smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CN(C)c1ccc(CNC(=O)C(=O)Nc2cnn(-c3ncccn3)c2)cc1 86445712 SZQNFPXAQVMEQC-UHFFFAOYSA-N 365.397 0.983 10 10 FCCE CCOC(=O)[C@H]1CCCN(C(=O)C(=O)N(C(C)=O)c2ccc(N)cc2)C1 170318530 BMNSNQXMFACUMN-ZDUSSCGKSA-N 361.398 0.950 10 10 FCCE CN(C)C[C@@]1(O)CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 788206754 WHMZVDDMYTYLSB-INIZCTEOSA-N 371.459 0.292 10 10 FCCE CC(=O)C(=O)COC(=O)c1ccccc1S(=O)(=O)N1CCOCC1 808502748 QROHMQHSYRXFAQ-UHFFFAOYSA-N 355.368 0.022 10 10 FCCE OC1CCN(c2ccc(CNC[C@H](O)CN3CCOCC3)cc2F)CC1 819120721 DZGYSJOSKWWQMN-KRWDZBQOSA-N 367.465 0.570 10 10 FCCE CN1CC[C@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)S1(=O)=O 843836739 XLIKLMUVACXEQR-GOEBONIOSA-N 368.455 0.934 10 10 FCCE CNS(=O)(=O)C[C@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 863825099 KZRQVEXQWRETRN-VGVVRCBHSA-N 354.428 0.899 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C(=O)O[C@@H](C)C3=O)CC2)cc1 871990337 VJBNKYRVBVHTQN-ZFWWWQNUSA-N 363.414 0.545 10 10 FCCE CCN1CC[C@H]1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 897565649 QKTPIXBGDJFEBM-QAPCUYQASA-N 374.485 0.911 10 10 FCCE CCN1CC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 898319577 BAPJSKBBNWGJON-GOSISDBHSA-N 373.501 0.265 10 10 FCCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2[C@@H](CNS2(=O)=O)C1 1156621707 LYUWPMDDIFDYDX-VIFPVBQESA-N 369.424 0.287 10 10 FCCE COC(=O)[C@@H](F)CNC(=O)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1262151072 YNOWAPNBFRXOMF-DOMZBBRYSA-N 367.421 0.736 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2218736573 ABZKFFOSWSEDPH-ZIQFBCGOSA-N 355.395 0.675 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)CNC(=O)Nc1ccc(N)cc1 2258271882 KLYFIMKVXODXMC-UHFFFAOYSA-N 354.407 0.638 10 10 FCCE Cn1cc(/C=C/C(=O)NCCCSc2nccs2)c(=O)n(C)c1=O 74136595 RTNDAXKVRRTHQP-SNAWJCMRSA-N 366.468 0.852 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3nccn3C)C2)cc1 827933707 COTXQWFRCDDISC-ZDUSSCGKSA-N 357.414 0.440 10 10 FCCE CCS(=O)(=O)NCCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852064928 UVXNMQHYABWSPF-CYBMUJFWSA-N 370.475 0.512 10 10 FCCE Cc1ccc(C(=O)N[C@@H]2CCN(c3ccc4nncn4n3)C2)c(O)c1O 862787514 QOZNRUONURVAQL-LLVKDONJSA-N 354.370 0.853 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2C[C@@H](C)[C@H](CN)C2)cc1 868393039 JMRNKNMMCBTSFX-HUUCEWRRSA-N 362.474 0.643 10 10 FCCE O=S1(=O)CCNC[C@H]1CCNCc1ccc(N2CCOCC2)cc1 903967627 DPBBCWGADGBACV-QGZVFWFLSA-N 353.488 0.390 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3CC4CC3(CN)C4)CC2)cc1 923390013 DVVXPVPYWQUJJU-KGXSXCIVSA-N 360.502 0.601 10 10 FCCE CC(C)(C)OC(=O)N1CCc2c(N3CC(O)(C(N)=O)C3)ccc(N)c2C1 1915223701 JVUFMTQYUPQQJG-UHFFFAOYSA-N 362.430 0.598 10 10 FCCE NS(=O)(=O)NC[C@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 158952174 IYHCBYPSKBBABL-MRXNPFEDSA-N 368.503 0.528 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCC3CCNCC3)C2)cc1 851689328 NBSMOMYSIYTUIC-MRXNPFEDSA-N 374.485 0.896 10 10 FCCE CNC(=O)[C@@H]1CN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCO1 852453934 MKBIXXKWICZFDQ-BBRMVZONSA-N 362.430 0.430 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCC[C@H]3NCC[C@H]32)cc1 868419352 WUERDQPBFMRQRV-QZTJIDSGSA-N 374.485 0.943 10 10 FCCE CS(=O)(=O)C[C@@H](O)CNC(=O)NCc1ccc(N2CC=CC2)cc1 919919175 WASLRKRZEBKVFB-HNNXBMFYSA-N 353.444 0.268 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3cc(C=O)n(C)n3)CC2)cc1 930940096 ANEFURHGURAXMM-UHFFFAOYSA-N 371.441 0.793 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CCNC1=O 1296055863 ZGGBZLRIQNOUTQ-RYUDHWBXSA-N 350.371 0.214 10 10 FCCE O=C(NC1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1)C1CC1 1332039225 JVUAVWCQYKFDGU-UHFFFAOYSA-N 357.410 0.752 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3CCOC(=O)N3)cc2)CC1 1471912787 YJUQKADNKBHRSD-HNNXBMFYSA-N 360.414 0.503 10 10 FCCE Nc1nnn(CC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 1620753302 IRVVKPVFUNSUSE-JTQLQIEISA-N 367.360 0.642 10 10 FCCE O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NCc1ccc(O)cc1O 1639444753 YGEMUVNMGDLKQC-XOUADPBQSA-N 360.366 0.267 10 10 FCCE C[C@@H](NC(=O)C(=O)NCC12CC(CN1)C2)c1ccc(N2CCOCC2)cc1 851685290 PXPIGTBUSXTJGG-ZUIJCZDSSA-N 372.469 0.569 10 10 FCCE Cc1cc(Br)c(O)c(CNC[C@H](O)CS(C)(=O)=O)c1 922823405 LYDXBGQTEFTELJ-JTQLQIEISA-N 352.250 0.958 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)NC[C@H]3C[C@@H]4COC[C@@H]4O3)ccc21 929806372 ZDAUCVGGBKNEBU-NUJGCVRESA-N 373.453 0.605 10 10 FCCE C[C@H](C(=O)NCc1ccc(O)cc1O)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1142533660 PHHOVOIGXQAPDJ-LPCRZITISA-N 360.366 0.265 10 10 FCCE O=C1CC[C@H](C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CN1 1629484028 CZUHLJNPTSVFDI-LBPRGKRZSA-N 353.369 0.944 10 10 FCCE CCNC(=O)N1CC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 761610014 YCOOUBMYWTYLKJ-LLVKDONJSA-N 370.431 0.297 10 10 FCCE CNS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCC[C@H](C)C2)cc1 797431675 VJWNHAFJTKLENR-NSHDSACASA-N 362.477 0.951 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4CCC[C@]4(C(N)=O)C3)nc12 1176556428 XICPACXKYUBHAY-VOJFVSQTSA-N 373.413 0.699 10 10 FCCE CN(C)c1ccc(CNC(=O)CNS(=O)(=O)c2ccccc2N)cc1 1587316751 MMARZELMAKORJZ-UHFFFAOYSA-N 362.455 0.930 10 10 FCCE CNC1CN(C(=O)[C@H](Cc2ccc(O)c(O)c2)NC(=O)OC(C)(C)C)C1 2136254174 UTFSVNSNVKJCBH-ZDUSSCGKSA-N 365.430 0.964 10 10 FCCE CN(C)S(=O)(=O)N1CCC[C@@H](NCc2cc3c(cc2O)OCO3)C1 808424511 IVZVZDPWYPLTNP-GFCCVEGCSA-N 357.432 0.481 10 10 FCCE CN(C)S(=O)(=O)N1CC(NC(=O)NCc2cccc(Cl)c2O)C1 1253797357 GCEMUCQLIPLQMU-UHFFFAOYSA-N 362.839 0.335 10 10 FCCE C[C@]12COC[C@@H]1CN(C(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)C2 1347444477 KMRYLMWWCGPIQT-JXFKEZNVSA-N 373.453 0.634 10 10 FCCE COc1ccc(CNC(=O)NCCCN2CCC[C@H]2C(N)=O)c(O)c1 1478970027 FYIUISKTXMABNV-AWEZNQCLSA-N 350.419 0.540 10 10 FCCE O=C(Cn1cnc([N+](=O)[O-])n1)NCc1ccc(N2CCC(CO)CC2)cc1 735828669 JDHGKQONIGWUNT-UHFFFAOYSA-N 374.401 0.711 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(C)s1 808493533 IYFLNUKPDVQEEI-LLVKDONJSA-N 359.425 0.911 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H](C)Cn3cncn3)C2)cc1 827607483 BEAPTDIFGPROEF-UONOGXRCSA-N 372.429 0.187 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@@H](O)[C@@H]3C)CC2)cc1 836882177 RPUVAMORCBKNDA-YMQRJHMESA-N 373.453 0.882 10 10 FCCE CN(CC(=O)NCc1ccc2cccnc2c1O)[C@@H]1CCS(=O)(=O)C1 862026165 HKNRZSAXMWHREN-CQSZACIVSA-N 363.439 0.676 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CC[C@@H]3C)CC2)cc1 1331483365 CUENUKMBEHHDIY-INIZCTEOSA-N 374.485 0.944 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)N3CC4(C3)NC(=O)NC4=O)C2)cc1 1478861059 VRXBQGPZTYIDAV-GFCCVEGCSA-N 373.413 0.125 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2077125714 XPEAAVPQIFEZNP-GVXVVHGQSA-N 374.459 0.286 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2299124235 VCIWCQXBRCCHGE-ZJUUUORDSA-N 361.424 0.836 10 10 FCCE O=C(NCC[C@H]1CCOC1)C(=O)NCc1ccc(N2CCOCC2)cc1 788321522 WMDGXMHWIHQWFO-INIZCTEOSA-N 361.442 0.682 10 10 FCCE C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H](O)C(F)(F)F 819564421 GCYBIPCIDFJQGR-LDWIPMOCSA-N 356.322 0.805 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCC2(C(=O)O)CCOCC2)cc1 843256111 DIEWRKSWYKJALA-UHFFFAOYSA-N 363.414 0.366 10 10 FCCE C[C@@H](NC(=O)[C@@H]1CCN(C)S1(=O)=O)c1ccc(N2CCOCC2)cc1 843537340 SARDTKWQCOXEKN-CJNGLKHVSA-N 367.471 0.734 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C3=C(C)N(C)c4nnnn4C3)C2)cc1 855225416 NAJXGJHLPJXPNJ-ZDUSSCGKSA-N 369.429 0.801 10 10 FCCE C[C@@H]1NCC[C@H]1NC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 861812708 IZCBPLSQXRGPKL-NUEKZKHPSA-N 361.442 0.766 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C[C@@]3(O)CCCN(C)C3)cc2)CC1 918905940 JLVJZTHXSLURBY-FQEVSTJZSA-N 360.502 0.901 10 10 FCCE C[C@H]1C[C@H]1C(=O)NCCC(=O)NCc1ccc(N2CCNC(=O)C2)cc1 106263878 PKRKONNMZPTUKZ-XJKSGUPXSA-N 358.442 0.401 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)NC3CC(C)C3)CC2)cc1 1322954607 HUBHGPZSRYIJMS-UHFFFAOYSA-N 374.485 0.848 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CC2CC1(CN)C2)c1ccc(N2CCOCC2)cc1 851684783 HRIOGBHSINHQRA-ZUIJCZDSSA-N 372.469 0.650 10 10 FCCE Cn1cnc(-c2nnc3n2CCN(C(=O)Cc2ccc(O)c(O)c2)C3)c1 1632310249 ATISAKMFYVNCEU-UHFFFAOYSA-N 354.370 0.675 10 10 FCCE COC(=O)c1cn([C@@H]2CCN(C(=O)c3c(F)ccc(O)c3O)C2)nn1 1648698862 IWRPXTZNRRCZSO-MRVPVSSYSA-N 350.306 0.702 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCC3(S(N)(=O)=O)CC3)C2)cc1 1687024503 CBRYUZRFXAMRTQ-GFCCVEGCSA-N 368.459 0.394 10 10 FCCE CN1CCN(CCOc2ccc(N)cc2)[C@H](CNC(=O)C(F)(F)F)C1 2106761554 YFXNDMBUYNOCQF-CYBMUJFWSA-N 360.380 0.942 10 10 FCCE COC(=O)C[C@@H]1O[C@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O 108047285 BUKUVEWCKMNEFV-RBQFQAMWSA-N 373.318 0.380 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H](O)C(F)(F)C2)c1 855445839 OSDVLZVYWKSJAF-NSHDSACASA-N 350.343 0.606 10 10 FCCE CCCC(=O)NCC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 786255151 JIHNITJJKYKFOL-UHFFFAOYSA-N 360.458 0.888 10 10 FCCE C[C@@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCNC1=O 1141996082 IBEGAEHZZSLKJI-IFXJQAMLSA-N 358.442 0.531 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC3=C(CCC(=O)N3)C2)c1 1328372319 FGMGQBDBWMOURO-UHFFFAOYSA-N 365.411 0.774 10 10 FCCE Cn1cc(S(=O)(=O)NCC(=O)NCc2cccc(Cl)c2O)cn1 1472316531 VMKRMNOVVORBJK-UHFFFAOYSA-N 358.807 0.374 10 10 FCCE CC(=O)N1CCN(C(=O)CCNC(=O)c2ccc(N=NC(N)=O)cc2)CC1 1628441902 PBTALWURPHLALT-UHFFFAOYSA-N 374.401 0.660 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](CC(N)=O)NC(=O)CC(C)C)c1 1630366485 RGUCCWCHFNDNSC-BXUZGUMPSA-N 365.430 0.984 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NC(=O)c2cc(O)nc(O)c2)C1 2063326978 VBPXDRBYCUYAKE-MNOVXSKESA-N 353.375 0.593 10 10 FCCE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2299123707 VCIWCQXBRCCHGE-VHSXEESVSA-N 361.424 0.836 10 10 FCCE COc1cc(C)cc(CN2CCN(C(=O)C(=O)N3CCCC3)CC2)c1O 754727800 QGAJSIHYXSDDKS-UHFFFAOYSA-N 361.442 0.976 10 10 FCCE CCO[C@@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C[C@H]1CN 846332647 UALCLTSZHMNEGG-SJLPKXTDSA-N 374.485 0.507 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCCNC(=O)c3cc[nH]n3)C2)cc1 852248213 RAGODNZYJQCCEE-CYBMUJFWSA-N 372.429 0.726 10 10 FCCE C[C@H](C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)S(C)(=O)=O 1583379207 OJXXVHRBDHNEBZ-SNVBAGLBSA-N 362.398 0.851 10 10 FCCE C[C@@H](CN)NC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2080880438 KTEXUYQFILREFI-JQWIXIFHSA-N 353.419 0.997 10 10 FCCE CNC(=O)CCOC1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768462557 AFNQDXWWLLDEOO-INIZCTEOSA-N 350.415 0.935 10 10 FCCE CO[C@H](CS(=O)(=O)NC[C@H](N)c1ccc(N(C)C)cc1)[C@@H]1CCOC1 850587443 ZYZXUIMHWVXZDP-HYVNUMGLSA-N 371.503 0.723 10 10 FCCE CO[C@H](CS(=O)(=O)NC[C@@H](N)c1ccc(N(C)C)cc1)[C@H]1CCOC1 850587444 ZYZXUIMHWVXZDP-USXIJHARSA-N 371.503 0.723 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)N1CC[C@@]2(O)C[C@H]2C1 1329198802 FJPPNSFMDBREDT-MGPUTAFESA-N 373.453 0.247 10 10 FCCE O=C1N[C@@H](CO)C(=O)N1Cc1ccc(N2CCN(CC3CC3)CC2)cc1 1332860515 ARDFLTGKPOGUDN-KRWDZBQOSA-N 358.442 0.631 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)C1 2077125715 XPEAAVPQIFEZNP-NQBHXWOUSA-N 374.459 0.286 10 10 FCCE CC(=O)Nc1ccc(S(=O)(=O)NCCN2C(=O)CSC2=S)cc1 71558056 ZBCDZCVFXVLOEX-UHFFFAOYSA-N 373.481 0.784 10 10 FCCE CC(=O)N(C(=O)C(=O)N1CCN(c2ccccn2)CC1)c1ccc(N)cc1 170319166 IMYWWCKRZMPKEE-UHFFFAOYSA-N 367.409 0.892 10 10 FCCE COc1ccc(CNC(=O)N[C@H]2CCC[C@H]2CNS(C)(=O)=O)c(O)c1 800055035 MHBWGDQXYTYURO-FZMZJTMJSA-N 371.459 0.918 10 10 FCCE CCNS(=O)(=O)CCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852085350 AMNMULPRSUTRJJ-ZDUSSCGKSA-N 370.475 0.512 10 10 FCCE COC(=O)C1=CC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 862665939 LCBDNSFLWGUQLM-JTQLQIEISA-N 354.384 0.755 10 10 FCCE COC(=O)[C@@]1(N2CCN(Cc3cc4c(cc3O)OCO4)CC2)CCOC1 1118883568 ACNZMDXWFYWMON-GOSISDBHSA-N 364.398 0.571 10 10 FCCE CO[C@H]1C[C@H](CNC(=O)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1338885383 UIBZZXHEGAPCSP-SAABIXHNSA-N 374.485 0.596 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NS(=O)(=O)Cc1ccc(N)cc1 2044244050 PNVDCTDPGGVSSR-KGLIPLIRSA-N 371.459 0.980 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2127629234 HQYSTDIYKAGWTJ-TUAOUCFPSA-N 369.422 0.924 10 10 FCCE CC(=O)C1=S=C(NC(=O)c2cccc3[nH]cn[n+]23)N=C1c1ccccc1 542497993 MPTSFUHGAKUHMI-UHFFFAOYSA-O 364.410 0.963 10 10 FCCE CCOC(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)/C=C\c1ccc(O)c(O)c1 787663379 UORFEBHQPWCFOI-XZZRAGQBSA-N 350.371 0.684 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N1C[C@H]2CC[C@H]1CN2 817995982 MANYCICMVPBVQL-AEFFLSMTSA-N 372.469 0.444 10 10 FCCE COc1ccc(N2CCN(C(=O)CC3CS(=O)(=O)C3)CC2)c(OC)c1 1329990340 UDVBACSTXIGZCP-UHFFFAOYSA-N 368.455 0.787 10 10 FCCE C[C@H]1CN(c2ccc(CNC(=O)Cn3nnc(N)n3)cc2F)C[C@H](C)O1 1441788000 RTHZLBLRWVZZOU-QWRGUYRKSA-N 363.397 0.324 10 10 FCCE C[C@H](NC(=O)NC[C@@]1(O)CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 1680280183 JJKUZGZOELMCMY-LRDDRELGSA-N 355.460 0.662 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NS(=O)(=O)Cc1ccc(N)cc1 2044244052 PNVDCTDPGGVSSR-ZIAGYGMSSA-N 371.459 0.980 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNCc1ccc(O)c(O)c1 2218616770 PLDUFYMFYOYJQO-CQDKDKBSSA-N 354.403 0.529 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@H](NS(C)(=O)=O)C1 172021654 DYGFBEYLCXNRRU-OAHLLOKOSA-N 368.503 0.335 10 10 FCCE CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@H]1OC(C)=O 616625325 LJICGUPPWNZTFT-RKQHYHRCSA-N 373.318 0.380 10 10 FCCE COc1ccc(N2CC[C@H](CNC[C@H](O)CN3CCN(C)CC3)C2)cc1 819379737 KULIZDTYZUZIIG-MJGOQNOKSA-N 362.518 0.719 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCN3CCCC3=O)C2)cc1 829757802 VPLIYKBFDKUEGP-CQSZACIVSA-N 374.441 0.129 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC[C@H]3CCNC3)C2)cc1 851688114 QOBURIFZXNPVNO-CABCVRRESA-N 360.458 0.506 10 10 FCCE COC(=O)[C@@H]1OCC[C@@H]1NCc1ccc(N2CCN(C)CC2)c(F)c1 1118655436 SBPLCNCGBNXHCN-DOTOQJQBSA-N 351.422 0.998 10 10 FCCE O=C1NCCn2c(CNCc3ccc(Br)cc3O)nnc21 1332021039 GXFSDDNHSHBODA-UHFFFAOYSA-N 352.192 0.779 10 10 FCCE CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)Cc1ccc(O)c(O)c1)C2 1627076302 VJCAXWYKNFGRGX-GJZGRUSLSA-N 361.442 0.840 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H]1CNC(=O)CN1 1952208846 NSYHPRKLZYEMLH-NWDGAFQWSA-N 351.403 0.622 10 10 FCCE N[C@H]1C(=O)Nc2cc(N3CCS(=O)(=O)CC3)c(Br)cc21 118711703 CYZZHRXIKMYDHR-LLVKDONJSA-N 360.233 0.636 10 10 FCCE CCOC(=O)C1(O)CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 266934671 PPDYQPKCZWWKNZ-UHFFFAOYSA-N 363.458 0.759 10 10 FCCE CC(C)[C@@H](O)CNC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 820993380 WVTUPDCIDFXBDB-INIZCTEOSA-N 369.487 0.738 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)O[C@@H](C)C3=O)CC2)cc1 871990334 VJBNKYRVBVHTQN-DZGCQCFKSA-N 363.414 0.545 10 10 FCCE CN1CCN(C(=O)C(=O)NCCCSc2nccs2)CCC1=O 1328945471 WAYUHGOQULTYQM-UHFFFAOYSA-N 356.473 0.432 10 10 FCCE CN1CC[C@@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1=O 1564621407 QZBCISGNTOQUDQ-MRXNPFEDSA-N 373.457 0.418 10 10 FCCE CN(C)c1ccc([C@H](NC(=O)[C@@H](N)CCC(N)=O)c2nccn2C)cc1 1866105557 MTZXRCQOMWDJKJ-HOCLYGCPSA-N 358.446 0.285 10 10 FCCE Cc1cccc(N2C(=O)C(=CNCCN3CCOCC3)C(=O)NC2=S)c1 2296179545 DPPCRGMHYCWCMA-UHFFFAOYSA-N 374.466 0.548 10 10 FCCE CC(=O)Oc1cccc(C(=O)NCCNC(=O)c2cc(O)c(O)c(O)c2)c1 169831299 BHEGECBZVWWWKF-UHFFFAOYSA-N 374.349 0.889 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)NCCCn1ccnn1 806280337 NCVSEYYRHKMURQ-UHFFFAOYSA-N 354.461 0.540 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)NCC34CC(CN3)C4)CC2)cc1 851692294 YNFOYNIYXARTBV-UHFFFAOYSA-N 372.469 0.602 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCN4C(=O)NC[C@@H]4C3)C2)cc1 854300718 YXRUNCPNEUFXAB-DZGCQCFKSA-N 359.430 0.693 10 10 FCCE CN1CCN(c2ccc(CNC(=O)CN3CCCCC(=O)C3=O)cc2)CC1 881855629 YZNHKBDPVZHZFQ-UHFFFAOYSA-N 372.469 0.636 10 10 FCCE Cn1cc([C@H](O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cn1 1291872053 RHASTLVTMCPFRJ-YOEHRIQHSA-N 371.441 0.472 10 10 FCCE C[C@H]1CC[C@H](NC(=O)C(=O)NCCc2ccc(N)cc2)CS1(=O)=O 1333542674 LLOQIUBSSVSRRP-FZMZJTMJSA-N 353.444 0.009 10 10 FCCE CN(C)c1ccc(CNC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)cc1 1527401228 SPOCAKFNEJQTLA-UHFFFAOYSA-N 363.443 0.513 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)[C@@H](CC(N)=O)NC(=O)CC(C)C)c1 1630366488 RGUCCWCHFNDNSC-SMDDNHRTSA-N 365.430 0.984 10 10 FCCE C[C@@H](C(=O)NCc1c(O)cccc1O)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1639289152 MBXKUUSYWZGTPT-CELJHQOASA-N 360.366 0.265 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)NCc1ccc(N)cc1 2080680684 CYUMTFCSJXBOFX-MJBXVCDLSA-N 351.403 0.226 10 10 FCCE CC(C)(C)OC(=O)N[C@H](COc1nnc(=N)[nH]n1)CC1CCOCC1 2219022639 UNGZGDQIOLIRGR-NSHDSACASA-N 354.411 0.768 10 10 FCCE O=C1c2ccccc2C(=O)c2c(S(=O)(=O)O)ccc(S(=O)(=O)O)c21 34317641 JSHSWIGVFFHFPB-UHFFFAOYSA-N 368.344 0.955 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCNC(=O)CC3)cc2)C1 729599775 UAGFEGYCMOLEDR-HNNXBMFYSA-N 373.457 0.420 10 10 FCCE CN(C)c1ccc([C@H](N)CNS(=O)(=O)c2nn(C)cc2[N+](=O)[O-])cc1 858610725 DLSHZGOYLKFZHY-GFCCVEGCSA-N 368.419 0.373 10 10 FCCE Cc1cc(C(=O)N2Cc3cccc(O)c3C2)nc2c1c(=O)n(C)c(=O)n2C 871202238 BAGBUWKUCMENKA-UHFFFAOYSA-N 366.377 0.802 10 10 FCCE CN1CCN(c2ccc(CN3CC[C@H](NS(C)(=O)=O)C3)cc2F)CC1 1116444021 OANHVUPPZSSIKK-HNNXBMFYSA-N 370.494 0.701 10 10 FCCE C[C@@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1471369998 OOXIRZHIXVHUID-CYBMUJFWSA-N 373.457 0.418 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)N1CCC(CN=[N+]=[N-])CC1 2136334944 GDFURQWESNQCCD-RWMBFGLXSA-N 369.422 0.876 10 10 FCCE CC(C)(C)OC(=O)N1CCC(OCCCOc2nnc(=N)[nH]n2)CC1 2219013542 TXKZDUIUBSBTGF-UHFFFAOYSA-N 354.411 0.864 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@@H](O)C(F)(F)F)c1 748417002 ALBJBNHMYJGRHF-SNVBAGLBSA-N 356.322 0.807 10 10 FCCE CC(=O)C(=O)COC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1 808500339 JUJHTLVOPFJCKE-UHFFFAOYSA-N 353.396 0.761 10 10 FCCE CC(=O)C(=O)COC(=O)c1cc(S(=O)(=O)N2CCCCC2)cn1C 808502608 MSSUVBIIDRYOML-UHFFFAOYSA-N 356.400 0.515 10 10 FCCE Cn1cc(CCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nn1 822937980 NHBVCEGITHGUNM-HNNXBMFYSA-N 370.457 0.766 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNC[C@H]3CCC[C@@H]3O)CC2)cc1 843070739 ZMRAMJUCDBQJJP-POAQFYNOSA-N 363.502 0.929 10 10 FCCE CC(C)(O)C[C@@H](O)CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 871982771 BUQKYGJUGXRVCW-MRXNPFEDSA-N 356.488 0.533 10 10 FCCE Cn1nnn(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1=O 1189769961 LLPCEBZRXVQZEO-UHFFFAOYSA-N 363.333 0.391 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)NC[C@H]3C[C@H]3C)CC2)cc1 1321888191 YIAWSNJBYKDCKC-HZPDHXFCSA-N 374.485 0.706 10 10 FCCE COC(=O)COc1ccc(N(C)CC(=O)N[C@H](C(=O)OC)C(C)C)cc1 1473373845 XMZXCJKLOLTRLP-KRWDZBQOSA-N 366.414 0.988 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)NC[C@]23COCCN2C(=O)COC3)cc1 1643778391 ONLXZSAYGIWKDE-MRXNPFEDSA-N 361.358 0.207 10 10 FCCE C[C@@H](NC(=O)NC[C@@]1(O)CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 1680280185 JJKUZGZOELMCMY-WBMJQRKESA-N 355.460 0.662 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CC(=O)C1 2060675446 WGVWWLIEDFWFBX-LBPRGKRZSA-N 350.371 0.945 10 10 FCCE O=c1c2c(ccn1Cc1ncc(I)cn1)CCNC2 2353311148 GQNPPWSHUQAXCN-UHFFFAOYSA-N 368.178 0.937 10 10 FCCE COc1ccc(N2CCN(C(=O)C3CN(S(C)(=O)=O)C3)CC2)cc1 70817154 HNZJAAHTHLDDOY-UHFFFAOYSA-N 353.444 0.235 10 10 FCCE CN(C)C(=O)c1cc(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)cn1C 776434969 UEYHPIOTMBJTEE-UHFFFAOYSA-N 367.383 0.932 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN(CCOC)[C@@H]3CCOC3)nc12 786193060 WHFWGKPAEPLKBH-CYBMUJFWSA-N 364.402 0.849 10 10 FCCE CC(=O)C(=O)COC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 808494325 BOSIXPQGNAEIRF-ZDUSSCGKSA-N 369.395 0.459 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3ccnc(C)n3)C2)cc1 827352949 UPMISJRJSCPWTE-HNNXBMFYSA-N 369.425 0.805 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1CCN(C)S1(=O)=O 843908749 PYYFNSUHYVJCKG-AWEZNQCLSA-N 370.427 0.318 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1=NO[C@H](CN)C1 852884518 HDNGSZHIACRVLA-NSHDSACASA-N 355.778 0.651 10 10 FCCE CC(=O)N1CCO[C@@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 929537738 SCGPJEVIHKOVLZ-GOSISDBHSA-N 361.442 0.729 10 10 FCCE NC[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@@H]1C(F)(F)F 1119066065 GKTUDRGANLIBFO-JQWIXIFHSA-N 357.332 0.830 10 10 FCCE O=C1C[C@@]2(CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2)CN1 1326842794 VNVLWROYBBAYLY-FQEVSTJZSA-N 368.437 0.418 10 10 FCCE N[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC[C@@H]1C(F)(F)F 1334054179 GEZNMHKMVRKQTE-RYUDHWBXSA-N 357.332 0.973 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CCC(N2CCS(=O)(=O)CC2)CC1 1566959928 DBEZOAMWXXCDAL-UHFFFAOYSA-N 368.455 0.362 10 10 FCCE CCCCN1C(=O)[C@H]2[C@H](C1=O)[C@](CO)(C(=O)O)N[C@H]2c1ccccc1O 248206778 BHVJNMAKDYYCQH-MOROJQBDSA-N 362.382 0.254 10 10 FCCE COC(=O)CCN(C)S(=O)(=O)N1CCN(c2ccc(OC)cc2)CC1 327405963 GAOPSFRKUGKHTG-UHFFFAOYSA-N 371.459 0.557 10 10 FCCE C[C@H](O)[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 817831454 MGWGOYUXKWZTOI-WMLDXEAASA-N 359.426 0.287 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C[C@@H](O)CN1CCOCC1 823582094 XLHBUGATVIXSJY-INIZCTEOSA-N 352.431 0.450 10 10 FCCE COC(=O)N(C)CCN(C)C(=O)C(=O)NCCCSc1nccs1 828239315 NWYWVIGCCHHKBJ-UHFFFAOYSA-N 374.488 0.898 10 10 FCCE CNS(=O)(=O)c1cc(C(=O)NCc2ccc(N(C)C)cc2)n(C)c1 27132957 BSJRUSPPHGINNF-UHFFFAOYSA-N 350.444 0.929 10 10 FCCE CN(CCCO)C(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 297977637 WUTJWZHXRDIHMA-OAHLLOKOSA-N 350.415 0.741 10 10 FCCE CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)/C=C/c1cnc(OC)nc1 775824584 IPWCAYRKZSXQGJ-ZZXKWVIFSA-N 374.422 0.996 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNCC[C@H](O)C(F)F)CC2)cc1 872222469 VINICKSPCUXNTA-WBVHZDCISA-N 373.444 0.784 10 10 FCCE CCN1CC[C@@H]1CNC(=O)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 898095922 ITXOIGLQDBHIRB-DOTOQJQBSA-N 374.485 0.848 10 10 FCCE C[C@@H](NC[C@@H](O)CS(C)(=O)=O)c1ccc(N2CCOCC2)c(F)c1 927031395 HNBZLMJWEYTJKZ-TZMCWYRMSA-N 360.451 0.718 10 10 FCCE COC(=O)[C@@H]1N[C@H](c2ccc3c(c2)CCN3C(C)C)[C@@H]2C(=O)N(C)C(=O)[C@H]12 65385878 LDHHKKHGZNCALV-YYIAUSFCSA-N 371.437 0.874 10 10 FCCE Cc1cc(Cl)cc(CN2CCN(C(=O)Cn3cnnn3)CC2)c1O 289749870 JCVMBIWXKJKXBP-UHFFFAOYSA-N 350.810 0.685 10 10 FCCE Cn1cc(C[C@@H](O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 787010699 NBNQOUSNFFNZEJ-LJQANCHMSA-N 372.469 0.849 10 10 FCCE C[C@H](NC(=O)C(=O)N1CCC2(COC2)C1)c1ccc(N2CCOCC2)cc1 827511027 MTORUKLSYPOVOG-HNNXBMFYSA-N 373.453 0.949 10 10 FCCE C[C@@H](CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)NC(N)=O 847366567 KETFCCZLQRXZPO-JSGCOSHPSA-N 361.446 0.451 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCCN3C(=O)CCC3=O)C2)cc1 852107219 JAIBCWNLYINRMR-ZDUSSCGKSA-N 360.414 0.722 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CN3CCS(=O)(=O)CC3)C2)cc1 855232328 PUVZUYBBKKCYLQ-CQSZACIVSA-N 367.471 0.121 10 10 FCCE O=C(NCc1cccc(O)c1O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1 1153793249 ZJQCBNVCCVBYNM-CYBMUJFWSA-N 372.381 0.905 10 10 FCCE Cc1cc(CN2CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)on1 1329330825 HUARHHGRFUCUOY-UHFFFAOYSA-N 370.409 0.875 10 10 FCCE C[C@@H](NC(=O)C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1O 1471196409 ZZDXHNWGUIXJSN-SNVBAGLBSA-N 363.395 0.856 10 10 FCCE CC(C)(C)OC(=O)NC[C@H]1C[C@H](O)CN1C(=O)c1cc(O)c(O)c(O)c1 2132348471 LXYTWWJAZOQJRG-MNOVXSKESA-N 368.386 0.904 10 10 FCCE NC(=O)[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(C(=O)Nc2ccc(N)cc2)C1 2162977514 UIGWLIRXPUTQSS-KCJUWKMLSA-N 373.335 0.655 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NOCC(C)(C)O)CC2)cc1 824259053 CGOTUNBTUJMOIE-UHFFFAOYSA-N 366.462 0.819 10 10 FCCE C[C@H]1CN(S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)C[C@@H](C)O1 842784915 CGWWKVKDVCIJEM-ZENOOKHLSA-N 356.492 0.696 10 10 FCCE CN(C)c1ccc([C@@H](N)CNS(=O)(=O)[C@H]2CC(=O)N(C3CC3)C2)cc1 866757025 HLJBIWCSSDBNCM-HOTGVXAUSA-N 366.487 0.435 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@H](CO)[C@@H](CCO)C1 1348483692 PLKZMLBTLPESHJ-DLBZAZTESA-N 363.458 0.656 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1nc(C2CC2)n[nH]1 1466674373 SLBXCYYTJDKIES-LBPRGKRZSA-N 374.397 0.926 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3nncn3C)CC2)cc1 1611365349 ICBFCFFSDCTFBO-FPLPWBNLSA-N 370.413 0.667 10 10 FCCE O=C(Cc1ccc(S(=O)(=O)CCO)cc1)NCc1cc(O)ccc1O 1651225339 GFRDGYMPSBRSMW-UHFFFAOYSA-N 365.407 0.723 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNCc1ccc(O)c(O)c1 2218616771 PLDUFYMFYOYJQO-TUKIKUTGSA-N 354.403 0.529 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3CCCC3=O)CC2)cc1F 84963952 PZINGFNUDYADQO-OAHLLOKOSA-N 351.422 0.940 10 10 FCCE CC(=O)N1CCN(c2ccc(CNc3cncc(C(N)=O)n3)cc2)CC1 191859250 KAJBTZLYFRNIEU-UHFFFAOYSA-N 354.414 0.856 10 10 FCCE CN(CC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1cc(Cl)c(F)cc1O 295280847 IKSFRFMIDSHNIA-JTQLQIEISA-N 364.826 0.920 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3C[C@H]4C[C@H]3C(=O)O4)CC2)cc1 296200886 CXRKTRBBCRINNT-SJORKVTESA-N 374.441 0.527 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@H](O)CN1C(=O)c1ccc2c(c1)CCC2 808512219 PTEYBYKHYQNWFH-HOTGVXAUSA-N 359.378 0.452 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2CNCC[C@H]2C)cc1 846343755 OJNQBCFQSKSRPS-PBHICJAKSA-N 362.474 0.704 10 10 FCCE C[C@H](NC(=O)C(=O)N1CC2CC1(CN)C2)c1ccc(N2CCOCC2)cc1 851684782 HRIOGBHSINHQRA-BQTBQCLESA-N 372.469 0.650 10 10 FCCE CCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@@H](C)CS(C)(=O)=O 1329421715 BILSHGRYGAANEH-NSHDSACASA-N 354.428 0.516 10 10 FCCE C[C@H](NC(=O)C(=O)N1CC=C[C@@H]1CO)c1ccc(N2CCOCC2)cc1 1332105611 PDDAJACEDVRQFT-WMLDXEAASA-N 359.426 0.460 10 10 FCCE COc1ccc(CNC[C@@H](C)N(C)C(=O)[C@H]2CC[C@@H](C(N)=O)O2)cc1C 1568300553 SMIWWPQHHBFKSZ-XOKHGSTOSA-N 363.458 0.973 10 10 FCCE COc1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1S(N)(=O)=O 1570020285 WSOJAWIULAQVLY-UHFFFAOYSA-N 366.395 0.613 10 10 FCCE OC[C@@H]1C[C@H](NCc2cc(Br)cc(F)c2O)[C@@H](O)[C@@H]1O 2177947487 FZBUCDBLNYJBSQ-AXVUBJCFSA-N 350.184 0.486 10 10 FCCE CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)NCCc1ccc(O)c(O)c1 270540538 JYZMQTCCQXYGLD-LLVKDONJSA-N 367.402 0.525 10 10 FCCE COC[C@@H](C)S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 275335577 UQEWKXAKMJJYNG-MRVPVSSYSA-N 366.417 0.533 10 10 FCCE CN1CCN(c2ccc(CN3CC[C@@H](NS(C)(=O)=O)C3)cc2)CC1 775706396 QKHMXEPEBLZURU-MRXNPFEDSA-N 352.504 0.562 10 10 FCCE C[C@H](CNC(=O)NCc1ccc(N2CCSCC2)cc1)S(N)(=O)=O 799887385 WKTLSVOVOXJJGC-GFCCVEGCSA-N 372.516 0.716 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCC[C@H](N)C3)C2)cc1 851688339 XGHRFRKYGKJZRV-ZNMIVQPWSA-N 360.458 0.776 10 10 FCCE CNS(=O)(=O)c1ccc2c(c1)N(C(=O)c1ccnc3c1CC(=O)N3)CC2 1445035439 SSHGTBILCPEZOG-UHFFFAOYSA-N 372.406 0.687 10 10 FCCE CCOC(=O)C1([S@@](C)=O)CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1635785611 CQTOPWONVUNBRL-RUZDIDTESA-N 369.439 0.943 10 10 FCCE CN1CCCc2cc(CNC(=O)/C=C\c3cn(C)c(=O)n(C)c3=O)ccc21 1772824421 WXZFYEYRXVGDGM-CLFYSBASSA-N 368.437 0.796 10 10 FCCE NC(=O)[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(C(=O)Nc2ccc(N)cc2)C1 2162977515 UIGWLIRXPUTQSS-KWQFWETISA-N 373.335 0.655 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2320917169 OHKDGDGGTSDCGG-LLVKDONJSA-N 357.411 0.926 10 10 FCCE N[C@@H]1C(=O)Nc2cc(N3CCS(=O)(=O)CC3)c(Br)cc21 92775257 CYZZHRXIKMYDHR-NSHDSACASA-N 360.233 0.636 10 10 FCCE COc1cncc(O[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)C2)n1 220109660 ZPRHSFYOGIWGJA-VIFPVBQESA-N 368.440 0.325 10 10 FCCE CCCCN1C(=O)[C@H]2[C@H](C1=O)[C@@](CO)(C(=O)O)N[C@H]2c1ccccc1O 248206775 BHVJNMAKDYYCQH-AHXJXLJNSA-N 362.382 0.254 10 10 FCCE CN1CCC[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1=O 822659762 FWHZTDJMYJEQBZ-NVXWUHKLSA-N 372.469 0.873 10 10 FCCE CC1(C)C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CO1 827078404 LMARWXYBUJPDDC-OAHLLOKOSA-N 361.442 0.823 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H]2CCNC[C@H]2C)cc1 846344720 TWTTZUCLMJQINW-RHSMWYFYSA-N 362.474 0.704 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1cc(S(N)(=O)=O)cn1 1297563139 YEIZUUQONPCEHU-UHFFFAOYSA-N 359.404 0.038 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCC1CS(=O)(=O)C1 1329900279 YSDCEXSEPPSFFX-UHFFFAOYSA-N 367.471 0.262 10 10 FCCE CO[C@@H]1CS(=O)(=O)C[C@@H]1NC1CCN(c2ccc3c(c2)OCO3)CC1 1616137652 XGLPBUBRWWFCBU-WMLDXEAASA-N 368.455 0.786 10 10 FCCE C[C@]1(C[C@@H]2CCCN2C(=O)c2c(F)ccc(O)c2O)NC(=O)NC1=O 1651014138 HJIKQZDBVDEXRI-ZKANADHPSA-N 351.334 0.830 10 10 FCCE CC(=O)N1CCN(CCNCc2ccc(N3CCN(C)CC3)cc2)CC1 1660927762 CBPIYHKUJMXKHJ-UHFFFAOYSA-N 359.518 0.692 10 10 FCCE COCCN1C(=O)C(=CNC[C@H]2CC2(Cl)Cl)C(=O)NC1=S 2040480364 OCXHYUXCTQMZLR-SSDOTTSWSA-N 352.243 0.543 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2312333156 ABZKFFOSWSEDPH-PREPNJAASA-N 355.395 0.675 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN3C(=O)OCC[C@@H]3C2)c1 765405386 TWNWZSGTLSXNKX-LLVKDONJSA-N 369.399 0.430 10 10 FCCE CCOC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)NCc1ccc(OC)cc1O 793083444 CQIPOKWXTOQFOI-QWRGUYRKSA-N 367.402 0.656 10 10 FCCE CN(C)CCN1CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1=O 844377357 XEBVKTDCSYFZFZ-UHFFFAOYSA-N 361.490 0.075 10 10 FCCE O=C(O)c1cc(O)ccc1NS(=O)(=O)C[C@@H]1CCCS(=O)(=O)C1 844782500 ADMGSHSFYVKWSR-SECBINFHSA-N 363.413 0.657 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCN(CCN(C)C)C(=O)C1 844994382 ZTCNAYKQALKHBM-UHFFFAOYSA-N 361.490 0.976 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN2C[C@H](O)C[C@H]2C1 847294391 BDVULMPLTCFHBT-ZWKOTPCHSA-N 360.458 0.484 10 10 FCCE COC(=O)COCCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 858599871 QYQAOMZXQPHFDX-ZDUSSCGKSA-N 351.403 0.763 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3[C@H]4CC[C@@H](NC4)[C@H]3C2)cc1 861735145 MZMRNSWUTVLVTH-LEUOFYLZSA-N 356.470 0.825 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@@H]3[C@H]4COC[C@H]43)C2)cc1 1118173991 DGJLSVYUSDKVGS-VZEFYGNVSA-N 359.426 0.399 10 10 FCCE CC(=O)c1cc(F)cc(CN2CCOC[C@@H]2CNS(C)(=O)=O)c1O 1329930204 NZKFPKXOLAHURJ-ZDUSSCGKSA-N 360.407 0.484 10 10 FCCE C[C@]1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCNC(=O)C1 1462808669 POAMGPQQKUJZTI-FQEVSTJZSA-N 372.469 0.921 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(=O)n(C)c1 1611045678 RMWDHBPAAFPLJH-ZDUSSCGKSA-N 360.366 0.701 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CC[C@@H](C(N)=O)C3)CC2)cc1 1631442603 CZZYTULOZLBNMQ-CVEARBPZSA-N 374.485 0.835 10 10 FCCE NS(=O)(=O)c1ccc(CCC(=O)NCc2cccc(O)c2O)cc1 1644708366 IZELYZRJIMFIMD-UHFFFAOYSA-N 350.396 0.994 10 10 FCCE COc1ccc(CNC(=O)NCCS(=O)(=O)N2CCCC2)c(O)c1 1676362666 PCXDGTUYWIRUOO-UHFFFAOYSA-N 357.432 0.626 10 10 FCCE CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@H]1OC(C)=O 12379892 QKGHBQJLEHAMKJ-MBJXGIAVSA-N 373.318 0.380 10 10 FCCE COc1ccc(N2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)cc1F 270925648 SQEMKSAZKLIZDZ-LBPRGKRZSA-N 350.350 0.081 10 10 FCCE Cc1cc(C(=O)N2CCN(CC(N)=O)C(=O)C2)c(C)n1-c1ccccn1 837977467 WNMXQKRIZBWPGO-UHFFFAOYSA-N 355.398 0.259 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cn1cnc(N)n1 1137818020 RVZZCDQRJCNXJB-UHFFFAOYSA-N 353.766 0.421 10 10 FCCE COC[C@@H](CNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)OC 1328090416 BHHTYQPSTIAOKQ-CZUORRHYSA-N 365.430 0.168 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3nsnc3O)cc2)C1 1542180272 GAQXAFGSROURIU-NSHDSACASA-N 361.427 0.875 10 10 FCCE CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@@H]1OC(C)=O 2054661982 LJICGUPPWNZTFT-MRTXSQPYSA-N 373.318 0.380 10 10 FCCE O=C(O)[C@@H]1CN(Cc2ccc(Br)cc2O)CCS1(=O)=O 2197714919 KGXSIMPAFGWUTR-NSHDSACASA-N 364.217 0.838 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCO[C@@H](C2CC2)C1 788313370 RQSQTUAEBSLRAS-GOSISDBHSA-N 373.453 0.777 10 10 FCCE CCn1ccc(CNC(=O)C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)n1 829664703 OXYHUSIJCLYLDN-HNNXBMFYSA-N 371.441 0.923 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H](CN)CC(C)C)C2)cc1 851688198 SIMCAMQYQCJUKG-HUUCEWRRSA-N 362.474 0.880 10 10 FCCE O[C@H](CNCc1ccc(N2CCOCC2)cc1)CC1(O)CCOCC1 872199539 PINFTFOAPNDBOC-SFHVURJKSA-N 350.459 0.905 10 10 FCCE CO[C@@H]1COCC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 897809746 WXKCUUGNIBJXMO-QZTJIDSGSA-N 373.453 0.941 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCOCC(F)F)C2)cc1 1118708614 CNYIZGGPDGHJRL-LBPRGKRZSA-N 371.384 0.788 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@H](OCCN2CCOCC2)C1 1294691639 XOLLSGDDJCEKOC-HNNXBMFYSA-N 350.415 0.590 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCS(=O)(=O)CCO3)C2)cc1 1346435620 HPGVZWPLFBPIPP-ZDUSSCGKSA-N 369.443 0.646 10 10 FCCE CS(C)(=O)=NS(=O)(=O)CCNC(=O)NCc1c(O)cccc1F 1685350021 RZBNZKDNEUPMBR-UHFFFAOYSA-N 367.424 0.388 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1C[C@H](O)CN(C(=O)c2cc(O)c(O)c(O)c2)C1 2132348282 ICJCSPOXPYTOCE-QWRGUYRKSA-N 368.386 0.904 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)CNCc1ccc(O)c(O)c1O 2258309350 SSRYLYXDULFDPB-UHFFFAOYSA-N 358.391 0.141 10 10 FCCE Cn1c(=O)n(C)c2cc(S(=O)(=O)NCCc3ccc(N)cc3)ccc21 193338070 USGJPDKTYADHBD-UHFFFAOYSA-N 360.439 0.980 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCCCCN2CCOCC2)cc1 284644258 LZIQEZRJERPYGE-UHFFFAOYSA-N 362.474 0.597 10 10 FCCE CCN(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)Cc1cn(C)nn1 782103344 UDANKBHWWIUTMF-UHFFFAOYSA-N 372.473 0.994 10 10 FCCE CC(=O)C(=O)COC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 808510006 ZPKUOXPXCGGJFX-UHFFFAOYSA-N 360.413 0.067 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@@H]1CNCC[C@@H]1C)c1ccc(N2CCOCC2)cc1 842123538 OTAVBHNCLABRAB-RLFYNMQTSA-N 374.485 0.815 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCNC[C@@H]3C(F)F)CC2)cc1 844224203 NFTXIFSRLNAOJY-MRXNPFEDSA-N 368.428 0.883 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3CCCCNC3)C2)cc1 851687868 JZORCCTYJBBWSE-HUUCEWRRSA-N 360.458 0.648 10 10 FCCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCC(O)(c2nn[nH]n2)CC1 1296955635 DFPSXFXZPFWDBP-UHFFFAOYSA-N 361.383 0.949 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CC=C[C@H]3CO)C2)cc1 1331799853 UPUFFFFYNYSCJJ-ZBFHGGJFSA-N 359.426 0.397 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2CCC3(CC2)C[C@@H](O)CNC3=O)cc1 1636318674 ZTSOFKBNYVHBRH-CYBMUJFWSA-N 359.386 0.952 10 10 FCCE CS(=O)(=O)C1(C(=O)O)CN(Cc2ccc(Br)cc2O)C1 2379836334 GKNLTNHKZXIBAW-UHFFFAOYSA-N 364.217 0.838 10 10 FCCE CC[C@H](C)[C@]1(C(=O)O)N[C@H](c2cccc(OC)c2O)[C@H]2C(=O)NC(=O)[C@H]21 248147459 AGCNCEFJJIIKIA-AEXWGPEASA-N 362.382 0.803 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)CCn3ccnn3)CC2)cc1 299307451 DUAUXWFRUHBARL-UHFFFAOYSA-N 358.446 0.615 10 10 FCCE CN(C)C(=O)C1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 806539010 DBWLZHZLEULCEQ-HNNXBMFYSA-N 372.469 0.873 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N[C@@H](C)Cn1cncn1 817812546 SJWSGEBBCJTQNV-CABCVRRESA-N 372.473 0.905 10 10 FCCE CN(C)c1ccc([C@H](N)CNC(=O)Cn2cnc3c(cnn3C)c2=O)cc1 832293317 UXFXTXVRGOEXIG-OAHLLOKOSA-N 369.429 0.012 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@H]([C@H](C)O)C3)nc12 839669533 AMCIFKMONIWLSY-GWCFXTLKSA-N 350.375 0.193 10 10 FCCE CCO[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C[C@H]1CN 846328930 KZGYAGMLMDFQOJ-SJLPKXTDSA-N 372.469 0.501 10 10 FCCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2CCOC[C@@]2(CO)C1 1124054067 WIHPDAUCZJZDEB-KRWDZBQOSA-N 364.423 0.832 10 10 FCCE O=C(NCc1cccc(O)c1O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1 1153793252 ZJQCBNVCCVBYNM-ZDUSSCGKSA-N 372.381 0.905 10 10 FCCE COC(=O)[C@@H]1C[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1333972568 OITBRKJTYDTTJV-GDBMZVCRSA-N 357.410 0.604 10 10 FCCE C[C@H]1CCOCCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1340389463 ATLYLUSYPKRBRZ-HNNXBMFYSA-N 361.442 0.777 10 10 FCCE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)C(=O)COc1ccc(N)cc1 2044690890 JEJUJODOBYZSHX-ZDUSSCGKSA-N 353.419 0.992 10 10 FCCE CSCC[C@@]1(C(=O)O)N[C@@H](c2ccccc2O)[C@H]2C(=O)N(C)C(=O)[C@H]21 59086918 BRPXHRAJUASVQS-NEULZYRMSA-N 364.423 0.844 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNC(=O)c2cc(O)nc(O)c2)C1 702776965 VJCPBFHTNCLOSE-GHMZBOCLSA-N 353.375 0.450 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3C[C@H]4CC[C@H]3CN4)C2)cc1 818676399 NLUJDFLVKWPBGI-UXLLHSPISA-N 372.469 0.601 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN2CN(CCN(C)C)C(=O)[C@@H]2C)c1O 843428963 PMCPIGFUJOPLLK-NSHDSACASA-N 352.391 0.861 10 10 FCCE COC[C@@H]1CCN1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 852501378 ZXAPICDNJBZCMA-INIZCTEOSA-N 367.471 0.852 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc4c(c3)COB4O)C2)cc1 863886848 OPUKXMHWSBGOSV-OAHLLOKOSA-N 352.199 0.922 10 10 FCCE O=C(NCc1cc(NC(=O)[C@@H]2[C@H]3COC[C@H]32)ccc1O)[C@@H]1[C@H]2COC[C@H]21 923119267 LSNCANMMYQPGOX-OOILUVOASA-N 358.394 0.732 10 10 FCCE C[C@@H]1CC[C@H](NC(=O)C(=O)NCCc2ccc(N)cc2)CS1(=O)=O 1333542675 LLOQIUBSSVSRRP-RISCZKNCSA-N 353.444 0.009 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)c2nc3ncc(CCO)cn3n2)c1 1445967241 JWKTWSOMZRTGGH-JTQLQIEISA-N 357.370 0.864 10 10 FCCE COC(OC)C(=O)N1CCN(C(=O)NCc2ccc(N(C)C)cc2)CC1 1527382256 HUSOZGHXSKKHJF-UHFFFAOYSA-N 364.446 0.725 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)[C@@H](O)C1 1890523658 BQZVRGBHWOCQNA-BFQNTYOBSA-N 369.422 0.878 10 10 FCCE Nc1ccc(N2C(=O)[C@H]3CS(=O)(=O)C[C@H]3C2=O)cc1Br 1924750081 IIBCPZSWGCMBAD-OCAPTIKFSA-N 359.201 0.565 10 10 FCCE CC(C)(C)OC(=O)NCC1(O)CN(C(=O)COc2ccc(N)cc2)C1 2044648310 MGZLUSGRMCFJSR-UHFFFAOYSA-N 351.403 0.746 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)Cc2ccc(N)cc2)[C@H](O)C1 2062451265 NGUZKCXLIRPSGN-UONOGXRCSA-N 371.459 0.668 10 10 FCCE O=S1(=O)C[C@@H](NCc2cc(Br)cc(F)c2O)[C@@H](O)C1 2121362402 ASTNEZZWCRTVRJ-ZJUUUORDSA-N 354.197 0.541 10 10 FCCE C[C@@H]1C[C@@H]1C(=O)NCCC(=O)NCc1ccc(N2CCNC(=O)C2)cc1 106263865 PKRKONNMZPTUKZ-CJNGLKHVSA-N 358.442 0.401 10 10 FCCE COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(OC)cc3)CC2)n1 739830774 JEIOLHVLSFVBBG-UHFFFAOYSA-N 358.398 0.818 10 10 FCCE Cc1nnc(CN(C)CC(=O)NC[C@H](N)c2ccc(N(C)C)cc2)n1C 832280634 PSMCGMOFBSAZDI-INIZCTEOSA-N 359.478 0.438 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN4C(=O)NC[C@@H]4C3)C2)cc1 854300720 YXRUNCPNEUFXAB-UKRRQHHQSA-N 359.430 0.693 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CCCN3C(=O)CNC3=O)C2)cc1 855229482 NXQYRICTQJBHOT-ZDUSSCGKSA-N 360.414 0.722 10 10 FCCE CN1C2(CCC2)COC[C@]1(CO)CNC(=O)/C=C\c1ccc(O)c(O)c1 862641925 DWURXAGZSUXDFC-GJEJWFRCSA-N 362.426 0.843 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3C[C@@H](O)C4(CC4)C3)CC2)cc1 1324209142 DNVMPMQFOLPSBP-IEBWSBKVSA-N 361.486 0.635 10 10 FCCE NC(=O)c1cc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c[nH]1 1638488577 KQFNVNUHWJYPRF-UHFFFAOYSA-N 369.425 0.745 10 10 FCCE Cn1cc([C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]2C[C@H](N)C2)nn1 2049780252 HPBQAIJNMLYQSS-KWBADKCTSA-N 351.407 0.647 10 10 FCCE CCc1nc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)no1 775378054 RVLZYRBWVWJPEN-UHFFFAOYSA-N 364.427 0.797 10 10 FCCE COc1ccc(N2CC[C@H](NS(=O)(=O)C[C@@H]3CN(C)CCO3)C2)cc1 867498103 WMIYMRNCCYZVMX-YOEHRIQHSA-N 369.487 0.524 10 10 FCCE O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NCc1c(O)cccc1O 1178912931 ZXVOTKMUELTJJW-RRCSTGOVSA-N 360.366 0.267 10 10 FCCE O=S1(=O)CC[C@@]2(CN(Cc3cc4c(cc3O)OC[C@@H]4O)CCO2)C1 1326485407 FKIZRJGDJSFPIU-GOEBONIOSA-N 355.412 0.208 10 10 FCCE C[C@H](NC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1O 1471196143 WAQWVTIUDCITPS-JTQLQIEISA-N 357.370 0.017 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2CCS(=O)(=O)[C@@H]3COCC[C@H]32)cc1 1570205177 KYSQLACCLCYZKO-CHWSQXEVSA-N 366.399 0.877 10 10 FCCE Cn1cc(C=CC(=O)N(CCC(N)=O)c2ccccc2)c(=O)n(C)c1=O 2296582621 HIHRMLJUEOXMPA-UHFFFAOYSA-N 356.382 0.006 10 10 FCCE COCCN1C[C@@H](C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1=O 45268552 HPWJAVKWIPNODB-HNNXBMFYSA-N 361.442 0.839 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCN(C(C)=O)C[C@@H]3C)CC2)cc1 268701546 RKRNAJKTGKNKQF-INIZCTEOSA-N 374.485 0.896 10 10 FCCE CC(=O)C(=O)COC(=O)CCCNS(=O)(=O)c1ccc(C(C)=O)cc1 808493486 HIARPFCGNVGCEG-UHFFFAOYSA-N 369.395 0.649 10 10 FCCE COC(=O)N(C)CCN(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 828436897 GRUDGDQZRIWOCU-UHFFFAOYSA-N 364.446 0.834 10 10 FCCE COc1cccn2c(=O)n(CC(=O)NCc3ccc(N(C)C)cc3)nc12 842611360 YIQBMXSGTKXCJW-UHFFFAOYSA-N 355.398 0.887 10 10 FCCE COC(=O)[C@@H]1CC[C@H](C(=O)NCc2ccc(N3CCN(C)CC3)cc2)O1 881854903 KWRLAQGTSVRQIP-SJORKVTESA-N 361.442 0.775 10 10 FCCE O=S1(=O)C[C@@H](O)[C@H](NCc2cc(Br)cc(F)c2O)C1 895675081 ASTNEZZWCRTVRJ-NXEZZACHSA-N 354.197 0.541 10 10 FCCE COc1ccc(CNC(=O)NCc2nnc3c(=O)n(C)ccn23)c(O)c1 1254666066 JCNFPUQMUXNDGE-UHFFFAOYSA-N 358.358 0.142 10 10 FCCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)C2CCS(=O)(=O)CC2)c1 1319411009 ZAIRRAWKXRDZEB-SNVBAGLBSA-N 363.457 0.958 10 10 FCCE CN1CCN(C[C@@H](O)CNCc2ccc(N3CCC(O)CC3)cc2)CC1 1328488241 UACITKGDAFAQCL-FQEVSTJZSA-N 362.518 0.346 10 10 FCCE CC[C@](COC)(NCC(=O)NCc1ccc(N(C)C)cc1)C(=O)OC 1460206036 HKCZRLIVOKCFHT-GOSISDBHSA-N 351.447 0.927 10 10 FCCE NS(=O)(=O)c1cc(C(=O)NCc2ccc3cccnc3c2O)ccn1 1469249244 MSUYMGKAIINICF-UHFFFAOYSA-N 358.379 0.913 10 10 FCCE Cc1cc(C(=O)NC[C@]2(O)CCS(=O)(=O)C2)c(C)n1-c1ccccn1 1624259301 IUVSRSBCLXYYCB-QGZVFWFLSA-N 363.439 0.769 10 10 FCCE CC(C)(C)OC(=O)N1CC(C(=O)C(=O)C[C@H]2C[C@H](N)C2)(S(C)(=O)=O)C1 2326762406 XPDWXDWDDUOORF-XYPYZODXSA-N 374.459 0.286 10 10 FCCE O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C(=O)NCCC2 218511667 KHZCOYKEEMIROI-UHFFFAOYSA-N 356.454 0.618 10 10 FCCE CNC(=O)[C@@H]1CCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C1 817862029 QFULOCAZQNVUIN-GOEBONIOSA-N 374.485 0.703 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CCN(C)S2(=O)=O)cc1 844857342 UHGHLDXHJBUKPL-HNNXBMFYSA-N 355.460 0.624 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C3(N4CCOCC4)CC3)cc2)CC1 918839399 SFOSJLOGUNMQGZ-UHFFFAOYSA-N 358.486 0.919 10 10 FCCE Cn1nncc1CNC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1251585924 GOHJZAMWWHVLAQ-UHFFFAOYSA-N 371.445 0.516 10 10 FCCE O=C(Cn1[nH]cc2c(=O)ncnc1-2)NCc1ccc2cccnc2c1O 1451953077 LBEYGYQOJUTOAK-UHFFFAOYSA-N 350.338 0.641 10 10 FCCE CN(C)c1ccc([C@H](CNC(=O)c2nccnc2C(N)=O)N(C)C)cc1 1637004985 YBQOPYRIXDQIFZ-AWEZNQCLSA-N 356.430 0.674 10 10 FCCE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCc1c(O)cccc1O 1639292572 IPTMDYLTJRRGLZ-UHFFFAOYSA-N 351.403 0.524 10 10 FCCE NS(=O)(=O)c1cnn(CC(=O)NCc2c(O)ccc3ccccc23)c1 1645440442 DHDQLNHCFNNSJN-UHFFFAOYSA-N 360.395 0.706 10 10 FCCE CN(CCN=[N+]=[N-])c1ccc2c(c1)C(=O)N([C@@H]1CCC(=O)NC1=O)C2=O 2086865001 YZKSNGFJHRNZKS-GFCCVEGCSA-N 356.342 0.834 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)Nn1cnnc1 2136257776 CDLYTLKVISMNNM-NSHDSACASA-N 363.374 0.895 10 10 FCCE COc1ccc(N2CCC(NC[C@@H](O)CN3CCN(C)CC3)CC2)cc1 819002673 NDCPVPFQCRAESH-LJQANCHMSA-N 362.518 0.862 10 10 FCCE CCN1CCN(CC(=O)NCc2ccc(N3CCN(C)CC3)cc2)CC1 881851435 UQKSMNUTJXDRCG-UHFFFAOYSA-N 359.518 0.692 10 10 FCCE CN(C)c1ccc(CNC(=O)[C@@H]2[C@H](O)C(=O)N(C)[C@H]2c2cnn(C)c2)cc1 1123481599 RWIXTGJPDDAVMF-ULQDDVLXSA-N 371.441 0.293 10 10 FCCE CCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@H](C)CS(=O)(=O)CC 1351836765 ACFSWYATDUZDNB-GFCCVEGCSA-N 368.455 0.906 10 10 FCCE CCOC(=O)c1c(NC(=O)[C@H](O)[C@@H](O)C(=O)O)sc2c1CC[C@H](C)C2 1865946131 SCZWVNUGAWENCD-UPZJHPNMSA-N 371.411 0.795 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC(F)(F)C[C@H]3CO)nc12 366660581 JQMNCVRTPFPGPR-JTQLQIEISA-N 356.329 0.814 10 10 FCCE CC(C)(C)OC(=O)N1CCC[C@](CO)(NC(=O)c2cc(O)nc(O)c2)C1 711743718 VHJUNRXVYLIGDG-KRWDZBQOSA-N 367.402 0.985 10 10 FCCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C(=O)c1c(F)ccc(O)c1O 827203649 WPLGWPDWEXUNPN-PNZRWIHMSA-N 367.329 0.802 10 10 FCCE C[C@@H](N)[C@@H](C)NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 851669693 ZZSUBGNGLJHQQK-CHWSQXEVSA-N 354.476 0.456 10 10 FCCE O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)NCC12CC(CN1)C2 851685365 ABDJPNXPQNCAAT-UHFFFAOYSA-N 374.510 0.724 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3nc(C)no3)C2)cc1 1118606179 KECBWSHODQKRFY-WCQYABFASA-N 373.413 0.959 10 10 FCCE COCCCS(=O)(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1631371215 PWTQXFAFVVUXGT-UHFFFAOYSA-N 372.443 0.151 10 10 FCCE COc1ccc(N2CCN(C(=O)CCCNS(C)(=O)=O)CC2)cc1 1858093094 PAOYCNBFRZYJQI-UHFFFAOYSA-N 355.460 0.673 10 10 FCCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)NCCOc2ccc(N)cc2)C1 2136224917 BPJLHJXTMQVDEW-UHFFFAOYSA-N 365.430 0.993 10 10 FCCE O=C1N[C@H](CF)C(=O)N1Cc1ccc(N2CCS(=O)(=O)CC2)cc1 849359365 PHPJRNMWPHNECD-CYBMUJFWSA-N 355.391 0.311 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3cncc(OC)n3)C2)cc1 850537290 ONZFICGNWPPFAE-GFCCVEGCSA-N 371.397 0.827 10 10 FCCE N[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC[C@H]1F 851686784 SXDBUDSLTLYMSP-HZPDHXFCSA-N 364.421 0.037 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3[C@H]4CC[C@@H](CN4)[C@H]3C2)cc1F 861751118 YZHWEGSVQBAXRD-KLZNWCGWSA-N 374.460 0.964 10 10 FCCE COC[C@H](CCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)OC 1333338742 GTODPDVYJOYXML-INIZCTEOSA-N 351.447 0.879 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)c3cnncc3O)cc2)CC1 1335903635 IZUXUHDKYJSMSS-UHFFFAOYSA-N 355.398 0.781 10 10 FCCE COCc1csc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)n1 1342412409 WOKMTJAOKYMXQI-UHFFFAOYSA-N 351.384 0.998 10 10 FCCE CNC(=O)CCn1c([C@H]2CCC(=O)N2)nnc1N(C)Cc1ccccc1O 1517596461 COWQSVAFRJIDJA-CYBMUJFWSA-N 372.429 0.707 10 10 FCCE COc1cc(C(=O)N[C@@H](C)CNC(=O)[C@@H]2CCN(C)[C@@H]2C)cc(OC)n1 1526629895 FXHMXATWQJMFGT-OUCADQQQSA-N 364.446 0.674 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3CC[C@@H](C(N)=O)O3)cc2)CC1 1537839053 INCBAOWNWFOUJB-JKSUJKDBSA-N 374.441 0.037 10 10 FCCE CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCN2CCO[C@H]1C2 1556735990 VAQXHWNRSCIVOS-HIFRSBDPSA-N 369.443 0.309 10 10 FCCE O=C(O)C[C@H](C(=O)O)[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O 30724560 KYSQDMNDMYECNZ-UBLBQRRNSA-N 354.267 0.283 10 10 FCCE in-vitro CC(C)(C)OC(=O)N[C@H](CCNC=C1C(=O)OC(C)(C)OC1=O)C(=O)O 100751499 OLJZDQDQJCQQFM-SNVBAGLBSA-N 372.374 0.664 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@@H](C)NC(N)=O 847662131 WNVFBAOGCSOBEO-SECBINFHSA-N 357.794 0.994 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CN3C(=O)NC(C)(C)C3=O)C2)cc1 855228547 CSABNQXAYNNNIV-GFCCVEGCSA-N 360.414 0.721 10 10 FCCE COc1cc(Br)cc(CN2CC(O)(c3ncnn3C)C2)c1O 895620873 MUVCSBSXJPQNFU-UHFFFAOYSA-N 369.219 0.995 10 10 FCCE CCOC(=O)[C@]1(C)CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCO1 1332090836 OLFLULNXBPIGAX-SFHVURJKSA-N 362.382 0.415 10 10 FCCE CC(C)(C)OC(=O)N1CC(CO)(NC(=O)Cc2ccc(O)c(O)c2)C1 2062352538 KEDBVWRIIXHYNO-UHFFFAOYSA-N 352.387 0.738 10 10 FCCE Cn1cc(Br)c(S(=O)(=O)NCc2cc(N)ccc2O)n1 2178415551 AEQZXVSDBDUWDR-UHFFFAOYSA-N 361.221 0.949 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)c1ccc(C(=O)NCCO)nn1 768517761 SGOSVBJCACTNOH-UHFFFAOYSA-N 371.441 0.672 10 10 FCCE CC(C)N(C[C@H](C)O)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788318900 JFLGWDHVYRRWMB-HNNXBMFYSA-N 363.458 0.757 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC[C@](O)(CO)C1 837712251 ASBQMQPUJLKPFJ-GOSISDBHSA-N 367.421 0.691 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CN3CCS(=O)(=O)CC3)C2)cc1 855232327 PUVZUYBBKKCYLQ-AWEZNQCLSA-N 367.471 0.121 10 10 FCCE NC[C@H]1Cc2ccccc2N(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)C1 868047904 VQXQGOJAWBWIEQ-CYBMUJFWSA-N 372.450 0.648 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C3CN(S(C)(=O)=O)C3)C2)cc1 912292905 QAHPGCGTWKISRI-ZDUSSCGKSA-N 353.444 0.282 10 10 FCCE C[C@H](NC(=O)Cn1cnnn1)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 929932835 FIYCSNASICLXKU-ZDUSSCGKSA-N 371.445 0.435 10 10 FCCE COC(=O)[C@@]1(N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)CCOC1 1331671171 PVKYGKKKTUPXBQ-GOSISDBHSA-N 364.398 0.496 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)CC(C)C)c1 1630366487 RGUCCWCHFNDNSC-RISCZKNCSA-N 365.430 0.984 10 10 FCCE CCS(=O)(=O)c1ccc(O)c(N=c2nc(N(C)C)[nH]c(N(C)C)n2)c1 1871736707 CXTUICFEBOSMOD-UHFFFAOYSA-N 366.447 0.668 10 10 FCCE CS(=O)(=O)CCNC(=O)NCc1cc(Br)ccc1O 805020447 UGFAHGSFSGCQTO-UHFFFAOYSA-N 351.222 0.999 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCn2c(O)nnc2C1 823518684 ADUDFWWULHHTFN-UHFFFAOYSA-N 372.429 0.670 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1C[C@H]2COC[C@@H](C1)O2 823530144 AHSQFZZDZKXXDT-HDICACEKSA-N 361.442 0.957 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCN(Cc4nc[nH]n4)CC3)cc2N1 845724973 QMBOTQDANYMLMT-UHFFFAOYSA-N 359.346 0.366 10 10 FCCE CNS(=O)(=O)NCC(=O)NCc1cc(C)n(-c2ccccc2)c1C 863164337 GYVUTMBUQAJCAJ-UHFFFAOYSA-N 350.444 0.764 10 10 FCCE O=C(CO)NCCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 907192967 SJIKDKABSWUQNC-UHFFFAOYSA-N 374.485 0.333 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCCN(C)C3=O)cc2)CC1 907642147 XOBYYTRPSPLKGR-GOSISDBHSA-N 372.469 0.840 10 10 FCCE O=C(NCc1c(O)ccc2c1CCCC2)NCc1nnc2n1CCNC2=O 1313216744 RXDXOOBWLTUULR-UHFFFAOYSA-N 370.413 0.605 10 10 FCCE C[C@H](NC(=O)C(=O)N1CCNC(=O)CC1)c1ccc(N2CCOCC2)cc1 1322497274 IFJJUZGLEOEOAI-AWEZNQCLSA-N 374.441 0.049 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H](O)CC(F)(F)C1 1324899459 RKAQQKQJWZXZKB-AWEZNQCLSA-N 355.385 0.906 10 10 FCCE COC1(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CS(=O)(=O)C1 1332965290 PKUQPDQVFVPLRZ-UHFFFAOYSA-N 372.418 0.092 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCc3cnn[nH]3)cc2)C1 1441942934 CSBOJBKAFPMWHW-AWEZNQCLSA-N 356.430 0.755 10 10 FCCE COCCN(C)CCN1C[C@H](NC(=O)c2ccc(C)c(O)c2O)CC1=O 1642000335 GRRPNSLPKFWILU-CYBMUJFWSA-N 365.430 0.315 10 10 FCCE COc1ccc(N2CCN(C(=O)c3cc(=O)n(C)c(=O)n3C)CC2)cc1 1889980511 AMXOUHFYWWSEAI-UHFFFAOYSA-N 358.398 0.055 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CC(=O)NCCN=[N+]=[N-])C1 2010391698 ARFQXQARQUGLSM-SNVBAGLBSA-N 361.424 0.837 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NOCCCN 2136244109 KJAFOLHJIUCXLG-LBPRGKRZSA-N 369.418 0.930 10 10 FCCE CN1C(=O)[C@@H]2ON(CC(=O)NC3CC3)[C@H](c3ccc(N(C)C)cc3)[C@H]2C1=O 248036698 JMJZZRHHCYQLKN-BRWVUGGUSA-N 372.425 0.303 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@]3(O)CCSC3)CC2)cc1 270794030 HSNOPIKXUOYIGY-SFHVURJKSA-N 365.499 0.801 10 10 FCCE O=C(CN1C[C@H](O)C2(CC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 375315771 UJOMDEHILHFDCV-KRWDZBQOSA-N 363.433 0.735 10 10 FCCE C[C@H](CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)S(N)(=O)=O 799887436 YGEVCZZUDFMHIS-LLVKDONJSA-N 374.438 0.139 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)CN3C(=O)NC(=O)C3(C)C)C2)cc1 819585037 WAIKQFCWOKLFCE-ZDUSSCGKSA-N 374.441 0.968 10 10 FCCE CCN1C[C@@H](COC(=O)c2cc(NS(C)(=O)=O)ccc2O)OC1=O 848708874 FPLKOPHPOITACW-JTQLQIEISA-N 358.372 0.761 10 10 FCCE CN1C(=O)CO[C@H](C(=O)NCCc2ccc(N)cc2)[C@H]1c1cccnc1 851631951 IEXFIGPJOJNGNH-MSOLQXFVSA-N 354.410 0.921 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N(C)CCCCO)cc2)CC1 898323517 LTWDPKDAMKPHIH-UHFFFAOYSA-N 362.474 0.286 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)c1cn(C[C@H]2CNC(=O)O2)nn1 1126082225 JQKSOCHQHJDVLB-CQSZACIVSA-N 358.402 0.691 10 10 FCCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC2(C1)NC(=O)NC2=O 1159378930 UUCQXZQXMLTWDI-UHFFFAOYSA-N 366.377 0.941 10 10 FCCE COC1CCN(c2ccc(CN3C[C@H](C(N)=O)[C@@H](C(N)=O)C3)cc2)CC1 1196091806 CGNWNZFDIARKTF-IRXDYDNUSA-N 360.458 0.320 10 10 FCCE COc1cc(C=C2C(=O)NC(=S)N(C)C2=O)ccc1O[C@H](C)C(=O)O 2297620233 BIMGELWPYHVGFE-MRVPVSSYSA-N 364.379 0.804 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CC[C@@]4(CNC(=O)C4)C3)CC2)cc1 278796617 FMAUUQNBXVLTLN-HXUWFJFHSA-N 372.469 0.556 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC(F)(F)C[C@@H]2CO)c1 781331180 MNAJLGBJJJRRJR-SECBINFHSA-N 350.343 0.606 10 10 FCCE CO[C@](C)(CO)CNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 847384341 JSDWBCZNKPLKNR-KRWDZBQOSA-N 373.400 0.998 10 10 FCCE CNC(=O)NC[C@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)CCO1 862458522 FUTVNCDTAAJAKD-HNNXBMFYSA-N 366.437 0.792 10 10 FCCE O=C([C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)N1Cc2cccc(O)c2C1 871199527 YPGDXQSTVDJQNN-STQMWFEESA-N 364.423 0.270 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)O[C@H]3CNOC3)CC2)cc1 913938711 GMLPFZCMGMDJPV-KRWDZBQOSA-N 364.446 0.837 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3[nH]nnc3C)CC2)cc1 1301571341 GXRZLXSDOHPTAE-BQYQJAHWSA-N 370.413 0.965 10 10 FCCE C[C@@H]1CCOCCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1340389468 ATLYLUSYPKRBRZ-OAHLLOKOSA-N 361.442 0.777 10 10 FCCE CN(C[C@@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1)S(C)(=O)=O 1568887816 GTCVGVOGIWOTGJ-ZDUSSCGKSA-N 356.444 0.770 10 10 FCCE CN1CCN(c2ccc(CNC(=O)c3nccnc3C(N)=O)cc2)CC1 1636779856 UQRQQCONECGXHN-UHFFFAOYSA-N 354.414 0.257 10 10 FCCE Cn1cnc(S(=O)(=O)NCC(=O)NCc2c(O)ccc3ccccc23)c1 1645441377 YUFWTPRWNBCWHN-UHFFFAOYSA-N 374.422 0.874 10 10 FCCE CC(C)(C)OC(=O)NCC(CO)(CO)NC(=O)c1cccc(O)c1O 2254525581 IYVIHBADSGJNCL-UHFFFAOYSA-N 356.375 0.076 10 10 FCCE CN1C(=O)NC(=O)C(=CN[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)C1=O 2296555008 JFBYVRPAWHIGTO-ZDUSSCGKSA-N 356.338 0.345 10 10 FCCE COc1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)c(O)c1 797389434 HVBOEOPIKKBWEL-UHFFFAOYSA-N 371.349 0.987 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](N)COC(C)C)CC2)cc1 852805558 CPGXIMFNOWMBEY-SFHVURJKSA-N 364.490 0.686 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@]3(C)CCC(=O)N3)C2)cc1 1328507683 DNLMSNZILPBLMN-DJJJIMSYSA-N 374.441 0.175 10 10 FCCE Cc1cc(C(=O)N2CC(O)(c3cnnn3C)C2)c(C)n1-c1ccccn1 1350277329 BXORFSITDQKEHG-UHFFFAOYSA-N 352.398 0.961 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1CC(C(=O)N2CCCn3ncc(N)c32)=C[C@@H]1O 2136281357 TXHKAVGTNGZUKL-STQMWFEESA-N 363.418 0.786 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCN(CCO)[C@@H](C)C3)nc12 778347769 SAWHDNLEUBBQAV-LBPRGKRZSA-N 363.418 0.110 10 10 FCCE C[C@H](O)[C@@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CCO1 817822406 DVNVDIZLWFOHRH-QWRGUYRKSA-N 359.473 0.350 10 10 FCCE COc1ccc(N2CCN(C(=O)CONC(=N)c3cn(C)nn3)CC2)cc1 842654309 RLUMXYIKRCEJMB-UHFFFAOYSA-N 373.417 0.019 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCS(=O)(=O)C3)C2)cc1 849224545 HROUIQDNYWJJGQ-OLZOCXBDSA-N 353.444 0.760 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 861796324 AOOKGHALBKWNLL-XOKHGSTOSA-N 360.458 0.647 10 10 FCCE CC(C)(CNC(N)=O)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1682986670 LQPAQZYRFFECIN-UHFFFAOYSA-N 363.462 0.894 10 10 FCCE CCOc1cccc(CNCCC(=O)N2CCN(CCO)CC2)c1O 1857864052 UDIHBYHWWKSZFX-UHFFFAOYSA-N 351.447 0.407 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc(O)nc(O)c2)[C@H](O)C1 2052705859 NDRPJWCUSXBXHM-GHMZBOCLSA-N 353.375 0.593 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)C1 2132348905 VIYPBOHQPGJEAS-GWCFXTLKSA-N 368.386 0.904 10 10 FCCE CNC(=O)[C@H](O)CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 839740057 MGOALYYLXMVBBP-GOSISDBHSA-N 372.469 0.631 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H]4OCC(=O)N[C@H]4C3)C2)cc1 852448808 NFCKYZQWKQNIMO-JQFCIGGWSA-N 374.441 0.573 10 10 FCCE N[C@@]1(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CC1(F)F 867983544 GFTUALIPKIDTLR-CQSZACIVSA-N 359.398 0.274 10 10 FCCE NS(=O)(=O)NC1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 931262927 KCYQOQGWCLJUNT-UHFFFAOYSA-N 354.476 0.281 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N3CC[C@@]4(O)C[C@H]4C3)CC2)cc1 1118503449 NJILKQAWPIEXRZ-MGPUTAFESA-N 373.453 0.717 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(C)CCC(=O)NC1 1256532824 NCKTXLALURUJLV-SGTLLEGYSA-N 364.398 0.605 10 10 FCCE CCS(=O)(=O)C[C@@H](C)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1348600549 YJDRPTCHZAYUOP-LLVKDONJSA-N 354.428 0.516 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@@H]1CC(=O)NC1=O 1446816791 QUJYRZLDKHMGLW-VIFPVBQESA-N 368.773 0.600 10 10 FCCE CN(C)S(=O)(=O)c1ccc(C(=O)NCc2c(O)cccc2O)cn1 1456238319 YUVONHJFOWFZCR-UHFFFAOYSA-N 351.384 0.673 10 10 FCCE NC(=O)C[C@H](NC(=O)Cc1cccc(F)c1)C(=O)NCc1ccccc1O 1622772876 MFYXKAMRABQAKI-HNNXBMFYSA-N 373.384 0.750 10 10 FCCE CCCCN(Cc1ccccc1O)C(=O)[C@@H](C)NC(=O)Cn1cnnn1 1634012359 MZSOOTZZODSLHK-CYBMUJFWSA-N 360.418 0.712 10 10 FCCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1[C@@H](O)[C@@H](O)CCN1C(=O)OC(C)(C)C 2064132116 HTVYWXAJSSSRAO-SRVKXCTJSA-N 357.411 0.876 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC3CCN(C)CC3)C2)cc1 826649560 AKAQUMCSDBBCLT-OAHLLOKOSA-N 360.458 0.601 10 10 FCCE CC(C)C(=O)NC1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1119001642 UNTNEHQRYBWJHW-UHFFFAOYSA-N 359.426 0.998 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCS(=O)(=O)CCO3)C2)cc1 1346435615 HPGVZWPLFBPIPP-CYBMUJFWSA-N 369.443 0.646 10 10 FCCE CN1CCN(c2ccc(CNC(=O)CC[C@H]3CC[C@@H](C(N)=O)O3)cc2)CC1 1536531153 CZQDKEKUDMKCNH-MSOLQXFVSA-N 374.485 0.868 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1cnn(C)n1 1567306547 SQWIWGSYCAXNRF-ZDUSSCGKSA-N 362.386 0.450 10 10 FCCE C[C@H](NC(=O)[C@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C)c1ccccc1O 2332888871 JSQBTKVTBHOFJU-HPEDKQMDSA-N 366.414 0.911 10 10 FCCE NS(=O)(=O)NC[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 158952325 IYHCBYPSKBBABL-INIZCTEOSA-N 368.503 0.528 10 10 FCCE CN1C[C@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCC1=O 287160518 WQTBLAKTNKQALQ-OAHLLOKOSA-N 356.426 0.416 10 10 FCCE CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NCc1ccc2cccnc2c1O 862028179 SGECFYKLWMYGAZ-OAHLLOKOSA-N 370.409 0.684 10 10 FCCE CC(C)C(=O)N1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1330399686 GAZHEFGDTXLUJJ-UHFFFAOYSA-N 359.426 0.951 10 10 FCCE CCOC(=O)[C@@]1(C)CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCO1 1332090833 OLFLULNXBPIGAX-GOSISDBHSA-N 362.382 0.415 10 10 FCCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)C[C@H](O)C1 2132404159 POOJKMPHSNUHCN-NSHDSACASA-N 368.386 0.857 10 10 FCCE COc1cc(N2CCN(c3cncc(C(N)=O)n3)CC2)cc(OC)c1OC 758933711 AIKDAGZULHVVEW-UHFFFAOYSA-N 373.413 0.928 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCNC(=O)CC3)cc2)C1 815074401 RKTWHRWMYIIOKT-HZPDHXFCSA-N 372.469 0.921 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@H](Cn2ccnn2)C1 828436560 CPMQQOUETOVSFA-OAHLLOKOSA-N 370.457 0.817 10 10 FCCE CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC(=O)NCCc1ccc(N)cc1 841897471 UKALSYVAPWGZAN-DZGCQCFKSA-N 354.476 0.828 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CN3CCCS3(=O)=O)C2)cc1 855233427 YLKVZOPEHBIXBZ-CYBMUJFWSA-N 353.444 0.426 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC(F)(F)C[C@H]1CO 1329164572 LEVLDTKCYLBUKV-HNNXBMFYSA-N 365.380 0.908 10 10 FCCE CN(C)c1ccc(CNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)cc1 1628709000 RWIXTGJPDDAVMF-BRWVUGGUSA-N 371.441 0.293 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C3(C(N)=O)CCC3)cc2)CC1 1645590715 BDAQGXIGXHLJBN-UHFFFAOYSA-N 358.442 0.660 10 10 FCCE NC(=O)CN(Cc1ccccc1)S(=O)(=O)CCOc1ccc(N)cc1 2034756265 QMIYWEHRKSWDSN-UHFFFAOYSA-N 363.439 0.965 10 10 FCCE Cc1ccc(N2C(=O)C(=CNCCN3CCNCC3)C(=O)NC2=S)cc1 2297454943 UEYCCULRKDSWSL-UHFFFAOYSA-N 373.482 0.121 10 10 FCCE C[C@@H](NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(C)(C)O 820991670 GLSWTXZXXVRJFM-CYBMUJFWSA-N 369.487 0.880 10 10 FCCE C[C@@H](O)[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCO1 823518881 DHUBCKHYUAMLPT-KDOFPFPSSA-N 363.458 0.939 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCCCNC3)C2)cc1 851687867 JZORCCTYJBBWSE-GJZGRUSLSA-N 360.458 0.648 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2CC[C@@H](C)NC2)cc1 861804847 UGSCXWLDEITLME-CABCVRRESA-N 362.474 0.847 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C[C@H]3CCNC3=O)CC2)cc1 878830810 XVTMKUUJKYXNFE-OAHLLOKOSA-N 360.458 0.460 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1n[nH]cc1F 1165915968 OAUGENADHXVYRP-UHFFFAOYSA-N 352.391 0.714 10 10 FCCE CN1C(=O)[C@@H](NC(=O)C(=O)NCCc2ccc(N)cc2)Cc2ccccc21 1261633666 LZWGVKJDDYOUJQ-INIZCTEOSA-N 366.421 0.631 10 10 FCCE CCN(CC)c1ccc(CNC(=O)c2c[nH]nc2S(N)(=O)=O)cc1F 1465003153 BAOVZSKBOGNVSO-UHFFFAOYSA-N 369.422 0.972 10 10 FCCE COC(=O)C[C@@H](N)C(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 1865968407 VEOSEAGYRGWHLQ-GDBMZVCRSA-N 359.430 0.582 10 10 FCCE COc1ccc(N2CCN(C(=O)c3cn(CCO)c(=O)cc3O)CC2)cc1 1870119854 KFNMQFPWNFKNQU-UHFFFAOYSA-N 373.409 0.517 10 10 FCCE CN(CCCn1c(=O)c2c(ncn2C)n(C)c1=O)Cc1ccccc1O 111236429 HQIQGACSYGWYJB-UHFFFAOYSA-N 357.414 0.661 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@H](Cn3ccnn3)C2)cc1 826706763 LZSHVYCENGQLNU-OAHLLOKOSA-N 356.430 0.509 10 10 FCCE CN(C)c1ccc([C@H](N)CNS(=O)(=O)CCCS(C)(=O)=O)cc1 842784697 KZIATDOKBYVNKL-CQSZACIVSA-N 363.505 0.107 10 10 FCCE NC(=O)C1CC2(C1)C[C@@H](NC(=O)c1cc(O)cs1)CCS2(=O)=O 1158182928 WZMSBNMZFYOGQU-PUUHTONNSA-N 358.441 0.395 10 10 FCCE NC(=O)C[C@H](C(=O)O)N1C(=O)C(=Cc2cccc(O)c2)SC1=S 2314541398 LDQQYGOIOHVGTF-SECBINFHSA-N 352.393 0.922 10 10 FCCE C[C@@H](O)[C@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 817811309 HJNPGGQQWRTVEV-CXAGYDPISA-N 361.442 0.293 10 10 FCCE CNC(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 817811558 LROCMKVILRMNPU-HNNXBMFYSA-N 358.442 0.280 10 10 FCCE CCn1ncnc1CNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 828813463 NRYUJRFFHPYMFP-CYBMUJFWSA-N 372.429 0.318 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CN(C)C(=O)[C@H]3C)C2)cc1 834862830 XQXCAFWSIWHSPN-ZIAGYGMSSA-N 374.441 0.284 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@H](C)NC(N)=O 847662132 WNVFBAOGCSOBEO-VIFPVBQESA-N 357.794 0.994 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3cc(OC)n(C)n3)C2)cc1 850537414 QLSUMGQAHIMJJJ-LBPRGKRZSA-N 373.413 0.771 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCNC3=O)cc2)C1 852411310 SGVBQENBHTXBOP-ZFWWWQNUSA-N 359.430 0.076 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)Cn3nc4ccccn4c3=O)C2)cc1 855231783 NXBCRPJWQNKARR-AWEZNQCLSA-N 367.409 0.900 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@@H]3CC[C@@H](C)NC3)C2)cc1 861783157 SIMVBBWTHCFGNH-BZUAXINKSA-N 374.485 0.894 10 10 FCCE COC(=O)c1cccn(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1=O 1154025154 GMQXOQPNVVUBKP-NSHDSACASA-N 360.366 0.794 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](OC)[C@@H]1CCOC1 1261737484 PPNUVLQVGIUSDM-DVOMOZLQSA-N 367.398 0.740 10 10 FCCE COC(=O)C1(O)CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 1565127114 JSQPVQSFDSWUSC-UHFFFAOYSA-N 363.414 0.077 10 10 FCCE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](CO)NC(N)=O 1622328251 RJXREBGVMTZQFC-JTQLQIEISA-N 360.208 0.532 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)[C@@H]3CCCN(C)C3)CC2)cc1 1862005571 UHNIBSRHEYQMGS-MRXNPFEDSA-N 374.485 0.802 10 10 FCCE CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC[C@@H](N=[N+]=[N-])C2)C(=O)C1 2060617985 UIRFCPAMAPFMOO-LLVKDONJSA-N 352.395 0.977 10 10 FCCE CC(C)(C)OC(=O)NCC(CO)(CO)NC(=O)COc1ccc(N)cc1 2265751180 NIQMLBFZSVDTHX-UHFFFAOYSA-N 369.418 0.012 10 10 FCCE O=C1NC(=O)N(c2ccccc2F)C(=O)C1=CNCCN1CCOCC1 2296923490 LUBHSASGXXGQIV-UHFFFAOYSA-N 362.361 0.214 10 10 FCCE Cc1ccc(O[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)C2)nn1 220328947 ICQVBMNWSBJASM-JTQLQIEISA-N 352.441 0.625 10 10 FCCE O=C1CCN(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2ccccc2N1 735800999 HTDXHPFGIDKFRL-UHFFFAOYSA-N 372.406 0.859 10 10 FCCE CN(C)S(=O)(=O)CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 752496899 ZMZFJPRTMNOALR-UHFFFAOYSA-N 373.450 0.294 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@H](C)N(C)C3CC3)C2)cc1 827891737 MPEAWUIYXNEGHJ-LSDHHAIUSA-N 374.485 0.989 10 10 FCCE C[C@@H](NC(=O)C(=O)NCCCc1ncn(C)n1)c1ccc(N(C)C)cc1 1326421968 HNOSYOJICLKONK-CYBMUJFWSA-N 358.446 0.807 10 10 FCCE COc1cccc(CNCC(CO)(CO)NC(=O)OC(C)(C)C)c1O 2258278071 VLCWQHBFFWYKQR-UHFFFAOYSA-N 356.419 0.739 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2299074792 HQMGAIIWGYZAJM-DCAQKATOSA-N 362.448 0.190 10 10 FCCE CC(=O)OC[C@@H]1O[C@@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@H]1OC(C)=O 12379893 QKGHBQJLEHAMKJ-QSLWVIQJSA-N 373.318 0.380 10 10 FCCE in-vitro COC1(CS(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)CCOCC1 905344429 ZMYFBHZSUJYZFB-MRXNPFEDSA-N 371.503 0.867 10 10 FCCE NC(=O)[C@@H]1CCCN1C1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 1182511061 VCXBTWNMRPSVFO-LBPRGKRZSA-N 351.378 0.791 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1=CCS(=O)(=O)C1 1556102040 OZOQTBYYXBALDK-LBPRGKRZSA-N 369.395 0.043 10 10 FCCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCN(c2ccc3nncn3n2)C1 1632944118 PPZXAWBWUJEPSZ-ZABGRMTBSA-N 366.381 0.944 10 10 FCCE CC(C)(C)OC(=O)NCCn1cc(C(=O)C(=O)C[C@H]2C[C@H](N)C2)nn1 2049782471 JDTOGSXPCMYICL-XYPYZODXSA-N 351.407 0.682 10 10 FCCE O=C1NC(=S)N(c2cccc(Cl)c2)C(=O)C1=CNN1CCOCC1 2296255997 HISGZVONQRJJGD-UHFFFAOYSA-N 366.830 0.808 10 10 FCCE CCCNS(=O)(=O)Nc1cc(N2CCN(C=O)CC2)ccc1OC 62275248 OTVKEXQPUGNVDX-UHFFFAOYSA-N 356.448 0.630 10 10 FCCE COc1ccc(N2CCC(NC(=O)Cn3cnc([N+](=O)[O-])n3)CC2)cc1 102382490 SWBGBJXNOZEBJD-UHFFFAOYSA-N 360.374 0.980 10 10 FCCE CN(CC1CC1)C(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 793720405 OPMDCLSSDURZKQ-INIZCTEOSA-N 372.469 0.873 10 10 FCCE CN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)CC(=O)N1CCNCC1 844217166 GHGJWDZBDHUXTR-UHFFFAOYSA-N 361.490 0.075 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)c3cnc(O)n(C)c3=O)C2)cc1 819584937 UZGZMKPBRHFNGR-GFCCVEGCSA-N 358.398 0.751 10 10 FCCE Cn1nccc1[C@H]1COCCN1C(=O)C(=O)NCCc1ccc(N)cc1 846341073 BZYLXOYKBUWKRB-MRXNPFEDSA-N 357.414 0.261 10 10 FCCE CO[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CCOC1 850601318 FKFXMTLAFMHFAY-WBVHZDCISA-N 363.458 0.879 10 10 FCCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3cc(F)cc(C(C)=O)c3O)C[C@@H]12 852593608 MERGLUYVFCXWPP-ZNMIVQPWSA-N 357.403 0.978 10 10 FCCE CCOC(=O)CN(C)C(=O)COc1ccc(N(C)C)c(C(=O)OC)c1 865396268 NPNQCRJELKOTQA-UHFFFAOYSA-N 352.387 0.940 10 10 FCCE C[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCS1(=O)=O 1118949959 DPTQKJPVNQWYNW-ZDUSSCGKSA-N 367.471 0.357 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)NCCN2C[C@@H]3CCCCN3C2=O)cc1 1327487865 XKHZBXLUJBPLNZ-INIZCTEOSA-N 373.457 0.334 10 10 FCCE O=C1N[C@@H](C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CO1 828258237 AMHKVTBHDICSIV-QGZVFWFLSA-N 358.442 0.943 10 10 FCCE NS(=O)(=O)c1ccc(NCC(=O)NCc2ccccc2O)c(F)c1 1465990784 RQWCHRCQVNASDL-UHFFFAOYSA-N 353.375 0.907 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCc2ccccc2O)[C@H](O)C1 1890526095 NWJPHBZAFHOBNB-RDTXWAMCSA-N 366.414 0.741 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCN1CCCC1=O 283081546 CKXDHDBXVQLVEV-UHFFFAOYSA-N 360.458 0.840 10 10 FCCE CC(=O)C(=O)COC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O 808497861 HFWHMHYHNRYLKA-BMLIUANNSA-N 352.387 0.825 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CCNC(=O)[C@@H]3CCCN3)C2)cc1 852844372 TWMDWKHSFCIUTG-PBHICJAKSA-N 360.458 0.648 10 10 FCCE COC(=O)[C@@H]1C[C@H](N2C(=O)CNC2=O)CN1Cc1ccc(N(C)C)cc1C 857056859 GDUOAFGBMAJGBG-HOTGVXAUSA-N 374.441 0.729 10 10 FCCE COC(=O)c1ccc(O)c([C@@H](C)NC2CN(S(=O)(=O)N(C)C)C2)c1 858570262 VMLFRFNMXRUTIO-SNVBAGLBSA-N 357.432 0.320 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H]2CC[C@H](C)NC2)cc1 861804850 UGSCXWLDEITLME-LSDHHAIUSA-N 362.474 0.847 10 10 FCCE C[C@@H](NC(=O)C(=O)N[C@H]1CCc2nnn(C)c2C1)c1ccc(N(C)C)cc1 1333428624 LMKOJMREIVLGRR-OCCSQVGLSA-N 370.457 0.732 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1 1347075120 KUCGVERVOIZENO-CJNGLKHVSA-N 353.369 0.858 10 10 FCCE COC[C@H](O)CNC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1479345068 ZFQRPPBYLZTSSO-MRXNPFEDSA-N 364.446 0.195 10 10 FCCE C[C@@H](NC(=O)CCCS(N)(=O)=O)c1ccc(N2CCOCC2)cc1 1626978418 PGKQEFBIEXBVOM-CYBMUJFWSA-N 355.460 0.769 10 10 FCCE CC(C)(C)OC(=O)NC[C@@H](O)CNS(=O)(=O)Cc1ccc(N)cc1 2011423915 AMFOWEFAZXHGHT-CYBMUJFWSA-N 359.448 0.574 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@H]1C[C@H]1N 2080880251 JESOETMRIUMSHC-WOPDTQHZSA-N 351.403 0.749 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@@H](C(=O)N3CC(N=[N+]=[N-])C3)O[C@H]2C1 2253906417 LUKAXSSCGBMNTR-SRVKXCTJSA-N 353.379 0.911 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC[C@@H](NS(C)(=O)=O)C2)c([N+](=O)[O-])c1 265329340 LQIPZTOYHBMVSY-FVOPLDGLSA-N 369.399 0.909 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)NCCc3nnnn3C)C2)cc1 823448800 FROLMBZCJHDJLW-CYBMUJFWSA-N 359.434 0.587 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(CO)on3)cc2)C1 1141996385 SSUHFKZQEWDZOH-ZDUSSCGKSA-N 358.398 0.799 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CO)Cc2cncs2)c1 1301774331 FJVZQGCWGMFYII-JTQLQIEISA-N 371.440 0.554 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCC[C@H](C)CO)C2)cc1 1328092169 JKSAHOUCTSVZFF-LSDHHAIUSA-N 363.458 0.915 10 10 FCCE O=C(N[C@@H](CO)C(=O)NCc1cc(Cl)ccc1O)c1cccc(F)n1 1628680515 LIGXRDHNEDREQS-LBPRGKRZSA-N 367.764 0.987 10 10 FCCE Cc1cc(C)c(N2C(=O)NC(=O)C(=CNN3CCOCC3)C2=O)c(C)c1 2296936503 XSIWDXBQIDNRSY-UHFFFAOYSA-N 358.398 0.915 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@H]1CS(N)(=O)=O 749305247 IEBQBSHBUNWNSM-INIZCTEOSA-N 368.503 0.464 10 10 FCCE CCCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@H](C)S(N)(=O)=O 802609790 KKTVGTWINULAQO-LBPRGKRZSA-N 371.459 0.314 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CCCOC3)C2)cc1 827312246 BZUCZQPAVOWGSC-LSDHHAIUSA-N 361.442 0.933 10 10 FCCE NCC1(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 846340281 NIVFMVSVANWYSO-UHFFFAOYSA-N 360.458 0.385 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCn4nncc4C3)CC2)cc1 847038400 XRHLQYGQXPBILB-UHFFFAOYSA-N 356.430 0.451 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CN(C)[C@@H]1CCS(=O)(=O)C1 935947628 ATGKQVIVZSPQDZ-GFCCVEGCSA-N 361.460 0.613 10 10 FCCE NC(=O)c1ncn(CC(=O)Nc2c(-c3ccccn3)nc3ccccn23)n1 1457404860 AXITZZIDJXLBKU-UHFFFAOYSA-N 362.353 0.725 10 10 FCCE CC(C)CC(=O)N[C@@H](CC(N)=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1598028882 PDAYOHPMCLHVCL-AWEZNQCLSA-N 366.437 0.914 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3C(=O)NCCN(C)C)CC2)cc1 244313665 XEWNCOHAYKZRCT-ZWKOTPCHSA-N 374.485 0.658 10 10 FCCE CC(C)(O)CN1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 327296281 XXTPXOAKLINUFL-UHFFFAOYSA-N 350.375 0.819 10 10 FCCE COc1ccc(O)c(CN2CCN(S(=O)(=O)N3CCOCC3)CC2)c1 775648364 FTOFBAIUUOPXSE-UHFFFAOYSA-N 371.459 0.095 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H]4C[C@@]4(CO)C3)CC2)cc1 782611752 DUZPFFOAGXSIMD-QRFRQXIXSA-N 361.486 0.492 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H]4C[C@]4(CO)C3)CC2)cc1 782611754 DUZPFFOAGXSIMD-XKGZKEIXSA-N 361.486 0.492 10 10 FCCE O=C(O)c1cc(NS(=O)(=O)C[C@H]2CCCS(=O)(=O)C2)ccc1O 844782943 NEBOHFZNMCCGHO-VIFPVBQESA-N 363.413 0.657 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N3C[C@@H](C)[C@H](CN)C3)CC2)cc1 868366422 YWKWAJBBVRVVCL-HZPDHXFCSA-N 374.485 0.787 10 10 FCCE C[C@@H](NC[C@H](O)CS(C)(=O)=O)c1ccc(N2CCOCC2)c(F)c1 927031394 HNBZLMJWEYTJKZ-OCCSQVGLSA-N 360.451 0.718 10 10 FCCE C[C@@H](NC(=O)C(=O)NCC[C@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 1262269792 GIZCGQKWPVERHS-KGLIPLIRSA-N 360.458 0.914 10 10 FCCE Nc1ncnc2c1ncn2C[C@@H]1CC[C@H](C(=O)NCc2ccccc2O)O1 1595793655 XTIUCSCJCXZLFI-GXTWGEPZSA-N 368.397 0.978 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCOC2CCOCC2)c1 1597210943 CMIMFQGSEUYUJP-UHFFFAOYSA-N 358.416 0.689 10 10 FCCE Cc1c(C(=O)NCc2ccc(O)cc2O)cnc2c1c(=O)n(C)c(=O)n2C 1638352440 NYBNDSSIVFLXFF-UHFFFAOYSA-N 370.365 0.282 10 10 FCCE CC[C@H](F)C(=O)N[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1O 1735949244 VRDNSZICZYLXRE-XQQFMLRXSA-N 365.365 0.899 10 10 FCCE COC(=O)/C=C/c1ccc(N2CCCN(CC(N)=O)CC2)c([N+](=O)[O-])c1 64914966 NSEKUOUHKSQOOA-GQCTYLIASA-N 362.386 0.778 10 10 FCCE CN(C)CCN(C(=O)Nc1cc(O)c(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1 217278845 OMHOBMBAYLOTFT-LLVKDONJSA-N 373.431 0.386 10 10 FCCE CC(=O)C(=O)COC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1 808501398 NZLVQOWQOICDJI-UHFFFAOYSA-N 357.359 0.925 10 10 FCCE CNC1CCN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 923288297 VAKFFECXGZJSSY-IBGZPJMESA-N 362.518 0.862 10 10 FCCE NC(=O)[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(CCOc2ccc(N)cc2)C1 2162939205 LRSMEZOOBUBZRW-CMPLNLGQSA-N 374.363 0.502 10 10 FCCE C[C@@H](COC(=O)c1cc(NS(C)(=O)=O)ccc1O)CS(C)(=O)=O 758003874 QEKQGFOHXPYBEG-VIFPVBQESA-N 365.429 0.601 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)Cn3ccnc3)C2)cc1 827190223 SGEVAKJZADHJIF-CABCVRRESA-N 371.441 0.792 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC34CC(CN3)C4)C2)cc1 851691395 NUKRBROVFCRBHR-BIWSTMPVSA-N 358.442 0.258 10 10 FCCE O=C(O)c1cnn2c(O)cc(CN3CCN(c4cnccn4)CC3)nc12 1118314855 BROMFOVAIHZKNP-UHFFFAOYSA-N 355.358 0.245 10 10 FCCE CN(C)c1ccc2nnc(CNC(=O)/C=C/c3ccc(O)c(O)c3)n2n1 1304041450 MUAOTPNNNBYNBI-XBXARRHUSA-N 354.370 0.931 10 10 FCCE CCN(OC)C(=O)CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1332211118 KRMZFRURPZPKHU-UHFFFAOYSA-N 362.430 0.211 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1nnc(N)s1 1451912540 GZSYRWANEBQAEC-UHFFFAOYSA-N 350.400 0.960 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)c3cnc(C)cn3)CC2)cc1 1862241611 GRYDZRTTZWGAOS-UHFFFAOYSA-N 369.425 0.872 10 10 FCCE COCCNC(=O)C1=C(N)Oc2c(c(C)nn2C)[C@@H]1c1ccc(O)c(O)c1 1864008290 HPUAZIXHMJKTDV-AWEZNQCLSA-N 374.397 0.597 10 10 FCCE COC(=O)[C@H](CCSC)NC=C1C(=O)NC(=S)N(CC(C)C)C1=O 2040475538 LNNASIYOVPJQAU-NSHDSACASA-N 373.500 0.654 10 10 FCCE CN1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCC1=O 284290736 UGZMPDNMJJVDLK-OAHLLOKOSA-N 358.442 0.640 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CCNC(=O)CC3)CC2)cc1 754027126 CFJUBQOXZSAOQV-QGZVFWFLSA-N 362.474 0.000 10 10 FCCE C[C@@H](CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)S(N)(=O)=O 799892757 OVDMSEONXZFTQG-QWHCGFSZSA-N 370.475 0.560 10 10 FCCE COCCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@H]1CCOC1 807103287 NJZHPAKLKKVSBB-KRWDZBQOSA-N 363.458 0.941 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C[C@H](C)NC(N)=O)CC2)cc1 847399403 CTRZDPADZPJTHE-AWEZNQCLSA-N 363.462 0.380 10 10 FCCE O=C(NCc1cc(Br)ccc1O)C1=NN2CCCN=C2N1 854442769 XBLFVGKDTOIFGD-UHFFFAOYSA-N 352.192 0.749 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc2c(c1)B(O)OC2 863885129 FEJUBGSFUPBWJR-UHFFFAOYSA-N 366.226 0.795 10 10 FCCE C[C@@H](NC(=O)[C@@H]1[C@@H](c2cnn(C)c2)N(C)C(=O)[C@@H]1O)c1ccccc1O 1632249750 ACGLBCZTWIGWJD-HMTTWLPMSA-N 358.398 0.493 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(C)C[C@@H](O)CN1C 1632356923 WKNWHVBUDITDEA-FHSNZYRGSA-N 366.414 0.143 10 10 FCCE CN(CCCN=[N+]=[N-])C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C[C@H]1O 2076820617 KDYKNJNFSFIMLV-ABAIWWIYSA-N 357.411 0.878 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC[C@@H](O)CF 2124089255 MGVDAENSEXPEMP-RYUDHWBXSA-N 372.393 0.980 10 10 FCCE CCOC(=O)CN1C(=O)/C(=C\c2cn(C)c(=O)n(C)c2=O)c2ccccc21 755607164 STCZBPMOGGTDMA-ZROIWOOFSA-N 369.377 0.534 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)OC[C@H]2CN(C3CC3)C(=O)O2)c1 845104876 OTBWNGCKZXWWMY-LLVKDONJSA-N 370.383 0.904 10 10 FCCE CC(C)(C)OC(=O)C(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 859520176 FBMGCINCTSZZMG-UHFFFAOYSA-N 373.383 0.831 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNCC[C@H](O)C(F)F)CC2)cc1 872222468 VINICKSPCUXNTA-RDJZCZTQSA-N 373.444 0.784 10 10 FCCE O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NCc1c(O)cccc1F 928704913 GEFYEJUGRFYGFH-RRCSTGOVSA-N 362.357 0.700 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC(=O)N(CC)OC 1118167760 WDGDMIMBACTICQ-UHFFFAOYSA-N 364.446 0.627 10 10 FCCE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 1297006643 XNKIOYDNIZHDAY-ZDUSSCGKSA-N 354.428 0.434 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CCC(O)(CN2CCOCC2)CC1 1446692284 JMYPIYOTJRJDCY-UHFFFAOYSA-N 350.415 0.326 10 10 FCCE C[C@@H](NC(=O)c1cc(O)nc(O)c1)C1(O)CN(C(=O)OC(C)(C)C)C1 1918772698 SYEOQBIMTDFMHQ-SECBINFHSA-N 353.375 0.593 10 10 FCCE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ccc(N)cc1 2044648040 JOLHLSUBGHQDAV-AWEZNQCLSA-N 373.475 0.916 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)[C@H](O)C1 2076819571 DFHCKJXVVDDFSS-UEKVPHQBSA-N 355.395 0.630 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@@H]1C(=O)NCc1ccccc1O 2331521560 CHYVIMHGATZSRZ-RBSFLKMASA-N 366.414 0.740 10 10 FCCE CN(CCS(C)(=O)=O)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 94298864 BPHWQBSZVVTVFT-LLVKDONJSA-N 362.249 0.882 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(C3CC3)C(=O)C2)c1 748504848 VUVIBTFOYXFHAG-UHFFFAOYSA-N 353.400 0.211 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3cnn(C)c3C)C2)cc1 828087378 JMBYBKWILMWCQN-HNNXBMFYSA-N 371.441 0.748 10 10 FCCE CO[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@@H]1CCOC1 828497565 YYGHSGAIGIJWIQ-AEFFLSMTSA-N 373.453 0.847 10 10 FCCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3cc4c(cc3O)OC[C@@H]4O)C[C@@H]12 853570335 MVKWGINYCVGHIW-YUDUHTQSSA-N 355.412 0.062 10 10 FCCE CCN1C(=O)CO[C@H](C(=O)NCc2ccccc2O)[C@H]1c1ccnn1C 866755120 HLLFEISGWPUKJJ-SJORKVTESA-N 358.398 0.731 10 10 FCCE CNC(=O)C1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCC1 1303721291 WHBCZMRMTLESGJ-UHFFFAOYSA-N 372.469 0.921 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CC(CC(N)=O)C1 1351582096 KWWMNHDSKXAOAO-UHFFFAOYSA-N 360.458 0.871 10 10 FCCE CN1CCN(c2ccc(CNC(=O)Cc3c(O)ncnc3O)cc2)CC1 1651024499 VOLMTNNEBKEUGQ-UHFFFAOYSA-N 357.414 0.499 10 10 FCCE C[C@@H](NC(=O)NCc1nc(CS(C)(=O)=O)n[nH]1)c1ccccc1O 1684363635 PZSMFNOXMWENEE-SECBINFHSA-N 353.404 0.615 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2332924059 DMJSWOAOWRRERV-FDYHWXHSSA-N 369.422 0.876 10 10 FCCE CN1C(=O)[C@@H]2[C@@H](ON(CC(=O)NC3CC3)[C@H]2c2ccc(N(C)C)cc2)C1=O 248036707 JMJZZRHHCYQLKN-YESZJQIVSA-N 372.425 0.303 10 10 FCCE CN(C)c1ccc(CNC(=O)Cn2cc(CN3CCC(N)CC3)nn2)cc1 905789590 VIWQCAVRNMOEHA-UHFFFAOYSA-N 371.489 0.584 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)/C=C/Cn3cncn3)cc2)CC1 907639470 IQQMCVOARAIFBD-NSCUHMNNSA-N 368.441 0.819 10 10 FCCE COC(=O)/C=C/c1ccc(N(C)CCNS(C)(=O)=O)c([N+](=O)[O-])c1 1318516024 WZJYURQAKNXMQW-FNORWQNLSA-N 357.388 0.766 10 10 FCCE C[C@@H]1CN(C2CCOCC2)CCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1329810362 JVIUNCMADXYJHJ-CQSZACIVSA-N 373.453 0.946 10 10 FCCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1[C@H](O)[C@@H](O)CCN1C(=O)OC(C)(C)C 2064132115 HTVYWXAJSSSRAO-SDDRHHMPSA-N 357.411 0.876 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2081034341 GSCOCHAZQVWQAC-AXFHLTTASA-N 355.395 0.534 10 10 FCCE NS(=O)(=O)c1ccc(CCNC(=O)Cc2ccc(O)c(O)c2)cc1 243341716 LTGKOYQTCYKMMC-UHFFFAOYSA-N 350.396 0.647 10 10 FCCE NC(=O)CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 746155700 OLSGOAHTCHUFNK-UHFFFAOYSA-N 372.404 0.434 10 10 FCCE COc1ccnc(N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)n1 768444297 XEYPFOJAKQUQRP-HNNXBMFYSA-N 358.398 0.939 10 10 FCCE COc1ccc(N2CC[C@@H](NS(=O)(=O)[C@@H](C)C(=O)N(C)C)C2)cc1 849416223 MQQMXUUAHHCHAA-QWHCGFSZSA-N 355.460 0.670 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1CCNC1=O 852379290 NFRUFMVLXZJYTK-ZDUSSCGKSA-N 354.357 0.489 10 10 FCCE CCN1CCN(CC(=O)NCc2ccc3cccnc3c2O)C(=O)C1=O 862029309 VBNIOMPIMCFDPC-UHFFFAOYSA-N 356.382 0.247 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)CCc3nn[nH]n3)CC2)cc1 865034264 PJDSZWCNIVSEOQ-UHFFFAOYSA-N 359.434 0.079 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(N)n(C)n3)cc2)CC1 884334025 DZQPGWGCOHBJHR-UHFFFAOYSA-N 356.430 0.601 10 10 FCCE CCN(CC)c1ccc(CNC(=O)[C@@H](C)NC(=O)Cn2cnnn2)cc1 1596577912 DGXCDRKEYXMCCP-CYBMUJFWSA-N 359.434 0.340 10 10 FCCE C[C@H](NC(=O)C1=NN(CCO)C(=O)CC1)c1ccc(N2CCOCC2)cc1 1625882078 CJHINDXUAGINGM-AWEZNQCLSA-N 374.441 0.671 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2311715423 VKCGAKBRQJXPTA-IRCOFANPSA-N 355.395 0.629 10 10 FCCE CN1CCO[C@H](CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 104799445 JQKLSEGUTLEKAV-GOSISDBHSA-N 362.474 0.995 10 10 FCCE C[C@@H](CO)[C@@H](C)NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 295686972 HVLJUDCNHBUTHB-UONOGXRCSA-N 353.438 0.885 10 10 FCCE COc1ccc(N2CC[C@H](NC(=S)NCCNS(C)(=O)=O)C2)cc1 849270308 BERSVHYBHBMABJ-LBPRGKRZSA-N 372.516 0.287 10 10 FCCE O=C(CNS(=O)(=O)c1cccnc1)NCc1ccc2cccnc2c1O 1162612078 BRVSAJQIYMPHOF-UHFFFAOYSA-N 372.406 0.930 10 10 FCCE COc1cccc(O)c1CNC[C@@H]1[C@@H](O)[C@H](O)CN1C(=O)OC(C)(C)C 2225658228 JYBJMBLTZQCWHQ-XNRPHZJLSA-N 368.430 0.832 10 10 FCCE C[C@H](O)[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 817811738 PNYRGDRHJPCKHI-XHDPSFHLSA-N 353.394 0.116 10 10 FCCE CS(=O)(=O)N1CC[C@@H](CS(=O)(=O)N2Cc3cccc(O)c3C2)C1 867690778 MTVJVCNYWHXERC-LLVKDONJSA-N 360.457 0.319 10 10 FCCE COC(=O)c1c(CNC[C@@H](O)Cn2ccnn2)c2cc(F)ccc2n1C 894984174 IZDIXRIHUNEYRU-GFCCVEGCSA-N 361.377 0.846 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CC(=O)N(CC3CC3)C2)cc1 897361794 RNPCXBGPFQDWHK-HNNXBMFYSA-N 358.442 0.496 10 10 FCCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)cc1C 1268314663 OHMVSTFBIRULQI-OMWFQVSUSA-N 360.454 0.994 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3nc(C)no3)C2)cc1 1330370831 ADWPBAAZWXBPKW-GFCCVEGCSA-N 359.386 0.398 10 10 FCCE C[C@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1335574400 YGHFPLWASHBDDI-GHMZBOCLSA-N 354.428 0.514 10 10 FCCE COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)Cc1ccc(O)c(O)c1 1446957640 FPOSEPBHGOUZDO-LBPRGKRZSA-N 352.387 0.460 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC[C@@H]1C[C@@H]1N 2136245313 SVKDOVYCQHODDY-AVGNSLFASA-N 365.430 0.997 10 10 FCCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NN2CC(=O)NC2=O)C1 767632261 WUDPQQSECURCQF-UHFFFAOYSA-N 369.425 0.991 10 10 FCCE CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NC1CNC1 842234359 FDLVACLHFMKGQC-UHFFFAOYSA-N 356.220 0.591 10 10 FCCE OCC1CCN(c2ccc(CNC[C@H](O)CN3CCOCC3)cc2)CC1 843063384 ALYNYMPJSUVXTF-FQEVSTJZSA-N 363.502 0.678 10 10 FCCE CC1(C)C(=O)NC(=O)N1CC(=O)NCc1ccc(N2CCC(O)CC2)cc1 856211583 VXRPSVWWNSXFQK-UHFFFAOYSA-N 374.441 0.594 10 10 FCCE C[C@@H]1OC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 871780443 OIKGDRLQPRNBAA-NSHDSACASA-N 365.361 0.646 10 10 FCCE CN(C)C(=O)C1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 899471864 BTWOUHIAJZYFHL-UHFFFAOYSA-N 372.469 0.873 10 10 FCCE C[C@H]1CCN1C(=O)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1334705231 GEASNWINYWVTLV-ZDUSSCGKSA-N 358.442 0.625 10 10 FCCE COc1cccc(N2C(=O)C(=CNN3CCOCC3)C(=O)NC2=S)c1 2296233740 NANGJMJWKSJIBF-UHFFFAOYSA-N 362.411 0.164 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H]3C[C@@H]3C(=O)NCCN(C)C)CC2)cc1 244313664 XEWNCOHAYKZRCT-ROUUACIJSA-N 374.485 0.658 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCCN2CCOCC2)c1 299114464 ZMZQJQJYSURTQN-UHFFFAOYSA-N 371.459 0.606 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCN([C@H]4CCC[C@@H]4O)CC3)cc2N1 378157451 HFINEUCJQRZSJN-WFASDCNBSA-N 362.386 0.961 10 10 FCCE CCN(Cc1cn(C)nn1)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 803662674 FSSGWUHQRUECQG-UHFFFAOYSA-N 362.409 0.685 10 10 FCCE COC[C@@H](NC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)C1CC1 828579743 WBXDLXKSKDHVRZ-RHSMWYFYSA-N 361.442 0.931 10 10 FCCE O=C1CN(Cc2ccccc2O)C(=O)N1C[C@@]12COCCN1C(=O)OC2 865322634 WWIYXPAXJQQUCN-KRWDZBQOSA-N 361.354 0.378 10 10 FCCE CO[C@@]1(CNCc2ccc(N3CCOCC3)cc2)CCS(=O)(=O)C1 922615968 PVOXYOTYVLULRN-QGZVFWFLSA-N 354.472 0.817 10 10 FCCE COc1ccc(CNCCCN(C)C(=O)[C@H]2CC[C@@H](C(N)=O)O2)cc1C 1268847942 PEJZOEJQUVQBSD-DLBZAZTESA-N 363.458 0.975 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC[C@@H]1CC(=O)N(C)C1 1335760034 PWKUFYHIJJZJNS-CQSZACIVSA-N 360.458 0.662 10 10 FCCE COc1ccc(N2CCN(C(=O)C3CCN(CC(N)=O)CC3)CC2)cc1 9066283 AVWBSNTXGRFKND-UHFFFAOYSA-N 360.458 0.541 10 10 FCCE C=CC(=O)NCCC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 746146865 ASNDCJAEVPISBP-UHFFFAOYSA-N 360.458 0.626 10 10 FCCE COc1cccc(CNC(=O)NCCCN2CCC[C@H]2C(N)=O)c1O 1674395254 MTWFVLGIRGFRKP-ZDUSSCGKSA-N 350.419 0.540 10 10 FCCE C[C@]1(NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCNC1=O 1687631717 AXPPGLQMWAEOPB-IBGZPJMESA-N 373.457 0.466 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CC(CO)C1 2124089588 SQTPQZADSYZCME-ZDUSSCGKSA-N 366.414 0.984 10 10 FCCE COc1cncc(O[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C2)n1 220109593 ZPRHSFYOGIWGJA-SECBINFHSA-N 368.440 0.325 10 10 FCCE NC(=O)c1cc(O[C@@H]2CCCN(C(=O)c3cc(O)nc(O)c3)C2)ccn1 585338447 YYBZXOHAHZBNTP-GFCCVEGCSA-N 358.354 0.670 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)c3cnc(O)n(C)c3=O)C2)cc1 819584938 UZGZMKPBRHFNGR-LBPRGKRZSA-N 358.398 0.751 10 10 FCCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3ccc(N4CCOCC4)cc3)C[C@@H]12 827388047 ACFJJASROBUYHX-KSZLIROESA-N 366.483 0.767 10 10 FCCE COc1ccc(N(C)CCN(C)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](O4)[C@@H]3C2=O)cc1 844725944 RBDOULGUECXIRG-BDXSIMOUSA-N 371.437 0.959 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@](C)(COC)C3)nc12 860202860 RRODEDLDELXWKR-QGZVFWFLSA-N 364.402 0.849 10 10 FCCE O=C1NC(=S)N(c2ccccc2)C(=O)C1=CNCCN1CCOCC1 2296125552 HAMFDWAAEAAOPC-UHFFFAOYSA-N 360.439 0.240 10 10 FCCE O=C(NC1CCN(C(=O)[C@H]2CCCO2)CC1)c1cc(O)c(O)c(O)c1 169859760 MSBWLPGFBJJYRO-CQSZACIVSA-N 350.371 0.703 10 10 FCCE Cn1nnc(Br)c1S(=O)(=O)NCCc1ccc(N)cc1 236090554 LLHDMIWCJMZZSH-UHFFFAOYSA-N 360.237 0.681 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCNC[C@@](C)(F)C3)CC2)cc1 844225346 OAXPLPAGTNVUMU-LJQANCHMSA-N 364.465 0.977 10 10 FCCE O=S(=O)(C[C@H]1CNCCO1)NCc1ccc(N2CCSCC2)cc1 866745517 GUWAKOVMVHUBFE-MRXNPFEDSA-N 371.528 0.648 10 10 FCCE Cn1nnc(CNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)n1 1227619908 XDKKZMRFZYAYIR-UHFFFAOYSA-N 367.360 0.324 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H](NS(C)(=O)=O)C(C)C)CC2)cc1 1526037688 ZVMBHOSSSAEMSI-INIZCTEOSA-N 369.487 0.918 10 10 FCCE CC(=O)N1CCN(C(=O)CCNC(=O)N[C@H](C)c2ccccc2O)CC1 1677881202 IXANTNWEHZBXAB-CYBMUJFWSA-N 362.430 0.833 10 10 FCCE O=C(C[C@H]1NC(=O)c2ccccc2NC1=O)NCCc1ccc(O)c(O)c1 1860168349 VZGLFMIILUSNFO-CQSZACIVSA-N 369.377 0.897 10 10 FCCE CC(C)(C)OC(=O)NCC1(NC(=O)c2cc(O)c(O)c(O)c2)COC1 2068625519 YVZSZLUPFBMPBY-UHFFFAOYSA-N 354.359 0.827 10 10 FCCE COC(=O)C1=C[C@H](N=[N+]=[N-])[C@@H](NC(C)=O)[C@H]([C@H](OC)[C@H]2COC(=O)O2)O1 96031173 DMLIIKCIUVVBPP-FRNCOOQWSA-N 370.318 0.176 10 10 FCCE in-vitro COCCN(C(=O)[C@@H](C)Cc1ccc(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1 170245309 JANDYCMJYDNOOH-GXTWGEPZSA-N 371.455 0.939 10 10 FCCE O=C(O)CNC(=O)CN1C(=O)/C(=C\c2cccc(O)c2)SC1=S 210680932 CACMWGFNTMYQSX-BJMVGYQFSA-N 352.393 0.794 10 10 FCCE CCS(=O)(=O)C[C@H](C)N(C)Cc1cc(O)n2ncc(C(=O)O)c2n1 737886563 GVFLZEMWNHKWNO-VIFPVBQESA-N 356.404 0.388 10 10 FCCE NCCCNC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 842216246 GTKHPGPUIBTUHR-GFCCVEGCSA-N 370.400 0.838 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H]3CCN(C)S3(=O)=O)CC2)cc1F 843819305 UYICJWFYVFDURU-OAHLLOKOSA-N 371.434 0.517 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H](C)[C@@H]3CCC(=O)N3)CC2)cc1 858839435 DTTDGBSYHRXFCH-QAPCUYQASA-N 374.485 0.848 10 10 FCCE CC(C)(C)OC(=O)N1CC(NC(=O)c2ccc(O)c(O)c2)(C(N)=O)C1 2054399138 LCXSMRWJQWECAF-UHFFFAOYSA-N 351.359 0.302 10 10 FCCE O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)C1=CNN1CCOCC1 2296082826 WHLGURYXAKYSCW-UHFFFAOYSA-N 350.762 0.644 10 10 FCCE CS(=O)(=O)NC[C@H]1CCC[C@H]1NC(=O)NCCc1ccc(N)cc1 841897473 UKALSYVAPWGZAN-UKRRQHHQSA-N 354.476 0.828 10 10 FCCE NS(=O)(=O)c1ccc(/C=C2\SC(N3CCOCC3)=NC2=O)c(F)c1 843270412 YXRQEPXUDHZLSG-GHXNOFRVSA-N 371.415 0.776 10 10 FCCE COc1ccc(N2CC[C@H](N3C(=O)N[C@H](CC4OCCO4)C3=O)C2)cc1 924980972 XADALRBYOFQSJN-DZGCQCFKSA-N 361.398 0.957 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1 1143202530 IJSRXZRTQSQKDE-OAHLLOKOSA-N 366.399 0.879 10 10 FCCE Cc1nc(S(=O)(=O)NCCC(=O)NCc2c(O)cccc2O)cn1C 1156881008 LNOGVKQHSINGQL-UHFFFAOYSA-N 368.415 0.125 10 10 FCCE Cc1nnc(N2CCNC(=O)C2)n1Cc1ccc(N2CCOCC2)cc1 1304859092 AZPDIOBJAYSVBR-UHFFFAOYSA-N 356.430 0.408 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@@H]1CCc2nnn(C)c2C1)c1ccc(N(C)C)cc1 1333428595 LMKOJMREIVLGRR-GXTWGEPZSA-N 370.457 0.732 10 10 FCCE C[C@@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1338556652 POAINWLGLYXYAQ-CRAIPNDOSA-N 374.485 0.596 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H]3CCNC(=O)[C@H]32)c1 1455184305 HXYDTHRKGZZSKN-YGRLFVJLSA-N 367.427 0.504 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccnc(CO)c1 1633473165 KRKRZPDMYFAZCU-AWEZNQCLSA-N 360.366 0.889 10 10 FCCE CC(C)(C)OC(=O)NCC(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)O 2059475803 SQRDBJKNBYWNKZ-SNVBAGLBSA-N 354.359 0.734 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2081034543 HFWNOOKCTHKEAI-YFKTTZPYSA-N 355.395 0.486 10 10 FCCE CC(C)(C)OC(=O)NOCC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O 2123829042 VBWZBYMNWXUNSR-JTQLQIEISA-N 370.358 0.666 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)OCCC2CS(=O)(=O)C2)c1 790641802 JQOVVZVUGPEUMY-UHFFFAOYSA-N 363.413 0.355 10 10 FCCE C[C@H](N)[C@H](C)NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 851669696 ZZSUBGNGLJHQQK-STQMWFEESA-N 354.476 0.456 10 10 FCCE CCN1OC[C@@H](N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1=O 851936636 SJIJUPQKAXEXIW-CQSZACIVSA-N 365.430 0.997 10 10 FCCE O=C1COC[C@]2(CNCc3c(O)cccc3Br)COCCN12 865796251 YZBFVGLGBBVALI-HNNXBMFYSA-N 371.231 0.872 10 10 FCCE CN1CCN(c2ccc(CNC(=O)N[C@H](CO)[C@@H]3CCOC3)cc2)CC1 1479185775 UACPHOXQVMNQCO-SJLPKXTDSA-N 362.474 0.635 10 10 FCCE CC(C)(C)OC(=O)NC1(C(N)=O)CN(C(=O)COc2ccc(N)cc2)C1 2109488601 BWSHICMDKISSQN-UHFFFAOYSA-N 364.402 0.239 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNCc1cccc(O)c1O 2312325100 QQVMRAGTUDIIKE-KYOSRNDESA-N 354.403 0.529 10 10 FCCE COc1ccc(N2CCN(C(=O)CC(=O)NCCCN(C)C)CC2)cc1 243254640 KRSHAZSOAHKRLV-UHFFFAOYSA-N 362.474 0.802 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNC(=O)c2cc(O)nc(O)c2)C1 702776978 VJCPBFHTNCLOSE-WDEREUQCSA-N 353.375 0.450 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCO[C@@H]([C@@H](C)O)C3)CC2)cc1 839671485 BDSOXOAKRPHJDC-CRAIPNDOSA-N 363.458 0.425 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@H]1CNCC[C@@H]1C)c1ccc(N2CCOCC2)cc1 842123537 OTAVBHNCLABRAB-MPGHIAIKSA-N 374.485 0.815 10 10 FCCE Nc1ccc(CCNC(=O)N[C@@H]2CCN(c3ccc4nncn4n3)C2)cc1 861640661 NQOPOGIPJKLXQK-OAHLLOKOSA-N 366.429 0.827 10 10 FCCE CN1CC[C@@](C)(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1=O 924252681 MFOWMCSKZRFXKF-FQEVSTJZSA-N 372.469 0.873 10 10 FCCE CN1C[C@H](CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1=O 929524140 POEXNQMNSJOLRR-MRXNPFEDSA-N 372.469 0.888 10 10 FCCE C[C@H](C(=O)NCc1ccc(O)cc1O)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1142533659 PHHOVOIGXQAPDJ-FYIZZCSQSA-N 360.366 0.265 10 10 FCCE O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NCc1cc(O)ccc1O 1153886184 ZMYMLUQFJWIVQG-VDERGJSUSA-N 360.366 0.267 10 10 FCCE Cn1c(-c2sc3ncccc3c2O)nnc1N1CCO[C@@H](C(N)=O)C1 1263606541 SCVNGHYSQRHWIX-SECBINFHSA-N 360.399 0.488 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCNC(=O)CC3)cc2)CC1 1313304647 JUKILVDCFBXOOJ-UHFFFAOYSA-N 373.457 0.420 10 10 FCCE COC(=O)/C=C\c1ccc(N2CCC[C@@]3(C2)NC(=O)NC3=O)c([N+](=O)[O-])c1 1772974743 WXOCFQSTQTTZFX-AATOQMJSSA-N 374.353 0.959 10 10 FCCE CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)N1CC(N=[N+]=[N-])C1 2010393629 VEIVZZZWVWZBMT-SNVBAGLBSA-N 361.424 0.836 10 10 FCCE CN(C(=O)C1=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1cccn(C)c1=O 2224794924 TYTNPTSRSDLQTA-JSGCOSHPSA-N 363.414 0.932 10 10 FCCE NS(=O)(=O)N1CCC(NCc2ccc(Br)cc2O)CC1 698654938 QPHPTQCGTOBZTM-UHFFFAOYSA-N 364.265 0.912 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3CCN(C4CC4)CC3)CC2)cc1 754020124 POTFAMGVXNIFIO-FQEVSTJZSA-N 374.529 0.958 10 10 FCCE O=C(NCc1cc(Br)ccc1O)C1=NN(CCO)C(=O)CC1 804734355 BKGQXFSBCPLRLZ-UHFFFAOYSA-N 370.203 0.742 10 10 FCCE CN1CC[C@@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)S1(=O)=O 843836743 XLIKLMUVACXEQR-ZBFHGGJFSA-N 368.455 0.934 10 10 FCCE O=C(CC[C@H]1NC(=O)NC1=O)NCc1cc(Br)ccc1O 854442032 DWLAKXQRNBJQAS-SECBINFHSA-N 356.176 0.759 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCCN3S(C)(=O)=O)C2)cc1 855230396 CWUJBVKNEQRSFS-CJNGLKHVSA-N 367.471 0.814 10 10 FCCE CC(=O)N1CCO[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 1332963227 CLLXLDFBWNXBAN-KRWDZBQOSA-N 365.405 0.526 10 10 FCCE CCN1CC[C@H](NC(=O)C(=O)NCCCSc2nccs2)C1=O 1336125861 QOEKNYRLGCQAMT-JTQLQIEISA-N 356.473 0.479 10 10 FCCE CCN(C)S(=O)(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 266746714 BBVMAZHEIQBNQF-UHFFFAOYSA-N 356.492 0.603 10 10 FCCE O=C(CN1CCN(Cc2cc3c(cc2O)OCO3)CC1)N1CCOCC1 298890766 QEBIZFHPMXSWQQ-UHFFFAOYSA-N 363.414 0.097 10 10 FCCE Cn1nc(N2CCCC[C@H]2CNC(=O)c2cc(O)nc(O)c2)ccc1=O 585608706 HMNIZPQPGVYAPD-LBPRGKRZSA-N 359.386 0.375 10 10 FCCE C[C@@H](CO)N(C)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789854827 MOOPMONZQIPKGI-ZDUSSCGKSA-N 351.472 0.695 10 10 FCCE Cn1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n1 805700327 BBIWMSZJDQHCSE-MRXNPFEDSA-N 372.425 0.950 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 808516042 WOYWGBVCOJENDK-HNNXBMFYSA-N 367.423 0.930 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(C)CCN(C)C3=O)cc2)CC1 822321223 YAXFSWYDUSQSDH-HXUWFJFHSA-N 372.469 0.840 10 10 FCCE Cn1cc([C@H](O)C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cn1 1455868445 TYCMVTALPRBPTO-KRWDZBQOSA-N 371.441 0.472 10 10 FCCE CC(C)(C)OC(=O)NC1CC(O)(CNC(=O)c2cc(O)nc(O)c2)C1 2045136024 MODJLEFORIIWTM-UHFFFAOYSA-N 353.375 0.641 10 10 FCCE C[C@H](NC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C)C(N)=O 2123503962 JOODWUZSOKIGFO-ONGXEEELSA-N 367.402 0.524 10 10 FCCE