CC3)cc2Br)C1 2361905158 FFBLXSIQUHWCRO-OAHLLOKOSA-N 341.249 1.491 10 10 EDCE CN(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccc(O)c(O)c1 122399302 UESTXVODETUKEA-INIZCTEOSA-N 328.412 1.929 10 10 EDCE CCOCCOCC(=O)NCc1ccc(N2CCSCC2)cc1 127537777 GEMZDSPGKYNXDV-UHFFFAOYSA-N 338.473 1.909 10 10 EDCE CN1CCCC[C@H]1CN1CCN(C(=O)c2cccc(O)c2O)CC1 193044967 RJCOFLRHZIXZDG-AWEZNQCLSA-N 333.432 1.340 10 10 EDCE COc1cc(OC)c2cc(C(=O)OCC(=O)C(C)=O)[nH]c2c1OC 808503671 SICIOFACGIVPBL-UHFFFAOYSA-N 335.312 1.509 10 10 EDCE Nc1ccc(OCCON2C(=O)COc3ccc(C(=O)O)cc32)cc1 821299459 JXCCAZMTSFRZPM-UHFFFAOYSA-N 344.323 1.703 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)cc2N1 828948231 YZFKYTHFRISFCS-QYAIJTBZSA-N 329.312 1.315 10 10 EDCE Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)Cc1ccc(N)cc1 831505698 HSYAQIHXFPYOBF-INIZCTEOSA-N 328.416 1.762 10 10 EDCE CNS(=O)(=O)C[C@@H]1CCCN1C/C=C\c1ccc(N(C)C)cc1 835028667 ORHVNQIBEYPCGE-AATOQMJSSA-N 337.489 1.779 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1CN(C)CCN(C)C1 910558319 OPVOLMPBOKSGQY-MRXNPFEDSA-N 346.519 1.602 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)/C=C\Cn1cncn1 910559964 YUORADLGJQXYHQ-IYKSTZQJSA-N 327.432 1.956 10 10 EDCE Nc1ccc(CCNC(=O)NC2(CO)Cc3ccccc3C2)cc1 841959126 LGAAGJKMNIIFAK-UHFFFAOYSA-N 325.412 1.640 10 10 EDCE O=C(NCCCSc1nccs1)N[C@H]1CNCCC1(F)F 841857190 NRWOJBXNFMJSRX-VIFPVBQESA-N 336.433 1.922 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3[C@H]4CC[C@H]3[C@H](CO)C4)C2)cc1 854297063 JKJMWABJBROPLG-DNUAJFIVSA-N 345.443 1.829 10 10 EDCE CC[C@H](Cn1cncn1)NCc1ccc(N2CCC(O)CC2)cc1 850567873 LDEICAFPRHLLIS-MRXNPFEDSA-N 329.448 1.808 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1C[C@H](C(N)=O)C1 858542764 BKNHPTOWXAKZGB-QEJZJMRPSA-N 332.448 1.555 10 10 EDCE CNS(=O)(=O)C[C@H]1CCCN(C(=O)Nc2ccc(N)cc2)C1 859698351 UNNBDWCDCTUZQP-NSHDSACASA-N 326.422 1.062 10 10 EDCE CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1cccc(O)c1O 856410911 PNFBRUYHQBCWNB-CYBMUJFWSA-N 334.416 1.813 10 10 EDCE COc1ccc(N2CCC(N3C(=O)N[C@@H](CSC)C3=O)CC2)cc1 924578051 ODKOYIXHHVGQGF-HNNXBMFYSA-N 349.456 1.947 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(=O)N(C)CC1 854176152 BLUUUBWUFJPNQT-OAHLLOKOSA-N 346.475 1.866 10 10 EDCE CO[C@@H]1CC[C@@H]2OCCN(Cc3cc4c(cc3O)OC[C@H]4O)[C@H]2C1 768465441 MRJKDIWMNVNDLX-UOJCXKCYSA-N 335.400 1.586 10 10 EDCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@@H]2CCCS2)c1 871033271 ZFNYGUDFPLWHGM-NSHDSACASA-N 344.458 1.779 10 10 EDCE O=C1C[C@H]([C@H]2CCCCN2C(=O)/C=C\c2ccc(O)c(O)c2)CN1 779541086 XFWLQIQUEOBDQR-BPIHMUFXSA-N 330.384 1.628 10 10 EDCE C[C@H](NCCCN1CCCS1(=O)=O)c1ccc(N(C)C)cc1 772959735 CVQYVZRRBHIKJJ-AWEZNQCLSA-N 325.478 1.829 10 10 EDCE C[C@H]1CC[C@H](C(N)=O)CN1Cc1ccc(N2CCN(C)CC2)cc1 775648850 GRBJSWKBZKLUHE-RDJZCZTQSA-N 330.476 1.524 10 10 EDCE CCn1cc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)nc1C 775289121 RQITXPOHSQSYNZ-UHFFFAOYSA-N 326.334 1.626 10 10 EDCE CCN(CC)c1ccc(CNC(=O)C2CN([C@H]3CCOC3)C2)cc1 895779968 XKBPZDANBDOFBK-SFHVURJKSA-N 331.460 1.870 10 10 EDCE O=C(COC(=O)C1C[C@H]2COC[C@@H](C1)C2=O)c1ccc(O)c(O)c1 783764665 MVOADZMNUPHOKQ-YOGCLGLASA-N 334.324 1.065 10 10 EDCE C[C@H](C(=O)NCc1ccc(O)c(O)c1)N1CSCCSC1 1137443274 JJCVCHFSSZYIAF-SNVBAGLBSA-N 328.459 1.800 10 10 EDCE CC(C)(CO)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1137936642 QTKXHYWHZQKTBY-UHFFFAOYSA-N 333.392 1.378 10 10 EDCE CCN(CC)c1ccc(CN(C)C(=O)CN2CCOCC2=O)cc1 790485140 YTRDTYCWJIDLDZ-UHFFFAOYSA-N 333.432 1.350 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1[C@H]2COC[C@H]21 793447507 OFNPEVFSEIKGOP-FVQHAEBGSA-N 331.416 1.309 10 10 EDCE C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C1(S(C)(=O)=O)CC1 1157533650 AHBLWBRZNSEBPE-SECBINFHSA-N 338.389 1.545 10 10 EDCE NC(=O)N[C@H](CC(=O)NCc1c(O)cccc1O)c1ccccc1 1304051616 YOUWRVSYABOBMA-CYBMUJFWSA-N 329.356 1.514 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@H]1CSC(c2ccccc2O)=N1 1162278768 LSEPLTWQQIAWRN-CYBMUJFWSA-N 344.392 1.982 10 10 EDCE CN(C)CCCN(C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1166160904 WAECQVWTEYHDKH-UHFFFAOYSA-N 334.424 1.462 10 10 EDCE CCOc1ccc(N2CCN(C(=O)C[C@@H]3CCNC3=O)CC2)cc1 1331923323 FNIXTPOYNXCNLW-AWEZNQCLSA-N 331.416 1.260 10 10 EDCE CCOc1ccc(N2CCN(C(=O)CC3(O)CCOCC3)CC2)cc1 1332098790 FCXBDHGYEBSAOZ-UHFFFAOYSA-N 348.443 1.666 10 10 EDCE CC12CC(CN1C(=O)C(=O)NCCCSc1nccs1)C2 1330932732 DCUDLHVOVYVSBG-UHFFFAOYSA-N 325.459 1.752 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@@]1([C@@H]2CCCCO2)CCCO1 1263768779 FOGREMTUTIRFTI-WMZOPIPTSA-N 335.400 1.875 10 10 EDCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(O)CCO[C@@H]1C 1612537365 DDHFGDBBUAVOMO-SJKOYZFVSA-N 332.404 1.468 10 10 EDCE COc1ccc(CNCCCN(C)C(=O)c2nccnc2N)cc1C 1722991017 NYWCFKQSRRHXIU-UHFFFAOYSA-N 343.431 1.628 10 10 EDCE NC(=O)[C@@H]1CCN(c2ccc(C=CC(=O)O)c(Br)c2)C1 1911938786 XTXPMHXJVZSEJV-SNVBAGLBSA-N 339.189 1.859 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)N1CCC(OC[C@H]2CCCO2)CC1 1632259326 BSVOPSHSDASZNS-OAHLLOKOSA-N 335.400 1.827 10 10 EDCE C/C=C(\C)C(=O)NC[C@H](CC)NC(=O)c1cc(OC)nc(OC)c1 1498994931 HPVGJBQMTUCNHY-VKUYVZBCSA-N 335.404 1.690 10 10 EDCE CC[C@@H](CNC(=O)[C@H](C)n1cncn1)NCc1ccc(OC)c(C)c1 1732198046 WYAAULRFPBPGAA-HOCLYGCPSA-N 345.447 1.841 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)C2=COCCC2)cc1C 1732635560 HGQOKFTUEIDSMJ-INIZCTEOSA-N 334.416 1.265 10 10 EDCE O=C(NCc1cccc(O)c1O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 1643812734 NTDCWXJLLHBUIY-GFCCVEGCSA-N 344.342 1.906 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)[C@]2(C)CCNC2=O)cc1C 1731619470 XCCWIWNPSCPZPP-FZKQIMNGSA-N 333.432 1.124 10 10 EDCE O=S(=O)(Nc1cc(Cl)c(O)c(Cl)c1)N1CC[C@H](O)C1 1914124888 UXWPTXLRZARRQX-ZETCQYMHSA-N 327.189 1.422 10 10 EDCE CC(=O)C(=O)[C@]1(O)[C@@H]2CCCN(C(=O)OC(C)(C)C)[C@H]2C1(C)C 1919201480 SKKXHGJCZUPSPS-PSTGCABASA-N 325.405 1.931 10 10 EDCE CN(C)C(=O)[C@@H]1CCN(c2ccc(CN)c(Br)c2F)C1 2143702437 GMQBHZBBYOJISA-SNVBAGLBSA-N 344.228 1.961 10 10 EDCE CN1CCN(Cc2ccc(N)cc2)[C@H](CNC(=O)OC(C)(C)C)C1 1999436076 CJEABQNLSCUNFD-MRXNPFEDSA-N 334.464 1.910 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)[C@H]21 2003172934 RPJCAASPIGVXEI-FPVZYODXSA-N 336.432 1.898 10 10 EDCE CC(C)(C)OC(=O)NC1CC(O)(C(=O)NCc2ccccc2O)C1 2012310756 GJIDPTCUIAWLNY-UHFFFAOYSA-N 336.388 1.427 10 10 EDCE CCNCc1ccc(N2C[C@H]3C[C@H]2[C@@H](O)[C@H]3O)cc1Br 2160717292 RKJIWZVBRAZGGQ-SDJAHQOYSA-N 341.249 1.489 10 10 EDCE C[C@H]1CN(C)C[C@@H](CNCc2cccc(Br)c2O)O1 697317534 SCIFRMXUTXSCGJ-CMPLNLGQSA-N 329.238 1.963 10 10 EDCE CCC1(N(C)C)CCN(C(=O)c2cnn3c(O)cc(C)nc23)CC1 2062575373 BMCYKPJRLRXEDF-UHFFFAOYSA-N 331.420 1.690 10 10 EDCE CNCc1ccc(N2CCCNC(=O)CC2)c(Br)c1 2089101895 QXGJSRBWPTUQKW-UHFFFAOYSA-N 326.238 1.885 10 10 EDCE CC(C)(C)OC(=O)N1CCC(CCCOc2nnc(=N)[nH]n2)CC1 2213784530 CKYHBVCZDRVYAP-UHFFFAOYSA-N 338.412 1.485 10 10 EDCE O=C(C=Cc1ccc(O)c(O)c1)N[C@@H]1CCN(c2ccccn2)C1 2308005860 LIAAQZVPHVPAGL-CQSZACIVSA-N 325.368 1.901 10 10 EDCE Cc1ccc(CN(C)C(=O)C2(N)COC2)c(O)c1Br 2352645518 KPBPEKZXUYDBAP-UHFFFAOYSA-N 329.194 1.149 10 10 EDCE Cc1ccc(CN2CCC(=O)NCC2=O)c(O)c1Br 2352946603 BIYUSILRCWRDEP-UHFFFAOYSA-N 327.178 1.312 10 10 EDCE O=C1N[C@H](c2cc(O)cc(Br)c2O)N2CCCC[C@H]12 124872096 LXXGFQKFIWPVAN-PWSUYJOCSA-N 327.178 1.843 10 10 EDCE COC(=O)[C@@H]1C[C@H](OC)CN1C(=O)/C=C\c1ccc(N(C)C)cc1 254838238 KROJOKOTJBECFK-WDSKNZHCSA-N 332.400 1.555 10 10 EDCE Cc1cnn(CCNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)c1 255233826 YGPUWQWUMLOYRP-DAXSKMNVSA-N 340.427 1.858 10 10 EDCE CO[C@H](C(=O)O)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381130035 SQXWAWUVDXPJCO-NSHDSACASA-N 346.177 1.521 10 10 EDCE CCN1CCN(c2ccc(C(=O)OCC(=O)C(C)=O)cc2F)CC1 808520732 XIUFNLSXRKMTOM-UHFFFAOYSA-N 336.363 1.283 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H]1CCCN(C(=O)c2cc(C)cc(C)c2)C1 808506500 KNMGEHKICFKBOK-HNNXBMFYSA-N 345.395 1.857 10 10 EDCE O=C(NCCCSc1nccs1)C(=O)NCC[C@@H]1CCOC1 806279467 PGZIFFGZOYONNB-LLVKDONJSA-N 343.474 1.284 10 10 EDCE CSCCCCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807264952 TWJRIXPFSMWUSI-UHFFFAOYSA-N 347.484 1.938 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C1C[C@H]2CNC[C@@H](C1)C2=O 829764775 WXKHUJRBTYPOIW-MQVJKMGUSA-N 329.444 1.492 10 10 EDCE C/C=C\[C@H](O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 901288626 YOKZUAYWHKFVNT-AXMVSILFSA-N 343.471 1.772 10 10 EDCE O=C(COc1ccc(O)cc1)NCc1ccc(N2CCOCC2)cc1 733890494 JPVRDJMGETZXSN-UHFFFAOYSA-N 342.395 1.924 10 10 EDCE CN(C)c1ccc(CNC(=O)CN2CCCCC[C@H]2CCO)cc1 839595649 KJQFEFQNTQWFER-SFHVURJKSA-N 333.476 1.996 10 10 EDCE COC(=O)C[C@@H]1C(=O)NCCN1C/C=C/c1ccc(N(C)C)cc1 835026496 YFAPCOHQBHNZPS-DWTRPJMMSA-N 331.416 1.129 10 10 EDCE CC(=O)N1CSC[C@@H]1C(=O)NCCCSc1nccs1 733972807 WPFWIPMJKXLESA-SNVBAGLBSA-N 331.488 1.663 10 10 EDCE O=C(NCc1cc(Br)ccc1O)NCC1CCNCC1 841924270 VOBOVGCTCMQPLH-UHFFFAOYSA-N 342.237 1.954 10 10 EDCE CC(=O)N1CCC(NC(=O)CN2CCCc3cc(CN)ccc32)CC1 843349516 BXDUQMFKBGRTRU-UHFFFAOYSA-N 344.459 1.025 10 10 EDCE COC(=O)/C=C/c1ccc(N2[C@H]3CC[C@H]2CC(=O)NC3)c([N+](=O)[O-])c1 748280764 DOAKEGWTUPUMMR-NHTCQFRESA-N 345.355 1.638 10 10 EDCE CCN1CCN(c2ccc(CNC(=O)C3(OC)CC3)cc2F)CC1 843545652 UPWKSPSGRPHEMF-UHFFFAOYSA-N 335.423 1.763 10 10 EDCE O=C1N[C@]2(C(=O)NCCCSc3nccs3)C[C@H]3C[C@H]1[C@H]2C3 845505724 KEFMWUHQXIGHAG-KIGUWFBYSA-N 337.470 1.656 10 10 EDCE C[C@@H](NCC(=O)NCC(=O)NCc1ccccc1)c1ccccc1O 926967753 PKQSWFRCURRIMN-CQSZACIVSA-N 341.411 1.475 10 10 EDCE COC[C@H](C1CCOCC1)N1C(=O)CN(Cc2ccccc2O)C1=O 849358710 BMICYKVMTSBWHT-OAHLLOKOSA-N 348.399 1.598 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCc2nnn(C)c2C1 927845922 AMQLKYDHKLMORY-CQSZACIVSA-N 342.447 1.580 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)CCc3cn(C)nn3)C2)cc1 855224942 IPUPKZVWKOVMSZ-ZDUSSCGKSA-N 329.404 1.151 10 10 EDCE COc1ccc(CNC(=O)N[C@H]2C[C@@H]3OC(C)(C)O[C@@H]3C2)c(O)c1 927363773 WSRKNWSQSUGJLK-UWEBFBLFSA-N 336.388 1.883 10 10 EDCE CCS(=O)(=O)C[C@@H](C)N[C@@H]1CCN(c2ccc(OC)cc2)C1 850487074 FEJRFWIITFVUIE-ZIAGYGMSSA-N 326.462 1.687 10 10 EDCE COC(=O)N1C[C@H]2C=C[C@H]1[C@@H](C(=O)NCc1c(O)cccc1F)C2 928706350 QZNREGLIXIKNST-MJVIPROJSA-N 334.347 1.790 10 10 EDCE CO[C@H](CNC(=O)NCc1ccc(N(C)C)cc1C)[C@H]1CCOC1 852441052 XISOBWMTVPYNME-DOTOQJQBSA-N 335.448 1.912 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](OC)[C@H]3CCOC3)C2)cc1 854980485 CAPIVGXLGJBHHL-VKJFTORMSA-N 348.443 1.689 10 10 EDCE CCN(C)C(=O)CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852260702 ADYYUGFRXAEPPT-CYBMUJFWSA-N 334.420 1.051 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCc4nccn4C3)C2)cc1 