COc1cc(OC)c([N+](=O)[O-])cc1C=C1C(=O)NC(=S)N(C)C1=O 2297454112 OTEJAPJLPDKAQT-UHFFFAOYSA-N 351.340 0.869 10 10 FCCE Cc1cccc(CN2CCN(S(=O)(=O)N3CCOCC3)CC2)c1O 775649455 RSURPMZFZLGPJG-UHFFFAOYSA-N 355.460 0.395 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1CCN(C2CC2)C(=O)C1 806276844 LQWBKHUYQCFKQC-UHFFFAOYSA-N 368.484 0.575 10 10 FCCE O=C(c1c(F)ccc(O)c1O)N1CC(S(=O)(=O)NC2CCCC2)C1 828158057 AGBCNDQWHVUZNA-UHFFFAOYSA-N 358.391 0.923 10 10 FCCE NC(=O)c1cn(C2CN(Cc3cccc(Br)c3O)C2)nn1 839143708 PHPGMIJTWAMXMA-UHFFFAOYSA-N 352.192 0.902 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N[C@H]1CCCOC1 852127128 MSWRMUFFCLRINY-HNNXBMFYSA-N 367.471 0.900 10 10 FCCE O=C(N[C@H]1CCN(c2ccc3nncn3n2)C1)c1c(F)ccc(O)c1O 863937675 DUDWYIIBVKITAE-VIFPVBQESA-N 358.333 0.683 10 10 FCCE COc1ccc(N2CCN(S(=O)(=O)CCNC(=O)CCF)CC2)cc1 912410742 HOVIOIPHUXQBRJ-UHFFFAOYSA-N 373.450 0.623 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCOC[C@@H]3C)C2)cc1 1118632500 DRJZVLDNVICODT-GRDNDAEWSA-N 361.442 0.931 10 10 FCCE COCCCN(C(=O)Cc1ccc(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1 1626881557 CYLJKIJDHQDYEQ-CYBMUJFWSA-N 357.428 0.693 10 10 FCCE Cn1ncc(CNC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)n1 1672943128 KUSPFEZYROAHCZ-UHFFFAOYSA-N 371.445 0.516 10 10 FCCE CNC(=O)CN(Cc1ccccc1)C(=O)[C@@H](N)Cc1ccc(O)c(O)c1 2095916697 ROSMBVRCHCJMHG-HNNXBMFYSA-N 357.410 0.742 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCO[C@@H](Cn3cccn3)C2)cc1 106192221 YBWMYQGQZGXDPV-GOSISDBHSA-N 357.458 0.966 10 10 FCCE Cc1cc(=O)oc2cc(O[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3N=[N+]=[N-])ccc12 575417073 JZSHWIUBDQNWDV-VMMWWAARSA-N 363.326 0.598 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN(CC)Cc3cn(C)nn3)nc12 782100560 SVCHTLAEBHSQCF-UHFFFAOYSA-N 359.390 0.762 10 10 FCCE CC(=O)N1CCO[C@H](C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 829295925 BRWOEVGMDZUVNG-SFHVURJKSA-N 360.458 0.302 10 10 FCCE COc1ccc(N2CCN(C(=O)N[C@H]3C[C@@H](C(N)=O)C3)CC2)cc1F 845445716 DHBOJAIKXJCWTP-TXEJJXNPSA-N 350.394 0.930 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)C(=O)N(C)OC)C2)cc1 858599846 QTRSJFQZKIRXHT-CHWSQXEVSA-N 350.419 0.981 10 10 FCCE Cn1c(=O)c2c(ncn2Cc2ccc(N3CCOCC3)cc2)n(C)c1=O 877888457 XDRYAKPFLAPZBM-UHFFFAOYSA-N 355.398 0.319 10 10 FCCE O=C(C(=O)N1CCn2c(CC3CC3)nnc2C1)N1Cc2cccc(O)c2C1 1351917212 AAANZIXRYZXCGY-UHFFFAOYSA-N 367.409 0.821 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)/C=C\C(=O)N(C)C)CC2)cc1 1463773570 JAYNDQNETZMXDU-KTKRTIGZSA-N 374.485 0.968 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)CCn3ccnn3)cc2)CC1 1598010459 YZIBIPWPBLNEGF-UHFFFAOYSA-N 356.430 0.686 10 10 FCCE COCCOCC(=O)NC1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169875417 FWMSTOONMSUJQR-UHFFFAOYSA-N 368.386 0.187 10 10 FCCE COc1ccc(N2CCN(C(=O)CONC(=N)Cn3cccn3)CC2)cc1 733791485 NBGIEEVHFIEZLR-UHFFFAOYSA-N 372.429 0.739 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCCC1(CN)CC1 846349367 WQAKCUHFMBAEDT-UHFFFAOYSA-N 374.485 0.727 10 10 FCCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN2C[C@H](O)C[C@H]2C1 848932062 SUHQXXHDAGYBMU-ZWKOTPCHSA-N 372.469 0.180 10 10 FCCE CN(C)c1ccc(CN(C(=O)C(=O)N2C[C@H]3COC[C@@H](C2)O3)C2CC2)cc1 1261307962 VEQSHERIVKUJSY-HDICACEKSA-N 373.453 0.870 10 10 FCCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(O)CCS(=O)(=O)C1 1290719225 NOYJTLKZYOLORN-MRXNPFEDSA-N 366.443 0.478 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@H]1C(=O)NCc1ccccc1O 2127618661 CHYVIMHGATZSRZ-KKUMJFAQSA-N 366.414 0.740 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCC[C@H](C(N)=O)C2)c1 746885218 CXUOAQOSBYDRPD-VHSXEESVSA-N 355.416 0.538 10 10 FCCE CCn1nccc1CN(CCO)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785422547 MJTWXEDARQZTIR-UHFFFAOYSA-N 373.457 0.606 10 10 FCCE C[C@@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)C[C@H]1CS(N)(=O)=O 933698832 DURMODSXWSENHH-HIFRSBDPSA-N 368.503 0.225 10 10 FCCE CCN1C(=O)CO[C@H](C(=O)NCc2c(O)cccc2O)[C@H]1c1ccnn1C 1304053878 UWEMJVUVQIKZTP-SJORKVTESA-N 374.397 0.436 10 10 FCCE CS(=O)(=O)c1ccccc1C(=O)N1CCS(=O)(=O)[C@H]2COCC[C@H]21 1556959922 IZEZAMJYHGVHBB-OCCSQVGLSA-N 373.452 0.118 10 10 FCCE NC(=O)C[C@@H](NC(=O)Cc1cccc(F)c1)C(=O)NCc1ccccc1O 1622772877 MFYXKAMRABQAKI-OAHLLOKOSA-N 373.384 0.750 10 10 FCCE O=C(NCc1c(O)cccc1F)C1CCN(c2ccc3nnnn3n2)CC1 1645048134 HUTNYHHIQTZKGY-UHFFFAOYSA-N 371.376 0.897 10 10 FCCE Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3N=[N+]=[N-])ccc12 504739600 JZSHWIUBDQNWDV-NZBFACKJSA-N 363.326 0.598 10 10 FCCE in-vitro CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@H]3CC(N)=O)nc12 726969500 WTJBSZMBDSZFDY-LBPRGKRZSA-N 361.402 0.842 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(C)CNCCO3)cc2)CC1 876910416 ZIMPGPSYXFQIPU-LJQANCHMSA-N 360.458 0.350 10 10 FCCE CCON(C)C(=O)CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1261537194 JTZVUYSBKQQDPB-LBPRGKRZSA-N 350.419 0.456 10 10 FCCE CN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@@H]1CCN(S(C)(=O)=O)C1 1450110191 GRPVLUXGHGKSLP-GFCCVEGCSA-N 353.404 0.955 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1cnc2c(cnn2C)c1=O 773744804 WMPMRMWTFHMDSW-SNVBAGLBSA-N 357.370 0.289 10 10 FCCE CCN1CN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1=O 792484146 YAKJFZGYDLEDGB-KRWDZBQOSA-N 362.474 0.300 10 10 FCCE CCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)OCC(=O)C(C)=O 808498772 VHEWDAYSWSQWOJ-GOSISDBHSA-N 358.350 0.687 10 10 FCCE CC(=O)C(=O)COC(=O)CNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C 808537537 ZUNIARDXQBLMHD-NSHDSACASA-N 356.375 0.203 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCC(=O)NCC(F)F)C2)cc1 852452407 XAWCVMSGZFFVMM-NSHDSACASA-N 356.373 0.954 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CC(S(C)(=O)=O)C3)C2)cc1 854298170 XLTUZLVKLDVBAE-GFCCVEGCSA-N 353.444 0.712 10 10 FCCE COC(=O)[C@@]1(OC)CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 859560123 DSYGUBUJHXMWFT-LJQANCHMSA-N 363.458 0.975 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)NC(=O)Cn1cnnn1 930905569 JKLROIMFDOYMJP-CYBMUJFWSA-N 359.434 0.293 10 10 FCCE CN1CCN(C[C@H](O)CNCc2ccc(N3CCC(O)CC3)cc2)CC1 1328488242 UACITKGDAFAQCL-HXUWFJFHSA-N 362.518 0.346 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)/C=C\C(=O)N(C)C)CC2)cc1 1583758188 IIUZIGDHARMATJ-HJWRWDBZSA-N 360.458 0.578 10 10 FCCE CON(CCN)C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2136254625 YVUWUNRTKGNELK-LBPRGKRZSA-N 369.418 0.882 10 10 FCCE O=C(O)[C@H]1CN(Cc2c(O)cccc2Br)CCS1(=O)=O 2197715381 QTZFLJFVGDKLDX-LLVKDONJSA-N 364.217 0.838 10 10 FCCE O=C1NC(=S)N(c2ccccc2Cl)C(=O)C1=CNN1CCOCC1 2296079776 WOSKMUSIIJDPIG-UHFFFAOYSA-N 366.830 0.808 10 10 FCCE CC[C@@H](CO)N1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 270783611 SYXIAFWEXHZHCY-ZDUSSCGKSA-N 371.459 0.292 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNCc3ccnn3C)CC2)cc1 818952506 NZFWBTUHRCBBES-SFHVURJKSA-N 359.474 0.701 10 10 FCCE COc1cc(O)c(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1OC 842633440 RKYAGUNCSZKPCU-MRXNPFEDSA-N 357.428 0.799 10 10 FCCE CN(CCCNC(=O)CN1CCCc2cc(CN)ccc21)S(C)(=O)=O 843349996 HNIRJRNMJOIPMZ-UHFFFAOYSA-N 368.503 0.296 10 10 FCCE CO[C@H](C)c1noc(CN(C)Cc2cc(O)n3ncc(C(=O)O)c3n2)n1 846259141 ZMYAHVNJLGUVIG-MRVPVSSYSA-N 362.346 0.856 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](NS(C)(=O)=O)C(C)C)C2)cc1 855227880 QVDVLXYMBIICKF-CJNGLKHVSA-N 369.487 0.964 10 10 FCCE COC(OC)C(=O)N1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 912357180 UPFKHPJLMMNYJB-XQRVVYSFSA-N 350.371 0.401 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCc3cn(C)c(=O)nc3O)C2)cc1 1252923494 MPTJTBKKNASWKN-CYBMUJFWSA-N 373.413 0.573 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@H](O)CC(F)(F)C1 1324899460 RKAQQKQJWZXZKB-CQSZACIVSA-N 355.385 0.906 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ncn(C)n3)C2)cc1 1331024013 VLKGTNHTGVVJQL-QWHCGFSZSA-N 372.429 0.396 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N[C@H]1CCOC1=O 1565044589 QAFMVLSDOFRVGU-AWEZNQCLSA-N 367.427 0.036 10 10 FCCE NC(=O)c1c[nH]c(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1 1644863463 MPVNLHAAVYHMRL-UHFFFAOYSA-N 369.425 0.745 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](C(=O)NCCCN=[N+]=[N-])C1 2020899748 LFSIFLKPCXVVAH-JTQLQIEISA-N 361.424 0.837 10 10 FCCE COc1cc(C(=O)N[C@@H](CO)CNC(=O)OC(C)(C)C)cc(OC)n1 2062362341 ITYSIJKIZREQOS-LLVKDONJSA-N 355.391 0.714 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@@H]1C[C@@H]1CN 2136240474 MPJAHAQQLFAMRM-UPJWGTAASA-N 365.430 0.997 10 10 FCCE O=S1(=O)CCN(CCNCc2c(O)cccc2Br)CC1 2184637425 QAAIZTCFDFMEPB-UHFFFAOYSA-N 363.277 0.975 10 10 FCCE COc1cccc(O)c1CNCC(CO)(CO)NC(=O)OC(C)(C)C 2258280717 GZXXTFVVUGDPBP-UHFFFAOYSA-N 356.419 0.739 10 10 FCCE CS(=O)(=O)NC1CN(c2ccc(CN)c(Br)c2F)C1 703018292 FNNWOJOWRFLTHX-UHFFFAOYSA-N 352.229 0.785 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@H]3CCCCNC3)C2)cc1 818678204 WWSOPNUERDRMOE-CVEARBPZSA-N 374.485 0.896 10 10 FCCE CN1CC[C@@H](C(=O)NCc2cccc(Br)c2O)S1(=O)=O 843867436 LYHFYQHGSAXIQS-JTQLQIEISA-N 363.233 0.805 10 10 FCCE C[C@H](NC(=O)C(=O)NCCC1(CN)CC1)c1ccc(N2CCOCC2)cc1 846330571 KNPQMRPAVSUGIW-HNNXBMFYSA-N 374.485 0.946 10 10 FCCE NCC12CC(CN1C(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C2 852915525 HQFGCWYCCTZKEG-FXUPRZHBSA-N 373.453 0.850 10 10 FCCE NC(=O)[C@H]1CC(C(=O)NCc2cc(O)ccc2O)=NN1c1ccc(F)cc1 1637122648 LOTUBCUKAXTVIG-OAHLLOKOSA-N 372.356 0.973 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](O)Cc3cnn(C)c3)C2)cc1 819588186 KSQVLQNIXPHLNW-KSSFIOAISA-N 358.442 0.975 10 10 FCCE CN1CC[C@H](C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)S1(=O)=O 843836736 XLIKLMUVACXEQR-GDBMZVCRSA-N 368.455 0.934 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCN2C[C@H](O)C[C@H]2C1 848630035 LMZBJSTWNNWLKG-ZWKOTPCHSA-N 374.485 0.379 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)c3nc(C)n(-c4nc[nH]n4)n3)C2)cc1 855232163 OQCYPJJGXLRAIX-GFCCVEGCSA-N 368.401 0.711 10 10 FCCE CC(=O)O[C@@H]1[C@H](OCCN=[N+]=[N-])O[C@H](C)[C@@H](OC(C)=O)[C@H]1OC(C)=O 885677533 SWFHDHBVUMLTMW-ONAGADSBSA-N 359.335 0.853 10 10 FCCE CCON(C)C(=O)CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1261537193 JTZVUYSBKQQDPB-GFCCVEGCSA-N 350.419 0.456 10 10 FCCE O=S1(=O)CC[C@]2(CN(Cc3cc4c(cc3O)OC[C@@H]4O)CCO2)C1 1326485408 FKIZRJGDJSFPIU-HOCLYGCPSA-N 355.412 0.208 10 10 FCCE Cc1nnc(N2CC[C@@H](C(N)=O)C2)n1Cc1ccc(N2CCOCC2)cc1 1742786431 HLXFQUNRZRLWCE-MRXNPFEDSA-N 370.457 0.783 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCc2ccccc2O)[C@H](O)C1 1890526093 NWJPHBZAFHOBNB-KDOFPFPSSA-N 366.414 0.741 10 10 FCCE CC(C)(C)OC(=O)N1CCN[C@H](CNC(=O)c2cc(O)c(O)c(O)c2)C1 2140601447 JSSRDCVBFKXJFW-LLVKDONJSA-N 367.402 0.742 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H]2OCCC[C@]2(COc2nnc(=N)[nH]n2)C1 2222986742 QYYCFKQOERJLQJ-MEBBXXQBSA-N 352.395 0.474 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H](O)Cc1cnn(C)c1 786859585 GNNDQHFRLWNIFR-KRWDZBQOSA-N 374.441 0.591 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H]4CN(C)C[C@H]43)CC2)cc1 794929563 MDDJLZFWIJHVLI-HFSMHLIXSA-N 374.529 0.814 10 10 FCCE COc1ccc(N2CC[C@@H](NS(=O)(=O)C[C@@H]3CNCCO3)C2)cc1 866777665 VZVGCVWVCNGVQI-CJNGLKHVSA-N 355.460 0.182 10 10 FCCE COc1ccc(N(CC(=O)O)CC(=O)NCC[C@H]2CC(=O)N(C)C2)cc1 905127509 AWDHBXMVNUDKNP-ZDUSSCGKSA-N 363.414 0.571 10 10 FCCE CN1CCCc2cc(CNC(=O)NC[C@H](O)CS(C)(=O)=O)ccc21 915390691 NHRPRHXPFODEIZ-AWEZNQCLSA-N 355.460 0.274 10 10 FCCE CCN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1=O 1329922849 XZBYONIYPGRHCM-MRXNPFEDSA-N 358.442 0.640 10 10 FCCE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1445938030 MVWYACNKSZKTRW-NXEZZACHSA-N 367.345 0.980 10 10 FCCE O=C(NCCNC(=O)c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1 13763194 CUKAJLUIIBQEDU-UHFFFAOYSA-N 364.310 0.080 10 10 FCCE COCCS(=O)(=O)CC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855229885 AKXYNOQOKXBLBZ-ZDUSSCGKSA-N 356.444 0.451 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N[C@@H]3CCN[C@H]3C)C2)cc1 861782558 FAOFPNHXYFBBSR-GRDNDAEWSA-N 360.458 0.504 10 10 FCCE O=C(CN1CCN(Cc2cc(F)cc(F)c2O)CC1)N1CCOCC1 893910106 WEVONGFMGXBEJK-UHFFFAOYSA-N 355.385 0.647 10 10 FCCE CO[C@H]1COCC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 897809748 WXKCUUGNIBJXMO-ROUUACIJSA-N 373.453 0.941 10 10 FCCE Cc1nc(S(=O)(=O)NCCC(=O)NCc2cccc(O)c2O)cn1C 1303194109 XOWXHDARFTWSNQ-UHFFFAOYSA-N 368.415 0.125 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)NCCN2C[C@H]3CCCCN3C2=O)cc1 1327487868 XKHZBXLUJBPLNZ-MRXNPFEDSA-N 373.457 0.334 10 10 FCCE NS(=O)(=O)CCOCCNC(=O)c1cc2cc(O)c(O)cc2s1 1636097008 PDDAGXZCEVEMAC-UHFFFAOYSA-N 360.413 0.347 10 10 FCCE O=C(C[C@@H]1NC(=O)c2ccccc2NC1=O)NCc1cccc(O)c1O 1651175580 CWARMNIEKWITAZ-ZDUSSCGKSA-N 355.350 0.855 10 10 FCCE C[C@@H](NC(=O)NCc1nnc2n1CCNC2=O)c1ccc(N(C)C)cc1 1671851882 LXQSDYYDESXXGI-LLVKDONJSA-N 357.418 0.648 10 10 FCCE C[C@@]1(NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCNC1=O 1687631718 AXPPGLQMWAEOPB-LJQANCHMSA-N 373.457 0.466 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2OCCC[C@@]2(COc2nnc(=N)[nH]n2)C1 2222986741 QYYCFKQOERJLQJ-BONVTDFDSA-N 352.395 0.474 10 10 FCCE CN(C)c1ccc(CNS(=O)(=O)CCCS(C)(=O)=O)cc1F 77387962 NKSLCPSEEJPAEI-UHFFFAOYSA-N 352.453 0.746 10 10 FCCE CN1CCO[C@@H](CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 104790470 WLNPSOPEUAPQGW-HNNXBMFYSA-N 366.437 0.792 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CC[C@H](C(N)=O)C3)cc2)CC1 890129706 YIJYEVKSSNBEJC-DLBZAZTESA-N 372.469 0.873 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](NC(N)=O)C(C)C 1469230847 PYSJXSITDNRVCW-HNNXBMFYSA-N 351.403 0.977 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(O)(C(N)=O)CC3)C2)cc1 1470771649 GRTMHHMOMQEFEI-CYBMUJFWSA-N 362.430 0.296 10 10 FCCE Cn1c(=O)c2ccc(C(=O)NCc3cc(Cl)ccc3O)nc2n(C)c1=O 1583817392 SFSPIBKSJVRECL-UHFFFAOYSA-N 374.784 0.921 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCC2(CN=[N+]=[N-])CC2)[C@@H](O)C1 1890527457 UDGSABIKIXKMTH-ZBEGNZNMSA-N 369.422 0.926 10 10 FCCE O=S1(=O)C[C@H]2NCCN(Cc3cc(Br)ccc3O)[C@@H]2C1 2143714962 WXWRGOIHCSTAKR-VXGBXAGGSA-N 361.261 0.726 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2332922615 DMJSWOAOWRRERV-QNWHQSFQSA-N 369.422 0.876 10 10 FCCE Cc1ccc(CN[C@@H]2CS(=O)(=O)C[C@H]2O)c(O)c1Br 2352676417 PHRGZXCFMRHKAH-NXEZZACHSA-N 350.234 0.711 10 10 FCCE COc1ccc(N2CCN(C(=O)CCN3CCN(C=O)CC3)CC2)cc1 243432331 MZYDUYWDVZDUCQ-UHFFFAOYSA-N 360.458 0.508 10 10 FCCE NCc1ccc2c(c1)CCCN2C(=O)C1=CC=CN2CCS(=O)(=O)N=C12 818551524 DMBDGWGZRHPBEC-UHFFFAOYSA-N 372.450 0.922 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3nc(C)n(C)n3)C2)cc1 850538330 YXUPEQAATGEAPR-LBPRGKRZSA-N 358.402 0.466 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CC[C@@H](F)[C@H](N)C3)CC2)cc1 852761619 YEOOXWWVWKVORC-IAGOWNOFSA-N 350.438 0.715 10 10 FCCE COC(=O)[C@]1(OC)CCN(C(=O)C(=O)N(C)Cc2ccccc2O)C1 1331572784 CZEAJEFLKWEOOD-KRWDZBQOSA-N 350.371 0.141 10 10 FCCE O=C(NCc1c(O)cccc1O)[C@@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1647289880 LEPUZKPYNADITG-BDAKNGLRSA-N 353.318 0.937 10 10 FCCE CC(C)(C)OC(=O)NCC1(NS(=O)(=O)Cc2ccc(N)cc2)COC1 2044249752 HUIPKAQVELYMJA-UHFFFAOYSA-N 371.459 0.982 10 10 FCCE COc1ccc(N2CCN(CC(=O)NCCNC(C)=O)CC2)cc1F 177713252 CPIJXXMOYMHUCS-UHFFFAOYSA-N 352.410 0.209 10 10 FCCE CC[S@@](=O)CCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788931940 JPDVSEZYHOETAN-XMMPIXPASA-N 351.472 0.788 10 10 FCCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(C(=O)NCCc3ccc(N)cc3)C[C@@H]12 851665037 OUFUOAPAIFARBP-ZNMIVQPWSA-N 353.444 0.265 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCc3nc(O)cc(CN)n3)C2)cc1 851679095 UUHMATGAUPZQQS-GFCCVEGCSA-N 372.429 0.728 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3C[C@@H](N)C(C)(C)C3)CC2)cc1 923431945 YYHDJTDMJMKNMX-IEBWSBKVSA-N 362.518 0.847 10 10 FCCE CN1C(=O)CO[C@H](C(=O)NCc2c(O)cccc2O)[C@H]1c1cccnc1 1178917735 RCCZJKFSHRKTKS-SJORKVTESA-N 357.366 0.708 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H](O)C4(CC4)C3)CC2)cc1 1324209148 DNVMPMQFOLPSBP-PKOBYXMFSA-N 361.486 0.635 10 10 FCCE O=C1NC[C@@H](Cn2cc(C(=O)NCc3ccc4cccnc4c3O)nn2)O1 1557122901 KWRXLVGZQRBZQJ-LBPRGKRZSA-N 368.353 0.570 10 10 FCCE C[C@@H]1NC(=O)[C@@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H]1C 1583302846 PMNKHBPTASZMIR-LPEHRKFASA-N 355.416 0.501 10 10 FCCE NS(=O)(=O)CCCC(=O)NCc1cccc(Br)c1O 1626822887 XLLUHZIPUCQNFY-UHFFFAOYSA-N 351.222 0.840 10 10 FCCE Cc1ccc(N2C(=O)NC(=O)C(=CNCCN3CCOCC3)C2=O)cc1 2296923424 ANSJFHNKIGZIAD-UHFFFAOYSA-N 358.398 0.384 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@@](C)(O)CN2CCOCC2)cc1 75491459 WWTLTSTVUDSKLX-GOSISDBHSA-N 350.463 0.635 10 10 FCCE COC(=O)[C@H]1CS(=O)(=O)CCN1Cc1cc(Cl)cc(OC)c1O 276750599 KWHSYRVAFRNMDX-LLVKDONJSA-N 363.819 0.826 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2nnc3n2CCC3)c1 769707255 XTIYBDMHDQPFIQ-UHFFFAOYSA-N 365.415 0.274 10 10 FCCE CC[C@H]1NC(=O)N(Cc2ccc(N3CCS(=O)(=O)CC3)cc2)C1=O 777605904 YLTLFOZUFVCHIK-CQSZACIVSA-N 351.428 0.752 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@H]3CCCCN3)C2)cc1 851687453 BCIZBDJUTYLEOQ-CABCVRRESA-N 360.458 0.648 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCN(C)S3(=O)=O)C2)cc1 855225045 NKXYMBSFMNMHDO-WFASDCNBSA-N 353.444 0.424 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCCn3nncc3C2)cc1F 1262122101 YEULNUOGNSAINE-UHFFFAOYSA-N 360.393 0.532 10 10 FCCE NS(=O)(=O)CCCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1446571617 ZSGUIFJWTIJXMM-AWEZNQCLSA-N 356.444 0.969 10 10 FCCE NC(=O)c1cccnc1N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1583723760 ORHOFRQBCDMIAP-UHFFFAOYSA-N 356.382 0.483 10 10 FCCE NS(=O)(=O)CCCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1626154148 IYPXZLRWQIALCD-UHFFFAOYSA-N 359.423 0.347 10 10 FCCE CN1C(=O)/C(=C\N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)C(=O)N=C1S 103102948 QCMQWCNUTWQPTG-ZWXCPPHNSA-N 372.406 0.922 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N(C)CCCCO)C2)cc1 824981365 UCJDZWYZHPMYIX-OAHLLOKOSA-N 363.458 0.869 10 10 FCCE CCN(CC)c1ccc(CN(C)C(=O)[C@@H](C)NC(=O)Cn2cnnn2)cc1 929537762 SMPQIIHGIUOAON-CQSZACIVSA-N 373.461 0.683 10 10 FCCE O=C1C[C@@H](C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CCN1 1161175414 VVCTWCQELYGGSD-LBPRGKRZSA-N 353.369 0.944 10 10 FCCE O=C(NCc1ccc2cccnc2c1O)[C@H]1C[C@@H](O)CN1c1ccncn1 1162612802 QIYAIWPFCBFOAI-HUUCEWRRSA-N 365.393 0.986 10 10 FCCE CCOC(=O)[C@@H]1CSCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1467754347 SBJQOBRXTSMWPV-NSHDSACASA-N 374.440 0.842 10 10 FCCE Cn1c(O)nc(N2CC[C@H](NC(=O)/C=C/c3ccc(O)c(O)c3)C2)cc1=O 1652826927 DVOQABUDKMWDOZ-PYEVWLCESA-N 372.381 0.305 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)N[C@H]([C@H](N)Cc2ccc(O)c(O)c2)C1 1952970881 NHIUAKOECKEEHB-NEPJUHHUSA-N 351.403 0.703 10 10 FCCE CC(C)(C)OC(=O)NC[C@H](CO)NS(=O)(=O)Cc1ccc(N)cc1 2011423082 XTDPQHRUNQQCLL-CYBMUJFWSA-N 359.448 0.574 10 10 FCCE CN(CCN=[N+]=[N-])C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCS1(=O)=O 2020898953 BXXWIXUMRFOQQU-SNVBAGLBSA-N 361.424 0.789 10 10 FCCE CC(C)(C)OC(=O)N1CC(NC(=O)c2cccc(O)c2O)(C(=O)O)C1 2054409820 HSNRPEMLAOWBQP-UHFFFAOYSA-N 352.343 0.902 10 10 FCCE CNS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cnc3n2CCC3)cc1 797432639 LUYSFXICWIAACX-UHFFFAOYSA-N 371.444 0.506 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3CN(C)C(=O)[C@H]3C)CC2)cc1 830796800 HBHNJZZVKAWDJG-NVXWUHKLSA-N 362.474 0.298 10 10 FCCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 863340299 KAVQYKWRFDAFKG-ABAIWWIYSA-N 356.444 0.579 10 10 FCCE CN(C)c1ccc(CNC(=O)c2cn(C[C@H]3CNC(=O)O3)nn2)cc1F 1125469642 WNVGOTBXNXBPBX-LLVKDONJSA-N 362.365 0.522 10 10 FCCE CCC(=O)N[C@H](C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1133626568 PWUDDSNQYSCOLH-CYBMUJFWSA-N 360.458 0.919 10 10 FCCE CC(C)(C)NC(=O)N1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329470888 SPRKDSUYYKJISV-UHFFFAOYSA-N 374.441 0.887 10 10 FCCE N[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC[C@H]1C(F)(F)F 1334054182 GEZNMHKMVRKQTE-VXGBXAGGSA-N 357.332 0.973 10 10 FCCE Cc1ccc(O)c(CNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)c1 1557553510 OPQNGIVGZCZWHZ-UHFFFAOYSA-N 354.366 0.576 10 10 FCCE COC1(OC)CCOC[C@@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1633453318 QTASFXFUNDPZEK-ZDUSSCGKSA-N 374.415 0.272 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H]3CCN(S(C)(=O)=O)C3)CC2)cc1 1858388893 FMIVRSOQDZQYQJ-CQSZACIVSA-N 367.471 0.625 10 10 FCCE Cn1nnc(CNC(=O)OC(C)(C)C)c1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2049783901 CHMUJZFWLILGOJ-MGCOHNPYSA-N 351.407 0.719 10 10 FCCE CC(C)(C)OC(=O)N1CC(CO)(CNC(=O)COc2ccc(N)cc2)C1 2137082559 XYXBDXYXKOJCIH-UHFFFAOYSA-N 365.430 0.993 10 10 FCCE Cc1cc(N2CCC(NC(=O)CN3C(=O)CSC3=S)CC2)n[nH]1 238898076 RFMOXJZMTUDTGO-UHFFFAOYSA-N 353.473 0.663 10 10 FCCE Cn1nnnc1COC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O 733385386 MJAOHDDXZULQOY-UHFFFAOYSA-N 363.333 0.925 10 10 FCCE C[C@@H](NC(=O)C(=O)NCc1ccn(C)n1)c1ccc(N2CCOCC2)cc1 803297583 AQHVNKQHVBSMSU-CQSZACIVSA-N 371.441 0.750 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@]2(OCCO)CCOC2)cc1F 1328024357 PRNHDJRVMHYJDO-QGZVFWFLSA-N 355.410 0.859 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2081036065 NUBFXFPQKQRRLE-SDDRHHMPSA-N 355.395 0.629 10 10 FCCE COc1cccc(O)c1CNC[C@@H]1[C@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C 2225658226 JYBJMBLTZQCWHQ-INWMFGNUSA-N 368.430 0.832 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@H]3CCNC[C@@H]3C)C2)cc1 818676847 QATLFSMZIRXHTI-DAYGRLMNSA-N 374.485 0.752 10 10 FCCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N[C@@H]1COC[C@H]1O 838533084 KSZVZVFZTRIMKO-RTBURBONSA-N 374.485 0.778 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCN(CCO)C[C@H]3C)C2)cc1 854296680 FZNFNEDAWUDLON-CVEARBPZSA-N 362.474 0.982 10 10 FCCE NCCCOCCNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 861636924 AKZLPNNPIQOTGL-UHFFFAOYSA-N 372.416 0.966 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)c3cn([C@@H]4CC[C@H]4O)nn3)C2)cc1 912291917 FPYVQPHUEFMMAL-JCURWCKSSA-N 357.414 0.991 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cn1nc2n(c1=O)CCCC2 1627029303 YMMLYRHKZUMXHQ-UHFFFAOYSA-N 351.403 0.889 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)NC[C@H]3CNC(=O)C3)cc2)CC1 1683160548 FBOKRBDNENXBLU-CQSZACIVSA-N 373.457 0.324 10 10 FCCE COCCN(C(=O)N(C(C)=O)c1ccc(N)cc1)[C@@H]1CCS(=O)(=O)C1 244236705 WEVPXMLPDDVTBG-OAHLLOKOSA-N 369.443 0.877 10 10 FCCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCO[C@]2(CCOC2)C1 283887854 FSUYYACDOWZXQD-HXUWFJFHSA-N 373.453 0.921 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)Cn2cncn2)cc1 284142088 QDMKBMNMDJUNSO-CQSZACIVSA-N 358.446 0.945 10 10 FCCE CNS(=O)(=O)C1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 370538550 MHXFVARPDRZICH-UHFFFAOYSA-N 370.387 0.444 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H](O)Cc3cnn(C)c3)CC2)cc1F 787118290 VZBQJYMLBKXMER-INIZCTEOSA-N 362.405 0.820 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CNCC[C@H]3C)CC2)cc1 842265291 DHMNGGZUFLTDSP-QAPCUYQASA-N 374.485 0.848 10 10 FCCE CNC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 843053084 HYAVTKNRPQZVOT-CQSZACIVSA-N 358.320 0.734 10 10 FCCE COC(=O)CCNC(=O)CCNC(=O)NCc1ccc(OC)cc1O 858903709 YZFWWKOAWXGHSR-UHFFFAOYSA-N 353.375 0.269 10 10 FCCE NCC1(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCOCC1 861561767 GFLFPLYOFMLVCG-UHFFFAOYSA-N 366.437 0.969 10 10 FCCE C[C@@H](NC=C1C(=O)N(C)C(=O)N(C)C1=O)c1ccc(-n2cncn2)cc1 920979642 SSEVDOGQSDQZHS-LLVKDONJSA-N 354.370 0.852 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCC[C@](N)(CO)C1 926288801 OTUAFOPQNLPGKA-LJQANCHMSA-N 362.474 0.413 10 10 FCCE O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccn(C2CCOCC2)n1 1333322430 XAIQKLLJNJXCKS-UHFFFAOYSA-N 374.397 0.943 10 10 FCCE CNS(=O)(=O)c1ccc(CC(=O)NCc2c(O)cccc2O)cc1 1456313665 GEPDEHKMHQIVMT-UHFFFAOYSA-N 350.396 0.865 10 10 FCCE COc1ccc(CNC/C=C/CNC(=O)[C@H]2CC[C@@H](C(N)=O)O2)cc1C 1497672963 BPZMNWGYFPXEPB-OAZXXZECSA-N 361.442 0.799 10 10 FCCE C[C@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCS1(=O)=O 155464086 RKPQSAHOCVEQKK-AWEZNQCLSA-N 353.488 0.830 10 10 FCCE CC(C)C(=O)N1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 299071705 CSTPIGPZYGYPHS-UHFFFAOYSA-N 369.443 0.704 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NCC(F)(F)CN)CC2)cc1 841749145 ASAQFFMHKLEHAR-UHFFFAOYSA-N 371.432 0.710 10 10 FCCE COCC1(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 848931019 BVRXWRIORLHEHR-UHFFFAOYSA-N 361.442 0.682 10 10 FCCE NCC12CC(CN1C(=O)C(=O)NCc1ccc(N3CCC(O)CC3)cc1)C2 851692436 XUBSVBJJSVUWIS-UHFFFAOYSA-N 372.469 0.214 10 10 FCCE O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NCc1ccc(O)cc1O 1639444752 YGEMUVNMGDLKQC-VDERGJSUSA-N 360.366 0.267 10 10 FCCE COCCN1C(=O)C(=CNc2cc(OC)cc(OC)c2)C(=O)NC1=S 2040475252 DJVDCFBECRKUOG-UHFFFAOYSA-N 365.411 0.889 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)CNC(=O)CCc1ccc(N)cc1 2270652111 DMSGKDYVJTYXBI-UHFFFAOYSA-N 367.446 0.566 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@H](C(=O)C3CC3)C2)c1 788206272 SSKKCDQTPXFDNS-AWEZNQCLSA-N 368.411 0.584 10 10 FCCE C[C@H](C(=O)N(C)[C@@H]1CCS(=O)(=O)C1)N1CCCc2cc(CN)ccc21 843349480 AXEKCQLMANUMJR-CZUORRHYSA-N 365.499 0.932 10 10 FCCE CN1CCN(c2ccc(CNCC[C@H]3CNCCS3(=O)=O)cc2)CC1 903969369 XVIRKTZENZGLPP-SFHVURJKSA-N 366.531 0.305 10 10 FCCE NS(=O)(=O)c1ccc(F)c(CNC(=O)c2c(F)ccc(O)c2O)c1 1183925733 ZRYATFPNVOXTCW-UHFFFAOYSA-N 358.322 0.953 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)NCCCNC(=O)c2ccccc2)cc1 1261379598 HJXLBIBNNHKAIE-UHFFFAOYSA-N 368.437 0.864 10 10 FCCE CCc1ccc(N2C(=O)NC(=O)C(=CNCCN3CCNCC3)C2=O)cc1 2296103103 PETAWWGQELKDHG-UHFFFAOYSA-N 371.441 0.211 10 10 FCCE NC(=O)COc1ccc(C=C2SC(=S)N(CC(=O)O)C2=O)cc1 2296656432 LNUUVOYTGLGONO-UHFFFAOYSA-N 352.393 0.837 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)Cc3ccnn3C)cc2)CC1 277922525 PJOWWJQVBMYXCA-UHFFFAOYSA-N 355.442 0.948 10 10 FCCE O=C([C@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1)N1CCOCC1 768440527 FDTUZEGBVDWZRM-GUYCJALGSA-N 362.426 0.889 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN3CCOC[C@@H]3C2)cc1 788976811 CCRFEUOVRZFEDE-SFHVURJKSA-N 374.485 0.692 10 10 FCCE CN1NN=C2C1=NCC[C@@H]2C(=O)NCc1ccc(N2CCOCC2)cc1 816898263 WQHILXPMYSAFLO-HNNXBMFYSA-N 356.430 0.364 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)Cn3cncn3)C2)cc1 827607484 BEAPTDIFGPROEF-ZIAGYGMSSA-N 372.429 0.187 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N3CN(C)C(=O)[C@H]3C)CC2)cc1 834698884 PPTCFSVTXDTWHE-CYBMUJFWSA-N 374.441 0.427 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)C3=NO[C@H](CN)C3)cc2F)CC1 852872411 GOHWVAFCNIYLCZ-AWEZNQCLSA-N 363.437 0.687 10 10 FCCE CCN1CC[C@@H]1CNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 897640465 NFUUOSJEDUUZOX-QGZVFWFLSA-N 374.485 0.991 10 10 FCCE O=C(NCc1cc(Cl)ccc1O)NCc1nnc2n1CCNC2=O 1246805364 YWTZUGLTQJLZMC-UHFFFAOYSA-N 350.766 0.380 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCc2ncc3c(n2)CCOC3)cc1 1328904603 OBSDLXFWFGXPGS-UHFFFAOYSA-N 369.425 0.548 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(C(=O)c2cc(O)c(O)c(O)c2)C1 2132348281 ICJCSPOXPYTOCE-MNOVXSKESA-N 368.386 0.904 10 10 FCCE CC(=O)N(C(=S)N1CCN(S(C)(=O)=O)CC1)c1ccc(N)cc1 243102166 JBWHGZOBKASIHS-UHFFFAOYSA-N 356.473 0.484 10 10 FCCE COc1ccc(N2CCN(C(=O)CC(=O)N3CCN(C)CC3)CC2)cc1 243705164 PMGHNCDWVOHYFS-UHFFFAOYSA-N 360.458 0.508 10 10 FCCE COCCN1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1=O 375504781 FHZAOJGAAZXMPD-UHFFFAOYSA-N 364.358 0.611 10 10 FCCE C[C@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCC(=O)NC1 798405053 YEJOIHDFIAAYIB-QRWLVFNGSA-N 372.469 0.921 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H]3CCCCNC3)C2)cc1 851687869 JZORCCTYJBBWSE-LSDHHAIUSA-N 360.458 0.648 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCCCS(N)(=O)=O)C2)cc1 1312936349 HJCJEPHUVMMATB-GFCCVEGCSA-N 356.448 0.252 10 10 FCCE CCOC(=O)N[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1329782779 OYMGSDXDRWRYJA-ZDUSSCGKSA-N 361.398 0.972 10 10 FCCE Cc1nn(C)c2c1N(C(=O)c1cc(NS(C)(=O)=O)ccc1O)CCO2 1631558810 NVJPUONGGMLECW-UHFFFAOYSA-N 366.399 0.845 10 10 FCCE O=C(O)[C@@H]1[C@H](O)[C@H](O)CN1Cc1cc(Cl)cc(Br)c1O 2200842989 CKYQVJUNFJGCOY-WCABBAIRSA-N 366.595 0.799 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)c2ccc(S(N)(=O)=O)cn2)c1 798334534 ZVDMGFNEHLBGQO-VIFPVBQESA-N 351.384 0.934 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCN4CCOC[C@H]4C3)C2)cc1 854299833 SBWHGIUHVVEYQP-DOTOQJQBSA-N 360.458 1.000 10 10 FCCE COc1ccc(N2CCN(C(=O)C[C@@H](C)NC(N)=O)CC2)c(OC)c1 870166491 PRJBKHPFAIQPHI-GFCCVEGCSA-N 350.419 0.799 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC(Cc3nn[nH]n3)CC2)cc1 1175844045 BQDIXDHQKQHXMR-UHFFFAOYSA-N 357.462 0.837 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)CN3C(=O)CCC3=O)cc2)CC1 1178038791 HQSYJEDTAZEUKR-UHFFFAOYSA-N 372.425 0.154 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)NC[C@H]3C[C@@H]3C)CC2)cc1 1321888194 YIAWSNJBYKDCKC-JKSUJKDBSA-N 374.485 0.706 10 10 FCCE C[C@@H]([C@@H](C)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1)S(C)(=O)=O 1335574403 YGHFPLWASHBDDI-MNOVXSKESA-N 354.428 0.514 10 10 FCCE C[C@H](NC(=O)Cn1cnnn1)C(=O)NCc1cc(Cl)cc(Cl)c1O 1556884466 BGGUCGAPUUUJKY-ZETCQYMHSA-N 373.200 0.507 10 10 FCCE CN(C)S(=O)(=O)N1CC(NC(=O)c2cc3cc(O)c(O)cc3s2)C1 1631323983 FPHDMGLCXNGHFZ-UHFFFAOYSA-N 371.440 0.533 10 10 FCCE CN(C)c1ccc([C@@H](CNC(=O)Cc2c(O)ncnc2O)N(C)C)cc1 1653421804 RDRPFOMVWYCEPL-OAHLLOKOSA-N 359.430 0.915 10 10 FCCE CC(C)(C)OC(=O)N(CCO)CC(=O)NCCc1ccc(O)c(O)c1 2060135435 MQFBNCNPADIUAU-UHFFFAOYSA-N 354.403 0.986 10 10 FCCE COCCCNC(=O)CSc1nc(-c2ccco2)nc2cc(=O)[nH]n12 21537467 RRAOBSCJMJLMKZ-UHFFFAOYSA-N 363.399 0.922 10 10 FCCE O=C(CN1C(=O)CSC1=S)N1CCC[C@H](Oc2cccnn2)C1 238883427 PQKXWHGGOMIVFK-JTQLQIEISA-N 352.441 0.707 10 10 FCCE COc1ccc(N2CCN(CC(=O)N3CCC[C@@H](C(N)=O)C3)CC2)cc1 248151720 WOBATDAZFUDMDN-OAHLLOKOSA-N 360.458 0.541 10 10 FCCE COc1ccc(O)c([C@@H](C)NS(=O)(=O)CCCS(C)(=O)=O)c1 751318214 LGSHRZLNDOKJIZ-SNVBAGLBSA-N 351.446 0.816 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3cnn(C)c3C)C2)cc1 828087379 JMBYBKWILMWCQN-OAHLLOKOSA-N 371.441 0.748 10 10 FCCE O=C(C(=O)N1CCC[C@@H](Cn2ccnn2)C1)N1Cc2cccc(O)c2C1 1348641715 ZEISDPWHKNGSLG-CYBMUJFWSA-N 355.398 0.765 10 10 FCCE CC(=O)N1CCCN(C[C@@H]2OC[C@@H](NCc3ccccc3O)[C@H]2O)CC1 1615259191 DOMNJAYCCSHOQJ-NZSAHSFTSA-N 363.458 0.164 10 10 FCCE Cn1cc([C@H](NCCCN=[N+]=[N-])C(N)=O)c(I)n1 1912148262 RGFYWFYGWOEZDG-ZETCQYMHSA-N 363.163 0.841 10 10 FCCE CN(C(=O)[C@@H]1[C@H](O)[C@H](O)CN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2080685583 ADNRYIPCPUYZJD-HZSPNIEDSA-N 351.403 0.573 10 10 FCCE N[C@@H](COCc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O 2151895843 XBRCHCXPWFKAAX-GJZGRUSLSA-N 374.393 0.754 10 10 FCCE O=S1(=O)CCN(Cc2cc(Br)ccc2O)C2(CNC2)C1 2183502583 ABFQECORELMWOW-UHFFFAOYSA-N 361.261 0.727 10 10 FCCE NS(=O)(=O)N1CCC(NCc2cccc(Br)c2O)CC1 698710737 SRXFARSEGCPRPD-UHFFFAOYSA-N 364.265 0.912 10 10 FCCE Cn1cc(CNCc2cc(Br)ccc2O)c(=O)n(C)c1=O 809713392 OJEBDIFQYXYPCV-UHFFFAOYSA-N 354.204 0.842 10 10 FCCE C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c2ncnn21 827574918 JAIKZSKNNDKFDK-MFKMUULPSA-N 360.393 0.922 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCc3nnc4n3CCOC4)C2)cc1 852275429 OUUAKYHSAHVORE-ZDUSSCGKSA-N 372.429 0.895 10 10 FCCE CC(=O)NC[C@@H]1CCn2ncc(C(=O)NCc3cccc(O)c3O)c2C1 1153798116 MPVCEGFJFUWLIO-GFCCVEGCSA-N 358.398 0.923 10 10 FCCE CCOC(=O)N1CCC(NC(=O)CCN2C(=O)CSC2=S)CC1 1865765045 NDSOYYFFQUGFRF-UHFFFAOYSA-N 359.473 0.974 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2311714713 GBXAENVXUUQASV-WISYIIOYSA-N 355.395 0.629 10 10 FCCE O[C@H](CNCc1ccc(N2CCOCC2)c(F)c1)CN1CCOCC1 818967146 RZEJCMPIICIZFL-MRXNPFEDSA-N 353.438 0.445 10 10 FCCE CN(C)C(=O)N(C)[C@@H]1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 851687999 NYGVGRNMHKFYNN-OAHLLOKOSA-N 361.446 0.142 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@H](S(N)(=O)=O)C3)C2)cc1 852451164 FHLDVFUODFYPJR-DOMZBBRYSA-N 368.459 0.346 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@@]34COC[C@@H]3C4)cc2)CC1 891086435 VRZBQJHFCRTLRA-KXBFYZLASA-N 358.442 0.976 10 10 FCCE C[C@@H]1C[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1257232476 MYBXANXJKCLVPD-KBMXLJTQSA-N 372.469 0.777 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CCC(N2CCCS2(=O)=O)CC1 1626394551 QMDNQIUOXIBZGE-UHFFFAOYSA-N 354.428 0.667 10 10 FCCE CN(CCC(N)=O)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1685244288 NJNAZIQEGYAVMW-UHFFFAOYSA-N 361.446 0.405 10 10 FCCE CC(C)N1C(=O)NC(=O)C(=CN[C@H](Cc2ccc(O)cc2)C(=O)O)C1=O 2296564605 XRKUGQLOJKMHRW-CYBMUJFWSA-N 361.354 0.348 10 10 FCCE NC(=O)c1cncc(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 750016638 GYQUAIHVFQJWPT-ZDUSSCGKSA-N 354.414 0.889 10 10 FCCE Cc1c(C(=O)N2Cc3cccc(O)c3C2)cnc2c1c(=O)n(C)c(=O)n2C 871203008 JRYHDHIINQFKDQ-UHFFFAOYSA-N 366.377 0.802 10 10 FCCE C[C@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@@H]1CCC(=O)N1 1596354855 DUPBAGKWMUDETH-GUYCJALGSA-N 372.469 0.919 10 10 FCCE Cn1c(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cnc1O 1596355922 XTINWBHUVDLGLE-UHFFFAOYSA-N 357.414 0.757 10 10 FCCE CC[C@@H]1C[C@H]1C(=O)NC[C@@H](CO)NC(=O)c1cc(OC)nc(OC)c1 1718647013 KYGJWHJDUQTPCO-KGYLQXTDSA-N 351.403 0.352 10 10 FCCE CNC(=O)CNC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2123502377 BVVCHGRETKDZSG-NSHDSACASA-N 367.402 0.396 10 10 FCCE CC(C)(C)OC(=O)N1CC(NC(=O)c2cc(O)c(O)c(O)c2)(C(N)=O)C1 2132418478 KNDGDNNLMVXAFU-UHFFFAOYSA-N 367.358 0.008 10 10 FCCE COc1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)nn1C 773248013 YMKWLPJPNFKEMH-UHFFFAOYSA-N 373.413 0.520 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNCc3ccnn3C)CC2)cc1 818952505 NZFWBTUHRCBBES-GOSISDBHSA-N 359.474 0.701 10 10 FCCE CN(C)CCN1CCN(C(=O)NCc2ccc3c(c2)CCCN3C)CC1=O 844933362 FLIMMPAWOFIBTN-UHFFFAOYSA-N 373.501 0.984 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3ccnc(OC)n3)C2)cc1 850537140 NBQBQUGCUGQKEC-LBPRGKRZSA-N 371.397 0.827 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CC[C@H](C)NC3)C2)cc1 861804517 QYQVMAHYIBTJMS-KKUMJFAQSA-N 360.458 0.647 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N(C)CC3(CO)CC3)cc2)CC1 898323507 LPBDWZOLTWHZHH-UHFFFAOYSA-N 374.485 0.286 10 10 FCCE CCCNC(=O)[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1119003503 HMHRWFRFWPBTMF-CQSZACIVSA-N 359.426 0.999 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCc2nnc(O)n2C1 1646435065 LIGGCKPGZBZPAR-AWEZNQCLSA-N 371.441 0.824 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CC[C@H](CN)C3)C2)cc1 851689035 KENUSRWILLWWNC-KKUMJFAQSA-N 360.458 0.634 10 10 FCCE CN1NN=C2C1=NCC[C@@H]2C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856213060 BDPTVJWYFNAEIK-INIZCTEOSA-N 370.457 0.488 10 10 FCCE COC(=O)c1cc(OCC(=O)N[C@@H](C)C(=O)N(C)C)ccc1N(C)C 865396401 RNFYIJMINJROOP-NSHDSACASA-N 351.403 0.511 10 10 FCCE CCN(CC)c1ccc(CNC(=O)NC[C@@H](O)CS(C)(=O)=O)cc1 914254530 MJPQTLXOQLEDSD-OAHLLOKOSA-N 357.476 0.738 10 10 FCCE CC[C@@H](CNC(=O)C(=O)N(C)CCN(C)c1ccc(OC)cc1)C(=O)O 927957086 HVCBRENYQZMYAD-ZDUSSCGKSA-N 365.430 0.817 10 10 FCCE CN(C[C@H](O)CNC(=O)OC(C)(C)C)C(=O)Cc1ccc(O)c(O)c1 1298102717 NTVGPPZBLXBEQW-GFCCVEGCSA-N 354.403 0.984 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1coc(OC)n1 1328936053 GKAURHROZSWXAF-JTQLQIEISA-N 350.327 0.999 10 10 FCCE CCN1C(=O)C(=CN2CCN(C(=O)c3ccco3)CC2)C(=O)NC1=S 2297559049 GYIUMPUBGMCSLA-UHFFFAOYSA-N 362.411 0.185 10 10 FCCE Cc1cc(C(=O)NC[C@@H](O)CN2CCOCC2)c(C)n1-c1ccccn1 127754604 USTKJHUELAUZSN-MRXNPFEDSA-N 358.442 0.912 10 10 FCCE CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)CC1CC(O)C1 190128009 SRTJTIGEECJOOV-UHFFFAOYSA-N 365.449 0.981 10 10 FCCE CS(=O)(=O)NC1CN(c2cc(Br)c(CN)cc2F)C1 703019247 MVOCRPHPEZMIKP-UHFFFAOYSA-N 352.229 0.785 10 10 FCCE C[C@H](O)[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 817705340 DTVHJUXOOVDNKF-YOEHRIQHSA-N 361.442 0.511 10 10 FCCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@H](C)N1CCO 829015217 ARYBYHDKKUTPOI-PHIMTYICSA-N 350.375 0.817 10 10 FCCE CN1CC[C@H](C(=O)NCc2ccc(N3CCOCC3)cc2)S1(=O)=O 843775859 UVJOZIBSJPHKMT-OAHLLOKOSA-N 353.444 0.173 10 10 FCCE COc1ccc(N(C)CCN(C)c2ccc(C(=O)NCCO)nn2)cc1 845674148 VSPQEFGJOHHMRO-UHFFFAOYSA-N 359.430 0.780 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCN4C(=O)NC(=O)[C@H]4C3)C2)cc1 854298569 FVTAOFVWHBBSCU-SWLSCSKDSA-N 373.413 0.220 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCS(=O)(=O)NC[C@H]1CCCCO1 1136814754 OINXVYTZZKZXRT-CYBMUJFWSA-N 372.443 0.245 10 10 FCCE COCCn1cc(CNC(=O)/C=C/c2ccc(O)c(O)c2)c(O)nc1=O 1175594705 RAGHEGQUFIJGMR-HWKANZROSA-N 361.354 0.336 10 10 FCCE COc1ccc(N2CCN(C(=O)c3cnn4c(=O)cc[nH]c34)CC2)cc1 1445734555 LNRBHBPYSGBTBV-UHFFFAOYSA-N 353.382 0.994 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)c2ccnc(S(N)(=O)=O)c2)c1 1595800374 WCDDUQNZXLAPHL-SECBINFHSA-N 351.384 0.934 10 10 FCCE O=C(N=c1ccc(I)n[nH]1)c1cc(O)nc(O)c1 2052866439 UVOCFPIFPGHZNT-UHFFFAOYSA-N 358.095 0.562 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)NC[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2060641584 KYAHAMUKGWLVGA-SNVBAGLBSA-N 352.395 0.929 10 10 FCCE CN(C)c1ccc([C@@H](CNS(=O)(=O)N(C)C)N2CCOCC2)cc1 36100227 QEJWFOZXUFYLAS-MRXNPFEDSA-N 356.492 0.522 10 10 FCCE COc1ccc(N2CCN(CC(=O)NC3CCN(C(C)=O)CC3)CC2)cc1 52891359 FRGYCNINKWIOJQ-UHFFFAOYSA-N 374.485 0.944 10 10 FCCE COC(=O)CN1C(=O)N/C(=C\c2ccc(N3CCOCC3)c(C)c2)C1=O 96544952 CUKOHNUQVXLJMK-UVTDQMKNSA-N 359.382 0.897 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2CN2CCOCC2)cc1 283376946 GHZQLLQFPKKDMU-SFHVURJKSA-N 374.485 0.692 10 10 FCCE C[C@H](NC[C@@H](O)CN1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 775258900 LYNURGUSCXCIBF-FXAWDEMLSA-N 362.518 0.782 10 10 FCCE C[C@@H](O)[C@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CCO1 817822404 DVNVDIZLWFOHRH-GHMZBOCLSA-N 359.473 0.350 10 10 FCCE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NCCc2ccc(N)cc2)C1 841905936 KNCHJDYIJUAIID-OAHLLOKOSA-N 369.491 0.381 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3[C@H]4COC[C@H]3C4)CC2)cc1 848053651 TUENODKPVKCKSW-TZNMXKOXSA-N 371.437 0.900 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](C)S(N)(=O)=O)C2)cc1 852452132 SNWXZRSYAGNMKA-RYUDHWBXSA-N 356.448 0.250 10 10 FCCE CN(C)c1ccc([C@@H](N)CNS(=O)(=O)c2nn(C)cc2[N+](=O)[O-])cc1 858610738 DLSHZGOYLKFZHY-LBPRGKRZSA-N 368.419 0.373 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N[C@@H]3CCN[C@H]3C)CC2)cc1 861567967 SZVZQXBKXVMRCL-MAUKXSAKSA-N 361.490 0.867 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCCNC(=O)C3)cc2)CC1 1313306403 KPFALXNWNYCHLF-UHFFFAOYSA-N 373.457 0.420 10 10 FCCE CCCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCS(=O)(=O)C1 1351809648 KWTHBJHLJAJUGR-CYBMUJFWSA-N 366.439 0.660 10 10 FCCE CS(=O)(=O)C1CN(c2cc3c(cc2Br)[C@H](O)C(=O)N3)C1 2152281620 RRJLZMYGHFRWIO-NSHDSACASA-N 361.217 0.668 10 10 FCCE COC(=O)[C@@]1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCSC1 271397654 JPQNYKRATLEZCC-CQSZACIVSA-N 374.440 0.542 10 10 FCCE O=C(NCCCN1CCCC1=O)C(=O)NCc1ccc(N2CC=CC2)cc1 283420110 ZIQQWVHZGXVNDZ-UHFFFAOYSA-N 370.453 0.808 10 10 FCCE CNC(=O)[C@H]1CCN(C(=O)C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C1 817862032 QFULOCAZQNVUIN-ZBFHGGJFSA-N 374.485 0.703 10 10 FCCE CN1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 830628998 ZHFATRYSEQZNEJ-MRXNPFEDSA-N 374.485 0.474 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H]3CCN(C)S3(=O)=O)CC2)cc1 843516667 CUJRTBRGSJDCHX-HNNXBMFYSA-N 353.444 0.378 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3ccc(=O)n(C)c3)C2)cc1 850536298 FACAEVHFJOALBZ-AWEZNQCLSA-N 370.409 0.728 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H](O)c3cnc[nH]3)CC2)cc1 865034317 PZXQPRWBXQWQRS-QGZVFWFLSA-N 359.430 0.390 10 10 FCCE CCN1C(=O)CO[C@H](C(=O)N2Cc3cccc(O)c3C2)[C@H]1c1ccnn1C 871206731 COWOTDQYWBKDBZ-MSOLQXFVSA-N 370.409 0.957 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)[C@H]3CCOC3)C2)cc1 1118693777 ZVZFCQXUYNWKAD-KKUMJFAQSA-N 361.442 0.931 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H](c3ncon3)C2)c1 1154811726 JIKLPFNABJYERY-VIFPVBQESA-N 352.372 0.776 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC(F)(F)C[C@@H]2CO)cc1F 1327968317 NCBNVJREMXQZGT-LLVKDONJSA-N 359.348 0.736 10 10 FCCE O=C(NCc1c(O)cccc1F)[C@@H]1Nc2ccccc2S(=O)(=O)N1 1471975036 PWYFCLFVXRZMMI-CQSZACIVSA-N 351.359 0.878 10 10 FCCE Cc1nc(O)nc(O)c1CC(=O)NCc1ccc(N2CCOCC2)cc1 1597493549 LIBMAQFTGVLOQZ-UHFFFAOYSA-N 358.398 0.892 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCCC23OCCO3)c1 1645952010 AMICIXOMTZFXRK-CYBMUJFWSA-N 356.400 0.789 10 10 FCCE CN1CCN(C(=O)c2ccc(O)c(O)c2)[C@@H](CNC(=O)C(F)(F)F)C1 2118183558 DKELMFOQMAYJAS-JTQLQIEISA-N 361.320 0.533 10 10 FCCE CN1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCC1=O 287160513 WQTBLAKTNKQALQ-HNNXBMFYSA-N 356.426 0.416 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CCC(CN)CC3)C2)cc1 818675550 DAHWAVVUACUXOI-INIZCTEOSA-N 374.485 0.835 10 10 FCCE CN1CCOC[C@H]1CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 858836870 FMSSFSFRGDWJJN-QGZVFWFLSA-N 362.474 0.778 10 10 FCCE COC(=O)[C@@H](F)CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1331899222 IQOYBGDFFHGWFD-ZDUSSCGKSA-N 351.378 0.313 10 10 FCCE CN1CCN(c2ccc(CN3CC(O)(c4ncnn4C)C3)cc2F)CC1 1332021116 GYMSGOOTLRQGMI-UHFFFAOYSA-N 360.437 0.409 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)C(=O)C(=O)NC[C@H]1C[C@H]2C=C[C@H]1CC2 1351570206 QMSDDBZNBBHJHR-SBJFKYEJSA-N 361.442 0.100 10 10 FCCE COc1ccc(N2CCN(C(=O)c3cn(C(F)(F)CO)nn3)CC2)cc1 1465889527 FVGRCBPJGMREFA-UHFFFAOYSA-N 367.356 0.791 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCCCCN=[N+]=[N-])[C@H](O)C1 2076823035 YHCIMQFRGKGJIM-ABAIWWIYSA-N 357.411 0.926 10 10 FCCE Cn1[nH]c(CNC(=O)OC(C)(C)C)nc1=NC(=O)c1cccc(O)c1O 2126734682 SAUSUCIEFJUJCU-UHFFFAOYSA-N 363.374 0.925 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)NCc1ccccc1O 2313908241 INSWJXTWQBJOQI-LBPRGKRZSA-N 372.443 0.946 10 10 FCCE Cn1cc(/C=C/C(=O)NCc2c(O)ccc3c2CCCC3)c(=O)n(C)c1=O 156337564 VXWWVAYTPIRHPI-CSKARUKUSA-N 369.421 0.998 10 10 FCCE CN(C)CCCN(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788309081 BKURBQYNKWOGRA-UHFFFAOYSA-N 362.474 0.550 10 10 FCCE CC[C@]1(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCNC1=O 865033145 CKHKTDSUBYVQQY-FQEVSTJZSA-N 374.485 0.850 10 10 FCCE c1cc(N2CCOCC2)ccc1Cn1nnnc1N1C[C@H]2COC[C@@H](C1)O2 1120125156 ACBJVZXIHUHOPL-CALCHBBNSA-N 372.429 0.162 10 10 FCCE CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 1350673335 IAYNNFGUQRSPJC-JCNLHEQBSA-N 361.442 0.823 10 10 FCCE COCC(=O)NCCC(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1546151974 NTCKURIDEKASAH-UHFFFAOYSA-N 372.805 0.700 10 10 FCCE O=C(N[C@H]1CCCCN1[C@@H]1C(=O)CSC1=O)c1cc(O)c(O)c(O)c1 1865876443 LKAWOPLAVGXXIU-CHWSQXEVSA-N 366.395 0.556 10 10 FCCE Cc1n[nH]c([C@@H]2CN(CC(=O)NCc3ccc(N(C)C)cc3)CCO2)n1 173668447 PFBNNBSLMPYIII-INIZCTEOSA-N 358.446 0.869 10 10 FCCE CCn1c(N)c(N(C)Cc2cc(F)cc(C(C)=O)c2O)c(=O)[nH]c1=O 175629320 ZPLVJYQDHJUXGU-UHFFFAOYSA-N 350.350 0.822 10 10 FCCE Cn1nnnc1CCNC(=O)NCc1cccc(Br)c1O 764803610 AXECGXCLTPGDDZ-UHFFFAOYSA-N 355.196 0.720 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CS(=O)(=O)N(C)C 819696728 BJXYYILXRVZOKH-UHFFFAOYSA-N 358.416 0.175 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCC(=O)N(C)C3)C2)cc1 828188305 MJROZZGCJCKLKD-KGLIPLIRSA-N 374.441 0.127 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CC(S(C)(=O)=O)C3)C2)cc1 854298171 XLTUZLVKLDVBAE-LBPRGKRZSA-N 353.444 0.712 10 10 FCCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@](O)(C(N)=O)C2)c1 861219745 ZQVRXEFZIUPHTO-IBGZPJMESA-N 355.394 0.969 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2CCN(CCn3cncn3)CC2)cc1 1634355968 QEQWRBSNHJLXAU-UHFFFAOYSA-N 356.390 0.899 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@@H]1C(=O)NCc1ccc(N)cc1 2136254822 AJJIHISVEBMECL-ZNMIVQPWSA-N 365.430 0.616 10 10 FCCE CNC1CN(S(=O)(=O)NCc2ccc(C)c(Br)c2O)C1 2380759441 ODSLOIGTKOEJIW-UHFFFAOYSA-N 364.265 0.701 10 10 FCCE COCCCNS(=O)(=O)[C@H]1CON(C)[C@H]1c1ccc(N(C)C)cc1 245328307 MVPQZVXUQKCGDJ-HOTGVXAUSA-N 357.476 0.995 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H](C)NC(N)=O)cc2)CC1 847858111 HMLVANWASVHYHF-CYBMUJFWSA-N 361.446 0.418 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)NCC34CC(CN3)C4)CC2)cc1 851686214 KQMVVJKXHHHODX-UHFFFAOYSA-N 372.469 0.648 10 10 FCCE C[C@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1323222185 GNVLVXCCUUYRSI-WMLDXEAASA-N 361.442 0.681 10 10 FCCE Cc1cc(C(=O)N2CC3(C[C@@H](O)CNC3=O)C2)c(C)n1-c1ccccn1 1347371630 UMISFTDPPPDNBP-CQSZACIVSA-N 354.410 0.812 10 10 FCCE CN(C)CCN1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 1440685824 ZYPVHEWYDDABFK-UHFFFAOYSA-N 370.475 0.083 10 10 FCCE O=C(O)[C@@H]1[C@H](O)[C@@H](O)CN1Cc1cc(Br)cc(F)c1O 2200843479 JFVYVQJHEUHXLP-ATZCPNFKSA-N 350.140 0.284 10 10 FCCE Cn1nccc1CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 766432493 LGPIYBPTTRQLGX-OAHLLOKOSA-N 355.442 0.981 10 10 FCCE C[C@H](O)[C@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 817811312 HJNPGGQQWRTVEV-SUMWQHHRSA-N 361.442 0.293 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCNC3=O)cc2)C1 852411302 SGVBQENBHTXBOP-HIFRSBDPSA-N 359.430 0.076 10 10 FCCE O=C(C(=O)N1CCC[C@H]1CN1CCOCC1)N1Cc2cccc(O)c2C1 1329799526 XPLBKUMASNNCNL-HNNXBMFYSA-N 359.426 0.558 10 10 FCCE O=C1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN1 105160743 IJZOSGBUKQXNTK-UHFFFAOYSA-N 350.394 0.694 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCOCC2(CC2)C1 788314141 YZTWTPMTLPKRBX-UHFFFAOYSA-N 373.453 0.778 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)C[S@](C)=O)C2)cc1 829182221 LPWKERHYVHRPLX-IZEVZFMRSA-N 367.471 0.273 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNCC3(CCO)CC3)CC2)cc1 843107690 IXJDMEDXAFXIKS-SFHVURJKSA-N 363.502 0.930 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCN4C[C@H](O)C[C@H]4C3)CC2)cc1 847041579 OWCZPDBZJRMTBH-ZWKOTPCHSA-N 374.485 0.095 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NCC[C@H]1CNC(=O)C1 1262289440 DDTKVDRKDTWSEG-HUUCEWRRSA-N 374.485 0.751 10 10 FCCE CCN(CC)c1ccc(CNC(=O)c2c[nH]nc2S(N)(=O)=O)cc1 1291711687 TUNCBLXPODVUGS-UHFFFAOYSA-N 351.432 0.833 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N[C@@H]1COC(=O)C1 1470753329 NVZFVWQWQOPXHE-ZDUSSCGKSA-N 367.427 0.036 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(C)CCC(=O)NC3)cc2)CC1 282118064 FISAGPBUGCWOOK-HXUWFJFHSA-N 372.469 0.888 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1[C@H]2CC[C@H]1CC(O)C2 284001671 KCFSSGVLSARULZ-IRXDYDNUSA-N 373.453 0.654 10 10 FCCE COc1ccc(S(=O)(=O)CCC(=O)OCC(=O)C(C)=O)cc1OC 808520209 OBZPVZRXKAJROA-UHFFFAOYSA-N 358.368 0.569 10 10 FCCE CCN(OC)C(=O)CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852392592 QZDJPXXJGJATTQ-CYBMUJFWSA-N 350.419 0.983 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN(CCO)C[C@H]3C)C2)cc1 854296684 FZNFNEDAWUDLON-HZPDHXFCSA-N 362.474 0.982 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@@H]3CCC[C@]3(CO)C2)c1 863227711 RPGFEQGVVHWVKW-MEDUHNTESA-N 354.428 0.998 10 10 FCCE CCN1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1=O 1119134794 SNYRKCKEALLOCB-ZDUSSCGKSA-N 350.394 0.245 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCCn2nncc2C1 1331664245 HBWGVTKDJJDUGD-UHFFFAOYSA-N 356.430 0.701 10 10 FCCE COC(=O)[C@]12C[C@H]1CCCN2C(=O)c1cc(NS(C)(=O)=O)ccc1O 1456098445 MCNWBSKSOCFUSB-HWPZZCPQSA-N 368.411 0.931 10 10 FCCE O=C(NCc1c(O)cccc1F)[C@H]1Nc2ccccc2S(=O)(=O)N1 1471975035 PWYFCLFVXRZMMI-AWEZNQCLSA-N 351.359 0.878 10 10 FCCE CCOC(=O)[C@H]1CN(Cc2ccccc2)C[C@H](C(=O)OCC)C(=O)C1=O 1542988763 GVXYHLBQGCLAFC-GJZGRUSLSA-N 361.394 0.999 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)Cn3ccccc3=O)CC2)cc1 299301570 BOBRBJNJPNZOIN-UHFFFAOYSA-N 370.453 0.795 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1[C@@H]2CCCO[C@H]21 780390804 HTOYNFIQLXPIGS-GVDBMIGSSA-N 364.467 0.963 10 10 FCCE CCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)OCC(=O)C(C)=O 808498773 VHEWDAYSWSQWOJ-SFHVURJKSA-N 358.350 0.687 10 10 FCCE CN1NN=C2C1=NCC[C@H]2C(=O)NCc1ccc(N2CCOCC2)cc1 816898264 WQHILXPMYSAFLO-OAHLLOKOSA-N 356.430 0.364 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3CCCN(C)C3)cc2)CC1 898329264 MIBSCFFNQVJUCW-QGZVFWFLSA-N 373.501 0.265 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CCOC2(CCS(=O)(=O)CC2)C1 1607601000 MRZOCSAFODYECY-UHFFFAOYSA-N 355.412 0.447 10 10 FCCE CN(C)c1ccc(CNC(=O)c2nc(S(N)(=O)=O)c3ccccn23)cc1 1624401277 COKFXGDCINQRJG-UHFFFAOYSA-N 373.438 0.978 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C[C@H]3CCC(=O)N3)cc2)CC1 1638489190 UMSFKZKMHYZHPZ-OAHLLOKOSA-N 358.442 0.673 10 10 FCCE CN(C)C(=O)c1cc(S(=O)(=O)NCCc2ccc(N)cc2)cn1C 193342086 KLWOKABZBKAUAC-UHFFFAOYSA-N 350.444 0.830 10 10 FCCE C[C@H](NC(=O)C(=O)N1C[C@H]2CC[C@H]1CN2)c1ccc(N2CCOCC2)cc1 817913326 YHCZBPFKNMJIHL-LESCRADOSA-N 372.469 0.663 10 10 FCCE CN1CCO[C@H](CS(=O)(=O)NCc2ccc(N3CCOCC3)cc2)C1 866582097 HCGNOTFQAAHVRO-KRWDZBQOSA-N 369.487 0.273 10 10 FCCE CO[C@@]1(CO)CCCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1330332569 AVZHNSAKRSVFHD-IBGZPJMESA-N 363.458 0.711 10 10 FCCE COCCn1cc(N2C[C@H](C(=O)NCc3ccc(O)c(O)c3)CC2=O)cn1 1465953473 GTZAJWGLSBXSAI-CYBMUJFWSA-N 374.397 0.610 10 10 FCCE CC(C)(C)OC(=O)N[C@H](C(=O)NCCCN=[N+]=[N-])C1CS(=O)(=O)C1 2020698308 RGAMYKGPISHJDN-JTQLQIEISA-N 361.424 0.741 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1C(=O)NCc1ccccc1O 2080587156 GWVKIMSNCFRTFI-BFHYXJOUSA-N 352.387 0.350 10 10 FCCE NC(=O)[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(CCOc2ccc(N)cc2)C1 2162939207 LRSMEZOOBUBZRW-PWSUYJOCSA-N 374.363 0.502 10 10 FCCE C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCS1(=O)=O 265713133 XBNNDRQKFXJXLZ-CQSZACIVSA-N 367.471 0.852 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NCCNC(C)=O)CC2)cc1 299319985 BTMGERWATGMJFJ-UHFFFAOYSA-N 363.462 0.253 10 10 FCCE CN(C)S(=O)(=O)CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 752641915 VUZQDPJMLDIIOY-CQSZACIVSA-N 356.444 0.791 10 10 FCCE CC(C)CN1CCO[C@H](CNC(=O)COC(=O)c2cccc(O)c2O)C1 758573100 OZPCFKZHFUYHHF-CYBMUJFWSA-N 366.414 0.728 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@H](n4cc(CO)nn4)C3)cc2N1 814906896 NEYODDZWPMRKFO-NSHDSACASA-N 374.357 0.851 10 10 FCCE CC(C)OC[C@H](N)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 851641670 OIDGMXPLJXBJAC-INIZCTEOSA-N 369.487 0.290 10 10 FCCE C[C@H](C(=O)NCc1ccc(O)cc1O)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 1142533661 PHHOVOIGXQAPDJ-QWPVENPASA-N 360.366 0.265 10 10 FCCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCO[C@]2(CCS(=O)(=O)C2)C1 1326349041 YCLHWOXAGKCRRF-ZENLRNHISA-N 353.396 0.527 10 10 FCCE CN(C)c1ccc([C@H](CNC(=O)NCc2cc(C(N)=O)no2)N(C)C)cc1 1680876664 MPEKCEKXFFIZHW-INIZCTEOSA-N 374.445 0.942 10 10 FCCE CN(C)c1ccc([C@H](NC(=O)[C@H](N)CCC(=O)O)c2nccn2C)cc1 1866022539 YKRPYIIMSUZXPW-ZBFHGGJFSA-N 359.430 0.884 10 10 FCCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNC(=O)c1cc(O)c(O)c(O)c1 2068625368 XUVLNYVEYQNJSC-MRXNPFEDSA-N 356.375 0.809 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)[C@@H](O)C1 2076819570 DFHCKJXVVDDFSS-JRPNMDOOSA-N 355.395 0.630 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)Cc3ccnn3C)CC2)cc1 278039328 SJPPBRWAKGGFMB-UHFFFAOYSA-N 357.458 0.910 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H](O)C1 702776975 VJCPBFHTNCLOSE-QWRGUYRKSA-N 353.375 0.450 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCN2C[C@H](O)C[C@H]2C1 823519297 GYQBWROUSNICLW-PKOBYXMFSA-N 374.485 0.608 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)NC[C@@H](C)S(N)(=O)=O)C2)cc1 823732406 FLMPUZGSTLRUCD-CHWSQXEVSA-N 370.475 0.498 10 10 FCCE CCC[C@@H](C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)S(N)(=O)=O 855223524 BCUPCZRQGWCNQK-WFASDCNBSA-N 355.460 0.847 10 10 FCCE NC(=O)C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 1328769919 FGXOTQWQYZRLDS-MRXNPFEDSA-N 362.430 0.309 10 10 FCCE Nc1nnn(CC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)n1 1566434121 HFZBEDUADOOKDJ-UHFFFAOYSA-N 370.461 0.104 10 10 FCCE CCN(Cc1cc(Br)ccc1O)C(=O)Cn1nnc(N)n1 1588193235 PQHRZKBZGVTIOX-UHFFFAOYSA-N 355.196 0.772 10 10 FCCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@H](O)[C@H](O)CCN1C(=O)OC(C)(C)C 2315986665 GXVGJXMJIZTJPV-GRYCIOLGSA-N 357.411 0.876 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3[C@H]4COC[C@H]43)CC2)cc1 794228277 XZIAIZATFYYQBT-VHWVOOQRSA-N 371.437 0.661 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)noc2C)C1 808497774 GKEVFGKHJBTEMC-GFCCVEGCSA-N 372.399 0.393 10 10 FCCE CN1C[C@@H](O)C[C@]1(C)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 900754501 JYZBETVXHFHNIK-AZUAARDMSA-N 361.486 0.967 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CCCn2nncc2C1)c1ccc(N(C)C)cc1 1119475475 MCHUKQNLAVYYKQ-CYBMUJFWSA-N 356.430 0.954 10 10 FCCE CNC(=O)CCCNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1328849034 IOCSKTSVUYLHAB-CYBMUJFWSA-N 362.430 0.033 10 10 FCCE COC(=O)C1=C[C@H](N=[N+]=[N-])[C@H](NC(C)=O)[C@H]([C@@H](OC)[C@H]2COC(=O)O2)O1 504791835 DMLIIKCIUVVBPP-KQKFNCTQSA-N 370.318 0.176 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCn3cccn3)C2)cc1 827335762 YGSGNIKWQQURAK-CQSZACIVSA-N 357.414 0.403 10 10 FCCE C[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c2ncnn21 827574916 JAIKZSKNNDKFDK-GWCFXTLKSA-N 360.393 0.922 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCN4C(=O)NC(=O)[C@@H]4C3)C2)cc1 854298570 FVTAOFVWHBBSCU-WFASDCNBSA-N 373.413 0.220 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2CCNC23CCC3)cc1 861794123 JZRVYMZZGZKAGW-KRWDZBQOSA-N 374.485 0.991 10 10 FCCE CS(=O)(=O)Nc1ccc(C(=O)NCCc2ccc(O)c(O)c2)cn1 1630335970 ZLKQUFHAJSDAIU-UHFFFAOYSA-N 351.384 0.837 10 10 FCCE C[C@H]1OC(=O)N[C@@H]1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1638488566 KPLSNWGKODXCKG-ABAIWWIYSA-N 360.414 0.501 10 10 FCCE CCOC(=O)CN(CCC(=O)N(C)CC(=O)OC)Cc1ccccc1O 1646326482 MMRKKTRMWWQWHG-UHFFFAOYSA-N 366.414 0.779 10 10 FCCE CC(=O)C(=O)COC(=O)C1(NS(=O)(=O)c2c(C)noc2C)CCCC1 808544229 MDRCBDUQYLIOHA-UHFFFAOYSA-N 372.399 0.584 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)c3ccc(S(N)(=O)=O)o3)C2)cc1 855232706 SUXVNZAWRIYWGH-NSHDSACASA-N 365.411 0.944 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CCS(=O)(=O)C[C@@H]2CCO)cc1F 915365208 BRFUEFOTJKALIO-ZDUSSCGKSA-N 373.450 0.583 10 10 FCCE C[C@]1(C2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)NC(=O)NC1=O 1182872726 YFDUKBFXTQNNTG-MRXNPFEDSA-N 351.334 0.687 10 10 FCCE Cn1ccn2c(CCNC(=O)/C=C\c3ccc(O)c(O)c3)nnc2c1=O 1303721227 URRNGLSEQWJWBO-HYXAFXHYSA-N 355.354 0.211 10 10 FCCE C[C@H](N)CNC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2080880241 JBQCWRPEJZFADB-JQWIXIFHSA-N 353.419 0.997 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@@H]1C(=O)Nc1ccc(N)cc1 2080898831 URNHUDCAACXIKW-MJBXVCDLSA-N 351.403 0.939 10 10 FCCE Cc1cc(/C=C2\NC(=O)NC2=O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 15912390 JXPUAEGUABUULM-ZSOIEALJSA-N 360.395 0.922 10 10 FCCE CC(C)[C@H](NC(N)=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 58998914 KVNVJQZMVKZBBZ-HNNXBMFYSA-N 352.410 0.971 10 10 FCCE COC[C@H](NC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)C1CC1 828579745 WBXDLXKSKDHVRZ-YOEHRIQHSA-N 361.442 0.931 10 10 FCCE CN(C)c1ccc([C@@H](N)CNC(=O)CC2(n3cnnn3)CCOCC2)cc1 852790795 BRANJEUCPKTSHK-INIZCTEOSA-N 373.461 0.451 10 10 FCCE O=C(CCc1nn[nH]n1)NCc1cc(F)c(N2CCOCC2)c(F)c1 868838688 NEYGQHKYXZINCY-UHFFFAOYSA-N 352.345 0.564 10 10 FCCE C[C@@H](C(=O)N1Cc2cccc(O)c2C1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 871202323 DPKGILGGCHUTCS-LKGZJPOGSA-N 356.378 0.785 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3[C@H](CN)C3(F)F)cc2)CC1 876909844 JYKKWDXVPLYJSN-HOTGVXAUSA-N 366.412 0.811 10 10 FCCE OCCOCC1(O)CCN(Cc2ccc(N3CCOCC3)cc2)CC1 895827069 JNTNRHMOCBJAKQ-UHFFFAOYSA-N 350.459 0.859 10 10 FCCE O=C(Cc1ccc(S(=O)(=O)CCO)cc1)NCc1ccc(O)cc1O 1639444548 PIAFNWZLQXFFHA-UHFFFAOYSA-N 365.407 0.723 10 10 FCCE Cc1noc(-c2ccc(NC(=O)C3=S=c4c(cc[nH]c4=O)=C3)cn2)n1 1641000135 KCOCPVIFRYHMIG-UHFFFAOYSA-N 353.363 0.718 10 10 FCCE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@H](O)[C@@H](O)C(=O)O)cccc21 1865946103 QZAAKJFZXZOQQB-HZPDHXFCSA-N 355.302 0.207 10 10 FCCE Nc1ccc(N2C(=O)[C@@H]3CS(=O)(=O)C[C@H]3C2=O)cc1Br 1924755228 IIBCPZSWGCMBAD-HTQZYQBOSA-N 359.201 0.565 10 10 FCCE COCCN(C(=O)[C@@H](C)Cc1ccc(O)c(O)c1)[C@H]1CCS(=O)(=O)C1 170245312 JANDYCMJYDNOOH-JSGCOSHPSA-N 371.455 0.939 10 10 FCCE CC(C)(C)N1C(=O)[C@@H]2[C@H](c3ccccc3O)N[C@](CO)(C(=O)O)[C@@H]2C1=O 248233318 LMQMIVHOKFXTCX-RSLFNQERSA-N 362.382 0.252 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)NCCCN3CCCC3=O)ccc21 283138410 DMZONPMSXWGULL-UHFFFAOYSA-N 372.469 0.814 10 10 FCCE Cn1cc(/C=C/C(=O)N2C[C@@H](CO)Cc3ccccc32)c(=O)n(C)c1=O 816784635 QYPHVRUTZZPWPE-GWJCSSMESA-N 355.394 0.295 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3cc(O)n(C)n3)CC2)cc1 824285409 HVEOAROVUCCLGH-UHFFFAOYSA-N 359.430 0.686 10 10 FCCE NC(=O)c1cn(C2CN(Cc3c(O)cccc3Br)C2)nn1 862389600 MFSSYDNQALOAJP-UHFFFAOYSA-N 352.192 0.902 10 10 FCCE CNS(=O)(=O)C[C@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 863340302 KAVQYKWRFDAFKG-XHDPSFHLSA-N 356.444 0.579 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc2c(c1)COB2O 863884639 OXKBUWUIUGTZKT-UHFFFAOYSA-N 369.182 0.815 10 10 FCCE CNS(=O)(=O)CCCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 868940877 ZNUAOPWPBRPDEQ-CYBMUJFWSA-N 370.475 0.512 10 10 FCCE CCN1CC[C@@H]1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1146666685 OZMGRIHMFDWMHP-MRXNPFEDSA-N 351.472 0.632 10 10 FCCE CNC(=O)N[C@H]1CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 1478956255 DUOYAZPMIYLXOZ-UONOGXRCSA-N 361.446 0.987 10 10 FCCE COC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)NCc1cccc(Cl)c1O 1565166703 WNYRVZDILBQLLW-IUCAKERBSA-N 357.794 0.911 10 10 FCCE CN(C)S(=O)(=O)[C@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 1773109805 MFZHJKLMHJWXAZ-WOLRVDTOSA-N 354.428 0.993 10 10 FCCE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)c1cc2c(cc1N)OCC(=O)N2 2106704192 BSUYEPZTMGZDIB-JTQLQIEISA-N 366.418 0.922 10 10 FCCE COc1cc(C(=O)NCC(=O)OCC(=O)C(C)=O)cc(OC)c1OC 808494812 JQAOMDOQTAFFCJ-UHFFFAOYSA-N 353.327 0.144 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCN(C3CCC3)C2=O)c1 863836704 AFBTWIWRNOQAEJ-CYBMUJFWSA-N 367.427 0.647 10 10 FCCE O=C(CNC(=O)CNC(=O)NCc1ccccc1O)NCc1ccccc1 1479284554 VFOORWKTWCXSFQ-UHFFFAOYSA-N 370.409 0.624 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/Cn1cncn1 1624658288 DCSLAFWRSNAYHI-OOPCZODUSA-N 360.370 0.536 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2081034344 GSCOCHAZQVWQAC-HBNTYKKESA-N 355.395 0.534 10 10 FCCE CCOC(=O)[C@@H]1CCCN1S(=O)(=O)Nc1ccc(O)cc1C(=O)O 274928117 OHJXICNORIGGRE-LBPRGKRZSA-N 358.372 0.775 10 10 FCCE CC1=C(C(=O)O)N2C(=O)[C@H](NC(=O)[C@@H](N)c3ccccc3O)[C@H]2SC1 503996015 CUXVKLLSHPANDN-ZIBATOQPSA-N 363.395 0.151 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCN(C)[C@@H](C)C3)C2)cc1 828144110 SIONJHOSIIMMBH-XHSDSOJGSA-N 374.485 0.989 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CCC4(COC4)C3)C2)cc1 829711298 PDWYUKVSOFKSHW-OAHLLOKOSA-N 373.453 0.887 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)c3c(CN)cnn3C)cc2)CC1 876909914 MJJSPHGKZCKQFH-UHFFFAOYSA-N 370.457 0.477 10 10 FCCE COc1ccc(N2CCN(C(=O)C3CN(C)CCN(C)C3)CC2)cc1F 906950416 PNKQOGSUQNIQID-UHFFFAOYSA-N 364.465 0.976 10 10 FCCE Cn1nc2c(c1C(=O)NCc1ccc(O)cc1O)CS(=O)(=O)CC2 1570463262 KWBZLJFNYSCZPZ-UHFFFAOYSA-N 351.384 0.232 10 10 FCCE Nc1ccc(-n2nnc(C(=O)N3CCN(c4ccccn4)CC3)n2)cc1 1857878983 QXTNQHHKBCDPOO-UHFFFAOYSA-N 350.386 0.602 10 10 FCCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)[C@@H](CN)C1 2132403267 IROGUONXBIQDKJ-NSHDSACASA-N 367.402 0.824 10 10 FCCE O=C(O)CNC(=O)CN1C(=O)C(=Cc2cccc(O)c2)SC1=S 2314827344 CACMWGFNTMYQSX-UHFFFAOYSA-N 352.393 0.794 10 10 FCCE Cc1cc(=O)oc2cc(O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3N=[N+]=[N-])ccc12 575417064 JZSHWIUBDQNWDV-CHUNWDLHSA-N 363.326 0.598 10 10 FCCE CN(C)C[C@]1(O)CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 788206756 WHMZVDDMYTYLSB-MRXNPFEDSA-N 371.459 0.292 10 10 FCCE CO[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCOC1 855211013 PFBCVUHJQNOWSX-HZMBPMFUSA-N 358.416 0.545 10 10 FCCE COc1ccc2c(c1)N(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)CCO2 1329774753 PMLGMMVTOBSLQD-DAXSKMNVSA-N 357.366 0.531 10 10 FCCE CC[C@@](COC)(NCC(=O)NCc1ccc(N(C)C)cc1)C(=O)OC 1460206039 HKCZRLIVOKCFHT-SFHVURJKSA-N 351.447 0.927 10 10 FCCE CNC(=O)CCn1c([C@@H]2CCC(=O)N2)nnc1N(C)Cc1ccccc1O 1517596463 COWQSVAFRJIDJA-ZDUSSCGKSA-N 372.429 0.707 10 10 FCCE COc1cccc(CNC(=O)CN2CCCC3(CC3)S2(=O)=O)c1O 1528037068 LDTBBIIIGCVQNH-UHFFFAOYSA-N 354.428 0.975 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)NCc1ccc(N2CCOCC2)cc1 1626693996 XHXYQCHTKPQBHE-UHFFFAOYSA-N 355.460 0.421 10 10 FCCE NS(=O)(=O)CCCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1686915645 JCJVASFWQZXWQJ-UHFFFAOYSA-N 370.475 0.126 10 10 FCCE [N-]=[N+]=N[C@@H](COc1cccc(C(=O)NCCN)c1)OCCOCC(=O)O 201136360 MOFDILKXGCXADO-CYBMUJFWSA-N 367.362 0.508 10 10 FCCE O=C(CNC(=O)c1ccccn1)NCc1ccc(N2CCOCC2)cc1 739706629 SKOGPTOCCIRHSH-UHFFFAOYSA-N 354.410 0.964 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCCN(C)C3)CC2)cc1 804318548 NMQQWSHLBASPTK-MRXNPFEDSA-N 374.485 0.991 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1 808505250 WFPWATKCTFIRRP-NSHDSACASA-N 359.425 0.993 10 10 FCCE O=C1N[C@@H](CCF)C(=O)N1Cc1ccc(N2CCS(=O)(=O)CC2)cc1 849359066 JJXKJUJTELWOKT-AWEZNQCLSA-N 369.418 0.701 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](F)[C@@H]3CCNC3)cc2)CC1 876909611 CXJMRJHVUMRXGM-AEFFLSMTSA-N 362.449 0.919 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)NCC[C@H]3CCCO3)cc2)CC1 897401605 UNSZGMFPSLDPJS-GOSISDBHSA-N 374.485 0.740 10 10 FCCE Cc1nc(S(=O)(=O)NCCC(=O)NCc2ccc(O)cc2O)cn1C 1451763927 CFPNSCWJNVHFMT-UHFFFAOYSA-N 368.415 0.125 10 10 FCCE C[C@@H](NC(=O)Cn1cnnn1)C(=O)NCc1ccc(N2CCCCC2)cc1 1452054770 XKVRTSBLEOTEGA-CQSZACIVSA-N 371.445 0.485 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CC[C@@H](CNS(C)(=O)=O)C2)cc1 1460735217 UEIKCQFTLFAEHF-HNNXBMFYSA-N 368.503 0.240 10 10 FCCE Cc1ccc(O)c(CNC(=O)NCc2nc(CS(C)(=O)=O)n[nH]2)c1 1685415648 PMVXXTSMTWLNAG-UHFFFAOYSA-N 353.404 0.363 10 10 FCCE C[C@@H](NC(=O)NCCS(=O)(=O)N=S(C)(C)=O)c1ccccc1O 1687642701 HGMHBZIGEMBQCU-SNVBAGLBSA-N 363.461 0.810 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H]3C[C@H]3C(=O)N3CCOCC3)CC2)cc1 243473408 NKKACYROSHECRU-ZWKOTPCHSA-N 373.453 0.839 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NC[C@@H](C)CO)CC2)cc1 299326498 GEIVBKKIEXYKCR-OAHLLOKOSA-N 350.463 0.745 10 10 FCCE C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCS1(=O)=O 738544265 LJHAUPYQEBQBOH-SECBINFHSA-N 362.429 0.023 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN3C(=O)OCC[C@H]3C2)c1 765405389 TWNWZSGTLSXNKX-NSHDSACASA-N 369.399 0.430 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC3CCNCC3)C2)cc1 851687925 LIOAVTHHKQUIHS-OAHLLOKOSA-N 360.458 0.506 10 10 FCCE Cn1c(O)ncc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1=O 856211848 CSESGRLIVJBETA-UHFFFAOYSA-N 358.398 0.377 10 10 FCCE COC(=O)COCCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 858599869 QYQAOMZXQPHFDX-CYBMUJFWSA-N 351.403 0.763 10 10 FCCE CC[C@@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCNC1=O 1125257674 PACYIIAWYCZYIN-MGPUTAFESA-N 372.469 0.921 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC(F)(F)C[C@H]1CO 1323279667 QYGPSIVIYQQXEA-AWEZNQCLSA-N 355.385 0.906 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCC(=O)N(C)CC2)cc1 1350682597 QWFFTIUKAQADJB-UHFFFAOYSA-N 360.458 0.840 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC1(O)CCOCC1 1447342619 AJVYASLEECKBKK-ZDUSSCGKSA-N 367.398 0.620 10 10 FCCE CN(C)S(=O)(=O)NCCNC(=O)NCc1cccc(Cl)c1O 1672942675 GZMXTYYEIXCQLH-UHFFFAOYSA-N 350.828 0.241 10 10 FCCE COC(=O)/C=C\c1ccc(N2CCC3(CC2)NC(=O)NC3=O)c([N+](=O)[O-])c1 1772831298 LLNDQZJBNRSFPA-HYXAFXHYSA-N 374.353 0.959 10 10 FCCE COCCCN(C(=O)c1cc(O)c(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1 1866303384 SZLSXZVBUYXNRQ-LLVKDONJSA-N 359.400 0.469 10 10 FCCE CC(=O)OC[C@H]1O[C@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@@H]1OC(C)=O 85483058 QKGHBQJLEHAMKJ-BJJPWKGXSA-N 373.318 0.380 10 10 FCCE CC1(C)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCN1CCO 780631679 UZYIAKNIMAGMRT-UHFFFAOYSA-N 350.375 0.819 10 10 FCCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@H](C)S1(=O)=O 811867310 RFSDOBXNZXYGHY-IUCAKERBSA-N 355.372 0.938 10 10 FCCE Cc1nnc(CN(C)CC(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)n1C 832280636 PSMCGMOFBSAZDI-MRXNPFEDSA-N 359.478 0.438 10 10 FCCE CO[C@](C)(CO)CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 847291138 JEUNUEOLRLXGHB-SFHVURJKSA-N 369.437 0.983 10 10 FCCE CCOC(=O)[C@@H]1NC(=O)N(Cc2ccc(N3CCN(C)CC3)cc2)C1=O 925079502 JMDLNCUQNZBXEJ-OAHLLOKOSA-N 360.414 0.422 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3[C@H]4CNCC[C@H]43)cc2)CC1 1343647292 HMGCPTUJBZYTCE-QYZOEREBSA-N 356.470 0.827 10 10 FCCE CO[C@@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 1347071786 QRIRWTXZUUBJJI-NVXWUHKLSA-N 361.442 0.823 10 10 FCCE C[C@H](O)[C@@H](NC(=O)C1CCCC1)C(=O)NCCc1ccc(O)c(O)c1 1545669257 RNDJKRVAJJVJQK-MEDUHNTESA-N 350.415 0.812 10 10 FCCE CN(C[C@@H](O)c1cccnc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1647563114 XDXBAGDQAKGBJK-OAHLLOKOSA-N 365.411 0.964 10 10 FCCE CN(C)c1ccc([C@H](NC(=O)[C@@H](N)CCC(=O)O)c2nccn2C)cc1 1866022538 YKRPYIIMSUZXPW-HOCLYGCPSA-N 359.430 0.884 10 10 FCCE C[C@H](NC(=O)OC(C)(C)C)c1nnc(COc2nnc(=N)[nH]n2)s1 2213785039 IERHADDJBPROGE-LURJTMIESA-N 354.396 0.695 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)O[C@@H]2C1 2265036392 DYWXGOTZDPCYTE-XSXPHNMFSA-N 368.430 0.655 10 10 FCCE CCN(CCN=[N+]=[N-])C(=O)[C@H]1[C@@H](O)[C@@H](O)CCN1C(=O)OC(C)(C)C 2315986668 GXVGJXMJIZTJPV-TUAOUCFPSA-N 357.411 0.876 10 10 FCCE Cn1cc(/C=C/C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(=O)n(C)c1=O 29251781 BFSIIBDURRJEML-GQCTYLIASA-N 356.338 0.595 10 10 FCCE C[C@H]1CO[C@H](CO)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 221139255 WCYXLNDCHUNNLS-UVPNAGLESA-N 356.220 0.987 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCOCC3=O)CC2)cc1F 279320665 PIDKSHZBFNEXAD-UHFFFAOYSA-N 351.378 0.342 10 10 FCCE Cn1ccnc(N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)c1=O 779526809 YAMYABYLCDWOPR-HWKANZROSA-N 356.382 0.554 10 10 FCCE COc1ccc(CNC(=O)N[C@@H]2CCC[C@H]2CNS(C)(=O)=O)c(O)c1 800055037 MHBWGDQXYTYURO-SMDDNHRTSA-N 371.459 0.918 10 10 FCCE COc1cccc(CNC(=O)N[C@H]2CCC[C@H]2CNS(C)(=O)=O)c1O 800747763 PZDRQLOJKNRZKI-AAEUAGOBSA-N 371.459 0.918 10 10 FCCE Nc1ccc(OCCOn2c(=O)c(=O)oc3cc(C(=O)O)ccc32)cc1 821297410 SWCAFQDQYNBZLV-UHFFFAOYSA-N 358.306 0.743 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@H]3CCCOC3)C2)cc1 827312242 BZUCZQPAVOWGSC-CABCVRRESA-N 361.442 0.933 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3ncncc3OC)C2)cc1 850536545 HEJSQABOEATOKG-LBPRGKRZSA-N 371.397 0.827 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)NCC12CC(CN1)C2 851692167 XGGGNNDXDWHQLS-UHFFFAOYSA-N 372.469 0.132 10 10 FCCE O=C(O)c1cnn2c(O)cc(CN3CCS[C@@H]4COCC[C@@H]43)nc12 1118318311 DPVGWMJMIBIZBO-NWDGAFQWSA-N 350.400 0.839 10 10 FCCE CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cccc(C(N)=O)c2)cc1 1323470305 VVDNVOSUZMKKSD-UHFFFAOYSA-N 369.424 0.958 10 10 FCCE CN(C(=O)c1ccc(N=NC(N)=O)cc1)[C@H]1CCN(S(C)(=O)=O)C1 1450110204 GRPVLUXGHGKSLP-LBPRGKRZSA-N 353.404 0.955 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCN([C@@H]4CCC[C@H]4O)CC3)cc2N1 378157447 HFINEUCJQRZSJN-IUODEOHRSA-N 362.386 0.961 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCN3CCOC[C@H]3C2)cc1F 803664422 INIRTYHBMMKREE-CQSZACIVSA-N 364.421 0.051 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1 808497095 HSFSWMQWDOLBLT-LJQANCHMSA-N 370.361 0.829 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@H]2COC[C@@H]2C1 827079594 YHQWNQRTCSAKEE-IRXDYDNUSA-N 373.453 0.634 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@@H](O)[C@@H]3C)CC2)cc1 836882174 RPUVAMORCBKNDA-BUSQMGNYSA-N 373.453 0.882 10 10 FCCE COc1ccc(CNC(=O)C(C)(C)NC(=O)C(C)(C)NC(C)=O)c(O)c1 861490385 SLPUVJJGEHSICS-UHFFFAOYSA-N 365.430 0.827 10 10 FCCE Cc1ccc(C(=O)N[C@H]2CCN(c3ccc4nncn4n3)C2)c(O)c1O 862787515 QOZNRUONURVAQL-NSHDSACASA-N 354.370 0.853 10 10 FCCE CN1CCOC[C@]1(CO)CNC(=O)NCCCSc1nccs1 921447506 LEPTYXCAWREYRF-CQSZACIVSA-N 360.505 0.618 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1c[nH]nc1S(N)(=O)=O 1162116379 ZHLQKBIFBVJSJC-NSHDSACASA-N 365.459 0.793 10 10 FCCE NC(=O)c1nccnc1NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1559232306 BBJPACFSHFAVDG-UHFFFAOYSA-N 361.427 0.422 10 10 FCCE CN(C)c1ccc([C@@H](CNC(=O)NCc2cc(C(N)=O)no2)N(C)C)cc1 1680876665 MPEKCEKXFFIZHW-MRXNPFEDSA-N 374.445 0.942 10 10 FCCE NC(=O)[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(CCc2ccc(N)cc2)C1 2106666496 MFKGGNHLBKZHGL-WCQYABFASA-N 358.364 0.666 10 10 FCCE CN(C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1ccc(=O)n(C)c1 2224796782 PIHSAZIKOTVWFC-UONOGXRCSA-N 363.414 0.932 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3cccn(C)c3=O)CC2)cc1 56965723 ABVGDMMUIGMPAL-UHFFFAOYSA-N 370.453 0.946 10 10 FCCE Cc1noc(-c2ccn3c(CNC(=O)c4cc(O)nc(O)c4)nnc3c2)n1 238876181 OCCQCUMWHCHJMC-UHFFFAOYSA-N 367.325 0.824 10 10 FCCE Cn1c(O)ncc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1=O 267568559 GXRXPOGVKTVCKM-UHFFFAOYSA-N 362.361 0.392 10 10 FCCE CC(=O)C(=O)COC(=O)c1ccc(Br)c(S(N)(=O)=O)c1 808503095 FKMYMXPDLCFTIU-UHFFFAOYSA-N 364.173 0.411 10 10 FCCE OC1CCN(c2ccc(CNC[C@@H](O)CN3CCOCC3)cc2F)CC1 819120724 DZGYSJOSKWWQMN-QGZVFWFLSA-N 367.465 0.570 10 10 FCCE CN(C)C(=O)CCN1CCC(NC(=O)c2c(F)ccc(O)c2O)CC1 825785872 DMKCGCWIVNLOTL-UHFFFAOYSA-N 353.394 0.909 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H](C)Cn2cncn2)cc1 846726948 LZBNYZQQUKTTAP-AWEZNQCLSA-N 374.445 0.386 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCCCCS(N)(=O)=O)C2)cc1 854093500 HWOOZRPKSAZSQY-ZDUSSCGKSA-N 370.475 0.642 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3CCC[C@@H]3O)CC2)cc1 871112774 IEOQZAQQVJPHAG-WBNOOXNUSA-N 373.453 0.930 10 10 FCCE O=C(C(=O)N(CCN1CCOCC1)CC1CC1)N1Cc2cccc(O)c2C1 1329874884 XQMCQQKQOFCBHC-UHFFFAOYSA-N 373.453 0.805 10 10 FCCE CC[C@@]1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCNC1=O 1616600393 RZNAPFQHMWUEQF-HXUWFJFHSA-N 372.469 0.921 10 10 FCCE C[C@H]1OC(=O)N[C@H]1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1638488567 KPLSNWGKODXCKG-IAQYHMDHSA-N 360.414 0.501 10 10 FCCE OCC(CO)(CO)CNCc1cc(Cl)cc(Br)c1O 2123229261 WBEPDUPJEIMEAF-UHFFFAOYSA-N 354.628 0.861 10 10 FCCE COc1ccc(N2CCN(S(=O)(=O)[C@@H](C)C(=O)N(C)C)CC2)cc1 278183854 HEESDBWVSUFJIO-ZDUSSCGKSA-N 355.460 0.624 10 10 FCCE COC(=O)c1ccc2c(c1)CCN2C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 819798447 DHRDKVPWJLNSLB-ALCCZGGFSA-N 369.377 0.473 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(C)CCC(=O)N3)cc2)CC1 822320737 PDIWTTSTBJZIIV-IBGZPJMESA-N 358.442 0.640 10 10 FCCE CN1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1=O 822659764 FWHZTDJMYJEQBZ-WBVHZDCISA-N 372.469 0.873 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3cc(OC)n(C)n3)C2)cc1 850537413 QLSUMGQAHIMJJJ-GFCCVEGCSA-N 373.413 0.771 10 10 FCCE COc1ccc(N2CCC(NC(=O)NC[C@@H](C)S(N)(=O)=O)CC2)cc1 853642758 LFQRUIQKCUNZAC-GFCCVEGCSA-N 370.475 0.640 10 10 FCCE Nc1ccc(NC(=O)C(=O)NC[C@@H]2CN(Cc3ccncc3)CCO2)cc1 861530305 WBELIIIVXRQMDG-QGZVFWFLSA-N 369.425 0.620 10 10 FCCE CCOCc1cc(CNC[C@@]23COCCN2C(=O)COC3)ccc1OC 865800087 GFRXJMPBFHZEQY-IBGZPJMESA-N 364.442 0.949 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@]1(CO)COCCN1C 919081951 OYCGSAMQXLSRMM-SFHVURJKSA-N 350.463 0.553 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1C[C@@H](O)CN1c1ccncn1 1297562475 MBMVNRAVTRZWGV-CHWSQXEVSA-N 363.414 0.924 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC3=C(CCC(=O)N3)C2)cc1 1327854597 FOUBWPMEMDDNBH-UHFFFAOYSA-N 356.426 0.765 10 10 FCCE Cc1nc(S(=O)(=O)NCC(=O)N[C@H](C)c2ccccc2O)cn1C 1557966468 CGXGTWLHGDZBCO-SNVBAGLBSA-N 352.416 0.590 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C[C@H]2CNC(=O)O2)nn1 1638347095 CITFAMJULLWNAJ-MWLCHTKSSA-N 361.358 0.159 10 10 FCCE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@H]1OC 2140536891 XUSIILJBJUUOSF-CRIQSBETSA-N 370.446 0.901 10 10 FCCE Cc1ccc(CN[C@H]2CS(=O)(=O)C[C@H]2O)c(O)c1Br 2352676419 PHRGZXCFMRHKAH-VHSXEESVSA-N 350.234 0.711 10 10 FCCE CN(C(=O)Cn1cc(Br)c(=O)[nH]c1=O)c1ccc(N)cc1 88452893 JZHFRRVOGBUNJQ-UHFFFAOYSA-N 353.176 0.544 10 10 FCCE CS(=O)(=O)N1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761869856 DYFGTRSTEUVZGN-UHFFFAOYSA-N 356.360 0.007 10 10 FCCE CO[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@H]1CCOC1 827575001 LTMHJSUPDSWJRK-BBRMVZONSA-N 367.421 0.676 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@H]3[C@H]2CCCN3CCO)cc1 929236828 DMIOYSUEKDRQAE-QZTJIDSGSA-N 374.485 0.426 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3CCC(=O)NC3)cc2)CC1 1471912613 QXKHJRCZFOVXTL-OAHLLOKOSA-N 358.442 0.531 10 10 FCCE Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@H](C(N)=O)[C@@H](C(N)=O)C2)cc1 1557689122 GWSWVZWKLLZERX-HOTGVXAUSA-N 354.410 0.753 10 10 FCCE COc1ccc(CNC[C@H](C)N(C)C(=O)[C@H]2CC[C@@H](C(N)=O)O2)cc1C 1568300552 SMIWWPQHHBFKSZ-RRQGHBQHSA-N 363.458 0.973 10 10 FCCE CSCC[C@@]1(C(=O)O)N[C@@H](c2ccccc2O)[C@@H]2C(=O)N(C)C(=O)[C@H]21 104879580 BRPXHRAJUASVQS-ZOPJHEKZSA-N 364.423 0.844 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN(C)CC3(CO)CC3)CC2)cc1 782598927 FLICYEDCSXMMBW-SFHVURJKSA-N 363.502 0.882 10 10 FCCE CNC(=O)CN(C)c1ccc(CO)cc1S(=O)(=O)N1CCC(C)CC1 823819599 ALWCAAKPLSUMJF-UHFFFAOYSA-N 369.487 0.782 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCOC3CNC3)cc2)C1 827469288 TWYLCDLNTFEXGS-OAHLLOKOSA-N 360.458 0.383 10 10 FCCE CC(C)C[C@H](NC(=O)C(=O)Nc1ccc(N)cc1)C(=O)NCCN(C)C 841111053 ACFZWAGRSVJGEA-HNNXBMFYSA-N 363.462 0.416 10 10 FCCE COc1ccc(N(CC(=O)O)CC(=O)NC[C@@H](OC)[C@H]2CCOC2)cc1 853010551 FOQDIDIFZSSODV-XJKSGUPXSA-N 366.414 0.754 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@H]3CC[C@@H](C)NC3)C2)cc1 861783160 SIMVBBWTHCFGNH-OAGGEKHMSA-N 374.485 0.894 10 10 FCCE O=C(NCc1ccc2cccnc2c1O)[C@H]1C[C@H](O)CN1c1ccncn1 1162612803 QIYAIWPFCBFOAI-LSDHHAIUSA-N 365.393 0.986 10 10 FCCE CNC(=O)N[C@@H]1CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 1478956254 DUOYAZPMIYLXOZ-KGLIPLIRSA-N 361.446 0.987 10 10 FCCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1n[nH]c(=O)[nH]1 92126619 XGUAVTJDMXWMFH-UHFFFAOYSA-N 356.430 0.560 10 10 FCCE CN(CCCn1c(=O)c2c(ncn2C)n(C)c1=O)c1ccc2c(c1)OCO2 121408619 QJLPDRYFUZJOPT-UHFFFAOYSA-N 371.397 0.689 10 10 FCCE COCCc1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)n(C)n1 125226355 PSHNVHBVPGOKJL-UHFFFAOYSA-N 359.430 0.930 10 10 FCCE CN(CCCCO)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 283774120 DJFYAXZBLOTYLH-UHFFFAOYSA-N 367.421 0.509 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H](O)Cc1cnn(C)c1 786709737 VCYVQFIYOMCVFH-GOSISDBHSA-N 358.442 0.819 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCNC(=O)CC1 1117757737 CIMYZRPWQVEJSP-STQMWFEESA-N 364.398 0.605 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(CC2CCOCC2)CC1 1119005150 KUSUSBNBGJOZBE-UHFFFAOYSA-N 373.453 0.805 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)Nc1cnn(CC(=O)N2CCOCC2)c1 1136897499 XNMXLVMWKPUQMK-UHFFFAOYSA-N 360.370 0.334 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(N2CCCNC2=O)CC1 1351844620 JVMLUQPSBNOILZ-UHFFFAOYSA-N 372.425 0.641 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)NCc1ccc(N)cc1 2311667323 CYUMTFCSJXBOFX-HZSPNIEDSA-N 351.403 0.226 10 10 FCCE CCOC(=O)[C@H](CCOC)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 281576931 LUHFTUDFMCLKGY-LBPRGKRZSA-N 374.415 0.462 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCN(CC(F)F)CC2)cc1 283356013 DYPRMZHNWZHAEX-UHFFFAOYSA-N 354.401 0.778 10 10 FCCE O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@H]1CCN1 827543584 DHXWTIOSQBXFKP-MRXNPFEDSA-N 370.432 0.920 10 10 FCCE CC(=O)c1cc(Cl)cc(CN2CCN3[C@@H](CNS3(=O)=O)C2)c1O 933106458 LLVPNUBQQRBIAR-LBPRGKRZSA-N 359.835 0.582 10 10 FCCE COc1ccc(N2CCCN(C(=O)NCCCS(N)(=O)=O)CC2)cc1 1252419276 VQKYTLRGGNBOIX-UHFFFAOYSA-N 370.475 0.596 10 10 FCCE CC1CCN(c2ccc(CNC(=O)C(=O)NCc3cn(C)nn3)cc2)CC1 1328857017 GQLGPNQMPIIDKR-UHFFFAOYSA-N 370.457 0.984 10 10 FCCE Cn1nnnc1-c1ccc(NC(=O)C2=S=C(S(C)(=O)=O)C=C2)cc1 1539174218 FPVDPOWVWHYOIK-UHFFFAOYSA-N 363.424 0.466 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3nsnc3O)cc2)C1 1542180271 GAQXAFGSROURIU-LLVKDONJSA-N 361.427 0.875 10 10 FCCE CO[C@H]1CS(=O)(=O)C[C@H]1NC1CCN(c2ccc3c(c2)OCO3)CC1 1616137651 XGLPBUBRWWFCBU-PBHICJAKSA-N 368.455 0.786 10 10 FCCE CS(=O)(=O)Nc1nc(CC(=O)NCCc2ccc(O)c(O)c2)cs1 1860357775 QSODPDDEQGZEOO-UHFFFAOYSA-N 371.440 0.827 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC[C@H](O)CF 2124089254 MGVDAENSEXPEMP-NEPJUHHUSA-N 372.393 0.980 10 10 FCCE Nc1ccc(N(C(=O)C(=O)NCCN2CCNCC2)c2ccccc2)cc1 170368418 TXWUHEVKXNVOBL-UHFFFAOYSA-N 367.453 0.955 10 10 FCCE COc1ccc(N2CCN(C(=O)c3coc(S(N)(=O)=O)c3)CC2)cc1 757626705 CLRNKZRBOONUCI-UHFFFAOYSA-N 365.411 0.898 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(CO)C3)CC2)cc1 773939553 CABHNMHOPPSKTD-VOTSOKGWSA-N 359.426 0.351 10 10 FCCE COCCCn1nc(C(=O)OCC(=O)c2ccc(O)c(O)c2)ccc1=O 849851473 DBCSXJXPNDVYIP-UHFFFAOYSA-N 362.338 0.731 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCNC34CCC4)C2)cc1 861794484 RYHHUFZDQLRLSZ-YOEHRIQHSA-N 372.469 0.791 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3CCNC(=O)CC3)cc2)CC1 1471912686 UNIZZDNBZIAKJM-MRXNPFEDSA-N 372.469 0.921 10 10 FCCE CCn1cc(CC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)nn1 1535156821 QDGVDICDTHZPKO-UHFFFAOYSA-N 370.457 0.859 10 10 FCCE O=C(NCCNS(=O)(=O)c1cccnc1)N1Cc2cccc(O)c2C1 1633419332 ZFISGQCBYHCBRO-UHFFFAOYSA-N 362.411 0.791 10 10 FCCE Nc1ccc(-n2nnc(C(=O)N=c3[nH]nc([C@@H]4CCCO4)s3)n2)cc1 1857878795 NHQKHZIQGWVHJG-JTQLQIEISA-N 358.387 0.622 10 10 FCCE Cn1cccc1C=C1SC(=S)N([C@H](CCC(N)=O)C(=O)O)C1=O 2314541802 QITHPCWXFFJHFG-SECBINFHSA-N 353.425 0.945 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H]4CN(C)C[C@@H]43)CC2)cc1 794929562 MDDJLZFWIJHVLI-CUWPLCDZSA-N 374.529 0.814 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CC[C@H]4CN(C)C[C@@H]43)CC2)cc1 794931197 ZQWMNZLYKXFHAV-LPHOPBHVSA-N 358.486 0.980 10 10 FCCE O=C(NCCCn1ccnn1)C(=O)NCc1ccc(N2CC=CC2)cc1 806997021 ADKZYLKFKVFOOD-UHFFFAOYSA-N 354.414 0.477 10 10 FCCE CC(=O)C(=O)COC(=O)c1ccc(-n2cc(Br)cn2)nn1 808523116 JPOFLMXWXZBQCI-UHFFFAOYSA-N 353.132 0.740 10 10 FCCE COC(=O)[C@@H](NCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccnn1C 830388452 HIOAJPYREOYWLX-SFHVURJKSA-N 373.457 0.948 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CNCC[C@@H]3C)CC2)cc1 842186701 JHFPLTHCAYMEDY-KSSFIOAISA-N 374.485 0.894 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3ncc(OC)cn3)C2)cc1 850537312 PCTDEPHFOPTTDL-LBPRGKRZSA-N 371.397 0.827 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCC34COC4)CC2)cc1 854837675 OEGYQHLLEBIOQJ-SREVYHEPSA-N 371.437 0.901 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N1C[C@@H](N)C(C)(C)C1 903715376 ULBFGRXCPFCCPT-QGZVFWFLSA-N 374.485 0.677 10 10 FCCE O=C(NCCCNC1CC1)C(=O)C(=O)C(=O)NC[C@H]1C[C@H]2C=C[C@H]1CC2 1326036181 DPMSTXXVRPVCEU-MELADBBJSA-N 361.442 0.101 10 10 FCCE CN(C)c1ccc(CNC(=O)c2nc3ncc(CCO)cn3n2)cc1F 1442477345 ZXBUFSQQDLYZJO-UHFFFAOYSA-N 358.377 0.794 10 10 FCCE COc1ccc(CNC(=O)CNS(=O)(=O)c2ccccc2N)c(O)c1 1556354219 BXGJDUFCIUSMJH-UHFFFAOYSA-N 365.411 0.578 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]4CCNC(=O)[C@H]43)nc12 1659924741 ADTXFBGTOVJMQA-NHYWBVRUSA-N 373.413 0.712 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H]1CNCC(=O)N1 1952346474 MGSHGXRJILJDDQ-NWDGAFQWSA-N 351.403 0.622 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNCc1ccc(O)c(O)c1O 2225620951 AJNQRNBCTDPDTJ-VHRBIJSZSA-N 370.402 0.234 10 10 FCCE CCc1cccc2c(C=C3C(=O)NC(=S)N(C)C3=O)cn(CC(N)=O)c12 2313623730 BIPHWWXLNDKIJK-UHFFFAOYSA-N 370.434 0.946 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCc3cn(C)cn3)C2)cc1 829638149 OEGWDDMTDHITRH-HNNXBMFYSA-N 371.441 0.483 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)/C=C/Cn3cncn3)CC2)cc1 900407653 SEFSRQNGRWVLOZ-NSCUHMNNSA-N 370.457 0.781 10 10 FCCE CC[C@@H](CN1CCOCC1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1303791263 XGVWFANEZYWLDD-LBPRGKRZSA-N 371.459 0.604 10 10 FCCE O=C(NCc1cc(Cl)ccc1O)NC[C@]12COCCN1C(=O)COC2 1684747013 RFAZEUASJIWSFJ-MRXNPFEDSA-N 369.805 0.473 10 10 FCCE COc1ccc(N2CCN([C@@H](C)C(=O)N3CCN(C(C)=O)CC3)CC2)cc1 42290131 CAGWZKYHBHJELZ-INIZCTEOSA-N 374.485 0.896 10 10 FCCE CNC(=O)[C@H]1CCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C1 817862030 QFULOCAZQNVUIN-HOCLYGCPSA-N 374.485 0.703 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@@H]3CNCC[C@H]3C)C2)cc1 818677764 VLCJEXOIAGYJOS-IIDMSEBBSA-N 374.485 0.752 10 10 FCCE C[C@@H](CNCc1ccc(N2CCC(C(N)=O)CC2)cc1)S(C)(=O)=O 905480002 BWWBNRKSNWTNKE-ZDUSSCGKSA-N 353.488 0.911 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CC[C@@]4(O)C[C@H]4C3)C2)cc1 1118718127 HCFCXVNGMPJJSI-AUSJPIAWSA-N 373.453 0.621 10 10 FCCE C[C@H](NC(=O)Cn1cnnn1)C(=O)NCc1ccc(N2CCCCC2)cc1 1162801310 XKVRTSBLEOTEGA-AWEZNQCLSA-N 371.445 0.485 10 10 FCCE CN[C@@H]1C(=O)Nc2cc(N3CCNC(=O)CC3)c(Br)cc21 92775824 VZOAHKCSVOABLD-ZDUSSCGKSA-N 353.220 0.988 10 10 FCCE CN(C)c1ccc(CNC(=O)Cn2cnc3c(cnn3C)c2=O)cc1F 116151055 JLPMDPOKTVKTMO-UHFFFAOYSA-N 358.377 0.652 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CSC(=O)N3)cc2)CC1 276290273 TVYBNFOOLYKFAA-HNNXBMFYSA-N 362.455 0.796 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NCCN3CCC3)CC2)cc1 752658089 HVQMUMRDLVKYNB-UHFFFAOYSA-N 361.490 0.822 10 10 FCCE COCCc1cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)n(C)n1 770031422 ZIDCFIJJHUBYII-UHFFFAOYSA-N 368.415 0.938 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H](O)Cc3cnn(C)c3)CC2)cc1F 787118292 VZBQJYMLBKXMER-MRXNPFEDSA-N 362.405 0.820 10 10 FCCE Cn1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 788323162 JVFNJKIPDMYHII-UHFFFAOYSA-N 357.414 0.189 10 10 FCCE Cn1nnnc1CCNC(=O)NCc1cc(Br)ccc1O 805252465 IVIPPPJDRVRDFU-UHFFFAOYSA-N 355.196 0.720 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C[C@@H]4C[C@H]3C[S@@]4=O)CC2)cc1 844430262 MOQXLHOOJVLWGU-RTNKVPBISA-N 363.483 0.549 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CN(C)[C@H]1CCS(=O)(=O)C1 935947629 ATGKQVIVZSPQDZ-LBPRGKRZSA-N 361.460 0.613 10 10 FCCE CCN(OC)C(=O)CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1118215001 FSTKKZIOEOHQNP-GFCCVEGCSA-N 350.419 0.456 10 10 FCCE COC[C@](C)(CC(=O)OC)NCC(=O)NCc1ccc(N(C)C)cc1 1652772634 IHRIINNNAJGCCL-SFHVURJKSA-N 351.447 0.927 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)Nc2ccc(N)cc2)[C@H](O)C1 2076784719 NNUKPXWMLIDWPF-DYVFJYSZSA-N 351.403 0.940 10 10 FCCE COc1ccc(O)c(CNCC(CO)(CO)NC(=O)OC(C)(C)C)c1 2258309139 QMFSJFOJAODUDG-UHFFFAOYSA-N 356.419 0.739 10 10 FCCE O=C(O)CC[C@H](NC=C1C(=O)NC(=O)N(c2ccccc2)C1=O)C(=O)O 2296562020 WJEWJEIMIJJIPN-NSHDSACASA-N 361.310 0.061 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N[C@@H]1CCC(=O)N(C)C1 817822320 LVXPRCYHXOFOEL-GOEBONIOSA-N 374.485 0.845 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)[C@H](NS(C)(=O)=O)C(C)C)C2)cc1 855227881 QVDVLXYMBIICKF-CZUORRHYSA-N 369.487 0.964 10 10 FCCE CCn1ncc(CNC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)n1 863561016 AXROCBRAOHKMGX-SFHVURJKSA-N 374.489 0.579 10 10 FCCE COC(=O)c1cc(OCC(=O)N[C@H](C)C(=O)N(C)C)ccc1N(C)C 865396400 RNFYIJMINJROOP-LLVKDONJSA-N 351.403 0.511 10 10 FCCE COC(=O)c1c(CN2C[C@H]3C(=O)NC(=O)[C@H]3C2)c2cc(F)ccc2n1C 894904059 YFSLFLFBXDWOIG-BETUJISGSA-N 359.357 0.808 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1C[C@H](O)CC(F)(F)C1 1342506947 KRTJKWQEULMMGS-OAHLLOKOSA-N 365.380 0.908 10 10 FCCE COc1cccc(CNC(=O)N[C@@H]2CCN(c3cc(O)ncn3)C2)c1O 1471523924 LSANUQGNMRFQIV-GFCCVEGCSA-N 359.386 0.975 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1=C2CCCN=C2NN1 1630550025 HBCPDDAHKLHKER-UHFFFAOYSA-N 359.405 0.833 10 10 FCCE COc1cc(C(=O)NCc2c(O)cccc2O)sc1S(N)(=O)=O 1652625332 BRIYCSGLWGZYAD-UHFFFAOYSA-N 358.397 0.745 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC[C@H](O)CO 2124090627 SFOMZYGFUCGURA-RYUDHWBXSA-N 370.402 0.003 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCCCN2CCCC2=O)cc1F 283339230 SKHCJYBSFGFHLZ-UHFFFAOYSA-N 364.421 0.637 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC(=O)N(C)[C@H](C)C1 297934852 VBTXFHKQOTUOTI-CQSZACIVSA-N 360.458 0.790 10 10 FCCE CNC(=O)C1(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCC1 729968031 FUMGUOAPYPIGIF-UHFFFAOYSA-N 374.485 0.850 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNC[C@@H]3CCCN3C)CC2)cc1 819061538 WDQBBIMYEYEVRU-RBUKOAKNSA-N 362.518 0.862 10 10 FCCE CC(C)[C@H](O)CNC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 820993381 WVTUPDCIDFXBDB-MRXNPFEDSA-N 369.487 0.738 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@]3(C)CCOC3)C2)cc1 828142734 JLCZIXWQZZWFKD-LIRRHRJNSA-N 361.442 0.933 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N(C)CCS(C)(=O)=O)C2)cc1 852453420 JBMBXRBZNXTBGQ-ZDUSSCGKSA-N 355.460 0.960 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C)c(=O)n1C 1153663473 LPMOQUFEUUCYPN-NSHDSACASA-N 363.370 0.039 10 10 FCCE CCON(C)C(=O)CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1329828794 LEKLSPRLDQTXDK-UHFFFAOYSA-N 360.414 0.205 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1C[C@@H](O)CC(F)(F)C1 1342506946 KRTJKWQEULMMGS-HNNXBMFYSA-N 365.380 0.908 10 10 FCCE CN(CCC(N)=O)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1478786537 RDDHMFKONIIWBW-UHFFFAOYSA-N 356.373 0.818 10 10 FCCE CN(C)S(=O)(=O)c1cc(C(=O)NCc2c(O)cccc2O)n(C)c1 1597574979 WMEPTLSWIYHUGD-UHFFFAOYSA-N 353.400 0.617 10 10 FCCE CS(=O)(=O)CCN1CCC(NC(=O)Cc2ccc(O)c(O)c2)CC1 1627245845 IRDFJLYAFBWZAO-UHFFFAOYSA-N 356.444 0.266 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)C[C@@H](O)CN1C 1632356925 WKNWHVBUDITDEA-VBHSOAQHSA-N 366.414 0.143 10 10 FCCE O=C(Cn1cc(Br)c(O)nc1=O)NCc1c(O)cccc1F 1638863345 MIIMWACRTGCOGO-UHFFFAOYSA-N 372.150 0.873 10 10 FCCE Cc1ccc(CN[C@@H]2CS(=O)(=O)C[C@@H]2O)c(O)c1Br 2352676420 PHRGZXCFMRHKAH-ZJUUUORDSA-N 350.234 0.711 10 10 FCCE CCN(Cc1cc(O)n2ncc(C(=O)O)c2n1)[C@H](C)CS(C)(=O)=O 737851047 DGLWTOWLVYTAEE-SECBINFHSA-N 356.404 0.388 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@]2(CCO)CCOC2)c1 762576937 UVYGXAFGTBKJDL-HNNXBMFYSA-N 358.416 0.283 10 10 FCCE Cn1nnnc1CCNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 772576747 IJBUSLXKNWJKRL-AWEZNQCLSA-N 360.418 0.849 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)Cn3cccn3)C2)cc1 826972721 LLVBVFNYEFGQTM-HUUCEWRRSA-N 371.441 0.792 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC[C@H]3CCOC3)C2)cc1 828506576 OTLSKYJUKNOTBS-LSDHHAIUSA-N 361.442 0.933 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](O)Cn3ccnn3)C2)cc1 852448658 LJZDECWKDJFYQG-UKRRQHHQSA-N 360.418 0.226 10 10 FCCE CCN1C[C@H](S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)CC1=O 866581533 AXQFQIKNZWYGQT-MRXNPFEDSA-N 367.471 0.563 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)NCCCS(N)(=O)=O)C2)cc1 1478891145 IEHWXUGFNUHGSQ-CYBMUJFWSA-N 370.475 0.499 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)CCCS(N)(=O)=O)C2)cc1 1627154888 YFRPHQBAHWFFRX-CYBMUJFWSA-N 355.460 0.706 10 10 FCCE NC(=O)[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(CCc2ccc(N)cc2)C1 2106666494 MFKGGNHLBKZHGL-AAEUAGOBSA-N 358.364 0.666 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](COc3nnc(=N)[nH]n3)O[C@@H]2C1 2260766204 PAXQCZBYUWEJMS-GARJFASQSA-N 352.395 0.472 10 10 FCCE COC(=O)C[C@@H]1C[C@]2(OC)C(=O)c3cccc(O)c3C(=O)[C@]2(O)[C@H](C)O1 248036240 QYARGOCFMSDSQR-NDGXYMQXSA-N 364.350 0.628 10 10 FCCE biogenic C[C@H]1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H]1CO 249008339 ZTPLFURKWOMDGD-KSSFIOAISA-N 365.449 0.981 10 10 FCCE Cn1ncc2c(=O)n(CC(=O)NCCCSc3nccs3)cnc21 733884095 NKIUXLODTGGAHE-UHFFFAOYSA-N 364.456 0.885 10 10 FCCE Cc1cnn(C)c1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 850357044 WULBYKGMCFFUDR-UHFFFAOYSA-N 357.414 0.820 10 10 FCCE COCCn1nc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)ccc1=O 855229072 JVAFWBZALDFQIS-CQSZACIVSA-N 372.425 0.907 10 10 FCCE CN1C[C@@H](CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC1=O 929524139 POEXNQMNSJOLRR-INIZCTEOSA-N 372.469 0.888 10 10 FCCE Cn1ncc(CCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 1264736774 BVRLLBLODYRBKK-OAHLLOKOSA-N 370.457 0.766 10 10 FCCE C[C@H]1CN(C2CCOCC2)CCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1329810360 JVIUNCMADXYJHJ-AWEZNQCLSA-N 373.453 0.946 10 10 FCCE Cn1ncc2c(N3CCN(C(=O)Cc4ccc(O)c(O)c4)CC3)ncnc21 1540593469 XIGKQXKXGTUARE-UHFFFAOYSA-N 368.397 0.666 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC3(C[C@@H](O)CNC3=O)C2)c([N+](=O)[O-])c1 1640411811 FROJISFTYMRHGG-OGOUPESXSA-N 361.354 0.468 10 10 FCCE CC[C@@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)C(N)=O 1685244202 LPYDZJGPYGJVRG-OAHLLOKOSA-N 361.446 0.451 10 10 FCCE CN1CCN(C(=O)Cc2ccc(N)cc2)[C@H](CNC(=O)C(F)(F)F)C1 2106719983 UPKJQJUWUUKDRI-CYBMUJFWSA-N 358.364 0.632 10 10 FCCE C[C@H](NC(=O)c1cc(O)c(O)c(O)c1)C1(O)CN(C(=O)OC(C)(C)C)C1 2132349081 YAPPKBRAUJVMPY-VIFPVBQESA-N 368.386 0.904 10 10 FCCE CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=CNCCN1CCNCC1 2293031282 NYNLQPZPCYLYJA-UHFFFAOYSA-N 358.402 0.696 10 10 FCCE O=C(NC1CCN(C(=O)[C@@H]2CCCO2)CC1)c1cc(O)c(O)c(O)c1 169859758 MSBWLPGFBJJYRO-AWEZNQCLSA-N 350.371 0.703 10 10 FCCE COC(=O)/C=C/c1ccc(N2CCC3(CC2)NC(=O)NC3=O)c([N+](=O)[O-])c1 265611252 LLNDQZJBNRSFPA-HWKANZROSA-N 374.353 0.959 10 10 FCCE CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@H]1OC(C)=O 616626134 QKGHBQJLEHAMKJ-PEBLQZBPSA-N 373.318 0.380 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CN1C(=O)NC(C)(C)C1=O 728302079 QODXXLGZZDXFRN-UHFFFAOYSA-N 374.441 0.812 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1cscn1 788319482 KPJCOQCACXCFFC-UHFFFAOYSA-N 360.439 0.912 10 10 FCCE CN(CC(=O)NCc1cccc(O)c1O)S(=O)(=O)c1cccnc1 1471644575 VLAMVAODMJYDGL-UHFFFAOYSA-N 351.384 0.430 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC(CN=[N+]=[N-])CC1 2332924164 GDFURQWESNQCCD-JHJVBQTASA-N 369.422 0.876 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@](C)(O)CN(C)C)C2)cc1 854299205 GIEJNUDAZDVFJR-KSSFIOAISA-N 350.463 0.886 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@H](O)C(F)(F)C2)c1 855445837 OSDVLZVYWKSJAF-LLVKDONJSA-N 350.343 0.606 10 10 FCCE N[C@@H]1CCO[C@@H]([C@H]2CCCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)C2)C1 1329504629 NQYMCJRTMIOGJO-HDMKZQKVSA-N 373.453 0.979 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3CCCNC3=O)cc2)CC1 1471912680 UEFOPLXMHOMDQC-MRXNPFEDSA-N 358.442 0.531 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@H]4CCN(C)[C@H]4C3)CC2)cc1 1618055998 WCSIKYVVHMEOGV-LMNJBCLMSA-N 374.529 0.814 10 10 FCCE Nc1nnn(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 1631425806 PEGAEJDNWIDMES-LBPRGKRZSA-N 365.825 0.395 10 10 FCCE CNS(=O)(=O)N1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1636454064 KIRDIIKEDAKATM-UHFFFAOYSA-N 371.440 0.535 10 10 FCCE NS(=O)(=O)CCCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1636527651 DYZYBYBUSIEBTM-UHFFFAOYSA-N 374.438 0.140 10 10 FCCE CC[S@](=O)c1ccccc1C(=O)N1CCS(=O)(=O)[C@@H]2COCC[C@@H]21 1638771169 ADCJTSZKAKNXHZ-WXQIDZRNSA-N 371.480 0.842 10 10 FCCE CCc1nc([C@@H]2C[C@@H](O)CN2CC(=O)NCc2ccc(N(C)C)cc2)n[nH]1 1655109814 PMTXKGIFIZFBQP-CVEARBPZSA-N 372.473 0.857 10 10 FCCE [N-]=[N+]=N[C@H]1[C@H](Oc2ccc([N+](=O)[O-])cc2Cl)O[C@H](CO)[C@@H](O)[C@@H]1O 2037796625 BJMHBPGJICQXPT-LZQZFOIKSA-N 360.710 0.745 10 10 FCCE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1C(=O)c1cc(O)nc(O)c1 2067395889 JUPGBXORPZKPRJ-GHMZBOCLSA-N 353.375 0.593 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@H]1C[C@@H]1CN 2136240472 MPJAHAQQLFAMRM-AGIUHOORSA-N 365.430 0.997 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H](N)C(F)(F)F)cc2)C1 827468723 CPZNPSQZPWFCEG-YPMHNXCESA-N 358.364 0.894 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCNC[C@](C)(F)C3)CC2)cc1 844225345 OAXPLPAGTNVUMU-IBGZPJMESA-N 364.465 0.977 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CN(C)C(=O)[C@H]2C)cc1 846282296 YNUZCOAHCIVTBF-CYBMUJFWSA-N 362.430 0.236 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CC[C@@H](CN)C3)C2)cc1 851689033 KENUSRWILLWWNC-KFWWJZLASA-N 360.458 0.634 10 10 FCCE C[C@H](CO)[C@H](C)NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 853775887 FSRUDJHFBWKAIS-KGLIPLIRSA-N 369.487 0.738 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CC(C(N)=O)=NO3)C2)cc1 854050348 AKQXRMYKCGWXAK-FZMZJTMJSA-N 361.402 0.203 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)c3cn(C)c(=O)n(C)c3=O)C2)cc1 855232043 QBILPALNEBTVBG-LBPRGKRZSA-N 358.398 0.101 10 10 FCCE C[C@@H](C(=O)NCc1c(O)cccc1F)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 928706548 WVEBWGPQWNJAPN-CELJHQOASA-N 362.357 0.698 10 10 FCCE COc1nn(C)cc1CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 929805821 WNTNEZQKHQZMOJ-UHFFFAOYSA-N 371.441 0.744 10 10 FCCE COCCCOC1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1323020678 SDQRTHYWBYOOSM-UHFFFAOYSA-N 373.453 0.943 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2077107255 PCFIHUZCOXUHRF-GHMZBOCLSA-N 373.435 0.932 10 10 FCCE Nc1ccc(OC[C@@H](O)CN2C[C@H]3C[C@H]2CN3C(=O)C(F)(F)F)cc1 2106767500 PZFZOJHDUKOAPL-XQQFMLRXSA-N 359.348 0.856 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCN4CCOC[C@H]4C3)nc12 368816069 IURCYSSICDJWBR-CYBMUJFWSA-N 361.402 0.128 10 10 FCCE C[C@@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCC(=O)NC1 798405051 YEJOIHDFIAAYIB-MGPUTAFESA-N 372.469 0.921 10 10 FCCE CC(=O)N1CCN(C(=O)C(=O)NCCCSc2nccs2)[C@@H](C)C1 806278488 SJCRIDKBBCTUTR-NSHDSACASA-N 370.500 0.821 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CCN(C)S3(=O)=O)C2)cc1 843607674 FOKKKNNAKAYGCG-CJNGLKHVSA-N 367.471 0.672 10 10 FCCE CNCCOCCNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 861637975 TVJAZJHAIAKWBC-UHFFFAOYSA-N 372.416 0.837 10 10 FCCE C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCN1S(C)(=O)=O 1166751720 OIPGZUNJYDZQPF-SNVBAGLBSA-N 353.404 0.955 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@]2(CNC(=O)C2)C1 1261303667 VSEMKRSXXRDCFX-HXUWFJFHSA-N 372.469 0.840 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)NCC[C@@H]3CNC(=O)C3)ccc21 1334733166 LRVWRUDTHUXPGV-AWEZNQCLSA-N 358.442 0.328 10 10 FCCE CN(C)c1ccc([C@@H](NC(=O)[C@H](N)CCC(N)=O)c2nccn2C)cc1 1866105555 MTZXRCQOMWDJKJ-GDBMZVCRSA-N 358.446 0.285 10 10 FCCE CN(Cc1ccccc1O)C(=O)[C@@H]1[C@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C 2136113615 NJFHBLLSMJBFEE-SOUVJXGZSA-N 366.414 0.692 10 10 FCCE COC(=O)C=C1SC(NC(=O)CN2C(=O)c3ccccc3C2=O)=NC1=O 2313553152 MOTIRYTWELDGLH-UHFFFAOYSA-N 373.346 0.085 10 10 FCCE O=C(O)C[C@@H](C(=O)O)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O 1529553 KYSQDMNDMYECNZ-UBYHCNMCSA-N 354.267 0.283 10 10 FCCE in-vitro CCCN1C(=O)/C(=C/NCC(C)(C)N2CCOCC2)C(=O)NC1=S 105490368 WVLUYOGVWXDNMU-ZRDIBKRKSA-N 354.476 0.224 10 10 FCCE CS(=O)(=O)N[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 780524215 FJJDDWBZOQSKFP-SECBINFHSA-N 370.387 0.444 10 10 FCCE COc1cccc(CNC(=O)[C@H](CO)NC(=O)c2cccc(F)n2)c1O 1622779756 VJDCAAWIMSUHNT-LBPRGKRZSA-N 363.345 0.342 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCC2(CN=[N+]=[N-])CC2)[C@H](O)C1 1890527454 UDGSABIKIXKMTH-BDJLRTHQSA-N 369.422 0.926 10 10 FCCE O=C1c2ccccc2C(=O)N1C[C@@H](O)Cn1ccc2c(c1=O)CNCC2 1994834431 IXEKACDKAWSALE-ZDUSSCGKSA-N 353.378 0.151 10 10 FCCE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCS1(=O)=O 2020898952 BXXWIXUMRFOQQU-JTQLQIEISA-N 361.424 0.789 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NC(=O)COc2ccc(N)cc2)C1 2062449887 BVEHQESSBOFGGW-KGLIPLIRSA-N 351.403 0.744 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3C[C@H]4C[C@@]4(CO)C3)cc2)C1 782945062 DCVCXMBAZAVDSN-QINHECLXSA-N 372.469 0.912 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCC(=O)N3CCNCC3)C2)cc1 851662008 SZJDDLHQZNFEMH-CQSZACIVSA-N 361.446 0.005 10 10 FCCE Cn1nncc1CC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 854905883 IEXXLDAKUYAGPM-UHFFFAOYSA-N 351.357 0.789 10 10 FCCE CCCC(=O)NCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918340228 NFQPDGOYXMQQKK-UHFFFAOYSA-N 367.471 0.454 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCOC[C@H]3C)C2)cc1 1118632501 DRJZVLDNVICODT-JKIFEVAISA-N 361.442 0.931 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC1CCC(C(N)=O)CC1 1258165777 QIKINIWBCNKVET-UHFFFAOYSA-N 360.458 0.871 10 10 FCCE COC(=O)[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 1323028197 WNQSXVATDFLVNX-SNVBAGLBSA-N 357.457 0.763 10 10 FCCE O=C(O)c1cnn2c(O)cc(CN3CCC(O[C@H]4CCOC4)CC3)nc12 1333570838 BTQOHEDYPOYAOQ-ZDUSSCGKSA-N 362.386 0.903 10 10 FCCE COC(=O)[C@H]1CCN(C(=O)Cc2ccc(O)c(O)c2)[C@@H](C(=O)OC)C1 1597208407 GRYJTDUMVCXXGK-NWDGAFQWSA-N 351.355 0.594 10 10 FCCE CC(=O)O[C@@H]1[C@@H](OCCN=[N+]=[N-])O[C@@H](C)[C@@H](OC(C)=O)[C@@H]1OC(C)=O 1616083721 SWFHDHBVUMLTMW-OPKVAGGOSA-N 359.335 0.853 10 10 FCCE COc1ccc(S(N)(=O)=O)cc1C(=O)NCc1ccc(O)cc1O 1638351654 ACWGEMRKDDSSEH-UHFFFAOYSA-N 352.368 0.684 10 10 FCCE Nc1ccc(-n2nnc(C(=O)N3CCN(C(=O)c4ccco4)CC3)n2)cc1 1857878416 AXDUAPINRPBERE-UHFFFAOYSA-N 367.369 0.436 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNC(=O)Nc1ccc(N)cc1 2225621981 HBIXHBVOBUAQIX-IHRRRGAJSA-N 366.418 0.731 10 10 FCCE CN1C(=O)NC(=O)/C(=C\c2cc([N+](=O)[O-])ccc2N2CCOCC2)C1=O 59498873 CGGAVZDBOSEUIW-FMIVXFBMSA-N 360.326 0.523 10 10 FCCE Cn1c(O)ncc(C(=O)NCc2cccc(Br)c2O)c1=O 765748524 VVXUXFBUHCCWCR-UHFFFAOYSA-N 354.160 0.884 10 10 FCCE CCS(=O)(=O)N[C@@H](C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 854198238 FUXZLQUQRUCMPK-ZDUSSCGKSA-N 355.460 0.672 10 10 FCCE CCn1ncc(CNC(=O)C(=O)N(C)CCN(C)c2ccc(OC)cc2)n1 859422201 IKYMIBVHOVRVLI-UHFFFAOYSA-N 374.445 0.518 10 10 FCCE CNS(=O)(=O)C[C@@H]1CCCN(C(=O)NCCc2ccc(N)cc2)C1 861640713 NXBXSNIJSVOBDB-CQSZACIVSA-N 354.476 0.782 10 10 FCCE Cn1ccn2c(CCNC(=O)/C=C/c3ccc(O)c(O)c3)nnc2c1=O 1303721226 URRNGLSEQWJWBO-HWKANZROSA-N 355.354 0.211 10 10 FCCE CN1CCN(c2ccc(CN3CCO[C@@H](CC(N)=O)C3)cc2F)CC1 1329077291 BKVZPTCRGUPYNB-HNNXBMFYSA-N 350.438 0.654 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3COC(C)(C)C3)cc2)CC1 1333257270 ONIBYUJVAFCMTF-INIZCTEOSA-N 374.485 0.738 10 10 FCCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCCn2nncc2C1 1350385306 KJNCMBGDVWQOFI-UHFFFAOYSA-N 368.441 0.927 10 10 FCCE CN(Cc1ccccc1O)C(=O)[C@@H]1[C@@H](c2cnn(C)c2)N(C)C(=O)[C@@H]1O 1465844205 INNPLCAAHKHKQE-BZUAXINKSA-N 358.398 0.275 10 10 FCCE COc1cc(N2CCN(c3nccnc3C(N)=O)CC2)cc(OC)c1OC 1472753895 LAADPZVHJPMSBW-UHFFFAOYSA-N 373.413 0.928 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1529404719 YCCDNZHWZDCKCN-CQSZACIVSA-N 369.487 0.919 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)CCc3nc[nH]n3)cc2)CC1 1644863243 DAPLFZBMAQTYJN-UHFFFAOYSA-N 356.430 0.755 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)NCCc1ccc(N)cc1 2136169631 GHUDDFPQEADHKG-SOUVJXGZSA-N 365.430 0.269 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2312333772 ABZKFFOSWSEDPH-YBXAARCKSA-N 355.395 0.675 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)NCCc1ccc(N)cc1 2332881313 GHUDDFPQEADHKG-QLFBSQMISA-N 365.430 0.269 10 10 FCCE CCN1C(=O)CO[C@H](C(=O)NCc2ccccc2O)[C@H]1c1nccn1C 860235620 ZQSALMIRHZTZSM-HOTGVXAUSA-N 358.398 0.731 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H]3CCNC34CCC4)C2)cc1 861794481 RYHHUFZDQLRLSZ-PBHICJAKSA-N 372.469 0.791 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@]23COCCN2C(=O)OC3)cc1F 869020777 MVLOCMHPKQARJZ-QGZVFWFLSA-N 366.393 0.912 10 10 FCCE CN1CCN(c2ccc(CN3C(=O)N[C@H](CC4OCCO4)C3=O)cc2)CC1 925079667 MQHURWXJMWMDQX-MRXNPFEDSA-N 374.441 0.622 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1CN(C2CC2)C(=O)O1 1333008728 NUHICZRNANLXSF-INIZCTEOSA-N 374.441 0.777 10 10 FCCE NC(=O)N[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 1346326696 JQWKCKSJCDKTAP-VIFPVBQESA-N 357.461 0.011 10 10 FCCE Cn1cc(S(=O)(=O)NCC(=O)NCc2c(O)ccc3ccccc23)cn1 1639384455 KVNMIQFFBSQPHW-UHFFFAOYSA-N 374.422 0.874 10 10 FCCE CN1C[C@H](NC(=O)C(=O)NCCCSc2nccs2)CCC1=O 806188336 UAYRBHOETUJUOU-SNVBAGLBSA-N 356.473 0.479 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CN1CCN(CC)CC1 819695977 GSHBBFCOYKKCJM-UHFFFAOYSA-N 363.458 0.921 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCO[C@@H]([C@H](C)O)C1 840976646 DEVSEWIASPZTSE-WMLDXEAASA-N 363.458 0.709 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C3=C(C)N(C)c4nnnn4C3)C2)cc1 855225415 NAJXGJHLPJXPNJ-CYBMUJFWSA-N 369.429 0.801 10 10 FCCE O=C1C[C@@H](C(=O)N2Cc3cccc(O)c3C2)CN1CCN1CCOCC1 871200923 NGFWKNBRUVWUJN-OAHLLOKOSA-N 359.426 0.415 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1C[C@H]2COC[C@@H](C1)O2 1258446404 YXACIAMDSMDGHM-PHIMTYICSA-N 357.457 0.368 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1cn(C)nn1 1347749909 FBEZATIISAALKG-ZDUSSCGKSA-N 362.386 0.450 10 10 FCCE C[C@@H](NC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O)c1ccccc1O 1557965753 MGCIZKOMIBVFQD-SNVBAGLBSA-N 357.370 0.017 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN(C)CCCCO)CC2)cc1 788281612 MEQKRQMOJMPPGT-SFHVURJKSA-N 351.491 0.882 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1CCCNC1=O 838162581 JPJSUOMVDNYRAX-AWEZNQCLSA-N 368.384 0.879 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCN(C)S3(=O)=O)C2)cc1 855225043 NKXYMBSFMNMHDO-SWLSCSKDSA-N 353.444 0.424 10 10 FCCE C[C@@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CN1 861761348 DEPJDNODOSELAK-GDBMZVCRSA-N 360.458 0.396 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCC[C@H]3NCC[C@@H]32)cc1 868419350 WUERDQPBFMRQRV-MSOLQXFVSA-N 374.485 0.943 10 10 FCCE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCNC(=O)CO)cc1 906463783 HDXYKWDQXRVVDI-QGZVFWFLSA-N 363.458 0.759 10 10 FCCE Cc1nn(CCS(=O)(=O)NCc2ccc(N(C)C)c(F)c2)c(=O)o1 914013894 GEBQMZLLNFBSCZ-UHFFFAOYSA-N 358.395 0.469 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCc3cn(C)c(=O)nc3O)C2)cc1 1252923496 MPTJTBKKNASWKN-ZDUSSCGKSA-N 373.413 0.573 10 10 FCCE CCOC(=O)C[C@@H](O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1464307673 JOWWXYLOMFVZSD-OAHLLOKOSA-N 354.378 0.593 10 10 FCCE O=C(CNC(=O)c1ccsc1)NCc1ccc(N2CCNC(=O)C2)cc1 55249726 NFAYZCXZDJTVQO-UHFFFAOYSA-N 372.450 0.731 10 10 FCCE COC(=O)CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(\C)NCCO 205941518 FIXWKMURRZRLJP-XNTDXEJSSA-N 362.342 0.716 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N(C)CCS(C)(=O)=O)C2)cc1 852453419 JBMBXRBZNXTBGQ-CYBMUJFWSA-N 355.460 0.960 10 10 FCCE CN(C)CCCN(C)CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 855415175 SOWCHTORLSLFOX-UHFFFAOYSA-N 372.491 0.377 10 10 FCCE O=C(N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1c(F)ccc(O)c1O 863937674 DUDWYIIBVKITAE-SECBINFHSA-N 358.333 0.683 10 10 FCCE O=C1C[C@H](CCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CN1 914241272 HURIYJVYOLLOTB-AWEZNQCLSA-N 364.421 0.988 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCO[C@@H]([C@H](C)O)C2)cc1 817705860 MEXRINZOUJMGAT-WMLDXEAASA-N 363.458 0.757 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@](O)(C(F)F)C3)nc12 831176443 VSWYFRFYGVTPPO-HNNXBMFYSA-N 356.329 0.814 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](N)C(F)(F)F)cc2)CC1 832172422 GHJRGMPRLKKLGP-CQSZACIVSA-N 358.364 0.861 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)N3CCN4C[C@H](O)C[C@H]4C3)C2)cc1 847386919 IQCYKIFMAYVIMJ-RYQLBKOJSA-N 374.485 0.982 10 10 FCCE CN(Cc1ccccc1O)S(=O)(=O)C[C@@H]1CCN(S(C)(=O)=O)C1 866833348 AAJXUCOOZNNFFK-GFCCVEGCSA-N 362.473 0.435 10 10 FCCE CC(C)(O)CONC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1565363311 MKTFHOYZRZZCCA-UHFFFAOYSA-N 364.446 0.890 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCOC23CCOCC3)c1 1640277106 SPLMFSCWZXWXSE-CQSZACIVSA-N 370.427 0.832 10 10 FCCE NC(=O)CCn1ccc(=NC(=O)C=Cc2ccc(N3CCOCC3)cc2)[nH]1 2297599602 CWRVPOJIKXKNNJ-UHFFFAOYSA-N 369.425 0.669 10 10 FCCE COCCN(C(=O)[C@H](C)Cc1ccc(O)c(O)c1)[C@H]1CCS(=O)(=O)C1 170245314 JANDYCMJYDNOOH-OCCSQVGLSA-N 371.455 0.939 10 10 FCCE COC(=O)[C@H]1CS(=O)(=O)CCN1Cc1cc(OC)c(OC)cc1O 276762154 NAJUEBMYHNOTKY-LLVKDONJSA-N 359.400 0.181 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCn4c(O)nnc4C3)CC2)cc1 763152758 OAROBWDXTXTVSA-UHFFFAOYSA-N 372.429 0.157 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN4C(=O)NC(=O)[C@@H]4C3)C2)cc1 854298567 FVTAOFVWHBBSCU-DOMZBBRYSA-N 373.413 0.220 10 10 FCCE O=S(=O)(C[C@@H]1CNCCO1)NCc1ccc(N2CCOCC2)c(F)c1 866745910 OVKJQAKGUWDQGH-AWEZNQCLSA-N 373.450 0.070 10 10 FCCE CC(C)(O)C[C@H](O)CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 871982770 BUQKYGJUGXRVCW-INIZCTEOSA-N 356.488 0.533 10 10 FCCE C[C@H](NC(=O)NC[C@@]1(CO)COCCN1C)c1ccc(N(C)C)cc1 922053954 HENLDISNRPNWTH-KBXCAEBGSA-N 350.463 0.806 10 10 FCCE N[C@@H]1CCO[C@H](C2CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)C1 1329504603 NJAXXGBQNGWTSR-QAPCUYQASA-N 373.453 0.979 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCN1CCN(c2ncccn2)CC1 1470331784 NITGIYGQAZATFU-UHFFFAOYSA-N 357.414 0.369 10 10 FCCE Nc1nnn(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 1631425805 PEGAEJDNWIDMES-GFCCVEGCSA-N 365.825 0.395 10 10 FCCE O=C(CN1C(=O)[C@H]2C[C@@H]2C1=O)NCc1ccc(N2CCOCC2)c(F)c1 760369416 AFORNUGZQMPCQI-STQMWFEESA-N 361.373 0.283 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC3(CO)CC3)CC2)cc1 778394160 RSFJRGYNIKIOCT-SREVYHEPSA-N 359.426 0.541 10 10 FCCE COc1ccc(N2CCN(C(=O)N[C@H]3C[C@H](C(N)=O)C3)CC2)c(OC)c1 868805879 PSDPUFPWUQWCKD-JOCQHMNTSA-N 362.430 0.799 10 10 FCCE C[C@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCNC1=O 1141996083 IBEGAEHZZSLKJI-KUHUBIRLSA-N 358.442 0.531 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)NCC(F)(F)CO)cc2)CC1 1255509470 QHBPCZMMFPKWRN-UHFFFAOYSA-N 370.400 0.815 10 10 FCCE COC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCCOC1 1303725606 PBTKUNHCKWWFCT-BXUZGUMPSA-N 372.443 0.935 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC3(CC(N)=O)CC3)C2)cc1 1331053149 GVDKEXSMPQZOAL-CYBMUJFWSA-N 374.441 0.162 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)/C=C/Cn3cncn3)cc2)CC1 1558397121 KKBGJFRYEHTTQM-OWOJBTEDSA-N 368.441 0.852 10 10 FCCE C[C@H]1[C@@H](C(N)=O)CC[C@@H](C)N1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1627712109 WKAWHTRBWCKPTL-SCVCMEIPSA-N 369.443 0.878 10 10 FCCE CN1C(=O)C(=CN[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)C(=O)NC1=S 2296930339 QCMQWCNUTWQPTG-ZDUSSCGKSA-N 372.406 0.510 10 10 FCCE Cc1ccccc1N1C(=O)NC(=O)C(=CNCCN2CCOCC2)C1=O 2297059848 MNDHSHLBMIMXGH-UHFFFAOYSA-N 358.398 0.384 10 10 FCCE NC(=O)COc1ccccc1/C=C1\SC(=S)N(CC(=O)O)C1=O 96488914 ZZKQWNGQJRTBQR-YHYXMXQVSA-N 352.393 0.837 10 10 FCCE CCCCN1C(=O)[C@@H]2[C@H](c3ccccc3O)N[C@](CO)(C(=O)O)[C@@H]2C1=O 248206782 BHVJNMAKDYYCQH-NUXNZHGMSA-N 362.382 0.254 10 10 FCCE COC(=O)C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 327162577 SEUNZEVGGHNYOZ-VIFPVBQESA-N 351.315 0.694 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@H](N4CCNC4=O)C3)cc2N1 360485019 SOEVTCZQLGSBQZ-JTQLQIEISA-N 361.358 0.920 10 10 FCCE CN(C[C@@H](O)CN1CCOCC1)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 761905359 PXHRCWHGZQGERL-LLVKDONJSA-N 366.374 0.055 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c1 768909726 BJZLKILXSWEIGA-OFSNVTPPSA-N 359.382 0.689 10 10 FCCE CC(=O)C(=O)COC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCCO2 808520847 ZLWSFXPQFUQMLX-UHFFFAOYSA-N 370.379 0.713 10 10 FCCE CC(=O)N1CCO[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 826530505 HVKJYNBPJSMKBZ-SFHVURJKSA-N 361.442 0.511 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCC(=O)N(C)C3=O)C2)cc1 852388769 QTKPXFQXVPUURM-WFASDCNBSA-N 360.414 0.721 10 10 FCCE COc1ccc(N2CC[C@H](N3C(=O)N[C@@H](CC4OCCO4)C3=O)C2)cc1 924980975 XADALRBYOFQSJN-ZFWWWQNUSA-N 361.398 0.957 10 10 FCCE CN1CCN(c2ccc(CNC(=O)NC(C)(C)CNC(N)=O)cc2)CC1 1254716163 HDZWANLJNGSKDE-UHFFFAOYSA-N 362.478 0.685 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1356037203 UUBRSIMQHIHBFS-UHFFFAOYSA-N 373.450 0.560 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1C[C@@H](C(=O)OC)C1 1447349720 SKBUZBMHASKNOP-XQQFMLRXSA-N 365.382 0.887 10 10 FCCE CN(C)c1ccc([C@H](CNC(=O)Cn2cnc([N+](=O)[O-])n2)N(C)C)cc1 1618636103 UHRVFWGUIDSAQQ-AWEZNQCLSA-N 361.406 0.671 10 10 FCCE Cc1nonc1CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1634973793 ACJZLUNZDSVNNM-UHFFFAOYSA-N 357.414 0.939 10 10 FCCE Cn1nc2c(c1C(=O)NCc1c(O)cccc1F)CS(=O)(=O)CC2 1635366587 CYBNYEDAYRNVNX-UHFFFAOYSA-N 353.375 0.666 10 10 FCCE Cc1nn(C)c2c1[C@H](c1ccc(O)c(O)c1)C(C(=O)NC[C@H](C)O)=C(N)O2 1864008662 PEDSKCZNFBWZIG-RTHLEPHNSA-N 374.397 0.331 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2320915820 FFWPLMCWCNSUAX-LLVKDONJSA-N 357.411 0.783 10 10 FCCE O=C(CN1C(=O)CSC1=S)N1CCC[C@H](Oc2ncccn2)C1 585338795 HLHJTQNYNATQKD-JTQLQIEISA-N 352.441 0.707 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H]4CN(C)C[C@H]43)CC2)cc1 794929565 MDDJLZFWIJHVLI-SLYNCCJLSA-N 374.529 0.814 10 10 FCCE CCn1c(=O)nc(O)c2c(C(=O)OCC(=O)C(C)=O)cc(C(C)C)nc21 808500774 AQCGUBYQMLMKBF-UHFFFAOYSA-N 361.354 0.955 10 10 FCCE CN1C[C@@H](C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)NC1=O 831560600 CKODUERQIFENFH-SFHVURJKSA-N 371.485 0.858 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(C)CNCCO3)cc2)CC1 876910415 ZIMPGPSYXFQIPU-IBGZPJMESA-N 360.458 0.350 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)NC[C@]23COCCN2C(=O)OC3)c1 1254433216 ROGBGDSPRAULFI-APPDUMDISA-N 365.386 0.982 10 10 FCCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 1264287073 JLGHLEXKPYOLTM-HNNXBMFYSA-N 365.455 0.158 10 10 FCCE O=C1C[C@@]2(CCN(C(=O)C(=O)NCCCSc3nccs3)C2)CN1 1346328134 VNRGQQKIOHCHKD-HNNXBMFYSA-N 368.484 0.480 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)c1nc2ncc(CCO)cn2n1 1585787049 ITAXGHOMCPSEPZ-UHFFFAOYSA-N 354.414 0.964 10 10 FCCE CN(CC(=O)N1CCC[C@@H](C(N)=O)C1)Cc1ccc(N2CCOCC2)cc1 72953300 WQGDTWQQQZVZCZ-QGZVFWFLSA-N 374.485 0.679 10 10 FCCE CN1CCN(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c2ccc(F)cc21 174454438 OBEWCHMQUAIKTA-QPJJXVBHSA-N 358.373 0.719 10 10 FCCE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@@H]2NC(=O)NC2=O)cc1 270616396 RZUGEVYISQOGKI-HOTGVXAUSA-N 374.441 0.858 10 10 FCCE CC(=O)C(=O)COC(=O)CNC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C 808537535 ZUNIARDXQBLMHD-LLVKDONJSA-N 356.375 0.203 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C)S(N)(=O)=O)C2)cc1 852452129 SNWXZRSYAGNMKA-NEPJUHHUSA-N 356.448 0.250 10 10 FCCE O=C(C[C@@H]1NC(=O)c2ccccc2NC1=O)NCc1c(O)cccc1O 1156886030 RVDPDMLYJMHFCP-ZDUSSCGKSA-N 355.350 0.855 10 10 FCCE O=C1C[C@]2(CCN(C(=O)C(=O)NCCCSc3nccs3)C2)CN1 1346328142 VNRGQQKIOHCHKD-OAHLLOKOSA-N 368.484 0.480 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)CNC(=O)Cc1ccc(O)c(O)c1 2270659900 PWDNZKKAZXNMSL-UHFFFAOYSA-N 370.402 0.005 10 10 FCCE CC[C@@H](C)N1C(=O)C(=CNCCCN2CCOCC2)C(=O)NC1=S 2296923993 LTOAQTAJQIWMPI-GFCCVEGCSA-N 354.476 0.224 10 10 FCCE COc1ccc(N2CCN(C(=O)CN(C)Cc3nnc(C)n3C)CC2)cc1 729032916 RQKMOMSARLHDQV-UHFFFAOYSA-N 372.473 0.913 10 10 FCCE C[C@@H]1CN(S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)C[C@@H](C)O1 842784914 CGWWKVKDVCIJEM-XJKCOSOUSA-N 356.492 0.696 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 1299793638 BRAQMCKQQDUUEH-GFCCVEGCSA-N 363.391 0.991 10 10 FCCE Cc1ccc(O)c(N=c2nc(N3CCOCC3)[nH]c(N3CCOCC3)n2)c1 1871732218 YBKSNUXVHHAYGN-UHFFFAOYSA-N 372.429 0.724 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](O)[C@H](N)C(=O)O 1952205352 WIPCCMLXTYNHQK-ICCXJUOJSA-N 356.375 0.306 10 10 FCCE COc1ccc(N2CCCN(c3ccc(C(=O)NCCO)nn3)CC2)cc1 768522016 GHVVUIONJMZGES-UHFFFAOYSA-N 371.441 0.924 10 10 FCCE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C(=O)c1ccc(C)c(O)c1O 780992781 DXLRWLBRBGRMFB-LPWJVIDDSA-N 363.366 0.971 10 10 FCCE CNC(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 817705213 ARHJQOTVLBNCHM-OAHLLOKOSA-N 358.442 0.498 10 10 FCCE C[C@H]1C(=O)N(C)CN1C(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 834664621 IOKGUZBKBKKFGT-KGLIPLIRSA-N 374.441 0.347 10 10 FCCE COC(=O)CN(CCN1C(=O)CN(C)C1=O)Cc1cc(Cl)ccc1O 851840929 MBGLITHPYFSBMM-UHFFFAOYSA-N 369.805 0.915 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H]2CC[C@@H](C)NC2)cc1 861804849 UGSCXWLDEITLME-HUUCEWRRSA-N 362.474 0.847 10 10 FCCE O=C1OC[C@]2(CNCc3ccc(N4CCOCC4)c(F)c3)COCCN12 865768785 CAHFOCMUFWLFAA-SFHVURJKSA-N 365.405 0.973 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1CCC(=O)N(C)CC1 1118653599 DSMJUFIVYXJLCG-OAHLLOKOSA-N 374.485 0.799 10 10 FCCE O=C(CC[C@H]1NC(=O)NC1=O)NCc1ccc(N2CCC(O)CC2)cc1 1148701045 LDMJGAIPLXHQOV-OAHLLOKOSA-N 360.414 0.252 10 10 FCCE CNC(=O)CCn1c(C(=O)NC(C)C)nnc1N(C)Cc1ccccc1O 1554476891 BVGXIIPCIIXRLT-UHFFFAOYSA-N 374.445 0.894 10 10 FCCE O=C1NC(=S)N(c2ccc(F)cc2)C(=O)C1=CNN1CCOCC1 2297510258 ZGCAMQVNVAXQDD-UHFFFAOYSA-N 350.375 0.294 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCN(CCCCO)CC3)cc2N1 761906692 FOLSDQLOPSPRFY-UHFFFAOYSA-N 350.375 0.820 10 10 FCCE CO[C@@]1(CNCc2ccc(N3CCN(C)CC3)cc2)CCS(=O)(=O)C1 922619388 QREDBGQORMNNBT-GOSISDBHSA-N 367.515 0.732 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H](CN)[C@H](C(F)(F)F)C1 1261891128 ZBEVPFAFEAKYNW-NWDGAFQWSA-N 359.348 0.946 10 10 FCCE C[C@@H]1CCN1C(=O)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1334705230 GEASNWINYWVTLV-CYBMUJFWSA-N 358.442 0.625 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCCCCN=[N+]=[N-])[C@H](O)C1 2076823036 YHCIMQFRGKGJIM-IAQYHMDHSA-N 357.411 0.926 10 10 FCCE O=S1(=O)CCN(Cc2ccc(Br)cc2O)C2(CNC2)C1 2183498155 VWPIUIYCPGUIFY-UHFFFAOYSA-N 361.261 0.727 10 10 FCCE NS(=O)(=O)N1CCC(NCc2c(O)cccc2Br)CC1 706808753 ZGTKFOVAKNMLPZ-UHFFFAOYSA-N 364.265 0.912 10 10 FCCE O=C(NCC(=O)N1CCOCC1)NCc1cc(Br)ccc1O 805265989 TYPGXUBAITUSOW-UHFFFAOYSA-N 372.219 0.813 10 10 FCCE C[C@H](O)[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 840261529 NNVSPJVHNRTFQO-SUMWQHHRSA-N 367.421 0.954 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC3CCC(N)CC3)C2)cc1 851688032 OWXLTUFSNGHKAE-YMAMQOFZSA-N 360.458 0.776 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCN(C)S3(=O)=O)C2)cc1 855225039 NKXYMBSFMNMHDO-DOMZBBRYSA-N 353.444 0.424 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CC[C@H](C)NC3)C2)cc1 861804518 QYQVMAHYIBTJMS-ZNMIVQPWSA-N 360.458 0.647 10 10 FCCE CC(=O)c1cc(Cl)cc(CN2CCN3[C@H](CNS3(=O)=O)C2)c1O 933106456 LLVPNUBQQRBIAR-GFCCVEGCSA-N 359.835 0.582 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccnc(OC)n1 1153663435 KCLOPSGWRIVPIK-LBPRGKRZSA-N 361.354 0.801 10 10 FCCE CC(C)C[C@H](CN)NC(=O)C(=O)C(=O)C(=O)NC[C@H]1C[C@H]2C=C[C@H]1CC2 1329023453 HZEOMQIXROTWCP-BYNSBNAKSA-N 363.458 0.333 10 10 FCCE CCOC(=O)N1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1335559886 XNJRFYAIGLSBEL-UHFFFAOYSA-N 361.398 0.925 10 10 FCCE COC(=O)[C@H]1CCCN(CC(=O)N[C@@H](C)c2cc(OC)ccc2O)C1=O 1465993175 OSRTXHSRXOKMJM-AAEUAGOBSA-N 364.398 0.990 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C1=C2CCCN=C2NN1 1629967582 GYAAKNVXCDAWRO-UHFFFAOYSA-N 373.432 0.957 10 10 FCCE CN1C[C@@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)CC1=O 2060610306 GHQNMYQVNCVQOP-QWRGUYRKSA-N 352.395 0.975 10 10 FCCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1[C@H](O)[C@H](O)CCN1C(=O)OC(C)(C)C 2064132114 HTVYWXAJSSSRAO-GRYCIOLGSA-N 357.411 0.876 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3CCN(C4CC4)CC3)ccc21 285583963 ADYQLCJZDDLNQX-UHFFFAOYSA-N 356.470 0.992 10 10 FCCE CC(=O)N1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)[C@@H](C)C1 285702911 LONFLLNKPMRWFK-LBPRGKRZSA-N 364.421 0.587 10 10 FCCE NC(=O)c1cncc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 771196858 JVAMQSXSUARPNA-UHFFFAOYSA-N 361.427 0.422 10 10 FCCE C[C@H](O)[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCO1 823518882 DHUBCKHYUAMLPT-KSSFIOAISA-N 363.458 0.939 10 10 FCCE C[C@@H](O)[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 840261527 NNVSPJVHNRTFQO-DYVFJYSZSA-N 367.421 0.954 10 10 FCCE CC1(OCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CNC1 844176786 WHPIOGSUPLNHKW-OAHLLOKOSA-N 360.458 0.383 10 10 FCCE COCCNC1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 846333869 WPRZTTIXEMOYSG-UHFFFAOYSA-N 362.474 0.596 10 10 FCCE CN1CCCc2cc(CNC(=O)NC[C@@]3(CO)COCCN3C)ccc21 915389970 HBJALJFPYRMTIA-LJQANCHMSA-N 362.474 0.561 10 10 FCCE CN(C)c1ccc2nnc(CNC(=O)/C=C\c3ccc(O)c(O)c3)n2n1 1304041451 MUAOTPNNNBYNBI-YWEYNIOJSA-N 354.370 0.931 10 10 FCCE COc1cc(N2CCO[C@H](CS(C)(=O)=O)C2)c([N+](=O)[O-])cc1OC 1307219947 ASZOWDBDXBHSTK-JTQLQIEISA-N 360.388 0.862 10 10 FCCE COC(=O)c1cn(C2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)nn1 1567412776 NCLOQPFLJUEUMN-UHFFFAOYSA-N 360.370 0.882 10 10 FCCE Nc1ccc(N2C(=O)[C@@H]3CS(=O)(=O)C[C@H]3C2=O)c(Br)c1 1924756733 NLBRPIKDMIQCKN-HTQZYQBOSA-N 359.201 0.565 10 10 FCCE Cn1[nH]c(CNC(=O)OC(C)(C)C)nc1=NC(=O)c1ccc(O)c(O)c1 2126734686 SCWDERRXEXZASB-UHFFFAOYSA-N 363.374 0.925 10 10 FCCE NC(=O)[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CN(CCOc2ccc(N)cc2)C1 2162939208 LRSMEZOOBUBZRW-ZYHUDNBSSA-N 374.363 0.502 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@@H](C(=O)N3CC(N=[N+]=[N-])C3)O[C@@H]2C1 2253906419 LUKAXSSCGBMNTR-TUAOUCFPSA-N 353.379 0.911 10 10 FCCE Cc1ccc(CNS(=O)(=O)C[C@H](N)C(=O)O)c(O)c1Br 2380760338 WVFDPCORSKGLLQ-QMMMGPOBSA-N 367.221 0.294 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC3(N(C)C)CCC3)C2)cc1 828417561 CWPAJMGVHMMOIV-HNNXBMFYSA-N 374.485 0.991 10 10 FCCE CO[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@@H]1CCOC1 828497567 YYGHSGAIGIJWIQ-SJLPKXTDSA-N 373.453 0.847 10 10 FCCE O=C(O)c1cnn2c(O)cc(CN3CCS[C@@H]4COCC[C@H]43)nc12 1118318317 DPVGWMJMIBIZBO-VXGBXAGGSA-N 350.400 0.839 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(N2CC[C@H](O)C2)CC1 1119022992 KBZAOQVEAIEMEI-HNNXBMFYSA-N 359.426 0.292 10 10 FCCE CN(Cc1cc[nH]n1)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1329200942 VSENGKHULFLIAC-UHFFFAOYSA-N 371.441 0.646 10 10 FCCE COc1ccc(N2CCN(C(=O)CN=c3nc(O)cc(C)[nH]3)CC2)cc1 1858520774 LWWLGTXCEGBLOC-UHFFFAOYSA-N 357.414 0.682 10 10 FCCE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CN2CC(=O)NC2=O)cc1 265701323 YSSFWICGUHVEDY-MRXNPFEDSA-N 374.441 0.812 10 10 FCCE Cn1ccc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)n1 789859198 ADOHUJLHPFAASJ-UHFFFAOYSA-N 373.482 0.906 10 10 FCCE Cn1cc(/C=C\C(=O)N2C[C@@H](CO)Cc3ccccc32)c(=O)n(C)c1=O 816784638 QYPHVRUTZZPWPE-WSROAFLRSA-N 355.394 0.295 10 10 FCCE COC(=O)c1cc2ccccc2c(CN2CCN(CC(N)=O)C(=O)C2)c1O 840160817 XXRANUBAILSVJS-UHFFFAOYSA-N 371.393 0.462 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2CCNC[C@H]2C)cc1 846344719 TWTTZUCLMJQINW-PBHICJAKSA-N 362.474 0.704 10 10 FCCE CC(C)OC[C@H](O)CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 849328485 LURZFGHVVXZKMU-QGZVFWFLSA-N 356.488 0.797 10 10 FCCE COc1ccc(N2CCN(CC3CN(S(C)(=O)=O)C3)CC2)cc1F 929820958 IJQXUTRBYFYKQW-UHFFFAOYSA-N 357.451 0.848 10 10 FCCE O=C(NCc1ccc(O)cc1O)[C@@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1630306870 PDPSIBGBKQCBHR-ZJUUUORDSA-N 353.318 0.937 10 10 FCCE CS(=O)(=O)C1CN(c2cc3c(cc2Br)[C@H](N)C(=O)N3)C1 2152284534 LDCHFKBSYQXGKM-NSHDSACASA-N 360.233 0.634 10 10 FCCE CN1C(=O)NC(=O)C(=Cc2cc([N+](=O)[O-])ccc2N2CCOCC2)C1=O 2313526711 CGGAVZDBOSEUIW-UHFFFAOYSA-N 360.326 0.523 10 10 FCCE CCN(Cc1cc(O)n2ncc(C(=O)O)c2n1)[C@H](C)CS(=O)(=O)CC 737851149 HFAXYGJPZFVSEG-SNVBAGLBSA-N 370.431 0.778 10 10 FCCE COC[C@](C)(O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 754985305 CPSNUOXXQNBZCN-SFHVURJKSA-N 351.447 0.331 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(C(=O)NCCO)CC3)cc2N1 761885478 CHEOHJITLAVHIA-UHFFFAOYSA-N 364.358 0.251 10 10 FCCE COc1ccc(N(CC(=O)O)CC(=O)NCCC2CS(=O)(=O)C2)cc1 853004165 AGAREJZZTMDHHU-UHFFFAOYSA-N 370.427 0.137 10 10 FCCE COCCn1cc(S(=O)(=O)NNc2nc3cccnc3s2)cn1 857225445 MLZBYTIWPJWTOO-UHFFFAOYSA-N 354.417 0.840 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC[C@H](C(N)=O)C3)CC2)cc1 896329961 CZZYTULOZLBNMQ-JKSUJKDBSA-N 374.485 0.835 10 10 FCCE C[C@H]1CN(c2ccc(CNS(=O)(=O)C3CNC3)cc2F)C[C@H](C)O1 923592524 QGJJZEJDAVGHLI-RYUDHWBXSA-N 357.451 0.831 10 10 FCCE NC[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@@H]1C(F)(F)F 1119066066 GKTUDRGANLIBFO-PWSUYJOCSA-N 357.332 0.830 10 10 FCCE COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=O)C(=O)NCCc1ccc(N)cc1)C2 1331951253 TXOCBIPOGNDEOQ-BPUTZDHNSA-N 374.441 0.663 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)NCC(=O)NC3CC3)cc2)CC1 1684169612 OJAZWHDNOWQHPG-UHFFFAOYSA-N 373.457 0.466 10 10 FCCE COc1ccc(S(=O)(=O)NCCC(=O)OCC(=O)C(C)=O)cc1OC 808496270 IGPVOMYAAHDTJJ-UHFFFAOYSA-N 373.383 0.074 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CN(C)C(=O)[C@@H]3C)C2)cc1 834862727 XQXCAFWSIWHSPN-KBPBESRZSA-N 374.441 0.284 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)N2CCc3cc(Cl)nnc3C2)cc1 1118255041 OIENNIGKGFAROS-UHFFFAOYSA-N 359.817 0.956 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1csc(CO)n1 1296054888 NHDVGDVPBNLBNF-JTQLQIEISA-N 366.395 0.951 10 10 FCCE CCON(C)C(=O)CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1329809438 CIMXNSWFXDZHMG-UHFFFAOYSA-N 354.382 0.034 10 10 FCCE CNC(=O)NCCC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1471911713 FDTBDXHVIQCWAL-UHFFFAOYSA-N 361.446 0.324 10 10 FCCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C[C@@H]2CNC(=O)O2)nn1 1638347096 CITFAMJULLWNAJ-ONGXEEELSA-N 361.358 0.159 10 10 FCCE O=C(NCc1c(O)cccc1F)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 1638863231 KYJIWQFNRVEAEO-MNOVXSKESA-N 370.402 0.183 10 10 FCCE COC(=O)[C@@H]1CS(=O)(=O)CCN1Cc1ccc(N2CCOCC2)cc1 1655799456 BJZOPVFVKNIMKJ-INIZCTEOSA-N 368.455 0.295 10 10 FCCE COc1ccc(N2CCN(S(=O)(=O)[C@@H]3CCS(=O)(=O)C3)CC2)cc1 1890877573 HJOUECNDQCFNKQ-OAHLLOKOSA-N 374.484 0.334 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CC(N)C1 2080879409 ADZXMOPFDGJSKI-LBPRGKRZSA-N 351.403 0.703 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@H](Cn2ccnn2)C1 850602205 QQYFOPFVMZDCIQ-INIZCTEOSA-N 370.457 0.851 10 10 FCCE CN(C)S(=O)(=O)N1CC(NCc2ccc(N3CCOCC3)c(F)c2)C1 858311626 KAIMYZMHNREBCP-UHFFFAOYSA-N 372.466 0.243 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)Cn3cncc(OC)c3=O)CC2)cc1 905986086 GOTOORGPCBZSEV-INIZCTEOSA-N 374.441 0.444 10 10 FCCE CCS(=O)(=O)N1CC(CNCc2ccc(N3CCOCC3)cc2)C1 190287186 KJBRDBKLTHCQHD-UHFFFAOYSA-N 353.488 0.894 10 10 FCCE O=CN1CCN(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)CC1 195093709 JUTSGDAHGKTHAT-UHFFFAOYSA-N 352.460 0.395 10 10 FCCE Cn1c(O)ncc(C(=O)NCc2cc(Br)ccc2O)c1=O 804733325 OSAZTVOGDTUVHN-UHFFFAOYSA-N 354.160 0.884 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN2CCN(CCN(C)C)C(=O)C2)c1O 846015370 WUYJZLKGCDHGHA-UHFFFAOYSA-N 352.391 0.515 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3[C@H]4CC[C@@H](NC4)[C@H]3C2)cc1F 861751129 YZHWEGSVQBAXRD-QSJFSLAZSA-N 374.460 0.964 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCc2cnn(CCF)c2)cc1F 929800484 GTTDDGRVVIEKNF-UHFFFAOYSA-N 365.384 0.990 10 10 FCCE C[C@H](NC(=O)C(=O)N1CC[C@@]2(O)C[C@H]2C1)c1ccc(N2CCOCC2)cc1 1118602627 DCZDQWMAZPHILT-DKICVRJWSA-N 373.453 0.684 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN(C)[C@@H](CC(C)C)C(N)=O)nc12 1648139779 PKTBLYLSXHKVSC-ZDUSSCGKSA-N 363.418 0.943 10 10 FCCE CCS(=O)(=O)N1CC(CNC(=O)NCc2ccc(N(C)C)c(F)c2)C1 187763073 IRWCKASLJOKBNL-UHFFFAOYSA-N 372.466 0.972 10 10 FCCE O=C(O)CNC(=O)CN1C(=O)/C(=C\c2ccccc2O)SC1=S 210680137 NDBSIJIGXQMBOU-BJMVGYQFSA-N 352.393 0.794 10 10 FCCE COc1cccc(CNC(=O)NCCCN2CCCS2(=O)=O)c1O 745795575 HCPSQKLIJVHRDD-UHFFFAOYSA-N 357.432 0.626 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCCCNC1 842190733 HYRFFMKOVLYFGM-INIZCTEOSA-N 360.458 0.398 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3CCNC(=O)C3)cc2)CC1 1155604778 XWAOOMQOVFFFPQ-HNNXBMFYSA-N 358.442 0.531 10 10 FCCE c1cc(N2CCOCC2)ccc1Cn1nnnc1N1C[C@@H]2CC[C@H](C1)O2 1335319129 HRKARLYZQFINBL-CALCHBBNSA-N 356.430 0.926 10 10 FCCE C[C@@]12COC[C@@H]1CN(C(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)C2 1347444478 KMRYLMWWCGPIQT-OXJNMPFZSA-N 373.453 0.634 10 10 FCCE Cn1c(=O)c2cc(NC(=O)Cc3ccc(O)c(O)c3)cnc2n(C)c1=O 1539687710 HVHPIBOLKYLDKY-UHFFFAOYSA-N 356.338 0.225 10 10 FCCE COc1ccc(CNC(=O)[C@H](CO)NC(=O)c2ccc(F)cc2)c(O)c1 1626079361 BNPHLCYEGSNHIK-HNNXBMFYSA-N 362.357 0.947 10 10 FCCE NC(=O)[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CN(C(=O)Cc2ccc(N)cc2)C1 2162969512 QHIRRQZYOLIBKF-ZYHUDNBSSA-N 372.347 0.192 10 10 FCCE CCN(CCN=[N+]=[N-])C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C[C@@H]1O 2315992114 HNGPKMIFIVCIGP-XHDPSFHLSA-N 357.411 0.878 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)CN(C)C(N)=O)cc2F)CC1 106928725 LKRDDXNOXXMBNK-UHFFFAOYSA-N 351.426 0.594 10 10 FCCE COC(=O)[C@H]1CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 298743477 SYMUKXQNFBAFKZ-HNNXBMFYSA-N 361.442 0.839 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@]3(C)CCOC3)C2)cc1 828142732 JLCZIXWQZZWFKD-KUHUBIRLSA-N 361.442 0.933 10 10 FCCE COC(=O)N(C)CCN(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 828497147 RNIMMCJCCHBJHK-UHFFFAOYSA-N 374.441 0.836 10 10 FCCE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)c2c(F)ccc(O)c2O)C1 832020120 DXDLBECTLOUOEI-SECBINFHSA-N 361.395 0.238 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CCN(C)S1(=O)=O 843908772 PYYFNSUHYVJCKG-CQSZACIVSA-N 370.427 0.318 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@]34CNC[C@H]3COC4)cc2)C1 846672857 LZJUYNVBBKDAJT-GUXCAODWSA-N 372.469 0.241 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@H]3CCCNC3)C2)cc1 851687908 KVZMBXLUZJMBRD-GJZGRUSLSA-N 360.458 0.506 10 10 FCCE CO[C@@]1(C(=O)NCc2ccc3cccnc3c2O)CCS(=O)(=O)C1 1142730639 CAHSUWCSFHMNLR-INIZCTEOSA-N 350.396 0.760 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)CN3CCOCC3)cc2F)CC1 1293087821 KUQDPCVSKIDBAE-UHFFFAOYSA-N 364.465 0.916 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@H]3C[C@H](OC)C3)C2)cc1 1331843796 KJQZEZITTORPBU-ZQIUZPCESA-N 361.442 0.931 10 10 FCCE Cc1noc(CN(C)c2nnnn2Cc2ccc(N3CCOCC3)cc2)n1 1343684062 IACABPWUGKWJRG-UHFFFAOYSA-N 370.417 0.886 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@@]2(O)C[C@H]2C1 1350673833 KNVCYTXZOIKNOL-HNAYVOBHSA-N 359.426 0.123 10 10 FCCE CC(C)(C)OC(=O)N1CC(CO)(NS(=O)(=O)Cc2ccc(N)cc2)C1 2044238839 BMSDITGTAWHBQM-UHFFFAOYSA-N 371.459 0.670 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)NC[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2060641583 KYAHAMUKGWLVGA-JTQLQIEISA-N 352.395 0.929 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@H]1C(=O)NCCCCN=[N+]=[N-] 2064133716 XYNGPUMKNGEGNX-SRVKXCTJSA-N 357.411 0.924 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCN4CCOC[C@H]4C3)CC2)cc1 368826057 PPBVOZRTAVXLAN-GOSISDBHSA-N 374.485 0.360 10 10 FCCE CN1CCO[C@@H](CS(=O)(=O)N2CCOc3cc(N(C)C)ccc32)C1 632051063 AXYVDAPJOWQYKY-CQSZACIVSA-N 355.460 0.612 10 10 FCCE CCOC(=O)[C@@H](C)NC(=O)[C@@H](C)NC(=O)NCc1ccc(OC)cc1O 793083442 CQIPOKWXTOQFOI-GHMZBOCLSA-N 367.402 0.656 10 10 FCCE CCN1C[C@H](S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)CC1=O 866757096 JCBCVVUSQFNNLI-HUUCEWRRSA-N 354.476 0.293 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(c2ccncc2)CC1 1335541210 CHESPRBCRVFYGG-UHFFFAOYSA-N 352.394 0.978 10 10 FCCE C[C@@H](NC(=O)c1cc2n(n1)CCN(C)S2(=O)=O)c1ccccc1O 1643741855 CFCUFBLMARQZGL-SNVBAGLBSA-N 350.400 0.714 10 10 FCCE O=C(NCc1c(O)cccc1O)[C@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1647289881 LEPUZKPYNADITG-DTWKUNHWSA-N 353.318 0.937 10 10 FCCE COc1ccc(N2CCN(C(=O)CCS(=O)(=O)N(C)C)CC2)cc1 41228200 WSCBMEREBHZYGM-UHFFFAOYSA-N 355.460 0.625 10 10 FCCE COc1cc(O)c(CN2CCN(C(=O)N3CCNCC3)CC2)cc1OC 530241726 ITFPTDBSGLKROP-UHFFFAOYSA-N 364.446 0.552 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1C[C@H]2COC[C@@H](C1)O2 800999052 PLOXONRTTGCRTO-GASCZTMLSA-N 365.405 0.972 10 10 FCCE CN(C)S(=O)(=O)N1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 811789092 QXGFSCKRVXVONI-OAHLLOKOSA-N 371.459 0.132 10 10 FCCE CN1CC[C@H](C(=O)NCc2cc(Br)ccc2O)S1(=O)=O 843884388 BKNHSNABPBARLI-LLVKDONJSA-N 363.233 0.805 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3cccn(C)c3=O)C2)cc1 850537024 MEPXXCIZSAYRMA-CYBMUJFWSA-N 370.409 0.728 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)[C@@H](O)c3cnc[nH]3)CC2)cc1 864615422 CDPYVMSQJJCVBX-SFHVURJKSA-N 373.457 0.780 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCCC2CS(=O)(=O)C2)cc1F 1345506839 SLUJKQHLDRKWQF-UHFFFAOYSA-N 371.434 0.059 10 10 FCCE CNC(=O)CCCC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1644864142 ZLZBIHVVUGGANV-UHFFFAOYSA-N 360.458 0.921 10 10 FCCE CN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 1773109804 MFZHJKLMHJWXAZ-FWPCIQOSSA-N 354.428 0.993 10 10 FCCE COC(=O)CC1(NCc2cc3c(cc2O)OCO3)CCS(=O)(=O)CC1 784670374 KKPTWDDCECIDGV-UHFFFAOYSA-N 371.411 0.721 10 10 FCCE CN1CCN(CC(=O)NCc2cc(Br)ccc2O)CC1=O 804735936 LTLXFEMUHYDCSW-UHFFFAOYSA-N 356.220 0.545 10 10 FCCE COCCNS(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)C(C)=O)c1 808494712 CUOCQYRXXWWITQ-UHFFFAOYSA-N 357.384 0.235 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](C)Cn3cncn3)CC2)cc1 818981361 RTOXWMNDOQZWPZ-WMZOPIPTSA-N 374.489 0.448 10 10 FCCE COC(=O)c1nc(=NCCN2CCN(c3ccc(OC)cc3)CC2)cc[nH]1 853234173 BOFJXZCHNIKCFF-UHFFFAOYSA-N 371.441 0.928 10 10 FCCE CCOc1ccc(N2CCN(C(=O)C3=NN(CCO)C(=O)CC3)CC2)cc1 1137658802 WRAKRYGZHLDAOE-UHFFFAOYSA-N 374.441 0.705 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H]4CN(C)C[C@@]4(C)C3)nc12 1473842170 LIHJATZBWXVBSU-XIKOKIGWSA-N 359.430 0.995 10 10 FCCE CN1CC[C@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1=O 1564621406 QZBCISGNTOQUDQ-INIZCTEOSA-N 373.457 0.418 10 10 FCCE NS(=O)(=O)c1cccc2c1CCN(C(=O)Cc1ccc(O)c(O)c1)C2 1650813103 FTLJMLOIPVERPX-UHFFFAOYSA-N 362.407 0.873 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1CNCC(=O)N1 1952346475 MGSHGXRJILJDDQ-RYUDHWBXSA-N 351.403 0.622 10 10 FCCE O=S1(=O)C[C@H](O)[C@@H](NCc2cc(Br)cc(F)c2O)C1 2121362400 ASTNEZZWCRTVRJ-UWVGGRQHSA-N 354.197 0.541 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)Nc1nn[nH]n1 2124603315 WMNDKOYOFJYGNX-VIFPVBQESA-N 364.362 0.685 10 10 FCCE CC(C)(C)OC(=O)N1CCC[C@@](CO)(NC(=O)c2cc(O)nc(O)c2)C1 711743719 VHJUNRXVYLIGDG-QGZVFWFLSA-N 367.402 0.985 10 10 FCCE CN(C)c1ccc([C@@H](N)CNC(=O)CS(=O)(=O)NC(C)(C)C)cc1 832272972 KTFJAFHQXFOSAP-AWEZNQCLSA-N 356.492 0.587 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CC(=O)N(CCN(C)C)C3)C2)cc1 855232652 WGTPGJCLAPGPJX-HOTGVXAUSA-N 374.485 0.800 10 10 FCCE OCCOCC1(O)CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 895827883 QOBFHXUTFJJXDP-UHFFFAOYSA-N 368.449 0.998 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCNC(=O)CC3)cc2)CC1 1324553531 QMZPKEUKBRINIR-KRWDZBQOSA-N 372.469 0.888 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2[C@@H]3C[C@@H]4[C@@H]2OC[C@@H]4C3)c1 1454704663 UMHANGFKDXTZEF-CNPGTBMKSA-N 352.412 0.917 10 10 FCCE COC[C@H](C)S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 275335589 UQEWKXAKMJJYNG-QMMMGPOBSA-N 366.417 0.533 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCN4CCOC[C@@H]4C3)nc12 368816070 IURCYSSICDJWBR-ZDUSSCGKSA-N 361.402 0.128 10 10 FCCE C[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)N(C)CC(=O)NC1CC1 759597821 SJKYHKSGECOAOZ-OHYQPGSNSA-N 362.382 0.780 10 10 FCCE O=C1CCN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CCN1 838747711 WKFYXJWSSTUGSH-UHFFFAOYSA-N 368.384 0.833 10 10 FCCE O=C1N[C@@H](CF)C(=O)N1Cc1ccc(N2CCS(=O)(=O)CC2)cc1 849359366 PHPJRNMWPHNECD-ZDUSSCGKSA-N 355.391 0.311 10 10 FCCE Cn1nnnc1CCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852237277 VBTHNQVOKSXOMC-UHFFFAOYSA-N 359.434 0.213 10 10 FCCE O=S(=O)(C[C@@H]1CNCCO1)N(Cc1ccccc1O)C[C@@H]1CCCO1 866751196 SSGXRIADKAITTK-HOTGVXAUSA-N 370.471 0.691 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCn2ncnc21 1611049932 SFUXVRGOMGJYAD-OLZOCXBDSA-N 374.397 0.857 10 10 FCCE Cc1nc(S(=O)(=O)NCC(=O)NCc2cccc(Cl)c2O)cn1C 1647826751 IGPHUDVWGPTRGG-UHFFFAOYSA-N 372.834 0.682 10 10 FCCE COc1c([N+](=O)[O-])ccc(CNCCCN2CCCS2(=O)=O)c1O 775012391 IEHDISRFVHRSHQ-UHFFFAOYSA-N 359.404 0.824 10 10 FCCE Cn1nccc1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788319541 LPFZNTDUVXXVEP-UHFFFAOYSA-N 357.414 0.189 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)NCC2(N)CCOCC2)cc1 861766271 NIMJWJAHYSBHBM-UHFFFAOYSA-N 362.474 0.773 10 10 FCCE CCOC(=O)[C@H]1NC(=O)N(Cc2ccc(N3CCN(C)CC3)cc2)C1=O 925079501 JMDLNCUQNZBXEJ-HNNXBMFYSA-N 360.414 0.422 10 10 FCCE COC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc(OC)cc2O)C1=O 1139031646 CSSCRVWTGFFKDP-CYBMUJFWSA-N 350.371 0.429 10 10 FCCE CN(C)CCC[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)CCO1 1261627869 JUXMMGXLYQCZMI-MRXNPFEDSA-N 363.458 0.920 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@]3(CNC(=O)C3)C2)cc1 1321599307 VFYBRYLCCUVYBF-HXUWFJFHSA-N 372.469 0.888 10 10 FCCE Cc1nn(C)c2c1[C@@H](c1ccc(O)c(O)c1)C(C(=O)N1CC(O)C1)=C(N)O2 1865026849 BNRYURMOFABQIX-CQSZACIVSA-N 372.381 0.037 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CCNC(=O)c1cc(O)nc(O)c1)C(=O)O 2034327084 FZDXIRFEEQQDQE-VIFPVBQESA-N 355.347 0.591 10 10 FCCE CN(C(=O)[C@@H]1[C@@H](O)[C@H](O)CN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2080685587 ADNRYIPCPUYZJD-RDBSUJKOSA-N 351.403 0.573 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@@H](O)CC(F)(F)C2)c1 787837418 RFOYEHRXMCVQOR-VIFPVBQESA-N 350.343 0.606 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN(CCO)[C@@H]3CCO[C@H]3C)nc12 796573901 FLERFTJWPHLDAK-SMDDNHRTSA-N 364.402 0.583 10 10 FCCE CN(Cc1cn(CC(N)=O)nn1)c1ccc(OCCN2CCCC2)cc1 839005606 QDPNOWMOGYAREA-UHFFFAOYSA-N 358.446 0.874 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)CCOC3CNC3)cc2)CC1 1329286536 DQOBGAOLITYWGD-UHFFFAOYSA-N 360.458 0.350 10 10 FCCE CC(C)(C)OC(=O)NCc1nc(=NCc2ccc(O)c(O)c2O)[nH][nH]1 2063192058 BQHGAKCNWKKQMB-UHFFFAOYSA-N 351.363 0.980 10 10 FCCE C[C@@H](Cc1ccc(O)c(O)c1)NCCn1cnc2c1c(=O)n(C)c(=O)n2C 33829324 KSWSOCZUAISECK-NSHDSACASA-N 373.413 0.066 10 10 FCCE COCCOCCS(=O)(=O)N1CCc2cc(N3CCOCC3)ccc21 62526700 DCYBQOHQTZNGPO-UHFFFAOYSA-N 370.471 0.879 10 10 FCCE CCOC(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)NCc1ccc(OC)cc1O 793083445 CQIPOKWXTOQFOI-WDEREUQCSA-N 367.402 0.656 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN(CCO)[C@H]3CCO[C@@H]3C)nc12 796573897 FLERFTJWPHLDAK-RISCZKNCSA-N 364.402 0.583 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)Cn3cncn3)C2)cc1 827607482 BEAPTDIFGPROEF-KGLIPLIRSA-N 372.429 0.187 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)[C@H](C)CO)CC2)cc1 828846829 UOVICOIKVLYTOF-JFIYKMOQSA-N 351.491 0.785 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CC=C[C@@H]3CO)C2)cc1 1331799847 UPUFFFFYNYSCJJ-GOEBONIOSA-N 359.426 0.397 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H]3CCNC(=O)[C@@H]32)c1 1455183834 HXYDTHRKGZZSKN-IINYFYTJSA-N 367.427 0.504 10 10 FCCE NC(=O)[C@@H]1CC(C(=O)NCc2ccc(O)cc2O)=NN1c1ccccc1 1639441309 PFSZUVLKNRZCIV-HNNXBMFYSA-N 354.366 0.834 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CCCn3c(O)nnc3O)C2)cc1 1645242649 PAHLOKBRNWHZAS-LBPRGKRZSA-N 361.402 0.873 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2081034540 HFWNOOKCTHKEAI-BJDJZHNGSA-N 355.395 0.486 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNCc1ccc(O)c(O)c1O 2333605863 AJNQRNBCTDPDTJ-SUHUHFCYSA-N 370.402 0.234 10 10 FCCE C[C@H]1OC(=O)N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1=O 871780442 OIKGDRLQPRNBAA-LLVKDONJSA-N 365.361 0.646 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCCNC(=O)[C@H]3CC)nc12 1560167982 XBSZGDSIOQTPCQ-CYBMUJFWSA-N 361.402 0.712 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CN1CCC[C@@H](C(=O)OC)C1=O 1636062800 GBAGICZTYQASDF-GFCCVEGCSA-N 369.414 0.906 10 10 FCCE O=C1C[C@H](CNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CN1 1683196019 XEJCFRNXPCMZRA-LBPRGKRZSA-N 368.384 0.737 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2310482334 IECWPJKZVBUYOE-IRCOFANPSA-N 355.395 0.629 10 10 FCCE CC(=O)NC1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 189889315 ZSRSRLUTEBFZCQ-UHFFFAOYSA-N 350.394 0.692 10 10 FCCE COc1ccc(N2CCN(CCN3C(=O)N[C@@H](CF)C3=O)CC2)cc1 287155961 AGZJNPSHSSBNOR-HNNXBMFYSA-N 350.394 0.707 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)C1(n2cnnn2)CCOCC1 611657037 IILDKEHLMMRIKI-UHFFFAOYSA-N 358.402 0.670 10 10 FCCE C[C@@H](NC(=O)CS(=O)(=O)N(C)C)c1ccc(N2CCOCC2)cc1 751539118 TXTVNIPCYUCQIB-CYBMUJFWSA-N 355.460 0.592 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)N2CCCC[C@@H]2CN2CCOCC2)cc1 842238171 JPDZVOBIYXCQLM-GOSISDBHSA-N 374.485 0.641 10 10 FCCE COC(=O)[C@@H]1CN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CCO1 854301535 QBVUFIYPGHMNRB-CJNGLKHVSA-N 363.414 0.857 10 10 FCCE CCN1C(=O)CO[C@H](C(=O)NCc2ccc(O)c(O)c2)[C@H]1c1nccn1C 860243692 USCGGCZIYVCVSC-HOTGVXAUSA-N 374.397 0.436 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CC=C[C@@H]1CO 1119531283 YHAXHDRVVRYGCZ-CQSZACIVSA-N 363.389 0.038 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)NCC[C@H]3CNC(=O)C3)ccc21 1334733167 LRVWRUDTHUXPGV-CQSZACIVSA-N 358.442 0.328 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN2CCC[C@@]3(C2)NC(=O)NC3=O)c1O 279164354 AYWIBOOGNOSKMT-HNNXBMFYSA-N 350.331 0.483 10 10 FCCE COCCCOC1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 748420641 YPYWVWCYFPBNBF-UHFFFAOYSA-N 358.416 0.641 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)NCc3ccnn3C)C2)cc1 824928899 MFDNYVNPKPSWBD-CQSZACIVSA-N 371.441 0.688 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H](N)CCN(C)C)CC2)cc1 846673741 DVWPEYGESQGRJC-GOSISDBHSA-N 363.506 0.212 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H]3[C@@H]2CCCN3CCO)cc1 929236829 DMIOYSUEKDRQAE-ROUUACIJSA-N 374.485 0.426 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NC(=O)c1cc(O)c(O)c(O)c1 1148586562 SCCDLEFNTDOPCF-ZJUUUORDSA-N 354.359 0.825 10 10 FCCE COC(=O)[C@@H]1C[C@@H]1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1288914095 AVBIKBNLTNDNSN-JKSUJKDBSA-N 359.426 0.814 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3C[C@@H]4C[C@@H]4C3)cc2)CC1 1331763764 AUCVUXIQAYHVIH-BJWYYQGGSA-N 356.470 0.969 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)Cn3nccc3N)cc2)CC1 1447716494 XFTLIBDWMXRZSC-UHFFFAOYSA-N 356.430 0.450 10 10 FCCE Cc1ccc(O)c(CNC(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)c1 1584983874 UJHGJAAJKUXVHM-UHFFFAOYSA-N 362.407 0.890 10 10 FCCE Cc1cc(C(=O)NC[C@@]2(O)CCS(=O)(=O)C2)c(C)n1-c1ccccn1 1624259300 IUVSRSBCLXYYCB-KRWDZBQOSA-N 363.439 0.769 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnnn3C)CC2)cc1 1645464041 ZPTZROMFKZFRDE-BQYQJAHWSA-N 370.413 0.667 10 10 FCCE O=S1(=O)CCN(Cc2c(O)cccc2Br)C2(CNC2)C1 2183495703 DAUQWYDHENACPL-UHFFFAOYSA-N 361.261 0.727 10 10 FCCE CNS(=O)(=O)[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 376666791 WBPQHAICAOHGOI-SECBINFHSA-N 370.387 0.444 10 10 FCCE COCCN(Cc1ccnn1C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785443894 PELOWNCPUUZYSM-UHFFFAOYSA-N 373.457 0.778 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCC(=O)N3C)CC2)cc1 806847021 GMSMOYGHLZVEJQ-QGZVFWFLSA-N 360.458 0.554 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC3=CCNCC3)C2)cc1 851689392 OIFGOKVBHAUTID-OAHLLOKOSA-N 358.442 0.426 10 10 FCCE O=C(NCc1ccc2cccnc2c1O)C1(n2cnnn2)CCOCC1 862024547 ANWZTOQQOBITNG-UHFFFAOYSA-N 354.370 0.749 10 10 FCCE COC(=O)[C@@H]1C[C@H](N2C(=O)CNC2=O)CN1Cc1cc(F)cc(F)c1O 895380107 XPXNBWOSULAGJX-JQWIXIFHSA-N 369.324 0.338 10 10 FCCE COC(=O)[C@H]1CCCN(CC(=O)NCc2ccc(OC)cc2O)C1=O 1139031647 CSSCRVWTGFFKDP-ZDUSSCGKSA-N 350.371 0.429 10 10 FCCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)C1CS(=O)(=O)C1 2076837607 MLKVVYMWYDLTHG-QWRGUYRKSA-N 373.435 0.836 10 10 FCCE CN1CCO[C@@H](CNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 104799448 JQKLSEGUTLEKAV-SFHVURJKSA-N 362.474 0.995 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1C[C@H](O)CN1C(=O)c1ccc2c(c1)CCC2 808512266 PTEYBYKHYQNWFH-JKSUJKDBSA-N 359.378 0.452 10 10 FCCE CCON(C)C(=O)CNC(=O)NCc1ccc(N2CCOCC2)cc1 844912705 JFRSMJRRSAFVOG-UHFFFAOYSA-N 350.419 0.732 10 10 FCCE CN1CCN(c2ccc(CN3CCN(c4nncn4C)CC3)cc2)CC1 848925111 NTCYQKSNPFXMRV-UHFFFAOYSA-N 355.490 0.889 10 10 FCCE CNCCOCCN(C)C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 863753493 WCCUGDWNRZHFHJ-UHFFFAOYSA-N 350.463 0.405 10 10 FCCE CC(C)(C)OC(=O)N(CCCOc1nnc(=N)[nH]n1)C1CCOCC1 2327746086 SBWBCBUVKDGTFL-UHFFFAOYSA-N 354.411 0.864 10 10 FCCE Cc1ccc(C(=O)N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)c(O)c1O 805485647 MHGCHDBZJIZYBD-LLVKDONJSA-N 357.432 0.407 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 808502947 WUYDSXRQSKATMV-ZDUSSCGKSA-N 353.396 0.789 10 10 FCCE COC(=O)CC[C@H](N)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 827363979 CAYPGHBQMSNGCU-HNNXBMFYSA-N 367.421 0.684 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3CCN(C4CC4)C3)C2)cc1 827489133 NXFBKTXMYWNHFZ-HUUCEWRRSA-N 372.469 0.743 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](CO)[C@H](C(F)(F)F)C1 1329464683 XLXVHFWGJFCNRM-NWDGAFQWSA-N 360.332 0.980 10 10 FCCE CCN(CC(=O)OC)C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1 754030219 MXQPOCVQWLBTHU-QGZVFWFLSA-N 365.474 0.673 10 10 FCCE CN1CCN(c2ccc(CN3CCC[C@H](CS(N)(=O)=O)C3)cc2)CC1 775689074 ZCCJHQHPDZBVPH-KRWDZBQOSA-N 366.531 0.939 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)CCCCC(N)=O)CC2)cc1 779751231 DWFPDKWINRSISC-UHFFFAOYSA-N 362.474 0.979 10 10 FCCE Cn1cc(/C=C/C(=O)N2CC[C@@H](C(=O)O)c3ccccc32)c(=O)n(C)c1=O 841773221 GHGAROOPMWYGIO-HSBSLETESA-N 369.377 0.702 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C3CN(S(C)(=O)=O)C3)C2)cc1 912292902 QAHPGCGTWKISRI-CYBMUJFWSA-N 353.444 0.282 10 10 FCCE C[C@H](NC(=O)NCCS(=O)(=O)N=S(C)(C)=O)c1ccccc1O 1685272340 HGMHBZIGEMBQCU-JTQLQIEISA-N 363.461 0.810 10 10 FCCE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2299123706 VCIWCQXBRCCHGE-NXEZZACHSA-N 361.424 0.836 10 10 FCCE CC(C)(C)OC(=O)N1CC2(CCOCC2)[C@@H]1COc1nnc(=N)[nH]n1 2327760207 KPZVPKAPWMOROH-JTQLQIEISA-N 352.395 0.474 10 10 FCCE O=C(O)CNS(=O)(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 527436145 HAGIFZUKZUXKHI-UHFFFAOYSA-N 360.347 0.793 10 10 FCCE O=C(CN1C[C@@H](O)C2(CC2)C1)NCc1ccc(N2CCOCC2)c(F)c1 375315772 UJOMDEHILHFDCV-QGZVFWFLSA-N 363.433 0.735 10 10 FCCE COc1cc(-c2nnc(SCC(=O)C(C)=O)n2N)cc(OC)c1OC 289804039 YRRVRBGEGBOWHY-UHFFFAOYSA-N 366.399 0.935 10 10 FCCE COc1ccc(N2CCN(C(=O)Cc3c(O)ncnc3O)CC2)cc1F 900996487 AZZABLYEOZTHHV-UHFFFAOYSA-N 362.361 0.927 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@H]([C@H](C)O)C3)nc12 839669535 AMCIFKMONIWLSY-GXFFZTMASA-N 350.375 0.193 10 10 FCCE COc1cnccc1N1CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 841119386 DNJPIJVNTLDSJP-UHFFFAOYSA-N 355.398 0.960 10 10 FCCE CNS(=O)(=O)[C@H]1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 749901213 GEVLVRMTPBJZMJ-RNZFLTOJSA-N 369.399 0.909 10 10 FCCE CN(C)c1ccc([C@H](CNC(=O)C(=O)NCc2ccnn2C)N(C)C)cc1 929502047 DDOVMTPTEOWNDI-KRWDZBQOSA-N 372.473 0.521 10 10 FCCE O=C(NCCO)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nn1 853955336 LNMFBBINXABXAJ-UHFFFAOYSA-N 371.441 0.772 10 10 FCCE CCC[C@@H](C(=O)N1CCN(c2ccc(OC)cc2)CC1)S(N)(=O)=O 854198083 CKGSAVRILLOAQI-HNNXBMFYSA-N 355.460 0.801 10 10 FCCE C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCO1 1119816039 ITZXQPFYFWVDKV-MRXNPFEDSA-N 374.485 0.692 10 10 FCCE Cn1c(O)nc(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1=O 1306939867 LMMDQSDXRJEOMS-ZDUSSCGKSA-N 357.414 0.800 10 10 FCCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCO[C@]2(CCS(=O)(=O)C2)C1 1326349039 YCLHWOXAGKCRRF-WPTTZPOMSA-N 353.396 0.527 10 10 FCCE O=C(NCc1ccc(O)c(O)c1)[C@@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1595596539 XQMCBPRFMFFFFK-BDAKNGLRSA-N 353.318 0.937 10 10 FCCE CCOC(=O)c1c(NC(=O)[C@H](O)[C@@H](O)C(=O)O)sc2c1CC[C@@H](C)C2 1865946130 SCZWVNUGAWENCD-NZXMKCKXSA-N 371.411 0.795 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NCC[C@@H](C)O)CC2)cc1 265205580 UPHMIEGLYGMRNU-OAHLLOKOSA-N 350.463 0.887 10 10 FCCE O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)CN1CCOCC1 819361340 OWOIKPOHXUAKMF-OAHLLOKOSA-N 371.428 0.584 10 10 FCCE Cn1nccc1[C@H]1COCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1332075840 XSTNUSJABLACIO-OAHLLOKOSA-N 356.382 0.568 10 10 FCCE CN(CCn1cccn1)c1nnnn1Cc1ccc(N2CCOCC2)cc1 1334005547 AQQFRDMIJXYJMC-UHFFFAOYSA-N 368.445 0.891 10 10 FCCE Cc1cc(C(=O)NC[C@H](O)CS(C)(=O)=O)c(C)n1-c1ccccn1 1456615433 WXJOXVVZPRIKOG-ZDUSSCGKSA-N 351.428 0.624 10 10 FCCE COc1cc(N2CCC(O)(COCCO)CC2)c([N+](=O)[O-])cc1OC 1651432549 UGHLZEVNLJCHBB-UHFFFAOYSA-N 356.375 0.952 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1C[C@@H](O)C[C@H]1CO 1683018076 DIRSEOYWYLNTJD-STQMWFEESA-N 371.384 0.439 10 10 FCCE CN(C)c1ccc([C@H](CNS(=O)(=O)N(C)C)N2CCOCC2)cc1 36100229 QEJWFOZXUFYLAS-INIZCTEOSA-N 356.492 0.522 10 10 FCCE Cc1noc(C)c1S(=O)(=O)N[C@H](C)C(=O)NCCc1ccc(N)cc1 152511098 DWKOGHIIMIUOFA-LLVKDONJSA-N 366.443 0.899 10 10 FCCE C[C@@H](Cn1cncn1)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 285613212 CSPWLAUGWIWGNB-ZDUSSCGKSA-N 356.430 0.482 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@@H]2COC[C@H]2C1 827079592 YHQWNQRTCSAKEE-IAGOWNOFSA-N 373.453 0.634 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCNC[C@@H]3C)CC2)cc1 842266346 QDLDQAYTSRCWCG-YJBOKZPZSA-N 374.485 0.848 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCC3(CCN3)CC2)cc1 846362745 KNHNDYUNJOWINC-UHFFFAOYSA-N 374.485 0.944 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCC[C@](N)(CO)C3)CC2)cc1 923479859 XQBMLCUDBCEAJR-LJQANCHMSA-N 362.474 0.129 10 10 FCCE NC(=O)c1ccc(NC=C2C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1 2297620280 SWGSNYQISNHHMF-UHFFFAOYSA-N 354.322 0.953 10 10 FCCE CS(=O)(=O)C1(C(=O)O)CN(Cc2cc(Br)ccc2O)C1 2379847034 SYOJGDKMZXRNOJ-UHFFFAOYSA-N 364.217 0.838 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N[C@@H]1CCC(=O)N(C)C1 817822319 LVXPRCYHXOFOEL-GDBMZVCRSA-N 374.485 0.845 10 10 FCCE CS(C)(=O)=NS(=O)(=O)CCNC(=O)c1c(F)ccc(O)c1O 1184327624 WKEGXZSDLMWBCF-UHFFFAOYSA-N 354.381 0.024 10 10 FCCE COC(=O)[C@]1(N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)CCOC1 1335429290 MBNJGGRZZJTGHH-KRWDZBQOSA-N 368.361 0.327 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCNC[C@H]1c1cccnc1 1348857771 SIVGDARHJTVFNW-INIZCTEOSA-N 354.410 0.919 10 10 FCCE C[S@](=O)CCN1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1444492833 YAXXQUIVOQPJHX-DEOSSOPVSA-N 351.432 0.985 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2132348947 VUMBUKRHJNTGNV-MNOVXSKESA-N 368.386 0.904 10 10 FCCE CNC(=O)CN1CCN(C(=O)c2c(C)oc(-n3cccc3)c2C#N)CC1 120629861 DXVIUIAWFOBJFU-UHFFFAOYSA-N 355.398 0.754 10 10 FCCE CS(=O)(=O)[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 763543181 MIKSELHXNDUFDB-SECBINFHSA-N 355.372 0.939 10 10 FCCE COC(=O)c1cnn(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 843292288 GAJQMGXELQBUMT-KRWDZBQOSA-N 374.441 0.861 10 10 FCCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(C(=O)NCc3ccc(N(C)C)cc3)C[C@@H]12 853244230 IIMDTJIBFFKRRR-XHSDSOJGSA-N 367.471 0.706 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CCn3cc[nH]c(=O)c3=O)C2)cc1 855228684 CYBXUGIGNLFJDG-ZDUSSCGKSA-N 358.398 0.330 10 10 FCCE O=C(COC(=O)c1ccnc(N2CCOCC2)n1)c1ccc(O)c(O)c1 859936827 IWYLDCGAESOPES-UHFFFAOYSA-N 359.338 0.764 10 10 FCCE CC(C)CC(=O)N1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329391426 GOVHXWYSADOQOO-UHFFFAOYSA-N 359.426 0.951 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)NCc1ccccc1O 2311675537 GWVKIMSNCFRTFI-MGPQQGTHSA-N 352.387 0.350 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2331520034 HQYSTDIYKAGWTJ-GRYCIOLGSA-N 369.422 0.924 10 10 FCCE Cc1oc(-n2cccc2)c(C#N)c1C(=O)NCCCNS(C)(=O)=O 31218024 LBWLMOBHDAQKJB-UHFFFAOYSA-N 350.400 0.920 10 10 FCCE COC(=O)/C=C/c1ccc(N2CCC[C@@]3(C2)NC(=O)NC3=O)c([N+](=O)[O-])c1 279196302 WXOCFQSTQTTZFX-YXMMZVCTSA-N 374.353 0.959 10 10 FCCE Cc1cc(Br)cc(CN2CCN(CC(N)=O)C(=O)C2)c1O 839169286 GYFZZNUBSMUFNT-UHFFFAOYSA-N 356.220 0.593 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3C[C@H]4CC[C@H]3CN4)CC2)cc1 923381152 BYBJBNFDHQEPJZ-NZSAHSFTSA-N 360.502 0.614 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cncnc2-n2cccn2)c1 1300057556 OANONMLSNYBTIK-UHFFFAOYSA-N 374.382 0.992 10 10 FCCE COc1cc(C(=O)N[C@@H](CO)CNC(=O)[C@@H]2C[C@H]2C2CC2)cc(OC)n1 1510953327 WKUXYVQFYUSEGM-HZSPNIEDSA-N 363.414 0.352 10 10 FCCE CS(=O)(=O)NCC[C@H]1CCCCN1C(=O)Cc1ccc(O)c(O)c1 1543256578 WGVXEQKXGGIJIX-CYBMUJFWSA-N 356.444 0.961 10 10 FCCE COc1ccc(CN[C@H](CO)CNC(=O)[C@H]2CC[C@@H](C(N)=O)C2)cc1C 1676582972 AHOHZWQCKCIAJT-PMPSAXMXSA-N 363.458 0.472 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@H]1C[C@@H]1N 2080880248 JESOETMRIUMSHC-SRVKXCTJSA-N 351.403 0.749 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](CO)[C@@H](NC(=O)c2cc(O)nc(O)c2)C1 2116256482 QSIPDZKDIVKULR-PWSUYJOCSA-N 367.402 0.841 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNCc1cccc(O)c1O 2218616998 QQVMRAGTUDIIKE-OSAQELSMSA-N 354.403 0.529 10 10 FCCE CC1(C)C(=O)NC(=O)N1CC(=O)NCc1ccc(N2CCOCC2)cc1 735854362 YGEHFKUWAOSSLH-UHFFFAOYSA-N 360.414 0.470 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNC[C@@H](O)C(C)C)CC2)cc1 843080046 DKRHLZJVBQHIQG-IEBWSBKVSA-N 351.491 0.785 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3ccnc(OC)n3)C2)cc1 850537138 NBQBQUGCUGQKEC-GFCCVEGCSA-N 371.397 0.827 10 10 FCCE C[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CN1 861761351 DEPJDNODOSELAK-ZBFHGGJFSA-N 360.458 0.396 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2(n3cccn3)CC2)c1 1157345347 NCJHPISMXHVZQY-UHFFFAOYSA-N 350.400 0.879 10 10 FCCE O=C(Cn1cc(Br)c(O)nc1=O)NCc1cccc(O)c1O 1471643540 IRGZLPRRYAWJIG-UHFFFAOYSA-N 370.159 0.439 10 10 FCCE CN(Cc1nc[nH]n1)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1684168465 ARVRRWOXXHEDIM-UHFFFAOYSA-N 371.445 0.848 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CSC(=O)N3)CC2)cc1 266806936 DZDFUUDZLKRJDB-HNNXBMFYSA-N 364.471 0.758 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCCNC1=O 726100570 DKXNJCBHQQZSLU-AWEZNQCLSA-N 350.394 0.740 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@@H](C)S(N)(=O)=O 841588878 HNEJLBYLBGDPIR-CHWSQXEVSA-N 356.492 0.968 10 10 FCCE NC(=O)[C@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 844900361 NBBRINXOQPGJJH-IYBDPMFKSA-N 360.458 0.958 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N[C@@H]3[C@H]4COC[C@H]43)C2)cc1 1118173990 DGJLSVYUSDKVGS-KKBVYLPWSA-N 359.426 0.399 10 10 FCCE CNC(=O)[C@H]1CN(c2nnc(C)n2Cc2ccc(N(C)C)cc2C)CCO1 1315006769 UGHYQPYLZFZODY-QGZVFWFLSA-N 372.473 0.960 10 10 FCCE COC(=O)[C@@]12CCOC[C@@H]1CN(C(=O)C(=O)N1Cc3cccc(O)c3C1)C2 1332036327 JWXVNMXHGGRIJO-ORAYPTAESA-N 374.393 0.273 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)[C@H](O)c3cnc[nH]3)CC2)cc1 864615421 CDPYVMSQJJCVBX-GOSISDBHSA-N 373.457 0.780 10 10 FCCE C[C@H](NC(=O)NC[C@]1(CO)COCCN1C)c1ccc(N(C)C)cc1 922053956 HENLDISNRPNWTH-KSSFIOAISA-N 350.463 0.806 10 10 FCCE CC[C@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCNC1=O 1125257776 PACYIIAWYCZYIN-YWZLYKJASA-N 372.469 0.921 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CC(=O)N(CCN(C)C)C1 1140198781 SEOFQPZTDTZLNU-ZDUSSCGKSA-N 354.447 0.904 10 10 FCCE CS(=O)(=O)CC1(NC(=O)c2cc3cc(O)c(O)cc3s2)COC1 1639273149 AQTDKSSTPLVEIJ-UHFFFAOYSA-N 357.409 0.856 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2064132164 IECWPJKZVBUYOE-RHYQMDGZSA-N 355.395 0.629 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CC(CN)C1 2136254147 UMNOTINIRKAMTO-ZDUSSCGKSA-N 365.430 0.951 10 10 FCCE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=CNCCCN1CCOCC1 2296082859 YBAJDEKMKDMERI-UHFFFAOYSA-N 362.386 0.054 10 10 FCCE COc1ccc(N2CCN(CCC(=O)N3CCN(C(C)=O)CC3)CC2)cc1 243878538 RNFZUCOUWOPAOZ-UHFFFAOYSA-N 374.485 0.898 10 10 FCCE CCN1C[C@H](COC(=O)c2cc(NS(C)(=O)=O)ccc2O)OC1=O 848708875 FPLKOPHPOITACW-SNVBAGLBSA-N 358.372 0.761 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)N[C@@H]1CCCCNC1 851688232 UCVSHXHQXPFDBT-MRXNPFEDSA-N 374.485 0.522 10 10 FCCE CCS(=O)(=O)N[C@H](C)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855223923 CWEOFEXTBUSHOT-OLZOCXBDSA-N 355.460 0.718 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(C)CCNC1=O 1153663204 JILVIRSQGDOGGL-GTNSWQLSSA-N 350.371 0.214 10 10 FCCE Cn1cc(CC2CN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)cn1 1470608764 IGSUJIOMEMSJFB-UHFFFAOYSA-N 364.427 0.812 10 10 FCCE CN1C[C@H](C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)NC1=O 1634974452 TVOCBDLGFPWSPW-OAHLLOKOSA-N 359.430 0.028 10 10 FCCE COC(=O)c1cn([C@H]2CCN(C(=O)c3c(F)ccc(O)c3O)C2)nn1 1648698863 IWRPXTZNRRCZSO-QMMMGPOBSA-N 350.306 0.702 10 10 FCCE Cc1ccc(CNC(=O)[C@H](N)CS(C)(=O)=O)c(O)c1Br 2380755811 FMSURGAHTQFDQQ-SECBINFHSA-N 365.249 0.451 10 10 FCCE Cn1nccc1CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 766432489 LGPIYBPTTRQLGX-HNNXBMFYSA-N 355.442 0.981 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC(CN3CCOCC3)C2)c1 816712503 BNBCWMXMLQBOPU-UHFFFAOYSA-N 369.443 0.168 10 10 FCCE CN(C)C(=O)N(C)[C@H]1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 851687998 NYGVGRNMHKFYNN-HNNXBMFYSA-N 361.446 0.142 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNC(=O)Cc2ccc(O)c(O)c2)C1 2087724443 HIMRRWLDSNRGIW-IUODEOHRSA-N 366.414 0.984 10 10 FCCE C[C@@H](CO)N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 283764184 BXGPYYPDLYTZGF-LBPRGKRZSA-N 353.394 0.118 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC[C@@H](N)C(C)C)C2)cc1 851690814 IROCKHMIRXYMKM-WMLDXEAASA-N 362.474 0.880 10 10 FCCE COC(=O)[C@@H]1C[C@H]1[C@H]1NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 924483896 RJZVUOQQTBWUGW-BZUAXINKSA-N 373.409 0.753 10 10 FCCE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CS(=O)(=O)CC(=O)N2)cc1 929536993 HPDNMMUHDRKKFP-HNNXBMFYSA-N 367.471 0.404 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ncnn3C)C2)cc1 1334208229 LIHNJAZWZFXIOC-CHWSQXEVSA-N 372.429 0.396 10 10 FCCE O=C(CN1C(=O)c2ccccc2S1(=O)=O)NCc1ccc(O)cc1O 1451770840 RZVWXDIVBNPBGR-UHFFFAOYSA-N 362.363 0.559 10 10 FCCE CC(C)(C)OC(=O)N[C@@]1(C(=O)NCCCN=[N+]=[N-])CCS(=O)(=O)C1 2010402318 PIZMIUGDSVRZNE-ZDUSSCGKSA-N 361.424 0.885 10 10 FCCE C[C@@H]([C@H](C)S(C)(=O)=O)N(C)Cc1cc(O)n2ncc(C(=O)O)c2n1 737567486 GOGCQOFMUSKDGG-IUCAKERBSA-N 356.404 0.387 10 10 FCCE Cn1nccc1[C@@H]1COCCN1C(=O)C(=O)NCCc1ccc(N)cc1 846341071 BZYLXOYKBUWKRB-INIZCTEOSA-N 357.414 0.261 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N(C)CC3CN(C)C3)CC2)cc1 850620980 OEWGQMJDHCJHIO-UHFFFAOYSA-N 374.485 0.754 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@]3(C)C[C@@H](O)CN3C)CC2)cc1F 900999413 SMRYEVIWFNFRNL-KDOFPFPSSA-N 351.422 0.938 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCN2[C@H](CNS2(=O)=O)C1 919081251 IZEGNYKAPSPCSN-OAHLLOKOSA-N 367.475 0.105 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)Cc1nnc2n1CCN(C)C2=O 1197712432 ZZBAYACCXWFMTP-UHFFFAOYSA-N 370.457 0.832 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@@]2(OC)CCS(=O)(=O)C2)c1 1251160724 AFAXAPJEMFICPT-BZNIZROVSA-N 372.443 0.965 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)NC[C@H]2COc3ccccc3O2)cc1 1325719022 LWKRKQUGMKIMHL-HNNXBMFYSA-N 355.394 0.884 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H]2C2OCCO2)c1 1598322283 ORLKEVHVSNAWGR-LBPRGKRZSA-N 356.400 0.741 10 10 FCCE CN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 286287398 MFZHJKLMHJWXAZ-STMXVASLSA-N 354.428 0.993 10 10 FCCE Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3N=[N+]=[N-])ccc12 504739596 JZSHWIUBDQNWDV-AKSVOJBYSA-N 363.326 0.598 10 10 FCCE in-vitro CCN(CC)CCNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 826593206 ALFYQEPAUZMQQR-HNNXBMFYSA-N 362.474 0.848 10 10 FCCE O=C(CCNS(=O)(=O)c1cccnc1)NCc1c(O)cccc1F 1156164344 XHUHPPACNNZSLD-UHFFFAOYSA-N 353.375 0.911 10 10 FCCE C[C@H](NC(=O)C(=O)N1CC[C@@]2(CNC(=O)C2)C1)c1ccc(N(C)C)cc1 1342713185 JUKHKMUJVHYRSG-ORAYPTAESA-N 358.442 0.668 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)NCc1ccc(N)cc1 2311667324 CYUMTFCSJXBOFX-MGPQQGTHSA-N 351.403 0.226 10 10 FCCE CC[C@H](C)[C@]1(C(=O)O)N[C@H](c2cccc(OC)c2O)[C@@H]2C(=O)NC(=O)[C@H]21 248147465 AGCNCEFJJIIKIA-KFWCKZIBSA-N 362.382 0.803 10 10 FCCE CNC(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 817705212 ARHJQOTVLBNCHM-HNNXBMFYSA-N 358.442 0.498 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H]3CCN=C4C3=NNN4C)CC2)cc1 854198708 PUABVTRXFFIOMM-HNNXBMFYSA-N 356.430 0.568 10 10 FCCE Cn1cc(/C=C\C(=O)N2CCOc3c2ccc(F)c3F)c(=O)n(C)c1=O 1142829656 WUWPLURSNYEUKT-UTCJRWHESA-N 363.320 0.801 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3CCNC(=O)C3)cc2)CC1 1155604779 XWAOOMQOVFFFPQ-OAHLLOKOSA-N 358.442 0.531 10 10 FCCE COC[C@@H](CCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)OC 1327987551 AQGNITCPEVNMHP-CYBMUJFWSA-N 355.410 0.676 10 10 FCCE CN(C[C@H](O)CNC(=O)OC(C)(C)C)C(=O)c1cc(O)c(O)c(O)c1 2068615254 NESHQEQPMMKQFS-SNVBAGLBSA-N 356.375 0.761 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNC(=O)Nc1ccc(N)cc1 2225621980 HBIXHBVOBUAQIX-HZSPNIEDSA-N 366.418 0.731 10 10 FCCE CS(=O)(=O)NCCNC(=O)NCc1cc(Br)ccc1O 804905029 JKOJCCPSHARHMS-UHFFFAOYSA-N 366.237 0.503 10 10 FCCE CC(=O)C(=O)COC(=O)CN1C(=O)COc2cc(Br)ccc21 808503609 IZIGDCHGWWFNSG-UHFFFAOYSA-N 370.155 0.876 10 10 FCCE O=C(NCC12CC(CN1)C2)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 851691036 JQDKDENWABVLKT-FXUPRZHBSA-N 373.453 0.768 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCCN3C(=O)CNC3=O)C2)cc1 852108854 OHSQWNYRAUMWDR-LBPRGKRZSA-N 361.402 0.125 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2C[C@@H]3CC[C@H](C2)O3)cc1 1348627611 XDBIUCHDVYQCFQ-CALCHBBNSA-N 361.442 0.980 10 10 FCCE CN[C@@H]1C(=O)Nc2cc(N3CCOC[C@@H]3CO)c(Br)cc21 168236224 DVNODLPYBLPRTM-SDBXPKJASA-N 356.220 0.859 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC[C@](O)(CO)C1 823523654 IADUVGBDFAQFQS-LJQANCHMSA-N 363.458 0.677 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](N)CCN(C)C)CC2)cc1 846673743 DVWPEYGESQGRJC-SFHVURJKSA-N 363.506 0.212 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CN(C)Cc3nnc(C)n3C)C2)cc1 855229341 ITJULKITKMNLOI-HNNXBMFYSA-N 372.473 0.959 10 10 FCCE CO[C@]1(CO)CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 855443975 HEUHUSKQSZWWRG-OAHLLOKOSA-N 358.416 0.377 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)C1CN(C)CCN(C)C1 911311631 UNQMCSQSDLNVNB-UHFFFAOYSA-N 363.458 0.777 10 10 FCCE CC(=O)NC[C@H]1CCn2ncc(C(=O)NCc3cccc(O)c3O)c2C1 1153798117 MPVCEGFJFUWLIO-LBPRGKRZSA-N 358.398 0.923 10 10 FCCE [N-]=[N+]=NCC1CN(c2ccc3c(c2)C(=O)N([C@@H]2CCC(=O)NC2=O)C3=O)C1 2086865259 ATLMNQYVNPBVMG-CYBMUJFWSA-N 368.353 0.834 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNCc1ccc(O)cc1O 2312325497 ZQCHSZGULYEAPK-CFVMTHIKSA-N 354.403 0.529 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H](O)Cc1cnn(C)c1 786709740 VCYVQFIYOMCVFH-SFHVURJKSA-N 358.442 0.819 10 10 FCCE COC[C@]1(C)CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 859276535 ICOKEBCWFJULPI-IBGZPJMESA-N 363.458 0.975 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)CCc3nn[nH]n3)cc2F)CC1 865201965 LDIIMYJZSITECZ-UHFFFAOYSA-N 361.425 0.730 10 10 FCCE CN(C)c1cc(F)c(CNC[C@]23COCCN2C(=O)COC3)cc1F 865795613 QMWGVFBIMRGSTI-QGZVFWFLSA-N 355.385 0.748 10 10 FCCE CCN1C[C@@H](S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)CC1=O 866757097 JCBCVVUSQFNNLI-LSDHHAIUSA-N 354.476 0.293 10 10 FCCE COC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCCOC1 897361762 QTSHYUGXUODSMU-NVXWUHKLSA-N 363.458 0.927 10 10 FCCE C[C@@H]1O[C@H](C)C[C@H]1NC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1353793683 JJPOEIVNDFVJIS-RVKKMQEKSA-N 374.485 0.737 10 10 FCCE NC(=O)c1nccnc1NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1458614176 GYQZUTXNADPOGV-UHFFFAOYSA-N 354.414 0.889 10 10 FCCE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)[C@H]1OC 2140536892 XUSIILJBJUUOSF-CXKPUVAFSA-N 370.446 0.901 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@@H]3CCCN(C)C3)C2)cc1 824973818 MFLOHXMJHNYMNW-HZPDHXFCSA-N 374.485 0.848 10 10 FCCE C[C@@H](CC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)NC(N)=O 848216715 IQQPRZZMJLUEQS-JTQLQIEISA-N 356.373 0.865 10 10 FCCE CNCCOCCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 861562298 OAOHMVPUHRUXPZ-UHFFFAOYSA-N 368.453 0.822 10 10 FCCE CN1C[C@H]2CC[C@@H](CC1=O)N2C(=O)C(=O)NCc1ccc(N(C)C)cc1 897361736 QDULOSNIKGECSW-JKSUJKDBSA-N 358.442 0.591 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1C[C@@H]2C[C@H]1C[S@]2=O 1326697185 XBKXKZFPINENOO-DUOCMMSMSA-N 359.451 0.411 10 10 FCCE CN(C(=O)[C@@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2080685584 ADNRYIPCPUYZJD-IHRRRGAJSA-N 351.403 0.573 10 10 FCCE CC[C@H](C)N1C(=O)C(=CNCCCN2CCOCC2)C(=O)NC1=S 2296923994 LTOAQTAJQIWMPI-LBPRGKRZSA-N 354.476 0.224 10 10 FCCE CC(=O)N1CCN(C(=O)CCNCc2ccc(N3CCOCC3)cc2)CC1 107714895 GDPQTDDORQSNPQ-UHFFFAOYSA-N 374.485 0.694 10 10 FCCE O=S(=O)(N1CCOCC1)N1CCN(Cc2cc(F)ccc2O)CC1 778996084 MWAOIMNYFSIEIQ-UHFFFAOYSA-N 359.423 0.226 10 10 FCCE COc1ccc(N2CCCN(C(=O)[C@@H]3CCN=C4C3=NNN4C)CC2)cc1 822918787 DVCIUMIQNXEKQR-MRXNPFEDSA-N 370.457 0.958 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(C)(C)NS(C)(=O)=O)C2)cc1 855230268 FGYFTBUAWYQDDM-LBPRGKRZSA-N 355.460 0.718 10 10 FCCE Oc1cc2c(cc1CN[C@@H]1CCN(c3ccc4nncn4n3)C1)OCO2 858243773 OPCXGVXXCSELPA-GFCCVEGCSA-N 354.370 0.927 10 10 FCCE Cc1cc(NC(=O)CN2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)no1 1135901296 JDEAXOROGPUYIF-UHFFFAOYSA-N 374.397 0.720 10 10 FCCE CC[C@@H](O)Cn1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)nn1 1454009201 XTQLOYRHIKDASE-MRXNPFEDSA-N 373.457 0.940 10 10 FCCE O=C(CCNS(=O)(=O)c1cccnc1)NCc1cc(O)ccc1O 1455357111 NQSGLWZTMRNCJR-UHFFFAOYSA-N 351.384 0.478 10 10 FCCE CC(C)(C)OC(=O)N1CC(CNCc2ccc(O)c(O)c2)(C(N)=O)C1 2041267342 YCNWJCDGADJISB-UHFFFAOYSA-N 351.403 0.910 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2311715064 NUBFXFPQKQRRLE-IJLUTSLNSA-N 355.395 0.629 10 10 FCCE O=C(O)[C@H]1[C@H](O)[C@H](O)CN1Cc1cc(Br)cc(F)c1O 2357877728 JFVYVQJHEUHXLP-FXPVBKGRSA-N 350.140 0.284 10 10 FCCE COc1ccc(N2CCN([C@@H](C)C(=O)N(C)CC(=O)NC3CC3)CC2)cc1 42290261 GNMYLJUPSHOWAM-HNNXBMFYSA-N 374.485 0.943 10 10 FCCE O=C(c1cc(O)c(O)c(O)c1)N1CCCN(C(=O)c2cnccn2)CC1 169846349 XPGZLFNFJLGAEM-UHFFFAOYSA-N 358.354 0.582 10 10 FCCE CN1CCCN(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c2ccccc21 172362089 CRKKMKWHJLPNTA-MDZDMXLPSA-N 354.410 0.970 10 10 FCCE CCN(C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)[C@H]1CCN(C)C1 827079109 SDDVLBGYFZLOJV-SFHVURJKSA-N 374.485 0.692 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)C[S@@](C)=O)C2)cc1 829182223 LPWKERHYVHRPLX-OLXKUKDPSA-N 367.471 0.273 10 10 FCCE CNCCOCCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 861653249 XDEZSDNLRZWLOP-UHFFFAOYSA-N 350.463 0.683 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCN[C@H]3C)CC2)cc1 861811984 CLTSWDSELMSKBK-WMLDXEAASA-N 360.458 0.601 10 10 FCCE COC[C@@]1(C)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 863829628 NUZLUEKXUNJOJX-OAHLLOKOSA-N 358.416 0.641 10 10 FCCE COC[C@H](CNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)OC 1328090414 BHHTYQPSTIAOKQ-CJNGLKHVSA-N 365.430 0.168 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2[C@H]3C[C@@H]4CO[C@@H]2[C@H]4C3)c1 1454704675 UMHANGFKDXTZEF-UBSPAHDZSA-N 352.412 0.917 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CCC(NC(=O)N2CCOCC2)CC1 1630560000 GPOBZJYGVYQSFN-UHFFFAOYSA-N 363.414 0.673 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C[C@H]3CCC(=O)NC3)cc2)C1 1630738108 JCTOEMAXGJVIGZ-HZPDHXFCSA-N 372.469 0.921 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](C)NC(=O)Cn1cnnn1 1643001634 KIXDLJZVNRTQST-KBPBESRZSA-N 373.461 0.300 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)NC[C@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2060641492 KATONPJHVNPYOA-MNOVXSKESA-N 352.395 0.881 10 10 FCCE Cn1cc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nn1 783012473 QQHNCVUQKNUAAT-CQSZACIVSA-N 371.445 0.516 10 10 FCCE COC(=O)/C=C/c1ccc(N2CCn3c(CO)nnc3C2)c([N+](=O)[O-])c1 804698520 KUICEXPEEXKBQV-HWKANZROSA-N 359.342 0.885 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3nc(C)n(C)n3)C2)cc1 850538328 YXUPEQAATGEAPR-GFCCVEGCSA-N 358.402 0.466 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NCC34CC(CN3)C4)CC2)cc1 851657357 YEWYYMOUESVRDQ-UHFFFAOYSA-N 373.501 0.868 10 10 FCCE C[C@@H]1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CN1 861741850 AHQCAONSGPSRLM-BFYDXBDKSA-N 374.485 0.957 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@@]23COCCN2C(=O)OC3)cc1F 869020775 MVLOCMHPKQARJZ-KRWDZBQOSA-N 366.393 0.912 10 10 FCCE O=C(NCCOC1CCOCC1)C(=O)NCc1ccc(N2CC=CC2)cc1 1119815630 AZPGEBWXNFRWAW-UHFFFAOYSA-N 373.453 0.991 10 10 FCCE COC(=O)N[C@H]1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 1353700518 KRRWEGLZSOEUDP-JSGCOSHPSA-N 362.430 0.887 10 10 FCCE Cn1cc(C(=O)C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cn1 1616600547 UORVMISZGSCUCE-UHFFFAOYSA-N 369.425 0.621 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2077107257 PCFIHUZCOXUHRF-QWRGUYRKSA-N 373.435 0.932 10 10 FCCE CC(C)(C)OC(=O)N1Cc2nncn2C[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2112570536 BEYWILJFBMKTJR-SRVKXCTJSA-N 363.418 0.663 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2311714711 GBXAENVXUUQASV-IRCOFANPSA-N 355.395 0.629 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]2c2nc(N)n(C)n2)cc1 298485913 JJJHXPVGNBYMCX-HNNXBMFYSA-N 357.462 0.917 10 10 FCCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2C[C@H](O)C[C@H]2C(N)=O)cc1 862680524 QERFXEXSQCRGLF-MSOLQXFVSA-N 369.421 0.896 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cnc3n2CCC3)c1 1455711026 ZMRBZLHHXVWHOK-UHFFFAOYSA-N 350.400 0.836 10 10 FCCE CN(C)c1ncnc2c1ncn2CC(=O)NCCc1ccc(O)c(O)c1 1860389601 VEEBENLCCQZBGS-UHFFFAOYSA-N 356.386 0.662 10 10 FCCE CCN(CC)CC[C@@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 798143748 HURFVIQNUYVJTO-ZDUSSCGKSA-N 373.475 0.586 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)Cn3cccn3)C2)cc1 826972720 LLVBVFNYEFGQTM-GJZGRUSLSA-N 371.441 0.792 10 10 FCCE Cc1cncc(CCNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)n1 827575756 VDSDYBWNRTZCJU-UHFFFAOYSA-N 359.405 0.965 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3[C@@H](C2)[C@H]2CC[C@H]3CN2)cc1 861735139 MZMRNSWUTVLVTH-DZJNRPSUSA-N 356.470 0.825 10 10 FCCE CO[C@]1(CNC(=O)NCc2ccc(N(C)C)c(F)c2)CCS(=O)(=O)C1 915365423 DVZXHHPLUWLWDC-INIZCTEOSA-N 373.450 0.895 10 10 FCCE C[C@@H](NC(=O)NC[C@@]1(CO)COCCN1C)c1ccc(N(C)C)cc1 922053957 HENLDISNRPNWTH-RDTXWAMCSA-N 350.463 0.806 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC(N3CCCC3=O)C2)c1 1472082173 LYZMISIJTNGUTO-UHFFFAOYSA-N 353.400 0.211 10 10 FCCE O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccn(CCN2CCNC2=O)n1 1597084828 YESDOZYSJLSGPY-RQOWECAXSA-N 357.370 0.971 10 10 FCCE O=C(c1cccc(O)c1O)N(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 1597768962 FKUBNTSSHWTANL-NEPJUHHUSA-N 355.412 0.906 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N[C@@H](C)Cn1cncn1 817812548 SJWSGEBBCJTQNV-GJZGRUSLSA-N 372.473 0.905 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(C[C@@H]2CCCO2)CC1 1331930800 ZPRKKEJCCSAXMF-HNNXBMFYSA-N 359.426 0.558 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3C[C@H](N)[C@H]4C[C@H]43)cc2)CC1 1340319707 BSWMMFQNPCFOGD-HCXYKTFWSA-N 356.470 0.955 10 10 FCCE COCc1nnc2n1CCN(CC(=O)NCc1ccc(N(C)C)cc1)C2 1460371874 QWEMFZKUYVHQLC-UHFFFAOYSA-N 358.446 0.623 10 10 FCCE O=C(NCc1c(O)cccc1F)C1=CN2CCS(=O)(=O)N=C2C=C1 1645048187 KFOMLELVUHKUJZ-UHFFFAOYSA-N 351.359 0.645 10 10 FCCE COc1ccc(CCN2C(=O)NC(=O)C(=CNC3CC3)C2=O)cc1OC 2296946538 NWMLFLXMATVHML-UHFFFAOYSA-N 359.382 0.961 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@]3(C2)NC(=O)NC3=O)cc1 279024999 HFCKBOHLQWDUEN-SFHVURJKSA-N 359.430 0.043 10 10 FCCE CNC(=O)CCNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 299324206 FEVDGFUPJNGGRY-UHFFFAOYSA-N 363.462 0.253 10 10 FCCE COc1ccc(N2CCN(C(=O)C(=O)Nc3ccc(N)cc3)CC2)nc1 841139107 BSJPCBICCNONTL-UHFFFAOYSA-N 355.398 0.960 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCNC[C@@H]3C)CC2)cc1 842266344 QDLDQAYTSRCWCG-MAUKXSAKSA-N 374.485 0.848 10 10 FCCE COC[C@@H]1C[C@@H](O)CN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 844896556 DAZWCZWJEKJHQW-LSDHHAIUSA-N 367.421 0.954 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3CCNC34CCC4)C2)cc1 861794482 RYHHUFZDQLRLSZ-RHSMWYFYSA-N 372.469 0.791 10 10 FCCE COC(=O)[C@@H]1C[C@@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1333059856 FRFFGHUKTQPCFZ-VXGBXAGGSA-N 351.378 0.433 10 10 FCCE COc1ccc(Br)c(CNC[C@@H](C)S(N)(=O)=O)c1O 2227746601 NZOMRCIIWSYANE-SSDOTTSWSA-N 353.238 0.930 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](C(=O)OC)C3)nc12 66832904 BOEMBUUVHOODSR-NSHDSACASA-N 362.386 0.997 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)c3cnn(C)c3)CC2)cc1 263700693 AIKDZGCNZATOPS-UHFFFAOYSA-N 371.441 0.550 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cnc(O)n(C)c1=O 267718085 ULGXYMRQHPPPIN-UHFFFAOYSA-N 358.398 0.595 10 10 FCCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCN1S(C)(=O)=O 776301254 RDHSTGPWZXZZRL-VIFPVBQESA-N 370.387 0.396 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CN(C)CC(=O)NC(C)C)C2)cc1 855230573 PMZCZNKEHFHUPM-HNNXBMFYSA-N 362.474 0.847 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC3(CC(N)=O)CC3)C2)cc1 1331053250 GVDKEXSMPQZOAL-ZDUSSCGKSA-N 374.441 0.162 10 10 FCCE CCOC(=O)[C@]1(C)CN(C(=O)C(=O)N(C)Cc2ccccc2O)CCO1 1332006048 FQVDFZZLIBMNRZ-SFHVURJKSA-N 364.398 0.531 10 10 FCCE CCc1ccc(N2C(=O)NC(=O)C(=CNCCN3CCOCC3)C2=O)cc1 2296091335 KLZIDQSITBCXOB-UHFFFAOYSA-N 372.425 0.638 10 10 FCCE O=C1NCC[C@@H]1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 831560503 ACCUYODBJZYPKQ-SFHVURJKSA-N 356.470 0.971 10 10 FCCE COC(=O)[C@@H]1CSCCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 842238246 LRASTOFHCFEKQS-ZDUSSCGKSA-N 365.455 0.292 10 10 FCCE NC(=O)c1ccc(CC(=O)NCc2ccc(N3CCOCC3)cc2)cn1 858724599 RHIOWZYPWVECEF-UHFFFAOYSA-N 354.410 0.876 10 10 FCCE COc1ccc(N2CCN(C(=O)CN(C)[C@H]3C[C@@H](C(N)=O)C3)CC2)cc1 859958824 ZLGHRHLPDUHKGK-FZNQNYSPSA-N 360.458 0.540 10 10 FCCE CC(C)CC(=O)N[C@H](CC(N)=O)C(=O)NCc1ccc2cccnc2c1O 862026612 VAULYRNBODTXRP-CQSZACIVSA-N 372.425 0.963 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCNC(=O)CC1 1117757736 CIMYZRPWQVEJSP-OLZOCXBDSA-N 364.398 0.605 10 10 FCCE O=C(NCCc1nnc2n1CCNC2=O)c1cc2cc(O)c(O)cc2s1 1455772400 FFMVEQYKROVZFS-UHFFFAOYSA-N 373.394 0.620 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CNC(=O)c3ncccc3O)C2)cc1 1632612122 VIQSOTOJRCXJID-ZDUSSCGKSA-N 370.409 0.921 10 10 FCCE O=C1C[C@@H](CNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CN1 1683196018 XEJCFRNXPCMZRA-GFCCVEGCSA-N 368.384 0.737 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1CN(C(=O)c2cc(O)nc(O)c2)CC[C@@H]1CO 2122238881 FOEMUALTGVDFRO-PWSUYJOCSA-N 367.402 0.841 10 10 FCCE COc1ccc(N2CCN(C(=O)CN[C@H]3CCS(=O)(=O)C3)CC2)cc1 243428531 MXVACFDMZWVKII-AWEZNQCLSA-N 367.471 0.121 10 10 FCCE O=C(CN1C(=O)CSC1=S)N1CCC[C@@H](Oc2ccncn2)C1 585343794 ABLKBZLCNYJQQV-SNVBAGLBSA-N 352.441 0.707 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccnc(S(C)(=O)=O)n1 847696325 OVAHXGHIKYDHIF-SECBINFHSA-N 351.384 0.652 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H]3CC(C(N)=O)=NO3)C2)cc1 854050350 AKQXRMYKCGWXAK-RISCZKNCSA-N 361.402 0.203 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@@H]1CC[C@@H](C)NC1)c1ccc(N2CCOCC2)cc1 861741852 AHQCAONSGPSRLM-HLLBOEOZSA-N 374.485 0.957 10 10 FCCE CN1CCN(c2ccc(CNC(=O)NC3CC(CC(N)=O)C3)cc2)CC1 924005334 DDPZVCATOIYJCV-UHFFFAOYSA-N 359.474 0.892 10 10 FCCE NC(=O)[C@H]1CC(C(=O)NCc2ccc(O)cc2O)=NN1c1ccc(F)cc1 1451763959 DIIXOHINKQCRSY-OAHLLOKOSA-N 372.356 0.973 10 10 FCCE O=C(CN1C(=O)CSC1=S)NCCn1ccnc1-c1ccccn1 238823711 DGCGNJFKUOETFB-UHFFFAOYSA-N 361.452 0.922 10 10 FCCE COC(=O)[C@H]1CSCCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 842238245 LRASTOFHCFEKQS-CYBMUJFWSA-N 365.455 0.292 10 10 FCCE COC1(OC)CCN(CC(=O)NCc2ccc(N(C)C)cc2)C[C@@H]1O 931635917 LKMZFHWXNJFDQT-INIZCTEOSA-N 351.447 0.425 10 10 FCCE CC(C)(C)OC(=O)N[C@]1(C(=O)NCCCN=[N+]=[N-])CCS(=O)(=O)C1 2010402317 PIZMIUGDSVRZNE-CYBMUJFWSA-N 361.424 0.885 10 10 FCCE Cc1ccc(N2C(=O)NC(=O)C(=CNN3CCN(C)CC3)C2=O)cc1C 2296928165 WSZMSYOIVSTOTE-UHFFFAOYSA-N 357.414 0.522 10 10 FCCE Cn1c(O)ncc(C(=O)NCc2ccc(N3CCSCC3)cc2)c1=O 751533758 CDKOGJBXODLRGP-UHFFFAOYSA-N 360.439 0.969 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H](Cn3ccnn3)C2)cc1F 827574925 JHZLHZIOVSDHIJ-AWEZNQCLSA-N 374.420 0.648 10 10 FCCE CS(=O)(=O)N1CCCC[C@@H]1CNC(=O)NCCc1ccc(N)cc1 841903229 LNGJEOOZVZFGDI-OAHLLOKOSA-N 354.476 0.925 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H](O)C1CCC1 855396612 PQJUAAJMPDDXPE-MRXNPFEDSA-N 352.456 0.699 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H]2CCNC23CCC3)cc1 861794125 JZRVYMZZGZKAGW-QGZVFWFLSA-N 374.485 0.991 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H]3CCCN(C)C3=O)cc2)CC1 907642148 XOBYYTRPSPLKGR-SFHVURJKSA-N 372.469 0.840 10 10 FCCE O=S1(=O)CCN(Cc2ccc(N3CCOCC3)cc2)[C@H]2CCOC[C@H]21 930701940 WVIPRWPAPWRAKT-ZWKOTPCHSA-N 366.483 0.911 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1c(O)ncnc1O 1162540357 VZIRZBORIGVGLU-UHFFFAOYSA-N 361.354 0.728 10 10 FCCE C[C@H](NC(=O)C(=O)N1CCN2C(=O)OCC[C@H]2C1)c1ccc(N(C)C)cc1 1323502635 WEAGYOZHBZIAPX-BBRMVZONSA-N 374.441 0.983 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)/C=C/C(=O)N(C)C)cc2)CC1 1447707351 GAXKQKHFDLLHHP-CMDGGOBGSA-N 358.442 0.616 10 10 FCCE CCn1c(=O)c2ccccc2n(CC(=O)NCc2ccc(O)cc2O)c1=O 1639441030 GPSXHHXWWPQLJM-UHFFFAOYSA-N 369.377 0.911 10 10 FCCE [N-]=[N+]=N[C@H]1CCN(c2ccc3c(c2)C(=O)N([C@@H]2CCC(=O)NC2=O)C3=O)C1 2086865330 KNMSQFPTAKMIOX-TVQRCGJNSA-N 368.353 0.977 10 10 FCCE O=C(O)CNC(=O)CN1C(=O)/C(=C/c2ccc(O)cc2)SC1=S 15036365 ZRRVCIPCHZJSEL-YHYXMXQVSA-N 352.393 0.794 10 10 FCCE Cn1ncc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 805995365 AWZIBVJKHJCBCY-UHFFFAOYSA-N 362.409 0.915 10 10 FCCE Cn1cc(CCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nn1 822937981 NHBVCEGITHGUNM-OAHLLOKOSA-N 370.457 0.766 10 10 FCCE CN1CC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)S1(=O)=O 856209659 WZIOOENAJFFSHH-INIZCTEOSA-N 367.471 0.298 10 10 FCCE NC[C@H]1CC2(CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)CO1 1119636251 KVCZIZJUSIAXCX-CQSZACIVSA-N 359.426 0.591 10 10 FCCE C[C@H](C(=O)NCc1c(O)cccc1O)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1639289154 MBXKUUSYWZGTPT-LPCRZITISA-N 360.366 0.265 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NOC1CNC1 2136240936 SBWCAOIKLZXXME-LBPRGKRZSA-N 367.402 0.553 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)NCC(C)C)CC2)cc1 56966417 GRTQHPWZHMTJLA-UHFFFAOYSA-N 362.474 0.706 10 10 FCCE CCNc1nc(NCC)n2c(S[C@@H]3CCS(=O)(=O)C3)nnc2n1 227118370 LGFKHMXNICIGDI-MRVPVSSYSA-N 357.465 0.662 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)c3cccn(C)c3=O)cc2)CC1 276082176 BLRLSZWPVIYTBV-UHFFFAOYSA-N 368.437 0.984 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCN(C)C3=O)CC2)cc1 294796212 TZHYCAZGEVNQNW-GOSISDBHSA-N 374.485 0.802 10 10 FCCE CC(C)(C)[C@H](O)C[C@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 803570226 VQBWXVCLDPQBKN-BXUZGUMPSA-N 374.459 0.652 10 10 FCCE CN(C[C@H](O)c1cccnc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1647563113 XDXBAGDQAKGBJK-HNNXBMFYSA-N 365.411 0.964 10 10 FCCE Nc1ccc(OCCS(=O)(=O)N2CC(NC(=O)C(F)(F)F)C2)cc1 2044598016 NSNWKBIWKYPEGC-UHFFFAOYSA-N 367.349 0.340 10 10 FCCE CC(C)(C)OC(=O)NCC1(O)CN(C[C@H](O)COc2ccc(N)cc2)C1 2106764129 FXLUFDAEFVETRH-AWEZNQCLSA-N 367.446 0.580 10 10 FCCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)[C@H](CO)C1 2132413422 MYYXUCRNYWJRBX-NSHDSACASA-N 368.386 0.857 10 10 FCCE CN(C(=O)[C@@H]1[C@@H](O)[C@H](O)CCN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2136255001 BZVBWQMBQZHYBZ-ILXRZTDVSA-N 365.430 0.963 10 10 FCCE CC(=O)C(=O)COC(=O)C1CCN(S(=O)(=O)c2c(C)noc2C)CC1 808498830 XIALEOOODNZUKG-UHFFFAOYSA-N 372.399 0.393 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC[C@@](O)(CO)C1 823523653 IADUVGBDFAQFQS-IBGZPJMESA-N 363.458 0.677 10 10 FCCE O=C1CC[C@@H](CNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)N1 854140868 RQUQLIRBCNFHOK-LBPRGKRZSA-N 368.384 0.879 10 10 FCCE CCOC(=O)C12CC(CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O)C2 856250459 PSKWIEGGBVOXHB-UHFFFAOYSA-N 368.411 0.931 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N3CC=C[C@@H]3CO)CC2)cc1 1119469546 QPBPWHSMVSFQCQ-MRXNPFEDSA-N 359.426 0.540 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C[C@@H]3CCNC3=O)cc2)CC1 1133846958 AHESALWBLDVLTK-HNNXBMFYSA-N 358.442 0.531 10 10 FCCE C[C@H](NC(=O)C(=O)N1CCN2C(=O)OCC[C@@H]2C1)c1ccc(N(C)C)cc1 1323502639 WEAGYOZHBZIAPX-XJKSGUPXSA-N 374.441 0.983 10 10 FCCE C[C@H](NC(=O)C(=O)N1C2CCC1(C(N)=O)CC2)c1ccc(N(C)C)cc1 1341251007 IWEVCNWWIMEROO-UUZUZFRQSA-N 358.442 0.939 10 10 FCCE COC(=O)C1=C[C@H](N=[N+]=[N-])[C@@H](NC(C)=O)[C@H]([C@H](OC)[C@@H]2COC(=O)O2)O1 1848432539 DMLIIKCIUVVBPP-KXMNOHPDSA-N 370.318 0.176 10 10 FCCE CO[C@@](C)(CO)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 823519602 KRBVPMQYYQCDAV-GOSISDBHSA-N 351.447 0.844 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NCc2ccnn2C)cc1 846723580 GAKRBUDJKSZLQX-UHFFFAOYSA-N 359.430 0.640 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(c2nncn2C)CC1 847036884 FSLMWPBUYQSJER-UHFFFAOYSA-N 371.489 0.662 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCNCCNCC1 926287953 HGWUVEXOOCSLSM-UHFFFAOYSA-N 361.490 0.123 10 10 FCCE C[C@H]1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@H]1O 1192849896 VCIOEWAPZYKXSM-KBXCAEBGSA-N 365.449 0.981 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(CN2CCOCC2)CC1 1329341052 WMXXMSFVTAXNAY-UHFFFAOYSA-N 373.453 0.805 10 10 FCCE CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCN2CCO[C@H]1C2 1556735991 VAQXHWNRSCIVOS-ZFWWWQNUSA-N 369.443 0.309 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)CCc3cnn[nH]3)cc2)CC1 1558397542 PHNWUAMZZQQLET-UHFFFAOYSA-N 356.430 0.755 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](O)[C@@H]1C(=O)Nc1ccc(N)cc1 2080898828 URNHUDCAACXIKW-BFHYXJOUSA-N 351.403 0.939 10 10 FCCE Cc1noc(C)c1S(=O)(=O)NCCNC(=O)c1cc(O)c(O)c(O)c1 169911827 ZWYNVWUWYWLNRG-UHFFFAOYSA-N 371.371 0.117 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3CC(C)(CO)C3)CC2)cc1 837987835 LOYCOTZHHUARRQ-UHFFFAOYSA-N 362.474 0.841 10 10 FCCE CN1C[C@H](CCNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 931645303 UWAFJIKOYICXLE-OAHLLOKOSA-N 360.458 0.696 10 10 FCCE CC(=O)N1CCN(C(=O)CCNC(=O)NCc2c(O)cccc2F)CC1 1477969857 KKYZAJWWACOLDJ-UHFFFAOYSA-N 366.393 0.411 10 10 FCCE CCc1nccn1CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1651660428 NMDKVKHVZMMSRT-UHFFFAOYSA-N 352.416 0.953 10 10 FCCE CNC(=O)CN1CCCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 1655870828 RNSGGMMJAUIWII-UHFFFAOYSA-N 352.391 0.870 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@H]1C[C@H]1CN 2136240473 MPJAHAQQLFAMRM-AVGNSLFASA-N 365.430 0.997 10 10 FCCE CN(C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1ccc(=O)n(C)c1 2224796783 PIHSAZIKOTVWFC-ZIAGYGMSSA-N 363.414 0.932 10 10 FCCE CC(C)(C)OC(=O)NCC(CO)(CO)NC(=O)Cc1ccc(N)cc1 2254548729 VMEPIJWYWGFPHO-UHFFFAOYSA-N 353.419 0.176 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2331520085 IZUVKJOTHMTJER-UMSGYPCISA-N 369.422 0.876 10 10 FCCE CCN(Cc1cn(C)nn1)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 807291971 RCQJTAXGYCXVMK-UHFFFAOYSA-N 368.441 0.856 10 10 FCCE CC1(OCC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CNC1 844173565 INUBWTDIVNTWBM-UHFFFAOYSA-N 351.422 0.782 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N3CCC4(COC4)C3)CC2)cc1 850621371 SLDPCPSATWSUSL-UHFFFAOYSA-N 373.453 0.983 10 10 FCCE C[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CN1 861786794 QWOBFESTQLXQKD-ZBFHGGJFSA-N 374.485 0.521 10 10 FCCE CCO[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)CN(C)C 1119735467 QWYFCHGNGHAVOW-SFHVURJKSA-N 374.485 0.762 10 10 FCCE CN(C)S(=O)(=O)NCCNC(=O)c1cc2cc(O)c(O)cc2s1 1140211681 BRDWVVYEULWLLP-UHFFFAOYSA-N 359.429 0.438 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H](CO)C3)c1 1305479277 ZKIOQXIXCFVFKT-IUCKATPISA-N 354.428 0.901 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H](O)C(F)(F)C1 1329608340 JARMGXOHXDSKQB-CQSZACIVSA-N 355.385 0.940 10 10 FCCE C[C@H](NC(=O)c1cnn2c1S(=O)(=O)N(C)CC2)c1ccccc1O 1557969393 UIOPCYCQNWOZOV-JTQLQIEISA-N 350.400 0.714 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3n[nH]c(C)c3O)CC2)cc1 1631443316 YGYQVDHHKKUWRD-UHFFFAOYSA-N 359.430 0.984 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN[C@](C)(CCO)COC)nc12 267480719 SFVBUHZUAGJCFZ-MRXNPFEDSA-N 352.391 0.489 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)[C@H](OC)C(=O)O)CC2)cc1 901976798 VRUGSQSCQZHZGO-INIZCTEOSA-N 365.430 0.423 10 10 FCCE NC(=O)C1CC2(C1)C[C@H](NC(=O)c1cc(O)cs1)CCS2(=O)=O 1158182929 WZMSBNMZFYOGQU-ZYTOWTHASA-N 358.441 0.395 10 10 FCCE CN(C)C(=O)Cn1c([C@H]2CCC(=O)N2)nnc1N(C)Cc1ccccc1O 1298003439 HQLGEPIVNNXJMQ-CYBMUJFWSA-N 372.429 0.659 10 10 FCCE O=C(C[C@H]1NC(=O)NC1=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874179542 JCPCZBXDOXKRMG-CYBMUJFWSA-N 363.329 0.999 10 10 FCCE COc1cccc(N2C(=O)C(=CNCCCN(C)C)C(=O)NC2=S)c1 2296139041 MXNUFOGWAYKXJX-UHFFFAOYSA-N 362.455 0.868 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@@]3(CCOC3)C2)cc1F 285750208 QAMZYPSUXTVFHZ-SFHVURJKSA-N 365.405 0.526 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CC(N)=O)CC2)cc1 745783839 FHMBCCVLWZKFHX-CQSZACIVSA-N 363.462 0.380 10 10 FCCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cn1cnc2c(cnn2C)c1=O 773744803 WMPMRMWTFHMDSW-JTQLQIEISA-N 357.370 0.289 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccn(C)n3)CC2)cc1 804315980 WZGFBUQCHCLMOL-UHFFFAOYSA-N 371.441 0.830 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCCCNC3)CC2)cc1 842240570 RPOREPZFHITIJR-MRXNPFEDSA-N 374.485 0.992 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@H]3CCCCN3)C2)cc1 851687454 BCIZBDJUTYLEOQ-GJZGRUSLSA-N 360.458 0.648 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCN[C@@H](C)C3)C2)cc1 851689732 SISUQRAIOJOTMR-ZNMIVQPWSA-N 360.458 0.647 10 10 FCCE O=C(O)[C@@H]1CS(=O)(=O)CCN1Cc1ccc(N2CCOCC2)cc1 923249982 PHOZULQRNLOLAS-HNNXBMFYSA-N 354.428 0.207 10 10 FCCE O=S1(=O)CC[C@]2(CN(Cc3cc4c(cc3O)OC[C@H]4O)CCO2)C1 1326485409 FKIZRJGDJSFPIU-ZBFHGGJFSA-N 355.412 0.208 10 10 FCCE CCOC(=O)C[C@H](O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1464307671 JOWWXYLOMFVZSD-HNNXBMFYSA-N 354.378 0.593 10 10 FCCE NS(=O)(=O)CCOCCNC(=O)NCc1cccc(Cl)c1O 1635975425 LRACZYNEERNXME-UHFFFAOYSA-N 351.812 0.150 10 10 FCCE CN(CCO)C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2059991912 BYGUWXKRJTYVQL-LBPRGKRZSA-N 354.403 0.984 10 10 FCCE O=C(O)CNC(=O)CN1C(=O)/C(=C/c2cccc(O)c2)SC1=S 15036455 CACMWGFNTMYQSX-YHYXMXQVSA-N 352.393 0.794 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3CCN4CCOC[C@H]4C3)ccc21 803689242 NMNNRIXJWREUAQ-QGZVFWFLSA-N 372.469 0.228 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H](NC(=O)c1cc(Cl)ccc1F)[C@@H](C)O 808508185 VAGRFQRKILKPBC-OQPBUACISA-N 359.737 0.660 10 10 FCCE CC(=O)C(=O)COC(=O)C(F)(F)c1ccc(OCC(=O)N(C)C)cc1 808537708 RMKHNTZGTBUZRM-UHFFFAOYSA-N 357.309 0.947 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)CN3C(=O)NC(=O)C3(C)C)C2)cc1 819585035 WAIKQFCWOKLFCE-CYBMUJFWSA-N 374.441 0.968 10 10 FCCE C[C@H](NC(=O)N1CCOC2(CNC2)C1)c1ccc(N2CCOCC2)cc1 841742398 XBOAFXSHGKPFPW-HNNXBMFYSA-N 360.458 0.968 10 10 FCCE C[C@H](C(=O)N(C)[C@H]1CCS(=O)(=O)C1)N1CCCc2cc(CN)ccc21 843349479 AXEKCQLMANUMJR-CJNGLKHVSA-N 365.499 0.932 10 10 FCCE CN(C)CCN1CCN(Cc2ccc(N3CCN(C)CC3)cc2)CC1=O 846011052 JJPKMNPOMDAWHV-UHFFFAOYSA-N 359.518 0.644 10 10 FCCE CN1C[C@H](O)C[C@@]1(C)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 900754506 JYZBETVXHFHNIK-QUCCMNQESA-N 361.486 0.967 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CCNC(=O)CC3)cc2)CC1 1324553532 QMZPKEUKBRINIR-QGZVFWFLSA-N 372.469 0.888 10 10 FCCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1C[C@@H]2C[C@H]1C[S@]2=O 1329794457 HWMTZSHXFUVFNA-DUOCMMSMSA-N 361.467 0.635 10 10 FCCE CN(C)c1ccc([C@H](CNC(=O)C(=O)N[C@@H]2[C@H]3COC[C@H]32)N(C)C)cc1 1333308454 NAMBIAJVVBFORM-VVLHAWIVSA-N 360.458 0.233 10 10 FCCE C[C@@H](NC(=O)C(=O)c1cc(S(N)(=O)=O)cn1C)c1ccccc1O 1557966661 MGFNATJEXVEQMC-SECBINFHSA-N 351.384 0.438 10 10 FCCE O=C(CN1C(=O)CNC1=O)Nc1c(-c2ccccn2)nc2ccccn12 1638269130 MYBAOBANVCRQNF-UHFFFAOYSA-N 350.338 0.887 10 10 FCCE O=C1NC(=O)N(Cc2ccccc2)C(=O)C1=CNCCN1CCOCC1 2296082728 RSJZKOUHNXAVGE-UHFFFAOYSA-N 358.398 0.071 10 10 FCCE COC(=O)COc1ccc(N(CC(=O)N(C)C)CC(=O)N(C)C)cc1 47046023 MCSXNLBFKFXLGI-UHFFFAOYSA-N 351.403 0.221 10 10 FCCE COc1nccnc1O[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)C1 220031007 DTMCIOMOSRRHNK-VIFPVBQESA-N 368.440 0.325 10 10 FCCE COc1ccc(N2CCCN(C(=O)CS(=O)(=O)N(C)C)CC2)cc1 785366884 IDMUVROTIDBKJC-UHFFFAOYSA-N 355.460 0.625 10 10 FCCE O=C(NCC[C@]1(O)CCOC1)NCc1ccc(N2CCC(O)CC2)cc1 852397271 IWGYNBCYNFRVDQ-IBGZPJMESA-N 363.458 0.988 10 10 FCCE CN(C)S(=O)(=O)CC(=O)NCc1ccc(N2CCC(O)CC2)cc1 856212423 LBHFIZVKJAIZRK-UHFFFAOYSA-N 355.460 0.155 10 10 FCCE O=S(=O)(C[C@@H]1CNCCO1)N(Cc1ccccc1O)C[C@H]1CCCO1 866751195 SSGXRIADKAITTK-CVEARBPZSA-N 370.471 0.691 10 10 FCCE CN(C)c1ccc(CN(C(=O)C(=O)N2CCC[C@](N)(CO)C2)C2CC2)cc1 926295616 GZMMDIDVPVFKAR-HXUWFJFHSA-N 374.485 0.556 10 10 FCCE C[C@H](Cc1cn(C)nn1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1153961780 FTYMPMVBMOHVFL-SECBINFHSA-N 353.404 0.253 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@H]3CCCNC3=O)cc2)CC1 1313306490 WEFVPIJSFVHRAW-INIZCTEOSA-N 373.457 0.466 10 10 FCCE Cn1nc2c(c1C(=O)NCc1ccc(O)c(O)c1)CS(=O)(=O)CC2 1465955038 VYJLRVZYTYWPHF-UHFFFAOYSA-N 351.384 0.232 10 10 FCCE CN(Cc1ccccc1O)C(=O)NCCS(=O)(=O)N=S(C)(C)=O 1676152855 WUUZICXUFCPQMM-UHFFFAOYSA-N 363.461 0.591 10 10 FCCE CN(Cc1ccccc1O)c1nnc([C@@H]2CCOC2)n1Cc1nnn(C)n1 1768681260 GVYHBPLBVGTXOJ-CYBMUJFWSA-N 370.417 0.696 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H]3CCN(S(C)(=O)=O)C3)CC2)cc1 1858388892 FMIVRSOQDZQYQJ-AWEZNQCLSA-N 367.471 0.625 10 10 FCCE CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)OCC(=O)C(C)=O)c1 808513740 KLXJAYKVVHEEEX-UHFFFAOYSA-N 356.356 0.331 10 10 FCCE CCN1CC[C@H]1CNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 897640464 NFUUOSJEDUUZOX-KRWDZBQOSA-N 374.485 0.991 10 10 FCCE CON(C)C[C@@H](O)Cn1cc(NC(=O)Cc2ccc(O)c(O)c2)cn1 1295118504 POMHYGRPYRQTHP-CYBMUJFWSA-N 350.375 0.330 10 10 FCCE C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CN(C)CCN1C 1544138998 IJQYJTLJGJFZRX-SMDDNHRTSA-N 370.475 0.128 10 10 FCCE Cc1nc(S(=O)(=O)NCC(=O)N2Cc3cccc(O)c3C2)cn1C 1644088026 BWMRXLKJBQBOKO-UHFFFAOYSA-N 350.400 0.255 10 10 FCCE O=C1CN(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2ccccc2N1 105317660 ORDWZCSDAQEJIV-UHFFFAOYSA-N 358.379 0.469 10 10 FCCE CO[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@H]1CCOC1 828437472 OMEKOLAOZSIULL-DOTOQJQBSA-N 363.458 0.845 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCCCNC3)CC2)cc1 842240569 RPOREPZFHITIJR-INIZCTEOSA-N 374.485 0.992 10 10 FCCE CN1C[C@H](C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)NC1=O 854905697 BOJMRXMFDJLKRM-CYBMUJFWSA-N 354.357 0.441 10 10 FCCE NC(=O)CN1CCN(Cc2cc(Br)cc(F)c2O)CC1=O 894987352 YNFKTRGMRZLQOJ-UHFFFAOYSA-N 360.183 0.423 10 10 FCCE CN1CCOC[C@]1(CO)CNC(=O)NCc1ccc(N2CCCC2)cc1 914180538 PWIXKTQCHHVVQN-LJQANCHMSA-N 362.474 0.779 10 10 FCCE Cc1ccc(CNS(=O)(=O)N2CC[C@H](O)C2)c(O)c1Br 2380813941 BSZQWGKENGRTIF-JTQLQIEISA-N 365.249 0.864 10 10 FCCE Cn1c(=O)c2c(ncn2CCCNCCc2ccc(O)c(O)c2)n(C)c1=O 31540854 PTKBXZQSYDMMLK-UHFFFAOYSA-N 373.413 0.067 10 10 FCCE CCS(=O)(=O)N1CC(CNC(=O)NCc2ccc(N(C)C)cc2)C1 190398466 KYUWGYNCGKAKCI-UHFFFAOYSA-N 354.476 0.833 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cnn(-c3ncccn3)c2)c1 738548674 LDPBKUGULOQBMN-UHFFFAOYSA-N 374.382 0.992 10 10 FCCE COc1cccc(CNC(=O)N[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)c1O 800747764 PZDRQLOJKNRZKI-DGCLKSJQSA-N 371.459 0.918 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1 808509369 NCMOFAHCUPORQP-PPYMECGQSA-N 372.377 0.491 10 10 FCCE CCc1cc(CNC(=O)C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)n[nH]1 828114258 PVBSNBLPBPNDKP-AWEZNQCLSA-N 371.441 0.992 10 10 FCCE CN(C)c1ccc([C@@H](N)CNC(=O)Cn2cnc3c(cnn3C)c2=O)cc1 832293316 UXFXTXVRGOEXIG-HNNXBMFYSA-N 369.429 0.012 10 10 FCCE COCc1nc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)n(C)n1 853798360 NDNQOWLLBYYUMZ-UHFFFAOYSA-N 363.393 0.867 10 10 FCCE C[C@H]1CN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC(=O)N1 1251103466 DJNLPOQOIWICAH-ZDUSSCGKSA-N 373.457 