855223887 CMQDFCHSWOIXSH-GJZGRUSLSA-N 340.427 1.849 10 10 EDCE CC(C)(C)OC(=O)C1(NC(=O)c2cccc(O)c2O)CCOCC1 856392991 GGHOFSPDXJOGBX-UHFFFAOYSA-N 337.372 1.719 10 10 EDCE Cc1ccc(O)c(CNC(=O)C(=O)Nc2cc(C)nnc2N(C)C)c1 862024741 FSOQWLOKFJZCTD-UHFFFAOYSA-N 343.387 1.120 10 10 EDCE C[C@H]1CN(c2ccncc2)CCN1C(=O)Cc1ccc(O)c(O)c1 1455927584 CDXQTAOQFLBJKU-ZDUSSCGKSA-N 327.384 1.773 10 10 EDCE COc1ccc(N2CCN(C(=O)NCC3(C)COC3)CC2)c(OC)c1 868245818 COPOIVHENMWHPH-UHFFFAOYSA-N 349.431 1.572 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)C1(C(=O)NC2CC2)CC1 862027655 APPWHVHRQFRLIO-UHFFFAOYSA-N 325.368 1.615 10 10 EDCE COC(=O)c1cc(OCCC2CS(=O)(=O)C2)ccc1N(C)C 865395421 QBLYSVUTHTWNDW-UHFFFAOYSA-N 327.402 1.353 10 10 EDCE CC/C=C(/F)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 864937461 FYOMXIOOTPZRLU-CRKCGEKBSA-N 340.420 1.801 10 10 EDCE O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1cc(O)cs1 765864513 CQWWCFQBUFIIJG-UHFFFAOYSA-N 337.376 1.754 10 10 EDCE CN(C)c1ccc(CN(C(=O)NCc2cn(C)nn2)C2CC2)cc1 783293346 UECXWTMICYXCBD-UHFFFAOYSA-N 328.420 1.755 10 10 EDCE CN1CCN(c2ccc(CNC(=O)COCC(F)F)cc2)CC1 881855235 RKHVOOJHKHMZMZ-UHFFFAOYSA-N 327.375 1.336 10 10 EDCE CN(C)c1ccc(CNC(=O)[C@H]2CN(C(=O)C(C)(C)C)CCO2)cc1 1124553155 OFVLQLNFWMWQIU-MRXNPFEDSA-N 347.459 1.642 10 10 EDCE CCc1cccc(CNC[C@]2(C(=O)OC)C[C@@H]2S(C)(=O)=O)c1O 895510036 GCMLVBOABUMNLX-XJKSGUPXSA-N 341.429 1.021 10 10 EDCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N(C)Cc1ccns1 897791378 LBVNUYZNLZASFU-UHFFFAOYSA-N 346.456 1.792 10 10 EDCE CC[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)C[C@@]2(CCOC2)O1 794700800 HTBVHFCEBMOPKZ-RPVQJOFSSA-N 335.400 1.588 10 10 EDCE CC[C@@H]1CCN1C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 795651447 YTJQJMIHBCIFJU-SJLPKXTDSA-N 333.476 1.662 10 10 EDCE CC(C)(C)OC(=O)[C@@]1(C(=O)NCc2ccc(O)cc2O)CCCO1 1142533134 DQDXOGVWAGOZRR-KRWDZBQOSA-N 337.372 1.605 10 10 EDCE CN1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)Cc2cccnc21 1175381298 LQSUECCTRCREPF-FNORWQNLSA-N 325.368 1.985 10 10 EDCE C/C=C(/C)C(=O)N[C@H](C)CNCc1nnnn1-c1ccc(OC)cc1 1321490865 PTIJPNLIJKOVMA-QWGHSUKYSA-N 344.419 1.231 10 10 EDCE COCCn1cc(NC(=O)NCc2c(O)cccc2F)ccc1=O 1335548396 ZKUCKPXPSADATE-UHFFFAOYSA-N 335.335 1.661 10 10 EDCE COc1ccc(N2CCC(NC(=O)C(=O)NC[C@H]3C[C@H]3C)CC2)cc1 1345185560 GTRQUQCYWHNQQB-ZIAGYGMSSA-N 345.443 1.552 10 10 EDCE Cc1ccc(O)c(CNC(=O)CCc2nc(-c3ncccn3)no2)c1 1453646898 CHWGGFHCYMICDC-UHFFFAOYSA-N 339.355 1.790 10 10 EDCE CCc1ccc(NC(=O)c2cc(O)cs2)cc1S(N)(=O)=O 1464531572 ODLPEMJCCPENBO-UHFFFAOYSA-N 326.399 1.916 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C2CCN(C)CC2)cc1C 1480531311 XQUBQAZVVWHAMC-HNNXBMFYSA-N 333.476 1.940 10 10 EDCE COc1ccc(CNC/C=C\CNC(=O)c2cncnc2O)cc1C 1716309112 VCZCHFXEUVSDTF-ARJAWSKDSA-N 342.399 1.575 10 10 EDCE 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10 10 EDCE COc1ccc(NC(=O)CN2C(=O)[C@H](C)SC2=S)c(OC)c1 11635483 LMRSTVRSYNADTK-QMMMGPOBSA-N 340.426 1.891 10 10 EDCE O=C(CSc1ncnc2[nH]cnc12)NCCc1ccc(O)c(O)c1 1860381461 CKBVAHQGNSLVJY-UHFFFAOYSA-N 345.384 1.215 10 10 EDCE COc1ccc(N2CCN(C(=O)[C@H](C(C)C)n3cnnn3)CC2)cc1 1873831276 AHARPHHZGZZWHU-INIZCTEOSA-N 344.419 1.228 10 10 EDCE COc1ccc(-n2c(C)cc(C(=O)NCCCNC=O)c2C)cc1 1874027118 AWHBHSMQXGEKAM-UHFFFAOYSA-N 329.400 1.969 10 10 EDCE CCNC(=S)NC1CCN(CCCOc2ccc(N)cc2)CC1 586051963 IKAUDUXJVQOERT-UHFFFAOYSA-N 336.505 1.986 10 10 EDCE CCCCN(CCO)c1cc2c(cc1Br)[C@H](N)C(=O)N2 118712004 RSKQIIDJRDSEAB-ZDUSSCGKSA-N 342.237 2.000 10 10 EDCE CN(C)CCN(CC(=O)NCCCCN=[N+]=[N-])C(=O)OC(C)(C)C 2010393005 MKPABJOOHJKHFC-UHFFFAOYSA-N 342.444 1.992 10 10 EDCE C[C@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)N1CC(NC(=O)OC(C)(C)C)C1 2014687019 UBIIKVIWFSDURT-MNOVXSKESA-N 338.412 1.495 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@@]1(CO)C(=O)Nc1ccc(N)cc1 2022801996 PPZNWXUIXVKMHM-QGZVFWFLSA-N 335.404 1.969 10 10 EDCE O=C(NCCCCNOCc1ccccc1)c1cc(O)nc(O)c1 308385438 HHZFPBGTFNAZJN-UHFFFAOYSA-N 331.372 1.724 10 10 EDCE C[C@@H](OCc1ccccc1)[C@@H](NC(=O)c1cc(O)nc(O)c1)C(=O)O 706713966 INVJWHNNNVBVJD-MEBBXXQBSA-N 346.339 1.281 10 10 EDCE C[C@@H]1[C@@H](NCc2c(O)cccc2Br)CCS1(=O)=O 706875228 QUERAOGXLNURTE-KCJUWKMLSA-N 334.235 1.820 10 10 EDCE O=C(O)CN1C(=O)C(=Cc2ccc3c(c2)OCCO3)SC1=S 2053527992 CCTWEMKRVCWJJX-UHFFFAOYSA-N 337.378 1.744 10 10 EDCE CCN1CC[C@H](N(C)C(=O)c2cnn3c(O)cc(C)nc23)C[C@H]1C 2062083919 AHWLGUQVFGJAOL-OLZOCXBDSA-N 331.420 1.688 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CC(=O)Nc2ccc(N)cc2)[C@H]2C[C@@H]21 2044676184 QPEHAKBINQCFGK-GJZGRUSLSA-N 346.431 1.901 10 10 EDCE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H]2[C@H](O)[C@@H]3O)cc1Br 2104424064 MELQUKUGBSFLIO-XPBUTXNASA-N 327.222 1.399 10 10 EDCE C[C@]1(CO)COCCN1c1ccc(CN)c(Br)c1F 2112706061 QLCZZTONYNOKAM-ZDUSSCGKSA-N 333.201 1.635 10 10 EDCE O=C1OC[C@@H]2CN(c3ccc(CO)c(Br)c3)CCN12 2114275508 WSGLOWAJNIOZSL-NSHDSACASA-N 327.178 1.582 10 10 EDCE OCc1ccc(N2CCc3nnc(O)cc3C2)cc1Br 2206098793 LHPNMQAEBDPQOG-UHFFFAOYSA-N 336.189 2.000 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2OCC[C@@]2(C(=O)N2CC(N=[N+]=[N-])C2)C1 2253375455 KNPXYAZNHZCTQC-IAQYHMDHSA-N 337.380 1.534 10 10 EDCE O=C(O)[C@H](Cc1cnc[nH]1)N1C(=O)C(=Cc2ccc[nH]2)SC1=S 2323718573 DFNBQOGLVLVLSQ-JTQLQIEISA-N 348.409 1.635 10 10 EDCE CC(C)(C)OC(=O)NCc1c[nH][nH]c1=NC(=O)c1ccc(O)c(O)c1 2327328548 LGZCUZTUXLXKMR-UHFFFAOYSA-N 348.359 1.520 10 10 EDCE C[C@H](O)c1ccc(N2CC3(COC(=O)N3)C2)c(Br)c1 2351836910 LSTZCAOSEWOWQZ-QMMMGPOBSA-N 327.178 1.801 10 10 EDCE NCc1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)c(F)c1Br 2355345523 ZACMVFHHEMOBKY-LPISUOKISA-N 345.212 1.367 10 10 EDCE N[C@H]1C(=O)Nc2cc(N3CC[C@H]4[C@@H]3C[C@H]4O)c(Br)cc21 2355698743 XFUDEJQRANFMOX-JZYVUTCPSA-N 338.205 1.361 10 10 EDCE COc1ccc(CNC(=O)C(=O)N(C(C)=O)c2ccc(N)cc2)cc1 170318206 CYOAUKBLHXXRGD-UHFFFAOYSA-N 341.367 1.473 10 10 EDCE Cc1nccn1CCCN(C)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 120193911 WPPVMZJAURFSJG-UHFFFAOYSA-N 345.359 1.957 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)CNc1ccc(C(N)=O)cc1 72816509 NPASDJOFDYLXTH-UHFFFAOYSA-N 340.427 1.922 10 10 EDCE CCC(CC)C(=O)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 41428759 CWMGMPRYPRSQBF-UHFFFAOYSA-N 347.459 1.896 10 10 EDCE CC(C)[C@H](NC(=O)/C=C\c1ccc(N2CCOCC2)cc1)C(=O)O 255215603 MTLXEFDLBGAXAN-AFCDSYGPSA-N 332.400 1.762 10 10 EDCE NC(=O)C[C@@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1 367468621 BGTNWKJBFRTQTQ-HNNXBMFYSA-N 330.432 1.694 10 10 EDCE COc1cc(O)c(CN[C@@H](CO)C[C@@H](O)C(C)(C)C)cc1OC 284284021 ATHTUWDNLDYQLJ-MLGOLLRUSA-N 327.421 1.657 10 10 EDCE COC(=O)[C@@H](C)NC(=O)NCc1ccc(C)c(Br)c1O 2380726245 OWMDSERDBQRWNI-MRVPVSSYSA-N 345.193 1.824 10 10 EDCE C[C@@H](CO)N(C)C(=O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 297926584 URLCLLFOWXGCNX-HNNXBMFYSA-N 347.459 1.475 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2OCCO[C@@H]2C)c(O)c1Br 2381131609 QBMKJVVWYCOADO-NOZJJQNGSA-N 344.205 1.883 10 10 EDCE COC(=O)C1(CS(=O)(=O)Nc2ccc(O)c(OC)c2)CCCC1 290490974 JFKNXCGSZWJZDE-UHFFFAOYSA-N 343.401 1.876 10 10 EDCE CC[C@H]1[C@@H](CO)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1 837818055 XYKHUIQCEDKWMH-AEFFLSMTSA-N 347.459 1.826 10 10 EDCE COc1ccc(N(C)CCN(C)S(=O)(=O)CC(C)(C)OC)cc1 845987996 RBFREJPKJSUHOZ-UHFFFAOYSA-N 344.477 1.818 10 10 EDCE COC(=O)/C=C\c1ccc(N2CC[C@H](C(=O)N(C)C)C2)c([N+](=O)[O-])c1 840365617 XFRQUEPCWLCLMO-VGVVRCBHSA-N 347.371 1.696 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H](CO)[C@H](c2cc(O)c(O)c(O)c2)C1 687734654 ZCWIUOKVLPQJSJ-QWRGUYRKSA-N 325.361 1.746 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCNC[C@H]2C)cc1 846172414 MFELBAFNDAYAQZ-RHSMWYFYSA-N 334.464 1.771 10 10 EDCE COc1cccc(CNC(=O)NCCNC(=O)c2ccccc2)c1O 745433875 NIZLUAHZJFQXNA-UHFFFAOYSA-N 343.383 1.630 10 10 EDCE CC[C@@H](NCC[C@H]1CNCCS1(=O)=O)c1cc(Cl)ccc1O 925787796 CMZWPIKNISSCLT-GXTWGEPZSA-N 346.880 1.863 10 10 EDCE Cn1nccc1[C@@H](O)CNCc1ccc(N2CCOCC2)c(F)c1 922974813 ZIQGWGIZMCZWSV-KRWDZBQOSA-N 334.395 1.219 10 10 EDCE COC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccccc2O)cc1 751236373 UGIJOAUMNSZJIO-UHFFFAOYSA-N 335.381 2.000 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC(C)(C)C(N)=O)C2)cc1 853450202 QSVWEJMZTYXKNO-LBPRGKRZSA-N 334.420 1.085 10 10 EDCE COC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nn1 853759279 QSWPTOGANXVVTP-LBPRGKRZSA-N 328.372 1.963 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NOC3CCOCC3)C2)cc1 852257515 SMMOVPBILONOSU-CYBMUJFWSA-N 335.404 1.684 10 10 EDCE NCC1(NC(=O)NCCCSc2nccs2)CCOCC1 861610087 VOFHJNMVBWCBAB-UHFFFAOYSA-N 330.479 1.432 10 10 EDCE C[C@H]1CN(Cc2cc(F)c(N(C)C)cc2F)[C@H](C)CN1CCO 862396743 YAHKAECMMXCRLR-QWHCGFSZSA-N 327.419 1.918 10 10 EDCE C[C@@H]1C[C@H](CO)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1 868130905 VHDUSNMCAUGDHE-NVXWUHKLSA-N 347.459 1.826 10 10 EDCE CCOC(=O)C[C@H](O)CN1CCN(c2ccc(OC)c(F)c2)CC1 767117599 GQIUKCGSWAGEIE-AWEZNQCLSA-N 340.395 1.270 10 10 EDCE O=C1OC[C@@]2(CNCc3ccc4ccccc4c3O)COCCN12 872261134 JKULCVPVZQUNBE-GOSISDBHSA-N 328.368 1.856 10 10 EDCE Cc1cc(Br)c(O)c(CNCCC2CS(=O)(=O)C2)c1 786824758 MKAWNJCBLCQNDG-UHFFFAOYSA-N 348.262 1.987 10 10 EDCE O=S(=O)(NCCNCc1c(O)cccc1Br)C1CC1 1964609383 FCIJOWQZPOJXPA-UHFFFAOYSA-N 349.250 1.326 10 10 EDCE COc1ccc(C(=O)NCc2ccc(O)cc2O)cc1-n1cnnn1 1162277971 FPNXRRHVPGLYBE-UHFFFAOYSA-N 341.327 1.012 10 10 EDCE COc1ccc(CN[C@H](CNC(=O)[C@@H]2CCNC2=O)C2CC2)cc1C 1317023756 CALGNDWSVIJJAV-HZPDHXFCSA-N 345.443 1.124 10 10 EDCE C[C@H](CN(C)C(=O)C(=O)N1Cc2cccc(O)c2C1)c1nccs1 1329436241 RDUHYHVXBRNHHR-LLVKDONJSA-N 345.424 1.953 10 10 EDCE O=C(C(=O)N1CC[C@@H]([C@H]2CCOC2)C1)N1Cc2cccc(O)c2C1 1329845027 YTFPYLIAUIBIGB-OCCSQVGLSA-N 330.384 1.119 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NC[C@@H](O)Cc1ccccc1F 1177982230 VELKQYNVGHNTIG-QPBFKRLHSA-N 331.343 1.970 10 10 EDCE COc1ccc(CNC[C@]2(C)CCN(C(=O)CNC(C)=O)C2)cc1C 1270671118 BAOBBYWJUPCKJK-IBGZPJMESA-N 347.459 1.468 10 10 EDCE COc1ccc(CN[C@@H]2CCN(C(=O)CCCC(N)=O)[C@@H]2C)cc1C 1507303286 WUOHYILIIVIJMR-GDBMZVCRSA-N 347.459 1.738 10 10 EDCE O=C(Cc1c(O)ncnc1O)NCc1cc(Cl)cc(Cl)c1O 1298841306 NVMCHCKADHPKMT-UHFFFAOYSA-N 344.154 1.759 10 10 EDCE Cn1nnnc1SCCC(=O)NCc1c(O)ccc2ccccc12 1558553839 CCPIMAHOMGTRMH-UHFFFAOYSA-N 343.412 1.868 10 10 EDCE CN(C)C(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)C(C)(C)C1 1624058898 LUDHSAOAMUYBNH-UHFFFAOYSA-N 335.404 1.245 10 10 EDCE COc1ccc(CNC[C@@H](NC(=O)C2=COCCO2)C2CC2)cc1C 1483542376 FDQCBHCXCCLAEX-MRXNPFEDSA-N 346.427 1.876 10 10 EDCE Cn1cc(N2CC[C@@H](NC(=O)c3ccc(N=NC(N)=O)cc3)C2)cn1 1628428324 