0.418 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@@]4(CNC(=O)C4)C3)ccc21 1322546537 BQQZQSLSXCVCIL-HXUWFJFHSA-N 370.453 0.424 10 10 FCCE COC(=O)N[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1350408842 HQOVJETXDWNWPE-HNNXBMFYSA-N 372.425 0.636 10 10 FCCE NC(=O)c1cc(NCc2ccc(N3CCC(C(N)=O)CC3)cc2)ncn1 1652239390 FBYGYCGIAXIBIE-UHFFFAOYSA-N 354.414 0.889 10 10 FCCE CNS(=O)(=O)CCNCc1c(Br)ccc(OC)c1O 1964563604 BGICYJVRQOWPLK-UHFFFAOYSA-N 353.238 0.802 10 10 FCCE COc1cccc(CNC[C@@H]2[C@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c1O 2225621294 CBESSPBYVZWKII-WWGRRREGSA-N 368.430 0.832 10 10 FCCE CC(=O)N1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)[C@@H](C)C1 284326669 WVBRSEUNUGBVEB-HNNXBMFYSA-N 372.469 0.982 10 10 FCCE CN(CCN1CCCS1(=O)=O)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 761908046 MIVKGFFOKLUTLG-UHFFFAOYSA-N 370.387 0.397 10 10 FCCE Cn1ccnc(N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)c1=O 779526811 YAMYABYLCDWOPR-HYXAFXHYSA-N 356.382 0.554 10 10 FCCE C[C@H](NC(=O)[C@@H]1CCN(C)S1(=O)=O)c1ccc(N2CCOCC2)cc1 843537339 SARDTKWQCOXEKN-BBRMVZONSA-N 367.471 0.734 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CCNC(=O)[C@H]3CCCN3)C2)cc1 852844373 TWMDWKHSFCIUTG-RHSMWYFYSA-N 360.458 0.648 10 10 FCCE C[C@@H]1CC[C@@H](NC(=O)C(=O)N(C)Cc2ccccc2O)CS1(=O)=O 1118670738 XOOLPMXLCKJZHJ-DGCLKSJQSA-N 354.428 0.433 10 10 FCCE CCN1C(=O)[C@H]2CN(C(=O)c3ccc(N=NC(N)=O)cc3)CCN2C1=O 1294450244 HJAIQMNTPPSEGR-GFCCVEGCSA-N 358.358 0.958 10 10 FCCE CS(=O)(=O)N[C@@H]1CCCC[C@@H]1CNC(=O)Cc1ccc(O)c(O)c1 1640371604 ZLHMSIWGINXNMW-CHWSQXEVSA-N 356.444 0.865 10 10 FCCE Cn1cc(/C=C\C(=O)N2CCc3c2cccc3[N+](=O)[O-])c(=O)n(C)c1=O 254949803 MKCWTLSCMDBBNZ-SREVYHEPSA-N 356.338 0.595 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N[C@@H]3CCCN(C)C3)C2)cc1 824973819 MFLOHXMJHNYMNW-JKSUJKDBSA-N 374.485 0.848 10 10 FCCE COC(=O)[C@H](NCC(=O)NCc1ccc(N(C)C)cc1)c1ccnn1C 830383653 WAYDTKNXZDZJPA-QGZVFWFLSA-N 359.430 0.606 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CN(C)C(=O)[C@@H]3C)CC2)cc1 830796801 HBHNJZZVKAWDJG-RDJZCZTQSA-N 362.474 0.298 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](O)Cn3ccnn3)C2)cc1 852448654 LJZDECWKDJFYQG-DZGCQCFKSA-N 360.418 0.226 10 10 FCCE CN1CCCc2cc(CNC(=O)C3(CS(C)(=O)=O)COC3)ccc21 1123543063 YKNXIKDWZKJUMO-UHFFFAOYSA-N 352.456 0.746 10 10 FCCE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cn2nnc(N)n2)cc1 1464600329 CMTGFYNLQARNGA-HNNXBMFYSA-N 359.434 0.529 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(C)C[C@H](O)CN1C 1632356926 WKNWHVBUDITDEA-ZJNRKIDTSA-N 366.414 0.143 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C[C@@H]3CCC(=O)N3)cc2)CC1 1638489189 UMSFKZKMHYZHPZ-HNNXBMFYSA-N 358.442 0.673 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@](C)(O)Cn3ccccc3=O)CC2)cc1 790466531 SUQOYBRBHAUZCU-HXUWFJFHSA-N 371.437 0.957 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H]2CNCC[C@H]2C)cc1 846343757 OJNQBCFQSKSRPS-RHSMWYFYSA-N 362.474 0.704 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3cnc(O)n3C)CC2)cc1 865033343 DPAYIHPBOUUWTE-UHFFFAOYSA-N 359.430 0.686 10 10 FCCE COCCOCCOCCN(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1329379809 SBXOBWUJLQUENS-UHFFFAOYSA-N 366.414 0.372 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNCc1cccc(F)c1O 2218612038 CSXLPLNAUZGRLA-KCQAQPDRSA-N 356.394 0.962 10 10 FCCE NC(=O)[C@@H]1CC[C@@H](CNC(=O)NCc2cc(Br)ccc2O)O1 805201359 UBBOZWXTFKNPOL-JQWIXIFHSA-N 372.219 0.987 10 10 FCCE COC(=O)/C=C/c1ccc(N2CCn3nnc(CO)c3C2)c([N+](=O)[O-])c1 820585729 BKBSEFUGFGSKAX-HWKANZROSA-N 359.342 0.885 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC3(C)CCNCC3)C2)cc1 851689930 VXFMVOWKSMTJKP-OAHLLOKOSA-N 374.485 0.896 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@](C)(COC)C3)nc12 860202859 RRODEDLDELXWKR-KRWDZBQOSA-N 364.402 0.849 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 861796322 AOOKGHALBKWNLL-RRQGHBQHSA-N 360.458 0.647 10 10 FCCE CNS(=O)(=O)c1ccc(CC(=O)NCc2cc(O)ccc2O)cc1 1153886100 WHUSOZOZEWOISO-UHFFFAOYSA-N 350.396 0.865 10 10 FCCE CN1CCN(c2ccc(CNC(=O)N[C@@H](CO)[C@@H]3CCOC3)cc2)CC1 1479185769 UACPHOXQVMNQCO-AEFFLSMTSA-N 362.474 0.635 10 10 FCCE C[C@@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCC(=O)N1 1517372691 KFSMVPMDMMLGKE-KUHUBIRLSA-N 358.442 0.673 10 10 FCCE COCCN1[C@H]2CN(Cc3ccccc3O)C[C@@H]2OCCS1(=O)=O 1614963275 OSNJNGHKYKEYKQ-HOCLYGCPSA-N 356.444 0.253 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)NC2CN(S(=O)(=O)N(C)C)C2)c1 1684308796 SRVYSIYMLFOVNF-JTQLQIEISA-N 372.447 0.252 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc(O)nc(O)c2)[C@@H](CO)C1 2116259219 WVUHUMOGXVHSTG-NEPJUHHUSA-N 367.402 0.841 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)N3CCOCC3)CC2)cc1 41428784 YLKKTBANPYZFCP-UHFFFAOYSA-N 362.430 0.386 10 10 FCCE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cn2cn[nH]c2=O)cc1 157706767 ALXDYBNKNNRYKN-INIZCTEOSA-N 359.430 0.845 10 10 FCCE O=C(Cn1cnc([N+](=O)[O-])n1)NCc1cccc(Br)c1O 765731567 JPJUGDFGOGFJJD-UHFFFAOYSA-N 356.136 0.971 10 10 FCCE C[C@@H](O)[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 840261526 NNVSPJVHNRTFQO-CXAGYDPISA-N 367.421 0.954 10 10 FCCE O=S1(=O)CCN(c2ccc(CNC[C@H](O)C(F)(F)F)cc2)CC1 849326076 BWRQCEGYWIBORM-ZDUSSCGKSA-N 352.378 0.934 10 10 FCCE COc1ccc(N2CC[C@H](NS(=O)(=O)C[C@H]3CN(C)CCO3)C2)cc1 867498102 WMIYMRNCCYZVMX-WMLDXEAASA-N 369.487 0.524 10 10 FCCE Cc1nnc2n1C[C@H](C(=O)N(C)C)N(C(=O)Cc1ccc(O)c(O)c1)C2 1305003759 YXRFISGLDNMRHZ-GFCCVEGCSA-N 359.386 0.039 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCOCCF)C2)cc1 1328250412 JUPDFWWNTIVGFU-CYBMUJFWSA-N 353.394 0.492 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CC=C[C@@H]3CO)C2)cc1 1331799845 UPUFFFFYNYSCJJ-GDBMZVCRSA-N 359.426 0.397 10 10 FCCE CCN(OC)C(=O)CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1345869119 STZMXBWLYZFVJY-UHFFFAOYSA-N 360.414 0.205 10 10 FCCE COc1ccc(CNC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)c(O)c1 1635041714 BSANVCKULHAIQE-UHFFFAOYSA-N 366.399 0.161 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NS(=O)(=O)Cc2ccc(N)cc2)C1 2062451266 NGUZKCXLIRPSGN-ZIAGYGMSSA-N 371.459 0.668 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)C(=O)NCCOc1ccc(N)cc1 2344102209 XEXAFIKSIWKPME-UHFFFAOYSA-N 369.418 0.012 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1 828846832 UOVICOIKVLYTOF-XYJFISCASA-N 351.491 0.785 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCN(CCO)C[C@@H]3C)nc12 832781644 CXOJVUIEZLDGPN-LBPRGKRZSA-N 363.418 0.110 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H](CN)[C@@H](C(F)(F)F)C1 1261891129 ZBEVPFAFEAKYNW-RYUDHWBXSA-N 359.348 0.946 10 10 FCCE COC(=O)[C@@H]1C[C@@H]1CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1332360412 PWFJAGXESRBJQD-HUUCEWRRSA-N 359.426 0.611 10 10 FCCE NC(=O)N[C@@H](CO)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1442919554 FPNUQWWGDKNPDU-ZDUSSCGKSA-N 372.372 0.402 10 10 FCCE NC(=O)[C@@H]1CC(C(=O)NCc2ccc(O)cc2O)=NN1c1ccc(F)cc1 1451763958 DIIXOHINKQCRSY-HNNXBMFYSA-N 372.356 0.973 10 10 FCCE Cc1ccc(N2C(=O)NC(=O)C(=CNCCN3CCOCC3)C2=O)cc1C 2296115547 CWEDUVSMHUCWSW-UHFFFAOYSA-N 372.425 0.692 10 10 FCCE CCN(CCN=[N+]=[N-])C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C[C@@H]1O 2315992113 HNGPKMIFIVCIGP-NHYWBVRUSA-N 357.411 0.878 10 10 FCCE CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@@H]1OC(C)=O 12379894 QKGHBQJLEHAMKJ-XVIXHAIJSA-N 373.318 0.380 10 10 FCCE CCN1CCN(C(=O)C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 244145718 URWLIIIDEFODLF-UHFFFAOYSA-N 360.458 0.508 10 10 FCCE CN1C[C@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CCC1=O 286868527 COYYKWDMUFMQIT-OAHLLOKOSA-N 372.469 0.981 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)c3coc(S(N)(=O)=O)c3)C2)cc1 855234216 VKHNVFIEUUYGJF-GFCCVEGCSA-N 365.411 0.944 10 10 FCCE O=C(N1CCNCC1)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 863642039 IKQOCSZVMAGTOB-UHFFFAOYSA-N 373.501 0.666 10 10 FCCE O=C(CNS(=O)(=O)c1cccc(F)c1)NCc1ccc(O)c(O)c1 1294868531 AWUMYMSIQUMACG-UHFFFAOYSA-N 354.359 0.832 10 10 FCCE COC(=O)[C@@]1(N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)CCOC1 1335429291 MBNJGGRZZJTGHH-QGZVFWFLSA-N 368.361 0.327 10 10 FCCE C[C@@H](NC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1ccccc1O 1587445024 RTZAYJQHWBKJPH-UPJWGTAASA-N 366.439 0.605 10 10 FCCE CCN1CCN(CC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C(=O)C1=O 855230915 GOIZHAPTRHIDLG-AWEZNQCLSA-N 374.441 0.081 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CCN[C@H]3C)CC2)cc1 861759655 OBVKCCUQNFWDRP-SUMWQHHRSA-N 360.458 0.647 10 10 FCCE CN1C(=O)CO[C@H](C(=O)NCc2ccc(O)cc2O)[C@H]1c1cccnc1 1299574010 NIAKIVZTRXGARE-SJORKVTESA-N 357.366 0.708 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN2C(=O)OCC[C@H]2C1 1326818972 YVJVRTIJOYKYOJ-INIZCTEOSA-N 374.441 0.730 10 10 FCCE COC(=O)C[C@H]1CS(=O)(=O)CCN1C(=O)/C=C/c1ccc(O)c(O)c1 1454615960 IKOKMEGAPLNWSV-PYEVWLCESA-N 369.395 0.300 10 10 FCCE COC(=O)[C@@H]1OCC[C@@H]1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1454857491 ORHIBCHTGDCHRF-NOZJJQNGSA-N 372.399 0.072 10 10 FCCE CCOC(=O)[C@@H]1CN(Cc2ccccc2)C[C@@H](C(=O)OCC)C(=O)C1=O 1542988764 GVXYHLBQGCLAFC-HUUCEWRRSA-N 361.394 0.999 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)C(C)(CO)CO)cc2F)CC1 134294261 DHQNECXZGOOBQL-UHFFFAOYSA-N 353.438 0.575 10 10 FCCE CN1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788331818 MJYRBDOFNAFTJD-INIZCTEOSA-N 360.458 0.350 10 10 FCCE COCCN(C(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@@H]1CCOC1 807103288 NJZHPAKLKKVSBB-QGZVFWFLSA-N 363.458 0.941 10 10 FCCE COC(=O)c1c(CN2CCN3C(=O)NC(=O)[C@@H]3C2)c2cc(F)ccc2n1C 894423002 OACDCYAMRGNEDQ-AWEZNQCLSA-N 374.372 0.840 10 10 FCCE CN1C[C@@H](CCNC(=O)C(=O)NCCCSc2nccs2)CC1=O 930197780 KDUDGHHHMLAMOO-NSHDSACASA-N 370.500 0.726 10 10 FCCE CCS(=O)(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1304259107 WOECQWJJFQBKSA-UHFFFAOYSA-N 353.404 0.957 10 10 FCCE Nc1ccc(N2C(=O)[C@H]3CS(=O)(=O)C[C@H]3C2=O)cc1Br 1924755231 IIBCPZSWGCMBAD-OCAPTIKFSA-N 359.201 0.565 10 10 FCCE CC(C)(C)OC(=O)N1CC(NC(=O)CCc2ccc(N)cc2)(C(N)=O)C1 2106228048 CJOKCNZYZKRLCP-UHFFFAOYSA-N 362.430 0.792 10 10 FCCE CN1CCN(C(=O)c2cccc(O)c2O)[C@H](CNC(=O)C(F)(F)F)C1 2118184719 NXGSZIHDHUSHBD-SECBINFHSA-N 361.320 0.533 10 10 FCCE CC(=O)CCC(=O)NC1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169876120 RYLZBXVAUWTMKJ-UHFFFAOYSA-N 350.371 0.893 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN(CCOC)[C@H]3CCOC3)nc12 786193064 WHFWGKPAEPLKBH-ZDUSSCGKSA-N 364.402 0.849 10 10 FCCE Cc1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnn1 786796346 GHFSHWPSVZVUOO-UHFFFAOYSA-N 360.439 0.950 10 10 FCCE Cn1ncc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 805994797 VHKGRMNOBUCLKS-CQSZACIVSA-N 371.445 0.516 10 10 FCCE COC(=O)CCNC(=O)CCNC(=O)NCc1ccc(N(C)C)cc1C 858903797 GTGKDXLZDUWWDE-UHFFFAOYSA-N 364.446 0.930 10 10 FCCE NC1(CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCOCC1 861766833 TYOFVDYVVLXRPJ-UHFFFAOYSA-N 360.458 0.527 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1CCNC(=O)CC1 1327820493 IFXZPSZCJKARCD-AWEZNQCLSA-N 360.458 0.457 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3CCC(=O)NC3)cc2)C1 1630738109 JCTOEMAXGJVIGZ-JKSUJKDBSA-N 372.469 0.921 10 10 FCCE CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NCc2cccc(O)c2O)c1 1651176067 ZFHPARNCFKXTFE-UHFFFAOYSA-N 366.395 0.984 10 10 FCCE NC(=O)c1cn(CCCCNC(=O)NCc2c(O)cccc2F)nn1 1683286253 LCSIHYMSSYUGPE-UHFFFAOYSA-N 350.354 0.501 10 10 FCCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)NC[C@@H]1CN2CCN1CC2 178655954 QTGLMUYVSWPMPD-MTGFJVSHSA-N 356.470 0.652 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCN(C)C3=O)CC2)cc1 772507974 GDXQIQLFTHUQSC-QGZVFWFLSA-N 360.458 0.412 10 10 FCCE Cn1c(=O)ccn(CC(=O)NCc2cc(Br)ccc2O)c1=O 804736810 ACFMIPAVRCSTKM-UHFFFAOYSA-N 368.187 0.332 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1 808509371 NCMOFAHCUPORQP-WUKHSURWSA-N 372.377 0.491 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cn([C@@H]2CCCNC2)nn1 827567859 ZNZXJAKWNQEVPD-QGZVFWFLSA-N 370.457 0.969 10 10 FCCE CN1CCCC[C@@H]1CN1CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 841033234 QJBOSQHMNSIUAP-QGZVFWFLSA-N 359.474 0.836 10 10 FCCE COCCOc1cc2c(cc1C=C1C(=O)N(C)C(=O)N(C)C1=O)OCO2 920755749 QLHIIAXXEWZQJC-UHFFFAOYSA-N 362.338 0.874 10 10 FCCE Cc1cc(C)nc(-n2[nH]c(C(=O)NCc3ccc(O)c(O)c3)cc2=O)n1 1545639516 RGXZBXLGKDWXRB-UHFFFAOYSA-N 355.354 0.914 10 10 FCCE CN(C1CC1)S(=O)(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 736329720 KSPVCYTULPOSCE-CQSZACIVSA-N 366.487 0.817 10 10 FCCE C[C@@H](O)[C@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCO1 823518883 DHUBCKHYUAMLPT-RDTXWAMCSA-N 363.458 0.939 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCC12CC(CN1)C2 851687196 ZJFSTTZQZSOREH-UHFFFAOYSA-N 358.442 0.008 10 10 FCCE COC(=O)c1cc(OCC(=O)N2CCN(C(C)=O)CC2)ccc1N(C)C 865396341 OUXSXQHSTVNLCT-UHFFFAOYSA-N 363.414 0.609 10 10 FCCE COC(=O)c1cc(OCC(=O)NCC(=O)N2CCCC2)ccc1N(C)C 865396419 SNLCGAVKTRMZJG-UHFFFAOYSA-N 363.414 0.657 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCS(=O)(=O)N1CCSCC1 1144612513 DTGSZVXRAHSSJV-UHFFFAOYSA-N 360.457 0.135 10 10 FCCE Cn1c(=O)c2cc(C(=O)NCc3c(O)cccc3F)cnc2n(C)c1=O 1156163752 CXZCCVBDHGZWCF-UHFFFAOYSA-N 358.329 0.407 10 10 FCCE C[C@H]1CC[C@@H](NC(=O)C(=O)NCCc2ccc(N)cc2)CS1(=O)=O 1333542676 LLOQIUBSSVSRRP-SMDDNHRTSA-N 353.444 0.009 10 10 FCCE Cn1nc2c(c1C(=O)NCc1c(O)cccc1O)CS(=O)(=O)CC2 1652628466 CZYQDDYNYSRTJP-UHFFFAOYSA-N 351.384 0.232 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2C[C@H]3CS(=O)(=O)C[C@@]3(C)C2)cc1 1656388792 ZETDMHMIKYXZRG-MAUKXSAKSA-N 365.499 0.735 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2311715424 VKCGAKBRQJXPTA-WHOHXGKFSA-N 355.395 0.629 10 10 FCCE COC(=O)COc1ccc(N(C)C[C@H]2CCN(S(C)(=O)=O)C2)cc1 801539710 NRGIITYCRRVXNH-CYBMUJFWSA-N 356.444 0.956 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@H]1CCCCNC1)c1ccc(N2CCOCC2)cc1 842123429 KLVHFCGACSZZNR-RDJZCZTQSA-N 374.485 0.959 10 10 FCCE CO[C@](C)(CO)CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 847290852 AZYXBGRXOGJOCP-KRWDZBQOSA-N 355.410 0.859 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@@]23COCCN2C(=O)COC3)cc1 866144335 CTBXDSKTQZVQEW-SFHVURJKSA-N 362.430 0.180 10 10 FCCE C[C@H](NC(=O)CCn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1O 1454819202 PDXQSJWQMKRESW-NSHDSACASA-N 371.397 0.407 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCN(S(N)(=O)=O)C1 1467841231 UFTDNDGEHYWOFE-LLVKDONJSA-N 362.448 0.410 10 10 FCCE CNS(=O)(=O)c1ccc(CCNC(=O)Cc2ccc(O)c(O)c2)cc1 1557965346 BXJLBJIHNCWEBA-UHFFFAOYSA-N 364.423 0.907 10 10 FCCE CN1C(=O)N[C@@]2(CCC[C@@H]2CNC(=O)c2c(F)ccc(O)c2O)C1=O 1638421615 CSOWEGOPJJNJOE-VPTHRUTESA-N 351.334 0.687 10 10 FCCE CC(C)(C)OC(=O)N[C@](C)(CO)CNC(=O)c1cc(O)c(O)c(O)c1 2068625367 XUVLNYVEYQNJSC-INIZCTEOSA-N 356.375 0.809 10 10 FCCE CN1CCO[C@@H](CS(=O)(=O)NCc2ccc(N3CCOCC3)cc2)C1 866582099 HCGNOTFQAAHVRO-QGZVFWFLSA-N 369.487 0.273 10 10 FCCE C[C@@H]1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@H]1O 1192849900 VCIOEWAPZYKXSM-RDTXWAMCSA-N 365.449 0.981 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cn(CC)nn1 1296059024 XSSLMBIIHXBUPV-ZDUSSCGKSA-N 362.386 0.542 10 10 FCCE CC(CO)(CO)NC=C1C(=O)NC(=O)N(c2cccc3ccccc23)C1=O 2296754970 XVGHRKKWCIBCIY-UHFFFAOYSA-N 369.377 0.639 10 10 FCCE CCNc1nc(NCC)n2c(SCC(=O)N(C)CCCO)nnc2n1 282067045 YCNWSZFJGDGCGD-UHFFFAOYSA-N 368.467 0.316 10 10 FCCE COc1ccc(N2CCN(CCNS(=O)(=O)NC(C)C)CC2)cc1 778626045 HRKNNTFOGTUROB-UHFFFAOYSA-N 356.492 0.650 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCn1ccnn1 806995060 NOQSETCMNPSSRQ-UHFFFAOYSA-N 358.446 0.899 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN(C2CC2)C(=O)C1 807095750 GAVSFPCOXABLFB-UHFFFAOYSA-N 358.442 0.510 10 10 FCCE COc1cnc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)nc1 845829611 XMGXIMZTVNCPSX-UHFFFAOYSA-N 371.397 0.577 10 10 FCCE COC(=O)CCNC(=O)CCN1C(=O)CN(Cc2ccccc2O)C1=O 863533443 PLGDTPHRUGXFNN-UHFFFAOYSA-N 363.370 0.226 10 10 FCCE O=C([C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)N1Cc2cccc(O)c2C1 871199501 YPGDXQSTVDJQNN-CHWSQXEVSA-N 364.423 0.270 10 10 FCCE COc1ccc(CNC(=O)[C@@H]2CC[C@H](CN3CCOCC3)O2)c(O)c1 935770905 KYZPXMRTORGIEX-WBVHZDCISA-N 350.415 0.897 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@H](N2CCCS2(=O)=O)C1 1568429584 VMUKMEYEMANMIV-ZDUSSCGKSA-N 354.428 0.667 10 10 FCCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc2ncc(CCO)cn2n1 1611430266 AJNLKCSQAHNMEW-JTQLQIEISA-N 357.370 0.431 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CCn1cc(S(N)(=O)=O)cn1 1627026603 PJZUCKYTSLNGTL-UHFFFAOYSA-N 373.431 0.428 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)c3nn[nH]n3)CC2)cc1 1634121781 ZDJAAHVRUHQPOJ-BQYQJAHWSA-N 371.401 0.076 10 10 FCCE Cc1cc(C(=O)N2C[C@@H](C(N)=O)[C@H](C(N)=O)C2)c(C)n1-c1ccc(F)cc1 1641444032 HTNCUKVWBCLESK-HZPDHXFCSA-N 372.400 0.892 10 10 FCCE O=C(N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)c1c(F)ccc(O)c1O 1654451276 ZFTZDHRQIKCINM-RFAUZJTJSA-N 359.375 0.703 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCCCS(N)(=O)=O 1683658959 XMPDQSZULPTOHY-CYBMUJFWSA-N 356.492 0.970 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](CO)[C@H](NC(=O)c2cc(O)nc(O)c2)C1 2116256484 QSIPDZKDIVKULR-ZYHUDNBSSA-N 367.402 0.841 10 10 FCCE O=C(O)CCn1cc(C=C2C(=O)NC(=O)NC2=O)c(-c2ccc(F)cc2)n1 3272978 UCMQLOZVPAVWRN-UHFFFAOYSA-N 372.312 0.913 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C[C@@H]3COCCN3)CC2)cc1 285895341 CQZIOTSZNLAELV-MRXNPFEDSA-N 362.474 0.312 10 10 FCCE CN1C2(CCC2)COC[C@]1(CO)CNC(=O)c1c(F)ccc(O)c1O 530275481 UMZCVUWMTSRFQN-QGZVFWFLSA-N 354.378 0.583 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CC(=O)N(CC2CC2)C1 898567640 YGUSCVBEUPDLSH-INIZCTEOSA-N 372.469 0.838 10 10 FCCE CCN1CCN(c2ccc(CNS(=O)(=O)C3CNC3)cc2F)CC1 923605184 CZHILVGCTVDHDU-UHFFFAOYSA-N 356.467 0.359 10 10 FCCE CS(=O)(=O)[C@H]1CCCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1119018995 ICRZDGXQESSPLG-ZDUSSCGKSA-N 366.439 0.660 10 10 FCCE CN1C(=O)c2ccccc2[C@@H]1CNC(=O)C(=O)NCCc1ccc(N)cc1 1331603587 AMFIPYHTEYJWJV-KRWDZBQOSA-N 366.421 0.871 10 10 FCCE CS(=O)(=O)[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332021026 JICKANITMVIAAG-LBPRGKRZSA-N 352.412 0.270 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H](c3cc(O)n[nH]3)C2)c1 1469715263 NMLSCGXXNKBOGD-VIFPVBQESA-N 366.399 0.822 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3nncn3C)CC2)cc1 1611365348 ICBFCFFSDCTFBO-BQYQJAHWSA-N 370.413 0.667 10 10 FCCE CC(=O)c1cc(F)cc(CNC2(C(N)=O)CCS(=O)(=O)CC2)c1O 1620519881 QDZAYHYQASQLPG-UHFFFAOYSA-N 358.391 0.256 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccn(C)n1 805703173 LFLVYEJTBCXSBB-UHFFFAOYSA-N 371.441 0.532 10 10 FCCE CN(C)c1ccc([C@@H](N)CNC(=O)c2cn([C@H]3CCCNC3)nn2)cc1 832278525 DQVSGBBCKSMBAQ-HOTGVXAUSA-N 357.462 0.698 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3CCN(C)S3(=O)=O)C2)cc1 843607673 FOKKKNNAKAYGCG-BBRMVZONSA-N 367.471 0.672 10 10 FCCE Cc1ccc(O)c(CNC(=O)[C@@H]2[C@@H](c3cnn(C)c3)N(C)C(=O)[C@@H]2O)c1 1167293713 PCSMTUWMURFNTC-BZUAXINKSA-N 358.398 0.241 10 10 FCCE O=C(NCc1ccc2cccnc2c1O)c1nc2ncc(CCO)cn2n1 1630532725 PKWCOWBNEJUUSL-UHFFFAOYSA-N 364.365 0.843 10 10 FCCE CCCN1C(=O)C(=CNCC(C)(C)N2CCOCC2)C(=O)NC1=S 2040476235 WVLUYOGVWXDNMU-UHFFFAOYSA-N 354.476 0.224 10 10 FCCE Cn1nnc(Br)c1CNS(=O)(=O)Cc1ccc(N)cc1 2145573600 XLGFFTAMLNZSOJ-UHFFFAOYSA-N 360.237 0.779 10 10 FCCE CO[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@@H]1CCOC1 828437474 OMEKOLAOZSIULL-NVXWUHKLSA-N 363.458 0.845 10 10 FCCE COc1cccc(CNC(=O)C(=O)Nc2cc(C)nnc2N(C)C)c1O 850377941 PHZZEBSRHHHDBU-UHFFFAOYSA-N 359.386 0.820 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)c3nc(O)nc(O)c3OC)C2)cc1 855225086 IRJYBDQOGCOOPF-JTQLQIEISA-N 360.370 0.914 10 10 FCCE COc1ccc(N(C)CCN(C)S(=O)(=O)C[C@H]2CNCCO2)cc1 866774779 QVCPDMPUQQPFQI-MRXNPFEDSA-N 357.476 0.381 10 10 FCCE C[C@@H](NC(=O)c1cnn2c1S(=O)(=O)N(C)CC2)c1ccccc1O 1454808238 UIOPCYCQNWOZOV-SNVBAGLBSA-N 350.400 0.714 10 10 FCCE O=C(CN1CCCC2(CC2)S1(=O)=O)NCCc1ccc(O)c(O)c1 1622753337 RLBIRDWFTVSTOZ-UHFFFAOYSA-N 354.428 0.715 10 10 FCCE CCOC(=O)CCC(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169902536 SJWMVUGSEMAGHQ-UHFFFAOYSA-N 366.370 0.431 10 10 FCCE COC(=O)[C@@H]1CS(=O)(=O)CCN1Cc1cc(OC)c(OC)cc1O 276762157 NAJUEBMYHNOTKY-NSHDSACASA-N 359.400 0.181 10 10 FCCE CCCn1nccc1NC(=O)C(=O)NC1=S=C(C(=O)OCC)C(C)=C1 411529016 GHBZVYNXWZVUCA-UHFFFAOYSA-N 364.427 0.906 10 10 FCCE CN(C)c1ccc([C@H](N)CNC(=O)c2ccc(S(N)(=O)=O)cn2)cc1 843296930 CXCSLULWRCFTBP-CQSZACIVSA-N 363.443 0.225 10 10 FCCE NC(=O)[C@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 844898556 XGCRMXYMYKQSKS-BETUJISGSA-N 364.421 0.850 10 10 FCCE NC(=O)[C@@H]1CC[C@H](CCC(=O)NCc2ccc(N3CCOCC3)cc2)O1 864984656 YXVFFKKUMCNYAU-SJORKVTESA-N 361.442 0.953 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)C1CS(=O)(=O)C1 868838379 BVOASPBLWPUXOC-UHFFFAOYSA-N 360.382 0.462 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3cc(=O)n(C)cn3)CC2)cc1 874242893 HUVMKRCCSDLQGK-UHFFFAOYSA-N 371.441 0.341 10 10 FCCE NC(=O)N[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 1327620137 GBUGDPLLKNIHSK-CQSZACIVSA-N 359.430 0.172 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CN(C)S(=O)(=O)N(C)C 1556515649 HCVNVQPQWXMTBJ-UHFFFAOYSA-N 350.437 0.232 10 10 FCCE NC(=O)c1cncc(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 750016637 GYQUAIHVFQJWPT-CYBMUJFWSA-N 354.414 0.889 10 10 FCCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CNS(=O)(=O)N(C)C 1136025466 LIAUBYQJRGFPIX-UHFFFAOYSA-N 354.476 0.641 10 10 FCCE COC(=O)N[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 1262124659 NIQYYEASKFXPGW-AWEZNQCLSA-N 362.430 0.634 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CCN(CC(=O)N2CCCCC2)CC1 1628940752 PLHGHJZIYBOXGN-UHFFFAOYSA-N 361.442 0.797 10 10 FCCE O=C1OC[C@@H]2CN(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)C[C@H]12 1682986535 HUPRZLAAIWVVBC-YOEHRIQHSA-N 359.426 0.962 10 10 FCCE CC[C@@H](F)C(=O)N[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1O 1735772646 VRDNSZICZYLXRE-JHJVBQTASA-N 365.365 0.899 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](O)[C@@H]1C(=O)NCc1ccccc1O 2127618662 CHYVIMHGATZSRZ-RRFJBIMHSA-N 366.414 0.740 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)CNCc1cc2c(cc1O)OCO2 2270666282 SCEQJZZSAVRBQL-UHFFFAOYSA-N 370.402 0.459 10 10 FCCE NC(=O)CN(Cc1ccc(N)cc1)c1nc[nH]c(=O)c1Br 164549457 AOLDQFCTUGFINF-UHFFFAOYSA-N 352.192 0.607 10 10 FCCE CC(=O)NS(=O)(=O)c1ccc(NC(=O)c2cc(O)c(O)c(O)c2)cc1 586739375 UHLBWHOQABEXKK-UHFFFAOYSA-N 366.351 0.881 10 10 FCCE COc1ccc(N2CCN(CCNc3nccn4nnnc34)CC2)cc1 749147023 BAIBXOCZGCZOJG-UHFFFAOYSA-N 354.418 0.762 10 10 FCCE CC(C)(C)[C@H](O)C[C@@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 803570229 VQBWXVCLDPQBKN-SMDDNHRTSA-N 374.459 0.652 10 10 FCCE CS(=O)(=O)NC[C@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 1460744007 QDAYGDDAUBXZNY-MRXNPFEDSA-N 353.488 0.894 10 10 FCCE Cc1nnc(CN(C)CC(=O)NCc2ccc(N3CCOCC3)cc2)n1C 121453108 DDOKILYMGPNACJ-UHFFFAOYSA-N 372.473 0.708 10 10 FCCE CC(=O)CCC(=O)N1CCC(NC(=O)c2cc(O)c(O)c(O)c2)CC1 169859825 CQXJYEMCSVLLRX-UHFFFAOYSA-N 350.371 0.893 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N(C)[C@@H](C)CO)CC2)cc1 283822192 ZQBHTCYAYRBPPY-HNNXBMFYSA-N 350.463 0.839 10 10 FCCE COc1ccc(N2CCN(S(=O)(=O)C[C@@H]3CNCCO3)CC2)cc1 326512980 BPOBYFVLWAWILN-INIZCTEOSA-N 355.460 0.135 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CCN2C[C@H](O)C[C@H]2C1)c1ccc(N(C)C)cc1 848938232 ZPLHZKWFEHDUGQ-XOKHGSTOSA-N 360.458 0.207 10 10 FCCE C[C@@]12COC[C@H]1CN(C(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)C2 1347444479 KMRYLMWWCGPIQT-OXQOHEQNSA-N 373.453 0.634 10 10 FCCE COC(=O)C1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 1535156650 LJVQTHUYBPBCHI-UHFFFAOYSA-N 359.426 0.958 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN(C)CCn3cnnc3)CC2)cc1 1654685593 HBTXFLAFDDWKPZ-GOSISDBHSA-N 374.489 0.402 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)NCc2nnc3c(=O)n(C)ccn23)c1 1683683681 WKHXAKJGNRRCLO-SNVBAGLBSA-N 372.385 0.703 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2OCCC[C@]2(COc2nnc(=N)[nH]n2)C1 2222986743 QYYCFKQOERJLQJ-ZUZCIYMTSA-N 352.395 0.474 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@@H]1C(=O)Nc1ccc(N)cc1 2311697390 URNHUDCAACXIKW-MGPQQGTHSA-N 351.403 0.939 10 10 FCCE Cn1c2c(ccc1=O)[C@H](NC(=O)C(=O)NCCc1ccc(N)cc1)CCC2 846344969 SRUQRNUJNOCELZ-MRXNPFEDSA-N 368.437 0.820 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](C)S(N)(=O)=O)C2)cc1 852452134 SNWXZRSYAGNMKA-VXGBXAGGSA-N 356.448 0.250 10 10 FCCE Cc1cc(Br)c(O)c(CNC[C@@H](O)CS(C)(=O)=O)c1 922823406 LYDXBGQTEFTELJ-SNVBAGLBSA-N 352.250 0.958 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C[C@@H]3COC(=O)C3)cc2)CC1 1133847709 SEVQYERXEQHAQJ-AWEZNQCLSA-N 359.426 0.958 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)NC[C@@]23COCCN2C(=O)OC3)c1 1254433218 ROGBGDSPRAULFI-GTNSWQLSSA-N 365.386 0.982 10 10 FCCE COC(=O)N[C@@H](C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1455869007 WQDXQUDJDWJVRJ-LBPRGKRZSA-N 362.430 0.749 10 10 FCCE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C1 805480791 BAOPFHSLHZCBDA-FWPCIQOSSA-N 369.443 0.498 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCCNC3CC3)C2)cc1 851687681 HABNPDAJBUNITM-HNNXBMFYSA-N 360.458 0.648 10 10 FCCE COc1cc(N2C[C@H]3[C@H](OC)CS(=O)(=O)[C@H]3C2)c([N+](=O)[O-])cc1OC 853877352 VZHGMFQOBOFJQE-AMFBXLIHSA-N 372.399 0.860 10 10 FCCE O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)N1Cc2cccc(O)c2C1 871202494 JKYGOPLDKVHNSD-GOSISDBHSA-N 373.453 0.948 10 10 FCCE CCOC(=O)[C@H]1CN(Cc2ccccc2)C[C@@H](C(=O)OCC)C(=O)C1=O 1542988762 GVXYHLBQGCLAFC-GASCZTMLSA-N 361.394 0.999 10 10 FCCE CCS(=O)(=O)c1cnc(O)c(C(=O)NCc2cc(O)ccc2O)c1 1558175147 FMEVQJCAFOIUAS-UHFFFAOYSA-N 352.368 0.922 10 10 FCCE CC(C)(C)OC(=O)NC[C@@H](CO)C(=O)NCCOc1ccc(N)cc1 2080928445 DHAMLBSQFAZCOK-LBPRGKRZSA-N 353.419 0.897 10 10 FCCE CC(=O)N1N=C(c2c(O)[nH]c(=O)n(C)c2=O)C[C@@H]1c1ccc(N(C)C)cc1 101765931 GNMPOBVQCFTYMP-CQSZACIVSA-N 371.397 0.543 10 10 FCCE CCOC(=O)[C@@H]1CCCN(C(=O)C(=O)N(C(C)=O)c2ccc(N)cc2)C1 170318528 BMNSNQXMFACUMN-CYBMUJFWSA-N 361.398 0.950 10 10 FCCE C[C@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCC(=O)NC1 798405055 YEJOIHDFIAAYIB-YWZLYKJASA-N 372.469 0.921 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NCCCn1ccnn1 817825240 JYZYCJREIPSMQT-HNNXBMFYSA-N 372.473 0.906 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCNC[C@H]3C)C2)cc1 851688623 FDIQBKHONWVDQT-JKIFEVAISA-N 360.458 0.504 10 10 FCCE CN1NN=C2C1=NCC[C@@H]2C(=O)NCc1cc(Br)ccc1O 854442370 PYABALUZPKFNFV-JTQLQIEISA-N 366.219 0.995 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3CC(F)(F)C[C@H]3CO)ccc21 1257536509 OVBCLWYSYCZSFV-AWEZNQCLSA-N 367.396 0.914 10 10 FCCE Cn1ncc(CCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 1264736773 BVRLLBLODYRBKK-HNNXBMFYSA-N 370.457 0.766 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CC[C@@H](C(N)=O)O1 1630481403 STDRYUCBVMIWSX-UONOGXRCSA-N 350.371 0.317 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)NC[C@@H]3CNC(=O)C3)cc2)CC1 1683160547 FBOKRBDNENXBLU-AWEZNQCLSA-N 373.457 0.324 10 10 FCCE C[C@@H](NC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C)C(N)=O 2123503961 JOODWUZSOKIGFO-KOLCDFICSA-N 367.402 0.524 10 10 FCCE COc1ccc(Br)c(CNCCNS(N)(=O)=O)c1O 2227752509 WFMHNVKXMDTBRN-UHFFFAOYSA-N 354.226 0.046 10 10 FCCE CCn1cnc(S(=O)(=O)Nc2ccc(NS(=O)(=O)NC)cc2)c1 797431317 LQZOBNMGKOBXPU-UHFFFAOYSA-N 359.433 0.580 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H]3CCCN3C)CC2)cc1 819061537 WDQBBIMYEYEVRU-OALUTQOASA-N 362.518 0.862 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3c[nH]nc3C)C2)cc1 827147321 PZZBDBPQJGRQSF-CQSZACIVSA-N 357.414 0.738 10 10 FCCE O=C(c1c(F)ccc(O)c1O)N1CCCN(S(=O)(=O)C2CC2)CC1 831447271 GAYITRWICSZTLT-UHFFFAOYSA-N 358.391 0.877 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNCC3(CCO)CC3)CC2)cc1 843107689 IXJDMEDXAFXIKS-GOSISDBHSA-N 363.502 0.930 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCOC[C@@H]2c2ccnn2C)cc1 846722628 MHWXKYFEBYZLBB-QGZVFWFLSA-N 371.441 0.702 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCCN3CCNC(=O)C3)C2)cc1 852455587 UVGGTCOCNPZNIC-CQSZACIVSA-N 361.446 0.005 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCc3nnn(C)c3C2)cc1 929237563 KTKHUJFRJQIALA-CYBMUJFWSA-N 356.430 0.171 10 10 FCCE COC(=O)/C=C\c1ccc(N(C)CCNS(C)(=O)=O)c([N+](=O)[O-])c1 1318516021 WZJYURQAKNXMQW-ALCCZGGFSA-N 357.388 0.766 10 10 FCCE C[C@@H]1CC[C@@H](NC(=O)C(=O)NCCc2ccc(N)cc2)CS1(=O)=O 1333542673 LLOQIUBSSVSRRP-BXUZGUMPSA-N 353.444 0.009 10 10 FCCE O=C1CS(=O)(=O)C[C@@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)N1 1468669906 UKHDGFWRBHNIIT-VIFPVBQESA-N 367.210 0.228 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C[C@H]3CC(=O)NC3=O)cc2)CC1 1634974384 QQNOASCNDNMPAR-AWEZNQCLSA-N 372.425 0.057 10 10 FCCE CNS(=O)(=O)c1cc(NS(=O)(=O)CC(C)(C)OC)ccc1O 840913598 HVGYCLJZMKVVNJ-UHFFFAOYSA-N 352.434 0.467 10 10 FCCE COc1ccc(N2CC[C@H](CNS(=O)(=O)C[C@H]3CNCCO3)C2)cc1 866773823 KEOYYOPCTINDKI-RHSMWYFYSA-N 369.487 0.429 10 10 FCCE COCCN(CCOC)C1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 911859574 LAWAISIKDPWHPY-GQCTYLIASA-N 350.415 0.917 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 1772821576 DSFCDHFTGOKAQJ-FLIBITNWSA-N 356.426 0.822 10 10 FCCE CN1C[C@@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)NC1=O 822937315 GTKRDPLOSRYMEF-ZFWWWQNUSA-N 359.430 0.028 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](N)C(F)(F)F)cc2)CC1 832172421 GHJRGMPRLKKLGP-AWEZNQCLSA-N 358.364 0.861 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CCN(C)S1(=O)=O 843757973 HVLGSRSAWASCIJ-MRXNPFEDSA-N 367.471 0.516 10 10 FCCE CN1CCN(c2ccc(CNC(=O)c3cccnc3C(N)=O)cc2)CC1 918857662 SEDSFCAWUJRRBF-UHFFFAOYSA-N 353.426 0.862 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(c2ncccn2)CC1 1331930006 SLPLVSNCVSZFOY-UHFFFAOYSA-N 353.382 0.373 10 10 FCCE CN(C)c1ccc(CNC(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)cc1F 1772824413 SLCWCGOMNRODDB-VURMDHGXSA-N 360.389 0.619 10 10 FCCE Cc1ccc(CNS(=O)(=O)CCOCCN)c(O)c1Br 2381132447 AYXPOSYMSFGXAK-UHFFFAOYSA-N 367.265 0.858 10 10 FCCE CSCC[C@@]1(C(=O)O)N[C@H](c2ccccc2O)[C@H]2C(=O)N(C)C(=O)[C@H]21 59086919 BRPXHRAJUASVQS-APNQJHFZSA-N 364.423 0.844 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)Cn2cncn2)cc1 284142087 QDMKBMNMDJUNSO-AWEZNQCLSA-N 358.446 0.945 10 10 FCCE CC1=C(C(=O)O)N2C(=O)[C@H](NC(=O)[C@H](N)c3ccccc3O)[C@@H]2SC1 503996013 CUXVKLLSHPANDN-ZETOZRRWSA-N 363.395 0.151 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C3(O)CCOCC3)CC2)cc1 772506847 BALWACNCIKYUTF-UHFFFAOYSA-N 363.458 0.475 10 10 FCCE COc1ccc(N2CCN(CCNS(=O)(=O)N3CCC3)CC2)cc1 795828610 GLSIWERHYLFNGR-UHFFFAOYSA-N 354.476 0.357 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CCN=C4C3=NNN4C)C2)cc1 855227654 ZVOKLYPULDQZIV-IUODEOHRSA-N 356.430 0.615 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)c3cn(CC(=O)N(C)C)nn3)C2)cc1 855228443 ALGYUKSGAUZRLK-CYBMUJFWSA-N 372.429 0.384 10 10 FCCE O=C(c1cccc(O)c1O)N1CCN(C[C@@H]2CCCS2(=O)=O)CC1 913127528 CYBYTRBDSUGJIN-LBPRGKRZSA-N 354.428 0.433 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 930905442 GOTZOMRYICDDQO-AWEZNQCLSA-N 353.444 0.014 10 10 FCCE C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1348638541 DZQQZKHEBIGJKU-CYBMUJFWSA-N 361.442 0.538 10 10 FCCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C[C@H]2CNC(=O)O2)nn1 1638347093 CITFAMJULLWNAJ-GXSJLCMTSA-N 361.358 0.159 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2311714770 HFWNOOKCTHKEAI-IRCOFANPSA-N 355.395 0.486 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2331520082 IZUVKJOTHMTJER-FDYHWXHSSA-N 369.422 0.876 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNCCCn3ccnn3)CC2)cc1 819223881 OSOFEXIIVCIXOI-SFHVURJKSA-N 374.489 0.450 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H](C)CCN(C)C)C2)cc1 827489875 WWELVZYOWYGDQF-LSDHHAIUSA-N 362.474 0.847 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CC[C@H](O)CC3)C2)cc1 829700219 YOSYUMVQPSADHB-DZKIICNBSA-N 361.442 0.810 10 10 FCCE CCO[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1CN 846348645 KLTPBQRRMDUPSL-NVXWUHKLSA-N 362.474 0.533 10 10 FCCE CS(=O)(=O)CC1(C(=O)NCc2ccc(N3CCCC3)cc2)COC1 1347335744 NCHUVWCOTXUKEC-UHFFFAOYSA-N 352.456 0.964 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCN4CCOC[C@@H]4C3)CC2)cc1 368826061 PPBVOZRTAVXLAN-SFHVURJKSA-N 374.485 0.360 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@@H]([C@H](C)O)C1 840981472 VFVUMKZHSAJBLX-XJKSGUPXSA-N 350.415 0.739 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCOC1CNC1 843489746 SZHBJMNVANBWHT-UHFFFAOYSA-N 356.806 0.926 10 10 FCCE COC(=O)c1cn(CC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)nn1 855230263 FEUOQIRKNULGNJ-GFCCVEGCSA-N 359.386 0.468 10 10 FCCE CC(C)NC(=O)CNS(=O)(=O)CCC(=O)N(C)Cc1ccccc1O 1622317270 DWHQEFSGPVQECL-UHFFFAOYSA-N 371.459 0.185 10 10 FCCE Cc1cc(C(=O)N2C[C@@H](C(N)=O)[C@@H](C(N)=O)C2)c(C)n1-c1ccc(F)cc1 1641444034 HTNCUKVWBCLESK-IYBDPMFKSA-N 372.400 0.892 10 10 FCCE C[C@@H](CN)NC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2080869262 KTEXUYQFILREFI-JQWIXIFHSA-N 353.419 0.997 10 10 FCCE CC(C)(C)OC(=O)N1CCC(COCCOc2nnc(=N)[nH]n2)CC1 2219018962 VYORFXRLPKIISO-UHFFFAOYSA-N 354.411 0.722 10 10 FCCE COc1ccc(N2C(=O)C(=CNCCCN(C)C)C(=O)NC2=S)cc1 2296548400 CUAHTBURLUTWOR-UHFFFAOYSA-N 362.455 0.868 10 10 FCCE CSCC[C@H](C(=O)OCC(=O)C(C)=O)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 808491142 MMBGOFPFLVFKIF-JHJVBQTASA-N 369.439 0.985 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@H](C(=O)NC)C1 817762911 XFFWASIQLRAAKN-HNNXBMFYSA-N 360.458 0.696 10 10 FCCE CC1(C)C[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CO1 827078403 LMARWXYBUJPDDC-HNNXBMFYSA-N 361.442 0.823 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](NC(=O)C3CC3)[C@@H](C)O)C2)cc1 855228204 XFZNJVFHMFEASX-IFIJOSMWSA-N 361.442 0.666 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)[C@@H]3CCOC3)C2)cc1 1118693779 ZVZFCQXUYNWKAD-ZNMIVQPWSA-N 361.442 0.931 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(C[C@H]2CCOC2)CC1 1329844637 VNVSEMJTRASFPI-CQSZACIVSA-N 359.426 0.415 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)NC3C[C@H]4C[C@@H]4C3)cc2)CC1 1331763766 AUCVUXIQAYHVIH-HZPDHXFCSA-N 356.470 0.969 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC3(C[C@H](O)CNC3=O)C2)c([N+](=O)[O-])c1 1640411809 FROJISFTYMRHGG-FHMRSRPSSA-N 361.354 0.468 10 10 FCCE COc1ccc(N2CCN(C=O)CC2)cc1NS(=O)(=O)NC(C)C 62275249 SJPPAQQSDAXPRA-UHFFFAOYSA-N 356.448 0.628 10 10 FCCE CN1C(=O)C(=CNNc2ccc(Br)cn2)C(=O)N(C)C1=O 727490703 VZKDEKDJBHATDJ-UHFFFAOYSA-N 354.164 0.695 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3C[C@H]4CC[C@H]3CN4)C2)cc1 818676398 NLUJDFLVKWPBGI-INMHGKMJSA-N 372.469 0.601 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cnc(O)n(C)c1=O 819696663 ZEICTUQCAMCWBE-UHFFFAOYSA-N 361.354 0.397 10 10 FCCE C[C@@H](NS(=O)(=O)C[C@H]1CNCCO1)c1ccc(N2CCOCC2)cc1 866747064 OCCPCXLCIXTJDO-RHSMWYFYSA-N 369.487 0.492 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@H]4CC[C@H]3CN4)CC2)cc1 923381142 BYBJBNFDHQEPJZ-NEWSRXKRSA-N 360.502 0.614 10 10 FCCE O=C(NCc1cn(CC(F)(F)F)c(=O)nc1O)c1cccc(O)c1O 1303784081 SKUNDCDGINDGNW-UHFFFAOYSA-N 359.260 0.852 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCCn2nncc2C1 1338538081 KRLBTUFWNWVHLA-UHFFFAOYSA-N 366.425 0.703 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C3CS(=O)(=O)C3)cc2)C1 1544930252 WOATWMADSYHYMR-CYBMUJFWSA-N 365.455 0.049 10 10 FCCE O=C(Cn1c(O)nnc1O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1626058979 OVHKRGGLSWAALO-UHFFFAOYSA-N 369.328 0.121 10 10 FCCE C[C@@H](NC(=O)c1cnc2c(c1)c(=O)n(C)c(=O)n2C)c1ccccc1O 1642824484 XGJSZJDYUXYCSE-SNVBAGLBSA-N 354.366 0.829 10 10 FCCE COCCN(C(=O)[C@H](C)Cc1ccc(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1 170245310 JANDYCMJYDNOOH-TZMCWYRMSA-N 371.455 0.939 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H](C)S(C)(=O)=O)CC2)cc1 299490557 GBGQRKLUBZUNGA-AWEZNQCLSA-N 369.487 0.367 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCN(C3CC3)C(=O)C2)cc1F 803660888 ICUSLSFTOQOWAJ-UHFFFAOYSA-N 362.405 0.341 10 10 FCCE CNS(=O)(=O)CCNC(=O)NCc1cc(Br)ccc1O 805322945 ISNBHZYTOXTEQR-UHFFFAOYSA-N 366.237 0.503 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3CC4CC3(CN)C4)CC2)cc1 851655869 ANXAUPVGMALISH-UHFFFAOYSA-N 373.501 0.950 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)C3=NO[C@@H](CN)C3)cc2F)CC1 852872412 GOHWVAFCNIYLCZ-CQSZACIVSA-N 363.437 0.687 10 10 FCCE CCN1CC[C@H](NC(=O)C(=O)NCc2ccc(N(CC)CC)cc2)C1=O 1119068792 FPVQKYXYRKRMOG-INIZCTEOSA-N 360.458 0.886 10 10 FCCE CC[C@@H](CNC(=O)[C@@]12COC[C@@H]1C2)NC(=O)c1cc(OC)nc(OC)c1 1582471284 XDUBTKBVJQCUGN-LXIYXOSZSA-N 363.414 0.760 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NS(=O)(=O)Cc1ccc(N)cc1 2044244049 PNVDCTDPGGVSSR-KBPBESRZSA-N 371.459 0.980 10 10 FCCE CC(C)(C)OC(=O)N[C@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)C1CS(=O)(=O)C1 2076830354 CHSGEOORIMZBPM-GAFUQQFSSA-N 374.459 0.190 10 10 FCCE Cn1ncc(I)c1CNC(=O)c1cc(O)nc(O)c1 2133344034 QMUSSOQXWORMBO-UHFFFAOYSA-N 374.138 0.761 10 10 FCCE COc1cccc(CNC[C@@H]2[C@H](O)[C@H](O)CN2C(=O)OC(C)(C)C)c1O 2225621293 CBESSPBYVZWKII-IOASZLSFSA-N 368.430 0.832 10 10 FCCE CN1C(=O)C(=CNCCN2CCOCC2)C(=O)N(c2ccccc2)C1=S 2297512673 DMXZKEGGOBKBJB-UHFFFAOYSA-N 374.466 0.582 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2311714710 GBXAENVXUUQASV-DDHJBXDOSA-N 355.395 0.629 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNCc1ccc(O)cc1O 2312325498 ZQCHSZGULYEAPK-YUELXQCFSA-N 354.403 0.529 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC[C@@H]3CCOC3)C2)cc1 828506574 OTLSKYJUKNOTBS-HUUCEWRRSA-N 361.442 0.933 10 10 FCCE CN1C[C@@H](O)C[C@]1(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 909856538 NQCQPRPLNGIJRA-SCLBCKFNSA-N 369.412 0.873 10 10 FCCE NC(=O)N[C@H](CO)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1137082389 YAFGSJWDBKAWTH-GXFFZTMASA-N 372.372 0.402 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCN2C(=O)CCCC2=O)c1 1147558903 IMRUXKNBZVQJKG-UHFFFAOYSA-N 369.399 0.033 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CCn1cc(C(N)=O)c(O)nc1=O 1440660975 AXOQJLTVVBKCPI-UHFFFAOYSA-N 373.413 0.163 10 10 FCCE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2299074793 HQMGAIIWGYZAJM-GMTAPVOTSA-N 362.448 0.190 10 10 FCCE O=C(O)C[C@H](C(=O)O)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O 13524674 KYSQDMNDMYECNZ-GGKWECFFSA-N 354.267 0.283 10 10 FCCE in-vitro CCN1C(=O)C(=CNCCCN2CCCC2=O)C(=O)N(CC)C1=S 60861209 FFHLAIGLUYSNFN-UHFFFAOYSA-N 352.460 0.468 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CCCC3=O)CC2)cc1F 84963951 PZINGFNUDYADQO-HNNXBMFYSA-N 351.422 0.940 10 10 FCCE CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@@H]1OC(C)=O 85483138 QKGHBQJLEHAMKJ-XGFWRYKXSA-N 373.318 0.380 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@@]3(CCCOC3)C2)c1 285764054 BNXGHMDEOMYNIJ-INIZCTEOSA-N 370.427 0.785 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CSC(=O)N3)cc2)C1 746147425 OXLNWJAMDXGRRS-JSGCOSHPSA-N 362.455 0.830 10 10 FCCE Cn1cc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nn1 783012465 QQHNCVUQKNUAAT-AWEZNQCLSA-N 371.445 0.516 10 10 FCCE C[C@H](O)[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 817831455 MGWGOYUXKWZTOI-YOEHRIQHSA-N 359.426 0.287 10 10 FCCE O=S(=O)(C[C@H]1CNCCO1)N(Cc1ccccc1O)C[C@@H]1CCCO1 866751198 SSGXRIADKAITTK-JKSUJKDBSA-N 370.471 0.691 10 10 FCCE Cc1nc([C@H]2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)n[nH]1 1142369073 BHDIEHNYUAXKPE-JTQLQIEISA-N 365.415 0.820 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CC[C@H](O)[C@H](O)CC2)c1 1303830060 QORDGKCAKYBLCI-CFWWUVRLSA-N 358.416 0.158 10 10 FCCE C=CC(=O)NCCC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1645590746 COZPGYUYJIQMRG-UHFFFAOYSA-N 358.442 0.697 10 10 FCCE Nc1n[nH]c(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)n1 1684749538 HNMTVNDMCIOXSD-UHFFFAOYSA-N 363.397 0.487 10 10 FCCE NS(=O)(=O)NCCCNCc1cc(Br)cc(F)c1O 2101322679 UWTBBPGOZMBOOU-UHFFFAOYSA-N 356.217 0.567 10 10 FCCE CN(c1cc2c(cc1Br)[C@@H](N)C(=O)N2)C1CS(=O)(=O)C1 2152239874 ODACCTXOUMOGDT-LLVKDONJSA-N 360.233 0.634 10 10 FCCE COC[C@@H](C)S(=O)(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 265370038 CNSSJRIVJBKKHE-OAHLLOKOSA-N 371.503 0.772 10 10 FCCE Cc1cc(C(=O)NS(=O)(=O)c2cnnn2C)c(C)n1-c1ccccn1 781740872 COCUUWWOICZPRK-UHFFFAOYSA-N 360.399 0.736 10 10 FCCE CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC(=O)/C=C\c1ccc(O)c(O)c1 800667912 PLRJNCZUOULIMN-BZGOVLQXSA-N 354.428 0.945 10 10 FCCE COCCN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CCOC1 807291359 HPTUEDMCYZKNCJ-SFHVURJKSA-N 373.453 0.943 10 10 FCCE O=C1OC[C@@]2(CNCc3ccc(N4CCOCC4)c(F)c3)COCCN12 865768784 CAHFOCMUFWLFAA-GOSISDBHSA-N 365.405 0.973 10 10 FCCE CNC(=O)N[C@@H]1CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 1478956256 DUOYAZPMIYLXOZ-ZIAGYGMSSA-N 361.446 0.987 10 10 FCCE COc1ccc(S(N)(=O)=O)cc1C(=O)NCc1c(O)cccc1O 1645360536 BFWWALVJHAUAIP-UHFFFAOYSA-N 352.368 0.684 10 10 FCCE O=C(CNC(=O)c1ccccc1)NCCNC(=O)c1cc(O)c(O)c(O)c1 169837021 FXZYSFPIEXUCLY-UHFFFAOYSA-N 373.365 0.079 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cn([C@H]2CCCNC2)nn1 827567858 ZNZXJAKWNQEVPD-KRWDZBQOSA-N 370.457 0.969 10 10 FCCE C[C@@H]1NCC[C@H]1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 861743402 VVLVKHYLXWPNSS-JKIFEVAISA-N 360.458 0.567 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1CCC(=O)N(C)CC1 1118653593 DSMJUFIVYXJLCG-HNNXBMFYSA-N 374.485 0.799 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@@H]2CCCS2(=O)=O)cc1 1331633783 UEIKVWVDRURKBK-HNNXBMFYSA-N 367.471 0.452 10 10 FCCE O=C(NCCN1CCS(=O)(=O)CC1)c1cc2cc(O)c(O)cc2s1 1443222906 DKCSTZOUPSZHDV-UHFFFAOYSA-N 370.452 0.773 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@@H]3COCC[C@@H]32)c1 1647779587 NYPWJUBYYFFWKD-GXTWGEPZSA-N 356.400 0.394 10 10 FCCE C[C@H](Cn1cncn1)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 284365674 ZQAZREMWVAXNCK-CQSZACIVSA-N 356.430 0.699 10 10 FCCE CN1C[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)NC1=O 822937312 GTKRDPLOSRYMEF-UKRRQHHQSA-N 359.430 0.028 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@H]3CCCCN3)C2)cc1 851687455 BCIZBDJUTYLEOQ-HUUCEWRRSA-N 360.458 0.648 10 10 FCCE Cn1ccn2c(CCNC(=O)NCc3c(O)cccc3F)nnc2c1=O 1251104105 KQTYAHKGXIIPNT-UHFFFAOYSA-N 360.349 0.315 10 10 FCCE COC[C@@H](CCNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)OC 1328959514 OYYZZAHMKBOFIN-MRXNPFEDSA-N 351.447 0.845 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N(C)CCNS(C)(=O)=O)C2)cc1 1333778088 MFPKVCZSFPVAEE-CYBMUJFWSA-N 370.475 0.465 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)N(C)CCN(C)c1ccc(OC)cc1 1531375216 SJBRFFZYKRNVTF-UHFFFAOYSA-N 357.476 0.871 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@H]3C[C@H](CO)C3)cc2)CC1 1687632031 JXAYKJQNONCSGI-KOMQPUFPSA-N 360.458 0.958 10 10 FCCE NC(=O)[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(Cc2cc(N)ccc2O)C1 2106667241 UXSHGSZCQZZVAQ-GXSJLCMTSA-N 360.336 0.329 10 10 FCCE CCN1C(=O)[C@H]2CN(Cc3ccc(N4CCN(C)CC4)cc3)CCN2C1=O 775735894 DWFDQRNQGLSVBB-GOSISDBHSA-N 371.485 0.907 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N[C@@H]3[C@H]4COC[C@H]43)CC2)cc1 792946584 QXRABJJMDJUDMN-PIIMJCKOSA-N 360.458 0.761 10 10 FCCE COC(=O)[C@@H]1C[C@H](O)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 826816279 DVSANTALGMHVKQ-BDAKNGLRSA-N 351.315 0.286 10 10 FCCE COC(=O)c1cn(CC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)nn1 855230264 FEUOQIRKNULGNJ-LBPRGKRZSA-N 359.386 0.468 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)c3nc(C)n(-c4nc[nH]n4)n3)C2)cc1 855232164 OQCYPJJGXLRAIX-LBPRGKRZSA-N 368.401 0.711 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N3C[C@H](N)C(C)(C)C3)CC2)cc1 903727820 BRPBCRXMNHBTSF-KRWDZBQOSA-N 374.485 0.930 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@H]2CNC(=O)C2)cc1F 1351248344 UGGZZAGOTZXKCB-GFCCVEGCSA-N 350.394 0.150 10 10 FCCE NS(=O)(=O)c1ccc(CCC(=O)NCc2ccc(O)cc2O)cc1 1451765262 GLVUUWFELHBYLY-UHFFFAOYSA-N 350.396 0.994 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCOc2ncccn2)c1 1557257232 PBNPGQPBEPMNAF-UHFFFAOYSA-N 366.399 0.753 10 10 FCCE NS(=O)(=O)CCCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1565985219 AELYMEUJHABMBI-UHFFFAOYSA-N 369.487 0.580 10 10 FCCE C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NCc1cccc(Cl)c1O 1648606087 HPAWHADVNFMVPK-SECBINFHSA-N 372.834 0.762 10 10 FCCE COc1cc(N2CCC(C(=O)NCCO)CC2)c([N+](=O)[O-])cc1OC 1651290845 OLWGTNPIZLMZJM-UHFFFAOYSA-N 353.375 0.937 10 10 FCCE CC(C)(C)OC(=O)NC[C@@]1(O)CCCN(C(=O)c2cc(O)nc(O)c2)C1 2270837983 ONFIELDGZPQDPP-KRWDZBQOSA-N 367.402 0.985 10 10 FCCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NCCNC(=O)c1cc[nH]n1 2308083382 OPVMDLFJJLDGTA-UHFFFAOYSA-N 369.425 0.806 10 10 FCCE COc1ccc(N2CCN(C(=O)CN[C@@H]3CCS(=O)(=O)C3)CC2)cc1 243428532 MXVACFDMZWVKII-CQSZACIVSA-N 367.471 0.121 10 10 FCCE CC1(C)O[C@@H]2[C@@H]3OC(C)(C)O[C@@]3(COS(=O)(=O)N=[N+]=[N-])OC[C@H]2O1 256004524 ULLWHTAOFMDWSA-JDVQERKKSA-N 365.364 0.956 10 10 FCCE COCCOc1ccc(-n2nc(C)c(C(=O)OCC(=O)C(C)=O)n2)cc1 808518305 HBMPPWIDKUEQNI-UHFFFAOYSA-N 361.354 0.916 10 10 FCCE Cc1cc(C(=O)CN2CCN(CC(N)=O)C(=O)C2)c(C)n1-c1ccccc1 839180951 ZHSJQYKXOJQQEP-UHFFFAOYSA-N 368.437 0.906 10 10 FCCE COC(=O)CC[C@@H](N)C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 843490366 XSRHEUKWCNBVRQ-GFCCVEGCSA-N 372.805 0.828 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@@H](C(N)=O)C3)cc2)C1 844907050 ZTDUGPJHFYRPQI-KFWWJZLASA-N 373.457 0.451 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCC(=O)N1C 1138054510 AUONAUBPELROKS-QWHCGFSZSA-N 364.398 0.699 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnn[nH]3)CC2)cc1 1138325270 BVMZJDARBURCRE-SREVYHEPSA-N 356.386 0.657 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@H](O)CN1c1ccncn1 1466790815 LQGFLPJFCRZWQN-XBFCOCLRSA-N 358.398 0.575 10 10 FCCE O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NCc1ccc(O)cc1O 1557084748 MULANVFGIULEQF-UHFFFAOYSA-N 367.361 0.986 10 10 FCCE O=C1NC(=O)[C@@H]2[C@@H]1[C@H](c1ccccc1O)N[C@]2(Cc1ccccc1)C(=O)O 247433221 VCMNEVBKUKRYCY-OLPIVMHESA-N 366.373 0.991 10 10 FCCE COC(=O)[C@@H]1C[C@H](N2C(=O)CNC2=O)CN1Cc1cccc(OC)c1O 857057657 HTVQILWAGNBWLC-RYUDHWBXSA-N 363.370 0.069 10 10 FCCE CNCCOCCN(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 861755080 OCNZWOCZQBEBPT-UHFFFAOYSA-N 360.458 0.373 10 10 FCCE COC(=O)c1cc(OCC(=O)N2CCCC[C@@H]2C(N)=O)ccc1N(C)C 1166714769 ZGLBUXJNMALXQN-OAHLLOKOSA-N 363.414 0.784 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C[C@H]3CCC(=O)NC3)cc2)CC1 1652071409 WVEQRPHTWQZWRE-OAHLLOKOSA-N 372.469 0.921 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1NC(=O)c1cc(O)c(O)c(O)c1 2068618619 SCCDLEFNTDOPCF-VHSXEESVSA-N 354.359 0.825 10 10 FCCE Cn1ccnc(N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)c1=O 768465610 IVTKHZWEWBNGQQ-HNNXBMFYSA-N 358.398 0.234 10 10 FCCE CN(C)S(=O)(=O)[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 795654961 WRWWAFVDYNWPGG-IUODEOHRSA-N 356.444 0.674 10 10 FCCE CN(CCO)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 808851390 CUYBYLJBYORWRJ-UHFFFAOYSA-N 374.485 0.286 10 10 FCCE CCON(C)C(=O)CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852397524 LHHGSNDNIWEGQJ-CYBMUJFWSA-N 350.419 0.983 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H](Cn3ccnn3)C2)c1 855237545 NNACKNVYJMLFHC-NSHDSACASA-N 365.415 0.518 10 10 FCCE C[C@@]1(CO)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@]1(C)CO 858775361 CBDDWCGJWFVSOP-IYBDPMFKSA-N 351.359 0.743 10 10 FCCE Nc1ccc(NC(=O)C(=O)NC[C@H]2CN(Cc3ccncc3)CCO2)cc1 861530304 WBELIIIVXRQMDG-KRWDZBQOSA-N 369.425 0.620 10 10 FCCE CCN1CCC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 1456064406 KRIZQJKNNSYPGU-LBPRGKRZSA-N 355.416 0.504 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C3CCC2(C(N)=O)CC3)c1 1653005777 OVMVXLQOCFIRJP-UHFFFAOYSA-N 353.400 0.386 10 10 FCCE NC(=O)[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(Cc2cc(N)ccc2O)C1 2106667244 UXSHGSZCQZZVAQ-ONGXEEELSA-N 360.336 0.329 10 10 FCCE C[C@H](NC(=O)[C@@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C)c1ccccc1O 2136132652 JSQBTKVTBHOFJU-HJPIBITLSA-N 366.414 0.911 10 10 FCCE O=S1(=O)C[C@H]2NCCN(Cc3cc(Br)ccc3O)[C@H]2C1 2143714954 WXWRGOIHCSTAKR-NEPJUHHUSA-N 361.261 0.726 10 10 FCCE COc1ccc(N2CCC(NC(=O)CS(=O)(=O)N(C)C)CC2)cc1 751888740 RHWBXPGXEVBSDC-UHFFFAOYSA-N 355.460 0.672 10 10 FCCE C[S@](=O)CCN1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 771148780 YRNSMJYXVAZXDJ-VWLOTQADSA-N 368.415 0.426 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(S(N)(=O)=O)cn2)c1 798334533 ZVDMGFNEHLBGQO-SECBINFHSA-N 351.384 0.934 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC(N3CC[C@H](O)C3)CC2)cc1 826707525 UHRVHWKGKLPGNA-SFHVURJKSA-N 374.485 0.426 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@]12CNC[C@H]1COC2 846672826 LPORVTVBXCEJMK-LIRRHRJNSA-N 363.433 0.639 10 10 FCCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 929522869 ASNYTAQVMCZARI-NJAFHUGGSA-N 373.453 0.823 10 10 FCCE NCCCNCCCCNCCCNC(=O)/C=C/c1ccc(O)c(O)c1 1848437418 VBNNALZDIMCECI-SOFGYWHQSA-N 364.490 0.926 10 10 FCCE O=C(N=c1ccc(I)n[nH]1)c1cc(O)c(O)c(O)c1 2132407044 MNKPPCZCBGVQIZ-UHFFFAOYSA-N 373.106 0.872 10 10 FCCE O=C1NC(=O)N(C2CCCCC2)C(=O)C1=CNCCN1CCOCC1 2297455953 JRKXAIMGVLOUHS-UHFFFAOYSA-N 350.419 0.203 10 10 FCCE COCCOCCS(=O)(=O)Nc1cc(N2CCOCC2)ccc1OC 62274243 QMEGGGATLASWCC-UHFFFAOYSA-N 374.459 0.937 10 10 FCCE Cn1nnc(COC(=O)c2ccc3c(c2N)C(=O)c2ccccc2C3=O)n1 799454668 UTUOJCHYQOYRJX-UHFFFAOYSA-N 363.333 0.925 10 10 FCCE CCn1nccc1CNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 830905911 HKCMOYCQTYIQJV-AWEZNQCLSA-N 371.441 0.923 10 10 FCCE C[C@@H](NC(=O)C(=O)NCCC1(CN)CC1)c1ccc(N2CCOCC2)cc1 846330573 KNPQMRPAVSUGIW-OAHLLOKOSA-N 374.485 0.946 10 10 FCCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3cc4c(cc3O)OC[C@H]4O)C[C@@H]12 853570351 MVKWGINYCVGHIW-ZCDTZLGTSA-N 355.412 0.062 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@H](N)C(C)(C)C3)CC2)cc1 923431944 YYHDJTDMJMKNMX-HKUYNNGSSA-N 362.518 0.847 10 10 FCCE COc1ccc(N2CCN(C(=O)C[C@@]3(C)CCS(=O)(=O)N3)CC2)cc1 929249693 INHMLSHQJUMIRB-QGZVFWFLSA-N 367.471 0.816 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCNC(=O)C3CC3)C2)cc1 1118644502 OETQDNMKNRDQPD-AWEZNQCLSA-N 374.441 0.033 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3CC[C@@H]3C(N)=O)cc2)CC1 1303721273 VORTZPMFFJDWAH-JKSUJKDBSA-N 358.442 0.516 10 10 FCCE COC[C@@H]1C[C@@H](O)CN1C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1346357344 IJTCUOARDOAAEW-JKSUJKDBSA-N 361.442 0.293 10 10 FCCE C[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)[C@@H](C)O1 1353793680 JJPOEIVNDFVJIS-IIDMSEBBSA-N 374.485 0.737 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1532104456 CEGAYUISHKFQMG-ZDUSSCGKSA-N 355.460 0.672 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccnc(S(N)(=O)=O)c1 1640259904 IUIJHUDOMYKVET-UHFFFAOYSA-N 356.400 0.850 10 10 FCCE NC(=O)[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(CCOc2ccc(N)cc2)C1 2162939206 LRSMEZOOBUBZRW-JQWIXIFHSA-N 374.363 0.502 10 10 FCCE CN1CCN(C[C@@H](O)CNCc2ccc(N3CCOCC3)c(F)c2)CC1 818965534 BMLGLAYXKVCWFT-KRWDZBQOSA-N 366.481 0.360 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cnnn1C1CCNCC1 852794291 OANTUQFPQYBXLD-UHFFFAOYSA-N 370.457 0.969 10 10 FCCE O=C(NCc1ccc2cccnc2c1O)[C@@H]1C[C@H](O)CN1c1ccncn1 1162612801 QIYAIWPFCBFOAI-GJZGRUSLSA-N 365.393 0.986 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3CC[C@H]3C(N)=O)cc2)CC1 1303721272 VORTZPMFFJDWAH-HZPDHXFCSA-N 358.442 0.516 10 10 FCCE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCc1c(O)cccc1F 1303875583 KXUXNYMLMOJWPZ-UHFFFAOYSA-N 353.394 0.957 10 10 FCCE O=C(NC[C@@H]1C[C@H]2C=C[C@H]1CC2)C(=O)C(=O)C(=O)N[C@@H]1CCNC12CCC2 1329096014 VGFFZXRKZFOFBY-ZQDZILKHSA-N 373.453 0.244 10 10 FCCE COC(=O)c1cc(OCC(=O)N2CCC(C(N)=O)CC2)ccc1N(C)C 1473077573 ZZMGVBPXOILSOI-UHFFFAOYSA-N 363.414 0.642 10 10 FCCE CO[C@H]1COCC[C@H]1N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1644526480 MTWWDGDYJWYOTB-OCCSQVGLSA-N 358.416 0.640 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC(=O)c2cc(O)nc(O)c2)C[C@@H]1O 2116224597 LLGHTACCFOCUJS-JLLWLGSASA-N 367.402 0.887 10 10 FCCE CC(=O)N1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H](C)C1 288432856 DPLNRYFHRXJKKJ-HNNXBMFYSA-N 370.453 0.758 10 10 FCCE C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1cc(O)n2ncc(C(=O)O)c2n1 737567484 GOGCQOFMUSKDGG-DTWKUNHWSA-N 356.404 0.387 10 10 FCCE C[C@H](NC[C@H](O)CN1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 775258901 LYNURGUSCXCIBF-PXNSSMCTSA-N 362.518 0.782 10 10 FCCE CCN(OC)C(=O)CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 825728242 SBXOKNRZSBHKFN-UHFFFAOYSA-N 368.409 0.871 10 10 FCCE O=S(=O)(NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCCNC1 923659546 WWJHTPSETZITCF-KRWDZBQOSA-N 353.488 0.819 10 10 FCCE CO[C@@H]1C[C@H]1C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 924124058 MELHRFZEQOOYHF-CZUORRHYSA-N 366.389 0.857 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@]3(C)CCC(=O)N3)C2)cc1 1328507685 DNLMSNZILPBLMN-YJYMSZOUSA-N 374.441 0.175 10 10 FCCE COc1cc(N(C)C[C@H](O)CN2CCOCC2)c([N+](=O)[O-])cc1OC 1458226864 ALJJZDQJLNSXEX-LBPRGKRZSA-N 355.391 0.741 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H](O)CS(=O)(=O)c1cccs1 1466307700 USMAXPBHFNWCCB-LLVKDONJSA-N 371.436 0.653 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCCS(N)(=O)=O 1682333606 NNKZYAKDMBNOKY-UHFFFAOYSA-N 370.475 0.343 10 10 FCCE COc1ccc(N2CCN(C(=O)c3nn4c(=O)cc(C)nc4[nH]3)CC2)cc1 1873831497 PDXZTIDVLAOCKK-UHFFFAOYSA-N 368.397 0.697 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNC(=O)c1ccc(O)c(O)c1 2225625228 CZGFAEHKTROBNG-BPNCWPANSA-N 368.386 0.169 10 10 FCCE CCCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H](C)S(N)(=O)=O 802609788 KKTVGTWINULAQO-GFCCVEGCSA-N 371.459 0.314 10 10 FCCE C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 1351112607 MYEVDHISBSNSFL-HNNXBMFYSA-N 361.442 0.777 10 10 FCCE Cc1ccc(C(=O)N[C@H]2CCN(c3cc(=O)n(C)c(O)n3)C2)c(O)c1O 1639533205 PCONNQXLOQSKRW-JTQLQIEISA-N 360.370 0.214 10 10 FCCE C[C@@]1(C[C@@H]2CCCN2C(=O)c2c(F)ccc(O)c2O)NC(=O)NC1=O 1651014136 HJIKQZDBVDEXRI-PWJLMRLQSA-N 351.334 0.830 10 10 FCCE O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NCc1c(O)cccc1O 1652625758 LLIKGERRWHTBAO-UHFFFAOYSA-N 367.361 0.986 10 10 FCCE COC(=O)/C=C/c1ccc(N2C[C@H](O)C[C@H]2C(=O)OC)c([N+](=O)[O-])c1 1772938925 CYZWSANTZGZEGM-OZAOCKQISA-N 350.327 0.894 10 10 FCCE COc1ccc(N2CCN(C(=O)Cc3cnc4nc[nH]n4c3=O)CC2)cc1 1873831475 OFIBCKGHAULUOE-UHFFFAOYSA-N 368.397 0.318 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1CNCC(=O)N1 1952346476 MGSHGXRJILJDDQ-VXGBXAGGSA-N 351.403 0.622 10 10 FCCE CC(C)(C)OC(=O)NCCN(CCO)C(=O)COc1ccc(N)cc1 2044618673 DTLBYKWAUJYKDB-UHFFFAOYSA-N 353.419 0.993 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2cc(O)c(O)c(O)c2)[C@H](O)C1 2068565495 CVOYZLFVPUAUSJ-JOYOIKCWSA-N 354.359 0.513 10 10 FCCE O=C(O)[C@@H](NCc1ccc(Br)cc1O)C1CS(=O)(=O)C1 2197524285 ISKGNNMSGCALBR-NSHDSACASA-N 364.217 0.742 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@](O)(C(F)(F)F)C2)cc1 785432382 BHHCCJGOPSKART-HNNXBMFYSA-N 359.348 0.895 10 10 FCCE C[C@H](NC(=O)C(=O)NCc1ccnn1C)c1ccc(N2CCOCC2)cc1 788506521 NBHMCXPEBDKFBR-AWEZNQCLSA-N 371.441 0.750 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@@]3(OC)CCS(=O)(=O)C3)C2)cc1 892685535 SDUGHYGXESBGPJ-SUMWQHHRSA-N 368.455 0.594 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cccc[n+]3[O-])cc2)CC1 1634974239 KJXFLLVRHIYQJM-UHFFFAOYSA-N 354.410 0.952 10 10 FCCE O=C(NC1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1)[C@@H]1CCCO1 169869691 PPLDULLVPDWRLY-AWEZNQCLSA-N 350.371 0.703 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCN(CC(F)F)CC2)cc1F 285724444 NNDGUSWEZKATHD-UHFFFAOYSA-N 372.391 0.917 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CNCC[C@H]3C)CC2)cc1 842186698 JHFPLTHCAYMEDY-KDOFPFPSSA-N 374.485 0.894 10 10 FCCE CN(C)c1ccc(CN2C(=O)[C@@H]3C[C@H](N4C(=O)CNC4=O)CN3C2=O)cc1 924444265 GNWJKZSQLRXCCV-KBPBESRZSA-N 371.397 0.210 10 10 FCCE O=C(NCc1c(O)cccc1F)[C@H]1CC(=O)N(CCN2CCOCC2)C1 928710327 BHPORSDHBLAVIC-ZDUSSCGKSA-N 365.405 0.328 10 10 FCCE Cc1cc(C(=O)NCc2ccc(O)cc2O)nc2c1c(=O)n(C)c(=O)n2C 1299574337 PTNQZSXLECTOCC-UHFFFAOYSA-N 370.365 0.282 10 10 FCCE CNC(=O)N[C@H]1CCN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1471192425 YPBQHLXGKDOIKM-INIZCTEOSA-N 374.489 0.651 10 10 FCCE O=C(NCc1nnc2n1CCNC2=O)c1cc2cc(O)c(O)cc2s1 1589424792 XKDULHXQVNLDRG-UHFFFAOYSA-N 359.367 0.577 10 10 FCCE COc1cc(CNC(=O)Cc2ccc(O)c(O)c2)ccc1OCC(N)=O 1630265217 AYUVIWYYAUJJNP-UHFFFAOYSA-N 360.366 0.829 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCC1(N2CCOCC2)CCOCC1 1637597353 KBHDWMIJGNVBDM-UHFFFAOYSA-N 350.415 0.638 10 10 FCCE CS(=O)(=O)N[C@H]1CCCC[C@@H]1CNC(=O)Cc1ccc(O)c(O)c1 1640371605 ZLHMSIWGINXNMW-OLZOCXBDSA-N 356.444 0.865 10 10 FCCE COc1ccc(Br)c(CNCC2(O)CS(=O)(=O)C2)c1O 2283077132 VNZZWYVBAQIOFD-UHFFFAOYSA-N 366.233 0.412 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1CCC(=O)N(C)C1 287132126 UZYNDAWSTWQTGY-HNNXBMFYSA-N 360.458 0.838 10 10 FCCE Cc1ccc(C(=O)NC[C@@]2(CO)COCC3(CCC3)N2C)c(O)c1O 529749409 AJWMSMOIFNWNAL-GOSISDBHSA-N 350.415 0.752 10 10 FCCE CCN(Cc1cn(C)nn1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 782102167 JZNYHPILIZGGLQ-UHFFFAOYSA-N 353.404 0.555 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H](C)NC(=O)c1cc2c(C)nn(C)c2s1 808521210 KHKIVWPQVLPCOL-MRVPVSSYSA-N 351.384 0.763 10 10 FCCE NC(=O)CN1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)CC1=O 837625588 QWAFFRNCPWFCOS-UHFFFAOYSA-N 359.430 0.126 10 10 FCCE Cn1cnc(CCCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 843978420 NOKMJLLSPNNNGT-UHFFFAOYSA-N 353.404 0.255 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@]3(N)CC3(F)F)CC2)cc1 870886373 GOEVDZBQIQAVKZ-MRXNPFEDSA-N 354.401 0.670 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCN(C)C1=O 1119566925 JDUBGVXKQUHACX-STQMWFEESA-N 364.398 0.557 10 10 FCCE COC(=O)C[C@H]1C(=O)NCCN1C(=O)c1cc2cc(O)c(O)cc2s1 1136205454 AMXOOPFZMINSFE-VIFPVBQESA-N 364.379 0.816 10 10 FCCE COC(=O)[C@@]1(OC)CCN(C(=O)C(=O)N(C)Cc2ccccc2O)C1 1331572787 CZEAJEFLKWEOOD-QGZVFWFLSA-N 350.371 0.141 10 10 FCCE CN1CCN(CCOc2ccc(N)cc2)[C@@H](CNC(=O)C(F)(F)F)C1 2106761555 YFXNDMBUYNOCQF-ZDUSSCGKSA-N 360.380 0.942 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNC(=O)Cc1ccc(N)cc1 2333603900 OWJSZLQJKMFJBJ-FMKPAKJESA-N 365.430 0.269 10 10 FCCE [N-]=[N+]=N[C@H](COc1cccc(C(=O)NCCN)c1)OCCOCC(=O)O 201136331 MOFDILKXGCXADO-ZDUSSCGKSA-N 367.362 0.508 10 10 FCCE CC1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCNC3=O)cc2)CC1 828013640 GSSHRVYSUORVNP-INIZCTEOSA-N 358.442 0.544 10 10 FCCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@]12CNC[C@H]1COC2 846673875 XPXRBIBWAYFMHM-PXNSSMCTSA-N 359.470 0.748 10 10 FCCE CC(C)(O)[C@H](O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 901287377 NHDRAKIMPUFFJH-GOSISDBHSA-N 361.486 0.967 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCCN(C(=O)C2CC2)CC1 1118936445 NSZNTTXDNOEOIF-UHFFFAOYSA-N 357.410 0.705 10 10 FCCE NS(=O)(=O)c1nc(C(=O)NCc2c(O)cccc2F)n2ccccc12 1635366759 KUBYKTFVABMXEJ-UHFFFAOYSA-N 364.358 0.756 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2081034260 GBXAENVXUUQASV-FIQHERPVSA-N 355.395 0.629 10 10 FCCE COC(=O)Cn1cc(CCN(C)Cc2ccc(N3CCOCC3)cc2)nn1 126957386 OMVPROGSCCZALX-UHFFFAOYSA-N 373.457 0.962 10 10 FCCE CC(=O)C(=O)COC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1 808496069 YUOQHVWIKARFDU-UHFFFAOYSA-N 371.386 0.928 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@H]([C@H](C)O)C1 840981469 VFVUMKZHSAJBLX-BBRMVZONSA-N 350.415 0.739 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)c3nsnc3O)cc2)CC1 1154271285 NFQOPFJPCMWZHC-UHFFFAOYSA-N 361.427 0.842 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@]3(CNC(=O)C3)C2)cc1F 1327967061 AJVNNWQZKJQVHG-SFHVURJKSA-N 362.405 0.247 10 10 FCCE COC(=O)[C@@]1(N2CCN(Cc3cc(OC)ccc3O)CC2)CCOC1 1329068472 VKJNMGAMRHWGAR-GOSISDBHSA-N 350.415 0.851 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 255843501 JAYOJVPEFUTDOC-YVMONPNESA-N 370.409 0.589 10 10 FCCE COC[C@@]1(C)NC(=O)N(CN2CCN(c3ccc(OC)cc3)CC2)C1=O 733289223 GNMGOJGJNJHFAX-GOSISDBHSA-N 362.430 0.732 10 10 FCCE Cn1cc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)nn1 783012393 OPBNZSNZCPPAJT-UHFFFAOYSA-N 362.409 0.915 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1C[C@@H](O)CN1C(=O)c1ccc2c(c1)CCC2 808512265 PTEYBYKHYQNWFH-HZPDHXFCSA-N 359.378 0.452 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@H]1CC[C@@H](C)NC1)c1ccc(N2CCOCC2)cc1 861741856 AHQCAONSGPSRLM-VYDXJSESSA-N 374.485 0.957 10 10 FCCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1C[C@H]2COC[C@@H](C1)O2 1257177722 XBGMKMGUBFXJPY-CALCHBBNSA-N 359.426 0.529 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](OC)[C@H]1CCOC1 1261737487 PPNUVLQVGIUSDM-XEZPLFJOSA-N 367.398 0.740 10 10 FCCE CNC(=O)[C@H](C)NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1313305660 REJHJGJPBRLXEG-LBPRGKRZSA-N 361.446 0.322 10 10 FCCE CN1C[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCC1=O 285758898 QVANUXJYRUFHNP-OAHLLOKOSA-N 358.442 0.422 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CC[C@@H](NC(N)=O)C3)CC2)cc1 762926623 VUSOKIKIQOSLDL-CQSZACIVSA-N 361.446 0.086 10 10 FCCE CN(CC(=O)N1CCNCC1)C(=O)c1csc(Cc2ccc(N)cc2)n1 825611054 NCQFXCYXBRCAHL-UHFFFAOYSA-N 373.482 0.820 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CCCCN2CCO)c1 833558815 FYUSSRFBDJNREN-CYBMUJFWSA-N 371.459 0.340 10 10 FCCE Cn1c(=O)c2cc(C(=O)N3Cc4cccc(O)c4C3)n(C)c2n(C)c1=O 871201383 UZTPPYHRFCNKNP-UHFFFAOYSA-N 354.366 0.437 10 10 FCCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC3(C2)NC(=O)NC3=O)c1 1305461320 LWQJWDGPRITYOL-UHFFFAOYSA-N 366.377 0.941 10 10 FCCE CN(C)S(=O)(=O)NCC(=O)Nc1c(-c2ccccn2)nc2ccccn12 1570017540 OJJIPAUOITWXOV-UHFFFAOYSA-N 374.426 0.731 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(=O)n(C)cn1 1611050260 XMEWKHGQUWMCHL-LBPRGKRZSA-N 361.354 0.096 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H](C3OCCO3)C2)c1 1634995779 VHRQKRGQRGTTPG-JTQLQIEISA-N 356.400 0.599 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCCCN 2080868742 DZRKGWBDFWWPED-LBPRGKRZSA-N 353.419 0.999 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2C[C@@H]3COC[C@@H]3O2)cc1F 929801038 LZPSZEPEKINDIM-IOASZLSFSA-N 365.405 0.428 10 10 FCCE CCOC(=O)NCC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1178039500 WMFKJKNVZPIVRW-UHFFFAOYSA-N 362.430 0.751 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCC2(CN=[N+]=[N-])CC2)[C@@H](O)C1 1890527456 UDGSABIKIXKMTH-MEDUHNTESA-N 369.422 0.926 10 10 FCCE CCN(CC)CCNNC=C1C(=O)NC(=S)N(c2ccccc2)C1=O 2296925403 CAXSETKBNLTABX-UHFFFAOYSA-N 361.471 0.754 10 10 FCCE COc1ccc(N2CCN(C(=O)NC[C@H]3CN(C)CCO3)CC2)cc1F 124913744 QEYFVWFDDHQDJM-HNNXBMFYSA-N 366.437 0.997 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C[C@@H]4CN(C)C[C@@H]4C3)CC2)cc1 193611733 HWKBODUYAVRZIQ-CALCHBBNSA-N 358.486 0.837 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC(F)(F)C[C@@H]3CO)nc12 366660586 JQMNCVRTPFPGPR-SNVBAGLBSA-N 356.329 0.814 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)CS(=O)(=O)N(C)C)C2)cc1 819585870 JAVYOYYTTZYTJR-CYBMUJFWSA-N 355.460 0.529 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3ncc(OC)cn3)C2)cc1 850537310 PCTDEPHFOPTTDL-GFCCVEGCSA-N 371.397 0.827 10 10 FCCE CCn1cc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)nn1 1330665471 DLEBHGBFCRJPSJ-CYBMUJFWSA-N 372.429 0.318 10 10 FCCE CN(C)S(=O)(=O)c1cc(C(=O)NCc2ccc(O)cc2O)n(C)c1 1557084766 NQPOGGCKQIEZFF-UHFFFAOYSA-N 353.400 0.617 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2081037003 VKCGAKBRQJXPTA-RHYQMDGZSA-N 355.395 0.629 10 10 FCCE CN1C[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)NC1=O 829262956 HORAQHZTLWAYIN-CQSZACIVSA-N 350.394 0.427 10 10 FCCE C[C@H]1C(=O)N(C)CN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 830778204 NZGBKFARMZAGMC-ZDUSSCGKSA-N 364.421 0.399 10 10 FCCE CN1NN=C2C1=NCC[C@H]2C(=O)NCc1cccc(Br)c1O 834476216 RMTPQCIQMNOHNF-SECBINFHSA-N 366.219 0.995 10 10 FCCE Nc1ccc(CCNC(=O)N[C@H]2CCN(c3ccc4nncn4n3)C2)cc1 861640659 NQOPOGIPJKLXQK-HNNXBMFYSA-N 366.429 0.827 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3nc(C)no3)C2)cc1 1118606175 KECBWSHODQKRFY-AAEUAGOBSA-N 373.413 0.959 10 10 FCCE COC(=O)C1(NC(=O)c2cccc(O)c2O)CN(C(=O)OC(C)(C)C)C1 2118180882 KOKWLTPJJZFORX-UHFFFAOYSA-N 366.370 0.990 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@@H]1C(=O)NCc1ccccc1O 2127618664 CHYVIMHGATZSRZ-ZNMIVQPWSA-N 366.414 0.740 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)[C@@H]3CNC(=O)C3)CC2)cc1 122012074 IBAKEEHNVUJUCM-HNNXBMFYSA-N 360.458 0.460 10 10 FCCE C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 769709609 OOUGIOQEAOSKMY-NXEZZACHSA-N 355.416 0.490 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](C(=O)NC)C2)cc1 817707093 UNJQCBWLWWVIQQ-OAHLLOKOSA-N 360.458 0.744 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@H]3CCCNC3)C2)cc1 851687907 KVZMBXLUZJMBRD-CABCVRRESA-N 360.458 0.506 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@@H]1CN(C2CC2)C(=O)O1 1118390860 ZARHHUXBLBEIPB-MRXNPFEDSA-N 374.441 0.810 10 10 FCCE CCN1C(=O)CO[C@H](C(=O)NCc2c(O)cccc2O)[C@H]1c1nccn1C 1156885819 PAOYKVFAHOWXND-HOTGVXAUSA-N 374.397 0.436 10 10 FCCE CCOC(=O)[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CCO1 1332553119 CSQSOWLCZFSGNP-HNNXBMFYSA-N 363.414 0.159 10 10 FCCE Cc1cc(CC(=O)N2C[C@@H](C(N)=O)[C@@H](C(N)=O)C2)c(C)n1-c1ccccc1 1634099302 CBQBLOQCDWPBFC-CALCHBBNSA-N 368.437 0.682 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1COC[C@@H]1NC(=O)c1cc(O)c(O)c(O)c1 2068618618 SCCDLEFNTDOPCF-UWVGGRQHSA-N 354.359 0.825 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC(=O)c2cc(O)nc(O)c2)C[C@H]1O 2116224600 LLGHTACCFOCUJS-YUSALJHKSA-N 367.402 0.887 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)C3CCOCC3)CC2)cc1 242807637 FHOXVBQTXXERJY-UHFFFAOYSA-N 361.442 0.887 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@@]2(C1)NC(=O)NC2=O 279032796 ICEGLTNOBNUGPA-IBGZPJMESA-N 373.457 0.385 10 10 FCCE Cc1ccc2c(n1)OCCN2C(=O)C1=CC=CN2CCS(=O)(=O)N=C12 367630869 GTGYPGMDCBXGBZ-UHFFFAOYSA-N 360.395 0.613 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCSC[C@H]2CCO)cc1F 803663401 YHLTUTQHQFDYLJ-CYBMUJFWSA-N 369.462 0.834 10 10 FCCE C[C@H](O)[C@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CCO1 817822407 DVNVDIZLWFOHRH-WDEREUQCSA-N 359.473 0.350 10 10 FCCE COC(=O)[C@@H]1C[C@H](N2C(=O)CNC2=O)CN1Cc1cc(Cl)ccc1O 857058205 OFMMILYQUOTZAP-RYUDHWBXSA-N 367.789 0.713 10 10 FCCE CO[C@@H]1COCC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 897580201 QCQHZVLHKISYSW-HZPDHXFCSA-N 367.421 0.770 10 10 FCCE Cc1nn(CCS(=O)(=O)N(C)Cc2ccc(N(C)C)cc2)c(=O)o1 913860912 UEZYLGHNNIVHTE-UHFFFAOYSA-N 354.432 0.673 10 10 FCCE COC(=O)c1cc(OCC(=O)N2CCCC[C@H]2C(N)=O)ccc1N(C)C 1166714768 ZGLBUXJNMALXQN-HNNXBMFYSA-N 363.414 0.784 10 10 FCCE C[C@H](NC(=O)NCc1nnc2n1CCNC2=O)c1ccc(N(C)C)cc1 1671851883 LXQSDYYDESXXGI-NSHDSACASA-N 357.418 0.648 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2081034262 GBXAENVXUUQASV-NNYUYHANSA-N 355.395 0.629 10 10 FCCE CC(C)(C)OC(=O)N1CCN[C@@H](CNC(=O)Cc2ccc(O)c(O)c2)C1 2140606929 MKWWQDWCGXPFQW-ZDUSSCGKSA-N 365.430 0.965 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2218736572 ABZKFFOSWSEDPH-NGDQXYMTSA-N 355.395 0.675 10 10 FCCE Cc1cn2c(n1)CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)CC2 371728387 QZPBSUXTQGNKAM-UHFFFAOYSA-N 350.400 0.925 10 10 FCCE CN(CCCO)C(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 789855495 SLTDXNDUQUMTTA-UHFFFAOYSA-N 351.472 0.697 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCN(C)[C@@H](C)C3)C2)cc1 828144107 SIONJHOSIIMMBH-JYJNAYRXSA-N 374.485 0.989 10 10 FCCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N[C@H]1CCNC1=O 852409530 RRTORMGACKARFY-SFHVURJKSA-N 371.485 0.906 10 10 FCCE CCN1C[C@@H](S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)CC1=O 866757095 JCBCVVUSQFNNLI-GJZGRUSLSA-N 354.476 0.293 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCCOC2CCOCC2)cc1F 929801195 NOKXUVDIZSEXET-UHFFFAOYSA-N 367.421 0.820 10 10 FCCE Cc1noc(CCNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 1340544367 LYEJKRVXJOYEMU-UHFFFAOYSA-N 373.413 0.190 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)NC[C@H]3C[C@H](O)C3)cc2)CC1 1638485357 WREHRJYTBYFZDL-CZIWCDLHSA-N 360.458 0.958 10 10 FCCE CC(=O)NCCc1c(C=C2C(=O)NC(=O)N(C)C2=O)[nH]c2ccccc12 2297638885 CIELECFUFDHMTQ-UHFFFAOYSA-N 354.366 0.938 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCNC34CCC4)C2)cc1 861794483 RYHHUFZDQLRLSZ-WMLDXEAASA-N 372.469 0.791 10 10 FCCE C[C@H](NC(=O)[C@@H](C)NS(=O)(=O)c1cnn(C)c1)c1ccccc1O 1171729348 AEEMNHOPDXGPMY-WDEREUQCSA-N 352.416 0.670 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2064132163 IECWPJKZVBUYOE-KXNHARMFSA-N 355.395 0.629 10 10 FCCE CC(C)(C)OC(=O)NCCN(CCO)c1cc2c(cc1N)OCC(=O)N2 2106808596 VRAJLVLICMEQCY-UHFFFAOYSA-N 366.418 0.923 10 10 FCCE COc1ccc(N2CCN(C(=O)N[C@H]3CCS(=O)(=O)C3)CC2)cc1 53507350 FREWGKBBJBQLQZ-ZDUSSCGKSA-N 353.444 0.714 10 10 FCCE CCNS(=O)(=O)[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 364924173 OTRAHYDEWQAYIG-SECBINFHSA-N 370.387 0.444 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CC[C@H]4CN(C)C[C@H]43)CC2)cc1 794931198 ZQWMNZLYKXFHAV-QFBILLFUSA-N 358.486 0.980 10 10 FCCE Cn1cc(/C=C/C(=O)N2CC[C@H](C(=O)O)c3ccccc32)c(=O)n(C)c1=O 841773222 GHGAROOPMWYGIO-NPQIQWPPSA-N 369.377 0.702 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H](Cn2ccnn2)C1 850602206 QQYFOPFVMZDCIQ-MRXNPFEDSA-N 370.457 0.851 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC(NS(C)(=O)=O)C2)c([N+](=O)[O-])c1 858725941 SAEAANVKINVERW-GQCTYLIASA-N 355.372 0.519 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C1CN([C@H]2CCOC2)C1 898982784 HXFFOJUEPZJUJR-SFHVURJKSA-N 359.470 0.985 10 10 FCCE COc1ccc(N2CCN(C(=O)C3=C(C)N(C)c4nnnn4C3)CC2)cc1 1150068482 CSGLTXZAXCHFCN-UHFFFAOYSA-N 369.429 0.754 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CCN2C(=O)OCC[C@@H]2C1)c1ccc(N(C)C)cc1 1323502637 WEAGYOZHBZIAPX-CZUORRHYSA-N 374.441 0.983 10 10 FCCE CN1CCC2(CC1)CN(C(=O)C(=O)N(C)Cc1ccccc1O)CCO2 1349335856 JAWQTVLQWPIHJT-UHFFFAOYSA-N 361.442 0.674 10 10 FCCE CC(=O)O[C@@H]1[C@@H](OCCN=[N+]=[N-])O[C@@H](C)[C@@H](OC(C)=O)[C@H]1OC(C)=O 1616083706 SWFHDHBVUMLTMW-GSFXOHHKSA-N 359.335 0.853 10 10 FCCE CN(C[C@H]1CCCO1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 283851253 CSNQFYGPOUYILM-QGZVFWFLSA-N 361.442 0.777 10 10 FCCE COc1cc(N2CCN(C(=O)[C@H]3COC(=O)N3)CC2)cc(OC)c1OC 295948254 IKZONWHORWRSQH-GFCCVEGCSA-N 365.386 0.469 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCc3nc[nH]c3C2)c1 378307877 MKJQYXRQXNDOCL-VIFPVBQESA-N 350.400 0.774 10 10 FCCE CN(C)C(=O)CN1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761873124 IXABIYZAXGTBRE-UHFFFAOYSA-N 363.374 0.136 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@H](C(=O)C4CC4)C3)nc12 775927530 KZCPTVSXIWRLNZ-AWEZNQCLSA-N 374.397 0.792 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)CN2C(=O)NC(=O)C2(C)C)cc1 846446483 MNNPNKMFMTWCRH-UHFFFAOYSA-N 362.430 0.920 10 10 FCCE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCCc1ccc(O)c(O)c1 860235330 RNYOHTBLXHUHLM-UHFFFAOYSA-N 365.430 0.566 10 10 FCCE CN1CCN(c2ccc(CNC[C@@]3(CO)COCCN3C)cc2F)CC1 1119614529 CMNBBWMIXYASPW-LJQANCHMSA-N 366.481 0.360 10 10 FCCE CN(C)S(=O)(=O)c1ccc(C(=O)NCc2cccc(O)c2O)cn1 1153798694 WLTCNRMAPJRAGJ-UHFFFAOYSA-N 351.384 0.673 10 10 FCCE C[C@H](NC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O)c1ccccc1O 1302532638 MGCIZKOMIBVFQD-JTQLQIEISA-N 357.370 0.017 10 10 FCCE COC[C@@H]1C[C@@H](O)CN1C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1346358211 QCBDMNJEASLYEG-QWHCGFSZSA-N 353.394 0.116 10 10 FCCE COC(=O)c1cn([C@H]2CCCN(C(=O)Cc3ccc(O)c(O)c3)C2)nn1 1611030338 OAEUWJSKMCPPEV-LBPRGKRZSA-N 360.370 0.882 10 10 FCCE CCc1nn(C)c2c1[C@H](c1ccc(O)c(O)c1)C(C(=O)NCCO)=C(N)O2 1864019347 JDYLXTAVGCIYEF-ZDUSSCGKSA-N 374.397 0.197 10 10 FCCE CC(C)COC(=O)C[C@H]1C(=O)NCCN1C=C1C(=O)OC(C)(C)OC1=O 10213650 RTFYQKOJSKCNEG-LBPRGKRZSA-N 368.386 0.096 10 10 FCCE Cc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(N(C)C)nn1 850434661 ZXDUOSBRJHIRFW-JTQLQIEISA-N 373.413 0.948 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)c2cncs2)c1 1155093314 ZYLHTVUZQLFCQR-NSHDSACASA-N 357.413 0.684 10 10 FCCE NS(=O)(=O)CCCNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1252408761 JPEMSROZOWOACD-AWEZNQCLSA-N 371.459 0.761 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)NCCCc3ncn(C)n3)ccc21 1261465987 ABDDYEGKQFKRNZ-UHFFFAOYSA-N 370.457 0.563 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@@H]3CC(N)=O)nc12 726969499 WTJBSZMBDSZFDY-GFCCVEGCSA-N 361.402 0.842 10 10 FCCE COc1ccc(N2CCN(C(=O)CCNC(=O)[C@H]3CCCN3)CC2)cc1 825727298 BZELJUIMGZSGKH-QGZVFWFLSA-N 360.458 0.602 10 10 FCCE CO[C@]1(CNCc2ccc(N3CCOCC3)cc2)CCS(=O)(=O)C1 922615965 PVOXYOTYVLULRN-KRWDZBQOSA-N 354.472 0.817 10 10 FCCE NS(=O)(=O)c1cnn(CCC(=O)NCc2cc(Cl)ccc2O)c1 1165498589 OUEFIDIRYFTQCB-UHFFFAOYSA-N 358.807 0.596 10 10 FCCE CCNC(=O)CNC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1251103781 HROOAIXDBAYZDR-UHFFFAOYSA-N 361.446 0.324 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(CO[C@@H]2CCNC2)CC1 1330567907 NVRNWEQLNJICTJ-MRXNPFEDSA-N 373.453 0.852 10 10 FCCE CN1CCCc2cc(CNC(=O)N3CCS(=O)(=O)CCO3)ccc21 1348506591 NBVXSSPXUNHFCP-UHFFFAOYSA-N 353.444 0.941 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)CSCC(=O)O)cc2)CC1 842690825 CAJJKZJAKVCLGU-UHFFFAOYSA-N 365.455 0.789 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)CC(F)(F)CN)CC2)cc1 846673929 HIHKYKKWAIPWEI-UHFFFAOYSA-N 356.417 0.918 10 10 FCCE CN1CC[C@](C)(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1=O 924252682 MFOWMCSKZRFXKF-HXUWFJFHSA-N 372.469 0.873 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCC(=O)N3CCOCC3)C2)cc1 852242935 WNBGBMDEQUAMFF-AWEZNQCLSA-N 362.430 0.432 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](O)c3cnc[nH]3)CC2)cc1 865034315 PZXQPRWBXQWQRS-KRWDZBQOSA-N 359.430 0.390 10 10 FCCE CCN1CC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 898129183 PVPJHEMBHPFHSP-QGZVFWFLSA-N 374.485 0.474 10 10 FCCE C[C@@H](NC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1O 1648887545 WAQWVTIUDCITPS-SNVBAGLBSA-N 357.370 0.017 10 10 FCCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC(O)(CO)C2)C1 615433656 JBXAEMVGSIQKMN-UHFFFAOYSA-N 357.454 0.973 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N[C@H]1CCC(=O)N(C)C1 817822321 LVXPRCYHXOFOEL-HOCLYGCPSA-N 374.485 0.845 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCc3ccnn3C)C2)cc1 828848349 QLSNRPOEUCNBSW-CQSZACIVSA-N 371.441 0.483 10 10 FCCE COc1ccc(N2CCC(NC(=O)C3(OC)CS(=O)(=O)C3)CC2)cc1 931577398 TWJYKUVPQLKBLR-UHFFFAOYSA-N 368.455 0.594 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)Cn3nccc3N)CC2)cc1 1136454972 QKGVPPSOEPWWKQ-UHFFFAOYSA-N 358.446 0.412 10 10 FCCE CC(=O)NC[C@@H]1CCn2ncc(C(=O)NCc3c(O)cccc3O)c2C1 1178912814 XSCHLXNGVRECJO-GFCCVEGCSA-N 358.398 0.923 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NCC1(CO)COC1 1229780155 DSAULLGPAVKKCB-UHFFFAOYSA-N 371.384 0.610 10 10 FCCE CCC(N)(CC)CNC(=O)C(=O)C(=O)C(=O)NC[C@H]1C[C@H]2C=C[C@H]1CC2 1348851636 FBOZTPVCHWPROX-MELADBBJSA-N 363.458 0.477 10 10 FCCE O=C(NCc1ccc(O)cc1O)[C@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1630306868 PDPSIBGBKQCBHR-UWVGGRQHSA-N 353.318 0.937 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC[C@@H](C(N)=O)C1 1632356738 UIMPCNDKHDUTLR-AGIUHOORSA-N 364.398 0.590 10 10 FCCE Cn1c(=O)c2cc(C(=O)NCc3cccc(O)c3O)sc2n(C)c1=O 1633515741 OAGHIGNWXNYJPS-UHFFFAOYSA-N 361.379 0.640 10 10 FCCE CCS(=O)(=O)NCCn1c(C)nnc1N(C)Cc1ccccc1O 1768290400 AVVOHUCROCZANM-UHFFFAOYSA-N 353.448 0.868 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNC(=O)Cc1ccc(N)cc1 2333603901 OWJSZLQJKMFJBJ-LZWOXQAQSA-N 365.430 0.269 10 10 FCCE CCOC(=O)N1CCN(C(=O)C(=O)N(C(C)=O)c2ccc(N)cc2)CC1 170319132 UGWZNABJRDBPRM-UHFFFAOYSA-N 362.386 0.449 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)Cn1cnc2c(cnn2C)c1=O 173195221 SUJDULKEXAGJAD-UHFFFAOYSA-N 368.397 0.622 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC[C@]3(C2)NC(=O)NC3=O)cc1 279024993 HFCKBOHLQWDUEN-GOSISDBHSA-N 359.430 0.043 10 10 FCCE COC(=O)N(C)CCN(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1 826705770 ATZWITNRPZAFGI-UHFFFAOYSA-N 350.419 0.525 10 10 FCCE C[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)cc2)CCN1S(C)(=O)=O 827271607 SIRIHHYJAZRBEG-MRXNPFEDSA-N 366.531 0.904 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)[C@@H](OC)C(=O)O)CC2)cc1 901976800 VRUGSQSCQZHZGO-MRXNPFEDSA-N 365.430 0.423 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@]12COCC[C@@H]1CN(C(=O)OC(C)(C)C)C2 910126851 LZCGWCSWPZITOX-PXAZEXFGSA-N 355.387 0.961 10 10 FCCE COC(OC)C(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 930952840 HYXZLULBBVGMGS-UHFFFAOYSA-N 363.458 0.786 10 10 FCCE NS(=O)(=O)CCCNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1252408762 JPEMSROZOWOACD-CQSZACIVSA-N 371.459 0.761 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1C[C@H](O)CC(F)(F)C1 1322813246 BJLLNEQFMZTKPR-SECBINFHSA-N 365.427 0.970 10 10 FCCE CN(CCCNC(=O)C1CCC1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1332015229 YWFCFRLMLNOOJU-UHFFFAOYSA-N 359.426 0.999 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cn(C)nc1C 1466674302 PLIOKCUHFGERPC-AWEZNQCLSA-N 361.398 0.973 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@H](C3OCCO3)C2)c1 1634995780 VHRQKRGQRGTTPG-SNVBAGLBSA-N 356.400 0.599 10 10 FCCE Cn1cc([C@@H](NCCCN=[N+]=[N-])C(N)=O)c(I)n1 1912148261 RGFYWFYGWOEZDG-SSDOTTSWSA-N 363.163 0.841 10 10 FCCE CN(C[C@H](O)CNC(=O)OC(C)(C)C)S(=O)(=O)Cc1ccc(N)cc1 2044648041 JOLHLSUBGHQDAV-CQSZACIVSA-N 373.475 0.916 10 10 FCCE CCCNS(=O)(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCOCC1 62370935 PWXLOCRGMYDTPE-QGZVFWFLSA-N 370.519 0.960 10 10 FCCE O=C1NC(=O)[C@@H]2[C@@H]1[C@@H](c1ccccc1O)N[C@@]2(Cc1ccccc1)C(=O)O 247433229 VCMNEVBKUKRYCY-UIVXKWKOSA-N 366.373 0.991 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@]3(C)CCC(=O)NC3)CC2)cc1 281597053 LXUMVAJVDDEYDX-FQEVSTJZSA-N 374.485 0.850 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 808500653 USWZURNJTAESEQ-VIFPVBQESA-N 352.274 0.788 10 10 FCCE COCCn1nnc2c1CCN(c1cc3c(cc1[N+](=O)[O-])OCC(=O)N3)C2 814375418 GAKQWKCKVMUAAG-UHFFFAOYSA-N 374.357 0.726 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCC34COC4)CC2)cc1 854837676 OEGYQHLLEBIOQJ-VOTSOKGWSA-N 371.437 0.901 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CCCN3C(=O)CNC3=O)C2)cc1 855229481 NXQYRICTQJBHOT-CYBMUJFWSA-N 360.414 0.722 10 10 FCCE CC(C)(CNC(=O)C(=O)NCCc1ccc(N)cc1)C(=O)N1CCCC1 861777603 VMMXFCJHGVSOFU-UHFFFAOYSA-N 360.458 0.692 10 10 FCCE C[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)n1cncn1 1133847335 LSBYUAZCAJHELO-ZDUSSCGKSA-N 356.430 0.857 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CC[C@H](O)[C@H](O)CC2)c1 1303830061 QORDGKCAKYBLCI-KFKUMKOWSA-N 358.416 0.158 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1526967343 GZIGCVSWVNVFRB-CQSZACIVSA-N 369.487 0.982 10 10 FCCE O=C(C[C@@H]1COC(=O)C1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1617143264 QBVKAYHWXWYDKR-AWEZNQCLSA-N 366.439 0.491 10 10 FCCE Cc1ccc(CN(C)C(=O)CNS(C)(=O)=O)c(O)c1Br 2380776027 JLJMXBRWCJPLPQ-UHFFFAOYSA-N 365.249 0.971 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@@]3(C)C(N)=O)nc12 371830503 ZTYWESGTLDCLBH-KRWDZBQOSA-N 361.402 0.842 10 10 FCCE NC(=O)Cn1cc(C(=O)NCc2cc(Br)ccc2O)nn1 804739768 RUBLTGIKGGJKJN-UHFFFAOYSA-N 354.164 0.162 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1CCN=C2C1=NNN2C 854987428 CYWMLZVZZMAOAC-CYBMUJFWSA-N 373.413 0.508 10 10 FCCE COc1cccc(CNC(=O)[C@H](CC(N)=O)NC(=O)CC(C)C)c1O 1566374219 YYCVEIIPJZNFIP-LBPRGKRZSA-N 351.403 0.423 10 10 FCCE NC(=O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1625442383 XZRPLMBQQISZGX-UHFFFAOYSA-N 358.377 0.044 10 10 FCCE Cn1c(O)nc(N2CC[C@H](NC(=O)/C=C\c3ccc(O)c(O)c3)C2)cc1=O 1652826924 DVOQABUDKMWDOZ-FHMRSRPSSA-N 372.381 0.305 10 10 FCCE C[C@@H]1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)[C@H]1CO 249008336 ZTPLFURKWOMDGD-KDOFPFPSSA-N 365.449 0.981 10 10 FCCE Cn1c(O)ncc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1=O 267602412 NDGYSKKVDHLDCM-UHFFFAOYSA-N 372.425 0.625 10 10 FCCE NCCCNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 842130547 APZFCRNDGVFXDP-UHFFFAOYSA-N 373.501 0.300 10 10 FCCE CCO[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C[C@H]1CN 846333014 XDLQMQNEDZUVGW-CZUORRHYSA-N 366.437 0.330 10 10 FCCE O=S1(=O)C[C@@H]2[C@H](C1)NCCN2Cc1ccc(N2CCOCC2)cc1 923523654 HOLXLDRYDCGFFX-DLBZAZTESA-N 351.472 0.094 10 10 FCCE CC[S@](=O)c1ccccc1C(=O)N1CCS(=O)(=O)[C@H]2COCC[C@@H]21 1638771167 ADCJTSZKAKNXHZ-HMFCALDFSA-N 371.480 0.842 10 10 FCCE CC(=O)NC[C@@H]1CCn2ncc(C(=O)NCc3cc(O)ccc3O)c2C1 1644753537 COXMACMNXGXNSJ-GFCCVEGCSA-N 358.398 0.923 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NCc3nc(N)n[nH]3)CC2)cc1 1683464850 ONAWKRSOSJJOHI-UHFFFAOYSA-N 374.449 0.017 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCC[C@@H]3C(=O)N(C)C)CC2)cc1 105357103 SBMPWKMXPHKYPK-GOSISDBHSA-N 374.485 0.896 10 10 FCCE CCN(CC)S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 264865446 PMDITHQJDSAKAH-UHFFFAOYSA-N 365.433 0.755 10 10 FCCE C=CC(=O)NCCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 773281296 BYNDHUMKQRWNFJ-UHFFFAOYSA-N 365.455 0.230 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)[C@H]3CCN=C4C3=NNN4C)C2)cc1 854981672 YOYQIIRVZPXQSO-BBRMVZONSA-N 370.457 0.862 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CC[C@]2(CNC(=O)C2)C1)c1ccc(N(C)C)cc1 1342713187 JUKHKMUJVHYRSG-YJYMSZOUSA-N 358.442 0.668 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N3C[C@H]4C[C@H]3C(=O)O4)cc2)CC1 1565362986 FIAWNKDODDOBFC-CVEARBPZSA-N 372.425 0.598 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC[C@H]3OCC(=O)N[C@@H]3C2)c([N+](=O)[O-])c1 373766604 NVQDBEMWFMSBJX-BYSCNOHMSA-N 361.354 0.875 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCC3(C)C)CC2)cc1 803749221 FSWPDMKUAAGYGA-UHFFFAOYSA-N 374.485 0.944 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC(C)(C)O[C@@H]3COC[C@H]32)cc1 846720402 BVZXFSMRBBYZMH-HZPDHXFCSA-N 361.442 0.774 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@H](S(N)(=O)=O)C3)C2)cc1 852451165 FHLDVFUODFYPJR-IUODEOHRSA-N 368.459 0.346 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N[C@@]12COC[C@@H]1C2 889341588 XXFHAQMCAAIMJU-YOEHRIQHSA-N 365.455 0.510 10 10 FCCE CCO[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)CN(C)C 929800695 IXQWLRWXGUKILA-CQSZACIVSA-N 368.453 0.591 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCC(=O)N1C 1138054511 AUONAUBPELROKS-STQMWFEESA-N 364.398 0.699 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@@]23COCCN2C(=O)OC3)c1 1254433217 ROGBGDSPRAULFI-DIFFPNOSSA-N 365.386 0.982 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1=C2CCCN=C2NN1 1556102363 BPZQTTKOEOWFQE-LBPRGKRZSA-N 374.397 0.242 10 10 FCCE O=C(C[C@@H]1NC(=O)NC1=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1556946416 IUPUBZFTNVXKIY-LBPRGKRZSA-N 368.340 0.016 10 10 FCCE CC(=O)N1CCCN(C[C@@H]2OC[C@H](NCc3ccccc3O)[C@@H]2O)CC1 1615259192 DOMNJAYCCSHOQJ-WDSOQIARSA-N 363.458 0.164 10 10 FCCE CC(C)(C)OC(=O)N1CC(C(=O)N2CC(N=[N+]=[N-])C2)(S(C)(=O)=O)C1 2306880449 DIOHALBGORREME-UHFFFAOYSA-N 359.408 0.542 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2311714712 GBXAENVXUUQASV-WHOHXGKFSA-N 355.395 0.629 10 10 FCCE CC(=O)NCCC(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCOCC1 41310357 OWQKIBFGSVVAPH-GOSISDBHSA-N 362.474 0.768 10 10 FCCE CS(=O)(=O)N[C@H]1CCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 93531094 GDPYDQLPBVUHGM-AWEZNQCLSA-N 357.451 0.786 10 10 FCCE CC[C@@H](NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)C(N)=O 297104490 GDPHUOFMCGVHLJ-MRXNPFEDSA-N 363.462 0.380 10 10 FCCE COc1ccc(O)c(CNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)c1 734072630 KVKGQXIDQGOLOL-UHFFFAOYSA-N 371.349 0.987 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3CCC(N)CC3)CC2)cc1 841749337 CPYSXJFDRWPTGK-UHFFFAOYSA-N 361.490 0.950 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)c2c[nH]nc2S(N)(=O)=O)cc1 1164597875 VPSCCHNNALJTOX-UHFFFAOYSA-N 367.431 0.274 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NCC[C@H]1CNC(=O)C1 1262289441 DDTKVDRKDTWSEG-LSDHHAIUSA-N 374.485 0.751 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@@]2(CO)COC[C@@H]3CCCN32)cc1 1346231210 XEFIGOGWPRJWKY-PKOBYXMFSA-N 362.474 0.778 10 10 FCCE CC(C)NC(=O)CNS(=O)(=O)CCC(=O)N[C@@H](C)c1ccccc1O 1454819242 PTMHMFXGXXSFII-LBPRGKRZSA-N 371.459 0.404 10 10 FCCE COc1ccc(N2CCN(C(=O)NC[C@@H]3CNC(=O)C3)CC2)cc1F 1478817625 AKISOQXJDHZGTD-LBPRGKRZSA-N 350.394 0.802 10 10 FCCE COc1cccc(CNC(=O)[C@H](CO)NC(=O)c2ccc(F)cc2)c1O 1595799761 HIUHANBURBRSDR-AWEZNQCLSA-N 362.357 0.947 10 10 FCCE COc1cc(N2CCN(c3cc(C(N)=O)ncn3)CC2)cc(OC)c1OC 1651726080 JJQJBFUTJPTGGB-UHFFFAOYSA-N 373.413 0.928 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@H]3CCNC3=O)cc2)CC1 1687171326 FQLKHYLQQNAFOX-HNNXBMFYSA-N 359.430 0.076 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(CC(F)F)CC2)c1 299427574 MGLVCNMUWFRWLX-UHFFFAOYSA-N 363.386 0.787 10 10 FCCE CCN1C(=O)[C@H]2CN(C(=O)NCc3ccc(N(C)C)cc3)CCN2C1=O 757582830 GZLNTCCXDNGZPB-OAHLLOKOSA-N 359.430 0.931 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCCC[C@@H]2[C@@H]2CNC(=O)C2)cc1 785423924 IRJMUVGSCVFGNQ-DOTOQJQBSA-N 372.469 0.886 10 10 FCCE CCOC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)/C=C/c1ccc(O)c(O)c1 787663377 UORFEBHQPWCFOI-SIPGATMPSA-N 350.371 0.684 10 10 FCCE CN1C(=O)CO[C@H](C(=O)NCCc2ccc(O)c(O)c2)[C@H]1c1cccnc1 830531271 GZCCWMRQZMLDJJ-MSOLQXFVSA-N 371.393 0.750 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCN2[C@@H](CNS2(=O)=O)C1 919081250 IZEGNYKAPSPCSN-HNNXBMFYSA-N 367.475 0.105 10 10 FCCE CC(C)[C@H](NC=O)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1598009258 LUSSBGBKUSEZSK-KRWDZBQOSA-N 360.458 0.775 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1 825602443 KFWZPLIPPLRWEF-QGZVFWFLSA-N 367.471 0.852 10 10 FCCE CCS(=O)(=O)CCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1451453573 LXPBOLXDPMATFF-UHFFFAOYSA-N 364.445 0.318 10 10 FCCE COC(=O)C[C@@H]1CS(=O)(=O)CCN1C(=O)/C=C\c1ccc(O)c(O)c1 1454615947 IKOKMEGAPLNWSV-KTLBGCOUSA-N 369.395 0.300 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)N(C)CCS(N)(=O)=O)C2)cc1 1683340085 OWJIWBIKPIJMTR-CYBMUJFWSA-N 370.475 0.451 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNCc1cccc(F)c1O 2218612040 CSXLPLNAUZGRLA-YDHLFZDLSA-N 356.394 0.962 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H](c3nc(=O)[nH][nH]3)C2)cc1 289508722 UWCIKINFYTZXBG-CQSZACIVSA-N 358.446 0.660 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN(C)CC3(CO)CC3)CC2)cc1 782598926 FLICYEDCSXMMBW-GOSISDBHSA-N 363.502 0.882 10 10 FCCE C[C@H](NC(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1nnc(O)n1C 924009026 VFCLRPDKMUIFIQ-ZDUSSCGKSA-N 373.461 0.833 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCC[C@H]3C)CC2)cc1 1257544570 HIXHVZRUUWZKAN-MRXNPFEDSA-N 374.485 0.944 10 10 FCCE CO[C@H]1C[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1338797059 UIBZZXHEGAPCSP-MAEOIBBWSA-N 374.485 0.596 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](O)c3cnn(C)c3)CC2)cc1 1464540295 JHQMHGSIEVLIMT-SFHVURJKSA-N 373.457 0.401 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1C[C@H](O)C[C@H]1CO 1470448910 DIRSEOYWYLNTJD-QWHCGFSZSA-N 371.384 0.439 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2cnc3n2CCOC3)c1 1472284419 QMHXOJNTGNHZPD-UHFFFAOYSA-N 366.399 0.420 10 10 FCCE O=C(C[C@@H]1NC(=O)c2ccccc2NC1=O)NCc1ccc(O)c(O)c1 1635959583 KWKFWPJGHDFNAT-ZDUSSCGKSA-N 355.350 0.855 10 10 FCCE Cc1ccc(CNS(=O)(=O)N2CCNCC2)c(O)c1Br 2381134235 ZOIKGCAFFGTEFO-UHFFFAOYSA-N 364.265 0.703 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)CC(=O)N(C)C)CC2)cc1 174454642 SQHPWIQSAZBYED-UHFFFAOYSA-N 362.474 0.802 10 10 FCCE COc1ccc(O)c(CNC(=O)C(=O)Nc2cnn(-c3ncccn3)c2)c1 754939689 UVUQHMAQNBTHRW-UHFFFAOYSA-N 368.353 0.631 10 10 FCCE Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)CC2 773984291 CMLJLARKDUPLEZ-PLNGDYQASA-N 370.365 0.903 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCCN3S(C)(=O)=O)C2)cc1 855230393 CWUJBVKNEQRSFS-BBRMVZONSA-N 367.471 0.814 10 10 FCCE COC(=O)[C@@H]1CCCN(CC(=O)NCc2cccc(OC)c2O)C1=O 1631543528 UQQQDNBOEGBOML-GFCCVEGCSA-N 350.371 0.429 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CC(=O)N2CC(N=[N+]=[N-])C2)C1 2060614456 CNMUKZKHPZPTNN-NSHDSACASA-N 373.435 0.932 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCO[C@]3(CCOC3)C2)cc1F 285750206 QAMZYPSUXTVFHZ-GOSISDBHSA-N 365.405 0.526 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCc3cnn[nH]3)CC2)cc1 778312100 VTXZBBQPOBOLTB-SREVYHEPSA-N 370.413 0.335 10 10 FCCE C[C@H](NC(=O)C(=O)NCc1ccn(C)n1)c1ccc(N2CCOCC2)cc1 803297582 AQHVNKQHVBSMSU-AWEZNQCLSA-N 371.441 0.750 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@@]34CCNC4)CC2)cc1 829504285 CVQSKMQDWVTEFP-AZUAARDMSA-N 358.486 0.933 10 10 FCCE CCn1nnc(C)c1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 862082136 IHZKCVHJCKEUSH-UHFFFAOYSA-N 353.404 0.614 10 10 FCCE C[C@H](NC(=O)C(=O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(N(C)C)cc1 1119838411 RSLPIYPRQLEGFG-YVVXQTMVSA-N 361.442 0.850 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](CO)[C@H](NC(=O)c2cc(O)nc(O)c2)C1 2116256478 QSIPDZKDIVKULR-CMPLNLGQSA-N 367.402 0.841 10 10 FCCE CC[C@H](C)OC(=O)C[C@@H]1C(=O)NCCN1C=C1C(=O)OC(C)(C)OC1=O 10213742 LLYSGMXKHIKDMU-CMPLNLGQSA-N 368.386 0.239 10 10 FCCE CC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCNCC2)c(F)c1 236819379 RZFOJVOHVMVHEW-MRXNPFEDSA-N 366.462 0.773 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1 808505248 WFPWATKCTFIRRP-LLVKDONJSA-N 359.425 0.993 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@H](NS(C)(=O)=O)C(C)C)C2)cc1 855227882 QVDVLXYMBIICKF-XJKSGUPXSA-N 369.487 0.964 10 10 FCCE CN(C)S(=O)(=O)C1(CN2C(=O)CN(Cc3ccccc3O)C2=O)CC1 925130351 LOXOZPCLVZUTPA-UHFFFAOYSA-N 367.427 0.580 10 10 FCCE CN(C)c1ncc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cn1 752649008 RWKRKKWPIHSKDH-UHFFFAOYSA-N 351.388 0.872 10 10 FCCE O=C(C(=O)N1CCOCC2(CCOCC2)C1)N1Cc2cccc(O)c2C1 1332056623 LZCPCKOULNXGGV-UHFFFAOYSA-N 360.410 0.890 10 10 FCCE Cn1cnnc1C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1261857067 ZMNDNWIHBAUQIO-UHFFFAOYSA-N 355.398 0.769 10 10 FCCE CN1C[C@@H]2CC[C@@H](NC(=O)c3cc(NS(C)(=O)=O)ccc3O)[C@H]2C1 1529330066 XXEGSYUEKNWDBN-LEWSCRJBSA-N 353.444 0.834 10 10 FCCE O=C(Cc1c(O)ncnc1O)NCc1ccc(N2CCC(O)CC2)cc1 1641203556 FNSNWYXTBUXIBZ-UHFFFAOYSA-N 358.398 0.708 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(CNC(=O)c2cc(O)nc(O)c2)C1 2028022914 CFTGVUJTTQGWAL-INIZCTEOSA-N 353.375 0.595 10 10 FCCE CN1NC(C(=O)N=NC(=O)c2csc(N3CCOCC3)n2)=CC=C1O 606347096 KCVWCSVLQZVEMY-UHFFFAOYSA-N 364.387 0.832 10 10 FCCE COc1cc(N2CCN(CC(=O)N(C)OC)CC2)cc(OC)c1OC 759887676 WKJLQSQRQZDIIM-UHFFFAOYSA-N 353.419 0.854 10 10 FCCE Cc1cc(C(=O)N2C[C@@H](C(N)=O)[C@@H](C(N)=O)C2)c(C)n1-c1ccccn1 1630581286 RFOIIDPRNVDGEC-OKILXGFUSA-N 355.398 0.148 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCC4(CCNC4=O)CC3)nc12 1660033574 HNPJLEZAOBAIMB-UHFFFAOYSA-N 373.413 0.714 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccn(C)c3=O)nc12 733503802 DKVBFUUIOOKOHT-UHFFFAOYSA-N 372.337 0.667 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1 825602437 KFWZPLIPPLRWEF-KRWDZBQOSA-N 367.471 0.852 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCC[C@](O)(CO)C3)CC2)cc1 839147761 AATOANSBTXSCRR-LJQANCHMSA-N 363.458 0.163 10 10 FCCE C[C@H](NC(=O)C(=O)NCC12CC(CN1)C2)c1ccc(N2CCOCC2)cc1 851685288 PXPIGTBUSXTJGG-BQTBQCLESA-N 372.469 0.569 10 10 FCCE NC[C@@H]1Cc2ccccc2N(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)C1 868047905 VQXQGOJAWBWIEQ-ZDUSSCGKSA-N 372.450 0.648 10 10 FCCE C[C@@H]1CN(c2ccc(CNS(=O)(=O)C3CNC3)cc2F)C[C@@H](C)O1 923592528 QGJJZEJDAVGHLI-VXGBXAGGSA-N 357.451 0.831 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1C2CCC1(CO)CC2 1334568655 SBASEXCNFAEBKF-UHFFFAOYSA-N 373.453 0.655 10 10 FCCE C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CN(C)CCN1C 1544138995 IJQYJTLJGJFZRX-BXUZGUMPSA-N 370.475 0.128 10 10 FCCE COc1cc(C(=O)NCc2cc(O)ccc2O)sc1S(N)(=O)=O 1558175662 ZYZCMVQHWDFSPK-UHFFFAOYSA-N 358.397 0.745 10 10 FCCE O=C(Cn1cc(Br)c(O)nc1=O)NCc1cc(O)ccc1O 1637122231 CALDPKLLSVXFOT-UHFFFAOYSA-N 370.159 0.439 10 10 FCCE O=C([C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1)N1CCOCC1 768440523 FDTUZEGBVDWZRM-CXAGYDPISA-N 362.426 0.889 10 10 FCCE Cn1cc(/C=C\C(=O)N2C[C@H](CO)Cc3ccccc32)c(=O)n(C)c1=O 816784636 QYPHVRUTZZPWPE-MEJMFZKBSA-N 355.394 0.295 10 10 FCCE CO[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@H]1CCOC1 827575004 LTMHJSUPDSWJRK-XJKSGUPXSA-N 367.421 0.676 10 10 FCCE C[C@H]1C(=O)N(CCN(C)C)CN1Cc1ccc(N2CCN(C)CC2)cc1 843428713 MBEZPZWXYRSNPJ-KRWDZBQOSA-N 359.518 0.990 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@H]4OCC(=O)N[C@H]4C3)C2)cc1 852448805 NFCKYZQWKQNIMO-COXVUDFISA-N 374.441 0.573 10 10 FCCE c1cc(N2CCOCC2)ccc1Cn1cc(CCN2CCNCC2)nn1 900601370 OTTMAZUTDWSJRZ-UHFFFAOYSA-N 356.474 0.611 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H](F)C(=O)OC)cc1 1119522515 ILHBCDNKGHUZNV-AWEZNQCLSA-N 353.394 0.776 10 10 FCCE O=C(CNS(=O)(=O)c1ccc(F)cc1)NCc1c(O)cccc1O 1178904867 AZABFJFSUCYCFJ-UHFFFAOYSA-N 354.359 0.832 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3CC(O)(C4CC4)C3)CC2)cc1 1322878501 DZPMDBQOTGMBMD-UHFFFAOYSA-N 374.485 0.984 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)NC[C@@H]1[C@H](N)Cc1ccc(O)c(O)c1 1952911367 RMQFSDCNJKPCBC-VXGBXAGGSA-N 351.403 0.703 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@H]1C(=O)Nc1ccc(N)cc1 2080898829 URNHUDCAACXIKW-IHRRRGAJSA-N 351.403 0.939 10 10 FCCE C[C@H](NC(=O)C(=O)N1CCN(C2CC2)C(=O)C1)c1ccc(N(C)C)cc1 807672190 XIDOUNVWCKTJDY-ZDUSSCGKSA-N 358.442 0.763 10 10 FCCE CCn1ncc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 815065393 BHAKQPYMYVZTSX-UHFFFAOYSA-N 363.443 0.463 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN2CCO[C@]3(CCS(=O)(=O)C3)C2)c1O 843425731 HDJDAEWKLFXFFS-OAHLLOKOSA-N 372.399 0.699 10 10 FCCE Oc1cc2c(cc1CN[C@H]1CCN(c3ccc4nncn4n3)C1)OCO2 858243775 OPCXGVXXCSELPA-LBPRGKRZSA-N 354.370 0.927 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3cc(OC)n[nH]3)C2)cc1 861904478 GFPWVSUYNWDGNB-NSHDSACASA-N 359.386 0.761 10 10 FCCE CC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 881851755 PXBIGZCPHLQTIP-QGZVFWFLSA-N 362.499 0.976 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H](C)[C@H](O)C3)CC2)cc1 1645117217 GEWVSPZITUORQS-IMFGXOCKSA-N 363.502 0.881 10 10 FCCE C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NCc1cccc(Cl)c1O 1648606088 HPAWHADVNFMVPK-VIFPVBQESA-N 372.834 0.762 10 10 FCCE Cc1cccc(N(CCC(N)=O)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c1 1772824626 FHMBGTMLNYKZGO-FPLPWBNLSA-N 370.409 0.314 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)[C@H](O)C1 1890523661 BQZVRGBHWOCQNA-XHBSWPGZSA-N 369.422 0.878 10 10 FCCE CC[C@@H](C)OC(=O)C[C@@H]1C(=O)NCCN1C=C1C(=O)OC(C)(C)OC1=O 10213740 LLYSGMXKHIKDMU-ZYHUDNBSSA-N 368.386 0.239 10 10 FCCE Nc1ccc(CCNC(=O)Cn2cc(Br)c(=O)[nH]c2=O)cc1 152510101 GCUAZCFKRUANBF-UHFFFAOYSA-N 367.203 0.240 10 10 FCCE Cn1ccnc(N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)c1=O 768465611 IVTKHZWEWBNGQQ-OAHLLOKOSA-N 358.398 0.234 10 10 FCCE C[C@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CN1 861761349 DEPJDNODOSELAK-GOEBONIOSA-N 360.458 0.396 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@@H]3CC[C@H](C)NC3)C2)cc1 861783155 SIMVBBWTHCFGNH-ARFHVFGLSA-N 374.485 0.894 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(CO)on3)cc2)C1 1141996384 SSUHFKZQEWDZOH-CYBMUJFWSA-N 358.398 0.799 10 10 FCCE CNC(=O)CNC(=O)c1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 1296989647 GARHKWPWGQWCLE-UHFFFAOYSA-N 357.366 0.755 10 10 FCCE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cn2nnc(N)n2)cc1 1464600330 CMTGFYNLQARNGA-OAHLLOKOSA-N 359.434 0.529 10 10 FCCE COC(=O)c1cn(CCNC(=O)NCc2cccc(Cl)c2O)nn1 1635201277 GSIYAJLZTNKCJL-UHFFFAOYSA-N 353.766 0.923 10 10 FCCE CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCc2cc(O)c(O)cc2C1 2318626537 PKZROOLFSVRHFA-AWEZNQCLSA-N 352.387 0.868 10 10 FCCE C[C@H](NC=C1C(=O)N(C)C(=O)N(C)C1=O)c1ccc(-n2cncn2)cc1 920979645 SSEVDOGQSDQZHS-NSHDSACASA-N 354.370 0.852 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC3(CCNC(=O)O3)CC2)cc1 929238601 PZEVTPLYCNIMTE-UHFFFAOYSA-N 374.441 0.860 10 10 FCCE COC[C@@H](CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)OC 1334034875 SUVBAAQDSDMTJT-MRXNPFEDSA-N 363.458 0.853 10 10 FCCE C[C@@H]1NC(=O)[C@@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H]1C 1583302844 PMNKHBPTASZMIR-IVZWLZJFSA-N 355.416 0.501 10 10 FCCE CC(C)(C)OC(=O)N1CC(NC(=O)COc2ccc(N)cc2)(C(=O)O)C1 2106260788 ZYOIRMQISCHAAU-UHFFFAOYSA-N 365.386 0.838 10 10 FCCE CCN1C(=O)[C@@H]2[C@H](c3ccc(O)c(O)c3)N[C@@](C(=O)O)(C(C)C)[C@@H]2C1=O 248195470 PDSOWMVSWXBTFZ-NUXNZHGMSA-N 362.382 0.843 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCNC(=O)CC3)cc2)C1 815074402 RKTWHRWMYIIOKT-JKSUJKDBSA-N 372.469 0.921 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)CCc3cn(C)nn3)cc2)CC1 832794851 QZKBLRVPZGVIDE-UHFFFAOYSA-N 370.457 0.733 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)C(=O)N(C)OC)C2)cc1 858599848 QTRSJFQZKIRXHT-QWHCGFSZSA-N 350.419 0.981 10 10 FCCE C[C@@H]1CC[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CN1 861805694 JMNTVRWGBNAXMZ-WBVHZDCISA-N 374.485 0.738 10 10 FCCE COc1ccc(N(C)CCN(C)S(=O)(=O)C[C@@H]2CNCCO2)cc1 866774778 QVCPDMPUQQPFQI-INIZCTEOSA-N 357.476 0.381 10 10 FCCE C[C@H](NC[C@@H](O)CS(C)(=O)=O)c1ccc(N2CCOCC2)c(F)c1 927031392 HNBZLMJWEYTJKZ-GXTWGEPZSA-N 360.451 0.718 10 10 FCCE CCC(=O)N[C@@H](C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1133626569 PWUDDSNQYSCOLH-ZDUSSCGKSA-N 360.458 0.919 10 10 FCCE COC(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1323017298 BBXUINUIMMARIC-OAHLLOKOSA-N 357.410 0.701 10 10 FCCE Cn1c(O)nnc1CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1637908501 ZATBUQXKLMNZMS-UHFFFAOYSA-N 374.445 0.729 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)NCc2nnc3c(=O)[nH]ccn23)c1 1638501593 YHMOWHUOIFNJDL-SECBINFHSA-N 358.358 0.692 10 10 FCCE CN(C)Cc1nc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)co1 1639454950 UJFNMZDMGPOVSI-UHFFFAOYSA-N 368.415 0.743 10 10 FCCE COC(=O)COCCNC(=O)N(C)CCN(C)c1ccc(OC)cc1 1675024673 HWUIRMIKYQWGFE-UHFFFAOYSA-N 353.419 0.962 10 10 FCCE COCCOCC(=O)N1CCOc2ccc(N3CCOCC3)cc2C1 581789035 FPZYDGDJSVZKKS-UHFFFAOYSA-N 350.415 0.907 10 10 FCCE C[C@@H](O)[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 817831452 MGWGOYUXKWZTOI-PBHICJAKSA-N 359.426 0.287 10 10 FCCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@@](O)(C(N)=O)C2)cc1 861219393 VAXCBKNCZKHMKQ-FQEVSTJZSA-N 369.421 0.898 10 10 FCCE CN1CCN(C)CC(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 912709926 YOSGDFRSAZEFQH-UHFFFAOYSA-N 360.502 0.757 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)N3CCC[C@@H]3C)CC2)cc1 1257544568 HIXHVZRUUWZKAN-INIZCTEOSA-N 374.485 0.944 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1[C@H]2COC[C@H]21 1323042094 LJLNKTVDFOKDHE-FVQHAEBGSA-N 359.426 0.243 10 10 FCCE CC(C)CN1[C@@H]2CN(Cc3ccc(O)c(O)c3)C[C@H]2OCCS1(=O)=O 1613880016 PZQDDCUEZCIIIB-RHSMWYFYSA-N 370.471 0.969 10 10 FCCE CN1C(=O)N[C@]2(CCC[C@@H]2CNC(=O)c2c(F)ccc(O)c2O)C1=O 1638421613 CSOWEGOPJJNJOE-BCTVWOGZSA-N 351.334 0.687 10 10 FCCE C[C@@H]1OC(=O)N[C@@H]1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1638488568 KPLSNWGKODXCKG-NHYWBVRUSA-N 360.414 0.501 10 10 FCCE Cc1ccc(CNS(=O)(=O)N2CC(O)C2)c(O)c1Br 2352695474 ZLLFFLDALTXCQL-UHFFFAOYSA-N 351.222 0.474 10 10 FCCE O=[N+]([O-])c1ccc(O)c(CN2CCC(N3CCS(=O)(=O)CC3)CC2)c1 184334581 YGLDYFZYYOHBQZ-UHFFFAOYSA-N 369.443 0.995 10 10 FCCE CCOC(=O)[C@@H]1CCCN1S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 391768112 BLLWJQOCSSGXCB-NSHDSACASA-N 358.372 0.775 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCC[C@@H](C(N)=O)C2)c1 746885219 CXUOAQOSBYDRPD-ZJUUUORDSA-N 355.416 0.538 10 10 FCCE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CC[C@H](CN2CCOCC2)O1 934939889 YESNRIXRYXKMCF-PBHICJAKSA-N 350.415 0.636 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2081034342 GSCOCHAZQVWQAC-DCAQKATOSA-N 355.395 0.534 10 10 FCCE COc1ccccc1N1C(=O)NC(=O)C(=CNCCN2CCOCC2)C1=O 2296132659 BSJRGKADJUNXJX-UHFFFAOYSA-N 374.397 0.084 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@H]2CC(N)=O)c1 769738163 NVDFAIVAZKKAFA-NSHDSACASA-N 355.416 0.634 10 10 FCCE O=C(NCC[C@@H]1CCOC1)C(=O)NCc1ccc(N2CCOCC2)cc1 788321523 WMDGXMHWIHQWFO-MRXNPFEDSA-N 361.442 0.682 10 10 FCCE CC(=O)C(=O)COC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1 808497094 HSFSWMQWDOLBLT-IBGZPJMESA-N 370.361 0.829 10 10 FCCE CC(=O)C(=O)COC(=O)c1c(C)cc(=O)n(CC(=O)NC(C)C)c1C 808524238 NHPMCHRDFOZZLN-UHFFFAOYSA-N 350.371 0.305 10 10 FCCE CCc1cccc(CN2CCN(S(=O)(=O)N3CCOCC3)CC2)c1O 848882173 YSIMEYFYWHYABP-UHFFFAOYSA-N 369.487 0.649 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC(F)(F)CN)C2)cc1 851689397 OKTJMQHTKLHAHJ-LLVKDONJSA-N 356.373 0.100 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H](O)Cc3cnn(C)c3)CC2)c(OC)c1 870167355 HCYLKTXIZKNUSU-KRWDZBQOSA-N 374.441 0.690 10 10 FCCE CC(C)(C)C(=O)N1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329776244 UHMLMGRKKTWWSB-UHFFFAOYSA-N 359.426 0.951 10 10 FCCE COC(=O)[C@H]1CC[C@@H](C(=O)OC)N(C(=O)Cc2ccc(O)c(O)c2)C1 1453538449 IAPNSFLQYNYBJO-RYUDHWBXSA-N 351.355 0.594 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)NCCc1ccc(N)cc1 2136169627 GHUDDFPQEADHKG-KKUMJFAQSA-N 365.430 0.269 10 10 FCCE COc1nn(C)cc1CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 929801900 HDUOJOWMRYTSLR-UHFFFAOYSA-N 363.393 0.566 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(Cc2ccncc2)CC1 1351811772 ZSWSYIVBSXNSIU-UHFFFAOYSA-N 366.421 0.974 10 10 FCCE Cn1c(=O)c2cc(C(=O)NCc3ccc(O)c(O)c3)sc2n(C)c1=O 1445904667 XRUVQAYOZZTKBA-UHFFFAOYSA-N 361.379 0.640 10 10 FCCE O=C(CNS(=O)(=O)c1ccccc1F)NCc1ccc(O)cc1O 1638352481 PPADKOXDPOBHDO-UHFFFAOYSA-N 354.359 0.832 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CN(C)C(=O)[C@@H]3C)C2)cc1 834862829 XQXCAFWSIWHSPN-UONOGXRCSA-N 374.441 0.284 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCS(=O)(=O)NCc1ccccc1 1596135004 NAIMDWVKPZHACS-UHFFFAOYSA-N 364.423 0.876 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCC(=O)N=S(C)(C)=O)C2)cc1 1687024048 YEUORGZJNKDWBT-GFCCVEGCSA-N 368.459 0.827 10 10 FCCE COCCNC(=O)[C@H]1C[C@@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 242954432 HGVTVJCTKUODMI-IRXDYDNUSA-N 361.442 0.743 10 10 FCCE CN1CCC[C@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1=O 822659761 FWHZTDJMYJEQBZ-DOTOQJQBSA-N 372.469 0.873 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2CCC(O)(COCCO)CC2)cc1 1155858492 YTUUAENPWQLYMO-UHFFFAOYSA-N 350.375 0.825 10 10 FCCE COc1ccc(N2CCN(C(=O)NCc3nc(N)n[nH]3)CC2)c(OC)c1 1235060249 FUGZRVPGVKPUFP-UHFFFAOYSA-N 361.406 0.436 10 10 FCCE NC(=O)C1CCC(NC(=O)C(=O)NCCCSc2nccs2)CC1 1326463047 VCCLCIMRIJMGQV-UHFFFAOYSA-N 370.500 0.902 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)C1CS(=O)(=O)C1 2076837608 MLKVVYMWYDLTHG-WDEREUQCSA-N 373.435 0.836 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)C[C@@H]1CO 2122239376 JKOLSUZNEYTYLF-VXGBXAGGSA-N 367.402 0.841 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2312333770 ABZKFFOSWSEDPH-IYKVGLELSA-N 355.395 0.675 10 10 FCCE CN(C)CCn1cc(NC(=O)C(=O)NCc2ccc(N(C)C)cc2)cn1 125226145 UAORUAWPBAKJHB-UHFFFAOYSA-N 358.446 0.766 10 10 FCCE CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CN2CCC1CC2 769815603 LCDQQSGADOFQHL-AWEZNQCLSA-N 353.444 0.930 10 10 FCCE CN(CC1CC1)C(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 793720408 OPMDCLSSDURZKQ-MRXNPFEDSA-N 372.469 0.873 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCOCC3CC3)C2)cc1 827549741 TUBAXTASUZLQIV-HNNXBMFYSA-N 361.442 0.933 10 10 FCCE CNCCOCCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 861562779 YDJYOVUNZPSIJF-UHFFFAOYSA-N 354.426 0.698 10 10 FCCE CN(C)S(=O)(=O)N1CC(NCc2ccc(Br)cc2O)C1 862536270 GSCNSYDANOHSML-UHFFFAOYSA-N 364.265 0.735 10 10 FCCE Cn1nc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1O 1455865346 GGULHMINGWKUBN-UHFFFAOYSA-N 357.414 0.757 10 10 FCCE CS(=O)(=O)c1ccccc1C(=O)N1CCS(=O)(=O)[C@H]2COCC[C@@H]21 1556959921 IZEZAMJYHGVHBB-JSGCOSHPSA-N 373.452 0.118 10 10 FCCE C[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CCN1c1nccn2cnnc12 1566543729 IHTAYVDCNRWCGH-LBPRGKRZSA-N 368.397 0.815 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CO)C[C@@H]2CCCO2)c1 1652026322 SRLGKOAUHCACKI-NEPJUHHUSA-N 358.416 0.424 10 10 FCCE C[C@H]1CO[C@@H](CO)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 221139131 WCYXLNDCHUNNLS-HHURGBBESA-N 356.220 0.987 10 10 FCCE CCCCN(Cc1ccccc1O)C(=O)C(=O)N1CCNCCNCC1 926347644 HLVGKPSSHIIRDQ-UHFFFAOYSA-N 362.474 0.542 10 10 FCCE C[C@@H](C(=O)NCc1ccc(O)cc1O)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1142533658 PHHOVOIGXQAPDJ-CELJHQOASA-N 360.366 0.265 10 10 FCCE COC(=O)[C@@H]1C[C@@H]1CNC(=O)C(=O)NCCCSc1nccs1 1353851389 JRSKMURCBPMVSM-NXEZZACHSA-N 357.457 0.667 10 10 FCCE O=C1C[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)NC(=O)N1 1625657689 ULENVIPUEUWCJV-NSHDSACASA-N 350.338 0.933 10 10 FCCE CCn1cc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)nn1 1638488597 KVHSYTLKZMKOKW-UHFFFAOYSA-N 356.430 0.930 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCc2ccccc2O)[C@@H](O)C1 1890526094 NWJPHBZAFHOBNB-KSSFIOAISA-N 366.414 0.741 10 10 FCCE CCN1C(=O)/C(=C\c2cn(CC(N)=O)c3ccccc23)C(=O)NC1=S 5926708 POWDFKWLJUEDCW-GHXNOFRVSA-N 356.407 0.773 10 10 FCCE CC[C@@H](CO)N1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761908009 JUCUCTWVQJVHDG-NSHDSACASA-N 350.375 0.819 10 10 FCCE Cn1nccc1CNC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 788500388 CAPUPCISKAEBOZ-UHFFFAOYSA-N 373.482 0.906 10 10 FCCE O=C(Cn1ccc(O)nc1=O)NCc1cc(Br)ccc1O 804739183 UJTUFSAFKYTFSJ-UHFFFAOYSA-N 354.160 0.733 10 10 FCCE CCN(OC)C(=O)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852396835 PDPGKPDQFDPTDP-UHFFFAOYSA-N 364.446 0.857 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C1CN([C@@H]2CCOC2)C1 898982783 HXFFOJUEPZJUJR-GOSISDBHSA-N 359.470 0.985 10 10 FCCE CN(CCNC(=O)c1cc2cc(O)c(O)cc2s1)CCOCCO 1303015601 KVFJSLDHGPCLBN-UHFFFAOYSA-N 354.428 0.983 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CC=C[C@@H]1CO)c1ccc(N2CCOCC2)cc1 1332105610 PDDAJACEDVRQFT-RHSMWYFYSA-N 359.426 0.460 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCNS(=O)(=O)c1ccccc1 1542506403 AXYUCFBZFZPHCK-UHFFFAOYSA-N 350.396 0.735 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC[C@@H](C(N)=O)O3)cc2)CC1 1625198677 JNHGDZUXLXFNRA-DLBZAZTESA-N 374.441 0.004 10 10 FCCE NC(=O)C1CCN(c2ccc(CNc3ccc4nnnn4n3)cc2)CC1 1640418226 GUCPNIZBTGNIRG-UHFFFAOYSA-N 352.402 0.833 10 10 FCCE C=CC(=O)NCCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 773287731 XYTJAHMTSXCAEE-OAHLLOKOSA-N 358.442 0.697 10 10 FCCE CNS(=O)(=O)Nc1ccc(NS(=O)(=O)N2CCC[C@@H](C)C2)cc1 797431674 VJWNHAFJTKLENR-LLVKDONJSA-N 362.477 0.951 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@@]34CCNC4)CC2)cc1 829504288 CVQSKMQDWVTEFP-UYAOXDASSA-N 358.486 0.933 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(N4CC[C@@H](O)C4)CC3)cc2N1 853966099 OSCBJHQJROHZTB-GFCCVEGCSA-N 362.386 0.961 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CCN=C4C3=NNN4C)C2)cc1 854981673 YOYQIIRVZPXQSO-CJNGLKHVSA-N 370.457 0.862 10 10 FCCE Cc1nnc2n1C[C@@H](C(=O)N(C)C)N(C(=O)Cc1ccc(O)c(O)c1)C2 1305003760 YXRFISGLDNMRHZ-LBPRGKRZSA-N 359.386 0.039 10 10 FCCE Cn1cc(CN2CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)cn1 1329419348 JCXKODDLEJVRCR-UHFFFAOYSA-N 369.425 0.312 10 10 FCCE CC(C)(C)OC(=O)N1CC(NC(=O)c2ccc(O)c(O)c2)(C(=O)O)C1 2054410740 QQMLVZUXYCNJSN-UHFFFAOYSA-N 352.343 0.902 10 10 FCCE COCCS(=O)(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCOCC1 21754673 ODCJDSPQUAKBSG-KRWDZBQOSA-N 371.503 0.692 10 10 FCCE CN1C(=O)/C(=C\N[C@H](Cc2c[nH]c3ccccc23)C(=O)O)C(=O)N=C1S 103102951 QCMQWCNUTWQPTG-BIRHUZIMSA-N 372.406 0.922 10 10 FCCE COC(=O)C1CCN(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)CC1 274944023 RJZIKHMMJRCLTG-UHFFFAOYSA-N 358.372 0.632 10 10 FCCE COC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)C1CCOCC1 826707863 YRZXCWYZMGUPTA-KRWDZBQOSA-N 363.458 0.927 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)N2CC[C@@H](Nc3ncccn3)C2)cc1 843261469 KOBCKTOTGLGLKB-OAHLLOKOSA-N 354.414 0.431 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H]2CNCC[C@@H]2C)cc1 846343760 OJNQBCFQSKSRPS-WMLDXEAASA-N 362.474 0.704 10 10 FCCE COc1ccc(N(CC(=O)O)CC(=O)NCC[C@@H]2CC(=O)N(C)C2)cc1 905127508 AWDHBXMVNUDKNP-CYBMUJFWSA-N 363.414 0.571 10 10 FCCE CN1CCN(c2ccc(CN3C(=O)N[C@H](c4ccnn4C)C3=O)cc2)CC1 925079559 KRLLAJSOHIGZCD-QGZVFWFLSA-N 368.441 0.965 10 10 FCCE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCc1cccc(O)c1O 1176576242 HYQBVEAJAHWFAB-UHFFFAOYSA-N 351.403 0.524 10 10 FCCE C[C@@H](C(=O)N1CCCC1)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1294660541 QOFFKIQINSGDLQ-AWEZNQCLSA-N 361.442 0.795 10 10 FCCE COC[C@@H](CCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)OC 1334109016 DIBVQUXDERPYIK-QGZVFWFLSA-N 361.442 0.847 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CNS(=O)(=O)c1cnn(C)c1 1640257207 NGCWJLHCXIVEDS-UHFFFAOYSA-N 373.431 0.206 10 10 FCCE NC(=O)C[C@H](C(=O)O)N1C(=O)C(=Cc2ccccc2O)SC1=S 2314542871 ZPRHWSHNWPUZKL-MRVPVSSYSA-N 352.393 0.922 10 10 FCCE O=C1C[C@H](C(=O)N2Cc3cccc(O)c3C2)CN1CCN1CCOCC1 871200922 NGFWKNBRUVWUJN-HNNXBMFYSA-N 359.426 0.415 10 10 FCCE COc1nn(C)cc1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 929525768 BIDLJENGZBTNIP-UHFFFAOYSA-N 371.441 0.962 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CN(C(=O)CCCF)C[C@@H]2O)cc1 1343480191 JYKKTIQZWBYCBQ-OLZOCXBDSA-N 365.365 0.900 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@H](c3cc(O)n[nH]3)C2)c1 1469715261 NMLSCGXXNKBOGD-SECBINFHSA-N 366.399 0.822 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H](CO)c1ncc[nH]1 1479030974 WGVBHQRDFOCAON-INIZCTEOSA-N 359.430 0.904 10 10 FCCE C[C@H](O)C(=O)N1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1556066984 IESQFPDGUVUTJZ-VIFPVBQESA-N 350.396 0.978 10 10 FCCE O=C(C[C@@H]1NC(=O)c2ccccc2NC1=O)NCc1ccc(O)cc1O 1643104240 RFCBTJLAVQBLNB-AWEZNQCLSA-N 355.350 0.855 10 10 FCCE O=C(CN1C(=O)c2ccccc2S1(=O)=O)NCc1c(O)cccc1O 1645360583 DKEAYROBSFQXTP-UHFFFAOYSA-N 362.363 0.559 10 10 FCCE O=C(N[C@@H]1CCCCN1[C@H]1C(=O)CSC1=O)c1cc(O)c(O)c(O)c1 1865876446 LKAWOPLAVGXXIU-STQMWFEESA-N 366.395 0.556 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NOCCN 2080872746 GRPFHEXPTDNYMN-NSHDSACASA-N 355.391 0.540 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNC(=O)c1cccc(O)c1O 2225627440 MXCDTEMPJCWYJP-VHRBIJSZSA-N 368.386 0.169 10 10 FCCE Cc1cccc(N2C(=O)C(=CNCCN3CCNCC3)C(=O)NC2=S)c1 2297056663 OFEVPIBEWWMVKX-UHFFFAOYSA-N 373.482 0.121 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC[C@H]3CCOC3)C2)cc1 828506572 OTLSKYJUKNOTBS-GJZGRUSLSA-N 361.442 0.933 10 10 FCCE CCCN1CC[C@H](NC(=O)C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 830454328 HSGFDGHXBCCHCI-HOTGVXAUSA-N 374.485 0.991 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCNC12CCC2 861761713 NIDXEOMQFNKUTG-QGZVFWFLSA-N 372.469 0.540 10 10 FCCE CCc1nnc(N(C)Cc2ccccc2O)n1CCNS(C)(=O)=O 1306080753 QUOWOWURNGEMIG-UHFFFAOYSA-N 353.448 0.732 10 10 FCCE C[C@H](NC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1ccccc1O 1471194992 RTZAYJQHWBKJPH-RWMBFGLXSA-N 366.439 0.605 10 10 FCCE COC[C@](O)(CO)CNCc1c(Br)ccc(OC)c1O 1966068448 VZAFIGCMVHPSKD-CYBMUJFWSA-N 350.209 0.623 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](C)S(C)(=O)=O)CC2)cc1 299490563 GBGQRKLUBZUNGA-CQSZACIVSA-N 369.487 0.367 10 10 FCCE CCN(Cc1cc(O)n2ncc(C(=O)O)c2n1)[C@@H](C)CS(C)(=O)=O 737851050 DGLWTOWLVYTAEE-VIFPVBQESA-N 356.404 0.388 10 10 FCCE Cc1ccc(O)c(CNC(=O)N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)c1 858457679 LWMMYDZGUVAJQV-CQSZACIVSA-N 370.475 0.771 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)/C=C\Cn3cncn3)cc2)CC1 907639469 IQQMCVOARAIFBD-IHWYPQMZSA-N 368.441 0.819 10 10 FCCE CN(C)CCN(C(=O)Cc1ccc(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1 1294386635 GHQFEQQKHJCDBJ-CYBMUJFWSA-N 356.444 0.218 10 10 FCCE C[C@H](O)[C@H](NS(=O)(=O)c1cccs1)C(=O)NCc1ccccc1O 1566373921 MCONJMKKRQROFS-HZMBPMFUSA-N 370.452 0.798 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](N)[C@H](O)C(=O)O 1952345732 GMXPSKONXCQVOK-WQAKAFBOSA-N 356.375 0.306 10 10 FCCE CN(C)S(=O)(=O)[C@H]1CCCN(C(=O)NCCc2ccc(N)cc2)C1 841962670 QIVJNHGCDTUHQP-HNNXBMFYSA-N 354.476 0.877 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCC[C@@H](N)C3)C2)cc1 851688336 XGHRFRKYGKJZRV-ILXRZTDVSA-N 360.458 0.776 10 10 FCCE CNCCOCCN(C)C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 861765351 AKKOFBIIVZTYPB-UHFFFAOYSA-N 362.474 0.597 10 10 FCCE Cc1nc(CNC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)n[nH]1 1685248579 JXEDAFGSCJXMGM-UHFFFAOYSA-N 371.445 0.814 10 10 FCCE Cc1ccc(N=c2nc(N3CCOCC3)[nH]c(N3CCOCC3)n2)c(O)c1 1871732227 YGOAQCVMHABXEM-UHFFFAOYSA-N 372.429 0.724 10 10 FCCE Cn1cc(C=CC(=O)NCc2c(O)ccc3c2CCCC3)c(=O)n(C)c1=O 2301550586 VXWWVAYTPIRHPI-UHFFFAOYSA-N 369.421 0.998 10 10 FCCE CCN1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1=O 189772945 DECFRSINIQDWAI-UHFFFAOYSA-N 350.394 0.994 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CCN=C3C2=NNN3C)cc1 855020895 XARAYEYNWIKXFC-HNNXBMFYSA-N 358.446 0.814 10 10 FCCE CN(C)CCN1C[C@@H](C(=O)NCc2ccc3cccnc3c2O)CC1=O 862027811 GRWGGCCHVJCKCZ-HNNXBMFYSA-N 356.426 0.967 10 10 FCCE Cn1nccc1[C@@H](O)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1253512056 QHYTXHATXJOHPK-SFHVURJKSA-N 373.457 0.914 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@]3(C)CCC(=O)N3)C2)cc1 1328507684 DNLMSNZILPBLMN-ORAYPTAESA-N 374.441 0.175 10 10 FCCE Nc1nc(C2CC2)nc(N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)n1 1559038419 IPNOBVZMIMUBLX-UHFFFAOYSA-N 374.376 0.844 10 10 FCCE O=C(NCc1c(O)cccc1O)[C@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1647289882 LEPUZKPYNADITG-IUCAKERBSA-N 353.318 0.937 10 10 FCCE COc1ccc(O[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C2)nn1 220403071 PDYKVGWDOQFYJI-SECBINFHSA-N 368.440 0.325 10 10 FCCE CN1C[C@@H](NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CCC1=O 286868523 COYYKWDMUFMQIT-HNNXBMFYSA-N 372.469 0.981 10 10 FCCE CN1CCN(c2ccc(CN3CCC[C@@]4(C3)NC(=O)NC4=O)cc2)CC1 789770851 SAUPSEXVJHQWEX-IBGZPJMESA-N 357.458 0.612 10 10 FCCE CSCC[C@H](C(=O)OCC(=O)C(C)=O)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 808491144 MMBGOFPFLVFKIF-RWMBFGLXSA-N 369.439 0.985 10 10 FCCE C[C@@H]1NCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 861769405 IMKDEZCIHWBBNZ-SWLSCSKDSA-N 364.421 0.145 10 10 FCCE COC(=O)[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C[C@@H](C)O1 862867449 UNAQSILGYQCKIZ-RNCFNFMXSA-N 372.399 0.166 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@@H](O)CS(C)(=O)=O 922917163 YAHJVGJKVOXLPI-XJKSGUPXSA-N 371.503 0.697 10 10 FCCE CN(Cc1ccccc1S(N)(=O)=O)C(=O)Cc1ccc(O)c(O)c1 1141400721 RCYIVPUFCDZZFN-UHFFFAOYSA-N 350.396 0.946 10 10 FCCE Cn1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n(C)c1=O 1542180531 PIDIYOSOPSMQQG-CQSZACIVSA-N 371.441 0.356 10 10 FCCE O=C1NC[C@H](Cn2cc(C(=O)NCc3c(O)ccc4c3CCCC4)nn2)O1 1635964640 VJKZCMGSIQDOEZ-GFCCVEGCSA-N 371.397 0.901 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](O)[C@H](N)C(=O)O 1952205353 WIPCCMLXTYNHQK-JIMOISOXSA-N 356.375 0.306 10 10 FCCE Cn1ncc(Br)c1S(=O)(=O)NCc1cc(N)ccc1O 2145974572 XXRNEIPBRDDMNH-UHFFFAOYSA-N 361.221 0.949 10 10 FCCE CNS(=O)(=O)NCC(=O)NCc1ccc(N2CCC(C)CC2)cc1 823195757 KSEOSNXQIILDRT-UHFFFAOYSA-N 354.476 0.593 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N(C)CC2(CO)CC2)cc1 846256387 MPIPIBQAQODJBB-UHFFFAOYSA-N 363.458 0.821 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CNCC[C@H]3C)CC2)cc1 842265089 DHMNGGZUFLTDSP-CRAIPNDOSA-N 374.485 0.848 10 10 FCCE C[C@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ncnn21 855328405 SZONDPHNJDKTKO-GZMMTYOYSA-N 351.388 0.791 10 10 FCCE O=S1(=O)CCN(Cc2ccc(N3CCOCC3)cc2)[C@@H]2CCOC[C@H]21 930701938 WVIPRWPAPWRAKT-QZTJIDSGSA-N 366.483 0.911 10 10 FCCE CCON(CC)C(=O)CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 862620688 MJDPEDOOLXQEES-UHFFFAOYSA-N 359.404 0.294 10 10 FCCE COC(=O)[C@]1(N2CCN(Cc3cc4c(cc3O)OCO4)CC2)CCOC1 1118883569 ACNZMDXWFYWMON-SFHVURJKSA-N 364.398 0.571 10 10 FCCE COC(=O)c1c(CN2CCN3C(=O)NC(=O)[C@H]3C2)c2cc(F)ccc2n1C 894423003 OACDCYAMRGNEDQ-CQSZACIVSA-N 374.372 0.840 10 10 FCCE C[C@H](NC(=O)C(=O)c1cc(S(N)(=O)=O)cn1C)c1ccccc1O 1151892245 MGFNATJEXVEQMC-VIFPVBQESA-N 351.384 0.438 10 10 FCCE COC(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1322171671 NYPNSOXGZYRQDH-GFCCVEGCSA-N 351.378 0.529 10 10 FCCE CN1CCN(c2ccc(CNC[C@H](O)CS(C)(=O)=O)cc2F)CC1 1262194615 YABHEAUPYRLSJA-AWEZNQCLSA-N 359.467 0.073 10 10 FCCE COC(=O)N[C@H]1CCN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1353700520 KRRWEGLZSOEUDP-OCCSQVGLSA-N 362.430 0.887 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2C[C@H](S(C)(=O)=O)C2)c1 1650920447 QABTZBNSYMJMGV-MGCOHNPYSA-N 362.429 0.069 10 10 FCCE NS(=O)(=O)CCCNC(=O)NCc1ccc(N2CCOCC2)cc1 1683484963 FEWSHUMDCASMCI-UHFFFAOYSA-N 356.448 0.001 10 10 FCCE OC[C@@H]1C[C@H](NCc2cc(Br)cc(F)c2O)[C@H](O)[C@@H]1O 2177947490 FZBUCDBLNYJBSQ-SWMFJSFKSA-N 350.184 0.486 10 10 FCCE O=C(N[C@@]1(C(=O)O)CCN(Cc2ccccc2)C1)c1cc(O)nc(O)c1 822013996 KAANDUZPQKIDOT-SFHVURJKSA-N 357.366 0.952 10 10 FCCE O=C(O)[C@H]1CN(Cc2cc(Br)ccc2O)CCS1(=O)=O 2197723901 YJMWNNJRIJZARR-LLVKDONJSA-N 364.217 0.838 10 10 FCCE COc1cc(C=C2C(=O)NC(=S)N(C)C2=O)ccc1O[C@@H](C)C(=O)O 2297620234 BIMGELWPYHVGFE-QMMMGPOBSA-N 364.379 0.804 10 10 FCCE COc1ccc(N2CCN(CCN3C(=O)N[C@]4(CCOC4)C3=O)CC2)cc1 277665627 FUFWRJYDEVSDHL-IBGZPJMESA-N 374.441 0.528 10 10 FCCE O=S(=O)(C1CC1)N1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 802746466 PIINLKUEMGUDIU-INIZCTEOSA-N 368.455 0.818 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNCCc3cn(C)cn3)CC2)cc1 819359193 DFMXLEYMAOHTEF-LJQANCHMSA-N 373.501 0.744 10 10 FCCE CC(C)OC[C@H](N)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 851629401 ISTHZOKXNSZIFF-WBVHZDCISA-N 362.474 0.757 10 10 FCCE CN1CC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)S1(=O)=O 856209660 WZIOOENAJFFSHH-MRXNPFEDSA-N 367.471 0.298 10 10 FCCE CN1C[C@@H](O)C[C@@]1(C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 924251798 FOZRJDAZMGHTPZ-PXNSSMCTSA-N 374.485 0.460 10 10 FCCE O=C(Cc1ccc(S(=O)(=O)CCO)cc1)NCc1c(O)cccc1O 1472063715 OGNYTRABFHLBAN-UHFFFAOYSA-N 365.407 0.723 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2081037004 VKCGAKBRQJXPTA-YFKTTZPYSA-N 355.395 0.629 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2CN2CCOCC2)cc1 283376941 GHZQLLQFPKKDMU-GOSISDBHSA-N 374.485 0.692 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCN(C4CC4)C(=O)C3)CC2)cc1 748830471 JABGUQWCKSLBPK-UHFFFAOYSA-N 372.469 0.650 10 10 FCCE O=C(Cn1c(O)nc2ccccc2c1=O)NCCc1ccc(O)c(O)c1 768899120 FZFWERSTQNNBRV-UHFFFAOYSA-N 355.350 0.872 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CCNC[C@H]3C)CC2)cc1 842266343 QDLDQAYTSRCWCG-CRAIPNDOSA-N 374.485 0.848 10 10 FCCE NC1(CNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCOCC1 861754428 HSWVHWVUSMTWBQ-UHFFFAOYSA-N 358.442 0.303 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(C[C@H]2CCCO2)CC1 1331930801 ZPRKKEJCCSAXMF-OAHLLOKOSA-N 359.426 0.558 10 10 FCCE COC(=O)[C@]1(N2CCN(Cc3cccc(OC)c3O)CC2)CCOC1 1335329683 MIFSAIJBOSOANI-SFHVURJKSA-N 350.415 0.851 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cn([C@@H]2CC[C@H]2O)nn1 1557640656 RTROHHZMXKNYOC-QZTJIDSGSA-N 371.441 0.865 10 10 FCCE C[C@@]1(C[C@H]2CCCN2C(=O)c2c(F)ccc(O)c2O)NC(=O)NC1=O 1651014135 HJIKQZDBVDEXRI-BCTVWOGZSA-N 351.334 0.830 10 10 FCCE COc1ccc(N2CCN(C(=O)CCc3nnc(O)nc3O)CC2)cc1 1873831342 GICNBGTTYUKZOA-UHFFFAOYSA-N 359.386 0.573 10 10 FCCE CC(=O)OC[C@@H]1O[C@@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@@H]1OC(C)=O 110339841 QKGHBQJLEHAMKJ-RYMFRWLXSA-N 373.318 0.380 10 10 FCCE CC(=O)NC1CN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 189889910 ZUHVXJWJTLIUJU-UHFFFAOYSA-N 364.421 0.817 10 10 FCCE CC(=O)O[C@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](C)O[C@H]1OCCN=[N+]=[N-] 213789651 SWFHDHBVUMLTMW-KPSHWXKVSA-N 359.335 0.853 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@H](C)N(C)C3CC3)C2)cc1 827891735 MPEAWUIYXNEGHJ-GJZGRUSLSA-N 374.485 0.989 10 10 FCCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@](O)(C(N)=O)C2)c1 861219746 ZQVRXEFZIUPHTO-LJQANCHMSA-N 355.394 0.969 10 10 FCCE COC(=O)c1cc(OCC(=O)NCC(=O)NC(C)(C)C)ccc1N(C)C 865395723 AYVJEFJQVBTIDN-UHFFFAOYSA-N 365.430 0.949 10 10 FCCE COC(=O)c1c(CN2CCN(CC(N)=O)CC2)c2cc(F)ccc2n1C 893914108 CPYIGBJMADTWJI-UHFFFAOYSA-N 362.405 0.707 10 10 FCCE Cn1cc(N2C[C@@H](C(=O)NCCc3ccc(O)c(O)c3)CCC2=O)cn1 1294913141 MLICNZWUIAABEY-ZDUSSCGKSA-N 358.398 0.933 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCNS(=O)(=O)Cc1ccccc1 1644858444 VUWROVXHWBPIFI-UHFFFAOYSA-N 364.423 0.876 10 10 FCCE CCCn1nc(C(=O)NCc2ccc(N3CCNC(=O)C3)cc2)ccc1=O 46718073 BGUCZHQDSMZRAF-UHFFFAOYSA-N 369.425 0.520 10 10 FCCE O=S(=O)(C[C@H]1CNCCO1)NCc1ccc(N2CCOCC2)c(F)c1 866745911 OVKJQAKGUWDQGH-CQSZACIVSA-N 373.450 0.070 10 10 FCCE C[C@H](NC[C@H](O)CS(C)(=O)=O)c1ccc(N2CCOCC2)c(F)c1 927031393 HNBZLMJWEYTJKZ-JSGCOSHPSA-N 360.451 0.718 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(c2cnccn2)CC1 1118937457 BZKPDPRHCLMTQI-UHFFFAOYSA-N 353.382 0.373 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H]2c2nc[nH]n2)c1 1148400564 NUBWQRLLUMBSII-NSHDSACASA-N 351.388 0.859 10 10 FCCE CCOC(=O)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)[C@@H](O)c1cccnc1 1151407410 KEMSAHZSCOSREW-IRXDYDNUSA-N 360.366 0.817 10 10 FCCE C[C@@H](NC(=O)C(=O)NCc1cn(C)nn1)c1ccc(N2CCOCC2)cc1 1346321962 QYMHRLCMEWWPBN-CYBMUJFWSA-N 372.429 0.145 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC3(CC2)CC(=O)N3)c1 1558921634 TVGHHCNZFWAAOW-UHFFFAOYSA-N 353.400 0.258 10 10 FCCE O=C(c1cccc(O)c1O)N(C[C@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 1597768967 FKUBNTSSHWTANL-VXGBXAGGSA-N 355.412 0.906 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NS(=O)(=O)Cc2ccc(N)cc2)C1 2062451263 NGUZKCXLIRPSGN-KBPBESRZSA-N 371.459 0.668 10 10 FCCE COC[C@H](CO)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 280165091 GNVSEAMDFMYLPB-HNNXBMFYSA-N 366.462 0.124 10 10 FCCE CCOC(=O)[C@@H](CCOC)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 281576929 LUHFTUDFMCLKGY-GFCCVEGCSA-N 374.415 0.462 10 10 FCCE CN(C)S(=O)(=O)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 785355587 WKPKUUORUXKZCO-UHFFFAOYSA-N 359.423 0.170 10 10 FCCE CC(=O)C(=O)COC(=O)c1cc(S(N)(=O)=O)cc(Cl)c1Cl 808518943 SOCLBHQJGPUAPN-UHFFFAOYSA-N 354.167 0.956 10 10 FCCE CN1C[C@@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)NC1=O 822937311 GTKRDPLOSRYMEF-HIFRSBDPSA-N 359.430 0.028 10 10 FCCE COC(=O)[C@H]1C[C@@H](O)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 826816280 DVSANTALGMHVKQ-DTWKUNHWSA-N 351.315 0.286 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCN(C[C@H](C)O)CC3)C2)cc1 854298267 ZCHUUKXEFVEKSR-HOTGVXAUSA-N 362.474 0.982 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CCS(=O)(=O)N(C)C)C2)cc1 855234226 VQKYQKHMVQEKKI-CYBMUJFWSA-N 355.460 0.672 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCOCC(F)F)C2)cc1 1118708613 CNYIZGGPDGHJRL-GFCCVEGCSA-N 371.384 0.788 10 10 FCCE CN1CCN(c2ccc(CNC(=O)Cn3cnc([N+](=O)[O-])n3)cc2)CC1 1132903126 TWXXRJJOZUQVQC-UHFFFAOYSA-N 359.390 0.255 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1C[C@H](O)CN1c1ccncn1 1297562478 MBMVNRAVTRZWGV-STQMWFEESA-N 363.414 0.924 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CNC(=O)c3ncccc3O)C2)cc1 1632612121 VIQSOTOJRCXJID-CYBMUJFWSA-N 370.409 0.921 10 10 FCCE CN(CCN=[N+]=[N-])C(=O)[C@]1(NC(=O)OC(C)(C)C)CCS(=O)(=O)C1 2010402652 UISJZHQXYBDKRO-ZDUSSCGKSA-N 361.424 0.837 10 10 FCCE COc1cccc(O)c1CNC(CO)(CO)CNC(=O)OC(C)(C)C 2254547137 AAKLDJXKNFIDKC-UHFFFAOYSA-N 356.419 0.739 10 10 FCCE CCNc1nc(NCC)n2c(SCC(=O)NCC[C@@H](C)O)nnc2n1 265453288 LHAVHRWHWDVEIY-SECBINFHSA-N 368.467 0.362 10 10 FCCE CN(Cc1cc[nH]n1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788317923 BCQAZRFMIZGMHA-UHFFFAOYSA-N 357.414 0.521 10 10 FCCE C[C@H]1C(=O)N(C)CN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 825859905 WSWNVYWDZJWNLZ-ZFWWWQNUSA-N 373.457 0.718 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 861762486 VWTNHCYXLSNEQD-DLBZAZTESA-N 360.458 0.396 10 10 FCCE Cn1cc(/C=C\C(=O)N2C[C@H](CO)Cc3cccc(F)c32)c(=O)n(C)c1=O 911696281 LOZHZEBGXDGFEP-ZHRWSRJISA-N 373.384 0.434 10 10 FCCE O=C(CCn1cnnn1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1119627913 XOWJJMULWPXDNR-UHFFFAOYSA-N 369.473 0.912 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCC[C@H]2C=NNC2=O)c1 1149262908 PQKDHCWXQFWJAC-VIFPVBQESA-N 354.388 0.006 10 10 FCCE Cn1nc2c(c1C(=O)NCc1cc(O)ccc1O)CS(=O)(=O)CC2 1176756112 XIBNAWCVVNEOAJ-UHFFFAOYSA-N 351.384 0.232 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC1CCC(C(N)=O)CC1 1323699292 KYSBWSIZJXHEDM-UHFFFAOYSA-N 360.458 0.838 10 10 FCCE O=C(Cn1cc(NC(=O)N2Cc3cccc(O)c3C2)cn1)N1CCOCC1 1335945034 CBIHVDBCNOKULZ-UHFFFAOYSA-N 371.397 0.995 10 10 FCCE C[C@H](NC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1ccccc1O 1471194994 RTZAYJQHWBKJPH-XQQFMLRXSA-N 366.439 0.605 10 10 FCCE COc1cccc(CNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)c1O 1595799954 LIEVUPGXWIMTBD-UHFFFAOYSA-N 366.399 0.161 10 10 FCCE Cn1c(Br)nnc1CNS(=O)(=O)Cc1ccc(N)cc1 2178013461 ZWCLQZCQXRUWCW-UHFFFAOYSA-N 360.237 0.779 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNCc1cc(F)ccc1O 2312324619 GZNFUZBHXZMMHV-YUELXQCFSA-N 356.394 0.962 10 10 FCCE C[C@@H](NC(=O)C(=O)N[C@H]1CCCCNC1)c1ccc(N2CCOCC2)cc1 842123430 KLVHFCGACSZZNR-WBVHZDCISA-N 374.485 0.959 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NCC23CC(CN2)C3)cc1 851690500 DKXRMNILTGUYDE-UHFFFAOYSA-N 360.458 0.458 10 10 FCCE NS(=O)(=O)c1n[nH]cc1C(=O)NCc1ccc(N2CCCCC2)cc1 1638694111 QSGOAWVIMXFBQL-UHFFFAOYSA-N 363.443 0.977 10 10 FCCE CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NCc2cc(O)ccc2O)c1 1644754408 VTVXLPCMTWWHLO-UHFFFAOYSA-N 366.395 0.984 10 10 FCCE CN(C)c1ccc([C@H](NC(=O)[C@H](N)CCC(N)=O)c2nccn2C)cc1 1866105558 MTZXRCQOMWDJKJ-ZBFHGGJFSA-N 358.446 0.285 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNC(=O)c2cc(O)c(O)c(O)c2)C1 2132351473 XOGXCOOLHCQJIV-ZWNOBZJWSA-N 368.386 0.761 10 10 FCCE C[C@@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CN1 861786791 QWOBFESTQLXQKD-GDBMZVCRSA-N 374.485 0.521 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N1CC=C[C@H]1CO 1119531282 YHAXHDRVVRYGCZ-AWEZNQCLSA-N 363.389 0.038 10 10 FCCE O=C1NC(=O)N(CCc2ccc(F)cc2)C(=O)C1=CNN1CCOCC1 2296115732 HWCLMGBSQTZFTR-UHFFFAOYSA-N 362.361 0.167 10 10 FCCE COc1ccc(N2CCN(CCNS(=O)(=O)N(C)C3CC3)CC2)cc1 736337738 MLKZXZCZTXRRQN-UHFFFAOYSA-N 368.503 0.746 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(CO)C3)CC2)cc1 773939550 CABHNMHOPPSKTD-SREVYHEPSA-N 359.426 0.351 10 10 FCCE COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)cc1 850257595 JSSYUMMXDPPZJV-VQFNDLOPSA-N 360.410 0.779 10 10 FCCE COC(=O)[C@H]1CN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCO1 854301538 QBVUFIYPGHMNRB-XJKSGUPXSA-N 363.414 0.857 10 10 FCCE COc1ccc(N2CCN(C(=O)C3CS(=O)(=O)C3)CC2)c(OC)c1 870166889 XKSUXKDAKLVPPB-UHFFFAOYSA-N 354.428 0.397 10 10 FCCE CN1CCN(c2ccc(CN3C(=O)[C@H]4[C@@H](O)CCCN4C3=O)cc2)CC1 925079731 NJUFLBDCCTWTFI-DLBZAZTESA-N 358.442 0.726 10 10 FCCE O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CC=C[C@H]1CO 1334467171 WGUOQBFMJANKSZ-INIZCTEOSA-N 361.467 0.615 10 10 FCCE Cn1cc(S(N)(=O)=O)cc1C(=O)C(=O)NCc1cccc(Cl)c1O 1457032944 AWFNQEGOJNFVEJ-UHFFFAOYSA-N 371.802 0.531 10 10 FCCE CCN(CC)S(=O)(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1587444845 PBQLGLUKIYXONW-UHFFFAOYSA-N 371.459 0.371 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(C=O)n(C)n1 1624659334 RGXHLGLEPUBPCT-ZDUSSCGKSA-N 361.354 0.548 10 10 FCCE CN(C)c1ccc(CNC(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)cc1F 58972226 SLCWCGOMNRODDB-SOFGYWHQSA-N 360.389 0.619 10 10 FCCE CCOC(=O)N1CCN(S(=O)(=O)N2Cc3cccc(O)c3C2)CC1 867690394 SIJKYPLUJKVPTI-UHFFFAOYSA-N 355.416 0.727 10 10 FCCE CS(=O)(=O)Cc1n[nH]c(CNC(=O)NCc2cc(Cl)ccc2O)n1 1251262196 FZKVILRNIPXARL-UHFFFAOYSA-N 373.822 0.708 10 10 FCCE CN(C)CCN(C[C@H]1CCCO1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1332003488 MRBKIAHINDDNCZ-OAHLLOKOSA-N 361.442 0.804 10 10 FCCE CO[C@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 1347071790 QRIRWTXZUUBJJI-WBVHZDCISA-N 361.442 0.823 10 10 FCCE CC(C)(C)OC(=O)NCc1cn(CC(=O)C(=O)C[C@H]2C[C@H](N)C2)nn1 2049783516 XDCSVOFROCAHGB-XYPYZODXSA-N 351.407 0.568 10 10 FCCE CC(C)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@]1(O)CCOC1 844038500 CCQCHPFJBCSGJV-INIZCTEOSA-N 372.443 0.671 10 10 FCCE O=C(/C=C\c1ccc(O)c(O)c1)NCCS(=O)(=O)C1CCOCC1 1141126982 CRWMWASATOWNRI-RQOWECAXSA-N 355.412 0.821 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CCNCC1 2136253969 SAGDTQGKZHUORQ-ZDUSSCGKSA-N 365.430 0.965 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNCc1ccc(O)c(O)c1O 2333604366 AJNQRNBCTDPDTJ-QKCSRTOESA-N 370.402 0.234 10 10 FCCE Cc1ccc(CNCC2(O)CS(=O)(=O)C2)c(O)c1Br 2352678050 FBKHKUZRFVMCGH-UHFFFAOYSA-N 350.234 0.712 10 10 FCCE CC(C)NC(=O)C(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 122013467 VVXBSFHMOKDJOJ-UHFFFAOYSA-N 374.485 0.692 10 10 FCCE CN(C)CCN(C(=O)/C=C/c1ccc(O)c(O)c1)[C@H]1CCS(=O)(=O)C1 272598737 GVFWAFIGQXWWFV-YVZNUBBCSA-N 368.455 0.688 10 10 FCCE Cn1cc(/C=C/C(=O)N2CCCc3cc(CN)ccc32)c(=O)n(C)c1=O 378187337 JEKAIAJOJSNXSZ-SOFGYWHQSA-N 354.410 0.535 10 10 FCCE CO[C@@H](C)c1noc(CN(C)Cc2cc(O)n3ncc(C(=O)O)c3n2)n1 846259143 ZMYAHVNJLGUVIG-QMMMGPOBSA-N 362.346 0.856 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(=O)n(CCO)c2)c1 857547262 WQCLVYIOKWAVDJ-UHFFFAOYSA-N 367.383 0.170 10 10 FCCE COc1ccc(N2CCN(C(=O)c3ccc4c(c3)COB4O)CC2)cc1 863876206 QKVADNWTAWVUNA-UHFFFAOYSA-N 352.199 0.875 10 10 FCCE COc1ccc(N2CC[C@@H](N3C(=O)N[C@@H](CC4OCCO4)C3=O)C2)cc1 924980973 XADALRBYOFQSJN-HIFRSBDPSA-N 361.398 0.957 10 10 FCCE Cc1ccc(O)c(CNC(=O)NCCc2nnc3c(=O)n(C)ccn23)c1 1251104336 MZLUKBBMKZSEJW-UHFFFAOYSA-N 356.386 0.484 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCS(=O)(=O)N(C)C 1540536822 SYXCVZACODMTEZ-UHFFFAOYSA-N 369.487 0.763 10 10 FCCE COC(=O)NCCC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1584506887 ILSOJGLHOGHFPS-UHFFFAOYSA-N 362.430 0.751 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2CCN(CC(=O)NC3CC3)CC2)cc1 1587364696 LVLKCQOQRGDRIC-UHFFFAOYSA-N 358.402 0.885 10 10 FCCE COc1ccc2c(c1)CCCN2CC(=O)Nc1cc(=O)n(C)c(=O)n1C 19664351 OYYPSLBRQROFHX-UHFFFAOYSA-N 358.398 0.484 10 10 FCCE O=C1N[C@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CS1 746136580 ZFPMAUWQTAURHZ-ZDUSSCGKSA-N 369.468 0.363 10 10 FCCE C[C@H]1CC[C@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CN1 861805693 JMNTVRWGBNAXMZ-RDJZCZTQSA-N 374.485 0.738 10 10 FCCE COc1ccc(N2CCN(C(=O)NCc3cnn(C)n3)CC2)c(OC)c1 868608973 OOLOLINUSAYFAD-UHFFFAOYSA-N 360.418 0.864 10 10 FCCE O=C(NCc1cc(O)ccc1O)[C@@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1303225163 ACRJFAOQBJODOX-ZJUUUORDSA-N 353.318 0.937 10 10 FCCE CCOc1ccc(N2CCN(C(=O)CS(=O)(=O)N(C)C)CC2)cc1 1320060695 FLKIKSKQDSGWJM-UHFFFAOYSA-N 355.460 0.625 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCNC(=O)CC2)cc1F 1322533009 UWLQBIGKAFYHOK-UHFFFAOYSA-N 364.421 0.637 10 10 FCCE C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NCc2ccccc2O)cc1 1445972151 QDYAMWOEQHVGQI-GFCCVEGCSA-N 364.423 0.981 10 10 FCCE COCCN1C(=O)C(=CNCc2nc3ccccc3n2C)C(=O)NC1=S 2040482596 TWXZTHZYUCCRGI-UHFFFAOYSA-N 373.438 0.437 10 10 FCCE NC(=O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccccc2O)SC1=S 2314542872 ZPRHWSHNWPUZKL-QMMMGPOBSA-N 352.393 0.922 10 10 FCCE COCCN1C[C@H](C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1=O 45268549 HPWJAVKWIPNODB-OAHLLOKOSA-N 361.442 0.839 10 10 FCCE C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC(=O)N1C 285640959 FWNYHJNLZNSDQJ-LLVKDONJSA-N 350.394 0.197 10 10 FCCE CC[S@@](=O)CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788317907 ANUBNNRJJYGORW-RUZDIDTESA-N 367.471 0.024 10 10 FCCE COc1ccc(N2CC[C@@H](NS(=O)(=O)C[C@@H]3CN(C)CCO3)C2)cc1 867498100 WMIYMRNCCYZVMX-PBHICJAKSA-N 369.487 0.524 10 10 FCCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCS(=O)(=O)[C@@H]2COCC[C@H]21 1161283375 CWRHYUPTTJLMGQ-NKZHAWSJSA-N 353.396 0.526 10 10 FCCE NCC1(CCNC(=O)C(=O)C(=O)C(=O)NC[C@@H]2C[C@H]3C=C[C@H]2CC3)CC1 1261524859 LZNKOEACUNQFGT-IHRRRGAJSA-N 361.442 0.088 10 10 FCCE Nc1ccc(NC(=O)C(=O)NCCS(=O)(=O)CC(F)(F)F)cc1 1261630469 NCWVYEMKVVKGSR-UHFFFAOYSA-N 353.322 0.301 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCS(=O)(=O)[C@H](C)C1 1329796003 HQPROORJFVJOAV-CYBMUJFWSA-N 368.455 0.776 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C3(O)CCOCC3)cc2)CC1 1558397941 UQHOESQYYDMJQF-UHFFFAOYSA-N 361.442 0.546 10 10 FCCE Cn1ccn2c(CNC(=O)NCc3cccc(Cl)c3O)nnc2c1=O 1565268094 CZLZGLQQKLSHPP-UHFFFAOYSA-N 362.777 0.786 10 10 FCCE CO[C@@H]1COCC[C@@H]1N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1644526478 MTWWDGDYJWYOTB-GXTWGEPZSA-N 358.416 0.640 10 10 FCCE CC(C)(C)OC(=O)N1CC(O)(CNC(=O)COc2ccc(N)cc2)C1 2044228008 DYPBVNOTQPOFQU-UHFFFAOYSA-N 351.403 0.746 10 10 FCCE C[C@@H](NCC(CO)(CO)NC(=O)OC(C)(C)C)c1ccc(O)cc1O 2258277545 UGPYIMPGXDREJF-LLVKDONJSA-N 356.419 0.997 10 10 FCCE COC(=O)[C@H]1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 66143939 ZTDTZDJNSLZPFO-JTQLQIEISA-N 356.400 0.789 10 10 FCCE COCCN1CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 267141524 HECGOOPJRPTDIV-UHFFFAOYSA-N 371.459 0.558 10 10 FCCE C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC(=O)N1C 284139507 QAIQZFZVNMUPHV-AWEZNQCLSA-N 358.442 0.592 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@]3(C)CCOC3)C2)cc1 828142731 JLCZIXWQZZWFKD-IFXJQAMLSA-N 361.442 0.933 10 10 FCCE CN(C)c1ccc([C@H](N)CNC(=O)c2cnnn2C2CCNCC2)cc1 852791801 MRLXHYDPQLDEKO-MRXNPFEDSA-N 357.462 0.698 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3C[C@H]4CC[C@H]3[C@H](N)C4)CC2)cc1 923398308 KIWZHNBXNWQKNM-QAKNJHSXSA-N 374.529 0.990 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCN(CC(F)(F)F)C(=O)C1 1117897650 LACQDEILRKONEQ-UHFFFAOYSA-N 373.331 0.584 10 10 FCCE CN(C)c1ccc([C@@H](CNC(=O)c2nc(O)nc(O)c2N)N(C)C)cc1 1134886346 ZYJIJWYWQNIDLU-GFCCVEGCSA-N 360.418 0.569 10 10 FCCE C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)N[C@@H](C)c1ccccc1O 1171729347 AEEMNHOPDXGPMY-QWRGUYRKSA-N 352.416 0.670 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Cc3nnc(N)s3)cc2)C1 1626339243 PWEXXDUWCXPHKN-LBPRGKRZSA-N 374.470 0.681 10 10 FCCE C[C@H](NC(=O)NCc1nc(CS(C)(=O)=O)n[nH]1)c1ccccc1O 1685497397 PZSMFNOXMWENEE-VIFPVBQESA-N 353.404 0.615 10 10 FCCE O=C(O)[C@H]1CN(Cc2ccc(Br)cc2O)CCS1(=O)=O 2197714918 KGXSIMPAFGWUTR-LLVKDONJSA-N 364.217 0.838 10 10 FCCE CCNc1nc(NCC)n2c(SCC(=O)N[C@@H]3C[C@H]3C)nnc2n1 263901544 DNVHQVYDMXNDEP-RKDXNWHRSA-N 350.452 1.000 10 10 FCCE CCN1C(=O)[C@@H]2CN(Cc3ccc(N4CCN(C)CC4)cc3)CCN2C1=O 775735895 DWFDQRNQGLSVBB-SFHVURJKSA-N 371.485 0.907 10 10 FCCE Cn1ncc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 805994787 VHKGRMNOBUCLKS-AWEZNQCLSA-N 371.445 0.516 10 10 FCCE CC(=O)C(=O)COC(=O)c1cc(S(N)(=O)=O)c(Br)s1 808508361 BVIYBUCHPOYTGH-UHFFFAOYSA-N 370.202 0.473 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H]3CCCNCC3)C2)cc1 851689464 PGYSIKSKGZSGAM-LSDHHAIUSA-N 360.458 0.648 10 10 FCCE COC(=O)c1ccc(O)c([C@@H](C)NC[C@@]23COCCN2C(=O)COC3)c1 866554901 VHMBYIMPZCVGRT-XIKOKIGWSA-N 364.398 0.457 10 10 FCCE O=C(CN1C[C@@H]2CNC[C@H]2C1)NCc1ccc(N2CCOCC2)c(F)c1 917084693 BMFAEMGAIUXHTK-HOTGVXAUSA-N 362.449 0.430 10 10 FCCE O=C(NCCS(=O)(=O)C1CCOCC1)NCc1c(O)cccc1F 1470237451 YZTPHXJPXPGMJH-UHFFFAOYSA-N 360.407 0.924 10 10 FCCE CCCS(=O)(=O)N1CCC(NC(=O)Cc2ccc(O)c(O)c2)CC1 1638858447 VDHDCEYYXUDYSI-UHFFFAOYSA-N 356.444 0.961 10 10 FCCE COCCN1C(=O)/C(=C/NC(=O)Nc2ccc(C)cc2)C(=O)NC1=S 13149315 ABFCRVSAAIGKJQ-FMIVXFBMSA-N 362.411 0.890 10 10 FCCE COC(=O)/C=C/c1ccc(N2CCC[C@]3(C2)NC(=O)NC3=O)c([N+](=O)[O-])c1 279196300 WXOCFQSTQTTZFX-UKINESCASA-N 374.353 0.959 10 10 FCCE CN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)Cc1cc(Cl)c(F)cc1O 295280863 IKSFRFMIDSHNIA-SNVBAGLBSA-N 364.826 0.920 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3CCN4CCOC[C@@H]4C3)ccc21 803689241 NMNNRIXJWREUAQ-KRWDZBQOSA-N 372.469 0.228 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H](C(=O)NC)C1 817762912 XFFWASIQLRAAKN-OAHLLOKOSA-N 360.458 0.696 10 10 FCCE COc1ccc(N2CCN(C(=O)CCNC(=O)[C@@H]3CCCN3)CC2)cc1 825727294 BZELJUIMGZSGKH-KRWDZBQOSA-N 360.458 0.602 10 10 FCCE C[C@@H]1CCNC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 842190661 GDKDRSDMNKFYPQ-RHSMWYFYSA-N 360.458 0.254 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC[C@H]3C(N)=O)CC2)cc1 847399252 AKJGLQVKCFVOQD-IAGOWNOFSA-N 360.458 0.445 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)NC(=O)Cn1cnnn1 930905570 JKLROIMFDOYMJP-ZDUSSCGKSA-N 359.434 0.293 10 10 FCCE Cn1c(=O)c2c(ncn2CCC(=O)N2Cc3cccc(O)c3C2)n(C)c1=O 1175029448 FDLLCRIKMDPWND-UHFFFAOYSA-N 369.381 0.072 10 10 FCCE CN(C)CCN(C(=O)Cc1ccc(O)c(O)c1)[C@H]1CCS(=O)(=O)C1 1294386636 GHQFEQQKHJCDBJ-ZDUSSCGKSA-N 356.444 0.218 10 10 FCCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cn(C)c(=O)n(C)c1=O 1353910929 MALQBDZSAJAJCS-UHFFFAOYSA-N 356.426 0.956 10 10 FCCE COc1ccc(N2C[C@@H](C(N)=O)C[C@@H](NC(=O)C(F)(F)F)C2)c(N)c1 2106883905 VWGUQZKTMBNRQE-DTWKUNHWSA-N 360.336 0.636 10 10 FCCE C[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCS1(=O)=O 365495263 XSWYUTGROOHBMQ-SECBINFHSA-N 355.372 0.939 10 10 FCCE C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H](O)C(F)(F)F 819564425 GCYBIPCIDFJQGR-WKEGUHRASA-N 356.322 0.805 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C[C@]3(O)CCCN(C)C3)cc2)CC1 918905941 JLVJZTHXSLURBY-HXUWFJFHSA-N 360.502 0.901 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)CN3CCOCC3)CC2)cc1 1464538793 HTHAOPSYIKRHMQ-UHFFFAOYSA-N 362.474 0.266 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 1566268003 OCJHSHQADAQROY-MWDDYTRKSA-N 356.378 0.564 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)c3nn[nH]n3)CC2)cc1 1634121782 ZDJAAHVRUHQPOJ-FPLPWBNLSA-N 371.401 0.076 10 10 FCCE CN(Cc1ccc(N)cc1)C(=O)[C@@H]1[C@H](O)[C@H](O)CN1C(=O)OC(C)(C)C 2136173217 QIKMPSHRSBFKNC-QLFBSQMISA-N 365.430 0.568 10 10 FCCE Nc1nonc1/N=N/N(CC(=O)Nc1ccc(F)cc1)c1nonc1N 59498595 SHKAAVMCEHJWOQ-OQKWZONESA-N 362.285 0.900 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3ccc(C(N)=O)o3)CC2)cc1 269445808 BPIUWUKOQYFZHM-UHFFFAOYSA-N 372.425 0.939 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H](N)CCS(C)(=O)=O)CC2)cc1 323807815 ABTVILQJYCEGHT-HNNXBMFYSA-N 355.460 0.106 10 10 FCCE COCCOCCNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 827216410 UYUCQNVSQJRARM-AWEZNQCLSA-N 365.430 0.169 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)C[C@H]3CCNC3=O)cc2)CC1 879688043 RNKLSLABTULXRP-MRXNPFEDSA-N 358.442 0.498 10 10 FCCE CCN(CC)C(=O)N1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329340559 PFYOMXZSISECPK-UHFFFAOYSA-N 374.441 0.840 10 10 FCCE CS(=O)(=O)Cc1n[nH]c(CNC(=O)N2Cc3cccc(O)c3C2)n1 1685415894 VTONIVGAWOKEIF-UHFFFAOYSA-N 351.388 0.280 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNCc1cc(F)ccc1O 2218612934 GZNFUZBHXZMMHV-QEJZJMRPSA-N 356.394 0.962 10 10 FCCE COC(=O)[C@@](C)(O)CN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 808746589 QVKTUUJLAGIKCB-SFHVURJKSA-N 368.430 0.758 10 10 FCCE CN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)NCCc2ccc(N)cc2)C1 841962673 QIVJNHGCDTUHQP-OAHLLOKOSA-N 354.476 0.877 10 10 FCCE COc1cccc(CNC(=O)c2nnc(C(C)(C)S(C)(=O)=O)o2)c1O 1150542474 AQRQWEAZGCEVRD-UHFFFAOYSA-N 369.399 0.994 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3COC[C@@H](C2)O3)cc1F 1321935282 OVCBBBWAAGPDLP-BETUJISGSA-N 351.378 0.134 10 10 FCCE CCN1CC[C@@H](NC(=O)C(=O)NCCCSc2nccs2)C1=O 1336125862 QOEKNYRLGCQAMT-SNVBAGLBSA-N 356.473 0.479 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC[C@H](C)S(C)(=O)=O)cc2)CC1 1353352187 DFHFJSKMRCEFLV-AWEZNQCLSA-N 353.488 0.878 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)Nc2ccc(N)cc2)[C@@H](O)C1 2076784721 NNUKPXWMLIDWPF-SUMWQHHRSA-N 351.403 0.940 10 10 FCCE CC[C@H](CO)N1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 270783610 SYXIAFWEXHZHCY-CYBMUJFWSA-N 371.459 0.292 10 10 FCCE COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C(=O)c1ccc(C)c(O)c1O 780992782 DXLRWLBRBGRMFB-NDBYEHHHSA-N 363.366 0.971 10 10 FCCE COc1cc(OC)cc(N(C)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c1 786235561 KPJRKZCMPXMSAA-SREVYHEPSA-N 359.382 0.777 10 10 FCCE Cn1nncc1CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 822938843 ZGIGTQIOXJZARF-AWEZNQCLSA-N 356.430 0.376 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)C[S@](C)=O)C2)cc1 829182222 LPWKERHYVHRPLX-OCDDVZBJSA-N 367.471 0.273 10 10 FCCE O=C(CN1CC[C@@]2(O)C[C@H]2C1)NCc1ccc(N2CCOCC2)c(F)c1 852536069 ATVGECQAAYRMHJ-HNAYVOBHSA-N 363.433 0.735 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)NCC3(N)CCOCC3)ccc21 861750671 TVDHSRURXRUAPE-UHFFFAOYSA-N 360.458 0.309 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1CC(F)(F)C[C@@H]1CO 1117372836 CCFUMQWHNAJQEK-SECBINFHSA-N 365.427 0.970 10 10 FCCE O=C1CCCN1C[C@@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1329440617 BUANITYCEOOZPS-ZDUSSCGKSA-N 357.410 0.705 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(C)C[C@@H](O)CN3)cc2)CC1 1343649583 WGAPFKWVIFVIRO-MJGOQNOKSA-N 360.458 0.084 10 10 FCCE CCOc1ccc(N2C(=O)NC(=O)C(=CNN3CCOCC3)C2=O)cc1 2296936011 UPUOVIVSZPGFCC-UHFFFAOYSA-N 360.370 0.389 10 10 FCCE COc1ccc(OCCS(=O)(=O)NC[C@@]2(OC)C=C[C@@H](OC)O2)cc1 70877779 UHOUWCDEZAXLOH-JKSUJKDBSA-N 373.427 0.895 10 10 FCCE NC(=O)N[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 270740293 NDBNKGJDEPDPMZ-CYBMUJFWSA-N 365.409 0.615 10 10 FCCE CC(=O)C(=O)COC(=O)CNS(=O)(=O)c1ccc(Cl)c(Cl)c1 808495208 ODQZNSRSPOQJKJ-UHFFFAOYSA-N 368.194 0.973 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCCNC(=O)c3cc[nH]n3)C2)cc1 852248215 RAGODNZYJQCCEE-ZDUSSCGKSA-N 372.429 0.726 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CC[C@@H](C)NC3)C2)cc1 861804515 QYQVMAHYIBTJMS-ILXRZTDVSA-N 360.458 0.647 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1 1143202529 IJSRXZRTQSQKDE-HNNXBMFYSA-N 366.399 0.879 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1 1294155629 GLRYCVWKADWAIY-LLVKDONJSA-N 351.384 0.835 10 10 FCCE COC(=O)COCC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1616600807 VAGGYTSRJNRFGU-UHFFFAOYSA-N 363.414 0.194 10 10 FCCE CN(C)c1ccc([C@@H](CNC(=O)c2nc(N)nc(N(C)C)n2)N(C)C)cc1 1637004664 KPOJDRWTFVECIA-CQSZACIVSA-N 372.477 0.619 10 10 FCCE O=C(c1c(F)ccc(O)c1O)N1CCC(N2CCCS2(=O)=O)CC1 1638795737 IUOXAZMHDIAHQK-UHFFFAOYSA-N 358.391 0.877 10 10 FCCE C[C@H](NC(=O)[C@@H]1[C@H](O)[C@H](O)CN1C(=O)OC(C)(C)C)c1ccccc1O 2136132653 JSQBTKVTBHOFJU-OADPDTJPSA-N 366.414 0.911 10 10 FCCE O=C(O)[C@@H]1[C@@H](O)[C@H](O)CN1Cc1cc(Cl)cc(Br)c1O 2200842990 CKYQVJUNFJGCOY-YWVKMMECSA-N 366.595 0.799 10 10 FCCE C[C@@H](C(=O)N(C)[C@@H]1CCS(=O)(=O)C1)N1CCCc2cc(CN)ccc21 843349481 AXEKCQLMANUMJR-XJKSGUPXSA-N 365.499 0.932 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC(F)(F)CN)C2)cc1 851689398 OKTJMQHTKLHAHJ-NSHDSACASA-N 356.373 0.100 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCc3cc(C(N)=O)no3)C2)cc1 852222736 KDADIIUZZPVHGR-LLVKDONJSA-N 359.386 0.860 10 10 FCCE CN(C[C@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1)S(C)(=O)=O 1568887815 GTCVGVOGIWOTGJ-CYBMUJFWSA-N 356.444 0.770 10 10 FCCE CC1(C)O[C@H]2[C@@H](CO[C@]3(COS(=O)(=O)N=[N+]=[N-])OC(C)(C)O[C@H]23)O1 256004525 ULLWHTAOFMDWSA-JXVAYASWSA-N 365.364 0.956 10 10 FCCE CS(=O)(=O)CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768916094 SCEPNVSYBJCQFY-UHFFFAOYSA-N 365.499 0.879 10 10 FCCE NC(=O)[C@H]1CC[C@@H](CNC(=O)NCc2cc(Br)ccc2O)O1 805201355 UBBOZWXTFKNPOL-CMPLNLGQSA-N 372.219 0.987 10 10 FCCE CCn1ncc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 815073979 DPGIEGVBDXEUPG-CQSZACIVSA-N 356.430 0.930 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CC(=O)N(CCN(C)C)C3)C2)cc1 855232651 WGTPGJCLAPGPJX-CVEARBPZSA-N 374.485 0.800 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCn1cnnn1 1466397842 FIIYRRBCUZKJDZ-UHFFFAOYSA-N 353.766 0.624 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN1C(C)=O 1633473319 MRTPZHXISZALJO-UONOGXRCSA-N 364.398 0.699 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCNC(=O)C3)cc2)CC1 1687631929 HJERYESESAQAKX-UHFFFAOYSA-N 359.430 0.030 10 10 FCCE O=C(O)CC[C@@H](NC=C1C(=O)NC(=O)N(c2ccccc2)C1=O)C(=O)O 2296562019 WJEWJEIMIJJIPN-LLVKDONJSA-N 361.310 0.061 10 10 FCCE CCN(Cc1cc(O)n2ncc(C(=O)O)c2n1)[C@@H](C)CS(=O)(=O)CC 737851148 HFAXYGJPZFVSEG-JTQLQIEISA-N 370.431 0.778 10 10 FCCE CN(C)C(=O)c1cc(S(=O)(=O)Nc2ccc(O)c(C(=O)O)c2)cn1C 774620078 HOZICMSSVAQDCA-UHFFFAOYSA-N 367.383 0.932 10 10 FCCE CCn1ncc(CNC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)n1 863561015 AXROCBRAOHKMGX-GOSISDBHSA-N 374.489 0.579 10 10 FCCE CC(=O)N1CCO[C@@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 1332963228 CLLXLDFBWNXBAN-QGZVFWFLSA-N 365.405 0.526 10 10 FCCE Cc1c(C(=O)NCc2cc(O)ccc2O)cnc2c1c(=O)n(C)c(=O)n2C 1637125955 IZHFMHDGDLHMLH-UHFFFAOYSA-N 370.365 0.282 10 10 FCCE CCn1c(=O)c2ccccc2n(CC(=O)NCc2cc(O)ccc2O)c1=O 1643879119 APGWZLNGLVNIQO-UHFFFAOYSA-N 369.377 0.911 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNCc1c(O)cccc1F 2218633683 SIUFNHVQOWIRRN-VHDGCEQUSA-N 356.394 0.962 10 10 FCCE CC(=O)OC[C@H]1O[C@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O 616625451 NHNYHKRWHCWHAJ-BJJPWKGXSA-N 373.318 0.380 10 10 FCCE COC1(OC)CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1O 931640121 NKSUSGAHMIBOIA-QGZVFWFLSA-N 365.474 0.767 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H]3CCNC(=O)[C@H]32)c1 1455183830 HXYDTHRKGZZSKN-HZMBPMFUSA-N 367.427 0.504 10 10 FCCE COCCn1cc(N2C[C@@H](C(=O)NCc3ccc(O)c(O)c3)CC2=O)cn1 1465953480 GTZAJWGLSBXSAI-ZDUSSCGKSA-N 374.397 0.610 10 10 FCCE CS(=O)(=O)NCC[C@@H]1CCCCN1C(=O)Cc1ccc(O)c(O)c1 1543256603 WGVXEQKXGGIJIX-ZDUSSCGKSA-N 356.444 0.961 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc(O)nc(O)c2)[C@@H](O)C1 2052705860 NDRPJWCUSXBXHM-MNOVXSKESA-N 353.375 0.593 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@H]1C(=O)Nc1ccc(N)cc1 2311697389 URNHUDCAACXIKW-HZSPNIEDSA-N 351.403 0.939 10 10 FCCE O=C(NCCN1C(=O)CNC1=O)NCc1cc(Br)ccc1O 805111152 RKBKPSZJMFLEMK-UHFFFAOYSA-N 371.191 0.506 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3cncnc3)nc12 811331051 BBMDLAYQFPMQBH-UHFFFAOYSA-N 357.326 0.688 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3CN(C)C(=O)[C@@H]3C)CC2)cc1 830796799 HBHNJZZVKAWDJG-DOTOQJQBSA-N 362.474 0.298 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@@]4(O)C[C@H]4C3)CC2)cc1 852539269 RMCJZBSTRHJWOF-ILZDJORESA-N 361.486 0.635 10 10 FCCE CNS(=O)(=O)C[C@@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 863825100 KZRQVEXQWRETRN-VUDGCMKMSA-N 354.428 0.899 10 10 FCCE CN1C[C@@H](O)C[C@@]1(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 909856539 NQCQPRPLNGIJRA-UGSOOPFHSA-N 369.412 0.873 10 10 FCCE Cn1nc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1C=O 1155603519 CXLUAJPWHPLRPH-UHFFFAOYSA-N 369.425 0.864 10 10 FCCE C[C@H](C(=O)NCc1cc(O)ccc1O)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1558174972 VZXNWVRXCIYDCY-LPCRZITISA-N 360.366 0.265 10 10 FCCE CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@@H]1OC(C)=O 221702405 LJICGUPPWNZTFT-QNSTZXKLSA-N 373.318 0.380 10 10 FCCE CCOC(=O)N1CCN(S(=O)(=O)Nc2ccc(O)c(OC)c2)CC1 280545063 IKXVPCNZBORXOP-UHFFFAOYSA-N 359.404 0.832 10 10 FCCE C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCS1(=O)=O 738544267 LJHAUPYQEBQBOH-VIFPVBQESA-N 362.429 0.023 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 808517880 QMDITDKMWVZTHL-VIFPVBQESA-N 354.340 0.962 10 10 FCCE CNC(=O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 817154654 NJSBEUSDYWWNDN-CQSZACIVSA-N 364.421 0.940 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N[C@@H]3CCCCNC3)C2)cc1 818678213 WWSOPNUERDRMOE-JKSUJKDBSA-N 374.485 0.896 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)CS(=O)(=O)N(C)C)C2)cc1 819585871 JAVYOYYTTZYTJR-ZDUSSCGKSA-N 355.460 0.529 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC3(N(C)C)CCC3)C2)cc1 828417563 CWPAJMGVHMMOIV-OAHLLOKOSA-N 374.485 0.991 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2C[C@H]3CC[C@H]2CN3)cc1 846362759 LAZASMBAXMQCMS-ZBFHGGJFSA-N 360.458 0.553 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=S)NCCS(C)(=O)=O)C2)cc1 849270294 AVQIRZIOFVKMDL-GFCCVEGCSA-N 357.501 0.783 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](C)S(N)(=O)=O)C2)cc1 852452131 SNWXZRSYAGNMKA-NWDGAFQWSA-N 356.448 0.250 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)CCCc3nn[nH]n3)cc2)CC1 1154270890 DVCPAUHDWBSFFY-UHFFFAOYSA-N 371.445 0.507 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCc1ncn(C)n1 1326468767 TXQWUOFHYMZTOQ-UHFFFAOYSA-N 358.446 0.589 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC(F)(F)C[C@H]1CO 1328546106 IXIITLZPNRQMCD-AWEZNQCLSA-N 355.385 0.940 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Cn3nccc3N)cc2)C1 1630738295 LAUXIAFIKCYFAJ-CQSZACIVSA-N 356.430 0.483 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCc2ccc(N)cc2)[C@H](O)C1 1890187385 SLCZAQZVGSQESP-RDTXWAMCSA-N 365.430 0.618 10 10 FCCE CN(C(=O)[C@@H]1[C@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2080685585 ADNRYIPCPUYZJD-MELADBBJSA-N 351.403 0.573 10 10 FCCE CC(C)(C)OC(=O)N1CC(C(=O)NCCCN=[N+]=[N-])(S(C)(=O)=O)C1 2306881528 TUSLVKFFIVVQNS-UHFFFAOYSA-N 361.424 0.837 10 10 FCCE COC(=O)C1CCN(S(=O)(=O)Nc2ccc(O)cc2C(=O)O)CC1 274894456 GSGOQKKAVKVBAQ-UHFFFAOYSA-N 358.372 0.632 10 10 FCCE COc1ccc(N2CCN(CCN3C(=O)N[C@H](CF)C3=O)CC2)cc1 287155966 AGZJNPSHSSBNOR-OAHLLOKOSA-N 350.394 0.707 10 10 FCCE CNS(=O)(=O)[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 372742492 QMEAEAAJEJLLFY-QMMMGPOBSA-N 356.360 0.054 10 10 FCCE O=C1NC(=O)[C@]2(CCCN(Cc3ccc(N4CCOCC4)c(F)c3)C2)N1 789768515 IAYKGFNJOOXSDF-GOSISDBHSA-N 362.405 0.836 10 10 FCCE CC(=O)C(=O)COC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O 808505075 RWELMVCVKAMABU-INIZCTEOSA-N 350.302 0.294 10 10 FCCE CN1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1=O 822659763 FWHZTDJMYJEQBZ-RDJZCZTQSA-N 372.469 0.873 10 10 FCCE O=C(CN1CCCCC(=O)C1=O)NCc1ccc(N2CCC(O)CC2)cc1 869295415 UVMUNDCBFPBWKH-UHFFFAOYSA-N 373.453 0.846 10 10 FCCE CCN1CC[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 897475482 UFVTVKOTURRJKW-QGZVFWFLSA-N 360.458 0.350 10 10 FCCE CCN1CC[C@H]1CNC(=O)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 898095924 ITXOIGLQDBHIRB-RDJZCZTQSA-N 374.485 0.848 10 10 FCCE Cc1nccc(N2CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)n1 1261863040 OVJLEYSTMIZUFU-UHFFFAOYSA-N 367.409 0.682 10 10 FCCE Cn1cc([C@@H](O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1 1291872051 RHASTLVTMCPFRJ-RHSMWYFYSA-N 371.441 0.472 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@]2(CNC(=O)C2)C1 1324917760 FXKSVKNALWONCH-LJQANCHMSA-N 359.426 0.869 10 10 FCCE Cc1cc(CC(=O)N2C[C@H](C(N)=O)[C@@H](C(N)=O)C2)c(C)n1-c1ccccc1 1634099304 CBQBLOQCDWPBFC-IRXDYDNUSA-N 368.437 0.682 10 10 FCCE C[C@@H](NC(=O)OC(C)(C)C)c1nnc(COc2nnc(=N)[nH]n2)s1 2213785040 IERHADDJBPROGE-ZCFIWIBFSA-N 354.396 0.695 10 10 FCCE Cc1cc(N2CCN(C(=O)Cc3ccc(N)cc3)CC2)n2ncnc2n1 237808588 YWXKETGFQCFPLB-UHFFFAOYSA-N 351.414 0.906 10 10 FCCE CC(C)C(=O)N1CCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 283513844 OFOMYQKENNLLOI-UHFFFAOYSA-N 360.458 0.696 10 10 FCCE O=C1CC(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)=NN1 768914267 UYDKQSDHICCNAQ-UHFFFAOYSA-N 355.442 0.711 10 10 FCCE COc1ccc(N2CCC(NC(=O)[C@@H]3CCN(C)S3(=O)=O)CC2)cc1 843541595 JATYSFAOFXALKX-INIZCTEOSA-N 367.471 0.814 10 10 FCCE O=C(O)c1cc(NS(=O)(=O)C[C@@H]2CCCS(=O)(=O)C2)ccc1O 844782942 NEBOHFZNMCCGHO-SECBINFHSA-N 363.413 0.657 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NCC[C@@H]2CCNC2)cc1 846342531 DRXQUVSUTZLRIP-HNNXBMFYSA-N 362.474 0.706 10 10 FCCE CC(=O)N1CCO[C@@H](C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C1 891241497 ATUPFYQHOSWOTK-QZTJIDSGSA-N 362.474 0.719 10 10 FCCE CN(C)C(=O)/C=C/C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1141996393 TVHDTIHOTQTDGM-FEAKQIBJSA-N 358.442 0.649 10 10 FCCE Cn1cc(N2C[C@H](C(=O)NCCc3ccc(O)c(O)c3)CCC2=O)cn1 1294913140 MLICNZWUIAABEY-CYBMUJFWSA-N 358.398 0.933 10 10 FCCE COc1ccc(O)c(CNC[C@@H]2[C@@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c1 2225623615 QTGOCJQNPHMYHX-VNQPRFMTSA-N 368.430 0.832 10 10 FCCE COc1ccc(Br)c(CN[C@@H](C)CS(N)(=O)=O)c1O 2227750545 KFMPGSBUHSFLQE-ZETCQYMHSA-N 353.238 0.930 10 10 FCCE CNC(=O)NCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 92643629 PEVIXCRIRRMMEU-UHFFFAOYSA-N 359.474 0.764 10 10 FCCE Cn1nccc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 788501599 FUYZUGLTMQWTPS-INIZCTEOSA-N 372.425 0.950 10 10 FCCE C[C@@H](N)CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 842131040 OSESZGBQLQZNTA-OAHLLOKOSA-N 373.501 0.298 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCS(=O)(=O)C3)C2)cc1 849224544 HROUIQDNYWJJGQ-CHWSQXEVSA-N 353.444 0.760 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)[C@H]3CCCNC3)C2)cc1 851688033 OYILWDXGIDAMKG-JYJNAYRXSA-N 374.485 0.894 10 10 FCCE Cc1cc(CCNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)nn1C 929801695 XHVUBRNQRSHJAB-UHFFFAOYSA-N 361.421 0.909 10 10 FCCE CNS(=O)(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1449415838 QXZHCPOKZPHTMS-UHFFFAOYSA-N 354.392 0.071 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC3(CC2)COCCO3)c1 1633126687 STFZOCZTMDMUPX-UHFFFAOYSA-N 370.427 0.785 10 10 FCCE COc1ccc(N2CCN(CC(=O)N[C@H]3CCS(=O)(=O)C3)CC2)cc1 7489361 BULFIUFWJYNMNB-AWEZNQCLSA-N 367.471 0.121 10 10 FCCE CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)O[C@@H]1CN=[N+]=[N-] 36453584 LFQWTDKRDROWBN-HTOAHKCRSA-N 373.318 0.380 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(C)=O)C[C@H]3C)nc12 268646165 FUEAZLQATSSLQS-LLVKDONJSA-N 361.402 0.664 10 10 FCCE O=C(CN1C[C@@H]2CNC[C@@H]2C1)NCc1ccc(N2CCOCC2)c(F)c1 917084695 BMFAEMGAIUXHTK-IYBDPMFKSA-N 362.449 0.430 10 10 FCCE COc1ccc(N2CCN(C(=O)CCCN3C(=O)CNC3=O)CC2)cc1 920221218 CQMFUDUVPKNPNH-UHFFFAOYSA-N 360.414 0.676 10 10 FCCE COC(=O)N[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 1119531115 WKAIVBLHRBWEQH-HNNXBMFYSA-N 374.441 0.860 10 10 FCCE CONC(=O)CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1251350089 MVBUIOYBTKTJQZ-UHFFFAOYSA-N 350.419 0.372 10 10 FCCE CC(C)N(CCS(C)(=O)=O)C(=O)C(=O)N1Cc2cccc(O)c2C1 1261862600 AVYKDDRIQGYNFK-UHFFFAOYSA-N 354.428 0.516 10 10 FCCE Cn1c(=O)c2ccc(C(=O)NCc3cccc(Cl)c3O)nc2n(C)c1=O 1457037419 LSKLMOBFEMPBQZ-UHFFFAOYSA-N 374.784 0.921 10 10 FCCE COC(=O)c1nc(=NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc[nH]1 1640418048 DWUKPEIQXMLGIJ-UHFFFAOYSA-N 369.425 0.999 10 10 FCCE O=C(NCc1c(O)cccc1O)[C@@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1647289883 LEPUZKPYNADITG-RKDXNWHRSA-N 353.318 0.937 10 10 FCCE CN(CC1(O)CN(C(=O)OC(C)(C)C)C1)C(=O)c1cc(O)nc(O)c1 2259125807 UFCZNUZMZJDAGA-UHFFFAOYSA-N 353.375 0.547 10 10 FCCE COc1ccc2c(c1)N(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)CCO2 266361928 PMLGMMVTOBSLQD-QPJJXVBHSA-N 357.366 0.531 10 10 FCCE CN1CCN(C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c2cc(F)ccc21 742781439 XGAGYEUXUREIDS-DAXSKMNVSA-N 358.373 0.719 10 10 FCCE Cc1nn(CCS(=O)(=O)NCc2ccc(N3CCCC3)cc2)c(=O)o1 825303379 AJBYSMYVVUHBMD-UHFFFAOYSA-N 366.443 0.865 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@H](C)S(N)(=O)=O 841588881 HNEJLBYLBGDPIR-OLZOCXBDSA-N 356.492 0.968 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)C[C@@H]1CNCCO1 866744336 LHWLDDKDXZJZRF-KRWDZBQOSA-N 369.487 0.273 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)[C@@H](O)C(C)(C)O)CC2)cc1 900014105 DSNWNAXXAPQLSA-QGZVFWFLSA-N 365.474 0.455 10 10 FCCE O=C1C[C@@H](CCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CN1 1351301611 MDTXDZZUZVVRJM-OAHLLOKOSA-N 356.426 0.321 10 10 FCCE Cn1c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cnc1O 1441949404 WGTZFUFBXBCQSU-CYBMUJFWSA-N 357.414 0.757 10 10 FCCE COc1ccc(N2CCN(C(=O)CSc3ncnc(N)n3)CC2)cc1 197819471 IIYQFKWFZXBLRP-UHFFFAOYSA-N 360.443 0.903 10 10 FCCE Cc1nc(CN2CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC2)no1 757509474 URCDSBMEDNFGMR-UHFFFAOYSA-N 374.357 0.939 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNC3COCCOC3)CC2)cc1 819325583 DPDVQQJQYVPKBD-SFHVURJKSA-N 365.474 0.183 10 10 FCCE COC(=O)CCNC(=O)CCNC(=O)N[C@H](C)c1cc(OC)ccc1O 858903479 BTGKKZCHTSXXIX-LLVKDONJSA-N 367.402 0.830 10 10 FCCE CCCNC(=O)[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1119003502 HMHRWFRFWPBTMF-AWEZNQCLSA-N 359.426 0.999 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)N[C@@H]([C@@H](N)Cc2ccc(O)c(O)c2)C1 1952970882 NHIUAKOECKEEHB-NWDGAFQWSA-N 351.403 0.703 10 10 FCCE CN(C[C@@H]1CCCO1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 283851248 CSNQFYGPOUYILM-KRWDZBQOSA-N 361.442 0.777 10 10 FCCE CCOC(=O)C[C@H](O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 774012690 GRDRFYOVUXULNZ-INIZCTEOSA-N 368.405 0.717 10 10 FCCE COCC1(CNC(=O)C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 829767587 SHMRRUHLDXTXIS-CQSZACIVSA-N 361.442 0.933 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC[C@@H]3CCNC3)C2)cc1 851688117 QOBURIFZXNPVNO-LSDHHAIUSA-N 360.458 0.506 10 10 FCCE CN(C)c1ccc([C@@H](N)CNS(=O)(=O)[C@@H]2CC(=O)N(C3CC3)C2)cc1 866757024 HLJBIWCSSDBNCM-CVEARBPZSA-N 366.487 0.435 10 10 FCCE O=C(CN1C(=O)CCC1=O)N1CCN(Cc2cc3c(cc2O)CCC3)CC1 918179922 ISAHTDYLTOKWTD-UHFFFAOYSA-N 371.437 0.674 10 10 FCCE CC(=O)O[C@H]1[C@@H](OC(C)=O)[C@@H](CN=[N+]=[N-])O[C@H](OC(C)=O)[C@H]1OC(C)=O 1083804964 LFQWTDKRDROWBN-QMVSFRDZSA-N 373.318 0.380 10 10 FCCE CN(C)C(=O)N(C)[C@@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1118956643 AMQZSZNTYJVLQP-CYBMUJFWSA-N 360.414 0.449 10 10 FCCE CCN(OC)C(=O)CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1326077661 DPPSQVFXNATDMJ-UHFFFAOYSA-N 354.382 0.034 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)NCCN2CCS(=O)(=O)CC2)cc1 1626876270 DWEUNHJGMVKMJP-UHFFFAOYSA-N 353.404 0.309 10 10 FCCE CC1=NNC(=O)[C@@H]1CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1628269770 HXNOSCHBZCJHRV-SNVBAGLBSA-N 354.388 0.006 10 10 FCCE CN1C[C@@H](C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)NC1=O 1634974451 TVOCBDLGFPWSPW-HNNXBMFYSA-N 359.430 0.028 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CN(C)CCN3C)C2)cc1 852092895 WTTCMVAGMKCGQO-RDJZCZTQSA-N 361.490 0.819 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)C1=C2CCCN=C2NN1 1142689837 CRIATRIZBRCGNR-UHFFFAOYSA-N 358.398 0.838 10 10 FCCE COc1cccc(O)c1CNC1(C(N)=O)CN(C(=O)OC(C)(C)C)C1 2042579491 OPOJAUJNRRXBOY-UHFFFAOYSA-N 351.403 0.965 10 10 FCCE C[C@@H](NC(=O)c1cc(O)c(O)c(O)c1)C1(O)CN(C(=O)OC(C)(C)C)C1 2132349080 YAPPKBRAUJVMPY-SECBINFHSA-N 368.386 0.904 10 10 FCCE O=C(c1cc(O)c(O)c(O)c1)N1CCCN(C(=O)[C@H]2CCCO2)CC1 169846327 WMYQDRXLBXGZJC-CQSZACIVSA-N 350.371 0.657 10 10 FCCE C[C@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CN1 861786792 QWOBFESTQLXQKD-GOEBONIOSA-N 374.485 0.521 10 10 FCCE COC(=O)/C=C/c1ccc(N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)c([N+](=O)[O-])c1 1472856407 WGCRBHIDKITTKR-FVSXHXCTSA-N 359.338 0.832 10 10 FCCE O=C1NC[C@H](Cn2cc(C(=O)NCc3ccc4cccnc4c3O)nn2)O1 1557122898 KWRXLVGZQRBZQJ-GFCCVEGCSA-N 368.353 0.570 10 10 FCCE CNC(=O)CC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 774030988 NXBIEFWRJMFEBW-UHFFFAOYSA-N 351.403 0.497 10 10 FCCE Cc1cc(Br)c(O)c(CN2CCN3C(=O)C(=O)NC[C@@H]3C2)c1 781911229 YQTVZCDJTSKGIS-LLVKDONJSA-N 368.231 0.606 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)Cc3ccn(C)n3)CC2)cc1 782606544 DUSHZHNOVOSWNZ-UHFFFAOYSA-N 357.458 0.910 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2CCNC[C@@H]2C)cc1 846344722 TWTTZUCLMJQINW-YOEHRIQHSA-N 362.474 0.704 10 10 FCCE Nc1ccc(NC(=O)C(=O)N[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)cc1 850852937 NTQRXJAEKDEGCW-HZPDHXFCSA-N 358.442 0.967 10 10 FCCE C[C@@H](NC(=O)N1CCC(CO)(CO)C1)c1ccc(N2CCOCC2)cc1 853487164 LFYYKWKAMSGGKZ-OAHLLOKOSA-N 363.458 0.971 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CC(C(N)=O)=NO3)C2)cc1 854050352 AKQXRMYKCGWXAK-SMDDNHRTSA-N 361.402 0.203 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(COC(=O)COCC(F)F)nc12 860044745 BDPLIIFSVUZGIC-UHFFFAOYSA-N 359.285 0.937 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 1334069210 GBTSKZPFYYEHDH-WKULXVSPSA-N 353.422 0.971 10 10 FCCE COC(=O)/C=C/c1ccc(N2C[C@H](O)C[C@@H]2C(=O)OC)c([N+](=O)[O-])c1 1651347586 CYZWSANTZGZEGM-JDRNFJBZSA-N 350.327 0.894 10 10 FCCE CN(C)c1ccc([C@@H](NC(=O)[C@H](N)Cc2cnc[nH]2)c2nccn2C)cc1 1866032148 DEEWCFSYNWIKIG-IAGOWNOFSA-N 367.457 0.985 10 10 FCCE CN1CCN(c2ccc(CN3CC[C@H](NS(C)(=O)=O)C3)cc2)CC1 775706395 QKHMXEPEBLZURU-INIZCTEOSA-N 352.504 0.562 10 10 FCCE CC(=O)C(=O)COC(=O)c1cc(S(=O)(=O)N2CCC[C@@H](C)C2)cn1C 808515982 UEUHGDSXZDBOGT-LLVKDONJSA-N 370.427 0.761 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](O)Cn3ccnn3)C2)cc1 852448656 LJZDECWKDJFYQG-HIFRSBDPSA-N 360.418 0.226 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCN4CCOC[C@@H]4C3)C2)cc1 854299835 SBWHGIUHVVEYQP-RDJZCZTQSA-N 360.458 1.000 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@]3(C)CNC[C@]3(C)C2)cc1F 861749694 GWXKITCMVOVDNY-KDURUIRLSA-N 362.449 0.966 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3[C@H]4CC[C@H]3CN(C)C4)CC2)cc1 931392049 OXWKNYPKQKAQQR-UFYCRDLUSA-N 374.529 0.957 10 10 FCCE C[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCN1CC(C)(C)O 1351906768 JKQIEEQGHGBNDW-CYBMUJFWSA-N 361.442 0.538 10 10 FCCE CS(=O)(=O)CC1(C(=O)NCCCSc2nccs2)COC1 1520987203 RYUCKJIYJNZDMG-UHFFFAOYSA-N 350.487 0.803 10 10 FCCE O=C(c1cccc(O)c1O)N(C[C@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 1597768964 FKUBNTSSHWTANL-NWDGAFQWSA-N 355.412 0.906 10 10 FCCE CN(C)c1ccc([C@@H](NC(=O)[C@@H](N)CCC(=O)O)c2nccn2C)cc1 1866022537 YKRPYIIMSUZXPW-GOEBONIOSA-N 359.430 0.884 10 10 FCCE CC(C)(C)OC(=O)N1CC(CO)(NC(=O)c2cc(O)c(O)c(O)c2)C1 2068565253 AWDCJXBBNJVBLC-UHFFFAOYSA-N 354.359 0.515 10 10 FCCE O=S1(=O)C[C@H]2NCCN(Cc3c(O)cccc3Br)[C@H]2C1 2143710894 BXEOQLSOZGISFJ-NEPJUHHUSA-N 361.261 0.726 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H]2OCCC[C@@]2(COc2nnc(=N)[nH]n2)C1 2222986740 QYYCFKQOERJLQJ-BMIGLBTASA-N 352.395 0.474 10 10 FCCE COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CCC(=O)O3)CC2)cc1 770500659 HWRNUGCNRMDBME-OAHLLOKOSA-N 362.382 0.593 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H](C)Cn3cccn3)C2)cc1 826972722 LLVBVFNYEFGQTM-LSDHHAIUSA-N 371.441 0.792 10 10 FCCE CC[C@H](CNC(=O)C(=O)N(C)CCN(C)c1ccc(OC)cc1)C(=O)O 927957085 HVCBRENYQZMYAD-CYBMUJFWSA-N 365.430 0.817 10 10 FCCE CN1CCN(c2ccc(/C=C3/C(=O)NC(=O)N(C)C3=O)cc2[N+](=O)[O-])CC1 1084462110 ZHOIDAMZSMGUJO-XFXZXTDPSA-N 373.369 0.438 10 10 FCCE Cc1ccc(C)n1-c1ccsc1C(=O)N1C[C@H](C(N)=O)[C@@H](C(N)=O)C1 1149187593 QVHKFMMNRJCGRJ-RYUDHWBXSA-N 360.439 0.814 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(C)C[C@@H](O)CN3)cc2)CC1 1343649581 WGAPFKWVIFVIRO-IEBWSBKVSA-N 360.458 0.084 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1C[C@@H](CO)[C@@H](O)C1 1681849667 DSUXCQCIEWXWTQ-WFASDCNBSA-N 371.384 0.296 10 10 FCCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CCS(=O)(=O)C1 2060637074 GIOLUTNJTFPSLT-IINYFYTJSA-N 373.435 0.980 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@@H]1C(=O)NCCCCN=[N+]=[N-] 2064133717 XYNGPUMKNGEGNX-TUAOUCFPSA-N 357.411 0.924 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2081034265 GBXAENVXUUQASV-WRWGMCAJSA-N 355.395 0.629 10 10 FCCE O=C(CN1C(=O)c2ccccc2C1=O)NCCN1C(=O)CSC1=S 49755787 FVIVLTFPZIJTMZ-UHFFFAOYSA-N 363.420 0.259 10 10 FCCE CC(=O)Nc1cccc(C(=O)NCCNC(=O)c2cc(O)c(O)c(O)c2)c1 169839020 LLXTWFXCPHQJTH-UHFFFAOYSA-N 373.365 0.922 10 10 FCCE Cn1nc(N2CCCC[C@@H]2CNC(=O)c2cc(O)nc(O)c2)ccc1=O 585608702 HMNIZPQPGVYAPD-GFCCVEGCSA-N 359.386 0.375 10 10 FCCE CNC(=O)[C@@H]1CCN(C(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 817764198 QQWCYWGWDDAKOP-OAHLLOKOSA-N 372.469 0.838 10 10 FCCE CNCCOCCN(C)C(=O)NCc1ccc(N2CCOCC2)cc1 861564788 NRFWZYGWPYMBRG-UHFFFAOYSA-N 350.463 0.901 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 861783152 SIEAPOGJUNGPLT-FHLIZLRMSA-N 374.485 0.894 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCNC(=O)CC34CCC4)nc12 1197565560 UXJORPQWSYQWHD-UHFFFAOYSA-N 373.413 0.856 10 10 FCCE Cc1noc(C)c1S(=O)(=O)NCC(=O)NCc1c(O)cccc1F 1651239805 KLNLCDNJOVUYBY-UHFFFAOYSA-N 357.363 0.731 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2127629461 IZUVKJOTHMTJER-RVMXOQNASA-N 369.422 0.876 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2311714772 HFWNOOKCTHKEAI-WISYIIOYSA-N 355.395 0.486 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCN(C4CC4)C(=O)C3)nc12 748830947 OHEYLSWZAPATDL-UHFFFAOYSA-N 359.386 0.418 10 10 FCCE CNC(=O)CCOC1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768462563 AFNQDXWWLLDEOO-MRXNPFEDSA-N 350.415 0.935 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@@H]([C@@H](C)O)C1 840981471 VFVUMKZHSAJBLX-CZUORRHYSA-N 350.415 0.739 10 10 FCCE COC(=O)C12CC(CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O)C2 855523354 UTTWJUYYKAZHAA-UHFFFAOYSA-N 354.384 0.541 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(CN)CCCOC3)cc2)CC1 876910409 ZAVLASJFATXNDY-FQEVSTJZSA-N 374.485 0.727 10 10 FCCE CN1C[C@@H](O)C[C@]1(C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 924251794 FOZRJDAZMGHTPZ-FXAWDEMLSA-N 374.485 0.460 10 10 FCCE N[C@H]1CCCO[C@@H]1C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1118976136 OQFITHZCRKHBKB-FUHWJXTLSA-N 373.453 0.979 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CC(=O)N(CCN(C)C)C1 1140198780 SEOFQPZTDTZLNU-CYBMUJFWSA-N 354.447 0.904 10 10 FCCE O=C(CCCn1c(O)nnc1O)NCc1ccc(N2CCOCC2)cc1 1464447600 CPAWAHQGZPACES-UHFFFAOYSA-N 361.402 0.623 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cc(CO)on3)cc2)CC1 1644863274 FGRPQZRAHQZMPB-UHFFFAOYSA-N 358.398 0.799 10 10 FCCE O=C(CCN1C(=O)CSC1=S)N1CCN(C(=O)c2ccco2)CC1 1865766219 XGOGYAZYZGMDFZ-UHFFFAOYSA-N 367.452 0.814 10 10 FCCE CN[C@@H]1C(=O)Nc2cc(N3CCO[C@H](CO)C3)c(Br)cc21 167220144 LQLLEKJMPLYZEI-SDBXPKJASA-N 356.220 0.859 10 10 FCCE CCOC(=O)C[C@@H](O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 773727872 YGVPASGMMLMWKH-MRXNPFEDSA-N 350.415 0.796 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)C[S@@](C)=O)C2)cc1 829182224 LPWKERHYVHRPLX-UXGGDIESSA-N 367.471 0.273 10 10 FCCE C[C@@H]1CC[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CN1 861805692 JMNTVRWGBNAXMZ-NVXWUHKLSA-N 374.485 0.738 10 10 FCCE CS(=O)(=O)N=S1(=O)CCN(Cc2ccc(F)c(F)c2O)CC1 894829543 VDFYBEONXCLFIS-UHFFFAOYSA-N 354.400 0.914 10 10 FCCE CN1C[C@H](CCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1=O 929805742 VIFIXBJNHPGAQE-OAHLLOKOSA-N 372.469 0.670 10 10 FCCE CCN1C(=O)[C@H]2CN(c3nnc(-c4sccc4O)n3C)CCN2C1=O 1350468002 CVMZPZPDXCZZPP-SECBINFHSA-N 362.415 0.722 10 10 FCCE O=C(N[C@@H](CO)C(=O)NCCc1ccc(O)c(O)c1)c1cccc(F)n1 1566370024 JLTNOJMVMLJAQN-LBPRGKRZSA-N 363.345 0.082 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CS(=O)(=O)CCOC 1630481601 WDCQVUGSEASHBL-UHFFFAOYSA-N 373.427 0.345 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@H]3CCOC3=O)cc2)CC1 1685043332 ZDMZROQCUBYAIN-HNNXBMFYSA-N 360.414 0.503 10 10 FCCE Cc1cccc(N2C(=O)C(=CNN3CCN(C)CC3)C(=O)NC2=S)c1 2296136192 SYXCCDOXMJUFQI-UHFFFAOYSA-N 359.455 0.379 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)Cn3cncn3)CC2)cc1 818981356 RTOXWMNDOQZWPZ-AEFFLSMTSA-N 374.489 0.448 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N(C)CCCCO)C2)cc1 824981364 UCJDZWYZHPMYIX-HNNXBMFYSA-N 363.458 0.869 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(C)(CO)C3)CC2)cc1 836873042 NONZPAQIKZZWAI-BQYQJAHWSA-N 373.453 0.741 10 10 FCCE C[C@]1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CN2CCC1CC2 912377439 NDORXHQKTDNNIB-INIZCTEOSA-N 353.444 0.978 10 10 FCCE CC(C)N1C(=O)CN(C(=O)C(=O)NCCc2ccc(N)cc2)CC1(C)C 842242156 PBHRXEWPORJHLD-UHFFFAOYSA-N 360.458 0.785 10 10 FCCE Cc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)c(N(C)C)nn1 850400910 PPMDLNYMLZTUJP-UHFFFAOYSA-N 359.386 0.560 10 10 FCCE COc1ccc(N(CC(=O)O)CC(=O)NC[C@@H](OC)[C@@H]2CCOC2)cc1 853010550 FOQDIDIFZSSODV-CZUORRHYSA-N 366.414 0.754 10 10 FCCE NC[C@@H]1CC2(CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)CO1 1119636250 KVCZIZJUSIAXCX-AWEZNQCLSA-N 359.426 0.591 10 10 FCCE COc1ccc(CNC(=O)C(=O)Nc2cnn(-c3ncccn3)c2)c(O)c1 797388896 FGCJKMDECHNQKY-UHFFFAOYSA-N 368.353 0.631 10 10 FCCE Cn1cnc(CCCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)n1 1261468810 NGRZDBTZLAIKPT-UHFFFAOYSA-N 368.441 0.557 10 10 FCCE O=C1c2ccccc2C(=O)N1C[C@H](O)Cn1ccc2c(c1=O)CNCC2 1994834429 IXEKACDKAWSALE-CYBMUJFWSA-N 353.378 0.151 10 10 FCCE Cn1cccc1C=C1SC(=S)N([C@@H](CCC(N)=O)C(=O)O)C1=O 2314541803 QITHPCWXFFJHFG-VIFPVBQESA-N 353.425 0.945 10 10 FCCE Cc1cccc(CNC(=O)C(CO)(CO)NC(=O)OC(C)(C)C)c1O 2320978431 GCKVXHRNOSBSIZ-UHFFFAOYSA-N 354.403 0.565 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NCC(C)(C)O)CC2)cc1 264516516 GTRDDOSAKJBTGH-UHFFFAOYSA-N 350.463 0.887 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)[C@H]1CCN(S(C)(=O)=O)C1 814171734 RAUBLZVTZDLQRC-KRWDZBQOSA-N 353.488 0.989 10 10 FCCE Cn1ncnc1CCCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 862088647 XLHVIPYMPAVFCW-UHFFFAOYSA-N 353.404 0.255 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N(C)C[C@@H]3CCCO3)cc2)CC1 898323277 AVCFDWZRSIEXFL-SFHVURJKSA-N 374.485 0.692 10 10 FCCE Cc1nc(C(=O)NCc2ccc3cccnc3c2O)nn1-c1nc[nH]n1 1162606991 DJRCRQLTKMXHRM-UHFFFAOYSA-N 350.342 0.878 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H]3CC[C@@H](O)C[C@H]3C2)c1 1300777382 VJZREBPYRMWXSL-NTZNESFSSA-N 354.428 0.997 10 10 FCCE Cn1cc([C@@H]2CS(=O)(=O)CCCN2C(=O)c2cccc(O)c2O)cn1 1303543502 KZHOAKDKNWGXKU-ZDUSSCGKSA-N 365.411 0.833 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@]3(CNC(=O)C3)C2)c1 1320977644 ZEEJWQBLKAGKDJ-HNNXBMFYSA-N 353.400 0.116 10 10 FCCE CCS(=O)(=O)N[C@H](CCSC)C(=O)NCc1cc(O)ccc1O 1644752675 OUJLHHMEKPLSFS-GFCCVEGCSA-N 362.473 0.775 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCOC[C@@H]1CCO 758380118 FSCQJQHIHWOCKA-HNNXBMFYSA-N 367.421 0.955 10 10 FCCE CS(=O)(=O)C[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 813628463 NTWBTJCALOASNN-VIFPVBQESA-N 355.372 0.797 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)Cc3cnnn3C)cc2)CC1 832795275 YUJNQMTXOKKIDG-UHFFFAOYSA-N 356.430 0.343 10 10 FCCE COC(=O)[C@@H]1CC[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)O1 858625948 HMSAWRNVXDTFMJ-CVEARBPZSA-N 366.389 0.999 10 10 FCCE Cc1nn(CC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(=O)o1 880264806 JMSPCWRBZCLSHS-UHFFFAOYSA-N 368.340 0.576 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCc1ccc(S(=O)(=O)CCO)cc1 1156964377 JKVXPWZTZPJAJE-UHFFFAOYSA-N 365.407 0.723 10 10 FCCE NS(=O)(=O)c1ccc(C(=O)NCc2ccc3cccnc3c2O)cn1 1299726321 RNUPYBGDNNIBQU-UHFFFAOYSA-N 358.379 0.913 10 10 FCCE CN1CCN(c2ccc(CNC(=O)CN(C)[C@@H]3CCC[C@H]3O)cc2)CC1 1633252328 KAQDUEMDRJCSAG-RTBURBONSA-N 360.502 0.900 10 10 FCCE CN(C)c1ccc([C@H](CNC(=O)c2nc(N)nc(N(C)C)n2)N(C)C)cc1 1637004663 KPOJDRWTFVECIA-AWEZNQCLSA-N 372.477 0.619 10 10 FCCE Cn1nnc(Br)c1S(=O)(=O)N1CC[C@H](CN=[N+]=[N-])C1 1912143948 MIJWIUWVWPKSME-ZCFIWIBFSA-N 350.202 0.899 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](O)[C@@H](N)C(=O)O 1952205354 WIPCCMLXTYNHQK-OASPWFOLSA-N 356.375 0.306 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](CO)c2cccnc2)c1 807850722 KQAKZTVVQIMUGT-LBPRGKRZSA-N 365.411 0.665 10 10 FCCE CNC(=O)[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 817822160 AQEQEFZKIFFRGG-JTQLQIEISA-N 356.473 0.336 10 10 FCCE C[C@@H]1CCN(CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 847360991 GRDQBPXIZNPWND-OAHLLOKOSA-N 365.499 0.879 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC(C(=O)O)C3)cc2)C1 857096873 JAZZMZWXFBITTF-ZDUSSCGKSA-N 360.414 0.614 10 10 FCCE CC(=O)N1CCN(C(=O)CCNC(=O)N2Cc3cccc(O)c3C2)CC1 875306160 JQRROMKFPBCZDJ-UHFFFAOYSA-N 360.414 0.498 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3CCC[C@]3(C(N)=O)C2)cc1 929237270 ITJLVKYLKUVLTP-LIRRHRJNSA-N 358.442 0.483 10 10 FCCE C[C@@H]1CC[C@@H](NC(=O)C(=O)C(=O)C(=O)NC[C@H]2C[C@H]3C=C[C@H]2CC3)CN1 1331763226 WUMIJHOHFXXRQC-GZBLMMOJSA-N 361.442 0.100 10 10 FCCE COc1cccc(CNC(=O)c2c3c(nn2C)CCS(=O)(=O)C3)c1O 1631542320 HKVQNIRRMYIPJF-UHFFFAOYSA-N 365.411 0.535 10 10 FCCE CCc1c(C(=O)NCc2ccccc2O)cnc2c1c(=O)n(C)c(=O)n2C 754084794 BOEQMNBWRWKRQN-UHFFFAOYSA-N 368.393 0.830 10 10 FCCE CNC(=O)c1ccccc1N(C)C(=O)C1=CC=CN2CCS(=O)(=O)N=C12 1133455309 FPUJKKJQJKVWOX-UHFFFAOYSA-N 374.422 0.507 10 10 FCCE C[C@H]1C[C@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C(=O)O1 1254871298 FGJUPSDFGRQKOV-LRDDRELGSA-N 374.441 0.892 10 10 FCCE COc1nn(C)cc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1456987958 AMEPVBTVYINVFP-UHFFFAOYSA-N 354.388 0.436 10 10 FCCE CON(C)C[C@@H](O)Cn1cc(NC(=O)/C=C/c2ccc(O)c(O)c2)cn1 1466115071 UMHNUPFRXLDGRR-YVARQFDVSA-N 362.386 0.800 10 10 FCCE NS(=O)(=O)N1CCc2ccc(NC(=O)Cc3ccc(O)c(O)c3)cc21 1626179038 OSOGCYMIHYQLMU-UHFFFAOYSA-N 363.395 0.845 10 10 FCCE CCOC(=O)CNC(=O)C1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 1638503234 KXAKRVJLVQNLIT-UHFFFAOYSA-N 368.361 0.768 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2311715063 NUBFXFPQKQRRLE-GRYCIOLGSA-N 355.395 0.629 10 10 FCCE O=C(CN1C(=O)CSC1=S)N1CCC[C@@H](Oc2ncc(F)cn2)C1 585340804 FWJYWMKULSVSNK-SNVBAGLBSA-N 370.431 0.846 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C1(n2cnnn2)CCOCC1 823291970 KNTXSTVDQIUSAS-UHFFFAOYSA-N 372.429 0.332 10 10 FCCE COc1ncc(CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cn1 863443847 CUFORFZFOBBXFQ-UHFFFAOYSA-N 366.399 0.535 10 10 FCCE CN1CCCc2cc(CNC(=O)NC[C@]3(CO)COCCN3C)ccc21 915389967 HBJALJFPYRMTIA-IBGZPJMESA-N 362.474 0.561 10 10 FCCE CN1CCOC[C@]1(CO)CNCc1ccc(N2CCOCC2)c(F)c1 922535563 IKXMSXNQJHTSAJ-GOSISDBHSA-N 353.438 0.445 10 10 FCCE Cn1nccc1[C@@H]1COCCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1332075839 XSTNUSJABLACIO-HNNXBMFYSA-N 356.382 0.568 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N[C@@H]3C[C@@H]4O[C@H]3[C@H]3C[C@@H]43)ccc21 1332816997 BCXIKCXHRRXPNY-DZXRDFMUSA-N 355.438 0.977 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](NC(=O)NC)C3)nc12 1653231499 YZWKSYPCPIPFAM-SNVBAGLBSA-N 362.390 0.115 10 10 FCCE O=C(C[C@@H]1NC(=O)NC1=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874179543 JCPCZBXDOXKRMG-ZDUSSCGKSA-N 363.329 0.999 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2077107256 PCFIHUZCOXUHRF-MNOVXSKESA-N 373.435 0.932 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNCc1cc(F)ccc1O 2218612936 GZNFUZBHXZMMHV-VHDGCEQUSA-N 356.394 0.962 10 10 FCCE CC(C)(C)OC(=O)NCC(CO)(CO)NC(=O)CCc1ccc(N)cc1 2265748806 IJUXPFMEOAPIRK-UHFFFAOYSA-N 367.446 0.566 10 10 FCCE CS(=O)(=O)Nc1ccc(NS(=O)(=O)C2CC3(C2)OCCO3)cc1 2295334673 ZRCRKHYGDHRRLL-UHFFFAOYSA-N 362.429 0.705 10 10 FCCE COc1cc(N2CCC[C@@]3(C2)NC(=O)NC3=O)c([N+](=O)[O-])cc1OC 279120932 QDWKCHSFGBJBMJ-HNNXBMFYSA-N 350.331 0.790 10 10 FCCE C[C@H](O)[C@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCO1 823518880 DHUBCKHYUAMLPT-KBXCAEBGSA-N 363.458 0.939 10 10 FCCE CO[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@H]1CCOC1 828437476 OMEKOLAOZSIULL-RDJZCZTQSA-N 363.458 0.845 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NCC12CC(CN1)C2 851685062 MBWBMQBLSYFEDQ-BQTBQCLESA-N 358.486 0.976 10 10 FCCE COc1ccc(N2CCC(NS(=O)(=O)[C@@H]3COC[C@H]3O)CC2)cc1 914045542 PXCXPLITGSMHLA-HZPDHXFCSA-N 356.444 0.343 10 10 FCCE CCN1C(=O)[C@@H]2CN(c3nnc(-c4sccc4O)n3C)CCN2C1=O 1350468286 CVMZPZPDXCZZPP-VIFPVBQESA-N 362.415 0.722 10 10 FCCE COC(=O)[C@@H]1CC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1638621370 WOJUZJHDMKYLTG-ZJUUUORDSA-N 356.400 0.835 10 10 FCCE Cc1cc(Cl)cc(CN[C@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)c1O 271841036 GTINGIXQCDACIX-LSDHHAIUSA-N 374.890 0.941 10 10 FCCE NC(=O)CCN(Cc1ccccc1)C(=O)[C@@H](N)Cc1ccc(O)c(O)c1 311099984 JABYJFQOVNAQOF-HNNXBMFYSA-N 357.410 0.872 10 10 FCCE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(CC(N)=O)C(=O)C1 837976864 FVNZEQFWEJAGHE-UHFFFAOYSA-N 360.439 0.925 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCNS(=O)(=O)c1cccs1 1446427497 NYDONIRKDPLSIV-UHFFFAOYSA-N 356.425 0.797 10 10 FCCE O=C(Nc1c(-c2ccccn2)nc2ccccn12)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1 1450714338 NYSPBKJNHOKXID-CKEIUWERSA-N 366.377 0.748 10 10 FCCE Cn1cc(/C=C\C(=O)N2CCOc3cc(F)c(F)cc32)c(=O)n(C)c1=O 1644295912 JUEHUFCWDRROTB-ARJAWSKDSA-N 363.320 0.801 10 10 FCCE Nc1ccc(-n2nnc(C(=O)Nc3ccc(S(N)(=O)=O)cc3)n2)cc1 1857878951 PMNLVTNSQDQEPV-UHFFFAOYSA-N 359.371 0.144 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC[C@@H](O)CO 2124090626 SFOMZYGFUCGURA-NEPJUHHUSA-N 370.402 0.003 10 10 FCCE O=C(O)[C@@H](NCc1c(O)cccc1Br)C1CS(=O)(=O)C1 2197525237 NDHUCWZNQJMKBS-NSHDSACASA-N 364.217 0.742 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 808502946 WUYDSXRQSKATMV-CYBMUJFWSA-N 353.396 0.789 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CCCCN2CCO)c1 833558816 FYUSSRFBDJNREN-ZDUSSCGKSA-N 371.459 0.340 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H](C)Cn2cncn2)cc1 846726949 LZBNYZQQUKTTAP-CQSZACIVSA-N 374.445 0.386 10 10 FCCE CN1CCOC[C@@H]1CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 858836869 FMSSFSFRGDWJJN-KRWDZBQOSA-N 362.474 0.778 10 10 FCCE CC[C@H](O)Cn1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)nn1 1454009197 XTQLOYRHIKDASE-INIZCTEOSA-N 373.457 0.940 10 10 FCCE CN(CCS(N)(=O)=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1470905812 WUAVTOFVOZWDHX-UHFFFAOYSA-N 370.475 0.078 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3CCC(=O)NC3)cc2)C1 1630738107 JCTOEMAXGJVIGZ-HOTGVXAUSA-N 372.469 0.921 10 10 FCCE C[C@]1(C[C@H]2CCCN2C(=O)c2c(F)ccc(O)c2O)NC(=O)NC1=O 1651014137 HJIKQZDBVDEXRI-VPTHRUTESA-N 351.334 0.830 10 10 FCCE CCc1nn(C)c2c1[C@@H](c1ccc(O)c(O)c1)C(C(=O)NCCO)=C(N)O2 1864019346 JDYLXTAVGCIYEF-CYBMUJFWSA-N 374.397 0.197 10 10 FCCE CC(C)(C)OC(=O)N1CC(CO)(CNC(=O)c2cc(O)c(O)c(O)c2)C1 2137084293 RHKYWRVFPNWCNE-UHFFFAOYSA-N 368.386 0.763 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)C(=O)C3CCC3)CC2)cc1 243723909 PPORMYUDRZRCRJ-UHFFFAOYSA-N 359.426 0.829 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)[C@H]3CN(C)C(=O)N3)cc2F)CC1 826719713 UDABUPREQNTIID-OAHLLOKOSA-N 363.437 0.607 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC=C[C@H]3CO)CC2)cc1 922266725 LEJHYXAFRRCKNM-JJEJIETFSA-N 371.437 0.659 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCN=C4C3=NNN4C)C2)cc1 855227658 ZVOKLYPULDQZIV-WFASDCNBSA-N 356.430 0.615 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@H]4C(=O)NC(=O)[C@H]4C3)C2)cc1 854296863 HDGJCXYLDOSFFQ-DFBGVHRSSA-N 358.398 0.188 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](C)[C@H]3CCC(=O)N3)CC2)cc1 858839434 DTTDGBSYHRXFCH-MAUKXSAKSA-N 374.485 0.848 10 10 FCCE O=S(=O)(C[C@H]1CNCCO1)N(Cc1ccccc1O)C[C@H]1CCCO1 866751197 SSGXRIADKAITTK-HZPDHXFCSA-N 370.471 0.691 10 10 FCCE COC(=O)/C=C\c1ccc(N2CCN3C(=O)NC(=O)[C@@H]3C2)c([N+](=O)[O-])c1 778587830 FYYLZXLMPIPLLU-DXTPNHAXSA-N 360.326 0.521 10 10 FCCE CS(=O)(=O)[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332021024 JICKANITMVIAAG-GFCCVEGCSA-N 352.412 0.270 10 10 FCCE O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1CC=C[C@@H]1CO 1334467173 WGUOQBFMJANKSZ-MRXNPFEDSA-N 361.467 0.615 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCN1C(=O)CNC(C)=O 1634939472 OUHXAULINIRZEY-ZDUSSCGKSA-N 368.430 0.621 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)C(=O)C[C@H]1C[C@H](N)C1 2299077554 HQMGAIIWGYZAJM-DCAQKATOSA-N 362.448 0.190 10 10 FCCE CC(=O)OC[C@H]1O[C@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@@H]1OC(C)=O 85482221 QKGHBQJLEHAMKJ-POQQGIQPSA-N 373.318 0.380 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCC(=O)NC3)CC2)cc1 742919348 GCLKJJHTBIPFRP-OAHLLOKOSA-N 360.458 0.460 10 10 FCCE C[C@H](NC(=O)NC[C@@H](C)S(N)(=O)=O)c1ccc(N2CCOCC2)cc1 799892755 OVDMSEONXZFTQG-OLZOCXBDSA-N 370.475 0.560 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN2C[C@H]3[C@H](OC)CS(=O)(=O)[C@H]3C2)c1O 827388757 ICZQMESNAWMYLB-UHTWSYAYSA-N 372.399 0.553 10 10 FCCE C[C@@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c2ncnn21 827574919 JAIKZSKNNDKFDK-ZWNOBZJWSA-N 360.393 0.922 10 10 FCCE CN1C[C@H](CCNC(=O)C(=O)NCCCSc2nccs2)CC1=O 930197779 KDUDGHHHMLAMOO-LLVKDONJSA-N 370.500 0.726 10 10 FCCE CC(C)NC(=O)[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1261867311 CSXSDJFMCCRCQE-CQSZACIVSA-N 359.426 0.998 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)NCc3nnc(O)n3C)C2)cc1 1312902631 NTPUTIMCGRGUMF-LBPRGKRZSA-N 360.418 0.855 10 10 FCCE Cc1cc(CNC(=O)Cc2ccc(O)c(O)c2)ccc1S(N)(=O)=O 1467668210 QCVATWGEPAFFLJ-UHFFFAOYSA-N 350.396 0.913 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)NC(N)=O)cc2F)CC1 106829795 DJJABIJGBBXSAE-GFCCVEGCSA-N 351.426 0.641 10 10 FCCE CN[C@@H]1C(=O)Nc2cc(N3CCS(=O)(=O)CC3)c(Br)cc21 118711700 UXOHLGNWVSBKEA-LBPRGKRZSA-N 374.260 0.897 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)CCN(C)C)C2)cc1 827489874 WWELVZYOWYGDQF-HUUCEWRRSA-N 362.474 0.847 10 10 FCCE CCS(=O)(=O)C[C@@H](C)N(C)Cc1cc(O)n2ncc(C(=O)O)c2n1 737886556 GVFLZEMWNHKWNO-SECBINFHSA-N 356.404 0.388 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3CCO[C@@H]3C(=O)OC)nc12 852414849 ABHLYELPCPPSSL-YPMHNXCESA-N 364.358 0.032 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCCN3C(=O)CCC3=O)C2)cc1 852107216 JAIBCWNLYINRMR-CYBMUJFWSA-N 360.414 0.722 10 10 FCCE C[C@@H]1NCC[C@H]1NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 861565580 XZINEEPGDXCTLX-YSVLISHTSA-N 359.474 0.938 10 10 FCCE C[C@@]1(C2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)NC(=O)NC1=O 1182872725 YFDUKBFXTQNNTG-INIZCTEOSA-N 351.334 0.687 10 10 FCCE CNS(=O)(=O)c1ccc(CCNC(=O)c2cccc(O)c2O)cc1 1557966247 YLWHTXQRGGSKBB-UHFFFAOYSA-N 350.396 0.978 10 10 FCCE Nc1ccnn1CC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1637554323 IOGWMOJNMBJPGA-UHFFFAOYSA-N 351.357 0.897 10 10 FCCE CCN(CCO)c1nc(=Nc2ccccc2O)nc(N(CC)CCO)[nH]1 1871730129 ILJKQOFADGCQCE-UHFFFAOYSA-N 362.434 0.380 10 10 FCCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1C(=O)c1cc(O)nc(O)c1 2067373243 JUPGBXORPZKPRJ-WDEREUQCSA-N 353.375 0.593 10 10 FCCE NC(=O)COc1ccc(C=C2C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1 2297335163 ACFPAGDMPKRJAC-UHFFFAOYSA-N 369.333 0.806 10 10 FCCE O=[N+]([O-])c1ccc(O)c(CN2CCN([C@H]3CCS(=O)(=O)C3)CC2)c1 175499391 WUXZTMGHMHFBIW-AWEZNQCLSA-N 355.416 0.605 10 10 FCCE COc1ccc(N2CCN(C(=O)CSc3n[nH]c(=O)[nH]3)CC2)cc1F 288100180 XBDXHKPBSXWXGI-UHFFFAOYSA-N 367.406 0.687 10 10 FCCE CCOC(=O)C1(O)CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761906647 DVKVYTZILJBOLI-UHFFFAOYSA-N 365.342 0.820 10 10 FCCE O=C(c1c(F)ccc(O)c1O)N1CCC[C@@H](C(=O)N2CCOCC2)C1 789945990 AYDHKPRFESFWHB-LLVKDONJSA-N 352.362 0.948 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H]4CN(C)C[C@@H]43)CC2)cc1 794929564 MDDJLZFWIJHVLI-LMNJBCLMSA-N 374.529 0.814 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H](O)Cc3cnn(C)c3)CC2)c(OC)c1 870167356 HCYLKTXIZKNUSU-QGZVFWFLSA-N 374.441 0.690 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCCc1ncn(C)n1 1118217754 BGHLPJADGMNEMF-UHFFFAOYSA-N 358.446 0.555 10 10 FCCE COC(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1 1323017297 BBXUINUIMMARIC-HNNXBMFYSA-N 357.410 0.701 10 10 FCCE C[C@H](NC(=O)C(=O)NCCC1CS(=O)(=O)C1)c1ccc(N(C)C)cc1 1327465975 QUTUWXQSSOLSLR-LBPRGKRZSA-N 367.471 0.481 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)Cn3cnc(N)n3)CC2)cc1 1440672623 FLYNXNYALIKAFL-UHFFFAOYSA-N 373.461 0.197 10 10 FCCE C[C@@H](C(=O)NCc1cc(O)ccc1O)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1558174970 VZXNWVRXCIYDCY-CELJHQOASA-N 360.366 0.265 10 10 FCCE Cc1noc(C2(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)n1 1607372443 VGKDFFKBDNXTER-UHFFFAOYSA-N 352.372 0.874 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNC(=O)COc2ccc(N)cc2)C1 2106246339 BMJDMOXEVYSEHN-SWLSCSKDSA-N 365.430 0.992 10 10 FCCE O=C(O)CNC(=O)CN1C(=O)C(=Cc2ccccc2O)SC1=S 2314827829 NDBSIJIGXQMBOU-UHFFFAOYSA-N 352.393 0.794 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)[C@H]3COC(=O)N3)CC2)cc1 283095816 WTKGIKWWXGUOMQ-MRXNPFEDSA-N 362.430 0.432 10 10 FCCE CN1CCN(C)CC(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 905457258 WDNLOOMPIZEAAN-UHFFFAOYSA-N 360.502 0.975 10 10 FCCE CCn1nccc1CNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 830905912 HKCMOYCQTYIQJV-CQSZACIVSA-N 371.441 0.923 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CCN3CCCS3(=O)=O)C2)cc1 855231008 HOMKLYQDXHBLAH-CQSZACIVSA-N 367.471 0.816 10 10 FCCE NCCCOCCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 861561663 FIGKVLVGIHVBPO-UHFFFAOYSA-N 368.453 0.951 10 10 FCCE CN(C)S(=O)(=O)CC(=O)NCc1ccc(N2CCSCC2)cc1 785336235 FMEUTRXJTLMKBB-UHFFFAOYSA-N 357.501 0.747 10 10 FCCE CN1CCC2(CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)C1=O 1332010378 BQGLAIBFQSMWQS-UHFFFAOYSA-N 357.410 0.705 10 10 FCCE CC(C)N(C[C@H]1CCC(=O)N1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 1331539043 JTCKUICWRJYJBM-OAHLLOKOSA-N 360.458 0.884 10 10 FCCE CN1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCC1=O 1350678209 AKPGCYRHOLUQHW-UHFFFAOYSA-N 358.442 0.594 10 10 FCCE O=C(CNS(=O)(=O)c1ccccc1F)NCc1cc(O)ccc1O 1455342567 ADZBUWQBYCPUTP-UHFFFAOYSA-N 354.359 0.832 10 10 FCCE O=C(NCc1cc(O)ccc1O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1 1637125736 DTYJBQZIZDTGHY-AWEZNQCLSA-N 372.381 0.905 10 10 FCCE CN(Cc1ccccc1O)c1nnc([C@H]2CCOC2)n1Cc1nnn(C)n1 1768681268 GVYHBPLBVGTXOJ-ZDUSSCGKSA-N 370.417 0.696 10 10 FCCE N[C@@H](COCc1ccccc1)C(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)O 2151895845 XBRCHCXPWFKAAX-LSDHHAIUSA-N 374.393 0.754 10 10 FCCE CN(C(=O)C1=C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1cccn(C)c1=O 2224794923 TYTNPTSRSDLQTA-GXTWGEPZSA-N 363.414 0.932 10 10 FCCE CCN(CC)CCNNC=C1C(=O)NC(=S)N(C2CCCCC2)C1=O 2296936474 VRPMNNPKYZFGEP-UHFFFAOYSA-N 367.519 0.882 10 10 FCCE COC(=O)[C@@H]1CS(=O)(=O)CCN1Cc1cc(Cl)cc(OC)c1O 276750603 KWHSYRVAFRNMDX-NSHDSACASA-N 363.819 0.826 10 10 FCCE O=C(CN1CCC(=O)NC1=O)NCc1cc(Br)ccc1O 804739318 VVHGNUFCVPDGDS-UHFFFAOYSA-N 356.176 0.713 10 10 FCCE NC[C@H]1CC(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)=NO1 852859881 CWPQWBQYSICEIY-CYBMUJFWSA-N 350.394 0.507 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3CCC[C@@H]3O)CC2)cc1 871112773 IEOQZAQQVJPHAG-VCVRMXLYSA-N 373.453 0.930 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(C)CCNC(=O)C3)cc2)CC1 898575973 XMPGJYPABICROE-FQEVSTJZSA-N 372.469 0.888 10 10 FCCE C[C@@H]1[C@@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H](C)C(=O)N1C 1163828594 NSSPOQNBCDTIHZ-GMTAPVOTSA-N 369.443 0.843 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(C(=O)N2CCCC2)CC1 1351816839 HTNDPBLMIYUNCO-UHFFFAOYSA-N 372.425 0.594 10 10 FCCE CN1CCc2nc(NC(=O)c3nnn(-c4ccc(N)cc4)n3)sc2C1 1857878399 AEJALYMNXJLULF-UHFFFAOYSA-N 356.415 0.941 10 10 FCCE COc1ccc(N2CCN(C(=O)c3ccc(S(N)(=O)=O)o3)CC2)cc1 56088506 DHSRWNPXFUQUBC-UHFFFAOYSA-N 365.411 0.898 10 10 FCCE COC(=O)COc1ccc(N(C)C[C@@H]2CCN(S(C)(=O)=O)C2)cc1 801539711 NRGIITYCRRVXNH-ZDUSSCGKSA-N 356.444 0.956 10 10 FCCE NCC(F)(F)CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 846673164 PPIKEBCAIJFNAD-ZDUSSCGKSA-N 354.401 0.989 10 10 FCCE COc1ccc(N2CCN(C(=O)C3(n4cnnn4)CCOCC3)CC2)cc1 854198655 NINXTLSSOTVQGO-UHFFFAOYSA-N 372.429 0.536 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1C[C@H](S(C)(=O)=O)C1 1262124503 KBGGRHLTDLLUEW-CTYIDZIISA-N 367.471 0.369 10 10 FCCE COc1ccc(CN[C@H](CO)CNC(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)cc1C 1283781193 AGSVIFSAWQKASF-HRVGUFCPSA-N 360.454 0.994 10 10 FCCE Cn1cc([C@H](O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1 1291872050 RHASTLVTMCPFRJ-PBHICJAKSA-N 371.441 0.472 10 10 FCCE COC(=O)[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)C[C@@H](C)O1 1351395769 SCDPXGIGPCHQHB-RISCZKNCSA-N 350.371 0.140 10 10 FCCE CCOc1ccc(N2C(=O)C(=CNCCN(C)C)C(=O)NC2=S)cc1 2296115523 BOIYDELPYVPNAS-UHFFFAOYSA-N 362.455 0.868 10 10 FCCE CC(C)(C)OC(=O)NCC(=O)NCCNC(=O)c1cc(O)c(O)c(O)c1 169830329 QOOCRWSVVSALBP-UHFFFAOYSA-N 369.374 0.174 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCN2CCCC2=O)c1 