CWTPPQMCYSHKIE-CYBMUJFWSA-N 341.375 1.591 10 10 EDCE COC[C@H](C)NC/C=C/CNC(=O)c1ccc(N=NC(N)=O)cc1 1715916978 WEMAPHZBMSFWOL-UQOKPNQJSA-N 333.392 1.760 10 10 EDCE O=C(Cn1nnc(-c2ccccc2)n1)NCc1c(O)cccc1O 1639289101 JPHFFDDLRLIDJZ-UHFFFAOYSA-N 325.328 1.068 10 10 EDCE COc1ccc(CNCC[C@@H]2[C@H](C)CCCN2C(=O)C(N)=O)cc1C 1565938452 IPEXPABRWXYKLQ-CZUORRHYSA-N 347.459 1.596 10 10 EDCE CN(CCNC(=O)CC(C)(C)O)C(=O)c1ccc(N=NC(N)=O)cc1 1758927272 LPQPQSSEQAFPHT-UHFFFAOYSA-N 349.391 1.198 10 10 EDCE COc1ccc(CN[C@H](C)[C@H](C)NC(=O)Cc2cc[nH]n2)cc1C 1674648576 VIGVSVRROWVXHV-KGLIPLIRSA-N 330.432 1.952 10 10 EDCE C[C@H](NC(=O)NCc1nc(C2CCOCC2)n[nH]1)c1ccccc1O 1683287740 REEKXZSTDNAPGE-NSHDSACASA-N 345.403 1.965 10 10 EDCE O=C(O)CN1C(=O)/C(=C2\C(=O)Nc3ccc(F)cc32)SC1=S 2827559 DMJGNHJLNTYYCN-MDZDMXLPSA-N 338.341 1.434 10 10 EDCE CN[C@@H](c1ccccc1O)[C@@](O)(CNC(=O)OC(C)(C)C)COC 1921803927 LXKCXLIBMHDHEF-WMLDXEAASA-N 340.420 1.555 10 10 EDCE CC(=O)N1C[C@@H]2C[C@H]1CN2Cc1ccc(Br)cc1O 1970760108 NEMMJVDUFZUGGF-STQMWFEESA-N 325.206 1.960 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@@]1(NC(=O)OC(C)(C)C)CCOC1 1985103304 SQSNOYVYLIUBJW-CQSZACIVSA-N 327.385 1.829 10 10 EDCE CC(C)(C)OC(=O)N1CCNC(=O)CCN(CCCN=[N+]=[N-])CC1 2006177399 QHURNSWEEATUQH-UHFFFAOYSA-N 340.428 1.746 10 10 EDCE CC[C@@H]1C(=O)NCCN1c1cc(Br)c(CN)cc1F 387913473 AGJKKRRPXOLNGC-LLVKDONJSA-N 330.201 1.762 10 10 EDCE COc1ccc([C@@H](n2nc(C)c(C(N)=O)c2N)C2(C)CC2)c(O)c1 2079970161 OMJYLYAUWNNLKA-CQSZACIVSA-N 330.388 1.976 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H]4[C@H]3CO)c(Br)cc21 2198999392 ZKAYEIZGIXYXIH-CLBUKXALSA-N 338.205 1.218 10 10 EDCE CC(C)(C)OC(=O)N1CCc2c(N3CC4(CNC4)C3)ccc(N)c2C1 2071858612 QSHMHBPQBCUAGK-UHFFFAOYSA-N 344.459 1.972 10 10 EDCE CCNCc1ccc(N2CC[C@@H](O)C[C@H]2CO)cc1Br 2200832605 LKUKIXCLJGJZAA-UONOGXRCSA-N 343.265 1.881 10 10 EDCE NCc1ccc(N2CCN3C(=O)OC[C@H]3C2)cc1Br 2114271793 LCYDQHUEUFCURM-LLVKDONJSA-N 326.194 1.549 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2C[C@H](O)[C@@H](OC)C2)c1O 2236052418 HFYBABHAEWEUQM-WLTAIBSBSA-N 346.221 1.791 10 10 EDCE COc1ccc(Br)c(CNN2CCN(C)CC2)c1O 2227747897 GZLCOWVXRKSBFS-UHFFFAOYSA-N 330.226 1.415 10 10 EDCE O=C(/C=C/c1cnccn1)N(CCN1CCOCC1)c1ccccc1 299693894 MQPMIYIGXFNCMU-VOTSOKGWSA-N 338.411 1.855 10 10 EDCE Cn1cccc1C=C1C(=O)NC(=S)N(c2ccc(F)cc2)C1=O 2296931547 UMLPCBOAIJQWCT-UHFFFAOYSA-N 329.356 1.996 10 10 EDCE Cc1ccc(N2C(=O)C(=CNN3CCCCC3)C(=O)NC2=S)cc1 2297057224 SWSSMNUEQSTCII-UHFFFAOYSA-N 344.440 1.617 10 10 EDCE CO[C@H](CCNC(=O)OC(C)(C)C)C(=O)NCc1ccc(N)cc1 2302446968 GSIQSEYMNNFIGM-CQSZACIVSA-N 337.420 1.815 10 10 EDCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NC[C@H]1CC[C@H](O)C1 2311487615 QCVWPAYWELRDNA-WMZOPIPTSA-N 330.428 1.814 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)C[C@H]2CO)cc1Br 2335183910 XKMGELCTYAXRFF-DLOVCJGASA-N 329.238 1.661 10 10 EDCE C[C@@H]1CN=C(N2CCN(Cc3cc([N+](=O)[O-])ccc3O)CC2)S1 175788993 HNPYQDHKJVXFKY-LLVKDONJSA-N 336.417 1.909 10 10 EDCE CNCc1ccc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)c(Br)c1 2357591993 CSOFFIANRGFREZ-KJEVXHAQSA-N 341.249 1.489 10 10 EDCE Nc1ccc(CNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]32)cc1 216817727 AGEWMIKJLGOOBX-IJEWVQPXSA-N 348.472 1.611 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCc2[nH]ncc21 134713890 YUGXKNNPXPBJPS-MRXNPFEDSA-N 340.427 1.983 10 10 EDCE COC(=O)/C=C/c1ccc(N(CCO)CC(F)F)c([N+](=O)[O-])c1 193023761 DYLOQRYEKDLICM-HWKANZROSA-N 330.287 1.845 10 10 EDCE COCCN(CCOC)C(=S)N(C(C)=O)c1ccc(N)cc1 242688417 CWLQVEFIHNUPNL-UHFFFAOYSA-N 325.434 1.501 10 10 EDCE N[C@@H]1CC[C@@H]2CN(C(=O)/C=C/c3ccc(N4CCOCC4)cc3)C[C@@H]21 248632710 PLOPMPNXOXYWJD-WUKFNQGCSA-N 341.455 1.732 10 10 EDCE COC(=O)CC1(CS(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)CC1 274876340 BTNYMSVUWYEKOW-UHFFFAOYSA-N 343.357 1.175 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@]4(CCCOC4)C3)cc2N1 376486970 KKORJIHHOJFWSQ-INIZCTEOSA-N 333.344 1.933 10 10 EDCE CN(C)c1ccc(CN[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)cc1F 800309932 QBYKPPWMTYQXCS-UKRRQHHQSA-N 343.468 1.699 10 10 EDCE CN1CCC[C@@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 294562293 TWIUMMJXCXEANK-AWEZNQCLSA-N 349.406 1.147 10 10 EDCE Cc1cc(CCNC(=O)CCNC(=O)CO)c(C)n1-c1ccccc1 905487323 YJPDQHKFMQEUGQ-UHFFFAOYSA-N 343.427 1.251 10 10 EDCE CCN(CC)c1ccc(CNC(=O)N2C[C@@H]3C[C@H]2C[S@@]3=O)cc1 844898934 PPFYLXNRLVNEJS-KXNSMUHISA-N 335.473 1.948 10 10 EDCE COc1c([N+](=O)[O-])ccc(CN2CCNC[C@H]2c2cccnc2)c1O 843113658 AAALRAKYXFDCTI-HNNXBMFYSA-N 344.371 1.851 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)NCC3(N(C)C)CC3)C2)cc1 922985803 KZATWHKJPKSGMQ-AWEZNQCLSA-N 332.448 1.667 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@H](O)CC3)C2)cc1 854298288 ZPVLBUIPDHJLTK-HOCLYGCPSA-N 333.432 1.830 10 10 EDCE NC(=O)Cc1ccc(NS(=O)(=O)c2cc(F)cc(F)c2O)cc1 753015224 BPBLXDVFSJKKDN-UHFFFAOYSA-N 342.323 1.499 10 10 EDCE CO[C@H](CS(=O)(=O)N1Cc2cccc(O)c2C1)C1CCOCC1 867691054 QGEWRLDQBULOQM-MRXNPFEDSA-N 341.429 1.479 10 10 EDCE Cn1ncc(S(=O)(=O)NCc2ccccc2O)c1C(F)(F)F 866828537 AUURHWUKFOPVBC-UHFFFAOYSA-N 335.307 1.623 10 10 EDCE CCOC(=O)C[C@@H](O)CN1CCN(c2ccc(OCC)cc2)CC1 1118815454 JHUCHJFJYMFVDS-MRXNPFEDSA-N 336.432 1.521 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1C[C@H]1c1cnc[nH]1 874155491 SFYSZZRBFBMURI-HZPDHXFCSA-N 326.400 1.666 10 10 EDCE C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 899414309 QYPSIGQOQZRFLE-VCDKRKBESA-N 338.429 1.786 10 10 EDCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCCS(=O)(=O)CC1 896289307 RSRBJPLCQJWUQL-UHFFFAOYSA-N 341.410 1.573 10 10 EDCE O=C(Cn1c(O)nnc1O)N(Cc1ccco1)Cc1ccccc1O 1149856548 ARUIMANEPVYZKQ-UHFFFAOYSA-N 344.327 1.217 10 10 EDCE COC(=O)[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)c2ccccc21 1156693988 OXDFEHDFRIHYLM-CYBMUJFWSA-N 327.336 1.944 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@@H]1CC(=O)N(Cc2ccco2)C1 1162277916 DDLUIAJRCKDJQD-GFCCVEGCSA-N 330.340 1.356 10 10 EDCE COc1ccc(Cc2nn(Cc3ccc(N)cc3)c(=O)nc2O)cc1 82720959 QEPSPYLIWIFALD-UHFFFAOYSA-N 338.367 1.574 10 10 EDCE CC(C)N1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329419580 MEPYIOZDVXVFIJ-UHFFFAOYSA-N 331.416 1.177 10 10 EDCE C[C@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1261089479 OJJKEPIVOOZVND-WMLDXEAASA-N 343.427 1.220 10 10 EDCE COC[C@H](OC)C(=O)N[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1265557884 GRFZQWFKFZLCJO-UXLLHSPISA-N 336.432 1.402 10 10 EDCE C[C@@H](NC(=O)NCc1cccc(Cl)c1O)[C@H]1CN(C)CCN1C 1346765642 BMTGESSFOHTWII-BXUZGUMPSA-N 340.855 1.479 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1c(C)nc(O)nc1O 1297562926 SSALKMPCRSCWAD-UHFFFAOYSA-N 338.360 1.246 10 10 EDCE COC(=O)C[C@@H]1CCC[C@H]1NC(=O)NCc1ccc(OC)cc1O 1528107772 CASWOJAMBWPFJG-SMDDNHRTSA-N 336.388 1.932 10 10 EDCE C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)C(C)(C)F 1526697883 HKXVUCRBIVPWCA-SECBINFHSA-N 337.355 1.832 10 10 EDCE COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)C(C)(C)C(N)=O)cc1C 1700406284 XMARILBCFQCELP-CHWSQXEVSA-N 335.448 1.498 10 10 EDCE NC(=O)[C@H]1Cc2ccccc2N(C(=O)Cc2ccc(O)c(O)c2)C1 1542837197 IQRBHICAHLEXSL-ZDUSSCGKSA-N 326.352 1.331 10 10 EDCE O=C(NCc1cnc(Br)cn1)c1c(F)ccc(O)c1O 1558981135 ZXESOFAHYZXBMC-UHFFFAOYSA-N 342.124 1.719 10 10 EDCE CN1C(=O)[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)Cc2ccccc21 1557449116 QHSMFYBQISYURH-IUCKJTJTSA-N 338.363 1.815 10 10 EDCE COc1ccc(-n2nnnc2CNCC[C@@H](C)NC(=O)C(C)C)cc1 1716121262 YCMZOEQFPCPWQO-CYBMUJFWSA-N 346.435 1.311 10 10 EDCE CCC(=O)N[C@H](C)C(=O)N[C@@H](C)CNCc1ccc(OC)c(C)c1 1498049928 ZXSSGYPIYQALCD-UONOGXRCSA-N 335.448 1.513 10 10 EDCE CC[C@H](CNC(=O)[C@H]1C[C@@H]1C)NC(=O)c1cc(OC)nc(OC)c1 1499276687 IFULWDALYNETCA-UHTWSYAYSA-N 335.404 1.379 10 10 EDCE CC[C@H](C)CC(=O)N[C@H]1C[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1720822604 LAHLYRLIFSWMSE-FPMFFAJLSA-N 349.431 1.912 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)[C@H]2CCNC(=O)C2)cc1C 1491433141 ZGRGAZZBVYFAKY-ZFWWWQNUSA-N 333.432 1.124 10 10 EDCE CC(C)c1nnc(N(C)Cc2ccccc2O)n1Cc1ncn(C)n1 1723145392 ZJHOIMFOJZFUFQ-UHFFFAOYSA-N 341.419 1.920 10 10 EDCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)[C@H](O)CC 1632356656 TVIQWLPIJCXICV-KGYLQXTDSA-N 339.388 1.095 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CCN(c2ccncc2)C1 1654410141 SHWOKKFDGNCBTI-CQSZACIVSA-N 327.384 1.678 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)c2[nH]c(O)nc2C)cc1C 1666926618 BKCDKSWCXGILDM-GFCCVEGCSA-N 346.431 1.991 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)C[C@@H]2CCCC(=O)N2)cc1C 1690600115 OPBYMRIORQYPMT-ZBFHGGJFSA-N 347.459 1.657 10 10 EDCE COC(=O)C1CCN(/N=N/c2ccc3c(c2)OCC(=O)N3C)CC1 1860487653 IIXSFEGUOYNGLD-ISLYRVAYSA-N 332.360 1.926 10 10 EDCE O=C(CCN1C(=O)CSC1=S)Nc1ncccc1[N+](=O)[O-] 1865767704 BSTLEABZFAAMME-UHFFFAOYSA-N 326.359 1.179 10 10 EDCE Nc1ccc(OCCN2CCC[C@@H](NC(=O)[C@@H]3CCCO3)C2)cc1 586067946 ZAUJRXQPPCWOCZ-WBVHZDCISA-N 333.432 1.407 10 10 EDCE Nc1ccc(OCCN2CCC[C@H](NC(=O)[C@@H]3CCCO3)C2)cc1 586067945 ZAUJRXQPPCWOCZ-RDJZCZTQSA-N 333.432 1.407 10 10 EDCE Oc1cccc(Br)c1CNCC1(F)COCCOC1 2130653562 XLPNXNNZUJVLAG-UHFFFAOYSA-N 334.185 1.999 10 10 EDCE [N-]=[N+]=NCCNC1(C(N)=O)[C@H]2CC[C@H]1CN(Cc1ccccc1)C2 1949746121 FBMUKSGUKDYHJO-GJZGRUSLSA-N 328.420 1.652 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCCCN=[N+]=[N-])CCOC1 1985102882 NEFSACOAZKDONF-CQSZACIVSA-N 327.385 1.877 10 10 EDCE CN(C[C@@](C)(O)C(=O)O)c1ccc(CNC(=O)OC(C)(C)C)cc1 1999353137 GMNWDVYSDWKGBM-QGZVFWFLSA-N 338.404 1.983 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@@H](O)C(C)(C)C 2017669843 RFQUDDAVKMWWQZ-WDEREUQCSA-N 341.412 1.808 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](CO)(NCc2ccc(F)cc2O)C1 2024887857 JVHXGEFCKUKROF-KRWDZBQOSA-N 340.395 1.993 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3Cc4conc4C3)c(Br)cc21 2160432111 XVNZLPMFUDXIKC-LBPRGKRZSA-N 335.161 1.909 10 10 EDCE C[C@@H]1CN(c2ccc(CO)cc2Br)CCS1(=O)=O 707379299 QSTXROCPUALBPA-SECBINFHSA-N 334.235 1.565 10 10 EDCE Oc1c(F)cc(Br)cc1CN1CCN(C2CNC2)CC1 715776594 ALNATZKWQGYMDV-UHFFFAOYSA-N 344.228 1.383 10 10 EDCE C[C@H](N)c1ccc(N2C[C@@H](O)[C@H](N(C)C)C2)cc1Br 2089926804 NCAPQIIAOFDPEH-CUOATXAZSA-N 328.254 1.580 10 10 EDCE COCCNCc1ccc(N2CC[C@H]2CO)cc1Br 2092549183 RZXCVMBRFPIROQ-ZDUSSCGKSA-N 329.238 1.756 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2CN(Cc3ccc(N)cc3)C[C@H]2[C@H]1CO 2220131232 OEUWIAXFMPXDLW-USXIJHARSA-N 347.459 1.928 10 10 EDCE O=C(O)[C@@H]1CC[C@H](O)CN1Cc1c(O)cccc1Br 2264529378 RKOJZEIAPVNBDA-KWQFWETISA-N 330.178 1.565 10 10 EDCE