299074259 FKSNYQLMEWZXCB-UHFFFAOYSA-N 355.416 0.506 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)c2cn(C[C@@H]3CNC(=O)O3)nn2)c1 1150543431 OIRCBZOFNUQUJL-ONGXEEELSA-N 361.358 0.592 10 10 FCCE COCCNS(=O)(=O)c1c[nH]c(C(=O)NCc2c(O)cccc2F)c1 1646034574 NIMQXSZVRXANLC-UHFFFAOYSA-N 371.390 0.714 10 10 FCCE Nc1ccc(-n2nnc(C(=O)Nc3ccc(N4CCOCC4)nc3)n2)cc1 1857878950 PLXWORSWWMYTER-UHFFFAOYSA-N 366.385 0.728 10 10 FCCE CC[C@@H](NC(C)=O)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1535156666 LYAPRHRABKRDDT-QGZVFWFLSA-N 360.458 0.919 10 10 FCCE COc1cc(N2CCN(C(=O)C(OC)OC)CC2)c([N+](=O)[O-])cc1OC 1640432108 UOWGUTMELIIPSK-UHFFFAOYSA-N 369.374 0.880 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)[C@H](O)C1 1890523659 BQZVRGBHWOCQNA-HWWQOWPSSA-N 369.422 0.878 10 10 FCCE O=C(O)[C@@H]1[C@@H](O)[C@@H](O)CN1Cc1cc(Br)cc(F)c1O 2200843480 JFVYVQJHEUHXLP-QXEWZRGKSA-N 350.140 0.284 10 10 FCCE C[C@@H](CO)N(C)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 284162363 ZQLHORLVESNZKC-LBPRGKRZSA-N 367.421 0.242 10 10 FCCE CN(CC(=O)NCc1ccc(N(C)C)cc1)C[C@@H]1CCS(=O)(=O)C1 740888319 FEJKFTBWVDKZIF-HNNXBMFYSA-N 353.488 0.735 10 10 FCCE COC(=O)/C=C/c1ccc(N2CCN3C(=O)NC(=O)[C@@H]3C2)c([N+](=O)[O-])c1 778587837 FYYLZXLMPIPLLU-LQPUYASZSA-N 360.326 0.521 10 10 FCCE CS(=O)(=O)CCS(=O)(=O)NCc1cc(Br)ccc1O 796191650 ZBPDFTFYGNNVON-UHFFFAOYSA-N 372.262 0.619 10 10 FCCE COc1cc(NS(=O)(=O)c2ccc(S(N)(=O)=O)cc2)ccc1O 797820165 JIVHGZRPMONTGL-UHFFFAOYSA-N 358.397 0.849 10 10 FCCE O=C1CNCCN1[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 843065841 QOPDHFCKECIVBD-LJQANCHMSA-N 358.486 0.919 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](O)C[C@H]3COC)nc12 844393361 RPHOITXWSQICLM-NWDGAFQWSA-N 350.375 0.193 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCO[C@@H]2CC2(F)F)c1 855608646 KPLYVJXSOBWDGR-LLVKDONJSA-N 350.343 0.918 10 10 FCCE O=C(CN1C[C@H]2CNC[C@@H]2C1)NCc1ccc(N2CCOCC2)c(F)c1 917084694 BMFAEMGAIUXHTK-HZPDHXFCSA-N 362.449 0.430 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC=C[C@H]3CO)CC2)cc1 922266723 LEJHYXAFRRCKNM-IJDCCNJMSA-N 371.437 0.659 10 10 FCCE C[C@@H](NC(=O)Cn1cnnn1)C(=O)NCc1cc(Cl)cc(Cl)c1O 1638305008 BGGUCGAPUUUJKY-SSDOTTSWSA-N 373.200 0.507 10 10 FCCE COc1ccc(N2CCN(C(=O)C3(C(=O)NCCN(C)C)CC3)CC2)cc1 253436689 XFZNGGIFTRTSCT-UHFFFAOYSA-N 374.485 0.802 10 10 FCCE CNC(=O)[C@H]1CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 817284065 JJUSKUFIICWNMM-HNNXBMFYSA-N 360.458 0.412 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3ccnn3C)C2)cc1 827132015 IREROHSAGDLJEZ-CYBMUJFWSA-N 357.414 0.440 10 10 FCCE CN1CC[C@H](C(=O)NCc2cccc(Br)c2O)S1(=O)=O 843867440 LYHFYQHGSAXIQS-SNVBAGLBSA-N 363.233 0.805 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)NCCC1(CS(C)(=O)=O)CC1 1118439960 UNRRRSARWQROKQ-UHFFFAOYSA-N 368.455 0.682 10 10 FCCE CCOC[C@H](C(=O)OC)N(C)CC(=O)NCc1ccc(N(C)C)cc1 1616425833 FEFFUUCBVWJUPV-MRXNPFEDSA-N 351.447 0.879 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3CC(=O)NC3=O)cc2)C1 1626338446 ANDCQVZEZMBYRE-UONOGXRCSA-N 372.425 0.057 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2C[C@@H]3COC[C@@H]3O2)c1 1637692443 YXYBTQXFNXCYEO-UDZFHETQSA-N 356.400 0.297 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@H]1CNOC1 2136262931 YNWKDCFIGIVVNT-RYUDHWBXSA-N 367.402 0.553 10 10 FCCE COc1ccc(Br)c(CNCCCS(N)(=O)=O)c1O 2227747866 GLGOAOMRNDIXPX-UHFFFAOYSA-N 353.238 0.932 10 10 FCCE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C[C@@H]2NC(=O)NC2=O)cc1 270616395 RZUGEVYISQOGKI-CVEARBPZSA-N 374.441 0.858 10 10 FCCE NC(=O)N[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 270740298 NDBNKGJDEPDPMZ-ZDUSSCGKSA-N 365.409 0.615 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)[C@H]3COC(=O)N3)cc2F)CC1 294461241 CGTBFXXQKDILBK-CQSZACIVSA-N 350.394 0.692 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](O)CC(F)(F)C3)nc12 787367574 KLEHXBOFFYJRSR-SNVBAGLBSA-N 356.329 0.814 10 10 FCCE CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 800667914 PLRJNCZUOULIMN-KELULYIISA-N 354.428 0.945 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCS(=O)(=O)C3)C2)cc1 849224547 HROUIQDNYWJJGQ-STQMWFEESA-N 353.444 0.760 10 10 FCCE C[C@@H]1NCC[C@H]1NC(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 861812707 IZCBPLSQXRGPKL-CWRNSKLLSA-N 361.442 0.766 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C[C@@H]3CCNC3=O)CC2)cc1 878830809 XVTMKUUJKYXNFE-HNNXBMFYSA-N 360.458 0.460 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@H]4CC[C@H]3[C@H](N)C4)CC2)cc1 923398309 KIWZHNBXNWQKNM-YRLHULLVSA-N 374.529 0.990 10 10 FCCE COc1cccc(CNC(=O)NC[C@]2(OC)CCS(=O)(=O)C2)c1O 1251161552 FWUFJQUURDASOY-OAHLLOKOSA-N 358.416 0.404 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)c1nc2ncc(CCO)cn2n1 1290290624 LBLGOCDNJSTQHE-UHFFFAOYSA-N 354.414 0.997 10 10 FCCE CN1CCN(C(=O)C2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)CC1 1543926122 FWILCRSFFMJSSZ-UHFFFAOYSA-N 361.442 0.653 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCN4C[C@@H](F)C[C@H]4C3)nc12 1560201625 SADSPWWXEHVREO-AAEUAGOBSA-N 363.393 0.840 10 10 FCCE CO[C@H]1CS(=O)(=O)C[C@@H]1NC(=O)c1cc2cc(O)c(O)cc2s1 1584122090 FOOOIFKZBJKLDV-KWQFWETISA-N 357.409 0.854 10 10 FCCE CC(=O)NC[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 761899633 FXEMWEYCZUAVRJ-SNVBAGLBSA-N 350.331 0.267 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CCC[C@@H]2CS(N)(=O)=O)cc1F 785865395 TVRUNYALNARSNP-GFCCVEGCSA-N 358.439 0.854 10 10 FCCE CS(=O)(=O)C[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 813628461 NTWBTJCALOASNN-SECBINFHSA-N 355.372 0.797 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CNCC[C@@H]3C)C2)cc1 851688523 CEWNHENWAXWGEY-ZQIUZPCESA-N 360.458 0.504 10 10 FCCE CNC(=O)[C@@H]1CN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CCO1 852453935 MKBIXXKWICZFDQ-CJNGLKHVSA-N 362.430 0.430 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(C(=O)[C@@H]2CCCO2)CC1 1330379537 OFCHUQMDUWDBKC-INIZCTEOSA-N 373.409 0.084 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CN3CCOCC3)cc2)C1 1441946528 LVBUZSZZIAXAQE-MRXNPFEDSA-N 360.458 0.337 10 10 FCCE COc1cc(N2CCN(C(=O)[C@@H](C)CC(N)=O)CC2)cc(OC)c1OC 1638186675 QQIUDOIGZGQEFY-LBPRGKRZSA-N 365.430 0.873 10 10 FCCE O=C1NC(=S)SC1=Cc1c(NCCCO)nc2ccccn2c1=O 2296709044 FTZINFSJGJVNTL-UHFFFAOYSA-N 362.436 0.978 10 10 FCCE COCCN(C(=O)Nc1cc(O)c(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1 217278847 CVGKTESEVSFMSU-SNVBAGLBSA-N 360.388 0.471 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCO[C@@]2(CCOC2)C1 807099392 UKNGRFJJYWKYAB-IBGZPJMESA-N 361.442 0.695 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1[C@H]2COC[C@H]21 822759704 XKNZYSXDVKQPFW-ZSHCYNCHSA-N 350.440 0.430 10 10 FCCE COC1CCN(c2ccc(CN3CCN(CC(N)=O)C(=O)C3)cc2)CC1 839177486 LXPOMWMZLKOBFW-UHFFFAOYSA-N 360.458 0.431 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCOC(=O)N3)CC2)cc1 858839346 BMWODLAZURTPQJ-MRXNPFEDSA-N 362.430 0.432 10 10 FCCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCS(=O)(=O)C[C@@H]1CCO 1156138472 MIQBEUUPFASBRL-JTQLQIEISA-N 371.436 0.934 10 10 FCCE CN(C)CCN(C[C@@H]1CCCO1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1332003487 MRBKIAHINDDNCZ-HNNXBMFYSA-N 361.442 0.804 10 10 FCCE Cn1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n(C)c1=O 1542180530 PIDIYOSOPSMQQG-AWEZNQCLSA-N 371.441 0.356 10 10 FCCE CN1CCN(C(=O)c2ccc(O)c(O)c2)[C@H](CNC(=O)C(F)(F)F)C1 2118183559 DKELMFOQMAYJAS-SNVBAGLBSA-N 361.320 0.533 10 10 FCCE CCn1ncc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)n1 292741525 AJSAYGGBVNPDRV-UHFFFAOYSA-N 358.446 0.859 10 10 FCCE C[C@H](NC(=O)c1cnc(O)n(C)c1=O)c1ccc(N2CCOCC2)cc1 751564774 KNOCVKWTFUDUAV-LBPRGKRZSA-N 358.398 0.814 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@@H](C)N(C)C3CC3)C2)cc1 827891736 MPEAWUIYXNEGHJ-HUUCEWRRSA-N 374.485 0.989 10 10 FCCE CCN1CCN(CC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C(=O)C1=O 855230918 GOIZHAPTRHIDLG-CQSZACIVSA-N 374.441 0.081 10 10 FCCE COC(=O)CCNC(=O)CCNCc1ccc(N2CCN(C)CC2)cc1 858294236 WMHHHEUMJGXEIU-UHFFFAOYSA-N 362.474 0.597 10 10 FCCE CN(C[C@@H]1COCCO1)c1nnnn1Cc1ccc(N2CCOCC2)cc1 1352232535 BKCLPWGTUCZFAD-QGZVFWFLSA-N 374.445 0.410 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)NCC3(CO)CC3)cc2)CC1 1638478872 IHIRUAVXHYVKNH-UHFFFAOYSA-N 360.458 0.960 10 10 FCCE CC(=O)N1NC(=C2C(=O)NC(=O)N(C)C2=O)C[C@H]1c1ccc(N(C)C)cc1 2296555996 LTBCJJDMBOVDQG-AWEZNQCLSA-N 371.397 0.513 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](CC)C(=O)OC)nc12 791630903 FKEFKDIIEIDKRH-SNVBAGLBSA-N 365.342 0.854 10 10 FCCE CC(=O)N[C@@H](CC(=O)NCc1cc(Br)ccc1O)C(N)=O 804737963 XCJYVOMFFSMSEG-JTQLQIEISA-N 358.192 0.151 10 10 FCCE N[C@@H]1C[C@@H]1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 827543619 GJTOQEWLSLUDNI-GOEBONIOSA-N 370.432 0.906 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCC(=O)N(C)C3=O)C2)cc1 852388768 QTKPXFQXVPUURM-SWLSCSKDSA-N 360.414 0.721 10 10 FCCE Cn1cc(/C=C/C(=O)N2CCOc3c2ccc(F)c3F)c(=O)n(C)c1=O 1142829657 WUWPLURSNYEUKT-ZZXKWVIFSA-N 363.320 0.801 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3nc(C)no3)C2)cc1 1330370834 ADWPBAAZWXBPKW-LBPRGKRZSA-N 359.386 0.398 10 10 FCCE C[C@@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCNC(=O)C1 1534541338 WTXZLEMRPNKVEO-FOIQADDNSA-N 372.469 0.921 10 10 FCCE CN1C(=O)C(=CNCCN2CCNCC2)C(=O)N(c2ccccc2)C1=S 2297510212 JIBUADODHWWVGY-UHFFFAOYSA-N 373.482 0.155 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)C(=O)N1CCC(CN=[N+]=[N-])CC1 2320921067 APLKQJTWZOGATN-UHFFFAOYSA-N 357.411 0.783 10 10 FCCE CC[C@H](C)OC(=O)C[C@H]1C(=O)NCCN1C=C1C(=O)OC(C)(C)OC1=O 10213747 LLYSGMXKHIKDMU-JQWIXIFHSA-N 368.386 0.239 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H](Cn3ccnn3)C2)cc1 826706758 LZSHVYCENGQLNU-HNNXBMFYSA-N 356.430 0.509 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCS(=O)(=O)C3)C2)cc1 849224546 HROUIQDNYWJJGQ-QWHCGFSZSA-N 353.444 0.760 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CC4CC3(CN)C4)C2)cc1 851688535 CNUACTSAWHDGJK-BQTBQCLESA-N 372.469 0.587 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCN(c3nccnn3)CC2)cc1 859408386 SLNZWQHNWDDDBE-UHFFFAOYSA-N 355.446 0.376 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1301350705 WEBLROCDRDNJRE-UHFFFAOYSA-N 369.487 0.545 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCOC[C@@H]1c1ccnn1C 1326536998 MOZGTJZLTJEAEI-OAHLLOKOSA-N 358.398 0.684 10 10 FCCE CCN1CC[C@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1=O 1332601294 XNRNMGNEIMATIK-HNNXBMFYSA-N 358.442 0.422 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NC[C@@H](O)COc1ccc2c(c1)OCO2 1465908705 GGODMGFKSGLGFT-GFCCVEGCSA-N 361.350 0.925 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)CCCS(N)(=O)=O)C2)cc1 1627154890 YFRPHQBAHWFFRX-ZDUSSCGKSA-N 355.460 0.706 10 10 FCCE COc1cc(N2CCN(C(=O)[C@H]3C[C@H]3C(N)=O)CC2)cc(OC)c1OC 1633649148 YIVMJRIESVRKOL-OLZOCXBDSA-N 363.414 0.482 10 10 FCCE O=C(NC1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1)c1cnccn1 169874598 FLLGGDMSHOAQIN-UHFFFAOYSA-N 358.354 0.628 10 10 FCCE COC(=O)[C@H]1N[C@@H](c2ccc3c(c2)CCN3C(C)C)[C@H]2C(=O)N(C)C(=O)[C@@H]12 248030908 LDHHKKHGZNCALV-YVSFHVDLSA-N 371.437 0.874 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCN(CCO)[C@H](C)C3)nc12 778347766 SAWHDNLEUBBQAV-GFCCVEGCSA-N 363.418 0.110 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCO[C@H]([C@@H](C)O)C1 840976641 DEVSEWIASPZTSE-PBHICJAKSA-N 363.458 0.709 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@]3(N)CC3(F)F)CC2)cc1 870886372 GOEVDZBQIQAVKZ-INIZCTEOSA-N 354.401 0.670 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CC(=O)N(CC3CC3)C2)cc1 897361795 RNPCXBGPFQDWHK-OAHLLOKOSA-N 358.442 0.496 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCc2cnc3n2CCOC3)cc1 1354381644 FGVJOTULJIBFAL-UHFFFAOYSA-N 357.414 0.412 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H]4OCC(=O)N[C@@H]4C3)C2)cc1 1565055917 NFCKYZQWKQNIMO-IAOVAPTHSA-N 374.441 0.573 10 10 FCCE COc1cc(N2CCN(C[C@@H](O)C(C)(C)O)CC2)cc(OC)c1OC 1658172053 CSHXDWICFHZZSR-MRXNPFEDSA-N 354.447 0.966 10 10 FCCE CN(C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C)C1CNC1 2136241234 WOBQCIPOUXBJMS-ZDUSSCGKSA-N 365.430 0.964 10 10 FCCE Cc1ccc(CNS(=O)(=O)N2CC[C@@H](O)C2)c(O)c1Br 2380814024 BSZQWGKENGRTIF-SNVBAGLBSA-N 365.249 0.864 10 10 FCCE CCCN(C)C(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 285710438 CYFSSQKQGPRWCO-UHFFFAOYSA-N 362.474 0.802 10 10 FCCE CCN(Cc1cn(C)nn1)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 807096241 FDOACWPRAKDCOY-UHFFFAOYSA-N 358.446 0.854 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CCC(CN)CC3)C2)cc1 818675551 DAHWAVVUACUXOI-MRXNPFEDSA-N 374.485 0.835 10 10 FCCE COc1ccc(N2CCN(C(=O)C3(OC)CS(=O)(=O)C3)CC2)cc1 929249648 HFMOWZFZQZUSAN-UHFFFAOYSA-N 354.428 0.157 10 10 FCCE CN(C)C(=O)N(C)[C@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1118956644 AMQZSZNTYJVLQP-ZDUSSCGKSA-N 360.414 0.449 10 10 FCCE N[C@@H]1CCO[C@H]([C@@H]2CCCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)C2)C1 1329504631 NQYMCJRTMIOGJO-RKVPGOIHSA-N 373.453 0.979 10 10 FCCE C[C@H](NC(=O)C(=O)N1CC[C@]2(CNC(=O)C2)C1)c1ccc(N(C)C)cc1 1342713182 JUKHKMUJVHYRSG-DJJJIMSYSA-N 358.442 0.668 10 10 FCCE CS(=O)(=O)NC[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1644182257 XIBAYVBGWDNCHJ-JTQLQIEISA-N 353.404 0.860 10 10 FCCE NC(=O)CSCC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1652068757 UWDGFBHGLKYXRE-UHFFFAOYSA-N 364.471 0.223 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)[C@@H](O)C1 1890523660 BQZVRGBHWOCQNA-MQIPJXDCSA-N 369.422 0.878 10 10 FCCE CN(CCN=[N+]=[N-])C(=O)[C@@]1(NC(=O)OC(C)(C)C)CCS(=O)(=O)C1 2010402651 UISJZHQXYBDKRO-CYBMUJFWSA-N 361.424 0.837 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)C[C@@H]1CO 2122239373 JKOLSUZNEYTYLF-NEPJUHHUSA-N 367.402 0.841 10 10 FCCE CCCCCCN1C(=O)NC(=O)C(=CNCCCN2CCOCC2)C1=O 2296930138 AUGWTLMQFPOXGE-UHFFFAOYSA-N 366.462 0.841 10 10 FCCE CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@H]1OC(C)=O 36056230 QKGHBQJLEHAMKJ-YHQUGGNUSA-N 373.318 0.380 10 10 FCCE O=C(Cn1cn[nH]c1=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 154753804 FMZPLXPYGKLAEL-LLVKDONJSA-N 367.356 0.958 10 10 FCCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)NC[C@H]1CN2CCN1CC2 178655970 QTGLMUYVSWPMPD-NAASZUNDSA-N 356.470 0.652 10 10 FCCE CC(C)(C)OC(=O)N[C@]1(C(=O)O)CCN(C(=O)c2cc(O)nc(O)c2)C1 382133944 BBKQZTPTRGCHLY-MRXNPFEDSA-N 367.358 0.687 10 10 FCCE CC(=O)C(=O)COC(=O)CCNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C 808536477 KXPNNRRKOWJXJW-LBPRGKRZSA-N 370.402 0.594 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCn3ccnc3C)C2)cc1 827674873 WNAHPBBDJZVMHZ-HNNXBMFYSA-N 371.441 0.711 10 10 FCCE CN(C)CCC[C@H]1CN(C(=O)C(=O)NCCc2ccc(N)cc2)CCO1 851688083 PZCLUKQESNLYEB-KRWDZBQOSA-N 362.474 0.497 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C2(n3cnnn3)CCOCC2)cc1 855020568 SGAGLVKCSDMBHR-UHFFFAOYSA-N 374.445 0.782 10 10 FCCE COc1ccc(N2CCCN(C(=O)C3(OC)CS(=O)(=O)C3)CC2)cc1 930308910 CBYVWHHVJULXHK-UHFFFAOYSA-N 368.455 0.548 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@@]34CCOC4)cc2)CC1 1333945690 XCJUXIJWDLBGPX-FQEVSTJZSA-N 372.469 0.446 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@@H](N2CCCS2(=O)=O)C1 1568429583 VMUKMEYEMANMIV-CYBMUJFWSA-N 354.428 0.667 10 10 FCCE COc1ccc(N2CCN(CCNC3CCS(=O)(=O)CC3)CC2)cc1 291067590 DTVDHESWEQGJEH-UHFFFAOYSA-N 367.515 0.984 10 10 FCCE CNC(=O)c1cc(S(=O)(=O)NCc2cc(OC)ccc2O)cn1C 751415748 WMUOOXCNRAFKGN-UHFFFAOYSA-N 353.400 0.577 10 10 FCCE CCOc1ccc(CN2CCN(CC(=O)N3CCOCC3)CC2)c(O)c1 768197199 IUXMCDKQLJTXRY-UHFFFAOYSA-N 363.458 0.767 10 10 FCCE C[C@H](NC(=O)c1ccc2c(=O)n(C)c(=O)n(C)c2n1)c1ccccc1O 1302532498 GHQLVUIUFFJPPI-JTQLQIEISA-N 354.366 0.829 10 10 FCCE CCOc1ccc(N2CCN(C(=O)Cn3cnc([N+](=O)[O-])n3)CC2)cc1 1319625688 ODTIJPVDIMDHBG-UHFFFAOYSA-N 360.374 0.934 10 10 FCCE CC(C)NC(=O)CNS(=O)(=O)CCC(=O)N[C@H](C)c1ccccc1O 1587447329 PTMHMFXGXXSFII-GFCCVEGCSA-N 371.459 0.404 10 10 FCCE CC(C)CN1[C@H]2CN(Cc3ccc(O)c(O)c3)C[C@@H]2OCCS1(=O)=O 1613880018 PZQDDCUEZCIIIB-YOEHRIQHSA-N 370.471 0.969 10 10 FCCE COc1ccc(N2CCN(C(=O)CN(C3CC3)S(C)(=O)=O)CC2)cc1 244143041 UQLAEECNXHJEMC-UHFFFAOYSA-N 367.471 0.768 10 10 FCCE CN(C)CCN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1ccccc1 299371509 DSUBSRSCUJDYQK-ZHACJKMWSA-N 356.426 0.692 10 10 FCCE NC(=O)CN(CC(N)=O)Cc1cc(Cl)cc(Br)c1O 708145593 JJBVJJWWFKIUIW-UHFFFAOYSA-N 350.600 0.581 10 10 FCCE COc1ccc(N2CCN(C(=O)COC(=O)Cc3ccnn3C)CC2)cc1 769326853 HJDPYJMQNLUORD-UHFFFAOYSA-N 372.425 0.863 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1CCO[C@]2(CCOC2)C1 806279019 BTLZLNXRGQDOGB-OAHLLOKOSA-N 371.484 0.759 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)CCc3cnn(C)n3)CC2)cc1 822823570 KDZZIUJQJXXLCT-UHFFFAOYSA-N 372.473 0.695 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCCn3cccn3)C2)cc1 826872164 IFWQWZYTWCAPNL-HNNXBMFYSA-N 371.441 0.793 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CCC4(COC4)C3)C2)cc1 829711297 PDWYUKVSOFKSHW-HNNXBMFYSA-N 373.453 0.887 10 10 FCCE C[C@H](CN)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 842131057 PINJUSHDDUWGFK-OAHLLOKOSA-N 373.501 0.298 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC3=CCNCC3)C2)cc1 851689391 OIFGOKVBHAUTID-HNNXBMFYSA-N 358.442 0.426 10 10 FCCE COC(=O)[C@H]1CN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CCO1 854301536 QBVUFIYPGHMNRB-CZUORRHYSA-N 363.414 0.857 10 10 FCCE CS(=O)(=O)C[C@H](O)CNC(=O)NCc1ccc(N2CCCC2)cc1 914180127 FWEWQZJOKOQACI-OAHLLOKOSA-N 355.460 0.492 10 10 FCCE CCN(CC)c1ccc(CNC(=O)[C@@H]2CS(=O)(=O)CC(=O)N2)cc1 1334161285 OUAGTZYGQLYFCG-AWEZNQCLSA-N 353.444 0.062 10 10 FCCE COc1cccc(CNC(=O)NCCS(=O)(=O)C2CCOCC2)c1O 1635426858 MUFXMQWRXMTPSU-UHFFFAOYSA-N 372.443 0.794 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)c3cnccn3)CC2)cc1 1862037881 HHWPUCXXYDDQPH-UHFFFAOYSA-N 355.398 0.564 10 10 FCCE CN(C(=O)[C@@H]1[C@@H](O)[C@@H](O)CCN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2136255002 BZVBWQMBQZHYBZ-KKUMJFAQSA-N 365.430 0.963 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNC(=O)c1cccc(O)c1O 2225627439 MXCDTEMPJCWYJP-SCDSUCTJSA-N 368.386 0.169 10 10 FCCE Cn1nnnc1CCNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 772081633 KWPZAWZZBWISEO-UHFFFAOYSA-N 373.461 0.461 10 10 FCCE C[C@@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCC(=O)NC1 798405041 YEJOIHDFIAAYIB-FOIQADDNSA-N 372.469 0.921 10 10 FCCE COC(=O)c1cn(CC(=O)NCc2cc(Br)ccc2O)nn1 804735662 CLOVPZYNOCSGME-UHFFFAOYSA-N 369.175 0.849 10 10 FCCE CNC(=O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 823520548 YDVVUUXHWLFPIP-OAHLLOKOSA-N 360.458 0.925 10 10 FCCE COc1ccc(N2CCN(CCNc3cc(=O)n(C)c(=O)n3C)CC2)cc1 853234551 FMYXKPYZIWYURZ-UHFFFAOYSA-N 373.457 0.327 10 10 FCCE CNCCOCCN(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 861749980 CIUWGGZGQAJJKJ-UHFFFAOYSA-N 350.463 0.372 10 10 FCCE C[C@@H]1O[C@H](C)C[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1353793684 JJPOEIVNDFVJIS-VKJFTORMSA-N 374.485 0.737 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@](C)(O)CN2CCOCC2)cc1F 73915842 XJWUCOJMANTIOJ-SFHVURJKSA-N 368.453 0.774 10 10 FCCE CN1CCN(C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c2ccccc2C1 255525477 VKGVDBFAWIEDAP-HJWRWDBZSA-N 354.410 0.576 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CCN(C2CC2)C(=O)C1)c1ccc(N(C)C)cc1 807672189 XIDOUNVWCKTJDY-CYBMUJFWSA-N 358.442 0.763 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@H]([C@@H](C)O)C3)nc12 839669540 AMCIFKMONIWLSY-ZWNOBZJWSA-N 350.375 0.193 10 10 FCCE C[C@@H](NC(=O)C(=O)N[C@@H]1CCCCNC1)c1ccc(N2CCOCC2)cc1 842123428 KLVHFCGACSZZNR-NVXWUHKLSA-N 374.485 0.959 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN(C)CCN(C)C(=O)OC)nc12 852570929 XKQZAEUZWBNPSF-UHFFFAOYSA-N 365.390 0.742 10 10 FCCE COC(=O)c1ccc(O)c([C@H](C)NC[C@]23COCCN2C(=O)COC3)c1 866554893 VHMBYIMPZCVGRT-KPZWWZAWSA-N 364.398 0.457 10 10 FCCE O=C([C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)N1Cc2cccc(O)c2C1 871199525 YPGDXQSTVDJQNN-QWHCGFSZSA-N 364.423 0.270 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3C[C@@H](O)CC(F)(F)C3)ccc21 1117165290 SOTIVZXZNCCKRA-AWEZNQCLSA-N 367.396 0.914 10 10 FCCE O=C(CNS(=O)(=O)c1c(F)cccc1F)NCc1ccc(O)c(O)c1 1465953941 KYUJASZTVXXXLV-UHFFFAOYSA-N 372.349 0.971 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(-n2[nH]nnc2=N)c1 1556157579 FMYQJOVOQNYYIG-SNVBAGLBSA-N 354.370 0.847 10 10 FCCE CNC(=O)c1cccc(N(C)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c1 1638791275 SSJBCNYOELGPAG-HJWRWDBZSA-N 356.382 0.120 10 10 FCCE Cn1nnc(Br)c1S(=O)(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1912143947 MIJWIUWVWPKSME-LURJTMIESA-N 350.202 0.899 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@@H]2CC(N)=O)c1 769738162 NVDFAIVAZKKAFA-LLVKDONJSA-N 355.416 0.634 10 10 FCCE O=S1(=O)CCNC[C@@H]1CCNCc1ccc(N2CCOCC2)c(F)c1 903968254 JZDDXVWDKCAWJB-HNNXBMFYSA-N 371.478 0.529 10 10 FCCE Cc1nnc(N2CCNC(=O)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1290881115 OZCBJAFXERWENR-UHFFFAOYSA-N 374.420 0.547 10 10 FCCE Cn1nc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1C=O 1542180732 XFCQCWLADNBOTR-AWEZNQCLSA-N 369.425 0.864 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\Cn1cncn1 1624658289 DCSLAFWRSNAYHI-SCOBNMCVSA-N 360.370 0.536 10 10 FCCE CC(C)(C)OC(=O)N1CCN(C(=O)c2nnn(-c3ccc(N)cc3)n2)CC1 1857879218 ZDZFYRWJCZELME-UHFFFAOYSA-N 373.417 0.937 10 10 FCCE COCCNC(=O)C1=C(N)Oc2c(c(C)nn2C)[C@H]1c1ccc(O)c(O)c1 1864008291 HPUAZIXHMJKTDV-CQSZACIVSA-N 374.397 0.597 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CCC(=O)N(C)C1 287132132 UZYNDAWSTWQTGY-OAHLLOKOSA-N 360.458 0.838 10 10 FCCE Cn1cc(/C=C\C(=O)N2CCN3CCOc4cccc2c43)c(=O)n(C)c1=O 771408633 ITYHCLGGLBFEFB-SREVYHEPSA-N 368.393 0.343 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NCC12CC(CN1)C2 851685064 MBWBMQBLSYFEDQ-ZUIJCZDSSA-N 358.486 0.976 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN[C@](C)(CCF)C(=O)OC)nc12 852577862 GGWAUHGYVGBVJK-MRXNPFEDSA-N 368.365 0.993 10 10 FCCE COC(=O)[C@H](CCC1OCCO1)NC(=O)/C=C\c1ccc(O)c(O)c1 1152646336 XKSKTJBOSBXHMM-RYBZSIHZSA-N 351.355 0.922 10 10 FCCE CN(C)c1ccc2nnc(CCC(=O)NCCc3ccc(O)c(O)c3)n2n1 1860387066 RUCYPBACYLVSPQ-UHFFFAOYSA-N 370.413 0.893 10 10 FCCE CC1=NN(c2nc3ccccc3s2)C(=O)C1=CNC(CO)(CO)CO 2293308778 YCQNICMHPFPQRH-UHFFFAOYSA-N 362.411 0.208 10 10 FCCE CS(=O)(=O)C1=NSC2=NC(=O)/C(=C/c3ccc(O)c(O)c3)C(=N)N21 96459867 WTSPSYWDQOXKNX-SMNSQHBTSA-N 366.380 0.719 10 10 FCCE CC[C@@](C)(NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(N)=O 133666774 PYFANSCUHACXLA-GOSISDBHSA-N 366.437 0.522 10 10 FCCE COc1cc(N(C)CC(=O)NCC(=O)N2CCCC2)cc(OC)c1OC 265986966 DDJHSEZJFNTFHC-UHFFFAOYSA-N 365.430 0.887 10 10 FCCE CNS(=O)(=O)NCC(=O)N(Cc1ccco1)Cc1ccccc1O 827081643 OGNJESBMORDOJH-UHFFFAOYSA-N 353.400 0.568 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@]34COC[C@@H]3C4)CC2)cc1 923363866 BQJSGTNBEBXIKF-DYELUZBYSA-N 371.437 0.805 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1C[C@@H](O)CC(F)(F)C1 1322813247 BJLLNEQFMZTKPR-VIFPVBQESA-N 365.427 0.970 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC[C@@H](C(N)=O)C3)cc2)C1 1351134589 KUVCDZKEVPYVPN-PMPSAXMXSA-N 372.469 0.906 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCCN3CCNC3=S)C2)cc1 1470774191 XIJDXOGMLBGTKF-ZDUSSCGKSA-N 363.487 0.763 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](COc3nnc(=N)[nH]n3)O[C@@H]2C1 2260766206 PAXQCZBYUWEJMS-HBNTYKKESA-N 352.395 0.472 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H](C)N1CCN(C(=O)OC(C)(C)C)CC1=O 859976347 XIJNVHPSRMBFMY-SNVBAGLBSA-N 356.375 0.156 10 10 FCCE CO[C@@H]1CC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1119675856 KEXBEMPLYWXFGQ-DLBZAZTESA-N 361.442 0.775 10 10 FCCE CS(=O)(=O)C[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 1179412610 CWDCQNQIGYXWJR-LBPRGKRZSA-N 354.388 0.735 10 10 FCCE CC(=O)c1cc(F)cc(CN2CCOC[C@H]2CNS(C)(=O)=O)c1O 1329930203 NZKFPKXOLAHURJ-CYBMUJFWSA-N 360.407 0.484 10 10 FCCE CC1(F)CN(C(=O)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1261414641 GPFOKDZTFDNZKZ-UHFFFAOYSA-N 371.359 0.988 10 10 FCCE Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H](C(N)=O)[C@H](C(N)=O)C2)cc1 1557689124 GWSWVZWKLLZERX-HZPDHXFCSA-N 354.410 0.753 10 10 FCCE COc1cccc(CNC(=O)NCC2(S(=O)(=O)N(C)C)CC2)c1O 1638447657 BZQLKMJVSFENRE-UHFFFAOYSA-N 357.432 0.624 10 10 FCCE NC(=O)[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CN(CCc2ccc(N)cc2)C1 2106666495 MFKGGNHLBKZHGL-DGCLKSJQSA-N 358.364 0.666 10 10 FCCE O=C(NCCNS(=O)(=O)c1cccs1)c1cc(O)c(O)c(O)c1 169911909 SGXWDCABPQYXSK-UHFFFAOYSA-N 358.397 0.573 10 10 FCCE COCCN(C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@@H]1CCOC1 807291358 HPTUEDMCYZKNCJ-GOSISDBHSA-N 373.453 0.943 10 10 FCCE C[C@H]1C[C@@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CCN1 827396327 UCYDKTKQZJGKSO-HOCLYGCPSA-N 365.499 0.926 10 10 FCCE CNS(=O)(=O)C[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 863340300 KAVQYKWRFDAFKG-IAQYHMDHSA-N 356.444 0.579 10 10 FCCE COC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCCOC1 897361763 QTSHYUGXUODSMU-RDJZCZTQSA-N 363.458 0.927 10 10 FCCE C[C@H](CNCc1ccc(N2CCC(C(N)=O)CC2)cc1)S(C)(=O)=O 905480001 BWWBNRKSNWTNKE-CYBMUJFWSA-N 353.488 0.911 10 10 FCCE CON(C)C[C@H](O)Cn1cc(NC(=O)c2ccc(C)c(O)c2O)cn1 1151075373 LJQZSDLSONYGOR-LBPRGKRZSA-N 350.375 0.709 10 10 FCCE O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NCc1cc(O)ccc1O 1153886183 ZMYMLUQFJWIVQG-RRCSTGOVSA-N 360.366 0.267 10 10 FCCE CCN(CC)C(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 1322176824 CCYNAKSVGPVPIC-UHFFFAOYSA-N 362.474 0.802 10 10 FCCE C[S@@](=O)CCN1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1444492835 YAXXQUIVOQPJHX-XMMPIXPASA-N 351.432 0.985 10 10 FCCE Cn1cc(S(=O)(=O)NCC(=O)NCc2cc(Cl)ccc2O)cn1 1639966172 WWJAZQONEUNZRG-UHFFFAOYSA-N 358.807 0.374 10 10 FCCE O=C1N[C@@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CS1 746136579 ZFPMAUWQTAURHZ-CYBMUJFWSA-N 369.468 0.363 10 10 FCCE Cn1nnnc1CCN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 762265676 WKTBGERMZTVVPU-UHFFFAOYSA-N 350.766 0.576 10 10 FCCE CN(CCN)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 842130997 NGANUSGETDYKNB-UHFFFAOYSA-N 373.501 0.252 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)CCc3nn[nH]n3)CC2)cc1 864617965 VACVAUFQSLYJSG-UHFFFAOYSA-N 373.461 0.469 10 10 FCCE COCCCOC1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1325077994 JFQMTZOXXCKTRD-UHFFFAOYSA-N 363.458 0.975 10 10 FCCE O=C(C(=O)N1CCC[C@H](Cn2ccnn2)C1)N1Cc2cccc(O)c2C1 1348641819 ZEISDPWHKNGSLG-ZDUSSCGKSA-N 355.398 0.765 10 10 FCCE C[C@H](NC(=O)CCS(=O)(=O)N(C)C)c1ccc(N2CCOCC2)cc1 1442411619 LWFMSMWXLDWXBS-AWEZNQCLSA-N 369.487 0.982 10 10 FCCE COCCn1cc(N2C[C@@H](C(=O)NCc3cc(O)ccc3O)CC2=O)cn1 1643882305 SPMGLEZLCGMAAD-ZDUSSCGKSA-N 374.397 0.610 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNCc1cccc(F)c1O 2218612037 CSXLPLNAUZGRLA-IPYPFGDCSA-N 356.394 0.962 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H](NC(=O)c1cc(Cl)ccc1F)[C@H](C)O 808508186 VAGRFQRKILKPBC-SDBXPKJASA-N 359.737 0.660 10 10 FCCE C[C@@H](CN)NC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 842131056 PINJUSHDDUWGFK-HNNXBMFYSA-N 373.501 0.298 10 10 FCCE NC(=O)[C@H]1C[C@H](NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 858154230 AZNSBDDOADHZRK-JOCQHMNTSA-N 350.394 0.725 10 10 FCCE CN1CCN(c2ccc(CN3C(=O)[C@@H]4[C@@H](O)CCCN4C3=O)cc2)CC1 925079734 NJUFLBDCCTWTFI-IRXDYDNUSA-N 358.442 0.726 10 10 FCCE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1445938042 MVWYACNKSZKTRW-ZJUUUORDSA-N 367.345 0.980 10 10 FCCE C[C@H](NC(=O)c1cnc2c(c1)c(=O)n(C)c(=O)n2C)c1ccccc1O 1557968283 XGJSZJDYUXYCSE-JTQLQIEISA-N 354.366 0.829 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H](NS(C)(=O)=O)C(C)C)CC2)cc1 1594800493 ZVMBHOSSSAEMSI-MRXNPFEDSA-N 369.487 0.918 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CO)c2cccnc2)c1 1638357530 RVXNTMPVJPAGIT-ZDUSSCGKSA-N 351.384 0.622 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N(C)CCS(N)(=O)=O)C2)cc1 1674328371 YPPOGGIQWSUMHJ-LBPRGKRZSA-N 356.448 0.204 10 10 FCCE CNC(=O)CN1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])CC1 1772826058 HKILONITVPQEFS-XQRVVYSFSA-N 362.386 0.649 10 10 FCCE COC(=O)C[C@H](N)C(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1865968409 VEOSEAGYRGWHLQ-HOCLYGCPSA-N 359.430 0.582 10 10 FCCE CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC[C@H](N=[N+]=[N-])C2)C(=O)C1 2060617986 UIRFCPAMAPFMOO-NSHDSACASA-N 352.395 0.977 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2311714736 GSCOCHAZQVWQAC-GMTAPVOTSA-N 355.395 0.534 10 10 FCCE CC(=O)OC[C@@H]1O[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@H]1OC(C)=O 616625328 LJICGUPPWNZTFT-ZUWCUPBKSA-N 373.318 0.380 10 10 FCCE Cn1cc(C[C@H](O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cn1 787010698 NBNQOUSNFFNZEJ-IBGZPJMESA-N 372.469 0.849 10 10 FCCE CN(Cc1ccccc1O)C(=O)N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1 807577943 POAOHASHGHTKAK-CQSZACIVSA-N 370.475 0.804 10 10 FCCE CNS(=O)(=O)NCC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 822273106 AYRLJBFAAUOVIH-UHFFFAOYSA-N 364.471 0.807 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3cccn(C)c3=O)C2)cc1 850537025 MEPXXCIZSAYRMA-ZDUSSCGKSA-N 370.409 0.728 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CC[C@@H](C)NC3)CC2)cc1 861804521 QYUGUPCNWOYQOV-HZPDHXFCSA-N 374.485 0.991 10 10 FCCE CO[C@@H]1COCC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 897791603 RGCFCLSMIDEUMY-IAGOWNOFSA-N 363.458 0.940 10 10 FCCE CN1CCC[C@H](C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1=O 899473458 SHPAXZWHGLRXHQ-QGZVFWFLSA-N 372.469 0.873 10 10 FCCE CCCn1c(N)c(N(CCOC)C(=O)/C=C/c2cnccn2)c(O)nc1=O 918145014 OLYZHCHYEXGXAX-SNAWJCMRSA-N 374.401 0.424 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCN2C(=O)OCC[C@@H]2C1 1326818975 YVJVRTIJOYKYOJ-MRXNPFEDSA-N 374.441 0.730 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N3CCNC(C)(C)C3)CC2)cc1 1345468999 AHELVQZBYQANQS-UHFFFAOYSA-N 374.485 0.944 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3[C@H]4COC[C@H]43)CC2)cc1 1346543005 DPXYLWYMHFPWRV-FVQHAEBGSA-N 359.426 0.495 10 10 FCCE CC[S@](=O)c1ccccc1C(=O)N1CCS(=O)(=O)[C@H]2COCC[C@H]21 1638771166 ADCJTSZKAKNXHZ-CYULLINESA-N 371.480 0.842 10 10 FCCE COc1ccc(N2CCN(C(=O)c3nonc3OCCCO)CC2)cc1 1872679617 IVDMLIDTWSMBNV-UHFFFAOYSA-N 362.386 0.802 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1CNC(=O)CN1 1952208845 NSYHPRKLZYEMLH-NEPJUHHUSA-N 351.403 0.622 10 10 FCCE CN(c1cc2c(cc1Br)[C@H](N)C(=O)N2)C1CS(=O)(=O)C1 2152239877 ODACCTXOUMOGDT-NSHDSACASA-N 360.233 0.634 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)C(=O)NCCc1ccc(O)c(O)c1 2344197609 PPGNELVJVHRYJV-UHFFFAOYSA-N 370.402 0.005 10 10 FCCE CNS(=O)(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 813331179 GJLNGIMJNCEEBJ-UHFFFAOYSA-N 354.476 0.105 10 10 FCCE C[C@@H](NC(=O)[C@H]1CCN=C2C1=NNN2C)c1ccc(N2CCOCC2)cc1 823834360 BHWWTLVEZULZSA-CJNGLKHVSA-N 370.457 0.925 10 10 FCCE COc1ccc(N2CCN(CCNc3cncc(C(N)=O)n3)CC2)cc1 750026154 UEXKHAWIOTVHSA-UHFFFAOYSA-N 356.430 0.818 10 10 FCCE CN(C)CCN1C[C@H](C(=O)NCc2ccc3cccnc3c2O)CC1=O 862027812 GRWGGCCHVJCKCZ-OAHLLOKOSA-N 356.426 0.967 10 10 FCCE COc1ccc(N2CCN(C(=O)c3cnc(O)n(C)c3=O)CC2)c(OC)c1 870165243 QXYNJSHSNCHQIE-UHFFFAOYSA-N 374.397 0.466 10 10 FCCE COc1cc(OC)cc(N(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c1 786235562 KPJRKZCMPXMSAA-VOTSOKGWSA-N 359.382 0.777 10 10 FCCE C[C@@H](NC(=O)NC[C@@H](C)S(N)(=O)=O)c1ccc(N2CCOCC2)cc1 799892750 OVDMSEONXZFTQG-CHWSQXEVSA-N 370.475 0.560 10 10 FCCE COc1cc(N2CCO[C@@H](CS(C)(=O)=O)C2)c([N+](=O)[O-])cc1OC 1307219948 ASZOWDBDXBHSTK-SNVBAGLBSA-N 360.388 0.862 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@@]4(O)C[C@H]4C3)cc2)CC1 1338899177 XCQVXKVYGPFTDP-OXJNMPFZSA-N 372.469 0.038 10 10 FCCE CCCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@H]1CCS(=O)(=O)C1 1351809651 KWTHBJHLJAJUGR-ZDUSSCGKSA-N 366.439 0.660 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)c2nc3ncc(CCO)cn3n2)c1 1445967251 JWKTWSOMZRTGGH-SNVBAGLBSA-N 357.370 0.864 10 10 FCCE CNS(=O)(=O)CCNC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1686150336 WHJRXSDJLGCQFJ-UHFFFAOYSA-N 354.476 0.977 10 10 FCCE COC(=O)C[C@@H]1C[C@]2(OC)C(=O)c3cccc(O)c3C(=O)[C@@]2(O)[C@@H](C)O1 229775290 QYARGOCFMSDSQR-MKXFUORMSA-N 364.350 0.628 10 10 FCCE biogenic CN(C)c1ccc(CNS(=O)(=O)C2CCS(=O)(=O)CC2)cc1F 263652033 DOTLWPNGQMSTET-UHFFFAOYSA-N 364.464 0.888 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CNCC[C@@H]3C)CC2)cc1 842186696 JHFPLTHCAYMEDY-KBXCAEBGSA-N 374.485 0.894 10 10 FCCE CN(C)CCN1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1=O 846010620 HKFNJBOWNFZQEH-UHFFFAOYSA-N 364.465 0.868 10 10 FCCE O=C1OC[C@H]2CN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)C[C@@H]12 858154923 WBVDAPZAHYHKSO-ZIAGYGMSSA-N 363.389 0.977 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCNC(=O)CC23CCC3)c1 1177163478 VMYFZOZUHZIWGF-UHFFFAOYSA-N 367.427 0.649 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CCc2nnn(C)c2C1 1332868335 WGAKBMPONIZMHM-AWEZNQCLSA-N 370.457 0.479 10 10 FCCE CS(=O)(=O)NC[C@@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 1460744006 QDAYGDDAUBXZNY-INIZCTEOSA-N 353.488 0.894 10 10 FCCE CN1C[C@H]2CC[C@H]1[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C2 1472585832 KSLIWCGHFSOHAE-GDLCADMTSA-N 353.444 0.976 10 10 FCCE CN1CCCc2cc(CNC(=O)c3cn(C[C@@H]4CNC(=O)O4)nn3)ccc21 1597849166 QWUCLYUXNSHLTQ-AWEZNQCLSA-N 370.413 0.699 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N1CCC(CN=[N+]=[N-])CC1 2136334945 GDFURQWESNQCCD-XQQFMLRXSA-N 369.422 0.876 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)C(=O)c3ccco3)CC2)cc1 244471991 ZGZPJQVLDCOZSC-UHFFFAOYSA-N 371.393 0.936 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CN(C)S(=O)(=O)N(C)C)C2)cc1 855227432 WNMGXNNMMOGULN-CYBMUJFWSA-N 370.475 0.128 10 10 FCCE CN(C)C(=O)/C=C/C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1141996392 TVHDTIHOTQTDGM-BOLDSZDNSA-N 358.442 0.649 10 10 FCCE CONC(=O)C1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 1558224187 OATQZFNCPADUJT-UHFFFAOYSA-N 371.415 0.294 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CN3CCC2CC3)c1 1636747199 AKKQNBAKOISVNW-GFCCVEGCSA-N 353.444 0.835 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2064132162 IECWPJKZVBUYOE-BJDJZHNGSA-N 355.395 0.629 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CNC(=O)COc2ccc(N)cc2)C1 2106246337 BMJDMOXEVYSEHN-DOMZBBRYSA-N 365.430 0.992 10 10 FCCE CN1CCN(c2ccc(C=C3C(=O)NC(=O)N(C)C3=O)cc2[N+](=O)[O-])CC1 2313548596 ZHOIDAMZSMGUJO-UHFFFAOYSA-N 373.369 0.438 10 10 FCCE COCCN1C(=O)/C(=C/NCc2nc3ccccc3n2C)C(=O)NC1=S 105209717 TWXZTHZYUCCRGI-PKNBQFBNSA-N 373.438 0.437 10 10 FCCE CCN1CCN(C(=O)CC(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 243183811 JXSPWAMEJKWTDO-UHFFFAOYSA-N 374.485 0.898 10 10 FCCE CC(=O)O[C@@H]1O[C@H](CN=[N+]=[N-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O 616585989 LFQWTDKRDROWBN-XHJNMGKDSA-N 373.318 0.380 10 10 FCCE CC(=O)OC[C@H]1O[C@@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O 616625453 NHNYHKRWHCWHAJ-DHGKCCLASA-N 373.318 0.380 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN(C)CCN2CCCS2(=O)=O)c1O 774910673 AOFBUZRNVVDPRE-UHFFFAOYSA-N 359.404 0.776 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN[C@@](C)(CCF)C(=O)OC)nc12 852577861 GGWAUHGYVGBVJK-INIZCTEOSA-N 368.365 0.993 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCN(C(C)=O)C3)C2)cc1 1334709377 DTNBKFSAKFXJKU-CABCVRRESA-N 374.441 0.127 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)C3(CN)CC(O)C3)cc2)CC1 1341929235 RESMSJCMCVWWNW-UHFFFAOYSA-N 360.458 0.071 10 10 FCCE O=C(CS(=O)(=O)C1CC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1628763875 JASWLHFZPUJNJY-UHFFFAOYSA-N 370.446 0.980 10 10 FCCE CN(C[C@H](O)CNC(=O)OC(C)(C)C)C[C@@H](O)COc1ccc(N)cc1 2106663502 ALSXPHFPSQZVPS-HUUCEWRRSA-N 369.462 0.826 10 10 FCCE Cn1nnc(Br)c1S(=O)(=O)NCC1(CN=[N+]=[N-])CC1 2117724144 ISZFCYMEKJKWGU-UHFFFAOYSA-N 350.202 0.946 10 10 FCCE CCON(C)C(=O)CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 844898381 VGJNACBOQBUVNQ-UHFFFAOYSA-N 368.409 0.871 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3nnc(C)n3C)C2)cc1 1334029964 AIRLRFBBSPUVOA-ZDUSSCGKSA-N 372.429 0.143 10 10 FCCE C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)N[C@H](C)c1ccccc1O 1587446866 AEEMNHOPDXGPMY-GHMZBOCLSA-N 352.416 0.670 10 10 FCCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CN(C)S(=O)(=O)N(C)C 1628955040 YGUINCYZSFZTIZ-UHFFFAOYSA-N 368.503 0.983 10 10 FCCE CN(C)c1ccc([C@H](NC(=O)CC[C@@H](N)C(=O)O)c2nccn2C)cc1 1866021169 AKOHXOQHXGCTRT-ZBFHGGJFSA-N 359.430 0.884 10 10 FCCE C[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC(=O)N1C 288503775 JJEZRLYMIJASCM-AWEZNQCLSA-N 356.426 0.368 10 10 FCCE Nc1ccc(OCCS(=O)(=O)NCC(=O)NCc2ccccc2)cc1 327182453 JRPLAYRMCOGIHP-UHFFFAOYSA-N 363.439 0.883 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CCn4nncc4C3)CC2)cc1 847019290 UDZUYQDLYQILQO-SFHVURJKSA-N 372.473 0.285 10 10 FCCE COC1(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CS(=O)(=O)C1 930743847 GVBHKCIODIGBOY-ZDUSSCGKSA-N 368.455 0.514 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(CO)nc1 1624659589 XZLHEHBQOVJLAC-AWEZNQCLSA-N 360.366 0.889 10 10 FCCE NS(=O)(=O)c1ccc(C(=O)NCCc2ccc(O)c(O)c2)c(F)c1 1631510312 MQVQKBJXAAALIJ-UHFFFAOYSA-N 354.359 0.857 10 10 FCCE Nc1ccc(OC[C@H](O)CN2C[C@H]3C[C@H]2CN3C(=O)C(F)(F)F)cc1 2106767501 PZFZOJHDUKOAPL-YNEHKIRRSA-N 359.348 0.856 10 10 FCCE NS(=O)(=O)N1CCC(NCc2cc(Br)ccc2O)CC1 698711091 VDXBWFJOPWCJSL-UHFFFAOYSA-N 364.265 0.912 10 10 FCCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CC1(n2cnnn2)CCOCC1 831924743 MGKGOKHNQQFBAA-LBPRGKRZSA-N 361.402 0.728 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)OC[C@@H]2CN(C3CC3)C(=O)O2)c1 845104877 OTBWNGCKZXWWMY-NSHDSACASA-N 370.383 0.904 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC(c3nc(N)n[nH]3)CC2)cc1 852055590 BCCSBHUEFZEGIT-UHFFFAOYSA-N 357.462 0.949 10 10 FCCE CNC(=O)NC[C@H]1CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CCO1 858684119 PHENKBFPJKXOBM-JTQLQIEISA-N 354.363 0.746 10 10 FCCE CNC(=O)NC[C@@H]1CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CCO1 858684120 PHENKBFPJKXOBM-SNVBAGLBSA-N 354.363 0.746 10 10 FCCE CCNC(=O)N1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 1117584423 IQBIICJJHZXWHR-AWEZNQCLSA-N 361.446 0.289 10 10 FCCE CCOC(=O)NCCC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCC 1296055789 XBIUIINEAINPGW-LBPRGKRZSA-N 368.386 0.824 10 10 FCCE CN1C[C@@H](CCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1=O 1332871336 JXRUYXSQYBZUED-INIZCTEOSA-N 370.453 0.664 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1470604535 SWBUPNNBUJXHDA-RISCZKNCSA-N 352.387 0.737 10 10 FCCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CCS(=O)(=O)C1 2060637075 GIOLUTNJTFPSLT-QMTHXVAHSA-N 373.435 0.980 10 10 FCCE Nc1ccc(CS(=O)(=O)NCCn2cc(Br)nn2)cc1 2192986397 QLEHZZKGHOKXQM-UHFFFAOYSA-N 360.237 0.742 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNC(=O)Nc1ccc(N)cc1 2225621982 HBIXHBVOBUAQIX-MELADBBJSA-N 366.418 0.731 10 10 FCCE CNC(=O)CN1CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CC1 2297798126 SAPFPQDEYPGNTO-UHFFFAOYSA-N 372.469 0.427 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNC(=O)c1cccc(O)c1O 2333598706 MXCDTEMPJCWYJP-QKCSRTOESA-N 368.386 0.169 10 10 FCCE CN[C@H]1C(=O)Nc2cc(N3CCOC[C@@H]3CO)c(Br)cc21 168236130 DVNODLPYBLPRTM-ISVAXAHUSA-N 356.220 0.859 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)[C@H]4C[C@H]4C3=O)CC2)cc1 758233778 WQTWVXCPFFQFGB-OIISXLGYSA-N 359.426 0.183 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H](O)CC(F)(F)C2)c1 787837413 RFOYEHRXMCVQOR-SECBINFHSA-N 350.343 0.606 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)NCCc3cn(C)cn3)ccc21 817812130 WWSAMINSSZPQBC-UHFFFAOYSA-N 355.442 0.778 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN[C@@H](CO)C3CCC3)CC2)cc1 852320515 LLQKNVMDWFEVME-QUCCMNQESA-N 363.502 0.929 10 10 FCCE Cn1c(=O)c2cc(C(=O)NCc3ccc(O)cc3O)sc2n(C)c1=O 1469158552 AZHQJWRUZNYZGT-UHFFFAOYSA-N 361.379 0.640 10 10 FCCE O=C(c1c(F)ccc(O)c1O)N1CCC[C@@H](N2CCCS2(=O)=O)C1 1650982532 HYHQFLUNHGUESI-SNVBAGLBSA-N 358.391 0.877 10 10 FCCE O=C(N[C@@H]1CCCCN1[C@@H]1C(=O)CSC1=O)c1cc(O)c(O)c(O)c1 1865876445 LKAWOPLAVGXXIU-QWHCGFSZSA-N 366.395 0.556 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@]4(CNC(=O)C4)C3)nc12 278977537 YOASRGGFRSBXPH-QGZVFWFLSA-N 359.386 0.324 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@@]4(CCOC4)C3)ccc21 285660668 HQGBORYHVOVNFI-FQEVSTJZSA-N 373.453 0.703 10 10 FCCE C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)N(C)CC(=O)NC1CC1 759597822 SJKYHKSGECOAOZ-SOZJPDODSA-N 362.382 0.780 10 10 FCCE COc1cc(N2CCN(Cc3cc4c(cc3O)OC[C@@H]4O)CC2)ncn1 763384484 RRRVSJZQFSDPQN-HNNXBMFYSA-N 358.398 0.939 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc(-n2cnnn2)cn1 847381401 LIOUEEJUDFEAGP-UHFFFAOYSA-N 365.397 0.824 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCN(C3CCC3)C2=O)c1 863836707 AFBTWIWRNOQAEJ-ZDUSSCGKSA-N 367.427 0.647 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@]2(OC)CCS(=O)(=O)C2)c1 1251160723 AFAXAPJEMFICPT-BDJLRTHQSA-N 372.443 0.965 10 10 FCCE CN(C)CCOC1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1351837648 XVJGLMPPBAFNCE-UHFFFAOYSA-N 361.442 0.804 10 10 FCCE O=C(NCc1ccc(O)c(O)c1)[C@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1595596541 XQMCBPRFMFFFFK-IUCAKERBSA-N 353.318 0.937 10 10 FCCE CC(C)NS(=O)(=O)NCCNC(=O)c1cc2cc(O)c(O)cc2s1 1625114506 LCGHIRKJDZAIFG-UHFFFAOYSA-N 373.456 0.875 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C1 2062452114 SWBUPNNBUJXHDA-FZMZJTMJSA-N 352.387 0.737 10 10 FCCE O=C(O)[C@H](NCc1cc(Br)ccc1O)C1CS(=O)(=O)C1 2197522624 ASPLSUPFMVLXRX-LLVKDONJSA-N 364.217 0.742 10 10 FCCE CC(C)(C)OC(=O)N1CC2(CCOCC2)[C@H]1COc1nnc(=N)[nH]n1 2327760209 KPZVPKAPWMOROH-SNVBAGLBSA-N 352.395 0.474 10 10 FCCE Cn1nc2c(cc1=O)CN(c1cc3c(cc1[N+](=O)[O-])OCC(=O)N3)CC2 371170947 RLVCILFPSVTHIG-UHFFFAOYSA-N 357.326 0.582 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@H]1CCCN(C)C1)c1ccc(N2CCOCC2)cc1 803308875 LTZXLVZBINSSCF-RDJZCZTQSA-N 374.485 0.911 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)COC3(C)CNC3)cc2)CC1 843499597 JMGSVNQRESNTIW-UHFFFAOYSA-N 360.458 0.350 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N(C)CC2CN(C)C2)cc1 850681198 CAGHLQYKGWYDPC-UHFFFAOYSA-N 362.474 0.610 10 10 FCCE CS(=O)(=O)N1CC(C(=O)NCc2cc(Br)ccc2O)C1 908169848 BCYOPJNNICTXFS-UHFFFAOYSA-N 363.233 0.662 10 10 FCCE COc1cc(N(C)Cc2cc(=O)n3nc(N)[nH]c3n2)cc(OC)c1OC 1329478876 AOUMBUINPIRYQP-UHFFFAOYSA-N 360.374 0.662 10 10 FCCE CN(Cc1nncn1C)c1nnnn1Cc1ccc(N2CCOCC2)cc1 1343683645 HNJHYXCCOLGHBC-UHFFFAOYSA-N 369.433 0.323 10 10 FCCE COC(=O)CC1=NN(c2ccccc2)C(=O)C1=C(C)NN1CCN(C)CC1 2294317176 LBPJKWZBEIBUFB-UHFFFAOYSA-N 371.441 0.978 10 10 FCCE COc1ccc(N2CCN(CC(=O)N[C@@H]3CCS(=O)(=O)C3)CC2)cc1 7489357 BULFIUFWJYNMNB-CQSZACIVSA-N 367.471 0.121 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN(CCO)[C@H]3CCO[C@H]3C)nc12 796573893 FLERFTJWPHLDAK-FZMZJTMJSA-N 364.402 0.583 10 10 FCCE CNC(=O)[C@]1(C(F)(F)F)CCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 843053083 HYAVTKNRPQZVOT-AWEZNQCLSA-N 358.320 0.734 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCCCn3cc(CO)nn3)C2)cc1 854297264 LMTQYNUOMWKQHX-AWEZNQCLSA-N 374.445 0.747 10 10 FCCE Cc1cncc(CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 855951411 QFEWMUSNZAZZAC-UHFFFAOYSA-N 350.400 0.835 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)C(=O)N3CC[C@H]3C)CC2)cc1 1331483366 CUENUKMBEHHDIY-MRXNPFEDSA-N 374.485 0.944 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NC[C@@]1(N2CCOCC2)CCSC1 1542293816 FNTIUVHAENYXNO-KRWDZBQOSA-N 352.456 0.964 10 10 FCCE O=C(CNC(CO)CO)Nc1cccc2c1C(=O)c1ccccc1C2=O 1559850031 MMTRBTFTAWXCKG-UHFFFAOYSA-N 354.362 0.343 10 10 FCCE COC(=O)C[C@@H]1O[C@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O 1615946159 BUKUVEWCKMNEFV-BQQXIIOZSA-N 373.318 0.380 10 10 FCCE CN(C)c1ccc([C@H](CNC(=O)Cc2c(O)ncnc2O)N(C)C)cc1 1653421803 RDRPFOMVWYCEPL-HNNXBMFYSA-N 359.430 0.915 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H](CO)[C@H]1CCOC1 1684140713 AOSPHDWFRWUNOG-MAUKXSAKSA-N 363.458 0.844 10 10 FCCE COC(=O)/C=C\c1ccc(N2CCC[C@]3(C2)NC(=O)NC3=O)c([N+](=O)[O-])c1 1772974744 WXOCFQSTQTTZFX-XQDHMALISA-N 374.353 0.959 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC1CNC1 2080880782 OOANNWZJHVZJGF-LBPRGKRZSA-N 351.403 0.622 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](COc3nnc(=N)[nH]n3)O[C@H]2C1 2260766199 PAXQCZBYUWEJMS-DCAQKATOSA-N 352.395 0.472 10 10 FCCE CCN1CCN(C(=O)N2CCN(c3ccc(OC)cc3)CC2)C(=O)C1=O 2398715 NAHKLIGCMVDYHC-UHFFFAOYSA-N 360.414 0.628 10 10 FCCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N1CCN2C(=O)NC[C@@H]2C1 104267081 NZGVHGTVTKJEAX-GPCFVJJQSA-N 356.426 0.772 10 10 FCCE O=C(CN1CCOCC1=O)NCc1ccc(N2CCOCC2)c(F)c1 280181821 OOPLXYQSSSAQLG-UHFFFAOYSA-N 351.378 0.137 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN[C@H]3CCCN(C)C3)CC2)cc1 819023207 IRVOUSZHAQMMHF-HKUYNNGSSA-N 362.518 0.862 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@@H]1CCCCNC1 842239528 IHAIVYNBJZJUHY-QGZVFWFLSA-N 374.485 0.740 10 10 FCCE COc1ccc(N2CC[C@@H](NS(=O)(=O)N(C)C3CCNCC3)C2)cc1 866776503 HUCNAKWPBAEMEN-CQSZACIVSA-N 368.503 0.792 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3CCOCCN3)CC2)cc1 892429078 CLCFEEDOBMDPOO-UHFFFAOYSA-N 363.462 0.364 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)c1cn(C(F)(F)CO)nn1 1142235059 JEUUKHFBHZWOPN-UHFFFAOYSA-N 367.356 0.586 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cnncc3O)cc2)C1 1543378845 WLTGRGPDKGZEAT-ZDUSSCGKSA-N 355.398 0.814 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(N4CCNC4=O)CC3)cc2N1 366211283 RKPLHTWLICOKBF-UHFFFAOYSA-N 361.358 0.920 10 10 FCCE Cn1c2c(ccc1=O)[C@@H](NC(=O)C(=O)NCCc1ccc(N)cc1)CCC2 846344967 SRUQRNUJNOCELZ-INIZCTEOSA-N 368.437 0.820 10 10 FCCE CNC(=O)NC[C@@H]1CN(Cc2ccc([N+](=O)[O-])c(OC)c2O)CCO1 862459505 UVQLYKMKLCIKMX-LLVKDONJSA-N 354.363 0.439 10 10 FCCE O=C1CC[C@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)O1 1348627344 OMXKMJYFDSROPJ-CQSZACIVSA-N 352.412 0.243 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCC(O)(C(N)=O)CC3)C2)cc1 1470771650 GRTMHHMOMQEFEI-ZDUSSCGKSA-N 362.430 0.296 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](O)[C@H]1C(=O)NCCCCN=[N+]=[N-] 2064133715 XYNGPUMKNGEGNX-SDDRHHMPSA-N 357.411 0.924 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2081037001 VKCGAKBRQJXPTA-BJDJZHNGSA-N 355.395 0.629 10 10 FCCE CN1C(=O)NC(=O)C(=CN[C@H](Cc2c[nH]c3ccccc23)C(=O)O)C1=O 2296555005 JFBYVRPAWHIGTO-CYBMUJFWSA-N 356.338 0.345 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N(C)CCCO)CC2)cc1 283089598 VHLXOFPLBCHQBX-UHFFFAOYSA-N 350.463 0.841 10 10 FCCE Cc1cccc(N(CCC(N)=O)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c1 299488454 FHMBGTMLNYKZGO-BQYQJAHWSA-N 370.409 0.314 10 10 FCCE CS(=O)(=O)N1CCN(c2ccc(/C=C/C(=O)O)cc2[N+](=O)[O-])CC1 392106037 LFVLJLRAYPQACH-HWKANZROSA-N 355.372 0.774 10 10 FCCE CN1CC(CN(C)C(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 850602771 HDOJRCSAUJLCJC-UHFFFAOYSA-N 374.485 0.502 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2C[C@H](S(C)(=O)=O)C2)cc1F 1350397144 ZJWHQLTZLMVHBK-HAQNSBGRSA-N 371.434 0.200 10 10 FCCE CCn1cc(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nn1 1526260321 WDWFEDCQXOIVDG-OAHLLOKOSA-N 370.457 0.859 10 10 FCCE C[C@@H](NC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1ccccc1O 1587445021 RTZAYJQHWBKJPH-AGIUHOORSA-N 366.439 0.605 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](C)NC(=O)Cn1cnnn1 1643001635 KIXDLJZVNRTQST-KGLIPLIRSA-N 373.461 0.300 10 10 FCCE NC(=O)C1(NCc2ccc(N3CCOCC3)cc2)CCS(=O)(=O)CC1 1655386991 VJJWBJOYHCMDNO-UHFFFAOYSA-N 367.471 0.046 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NC(=O)COc2ccc(N)cc2)C1 2062449889 BVEHQESSBOFGGW-ZIAGYGMSSA-N 351.403 0.744 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)Nc2ccc(N)cc2)[C@@H](O)C1 2076784720 NNUKPXWMLIDWPF-GUYCJALGSA-N 351.403 0.940 10 10 FCCE O=S1(=O)CCN(CCNCc2ccc(Br)cc2O)CC1 2184637144 LPDBLIRBLICYIW-UHFFFAOYSA-N 363.277 0.975 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNCc1ccc(O)c(O)c1 2312325042 PLDUFYMFYOYJQO-DFBGVHRSSA-N 354.403 0.529 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCC(=O)N3C)CC2)cc1 751539946 GMSMOYGHLZVEJQ-KRWDZBQOSA-N 360.458 0.554 10 10 FCCE COc1ccc(N2CCC(NC(=O)[C@H]3CCN(C)S3(=O)=O)CC2)cc1 843541596 JATYSFAOFXALKX-MRXNPFEDSA-N 367.471 0.814 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CC[C@H](C(N)=O)O3)C2)cc1 852202286 CQGPPHKZDUTGRM-VBNZEHGJSA-N 362.430 0.606 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC[C@@]3(O)C[C@H]3C2)cc1 1327421200 GRYKNUHNDQKCSZ-IFXJQAMLSA-N 361.442 0.573 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(C)CCNC(=O)C1 1447349756 SYLXJHOQCTTWEW-SGTLLEGYSA-N 364.398 0.605 10 10 FCCE CN1CCN(c2ccc(CNC(=O)N[C@@H](CO)[C@H]3CCOC3)cc2)CC1 1479185776 UACPHOXQVMNQCO-WMZOPIPTSA-N 362.474 0.635 10 10 FCCE Cn1cc(C=CC(=O)NCCCSc2nccs2)c(=O)n(C)c1=O 2297570369 RTNDAXKVRRTHQP-UHFFFAOYSA-N 366.468 0.852 10 10 FCCE CCN1C(=O)/C(=C\N2CCN(C(=O)c3ccco3)CC2)C(=O)NC1=S 208732976 GYIUMPUBGMCSLA-KHPPLWFESA-N 362.411 0.185 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3C(=O)N3CCOCC3)CC2)cc1 243473406 NKKACYROSHECRU-QZTJIDSGSA-N 373.453 0.839 10 10 FCCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCCNC(=O)c1cc[nH]n1 588414531 OPVMDLFJJLDGTA-UTCJRWHESA-N 369.425 0.806 10 10 FCCE COc1ccc(N2CCN([C@@H]3CCN(CC(=O)O)C3=O)CC2)cc1F 852726319 JKDRPHSFWCHIBK-CQSZACIVSA-N 351.378 0.642 10 10 FCCE COCCN(Cc1cc(=O)n2nc(N)[nH]c2n1)c1ccc(OC)c(OC)c1 856731954 XPELIZSCDIKFDB-UHFFFAOYSA-N 374.401 0.670 10 10 FCCE CCN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1=O 1119134793 SNYRKCKEALLOCB-CYBMUJFWSA-N 350.394 0.245 10 10 FCCE Cc1nn(C)c2c1[C@H](c1ccc(O)c(O)c1)C(C(=O)NC[C@@H](C)O)=C(N)O2 1864008660 PEDSKCZNFBWZIG-CLAHSXSESA-N 374.397 0.331 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCC[C@@](O)(CO)C3)CC2)cc1 839147757 AATOANSBTXSCRR-IBGZPJMESA-N 363.458 0.163 10 10 FCCE C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H](C)CN1CCO 841457853 WKIOJRFMFZUUTL-NWDGAFQWSA-N 371.459 0.291 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3CCn4nncc4C3)CC2)cc1 847019289 UDZUYQDLYQILQO-GOSISDBHSA-N 372.473 0.285 10 10 FCCE COC[C@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@@H]1CCCOC1 897361764 QTSHYUGXUODSMU-WBVHZDCISA-N 363.458 0.927 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)c2cn(C[C@H]3CNC(=O)O3)nn2)c1 1150543430 OIRCBZOFNUQUJL-MWLCHTKSSA-N 361.358 0.592 10 10 FCCE CC(C)(C)OC(=O)NCCC[C@@H](NC(=O)c1cc(O)nc(O)c1)C(=O)O 2103251907 TUCPLKAQRXTWJS-SNVBAGLBSA-N 369.374 0.981 10 10 FCCE O=S1(=O)C[C@@H](O)[C@@H](NCc2cc(Br)cc(F)c2O)C1 2121362401 ASTNEZZWCRTVRJ-VHSXEESVSA-N 354.197 0.541 10 10 FCCE CC(C)(C)OC(=O)NCC1(O)CCN(C(=O)c2cc(O)nc(O)c2)CC1 2138147691 DIWXXQRHCGSXBT-UHFFFAOYSA-N 367.402 0.985 10 10 FCCE Cc1cccc(CNC(=O)[C@H]2[C@@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c1O 2333190928 KWECPEJGFNWCCI-GUTXKFCHSA-N 366.414 0.658 10 10 FCCE COCCN1C(=O)/C(=C/NC[C@@H]2CC2(Cl)Cl)C(=O)NC1=S 105337964 OCXHYUXCTQMZLR-DGUDBNDOSA-N 352.243 0.543 10 10 FCCE CCn1c(=O)[nH]c(=O)c2c1nc(-c1ccc(N3CCOCC3)cc1)n2C 195512622 QODFMLXBKCYRSJ-UHFFFAOYSA-N 355.398 0.947 10 10 FCCE C[C@H]1CC[C@H](C(N)=O)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 769709611 OOUGIOQEAOSKMY-UWVGGRQHSA-N 355.416 0.490 10 10 FCCE C[C@H](NC(=O)C(=O)N1CCO[C@@]2(CCOC2)C1)c1ccc(N(C)C)cc1 807673743 YHATWDVNGAXCMK-LIRRHRJNSA-N 361.442 0.948 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)NCCc3nnnn3C)C2)cc1 823448801 FROLMBZCJHDJLW-ZDUSSCGKSA-N 359.434 0.587 10 10 FCCE COc1ccnc(N2CCN(C(=O)C(=O)Nc3ccc(N)cc3)CC2)n1 841057307 FNRRDKLIRSDTFM-UHFFFAOYSA-N 356.386 0.355 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)C(=O)NCCCN)cc2F)CC1 842216158 ZUIZLZYXEZLKRI-UHFFFAOYSA-N 365.453 0.049 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)COC3(C)CNC3)cc2F)CC1 844190152 CIJVOLXQLJNZAR-UHFFFAOYSA-N 364.465 0.962 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CC[C@@H](C(N)=O)O3)C2)cc1 852202284 CQGPPHKZDUTGRM-MAZHCROVSA-N 362.430 0.606 10 10 FCCE COC(=O)[C@@]1(O)CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 1119516878 JWALOOIMAXLPOZ-GOSISDBHSA-N 351.422 0.687 10 10 FCCE O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N[C@@H]1[C@H]2COC[C@H]21 1345172856 FDASZGWREANXLS-ZSHCYNCHSA-N 361.467 0.617 10 10 FCCE Cn1cnc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1=O 1596355354 OVKIEUWCWDMQJV-UHFFFAOYSA-N 369.425 0.412 10 10 FCCE O=C(CC1CS(=O)(=O)C1)NCc1ccc(N2CCC(O)CC2)cc1 1641204848 WUSROWURUYDWQP-UHFFFAOYSA-N 352.456 0.699 10 10 FCCE Cc1ccc(O)c(CNC(=O)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1 1645800749 RCBJHUDNHNPMKG-UHFFFAOYSA-N 363.395 0.603 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1C[C@H](O)CO1 2124086870 FRIPHXOBGPXDBC-RYUDHWBXSA-N 368.386 0.668 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(CNC(=O)c2cc(O)c(O)c(O)c2)C1 2132348620 OZTXWGQPUVRNKX-KRWDZBQOSA-N 368.386 0.905 10 10 FCCE Cc1cccn2c(=O)c(/C=C3/SC(=S)NC3=O)c(NCCO)nc12 102844921 VNVDCLXCOCRQML-JXMROGBWSA-N 362.436 0.896 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C(N)=O)CC[C@H]3C)nc12 729266968 UOPBGNGFTKQGRM-MNOVXSKESA-N 361.402 0.697 10 10 FCCE CCOC(=O)C[C@H](O)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 837715439 SJDOAVNGVZQOHM-AWEZNQCLSA-N 372.368 0.732 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)NCC34CC(CN3)C4)C2)cc1 851689758 SYZBWXILNJKUIC-ZUIJCZDSSA-N 372.469 0.506 10 10 FCCE CCN1CC[C@H]1CNC(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 898095925 ITXOIGLQDBHIRB-WBVHZDCISA-N 374.485 0.848 10 10 FCCE NS(=O)(=O)c1cccc(C(=O)C(=O)c2cccc(S(N)(=O)=O)c2)c1 1088715291 IMVYYGGTPVEXNI-UHFFFAOYSA-N 368.392 0.047 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCOC1CCOCC1 1119810032 IWSUTMQKEPKITH-UHFFFAOYSA-N 363.458 0.989 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@@H](CNS(=O)(=O)C2CC2)C1 1298888229 NVUYBZYKEYQXFW-ZDUSSCGKSA-N 368.455 0.961 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(CO)CCOCC1 1624658453 GIRXOWIJGVXMPS-ZDUSSCGKSA-N 367.398 0.477 10 10 FCCE NC(=O)[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(Cc2cc(N)ccc2O)C1 2106667242 UXSHGSZCQZZVAQ-KOLCDFICSA-N 360.336 0.329 10 10 FCCE CC(=O)OC[C@@H]1O[C@@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O 230834828 NHNYHKRWHCWHAJ-MEBFFEOJSA-N 373.318 0.380 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(=O)N(C)C3)CC2)cc1 778420344 UNNLCDGJWRTKQC-FPLPWBNLSA-N 372.425 0.158 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC(N3CC[C@H](O)C3)CC2)cc1 852709736 FGRKBFGFEXPNMS-IBGZPJMESA-N 360.502 0.900 10 10 FCCE Cc1cc(CC(=O)N2CCN(CC(N)=O)C(=O)C2)c(C)n1-c1ccccc1 854911068 LXUVYYFGINYHPM-UHFFFAOYSA-N 368.437 0.793 10 10 FCCE COc1cccc(CNC(=O)[C@@H]2CC[C@H](CN3CCOCC3)O2)c1O 934941048 VZXPRPLXHVXAPM-ZBFHGGJFSA-N 350.415 0.897 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNC(=O)c1ccc(O)c(O)c1 2333598324 CZGFAEHKTROBNG-HONMWMINSA-N 368.386 0.169 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](C)n3cncn3)CC2)cc1 299307509 DWGXVCDBAPZPFC-OAHLLOKOSA-N 358.446 0.786 10 10 FCCE C[C@@H](NC(=O)NCCc1nnnn1C)c1ccc(N2CCOCC2)cc1 771940160 XGJYMDQJFSJZID-CYBMUJFWSA-N 359.434 0.650 10 10 FCCE O=C1CN(CCNC(=O)NCc2cc(Br)ccc2O)CCN1 807094290 WDZRUBLRAPCIED-UHFFFAOYSA-N 371.235 0.386 10 10 FCCE COc1ccc(N2CCC(NC(=O)NC[C@H](C)S(N)(=O)=O)CC2)cc1 853642759 LFQRUIQKCUNZAC-LBPRGKRZSA-N 370.475 0.640 10 10 FCCE C[C@H](NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H](C)CO 853775886 FSRUDJHFBWKAIS-KBPBESRZSA-N 369.487 0.738 10 10 FCCE CCOC(=O)C[C@@H](O)C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1566849580 MYEYWQVUVJLZPU-CYBMUJFWSA-N 373.789 0.861 10 10 FCCE C[C@@H]1CC[C@@H](C(N)=O)[C@@H](C)N1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1627712106 WKAWHTRBWCKPTL-CKYFFXLPSA-N 369.443 0.878 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCC3(S(N)(=O)=O)CC3)C2)cc1 1687024504 CBRYUZRFXAMRTQ-LBPRGKRZSA-N 368.459 0.394 10 10 FCCE O=S1(=O)C[C@H]2NCCN(Cc3ccc(Br)cc3O)[C@@H]2C1 2143712084 IUASEWHMJNIFNH-VXGBXAGGSA-N 361.261 0.726 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)C(=O)NCCc1ccc(N)cc1 2320919905 LHMFFUREEIHUTR-UHFFFAOYSA-N 353.419 0.176 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2332922613 DMJSWOAOWRRERV-FDYHWXHSSA-N 369.422 0.876 10 10 FCCE CC(=O)OC[C@@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@H]1OC(C)=O 616625319 LJICGUPPWNZTFT-MEBFFEOJSA-N 373.318 0.380 10 10 FCCE Cn1nccc1CNC(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 788501601 FUYZUGLTMQWTPS-MRXNPFEDSA-N 372.425 0.950 10 10 FCCE CC(=O)C(=O)COC(=O)Cn1cnc2ccc(Br)cc2c1=O 808504131 SNJFEJKHHUNRRX-UHFFFAOYSA-N 367.155 0.860 10 10 FCCE OCCO[C@]1(CNCc2ccc(N3CCOCC3)c(F)c2)CCOC1 850358181 JJBLGYNLTSQJQC-SFHVURJKSA-N 354.422 0.920 10 10 FCCE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2C[C@H](O)C[C@H]2C(N)=O)c1 862680648 SJBIKLLCNJEMFA-SJORKVTESA-N 355.394 0.967 10 10 FCCE CC(=O)N1CCO[C@@H](C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 930744875 OPMRAHAXEYSIAV-KBXCAEBGSA-N 361.442 0.948 10 10 FCCE COc1cccc(CNC(=O)c2cc(S(N)(=O)=O)cnc2C)c1O 1150544178 ZGJYUSXQGYCVID-UHFFFAOYSA-N 351.384 0.682 10 10 FCCE COC[C@H](CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C)OC 1334034874 SUVBAAQDSDMTJT-INIZCTEOSA-N 363.458 0.853 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C[C@@H]3CCC(=O)NC3)CC2)cc1 1631443357 ZEQPBWIXHIEYIB-INIZCTEOSA-N 374.485 0.850 10 10 FCCE Cc1ccc(CNCCS(=O)(=O)CCO)c(O)c1Br 2352674930 AOOVOKBZIKBBOB-UHFFFAOYSA-N 352.250 0.960 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CN3C(=O)NC(=O)C3(C)C)C2)cc1 855231767 NUFBRWYYUBINKL-GFCCVEGCSA-N 360.414 0.721 10 10 FCCE C[C@H](NC(=O)N1CCN2[C@H](CNS2(=O)=O)C1)c1ccc(N(C)C)cc1 922056218 WMZGGYIJUYNTMN-SWLSCSKDSA-N 367.475 0.357 10 10 FCCE Cn1cnc(S(=O)(=O)NCC(=O)NCc2cccc(Cl)c2O)c1 1305084485 JQTYLRKBIPVZLC-UHFFFAOYSA-N 358.807 0.374 10 10 FCCE CC1CCN(c2ccc(CNC(=O)C(=O)N3CCNC(=O)CC3)cc2)CC1 1322816529 LFNKHGXZJGCJJD-UHFFFAOYSA-N 372.469 0.888 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)N1CC[C@@]12CCOC2 1328212722 FXZYZMNCXOBHDC-FQEVSTJZSA-N 373.453 0.655 10 10 FCCE COc1cc(C(=O)NCc2ccc(O)cc2O)sc1S(N)(=O)=O 1469159647 LJUZATMJNYHLDP-UHFFFAOYSA-N 358.397 0.745 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCNC3=O)cc2)C1 1597004867 YGDGZDJVFXLBOT-GOEBONIOSA-N 358.442 0.531 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCn3nncc3C2)c1 1645580619 TWDFPOOPMKQKRN-UHFFFAOYSA-N 351.388 0.401 10 10 FCCE CN(CCCCO)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 276430552 RYRBTOVKNGMJKF-UHFFFAOYSA-N 353.438 0.983 10 10 FCCE CN1C2(CCC2)COC[C@@]1(CO)CNCc1cc2c(cc1O)OCO2 527751986 FAFNSCROGUHFPM-SFHVURJKSA-N 350.415 0.826 10 10 FCCE C[C@](O)(Cn1ccccc1=O)C(=O)NCc1ccc(N2CCOCC2)cc1 790572064 IVGTZTBLAPTFFB-FQEVSTJZSA-N 371.437 0.752 10 10 FCCE C[C@H](NC(=O)C(=O)N1CN(C)C(=O)[C@H]1C)c1ccc(N2CCOCC2)cc1 834664622 IOKGUZBKBKKFGT-UONOGXRCSA-N 374.441 0.347 10 10 FCCE C[C@@H]1NCC[C@H]1NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 861649863 SSJXOGFWNDTTAV-XJKSGUPXSA-N 366.487 0.471 10 10 FCCE CN1C[C@H](O)C[C@@]1(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 900902793 ZSHPCEMDDRZQLS-BEFAXECRSA-N 365.449 0.858 10 10 FCCE O=C1C[C@@H](CCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CN1 914241273 HURIYJVYOLLOTB-CQSZACIVSA-N 364.421 0.988 10 10 FCCE CC[C@@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCNC1=O 1125257673 PACYIIAWYCZYIN-FOIQADDNSA-N 372.469 0.921 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cnncc3O)cc2)C1 1543378842 WLTGRGPDKGZEAT-CYBMUJFWSA-N 355.398 0.814 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)/C=C/C(=O)N(C)C)CC2)cc1 1583758187 IIUZIGDHARMATJ-CMDGGOBGSA-N 360.458 0.578 10 10 FCCE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)C[C@H](O)COc1ccc(N)cc1 2106663501 ALSXPHFPSQZVPS-GJZGRUSLSA-N 369.462 0.826 10 10 FCCE NC(=O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(O)cc2)SC1=S 2314541838 QWGMYMKQEQSUTM-VIFPVBQESA-N 352.393 0.922 10 10 FCCE O=C(O)CNC(=O)CN1C(=O)/C(=C\c2ccc(O)cc2O)SC1=S 210680887 XTAYMDXSZRDTFY-XCVCLJGOSA-N 368.392 0.500 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC[C@H](NS(C)(=O)=O)C2)c([N+](=O)[O-])c1 265329338 LQIPZTOYHBMVSY-FUEXJSSKSA-N 369.399 0.909 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H](C)Cn1cncn1 286123132 OQPLIXPCERURSU-CQSZACIVSA-N 358.446 0.898 10 10 FCCE C[C@@H](O)[C@]1(N)Cc2c(O)c3c(c(O)c2[C@H](O)C1)C(=O)c1ccccc1C3=O 575625607 ZGPCATNYRXCKDP-YLVVLCGTSA-N 369.373 0.931 10 10 FCCE in-vitro CCOC(=O)c1cnn2c(O)cc(CN3CCSC[C@@H]3CCO)nc12 759731815 OBSADXUGLCTUKC-LBPRGKRZSA-N 366.443 0.911 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@H]3CCCOC3)C2)cc1 827312243 BZUCZQPAVOWGSC-GJZGRUSLSA-N 361.442 0.933 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3[C@H]4COC[C@H]43)CC2)cc1 1324006945 ZJXPJQCICMSIQZ-FVQHAEBGSA-N 359.426 0.541 10 10 FCCE Cn1c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cnc1O 1441949410 WGTZFUFBXBCQSU-ZDUSSCGKSA-N 357.414 0.757 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCNC(=O)COC 1469231428 TYXAEBKNQCFKGO-UHFFFAOYSA-N 352.387 0.437 10 10 FCCE Cn1c(=O)c2ccc(C(=O)NCc3c(O)cccc3F)nc2n(C)c1=O 1471975013 PATMTASFHISFAO-UHFFFAOYSA-N 358.329 0.407 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)NCc2nnc3n2CCNC3=O)c1 1479191412 QIUIOYJEUHZYCP-VIFPVBQESA-N 360.374 0.296 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCC(=O)N1C 1567306560 SYCDWBRFOGHEKU-NWDGAFQWSA-N 350.371 0.309 10 10 FCCE COC(=O)C[C@H]1CS(=O)(=O)CCN1C(=O)c1ccc(C)c(O)c1O 1631775828 AUBANWPISPXLOL-JTQLQIEISA-N 357.384 0.209 10 10 FCCE COc1ccc(N2CCN([C@H](C)C(=O)N(C)CC(=O)NC3CC3)CC2)cc1 42290264 GNMYLJUPSHOWAM-OAHLLOKOSA-N 374.485 0.943 10 10 FCCE C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CC(=O)N1C 284139511 QAIQZFZVNMUPHV-CQSZACIVSA-N 358.442 0.592 10 10 FCCE CNS(=O)(=O)[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 376666793 WBPQHAICAOHGOI-VIFPVBQESA-N 370.387 0.444 10 10 FCCE Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3N=[N+]=[N-])ccc12 504739599 JZSHWIUBDQNWDV-DZQJYWQESA-N 363.326 0.598 10 10 FCCE in-vitro NS(=O)(=O)c1ccc(/C=C2/SC(N3CCOCC3)=NC2=O)c(F)c1 843270413 YXRQEPXUDHZLSG-KPKJPENVSA-N 371.415 0.776 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3[C@H]4CC[C@@H](NC4)[C@H]3C2)cc1 861735147 MZMRNSWUTVLVTH-XOYOTBSWSA-N 356.470 0.825 10 10 FCCE CN1C[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)CC1=O 2060610305 GHQNMYQVNCVQOP-MNOVXSKESA-N 352.395 0.975 10 10 FCCE O=C(NCCNC(=O)c1ccc2[nH]cnc2c1)c1cc(O)c(O)c(O)c1 169839028 QRXUHHAHCDZVMT-UHFFFAOYSA-N 356.338 0.840 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H]3CN(C)CCN3C)C2)cc1 852092896 WTTCMVAGMKCGQO-WBVHZDCISA-N 361.490 0.819 10 10 FCCE COC1(CS(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)CCOCC1 905344428 ZMYFBHZSUJYZFB-INIZCTEOSA-N 371.503 0.867 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(C)c1OC 1138054710 FBMSNLYKQFELLP-LBPRGKRZSA-N 363.370 0.744 10 10 FCCE NC(=O)c1cc([N+](=O)[O-])cn(Cc2ccc(N3CCOCC3)cc2)c1=O 1472972761 HRDFZGSEEZEIEI-UHFFFAOYSA-N 358.354 0.740 10 10 FCCE C[C@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCNC(=O)C1 1534541346 WTXZLEMRPNKVEO-YWZLYKJASA-N 372.469 0.921 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H](CO)[C@@H]1CCOC1 1684140711 AOSPHDWFRWUNOG-CRAIPNDOSA-N 363.458 0.844 10 10 FCCE CN1CCN(NC=C2C(=O)NC(=S)N(C3CCCCC3)C2=O)CC1 2296125852 QNAYWAXFRZMNSO-UHFFFAOYSA-N 351.476 0.198 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CCO[C@]2(CCOC2)C1)c1ccc(N(C)C)cc1 807673740 YHATWDVNGAXCMK-AUUYWEPGSA-N 361.442 0.948 10 10 FCCE C[C@@H](CO)N(C)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 820985548 AEHGRNXGTBGKMK-ZDUSSCGKSA-N 355.460 0.444 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@@]2(CO)COCCN2C)cc1F 915365699 HJHSCVAIJWFXRS-QGZVFWFLSA-N 354.426 0.384 10 10 FCCE O=C(NCc1cc(O)ccc1O)[C@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1303225156 ACRJFAOQBJODOX-UWVGGRQHSA-N 353.318 0.937 10 10 FCCE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)N1CCNC(=O)CC1 1331062935 JEBRLMDJTNXIGN-UHFFFAOYSA-N 372.469 0.984 10 10 FCCE CON(C)C[C@H](O)Cn1cc(NC(=O)/C=C\c2ccc(O)c(O)c2)cn1 1466115070 UMHNUPFRXLDGRR-SDQPKGBYSA-N 362.386 0.800 10 10 FCCE C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCN1S(C)(=O)=O 1566975167 OIPGZUNJYDZQPF-JTQLQIEISA-N 353.404 0.955 10 10 FCCE CCCNS(=O)(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCOCC1 62370934 PWXLOCRGMYDTPE-KRWDZBQOSA-N 370.519 0.960 10 10 FCCE COC(=O)c1ccc(=O)n(CN(C)Cc2ccc(N3CCOCC3)cc2)n1 739840288 YDBLANFXPHSYKK-UHFFFAOYSA-N 372.425 0.956 10 10 FCCE Cn1ccnc1N1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 757508452 IXESDAUCYXYUCW-UHFFFAOYSA-N 358.358 0.986 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@H](C(=O)C4CC4)C3)nc12 775927534 KZCPTVSXIWRLNZ-CQSZACIVSA-N 374.397 0.792 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)c3nc(N)nc(N(C)C)n3)C2)cc1 855223460 AJGRPHDAYXUCCD-LLVKDONJSA-N 357.418 0.537 10 10 FCCE COC(=O)[C@@H]1C[C@H](N2C(=O)CNC2=O)CN1Cc1cc(OC)ccc1O 857057895 ZGWYDQXGTGMCAF-AAEUAGOBSA-N 363.370 0.069 10 10 FCCE COc1ccc(O)c(CNC(=O)C(C)(C)NC(=O)C(C)(C)NC(C)=O)c1 860242530 VCMWDJKDPRSSDB-UHFFFAOYSA-N 365.430 0.827 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@H](O)CC(F)(F)C1 1261353742 DGBAFNHNFSGJMM-CQSZACIVSA-N 355.385 0.940 10 10 FCCE CCS(=O)(=O)C[C@H](C)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1348600550 YJDRPTCHZAYUOP-NSHDSACASA-N 354.428 0.516 10 10 FCCE O=C1C[C@H](CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CN1 1564927659 VSSPZJFABBSMKV-INIZCTEOSA-N 360.458 0.831 10 10 FCCE CC(C)(C)OC(=O)NC1(CNC(=O)c2cc(O)c(O)c(O)c2)COC1 2068618593 RURCCYOFMHHWMA-UHFFFAOYSA-N 354.359 0.827 10 10 FCCE O=C1NC(=S)N(c2ccc(Cl)cc2)C(=O)C1=CNN1CCOCC1 2296079438 NREMPBPZPPMNHZ-UHFFFAOYSA-N 366.830 0.808 10 10 FCCE COC(=O)[C@@H]1C[C@@H]1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 727375871 OOWAZFDMLHVAIA-DLBZAZTESA-N 361.442 0.743 10 10 FCCE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)NCc2ccccc2O)C1 806037780 VIDLDXOYAJIJJR-CYBMUJFWSA-N 356.448 0.462 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NCCCn1ccnn1 817825281 JYZYCJREIPSMQT-OAHLLOKOSA-N 372.473 0.906 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNC3COCCOC3)CC2)cc1 819325582 DPDVQQJQYVPKBD-GOSISDBHSA-N 365.474 0.183 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)[C@@H]3CCOC3)C2)cc1 1118693775 ZVZFCQXUYNWKAD-KFWWJZLASA-N 361.442 0.931 10 10 FCCE CCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@H]1CCS(=O)(=O)C1 1261857010 XJAVQRLPLGSNHG-LBPRGKRZSA-N 352.412 0.270 10 10 FCCE NC(=O)c1cccc2c1CCN(C(=O)C(=O)NCCc1ccc(N)cc1)C2 1330529823 VHTBXGDVVOLTSX-UHFFFAOYSA-N 366.421 0.611 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3C[C@H]4CCN(C)[C@H]4C3)CC2)cc1 1618056015 WCSIKYVVHMEOGV-QFUCXCTJSA-N 374.529 0.814 10 10 FCCE CC[C@H]1C(=O)NCCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1646294831 MGFFYLFGWJROST-LBPRGKRZSA-N 355.416 0.504 10 10 FCCE CC[C@@H]1C[C@H]1C(=O)NC[C@H](CO)NC(=O)c1cc(OC)nc(OC)c1 1718647014 KYGJWHJDUQTPCO-RAIGVLPGSA-N 351.403 0.352 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1CC(C(=O)N2CCCn3ncc(N)c32)=C[C@H]1O 2136281356 TXHKAVGTNGZUKL-QWHCGFSZSA-N 363.418 0.786 10 10 FCCE CN(CC(=O)N1CCC[C@H](C(N)=O)C1)Cc1ccc(N2CCOCC2)cc1 72953299 WQGDTWQQQZVZCZ-KRWDZBQOSA-N 374.485 0.679 10 10 FCCE CC[C@](C)(NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(N)=O 133666603 PYFANSCUHACXLA-SFHVURJKSA-N 366.437 0.522 10 10 FCCE CCN1C[C@@H](S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)CC1=O 632051190 FPNNNKHUKUIBFK-ZDUSSCGKSA-N 353.444 0.902 10 10 FCCE CC(=O)C(=O)COC(=O)CNS(=O)(=O)c1c(C)c(C)cc(C)c1C 808495703 WRKWSOGDVACTFL-UHFFFAOYSA-N 355.412 0.900 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC[C@@](O)(CO)C1 837712252 ASBQMQPUJLKPFJ-SFHVURJKSA-N 367.421 0.691 10 10 FCCE CC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 881851754 PXBIGZCPHLQTIP-KRWDZBQOSA-N 362.499 0.976 10 10 FCCE CN(C[C@@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)C1)S(C)(=O)=O 1183434107 XDANGIBSQMYMBQ-JTQLQIEISA-N 360.407 0.981 10 10 FCCE O=C1C[C@H](CCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CN1 1351301609 MDTXDZZUZVVRJM-HNNXBMFYSA-N 356.426 0.321 10 10 FCCE O=C1NC[C@@H](Cn2cc(C(=O)NCc3c(O)ccc4c3CCCC4)nn2)O1 1635964641 VJKZCMGSIQDOEZ-LBPRGKRZSA-N 371.397 0.901 10 10 FCCE CN(C)c1ccc([C@H](NC(=O)CC[C@H](N)C(O)O)c2nccn2C)cc1 1865960369 URVCQDVWXBWOQZ-HOCLYGCPSA-N 361.446 0.110 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNC(=O)Cc1ccc(N)cc1 2225623294 OWJSZLQJKMFJBJ-OFQRWUPVSA-N 365.430 0.269 10 10 FCCE C[C@@](O)(CNC(=O)NCc1ccc(N2CC=CC2)cc1)CN1CCOCC1 175227381 BJHLYDXIQQSVOI-HXUWFJFHSA-N 374.485 0.945 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCN([C@H]4CCC[C@H]4O)CC3)cc2N1 378157449 HFINEUCJQRZSJN-SWLSCSKDSA-N 362.386 0.961 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCSC[C@H]2CCO)cc1 785428638 PVRZYHCXULHNOK-OAHLLOKOSA-N 351.472 0.695 10 10 FCCE CCn1ncnc1CNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 828813464 NRYUJRFFHPYMFP-ZDUSSCGKSA-N 372.429 0.318 10 10 FCCE COC(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1322171673 NYPNSOXGZYRQDH-LBPRGKRZSA-N 351.378 0.529 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ncnn3C)C2)cc1 1334208230 LIHNJAZWZFXIOC-OLZOCXBDSA-N 372.429 0.396 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ncc3c(n2)CCC3)c1 1626236187 ZBJJNHLRCIAXLO-UHFFFAOYSA-N 362.411 0.972 10 10 FCCE CC(C)(C)OC(=O)NCCN(CCO)S(=O)(=O)Cc1ccc(N)cc1 2044643916 IVUHOIVYMWKHKW-UHFFFAOYSA-N 373.475 0.918 10 10 FCCE COC(=O)[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 728750227 DGXFXKAZETWPRS-MRXNPFEDSA-N 363.414 0.607 10 10 FCCE O=C(Cn1c(O)nc2ccccc2c1=O)OCC(=O)c1ccc(O)c(O)c1 782784408 UMORALUHGMKMLV-UHFFFAOYSA-N 370.317 0.939 10 10 FCCE CN(C)c1ccc(CN2CCN(CC(N)=O)C(=O)C2)c(C(F)(F)F)c1 839172890 RPTYRHFLZZUVRX-UHFFFAOYSA-N 358.364 0.901 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CNCC[C@@H]3C)C2)cc1 851688520 CEWNHENWAXWGEY-GRDNDAEWSA-N 360.458 0.504 10 10 FCCE CN1CCN(c2ccc(CNC(=O)c3nc(O)nc(O)c3N)cc2)CC1 1133127072 JCGYMSBVKUXDJE-UHFFFAOYSA-N 358.402 0.152 10 10 FCCE NS(=O)(=O)c1ccc(OCC(=O)NCc2cc(O)ccc2O)cc1 1558175539 VEQHBVAAVGSWCN-UHFFFAOYSA-N 352.368 0.440 10 10 FCCE COC(=O)[C@H]1CCCN(CC(=O)NCc2cccc(OC)c2O)C1=O 1631543529 UQQQDNBOEGBOML-LBPRGKRZSA-N 350.371 0.429 10 10 FCCE Nc1nc(C2CC2)nc(N2CCN(C(=O)c3cccc(O)c3O)CC2)n1 1645706997 MHDPGYDZRDQMOC-UHFFFAOYSA-N 356.386 0.705 10 10 FCCE CN(Cc1ccc(N)cc1)C(=O)[C@@H]1[C@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C 2136173218 QIKMPSHRSBFKNC-SOUVJXGZSA-N 365.430 0.568 10 10 FCCE COCCN(C(=O)Nc1cc(O)c(O)c(O)c1)[C@H]1CCS(=O)(=O)C1 217278848 CVGKTESEVSFMSU-JTQLQIEISA-N 360.388 0.471 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCC(=O)N3)cc2)C1 853463497 KGUQYMZRKRSJFK-GJZGRUSLSA-N 373.457 0.466 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CCN=C2C1=NNN2C 854987430 CYWMLZVZZMAOAC-ZDUSSCGKSA-N 373.413 0.508 10 10 FCCE CN1C[C@@H](CCNC(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1=O 931645301 UWAFJIKOYICXLE-HNNXBMFYSA-N 360.458 0.696 10 10 FCCE CN(C)S(=O)(=O)CCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1625090733 XHFBDVIUHPNGDR-UHFFFAOYSA-N 373.450 0.560 10 10 FCCE O=S1(=O)C[C@H](c2cc(I)ccc2O)NCCN1 1952456982 HTMAHQYBHHVYPO-SECBINFHSA-N 368.196 0.561 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)O[C@H]2C1 2265036391 DYWXGOTZDPCYTE-SIGLWIIPSA-N 368.430 0.655 10 10 FCCE COc1ccc(N(CC(=O)O)CC(=O)NC[C@H](OC)[C@H]2CCOC2)cc1 853010548 FOQDIDIFZSSODV-BBRMVZONSA-N 366.414 0.754 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3CC[C@@]4(O)C[C@H]4C3)CC2)cc1 853542356 ONDNQBRWUBJTOF-OXJNMPFZSA-N 374.485 0.984 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N(C)C[C@H]3CCCO3)cc2)CC1 898323857 AVCFDWZRSIEXFL-GOSISDBHSA-N 374.485 0.692 10 10 FCCE CN1C[C@@H](CCNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1=O 929800666 HZDRWYGOIMMHLN-ZDUSSCGKSA-N 364.421 0.493 10 10 FCCE COC1(OC)CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H]1O 931640120 NKSUSGAHMIBOIA-KRWDZBQOSA-N 365.474 0.767 10 10 FCCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)cc1C 1283781194 AGSVIFSAWQKASF-OMWFQVSUSA-N 360.454 0.994 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1CCNC(=O)CC1 1327820494 IFXZPSZCJKARCD-CQSZACIVSA-N 360.458 0.457 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N(C[C@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 1544087848 QYNRTCAINHZHOJ-UONOGXRCSA-N 369.439 0.835 10 10 FCCE C[C@H](C(=O)N1CC(N=[N+]=[N-])C1)N1CCN(C(=O)OC(C)(C)C)CC1=O 2060614991 JRFGNZUVXQOVBH-SNVBAGLBSA-N 352.395 0.975 10 10 FCCE CN(CCCN=[N+]=[N-])C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C[C@@H]1O 2076820619 KDYKNJNFSFIMLV-NHYWBVRUSA-N 357.411 0.878 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNCc1ccc(F)cc1O 2218642875 XHXBGTIBESIPLU-SNPRPXQTSA-N 356.394 0.962 10 10 FCCE COc1ccc(CNC[C@H]2[C@@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c(O)c1 2333604552 GSHOBHDPSBEONC-CWRNSKLLSA-N 368.430 0.832 10 10 FCCE CN(C)S(=O)(=O)N1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 366159025 QUPMTPBNMYUVDF-FNORWQNLSA-N 369.443 0.452 10 10 FCCE C[C@H](CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1)S(N)(=O)=O 823523624 HKJZZRPSSPUMDY-GFCCVEGCSA-N 370.475 0.124 10 10 FCCE COC(=O)CCN(C)S(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849415975 JAQPICQGKWIWSH-ZDUSSCGKSA-N 371.459 0.603 10 10 FCCE CC1(CNC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)COC1 852103804 REOHVNWKXRLJLI-UHFFFAOYSA-N 367.471 0.757 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](O)Cn3ccnn3)C2)cc1 852448661 LJZDECWKDJFYQG-ZFWWWQNUSA-N 360.418 0.226 10 10 FCCE COC(=O)[C@@H]1C[C@H](N2C(=O)CNC2=O)CN1Cc1cc(F)ccc1O 857056956 JVFLHTGHCQBDFR-RYUDHWBXSA-N 351.334 0.199 10 10 FCCE CCOC(=O)C[C@H](O)C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1566849581 MYEYWQVUVJLZPU-ZDUSSCGKSA-N 373.789 0.861 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2127629233 HQYSTDIYKAGWTJ-SRVKXCTJSA-N 369.422 0.924 10 10 FCCE O=C(O)CNC(=O)CN1C(=O)/C(=C/c2ccc(O)cc2O)SC1=S 15036452 XTAYMDXSZRDTFY-KMKOMSMNSA-N 368.392 0.500 10 10 FCCE CN1CCCC[C@H]1CN1CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 841033233 QJBOSQHMNSIUAP-KRWDZBQOSA-N 359.474 0.836 10 10 FCCE CS(=O)(=O)NC[C@H]1CCC[C@@H]1NC(=O)NCCc1ccc(N)cc1 841897472 UKALSYVAPWGZAN-HIFRSBDPSA-N 354.476 0.828 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@](CO)(OC)C3)nc12 852410585 DAXGKSUBWHMQOQ-QGZVFWFLSA-N 364.402 0.585 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)c2cncs2)c1 1155093312 ZYLHTVUZQLFCQR-LLVKDONJSA-N 357.413 0.684 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNCc1ccc(O)c(O)c1 2218616769 PLDUFYMFYOYJQO-BYCMXARLSA-N 354.403 0.529 10 10 FCCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@@H](O)[C@H](O)CCN1C(=O)OC(C)(C)C 2315986669 GXVGJXMJIZTJPV-WOPDTQHZSA-N 357.411 0.876 10 10 FCCE O=C(CN1CC(=O)NC1=O)NCc1ccc(N2CCC(CO)CC2)cc1 264829647 IUXNVIKXSZXDNO-UHFFFAOYSA-N 360.414 0.063 10 10 FCCE Cc1ccc(O)c(CN2CCN(S(=O)(=O)N3CCOCC3)CC2)c1 768264498 QJVGQXJMBUSGLI-UHFFFAOYSA-N 355.460 0.395 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN[C@H]3CCCN(C)C3)CC2)cc1 819023210 IRVOUSZHAQMMHF-PKOBYXMFSA-N 362.518 0.862 10 10 FCCE COC(=O)/C=C\c1ccc(N2CCn3nnc(CO)c3C2)c([N+](=O)[O-])c1 820585730 BKBSEFUGFGSKAX-HYXAFXHYSA-N 359.342 0.885 10 10 FCCE O=C(O)[C@H]1CS(=O)(=O)CCN1Cc1ccc(N2CCOCC2)cc1 923249986 PHOZULQRNLOLAS-OAHLLOKOSA-N 354.428 0.207 10 10 FCCE COCCN1[C@@H](C)CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H]1C 1261866664 KEFPRKOJUNNDRI-OKILXGFUSA-N 361.442 0.802 10 10 FCCE C[C@H](NC(=O)C(=O)NCC[C@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 1262269791 GIZCGQKWPVERHS-KBPBESRZSA-N 360.458 0.914 10 10 FCCE C[C@@]1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCNC1=O 1558397182 MPRYTCWBFXYLCD-LJQANCHMSA-N 358.442 0.531 10 10 FCCE O=C(N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)c1c(F)ccc(O)c1O 1654451274 ZFTZDHRQIKCINM-BJOHPYRUSA-N 359.375 0.703 10 10 FCCE COc1ccc(CNC(=O)NCc2cn(C3CC3)c(=O)nc2O)c(O)c1 1675601046 WFLABHQSNDBWJE-UHFFFAOYSA-N 360.370 0.997 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CCNC(=O)c1cc(O)nc(O)c1)C(=O)O 2034319604 FZDXIRFEEQQDQE-VIFPVBQESA-N 355.347 0.591 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3cc(C)ncn3)C2)cc1 828196927 RHLZXBLVEMJGFN-AWEZNQCLSA-N 369.425 0.805 10 10 FCCE NS(=O)(=O)N1CCC(C(=O)NCc2ccc3cccnc3c2O)CC1 862028744 JIUUGOMBKREPPQ-UHFFFAOYSA-N 364.427 0.472 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)[C@H](O)C(C)(C)O)CC2)cc1 900014104 DSNWNAXXAPQLSA-KRWDZBQOSA-N 365.474 0.455 10 10 FCCE CN1CCN(c2ccc(CNC(=O)NC[C@H](O)c3ccnn3C)cc2)CC1 924008842 QZNQGADSJSDBLK-SFHVURJKSA-N 372.473 0.705 10 10 FCCE O=C(NC1CC1)[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332003516 NKRIBWDLJIHGRI-ZDUSSCGKSA-N 357.410 0.752 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1C[C@H](O)CN1c1ccncn1 1466790811 LQGFLPJFCRZWQN-KWCYVHTRSA-N 358.398 0.575 10 10 FCCE O=C(c1cc(O)c(O)c(O)c1)N1CCCN(C(=O)[C@@H]2CCCO2)CC1 169846326 WMYQDRXLBXGZJC-AWEZNQCLSA-N 350.371 0.657 10 10 FCCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H](O)C(N)=O)C1 614077928 VOGDTLCXCXFETP-KRWDZBQOSA-N 358.442 0.370 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC2(COC2)C1 827078985 QSEYWEMEIAUZNY-UHFFFAOYSA-N 359.426 0.388 10 10 FCCE CC[C@H](O)CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 837810115 MGWPGRIPWHMMSE-AWEZNQCLSA-N 368.405 0.983 10 10 FCCE COc1cc(O)c(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1OC 842633438 RKYAGUNCSZKPCU-INIZCTEOSA-N 357.428 0.799 10 10 FCCE Cn1nccc1[C@H](O)CNC(=O)NCc1ccc(N2CCOCC2)cc1 914334637 AUWQKOZOWIPIOH-QGZVFWFLSA-N 359.430 0.790 10 10 FCCE CNS(=O)(=O)CCCNC(=O)NCCCSc1nccs1 1254034795 JDDQZXSETXPMAN-UHFFFAOYSA-N 352.507 0.864 10 10 FCCE CCOC(=O)[C@@]1(C)CN(C(=O)C(=O)N(C)Cc2ccccc2O)CCO1 1332006045 FQVDFZZLIBMNRZ-GOSISDBHSA-N 364.398 0.531 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N3CC[C@@]4(O)C[C@H]4C3)CC2)cc1 1350727273 WBUUWRZMRMLOKC-VBKZILBWSA-N 373.453 0.764 10 10 FCCE NC(=O)[C@H]1CC(C(=O)NCc2cccc(O)c2O)=NN1c1ccc(F)cc1 1593739164 HMPKXFSRQRPKDP-CQSZACIVSA-N 372.356 0.973 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Cn3nccc3N)cc2)C1 1630738294 LAUXIAFIKCYFAJ-AWEZNQCLSA-N 356.430 0.483 10 10 FCCE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCc1cc(O)ccc1O 1651225791 YLGGEIXAGSZZAO-UHFFFAOYSA-N 351.403 0.524 10 10 FCCE CN(C[C@H](O)CNC(=O)OC(C)(C)C)C(=O)COc1ccc(N)cc1 2044690889 JEJUJODOBYZSHX-CYBMUJFWSA-N 353.419 0.992 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](O)[C@H]1C(=O)NCc1ccccc1O 2127618663 CHYVIMHGATZSRZ-SOUVJXGZSA-N 366.414 0.740 10 10 FCCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@H](COCc1ccccc1)C(=O)O 2151967505 LBZPWJKMBNHGMB-LSDHHAIUSA-N 374.393 0.754 10 10 FCCE COc1ccc(Br)c(CNCC(CO)(CO)CO)c1O 2236055479 QEEXKVGCFFFJTP-UHFFFAOYSA-N 350.209 0.216 10 10 FCCE C[C@H]1C[C@@H]1C(=O)NCCC(=O)NCc1ccc(N2CCNC(=O)C2)cc1 106263869 PKRKONNMZPTUKZ-BBRMVZONSA-N 358.442 0.401 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccnn3C)CC2)cc1 788503687 FBGQMZWBRYRNRY-UHFFFAOYSA-N 371.441 0.830 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cn(C)nn3)CC2)cc1 794605673 JHNMSPQQUOLOKZ-BQYQJAHWSA-N 370.413 0.667 10 10 FCCE CO[C@H]1COCC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 897791604 RGCFCLSMIDEUMY-IRXDYDNUSA-N 363.458 0.940 10 10 FCCE CN1C[C@H](O)C[C@]1(C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 924251803 FOZRJDAZMGHTPZ-YLJYHZDGSA-N 374.485 0.460 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCc3cnn[nH]3)cc2)C1 1441942942 CSBOJBKAFPMWHW-CQSZACIVSA-N 356.430 0.755 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Cc3nnc(N)s3)cc2)C1 1626339242 PWEXXDUWCXPHKN-GFCCVEGCSA-N 374.470 0.681 10 10 FCCE CN(CCCN=[N+]=[N-])C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C[C@H]1O 2076820618 KDYKNJNFSFIMLV-IAQYHMDHSA-N 357.411 0.878 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1C[C@@H](O)CO1 2124086869 FRIPHXOBGPXDBC-NEPJUHHUSA-N 368.386 0.668 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC[C@H](O)CO 2124089546 SFOMZYGFUCGURA-RYUDHWBXSA-N 370.402 0.003 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@]4(CCOC4)C3)nc12 274395430 IPHRCABCZOBFHK-QGZVFWFLSA-N 362.386 0.603 10 10 FCCE CCn1ncc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)n1 815427120 LPEWEYVZNSPZAK-UHFFFAOYSA-N 373.413 0.812 10 10 FCCE COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C(=O)c1c(F)ccc(O)c1O 827203650 WPLGWPDWEXUNPN-RQSQLSILSA-N 367.329 0.802 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCCN3CCNC(=O)C3)C2)cc1 852455585 UVGGTCOCNPZNIC-AWEZNQCLSA-N 361.446 0.005 10 10 FCCE CN(C)C(=O)[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1299321825 OVEAWXXJTWVCIY-SNVBAGLBSA-N 355.416 0.314 10 10 FCCE CN(Cc1ccccc1O)C(=O)[C@@H]1[C@H](O)C(=O)N(C)[C@H]1c1cnn(C)c1 1346420672 INNPLCAAHKHKQE-JYJNAYRXSA-N 358.398 0.275 10 10 FCCE CN(C)S(=O)(=O)c1ccc(C(=O)NCc2ccc(O)cc2O)cn1 1557085286 HMIKDUORSWRBBY-UHFFFAOYSA-N 351.384 0.673 10 10 FCCE CC[C@@H]1NC(=O)[C@@H]2C[C@@H](NCc3ccc(OC)c(COC)c3)CN2C1=O 1616103420 XHZXHDRMVQSINR-PMPSAXMXSA-N 361.442 0.809 10 10 FCCE CN(C)c1ccc([C@@H](CNC(=O)c2nccnc2C(N)=O)N(C)C)cc1 1637004986 YBQOPYRIXDQIFZ-CQSZACIVSA-N 356.430 0.674 10 10 FCCE O=C(N[C@H](CO)CN1CCOCC1)c1cc2cc(O)c(O)cc2s1 1639274505 NYEJJHFLFBBILJ-NSHDSACASA-N 352.412 0.735 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@@]3(CCOC3)C2)c1 769626513 VZQZMDOLKAQJDV-HNNXBMFYSA-N 356.400 0.395 10 10 FCCE CCn1c(=O)nc(O)c2c(C(=O)OCC(=O)C(C)=O)cc(C3CC3)nc21 808500929 DIEGKWFBIZTBRP-UHFFFAOYSA-N 359.338 0.709 10 10 FCCE CCN(OC)C(=O)CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1118215002 FSTKKZIOEOHQNP-LBPRGKRZSA-N 350.419 0.456 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@]2(CNC(=O)C2)C1 1324917759 FXKSVKNALWONCH-IBGZPJMESA-N 359.426 0.869 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(Cn2cncn2)CC1 1329412133 LCWUAKOZTIGNRL-UHFFFAOYSA-N 355.398 0.765 10 10 FCCE NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(O)cc2O)cc1 1570462415 SDNZLUDPBNMEDW-UHFFFAOYSA-N 352.368 0.440 10 10 FCCE O=C(C[C@H]1COC(=O)C1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1617143265 QBVKAYHWXWYDKR-CQSZACIVSA-N 366.439 0.491 10 10 FCCE O=C1NC[C@H](Cn2cc(C(=O)NCc3cc(Cl)ccc3O)nn2)O1 1640924491 OITZQWJQKSLYOA-SNVBAGLBSA-N 351.750 0.676 10 10 FCCE Cc1cc(C(=O)N2C[C@H](C(N)=O)[C@@H](C(N)=O)C2)c(C)n1-c1ccc(F)cc1 1641444028 HTNCUKVWBCLESK-HOTGVXAUSA-N 372.400 0.892 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)NC[C@H]3C[C@@H](O)C3)cc2)CC1 1684169930 WREHRJYTBYFZDL-KDYLLFBJSA-N 360.458 0.958 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNCc1ccc(F)cc1O 2218642873 XHXBGTIBESIPLU-AEGPPILISA-N 356.394 0.962 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCN(Cc3nccn3C)CC2)cc1 113253595 KIFFOFQZDGMCRC-UHFFFAOYSA-N 370.501 0.920 10 10 FCCE Cn1nnnc1CCNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 772576749 IJBUSLXKNWJKRL-CQSZACIVSA-N 360.418 0.849 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3c[nH]nc3C)C2)cc1 827147319 PZZBDBPQJGRQSF-AWEZNQCLSA-N 357.414 0.738 10 10 FCCE C[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)CCN1S(C)(=O)=O 827271884 VXADUOYHWLSPDM-OAHLLOKOSA-N 353.488 0.989 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3CCN[C@H](C)C3)CC2)cc1 841749163 AWWCYXFUKICRNX-MRXNPFEDSA-N 361.490 0.821 10 10 FCCE CN(Cc1ccccc1O)C(=O)c1nc(S(N)(=O)=O)c2ccccn12 1629954937 KXBACASDYUKWSP-UHFFFAOYSA-N 360.395 0.960 10 10 FCCE CCOC(=O)N1CCC(NC(=O)c2nnn(-c3ccc(N)cc3)n2)CC1 1857878728 KGTHMDXAMIUUPL-UHFFFAOYSA-N 359.390 0.595 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)CCOC3CNC3)CC2)cc1 829505119 KONORYBRVPJEOH-UHFFFAOYSA-N 362.474 0.312 10 10 FCCE Cc1nn(CCS(=O)(=O)NCc2ccc(N(C)C)cc2C)c(=O)o1 914120142 WDUXMYWHLZCSKP-UHFFFAOYSA-N 354.432 0.639 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC(F)(F)C[C@@H]1CO 1328546108 IXIITLZPNRQMCD-CQSZACIVSA-N 355.385 0.940 10 10 FCCE CCS(=O)(=O)CC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1584515313 OPPHLFKQSLHZDD-UHFFFAOYSA-N 362.398 0.852 10 10 FCCE CC(C)(C)OC(=O)N[C@H](CCNC(=O)c1cc(O)nc(O)c1)C(=O)O 2034319603 FZDXIRFEEQQDQE-SECBINFHSA-N 355.347 0.591 10 10 FCCE CC(=O)CCC(=O)N1CCCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169846356 DGOCVZWVFDUYCL-UHFFFAOYSA-N 350.371 0.847 10 10 FCCE COC(=O)/C=C\c1ccc(N2CCN3C(=O)NC(=O)[C@H]3C2)c([N+](=O)[O-])c1 778587833 FYYLZXLMPIPLLU-HSBHDXMMSA-N 360.326 0.521 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C[C@H]4COC[C@@H](C3)O4)CC2)cc1 801588644 BVDKUETUTYKIMY-HDICACEKSA-N 361.442 0.443 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H](N)CC(F)F)CC2)cc1 829504096 AJLMZZQVWLDANN-OAHLLOKOSA-N 356.417 0.916 10 10 FCCE CS(=O)(=O)N1CCC(CS(=O)(=O)N2Cc3cccc(O)c3C2)CC1 867690773 MLRGGQWIGGNQPL-UHFFFAOYSA-N 374.484 0.709 10 10 FCCE COc1ccc(N2CCN(CC3CN(S(C)(=O)=O)C3)CC2)c(OC)c1 931532770 QRVBUXADKGIXKM-UHFFFAOYSA-N 369.487 0.717 10 10 FCCE COC[C@@H](O)CNC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1251106034 ZFQRPPBYLZTSSO-INIZCTEOSA-N 364.446 0.195 10 10 FCCE CCO[C@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1262137874 HIVLBUPMMHGMDX-SAABIXHNSA-N 374.485 0.738 10 10 FCCE COC(=O)C[C@@H]1CS(=O)(=O)CCN1Cc1cc(F)cc(C(C)=O)c1O 1460599191 CBENTWIZAQSQNT-CYBMUJFWSA-N 373.402 0.896 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H](N)C(F)F)cc2)CC1 1521687661 ZCCQPUJXJCPUKW-OAHLLOKOSA-N 354.401 0.954 10 10 FCCE NS(=O)(=O)N1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1636760008 KLFJIBLEXSZEDQ-UHFFFAOYSA-N 357.413 0.274 10 10 FCCE O=C(NCc1ccc(O)cc1O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1 1643103603 BINYUGDTCZTUQR-CQSZACIVSA-N 372.381 0.905 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNC(=O)c1ccc(O)c(O)c1 2225625231 CZGFAEHKTROBNG-SWHYSGLUSA-N 368.386 0.169 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CN1CCOCC1=O 790739577 HZQJQRGEEMTKGF-UHFFFAOYSA-N 363.414 0.113 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CC[C@@H]4CN(C)C[C@H]43)CC2)cc1 794931199 ZQWMNZLYKXFHAV-VQIMIIECSA-N 358.486 0.980 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3C[C@H]4CC[C@H]3CN4)CC2)cc1 817876822 MTAKYYRISGVURQ-AEFFLSMTSA-N 373.501 0.963 10 10 FCCE COc1ccc(N2CC[C@H](NS(=O)(=O)[C@H](C)C(=O)N(C)C)C2)cc1 849416222 MQQMXUUAHHCHAA-OLZOCXBDSA-N 355.460 0.670 10 10 FCCE COCCN1C[C@@H](C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 855232574 SCHKKUSITWBYDR-LSDHHAIUSA-N 361.442 0.885 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc2c(c1)B(O)OC2 863871709 YIZLZPZVKSHXMP-UHFFFAOYSA-N 352.199 0.671 10 10 FCCE O=C([C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)N1Cc2cccc(O)c2C1 871199520 YPGDXQSTVDJQNN-OLZOCXBDSA-N 364.423 0.270 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@H](O)C1(O)CCOCC1 929973078 WTBRYHGNBCBMRT-HNNXBMFYSA-N 373.833 0.923 10 10 FCCE C[C@H](NC(=O)C(=O)NC[C@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(N(C)C)cc1 1119838409 RSLPIYPRQLEGFG-JFOHDYCDSA-N 361.442 0.850 10 10 FCCE O=C(/C=C/c1ccc(O)c(O)c1)NCCS(=O)(=O)C1CCOCC1 1141126981 CRWMWASATOWNRI-DUXPYHPUSA-N 355.412 0.821 10 10 FCCE COc1ccc(N2CCN(C(=O)C(=O)N(C)CCCCO)CC2)cc1F 1327150177 GGRUMFJESNEGFO-UHFFFAOYSA-N 367.421 0.714 10 10 FCCE CCn1cc(CNC(=O)C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)nn1 1330665475 DLEBHGBFCRJPSJ-ZDUSSCGKSA-N 372.429 0.318 10 10 FCCE O=C(NCc1c(O)cccc1F)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 1638863229 KYJIWQFNRVEAEO-GHMZBOCLSA-N 370.402 0.183 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1CNC(=O)CN1 1952208848 NSYHPRKLZYEMLH-VXGBXAGGSA-N 351.403 0.622 10 10 FCCE CC(=O)c1cc(F)cc(CN2CCN(C(=O)N3CCNCC3)CC2)c1O 530228437 UOULUHMBWOJMPP-UHFFFAOYSA-N 364.421 0.877 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCNC(=O)CC3)cc2)C1 815074400 RKTWHRWMYIIOKT-HOTGVXAUSA-N 372.469 0.921 10 10 FCCE Cn1cc(/C=C/C(=O)N2C[C@H](CO)Cc3ccccc32)c(=O)n(C)c1=O 816784637 QYPHVRUTZZPWPE-SBDDDAINSA-N 355.394 0.295 10 10 FCCE O=S1(=O)CC[C@@]2(CN(Cc3ccc(N4CCOCC4)cc3)CCO2)C1 843426190 PYSDOFLGSWBWFK-GOSISDBHSA-N 366.483 0.913 10 10 FCCE COC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CCOCC1 855289274 KHWXPJAJVBISGK-AWEZNQCLSA-N 372.443 0.935 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H](O)c1cnc[nH]1 868838637 LQNOHLXSPULOIU-HNNXBMFYSA-N 352.341 0.874 10 10 FCCE NCC1(CCNC(=O)C(=O)C(=O)C(=O)NC[C@H]2C[C@H]3C=C[C@H]2CC3)CC1 1261524860 LZNKOEACUNQFGT-MELADBBJSA-N 361.442 0.088 10 10 FCCE Cn1c(O)nc(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1=O 1306939866 LMMDQSDXRJEOMS-CYBMUJFWSA-N 357.414 0.800 10 10 FCCE CN(C)C[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H]1CN(C)C 1329511138 NBISJHQOOFBVOY-HZPDHXFCSA-N 374.485 0.432 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1CN(C2CC2)C(=O)O1 1333008729 NUHICZRNANLXSF-MRXNPFEDSA-N 374.441 0.777 10 10 FCCE CN(C)c1ccc(CNC(=O)c2ccnc(S(N)(=O)=O)c2)cc1F 1442466605 BZWQRQOLWWGLQM-UHFFFAOYSA-N 352.391 0.864 10 10 FCCE COCCN(C)CCN1C[C@@H](NC(=O)c2ccc(C)c(O)c2O)CC1=O 1642000336 GRRPNSLPKFWILU-ZDUSSCGKSA-N 365.430 0.315 10 10 FCCE COc1cc(N2CCN(C[C@H](O)C(C)(C)O)CC2)cc(OC)c1OC 1658172052 CSHXDWICFHZZSR-INIZCTEOSA-N 354.447 0.966 10 10 FCCE CC(C)(C)OC(=O)N1CC(CCO)(NC(=O)c2cc(O)c(O)c(O)c2)C1 2132399214 DHKQQXUVDPQFRW-UHFFFAOYSA-N 368.386 0.905 10 10 FCCE CC(=O)O[C@@H]1O[C@@H](CN=[N+]=[N-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O 616585913 LFQWTDKRDROWBN-ODXJTPSBSA-N 373.318 0.380 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2C[C@H]3CC[C@H]2[C@H](N)C3)cc1 852927467 MNVMNMMXVONHKH-QGTPRVQTSA-N 374.485 0.928 10 10 FCCE CC(=O)N1CCO[C@@H](C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C1 891241505 ATUPFYQHOSWOTK-ZWKOTPCHSA-N 362.474 0.719 10 10 FCCE CC(C)NC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 1330528242 LKCBMYQOZZTIFK-OAHLLOKOSA-N 360.458 0.691 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 1637266321 SNBQZBKGOPXYBR-MLGOLLRUSA-N 355.412 0.493 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CO)C[C@H]2CCCO2)c1 1652026323 SRLGKOAUHCACKI-NWDGAFQWSA-N 358.416 0.424 10 10 FCCE CC(C)(C)OC(=O)N[C@H](CO)CNS(=O)(=O)Cc1ccc(N)cc1 2011517047 SAYVMXCIHMTINB-ZDUSSCGKSA-N 359.448 0.574 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@H]1CC(=O)N1CC(N=[N+]=[N-])C1 2060616024 VNKUNYOZNVPZDF-LLVKDONJSA-N 373.435 0.932 10 10 FCCE COc1ccc(N2CCN(C(=O)NC[C@@H]3CN(C)CCO3)CC2)cc1F 124913648 QEYFVWFDDHQDJM-OAHLLOKOSA-N 366.437 0.997 10 10 FCCE CNC(=O)c1cc(S(=O)(=O)NCc2cccc(OC)c2O)cn1C 269770258 HGZRXMQCBKDUOV-UHFFFAOYSA-N 353.400 0.577 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCCCC(=O)N3)CC2)cc1 279176040 HLXIEIFUGABWLP-GOSISDBHSA-N 374.485 0.992 10 10 FCCE CN(C1CC1)S(=O)(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 736329718 KSPVCYTULPOSCE-AWEZNQCLSA-N 366.487 0.817 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CCN(c3nccn(C)c3=O)CC2)cc1 744451823 YXVNRFADIXVARY-UHFFFAOYSA-N 370.457 0.878 10 10 FCCE CN(C)c1ccc([C@@H](N)CNC(=O)c2ccc(S(N)(=O)=O)cn2)cc1 843296929 CXCSLULWRCFTBP-AWEZNQCLSA-N 363.443 0.225 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3cc(OC)n[nH]3)C2)cc1 861904477 GFPWVSUYNWDGNB-LLVKDONJSA-N 359.386 0.761 10 10 FCCE CCN(CC)c1ccc(CNC(=O)NC[C@H](O)CS(C)(=O)=O)cc1 914254529 MJPQTLXOQLEDSD-HNNXBMFYSA-N 357.476 0.738 10 10 FCCE CN1CCn2nc(C(=O)NCc3c(O)cccc3F)cc2S1(=O)=O 1471976064 QHRORYXPSNANNL-UHFFFAOYSA-N 354.363 0.292 10 10 FCCE NC(=O)[C@@H]1CC(C(=O)NCc2c(O)cccc2O)=NN1c1ccccc1 1635842882 ALKIMTWLIOPIEG-AWEZNQCLSA-N 354.366 0.834 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC[C@@H]1C[C@H]1N 2136245315 SVKDOVYCQHODDY-XQQFMLRXSA-N 365.430 0.997 10 10 FCCE CS(=O)(=O)[C@@H]1CSCCN1S(=O)(=O)Cc1ccc(N)cc1 90922138 SQDXYEAIXTXDBL-GFCCVEGCSA-N 350.487 0.518 10 10 FCCE O=[N+]([O-])c1ccc(O)c(CN2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c1 175499374 WUXZTMGHMHFBIW-CQSZACIVSA-N 355.416 0.605 10 10 FCCE COc1cc(O)c(CN2CCCN(S(=O)(=O)N(C)C)CC2)cc1OC 367972589 LFJHMFTWCCUNMZ-UHFFFAOYSA-N 373.475 0.724 10 10 FCCE CCC(=O)N[C@H](C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742919351 GEQDREPOERJKQK-OAHLLOKOSA-N 362.474 0.848 10 10 FCCE CC[S@](=O)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 828082166 CERGVKNQKWTUDG-SHZVTRLKSA-N 367.471 0.275 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC[C@@H]3OCC(=O)N[C@H]3C2)c([N+](=O)[O-])c1 840312766 NVQDBEMWFMSBJX-WPCIHXCUSA-N 361.354 0.875 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2C[C@H]3CC[C@H]2[C@@H](N)C3)cc1 852927470 MNVMNMMXVONHKH-WBAXXEDZSA-N 374.485 0.928 10 10 FCCE COC(=O)c1ccc(O)c([C@@H](C)NC[C@]23COCCN2C(=O)COC3)c1 866554899 VHMBYIMPZCVGRT-KZULUSFZSA-N 364.398 0.457 10 10 FCCE COc1ccc(N2CCN(S(=O)(=O)C[C@H]3CNCCO3)CC2)cc1F 866753406 RKXZANMGARFHHA-CQSZACIVSA-N 373.450 0.275 10 10 FCCE O=C(CCc1nn[nH]n1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 867152283 ACLZQZHEMBXINS-UHFFFAOYSA-N 369.473 0.981 10 10 FCCE CN(C)C(=O)CN1CCC(NC(=O)NCc2c(O)cccc2F)CC1 917816023 HULSLQNEBVVOMR-UHFFFAOYSA-N 352.410 0.883 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@@H]1COC[C@@H]1O 1251751106 WJPJSYLVVZBPAW-KGLIPLIRSA-N 357.357 0.360 10 10 FCCE CCOC(=O)N1C[C@H](CO)[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1 1304839098 IKWPKLCDKADPCH-PBYRWIMMSA-N 350.371 0.676 10 10 FCCE CCON(C)C(=O)CNC(=O)C(=O)N(CC)Cc1ccc(N(C)C)cc1 1327038445 NOMIXALCPQHIAB-UHFFFAOYSA-N 364.446 0.627 10 10 FCCE COCC1(CNC(=O)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CC1 1334605639 PVJLEZWHTFXUMI-UHFFFAOYSA-N 374.485 0.597 10 10 FCCE CN(C[C@H]1COCCO1)c1nnnn1Cc1ccc(N2CCOCC2)cc1 1352232534 BKCLPWGTUCZFAD-KRWDZBQOSA-N 374.445 0.410 10 10 FCCE CNS(=O)(=O)CC(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1566848985 FWNNOJRGRQEOOU-UHFFFAOYSA-N 364.807 0.096 10 10 FCCE O=C(CN1C(=O)c2ccccc2S1(=O)=O)NCc1cc(O)ccc1O 1651223009 WDCSBCHBPZYFGM-UHFFFAOYSA-N 362.363 0.559 10 10 FCCE CN(C)C(=O)C1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 806539011 DBWLZHZLEULCEQ-OAHLLOKOSA-N 372.469 0.873 10 10 FCCE CN1CC[C@@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)S1(=O)=O 843531983 PAMOMMDWOPRXKJ-HNNXBMFYSA-N 371.434 0.312 10 10 FCCE CNS(=O)(=O)CCNCc1c(C(=O)OC)n(C)c2ccc(F)cc12 894533670 OQXHLZMAMDJILN-UHFFFAOYSA-N 357.407 0.743 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)NC[C@H](O)C3CC3)cc2)CC1 1251105632 WKTUFYFMRALPAZ-KRWDZBQOSA-N 360.458 0.958 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NC2CCC(C(N)=O)CC2)cc1F 1322505839 YVLJUKLHZWDFPB-UHFFFAOYSA-N 364.421 0.668 10 10 FCCE CCNc1nc(NCC)n2c(SCC(=O)NN3CCCC3)nnc2n1 282935532 PDNDBEQECULQLI-UHFFFAOYSA-N 365.467 0.602 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC4CC3(C(=O)OC)C4)nc12 852443454 LGDNQZZECZWFPN-UHFFFAOYSA-N 360.370 0.749 10 10 FCCE Cc1ccc(C(=O)N2CCN(C[C@H]3CCCS3(=O)=O)CC2)c(O)c1O 913127821 GOYMYSODXKDZBY-CYBMUJFWSA-N 368.455 0.741 10 10 FCCE CCOC(=O)N1C[C@H](CO)[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1 1304839096 IKWPKLCDKADPCH-LOWFTVKWSA-N 350.371 0.676 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3C[C@@H]4C[C@]4(CO)C3)C2)cc1 1326252133 AJOJMPDRSRVEJK-QEEYODRMSA-N 373.453 0.479 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC[C@@]23CCOC3)cc1 1326576515 LCISRMFNRBNPTB-IBGZPJMESA-N 361.442 0.981 10 10 FCCE O=C(CO)NCCC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632527 OKIHGSRXNFMCOZ-AWEZNQCLSA-N 369.849 0.625 10 10 FCCE COC(=O)C[C@@H]1O[C@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O 1615946163 BUKUVEWCKMNEFV-JDCLNJACSA-N 373.318 0.380 10 10 FCCE COC(=O)[C@@H](CCSC)NC=C1C(=O)NC(=S)N(CC(C)C)C1=O 2040475537 LNNASIYOVPJQAU-LLVKDONJSA-N 373.500 0.654 10 10 FCCE C[C@@H]1C[C@H]1N1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1=O 369817537 MYVLFLIGRQTMSY-IRUJWGPZSA-N 367.427 0.503 10 10 FCCE COCCNC(=O)CN1CCN(Cc2cc(C)cc(OC)c2O)CC1 732524714 QBDFLLOXJZUIJD-UHFFFAOYSA-N 351.447 0.589 10 10 FCCE CN(C)c1ccc(CNC(=O)c2ccc(S(N)(=O)=O)cn2)cc1F 769737471 HALQYICHENVRCW-UHFFFAOYSA-N 352.391 0.864 10 10 FCCE COC[C@@H](NC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)C1CC1 828579744 WBXDLXKSKDHVRZ-WMLDXEAASA-N 361.442 0.931 10 10 FCCE Cc1cc(Br)c(O)c(CN2CCN(CC(N)=O)C(=O)C2)c1 839169795 JGONOMZVBKVIBR-UHFFFAOYSA-N 356.220 0.593 10 10 FCCE COCCN1C[C@H](C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 855232569 SCHKKUSITWBYDR-CABCVRRESA-N 361.442 0.885 10 10 FCCE Nc1ncn(CC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)n1 867152752 PCOZCRDSPZVTKO-UHFFFAOYSA-N 369.473 0.709 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N3CCC4(COC4)C3)cc2)CC1 898321106 WLOTXKUHFHSKHB-UHFFFAOYSA-N 372.469 0.304 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CCNC(=O)CC1)c1ccc(N2CCOCC2)cc1 1322497276 IFJJUZGLEOEOAI-CQSZACIVSA-N 374.441 0.049 10 10 FCCE CCS(=O)(=O)C1(CNC(=O)C(=O)N(C)Cc2ccccc2O)CC1 1330719969 UAMBEXSTKPIVMT-UHFFFAOYSA-N 354.428 0.434 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)Cn3nc(C)oc3=O)cc2)CC1 1634074571 QFRRLVRQYYKDDC-UHFFFAOYSA-N 373.413 0.130 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@H](C(=O)N3CC(N=[N+]=[N-])C3)O[C@@H]2C1 2253906401 LUKAXSSCGBMNTR-QJPTWQEYSA-N 353.379 0.911 10 10 FCCE O=C(c1c(F)ccc(O)c1O)N1CCC[C@H](C(=O)N2CCOCC2)C1 789945991 AYDHKPRFESFWHB-NSHDSACASA-N 352.362 0.948 10 10 FCCE C[C@H]1CN(S(=O)(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)C[C@@H](C)O1 842784912 CGWWKVKDVCIJEM-DVOMOZLQSA-N 356.492 0.696 10 10 FCCE N=c1cc[nH]cc1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 844174000 IBCWYNAVNAHIKP-UHFFFAOYSA-N 360.439 0.659 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC1(N)CCOCC1 861797570 YISBNNYMTLEHPX-UHFFFAOYSA-N 362.474 0.725 10 10 FCCE CO[C@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1119675859 KEXBEMPLYWXFGQ-SJORKVTESA-N 361.442 0.775 10 10 FCCE COC(=O)[C@@H](F)CNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1331899422 LTVQQYDZDKJTJO-RISCZKNCSA-N 367.377 0.017 10 10 FCCE C[C@@H](NC(=O)C(=O)N1C2CCC1(C(N)=O)CC2)c1ccc(N(C)C)cc1 1341251006 IWEVCNWWIMEROO-CMQUCMFRSA-N 358.442 0.939 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)Cn3nccc3N)CC2)cc1 1539285865 WZZAVOAMRYFJOX-UHFFFAOYSA-N 372.473 0.802 10 10 FCCE Cc1c[nH]c(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c(C)c1=O 1652829230 IVCPZUMZBXLLLW-UHFFFAOYSA-N 365.411 0.999 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@H]1C(=O)NCCCCN=[N+]=[N-] 2310483241 XYNGPUMKNGEGNX-GRYCIOLGSA-N 357.411 0.924 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCS(=O)(=O)C(C)(C)C2)cc1 155203632 FDIOWDSHMPEPFJ-UHFFFAOYSA-N 353.488 0.878 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1 808483911 ZCOKBKLXDJOHLF-AWEZNQCLSA-N 353.396 0.849 10 10 FCCE C[C@@H](NC(=O)C(=O)N1C[C@H]2CC[C@H]1CN2)c1ccc(N2CCOCC2)cc1 817913325 YHCZBPFKNMJIHL-KYJSFNMBSA-N 372.469 0.663 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@H](O)CS(C)(=O)=O 922917161 YAHJVGJKVOXLPI-CJNGLKHVSA-N 371.503 0.697 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCN(Cc3ccnn3C)CC2)cc1 1198742632 OPIQAPBZGMLIFN-UHFFFAOYSA-N 370.501 0.920 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)NCc3nnc(O)n3C)C2)cc1 1312902628 NTPUTIMCGRGUMF-GFCCVEGCSA-N 360.418 0.855 10 10 FCCE CCNc1nc(NCC)n2c(S[C@H]3CCS(=O)(=O)C3)nnc2n1 227118379 LGFKHMXNICIGDI-QMMMGPOBSA-N 357.465 0.662 10 10 FCCE COCCC1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 827078097 HCTAMBIZBKHEJC-UHFFFAOYSA-N 361.442 0.634 10 10 FCCE CN1CCN(c2ccc(CNC(=O)NCC[C@H]3CNC(=O)C3)cc2)CC1 924004969 CSHVGCODDSJBQD-MRXNPFEDSA-N 359.474 0.764 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1 1294155631 GLRYCVWKADWAIY-NSHDSACASA-N 351.384 0.835 10 10 FCCE COC[C@@H](CCNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)OC 1333338743 GTODPDVYJOYXML-MRXNPFEDSA-N 351.447 0.879 10 10 FCCE CN(C)c1ccc(CNC(=O)CN[C@](C)(Cn2cccn2)C(N)=O)cc1 1648579165 JYUWSPCZHQNRFH-GOSISDBHSA-N 358.446 0.099 10 10 FCCE CN(C(=O)OC(C)(C)C)C1(C(N)=O)CN(Cc2cc(N)ccc2O)C1 2047100668 MUIHSJGTXUNXDW-UHFFFAOYSA-N 350.419 0.881 10 10 FCCE COc1ccc(N2CCN(C(=O)C(=O)N3CCN(C(C)=O)CC3)CC2)cc1 244302883 WYURFGKCFVVZAS-UHFFFAOYSA-N 374.441 0.035 10 10 FCCE COC(=O)C[C@@H]1C[C@]2(OC)C(=O)c3cccc(O)c3C(=O)[C@]2(O)[C@@H](C)O1 248036233 QYARGOCFMSDSQR-CFNQITDPSA-N 364.350 0.628 10 10 FCCE biogenic CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@]2(CCO)CCOC2)c1 762576938 UVYGXAFGTBKJDL-OAHLLOKOSA-N 358.416 0.283 10 10 FCCE Cn1nccc1CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 767663051 LOUNZRAKNHVDDD-UHFFFAOYSA-N 362.455 0.514 10 10 FCCE CC(=O)C(=O)COC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1 808510512 WZXRHUKZAGSMDT-UHFFFAOYSA-N 353.396 0.232 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN[C@H](CO)C3CCC3)CC2)cc1 852320512 LLQKNVMDWFEVME-AZUAARDMSA-N 363.502 0.929 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1C[C@H]2COC[C@@H](C1)O2 1324946081 YNGJZUCEOPFDRH-CALCHBBNSA-N 357.410 0.305 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(Cc2ccccn2)CC1 1329393624 YDPKCOSZICVKQM-UHFFFAOYSA-N 366.421 0.974 10 10 FCCE CN(C)C(=O)CC1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1332061936 SBOUBQOAQQEUSO-UHFFFAOYSA-N 359.426 0.951 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NC1CCN(S(=O)(=O)C2CC2)CC1 1630221059 OJQOPFDIBGNPEU-UHFFFAOYSA-N 354.428 0.713 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)C1CN(S(C)(=O)=O)C1 1639587816 HCJSBANZACENFH-UHFFFAOYSA-N 370.427 0.175 10 10 FCCE CCn1c(=O)c2ccccc2n(CC(=O)NCc2cccc(O)c2O)c1=O 1651172827 HYUUNOXIORWXFU-UHFFFAOYSA-N 369.377 0.911 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)CNCc1ccc2c(c1)CCO2 2258306267 HLEFJSQCZSRTAY-UHFFFAOYSA-N 352.431 0.959 10 10 FCCE Cc1cc(C)c(O)c(CN2CCN(S(=O)(=O)N3CCOCC3)CC2)c1 754722435 BDRSXBIOAQSBEW-UHFFFAOYSA-N 369.487 0.704 10 10 FCCE O=C(NCCO)c1ccc(NCc2ccc(N3CCOCC3)cc2)nn1 756767108 NOGZMJVBJQDIQB-UHFFFAOYSA-N 357.414 0.647 10 10 FCCE CNS(=O)(=O)c1cc(NS(=O)(=O)c2cnc3n2CCC3)ccc1O 790406804 HONUIWOYCNLWMM-UHFFFAOYSA-N 372.428 0.244 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3[C@H]4COC[C@H]43)CC2)cc1 794228275 XZIAIZATFYYQBT-UUTWJICRSA-N 371.437 0.661 10 10 FCCE CC(=O)C(=O)COC(=O)CN1C(=O)C(F)(F)c2cc([N+](=O)[O-])ccc21 838105268 NXCRKBXFSGOUQI-UHFFFAOYSA-N 356.237 0.735 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CN(C)S(=O)(=O)N(C)C)C2)cc1 855227438 WNMGXNNMMOGULN-ZDUSSCGKSA-N 370.475 0.128 10 10 FCCE COc1ccc(O)c([C@H](C)NS(=O)(=O)C2CCS(=O)(=O)CC2)c1 1319411008 ZAIRRAWKXRDZEB-JTQLQIEISA-N 363.457 0.958 10 10 FCCE COC(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 1345143490 XBBAJNJTHVTGAL-HNNXBMFYSA-N 359.426 0.925 10 10 FCCE O=C(NCCc1ccns1)C(=O)NCc1ccc(N2CCOCC2)cc1 1353659810 HNRYZKIWNQKBMC-UHFFFAOYSA-N 374.466 0.955 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CN3CCOCC3)cc2)C1 1441946523 LVBUZSZZIAXAQE-INIZCTEOSA-N 360.458 0.337 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N(C[C@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 1544087849 QYNRTCAINHZHOJ-ZIAGYGMSSA-N 369.439 0.835 10 10 FCCE CC(C)(C)OC(=O)N1CC(NC(=O)c2cc(O)c(O)c(O)c2)(C(=O)O)C1 2132410924 QTYMJEOKBBRXFD-UHFFFAOYSA-N 368.342 0.607 10 10 FCCE CC(=O)O[C@@H]1O[C@H](CN=[N+]=[N-])[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O 32107272 LFQWTDKRDROWBN-RKQHYHRCSA-N 373.318 0.380 10 10 FCCE biogenic COc1ccc(N2CCN(C[C@@H](O)CN3[C@H]4CC[C@H]3CN(C)C4)CC2)cc1 931392048 OXWKNYPKQKAQQR-SLFFLAALSA-N 374.529 0.957 10 10 FCCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCS(=O)(=O)[C@@H]2COCC[C@@H]21 1161283373 CWRHYUPTTJLMGQ-LAIWBBNNSA-N 353.396 0.526 10 10 FCCE CS(=O)(=O)CC1(CCNC(=O)C(=O)NCCc2ccc(N)cc2)CC1 1329837811 LJIDTZGPCOCCLO-UHFFFAOYSA-N 367.471 0.259 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCS(=O)(=O)CCO1 1346303755 BIZYWILQRFHSSH-UHFFFAOYSA-N 351.428 0.934 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C2(CS(C)(=O)=O)COC2)cc1 1347715491 BPIZWOJWKUCEIR-UHFFFAOYSA-N 370.471 0.651 10 10 FCCE C[C@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCNC(=O)C1 1534541345 WTXZLEMRPNKVEO-QRWLVFNGSA-N 372.469 0.921 10 10 FCCE CN(C)S(=O)(=O)c1ccc(C(=O)NCc2cc(O)ccc2O)cn1 1593873239 MOXKMDRVRUBVPR-UHFFFAOYSA-N 351.384 0.673 10 10 FCCE CN1CCN(c2ccc(CNC(=O)N[C@H](CO)c3ncc[nH]3)cc2)CC1 1684878326 PDAWQQQJORCREQ-MRXNPFEDSA-N 358.446 0.694 10 10 FCCE COc1ccc(N2CCN(C(=O)c3cnc4[nH]ncn4c3=O)CC2)cc1 1866389854 IADVNLSGYMOPLL-UHFFFAOYSA-N 354.370 0.389 10 10 FCCE CN1CCN(NC=C2C(=O)NC(=O)N(Cc3ccc(F)cc3)C2=O)CC1 2296102803 BAVPSNHVLTVZKX-UHFFFAOYSA-N 361.377 0.040 10 10 FCCE Cc1noc(C)c1S(=O)(=O)N[C@@H](C)C(=O)NCCc1ccc(N)cc1 152511005 DWKOGHIIMIUOFA-NSHDSACASA-N 366.443 0.899 10 10 FCCE CC(=O)O[C@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](C)O[C@H]1OCCN=[N+]=[N-] 213789708 SWFHDHBVUMLTMW-ZDMXAGDWSA-N 359.335 0.853 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@@H]1CS(N)(=O)=O 749305249 IEBQBSHBUNWNSM-MRXNPFEDSA-N 368.503 0.464 10 10 FCCE CN(C)S(=O)(=O)CC(=O)NCc1cccc(Br)c1O 765750594 JNKLLUQEMBNDFT-UHFFFAOYSA-N 351.222 0.662 10 10 FCCE CCN(CC)c1ccc(CNC(=O)N2CC(S(N)(=O)=O)C2)cc1F 823091685 FIZIBDRMOYMUBQ-UHFFFAOYSA-N 358.439 0.854 10 10 FCCE CC(=O)N1CCO[C@@H](C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 829295923 BRWOEVGMDZUVNG-GOSISDBHSA-N 360.458 0.302 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCC34CC(CN3)C4)cc2)C1 851655716 VABKELXBRYZKJU-LFDOHDQPSA-N 371.485 0.940 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](O)C(F)(F)C3)nc12 852411173 FMUBMQUUPRKNQG-NSHDSACASA-N 356.329 0.814 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N3CC4CC3(CN)C4)CC2)cc1 852916900 SVFJJLPEHPDPPW-UHFFFAOYSA-N 372.469 0.684 10 10 FCCE COc1ccc(N(C)CCN(C)S(=O)(=O)C[C@@H]2CN(C)CCO2)cc1 867460398 OCVSJBCNWJRLHO-KRWDZBQOSA-N 371.503 0.724 10 10 FCCE CC1(F)CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 1257214286 ZXHVBJSXMCVFCD-UHFFFAOYSA-N 353.369 0.849 10 10 FCCE CN(C)c1ccc([C@@H](CNC(=O)Cn2cnc([N+](=O)[O-])n2)N(C)C)cc1 1618636106 UHRVFWGUIDSAQQ-CQSZACIVSA-N 361.406 0.671 10 10 FCCE C[C@@H](NC(=O)CCn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1O 1632246973 PDXQSJWQMKRESW-LLVKDONJSA-N 371.397 0.407 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC[C@H]3OCC(=O)N[C@@H]3C2)c([N+](=O)[O-])c1 1642763165 NVQDBEMWFMSBJX-KUXCDZRCSA-N 361.354 0.875 10 10 FCCE O=C(O)C[C@@H](C(=O)O)[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O 6525040 KYSQDMNDMYECNZ-XQEGFVLMSA-N 354.267 0.283 10 10 FCCE in-vitro Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCCN1CCCC1=O 774460473 ICGBAKJNKVHODY-UHFFFAOYSA-N 360.458 0.806 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CC[C@@H]4CN(C)C[C@@H]43)CC2)cc1 794931196 ZQWMNZLYKXFHAV-APWZRJJASA-N 358.486 0.980 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C3(C(=O)N(C)C)CC3)CC2)cc1 806847187 JGQPAZSUYVVBCP-UHFFFAOYSA-N 374.485 0.802 10 10 FCCE CN1C[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)NC1=O 829262952 HORAQHZTLWAYIN-AWEZNQCLSA-N 350.394 0.427 10 10 FCCE Cc1ccc(O)c(CNC(=O)NCCNS(=O)(=O)c2cccnc2)c1 1633416747 FMZRJSSVAYEBPM-UHFFFAOYSA-N 364.427 0.873 10 10 FCCE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](O)CN1C(=O)c1cc(O)c(O)c(O)c1 2132348470 LXYTWWJAZOQJRG-GHMZBOCLSA-N 368.386 0.904 10 10 FCCE NC(=O)NCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 58970313 REKUENFYNHWWTO-UHFFFAOYSA-N 360.336 0.827 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCCC(=O)N3)CC2)cc1 279176046 HLXIEIFUGABWLP-SFHVURJKSA-N 374.485 0.992 10 10 FCCE CN1CCOC[C@H]1CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 858154239 BJEFHURPGYONIO-OAHLLOKOSA-N 366.437 0.792 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H]3CC[C@H](C(=O)O)O3)CC2)c(OC)c1 902412419 MAJFVWBTCCKWGT-LSDHHAIUSA-N 364.398 0.985 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cnc3c(c2)CNC3=O)c1 1472324372 VNEOQDGPUSPJRI-UHFFFAOYSA-N 362.367 0.654 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN(C)CCn3cnnc3)CC2)cc1 1654685594 HBTXFLAFDDWKPZ-SFHVURJKSA-N 374.489 0.402 10 10 FCCE COc1ccc(N2C(=O)NC(=O)C(=CNCCN3CCOCC3)C2=O)cc1 2296331011 WWWRCKXQWMDOBL-UHFFFAOYSA-N 374.397 0.084 10 10 FCCE Cn1cc(NC(=O)C=Cc2ccc(N3CCOCC3)cc2)c(=O)n(C)c1=O 2297666020 WQTWERHLSRCNQC-UHFFFAOYSA-N 370.409 0.573 10 10 FCCE Cc1ccc(CNCCCNS(N)(=O)=O)c(O)c1Br 2352945198 SDASFLSRKRHAMZ-UHFFFAOYSA-N 352.254 0.736 10 10 FCCE CN1C(=O)C(=Cc2cc([N+](=O)[O-])ccc2N2CCNCC2)C(=O)N(C)C1=O 17085498 VWEBIZQSFSIXIX-UHFFFAOYSA-N 373.369 0.438 10 10 FCCE CCOC(=O)c1nc[nH]c1N=Nc1nc(C(=O)N2CCOCC2)c(N)[nH]1 254846572 NGSMLSNFLRUMJT-UHFFFAOYSA-N 362.350 0.780 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCOC[C@H]3CCO)CC2)cc1 762338766 PEYKYIHRTGUJBG-QGZVFWFLSA-N 363.458 0.427 10 10 FCCE CC(=O)C(=O)COC(=O)CS(=O)(=O)c1cccc(Br)c1 808504370 DBLZHCHBOISPSF-UHFFFAOYSA-N 363.185 0.924 10 10 FCCE CNS(=O)(=O)c1cc(NS(=O)(=O)C[C@@H](OC)C2CC2)ccc1O 842589075 QTNKCGUIFDNWHZ-GFCCVEGCSA-N 364.445 0.467 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NCCCn2ccnn2)cc1 846733650 QTEXKTVGRHTSGQ-UHFFFAOYSA-N 374.445 0.388 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(CO)(CO)C1 853452464 IXYJBXWDPNSOTG-UHFFFAOYSA-N 367.421 0.549 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C1CS(=O)(=O)C1 866213564 SJVRDSIKNNDJNB-UHFFFAOYSA-N 356.419 0.448 10 10 FCCE CN(C[C@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)C1)S(C)(=O)=O 1183434113 XDANGIBSQMYMBQ-SNVBAGLBSA-N 360.407 0.981 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3[C@H]4CCC[C@H]43)cc2)CC1 1350476780 WGRWZQDWJBJZRB-BCDXTJNWSA-N 356.470 0.969 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)Cc1nnc2n1CCNC2=O 1660123490 VMKJGKAKKXPBPO-UHFFFAOYSA-N 356.430 0.490 10 10 FCCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NC[C@@H]1CN2CCN1CC2 255142223 QTGLMUYVSWPMPD-WSGSOLELSA-N 356.470 0.652 10 10 FCCE CCN1CN(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1=O 792484157 YAKJFZGYDLEDGB-QGZVFWFLSA-N 362.474 0.300 10 10 FCCE CC[S@](=O)CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687957 SSFJJIQULIXZTM-DEOSSOPVSA-N 351.472 0.570 10 10 FCCE COc1ccc(N2CCN(C(=O)C(=O)N(C)[C@@H](C)CO)CC2)c(OC)c1 867481360 QNVVHFXLLFUXPG-ZDUSSCGKSA-N 365.430 0.192 10 10 FCCE CNC(=O)CN(CC(=O)NC)C(=O)c1cc2cc(O)c(O)cc2s1 1633845057 DTERRPVPDOTCHF-UHFFFAOYSA-N 351.384 0.247 10 10 FCCE O=C(N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)c1c(F)ccc(O)c1O 1654451277 ZFTZDHRQIKCINM-VFZGTOFNSA-N 359.375 0.703 10 10 FCCE CN1CCCc2cc(CNS(=O)(=O)CCCS(C)(=O)=O)ccc21 77387975 MTQVASSHHXAZSL-UHFFFAOYSA-N 360.501 0.923 10 10 FCCE COc1ccc(O)c([C@H](C)NS(=O)(=O)CCCS(C)(=O)=O)c1 751318213 LGSHRZLNDOKJIZ-JTQLQIEISA-N 351.446 0.816 10 10 FCCE COc1ccc(N2CC[C@H](CNS(=O)(=O)C[C@@H]3CNCCO3)C2)cc1 866773820 KEOYYOPCTINDKI-PBHICJAKSA-N 369.487 0.429 10 10 FCCE COc1ccc(N2CCN(C(=O)CS(=O)(=O)N(C)C)CC2)c(OC)c1 870167178 DLAONMDWSKKONV-UHFFFAOYSA-N 371.459 0.244 10 10 FCCE O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)N1Cc2cccc(O)c2C1 871202495 JKYGOPLDKVHNSD-SFHVURJKSA-N 373.453 0.948 10 10 FCCE CS(=O)(=O)C[C@@H](O)CNC(=O)NCc1ccc(N2CCCC2)cc1 914180126 FWEWQZJOKOQACI-HNNXBMFYSA-N 355.460 0.492 10 10 FCCE N[C@@H]1CCCO[C@@H]1C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1118976137 OQFITHZCRKHBKB-SJLPKXTDSA-N 373.453 0.979 10 10 FCCE COC(=O)c1cccn(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1=O 1154025145 GMQXOQPNVVUBKP-LLVKDONJSA-N 360.366 0.794 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ncn(C)n3)C2)cc1 1331024012 VLKGTNHTGVVJQL-OLZOCXBDSA-N 372.429 0.396 10 10 FCCE Cc1n[nH]cc1CCCNC(=O)CCNC(=O)Cc1ccc(O)c(O)c1 1465139314 QHHMVHWHQSROOJ-UHFFFAOYSA-N 360.414 0.927 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC[C@@](O)(C(=O)OC)C2)c([N+](=O)[O-])c1 1472861401 CLOJRVGPZMDERP-LEXSJLIMSA-N 350.327 0.895 10 10 FCCE Cn1nnnc1-c1ccc(NC(=O)C2=S=C(NC(=O)C3CC3)C=C2)cc1 1587404782 GPPUCLYNGXTTIS-UHFFFAOYSA-N 368.422 0.947 10 10 FCCE Nc1nnn(CC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 1620753307 IRVVKPVFUNSUSE-SNVBAGLBSA-N 367.360 0.642 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCc4nccnc4C3)nc12 852697866 JBRUEBYQHMBCMY-UHFFFAOYSA-N 354.370 0.960 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cn1c(O)nnc1O 1152401741 ORIXGVVDNROYIE-UHFFFAOYSA-N 370.749 0.250 10 10 FCCE O=C(C(=O)N1CCC[C@H](N2CCCC2=O)C1)N1Cc2cccc(O)c2C1 1261858136 HASSWKXAOLEHDJ-AWEZNQCLSA-N 357.410 0.848 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)NCCN1C[C@@H]2CCCCN2C1=O 1328609779 MPUIGFZQHTWTRU-HNNXBMFYSA-N 374.441 0.757 10 10 FCCE C[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 1351112609 MYEVDHISBSNSFL-OAHLLOKOSA-N 361.442 0.777 10 10 FCCE Cc1cnc2c(c1)N(C(=O)C1=CC=CN3CCS(=O)(=O)N=C13)CCN2C 1537878972 ZTSOIOYTSBDCPZ-UHFFFAOYSA-N 373.438 0.670 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C[C@H]3CC(=O)NC3=O)cc2)C1 1626338445 ANDCQVZEZMBYRE-KGLIPLIRSA-N 372.425 0.057 10 10 FCCE CNC(=O)c1cccc(N(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c1 1638791274 SSJBCNYOELGPAG-CMDGGOBGSA-N 356.382 0.120 10 10 FCCE Nc1n[nH]c(CNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)n1 1684755154 RMWBHXPCQOYXGG-UHFFFAOYSA-N 367.360 0.501 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNCc1ccc(O)c(O)c1 2218616772 PLDUFYMFYOYJQO-UGFHNGPFSA-N 354.403 0.529 10 10 FCCE O=C(O)CN1C(=O)/C(=C2/SC(N3CCOCC3)=NC2=O)c2ccccc21 33343330 DPGNAFSBVBXWPH-BUHFOSPRSA-N 373.390 0.791 10 10 FCCE COc1cc(NS(=O)(=O)CCCS(=O)(=O)N(C)C)ccc1O 290507139 LEYFVUDWTHAZJG-UHFFFAOYSA-N 352.434 0.424 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CC[C@H](NC(N)=O)C3)CC2)cc1 762926621 VUSOKIKIQOSLDL-AWEZNQCLSA-N 361.446 0.086 10 10 FCCE COCCOC[C@H]1CCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)C1 1326500793 FIEXVRWLSRYRFW-NSHDSACASA-N 350.375 0.618 10 10 FCCE COC(=O)CC1=NN(c2ccccc2)C(=O)/C1=C(\C)NN1CCN(C)CC1 101771552 LBPJKWZBEIBUFB-NBVRZTHBSA-N 371.441 0.978 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN2CCC[C@]3(C2)NC(=O)NC3=O)c1O 279164364 AYWIBOOGNOSKMT-OAHLLOKOSA-N 350.331 0.483 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@@H](C(=O)C3CC3)C2)c1 788206274 SSKKCDQTPXFDNS-CQSZACIVSA-N 368.411 0.584 10 10 FCCE NC/C=C\CNC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 851668865 VXRASWPFLQPHTH-UPHRSURJSA-N 352.460 0.236 10 10 FCCE CCNC(=O)CCCC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCC 1611044880 CMEKINLKUAFNMQ-ZDUSSCGKSA-N 366.414 0.995 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C[C@H]3CCC(=O)NC3)cc2)C1 1630738106 JCTOEMAXGJVIGZ-CVEARBPZSA-N 372.469 0.921 10 10 FCCE CC(CO)(CO)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1682986497 GUAMBJDTANLUAD-UHFFFAOYSA-N 351.447 0.438 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 808498876 YWUSSYARCPYKAW-LBPRGKRZSA-N 371.386 0.928 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)N2CCCC[C@H]2CN2CCOCC2)cc1 842238172 JPDZVOBIYXCQLM-SFHVURJKSA-N 374.485 0.641 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(CO)(CO)C3)C2)cc1 854188091 XBQNFMCIJXFJAB-OAHLLOKOSA-N 363.458 0.908 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc2c(c1)B(O)OC2 863885483 ZYLADNZADPZYMC-UHFFFAOYSA-N 369.182 0.815 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)c3ccc4c(c3)B(O)OC4)C2)cc1 863887040 SHKGRFMYRARXPT-HNNXBMFYSA-N 352.199 0.922 10 10 FCCE CNC(=O)CCCNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1328849035 IOCSKTSVUYLHAB-ZDUSSCGKSA-N 362.430 0.033 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@H]1C[C@@H]2COC[C@@H]2O1 1341025366 MJDGYNXTPNZHQD-OIISXLGYSA-N 361.442 0.597 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(C)C[C@H](O)CN3)cc2)CC1 1343649585 WGAPFKWVIFVIRO-PKOBYXMFSA-N 360.458 0.084 10 10 FCCE O=C(CNS(=O)(=O)c1ccccc1F)NCc1ccc(O)c(O)c1 1631434310 ONBLFBDSQYUAFL-UHFFFAOYSA-N 354.359 0.832 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC3(CO)CC3)CC2)cc1 778394161 RSFJRGYNIKIOCT-VOTSOKGWSA-N 359.426 0.541 10 10 FCCE Cn1cc(/C=C\C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(=O)n(C)c1=O 825535553 BFSIIBDURRJEML-XQRVVYSFSA-N 356.338 0.595 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)N3CCN4C[C@H](O)C[C@H]4C3)C2)cc1 847386918 IQCYKIFMAYVIMJ-BPQIPLTHSA-N 374.485 0.982 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCCNCC3)C2)cc1 851689458 PGYSIKSKGZSGAM-CABCVRRESA-N 360.458 0.648 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CCNC(=O)[C@@H]3CCCN3)C2)cc1 852844375 TWMDWKHSFCIUTG-YOEHRIQHSA-N 360.458 0.648 10 10 FCCE C[C@@H]1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ncnn21 855328408 SZONDPHNJDKTKO-LDYMZIIASA-N 351.388 0.791 10 10 FCCE CS(=O)(=O)CCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)C1CC1 1261863931 PFWAIFCMZZXARW-UHFFFAOYSA-N 352.412 0.270 10 10 FCCE CNC1CCN(C(=O)C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 1327961919 PUJZDGIHPBRIFS-HNNXBMFYSA-N 374.485 0.848 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(CC(F)(F)F)CC1 1331938629 RHJLAPBEOPSNNH-UHFFFAOYSA-N 357.332 0.941 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CS(=O)(=O)C1CC1 1567306076 CAUPDTOSQYJMKS-LBPRGKRZSA-N 371.411 0.265 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC3(CCNC3=O)CC2)c1 1633849138 FVPMFHGTJSUTST-UHFFFAOYSA-N 367.427 0.506 10 10 FCCE Cn1cc(/C=C/C(=O)N2CCOc3cc(F)c(F)cc32)c(=O)n(C)c1=O 1644295913 JUEHUFCWDRROTB-ONEGZZNKSA-N 363.320 0.801 10 10 FCCE COC(=O)[C@H]1CS(=O)(=O)CCN1Cc1ccc([N+](=O)[O-])c(OC)c1O 278481778 JMYNIBCNGWCPSI-LLVKDONJSA-N 374.371 0.081 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)[C@H]3CCN(C)S3(=O)=O)C2)cc1 843607676 FOKKKNNAKAYGCG-XJKSGUPXSA-N 367.471 0.672 10 10 FCCE CC[C@@](C)(CO)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 847363196 XRNURKYVAGLOSL-KRWDZBQOSA-N 354.472 0.946 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC3(N)CCCC3)C2)cc1 851689347 NCQMPSVHYJVSFG-CQSZACIVSA-N 360.458 0.778 10 10 FCCE COC(=O)Cn1cc(CCOc2ccc(N(C)C)c(C(=O)OC)c2)nn1 865395798 BVTQABXNZMHPSK-UHFFFAOYSA-N 362.386 0.925 10 10 FCCE COC(=O)[C@]1(O)CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 1119516879 JWALOOIMAXLPOZ-SFHVURJKSA-N 351.422 0.687 10 10 FCCE Cc1noc(CCNC(=O)C(=O)NCCCSc2nccs2)n1 1257589352 WXUGPQPSAXVYPE-UHFFFAOYSA-N 355.445 0.792 10 10 FCCE COc1nn(C)cc1CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1351301837 OAJIHFIWTSZJPB-UHFFFAOYSA-N 369.425 0.738 10 10 FCCE COCCn1cc(N2C[C@H](C(=O)NCc3ccc(O)cc3O)CC2=O)cn1 1643103605 BJWSZWVNEKMOHW-CYBMUJFWSA-N 374.397 0.610 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNC(=O)c1ccc(O)c(O)c1 2225625230 CZGFAEHKTROBNG-LEWSCRJBSA-N 368.386 0.169 10 10 FCCE CC(=O)N[C@H](C(=O)NCc1ccc(N2CCNC(=O)C2)cc1)C1CCCC1 42078228 UFGQLRMQIYKYDQ-IBGZPJMESA-N 372.469 0.934 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CCN3CCCS3(=O)=O)C2)cc1 855231006 HOMKLYQDXHBLAH-AWEZNQCLSA-N 367.471 0.816 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCS(=O)(=O)C[C@@H]1CCO 919081273 JNYMDAFZCJREAH-INIZCTEOSA-N 369.487 0.752 10 10 FCCE COC(=O)[C@@H]1CCCN(CC(=O)NCc2ccc3cccnc3c2O)C1=O 1451954346 HCMGUGXJJHTQBB-CQSZACIVSA-N 371.393 0.968 10 10 FCCE C[C@@H](NC(=O)Cn1cnnn1)C(=O)NCc1ccc(N2CCCC2)cc1 1624321418 DHZVCHSTOMBZCZ-CYBMUJFWSA-N 357.418 0.094 10 10 FCCE CC(C)(C)OC(=O)NCCC[C@H](NC(=O)c1cc(O)nc(O)c1)C(=O)O 2103254357 TUCPLKAQRXTWJS-JTQLQIEISA-N 369.374 0.981 10 10 FCCE CC(C)(C)OC(=O)NCC1(O)CN(c2cc3c(cc2N)OCC(=O)N3)C1 2106807106 DTEDDJGVVTWMFC-UHFFFAOYSA-N 364.402 0.676 10 10 FCCE C[C@@H]1C[C@@H]1N1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1=O 369817539 MYVLFLIGRQTMSY-XWIASGKRSA-N 367.427 0.503 10 10 FCCE COc1ccc(N2CCCN(C(=O)c3cnc(O)n(C)c3=O)CC2)cc1 378060515 PGQDTEBCLIUUNU-UHFFFAOYSA-N 358.398 0.847 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)CCCO)CC2)cc1 799796064 PVDCOFVSFNETTK-HJWRWDBZSA-N 361.442 0.741 10 10 FCCE CC[S@](=O)CCNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 828082165 CERGVKNQKWTUDG-CANCMXDXSA-N 367.471 0.275 10 10 FCCE CN(C)c1ccc([C@H](N)CNC(=O)c2cn([C@H]3CCCNC3)nn2)cc1 832278527 DQVSGBBCKSMBAQ-JKSUJKDBSA-N 357.462 0.698 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C[C@@H](C)NC(N)=O)CC2)cc1 847399405 CTRZDPADZPJTHE-CQSZACIVSA-N 363.462 0.380 10 10 FCCE COCCCn1nc(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)ccc1=O 852792266 UNXAUSXQPQOPRE-MRXNPFEDSA-N 373.457 0.776 10 10 FCCE CO[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCOC1 855211016 PFBCVUHJQNOWSX-YGRLFVJLSA-N 358.416 0.545 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](OC)[C@H]1CCOC1 1261737485 PPNUVLQVGIUSDM-HEHGZKQESA-N 367.398 0.740 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@@]3(C)CCC(=O)N3)C2)cc1 1328507682 DNLMSNZILPBLMN-BFUOFWGJSA-N 374.441 0.175 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@@H](NC(N)=O)C2)cc1 1340616824 MVJIZOSQTQLOJG-CQSZACIVSA-N 361.446 0.418 10 10 FCCE CCN(C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1)S(C)(=O)=O 1628785314 RCPXRPPVHQWPNG-UHFFFAOYSA-N 356.444 0.913 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2C[C@H](O)[C@H](NC(=O)CCCF)C2)cc1 1739671123 VDWZOQJQVONQEX-OLZOCXBDSA-N 365.365 0.900 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2081034343 GSCOCHAZQVWQAC-GARJFASQSA-N 355.395 0.534 10 10 FCCE C[C@H]1C(=O)NC(=O)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 221251250 MLTBRYHMPBPERH-ULHQUTTKSA-N 353.176 0.252 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3CCC(=O)N(C)C3)C2)cc1 828188308 MJROZZGCJCKLKD-ZIAGYGMSSA-N 374.441 0.127 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CCS(=O)(=O)N(C)C)C2)cc1 855234227 VQKYQKHMVQEKKI-ZDUSSCGKSA-N 355.460 0.672 10 10 FCCE CCN1C[C@@H](S(=O)(=O)NCc2ccc(N3CCOCC3)cc2)CC1=O 866581532 AXQFQIKNZWYGQT-INIZCTEOSA-N 367.471 0.563 10 10 FCCE COc1ccc(N2CCN(CCNc3cc(C(N)=O)ncn3)CC2)cc1 881858040 FGUDFSMBQKMLNO-UHFFFAOYSA-N 356.430 0.818 10 10 FCCE CN1CCN(c2ccc(CN3C(=O)[C@H]4[C@H](O)CCCN4C3=O)cc2)CC1 925079733 NJUFLBDCCTWTFI-IAGOWNOFSA-N 358.442 0.726 10 10 FCCE C[C@@H](NC(=O)C(=O)NCc1cnc2n1CCOC2)c1ccc(N(C)C)cc1 1332949673 YMXBKVPJXKWMAX-CYBMUJFWSA-N 371.441 0.973 10 10 FCCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CN1C(=O)C(=O)N(C)C1=O 1351164877 ZYJUPEBYALYERW-UHFFFAOYSA-N 358.398 0.666 10 10 FCCE C[C@@H](NC(=O)CCn1cc(C(N)=O)c(O)nc1=O)c1ccc(N(C)C)cc1 1447966863 IMOSHNGMJJNNMV-LLVKDONJSA-N 373.413 0.381 10 10 FCCE COCCN1[C@H]2CN(Cc3ccccc3O)C[C@H]2OCCS1(=O)=O 1614963274 OSNJNGHKYKEYKQ-GOEBONIOSA-N 356.444 0.253 10 10 FCCE CS(=O)(=O)N[C@H]1CCCC[C@H]1CNC(=O)Cc1ccc(O)c(O)c1 1640371607 ZLHMSIWGINXNMW-STQMWFEESA-N 356.444 0.865 10 10 FCCE COc1ccc(N(C)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c(OC)c1 1772901999 WHDGVZZILBPYGN-TWGQIWQCSA-N 359.382 0.777 10 10 FCCE COc1ccc(N2CCN(C(=O)CN=c3nc(O)c(C)c(C)[nH]3)CC2)cc1 1858520878 QMHLWZCEHFRXJU-UHFFFAOYSA-N 371.441 0.990 10 10 FCCE COc1ccc2nnc(CCC(=O)NCCc3ccc(O)c(O)c3)n2n1 1860302451 KWDPOSIBEOCGPM-UHFFFAOYSA-N 357.370 0.836 10 10 FCCE O=C(NCCn1cnc(I)c1)c1cc(O)nc(O)c1 2228811574 YXZDUKPUCDFKBB-UHFFFAOYSA-N 374.138 0.724 10 10 FCCE CC(=O)O[C@@H]1O[C@@H](CN=[N+]=[N-])[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O 139280463 LFQWTDKRDROWBN-MQLXINIDSA-N 373.318 0.380 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCn3ccnc3)C2)cc1 826666504 GSDHIVFMBOFCLP-AWEZNQCLSA-N 357.414 0.403 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@H]4CC[C@H]3[C@@H](N)C4)CC2)cc1 923398306 KIWZHNBXNWQKNM-GIUOSPMZSA-N 374.529 0.990 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CNS(=O)(=O)c1cccnc1 1140198673 NRYJNSBYLKRAJN-UHFFFAOYSA-N 370.427 0.868 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCC[C@@H]2C=NNC2=O)c1 1149262903 PQKDHCWXQFWJAC-SECBINFHSA-N 354.388 0.006 10 10 FCCE COc1ccc(CNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)c(O)c1 1296968480 OXRUEBDMYKLULF-UHFFFAOYSA-N 366.399 0.161 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)C1(OC)CS(=O)(=O)C1 1451913600 HOEIUVROMFXFBO-UHFFFAOYSA-N 371.411 0.098 10 10 FCCE CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)NCCN=S(C)(C)=O 1646085426 MFSADPNYAARXGF-UHFFFAOYSA-N 369.468 0.849 10 10 FCCE COc1ccc(Br)c(CNCCS(=O)(=O)CCO)c1O 2360919008 IOGRUKQXMCTPJR-UHFFFAOYSA-N 368.249 0.660 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3ccc[n+]([O-])c3)CC2)cc1 299303474 CFIHMNJXWPUTEB-UHFFFAOYSA-N 356.426 0.881 10 10 FCCE O=C(CN1C(=O)CSC1=S)N1CCC[C@H](Oc2ncc(F)cn2)C1 585340803 FWJYWMKULSVSNK-JTQLQIEISA-N 370.431 0.846 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccnc(S(C)(=O)=O)n1 654846916 NGUASWNYMHBILP-UHFFFAOYSA-N 362.411 0.985 10 10 FCCE Cc1ccc(C(=O)O[C@H](C)C(=O)N(C)CC(=O)NC2CC2)c(O)c1O 727003903 IILLYAZMQCUIMV-SNVBAGLBSA-N 350.371 0.689 10 10 FCCE CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)/C=C\c1cnc(OC)nc1 775824583 IPWCAYRKZSXQGJ-UTCJRWHESA-N 374.422 0.996 10 10 FCCE Cc1cc(CC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2O)c(C)n1-c1ccccc1 913367127 WJYVLZNDYVCSEV-IAGOWNOFSA-N 362.451 0.911 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CC[C@H](C(N)=O)C3)C2)cc1 1331045444 SRNNDEHBXORRKU-MJBXVCDLSA-N 374.441 0.160 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2132348949 VUMBUKRHJNTGNV-WDEREUQCSA-N 368.386 0.904 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)NCCc1ccc(O)c(O)c1 270540542 JYZMQTCCQXYGLD-NSHDSACASA-N 367.402 0.525 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CC[C@@H]3OCC(=O)N[C@H]3C2)cc1F 373717690 FEJVXKFVQIGHMJ-ZFWWWQNUSA-N 350.394 0.691 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CCCNC1 827390427 RRCMCWSBEDDXSZ-OAHLLOKOSA-N 351.472 0.537 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@H](C)N(C)C3CC3)C2)cc1 827891734 MPEAWUIYXNEGHJ-CABCVRRESA-N 374.485 0.989 10 10 FCCE C[C@@H]1CCNC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 851689512 PXAWQXJSPCVANA-KDOFPFPSSA-N 374.485 0.378 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)NC[C@]2(OC)CCS(=O)(=O)C2)c1 1251160725 AFAXAPJEMFICPT-MEDUHNTESA-N 372.443 0.965 10 10 FCCE CC(=O)O[C@@H]1[C@H](C)O[C@H](OCCN=[N+]=[N-])[C@H](OC(C)=O)[C@@H]1OC(C)=O 1616083722 SWFHDHBVUMLTMW-RLJBGXMOSA-N 359.335 0.853 10 10 FCCE COc1ccc(N2CCC(NC(=O)NCCCS(N)(=O)=O)CC2)cc1 1636532049 UCIDUNLLYOXQBS-UHFFFAOYSA-N 370.475 0.642 10 10 FCCE CCn1nc(C)c2c1OC(N)=C(C(=O)NCCO)[C@@H]2c1ccc(O)c(O)c1 1864010083 OWJNDDGQRHTTSX-CQSZACIVSA-N 374.397 0.426 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@H]1CC(=O)NCCN=[N+]=[N-] 2010388646 FGGLBBWCSBZQLN-SNVBAGLBSA-N 361.424 0.837 10 10 FCCE COc1ccc(N(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)cc1OC 109124122 FLTZQCIYPDZVRD-RMKNXTFCSA-N 359.382 0.777 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](CC)C(=O)OC)nc12 791630901 FKEFKDIIEIDKRH-JTQLQIEISA-N 365.342 0.854 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)NCCCS(N)(=O)=O)cc1 1252424428 HDZQULBIZVZQCE-UHFFFAOYSA-N 358.464 0.451 10 10 FCCE O=C(CNS(=O)(=O)c1ccc(F)cc1)NCc1ccc(O)cc1O 1299569706 GEJNIXXJFKMRJE-UHFFFAOYSA-N 354.359 0.832 10 10 FCCE Cc1nn(CC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c(=O)o1 1596355166 KRWULMSBDBXWRJ-UHFFFAOYSA-N 373.413 0.163 10 10 FCCE CC(C)(C)C(=O)NCC(=O)OCCC(=O)NCc1c(O)cccc1O 1645363308 QBACRTRPOLNSRN-UHFFFAOYSA-N 352.387 0.810 10 10 FCCE Cc1nn(C)c2c1[C@@H](c1ccc(O)c(O)c1)C(C(=O)N(C)CCO)=C(N)O2 1865028215 RTQXKSQELGJWMS-CQSZACIVSA-N 374.397 0.285 10 10 FCCE CN(C)c1ccc([C@H](NC(=O)[C@H](N)Cc2cnc[nH]2)c2nccn2C)cc1 1866032150 DEEWCFSYNWIKIG-SJORKVTESA-N 367.457 0.985 10 10 FCCE CC(C)(C)OC(=O)NC1(C(N)=O)CN(C(=O)c2ccc(O)c(O)c2)C1 2054398048 QFUZAVCGEUOMFX-UHFFFAOYSA-N 351.359 0.302 10 10 FCCE CC(=O)C(=O)COC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@]12C 808501486 QBWQZXOZKIHJNR-GOSISDBHSA-N 358.350 0.687 10 10 FCCE COc1ccc(N(C)CCCn2c(=O)c3c(ncn3C)n(C)c2=O)cc1 844352760 GNCVYWNWWPMCLS-UHFFFAOYSA-N 357.414 0.969 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)C3(O)CCOCC3)CC2)cc1F 929820227 BHFCUASEYBYGGO-KRWDZBQOSA-N 354.422 0.859 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3CC[C@H](C(N)=O)C3)C2)cc1 1331045443 SRNNDEHBXORRKU-BFHYXJOUSA-N 374.441 0.160 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)C[C@H]1CO 2122239375 JKOLSUZNEYTYLF-RYUDHWBXSA-N 367.402 0.841 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)O[C@@H]2C1 2265036390 DYWXGOTZDPCYTE-RCZQDCHWSA-N 368.430 0.655 10 10 FCCE CS(=O)(=O)C1=NSC2=NC(=O)C(=Cc3ccc(O)c(O)c3)C(=N)N21 2297345441 WTSPSYWDQOXKNX-UHFFFAOYSA-N 366.380 0.719 10 10 FCCE C[C@H](NC(=O)NC[C@H](C)S(N)(=O)=O)c1ccc(N2CCOCC2)cc1 799892758 OVDMSEONXZFTQG-STQMWFEESA-N 370.475 0.560 10 10 FCCE COC(=O)c1n[nH]c2c1CN(c1cc3c(cc1[N+](=O)[O-])OCC(=O)N3)CC2 829132919 CSBQUVRETMZBTG-UHFFFAOYSA-N 373.325 0.998 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)c3cnn(C[C@@H](O)CO)c3)C2)cc1 855224926 ICXBZAAQLUCHOH-GOEBONIOSA-N 360.414 0.254 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@H](C(N)=O)C3)cc2)C1 858774349 ZTDUGPJHFYRPQI-RBSFLKMASA-N 373.457 0.451 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)NCc3ccnn3C)cc2)CC1 897480887 KZEHXJVHDXDRMK-UHFFFAOYSA-N 370.457 0.105 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)NC1CSC1 1312984675 UXXHFLKTCJTNSA-UHFFFAOYSA-N 355.485 0.836 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@@H](O)CN1c1ccncn1 1466790808 LQGFLPJFCRZWQN-BNOWGMLFSA-N 358.398 0.575 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCC[C@H]2CCOC2=O)c1 1644887562 RGDHNUYYVKZLEZ-JTQLQIEISA-N 356.400 0.837 10 10 FCCE Nc1ccc(-n2nnc(C(=O)N=c3[nH]nc([C@H]4CCCO4)s3)n2)cc1 1857878796 NHQKHZIQGWVHJG-SNVBAGLBSA-N 358.387 0.622 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](CO)(NC(=O)c2cc(O)c(O)c(O)c2)C1 2133571126 LKNXUAMCVXVKLE-KRWDZBQOSA-N 368.386 0.905 10 10 FCCE COc1cc(N2CCC[C@]3(C2)NC(=O)NC3=O)c([N+](=O)[O-])cc1OC 279120936 QDWKCHSFGBJBMJ-OAHLLOKOSA-N 350.331 0.790 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@H](NC(=O)NC4CC4)C3)cc2N1 760601664 MNDQUEOMIVOPFG-SNVBAGLBSA-N 361.358 0.966 10 10 FCCE COc1cc(C(=O)OCC(=O)C(C)=O)cc(NS(C)(=O)=O)c1OC 808522716 XPEXLJCDDMILLW-UHFFFAOYSA-N 359.356 0.390 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)N3CCOC4(CNC4)C3)C2)cc1 818655953 SNRHJPFHFMYCEU-HNNXBMFYSA-N 360.458 0.905 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N3CC4CC3(CN)C4)CC2)cc1 851686967 VSJDIKNVYADGIQ-UHFFFAOYSA-N 372.469 0.730 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)N1C[C@H]2CC[C@H]1CN2 851691062 DQUSGAGWYOWYHK-WBVHZDCISA-N 372.469 0.227 10 10 FCCE O=C(CC[C@@H]1NC(=O)NC1=O)NCc1cc(Br)ccc1O 854442033 DWLAKXQRNBJQAS-VIFPVBQESA-N 356.176 0.759 10 10 FCCE COc1ccc(N(C)CCN(C)S(=O)(=O)C[C@H]2CN(C)CCO2)cc1 867460399 OCVSJBCNWJRLHO-QGZVFWFLSA-N 371.503 0.724 10 10 FCCE NS(=O)(=O)CCCC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1136985260 ZMUPAWXKQRRHQG-UHFFFAOYSA-N 373.450 0.472 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C1=C2CCCN=C2NN1 1167762654 QZAOWYYBWDOSPJ-UHFFFAOYSA-N 355.442 0.818 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)NCc2cn(C)nn2)cc1F 1332732174 ZWPOVCLCNZABPI-UHFFFAOYSA-N 362.409 0.733 10 10 FCCE Cn1c(=O)c2ccc(C(=O)N3Cc4cccc(O)c4C3)nc2n(C)c1=O 1587928520 PDYQMUYOSXEAGX-UHFFFAOYSA-N 352.350 0.494 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC(CO)CO 2124090154 VVXXOSYCUOKLOU-LBPRGKRZSA-N 370.402 0.003 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3[C@H]4COC[C@H]43)cc2)C1 792893000 JNAJEYAFNFNLQR-QMCVQRASSA-N 358.442 0.832 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCC[C@@H](N)C3)C2)cc1 851688337 XGHRFRKYGKJZRV-KFWWJZLASA-N 360.458 0.776 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 861786571 MILHSSWUCBPDQS-ZWKOTPCHSA-N 374.485 0.521 10 10 FCCE CC(C)(O)C[C@@H](O)CNc1ccccc1OCC(=O)N1CCOCC1 872211053 FZFPCQKLOMDGNM-CQSZACIVSA-N 352.431 0.858 10 10 FCCE CN1C[C@@H](O)C[C@]1(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 900902795 ZSHPCEMDDRZQLS-HNAYVOBHSA-N 365.449 0.858 10 10 FCCE COc1ccc(N(C)C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)cc1OC 920472987 FLTZQCIYPDZVRD-TWGQIWQCSA-N 359.382 0.777 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCN3C(=O)OCC[C@@H]3C2)cc1 1327319205 MZIDNNJYRKAAMR-OAHLLOKOSA-N 360.414 0.422 10 10 FCCE C[C@H](NC(=O)C(=O)NCc1cn(C)nn1)c1ccc(N2CCOCC2)cc1 1346321963 QYMHRLCMEWWPBN-ZDUSSCGKSA-N 372.429 0.145 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3CCCC(=O)N3)cc2)CC1 1558396649 JBUTZZCAKBSDDB-MRXNPFEDSA-N 358.442 0.673 10 10 FCCE O=C(Cc1ccc(F)cc1)N[C@@H](CO)C(=O)NCc1ccc(O)c(O)c1 1595595871 MGVHYBXVZWJNTR-AWEZNQCLSA-N 362.357 0.573 10 10 FCCE C[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@@H]1CCC(=O)N1 1596354809 DUPBAGKWMUDETH-DYVFJYSZSA-N 372.469 0.919 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNC(=O)Cc2ccc(O)c(O)c2)C1 1637891683 HIMRRWLDSNRGIW-SWLSCSKDSA-N 366.414 0.984 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNC(=O)c1ccc(O)c(O)c1 2333598323 CZGFAEHKTROBNG-GDLCADMTSA-N 368.386 0.169 10 10 FCCE Cc1ccc(O[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C2)nn1 220328889 ICQVBMNWSBJASM-SNVBAGLBSA-N 352.441 0.625 10 10 FCCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccnc(S(C)(=O)=O)n1 847696327 OVAHXGHIKYDHIF-VIFPVBQESA-N 351.384 0.652 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CN3CCCCC(=O)C3=O)C2)cc1 869229000 RCPBAWHWTAFKIF-AWEZNQCLSA-N 359.426 0.972 10 10 FCCE CCON(C)C(=O)CNC(=O)C(=O)NCCCSc1nccs1 1326693376 NLRNLCCPVSETKZ-UHFFFAOYSA-N 360.461 0.268 10 10 FCCE CN1CCC(N(C)CCN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1330396608 NNZHWYBTORFICH-UHFFFAOYSA-N 374.485 0.719 10 10 FCCE Cn1cc([C@@H](O)C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cn1 1455868448 TYCMVTALPRBPTO-QGZVFWFLSA-N 371.441 0.472 10 10 FCCE C[C@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@H]1CCC(=O)N1 1596354857 DUPBAGKWMUDETH-SUMWQHHRSA-N 372.469 0.919 10 10 FCCE O=C(CNS(=O)(=O)c1cccc(F)c1)NCc1ccc(O)cc1O 1643101154 XARUUSLPDGKKQB-UHFFFAOYSA-N 354.359 0.832 10 10 FCCE COC(=O)C[C@H](N)C(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 1865968408 VEOSEAGYRGWHLQ-GOEBONIOSA-N 359.430 0.582 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](CO)(NC(=O)c2cc(O)nc(O)c2)C1 2069746911 KTUFRGISFMPTSQ-INIZCTEOSA-N 353.375 0.595 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@@H]1C[C@H]1N 2080880250 JESOETMRIUMSHC-UTUOFQBUSA-N 351.403 0.749 10 10 FCCE COCCN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCOC1 787845046 ZGJZQFZRBFXGOP-GFCCVEGCSA-N 358.416 0.641 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3ccn(C)n3)C2)cc1 828092245 FZYJLQSCPSHCDK-AWEZNQCLSA-N 357.414 0.440 10 10 FCCE CS(=O)(=O)[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1351917523 ADCIHUUVMWTUDK-ZDUSSCGKSA-N 366.439 0.660 10 10 FCCE CC(C)(C)OC(=O)N[C@H](COS(N)(=O)=O)Cc1ccc(O)c(O)c1 1951691832 AEQORDGPZXABAJ-JTQLQIEISA-N 362.404 0.754 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC[C@@H](S(N)(=O)=O)C2)c([N+](=O)[O-])c1 732667334 NCHBGPCVRVSONZ-USEMIUTHSA-N 355.372 0.648 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN2CCOC[C@H]2C1 758395322 CYGBSEIXUQWIGF-GOSISDBHSA-N 360.458 0.749 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cnn2c(=O)cc[nH]c12 774381105 RTVMAHDBJLITAW-UHFFFAOYSA-N 371.372 0.928 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@H](Cn3ccnn3)C2)cc1F 827574926 JHZLHZIOVSDHIJ-CQSZACIVSA-N 374.420 0.648 10 10 FCCE CCOC(=O)CN1C(=O)/C(=C\c2cn(CC(=O)OC)nn2)c2ccccc21 834430160 HXUPMODVIURHHM-ZSOIEALJSA-N 370.365 0.901 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCC34CC(CN3)C4)cc2)C1 851655717 VABKELXBRYZKJU-NGEICVOHSA-N 371.485 0.940 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCN(c4nccnn4)CC3)cc2N1 858663273 RCDWSKCTQLSLRL-UHFFFAOYSA-N 357.330 0.437 10 10 FCCE COC(=O)[C@]1(OC)CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 862744259 QGHHXPDMHYUPFB-HNNXBMFYSA-N 372.399 0.168 10 10 FCCE O=C1O[C@H]2CNC[C@H]2N1C1CCN(Cc2cc3c(cc2O)OCO3)CC1 863642792 XVXPIYUATXGCGX-DYVFJYSZSA-N 361.398 0.878 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1616857947 BZTOZTDQPUVEMD-INIZCTEOSA-N 370.519 0.753 10 10 FCCE CCO[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)CN(C)C 1645024810 SLCPTAVMOXIMKF-LBPRGKRZSA-N 359.448 0.460 10 10 FCCE COc1cccc(CNS(=O)(=O)c2cc(C(=O)N(C)C)n(C)c2)c1O 774772023 ODYDKLZXQKDREG-UHFFFAOYSA-N 367.427 0.920 10 10 FCCE COCc1n[nH]c(CNC(=O)NCc2ccc(N3CCOCC3)cc2)n1 853474673 KYQBVFIMYHGFII-UHFFFAOYSA-N 360.418 0.787 10 10 FCCE CNS(=O)(=O)c1ccc(CC(=O)NCc2ccc(O)cc2O)cc1 1162278950 OPFZTEIIPMEJCZ-UHFFFAOYSA-N 350.396 0.865 10 10 FCCE COc1ccc(CNC(=O)NCC2(S(=O)(=O)N(C)C)CC2)c(O)c1 1248731349 RZGNDDYKDXTSCD-UHFFFAOYSA-N 357.432 0.624 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCn2c(CC3CC3)nnc2C1 1346233967 YXBVNESFGFMZTJ-UHFFFAOYSA-N 369.425 0.937 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NC[C@H](O)COc1ccc2c(c1)OCO2 1465908789 GGODMGFKSGLGFT-LBPRGKRZSA-N 361.350 0.925 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](CC)NC(C)=O 1638030570 OYPFWMSKIGBZAG-STQMWFEESA-N 352.387 0.603 10 10 FCCE CO[C@@H]1COCC[C@H]1N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1644526481 MTWWDGDYJWYOTB-TZMCWYRMSA-N 358.416 0.640 10 10 FCCE CC(C)(C)OC(=O)NC[C@H]1C[C@H](O)CN1C(=O)c1cc(O)nc(O)c1 2067395890 JUPGBXORPZKPRJ-MNOVXSKESA-N 353.375 0.593 10 10 FCCE O=C(O)[C@@H]1[C@H](O)[C@@H](O)CN1Cc1cc(Cl)cc(Br)c1O 2200842987 CKYQVJUNFJGCOY-ATZCPNFKSA-N 366.595 0.799 10 10 FCCE CC(C)(C)OC(=O)NC[C@]1(O)CCCN(C(=O)c2cc(O)nc(O)c2)C1 2270837984 ONFIELDGZPQDPP-QGZVFWFLSA-N 367.402 0.985 10 10 FCCE COC(=O)/C=C1\SC(NC(=O)CN2C(=O)c3ccccc3C2=O)=NC1=O 58834513 MOTIRYTWELDGLH-POHAHGRESA-N 373.346 0.085 10 10 FCCE COc1cccc(O)c1CN1CCN(S(=O)(=O)N2CCOCC2)CC1 768265389 YSMCKTBSTDBKGO-UHFFFAOYSA-N 371.459 0.095 10 10 FCCE CS(=O)(=O)NCC1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 795669310 DJWGKFQENVGEOL-OAHLLOKOSA-N 356.444 0.579 10 10 FCCE NC(=O)c1nccnc1C(=O)NCc1cc(Br)ccc1O 804735527 CPIJPRYPNMSDME-UHFFFAOYSA-N 351.160 0.974 10 10 FCCE Cc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(N(C)C)nn1 850434662 ZXDUOSBRJHIRFW-SNVBAGLBSA-N 373.413 0.948 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCC4=C(CCC(=O)N4)C3)nc12 852298238 WEYBEUKGGAFIIC-UHFFFAOYSA-N 371.397 0.981 10 10 FCCE CC[S@](C)(=O)=NS(=O)(=O)NCc1ccc(N2CCOCC2)cc1 866581504 AIPZEKQHUHRHOF-QFIPXVFZSA-N 361.489 0.975 10 10 FCCE COc1ccc(N2CC[C@@H](CNS(=O)(=O)C[C@@H]3CNCCO3)C2)cc1 866773902 KEOYYOPCTINDKI-YOEHRIQHSA-N 369.487 0.429 10 10 FCCE CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(O)c1)[C@H](O)c1cccnc1 1151407409 KEMSAHZSCOSREW-IAGOWNOFSA-N 360.366 0.817 10 10 FCCE COCCc1cc(NC(=O)C(=O)NCc2ccc(OC)cc2O)n(C)n1 1321569090 FWSITIHVNWWXDD-UHFFFAOYSA-N 362.386 0.578 10 10 FCCE CN1C[C@H](CCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1=O 1332871337 JXRUYXSQYBZUED-MRXNPFEDSA-N 370.453 0.664 10 10 FCCE O=C(O)[C@@H]1[C@@H](O)[C@H](O)CN1Cc1cc(Br)cc(F)c1O 2200843482 JFVYVQJHEUHXLP-YWVKMMECSA-N 350.140 0.284 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)CCN(C)C)C2)cc1 827489872 WWELVZYOWYGDQF-CABCVRRESA-N 362.474 0.847 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(C)c(O)n3)cc2)CC1 832795248 YBMBBWQAOBWRBL-UHFFFAOYSA-N 357.414 0.724 10 10 FCCE COC(=O)[C@@H](CCC1OCCO1)NC(=O)/C=C\c1ccc(O)c(O)c1 1152646333 XKSKTJBOSBXHMM-GCLPIYDQSA-N 351.355 0.922 10 10 FCCE CC(C)NC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(N)cc2)C1 1328367925 LKCBMYQOZZTIFK-HNNXBMFYSA-N 360.458 0.691 10 10 FCCE CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C[C@H]1O)c1ccc(N)cc1 1890108343 MEXQQMLODYVQBV-RDTXWAMCSA-N 365.430 0.964 10 10 FCCE CC(C)(C)OC(=O)NC[C@@H](CO)NS(=O)(=O)Cc1ccc(N)cc1 2011423083 XTDPQHRUNQQCLL-ZDUSSCGKSA-N 359.448 0.574 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C1CS(=O)(=O)C1 2076837605 MLKVVYMWYDLTHG-GHMZBOCLSA-N 373.435 0.836 10 10 FCCE Nc1ccc(CS(=O)(=O)NCCn2ncc(Br)n2)cc1 2179693054 CHDJVOJYZDGSEZ-UHFFFAOYSA-N 360.237 0.742 10 10 FCCE COc1ccc(N2CCN(C=O)CC2)cc1NC(=O)c1ccc(=O)[nH]c1 62275241 OMZWCYQWAKXHJW-UHFFFAOYSA-N 356.382 0.914 10 10 FCCE CN(C)CC(=O)N1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 757509738 ZKSRWVLUDWYPQT-UHFFFAOYSA-N 363.374 0.136 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](O)Cc1cnn(C)c1 819697952 GKXXBTIWNYOZFR-INIZCTEOSA-N 361.398 0.621 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)CC(F)(F)CN)cc2)CC1 846680542 CZNMHMOCUAIKGK-UHFFFAOYSA-N 354.401 0.955 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CC(=O)N(CCN(C)C)C3)C2)cc1 855232653 WGTPGJCLAPGPJX-HZPDHXFCSA-N 374.485 0.800 10 10 FCCE COc1cccc(CNC(=O)C(=O)Nc2cnn(-c3ncccn3)c2)c1O 1116243023 ISQBNOARKJBZQH-UHFFFAOYSA-N 368.353 0.631 10 10 FCCE Cn1nnn(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1=O 1166542564 YIVNFRWDUCPOJD-UHFFFAOYSA-N 363.333 0.391 10 10 FCCE CCCS(=O)(=O)NC1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1540750439 MAMQDVDABUDWMK-UHFFFAOYSA-N 356.444 0.961 10 10 FCCE CCOC(=O)C1([S@](C)=O)CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1635785612 CQTOPWONVUNBRL-VWLOTQADSA-N 369.439 0.943 10 10 FCCE CN(C)c1ccc(CNC(=O)CN[C@@](C)(Cn2cccn2)C(N)=O)cc1 1648579166 JYUWSPCZHQNRFH-SFHVURJKSA-N 358.446 0.099 10 10 FCCE C[C@@H](NCC(CO)(CO)NC(=O)OC(C)(C)C)c1c(O)cccc1O 2258307243 VDWOWPHTEJBWSM-LLVKDONJSA-N 356.419 0.997 10 10 FCCE CN(C)c1ccc(Cn2nccc2NC(=O)CN(C)S(C)(=O)=O)cc1 68905523 TZDCWVWHTSHFLN-UHFFFAOYSA-N 365.459 0.827 10 10 FCCE O=C(CN1C(=O)CSC1=S)NCCn1nc2c(cc1=O)CCCC2 585408581 VDPQHBNLPXBRLD-UHFFFAOYSA-N 366.468 0.099 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@@H]3CNCC[C@@H]3C)C2)cc1 818677763 VLCJEXOIAGYJOS-HDMKZQKVSA-N 374.485 0.752 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC1(n2cnnn2)CCOCC1 831924741 MGKGOKHNQQFBAA-GFCCVEGCSA-N 361.402 0.728 10 10 FCCE O=C(COC(=O)c1cccnn1)NCc1ccc(N2CCOCC2)c(F)c1 860263901 HMRGNZNDENZQRC-UHFFFAOYSA-N 374.372 0.926 10 10 FCCE CC(C)(O)[C@@H](O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 901287380 NHDRAKIMPUFFJH-SFHVURJKSA-N 361.486 0.967 10 10 FCCE COCc1ncc2c(n1)CCN(C(=O)C(=O)N1Cc3cccc(O)c3C1)C2 1329450159 RNBSUBPZHVFETE-UHFFFAOYSA-N 368.393 0.756 10 10 FCCE CN(CC(C)(C)S(C)(=O)=O)C(=O)C(=O)NCc1ccc(N(C)C)cc1 1330311899 FVIWVOIPDGPQQI-UHFFFAOYSA-N 369.487 0.650 10 10 FCCE CCS(=O)(=O)N[C@H](CCSC)C(=O)NCc1cccc(O)c1O 1455317585 LXFWJVBDMORXHV-LLVKDONJSA-N 362.473 0.775 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)N3CC(S(N)(=O)=O)C3)C2)cc1 1478860040 KNGDPZJGIXZEOB-LBPRGKRZSA-N 368.459 0.204 10 10 FCCE CC[C@@H]1NC(=O)[C@H]2C[C@H](NCc3ccc(OC)c(COC)c3)CN2C1=O 1616103418 XHZXHDRMVQSINR-HRCADAONSA-N 361.442 0.809 10 10 FCCE CN[C@H]1C(=O)Nc2cc(N3CCO[C@@H](CO)C3)c(Br)cc21 221134371 LQLLEKJMPLYZEI-AMIZOPFISA-N 356.220 0.859 10 10 FCCE COC(=O)NCC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 299303843 CWLDJXUDUVEZCR-UHFFFAOYSA-N 350.419 0.289 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1C[C@H](O)CN1C(=O)Cc1ccccc1F 808504579 IFSBCVCZBYTELZ-GXTWGEPZSA-N 351.330 0.031 10 10 FCCE COc1ccc(N2CCN([C@H]3CCN(CC(=O)O)C3=O)CC2)cc1F 852726318 JKDRPHSFWCHIBK-AWEZNQCLSA-N 351.378 0.642 10 10 FCCE O=C(Cn1nc2n(c1=O)CCCC2)NCc1ccc2cccnc2c1O 862025235 PPWGSXPZRLIIJI-UHFFFAOYSA-N 353.382 0.951 10 10 FCCE CC[C@@]1(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCNC1=O 865033148 CKHKTDSUBYVQQY-HXUWFJFHSA-N 374.485 0.850 10 10 FCCE C[C@@H](NC(=O)C(=O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(N(C)C)cc1 1119838408 RSLPIYPRQLEGFG-IRWJRLHMSA-N 361.442 0.850 10 10 FCCE COC(=O)CC1(NC(=O)Cc2ccc(O)c(O)c2)CCS(=O)(=O)CC1 1448007271 XEKREDXEEDKKAP-UHFFFAOYSA-N 371.411 0.267 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H]3CCNC(=O)[C@@H]32)c1 1455184300 HXYDTHRKGZZSKN-QMTHXVAHSA-N 367.427 0.504 10 10 FCCE CCn1nc(C)c2c1OC(N)=C(C(=O)NCCO)[C@H]2c1ccc(O)c(O)c1 1864010082 OWJNDDGQRHTTSX-AWEZNQCLSA-N 374.397 0.426 10 10 FCCE COc1ccc(N2CCC(NC(=O)c3cnc(O)n(C)c3=O)CC2)cc1 751463016 DULPKLYHENUQFU-UHFFFAOYSA-N 358.398 0.893 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCCC[C@H]2[C@H]2CNC(=O)C2)cc1 785423930 IRJMUVGSCVFGNQ-WBVHZDCISA-N 372.469 0.886 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)N[C@H]1CCCCNC1 851688231 UCVSHXHQXPFDBT-INIZCTEOSA-N 374.485 0.522 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N[C@@H]1CCCOC1 852127130 MSWRMUFFCLRINY-OAHLLOKOSA-N 367.471 0.900 10 10 FCCE O=C(NCC[C@@]1(O)CCOC1)NCc1ccc(N2CCC(O)CC2)cc1 852397272 IWGYNBCYNFRVDQ-LJQANCHMSA-N 363.458 0.988 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCC(=O)N3)cc2)C1 853463496 KGUQYMZRKRSJFK-CABCVRRESA-N 373.457 0.466 10 10 FCCE CN(C)c1cc(F)c(CNC[C@@]23COCCN2C(=O)COC3)cc1F 865795612 QMWGVFBIMRGSTI-KRWDZBQOSA-N 355.385 0.748 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](O)c1cnn(C)c1 1611046107 VLFZIMTXZARQDG-WFASDCNBSA-N 363.370 0.155 10 10 FCCE Cc1cc(C=C2NC(=O)NC2=O)c(C)n1-c1ccc(S(N)(=O)=O)cc1 2294037483 JXPUAEGUABUULM-UHFFFAOYSA-N 360.395 0.922 10 10 FCCE CN(C)c1ccc(/C=C\CN2CCN(C(=O)Cn3cnnn3)CC2)cc1 835053970 QOGQXZHXQKWXFL-ARJAWSKDSA-N 355.446 0.597 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@H]1CNCC[C@H]1C)c1ccc(N2CCOCC2)cc1 842123540 OTAVBHNCLABRAB-VKJFTORMSA-N 374.485 0.815 10 10 FCCE CN(C)c1ccc([C@H](N)CNC(=O)CC2(n3cnnn3)CCOCC2)cc1 852790796 BRANJEUCPKTSHK-MRXNPFEDSA-N 373.461 0.451 10 10 FCCE CNC(=O)NC[C@H]1CN(Cc2ccc([N+](=O)[O-])c(OC)c2O)CCO1 862459506 UVQLYKMKLCIKMX-NSHDSACASA-N 354.363 0.439 10 10 FCCE CC(=O)NC[C@H]1CCn2ncc(C(=O)NCc3c(O)cccc3O)c2C1 1178912888 XSCHLXNGVRECJO-LBPRGKRZSA-N 358.398 0.923 10 10 FCCE Cc1nnc(N(C)Cc2ccccc2O)n1CCOCCS(C)(=O)=O 1290718631 HBOFMZRAPXOGRG-UHFFFAOYSA-N 368.459 0.990 10 10 FCCE Cc1nc(O)nc(O)c1CC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1651024311 PFABRXMTZFBVQX-UHFFFAOYSA-N 371.441 0.807 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1CN(C(=O)c2cc(O)nc(O)c2)CC[C@@H]1CO 2122238882 FOEMUALTGVDFRO-ZYHUDNBSSA-N 367.402 0.841 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](COc1nnc(=N)[nH]n1)CC1CCOCC1 2219022637 UNGZGDQIOLIRGR-LLVKDONJSA-N 354.411 0.768 10 10 FCCE COc1ccccc1N1C(=O)C(=CNN2CCOCC2)C(=O)NC1=S 2297056450 DVKDGMURBXLARX-UHFFFAOYSA-N 362.411 0.164 10 10 FCCE CCNc1nc(NCC)n2c(SCC(=O)N(C)[C@@H](C)CO)nnc2n1 283610943 LVZDWFAPEFHLAK-VIFPVBQESA-N 368.467 0.314 10 10 FCCE CCN(OC)C(=O)CNC(=O)NCc1ccc(N2CCOCC2)cc1 825753881 RIZDCFXUBBICJT-UHFFFAOYSA-N 350.419 0.732 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC(N3CC[C@@H](O)C3)CC2)cc1 826707524 UHRVHWKGKLPGNA-GOSISDBHSA-N 374.485 0.426 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@]34CCNC4)CC2)cc1 829504287 CVQSKMQDWVTEFP-QUCCMNQESA-N 358.486 0.933 10 10 FCCE COC(=O)C12CC(CN1CC(=O)N1CCN(c3ccc(OC)cc3)CC1)C2 852441727 QVYFRYMDOXDBQH-UHFFFAOYSA-N 373.453 0.981 10 10 FCCE C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCN1S(C)(=O)=O 853853082 RDHSTGPWZXZZRL-SECBINFHSA-N 370.387 0.396 10 10 FCCE Cc1ccc(O)c(CNC(=O)CCS(=O)(=O)NCC(=O)NC(C)C)c1 1147957530 SKZPFCPITNMLRV-UHFFFAOYSA-N 371.459 0.151 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H]2C2OCCO2)c1 1598322282 ORLKEVHVSNAWGR-GFCCVEGCSA-N 356.400 0.741 10 10 FCCE COC(=O)/C=C/c1ccc(N2CCN(C(=O)[C@@H](C)O)CC2)c([N+](=O)[O-])c1 270787010 KXTZFQNCTZGTRM-FVOPLDGLSA-N 363.370 0.810 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C[C@@H](C(N)=O)CC[C@H]3C)CC2)cc1 728733781 QSZVNOUDNRVQKG-CVEARBPZSA-N 374.485 0.930 10 10 FCCE CC(C)(C)[C@@H](O)C[C@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 803570228 VQBWXVCLDPQBKN-RISCZKNCSA-N 374.459 0.652 10 10 FCCE NS(=O)(=O)c1ccc(OCCC(=O)NCc2cccc(O)c2O)cc1 1455314066 BMMBKWHRZZICBP-UHFFFAOYSA-N 366.395 0.831 10 10 FCCE CN(C)c1ccc([C@@H](CNC(=O)[C@@H](N)CC(N)=O)N2CCCCC2)cc1 1866107114 AUNQRDLRHAKDAW-DLBZAZTESA-N 361.490 0.599 10 10 FCCE CN(C)CCCNC=C1C(=O)NC(=S)N(c2ccccc2F)C1=O 2296196242 BVAAWRKWDQHVAU-UHFFFAOYSA-N 350.419 0.999 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)CN3C(=O)NC(C)(C)C3=O)C2)cc1 819580347 IDNDKUPMZHDHEZ-CYBMUJFWSA-N 374.441 0.968 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCN[C@@H](C)C3)C2)cc1 851689731 SISUQRAIOJOTMR-KKUMJFAQSA-N 360.458 0.647 10 10 FCCE NS(=O)(=O)c1ccc(OCCC(=O)NCc2cc(O)ccc2O)cc1 1153879388 MUKCMHBSOCGQEO-UHFFFAOYSA-N 366.395 0.831 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1532104453 CEGAYUISHKFQMG-CYBMUJFWSA-N 355.460 0.672 10 10 FCCE NC(=O)[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(C(=O)Nc2ccc(N)cc2)C1 2162977513 UIGWLIRXPUTQSS-GZMMTYOYSA-N 373.335 0.655 10 10 FCCE O=C(O)[C@@H]1CN(Cc2cc(Br)ccc2O)CCS1(=O)=O 2197723902 YJMWNNJRIJZARR-NSHDSACASA-N 364.217 0.838 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 115489617 DLRWTWXYADSGNC-VQHVLOKHSA-N 356.426 0.788 10 10 FCCE CCOC(=O)C[C@H](O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 773727870 YGVPASGMMLMWKH-INIZCTEOSA-N 350.415 0.796 10 10 FCCE COC(=O)CC[C@H](N)C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 843490368 XSRHEUKWCNBVRQ-LBPRGKRZSA-N 372.805 0.828 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H]4C(=O)NC(=O)[C@H]4C3)C2)cc1 854296865 HDGJCXYLDOSFFQ-TUKIKUTGSA-N 358.398 0.188 10 10 FCCE Cc1nc([C@H]2COCCN2C(=O)C(=O)NCc2ccc(N(C)C)cc2)no1 1116975717 DCZOKSZYRWJDMC-OAHLLOKOSA-N 373.413 0.660 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1C[C@H]2C[C@]2(CO)C1 1118052187 FDRZYHZNCSCXCJ-YYFZDKIDSA-N 359.470 0.949 10 10 FCCE COC(=O)[C@@H](F)CNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1331899421 LTVQQYDZDKJTJO-FZMZJTMJSA-N 367.377 0.017 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)NCc1ccccc1O 2080587158 GWVKIMSNCFRTFI-MELADBBJSA-N 352.387 0.350 10 10 FCCE COC(=O)C1(NC(=O)c2ccc(O)c(O)c2)CN(C(=O)OC(C)(C)C)C1 2118181293 ODIYLKCUGIXIAP-UHFFFAOYSA-N 366.370 0.990 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)Cn2cnc3c(cnn3C)c2=O)c1 728980108 VPSRDOOICOAVRA-SNVBAGLBSA-N 357.370 0.722 10 10 FCCE CC(=O)N1CCN(c2ccc(CNS(=O)(=O)N(C)C3CC3)cc2)CC1 786122746 YDPVEFNXTFUMID-UHFFFAOYSA-N 366.487 0.784 10 10 FCCE CC(=O)C(=O)COC(=O)c1ccc2c(c1)S(=O)(=O)N(C(C)C)C2=O 808506416 KTRRNINDRQMBAD-UHFFFAOYSA-N 353.352 0.554 10 10 FCCE O=C(C[C@H]1CCNC1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 827389765 OCJKEMIRGDLXHO-OAHLLOKOSA-N 351.472 0.537 10 10 FCCE CC[C@](C)(CO)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 847363197 XRNURKYVAGLOSL-QGZVFWFLSA-N 354.472 0.946 10 10 FCCE CO[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCOC1 850601314 FKFXMTLAFMHFAY-DOTOQJQBSA-N 363.458 0.879 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 861743442 WAVVKGMPZHLHMX-JCGIZDLHSA-N 374.485 0.957 10 10 FCCE C[C@H]1CC[C@@H](NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)CN1 861805691 JMNTVRWGBNAXMZ-DOTOQJQBSA-N 374.485 0.738 10 10 FCCE COC(=O)C1=S=C(C(=O)Nc2cc(N(C)C)n3nc(C)cc3n2)C=C1 899072281 JYMLNOWELUZMAC-UHFFFAOYSA-N 359.411 0.863 10 10 FCCE COc1cc(N2CCOCC2)ccc1/C=C1\C(=O)NC(=S)N(C)C1=O 1084233433 RJSXKQSPXRNBKK-UKTHLTGXSA-N 361.423 0.788 10 10 FCCE Cc1c(C(=O)NCc2c(O)cccc2O)cnc2c1c(=O)n(C)c(=O)n2C 1597573394 DMURASVUDMABCA-UHFFFAOYSA-N 370.365 0.282 10 10 FCCE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1[C@@H](O)[C@H](O)CCN1C(=O)OC(C)(C)C 2064132117 HTVYWXAJSSSRAO-WOPDTQHZSA-N 357.411 0.876 10 10 FCCE O=C1NC(=O)N(c2ccccc2Cl)C(=O)C1=CNN1CCOCC1 2297060049 YYFXAQCUYLDBEC-UHFFFAOYSA-N 350.762 0.644 10 10 FCCE COC(=O)c1cnn(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1 843292289 GAJQMGXELQBUMT-QGZVFWFLSA-N 374.441 0.861 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N(C)Cc2cc[nH]n2)cc1 846256899 PXRZKTSPNPZTMZ-UHFFFAOYSA-N 359.430 0.972 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](CN)CC(C)C)C2)cc1 851688197 SIMCAMQYQCJUKG-GJZGRUSLSA-N 362.474 0.880 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc2c(c1)B(O)OC2 863871276 HOJHGNAMQJQCEL-UHFFFAOYSA-N 370.189 0.810 10 10 FCCE COC(=O)[C@@]1(N2CCN(Cc3cccc(OC)c3O)CC2)CCOC1 1335329682 MIFSAIJBOSOANI-GOSISDBHSA-N 350.415 0.851 10 10 FCCE CS(=O)(=O)N1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1463962180 ZEWLTYZWPDWTRC-UHFFFAOYSA-N 353.404 0.957 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CCCn3c(O)nnc3O)C2)cc1 1645242648 PAHLOKBRNWHZAS-GFCCVEGCSA-N 361.402 0.873 10 10 FCCE [N-]=[N+]=N[C@H]1CCN(c2ccc3c(c2)C(=O)N([C@H]2CCC(=O)NC2=O)C3=O)C1 2086865331 KNMSQFPTAKMIOX-ZANVPECISA-N 368.353 0.977 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNCc1ccc(O)c(O)c1O 2225620948 AJNQRNBCTDPDTJ-JKOKRWQUSA-N 370.402 0.234 10 10 FCCE O=C(CN1C(=O)CSC1=S)NCCn1cnc2ccsc2c1=O 238964340 YUUZLUOFJDYPOI-UHFFFAOYSA-N 368.465 0.435 10 10 FCCE CS(=O)(=O)CCCS(=O)(=O)NCCCSc1nccs1 740893354 JERQZNOITJQMHJ-UHFFFAOYSA-N 358.532 0.979 10 10 FCCE CCOC(=O)C[C@@H](O)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 837715503 SJDOAVNGVZQOHM-CQSZACIVSA-N 372.368 0.732 10 10 FCCE CO[C@@](C)(CO)CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 847291137 JEUNUEOLRLXGHB-GOSISDBHSA-N 369.437 0.983 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CC4CC3(CN)C4)C2)cc1 851688536 CNUACTSAWHDGJK-ZUIJCZDSSA-N 372.469 0.587 10 10 FCCE Cc1nnc(CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)o1 1130780199 JVPHCEACICQNJZ-UHFFFAOYSA-N 364.427 0.472 10 10 FCCE C[C@@H]1C[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1257232468 MYBXANXJKCLVPD-BMFZPTHFSA-N 372.469 0.777 10 10 FCCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(-n2[nH]nnc2=N)c1 1556157578 FMYQJOVOQNYYIG-JTQLQIEISA-N 354.370 0.847 10 10 FCCE COc1ccc(CNC(=O)c2cc(S(N)(=O)=O)ccc2O)c(O)c1 1568097820 QAAOVLLTEAIZTR-UHFFFAOYSA-N 352.368 0.684 10 10 FCCE NC(=O)[C@@H]1CC(C(=O)NCc2cccc(O)c2O)=NN1c1ccc(F)cc1 1593739163 HMPKXFSRQRPKDP-AWEZNQCLSA-N 372.356 0.973 10 10 FCCE O=C(NCc1ccc(O)cc1O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1 1643103602 BINYUGDTCZTUQR-AWEZNQCLSA-N 372.381 0.905 10 10 FCCE Cc1cc(C(=O)NC[C@H](O)CN2CCOCC2)c(C)n1-c1ccccn1 127754422 USTKJHUELAUZSN-INIZCTEOSA-N 358.442 0.912 10 10 FCCE CC(=O)OC[C@@H]1O[C@@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@@H]1OC(C)=O 616590012 QKGHBQJLEHAMKJ-MQLXINIDSA-N 373.318 0.380 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccnn3C)CC2)cc1 788502849 AGVYUMOVQIMDTO-UHFFFAOYSA-N 371.441 0.784 10 10 FCCE CNS(=O)(=O)Nc1ccc(NS(=O)(=O)C[C@H](OC)C2CC2)cc1 842585562 DNQUCVIBMXWMBM-ZDUSSCGKSA-N 363.461 0.729 10 10 FCCE C[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)CCN1S(C)(=O)=O 853245446 ZJGJNEREHQSSNW-CYBMUJFWSA-N 354.476 0.928 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CCS(=O)(=O)C[C@@H]2CCO)cc1 913927239 YNSAVVNNRYHWOU-HNNXBMFYSA-N 355.460 0.444 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cc[n+]([O-])cc3)cc2)CC1 1155603691 GPNCLAFEQGLFEC-UHFFFAOYSA-N 354.410 0.952 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@@H](O)CC(F)(F)C1 1261353741 DGBAFNHNFSGJMM-AWEZNQCLSA-N 355.385 0.940 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCc3nc(C)no3)C2)cc1 1328005052 ZRJFCHVNUWCJDM-CYBMUJFWSA-N 373.413 0.440 10 10 FCCE C[C@@H](NC(=O)NC[C@]1(O)CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 1680280184 JJKUZGZOELMCMY-MLGOLLRUSA-N 355.460 0.662 10 10 FCCE COC(=O)/C=C\c1ccc(N2CCN(C(=O)[C@H](C)O)CC2)c([N+](=O)[O-])c1 1772906878 KXTZFQNCTZGTRM-RNZFLTOJSA-N 363.370 0.810 10 10 FCCE CN(CCN=[N+]=[N-])C(=O)C1(S(C)(=O)=O)CN(C(=O)OC(C)(C)C)C1 2306881106 NVRJWXHHDFHFIX-UHFFFAOYSA-N 361.424 0.789 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H](c3nc(=O)[nH][nH]3)C2)cc1 289508719 UWCIKINFYTZXBG-AWEZNQCLSA-N 358.446 0.660 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@H](C)S(N)(=O)=O 841588884 HNEJLBYLBGDPIR-STQMWFEESA-N 356.492 0.968 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cn2c(n1)CCC2 843773310 PHEZRUIHWNPVRW-UHFFFAOYSA-N 374.466 0.994 10 10 FCCE CN1CCN(C(=O)COc2ccc(N)cc2)[C@H](CNC(=O)C(F)(F)F)C1 2162996210 BVNMXSRAADIDIQ-GFCCVEGCSA-N 374.363 0.469 10 10 FCCE O=C(O)CNC(=O)CN1C(=O)C(=Cc2ccc(O)cc2O)SC1=S 2314828982 XTAYMDXSZRDTFY-UHFFFAOYSA-N 368.392 0.500 10 10 FCCE CNC(=O)Cn1cc(NC(=O)NCc2ccc(N3CCOCC3)cc2)cn1 299121414 VOECHZVIWQVAKR-UHFFFAOYSA-N 372.429 0.787 10 10 FCCE CCO[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C[C@H]1CN 846342549 FFMXIPOSNATKRG-SJLPKXTDSA-N 374.485 0.725 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](O)C(F)(F)C3)nc12 852411172 FMUBMQUUPRKNQG-LLVKDONJSA-N 356.329 0.814 10 10 FCCE C[C@@H](NC(=O)N1CCN2[C@H](CNS2(=O)=O)C1)c1ccc(N(C)C)cc1 922056216 WMZGGYIJUYNTMN-IUODEOHRSA-N 367.475 0.357 10 10 FCCE NC(=O)c1ccc(N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)nc1 1558912197 HSXNTJFURNVDGI-UHFFFAOYSA-N 360.345 0.693 10 10 FCCE COc1ccc(N2CCN([C@@H](CNC(=O)C(N)=O)c3ccco3)CC2)cc1 49486595 BWSSKIGBXOUJDA-INIZCTEOSA-N 372.425 0.753 10 10 FCCE COc1ccc(N2CCN(c3cnnc(N4CCN(C)CC4)n3)CC2)cc1 243225573 KJXQAXXHHKMDHJ-UHFFFAOYSA-N 369.473 0.959 10 10 FCCE CC(=O)N1CCN(c2ccc(OC[C@@H](O)CN3CCOCC3)cc2)CC1 755304325 NTGNHHRUTMKUMJ-SFHVURJKSA-N 363.458 0.427 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c1 768909725 BJZLKILXSWEIGA-BWNDKRECSA-N 359.382 0.689 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCS(=O)(=O)[C@@H](C)C1 1331958849 HQPROORJFVJOAV-ZDUSSCGKSA-N 368.455 0.776 10 10 FCCE CC(=O)NC[C@H]1CCn2ncc(C(=O)NCc3cc(O)ccc3O)c2C1 1644753538 COXMACMNXGXNSJ-LBPRGKRZSA-N 358.398 0.923 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(C)[C@@H](C)CO)CC2)cc1 778394489 WEWUYBVFOJXSAV-CDNLZTBQSA-N 361.442 0.739 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNCc3cnn(C)n3)CC2)cc1 819309799 WKDHBQOOHOKORN-KRWDZBQOSA-N 360.462 0.096 10 10 FCCE NC(=O)[C@H]1CCCN1C1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 1182511049 VCXBTWNMRPSVFO-GFCCVEGCSA-N 351.378 0.791 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 2020899783 LRLRSLVAPYEGBL-SNVBAGLBSA-N 359.408 0.542 10 10 FCCE COc1ccc(CNC[C@@H]2[C@@H](O)[C@H](O)CN2C(=O)OC(C)(C)C)c(O)c1 2225621915 GSHOBHDPSBEONC-FVQBIDKESA-N 368.430 0.832 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)NCCCN1CCCC1=O 774458486 GCJNTDIZSJWTGA-UHFFFAOYSA-N 370.500 0.870 10 10 FCCE COC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)[C@H]1CCCOC1 897361761 QTSHYUGXUODSMU-DOTOQJQBSA-N 363.458 0.927 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@H](O)C4(CC4)C3)CC2)cc1 1324209138 DNVMPMQFOLPSBP-HKUYNNGSSA-N 361.486 0.635 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CC[C@@]2(CNC(=O)C2)C1)c1ccc(N(C)C)cc1 1342713177 JUKHKMUJVHYRSG-BFUOFWGJSA-N 358.442 0.668 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3CC(=O)NC3=O)cc2)C1 1626338447 ANDCQVZEZMBYRE-ZIAGYGMSSA-N 372.425 0.057 10 10 FCCE CC(C)(C)OC(=O)NC1(C(N)=O)CN(C(=O)CCc2ccc(N)cc2)C1 2109489483 POGLMPZQYFLMFM-UHFFFAOYSA-N 362.430 0.792 10 10 FCCE CN[C@H]1C(=O)Nc2cc(N3CCNC(=O)[C@H]3C)c(Br)cc21 252613996 XRJZCWBRWLVHFB-JMCQJSRRSA-N 353.220 0.986 10 10 FCCE C[C@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC(=O)N1C 285717834 NAGLZBJWCBIXEA-ZDUSSCGKSA-N 358.442 0.374 10 10 FCCE CN(C)S(=O)(=O)[C@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 795654963 WRWWAFVDYNWPGG-SWLSCSKDSA-N 356.444 0.674 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3cn(C)nc3OC)C2)cc1 850537771 UHCLVESUPMRADT-LBPRGKRZSA-N 373.413 0.771 10 10 FCCE COc1ccc(N2CCN(S(=O)(=O)[C@@H]3CCCNC3)CC2)c(OC)c1 923666122 PMQYFESXMWKFEM-OAHLLOKOSA-N 369.487 0.908 10 10 FCCE CN1CCN(c2ccc(CNC[C@@]3(OCCO)CCOC3)cc2F)CC1 1327202746 ZHQRUVBVLCIGIS-IBGZPJMESA-N 367.465 0.835 10 10 FCCE O=C(NC[C@@H]1C[C@H]2C=C[C@H]1CC2)C(=O)C(=O)C(=O)N[C@H]1CCNC12CCC2 1329096011 VGFFZXRKZFOFBY-AJNGGQMLSA-N 373.453 0.244 10 10 FCCE C[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)N1CCN(C(=O)OC(C)(C)C)CC1=O 2060614990 JRFGNZUVXQOVBH-JTQLQIEISA-N 352.395 0.975 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNCc1ccc(F)cc1O 2218642874 XHXBGTIBESIPLU-QEJZJMRPSA-N 356.394 0.962 10 10 FCCE CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@@H]1OC(C)=O 15636683 QKGHBQJLEHAMKJ-QNSTZXKLSA-N 373.318 0.380 10 10 FCCE CN1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCC1=O 285620425 DHWBRUNHRRRXDQ-LBPRGKRZSA-N 350.394 0.245 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)c3ccc4c(c3)COB4O)C2)cc1 863886847 OPUKXMHWSBGOSV-HNNXBMFYSA-N 352.199 0.922 10 10 FCCE CCOC(=O)C[C@H](O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1 870166068 TWKDAFLUANFBIT-HNNXBMFYSA-N 366.414 0.667 10 10 FCCE O=C(CCNS(=O)(=O)c1cccnc1)NCc1ccc(O)cc1O 1162271622 LNAZGXIJSMUKFH-UHFFFAOYSA-N 351.384 0.478 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCc3cnn(C)c3)C2)cc1 1327904061 RNQSXLIXCUIPLJ-OAHLLOKOSA-N 371.441 0.483 10 10 FCCE COC[C@@H](CNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)OC 1328090418 BHHTYQPSTIAOKQ-XJKSGUPXSA-N 365.430 0.168 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@H](O)C(F)(F)C1 1329608338 JARMGXOHXDSKQB-AWEZNQCLSA-N 355.385 0.940 10 10 FCCE Cc1nn(C)c2c1[C@@H](c1ccc(O)c(O)c1)C(C(=O)NC[C@H](C)O)=C(N)O2 1864008661 PEDSKCZNFBWZIG-RMLUDKJBSA-N 374.397 0.331 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)NC[C@@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2060641491 KATONPJHVNPYOA-GHMZBOCLSA-N 352.395 0.881 10 10 FCCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H]2CN(C)NC2=O)C1 569659882 LYJKYSGVINRIFG-MRXNPFEDSA-N 369.469 0.869 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN[C@@H]3CCCN(C)C3)CC2)cc1 819023209 IRVOUSZHAQMMHF-MJGOQNOKSA-N 362.518 0.862 10 10 FCCE CO[C@H](COC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCOC1 849711986 DXLCCZXGALVDGO-IINYFYTJSA-N 359.400 0.972 10 10 FCCE NC[C@H]1CC(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)=NO1 852861205 QJPYXXHYRFJNDL-UKRRQHHQSA-N 359.430 0.108 10 10 FCCE CC[C@H](C)[C@]1(C(=O)O)N[C@H](c2cccc(OC)c2O)[C@@H]2C(=O)NC(=O)[C@@H]21 248147462 AGCNCEFJJIIKIA-DTQXEMBZSA-N 362.382 0.803 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCc3nc(O)cc(CN)n3)C2)cc1 851679096 UUHMATGAUPZQQS-LBPRGKRZSA-N 372.429 0.728 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](Cn4ccnn4)C3)nc12 852313783 NIJOTQODDGKAQR-GFCCVEGCSA-N 371.401 0.725 10 10 FCCE COC[C@H](CCCN)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 854220997 DMDWXASVPTZUSW-INIZCTEOSA-N 355.504 0.765 10 10 FCCE CN1C[C@@H](O)C[C@]1(C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 900269537 PVPRNNYQCLACRB-KBXCAEBGSA-N 351.422 0.734 10 10 FCCE Cn1cc(S(N)(=O)=O)cc1C(=O)C(=O)NCc1c(O)cccc1F 1178413067 MSLWNUBIMHYRGZ-UHFFFAOYSA-N 355.347 0.016 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccn(C)c1=O 1320387820 WOPALXUEGPILPZ-ZDUSSCGKSA-N 360.366 0.701 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNC(=O)Cc1ccc(N)cc1 2225623292 OWJSZLQJKMFJBJ-DZKIICNBSA-N 365.430 0.269 10 10 FCCE CN(Cc1cnc(N(C)C)nc1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 785444653 SVIPVVYOSNBDKJ-UHFFFAOYSA-N 370.457 0.883 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H](N)C(F)(F)F)CC2)cc1 829499570 BATHRZJPMNOZHG-AWEZNQCLSA-N 360.380 0.823 10 10 FCCE CNCCOCCN(C)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 861749490 AILBCFFSGDNLGX-UHFFFAOYSA-N 362.474 0.380 10 10 FCCE CC(=O)N1CCO[C@H](C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 930744877 OPMRAHAXEYSIAV-KSSFIOAISA-N 361.442 0.948 10 10 FCCE Cc1ccc(C)n1-c1ccsc1C(=O)N1C[C@@H](C(N)=O)[C@H](C(N)=O)C1 1149187601 QVHKFMMNRJCGRJ-VXGBXAGGSA-N 360.439 0.814 10 10 FCCE O=C(NCc1cc(O)ccc1O)[C@@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1303225152 ACRJFAOQBJODOX-NXEZZACHSA-N 353.318 0.937 10 10 FCCE COCCCOC1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C1 1322980906 XPRVGZFSMNENQC-UHFFFAOYSA-N 363.458 0.941 10 10 FCCE Cc1ncc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c(N)n1 1652071390 WMOLYNIFSROARE-UHFFFAOYSA-N 368.441 0.999 10 10 FCCE CS(=O)(=O)[C@H]1CSCCN1S(=O)(=O)Cc1ccc(N)cc1 90922139 SQDXYEAIXTXDBL-LBPRGKRZSA-N 350.487 0.518 10 10 FCCE COc1nn(C)cc1CNC(=O)C(=O)NCCCSc1nccs1 930198623 RTUXTKSRRRAQCW-UHFFFAOYSA-N 369.472 0.800 10 10 FCCE O=C(C(=O)N1CCC[C@@H](N2CCCC2=O)C1)N1Cc2cccc(O)c2C1 1261858137 HASSWKXAOLEHDJ-CQSZACIVSA-N 357.410 0.848 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@](O)(C(F)F)C1 1325557110 PIJKYISRBPSWLM-QGZVFWFLSA-N 355.385 0.940 10 10 FCCE CCN1CCN(CC(=O)N(C)Cc2ccc(N3CCCC3)cc2)C(=O)C1=O 1587548011 VHPUNXKZHGORGL-UHFFFAOYSA-N 372.469 0.936 10 10 FCCE COc1ccc(Br)c(CNC2CN(S(C)(=O)=O)C2)c1O 1964595121 VWYUNZFOCMEFCL-UHFFFAOYSA-N 365.249 0.897 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](CC(=O)N2CC(N=[N+]=[N-])C2)C1 2060614455 CNMUKZKHPZPTNN-LLVKDONJSA-N 373.435 0.932 10 10 FCCE CC[C@H](NCCNS(N)(=O)=O)c1cc(Br)ccc1O 2101330342 ZZYGNWQSLOUIJP-JTQLQIEISA-N 352.254 0.989 10 10 FCCE O=C(O)Cn1nnc(-c2cc(O)c(O)c(I)c2)n1 2295334713 HXIPLPWSJOZXHE-UHFFFAOYSA-N 362.083 0.441 10 10 FCCE CN(Cc1ccc(N)cc1)C(=O)[C@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C 2332880366 QIKMPSHRSBFKNC-ZNMIVQPWSA-N 365.430 0.568 10 10 FCCE C[C@H](O)[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 817811737 PNYRGDRHJPCKHI-NHYWBVRUSA-N 353.394 0.116 10 10 FCCE C[C@@H]1C(=O)N(C)CN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 825859904 WSWNVYWDZJWNLZ-UKRRQHHQSA-N 373.457 0.718 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](CN)CC(C)C)C2)cc1 851688199 SIMCAMQYQCJUKG-LSDHHAIUSA-N 362.474 0.880 10 10 FCCE NCCCOCCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 861651806 CQULGTPGWSCKAW-UHFFFAOYSA-N 350.463 0.812 10 10 FCCE O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)N1Cc2cccc(O)c2C1 871202906 OOPWQIHICRGIQB-JHNDHUHGSA-N 356.378 0.787 10 10 FCCE Cc1nn(CCS(=O)(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c(=O)o1 914391867 NPNLKEKRWNVKKP-NSHDSACASA-N 354.432 0.891 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCN2C(=O)OCC[C@H]2C1 1117974483 ZXDCBAWHWLDURY-INIZCTEOSA-N 374.441 0.764 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@H]1CCc2nnn(C)c2C1)c1ccc(N(C)C)cc1 1333428622 LMKOJMREIVLGRR-JSGCOSHPSA-N 370.457 0.732 10 10 FCCE Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H](C(N)=O)[C@@H](C(N)=O)C2)cc1 1557689126 GWSWVZWKLLZERX-IYBDPMFKSA-N 354.410 0.753 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N(C)CCS(N)(=O)=O)C2)cc1 1674328370 YPPOGGIQWSUMHJ-GFCCVEGCSA-N 356.448 0.204 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3CC[C@@]4(O)C[C@H]4C3)C2)cc1 1118718128 HCFCXVNGMPJJSI-QEEYODRMSA-N 373.453 0.621 10 10 FCCE CN1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCC1=O 1330893961 NLRGYUYZPPPMJT-UHFFFAOYSA-N 350.394 0.199 10 10 FCCE COCCS(=O)(=O)Nc1cc(N2CCN(C=O)CC2)ccc1OC 62150018 IBBBQULSRVCPRB-UHFFFAOYSA-N 357.432 0.362 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)N1CCN(C=O)CC1 193359368 LEZPOCUCTQEPMB-UHFFFAOYSA-N 354.476 0.593 10 10 FCCE C[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCS1(=O)=O 365495267 XSWYUTGROOHBMQ-VIFPVBQESA-N 355.372 0.939 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC[C@@H]3OCC(=O)N[C@H]3C2)c([N+](=O)[O-])c1 373766606 NVQDBEMWFMSBJX-NSAARLCDSA-N 361.354 0.875 10 10 FCCE COCCN1NC(C(=O)N=NC(=O)c2cc([N+](=O)[O-])c[nH]2)=CC=C1O 588042527 FZVROAHZFIWRIE-UHFFFAOYSA-N 350.291 0.792 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCC(CO)(CO)C3)CC2)cc1 852628941 XEDHIFGLDCEJCT-UHFFFAOYSA-N 363.458 0.021 10 10 FCCE COc1cccc(CNC(=O)NCCc2nnc3c(=O)n(C)ccn23)c1O 1685241305 YTLDNGBNSAGEEM-UHFFFAOYSA-N 372.385 0.184 10 10 FCCE Cn1cc(CNC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)nn1 1686960145 JKYSLPUDHWPZEG-UHFFFAOYSA-N 371.445 0.516 10 10 FCCE COc1ccc(O)c(CNC(CO)(CO)CNC(=O)OC(C)(C)C)c1 2254550830 FYSYNFYTNIUYRB-UHFFFAOYSA-N 356.419 0.739 10 10 FCCE Cc1ccc(CN[C@H]2CS(=O)(=O)C[C@@H]2O)c(O)c1Br 2352676418 PHRGZXCFMRHKAH-UWVGGRQHSA-N 350.234 0.711 10 10 FCCE C[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H](C)CO 295686961 HVLJUDCNHBUTHB-KBPBESRZSA-N 353.438 0.885 10 10 FCCE COc1ccc(N2CCN(C(=O)COC(=O)c3nnn(C)c3C)CC2)cc1 745166628 ABEFOBKWQVSYDV-UHFFFAOYSA-N 373.413 0.638 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3C[C@H]4C[C@]4(CO)C3)cc2)C1 782945058 DCVCXMBAZAVDSN-JXXFODFXSA-N 372.469 0.912 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](O)CC(F)(F)C3)nc12 787367561 KLEHXBOFFYJRSR-JTQLQIEISA-N 356.329 0.814 10 10 FCCE O=C1N[C@H](C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CO1 828258235 AMHKVTBHDICSIV-KRWDZBQOSA-N 358.442 0.943 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3cn(C)nc3OC)C2)cc1 850537770 UHCLVESUPMRADT-GFCCVEGCSA-N 373.413 0.771 10 10 FCCE COc1cc(N2CCC(NS(N)(=O)=O)CC2)c([N+](=O)[O-])cc1OC 858811640 HCQGICWHTSPSNS-UHFFFAOYSA-N 360.392 0.374 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H](F)[C@H](N)C3)CC2)cc1 923394787 FEZMUTYFZGGDIA-QXAKKESOSA-N 366.481 0.549 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 1341091432 ABLHXOFFUZUJMI-NJAFHUGGSA-N 371.437 0.599 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCc2ccc(N)cc2)[C@@H](O)C1 1890187382 SLCZAQZVGSQESP-KBXCAEBGSA-N 365.430 0.618 10 10 FCCE CC(C)(C)OC(=O)N1CC(O)(CNS(=O)(=O)Cc2ccc(N)cc2)C1 2044242979 CMPOXZCPFNRIIN-UHFFFAOYSA-N 371.459 0.670 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)Nc2ccc(N)cc2)[C@H](O)C1 2076784718 NNUKPXWMLIDWPF-CXAGYDPISA-N 351.403 0.940 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC[C@@H](N)C(C)C)C2)cc1 851690813 IROCKHMIRXYMKM-RHSMWYFYSA-N 362.474 0.880 10 10 FCCE COC(=O)c1c(CNCCNS(C)(=O)=O)c2cc(F)ccc2n1C 894137425 PXXZVIIAGQYUFK-UHFFFAOYSA-N 357.407 0.743 10 10 FCCE C[C@]1(NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCOC1=O 1471369458 JYNAEJOOLQMIMZ-IBGZPJMESA-N 374.441 0.893 10 10 FCCE CC(C)(C)OC(=O)N1CCC(O)(CNC(=O)c2cc(O)nc(O)c2)CC1 1918797304 VLHLGGIMRCKSOV-UHFFFAOYSA-N 367.402 0.985 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](O)CN(C(=O)c2cc(O)nc(O)c2)C1 2049116569 JHOGJQGJTXCGNR-GHMZBOCLSA-N 353.375 0.593 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCC1CNC1 2136260153 ADOILVWRZSRPIJ-ZDUSSCGKSA-N 365.430 0.869 10 10 FCCE CCNS(=O)(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCOCC1 62370932 PVHAYMWAYHPVFV-INIZCTEOSA-N 356.492 0.570 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)Cn3ccnc3)C2)cc1 827190225 SGEVAKJZADHJIF-HUUCEWRRSA-N 371.441 0.792 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC3(C)CCNCC3)C2)cc1 851689929 VXFMVOWKSMTJKP-HNNXBMFYSA-N 374.485 0.896 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@](CO)(OC)C3)nc12 852410582 DAXGKSUBWHMQOQ-KRWDZBQOSA-N 364.402 0.585 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1140753936 SWBUPNNBUJXHDA-BXUZGUMPSA-N 352.387 0.737 10 10 FCCE CC[C@@H](NC(C)=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1356434760 VWQDSGVSSAQMFH-NVXWUHKLSA-N 360.458 0.919 10 10 FCCE COC(=O)C[C@@H]1CS(=O)(=O)CCN1C(=O)/C=C/c1ccc(O)c(O)c1 1454615951 IKOKMEGAPLNWSV-OGOUPESXSA-N 369.395 0.300 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H](CO)c1ncc[nH]1 1479030975 WGVBHQRDFOCAON-MRXNPFEDSA-N 359.430 0.904 10 10 FCCE CN(CC(N)=O)C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2136260661 FPTONPDPNBFYLN-NSHDSACASA-N 367.402 0.477 10 10 FCCE O=S1(=O)C[C@@H]2[C@H](C1)NCCN2Cc1c(O)cccc1Br 2143710897 BXEOQLSOZGISFJ-NWDGAFQWSA-N 361.261 0.726 10 10 FCCE COc1ccc(N2N=C(C)/C(=C\c3c(O)[nH]c(=O)n(C)c3=O)C2=O)cc1 103732224 VENPPKPZSIYZPT-XYOKQWHBSA-N 356.338 0.594 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)[C@H](C)CO)CC2)cc1 828846831 UOVICOIKVLYTOF-SOLBZPMBSA-N 351.491 0.785 10 10 FCCE CNS(=O)(=O)Nc1ccc(NS(=O)(=O)CC(C)(C)OC)cc1 840914172 QTYNXFPYKDHCIC-UHFFFAOYSA-N 351.450 0.729 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCO[C@H]([C@H](C)O)C1 840976648 DEVSEWIASPZTSE-YOEHRIQHSA-N 363.458 0.709 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCC(=O)N(C)C3=O)C2)cc1 852388766 QTKPXFQXVPUURM-DOMZBBRYSA-N 360.414 0.721 10 10 FCCE C[C@@H](NC(=O)C(=O)N[C@@H]1CCc2nnn(C)c2C1)c1ccc(N(C)C)cc1 1333428626 LMKOJMREIVLGRR-TZMCWYRMSA-N 370.457 0.732 10 10 FCCE C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CN(C)CCN1C 1544138997 IJQYJTLJGJFZRX-RISCZKNCSA-N 370.475 0.128 10 10 FCCE CCN1C(=O)CO[C@H](C(=O)NCc2ccc(O)c(O)c2)[C@H]1c1ccnn1C 1595596572 YOOBGGQKZZUZQH-SJORKVTESA-N 374.397 0.436 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C[C@@H]3CC(=O)NC3=O)cc2)CC1 1634974385 QQNOASCNDNMPAR-CQSZACIVSA-N 372.425 0.057 10 10 FCCE COC(=O)[C@]1(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)CCOC1 1640827336 FDCAOQDGSWVFGC-SFHVURJKSA-N 364.398 0.117 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC[C@H](NS(C)(=O)=O)C2)c([N+](=O)[O-])c1 1772830225 LQIPZTOYHBMVSY-RNZFLTOJSA-N 369.399 0.909 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2081036064 NUBFXFPQKQRRLE-QJPTWQEYSA-N 355.395 0.629 10 10 FCCE Nc1ccc(N(CCO)CC(O)CN(CCO)c2ccc(N)cc2)cc1 34008580 VIXBPSTZNCRCJE-UHFFFAOYSA-N 360.458 0.510 10 10 FCCE in-vitro Cc1cc(Cl)cc(CN[C@@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)c1O 271841032 GTINGIXQCDACIX-HUUCEWRRSA-N 374.890 0.941 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCO[C@H]([C@H](C)O)C3)CC2)cc1 839671492 BDSOXOAKRPHJDC-YJBOKZPZSA-N 363.458 0.425 10 10 FCCE CN1[C@H]2CC[C@H]1CC(N1CCN(C(=O)C(=O)Nc3ccc(N)cc3)CC1)C2 841073910 ALGHUSSEXSDKLR-IRXDYDNUSA-N 371.485 0.977 10 10 FCCE CN1C(=O)CO[C@H](C(=O)NCc2cc(O)ccc2O)[C@H]1c1cccnc1 1303225461 IGBCTCZLEGPWTB-SJORKVTESA-N 357.366 0.708 10 10 FCCE CNS(=O)(=O)c1ccc(CNC(=O)Cc2ccc(O)c(O)c2)s1 1624040160 RGQIILMWPFFELH-UHFFFAOYSA-N 356.425 0.926 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(C(=O)C3CC3)C2)c1 1643058710 XKHGLXKCZIUHSH-UHFFFAOYSA-N 353.400 0.416 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H](CO)[C@@H]1CCOC1 1684140715 AOSPHDWFRWUNOG-QAPCUYQASA-N 363.458 0.844 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](O)[C@H]1C(=O)Nc1ccc(N)cc1 2080898830 URNHUDCAACXIKW-MELADBBJSA-N 351.403 0.939 10 10 FCCE CN(C)c1ccc(CNC(=O)Cn2c(=O)c(=O)n(C)c3ncccc32)cc1 35449601 NDSYNADXZQDFKL-UHFFFAOYSA-N 367.409 0.478 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)[C@H]3CNC(=O)C3)CC2)cc1 122011876 IBAKEEHNVUJUCM-OAHLLOKOSA-N 360.458 0.460 10 10 FCCE CCN1C(=O)[C@H]2[C@H](C1=O)[C@@](C(=O)O)(C(C)C)N[C@H]2c1ccc(O)c(O)c1 248195469 PDSOWMVSWXBTFZ-MOROJQBDSA-N 362.382 0.843 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)Cn3cncc(OC)c3=O)CC2)cc1 905986087 GOTOORGPCBZSEV-MRXNPFEDSA-N 374.441 0.444 10 10 FCCE C[C@@H](NC(=O)NC[C@]1(CO)COCCN1C)c1ccc(N(C)C)cc1 922053955 HENLDISNRPNWTH-KDOFPFPSSA-N 350.463 0.806 10 10 FCCE C[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C(=O)O1 1254871299 FGJUPSDFGRQKOV-MLGOLLRUSA-N 374.441 0.892 10 10 FCCE C[C@H](NC(=O)C(=O)NCc1cnc2n1CCOC2)c1ccc(N(C)C)cc1 1332949674 YMXBKVPJXKWMAX-ZDUSSCGKSA-N 371.441 0.973 10 10 FCCE NC(=O)COc1cccc2c1CCCN2C(=O)c1ccoc1CC(N)=O 1637128343 NFSWCYHUFVMFLZ-UHFFFAOYSA-N 357.366 0.765 10 10 FCCE COc1ccc(CN2C(=O)NC(=O)C(=CN=c3cc(C)o[nH]3)C2=O)cc1 2296560873 UXAMUSWNSNGNQT-UHFFFAOYSA-N 356.338 0.988 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2311715425 VKCGAKBRQJXPTA-WISYIIOYSA-N 355.395 0.629 10 10 FCCE CCNS(=O)(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCOCC1 62370933 PVHAYMWAYHPVFV-MRXNPFEDSA-N 356.492 0.570 10 10 FCCE O=C(CN1C(=O)CSC1=S)N1CCC[C@@H](Oc2ncccn2)C1 585338796 HLHJTQNYNATQKD-SNVBAGLBSA-N 352.441 0.707 10 10 FCCE Cn1cc(CN2CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC2)cn1 761894534 PXYVUEFBBHMYPM-UHFFFAOYSA-N 372.385 0.981 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN3CCOC[C@H]3C2)cc1 788976804 CCRFEUOVRZFEDE-GOSISDBHSA-N 374.485 0.692 10 10 FCCE C[C@H](O)[C@@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 817811311 HJNPGGQQWRTVEV-GUYCJALGSA-N 361.442 0.293 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCn3cccn3)C2)cc1 827335761 YGSGNIKWQQURAK-AWEZNQCLSA-N 357.414 0.403 10 10 FCCE CO[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@](C)(CO)C1 867702390 XQOJXXUUGXOLNG-APWZRJJASA-N 363.458 0.709 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCNC(=O)CC3(C)C)CC2)cc1 931207998 YNAOFZSEASWIBN-UHFFFAOYSA-N 374.485 0.944 10 10 FCCE C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nn(C)cc1O 1158308332 VRIMQSBXTFOKAK-MRVPVSSYSA-N 354.388 0.694 10 10 FCCE COc1ccc(CNC(=O)NC[C@]23COCCN2C(=O)OC3)c(O)c1 1313180521 OJRIFUZJXMBVHF-MRXNPFEDSA-N 351.359 0.421 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H](O)CC(F)(F)C2)cc1F 1321935249 OFSNJUNMUVTPFW-NSHDSACASA-N 359.348 0.736 10 10 FCCE COC[C@H](CCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)OC 1327987553 AQGNITCPEVNMHP-ZDUSSCGKSA-N 355.410 0.676 10 10 FCCE COc1ccc(CNC(=O)NC[C@@]2(OC)CCS(=O)(=O)C2)c(O)c1 1565379324 JQAKDXYEWJTDFY-HNNXBMFYSA-N 358.416 0.404 10 10 FCCE CN1CCN(NC=C2C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)CC1 2296073482 GVDJHDFGUOFDGN-UHFFFAOYSA-N 363.805 0.559 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNCc1c(O)cccc1F 2312325199 SIUFNHVQOWIRRN-YUELXQCFSA-N 356.394 0.962 10 10 FCCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@@H](O)[C@@H](O)CCN1C(=O)OC(C)(C)C 2315986667 GXVGJXMJIZTJPV-SRVKXCTJSA-N 357.411 0.876 10 10 FCCE O=C1CSC(=S)N1CCNS(=O)(=O)c1ccc2[nH]c(=O)oc2c1 71558031 KIYPRPZIFFACEE-UHFFFAOYSA-N 373.437 0.260 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)CCCO)CC2)cc1 799796016 PVDCOFVSFNETTK-CMDGGOBGSA-N 361.442 0.741 10 10 FCCE Cn1c(=O)c2c(ncn2CCN2CCCc3cc(CN)ccc32)n(C)c1=O 843349764 AWMCMUMHQLUKNU-UHFFFAOYSA-N 368.441 0.345 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CC[C@H](CN)C3)C2)cc1 851689037 KENUSRWILLWWNC-ZNMIVQPWSA-N 360.458 0.634 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](O)C(C)(C)O)CC2)cc1 900408204 XBFMERHOXILXHW-MRXNPFEDSA-N 351.447 0.065 10 10 FCCE COc1cc(N2CCN(C(=O)[C@H](O)C(C)(C)O)CC2)cc(OC)c1OC 907369599 MWLQSVADOFOGOX-INIZCTEOSA-N 368.430 0.493 10 10 FCCE CN(C)c1ccc(CNC(=O)c2cn(C[C@@H]3CNC(=O)O3)nn2)cc1F 1125469643 WNVGOTBXNXBPBX-NSHDSACASA-N 362.365 0.522 10 10 FCCE CCn1cc(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nn1 1526260315 WDWFEDCQXOIVDG-HNNXBMFYSA-N 370.457 0.859 10 10 FCCE CC[C@@H]1NC(=O)[C@H]2C[C@@H](NCc3ccc(OC)c(COC)c3)CN2C1=O 1616103419 XHZXHDRMVQSINR-OWCLPIDISA-N 361.442 0.809 10 10 FCCE CC1=NS(=O)(=O)N(C)C=C1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 1633819941 XPKJQWDPJBLSDY-VIFPVBQESA-N 353.400 0.680 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C)ccc1=O 1638030519 MMVNAIJGCCFGBO-ZDUSSCGKSA-N 360.366 0.701 10 10 FCCE Cn1c(O)nnc1CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1682986434 FCNFWHOJUXAYKH-UHFFFAOYSA-N 360.418 0.481 10 10 FCCE CCCCN1C(=O)C(=CNCCCN2CCOCC2)C(=O)NC1=S 2296079585 QOFYADVGKNHHPB-UHFFFAOYSA-N 354.476 0.226 10 10 FCCE Cc1ccc(CNS(=O)(=O)N(C)CCN)c(O)c1Br 2352646260 SCYKWEXJPYDJGB-UHFFFAOYSA-N 352.254 0.688 10 10 FCCE CC(=O)C(=O)COC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 808494323 BOSIXPQGNAEIRF-CYBMUJFWSA-N 369.395 0.459 10 10 FCCE COc1nc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)co1 858641690 MYWZPNRWXITHJV-UHFFFAOYSA-N 365.411 0.848 10 10 FCCE COc1ccc(N2CC[C@@H](NS(=O)(=O)C[C@H]3CNCCO3)C2)cc1 866777666 VZVGCVWVCNGVQI-CZUORRHYSA-N 355.460 0.182 10 10 FCCE O=C1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CN1CC(F)(F)F 1330487986 UWVRJFQPTAJULE-UHFFFAOYSA-N 357.288 0.425 10 10 FCCE CN(C)c1ccc([C@@H](CNC(=O)C(=O)N[C@@H]2[C@H]3COC[C@H]32)N(C)C)cc1 1333308453 NAMBIAJVVBFORM-TWMKSMIVSA-N 360.458 0.233 10 10 FCCE COC(=O)C[C@H]1CS(=O)(=O)CCN1Cc1cc(F)cc(C(C)=O)c1O 1460599208 CBENTWIZAQSQNT-ZDUSSCGKSA-N 373.402 0.896 10 10 FCCE Cc1nc(S(=O)(=O)NCCC(=O)N2Cc3cccc(O)c3C2)cn1C 1643168531 DRVOCNIGCMSJDB-UHFFFAOYSA-N 364.427 0.645 10 10 FCCE C[C@@H](NCC(CO)(CO)NC(=O)OC(C)(C)C)c1cc(O)ccc1O 2258308916 OGCZKHOMANWBCV-LLVKDONJSA-N 356.419 0.997 10 10 FCCE COCCCNS(=O)(=O)[C@@H]1CON(C)[C@H]1c1ccc(N(C)C)cc1 34738691 MVPQZVXUQKCGDJ-CVEARBPZSA-N 357.476 0.995 10 10 FCCE C[C@@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)N(C)CC(=O)NC1CC1 759597820 SJKYHKSGECOAOZ-LAUIRUGDSA-N 362.382 0.780 10 10 FCCE CCN1CCC(NC(=O)C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 826668433 YIZTYOZTKMRELA-INIZCTEOSA-N 374.485 0.991 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@@H](C(N)=O)C3)cc2)C1 844907051 ZTDUGPJHFYRPQI-SOUVJXGZSA-N 373.457 0.451 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](S(N)(=O)=O)C3)C2)cc1 852451167 FHLDVFUODFYPJR-WFASDCNBSA-N 368.459 0.346 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N3CC=C[C@H]3CO)CC2)cc1 1119469543 QPBPWHSMVSFQCQ-INIZCTEOSA-N 359.426 0.540 10 10 FCCE C[C@@]1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCC(=O)N1 1133629845 HLIPCALRNHACFX-IBGZPJMESA-N 358.442 0.673 10 10 FCCE C[C@H](CNC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)S(N)(=O)=O 1479533441 HWUZNOHPNKTJJK-IUODEOHRSA-N 371.507 0.332 10 10 FCCE CC(C)(C)OC(=O)N[C@H](CO)C(=O)N1CCc2cc(O)c(O)cc2C1 2318624213 ARIDPGCPPSMJPZ-GFCCVEGCSA-N 352.387 0.868 10 10 FCCE CN1C[C@H](C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)NC1=O 831560599 CKODUERQIFENFH-GOSISDBHSA-N 371.485 0.858 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C2CCC1(C(N)=O)CC2 1119810827 TZTMLPBEDCRXSM-UHFFFAOYSA-N 358.442 0.686 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@H]2CCCS2(=O)=O)cc1 1331633786 UEIKVWVDRURKBK-OAHLLOKOSA-N 367.471 0.452 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cnn(CCO)c3)cc2)C1 1625273055 DAEHOJBLCHEFOM-HNNXBMFYSA-N 371.441 0.507 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cnn(CCO)c3)cc2)C1 1625273056 DAEHOJBLCHEFOM-OAHLLOKOSA-N 371.441 0.507 10 10 FCCE COc1ccc2c(c1)c1c(n2CC(=O)N2C[C@H](O)C[C@H]2C(N)=O)CCCC1 628598684 BWPPSLIKCDKUNB-XIKOKIGWSA-N 371.437 0.976 10 10 FCCE O[C@@H](CNCc1ccc(N2CCOCC2)c(F)c1)CN1CCOCC1 818967143 RZEJCMPIICIZFL-INIZCTEOSA-N 353.438 0.445 10 10 FCCE COc1ccc(N2CCC(NS(=O)(=O)C[C@@H]3CNCCO3)CC2)cc1 866748086 FFVSLHHZVKVZEN-KRWDZBQOSA-N 369.487 0.572 10 10 FCCE COc1ccc(N2CCN(CCNC[C@@H](O)CC(C)(C)O)CC2)cc1 872198973 FKKBJFPADLCVPC-KRWDZBQOSA-N 351.491 0.929 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C1(C(=O)O)CCS(=O)(=O)CC1 901605257 QAFAZQZSVLCWPO-UHFFFAOYSA-N 368.455 0.991 10 10 FCCE O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCCNC1 923616701 VCUTZTKENUWMFW-OAHLLOKOSA-N 371.478 0.958 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC([C@H]3COC(=O)N3)CC2)cc1 1119668017 PYUFWUJTESOJMQ-MRXNPFEDSA-N 374.441 0.716 10 10 FCCE CCN(CCNCc1ccc(OC)c(C)c1)C(=O)[C@H]1CC[C@@H](C(N)=O)O1 1268479969 YUICMCKKNGFQMW-DLBZAZTESA-N 363.458 0.975 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3[C@@H](C)[C@H](C)NC(=O)[C@H]3C)nc12 1643642928 TUYWUVJOBNYRJT-GARJFASQSA-N 361.402 0.709 10 10 FCCE CN(CCCN=[N+]=[N-])C(=O)[C@H]1[C@@H](O)[C@@H](O)CCN1C(=O)OC(C)(C)C 2310482297 HTVYWXAJSSSRAO-TUAOUCFPSA-N 357.411 0.876 10 10 FCCE COC[C@@](C)(O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 754985301 CPSNUOXXQNBZCN-GOSISDBHSA-N 351.447 0.331 10 10 FCCE C[C@@H](NS(C)(=O)=O)C(=O)NCc1cc(Br)ccc1O 804739526 IPXZBKDATIOULX-SSDOTTSWSA-N 351.222 0.709 10 10 FCCE Cc1cc(N2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)n2ncnc2n1 825432650 ONSBEZUAMWCBDW-UHFFFAOYSA-N 372.360 0.945 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CN(C)C(=O)[C@H]3C)CC2)cc1 830796802 HBHNJZZVKAWDJG-WBVHZDCISA-N 362.474 0.298 10 10 FCCE CC(C)OC[C@H](N)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 851629400 ISTHZOKXNSZIFF-RDJZCZTQSA-N 362.474 0.757 10 10 FCCE CCN1CC[C@@H]1CNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 897565647 QKTPIXBGDJFEBM-CRAIPNDOSA-N 374.485 0.911 10 10 FCCE COC(OC)C(=O)N1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 912357175 UPFKHPJLMMNYJB-GQCTYLIASA-N 350.371 0.401 10 10 FCCE CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NCc2ccc(O)cc2O)c1 1162279178 UQNCXZPHMQUCFV-UHFFFAOYSA-N 366.395 0.984 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)N1CC=C[C@@H]1CO 1334615334 KMJXYIJPINSOPU-MRXNPFEDSA-N 359.426 0.023 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCn3cnnn3)cc2)C1 1355489373 MQNUJFPXDJRYPE-AWEZNQCLSA-N 357.418 0.081 10 10 FCCE O=C(NCCNS(=O)(=O)c1ccccc1)c1c(F)ccc(O)c1O 1641213851 BLNKIKSVWSHEME-UHFFFAOYSA-N 354.359 0.945 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2311714737 GSCOCHAZQVWQAC-OUAUKWLOSA-N 355.395 0.534 10 10 FCCE O=C(O)CNC(=O)CN1C(=O)/C(=C\c2ccc(O)cc2)SC1=S 210679762 ZRRVCIPCHZJSEL-BJMVGYQFSA-N 352.393 0.794 10 10 FCCE CCn1ccc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1 829664706 OXYHUSIJCLYLDN-OAHLLOKOSA-N 371.441 0.923 10 10 FCCE CO[C@@H]1COC[C@@H]1NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 839198750 GZRPHBUJCUXGRV-DOTOQJQBSA-N 367.421 0.282 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCO[C@H]([C@@H](C)O)C3)CC2)cc1 839671490 BDSOXOAKRPHJDC-QAPCUYQASA-N 363.458 0.425 10 10 FCCE CO[C@@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCOC1 850601317 FKFXMTLAFMHFAY-RDJZCZTQSA-N 363.458 0.879 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3C[C@@H]4C[C@@]4(CO)C3)C2)cc1 1326252134 AJOJMPDRSRVEJK-SIFCLUCFSA-N 373.453 0.479 10 10 FCCE NC(=O)N[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 1327620136 GBUGDPLLKNIHSK-AWEZNQCLSA-N 359.430 0.172 10 10 FCCE O=C1C[C@@H](CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CN1 1332814912 ZVGCAGGZCMNWQR-OAHLLOKOSA-N 358.442 0.545 10 10 FCCE CN(C)CCNC(=O)Cn1cc(NC(=O)Cc2ccc(O)c(O)c2)cn1 1617864485 QFPZPTSWXBMZCU-UHFFFAOYSA-N 361.402 0.153 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCc3ccn(C)n3)C2)cc1 829167799 NKQDEMMDHWGVCE-OAHLLOKOSA-N 371.441 0.483 10 10 FCCE CN(C)S(=O)(=O)N1CC(NCc2ccc(N3CCOCC3)cc2)C1 858311595 JNLLBQWHRHBDEP-UHFFFAOYSA-N 354.476 0.103 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H](O)c1cnc[nH]1 868838638 LQNOHLXSPULOIU-OAHLLOKOSA-N 352.341 0.874 10 10 FCCE CN(C)c1ccc([C@H](CNC(=O)NCCCS(N)(=O)=O)N(C)C)cc1 1252425459 ORNFPTVFZGUQBZ-HNNXBMFYSA-N 371.507 0.333 10 10 FCCE Cc1nn(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(=O)o1 1586864624 NCFCXVAXRXXKAC-UHFFFAOYSA-N 364.377 0.561 10 10 FCCE O=C(O)[C@@H]1CN(Cc2c(O)cccc2Br)CCS1(=O)=O 2197715382 QTZFLJFVGDKLDX-NSHDSACASA-N 364.217 0.838 10 10 FCCE CN1CCN(C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c2ccc(F)cc21 255516791 OBEWCHMQUAIKTA-DAXSKMNVSA-N 358.373 0.719 10 10 FCCE CC1(O)CC(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 855396730 VIQWJCYCPJCYDR-UHFFFAOYSA-N 352.456 0.699 10 10 FCCE CCN1C[C@H](S(=O)(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 867496841 IPSKYJBMRKBNBJ-XJKSGUPXSA-N 367.471 0.814 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(N2CC[C@@H](O)C2)CC1 1119022995 KBZAOQVEAIEMEI-OAHLLOKOSA-N 359.426 0.292 10 10 FCCE NS(=O)(=O)CCCC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1148700779 GLHFWFQTPRTEBV-UHFFFAOYSA-N 355.460 0.333 10 10 FCCE O=S1(=O)CC[C@@]2(CN(Cc3cc4c(cc3O)OC[C@H]4O)CCO2)C1 1326485406 FKIZRJGDJSFPIU-GDBMZVCRSA-N 355.412 0.208 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)NCCCS(N)(=O)=O)C2)cc1 1478891146 IEHWXUGFNUHGSQ-ZDUSSCGKSA-N 370.475 0.499 10 10 FCCE CC(=O)N1CCN(C(=O)CCNC(=O)N[C@@H](C)c2ccccc2O)CC1 1679491919 IXANTNWEHZBXAB-ZDUSSCGKSA-N 362.430 0.833 10 10 FCCE COC(=O)C[C@@H](N)C(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1865968410 VEOSEAGYRGWHLQ-ZBFHGGJFSA-N 359.430 0.582 10 10 FCCE CN1C(=O)C(=Cc2c(NCCO)nc3ccccn3c2=O)SC1=S 2053515923 PUKWZODZRWOYJH-UHFFFAOYSA-N 362.436 0.930 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NOCC(=O)O 2123675555 CMGVVFNXFGXPNO-JTQLQIEISA-N 370.358 0.666 10 10 FCCE CN(C(=O)[C@@H]1[C@H](O)[C@@H](O)CCN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2136255004 BZVBWQMBQZHYBZ-SOUVJXGZSA-N 365.430 0.963 10 10 FCCE Cc1cccc(CNC(=O)[C@@H]2[C@@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c1O 2139763865 KWECPEJGFNWCCI-YDHLFZDLSA-N 366.414 0.658 10 10 FCCE CN[C@@H]1C(=O)Nc2cc(N3CCNC(=O)[C@@H]3C)c(Br)cc21 92775870 XRJZCWBRWLVHFB-MADCSZMMSA-N 353.220 0.986 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCSC[C@H]3CCO)nc12 759731813 OBSADXUGLCTUKC-GFCCVEGCSA-N 366.443 0.911 10 10 FCCE CC[C@H](CO)N1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761908008 JUCUCTWVQJVHDG-LLVKDONJSA-N 350.375 0.819 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC[C@@H](F)[C@H](N)C2)cc1 852921792 QTYSHBUDOHNLHR-HZPDHXFCSA-N 366.437 0.488 10 10 FCCE O=C(NCc1cc(Br)ccc1O)c1cnn(C[C@@H](O)CO)c1 854442408 RCDJASWOVCCXTI-GFCCVEGCSA-N 370.203 0.634 10 10 FCCE CN(CC(=O)NCc1ccc2cccnc2c1O)[C@H]1CCS(=O)(=O)C1 862026164 HKNRZSAXMWHREN-AWEZNQCLSA-N 363.439 0.676 10 10 FCCE C[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC(=O)N1C 288503777 JJEZRLYMIJASCM-CQSZACIVSA-N 356.426 0.368 10 10 FCCE CN(C)S(=O)(=O)N1CCC[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1 805480793 BAOPFHSLHZCBDA-STMXVASLSA-N 369.443 0.498 10 10 FCCE CC(=O)C(=O)COC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1 808524813 IBZWJWMXPRVDEI-UHFFFAOYSA-N 362.382 0.642 10 10 FCCE O=C(C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CC[C@@]2(O)C[C@H]2C1 1327288129 VKQBJVFYEGVVRG-RZQQEMMASA-N 374.437 0.883 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CCN(C(=O)c2ccc(O)nc2)CC1 1626322370 IBDIOTVDOOLSFL-UHFFFAOYSA-N 357.366 0.726 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCC(=O)Nc1ccc(-n2cncn2)cc1 1641965780 ZOPWCHFXWMOTLT-UHFFFAOYSA-N 367.365 0.976 10 10 FCCE COc1ccc(N2CCN(C(=O)c3cnc4nc[nH]n4c3=O)CC2)cc1 1866354706 HPOFCDNGGKSHRJ-UHFFFAOYSA-N 354.370 0.389 10 10 FCCE C[C@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CC(=O)N1C 806276403 OKCUYZAKMWTCTA-JTQLQIEISA-N 356.473 0.431 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](S(N)(=O)=O)C3)C2)cc1 852451166 FHLDVFUODFYPJR-SWLSCSKDSA-N 368.459 0.346 10 10 FCCE