CCN(CC)CCCNC=C1C(=O)NC(=O)N(Cc2ccco2)C1=O 2296114111 MOZJLAOQRUIXCN-UHFFFAOYSA-N 348.403 1.063 10 10 EDCE CCOC(=O)[C@@H](C)CNC(=O)C=Cc1ccc(N2CCOCC2)cc1 2297807087 JVKLQLQNOUAXBO-HNNXBMFYSA-N 346.427 1.852 10 10 EDCE Cc1ccccc1N1C(=O)NC(=O)C(=CN[C@H]2NC=CS2)C1=O 2313577441 VJSRECGPQIYZJG-CQSZACIVSA-N 330.369 1.143 10 10 EDCE C[C@H](O)c1ccc(N2CC(O)(CN(C)C)C2)cc1Br 2343627700 BPJMMZGXUJZHMU-JTQLQIEISA-N 329.238 1.615 10 10 EDCE CO[C@H]1CNC[C@@H](NCc2ccc(C)c(Br)c2O)C1 2352942196 AZVXDEKVLSUNIE-NWDGAFQWSA-N 329.238 1.930 10 10 EDCE COc1cccc(CNC(=O)[C@H](C)NC(=O)c2ccccc2)c1O 105653041 MFJDEICUSVELQW-LBPRGKRZSA-N 328.368 1.836 10 10 EDCE C[C@@H](OCCCNC=C1C(=O)N(C)C(=O)N(C)C1=O)c1ccccc1 52536836 ATHNUEZBKXBOJJ-CYBMUJFWSA-N 345.399 1.678 10 10 EDCE CCCNC(=O)CNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 108767884 MVJTUUQHDRNMFC-VMPITWQZSA-N 331.416 1.179 10 10 EDCE CN(C)C[C@H]1CN(C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 117040826 HYDNKCZGDIARSZ-KRWDZBQOSA-N 346.475 1.541 10 10 EDCE CC(C)c1nc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c[nH]1 133731878 UIDIDIUEKSBYEE-UHFFFAOYSA-N 326.334 1.948 10 10 EDCE Cc1ccc2c(c1)CCCN2C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 96794641 MYYCTJRFIPYTNY-CLFYSBASSA-N 339.395 1.385 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@@H](N4CCCC4)C3)cc2N1 91453334 MPXQVXXRUDIXAX-GFCCVEGCSA-N 346.387 1.990 10 10 EDCE O=C1COc2cc([N+](=O)[O-])c(N3CCOCC4(CCC4)C3)cc2N1 375198111 UCQWEALTTQJPAN-UHFFFAOYSA-N 333.344 1.933 10 10 EDCE Cc1ccc(CN2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)c(O)c1Br 2380815521 QHZJQJXHSUVLAV-AGCIHXOGSA-N 342.233 1.637 10 10 EDCE C[C@@H]1C[C@H]1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 727846469 LUXNDWPDYXPNDS-XNRPHZJLSA-N 330.432 1.596 10 10 EDCE Cc1cc(CC(=O)N[C@H]2CCN(C(N)=O)C2)c(C)n1-c1ccccc1 827470745 IFUZHHZLYFCROL-INIZCTEOSA-N 340.427 1.906 10 10 EDCE CN(C)CCN1CCN(Cc2cc(Cl)cc(Cl)c2O)CC1=O 846010057 AAKRODVBKUERLC-UHFFFAOYSA-N 346.258 1.905 10 10 EDCE CCOCc1cc(CN[C@@H](C(=O)OC)c2ccnn2C)ccc1OC 843430039 MVIJBPHEWZZYPV-QGZVFWFLSA-N 347.415 1.969 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@](C)(CO)C(C)C)C2)cc1 854298207 YFNXIIOJUXQFIF-KDOFPFPSSA-N 335.448 1.980 10 10 EDCE C[C@H](NC[C@@H](O)CS(C)(=O)=O)c1cc(Cl)c(Cl)cc1O 927024437 KNSAFQQQYRFQDN-JGVFFNPUSA-N 342.244 1.755 10 10 EDCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CC12CC2 855396851 ZRDWHTUECKANHQ-HNNXBMFYSA-N 334.441 1.338 10 10 EDCE C[C@H](NC(=O)N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccccc1O 868288124 YARCYMCTTVLDSA-ONGXEEELSA-N 345.321 1.916 10 10 EDCE COC(=O)[C@@]1(OC)CCN(Cc2cc(OC)c(OC)cc2O)C1 862475568 OULACIVVOIILNN-MRXNPFEDSA-N 325.361 1.173 10 10 EDCE COc1cc(O)c(CN2C[C@H](O)CC3(CCOCC3)C2)cc1OC 1119450950 QKCVIYDGLOLVKT-CQSZACIVSA-N 337.416 1.773 10 10 EDCE C[C@@H](C(=O)N1Cc2cccc(O)c2C1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 871200225 ZWHDQVVFCSUDRX-FPMFFAJLSA-N 342.395 1.798 10 10 EDCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1[C@@H]2CCCO[C@@H]21 780384368 HJIVGFMAIQTMCL-OTWHNJEPSA-N 344.455 1.937 10 10 EDCE CN(Cc1cnc(N(C)C)nc1)C(=O)/C=C\c1ccc(O)c(O)c1 781026337 JFBHULVMIRNREB-ALCCZGGFSA-N 328.372 1.626 10 10 EDCE CNC(=O)N1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 896799899 VYJFWQLKALERLS-UHFFFAOYSA-N 335.385 1.410 10 10 EDCE CCN(CC)CCS(=O)(=O)N(C)Cc1ccc(N(C)C)cc1 786945638 AUBLWOUPUMQGGD-UHFFFAOYSA-N 327.494 1.856 10 10 EDCE COc1nn(C)cc1NC(=O)NCc1ccc(N2CCOCC2)cc1 789317211 HJQQOBFJNYWAEO-UHFFFAOYSA-N 345.403 1.587 10 10 EDCE COC(=O)c1c(CN2C[C@H]3C(=O)OC[C@H]3C2)c2cc(F)ccc2n1C 895413564 GIBVSNGIJUMXOG-ZWNOBZJWSA-N 346.358 1.709 10 10 EDCE CN(C)c1ccc(CNC[C@H]2CCCCN2S(C)(=O)=O)cc1 796511111 PIIBURLLVTYDFX-MRXNPFEDSA-N 325.478 1.656 10 10 EDCE COc1cc(NS(=O)(=O)c2cccc3c2OCCO3)ccc1O 797819312 FFIVHOSWUYRCRB-UHFFFAOYSA-N 337.353 1.973 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H](N3CCOCC3)C2)cc1 1158517562 NZPZNJWLQLXGLP-OAHLLOKOSA-N 345.403 1.786 10 10 EDCE O=C(O)C1(O)CCN(Cc2c(O)cccc2Br)CC1 1890278960 JNBIUGSJULFPOG-UHFFFAOYSA-N 330.178 1.566 10 10 EDCE COC1=C(C(=O)O)NC(=O)N[C@H]1c1cc(Cl)cc(OC)c1O 76256682 ONUVAUFOJSEUPI-QMMMGPOBSA-N 328.708 1.351 10 10 EDCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1NCCCO 1327955496 ATWBDEKKJVUTKP-FZMZJTMJSA-N 333.392 1.282 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CC3(CCC3)CO2)cc1 1333759416 DCTFGEWPJDTCDR-MRXNPFEDSA-N 345.443 1.444 10 10 EDCE CN(C[C@H](O)COCc1ccccc1)c1ccc2c(c1)NC(=O)[C@H]2N 1916368733 HRZXWKJEOKQSBP-YJBOKZPZSA-N 341.411 1.652 10 10 EDCE CNC(=O)[C@H]1CN(C(=O)/C=C\c2cccnc2C)c2ccccc2O1 1264275926 URCNJLCUYLCSPJ-DOOKAGJSSA-N 337.379 1.943 10 10 EDCE Cc1cc(O)c(CN2CN(CCN(C)C)C(=O)[C@H]2C)cc1Cl 1261677825 DHRNXQSZNBUOIT-GFCCVEGCSA-N 325.840 1.906 10 10 EDCE COc1ccc(CNC[C@H]2CCC[C@@H]2NC(=O)CC(N)=O)cc1C 1272253447 PFGIECYPLYNMRE-CABCVRRESA-N 333.432 1.254 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)N2CC(Cc3ccoc3)C2)cc1 1351090747 MKJKGFBGCFLRRK-UHFFFAOYSA-N 341.411 1.663 10 10 EDCE CC(C)(O)[C@@H]1CN(c2ccc(CN)c(Br)c2)CCO1 2117533642 PWKRRLLDYMIRAZ-ZDUSSCGKSA-N 329.238 1.884 10 10 EDCE CCCC(=O)N(C)C1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1299307436 MWFZZJRFICZISI-UHFFFAOYSA-N 331.376 1.932 10 10 EDCE C[C@]1(CC(=O)Nc2c(Cl)ccc3nonc23)CCS(=O)(=O)N1 1539058583 HTIPWVNZAPAPCJ-GFCCVEGCSA-N 344.780 1.287 10 10 EDCE COc1ccc(CNC[C@@H](C)CNC(=O)C[C@H]2COC(=O)C2)cc1C 1482089446 JZHJEDMWYPPXDS-CZUORRHYSA-N 348.443 1.799 10 10 EDCE COc1ccc(CNC[C@H](O)CNC(=O)c2ccncc2C)cc1C 1482730089 ZFRVNBKDFBKDMM-INIZCTEOSA-N 343.427 1.588 10 10 EDCE [N-]=[N+]=N[C@@H]1CCN(S(=O)(=O)c2cncc(Br)c2)C1 1912143433 GGDMIWDPXDYOMC-MRVPVSSYSA-N 332.183 1.917 10 10 EDCE CC(C)N(CCO)CCCNC(=O)c1ccc(N=NC(N)=O)cc1 1567653495 SEOLHYLJGGSMKK-UHFFFAOYSA-N 335.408 1.672 10 10 EDCE NC(=O)N=Nc1ccc(C(=O)NCCCCN2CCC[C@H]2CO)cc1 1631274454 QXADNTZDWUTLPI-HNNXBMFYSA-N 347.419 1.816 10 10 EDCE C[C@H](NC(=O)CN1C(=O)COc2ccccc21)c1ccccc1O 1587446951 DGBANDWKAZFFGU-LBPRGKRZSA-N 326.352 1.995 10 10 EDCE Cc1nsc(N2CCCN(C(=O)Cc3ccc(O)c(O)c3)CC2)n1 1587202723 NDRONNJJTWLHTD-UHFFFAOYSA-N 348.428 1.539 10 10 EDCE COc1ccc(CN[C@@H](C)CN(C)C(=O)c2cnn(C)c2N)cc1C 1774113508 AXDPLPIORJNFGB-ZDUSSCGKSA-N 345.447 1.570 10 10 EDCE COc1ccc(CN[C@H](C)CNC(=O)c2ccc(=O)n(C)c2)cc1C 1690596145 MUYATLXOKRZNGV-CQSZACIVSA-N 343.427 1.610 10 10 EDCE CCC(=O)N[C@@H](C)CN(C)Cc1nnnn1-c1ccc(OC)cc1 1699435028 DBWUJIQLGODLMO-LBPRGKRZSA-N 332.408 1.017 10 10 EDCE Nc1ccc(OCC(=O)N2CCN(C(=O)c3ccco3)CC2)cc1 1860082242 KNQUAZDCZIBATK-UHFFFAOYSA-N 329.356 1.225 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@H](CO)[C@@H](NCc2ccc(N)cc2)C1 2005088541 JYSACSHFAFOBLY-HOCLYGCPSA-N 335.448 1.976 10 10 EDCE CN(CCN=[N+]=[N-])C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 1985099882 BMQIGDBOMLQKPB-LLVKDONJSA-N 327.385 1.781 10 10 EDCE C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 1985104400 IEHNHYAWPMRTHO-GARJFASQSA-N 327.385 1.562 10 10 EDCE CC(C)(C)OC(=O)N[C@](C)(CO)CNCc1ccc(O)cc1O 1985189988 IWBCUDZVZMWDKK-INIZCTEOSA-N 326.393 1.463 10 10 EDCE CN(C1CCC2(CC1)OCCO2)S(=O)(=O)Cc1ccc(N)cc1 2145840258 XDVMEEXAUXPTTM-UHFFFAOYSA-N 340.445 1.716 10 10 EDCE CC(C)(C)OC(=O)N1CCC(Nc2ccc(N)cc2)(C(N)=O)CC1 1999105947 KJVAQRKTABIHPJ-UHFFFAOYSA-N 334.420 1.936 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3OCCN(C)[C@@H]3C2)c(Br)c1 2153997495 YQNSBPDMBZRLGV-COLVAYQJSA-N 340.265 1.988 10 10 EDCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CCC(N=[N+]=[N-])CC1 2010405373 YSDPMPSWBRGETN-SNVBAGLBSA-N 340.384 1.056 10 10 EDCE CN(Cc1ncno1)c1cc2c(cc1Br)[C@H](N)C(=O)N2 2160397436 NLVLZQBZUWEFLI-NSHDSACASA-N 338.165 1.420 10 10 EDCE NCc1ccc(N2CC[C@]3(CNC(=O)N3)C2)c(F)c1Br 2177696284 POLYDSYSZQUHFH-ZDUSSCGKSA-N 343.200 1.309 10 10 EDCE CCN(CC(=O)N(C)C)c1cc(Br)c(CN)cc1F 387984768 IAWPSNRWEUUOIU-UHFFFAOYSA-N 332.217 1.961 10 10 EDCE C[C@H]1COCCN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 399073229 PLZYSTNKCUPMGT-AMIZOPFISA-N 340.221 1.874 10 10 EDCE CO[C@H]1CCN(Cc2cn(C)nc2C(=O)Nc2ccc(O)c(O)c2)C1 2062393727 JNRPJMZQRBPGBW-ZDUSSCGKSA-N 346.387 1.304 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCOC4(CCCCC4)C3)c2n1 2064682923 WEGYNLBLEIDLLZ-UHFFFAOYSA-N 330.388 1.919 10 10 EDCE CCN(c1ccc([C@@H](C)N)cc1Br)[C@@H]1CC(=O)NC1=O 2171191666 BFYHIAGNYIVGTG-PRHODGIISA-N 340.221 1.710 10 10 EDCE CN1C[C@@H]2C[C@H](C1)N2c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2187624727 LSKWBUYZPXHWIS-BFHDXFOESA-N 338.205 1.327 10 10 EDCE CN(C)C[C@H]1CN(c2ccc(CN)cc2Br)CCO1 2113979780 MLKVXSKKGRODGA-LBPRGKRZSA-N 328.254 1.675 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)cc1Br 2201289206 PBNQKVUUUXNRMZ-XFOOOJQKSA-N 338.249 1.897 10 10 EDCE O=C(NCCc1cc(Br)no1)c1cc(O)c(O)c(O)c1 2237172485 SNPHUTLDLQKHKU-UHFFFAOYSA-N 343.133 1.526 10 10 EDCE Cc1ccc(N2C(=O)NC(=O)C(=CNN3CCCCC3)C2=O)cc1 2296125979 XIRVGFOLUYDPMF-UHFFFAOYSA-N 328.372 1.452 10 10 EDCE COCCCN1CCC(NC(=O)C=Cc2ccc(O)c(O)c2)CC1 2307987056 ZKVYMLAEHAVANK-UHFFFAOYSA-N 334.416 1.728 10 10 EDCE OCc1ccc(N2C[C@@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2330385739 KFELOEAIUPNAGD-PWURMNTRSA-N 328.206 1.262 10 10 EDCE Cc1ccc(CNC(=O)Cn2cncn2)c(O)c1Br 2352932123 IENWRKGZXDAJKU-UHFFFAOYSA-N 325.166 1.371 10 10 EDCE Cc1ccc(CNC(=O)[C@]23C[C@H](N)[C@H]2C3)c(O)c1Br 2352933431 YZTOZCHOGGGBEJ-ISTVAULSSA-N 325.206 1.817 10 10 EDCE Nc1ccc(CC(=O)N2CC(n3ccc(Br)n3)C2)cc1 2361514970 PCSIGGFIRQHYHB-UHFFFAOYSA-N 335.205 1.854 10 10 EDCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCCO3)CC2)cc1 269404327 FZULQUYUHGBQOB-GOSISDBHSA-N 347.459 1.503 10 10 EDCE CO[C@H]1CN[C@@H](C(=O)NCc2ccc(C)c(Br)c2O)C1 2380758568 WLLZZWRWKBTHEM-GHMZBOCLSA-N 343.221 1.456 10 10 EDCE O=C(NCCCSc1nccs1)N1C[C@H]2COC[C@@H](C1)O2 802243701 HJXSEZXBZFKYFI-PHIMTYICSA-N 329.447 1.435 10 10 EDCE Cc1ccc(CN2CC[C@@H](N3CC(O)C3)C2)c(O)c1Br 2380806197 TWDSABJLBNTHNK-GFCCVEGCSA-N 341.249 1.714 10 10 EDCE CN(C)C(=O)CNC(=O)NCc1cc(Br)ccc1O 804870566 CYBHDXSTNXIWLZ-UHFFFAOYSA-N 330.182 1.042 10 10 EDCE COc1cccc([C@H](C)NC[C@@]2(OC)CCS(=O)(=O)C2)c1O 903362480 GHBGVKZYXZAJKQ-NHYWBVRUSA-N 329.418 1.255 10 10 EDCE COc1ccc(N2CC[C@@H](NS(=O)(=O)N(C)C3CC3)C2)cc1 849415909 HQWSBEUZUASXNT-GFCCVEGCSA-N 325.434 1.203 10 10 EDCE O=C(NCc1c(O)cccc1F)c1cccn1CCN1CCOCC1 928705372 HWDVODISNBJGNG-UHFFFAOYSA-N 347.390 1.595 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N3CCO[C@@H](CF)C3)C2)cc1 852449589 ULLOMPUQELYGJD-CJNGLKHVSA-N 337.395 1.654 10 10 EDCE COCc1n[nH]c(CNC(=O)NCc2ccc(N(C)C)cc2C)n1 853748826 JKXCOYWDNHUKLZ-UHFFFAOYSA-N 332.408 1.325 10 10 EDCE Cc1cc(N2CC[C@H](OC(=O)c3cccc(O)c3O)C2=O)n(C)n1 758582989 VFNHOWSPDPJLNI-LBPRGKRZSA-N 331.328 1.102 10 10 EDCE NC(=O)[C@@H](C1CC1)N(Cc1ccc(N2CCOCC2)cc1)CC1CC1 931532022 LGPWPJICDCAFMU-LJQANCHMSA-N 343.471 1.999 10 10 EDCE O=C(C[C@@H]1CCS(=O)(=O)C1)NCc1ccc2cccnc2c1O 862028827 LMNTVQMFKDUPQO-NSHDSACASA-N 334.397 1.381 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F 867301866 GZLYJVGILNAVHJ-WQHBLYJGSA-N 349.305 1.491 10 10 EDCE Cc1ccc(C(=O)NC[C@H](O)[C@@H](C)O)cc1-n1c(C)cc(C=O)c1C 871144076 UPYBBOWQUSYTFE-KDOFPFPSSA-N 344.411 1.687 10 10 EDCE COc1c([N+](=O)[O-])ccc(CNCC(=O)NCc2ccco2)c1O 774962517 JCDJMWUDVADJTA-UHFFFAOYSA-N 335.316 1.308 10 10 EDCE NC(=O)CN1CCc2ccc(NCc3cc(F)ccc3O)cc2C1 789770963 YIOURKVCBYADPS-UHFFFAOYSA-N 329.375 1.987 10 10 EDCE COC(=O)c1c(CN2CCN(C)C(=O)C2)c2cc(F)ccc2n1C 894032711 SIDKFYJJQORSGP-UHFFFAOYSA-N 333.363 1.378 10 10 EDCE O=S(=O)(NCc1cc(Br)ccc1O)N1CCCC1 796191553 XJUBWMUQRFUPSV-UHFFFAOYSA-N 335.223 1.585 10 10 EDCE C[C@@H](O)C[C@@H]1CCCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1330418650 QIDKFKZHYLRNAN-OCCSQVGLSA-N 332.400 1.386 10 10 EDCE CN1CCN(c2ccc(CNC[C@@H]3CCO[C@@H]3C(=O)O)cc2)CC1 1331934859 VRWLJDQCFFPWQI-RDJZCZTQSA-N 333.432 1.018 10 10 EDCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(C2CCCC2)CC1 1331936183 DPDDTVHTBNFRIN-UHFFFAOYSA-N 343.427 1.321 10 10 EDCE CCCN1CCC[C@@](CO)(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1271995643 CJEUPRGJAVUGST-QGZVFWFLSA-N 347.419 1.816 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CCCOC1 1446818800 ZHAWHSPYQTZLMT-LLVKDONJSA-N 341.791 1.974 10 10 EDCE COC(=O)[C@@H]1O[C@@H](C(=O)Nc2c(Cl)ccc3nonc23)C[C@H]1C 1525322293 MXFDMGUYRQTNBX-AKGNYGMASA-N 339.735 1.781 10 10 EDCE CC[C@H](C(=O)NCCNC(=O)c1ccc(N=NC(N)=O)cc1)N(C)C 1703236082 SLELNDRYBQMTQK-CYBMUJFWSA-N 348.407 1.035 10 10 EDCE O=C(NCc1c(O)cccc1O)c1cccc(CN2CCOCC2)c1 1558533565 HGYMBOFYSLHLHU-UHFFFAOYSA-N 342.395 1.860 10 10 EDCE CC[C@H](CNC(=O)[C@H]1CCC(=O)NC1)NCc1ccc(OC)c(C)c1 1495014030 VWSNLHZAWYHUMJ-JKSUJKDBSA-N 347.459 1.514 10 10 EDCE O=C(Cn1nc2ccccn2c1=O)NCc1cccc(Cl)c1O 1640401716 BVNNPUQGROBIAT-UHFFFAOYSA-N 332.747 1.171 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)C(=O)NCC2CC2)cc1C 1667023731 PLLIQVHHZCCHCO-CQSZACIVSA-N 347.459 1.466 10 10 EDCE COc1ccc(CN[C@@H](C)CCNC(=O)C(C)(C)C(N)=O)cc1C 1662935719 WONACNDCEAUGLZ-ZDUSSCGKSA-N 335.448 1.500 10 10 EDCE COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(O)c(O)c1 1597475511 VRXFTBBVRADETC-HNNXBMFYSA-N 341.363 1.767 10 10 EDCE C[C@H](NC(=O)NCc1ccc(CC(N)=O)cc1)c1ccccc1O 1686663354 MJPXNPICWQFBLJ-LBPRGKRZSA-N 327.384 1.980 10 10 EDCE CCOCCN1CCN(Cc2cc(OC)c(OC)cc2O)C[C@@H]1C 160211332 ACKVMDBBXMFOSO-AWEZNQCLSA-N 338.448 1.952 10 10 EDCE CN1CCN(c2ccc(/C=C3/SC(=N)NC3=O)cc2[N+](=O)[O-])CC1 6136037 WQEFPBMWARSRKC-UKTHLTGXSA-N 347.400 1.485 10 10 EDCE O=C(NCCc1ccc(O)c(O)c1)[C@H]1CC[C@H](Cn2cnnn2)CC1 1860166688 DWBQQRIMBKPCAS-HDJSIYSDSA-N 345.403 1.250 10 10 EDCE CC[C@](C)(N)C(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 1866113328 PHYRKBBXKGYVTQ-QAPCUYQASA-N 329.448 1.819 10 10 EDCE CCN(CCN=[N+]=[N-])C(=O)C1(O)CC(NC(=O)OC(C)(C)C)C1 1900613418 YBHNQOKUNDTUEW-UHFFFAOYSA-N 327.385 1.563 10 10 EDCE C[C@H]1CN(Cc2cccc(Br)c2O)CCS1(=O)=O 127936614 FLFDQCJZESEETG-VIFPVBQESA-N 334.235 1.774 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1C[C@H]1NS(=O)(=O)Cc1ccc(N)cc1 1977696667 NPKKYZGEFTVPPG-CHWSQXEVSA-N 341.433 1.354 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)CO1 1985094892 VPHCGZAYQFLDIA-KOLCDFICSA-N 325.369 1.437 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)[C@H]1CCCO1 1985102573 IRURBPKTBBMRJK-GHMZBOCLSA-N 325.369 1.580 10 10 EDCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C 1985100999 MHWVPGQOYUUQAC-LLVKDONJSA-N 327.385 1.781 10 10 EDCE CO[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCCN=[N+]=[N-] 1986262036 MOGAYAJCIIJLQU-GHMZBOCLSA-N 327.385 1.685 10 10 EDCE Nc1ccc(OC[C@@H](O)CN2CC(OCc3ccccc3)C2)cc1 1998336133 JDGXQOMEKVLTHY-KRWDZBQOSA-N 328.412 1.910 10 10 EDCE CN(C[C@H](O)CC(=O)O)c1ccc(CNC(=O)OC(C)(C)C)cc1 1999353680 NRLBKRLHZXJDTO-CQSZACIVSA-N 338.404 1.983 10 10 EDCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)CCOC1 2010405476 INRDQGDUWODWAV-XHDPSFHLSA-N 339.396 1.829 10 10 EDCE COc1ccc([C@@H](C)NC[C@H](O)CNC(=O)OC(C)(C)C)c(O)c1 2011422860 VYXCHWUUBQDBKE-NEPJUHHUSA-N 340.420 1.937 10 10 EDCE C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)c1cc(O)c(O)c(O)c1 2015124202 AESGKUAEDZQNHB-SECBINFHSA-N 340.376 1.694 10 10 EDCE Cc1cccc(CNC(=O)[C@@H](N)CN(C)Cc2ccccc2)c1O 2024806618 WKQMSYDKBAOCBN-KRWDZBQOSA-N 327.428 1.776 10 10 EDCE NCc1ccc(N2C[C@@H](O)C(F)(F)C2)c(F)c1Br 2034594610 AYIKYJHEMVRDMY-MRVPVSSYSA-N 325.128 1.863 10 10 EDCE O=S1(=O)C[C@H]2C[C@H]1CN2Cc1cccc(Br)c1O 319995826 KXDZWTJVUCWFGM-ZJUUUORDSA-N 332.219 1.526 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N[C@@H]3CCN(CC(F)(F)F)C3)c2n1 2062786373 LSRMVYDMRYLPKV-SECBINFHSA-N 343.309 1.110 10 10 EDCE C[C@@H](O)c1ccc(N2C[C@@H]3[C@H](CO)CO[C@H]3C2)cc1Br 2178087062 OYPBZGSEPPCXSQ-VWFAINMRSA-N 342.233 1.946 10 10 EDCE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H]4[C@@H](O)C[C@@H]43)c(Br)cc21 2178170615 XFUDEJQRANFMOX-XYVQTYRZSA-N 338.205 1.361 10 10 EDCE C[C@@]1(CO)COCCN(c2ccc(CN)c(Br)c2F)C1 2199845272 MZIFMCQWJZFVKF-CQSZACIVSA-N 347.228 1.882 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1CCOc1nnc(=N)[nH]n1 2213780600 HYWSYOFVYLBBKJ-WDEREUQCSA-N 338.412 1.532 10 10 EDCE COc1ccc(N2C[C@H](CO)[C@@H](CO)C2)c(OC)c1Br 2234892998 NHMHTIZIAZWNSR-NXEZZACHSA-N 346.221 1.503 10 10 EDCE COc1ccc(Br)c(CN2C[C@@H](OC)C[C@@H]2CN)c1O 2236053054 OPMVSEVORNJXBM-ZJUUUORDSA-N 345.237 1.711 10 10 EDCE COc1ccc(Br)c(CN2C[C@H](N)[C@@H]3COC[C@H]32)c1O 2236039763 DHSSPVURODITIR-ZMLRMANQSA-N 343.221 1.321 10 10 EDCE Cc1ccc(N2C(=O)NC(=O)C(=CNC[C@@H]3CCCO3)C2=O)cc1C 2296079316 INCPQAIZLAVDNT-AWEZNQCLSA-N 343.383 1.539 10 10 EDCE Nc1ccc(OCCNC(=O)c2cnnc(Br)c2)cc1 2289781045 KCMFKXSKKRGXCU-UHFFFAOYSA-N 337.177 1.630 10 10 EDCE CCN(CC)CCNC=C1C(=O)NC(=O)N(c2ccccc2)C1=O 2297510214 KJHNBYBPLKUVEH-UHFFFAOYSA-N 330.388 1.085 10 10 EDCE Cc1ccc(CN[C@@H]2CCOC[C@@H]2CO)c(O)c1Br 2352677593 BEMFVPKDXQPWEF-NWDGAFQWSA-N 330.222 1.950 10 10 EDCE O=C1CC[C@@H](COC(=O)/C=C/c2ccc(N3CCOCC3)cc2)N1 108909018 MCDWKHTWRDZCHX-GZTQLTBSSA-N 330.384 1.358 10 10 EDCE CC[C@@H](C)N1C(=O)/C(=C\Nc2cccc3nonc23)C(=O)NC1=S 102698377 NASGDXJYSRVWFW-XZZQCUQZSA-N 345.384 1.560 10 10 EDCE CCS(=O)(=O)N1CCN(c2ccc3c(c2)CCC(=O)N3C)CC1 62093289 IIEHXEYVAQAAQY-UHFFFAOYSA-N 337.445 1.067 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)cc1Br 2358208406 UEOTVNLBCAGXMR-XAGKMFGPSA-N 347.228 1.609 10 10 EDCE CN1CCc2cc([C@H](NN)c3c(Br)ncn3C)ccc21 2362478086 HZKHCJJLCDPZOC-LBPRGKRZSA-N 336.237 1.728 10 10 EDCE c1cnn(C[C@@H]2CN(Cc3ccc(N4CCOCC4)cc3)CCO2)c1 122218825 AXMYNWGRJFAWDB-IBGZPJMESA-N 342.443 1.621 10 10 EDCE O=C1NCCN1C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 127586906 HNFPLPBOBRMCPM-UHFFFAOYSA-N 344.459 1.513 10 10 EDCE Cc1nc(CN(C)C(=O)/C=C/c2ccc(N3CCOCC3)cc2)no1 181812048 RHSMBQPGYUNCOC-VMPITWQZSA-N 342.399 1.886 10 10 EDCE COc1ccc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c(O)c1 92045047 XLRPLLZQUVOYAI-OAHLLOKOSA-N 340.445 1.401 10 10 EDCE O=C(c1c(F)ccc(O)c1O)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O 530275726 HXAFVIKZFRCESH-BDAKNGLRSA-N 329.349 1.029 10 10 EDCE C[C@@H](C1CC1)n1nccc1NC(=O)C(=O)NCc1ccccc1O 277520025 OXXMEQYOCFHGFF-NSHDSACASA-N 328.372 1.815 10 10 EDCE CN(Cc1cn(C)nn1)c1cc(Br)c(CN)cc1F 701765084 COLJPKLUILDHRT-UHFFFAOYSA-N 328.189 1.812 10 10 EDCE Cc1ccc(CNC(=O)C[C@H]2CNC[C@H]2O)c(O)c1Br 2381128933 BHMDUDAMGBHODH-WDEREUQCSA-N 343.221 1.050 10 10 EDCE COc1ccc(N2CCN(CCN[C@H](C)[C@@H]3CCCCN3)CC2)cc1 817892593 BFZKJFYYKPOLTJ-XLIONFOSSA-N 346.519 1.937 10 10 EDCE Cc1ccc(C(=O)OCC(=O)N2CCO[C@@H]3CCCC[C@@H]32)c(O)c1O 727004371 UKKPYTUSNNJHFR-UONOGXRCSA-N 349.383 1.733 10 10 EDCE CCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1C 734405085 AWGDNNGCMAQIHM-OAHLLOKOSA-N 335.473 1.989 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CC[C@@](O)(C(F)F)C1 838486731 RUCXHSHEELHXNC-KRWDZBQOSA-N 337.370 1.974 10 10 EDCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cn2c(n1)CCC2 843757948 GUXUSZKNBWGBMO-UHFFFAOYSA-N 340.427 1.938 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H]4CC[C@H](C3)O4)C2)cc1 854300468 UDVJOJUAQLTOGZ-RRQGHBQHSA-N 331.416 1.847 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)NCC(=O)NCC3CC3)C2)cc1 852248138 PMONMWXSGJJGJH-CQSZACIVSA-N 346.431 1.099 10 10 EDCE CN(C)c1ccc([C@@H](N)CNC(=O)Cc2ccccc2C(=O)O)cc1 864609333 SHPPMQYITMPXNH-KRWDZBQOSA-N 341.411 1.810 10 10 EDCE COCC(=O)N1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 940026687 AVFLUJWUXRBVAR-UHFFFAOYSA-N 347.375 1.170 10 10 EDCE CC(C)[C@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)CCN1C 1118937902 QXJSTEYEKHCQEN-OAHLLOKOSA-N 333.432 1.149 10 10 EDCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(OC)c1O 770374302 LBGJQHWHSBNGQR-UXOAXIEHSA-N 349.383 1.326 10 10 EDCE c1cc(N2CCOCC2)ccc1CN1CCC2(CC1)COCCO2 895694351 FODUUCHIKLTDMW-UHFFFAOYSA-N 332.444 1.905 10 10 EDCE CCOCc1cc(CN[C@H](C(=O)OC)c2ccn(C)n2)ccc1OC 787437697 AFGSQADJRZAAQZ-KRWDZBQOSA-N 347.415 1.969 10 10 EDCE CN1CCN(c2ccc(CNC(=O)/C=C\[C@@H]3CCCO3)cc2)CC1 893608624 XGYOYTFZDIALBD-GIFJBRJJSA-N 329.444 1.790 10 10 EDCE COc1ccc(CNC[C@@H](C)N(C)C(=O)C2(C(N)=O)CC2)cc1C 1319522753 KWAQWRNROZHXHD-CYBMUJFWSA-N 333.432 1.206 10 10 EDCE CCOC(=O)c1cnn2c(O)cc(CN3C4CCC3(CO)CC4)nc12 1176353534 BQVGCUPCTFKHDK-UHFFFAOYSA-N 346.387 1.101 10 10 EDCE COC1(C(=O)NCCCCN=[N+]=[N-])CN(C(=O)OC(C)(C)C)C1 1964945470 YCSXPHLTJJPPMK-UHFFFAOYSA-N 327.385 1.829 10 10 EDCE COc1ccc(CNCC[C@H](C)NC(=O)Cc2nonc2C)cc1C 1320596620 LMNIJTQNUKAJHY-ZDUSSCGKSA-N 346.431 1.922 10 10 EDCE CCOC(=O)c1cc(CN[C@@H]2CCN(c3ccc(OC)cc3)C2)[nH]n1 1327924973 ZECLJTLTQWVONA-CYBMUJFWSA-N 344.415 1.964 10 10 EDCE C[C@@H](O)c1ccc(N(C)C[C@H](O)CN(C)C)cc1Br 690314606 DBTPKOUFCZBXAN-ZYHUDNBSSA-N 331.254 1.861 10 10 EDCE C[C@@H](NC(=O)C(=O)N1CC[C@]12CCOC2)c1ccc(N(C)C)cc1 1331649510 MWOSXYIEGMHQGZ-FZKQIMNGSA-N 331.416 1.321 10 10 EDCE CN1CCN(c2ccc(CN)c(Br)c2F)[C@@H](CO)C1 699476961 GWTSIKAMPWAISZ-SNVBAGLBSA-N 332.217 1.160 10 10 EDCE CNC(=O)[C@@H](C)N[C@@H](C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1266191904 MKPWSBSJYHFEQE-WDEREUQCSA-N 348.407 1.082 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCOC[C@H]1C 1342766161 GHLXELHVNAUUSP-PBHICJAKSA-N 347.459 1.642 10 10 EDCE NC(=O)N1CCC(NCc2ccc(N3CCC(O)CC3)cc2)CC1 1350144137 RINMWTRWJFCDIQ-UHFFFAOYSA-N 332.448 1.280 10 10 EDCE CCOCC(=O)N1CCO[C@@H](CNCc2ccc(OC)c(C)c2)C1 1502036186 OCPRRMZNJBKUAY-INIZCTEOSA-N 336.432 1.357 10 10 EDCE COc1ccc(NC(=O)c2cc(O)cs2)cc1-n1nnnc1C 1611145000 QBSQAUNQMINVPL-UHFFFAOYSA-N 331.357 1.999 10 10 EDCE COc1ccc(N(C)CCN(C)C(=O)C2=C3CCCN=C3NN2)cc1 1628469309 WIXVRHPGGSBATP-UHFFFAOYSA-N 343.431 1.144 10 10 EDCE CNC(=O)COc1ccc(NC(=O)Cc2ccc(O)c(O)c2)c(C)c1 1635113101 BWEHGKUHRQSWKT-UHFFFAOYSA-N 344.367 1.712 10 10 EDCE O=C(/C=C\c1ccc(O)c(O)c1)NCc1ccc(-c2nncnn2)cc1 1631904979 MVYXJHUYMMCHAX-YWEYNIOJSA-N 349.350 1.674 10 10 EDCE COc1nsc(OC)c1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1632681299 PAHMCSJIZSPBMX-MRVPVSSYSA-N 338.385 1.933 10 10 EDCE COc1ccc(CNC/C=C/CNC(=O)C(C)(C)NC(C)=O)cc1C 1568937302 VPLGPJMNXQWIQK-VOTSOKGWSA-N 347.459 1.680 10 10 EDCE CCOC(=O)c1cn(CC)nc1NC(=O)Cc1ccc(O)c(O)c1 1648498557 LIZSJROHSAYUQD-UHFFFAOYSA-N 333.344 1.672 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC[C@H](c1ccccc1)c1nc[nH]n1 1640630180 URFMGWDWUQDEQQ-CQSZACIVSA-N 338.367 1.707 10 10 EDCE COc1ccc(CNC[C@@H](C)NC(=O)CCc2cnn[nH]2)cc1C 1669400051 ZCIHPIMVWHKIAG-CYBMUJFWSA-N 331.420 1.349 10 10 EDCE Cn1[nH]c(CNC(=O)OC(C)(C)C)nc1=NCc1ccc(N)cc1 2011847858 OFIYYQVBASUYMF-UHFFFAOYSA-N 332.408 1.456 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N3CC(OC)C3)c(Br)cc21 312328553 ZEGVHCPYMUNMRC-ZDUSSCGKSA-N 340.221 1.887 10 10 EDCE CN(CCn1cnnc1)c1cc(Br)c(CN)cc1F 707626424 XELHXRVOBBYDON-UHFFFAOYSA-N 328.189 1.775 10 10 EDCE COCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1O 878559786 RQENMIGAKIUVRH-CYBMUJFWSA-N 338.404 1.938 10 10 EDCE OCc1ccc(N2CCN([C@H]3CCOC3)CC2)cc1Br 2171301300 VDNXPUPNFYGZHS-AWEZNQCLSA-N 341.249 1.852 10 10 EDCE CN[C@H](C)c1ccc(N(C)Cc2nnn(C)n2)c(Br)c1 2197844917 FTTZLXSXEBITAH-SECBINFHSA-N 339.241 1.889 10 10 EDCE COc1ccc(N2CCO[C@@H](CN)C2)c(OC)c1Br 2106334991 QRPGVHAZHXFTAS-VIFPVBQESA-N 331.210 1.630 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCNC(=O)C2)c1O 2208771692 HPLFYATYDAEIGE-MRVPVSSYSA-N 329.194 1.532 10 10 EDCE COc1ccc(N2C[C@H](O)C[C@@H](O)C2)c(OC)c1Br 2226544148 GIFLTWNSPUIFPX-RKDXNWHRSA-N 332.194 1.398 10 10 EDCE Cc1cccc(CNCC(CO)(CO)NC(=O)OC(C)(C)C)c1O 2249519988 UZPAEZSZDROOBO-UHFFFAOYSA-N 340.420 1.038 10 10 EDCE NCc1ccc(N2C[C@@H]3OCC[C@@]3(CO)C2)c(Br)c1 2278920988 GXZKSNWJTHTHMU-KBPBESRZSA-N 327.222 1.495 10 10 EDCE COc1ccc(N(CCN)C[C@@H](C)O)c(OC)c1Br 2269954908 SNICDHIRUBIUGO-SECBINFHSA-N 333.226 1.612 10 10 EDCE Cc1ccc(CN[C@@H]2CO[C@@H]3COC[C@H]23)c(O)c1Br 2352949786 JFJCETUDRSAWDD-IJLUTSLNSA-N 328.206 1.967 10 10 EDCE CN[C@@H](C)c1ccc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)c(Br)c1 2354367063 ARVXRDCFODMUEU-OCVOHJKQSA-N 341.249 1.925 10 10 EDCE Cn1c(O)ncc(C(=O)NCc2ccc(N3CCCC3)cc2)c1=O 267649502 RGJDJIBNTHQAGB-UHFFFAOYSA-N 328.372 1.016 10 10 EDCE CN(C[C@@H]1CCCO1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 288660795 VMSNQUFGLLUQCP-KRWDZBQOSA-N 343.427 1.316 10 10 EDCE Cc1ccc(CNC(=O)[C@@H]2CNCCOC2)c(O)c1Br 2380740078 RBBJBYISIFBBSX-LLVKDONJSA-N 343.221 1.315 10 10 EDCE Cc1ccc(CNC(=O)[C@H](C)n2cncn2)c(O)c1Br 2381129032 DDVJEKUFNSCQHV-VIFPVBQESA-N 339.193 1.932 10 10 EDCE C[C@H]1C[C@@H](C)CN(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)C1 386926399 NGPJGUCCDHWMRF-AOOOYVTPSA-N 328.390 1.725 10 10 EDCE CN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)[C@H]1CCN2CCO[C@H]1C2 295138153 PLVSUCDECAKUNK-JSGCOSHPSA-N 341.795 1.859 10 10 EDCE O=C(NCc1ccc(O)c(O)c1)[C@H]1CCc2nnc(C3CC3)n2C1 815836099 PXCGRHLPOKEYIL-LBPRGKRZSA-N 328.372 1.446 10 10 EDCE CCn1ncc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)n1 815115422 ZMOPCAJCAXZVPG-CYBMUJFWSA-N 329.404 1.626 10 10 EDCE Cn1ncc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)n1 815133479 JYYUINNWSTYNGC-UHFFFAOYSA-N 340.475 1.637 10 10 EDCE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CO[C@@H](CCC(=O)O)C1 901605314 QYUXRLGBNMPVQW-HOCLYGCPSA-N 334.416 1.981 10 10 EDCE CNC(=O)C[C@@H](C)NC(=O)NCc1cc(Br)ccc1O 836633014 TVWLOWVVZPHNFR-MRVPVSSYSA-N 344.209 1.479 10 10 EDCE CC[C@@H](O)CC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 837713728 FMVHHADIVVNUJB-GFCCVEGCSA-N 328.359 1.579 10 10 EDCE CC[C@@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)CCN1CC(F)F 841081887 HMKYMGKVPKXNTE-CYBMUJFWSA-N 340.374 1.395 10 10 EDCE COC1(OC)CC[C@H]1NCc1ccc(N2CCC(C(N)=O)CC2)cc1 926873657 NGPZJIKWYZGYOS-QGZVFWFLSA-N 347.459 1.629 10 10 EDCE CN1C[C@@H](CCNC(=O)c2cc3cc(O)c(O)cc3s2)CC1=O 927738355 UGBBHKNLXFRHCS-VIFPVBQESA-N 334.397 1.911 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CN)CC(C)C)C2)cc1 851664579 FWLLBEJFAFLAQL-LSDHHAIUSA-N 334.464 1.947 10 10 EDCE COC(=O)CCNC(=O)CCN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 858541067 GFAPMCCJPHOKRJ-CMPLNLGQSA-N 338.379 1.739 10 10 EDCE Cc1cncc(CCNCc2ccc(N3CCN(C)CC3)cc2)n1 850390855 VQERPQCDICERHQ-UHFFFAOYSA-N 325.460 1.869 10 10 EDCE O=C(NCc1ccc(N2CCOCC2)cc1)NCC1CCC(O)CC1 853474779 OWIBUXSPXNEBAD-UHFFFAOYSA-N 347.459 1.874 10 10 EDCE CN(C)c1ccc(CNc2ccc(C(=O)NCCO)nn2)cc1F 768526993 SIIPZBHUCPOVIJ-UHFFFAOYSA-N 333.367 1.016 10 10 EDCE COc1ccc(Br)c(CNCC2CN(C(N)=O)C2)c1O 1875454325 TVUNWTCTZMOLFM-UHFFFAOYSA-N 344.209 1.263 10 10 EDCE CNC1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 1118042973 GUPQSLYPPVDJMS-CYBMUJFWSA-N 332.448 1.140 10 10 EDCE CCOc1ccc(O)c(CNCC2(S(=O)(=O)N(C)C)CC2)c1 886322050 KAEQQNULYQJPGV-UHFFFAOYSA-N 328.434 1.305 10 10 EDCE C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)N[C@@H](C)C(=O)N(C)C 1317291116 VCWRVGRKWDWACZ-QWRGUYRKSA-N 348.407 1.034 10 10 EDCE CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCCCCN=[N+]=[N-] 1963732109 HHHZSARKRXBOFA-LBPRGKRZSA-N 340.428 1.744 10 10 EDCE COc1ccc(CNC[C@@H](O)CNC(=O)c2ccn(C)c2)cc1C 1320216420 MFOWIOUZHWDNRV-MRXNPFEDSA-N 331.416 1.223 10 10 EDCE C[C@H](NCc1ccc(N2CCN(C)CC2)c(F)c1)c1nnc(O)n1C 1333717356 CXJHXLXMAJZGHY-LBPRGKRZSA-N 348.426 1.262 10 10 EDCE COc1ccc(CNCCN(C)C(=O)C(=O)NCC2CC2)cc1C 1267447487 TUHPQOAFUCJGMG-UHFFFAOYSA-N 333.432 1.078 10 10 EDCE O=C(NCc1ccc(O)cc1O)[C@H]1CCN(c2ccc(F)cc2)C1=O 1451767199 LPTDLUWSIATRPV-OAHLLOKOSA-N 344.342 1.906 10 10 EDCE COCC(=O)NC[C@H]1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1290010318 GGGKCMMLDSBKLV-GSJFWJNXSA-N 347.375 1.120 10 10 EDCE CCOC(=O)CCN(CC)C(=O)CCN1C(=O)CSC1=S 1865765550 BPSXPRFPAAZBKN-UHFFFAOYSA-N 332.447 1.039 10 10 EDCE Oc1cccc(Br)c1CN[C@@]12CC[C@@H](C1)[C@@H](O)[C@H]2O 2120393814 HELKHUPRAWSIAM-IYMWITQMSA-N 328.206 1.519 10 10 EDCE COc1ccc(CNC2(CNC(=O)[C@@H]3CN(C)CCO3)CC2)cc1C 1483723994 GQYHYUZQGMXAHH-KRWDZBQOSA-N 347.459 1.073 10 10 EDCE COc1ccc(CNC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)c(O)c1 1633926391 CVDXXJNPGHOZEW-UHFFFAOYSA-N 326.696 1.616 10 10 EDCE [N-]=[N+]=NC[C@@H]1CCN(C(=O)Cn2cc(Br)ccc2=O)C1 1912187266 GHCLHRYRXLVQJX-VIFPVBQESA-N 340.181 1.770 10 10 EDCE COC[C@H](C)N(C)[C@@H](C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1725199356 BMCBRBQCQWUWGM-RYUDHWBXSA-N 335.408 1.934 10 10 EDCE CN1CCCc2cc(CNC(=O)[C@H]3CCCn4ncnc43)ccc21 1631322308 HXRCMOPSJZBVHY-HNNXBMFYSA-N 325.416 1.854 10 10 EDCE COc1ccc(CNC[C@H](C)CNC(=O)[C@@H]2CCC(=O)N2C)cc1C 1732354117 ITRJOJKNFCXCPO-BBRMVZONSA-N 347.459 1.466 10 10 EDCE COC(=O)c1cccn(CC(=O)N[C@H](C)c2ccccc2O)c1=O 1643742013 KCMBPHFWYVRTDQ-LLVKDONJSA-N 330.340 1.218 10 10 EDCE CC(C)OCC(=O)NC[C@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1584201867 GTPVFTQUYADKNE-NSHDSACASA-N 349.391 1.509 10 10 EDCE Cn1ncc(Br)c1CC(=O)NCc1c(O)cccc1O 1597574534 PAGVQGXSUGNVNI-UHFFFAOYSA-N 340.177 1.453 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)[C@@H]2CCCC(=O)N2C)cc1C 1699430991 YMZADMBUTBYMIJ-HOCLYGCPSA-N 347.459 1.609 10 10 EDCE NC(=O)CC[C@@H](N)C(=O)Nc1ccc(Cc2ccc(N)cc2)cc1 1866105363 HMMRNIMSGJNLBP-MRXNPFEDSA-N 326.400 1.391 10 10 EDCE CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NCc1ccc(O)cc1O 1948516719 CEOSQICTCXLKSV-TZMCWYRMSA-N 338.404 1.727 10 10 EDCE CN(C)C(=O)[C@@H]1CCN(c2cc(Br)c(CN)cc2F)C1 2143703434 PWNXCUIEZMATJB-SECBINFHSA-N 344.228 1.961 10 10 EDCE CC(C)(C)OC(=O)N[C@H]1C[C@@H]1CNC(=O)COc1ccc(N)cc1 1999571595 BIGOFWKLZGBJSV-RISCZKNCSA-N 335.404 1.677 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H]2CCO[C@]2(C(=O)N2CC(N=[N+]=[N-])C2)C1 2010393282 QGHQVZALPXSWQK-MEBBXXQBSA-N 337.380 1.534 10 10 EDCE CC(C)(C)OC(=O)N1CCC[C@]1(CO)C(=O)NCCCCN=[N+]=[N-] 2010390969 KTTDUCLQIPWADF-HNNXBMFYSA-N 341.412 1.955 10 10 EDCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)C1(O)CCC1 2014483725 VEJIGYMEQZDDFI-QWRGUYRKSA-N 339.396 1.706 10 10 EDCE CCN[C@@H]1C(=O)Nc2cc(N(CC(N)=O)Cc3ccccc3)ccc21 2034755990 MHFAPLDGUJKPTE-SFHVURJKSA-N 338.411 1.781 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)CC[C@@H]3O)cc1Br 2161354681 MSVMDHXZZGCCAM-ZQDZILKHSA-N 341.249 1.761 10 10 EDCE NC(=O)COCCNCc1cc(Cl)cc(Br)c1O 708170974 KZHFFMOXMKTORA-UHFFFAOYSA-N 337.601 1.400 10 10 EDCE C[C@H](N)c1ccc(N2C[C@H]3C[C@@H](O)[C@H](O)[C@H]2C3)c(Br)c1 2173316623 DFDFXLNKVFYRGG-NIQAVCIQSA-N 341.249 1.789 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3CCC[C@](CO)(C(C)C)C3)c2n1 2063572253 NEAGRUKDLHEFKX-KRWDZBQOSA-N 332.404 1.614 10 10 EDCE Cc1cc(O)n2ncc(C(=O)NCc3cccc(CN(C)C)c3)c2n1 2064926953 VEEFWNVGRMVRMS-UHFFFAOYSA-N 339.399 1.735 10 10 EDCE NCc1ccc(N2C[C@@H](O)[C@H](O)CC23CCC3)c(Br)c1 2169893498 CSJKKWXZWIFMKS-ZIAGYGMSSA-N 341.249 1.762 10 10 EDCE CNCc1ccc(N2C[C@@H](O)[C@@H](O)CC2(C)C)cc1Br 2188639480 ZLEHZMRSVSMGPV-UONOGXRCSA-N 343.265 1.879 10 10 EDCE NCc1ccc(N2C[C@H](CO)OCC23CC3)c(F)c1Br 2183972332 RDRDXAQDNPNTEN-SNVBAGLBSA-N 345.212 1.777 10 10 EDCE NCc1ccc(N2C[C@H](CO)C[C@@H]2CO)c(F)c1Br 2089907566 LPRQLRZEQMWITJ-PSASIEDQSA-N 333.201 1.226 10 10 EDCE C[C@@H](O)c1ccc(N2CCOC[C@@H](CO)C2)cc1Br 2098241620 COPMVAKKSMYFAX-GHMZBOCLSA-N 330.222 1.948 10 10 EDCE CC(C)(CCCNC(=O)OC(C)(C)C)COc1nnc(=N)[nH]n1 2210648305 WTPQSYGHXGDYBQ-UHFFFAOYSA-N 326.401 1.389 10 10 EDCE COc1ccc(N(C)Cc2c(Br)nnn2C)c(CN)c1 2235960241 UDBVPEAHJWNMJJ-UHFFFAOYSA-N 340.225 1.681 10 10 EDCE CC1(C)C(=O)NC[C@@H]1NCc1cc(Br)cc(F)c1O 2266451501 XBJLIEVUIQAZMC-JTQLQIEISA-N 331.185 1.908 10 10 EDCE NCc1ccc(N2CCC(C3(O)COC3)CC2)c(Br)c1 2287060527 DNFANJTZWPNALW-UHFFFAOYSA-N 341.249 1.886 10 10 EDCE OCc1ccc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)cc1Br 2330385737 KFELOEAIUPNAGD-DGJRKYIQSA-N 328.206 1.262 10 10 EDCE Cc1ccc(CNC(=O)[C@H](C)C2CNC2)c(O)c1Br 2352623980 JAENWSVNCGQRAK-SECBINFHSA-N 327.222 1.935 10 10 EDCE CC(=O)c1cc(F)cc(CN2C[C@H](C)[C@@H](N3CCOCC3)C2)c1O 177256672 BUZXXFGVOYSVCQ-SJCJKPOMSA-N 336.407 1.886 10 10 EDCE CC(=O)N1CC[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 175640081 KDRYLKXKDUOZNL-HNNXBMFYSA-N 349.406 1.147 10 10 EDCE Cc1cc(C(=O)NCCC(=O)NC(N)=O)c(C)n1-c1ccccc1 176115900 VPQBNJGIGOBRGN-UHFFFAOYSA-N 328.372 1.409 10 10 EDCE CCn1cc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)nc1C 315027622 MXMWFURMUBQJEE-UHFFFAOYSA-N 325.346 1.416 10 10 EDCE CCS(=O)(=O)[C@H]1CSCCN1c1ccc(CNC)cc1F 90927602 PNDFMXKYDQECOJ-AWEZNQCLSA-N 332.466 1.859 10 10 EDCE CN(C)CCN(CC(=O)O)Cc1cc(Br)ccc1O 234240568 QESKHUHZZGLQNZ-UHFFFAOYSA-N 331.210 1.603 10 10 EDCE CCOc1cccc(CNC[C@@H]2CCC[C@]23NC(=O)N(C)C3=O)c1O 360017463 DABYZDYYWMGQAP-UGSOOPFHSA-N 347.415 1.601 10 10 EDCE Cc1ccc(CNC(=O)[C@@H](N)[C@@H]2CCCO2)c(O)c1Br 2381129984 SCBAKYHAQQPYHL-JQWIXIFHSA-N 343.221 1.586 10 10 EDCE CO[C@@H](C)[C@H](N)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381133035 JFROTUWXEOUTLO-CABZTGNLSA-N 345.237 1.784 10 10 EDCE CC(=O)C(=O)COC(=O)c1nc(NCc2ccco2)ncc1Cl 808503749 UMLWWACGEOKQOB-UHFFFAOYSA-N 337.719 1.650 10 10 EDCE C[C@@H](c1cc(Br)ccc1O)N1CCN(CC(N)=O)CC1 700795623 CEZWKBCZJQDXDD-JTQLQIEISA-N 342.237 1.319 10 10 EDCE NCc1ccc(N2[C@H]3CC[C@H]2[C@H](O)[C@@H](O)C3)c(Br)c1 2133921767 YQTNHBUFHIPRRS-HBEIAFGSSA-N 327.222 1.371 10 10 EDCE COC(=O)[C@@H]1CO[C@H](CCC(=O)NCc2ccc(OC)cc2O)C1 822612804 UCKBIBOEVNLOMK-GXTWGEPZSA-N 337.372 1.375 10 10 EDCE Cn1cc(CCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)nn1 830900535 ZKNWPMZJJGMQTJ-MRXNPFEDSA-N 344.415 1.661 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)[C@@]3(C)C[C@@H](O)CN3C)C2)cc1 911277000 QLTDDMUESKHTMY-IDHHARJASA-N 347.459 1.093 10 10 EDCE O=C(NCc1ccccc1O)[C@H](C[C@@H]1COCCO1)C(F)(F)F 830527353 ZMGVVRQCSQDIIR-NEPJUHHUSA-N 333.306 1.992 10 10 EDCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCCCn1ccnn1 840343919 FVPZUTPJEUNDLB-OAHLLOKOSA-N 344.463 1.973 10 10 EDCE COC(=O)/C(C)=C/COC(=O)c1cc(NS(C)(=O)=O)ccc1O 748177619 HXQTVXSSLNSORN-RMKNXTFCSA-N 343.357 1.040 10 10 EDCE C[C@@H](NC1CN(S(=O)(=O)N(C)C)C1)c1cc(Cl)ccc1O 858570174 UOFDHUSKGTWTJS-SECBINFHSA-N 333.841 1.187 10 10 EDCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3C[C@@H](C(=O)OC)C3)C2)cc1 854174043 ZRTVCAVKQMIHBD-MELADBBJSA-N 347.415 1.525 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)C(=O)NC(C)C)C2)cc1 854296629 FJYHMPYVEQYGIA-ZIAGYGMSSA-N 348.447 1.486 10 10 EDCE CO[C@H](C(=O)O)C1CN(Cc2cc(Br)cc(F)c2O)C1 1875978606 BKYLPGPRBXNNPD-LBPRGKRZSA-N 348.168 1.825 10 10 EDCE COCCOCCNCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894204178 ZGEUOYZZQQWYNU-UHFFFAOYSA-N 338.379 1.857 10 10 EDCE COc1ccc(N2CC[C@@H](NC(=O)c3cncc4nc[nH]c34)C2)cc1 898580940 PYQRFKJGPSWERP-GFCCVEGCSA-N 337.383 1.975 10 10 EDCE CN(C)C(=O)NCCN(C)C(=O)c1cc2cc(O)c(O)cc2s1 897289527 APAOPYMHDSUFLG-UHFFFAOYSA-N 337.401 1.656 10 10 EDCE Cn1nccc1[C@@H]1C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CCO1 1158230110 MVDZLLBASQQCFU-WMWQSODISA-N 343.383 1.881 10 10 EDCE Cn1nccc1[C@@H]1COCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1300154717 TYGSAIVYSJAILE-AWEZNQCLSA-N 342.359 1.796 10 10 EDCE COC(=O)c1ccc2c(c1)CCN2C(=O)c1ccoc1CC(N)=O 1162575149 QQMCYEUJIONFQE-UHFFFAOYSA-N 328.324 1.297 10 10 EDCE CC1(C)CNC(=O)c2c(C(=O)NCc3ccc(O)cc3O)coc2C1 1162285384 LJXCQXAZGYXHNR-UHFFFAOYSA-N 344.367 1.933 10 10 EDCE O=C(O)[C@@]12CN(Cc3ccc(Br)cc3O)C[C@@H]1CCO2 707652275 SMUQAEFBYLAZOM-IINYFYTJSA-N 342.189 1.830 10 10 EDCE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1cnn(C)c1Br 712458583 DVVAYHYDUKUAKG-MRVPVSSYSA-N 331.174 1.687 10 10 EDCE O=C1Nc2cc(N3[C@H]4CC[C@H]3COC4)c(Br)cc2[C@H]1O 695051288 KWGXUTDXBIPRQY-UVPNAGLESA-N 339.189 1.802 10 10 EDCE COc1ccc(CNCCC[C@@H](C)NC(=O)c2nnn(C)n2)cc1C 1330895792 TTWMKGKHGMXEJV-CYBMUJFWSA-N 346.435 1.215 10 10 EDCE CCCCC(=O)N1CC[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1350448397 NDKBWVNNHCLUIB-CYBMUJFWSA-N 335.404 1.620 10 10 EDCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CCCOC1 1446818805 ZHAWHSPYQTZLMT-NSHDSACASA-N 341.791 1.974 10 10 EDCE O=C(CNC(=O)c1ccncc1)NCc1ccc2cccnc2c1O 1299721098 AYENNGZVTLGSOX-UHFFFAOYSA-N 336.351 1.382 10 10 EDCE COC(=O)c1ncnc(N[C@H](C)Cc2ccc(O)c(O)c2)c1OC 1472755410 XHNCXINBANDNLV-SECBINFHSA-N 333.344 1.726 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 1624955464 ZZCCTRLJAIULHP-QLJPJBMISA-N 346.339 1.787 10 10 EDCE Cn1cc(C(=O)NCc2cc(Cl)cc(Cl)c2O)n(C)c1=O 1629132858 NDUKIEHETHOQNQ-UHFFFAOYSA-N 330.171 1.666 10 10 EDCE O=C(Cc1ccc(O)c(O)c1)NC1CCN(C[C@H]2CCCO2)CC1 1628307353 SQMMYAWRURYHNQ-OAHLLOKOSA-N 334.416 1.400 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)c2cn(C)ccc2=O)cc1C 1714252829 GKBKNAPISJWHHM-AWEZNQCLSA-N 343.427 1.610 10 10 EDCE COC(=O)[C@@H]1CSCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1638436870 GBCDWGBGLBLWOJ-NSHDSACASA-N 336.373 1.580 10 10 EDCE [N-]=[N+]=N[C@H]1CCN(C(=O)CNC(=O)c2ccc(Br)o2)C1 1912156055 NEMNDKCTZBARCB-ZETCQYMHSA-N 342.153 1.683 10 10 EDCE CC(C)N(CCS(C)(=O)=O)C(=O)c1ccc(N=NC(N)=O)cc1 1636467853 KRLUQBAFDXTYFR-UHFFFAOYSA-N 340.405 1.744 10 10 EDCE O=C(N[C@@H]1CC(=O)N(c2ccccc2F)C1)c1c(F)ccc(O)c1O 1651048469 JLRKTNGYQNNOOU-SECBINFHSA-N 348.305 1.911 10 10 EDCE CN(Cc1ccccc1O)C(=O)NCCC(C)(C)S(C)(=O)=O 1686819189 YXKDAJVYEXEIEV-UHFFFAOYSA-N 328.434 1.747 10 10 EDCE CO[C@@H]1COCC[C@H]1Cn1c(C)nnc1N(C)Cc1ccccc1O 1697695356 DVBPNHKUHUCOIQ-DOTOQJQBSA-N 346.431 1.980 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCC(=O)N(C)C1 162982772 OTAHLJAZPDUJTG-OAHLLOKOSA-N 332.448 1.905 10 10 EDCE CN(c1ccc(C=CC(=O)O)cc1Br)[C@H]1CCNC1=O 1916230990 GXVDQCYUMKFYGK-LBPRGKRZSA-N 339.189 1.872 10 10 EDCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNC(=O)Cc1ccc(N)cc1 2010527298 CLDQIGIFJPURCU-QGZVFWFLSA-N 337.420 1.203 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2011939234 JLROCZFOCMZSJA-ABAIWWIYSA-N 339.396 1.660 10 10 EDCE COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(C)c1O 2024813236 ULKYFDVGTIXVQO-CYBMUJFWSA-N 338.404 1.857 10 10 EDCE CC(C)NCc1ccc(N2CC[C@](O)(CO)C2)c(Br)c1 313898479 RJOIQJPSCHDEEN-OAHLLOKOSA-N 343.265 1.881 10 10 EDCE O=C1Nc2cc(N3C[C@@H]4CCO[C@@H]4C3)c(Br)cc2[C@H]1O 2172075446 ZXMMFEHJEXIZJA-HAGUPOPPSA-N 339.189 1.660 10 10 EDCE C[C@H]1CS(=O)(=O)C[C@@H]1NCc1cc(Br)ccc1O 711722444 PMTZAEIKNJLKBF-KWQFWETISA-N 334.235 1.677 10 10 EDCE Cc1cc(O)n2ncc(C(=O)N3C[C@H](C)OC4(CCOCC4)C3)c2n1 2063819745 OURDOWOABWZNDW-LBPRGKRZSA-N 346.387 1.153 10 10 EDCE C[C@@H]1CCN(Cc2cc(N)ccc2O)C[C@@H]1NC(=O)C(F)(F)F 1906129208 AUKHTJQGYKSDIB-SKDRFNHKSA-N 331.338 1.863 10 10 EDCE CC(C)(C)OC(=O)N1CC2(CN(C(=O)COc3ccc(N)cc3)C2)C1 2044626028 CLIQPFORIIVRJR-UHFFFAOYSA-N 347.415 1.727 10 10 EDCE O=C1CN(c2ccc(CO)cc2Br)C[C@H]2CCCN12 2102002029 ZKYPGCMWPIPOCM-LLVKDONJSA-N 325.206 1.752 10 10 EDCE O=C(O)C[C@@]1(O)CCN(Cc2c(O)cccc2Br)C1 2104561138 VLIJRWSUNAYIIX-ZDUSSCGKSA-N 330.178 1.566 10 10 EDCE O=S1(=O)C[C@H]2CCN(Cc3ccc(Br)cc3O)[C@H]2C1 2094882768 MWYSPFPPXMCHQJ-PWSUYJOCSA-N 346.246 1.774 10 10 EDCE Oc1cc(Br)ccc1CNC1CN([C@H]2CCOC2)C1 2113051219 ALTZMOXIYDBVGF-ZDUSSCGKSA-N 327.222 1.717 10 10 EDCE COC[C@@H]1[C@@H](O)[C@H](O)CN1c1ccc([C@H](C)O)cc1Br 2233867576 ZSKXPSZEDBDLNX-OKVQYTGBSA-N 346.221 1.059 10 10 EDCE CN(Cc1cc(N)ccc1O)Cc1nn(C)nc1Br 2226990813 IZGPKRVEEAXJFK-UHFFFAOYSA-N 326.198 1.497 10 10 EDCE CC=CC[C@@H](CO)NC(=O)C=Cc1ccc(N2CCOCC2)cc1 2309668788 PYPFQFJLNQUIQD-KRWDZBQOSA-N 330.428 1.980 10 10 EDCE Cc1ccc(CN2CCO[C@@H](C(=N)N)C2)c(O)c1Br 2352686435 BKHDAFBWWUESNX-SNVBAGLBSA-N 328.210 1.600 10 10 EDCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCO[C@]2(CCOC2)C1 184462279 LILLHVHZNDMQSV-LJQANCHMSA-N 343.427 1.764 10 10 EDCE COc1ccc(N2CCCN(Cc3nc(N(C)C)no3)CC2)cc1 185251105 VBUAZEPMZHWQJG-UHFFFAOYSA-N 331.420 1.857 10 10 EDCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N[C@H]1CC[C@H](O)CC1 255200591 SKOXOJMMPHCTRU-GSPSFPEXSA-N 330.428 1.956 10 10 EDCE O=[N+]([O-])c1ccc(O)c(CNCc2cccc(N3CCOCC3)n2)c1 274845390 XCKMZSPYUDHWRW-UHFFFAOYSA-N 344.371 1.822 10 10 EDCE C[C@H]1C[C@@H](N(C)CC(=O)NCc2ccc(N(C)C)cc2)CCN1C 299215104 HVJUDELAWKRSHL-YJBOKZPZSA-N 332.492 1.783 10 10 EDCE CC(=O)C(=O)COC(=O)c1ccc(CN2CCC(CO)CC2)cc1 808543441 IEHKTYWWOQOCSF-UHFFFAOYSA-N 333.384 1.206 10 10 EDCE COC(=O)NCCCC(=O)NCc1cc(Br)ccc1O 804738572 VBXKYALRYXPWCR-UHFFFAOYSA-N 345.193 1.907 10 10 EDCE CN1CCO[C@H](C(=O)NCc2cc(Br)ccc2O)C1 804738581 VOXDSNGIEMHAEE-LBPRGKRZSA-N 329.194 1.102 10 10 EDCE CCn1ncc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)n1 815115423 ZMOPCAJCAXZVPG-ZDUSSCGKSA-N 329.404 1.626 10 10 EDCE CC(C)OC[C@@H](O)CNCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 818967989 HJRIMCDDHGBZLU-AEFFLSMTSA-N 349.475 1.264 10 10 EDCE CC(=O)C(=O)COC(=O)[C@H](NC(=O)OC(C)(C)C)C(F)(F)F 811422726 SJIWPJQBVKISAX-QMMMGPOBSA-N 327.255 1.143 10 10 EDCE Cc1cc(C(=O)CN2CCOC[C@H](O)C2)c(C)n1-c1ccccc1 830623450 RGWJFQLLNLQYLE-QGZVFWFLSA-N 328.412 1.970 10 10 EDCE CN1CC[C@@H](C(=O)NCc2ccc(O)cc2O)[C@@H](c2cnn(C)c2)C1 910942928 ISNRJFONBLNMOE-HZPDHXFCSA-N 344.415 1.183 10 10 EDCE CN(C)c1ccc(CNC(=O)NC[C@@H]2C[C@@H]3COC[C@@H]3O2)cc1F 915366220 MYYFWUBYCUXDCI-WWGRRREGSA-N 337.395 1.495 10 10 EDCE CO[C@@H](CNC(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCOC1 852439922 JPTCDJLNGIJXQO-RDJZCZTQSA-N 335.448 1.946 10 10 EDCE COc1ccc(N2CCN(CC(=O)Nc3cccnn3)CC2)cc1 929153146 QZBMKYPGHZQJFB-UHFFFAOYSA-N 327.388 1.246 10 10 EDCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CC[C@H](C)NC1 861806274 ZXMSYONIYCJCIA-GOEBONIOSA-N 346.475 1.358 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)C1(N2CCOCC2)CCC1 862027122 JULTYIBDXHEGEY-UHFFFAOYSA-N 341.411 1.812 10 10 EDCE CCn1nc(C)cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 861830741 FNBJGVQMUYZACU-JTQLQIEISA-N 346.387 1.309 10 10 EDCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\COC1CCOCC1 867301978 IHUCPCVUDQYKKP-XQJDBVBESA-N 335.400 1.897 10 10 EDCE CN(C)c1cc(F)c(CN2CC[C@@H](NS(C)(=O)=O)C2)cc1F 862246437 HTBFLVKUGYLLTQ-LLVKDONJSA-N 333.404 1.154 10 10 EDCE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CC[C@H](C)NC3)C2)cc1 861648614 YJVMINXFGNXPKM-ARFHVFGLSA-N 346.475 1.961 10 10 EDCE O=C(NC[C@@H](O)C1CCOCC1)c1cc2cc(O)c(O)cc2s1 896460810 MLEHLNLSLFFHFC-CYBMUJFWSA-N 337.397 1.830 10 10 EDCE O=C(O)[C@@H]1C[C@@H](NCc2ccc(Br)cc2O)CCO1 1880020119 IXPMYYNSZBXQCS-JQWIXIFHSA-N 330.178 1.877 10 10 EDCE CCN(C(=O)C1=CC=CN2CCS(=O)(=O)N=C12)c1cccnc1C 798218456 XTDLHMQZQDIEKP-UHFFFAOYSA-N 346.412 1.241 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CSC(c2ccccc2O)=N1 1304053431 KTTNJDVEWKCFFS-LBPRGKRZSA-N 344.392 1.982 10 10 EDCE CO[C@H]1CC[C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)C1 1321778363 TZLFEEQKRYBBEL-RDJZCZTQSA-N 333.432 1.890 10 10 EDCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CC[C@@H](C3CC3)O2)cc1 1333758652 LUPWIMNAUJHCGF-SJORKVTESA-N 345.443 1.443 10 10 EDCE COc1ccc(CNCC[C@@H](C)NC(=O)C(C)(C)C(N)=O)cc1C 1268372835 IKNRVDHSKSBOCK-CYBMUJFWSA-N 335.448 1.500 10 10 EDCE CCOCC(=O)NC[C@@H]1CCN1C(=O)c1ccc(N=NC(N)=O)cc1 1358582618 FQCDLAGREQDGMO-ZDUSSCGKSA-N 347.375 1.216 10 10 EDCE CC[C@H](F)C(=O)NC[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1298625980 JZJFKMRVHLVOBG-SKDRFNHKSA-N 337.355 1.832 10 10 EDCE CC[C@@H](CNC(=O)CC1CC1)NC(=O)c1cc(OC)nc(OC)c1 1297343698 MHTRJIUGUYCDHL-ZDUSSCGKSA-N 335.404 1.524 10 10 EDCE O=C(NCc1cc(O)ccc1O)c1cn(Cc2ccccn2)nn1 1471661093 HTGDSYCTPDFJCU-UHFFFAOYSA-N 325.328 1.063 10 10 EDCE COc1ccc(CNC[C@H](C)NC(=O)CCc2nc(C)no2)cc1C 1483253834 RSNMAMMRCPMKOJ-ZDUSSCGKSA-N 346.431 1.922 10 10 EDCE CN1CCCc2cc(CNC(=O)c3ccnc4[nH]c(O)nc34)ccc21 1544165055 UDBODAZLNOUIBL-UHFFFAOYSA-N 337.383 1.976 10 10 EDCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1c([N+](=O)[O-])cnn1C 1627026297 BRXVDJRPMAJCIX-UHFFFAOYSA-N 325.321 1.450 10 10 EDCE O=C(NCc1c(O)cccc1O)[C@@H]1CC[C@@H](C(F)(F)F)NC1=O 1635842984 DOUTVBJUTXBKLB-CPCISQLKSA-N 332.278 1.171 10 10 EDCE C[C@@H](O)CNC[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1567155333 OTGBEZLGDRZVHO-VXGBXAGGSA-N 333.392 1.282 10 10 EDCE NCc1ccc(N2C[C@@H](CO)OCC23CC3)cc1Br 2127544262 PRZUYXQZHWCPLC-LBPRGKRZSA-N 327.222 1.638 10 10 EDCE CNCc1ccc(N(C)[C@H]2CCC(=O)NC2)cc1Br 2127089158 YRULSRKFFANHSQ-LBPRGKRZSA-N 326.238 1.883 10 10 EDCE COc1ccc(CNC[C@@H]2CCN(C(=O)CNC(C)=O)C2)cc1C 1774055905 JXPMSZNKMJNUMV-INIZCTEOSA-N 333.432 1.078 10 10 EDCE CO[C@@H](CCNC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1902054564 SZMPVZFFJBNWFI-MNOVXSKESA-N 327.385 1.827 10 10 EDCE CC(C)(C)OC(=O)NC[C@H]1COC[C@H]1NCc1ccc(O)c(O)c1 1948517773 ILKWJXMJOLAFMK-QWHCGFSZSA-N 338.404 1.727 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1985095065 YIPFGQOXENMIDY-HBNTYKKESA-N 325.369 1.268 10 10 EDCE COC[C@@](C)(CC(=O)N1CC(N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1985102696 KRTUJZZMYDHABT-CQSZACIVSA-N 327.385 1.827 10 10 EDCE Cc1cccc(O)c1CNC1(C(=O)O)CN(C(=O)OC(C)(C)C)C1 1997962671 IHGBJDBOUITJHG-UHFFFAOYSA-N 336.388 1.864 10 10 EDCE CC(C)(C)OC(=O)N[C@@H]1COC[C@]1(C)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2003169470 KZYVBKNHQHHBHV-BIMLSOSBSA-N 340.420 1.182 10 10 EDCE CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)N1CC[C@H](N=[N+]=[N-])C1 2010402682 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COc1ccc(N2C[C@H](N)[C@@H](OC)C2)c(OC)c1Br 2122514211 XTYDUEZNPLZAKH-KWQFWETISA-N 331.210 1.629 10 10 EDCE CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-])C1COC1 2213585025 JSXUUJBZPKBXRE-UTUOFQBUSA-N 339.396 1.874 10 10 EDCE COc1ccc(N2C[C@@H](O)[C@@H](O)C2(C)C)c(OC)c1Br 2234900862 ZQCDYVFTOWCCGL-NOZJJQNGSA-N 346.221 1.787 10 10 EDCE Cn1c(=O)n(C)c2cc(C=C3C(=O)NN(c4ccccc4)C3=O)ccc21 2297317209 ISHOHUZIJGPUFJ-UHFFFAOYSA-N 348.362 1.338 10 10 EDCE COC(=O)C=Cc1ccc(N2CCO[C@@H](CN(C)C)C2)c([N+](=O)[O-])c1 2297495623 ODPZMRXLVLUWMD-AWEZNQCLSA-N 349.387 1.548 10 10 EDCE CCN(CCN=[N+]=[N-])S(=O)(=O)c1nn(C)cc1Br 2315992462 MNWYIWFNQARMBG-UHFFFAOYSA-N 337.203 1.504 10 10 EDCE OCC1(O)CCN(C2CCN(c3ccc4c(c3)OCO4)CC2)CC1 67856305 LNACKQYEELYHAI-UHFFFAOYSA-N 334.416 1.203 10 10 EDCE CO[C@H](C(=O)O)C(=O)NCc1ccc(C)c(Br)c1O 2352633585 KRWVOKRKGALEKV-JTQLQIEISA-N 332.150 1.179 10 10 EDCE Cc1ccc(CNCCc2nnnn2C)c(O)c1Br 2352678218 DDFZWXVAOQKLDH-UHFFFAOYSA-N 326.198 1.319 10 10 EDCE C[C@@H](NC=C1C(=O)NC(=S)NC1=O)c1ccc2c(c1)CCCC2 52529070 ZCVFQHDNUYHUAU-SNVBAGLBSA-N 329.425 1.631 10 10 EDCE O=C(c1cccc(O)c1O)N1CC(n2ccc(Br)n2)C1 2361511048 PICFKJCWQMMMGP-UHFFFAOYSA-N 338.161 1.754 10 10 EDCE COC[C@@H](O)CN1CCC(N[C@@H](C)c2ccc(F)cc2O)CC1 186194509 DROMRCHUDFEXTO-WFASDCNBSA-N 326.412 1.654 10 10 EDCE CNC(=O)C[C@@H]1CNCCN1Cc1c(O)cccc1Br 2369317448 XACWAMUIKTZAMB-SNVBAGLBSA-N 342.237 1.065 10 10 EDCE C[C@@H]1C[C@@H](N)CCN1C(=O)/C=C\c1ccc(N2CCOCC2)cc1 606441413 XWRZURQWCXUODF-JFWTUMDPSA-N 329.444 1.875 10 10 EDCE Cc1cc(C(=O)N2C[C@H](O)C[C@H]2CO)c(C)n1-c1ccc(F)cc1 366627761 FYLGSKFYKNTHSD-JKSUJKDBSA-N 332.375 1.801 10 10 EDCE Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H](NC(N)=O)C2)cc1 270769197 QJOILQXDWOGPOQ-HNNXBMFYSA-N 326.400 1.977 10 10 EDCE O=C(CCN1CCOCC1)NCc1cc(Br)ccc1O 804735325 UULFYFQBQHLODH-UHFFFAOYSA-N 343.221 1.493 10 10 EDCE O=C(CN1CCCC1=O)NCc1cc(Br)ccc1O 804738876 IAOQLXCFGNQXJH-UHFFFAOYSA-N 327.178 1.393 10 10 EDCE CCC(=O)N1CSC[C@@H]1C(=O)N[C@H](C)c1cc(OC)ccc1O 728978386 FLWCWBXMHPLIAU-ZWNOBZJWSA-N 338.429 1.890 10 10 EDCE COC(=O)[C@@H]1OCC[C@@H]1NCc1cccc(Br)c1O 826967421 RHBHRCYOSSRZDP-CMPLNLGQSA-N 330.178 1.575 10 10 EDCE COC(=O)[C@@H]1CSCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 840185949 JIHOWJVRXCOPSP-SMDDNHRTSA-N 339.413 1.156 10 10 EDCE COC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)Nc2ccc(N)cc2)C1 841092681 MCOOPERAKRCARP-NEPJUHHUSA-N 348.403 1.190 10 10 EDCE CN1CCN(c2ccc(CNCCCc3ncn(C)n3)cc2)CC1 842738618 PTZRVWDLDDZSER-UHFFFAOYSA-N 328.464 1.289 10 10 EDCE C[C@H]1CO[C@@H](C(=O)N(CC(=O)O)Cc2cc(Cl)ccc2O)C1 911360828 YSIMWBZOCHVNTQ-NOZJJQNGSA-N 327.764 1.884 10 10 EDCE COC(OC)[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1 914336232 QQMMIIZGTBHWDA-ZDUSSCGKSA-N 337.420 1.330 10 10 EDCE C[C@H]1CO[C@H](C(F)(F)F)CN1C(=O)C(=O)Nc1ccc(N)cc1 841127632 OEYMFMZRKRAXMR-KWQFWETISA-N 331.294 1.386 10 10 EDCE C[C@@H]1CCN(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 847506366 AMVNCXGEWYUVBG-MRXNPFEDSA-N 345.487 1.853 10 10 EDCE NC[C@H](NC(=O)NCc1c(O)ccc2c1CCCC2)C(F)(F)F 848596435 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JQZNXZKLWALLHI-UHFFFAOYSA-N 339.351 1.815 10 10 EDCE CCCc1nnc(SCC(=O)N[C@@H](C)c2ccccc2O)n1N 1151900519 RYKGFQKIONOYPZ-JTQLQIEISA-N 335.433 1.620 10 10 EDCE COc1ccc(Br)c(CN[C@@H]2CCOC[C@H]2O)c1O 1964581578 PHPNEOSQYATWRT-GHMZBOCLSA-N 332.194 1.403 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)C[C@@H](C)CO)c(Br)cc21 688402534 AJWSLZCZUIESIN-AMIZOPFISA-N 342.237 1.726 10 10 EDCE CCOC(=O)c1cc(CN[C@H]2CCN(c3ccc(OC)cc3)C2)[nH]n1 1327924975 ZECLJTLTQWVONA-ZDUSSCGKSA-N 344.415 1.964 10 10 EDCE C[C@@H](N)c1ccc(N2CCN(C)C[C@H]2CO)cc1Br 699487480 RCTIGVKCPJABDR-PWSUYJOCSA-N 328.254 1.582 10 10 EDCE COC(=O)NC1CN(Cc2c(C(=O)OC)n(C)c3ccc(F)cc23)C1 1338274611 QZWLMTAQVOSOSD-UHFFFAOYSA-N 349.362 1.644 10 10 EDCE COc1ccc(CNCCN(C)C(=O)[C@@H]2C[C@H]3C=C[C@H]2O3)cc1C 1266750008 YILFUYMUQDBCTB-JFIYKMOQSA-N 330.428 1.895 10 10 EDCE COC(=O)c1c(CNCCCn2cncn2)c2cc(F)ccc2n1C 1262110263 XTWVKVSTDYXYTA-UHFFFAOYSA-N 345.378 1.875 10 10 EDCE C[C@H]1CN(C2CCOCC2)CCN1C(=O)Cc1ccc(O)c(O)c1 1448721965 ORRWOUVGBCAKRM-ZDUSSCGKSA-N 334.416 1.352 10 10 EDCE CCN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@H](C)CS(C)(=O)=O 1465146606 SSBMTDUFQPDWNS-SNVBAGLBSA-N 340.405 1.744 10 10 EDCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCO[C@H]1c1ccc(O)nc1 1557906064 REYQLDZIOVWJCO-RCTPQGRFSA-N 342.351 1.858 10 10 EDCE CC(C)NC(=O)OC1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1556858987 UMWDBVTUNALFHH-UHFFFAOYSA-N 333.348 1.808 10 10 EDCE CCn1cc(C(=O)NC/C=C\CNCc2ccc(OC)c(C)c2)nn1 1716358769 KVRVFIXYLDKKOJ-WAYWQWQTSA-N 343.431 1.691 10 10 EDCE CNC(=O)NC1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1626484070 FZOYZMDFGHECPM-UHFFFAOYSA-N 332.364 1.383 10 10 EDCE CS(=O)(=O)c1ccc(C(=O)NCc2c(O)cccc2F)c(N)c1 1558457582 PUNQMPTUAYCXAP-UHFFFAOYSA-N 338.360 1.447 10 10 EDCE COc1ccc(CN[C@@H](C)CNC(=O)C[C@@H]2CCNC2=O)cc1C 1491476618 ARJVYQVKKIZQMZ-ZFWWWQNUSA-N 333.432 1.124 10 10 EDCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@@]1(C)CCNC1=O 1568774457 BIIJDIVGUHVQAL-IBGZPJMESA-N 347.459 1.468 10 10 EDCE Cc1nn(C)c(C)c1C(=O)C(=O)NCc1ccc2cccnc2c1O 1639621612 MOCYGNLDMWDEAA-UHFFFAOYSA-N 338.367 1.790 10 10 EDCE COc1ccc(CNC[C@H](C)N(C)C(=O)Cn2ccnc2)cc1C 1496242276 DYPLEFNRLVEXNV-HNNXBMFYSA-N 330.432 1.837 10 10 EDCE COCCCN1CC([C@H](C)NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1725271655 ZPYGUZNIXXGGMF-LBPRGKRZSA-N 347.419 1.936 10 10 EDCE COc1cc(C(=O)N[C@H]2C[C@@H](NC(=O)CC(C)(C)C)C2)cc(OC)n1 1744431228 ZMFHAFLVSORSGT-BETUJISGSA-N 349.431 1.912 10 10 EDCE COc1ccc(CN[C@H](CO)CNC(=O)c2ccsc2)cc1C 1676499309 LCFALBLLZCQFGI-HNNXBMFYSA-N 334.441 1.946 10 10 EDCE COC(=O)/C=C\c1ccc(N2C[C@H](OC)[C@H](OC)C2)c([N+](=O)[O-])c1 1772933854 CPSDRQQUIPYDLB-LAMLHYTJSA-N 336.344 1.631 10 10 EDCE Cc1cc(C(=O)NC[C@@H]2CC[C@H](C(N)=O)O2)c(C)n1-c1ccccc1 161311641 WVGWJTMXUKBUPL-DOTOQJQBSA-N 341.411 1.857 10 10 EDCE CN(C)c1ccc([C@H](NC(=O)[C@@H]2CCCN2)c2nccn2C)cc1 1866099420 GZVBJEAZBARDND-HOTGVXAUSA-N 327.432 1.444 10 10 EDCE CCN(CC)CCCCNC(=O)c1nnn(-c2ccc(N)cc2)n1 1857878779 MLQVCJOFAWDRHU-UHFFFAOYSA-N 331.424 1.096 10 10 EDCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C(C)(C)C(N)=O 1915544357 LTBLSNOUIWEUSZ-JTQLQIEISA-N 342.193 1.135 10 10 EDCE Oc1ccc(Br)cc1CN1CCN(C2CNC2)CC1 236615056 XORVQTSZNKERFL-UHFFFAOYSA-N 326.238 1.244 10 10 EDCE Oc1cccc(Br)c1CN[C@@H]1C[C@H]2C[C@H]1[C@H](O)[C@@H]2O 1974164001 WERSDYMGGMPIPL-IMWABMGISA-N 328.206 1.375 10 10 EDCE COc1ccc(O)c(CNC[C@H](O)CNC(=O)OC(C)(C)C)c1 1985772268 UCQRZGDHUQLDFA-LBPRGKRZSA-N 326.393 1.376 10 10 EDCE CN[C@H]1C(=O)Nc2cc(N(C)[C@@H]3CCOC3)c(Br)cc21 159732716 DJDVMDNHLWZAPN-AMIZOPFISA-N 340.221 1.887 10 10 EDCE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](N(C)C)C2)c(Br)c1 2146133268 UKZNVLWHGAKBEX-ONERCXAPSA-N 342.281 1.841 10 10 EDCE C[C@@H](O)c1ccc(N2CCOC[C@@H]2[C@H](O)CO)c(Br)c1 2146324183 SPLWICDAIJUXLB-OWYVNGRQSA-N 346.221 1.061 10 10 EDCE CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C1)[C@@H]2NC(=O)Cc1ccc(N)cc1 2011004115 SDERZRLPVHPTKQ-MIFYACCESA-N 331.416 1.793 10 10 EDCE CCCNCc1ccc(N2C[C@@H](O)C[C@@H](O)C2)c(Br)c1 2161356450 GQZQYJDCSBJGDM-BETUJISGSA-N 343.265 1.881 10 10 EDCE COCCNCc1ccc(N(C)CCC(N)=O)cc1Br 382058771 BWYDMGGMKXZXMF-UHFFFAOYSA-N 344.253 1.497 10 10 EDCE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCN2CCOC[C@@H]12 2062403778 VVJXSCAMRVWSMO-GJZGRUSLSA-N 327.384 1.277 10 10 EDCE CC(C)(C)OC(=O)N1CC[C@](O)(CNC(=O)Cc2ccc(N)cc2)C1 2044229247 SYGZMXIEUMDKJB-SFHVURJKSA-N 349.431 1.299 10 10 EDCE CC(C)(C)OC(=O)N1CCN(CC(=O)Nc2ccc(N)cc2)[C@@H]2C[C@H]21 2044676185 QPEHAKBINQCFGK-HUUCEWRRSA-N 346.431 1.901 10 10 EDCE CCCNC(=O)C1CN(c2ccc(CN)c(Br)c2)C1 2111743822 DJBUOIOGSSLFFB-UHFFFAOYSA-N 326.238 1.870 10 10 EDCE COc1ccc(Br)c(CN2CCO[C@@H]3CNC[C@@H]32)c1O 2236053598 XCPFAUSIDIXTMU-WCQYABFASA-N 343.221 1.336 10 10 EDCE CC(C)(C)OC(=O)N1C[C@H](O)CC[C@@H]1C(=O)N1CC(N=[N+]=[N-])C1 2242655885 HVLOQNRHTIDINT-GHMZBOCLSA-N 325.369 1.268 10 10 EDCE COc1ccc(Br)c(CN[C@H]2CNC(=O)C2(C)C)c1O 2281187222 YRFPHKVPLMYFMN-NSHDSACASA-N 343.221 1.778 10 10 EDCE CN(CC1(O)CC1)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 2340178326 DCICQPGWWHNUCY-LLVKDONJSA-N 326.194 1.362 10 10 EDCE