COC[C@H]1CCN1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 852501379 ZXAPICDNJBZCMA-MRXNPFEDSA-N 367.471 0.852 10 10 FCCE O=C(C=C1CCNCC1)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 852860180 MGARRXIVEJYHLY-UHFFFAOYSA-N 363.483 0.847 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H](C)[C@H]3CCC(=O)N3)CC2)cc1 858839433 DTTDGBSYHRXFCH-CRAIPNDOSA-N 374.485 0.848 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3CCn4nccc4C3)CC2)cc1 1473670607 LZPOPYDXZKVUKZ-LJQANCHMSA-N 371.485 0.890 10 10 FCCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NC[C@H]1CN2CCN1CC2 255142222 QTGLMUYVSWPMPD-ORUDLHBZSA-N 356.470 0.652 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)CCn3cncn3)CC2)cc1 299490597 GCAIGZCRQXCAQY-UHFFFAOYSA-N 358.446 0.615 10 10 FCCE CO[C@H](CNC(=O)C(=O)NCCCSc1nccs1)[C@H]1CCOC1 828239449 OSPXTXAXGCSBHC-NWDGAFQWSA-N 373.500 0.909 10 10 FCCE NS(=O)(=O)c1ccc2c(c1)N(C(=O)c1ccnc3c1CC(=O)N3)CC2 1565715469 IGRGZWKCDBMRDO-UHFFFAOYSA-N 358.379 0.427 10 10 FCCE Cc1ccc(CNS(=O)(=O)N2CC(N)C2)c(O)c1Br 2352944350 GOGGFYOMGKYHJD-UHFFFAOYSA-N 350.238 0.440 10 10 FCCE O=C(NC1CC1)C(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 91930508 JDOCJYUONMTOBY-UHFFFAOYSA-N 372.469 0.446 10 10 FCCE CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC(=O)/C=C\c1ccc(O)c(O)c1 800667915 PLRJNCZUOULIMN-SVSNBYFCSA-N 354.428 0.945 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](CN)CC(C)C)C2)cc1 851688196 SIMCAMQYQCJUKG-CABCVRRESA-N 362.474 0.880 10 10 FCCE COc1cc(C(=O)N[C@H](CO)CNC(=O)[C@@H]2C[C@H]2C2CC2)cc(OC)n1 1510953334 WKUXYVQFYUSEGM-MELADBBJSA-N 363.414 0.352 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)C[C@H](O)CN1C 1632356924 WKNWHVBUDITDEA-LXIYXOSZSA-N 366.414 0.143 10 10 FCCE N[C@H](COCc1ccccc1)C(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)O 2151895844 XBRCHCXPWFKAAX-HUUCEWRRSA-N 374.393 0.754 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNC(=O)Cc1ccc(N)cc1 2225623295 OWJSZLQJKMFJBJ-YCPHGPKFSA-N 365.430 0.269 10 10 FCCE CN(C(=O)[C@H]1[C@@H](O)[C@@H](O)CCN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2332901364 BZVBWQMBQZHYBZ-ZNMIVQPWSA-N 365.430 0.963 10 10 FCCE Cc1nn(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(=O)n1C 844772208 PGBAOACMEOHOHM-UHFFFAOYSA-N 363.393 0.182 10 10 FCCE COC(=O)c1ccc(O)c([C@H](C)NC[C@@]23COCCN2C(=O)COC3)c1 866554900 VHMBYIMPZCVGRT-SGTLLEGYSA-N 364.398 0.457 10 10 FCCE C[C@H]1CN(CCN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@@H](C)O1 1118941576 DONDRBBRTGMSAC-OKILXGFUSA-N 361.442 0.802 10 10 FCCE CCOC(=O)C1=S=C(NC(=O)c2ccnc3c(C(N)=O)cnn23)C=C1C 1301643440 DTRRYTWCGKZSPP-UHFFFAOYSA-N 373.394 0.117 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCN(c2ccc3nncn3n2)C1 1640534008 SNZVFOBRCNLJRQ-LBPRGKRZSA-N 354.370 0.473 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC[C@@H](CS(N)(=O)=O)C2)c([N+](=O)[O-])c1 1651480582 BKBHTDQPNHGPIT-OGOUPESXSA-N 369.399 0.896 10 10 FCCE COCCCN(C(=O)c1cc(O)c(O)c(O)c1)[C@H]1CCS(=O)(=O)C1 1866303385 SZLSXZVBUYXNRQ-NSHDSACASA-N 359.400 0.469 10 10 FCCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@H](COCc1ccccc1)C(=O)O 2151970857 LBZPWJKMBNHGMB-LSDHHAIUSA-N 374.393 0.754 10 10 FCCE CN(C(=O)C1=C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1cccn(C)c1=O 2224794926 TYTNPTSRSDLQTA-TZMCWYRMSA-N 363.414 0.932 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3CC(=O)N(C)C3)CC2)cc1 765238696 CHOKVNGLQDMEQC-UHFFFAOYSA-N 361.446 0.258 10 10 FCCE CN(C)S(=O)(=O)[C@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 795654965 WRWWAFVDYNWPGG-WFASDCNBSA-N 356.444 0.674 10 10 FCCE CCOC(=O)C[C@@H](O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 819591149 PMKYTAGUWYACTO-CZUORRHYSA-N 350.415 0.952 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)[C@H]3CCCNC3)C2)cc1 851688035 OYILWDXGIDAMKG-PMPSAXMXSA-N 374.485 0.894 10 10 FCCE C[C@H](NC(=O)N1CCC(CO)(CO)C1)c1ccc(N2CCOCC2)cc1 853487161 LFYYKWKAMSGGKZ-HNNXBMFYSA-N 363.458 0.971 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)C3CS(=O)(=O)C3)cc2F)CC1 865201732 JKRBFVMYJOZUIA-UHFFFAOYSA-N 369.462 0.628 10 10 FCCE O=C(NCc1c(O)cccc1F)[C@@H]1CC(=O)N(CCN2CCOCC2)C1 928710325 BHPORSDHBLAVIC-CYBMUJFWSA-N 365.405 0.328 10 10 FCCE COC1(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CS(=O)(=O)C1 930743846 GVBHKCIODIGBOY-CYBMUJFWSA-N 368.455 0.514 10 10 FCCE CCOC(=O)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)[C@H](O)c1cccnc1 1151407408 KEMSAHZSCOSREW-DLBZAZTESA-N 360.366 0.817 10 10 FCCE COC(=O)[C@@H](CCC1OCCO1)NC(=O)/C=C/c1ccc(O)c(O)c1 1152646335 XKSKTJBOSBXHMM-MJRJWQSSSA-N 351.355 0.922 10 10 FCCE CS(=O)(=O)C[C@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 1179412609 CWDCQNQIGYXWJR-GFCCVEGCSA-N 354.388 0.735 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(c2ccccn2)CC1 1329333799 WWTLLPGDPIZUBQ-UHFFFAOYSA-N 352.394 0.978 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CO)CNS(=O)(=O)Cc1ccc(N)cc1 2011520378 SAYVMXCIHMTINB-CYBMUJFWSA-N 359.448 0.574 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c1 768909728 BJZLKILXSWEIGA-UIJKISKDSA-N 359.382 0.689 10 10 FCCE CC[S@@](=O)CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687958 SSFJJIQULIXZTM-XMMPIXPASA-N 351.472 0.570 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc2c(c1)CCC2 808512218 PTEYBYKHYQNWFH-CVEARBPZSA-N 359.378 0.452 10 10 FCCE CC1(C)CN(CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 847360844 ATGNQVKFNUBMAS-UHFFFAOYSA-N 365.499 0.879 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CC[C@@H](C(N)=O)O3)C2)cc1 852202285 CQGPPHKZDUTGRM-RCBQFDQVSA-N 362.430 0.606 10 10 FCCE COc1ccc(N2CCCN(C(=O)[C@@H]3CN(C(C)=O)CCO3)CC2)cc1 930308891 BCQXREOBKVVALN-SFHVURJKSA-N 361.442 0.981 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1C[C@@H]2C[C@@]2(CO)C1 1118052186 FDRZYHZNCSCXCJ-UVFQYZLESA-N 359.470 0.949 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 1566268002 OCJHSHQADAQROY-IYVPYFHTSA-N 356.378 0.564 10 10 FCCE CN1CCn2c(CCNC(=O)/C=C/c3ccc(O)c(O)c3)nnc2C1=O 1594081810 JPCSKIHJPDSOPN-HWKANZROSA-N 357.370 0.147 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCC(N)=O 2059514082 UVLXHQRHJRWMSE-JTQLQIEISA-N 353.375 0.135 10 10 FCCE CC(C)(C)OC(=O)N1CCO[C@@H]2C[C@H](COc3nnc(=N)[nH]n3)C[C@H]21 2219022132 UFWJMLLZBIVTQJ-GMTAPVOTSA-N 352.395 0.472 10 10 FCCE CC(C)(C)OC(=O)NCC(CO)(CO)NCc1ccc2c(c1)CCO2 2254544464 KWQORIWZOPKUPH-UHFFFAOYSA-N 352.431 0.959 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2331520035 HQYSTDIYKAGWTJ-IJLUTSLNSA-N 369.422 0.924 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@]3(C)C(N)=O)nc12 371830504 ZTYWESGTLDCLBH-QGZVFWFLSA-N 361.402 0.842 10 10 FCCE Cc1cc(N2CCN(C(=O)c3cccc(O)c3O)CC2)n2ncnc2n1 790527615 HLXPAPUPJMBJJT-UHFFFAOYSA-N 354.370 0.806 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(S(N)(=O)=O)cn1C 808095375 CXZPCPUPTCBYRB-UHFFFAOYSA-N 358.416 0.794 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CCC4(COC4)C3)CC2)cc1 852682884 BIPRYAOUKSCWQQ-SFHVURJKSA-N 361.486 0.900 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(C(=O)c2ccco2)CC1 1351811395 YBVJSLVCKPCDOO-UHFFFAOYSA-N 369.377 0.812 10 10 FCCE CON(C)C[C@H](O)Cn1cc(NC(=O)/C=C/c2ccc(O)c(O)c2)cn1 1466115072 UMHNUPFRXLDGRR-YVZNUBBCSA-N 362.386 0.800 10 10 FCCE O=C(CNS(=O)(=O)c1ccc(F)cc1)NCc1cc(O)ccc1O 1651222479 HNZDVBCILSFYGU-UHFFFAOYSA-N 354.359 0.832 10 10 FCCE COc1ccc(CNC(=O)NCc2nc(O)c3c(n2)CCOC3)c(O)c1 1683594988 RWFIGDCMHNSQKY-UHFFFAOYSA-N 360.370 0.969 10 10 FCCE COc1ccc(CNC[C@@H]2[C@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c(O)c1 2225621916 GSHOBHDPSBEONC-KBMXLJTQSA-N 368.430 0.832 10 10 FCCE CN1C(=O)C(=CNC2CCN(Cc3ccccc3)CC2)C(=O)NC1=S 2296103020 LGXGJXPGJHYTCZ-UHFFFAOYSA-N 358.467 0.998 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2310482336 IECWPJKZVBUYOE-WISYIIOYSA-N 355.395 0.629 10 10 FCCE CNC(=O)[C@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 823520547 YDVVUUXHWLFPIP-HNNXBMFYSA-N 360.458 0.925 10 10 FCCE CO[C@]1(CNCc2ccc(N3CCN(C)CC3)cc2)CCS(=O)(=O)C1 922619389 QREDBGQORMNNBT-SFHVURJKSA-N 367.515 0.732 10 10 FCCE C[C@H]1CN(c2ccc(CNS(=O)(=O)C3CNC3)cc2F)C[C@@H](C)O1 923592526 QGJJZEJDAVGHLI-TXEJJXNPSA-N 357.451 0.831 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3cc(=O)cc[nH]3)CC2)cc1 1136455030 SENXZCPDRIFXGR-UHFFFAOYSA-N 356.426 0.936 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1C[C@@H](O)CN1c1ccncn1 1297562476 MBMVNRAVTRZWGV-OLZOCXBDSA-N 363.414 0.924 10 10 FCCE CC(C)C[C@@H](CN)NC(=O)C(=O)C(=O)C(=O)NC[C@@H]1C[C@H]2C=C[C@H]1CC2 1329023452 HZEOMQIXROTWCP-AJNGGQMLSA-N 363.458 0.333 10 10 FCCE C[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)S(C)(=O)=O 1598008636 DTWDRQXBQWDPDQ-LBPRGKRZSA-N 367.471 0.438 10 10 FCCE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](O)CN1C(=O)c1cc(O)c(O)c(O)c1 2132348473 LXYTWWJAZOQJRG-WDEREUQCSA-N 368.386 0.904 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1C[C@H]2CC[C@H]1CN2 817910045 ILBQISVSUNELRT-WBVHZDCISA-N 358.442 0.102 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@H]3CNCC[C@H]3C)C2)cc1 818677766 VLCJEXOIAGYJOS-RKVPGOIHSA-N 374.485 0.752 10 10 FCCE CN1C[C@H](C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)NC1=O 822937310 GTKRDPLOSRYMEF-DZGCQCFKSA-N 359.430 0.028 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)Cc3cnnn3C)CC2)cc1 854308870 CXGZQGVCZZCNAB-UHFFFAOYSA-N 372.473 0.695 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCc3nnn(C)c3C2)cc1F 929800446 FTRDKUQPAATJJW-LBPRGKRZSA-N 374.420 0.310 10 10 FCCE C[C@]1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCC(=O)NC1 1178039352 QIGUOROLCMDPHE-FQEVSTJZSA-N 372.469 0.921 10 10 FCCE CC1(F)CN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 1322227015 FWDMHYFWWMPNKY-UHFFFAOYSA-N 367.396 0.973 10 10 FCCE NC(=O)[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(C(=O)Cc2ccc(N)cc2)C1 2162969511 QHIRRQZYOLIBKF-PWSUYJOCSA-N 372.347 0.192 10 10 FCCE CN(C(=O)[C@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2311665787 ADNRYIPCPUYZJD-MJBXVCDLSA-N 351.403 0.573 10 10 FCCE CCN1CC[C@@H]1CNC(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 898095923 ITXOIGLQDBHIRB-NVXWUHKLSA-N 374.485 0.848 10 10 FCCE COC(=O)[C@@H](F)CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1119587262 CHAMYGFPYFNDLL-AWEZNQCLSA-N 351.378 0.530 10 10 FCCE CCN1C(=O)[C@@H]2CN(C(=O)c3ccc(N=NC(N)=O)cc3)CCN2C1=O 1294450245 HJAIQMNTPPSEGR-LBPRGKRZSA-N 358.358 0.958 10 10 FCCE CCN1C(=O)CN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1=O 1890595739 IDDIAAAJVGLDBQ-UHFFFAOYSA-N 360.414 0.628 10 10 FCCE Cn1ccnc1CN1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 130618251 KNHPDZWPWDOPQM-UHFFFAOYSA-N 372.385 0.981 10 10 FCCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2C[C@H](O)[C@@H](O)C2)C1 628527028 AMEUNSRVDUWOFP-OALUTQOASA-N 357.454 0.972 10 10 FCCE CNS(=O)(=O)c1cc(NS(=O)(=O)N2CCC[C@@H](C)C2)ccc1O 790406158 CVCRNOJSXCNTHN-SNVBAGLBSA-N 363.461 0.689 10 10 FCCE CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 800667913 PLRJNCZUOULIMN-FRNKVXGRSA-N 354.428 0.945 10 10 FCCE CC[C@@H](O)CC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 837810117 MGWPGRIPWHMMSE-CQSZACIVSA-N 368.405 0.983 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2CCCCNC2)cc1 846343690 NZMFHFFCMNOUNS-HNNXBMFYSA-N 362.474 0.848 10 10 FCCE COc1ccc(N2CCN(CCN3C(=O)CN(C)C3=O)CC2)cc1F 851805999 GSAKENJPSLQZEE-UHFFFAOYSA-N 350.394 0.850 10 10 FCCE Cc1nc([C@@H]2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)n[nH]1 1142369074 BHDIEHNYUAXKPE-SNVBAGLBSA-N 365.415 0.820 10 10 FCCE CC(C)(C)OC(=O)NC1(C(N)=O)CN(CC(=O)Nc2ccc(N)cc2)C1 2109490206 ANBCQISKMBZKSR-UHFFFAOYSA-N 363.418 0.272 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCCC(N)=O 2136260454 DANRBWKQUFPOTI-NSHDSACASA-N 367.402 0.525 10 10 FCCE C[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCS1(=O)=O 155464005 RKPQSAHOCVEQKK-CQSZACIVSA-N 353.488 0.830 10 10 FCCE CCCCS(=O)(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169902498 BAUZXTYHIIAFHH-UHFFFAOYSA-N 358.416 0.691 10 10 FCCE O=C(CN1C(=O)CSC1=S)N1CCC[C@H](Oc2ccncn2)C1 585343793 ABLKBZLCNYJQQV-JTQLQIEISA-N 352.441 0.707 10 10 FCCE CN(CCN1CCCS1(=O)=O)CC(=O)NCc1ccc(N(C)C)cc1 752304798 JAYPKKITWZRZTI-UHFFFAOYSA-N 368.503 0.336 10 10 FCCE CN1CCN(C[C@@H](O)CNCc2ccc(N3CCSCC3)cc2)CC1 818964529 YVNYHRLJRLCNNC-IBGZPJMESA-N 364.559 0.938 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H]2CCCCNC2)cc1 846343692 NZMFHFFCMNOUNS-OAHLLOKOSA-N 362.474 0.848 10 10 FCCE CC1(N2CCOCC2)CCN(C(=O)C(=O)NCCc2ccc(N)cc2)CC1 861776369 KQKKTEXYYDLZQS-UHFFFAOYSA-N 374.485 0.641 10 10 FCCE CCOC(=O)C[C@@H](O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1 870166070 TWKDAFLUANFBIT-OAHLLOKOSA-N 366.414 0.667 10 10 FCCE CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC1 875076408 JHSUFHSZGSPFAZ-UHFFFAOYSA-N 373.453 0.967 10 10 FCCE CC(=O)N1CCO[C@@H](C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 930744878 OPMRAHAXEYSIAV-RDTXWAMCSA-N 361.442 0.948 10 10 FCCE CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(O)c1)[C@@H](O)c1cccnc1 1151407411 KEMSAHZSCOSREW-SJORKVTESA-N 360.366 0.817 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCCCc2ncn(C)n2)cc1F 1328273838 WAFFBOSBGXCDKW-UHFFFAOYSA-N 362.409 0.385 10 10 FCCE C[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@H]1CCC(=O)N1 1596354808 DUPBAGKWMUDETH-CXAGYDPISA-N 372.469 0.919 10 10 FCCE C[C@H](NC(=O)Cn1cnnn1)C(=O)NCc1c(O)ccc2c1CCCC2 1630277835 KXROTERVBDIIDC-NSHDSACASA-N 358.402 0.079 10 10 FCCE CN1CCN(CC(=O)Nc2ccc(N)cc2)[C@@H](CNC(=O)C(F)(F)F)C1 2163045022 YHKOQCATSDRRGI-ZDUSSCGKSA-N 373.379 0.502 10 10 FCCE COc1cccc(CNC[C@@H]2[C@@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c1O 2225621292 CBESSPBYVZWKII-DVOMOZLQSA-N 368.430 0.832 10 10 FCCE COc1ccc(N2C(=O)C(=CNN3CCOCC3)C(=O)NC2=S)cc1 2296109992 BUKHNJPMGRULLD-UHFFFAOYSA-N 362.411 0.164 10 10 FCCE CN1NN=C2C1=NCC[C@@H]2C(=O)NCc1ccc(N2CCOCC2)c(F)c1 816891041 HCZYUHIWYYTZAF-ZDUSSCGKSA-N 374.420 0.503 10 10 FCCE COc1ccc(N2CC[C@H](NS(=O)(=O)N3CCCOCC3)C2)cc1 849417361 PPFLJHGQGFJZJC-AWEZNQCLSA-N 355.460 0.831 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C[C@@H]4CNC[C@]4(C)C3)CC2)cc1 872153990 QHHVEYDBUGBALK-OXJNMPFZSA-N 358.486 0.885 10 10 FCCE O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCNC1 923592934 XHQKIUHERCQATQ-AWEZNQCLSA-N 357.451 0.834 10 10 FCCE CON(C)C[C@H](O)Cn1cc(NC(=O)Cc2ccc(O)c(O)c2)cn1 1295118507 POMHYGRPYRQTHP-ZDUSSCGKSA-N 350.375 0.330 10 10 FCCE O=C(NCc1c(O)cccc1F)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 1638863233 KYJIWQFNRVEAEO-QWRGUYRKSA-N 370.402 0.183 10 10 FCCE COCC(=O)N1CCC[C@@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 1862277379 BFVFRCULCXVBMX-QGZVFWFLSA-N 361.442 0.981 10 10 FCCE O=S1(=O)C[C@@H]2NCCN(Cc3c(O)cccc3Br)[C@H]2C1 2143710899 BXEOQLSOZGISFJ-RYUDHWBXSA-N 361.261 0.726 10 10 FCCE CCOc1ccccc1N1C(=O)NC(=O)C(=CNN2CCOCC2)C1=O 2296926390 KFCZHKPHVYRZFG-UHFFFAOYSA-N 360.370 0.389 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)N3CC(CO)C3)CC2)cc1 190582646 BDTGPERDWIIZTJ-UHFFFAOYSA-N 362.474 0.841 10 10 FCCE CC(=O)OC[C@H]1O[C@@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O 616625458 NHNYHKRWHCWHAJ-XVIXHAIJSA-N 373.318 0.380 10 10 FCCE C[C@H]1CN([C@H](C)CNC(=O)C(=O)NCCc2ccc(N)cc2)C[C@@H](C)O1 848613003 CDGZXUKSOGNENU-KFWWJZLASA-N 362.474 0.541 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCCNCC3)C2)cc1 851689460 PGYSIKSKGZSGAM-GJZGRUSLSA-N 360.458 0.648 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(Cn2ccnn2)CC1 1329483153 HFHLHBHAPOBBTH-UHFFFAOYSA-N 355.398 0.765 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)CN3CCOC3=O)cc2)CC1 1558397066 JNQKDQHGTNKUHC-UHFFFAOYSA-N 360.414 0.457 10 10 FCCE C[C@@H]1CC[C@H](C(N)=O)[C@@H](C)N1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1627712107 WKAWHTRBWCKPTL-FOGDFJRCSA-N 369.443 0.878 10 10 FCCE CN1CCN(c2ccc(CNC(=O)N3C[C@H]4COC(=O)[C@H]4C3)cc2)CC1 1687441280 IEWQFMXMAZXWEQ-RDJZCZTQSA-N 358.442 0.753 10 10 FCCE Cc1nn(C)c2c1[C@H](c1ccc(O)c(O)c1)C(C(=O)NCCCO)=C(N)O2 1864009068 YQTANDLMSKMBRG-AWEZNQCLSA-N 374.397 0.333 10 10 FCCE CO[C@H]1[C@@H](C(=O)C(=O)C[C@H]2C[C@H](N)C2)N(C(=O)OC(C)(C)C)C[C@H]1OC 2140536893 XUSIILJBJUUOSF-PSDNQQDLSA-N 370.446 0.901 10 10 FCCE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cn2cn[nH]c2=O)cc1 157706916 ALXDYBNKNNRYKN-MRXNPFEDSA-N 359.430 0.845 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(CCO)C3)CC2)cc1 778420027 QVPUGGUVMGUXAS-VOTSOKGWSA-N 373.453 0.741 10 10 FCCE CCN1CCN(CC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 856211217 IVKPGMWQXXBSON-UHFFFAOYSA-N 360.502 0.901 10 10 FCCE COC(=O)c1c(CN2CC(NS(C)(=O)=O)C2)c2cc(F)ccc2n1C 895394161 VPMBOYBZUFKNKE-UHFFFAOYSA-N 369.418 0.837 10 10 FCCE COC(=O)c1c(CN(C)CCS(N)(=O)=O)c2cc(F)ccc2n1C 895476256 GVLAFHBSXPAWNA-UHFFFAOYSA-N 357.407 0.824 10 10 FCCE CCN1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1=O 1329922848 XZBYONIYPGRHCM-INIZCTEOSA-N 358.442 0.640 10 10 FCCE COC(=O)C[C@@H]1CS(=O)(=O)CCN1C(=O)c1ccc(C)c(O)c1O 1631775829 AUBANWPISPXLOL-SNVBAGLBSA-N 357.384 0.209 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1CN(C(=O)c2cc(O)nc(O)c2)CC[C@H]1CO 2122238880 FOEMUALTGVDFRO-JQWIXIFHSA-N 367.402 0.841 10 10 FCCE CC(=O)OC[C@H]1O[C@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@H]1OC(C)=O 85483048 QKGHBQJLEHAMKJ-DGTMBMJNSA-N 373.318 0.380 10 10 FCCE O=C1CN(c2ccc(CNC(=O)c3ccc4nncn4c3)cc2)CCN1 109848208 FYYRKYORWRYCGN-UHFFFAOYSA-N 350.382 0.596 10 10 FCCE O=c1c(=Cc2ccncc2)sc2n1CN(c1ccc3c(c1)OCO3)CN=2 254444922 SJZIAZPCOABGMT-UHFFFAOYSA-N 366.402 0.917 10 10 FCCE COC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 285665654 IADLJQCLPPDGHB-ZDUSSCGKSA-N 365.405 0.920 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H](C)NC(=O)c1cc2c(C)nn(C)c2s1 808521211 KHKIVWPQVLPCOL-QMMMGPOBSA-N 351.384 0.763 10 10 FCCE CON(C)C(=O)[C@H](C)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 858977070 IFKWPMFVCXMUOU-ZDUSSCGKSA-N 364.446 0.855 10 10 FCCE NC(=O)N[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 1346326695 JQWKCKSJCDKTAP-SECBINFHSA-N 357.461 0.011 10 10 FCCE COc1ccc(CNC2(CNC(=O)[C@H]3CC[C@@H](C(N)=O)O3)CC2)cc1C 1499351835 GYQJJYAEDIJPHA-JKSUJKDBSA-N 361.442 0.775 10 10 FCCE CN1N=C(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCC1=O 1537839351 KHCLSRLCXTVGPT-UHFFFAOYSA-N 371.441 0.613 10 10 FCCE C#CCNC(=O)CN1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@H]1C 1707268511 QUHAPZNNPPWMNJ-DOMZBBRYSA-N 370.413 0.791 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNC(=O)Nc1ccc(N)cc1 2225621983 HBIXHBVOBUAQIX-RDBSUJKOSA-N 366.418 0.731 10 10 FCCE COc1ccc(N2CCN(C(=O)COC(=O)c3ccnnc3)CC2)cc1 759815103 SGMHVTGLXBEEFS-UHFFFAOYSA-N 356.382 0.991 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)N(CCN)CCO)cc2F)CC1 841791902 BSRWRXYVXGBLSQ-UHFFFAOYSA-N 367.469 0.430 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(C[C@@H](O)CO)c3)C2)cc1 855224924 ICXBZAAQLUCHOH-GDBMZVCRSA-N 360.414 0.254 10 10 FCCE COC(=O)/C=C\c1ccc(N2CCCN(CC(N)=O)CC2)c([N+](=O)[O-])c1 919721628 NSEKUOUHKSQOOA-XQRVVYSFSA-N 362.386 0.778 10 10 FCCE COC1CCN(c2ccc(CN3C[C@@H](C(N)=O)[C@@H](C(N)=O)C3)cc2)CC1 1196091802 CGNWNZFDIARKTF-CALCHBBNSA-N 360.458 0.320 10 10 FCCE C[C@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1338556653 POAINWLGLYXYAQ-MAUKXSAKSA-N 374.485 0.596 10 10 FCCE CNC(=O)N[C@H]1CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 1478956253 DUOYAZPMIYLXOZ-KBPBESRZSA-N 361.446 0.987 10 10 FCCE Cc1c(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)nnn1C 1598010207 VGUYLUZTLCMHIS-UHFFFAOYSA-N 356.430 0.755 10 10 FCCE CN1C(=O)N[C@]2(CCC[C@H]2CNC(=O)c2c(F)ccc(O)c2O)C1=O 1638421614 CSOWEGOPJJNJOE-PWJLMRLQSA-N 351.334 0.687 10 10 FCCE Nc1n[nH]c(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 1687347372 AKMDKASHDJAALU-UHFFFAOYSA-N 359.434 0.595 10 10 FCCE CC(=O)N1CCN(CCNCc2ccc(N3CCOCC3)c(F)c2)CC1 66972731 VTSHXQHMHSAGLU-UHFFFAOYSA-N 364.465 0.916 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C(=O)NC(=O)C3(C)C)CC2)cc1 746093438 GMHJDCCWHJJMMU-UHFFFAOYSA-N 360.414 0.674 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1nnc(O)nc1O 1141926579 MGXASXPAWOUSOH-UHFFFAOYSA-N 367.312 0.328 10 10 FCCE CN1CCC[C@H](N2CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)C1 1332019613 SRZFWGXIJWBTPR-INIZCTEOSA-N 372.469 0.473 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CO)C[C@@H]2CCCO2)c1 1652026324 SRLGKOAUHCACKI-RYUDHWBXSA-N 358.416 0.424 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](N)[C@@H](O)C(=O)O 1952345727 GMXPSKONXCQVOK-JIMOISOXSA-N 356.375 0.306 10 10 FCCE O=C(CN1C(=O)CSC1=S)N1CCC[C@@H](Oc2cnccn2)C1 238881214 PHKWMEUQXUDLIR-SNVBAGLBSA-N 352.441 0.707 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3[C@H]4COC[C@H]43)cc2)C1 792893001 JNAJEYAFNFNLQR-SIXLDLHFSA-N 358.442 0.832 10 10 FCCE COc1ccc(N2CCC(NC[C@H](O)CN3CCN(C)CC3)CC2)cc1 819002672 NDCPVPFQCRAESH-IBGZPJMESA-N 362.518 0.862 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@H]([C@@H](C)O)C3)nc12 839669537 AMCIFKMONIWLSY-MFKMUULPSA-N 350.375 0.193 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN4C(=O)NC(=O)[C@H]4C3)C2)cc1 854298568 FVTAOFVWHBBSCU-IUODEOHRSA-N 373.413 0.220 10 10 FCCE CN1C[C@@H](C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)NC1=O 854905698 BOJMRXMFDJLKRM-ZDUSSCGKSA-N 354.357 0.441 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCN(OC)CC1 1624658822 LNCKORUPSZOJGN-AWEZNQCLSA-N 366.414 0.962 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC[C@H](O)[C@@H]3C)CC2)cc1 1627689629 RPUVAMORCBKNDA-QOLZPOHTSA-N 373.453 0.882 10 10 FCCE O=C(Cc1c(O)ncnc1O)NCc1ccc(N2CCOCC2)c(F)c1 1630550584 RWNBWUYDLYYALL-UHFFFAOYSA-N 362.361 0.722 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCCNC(=O)[C@@H]3CC)nc12 1654879159 XBSZGDSIOQTPCQ-ZDUSSCGKSA-N 361.402 0.712 10 10 FCCE COc1ccc(Br)c(CN[C@@H]2CS(=O)(=O)C[C@@H]2O)c1O 2236055870 SADKLOYUQZJKPF-ZJUUUORDSA-N 366.233 0.411 10 10 FCCE O=C(CN1C(=O)CSC1=S)NCCn1nc(C2CC2)ccc1=O 585410580 NULBDLFRUMCIKP-UHFFFAOYSA-N 352.441 0.097 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1CN(C)C(=O)N1 831706235 BTNSTFAFUZJBKO-NSHDSACASA-N 355.778 0.571 10 10 FCCE O=C(C(=O)N1CCNC[C@H]1c1cccnc1)N1Cc2cccc(O)c2C1 1329563115 MBBZZWHEYGJZQU-INIZCTEOSA-N 352.394 0.803 10 10 FCCE CCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@@H](C)CS(=O)(=O)CC 1351836769 ACFSWYATDUZDNB-LBPRGKRZSA-N 368.455 0.906 10 10 FCCE CCS(=O)(=O)N(C)C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1565683440 BJMIZVUDMDLMIE-UHFFFAOYSA-N 356.444 0.913 10 10 FCCE C[C@@H](NC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1ccccc1O 1587445023 RTZAYJQHWBKJPH-JHJVBQTASA-N 366.439 0.605 10 10 FCCE Cc1cccc(CNC(=O)[C@@H]2[C@@H](O)[C@H](O)CN2C(=O)OC(C)(C)C)c1O 2139763862 KWECPEJGFNWCCI-IPYPFGDCSA-N 366.414 0.658 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H]3C[C@@H]3C(=O)N3CCOCC3)CC2)cc1 243473407 NKKACYROSHECRU-ROUUACIJSA-N 373.453 0.839 10 10 FCCE CC[S@](=O)CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788317908 ANUBNNRJJYGORW-VWLOTQADSA-N 367.471 0.024 10 10 FCCE C[C@H](NC(=O)[C@H]1CCN=C2C1=NNN2C)c1ccc(N2CCOCC2)cc1 823834359 BHWWTLVEZULZSA-BBRMVZONSA-N 370.457 0.925 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CC[C@H](C(=O)O)C2)cc1F 843258187 ZXXQFPLSDCYAFN-NWDGAFQWSA-N 351.378 0.877 10 10 FCCE C[C@H](NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H](C)N 851669694 ZZSUBGNGLJHQQK-OLZOCXBDSA-N 354.476 0.456 10 10 FCCE C[C@@H]1NCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCSCC2)cc1 861769603 NUGSCBPRXWHILM-XJKSGUPXSA-N 362.499 0.723 10 10 FCCE COc1ccc(N2CCN(C(=O)CSc3nnc4nc[nH]n34)CC2)cc1 920110232 IMWNZTWQAMURCY-UHFFFAOYSA-N 373.442 0.902 10 10 FCCE CS(=O)(=O)NC(=O)CCNC(=O)c1cc2cc(O)c(O)cc2s1 1296321864 HOVYRGXAPDYORV-UHFFFAOYSA-N 358.397 0.508 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)NC[C@@]23COCCN2C(=O)COC3)cc1 1643778390 ONLXZSAYGIWKDE-INIZCTEOSA-N 361.358 0.207 10 10 FCCE CCCNC(=O)CN(CC(=O)O)Cc1cc(C(=O)OC)cc(O)c1O 71973653 GJBZRQOVVMGVMK-UHFFFAOYSA-N 354.359 0.297 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3C(=O)O[C@H](C)C3=O)CC2)cc1 871990336 VJBNKYRVBVHTQN-UKRRQHHQSA-N 363.414 0.545 10 10 FCCE C[C@H]1C(=O)N(C)[C@H](C)[C@H](C)N1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1163828600 NSSPOQNBCDTIHZ-VWYCJHECSA-N 369.443 0.843 10 10 FCCE COCCn1cc(N2C[C@H](C(=O)NCc3cc(O)ccc3O)CC2=O)cn1 1643882303 SPMGLEZLCGMAAD-CYBMUJFWSA-N 374.397 0.610 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1COC[C@H]1NS(=O)(=O)Cc1ccc(N)cc1 2044244051 PNVDCTDPGGVSSR-UONOGXRCSA-N 371.459 0.980 10 10 FCCE CC(=O)N1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H](C)C1 271406203 NEDRYHLSCJKJIE-SNVBAGLBSA-N 355.416 0.457 10 10 FCCE COc1ccc(CNC(=O)N[C@@H]2CCN(C3CCOCC3)C2=O)c(O)c1 375687260 ARVJZMXOETVXLN-OAHLLOKOSA-N 363.414 0.980 10 10 FCCE COc1cc(NS(=O)(=O)c2cccc(S(N)(=O)=O)c2)ccc1O 797820484 ZYIFJPSAPURZFM-UHFFFAOYSA-N 358.397 0.849 10 10 FCCE C[C@H]1C(=O)N(C)CN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 825728443 VYENXKPMOIWZNW-LBPRGKRZSA-N 350.394 0.992 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3ncncc3OC)C2)cc1 850536544 HEJSQABOEATOKG-GFCCVEGCSA-N 371.397 0.827 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C3=NN(CCO)C(=O)CC3)C2)cc1 855233542 IGGDHOJGAUKGTI-ZDUSSCGKSA-N 360.414 0.361 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCCN(CCF)C2)c1 898490485 IWPNOLPKBGKUFK-LBPRGKRZSA-N 359.423 0.927 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 930197059 CQFXZQXQKFVHPG-WOPDTQHZSA-N 371.484 0.662 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC[C@](O)(C(=O)OC)C2)c([N+](=O)[O-])c1 1472861402 CLOJRVGPZMDERP-MQDFFIGUSA-N 350.327 0.895 10 10 FCCE C[C@H](CO)[C@@H](C)NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 853775889 FSRUDJHFBWKAIS-ZIAGYGMSSA-N 369.487 0.738 10 10 FCCE CCC[C@H](C(=O)N1CCN(c2ccc(OC)cc2)CC1)S(N)(=O)=O 854198084 CKGSAVRILLOAQI-OAHLLOKOSA-N 355.460 0.801 10 10 FCCE CCS(=O)(=O)N[C@@H](C)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855223928 CWEOFEXTBUSHOT-STQMWFEESA-N 355.460 0.718 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 861783153 SIEAPOGJUNGPLT-JCGIZDLHSA-N 374.485 0.894 10 10 FCCE C[C@@H](O)[C@@H](NS(=O)(=O)c1cccs1)C(=O)NCc1ccccc1O 1566373923 MCONJMKKRQROFS-QMTHXVAHSA-N 370.452 0.798 10 10 FCCE CNC(=O)Cn1cc(NC(=O)N2CCN(c3ccc(OC)cc3)CC2)cn1 271570856 PTIAYEYECQTSBC-UHFFFAOYSA-N 372.429 0.992 10 10 FCCE CCOC(=O)c1cn(C)nc1NC(=O)C(=O)N(C)Cc1ccccc1O 273059100 DUSPHGQJYQLTGQ-UHFFFAOYSA-N 360.370 0.900 10 10 FCCE CCOC(=O)C1=C(C)C(C(C)=O)=S=C1NC(=O)c1cccc2ncnn12 541568785 HCRZJLXHAZLXEE-UHFFFAOYSA-N 372.406 0.977 10 10 FCCE CNS(=O)(=O)NCC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 773725071 BRAMQDZQDRJJEM-UHFFFAOYSA-N 354.476 0.689 10 10 FCCE C[C@H](O)[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 817705338 DTVHJUXOOVDNKF-WMLDXEAASA-N 361.442 0.511 10 10 FCCE C[C@H]1[C@@H](N)CCN1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 851669728 RQYKCOUYKTYBBN-BBRMVZONSA-N 366.487 0.553 10 10 FCCE O=C(NCc1cc(Br)ccc1O)c1cnn(C[C@H](O)CO)c1 854442409 RCDJASWOVCCXTI-LBPRGKRZSA-N 370.203 0.634 10 10 FCCE C[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@H]1CS(N)(=O)=O 933698143 ORBTWZCVEXKJIS-ZBFHGGJFSA-N 353.488 0.880 10 10 FCCE O=C1C[C@]2(CCN(C(=O)C(=O)NCc3ccc(N4CC=CC4)cc3)C2)CN1 1326842797 VNVLWROYBBAYLY-HXUWFJFHSA-N 368.437 0.418 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CN3CCOC3=O)cc2)C1 1542180367 JKBYSJNQTCMLRS-AWEZNQCLSA-N 360.414 0.457 10 10 FCCE NS(=O)(=O)N1CCC(NC(=O)c2cc3cc(O)c(O)cc3s2)CC1 1557715905 USMXZJMFNMMVAR-UHFFFAOYSA-N 371.440 0.710 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCCN1C(=O)CNC(C)=O 1634939469 OUHXAULINIRZEY-CYBMUJFWSA-N 368.430 0.621 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@H](NC(=O)NC4CC4)C3)cc2N1 760601660 MNDQUEOMIVOPFG-JTQLQIEISA-N 361.358 0.966 10 10 FCCE CSCC[C@H](C(=O)OCC(=O)C(C)=O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 808491137 MMBGOFPFLVFKIF-FRRDWIJNSA-N 369.439 0.985 10 10 FCCE CO[C@H]1CC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1119815581 FJOLYBUUUMIOGJ-ROUUACIJSA-N 374.485 0.690 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCN3C(=O)OCC[C@H]3C2)cc1 1327319203 MZIDNNJYRKAAMR-HNNXBMFYSA-N 360.414 0.422 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCc3cnn(C)c3)C2)cc1 1327904057 RNQSXLIXCUIPLJ-HNNXBMFYSA-N 371.441 0.483 10 10 FCCE CCOC[C@@H](C(=O)OC)N(C)CC(=O)NCc1ccc(N(C)C)cc1 1616425828 FEFFUUCBVWJUPV-INIZCTEOSA-N 351.447 0.879 10 10 FCCE Cc1nn(C)c2c1[C@@H](c1ccc(O)c(O)c1)C(C(=O)NCCCO)=C(N)O2 1864009069 YQTANDLMSKMBRG-CQSZACIVSA-N 374.397 0.333 10 10 FCCE CC(C)(C)OC(=O)N1CCC[C@@](O)(CNC(=O)c2cc(O)nc(O)c2)C1 2136606183 IHDWXFQSHIUTMR-QGZVFWFLSA-N 367.402 0.985 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N[C@H]1CCCCNC1 842239526 IHAIVYNBJZJUHY-KRWDZBQOSA-N 374.485 0.740 10 10 FCCE COc1cc2c(c(OC)c1)N(Cc1cc(=O)n3nc(N)[nH]c3n1)CCC2 856747415 PCLZGCYUBVUFLW-UHFFFAOYSA-N 356.386 0.970 10 10 FCCE COc1ccc(N2CCC(NC3CN(S(=O)(=O)N(C)C)C3)CC2)cc1 858314839 ZQZKSALGWTZLMS-UHFFFAOYSA-N 368.503 0.744 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H]1[C@H]2CC[C@]3(COC(=O)[C@H]13)O2 858724195 LCTRTPGGEPYMCR-PDOICOKGSA-N 372.421 0.860 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC3(C[C@H](O)CNC3=O)C2)c([N+](=O)[O-])c1 1640411812 FROJISFTYMRHGG-PYEVWLCESA-N 361.354 0.468 10 10 FCCE CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C[C@H]1O)c1ccc(N)cc1 1890108341 MEXQQMLODYVQBV-KDOFPFPSSA-N 365.430 0.964 10 10 FCCE COC[C@@H](CO)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 280165095 GNVSEAMDFMYLPB-OAHLLOKOSA-N 366.462 0.124 10 10 FCCE CCOC(=O)[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 741247392 OLUXSBNOMXRKLU-KRWDZBQOSA-N 363.458 0.975 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1C[C@@H]2C[C@H]1C[S@]2=O 1261535021 GDUQDUGCRNBQGY-SQQOMWROSA-N 359.498 0.473 10 10 FCCE CN(C)c1ccc(CN(C(=O)C(=O)N2C[C@H]3C(=O)OC[C@H]3C2)C2CC2)cc1 1328850016 FTPMMEBEXHUXCJ-RHSMWYFYSA-N 371.437 0.875 10 10 FCCE O=C(NC1CC1)[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332003515 NKRIBWDLJIHGRI-CYBMUJFWSA-N 357.410 0.752 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 1566268004 OCJHSHQADAQROY-SYWGBEHUSA-N 356.378 0.564 10 10 FCCE COc1ccc(S(N)(=O)=O)cc1C(=O)NCc1cc(O)ccc1O 1633595186 LGUCUAOYTZKRDG-UHFFFAOYSA-N 352.368 0.684 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2CO)c1 1651167536 NZAHHBYSNKCXCS-QWHCGFSZSA-N 369.443 0.045 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H]4CCNC(=O)[C@H]43)nc12 1659924739 ADTXFBGTOVJMQA-ABAIWWIYSA-N 373.413 0.712 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)Cn3cncn3)CC2)cc1 818981360 RTOXWMNDOQZWPZ-SJLPKXTDSA-N 374.489 0.448 10 10 FCCE CC(=O)N1CCO[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 826530490 HVKJYNBPJSMKBZ-GOSISDBHSA-N 361.442 0.511 10 10 FCCE CN1C(=O)CO[C@H](C(=O)NCc2ccc(O)c(O)c2)[C@H]1c1cccnc1 830558892 DFRNQTKTIGNJCK-SJORKVTESA-N 357.366 0.708 10 10 FCCE C[C@H](CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)NC(N)=O 847538337 FUKKHDLAQHICTD-LLVKDONJSA-N 352.410 0.850 10 10 FCCE COc1ccc(N2CC[C@@H](NS(=O)(=O)[C@H](C)C(=O)N(C)C)C2)cc1 849416221 MQQMXUUAHHCHAA-CHWSQXEVSA-N 355.460 0.670 10 10 FCCE CN(C)c1ccc(CNC(=O)c2c3c(nn2C)CCS(=O)(=O)C3)cc1 905318231 OBNGBRCGMPLSEK-UHFFFAOYSA-N 362.455 0.887 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3C[C@H]3C3CC3)cc2)CC1 1119560348 QSIXOBLNFHOGMA-ZWKOTPCHSA-N 356.470 0.969 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)C(=O)C(=O)NC[C@@H]1C[C@H]2C=C[C@H]1CC2 1351570326 QMSDDBZNBBHJHR-YYFQZIEXSA-N 361.442 0.100 10 10 FCCE Cc1nc(S(=O)(=O)NCCC(=O)N[C@@H](C)c2ccccc2O)cn1C 1648892200 QIYHTOUOBHLWLL-NSHDSACASA-N 366.443 0.980 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)NC[C@H]1[C@H](N)Cc1ccc(O)c(O)c1 1952911364 RMQFSDCNJKPCBC-NEPJUHHUSA-N 351.403 0.703 10 10 FCCE Cn1nc(Br)c(CNS(=O)(=O)Cc2ccc(N)cc2)n1 2235269932 FXCJFYWFZSCKOW-UHFFFAOYSA-N 360.237 0.779 10 10 FCCE O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NCc1c(O)cccc1F 928704918 GEFYEJUGRFYGFH-VDERGJSUSA-N 362.357 0.700 10 10 FCCE N[C@@H]1CCCO[C@H]1C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1118976135 OQFITHZCRKHBKB-AEFFLSMTSA-N 373.453 0.979 10 10 FCCE CCN1CCN(CC(=O)NCc2c(O)ccc3ccccc23)C(=O)C1=O 1597737004 QSXSQSGGFKXRER-UHFFFAOYSA-N 355.394 0.852 10 10 FCCE CN(C(=O)C1=C[C@H](O)[C@@H](NC(=O)OC(C)(C)C)C1)c1ccc(=O)n(C)c1 2224796780 PIHSAZIKOTVWFC-KBPBESRZSA-N 363.414 0.932 10 10 FCCE COc1ccc(N2CCN(C(=O)CCN3CCN(C(C)=O)CC3)CC2)cc1 44848974 DZLIJCDMXZLVQJ-UHFFFAOYSA-N 374.485 0.898 10 10 FCCE NC(=O)NCCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 92012162 SDYJPLCCWSIJNK-UHFFFAOYSA-N 359.474 0.893 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@H](NS(C)(=O)=O)C1 172021648 DYGFBEYLCXNRRU-HNNXBMFYSA-N 368.503 0.335 10 10 FCCE CCO[C@@H]1CN(C(=O)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C[C@H]1CN 846344192 PDLZCXNWLKNPGY-FRFSOERESA-N 362.474 0.752 10 10 FCCE COC(=O)N(C)CCN(C)C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 850601789 JGMIHMGEXMQBIJ-UHFFFAOYSA-N 364.446 0.868 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCC(=O)N3CCOCC3)C2)cc1 852242936 WNBGBMDEQUAMFF-CQSZACIVSA-N 362.430 0.432 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCCCn3cc(CO)nn3)C2)cc1 854297265 LMTQYNUOMWKQHX-CQSZACIVSA-N 374.445 0.747 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(C[C@H](O)CO)c3)C2)cc1 855224931 ICXBZAAQLUCHOH-ZBFHGGJFSA-N 360.414 0.254 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(S(N)(=O)=O)o3)C2)cc1 855232705 SUXVNZAWRIYWGH-LLVKDONJSA-N 365.411 0.944 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)NC[C@@H]3C[C@@H]3C)CC2)cc1 1321888189 YIAWSNJBYKDCKC-HOTGVXAUSA-N 374.485 0.706 10 10 FCCE O=C(CNS(=O)(=O)c1c(F)cccc1F)NCc1cc(O)ccc1O 1593869359 UCOWDIANDJQNKV-UHFFFAOYSA-N 372.349 0.971 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNCc1ccc(O)c(O)c1O 2333604367 AJNQRNBCTDPDTJ-SUHUHFCYSA-N 370.402 0.234 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@@](C)(O)CN2CCOCC2)cc1F 73915840 XJWUCOJMANTIOJ-GOSISDBHSA-N 368.453 0.774 10 10 FCCE O=C(NCCN1CCOCC1)N1CCN(c2ccc3c(c2)OCO3)CC1 243845735 RDJRLSOEKWPNEX-UHFFFAOYSA-N 362.430 0.579 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCO[C@@]2(CCOC2)C1 297981700 ZBUTYYAGKMOLOS-IBGZPJMESA-N 361.442 0.729 10 10 FCCE COc1ccc(N2CCN(c3ccc(C(=O)NCCO)nn3)CC2)cc1 768521245 FZQHLLZIRADQKA-UHFFFAOYSA-N 357.414 0.534 10 10 FCCE COCCN1CCC[C@@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785443596 NMKNXLAVIIVRSL-QGZVFWFLSA-N 362.474 0.596 10 10 FCCE CC(C)N(C[C@@H](C)O)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788318903 JFLGWDHVYRRWMB-OAHLLOKOSA-N 363.458 0.757 10 10 FCCE CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)OCC(=O)C(C)=O 808497572 ANPOQJYNPCCRMR-ZDUSSCGKSA-N 373.452 0.788 10 10 FCCE CN1CC[C@H](C(=O)NCc2ccc(N3CCOCC3)c(F)c2)S1(=O)=O 843531984 PAMOMMDWOPRXKJ-OAHLLOKOSA-N 371.434 0.312 10 10 FCCE COC(=O)[C@@H]1CC[C@H](C(=O)NCc2ccc(N3CCC(O)CC3)cc2)O1 862226230 XAFKEGMSBKMUGX-SJORKVTESA-N 362.426 0.985 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC(O)(c3ncnn3C)CC2)cc1 1175853446 GKEZDVPEPFXAOJ-UHFFFAOYSA-N 372.473 0.481 10 10 FCCE C[C@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CS1(=O)=O 1328780808 QTOMJXDHWITCKF-JSGCOSHPSA-N 367.471 0.451 10 10 FCCE COC[C@H](CCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)OC 1334109014 DIBVQUXDERPYIK-KRWDZBQOSA-N 361.442 0.847 10 10 FCCE C[C@H](NC(=O)CCCS(N)(=O)=O)c1ccc(N2CCOCC2)cc1 1626978419 PGKQEFBIEXBVOM-ZDUSSCGKSA-N 355.460 0.769 10 10 FCCE C[C@@H](CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)NC(N)=O 1638488901 QDHUALZQLFOFRC-LBPRGKRZSA-N 361.446 0.451 10 10 FCCE CN(CCN=[N+]=[N-])c1ccc2c(c1)C(=O)N([C@H]1CCC(=O)NC1=O)C2=O 2086865002 YZKSNGFJHRNZKS-LBPRGKRZSA-N 356.342 0.834 10 10 FCCE CCN(CC)S(=O)(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 264832468 HNYVMRSOSVPCFD-UHFFFAOYSA-N 370.519 0.993 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CCC2(COC2)C1)c1ccc(N2CCOCC2)cc1 827511028 MTORUKLSYPOVOG-OAHLLOKOSA-N 373.453 0.949 10 10 FCCE Cn1ncc(CNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)n1 838592981 YTWHXLJOURLTRV-UHFFFAOYSA-N 366.372 0.929 10 10 FCCE CO[C@@H](COC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCOC1 849711988 DXLCCZXGALVDGO-YGRLFVJLSA-N 359.400 0.972 10 10 FCCE O=C1COC[C@]2(CNCc3ccc(N4CCOCC4)cc3)COCCN12 865799366 ADNNIGRLSGAPSN-IBGZPJMESA-N 361.442 0.241 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)NC[C@@]2(OC)CCS(=O)(=O)C2)c1 1251160726 AFAXAPJEMFICPT-ZBEGNZNMSA-N 372.443 0.965 10 10 FCCE COC(=O)N[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1331664677 IIUBXWMHIDMPJX-LBPRGKRZSA-N 366.393 0.465 10 10 FCCE COc1ccc(CC(=O)NCCNC(=O)c2cc(O)c(O)c(O)c2)cc1 169835497 SHJHFLGWDVKHIK-UHFFFAOYSA-N 360.366 0.901 10 10 FCCE O=C1NC(=O)[C@@]2(CCCN(Cc3ccc(N4CCOCC4)c(F)c3)C2)N1 789768517 IAYKGFNJOOXSDF-SFHVURJKSA-N 362.405 0.836 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N[C@H](C)Cn1cncn1 817812551 SJWSGEBBCJTQNV-HUUCEWRRSA-N 372.473 0.905 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)N2CCn3c(CC4CC4)nnc3C2)cc1 846342588 ITUPZQNGJTZUKN-UHFFFAOYSA-N 368.441 0.514 10 10 FCCE NC/C=C/CNC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 851668864 VXRASWPFLQPHTH-OWOJBTEDSA-N 352.460 0.236 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)N2CCC(Cn3cnnc3)CC2)cc1 1329728518 USMASWSMKDZXGW-UHFFFAOYSA-N 356.430 0.458 10 10 FCCE Cn1nc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)ccc1=O 1535156193 FUWJFSSNMPUYNS-UHFFFAOYSA-N 369.425 0.412 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1536523396 FVDOAHPHGKIJFJ-UHFFFAOYSA-N 368.503 0.336 10 10 FCCE CN1CCn2nc(C(=O)NCc3cc(Cl)ccc3O)cc2S1(=O)=O 1583820497 DLYLCZRVSGDULC-UHFFFAOYSA-N 370.818 0.806 10 10 FCCE COC[C@H](CO)NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1684169171 IWOPYCUWZUKAOO-HNNXBMFYSA-N 364.446 0.195 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1NCCNC1=O 1952208535 KICSMGFAAJUXNF-RISCZKNCSA-N 351.403 0.622 10 10 FCCE CCOC(=O)CN1C(=O)/C(=C/c2cn(C)c(=O)n(C)c2=O)c2ccccc21 755607163 STCZBPMOGGTDMA-NTEUORMPSA-N 369.377 0.534 10 10 FCCE CN1CCO[C@H](CS(=O)(=O)NCc2ccc3c(c2)CCCN3C)C1 866673737 HEQHTTRZXSUHNK-INIZCTEOSA-N 353.488 0.819 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)/C=C\Cn3cncn3)cc2)C1 1544929608 INWUHIALAOABRC-ZENLRNHISA-N 368.441 0.852 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CO)c2cccnc2)c1 1638357528 RVXNTMPVJPAGIT-CYBMUJFWSA-N 351.384 0.622 10 10 FCCE CCOC(=O)c1c(NC(=O)[C@H](O)[C@@H](O)C(=O)O)sc2c1CCCC2 1865945988 KJGBDQUJMHBXLR-GHMZBOCLSA-N 357.384 0.549 10 10 FCCE CC(C)(C)OC(=O)N1CCc2c(N3CC(N)(C(N)=O)C3)ccc(N)c2C1 1876395522 LLJMAOPDQXRNMP-UHFFFAOYSA-N 361.446 0.565 10 10 FCCE CO[C@@H]1[C@H](OC)CN(C(=O)OC(C)(C)C)[C@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2140536894 XUSIILJBJUUOSF-SUPODQJDSA-N 370.446 0.901 10 10 FCCE COc1ccc(N2CCN(CC(=O)N3CCC[C@H](C(N)=O)C3)CC2)cc1 248151717 WOBATDAZFUDMDN-HNNXBMFYSA-N 360.458 0.541 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](O)CN2CCCCC2)c1 271403095 MXBIRRBLGVGMEC-ZDUSSCGKSA-N 371.459 0.340 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3CCNC(=O)CC3)CC2)cc1 754027125 CFJUBQOXZSAOQV-KRWDZBQOSA-N 362.474 0.000 10 10 FCCE CC[S@@](=O)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 828082168 CERGVKNQKWTUDG-YMXBGEKHSA-N 367.471 0.275 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](NC=O)C(C)C)CC2)cc1 858839425 DOCZIMJAKDLWAO-SFHVURJKSA-N 362.474 0.704 10 10 FCCE CC(C)(O)C[C@H](O)CNc1ccccc1OCC(=O)N1CCOCC1 872211052 FZFPCQKLOMDGNM-AWEZNQCLSA-N 352.431 0.858 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](F)[C@H]3CCNC3)cc2)CC1 876909612 CXJMRJHVUMRXGM-FUHWJXTLSA-N 362.449 0.919 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)cc1 1141785682 BOEFOMXNFUEJEI-UHFFFAOYSA-N 372.385 0.412 10 10 FCCE Cc1cc(C)nc(-n2[nH]c(C(=O)NCc3c(O)cccc3O)cc2=O)n1 1178910212 BECJGAHJWXJGRM-UHFFFAOYSA-N 355.354 0.914 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](CO)[C@H](CCO)C3)C2)cc1 1519454741 JEMRWQVNECKNOL-PMPSAXMXSA-N 363.458 0.906 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)[C@H]3CCCN(C)C3)CC2)cc1 1862005570 UHNIBSRHEYQMGS-INIZCTEOSA-N 374.485 0.802 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1cnc2c(cnn2C)c1=O 10432926 BSTHXNHHWOHGHD-UHFFFAOYSA-N 354.414 0.855 10 10 FCCE COCCOCC(=O)N1CCCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169846353 VQUCGOOFRSFIFE-UHFFFAOYSA-N 368.386 0.141 10 10 FCCE CCn1nccc1S(=O)(=O)Nc1ccc(NS(=O)(=O)NC)cc1 281908972 GDIBJIJCFWMVKD-UHFFFAOYSA-N 359.433 0.580 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CNC(=O)c2cc(O)nc(O)c2)C1 702776970 VJCPBFHTNCLOSE-MNOVXSKESA-N 353.375 0.450 10 10 FCCE CN(C)S(=O)(=O)NCC(=O)NCc1cc(Br)ccc1O 854441976 BXNRUGWGIQXTLT-UHFFFAOYSA-N 366.237 0.167 10 10 FCCE CCC[C@H](C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)S(N)(=O)=O 855223523 BCUPCZRQGWCNQK-SWLSCSKDSA-N 355.460 0.847 10 10 FCCE CCN1CC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 897475481 UFVTVKOTURRJKW-KRWDZBQOSA-N 360.458 0.350 10 10 FCCE Cn1cc(/C=C/C(=O)N2C[C@@H](CO)Cc3cccc(F)c32)c(=O)n(C)c1=O 911696280 LOZHZEBGXDGFEP-SYTKJHMZSA-N 373.384 0.434 10 10 FCCE Cc1ccc(O)c(CNC(=O)NCCS(=O)(=O)N=S(C)(C)=O)c1 1565369226 XSZHDGOTQNKHIH-UHFFFAOYSA-N 363.461 0.557 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1CCc2nnc(O)n2C1 1630487669 YERRAVKUBPKETR-ZDUSSCGKSA-N 374.397 0.844 10 10 FCCE O=C(Cn1cnnn1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 92010639 KEMQUVCFTZXGNT-UHFFFAOYSA-N 355.446 0.522 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)CCO)CC2)cc1 265714121 DKUZMFDYRWKNNK-HNNXBMFYSA-N 350.463 0.887 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCCS(=O)(=O)N(C)C)C2)cc1 852347810 INTPHBYRUDCYKH-CYBMUJFWSA-N 370.475 0.465 10 10 FCCE NC(=O)[C@H]1CC(C(=O)NCc2ccc(O)cc2O)=NN1c1ccccc1 1639441310 PFSZUVLKNRZCIV-OAHLLOKOSA-N 354.366 0.834 10 10 FCCE CC(C)(C)OC(=O)N1CC(NC(=O)COc2ccc(N)cc2)(C(N)=O)C1 2106230484 MSBISHNRRXMGIX-UHFFFAOYSA-N 364.402 0.239 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC[C@H](S(N)(=O)=O)C2)c([N+](=O)[O-])c1 732667332 NCHBGPCVRVSONZ-MZBZXASESA-N 355.372 0.648 10 10 FCCE CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)OCC(=O)C(C)=O 808497569 ANPOQJYNPCCRMR-CYBMUJFWSA-N 373.452 0.788 10 10 FCCE Cc1nn(CC(=O)NCc2cc(Br)ccc2O)c(=O)n1C 848069442 WOGNQQLEFZKXRM-UHFFFAOYSA-N 355.192 0.675 10 10 FCCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCS(=O)(=O)C[C@H]1CCO 1156138473 MIQBEUUPFASBRL-SNVBAGLBSA-N 371.436 0.934 10 10 FCCE CN(CCN=[N+]=[N-])C(=O)[C@@H](NC(=O)OC(C)(C)C)C1CS(=O)(=O)C1 2020695821 JEISFGJQKBZMGG-JTQLQIEISA-N 361.424 0.693 10 10 FCCE COCCN1C(=O)C(=CNC[C@@H]2CC2(Cl)Cl)C(=O)NC1=S 2040480365 OCXHYUXCTQMZLR-ZETCQYMHSA-N 352.243 0.543 10 10 FCCE C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCS(=O)(=O)C1 365440517 VAZGNGXAALLKKJ-SECBINFHSA-N 355.372 0.797 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](C(=O)NC)C2)cc1 817707092 UNJQCBWLWWVIQQ-HNNXBMFYSA-N 360.458 0.744 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)[C@@]3(OC)CCS(=O)(=O)C3)C2)cc1 892685527 SDUGHYGXESBGPJ-CXAGYDPISA-N 368.455 0.594 10 10 FCCE C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1335574407 YGHFPLWASHBDDI-WDEREUQCSA-N 354.428 0.514 10 10 FCCE COc1ccc(CNC(=O)c2c3c(nn2C)CCS(=O)(=O)C3)c(O)c1 1448380094 IEIZBJJCEVBNOR-UHFFFAOYSA-N 365.411 0.535 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)/C=C\Cn3cncn3)cc2)C1 1544929606 INWUHIALAOABRC-OUMXJLHTSA-N 368.441 0.852 10 10 FCCE CN(C)c1ccc([C@H](CNC(=O)[C@@H](N)CC(N)=O)N2CCCCC2)cc1 1866107115 AUNQRDLRHAKDAW-IRXDYDNUSA-N 361.490 0.599 10 10 FCCE CC(C)(C)OC(=O)NC1CN(CC(=O)NCCc2ccc(O)c(O)c2)C1 2124177344 SBXRULOSCXGDHJ-UHFFFAOYSA-N 365.430 0.965 10 10 FCCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)N1CC[C@@](O)(c2c[nH]nn2)C1 284563558 HLTCFIRBBLIFDM-NAASZUNDSA-N 369.425 0.775 10 10 FCCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@H](C)S1(=O)=O 811867309 RFSDOBXNZXYGHY-DTORHVGOSA-N 355.372 0.938 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCN(c3nncn3C)CC2)cc1 847035526 GSWLBHXONMNLLI-UHFFFAOYSA-N 357.462 0.320 10 10 FCCE CN1CCN(C(=O)N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)CC1 1293003103 WZUGHXOZCFTVDE-UHFFFAOYSA-N 362.430 0.152 10 10 FCCE CO[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 1347071784 QRIRWTXZUUBJJI-DOTOQJQBSA-N 361.442 0.823 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC[C@@H](C)S(C)(=O)=O)cc2)CC1 1353352190 DFHFJSKMRCEFLV-CQSZACIVSA-N 353.488 0.878 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cc4n(n3)CCO4)cc2)CC1 1616599116 MQBFSNFJSISLEX-UHFFFAOYSA-N 369.425 0.907 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NC(=O)COc2ccc(N)cc2)C1 2062449886 BVEHQESSBOFGGW-KBPBESRZSA-N 351.403 0.744 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C(N)=O)CC[C@@H]3C)nc12 729266971 UOPBGNGFTKQGRM-WDEREUQCSA-N 361.402 0.697 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(=O)N(C)C3)CC2)cc1 778420343 UNNLCDGJWRTKQC-BQYQJAHWSA-N 372.425 0.158 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[S@@](=O)CC 805611356 WHRLLIKAHLQEQP-DEOSSOPVSA-N 353.488 0.986 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)CCN(C)C)C2)cc1 827489873 WWELVZYOWYGDQF-GJZGRUSLSA-N 362.474 0.847 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCc3ccn(C)n3)C2)cc1 829167798 NKQDEMMDHWGVCE-HNNXBMFYSA-N 371.441 0.483 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCCCNC3)C2)cc1 851687866 JZORCCTYJBBWSE-CABCVRRESA-N 360.458 0.648 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@](C)(O)CN(C)C)C2)cc1 854299203 GIEJNUDAZDVFJR-KBXCAEBGSA-N 350.463 0.886 10 10 FCCE CS(=O)(=O)N1CC[C@H](CS(=O)(=O)N2Cc3cccc(O)c3C2)C1 867690780 MTVJVCNYWHXERC-NSHDSACASA-N 360.457 0.319 10 10 FCCE C[C@H](NC(=O)c1cn(C[C@H]2CNC(=O)O2)nn1)c1ccc(N(C)C)cc1 1128247200 OBUMUIRVHPVVET-SMDDNHRTSA-N 358.402 0.944 10 10 FCCE CCOC(=O)C(C)(C)ONC(=O)c1cc(NS(C)(=O)=O)ccc1O 1472564407 GVRCMYDYQWDXAM-UHFFFAOYSA-N 360.388 0.767 10 10 FCCE C[C@@H](CNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)S(N)(=O)=O 1479533443 HWUZNOHPNKTJJK-WFASDCNBSA-N 371.507 0.332 10 10 FCCE O=S1(=O)C[C@H]2NCCN(Cc3c(O)cccc3Br)[C@@H]2C1 2143710902 BXEOQLSOZGISFJ-VXGBXAGGSA-N 361.261 0.726 10 10 FCCE Cc1cc(C(=O)N[C@H](CO)CN2CCOCC2)c(C)n1-c1ccccn1 773370151 KWEAUMKXMCQLCK-INIZCTEOSA-N 358.442 0.912 10 10 FCCE CCOC(=O)C[C@@H](O)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 819591150 PMKYTAGUWYACTO-XJKSGUPXSA-N 350.415 0.952 10 10 FCCE O=C(C[C@@H]1NC(=O)NC1=O)Nc1c(-c2ccccn2)nc2ccccn12 820006264 QLXNOJUUBAIIKX-NSHDSACASA-N 350.338 0.933 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNC[C@H]3CCC[C@@H]3O)CC2)cc1 843118042 ZMRAMJUCDBQJJP-KPFFTGBYSA-N 363.502 0.929 10 10 FCCE CNCCOCCN(C)C(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 861767202 LXJJVKPKBSBAGB-AWEZNQCLSA-N 350.463 0.624 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@H]1CC(=O)N(CC2CC2)C1 897791615 RNZIYGYMEMYKMG-INIZCTEOSA-N 372.469 0.804 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3CCCN(C)C3)cc2)CC1 898329262 MIBSCFFNQVJUCW-KRWDZBQOSA-N 373.501 0.265 10 10 FCCE NC(=O)N1CCC[C@H]1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1161174780 AXSJEIJOVIVMSI-AWEZNQCLSA-N 368.384 0.961 10 10 FCCE Cn1c(O)nc(N2CC[C@@H](NC(=O)/C=C/c3ccc(O)c(O)c3)C2)cc1=O 1652826926 DVOQABUDKMWDOZ-OGOUPESXSA-N 372.381 0.305 10 10 FCCE CS(=O)(=O)Cc1n[nH]c(CNC(=O)NCc2c(O)cccc2F)n1 1687718129 RSURZTXISKUXNE-UHFFFAOYSA-N 357.367 0.193 10 10 FCCE CC[C@@H](F)C(=O)N[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@@H]1O 1735949241 VRDNSZICZYLXRE-UPJWGTAASA-N 365.365 0.899 10 10 FCCE Oc1c(Br)cc(Cl)cc1CN[C@H]1C[C@@H](O)[C@H](O)[C@@H]1O 2329643621 YRRRWRKSVBABJQ-SPFNVWMYSA-N 352.612 0.753 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)S(C)(=O)=O)CC2)cc1 242740495 DEVOWPIAZZQGCT-UHFFFAOYSA-N 355.416 0.098 10 10 FCCE CN(C)CCN(C(=O)/C=C/c1ccc(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1 272598735 GVFWAFIGQXWWFV-YVARQFDVSA-N 368.455 0.688 10 10 FCCE CNS(=O)(=O)CCCN(CC(=O)OC)Cc1cc(Cl)ccc1O 732202743 ALLHTLBYXMPTEE-UHFFFAOYSA-N 364.851 0.960 10 10 FCCE CN(C)S(=O)(=O)[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 795654960 WRWWAFVDYNWPGG-DOMZBBRYSA-N 356.444 0.674 10 10 FCCE CN(C)S(=O)(=O)N(C)CC(=O)NCc1ccc2cccnc2c1O 862026501 QOXICPJKOOXDIB-UHFFFAOYSA-N 352.416 0.295 10 10 FCCE CN1CCN(c2ccc(CN3C(=O)N[C@@H](CC4OCCO4)C3=O)cc2)CC1 925079664 MQHURWXJMWMDQX-INIZCTEOSA-N 374.441 0.622 10 10 FCCE CCOC(=O)C(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1465363356 JKFJZIKBCQZRAA-UHFFFAOYSA-N 361.358 0.697 10 10 FCCE NS(=O)(=O)c1ccc(OCC(=O)NCc2c(O)cccc2F)cc1 1596916195 CGTQTXNVZFNINO-UHFFFAOYSA-N 354.359 0.874 10 10 FCCE COC(=O)c1cn([C@@H]2CCCN(C(=O)Cc3ccc(O)c(O)c3)C2)nn1 1611030336 OAEUWJSKMCPPEV-GFCCVEGCSA-N 360.370 0.882 10 10 FCCE NS(=O)(=O)c1ccc(CCNC(=O)c2cc(O)c(O)c(O)c2)cc1 1865876258 ZOWLFXOLDNHDGN-UHFFFAOYSA-N 352.368 0.423 10 10 FCCE CN1CCN(NC=C2C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)CC1 2296931560 VUYDUYXYBXOXPP-UHFFFAOYSA-N 363.805 0.559 10 10 FCCE C[C@@H]1Cn2nnc(C(=O)NCc3ccc(N4CCOCC4)cc3)c2C(=O)N1 2297728410 JGIHKKKXLFTAPA-GFCCVEGCSA-N 370.413 0.177 10 10 FCCE Cc1ccc(CN(C)S(=O)(=O)N2CC(N)C2)c(O)c1Br 2381142216 JOWFXPAQTXJONN-UHFFFAOYSA-N 364.265 0.783 10 10 FCCE O=C(Cn1cn[nH]c1=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 154753692 FMZPLXPYGKLAEL-NSHDSACASA-N 367.356 0.958 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCC3CCNCC3)C2)cc1 851689327 NBSMOMYSIYTUIC-INIZCTEOSA-N 374.485 0.896 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)NC[C@@H]3C[C@@H]4COC[C@@H]4O3)ccc21 929806375 ZDAUCVGGBKNEBU-RYRKJORJSA-N 373.453 0.605 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 1333802079 LGQWMJOPINYVJM-WKULXVSPSA-N 371.437 0.431 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC[C@](O)(C(=O)OC)C2)c([N+](=O)[O-])c1 1472861400 CLOJRVGPZMDERP-DQOPKJQZSA-N 350.327 0.895 10 10 FCCE Nc1ccccc1S(=O)(=O)NCC(=O)NCc1c(O)cccc1F 1652298570 MIWZLZOFFFQJLP-UHFFFAOYSA-N 353.375 0.708 10 10 FCCE COc1ccc(CNC(=O)C(=O)Nc2cc(C)nnc2N(C)C)c(O)c1 850443838 OCSDZYSCBCZBDS-UHFFFAOYSA-N 359.386 0.820 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)c3cnn(C[C@H](O)CO)c3)C2)cc1 855224929 ICXBZAAQLUCHOH-HOCLYGCPSA-N 360.414 0.254 10 10 FCCE COc1ccc(CNC[C@@]2(CO)COCCN2C)cc1Cn1cccn1 922533079 KTUGGDDFEOWJDT-LJQANCHMSA-N 360.458 0.723 10 10 FCCE Cn1cc(C(=O)NC[C@H]2CCCN2C(=O)Cc2ccc(O)c(O)c2)cn1 1140723430 KQYOWNOPQNULJV-CQSZACIVSA-N 358.398 0.795 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)NC[C@@H]3C[C@H]3C)CC2)cc1 1321888188 YIAWSNJBYKDCKC-CVEARBPZSA-N 374.485 0.706 10 10 FCCE NC(=O)[C@H]1CC(C(=O)NCc2cccc(O)c2O)=NN1c1ccccc1 1471644373 SAEJLHHQIPIADU-CQSZACIVSA-N 354.366 0.834 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cn([C@@H]2CC[C@H]2O)nn1 1557115993 ZSEDOCQWOPUEAM-GDBMZVCRSA-N 374.397 0.885 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)[C@@H]3COC(=O)N3)cc2F)CC1 294461239 CGTBFXXQKDILBK-AWEZNQCLSA-N 350.394 0.692 10 10 FCCE CC(C)(C)OC(=O)N[C@@]1(C(=O)O)CCN(C(=O)c2cc(O)nc(O)c2)C1 382133934 BBKQZTPTRGCHLY-INIZCTEOSA-N 367.358 0.687 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CCN(C)S3(=O)=O)C2)cc1 843607675 FOKKKNNAKAYGCG-CZUORRHYSA-N 367.471 0.672 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCc4nnnn4CC3)C2)cc1 854183944 GTWLILCEOJZVOC-ZIAGYGMSSA-N 371.445 0.965 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H]1COCCN1C 858842121 MXFAPDWKYXKBBW-SFHVURJKSA-N 362.474 0.995 10 10 FCCE CNCCOCCN(C)C(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 861767203 LXJJVKPKBSBAGB-CQSZACIVSA-N 350.463 0.624 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3C[C@H](O)CC(F)(F)C3)ccc21 1117165291 SOTIVZXZNCCKRA-CQSZACIVSA-N 367.396 0.914 10 10 FCCE CC(C)(C)OC(=O)C(=O)N1CCN(C(=O)c2cccc(O)c2O)CC1 1144397581 FTPZFROBTSYQKE-UHFFFAOYSA-N 350.371 0.724 10 10 FCCE NC(=O)NC1(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC1 1299100607 UWWWOEXAQRZFCM-UHFFFAOYSA-N 354.357 0.619 10 10 FCCE O=C1CN(c2nnnn2Cc2ccc(N3CCOCC3)cc2)CN1C1CC1 1334006363 HMMKOZOUHNRROJ-UHFFFAOYSA-N 369.429 0.327 10 10 FCCE Cc1cc(C(=O)NCc2cc(O)ccc2O)nc2c1c(=O)n(C)c(=O)n2C 1558174127 FIOMHFGKVDYLBB-UHFFFAOYSA-N 370.365 0.282 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(C)CCN(C)C1=O 1633473931 XVQYJPWGHXREGH-KPZWWZAWSA-N 364.398 0.557 10 10 FCCE CC(C)(C)OC(=O)N1CC(NCc2ccc(O)c(O)c2O)(C(N)=O)C1 715551226 QCKXGDKCLVZBTG-UHFFFAOYSA-N 353.375 0.368 10 10 FCCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cnc(N(C)C)nc1 785293588 GMXGSDYRKWGZHB-JTQLQIEISA-N 359.386 0.640 10 10 FCCE CN1CCN(C[C@H](O)CNCc2ccc(N3CCSCC3)cc2)CC1 818964530 YVNYHRLJRLCNNC-LJQANCHMSA-N 364.559 0.938 10 10 FCCE C[C@H]1CN([C@@H](C)CNC(=O)C(=O)NCCc2ccc(N)cc2)C[C@@H](C)O1 848613004 CDGZXUKSOGNENU-SOUVJXGZSA-N 362.474 0.541 10 10 FCCE CNS(=O)(=O)CCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852271014 MZFUBEPPDNKOKH-GFCCVEGCSA-N 356.448 0.122 10 10 FCCE COc1ccc(N2CC[C@@H](NS(=O)(=O)C[C@H]3CN(C)CCO3)C2)cc1 867498101 WMIYMRNCCYZVMX-RHSMWYFYSA-N 369.487 0.524 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CCN2C2CCOCC2)cc1 929237604 UARQUKDCFJIAHP-SFHVURJKSA-N 374.485 0.738 10 10 FCCE COC(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 1321934610 FQKUCWUUOHLXHE-HNNXBMFYSA-N 359.426 0.707 10 10 FCCE COc1ccc(N2CCN(C(=O)C(=O)N3CC(C)(F)C3)CC2)c(OC)c1 1329422361 ATBJHZHWNKRKAF-UHFFFAOYSA-N 365.405 0.923 10 10 FCCE COc1nn(C)cc1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 1332867863 UKGYTYAKRLOQML-UHFFFAOYSA-N 359.430 0.736 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1nc2ncc(CCO)cn2n1 1611430267 AJNLKCSQAHNMEW-SNVBAGLBSA-N 357.370 0.431 10 10 FCCE CC(C)(C)OC(=O)N[C@@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CCS(=O)(=O)C1 2052091329 KEQMXOLWOHTJTI-MMPTUQATSA-N 374.459 0.334 10 10 FCCE O=C(O)[C@H]1[C@H](O)[C@H](O)CN1Cc1cc(Cl)cc(Br)c1O 2357877331 CKYQVJUNFJGCOY-FXPVBKGRSA-N 366.595 0.799 10 10 FCCE CCN(CC)c1ccc(CNS(=O)(=O)N2CCN(C=O)CC2)cc1F 195237748 MSDSRJQNBBGXQV-UHFFFAOYSA-N 372.466 0.780 10 10 FCCE COc1ccc(N2CCN(CC(=O)NCCN3CCOCC3)CC2)cc1 243865212 RJRGRHOHIZTLGU-UHFFFAOYSA-N 362.474 0.266 10 10 FCCE CCN1C(=O)[C@H]2[C@H](C1=O)[C@](C(=O)O)(C(C)C)N[C@H]2c1ccc(O)c(O)c1 248195468 PDSOWMVSWXBTFZ-AHXJXLJNSA-N 362.382 0.843 10 10 FCCE COc1ccc(N2CCN(CCNS(=O)(=O)C3COC3)CC2)cc1 276947277 DGHHQUKHYJQEKR-UHFFFAOYSA-N 355.460 0.135 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCC(=O)NC3)CC2)cc1 742919347 GCLKJJHTBIPFRP-HNNXBMFYSA-N 360.458 0.460 10 10 FCCE CO[C@H](CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CCOC1 850601315 FKFXMTLAFMHFAY-NVXWUHKLSA-N 363.458 0.879 10 10 FCCE COCc1nc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)n(C)n1 853862231 CUTMOFARKLMNBQ-UHFFFAOYSA-N 359.430 0.853 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CCS(=O)(=O)C[C@H]2CCO)cc1F 915365207 BRFUEFOTJKALIO-CYBMUJFWSA-N 373.450 0.583 10 10 FCCE Cc1ccc(O)c(CNC(=O)c2nc(S(N)(=O)=O)c3ccccn23)c1 1584988804 LXJXHJYDPGDZTL-UHFFFAOYSA-N 360.395 0.926 10 10 FCCE COc1ccc(CN2C(=O)NC(=O)C(=CNCCCN(C)C)C2=O)cc1 2297057237 UEXAOKSLULMCLW-UHFFFAOYSA-N 360.414 0.699 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2310482335 IECWPJKZVBUYOE-WHOHXGKFSA-N 355.395 0.629 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN[C@@H]3CCCN(C)C3)CC2)cc1 819023208 IRVOUSZHAQMMHF-IEBWSBKVSA-N 362.518 0.862 10 10 FCCE CN(C)CCN1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1=O 845001943 GJQMCTYDUCGOLY-UHFFFAOYSA-N 371.485 0.978 10 10 FCCE CN1C[C@@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1=O 1565364141 IMCCKTSNTOEBTB-HNNXBMFYSA-N 373.457 0.418 10 10 FCCE COCCn1c(N)c(C(=O)CN[C@H](C)c2ccccc2O)c(O)nc1=O 1655349520 LNYRSXNLMZZVEO-SNVBAGLBSA-N 362.386 0.417 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCC2(CN=[N+]=[N-])CC2)[C@H](O)C1 1890527455 UDGSABIKIXKMTH-BZNIZROVSA-N 369.422 0.926 10 10 FCCE COC[C@@](O)(CO)CNCc1c(Br)ccc(OC)c1O 1966068449 VZAFIGCMVHPSKD-ZDUSSCGKSA-N 350.209 0.623 10 10 FCCE CN1C[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)CC1=O 2060610307 GHQNMYQVNCVQOP-WDEREUQCSA-N 352.395 0.975 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CNC(=O)Cc2ccc(O)c(O)c2)C1 2087724442 HIMRRWLDSNRGIW-DOMZBBRYSA-N 366.414 0.984 10 10 FCCE CN(CC(=O)NCc1cc(Br)ccc1O)S(C)(=O)=O 804737179 KSLYLXLKZDUECV-UHFFFAOYSA-N 351.222 0.662 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N[C@H](CN)C3CC3)CC2)cc1 841749082 AAPQGRQXAMYOKS-GOSISDBHSA-N 361.490 0.854 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)C3(O)CCOCC3)CC2)c(OC)c1 931530614 KPRPULUGKUVVPD-SFHVURJKSA-N 366.458 0.728 10 10 FCCE O=C(NCc1cccc(Cl)c1O)NC[C@@]12COCCN1C(=O)COC2 1254322259 BRTYWNAVYFWVCJ-INIZCTEOSA-N 369.805 0.473 10 10 FCCE NC(=O)[C@H]1C[C@@H](NC(=O)C(F)(F)F)CN(C(=O)Cc2ccc(N)cc2)C1 2162969509 QHIRRQZYOLIBKF-CMPLNLGQSA-N 372.347 0.192 10 10 FCCE C[C@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CN1 861786793 QWOBFESTQLXQKD-HOCLYGCPSA-N 374.485 0.521 10 10 FCCE CCNC(=O)N1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)C1 1117584425 IQBIICJJHZXWHR-CQSZACIVSA-N 361.446 0.289 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)CCn3cncn3)cc2)CC1 1178038817 IWLAGPDRENEDQM-UHFFFAOYSA-N 356.430 0.686 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)CCc3nn[nH]n3)cc2)CC1 1178039355 QIPFFLAMHVFYNL-UHFFFAOYSA-N 357.418 0.150 10 10 FCCE CN1CCC[C@@H](N2CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)C1 1332019614 SRZFWGXIJWBTPR-MRXNPFEDSA-N 372.469 0.473 10 10 FCCE C[C@H](NC(=O)NCCc1nnc2c(=O)n(C)ccn12)c1ccccc1O 1565363842 ZMQOELWYHHRDBP-NSHDSACASA-N 356.386 0.737 10 10 FCCE COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)Cc1ccc(O)c(O)c1 1597208406 GRYJTDUMVCXXGK-NEPJUHHUSA-N 351.355 0.594 10 10 FCCE CN(C(=O)CN1CC(O)(CNC(=O)OC(C)(C)C)C1)c1ccc(N)cc1 2106765667 KOBRGLGKQIMBEP-UHFFFAOYSA-N 364.446 0.803 10 10 FCCE CSc1ncc(CNS(=O)(=O)N2CC[C@H](C(N)=S)C2)s1 2284712207 MPDZXJKFJSWHAP-ZETCQYMHSA-N 352.532 0.807 10 10 FCCE COc1ccc(O)c(CNC(=O)N[C@H]2CCC[C@H]2CNS(C)(=O)=O)c1 800706505 DRSOAPWRXKXPEE-FZMZJTMJSA-N 371.459 0.918 10 10 FCCE CC(=O)C(=O)COC(=O)c1cc(S(=O)(=O)N2CCC[C@H](C)C2)cn1C 808515983 UEUHGDSXZDBOGT-NSHDSACASA-N 370.427 0.761 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@H](C)S(N)(=O)=O)C2)cc1 823732412 FLMPUZGSTLRUCD-STQMWFEESA-N 370.475 0.498 10 10 FCCE C[C@@H](NC(=O)C(=O)NCC[C@@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 1262269794 GIZCGQKWPVERHS-ZIAGYGMSSA-N 360.458 0.914 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3CCNC3=O)cc2)C1 1358167690 FUQBIPUKDSMEQE-GJZGRUSLSA-N 358.442 0.531 10 10 FCCE Nc1ccc(N2C(=O)[C@H]3CS(=O)(=O)C[C@H]3C2=O)c(Br)c1 1924756735 NLBRPIKDMIQCKN-OCAPTIKFSA-N 359.201 0.565 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CO)CNS(=O)(=O)Cc1ccc(N)cc1 2011517046 SAYVMXCIHMTINB-CYBMUJFWSA-N 359.448 0.574 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1CN(C(=O)c2cc(O)nc(O)c2)CC[C@H]1CO 2122238879 FOEMUALTGVDFRO-CMPLNLGQSA-N 367.402 0.841 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C[C@H]3COCCN3)CC2)cc1 285895337 CQZIOTSZNLAELV-INIZCTEOSA-N 362.474 0.312 10 10 FCCE CCOC(=O)C[C@H](O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 773980009 RWOJGBGNDXKMPX-KRWDZBQOSA-N 364.442 0.826 10 10 FCCE COC[C@@H](O)CNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 802013072 SMPQRJHJDRMSFC-ZBFHGGJFSA-N 364.446 0.195 10 10 FCCE CC(=O)C(=O)COC(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1 808495523 SCSIBEDCUQPOEA-UHFFFAOYSA-N 367.301 0.685 10 10 FCCE C[C@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ncnn21 855328407 SZONDPHNJDKTKO-KWQFWETISA-N 351.388 0.791 10 10 FCCE C[C@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)n1cncn1 1133847334 LSBYUAZCAJHELO-CYBMUJFWSA-N 356.430 0.857 10 10 FCCE CN[C@H]1C(=O)Nc2cc(N3CCO[C@H](CO)C3)c(Br)cc21 167220021 LQLLEKJMPLYZEI-ISVAXAHUSA-N 356.220 0.859 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN2CCN(S(C)(=O)=O)[C@H](C)C2)c1O 827270739 DUQXMUAVKSMIPZ-SNVBAGLBSA-N 359.404 0.775 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@]3(C)CCCNC3)C2)cc1 851688595 DNYISEKQYKIQCY-MGPUTAFESA-N 374.485 0.896 10 10 FCCE CS(=O)(=O)CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1178039122 NPLVKXTWHMSPQN-UHFFFAOYSA-N 353.444 0.049 10 10 FCCE C[C@H](C(=O)N1CCCC1)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1294660542 QOFFKIQINSGDLQ-CQSZACIVSA-N 361.442 0.795 10 10 FCCE NC(=O)[C@H]1CC(C(=O)NCc2cc(O)ccc2O)=NN1c1ccccc1 1643879286 JNAGGNWCISMRDH-OAHLLOKOSA-N 354.366 0.834 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCc2ccc(N)cc2)[C@H](O)C1 1890187383 SLCZAQZVGSQESP-KDOFPFPSSA-N 365.430 0.618 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](COc2nnc(=N)[nH]n2)OC2(CCC2)C1 2219013918 YLGBJJOMALUASA-SNVBAGLBSA-N 352.395 0.617 10 10 FCCE Cc1ccc(CNC(=O)CNS(C)(=O)=O)c(O)c1Br 2352623464 BAAPYOLEABJRHA-UHFFFAOYSA-N 351.222 0.629 10 10 FCCE Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)CC2 773984292 CMLJLARKDUPLEZ-SNAWJCMRSA-N 370.365 0.903 10 10 FCCE Cc1cc(Br)c(O)c(CN2CCN3C(=O)C(=O)NC[C@H]3C2)c1 781911239 YQTVZCDJTSKGIS-NSHDSACASA-N 368.231 0.606 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)NCCC3(CN)CC3)C2)cc1 846345477 XQLGCUHAPOSXCB-HNNXBMFYSA-N 374.485 0.883 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN4C[C@H](O)C[C@H]4C3)C2)cc1 854296293 IFCDDQVPUMAVRQ-HYVNUMGLSA-N 360.458 0.734 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cnncc3O)cc2)CC1 1303723244 OIJUXIHTCGCORY-UHFFFAOYSA-N 355.398 0.814 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(=O)n(C)cn1 1466397687 CNUDYKTWLHIRNL-UHFFFAOYSA-N 365.773 0.955 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1C[C@@H](O)CN1c1ccncn1 1466790813 LQGFLPJFCRZWQN-MRVWCRGKSA-N 358.398 0.575 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNCc1ccc(O)cc1O 2218621903 ZQCHSZGULYEAPK-AEGPPILISA-N 354.403 0.529 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNC(=O)c1ccc(O)c(O)c1 2225625229 CZGFAEHKTROBNG-DDTOSNHZSA-N 368.386 0.169 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2312333155 ABZKFFOSWSEDPH-LZQZFOIKSA-N 355.395 0.675 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CSC(=O)N3)cc2)C1 746147422 OXLNWJAMDXGRRS-GXTWGEPZSA-N 362.455 0.830 10 10 FCCE C[C@@H]1CCNC[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 842265973 FAVLOJRSZCVUCG-CRAIPNDOSA-N 374.485 0.596 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NCCc2cn(C)cn2)cc1 846742890 ZRHIPMWVWYZNMC-UHFFFAOYSA-N 373.457 0.682 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)NC[C@@H](O)C3CC3)cc2)CC1 1251105635 WKTUFYFMRALPAZ-QGZVFWFLSA-N 360.458 0.958 10 10 FCCE O=C(N[C@@H]1[C@H]2COC[C@H]21)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1323274768 XBQDAWPOHZZEHA-AIANPOQGSA-N 360.410 0.661 10 10 FCCE CN1CCCc2cc(CNC(=O)c3cn(C[C@H]4CNC(=O)O4)nn3)ccc21 1597849169 QWUCLYUXNSHLTQ-CQSZACIVSA-N 370.413 0.699 10 10 FCCE C[C@H](NCc1cc(=O)n2nc(N)[nH]c2n1)c1ccc(N2CCOCC2)cc1 1616865361 JRABNZMECSKASF-LBPRGKRZSA-N 369.429 0.687 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 1637266322 SNBQZBKGOPXYBR-WBMJQRKESA-N 355.412 0.493 10 10 FCCE C[C@@H]1OC(=O)N[C@H]1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1638488570 KPLSNWGKODXCKG-XHDPSFHLSA-N 360.414 0.501 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)NC[C@@H]1[C@@H](N)Cc1ccc(O)c(O)c1 1952911365 RMQFSDCNJKPCBC-NWDGAFQWSA-N 351.403 0.703 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](CNC(=O)Cc2ccc(O)c(O)c2)[C@@H](O)C1 2087724444 HIMRRWLDSNRGIW-WFASDCNBSA-N 366.414 0.984 10 10 FCCE COc1ccc(Br)c(CNCCCNS(N)(=O)=O)c1O 2236054279 GUZMVMYPPOZVKK-UHFFFAOYSA-N 368.253 0.436 10 10 FCCE CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NCc1cc(C)ccc1O 862025818 QXFCSYXPBBZRDA-UHFFFAOYSA-N 360.370 0.866 10 10 FCCE COCC(=O)N(C)CC(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1632701824 ORZPRZOSVAPDDT-UHFFFAOYSA-N 372.805 0.652 10 10 FCCE COc1ccc(N2CCN(Cn3ncc4cn(C)nc4c3=O)CC2)cc1 186053690 CIIZUPOIEGFZJK-UHFFFAOYSA-N 354.414 0.918 10 10 FCCE CN(C)S(=O)(=O)CC(=O)NCc1cc(Br)ccc1O 804741434 YJEYVPBVPJOAGO-UHFFFAOYSA-N 351.222 0.662 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)NCc3ccn(C)n3)CC2)cc1 805700317 AUQDEXDXGBXJPZ-UHFFFAOYSA-N 371.441 0.784 10 10 FCCE CC(=O)C(=O)COC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O 808495166 IFFLPMVYLCMAJE-GFCCVEGCSA-N 359.334 0.777 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)[C@@H](C)CO)CC2)cc1 828846830 UOVICOIKVLYTOF-LZLYRXPVSA-N 351.491 0.785 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCc3cn(C)cn3)C2)cc1 829638150 OEGWDDMTDHITRH-OAHLLOKOSA-N 371.441 0.483 10 10 FCCE C[C@H](CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(N)=O 847366570 KETFCCZLQRXZPO-TZMCWYRMSA-N 361.446 0.451 10 10 FCCE CCN(C)c1ccc(CN2C[C@@H](N3C(=O)CNC3=O)C[C@H]2C(=O)OC)cc1 856784420 WGLKOZHQMVSKFS-HOTGVXAUSA-N 374.441 0.810 10 10 FCCE COCCCS(=O)(=O)NCC(=O)NCc1ccc2cccnc2c1O 862027004 GSBLQGQCZSXXMW-UHFFFAOYSA-N 367.427 0.513 10 10 FCCE CCO[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)CN(C)C 929800694 IXQWLRWXGUKILA-AWEZNQCLSA-N 368.453 0.591 10 10 FCCE Cn1cc(CCC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)nn1 1133847648 QRFQAFJYRGROMD-UHFFFAOYSA-N 370.457 0.766 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3C[C@H]4C[C@@]4(CO)C3)C2)cc1 1326252136 AJOJMPDRSRVEJK-SXGZJXTBSA-N 373.453 0.479 10 10 FCCE CCO[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)CN(C)C 1341026338 WJOKWQWRQRGUCE-KRWDZBQOSA-N 364.490 0.760 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2127629463 IZUVKJOTHMTJER-XQHKEYJVSA-N 369.422 0.876 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNCc1cccc(O)c1O 2218616999 QQVMRAGTUDIIKE-WHOFXGATSA-N 354.403 0.529 10 10 FCCE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@H](O)[C@@H](O)CCN1C(=O)OC(C)(C)C 2315986666 GXVGJXMJIZTJPV-SDDRHHMPSA-N 357.411 0.876 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2320917171 OHKDGDGGTSDCGG-NSHDSACASA-N 357.411 0.926 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 173201533 JAYOJVPEFUTDOC-VMPITWQZSA-N 370.409 0.589 10 10 FCCE CC(=O)OC[C@H]1O[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@@H]1OC(C)=O 221702298 LJICGUPPWNZTFT-BJJPWKGXSA-N 373.318 0.380 10 10 FCCE CS(=O)(=O)NCC1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 795669309 DJWGKFQENVGEOL-HNNXBMFYSA-N 356.444 0.579 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3cc(OC)ncn3)C2)cc1 850536579 HJQGQAMBPKGIAH-LBPRGKRZSA-N 371.397 0.827 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](Cn4ccnn4)C3)nc12 852313784 NIJOTQODDGKAQR-LBPRGKRZSA-N 371.401 0.725 10 10 FCCE C[C@@H](CO)[C@@H](C)NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 853775888 FSRUDJHFBWKAIS-UONOGXRCSA-N 369.487 0.738 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@H]3CC[C@H](C)NC3)C2)cc1 861783162 SIMVBBWTHCFGNH-XHSDSOJGSA-N 374.485 0.894 10 10 FCCE C[C@@H](NC(=O)N1CCN2[C@@H](CNS2(=O)=O)C1)c1ccc(N(C)C)cc1 922056215 WMZGGYIJUYNTMN-DOMZBBRYSA-N 367.475 0.357 10 10 FCCE CO[C@]1(CNCc2ccc(N3CCOCC3)c(F)c2)CCS(=O)(=O)C1 922614489 CQXTYRZFFKRXLB-KRWDZBQOSA-N 372.462 0.956 10 10 FCCE NC(=O)CS(=O)(=O)c1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1 1152573665 NNMZRBDTUWAXPJ-UHFFFAOYSA-N 360.391 0.807 10 10 FCCE CN1C(=O)[C@H](NC(=O)C(=O)NCCc2ccc(N)cc2)Cc2ccccc21 1261633667 LZWGVKJDDYOUJQ-MRXNPFEDSA-N 366.421 0.631 10 10 FCCE Cn1ccn2c(CNC(=O)NCc3cc(Cl)ccc3O)nnc2c1=O 1471184954 SLUFZWCOBBECQO-UHFFFAOYSA-N 362.777 0.786 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)CNC(=O)C3CC3)cc2)CC1 1644864143 ZNEZORPOSLSRCS-UHFFFAOYSA-N 358.442 0.531 10 10 FCCE O=C(NCc1c(O)cccc1F)NC1CCC2(CC1)NC(=O)NC2=O 1686413332 JLDFHYKQYYHHID-UHFFFAOYSA-N 350.350 0.851 10 10 FCCE Nc1ccc(CS(=O)(=O)N2CC(CNC(=O)C(F)(F)F)C2)cc1 1999424062 DIZYLCKKIMOBOW-UHFFFAOYSA-N 351.350 0.709 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2081034263 GBXAENVXUUQASV-NOOOWODRSA-N 355.395 0.629 10 10 FCCE COc1ccc(N(CC(N)=O)CC(N)=O)cc1NC(=O)OC(C)(C)C 42377211 OEQRKTUZDZBWPH-UHFFFAOYSA-N 352.391 0.819 10 10 FCCE CN1CCO[C@H](CS(=O)(=O)N2CCOc3cc(N(C)C)ccc32)C1 632051062 AXYVDAPJOWQYKY-AWEZNQCLSA-N 355.460 0.612 10 10 FCCE Cn1ncc(Br)c1/C=C1/SC(=S)N(CC(N)=O)C1=O 779205137 UMMAARGNKCOLJG-FARCUNLSSA-N 361.246 0.869 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1[C@H]2OCCC[C@@H]21 780390805 HTOYNFIQLXPIGS-ZACQAIPSSA-N 364.467 0.963 10 10 FCCE O=S1(=O)CC[C@]2(CN(Cc3ccc(N4CCOCC4)cc3)CCO2)C1 843426192 PYSDOFLGSWBWFK-SFHVURJKSA-N 366.483 0.913 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3[C@@H](C2)[C@H]2CC[C@H]3CN2)cc1F 861751122 YZHWEGSVQBAXRD-LJIGWXMPSA-N 374.460 0.964 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3C[C@H](O)C4(CC4)C3)CC2)cc1 1324209145 DNVMPMQFOLPSBP-MJGOQNOKSA-N 361.486 0.635 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@@H](Nc2ncccn2)C1 1345979152 GAUYWIWQZPEHCS-CQSZACIVSA-N 355.398 0.854 10 10 FCCE Cc1nnc(N(C)Cc2ccccc2O)n1CCC[C@@H]1NC(=O)NC1=O 1511780013 SOORWQBUPUDDIV-ZDUSSCGKSA-N 358.402 0.917 10 10 FCCE CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NCc2c(O)cccc2O)c1 1558536388 WQPQMLNYZWLOKT-UHFFFAOYSA-N 366.395 0.984 10 10 FCCE CC(C)(C)OC(=O)C(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1640569298 ZOUAPVJPBZKNDL-UHFFFAOYSA-N 364.398 0.653 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@@H]1C[C@@H]1N 2080880249 JESOETMRIUMSHC-TUAOUCFPSA-N 351.403 0.749 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)CN3C(=O)NC(C)(C)C3=O)C2)cc1 819580348 IDNDKUPMZHDHEZ-ZDUSSCGKSA-N 374.441 0.968 10 10 FCCE COC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CCOCC1 855289275 KHWXPJAJVBISGK-CQSZACIVSA-N 372.443 0.935 10 10 FCCE COC(=O)c1c(CN2CC[C@H](S(N)(=O)=O)C2)c2cc(F)ccc2n1C 894535388 ZRSZPHCCONXWRL-NSHDSACASA-N 369.418 0.967 10 10 FCCE C[C@H]1CC[C@@H](NC(=O)C(=O)N(C)Cc2ccccc2O)CS1(=O)=O 1118670739 XOOLPMXLCKJZHJ-WCQYABFASA-N 354.428 0.433 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCNC3=O)cc2)C1 1597004864 YGDGZDJVFXLBOT-GDBMZVCRSA-N 358.442 0.531 10 10 FCCE Cn1nc2c(c1C(=O)NCCc1ccc(O)c(O)c1)CS(=O)(=O)CC2 1636022286 GXHFTHSWYXWSFY-UHFFFAOYSA-N 365.411 0.275 10 10 FCCE Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3N=[N+]=[N-])ccc12 504739601 JZSHWIUBDQNWDV-YMILTQATSA-N 363.326 0.598 10 10 FCCE in-vitro CC(=O)C(=O)COC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O 808506146 HBDRORFJBKVXBP-UHFFFAOYSA-N 351.336 0.308 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CN(C3CC3)C(=O)O2)c1 848367100 VLGBEDKKJUFYNF-NSHDSACASA-N 369.399 0.477 10 10 FCCE O=C(CC1(n2cnnn2)CCOCC1)OCC(=O)c1ccc(O)c(O)c1 850232213 XURKBDNFAIVSPJ-UHFFFAOYSA-N 362.342 0.406 10 10 FCCE CCOC(=O)C[C@@H](O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856213250 DXHUHGJGTJINPU-MRXNPFEDSA-N 350.415 0.578 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N1CC[C@@]2(O)C[C@H]2C1 1118433525 HCBIRNLEKUYZQP-OXJNMPFZSA-N 373.453 0.465 10 10 FCCE O=C(O)[C@@H]1[C@@H](O)[C@@H](O)CN1Cc1cc(Cl)cc(Br)c1O 2200842988 CKYQVJUNFJGCOY-QXEWZRGKSA-N 366.595 0.799 10 10 FCCE COc1ccc(N2CCN(CCC(=O)N3CCN(C=O)CC3)CC2)cc1 243317084 LLCAZZNQGYIQAQ-UHFFFAOYSA-N 360.458 0.508 10 10 FCCE CCNS(=O)(=O)[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 364924174 OTRAHYDEWQAYIG-VIFPVBQESA-N 370.387 0.444 10 10 FCCE COc1ccc(O)c(CNC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c1 715550402 MOAWPQCIAXSORF-UHFFFAOYSA-N 351.403 0.965 10 10 FCCE Cn1cc(C[C@@H](O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 786795259 IMAIWERGGPRINC-QGZVFWFLSA-N 362.405 0.616 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1COCCOC1 813590368 LQEUDTNOZUEEDW-UHFFFAOYSA-N 353.394 0.877 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N3C[C@H]4CC[C@H]3CN4)CC2)cc1 817910146 MQOUXPWYVQRLKQ-WBVHZDCISA-N 372.469 0.743 10 10 FCCE C[C@H]1C(=O)N(C)CN1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 825859902 WSWNVYWDZJWNLZ-DZGCQCFKSA-N 373.457 0.718 10 10 FCCE CN(C)C(=O)/C=C\C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1141996395 TVHDTIHOTQTDGM-KVPUOBJLSA-N 358.442 0.649 10 10 FCCE CC1=C(C(=O)NCc2ccc3cccnc3c2O)Cn2nnnc2N1C 1162612567 MFTNPQMHLWWICY-UHFFFAOYSA-N 351.370 0.967 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@@H]1CC(=O)NCCN=[N+]=[N-] 2010388645 FGGLBBWCSBZQLN-JTQLQIEISA-N 361.424 0.837 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(CCNC(=O)c2cc(O)nc(O)c2)C1 2230125175 JSZJBMSCSRCVMK-QGZVFWFLSA-N 367.402 0.985 10 10 FCCE C[C@H](NC(=O)C(CO)(CO)NC(=O)OC(C)(C)C)c1ccccc1O 2320983528 JBKLTLZWCQFCES-NSHDSACASA-N 354.403 0.818 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@@H](n4cc(CO)nn4)C3)cc2N1 814906895 NEYODDZWPMRKFO-LLVKDONJSA-N 374.357 0.851 10 10 FCCE C[C@@H]1CN(c2ccc(CNC(=O)C(=O)NCCCN)cc2F)C[C@@H](C)O1 842217386 WMLKLNTVSISSTP-CHWSQXEVSA-N 366.437 0.521 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC[C@@H]3CCNC3)C2)cc1 851688115 QOBURIFZXNPVNO-GJZGRUSLSA-N 360.458 0.506 10 10 FCCE CC1(C)S[C@H]2[C@H](NC(=O)c3cc(O)c(O)c(O)c3)C(=O)N2[C@H]1C(=O)O 1865875777 GWDDSXIHHJWKGC-DVYJOKAKSA-N 368.367 0.049 10 10 FCCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)NCCc1ccc(O)c(O)c1 2067740243 OJWPTCRSDURAMD-GFCCVEGCSA-N 354.403 0.890 10 10 FCCE Cn1cc(/C=C/C(=O)N2CCc3c2cccc3[N+](=O)[O-])c(=O)n(C)c1=O 172360149 MKCWTLSCMDBBNZ-VOTSOKGWSA-N 356.338 0.595 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NC[C@H](C)CO)CC2)cc1 299326491 GEIVBKKIEXYKCR-HNNXBMFYSA-N 350.463 0.745 10 10 FCCE CC(=O)OC[C@@H]1O[C@@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@H]1OC(C)=O 616626137 QKGHBQJLEHAMKJ-ZUWCUPBKSA-N 373.318 0.380 10 10 FCCE in-vitro COc1ccc(O)c(CNC(=O)C(=O)Nc2cnn(CCN(C)C)c2)c1 768722229 QIJVKXMCDAMKRO-UHFFFAOYSA-N 361.402 0.414 10 10 FCCE CN1NN=C2C1=NCC[C@H]2C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856213062 BDPTVJWYFNAEIK-MRXNPFEDSA-N 370.457 0.488 10 10 FCCE CN1CCN(c2ccc(CNC[C@]34COCCN3C(=O)COC4)cc2)CC1 865796112 QCCZVBKULQJCCX-HXUWFJFHSA-N 374.485 0.156 10 10 FCCE Cc1ccc(O)c(CNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)c1 1167293762 RJXRYOZAGGTIMS-UHFFFAOYSA-N 350.400 0.461 10 10 FCCE C[C@H]1CS(=O)(=O)CCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 1262222974 HEUPUFZJXOUFKM-ZDUSSCGKSA-N 367.471 0.404 10 10 FCCE O=C(CNS(=O)(=O)c1c(F)cccc1F)NCc1c(O)cccc1O 1472063423 JVPZQZSARVDCDW-UHFFFAOYSA-N 372.349 0.971 10 10 FCCE COc1ccc(N2CCN(C(=O)C3(CS(C)(=O)=O)COC3)CC2)cc1 1521229516 MVTMPTGTCUZQLU-UHFFFAOYSA-N 368.455 0.405 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCCN=[N+]=[N-])C1CS(=O)(=O)C1 2020698310 RGAMYKGPISHJDN-SNVBAGLBSA-N 361.424 0.741 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNCc1ccc(O)cc1O 2218621904 ZQCHSZGULYEAPK-QEJZJMRPSA-N 354.403 0.529 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)CNS(C)(=O)=O)cc2F)CC1 106829815 DRRLAJDKLHYJSZ-UHFFFAOYSA-N 372.466 0.133 10 10 FCCE CCCN(C)S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 268771401 LSEAXSXDKFJZDQ-UHFFFAOYSA-N 365.433 0.755 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@@H]3CCC[C@H](C2)C3O)c1 370741161 IJBDFCBYSVQKAO-YWXMQNBFSA-N 354.428 0.997 10 10 FCCE CC(C)OC[C@@H](O)CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 849328483 LURZFGHVVXZKMU-KRWDZBQOSA-N 356.488 0.797 10 10 FCCE CN1C[C@@H](CCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC1=O 929805740 VIFIXBJNHPGAQE-HNNXBMFYSA-N 372.469 0.670 10 10 FCCE C[C@H]1CC[C@H](NC(=O)C(=O)N(C)Cc2ccccc2O)CS1(=O)=O 1118670737 XOOLPMXLCKJZHJ-AAEUAGOBSA-N 354.428 0.433 10 10 FCCE CCON(C)C(=O)CNC(=O)C(=O)NCc1ccc(N(CC)CC)cc1 1326669064 SUUDTODSCXAJRC-UHFFFAOYSA-N 364.446 0.675 10 10 FCCE C[C@@H](NC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1ccccc1O 1587445022 RTZAYJQHWBKJPH-FRRDWIJNSA-N 366.439 0.605 10 10 FCCE CC(=O)O[C@H]1[C@H](OC(C)=O)[C@H](C)O[C@H](OCCN=[N+]=[N-])[C@@H]1OC(C)=O 1616083724 SWFHDHBVUMLTMW-ZDEGCGEKSA-N 359.335 0.853 10 10 FCCE CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@@H]1OC(C)=O 2060446673 LJICGUPPWNZTFT-XVIXHAIJSA-N 373.318 0.380 10 10 FCCE COc1cc(C(=O)N[C@H](CO)CNC(=O)OC(C)(C)C)cc(OC)n1 2062362342 ITYSIJKIZREQOS-NSHDSACASA-N 355.391 0.714 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](O)[C@@H]1C(=O)NCCCCN=[N+]=[N-] 2064133714 XYNGPUMKNGEGNX-QJPTWQEYSA-N 357.411 0.924 10 10 FCCE COc1ccc(O)c(CNC(=O)N[C@@H]2CCN(C3CCOCC3)C2=O)c1 371824723 NCHQEFWFDYGGKG-OAHLLOKOSA-N 363.414 0.980 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@H](O)CN1CCOCC1 749298380 PVZTVMPAFBJQBO-OAHLLOKOSA-N 372.849 0.714 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CN(C)C(=O)[C@H]1C)c1ccc(N2CCOCC2)cc1 834664623 IOKGUZBKBKKFGT-ZIAGYGMSSA-N 374.441 0.347 10 10 FCCE COC(=O)CC[C@H](N)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 844174347 WTNUTTOHBYGTDL-KRWDZBQOSA-N 363.458 0.792 10 10 FCCE Nc1ncnc2c1ncn2CCCC(=O)NCCc1ccc(O)c(O)c1 1545669225 QAHRDVIXPJHZBV-UHFFFAOYSA-N 356.386 0.959 10 10 FCCE C[C@@H](CO)NS(=O)(=O)c1ccc(C(=O)NCc2ccccc2O)cc1 1622773002 RFCUJIZHOGNJDQ-LBPRGKRZSA-N 364.423 0.981 10 10 FCCE CCOC(=O)[C@@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1652977319 WJLCCOWGNSTGSB-SNVBAGLBSA-N 356.400 0.789 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)NCc1ccccc1O 2080587159 GWVKIMSNCFRTFI-MJBXVCDLSA-N 352.387 0.350 10 10 FCCE CC1=C(C(=O)O)N2C(=O)[C@H](NC(=O)[C@H](N)c3ccccc3O)[C@H]2SC1 503996008 CUXVKLLSHPANDN-JRPNMDOOSA-N 363.395 0.151 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCOC[C@H]3CCO)nc12 762333747 IWAKQMGGDNOTLE-GFCCVEGCSA-N 350.375 0.195 10 10 FCCE CN(C)c1noc(COC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 801241616 LILQJNXVSZXRDQ-UHFFFAOYSA-N 356.360 0.570 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)NCc3ccnn3C)C2)cc1 824928898 MFDNYVNPKPSWBD-AWEZNQCLSA-N 371.441 0.688 10 10 FCCE CC(C)N(C[C@H]1CCC(=O)N1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 857538680 FPJAEPYVHSOZRW-GFCCVEGCSA-N 369.443 0.893 10 10 FCCE CN(C)S(=O)(=O)N1CC(NCc2cccc(Br)c2O)C1 858311066 ADGSSZACRIKYFY-UHFFFAOYSA-N 364.265 0.735 10 10 FCCE COc1cccc(CNC(=O)NC[C@@]2(OC)CCS(=O)(=O)C2)c1O 1251161551 FWUFJQUURDASOY-HNNXBMFYSA-N 358.416 0.404 10 10 FCCE C[C@H](NC(=O)CCn1cc(C(N)=O)c(O)nc1=O)c1ccc(N(C)C)cc1 1447966867 IMOSHNGMJJNNMV-NSHDSACASA-N 373.413 0.381 10 10 FCCE COCCCN(C(=O)Cc1ccc(O)c(O)c1)[C@H]1CCS(=O)(=O)C1 1626881558 CYLJKIJDHQDYEQ-ZDUSSCGKSA-N 357.428 0.693 10 10 FCCE Cn1cc([C@@H](NC(=O)OC(C)(C)C)C(=O)C(=O)C[C@H]2C[C@H](N)C2)nn1 2049780251 HPBQAIJNMLYQSS-GIPNMCIBSA-N 351.407 0.647 10 10 FCCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](O)CN1C(=O)c1cc(O)c(O)c(O)c1 2132348472 LXYTWWJAZOQJRG-QWRGUYRKSA-N 368.386 0.904 10 10 FCCE Cc1cccc(N2C(=O)NC(=O)C(=CNCCN3CCOCC3)C2=O)c1 2295923697 GTFRIODOKQMPJJ-UHFFFAOYSA-N 358.398 0.384 10 10 FCCE COc1ccc(OCCS(=O)(=O)NC[C@]2(OC)C=C[C@H](OC)O2)cc1 70877768 UHOUWCDEZAXLOH-CVEARBPZSA-N 373.427 0.895 10 10 FCCE C[C@H]1C(=O)NC(=O)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 92776076 MLTBRYHMPBPERH-DYEAUMGKSA-N 353.176 0.252 10 10 FCCE COCC(=O)NC1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761881870 MQQUMINBUFRHDR-UHFFFAOYSA-N 364.358 0.657 10 10 FCCE CC[S@](=O)CCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 788931938 JPDVSEZYHOETAN-DEOSSOPVSA-N 351.472 0.788 10 10 FCCE C[C@@H](O)[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 817705336 DTVHJUXOOVDNKF-PBHICJAKSA-N 361.442 0.511 10 10 FCCE C[C@@H]1NCC[C@H]1NC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 861565576 XZINEEPGDXCTLX-JLJPHGGASA-N 359.474 0.938 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCCC1CS(=O)(=O)C1 1117659448 PVIKXKQDEIHDKL-UHFFFAOYSA-N 368.455 0.682 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C[C@H]3CCNC3=O)cc2)CC1 1133846959 AHESALWBLDVLTK-OAHLLOKOSA-N 358.442 0.531 10 10 FCCE CCOC(=O)C[C@@H](O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 1150241371 ZBCQGPDBOSWWAU-CQSZACIVSA-N 354.378 0.797 10 10 FCCE CCO[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)CN(C)C 1341026339 WJOKWQWRQRGUCE-QGZVFWFLSA-N 364.490 0.760 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](CO)(NC(=O)c2cc(O)nc(O)c2)C1 2069746912 KTUFRGISFMPTSQ-MRXNPFEDSA-N 353.375 0.595 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](C(=O)C(=O)C[C@H]1C[C@H](N)C1)C1CS(=O)(=O)C1 2076830355 CHSGEOORIMZBPM-IRUJWGPZSA-N 374.459 0.190 10 10 FCCE Oc1c(Br)cc(Cl)cc1CN[C@@H]1C[C@H](O)[C@@H](O)[C@@H]1O 2108826827 YRRRWRKSVBABJQ-RBLKWDMZSA-N 352.612 0.753 10 10 FCCE CC(C)(C)OC(=O)N1CCC(CO)(NC(=O)c2cc(O)nc(O)c2)CC1 2133570208 UJTYSVWIDXKKMU-UHFFFAOYSA-N 367.402 0.985 10 10 FCCE CC(C)(C)OC(=O)N1CC(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)(S(C)(=O)=O)C1 2326786790 NOUUKEHQRCXJQU-SNVBAGLBSA-N 373.435 0.932 10 10 FCCE CCOc1ccc(S(=O)(=O)NCCC(=O)OCC(=O)C(C)=O)cc1 808494704 CSLUUHVVAIDDBG-UHFFFAOYSA-N 357.384 0.455 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C1C[C@H]2CNC[C@@H](C1)C2=O 827567393 IWHZRPKCIIFRGS-ALOPSCKCSA-N 357.454 0.954 10 10 FCCE CN1CCN(c2ccc(CNC3CN(S(=O)(=O)N(C)C)C3)cc2)CC1 858313582 GUXAZOLUYJYKHT-UHFFFAOYSA-N 367.519 0.019 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3CC[C@@H](F)[C@H](N)C3)CC2)cc1 923394786 FEZMUTYFZGGDIA-BHIYHBOVSA-N 366.481 0.549 10 10 FCCE C[C@H](C(=O)NCc1c(O)cccc1F)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 928706549 WVEBWGPQWNJAPN-FYIZZCSQSA-N 362.357 0.698 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cnn(CCO)c3)cc2)CC1 1155603516 CTODLMJGYRNGOJ-UHFFFAOYSA-N 371.441 0.507 10 10 FCCE COCC(C)(C)N1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1261866395 CRKBGTFSINGOJD-UHFFFAOYSA-N 361.442 0.804 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(Cn2cnnc2)CC1 1335619993 AZZFKRBIKHAHEV-UHFFFAOYSA-N 355.398 0.765 10 10 FCCE O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1CCN(c2ccc3nncn3n2)C1 1632944116 PPZXAWBWUJEPSZ-NHEDYWLLSA-N 366.381 0.944 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCCCON 2136253559 NUYNUOIMBKENSB-LBPRGKRZSA-N 369.418 0.930 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H](C)n3cncn3)CC2)cc1 299307504 DWGXVCDBAPZPFC-HNNXBMFYSA-N 358.446 0.786 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)CCCS(C)(=O)=O 437713509 AGNJBYYCUWOXTG-UHFFFAOYSA-N 362.473 0.716 10 10 FCCE CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CN2CCC1CC2 769815605 LCDQQSGADOFQHL-CQSZACIVSA-N 353.444 0.930 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1cnnn1C 831706451 GDLSZJFUDSOZCX-UHFFFAOYSA-N 352.778 0.918 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2C[C@@H]3CNC[C@]3(C)C2)cc1 872194542 CGPHTJPFRHRVTA-MGPUTAFESA-N 374.485 0.658 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3cn(C)ccc3=O)CC2)cc1 930940356 DWHWBZJRCORYBQ-UHFFFAOYSA-N 370.453 0.946 10 10 FCCE CN1C(=O)[C@H](O)[C@H](C(=O)N2Cc3cccc(O)c3C2)[C@H]1c1cnn(C)c1 1263873286 OOEFOJHPQAIJPQ-BZUAXINKSA-N 356.382 0.158 10 10 FCCE CN(C)C(=O)N(C)[C@H]1CCN(C(=O)C(=O)N(C)Cc2ccccc2O)C1 1327316686 NYXJKZZPINEXLJ-AWEZNQCLSA-N 362.430 0.565 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1CCc2nnc(O)n2C1 1630487526 YERRAVKUBPKETR-CYBMUJFWSA-N 374.397 0.844 10 10 FCCE CNS(=O)(=O)c1cc(NC(=O)Cc2ccc(O)c(O)c2)ccc1O 1640382760 QBJRMWUVDDUZKN-UHFFFAOYSA-N 352.368 0.893 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@H](N=[N+]=[N-])C2)[C@@H](O)C1 2076819572 DFHCKJXVVDDFSS-ZIBATOQPSA-N 355.395 0.630 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNCc1ccc(F)cc1O 2218642876 XHXBGTIBESIPLU-VHDGCEQUSA-N 356.394 0.962 10 10 FCCE COc1ccc(N2CCN(C=O)CC2)cc1NC(=O)CCS(C)(=O)=O 62275239 YVUQFHDTCOSVQG-UHFFFAOYSA-N 369.443 0.347 10 10 FCCE O=C1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCN1 65954960 VTKVHBQOSSNYAP-UHFFFAOYSA-N 364.421 0.100 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CSC(=O)N3)cc2)C1 746147429 OXLNWJAMDXGRRS-OCCSQVGLSA-N 362.455 0.830 10 10 FCCE O=C1O[C@@H]2CNC[C@@H]2N1[C@@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 872254555 HKHBIDTUGWNUTM-CEXWTWQISA-N 372.469 0.890 10 10 FCCE COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=O)C(=O)NCCc1ccc(N)cc1)C2 1331951254 TXOCBIPOGNDEOQ-IMJJTQAJSA-N 374.441 0.663 10 10 FCCE C[C@@H](CNC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)S(N)(=O)=O 1479533442 HWUZNOHPNKTJJK-SWLSCSKDSA-N 371.507 0.332 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/C(=O)N(C)C 1624658744 KEVWDHSKTLMTPT-GUOLPTJISA-N 350.371 0.333 10 10 FCCE CC(C)(C)OC(=O)NC[C@H](O)CNS(=O)(=O)Cc1ccc(N)cc1 2011421438 AMFOWEFAZXHGHT-ZDUSSCGKSA-N 359.448 0.574 10 10 FCCE CC(C)(C)OC(=O)NC[C@@H](O)CNS(=O)(=O)Cc1ccc(N)cc1 2011425583 AMFOWEFAZXHGHT-CYBMUJFWSA-N 359.448 0.574 10 10 FCCE C[C@@H](O)CN(CCNC(=O)OC(C)(C)C)C(=O)c1cc(O)nc(O)c1 2257632726 DNGFWEJZJSCZKI-SNVBAGLBSA-N 355.391 0.841 10 10 FCCE CNS(=O)(=O)[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 372742491 QMEAEAAJEJLLFY-MRVPVSSYSA-N 356.360 0.054 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC(N3CC[C@@H](O)C3)CC2)cc1 852709738 FGRKBFGFEXPNMS-LJQANCHMSA-N 360.502 0.900 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCN=C4C3=NNN4C)C2)cc1 855227656 ZVOKLYPULDQZIV-SWLSCSKDSA-N 356.430 0.615 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@](O)(C(F)F)C2)c1 857524451 JLNURHDYWOFGMB-ZDUSSCGKSA-N 350.343 0.606 10 10 FCCE CNS(=O)(=O)c1cccc(CNC(=O)Cc2ccc(O)c(O)c2)c1 1290781977 JHYZLBVBYFOUGV-UHFFFAOYSA-N 350.396 0.865 10 10 FCCE CN1CCCc2cc(CNC(=O)c3nc4ncc(CCO)cn4n3)ccc21 1544164178 CTHLVNCNAPTHHE-UHFFFAOYSA-N 366.425 0.972 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCOC23CCOCC3)c1 1640277105 SPLMFSCWZXWXSE-AWEZNQCLSA-N 370.427 0.832 10 10 FCCE O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)C1=CNNCCO 2296115760 JIUHRRJOQSDQCC-UHFFFAOYSA-N 369.175 0.002 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNCc1ccc(F)cc1O 2312327798 XHXBGTIBESIPLU-CFVMTHIKSA-N 356.394 0.962 10 10 FCCE COc1ccc(OCCS(=O)(=O)NC[C@@]2(OC)C=C[C@H](OC)O2)cc1 70877769 UHOUWCDEZAXLOH-HZPDHXFCSA-N 373.427 0.895 10 10 FCCE CCOC(=O)C1CCN(C(=O)C(=O)N(C(C)=O)c2ccc(N)cc2)CC1 170318134 ORUVTHHJYWRZSO-UHFFFAOYSA-N 361.398 0.950 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C3CN(C(C)=O)C3)CC2)cc1 276230511 DKHNQFHHLNMOMZ-UHFFFAOYSA-N 360.458 0.412 10 10 FCCE CN(CC(=O)NCc1ccc(N(C)C)cc1)C[C@H]1CCS(=O)(=O)C1 740888323 FEJKFTBWVDKZIF-OAHLLOKOSA-N 353.488 0.735 10 10 FCCE C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCCSc1nccs1 803916743 SPUBIYNEOPOTOC-JTQLQIEISA-N 354.461 0.538 10 10 FCCE C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCCN)cc2F)C[C@@H](C)O1 842217383 WMLKLNTVSISSTP-BETUJISGSA-N 366.437 0.521 10 10 FCCE CN1C2(CCC2)COC[C@@]1(CO)CNC(=O)Cc1ccc(O)c(O)c1 1147832353 TZZOBFMCRQKRAE-SFHVURJKSA-N 350.415 0.372 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H](CO)[C@@H](CCO)C3)C2)cc1 1519454742 JEMRWQVNECKNOL-XHSDSOJGSA-N 363.458 0.906 10 10 FCCE CN(C)S(=O)(=O)N1CC(NC(=O)NCc2cc(Cl)ccc2O)C1 1683137517 FIIAINGUBSYTRI-UHFFFAOYSA-N 362.839 0.335 10 10 FCCE CN(C)c1ccc([C@@H](CNC(=O)CNC(=O)CN)N2CCCCC2)cc1 1866015157 MXLBZOFSHSJCOF-QGZVFWFLSA-N 361.490 0.471 10 10 FCCE Nc1ccc(N2C(=O)[C@H]3CS(=O)(=O)C[C@@H]3C2=O)c(Br)c1 1924756738 NLBRPIKDMIQCKN-YUMQZZPRSA-N 359.201 0.565 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNCc1ccc(F)cc1O 2312327799 XHXBGTIBESIPLU-YUELXQCFSA-N 356.394 0.962 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N[C@H](C)CCO)CC2)cc1 265714122 DKUZMFDYRWKNNK-OAHLLOKOSA-N 350.463 0.887 10 10 FCCE Cc1cc(C(=O)N2CC(n3cc(C(N)=O)nn3)C2)c(C)n1-c1ccccn1 378545583 USPQJFUQCSBZDJ-UHFFFAOYSA-N 365.397 0.877 10 10 FCCE CC(=O)NC[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 761899630 FXEMWEYCZUAVRJ-JTQLQIEISA-N 350.331 0.267 10 10 FCCE C[C@H](NC(=O)C(=O)N1CCN2C[C@H](O)C[C@H]2C1)c1ccc(N(C)C)cc1 848938228 ZPLHZKWFEHDUGQ-RRQGHBQHSA-N 360.458 0.207 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCC2(C(=O)O)CCC2)cc1F 851681253 MROBZIFBJGOJOL-UHFFFAOYSA-N 351.378 0.879 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CC[C@H](C)NC3)CC2)cc1 861804520 QYUGUPCNWOYQOV-HOTGVXAUSA-N 374.485 0.991 10 10 FCCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NC[C@H]1C[C@@H]2COC[C@@H]2O1 929522870 ASNYTAQVMCZARI-NXHRZFHOSA-N 373.453 0.823 10 10 FCCE CON(C)C(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1117554651 BZSQEGYXYMPXFJ-UHFFFAOYSA-N 360.458 0.855 10 10 FCCE CS(=O)(=O)CC1(C(=O)NCc2ccc(N3CCOCC3)cc2)COC1 1520819131 PRRMRDAVIBPIPD-UHFFFAOYSA-N 368.455 0.201 10 10 FCCE O=C1CN(CC(=O)Nc2c(-c3ccccn3)nc3ccccn23)CCN1 1641971971 JMXVRIKWPIIBJD-UHFFFAOYSA-N 350.382 0.767 10 10 FCCE CNCc1ccc(N2CC3(CNS(=O)(=O)C3)C2)cc1Br 2176158402 RSUXYSXBSAZZDP-UHFFFAOYSA-N 360.277 0.908 10 10 FCCE Cc1cc(C(=O)N(C)CC(=O)N2CCNCC2)c(C)n1-c1ccccn1 825617379 FMGZTRHQPFPDPK-UHFFFAOYSA-N 355.442 0.993 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)c1 856465378 ZGWLBOSTXMFQLS-MJVIPROJSA-N 354.428 0.997 10 10 FCCE CN(CC(N)=O)C(=O)c1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 1297524447 COJJPRUJFXNUGS-UHFFFAOYSA-N 357.366 0.836 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N3C[C@@H]4CC[C@H](C3)O4)cc2)CC1 1334668652 QZRYVNYWYBFXNT-HDICACEKSA-N 372.469 0.444 10 10 FCCE Cc1nnc(N2CC[C@H](C(N)=O)C2)n1Cc1ccc(N2CCOCC2)cc1 1742786390 HLXFQUNRZRLWCE-INIZCTEOSA-N 370.457 0.783 10 10 FCCE CS(=O)(=O)c1ncc(Br)c(C(=O)N2CC(N=[N+]=[N-])C2)n1 1912207306 NRYBBVIJSFVSFF-UHFFFAOYSA-N 361.181 0.777 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NCCn1cnc2c1c(=O)n(C)c(=O)n2C 33829325 KSWSOCZUAISECK-LLVKDONJSA-N 373.413 0.066 10 10 FCCE CN(C)S(=O)(=O)N1CCCN(Cc2cc3c(cc2O)OCO3)CC1 367972129 IUKVABOVWYSGLY-UHFFFAOYSA-N 357.432 0.435 10 10 FCCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H](C(=O)O)C1 687287695 LUZOVCHPZLYIRZ-SNVBAGLBSA-N 367.358 0.639 10 10 FCCE O=C([C@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1)N1CCOCC1 768440529 FDTUZEGBVDWZRM-SUMWQHHRSA-N 362.426 0.889 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CC[C@H]3C(N)=O)CC2)cc1 847399256 AKJGLQVKCFVOQD-SJORKVTESA-N 360.458 0.445 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3[C@H]4CC[C@@H](NC4)[C@H]3C2)cc1F 861751126 YZHWEGSVQBAXRD-QBYUYEEZSA-N 374.460 0.964 10 10 FCCE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)C(=O)Cc1ccc(O)c(O)c1 1298102719 NTVGPPZBLXBEQW-LBPRGKRZSA-N 354.403 0.984 10 10 FCCE O=C1C[C@@H](CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CN1 1564927660 VSSPZJFABBSMKV-MRXNPFEDSA-N 360.458 0.831 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)S(C)(=O)=O 1623927991 AAGIRAMWHULICW-SECBINFHSA-N 363.819 0.980 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2CCC3(CC2)C[C@H](O)CNC3=O)cc1 1636318675 ZTSOFKBNYVHBRH-ZDUSSCGKSA-N 359.386 0.952 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CCNC(=O)c1cc(O)c(O)c(O)c1)C(=O)O 2132347960 ARYGPHOCNMQYBB-VIFPVBQESA-N 370.358 0.901 10 10 FCCE COc1ccc(Br)c(CN[C@H]2CS(=O)(=O)C[C@@H]2O)c1O 2236055866 SADKLOYUQZJKPF-UWVGGRQHSA-N 366.233 0.411 10 10 FCCE CN1C[C@H](CCNC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC1=O 929800665 HZDRWYGOIMMHLN-CYBMUJFWSA-N 364.421 0.493 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCCC1CS(=O)(=O)C1 1324899259 LWBVMMJFOYDUMJ-UHFFFAOYSA-N 367.471 0.228 10 10 FCCE CCc1nnc(N(C)Cc2ccccc2O)n1CCS(=O)(=O)NC 1498676434 YHDFBJGANFJFER-UHFFFAOYSA-N 353.448 0.732 10 10 FCCE CS(=O)(=O)Cc1n[nH]c(CNC(=O)NCc2cccc(Cl)c2O)n1 1565403580 CDXXFFWPYKRZDD-UHFFFAOYSA-N 373.822 0.708 10 10 FCCE COCCOCC(=O)N1CCC(NC(=O)c2cc(O)c(O)c(O)c2)CC1 169859816 DMALMEFWPFHVJR-UHFFFAOYSA-N 368.386 0.187 10 10 FCCE CC(=O)C(=O)COC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O 808505076 RWELMVCVKAMABU-MRXNPFEDSA-N 350.302 0.294 10 10 FCCE O=C(N[C@]1(C(=O)O)CCN(Cc2ccccc2)C1)c1cc(O)nc(O)c1 822013988 KAANDUZPQKIDOT-GOSISDBHSA-N 357.366 0.952 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)c3cn(C)ccc3=O)cc2)CC1 935568756 GKDGWOTYJLMKOW-UHFFFAOYSA-N 368.437 0.984 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCCC(=O)NC 1138053228 CCSKLZMYJXPSCV-ZDUSSCGKSA-N 366.414 0.995 10 10 FCCE COc1ccc(CN[C@@H](C)CN(C)C(=O)[C@H]2CC[C@@H](C(N)=O)O2)cc1C 1283679062 PTSYVVRNXVLAQJ-RRQGHBQHSA-N 363.458 0.973 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCCN1CCN(c2ncccn2)CC1 1290588468 BBGCRXMDMWXQSL-UHFFFAOYSA-N 371.441 0.759 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)CN1CCC[C@H](C(=O)OC)C1=O 1636062801 GBAGICZTYQASDF-LBPRGKRZSA-N 369.414 0.906 10 10 FCCE CCN1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1=O 191531804 VKQOXDMKYPFLEY-UHFFFAOYSA-N 364.421 0.400 10 10 FCCE CNCCNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 842130792 FITCAFUSETUAQY-UHFFFAOYSA-N 373.501 0.170 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCO[C@H]2CC2(F)F)c1 855608647 KPLYVJXSOBWDGR-NSHDSACASA-N 350.343 0.918 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CO)Cc2cncs2)c1 1301774332 FJVZQGCWGMFYII-SNVBAGLBSA-N 371.440 0.554 10 10 FCCE CS(=O)(=O)C1CN(c2cc3c(cc2Br)[C@@H](N)C(=O)N3)C1 2152284533 LDCHFKBSYQXGKM-LLVKDONJSA-N 360.233 0.634 10 10 FCCE CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C\NCCN1CCNCC1 13635298 NYNLQPZPCYLYJA-VBKFSLOCSA-N 358.402 0.696 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3CCN=C4C3=NNN4C)C2)cc1 854981675 YOYQIIRVZPXQSO-XJKSGUPXSA-N 370.457 0.862 10 10 FCCE CN(C)c1ccc([C@H](CNC(=O)c2nc(O)nc(O)c2N)N(C)C)cc1 1134886347 ZYJIJWYWQNIDLU-LBPRGKRZSA-N 360.418 0.569 10 10 FCCE NS(=O)(=O)CCCNC(=O)NCc1cccc(Br)c1O 1252416848 AHQFZTYVZXOJLB-UHFFFAOYSA-N 366.237 0.633 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(NC)cn1 1329027455 RLANVNFTPNPFNZ-NSHDSACASA-N 360.370 0.834 10 10 FCCE CC1(N2CCOCC2)CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329880153 DHJPRIAVGRMBOO-UHFFFAOYSA-N 373.453 0.948 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2311714769 HFWNOOKCTHKEAI-DDHJBXDOSA-N 355.395 0.486 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CSC(=O)N3)cc2)CC1 276290277 TVYBNFOOLYKFAA-OAHLLOKOSA-N 362.455 0.796 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@]2(C1)NC(=O)NC2=O 279032799 ICEGLTNOBNUGPA-LJQANCHMSA-N 373.457 0.385 10 10 FCCE COc1ccc(N2CCCN(C(=O)[C@H]3CCN=C4C3=NNN4C)CC2)cc1 822918786 DVCIUMIQNXEKQR-INIZCTEOSA-N 370.457 0.958 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC3(C(=O)N(C)C)CC3)CC2)cc1 839632892 KFMZDJYQOMPEIQ-UHFFFAOYSA-N 360.458 0.554 10 10 FCCE C[C@H](CC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)NC(N)=O 847366569 KETFCCZLQRXZPO-OCCSQVGLSA-N 361.446 0.451 10 10 FCCE C[C@H](CC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)NC(N)=O 848216717 IQQPRZZMJLUEQS-SNVBAGLBSA-N 356.373 0.865 10 10 FCCE COC(=O)[C@@](C)(CCF)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 855910200 KDPFKMACKQFPML-CQSZACIVSA-N 362.379 0.785 10 10 FCCE CC(C)(C)C(=O)NCC(=O)OCCC(=O)NCCc1ccc(O)c(O)c1 1465981365 LCVIUXDAFQZCLM-UHFFFAOYSA-N 366.414 0.852 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](COc2nnc(=N)[nH]n2)OC2(CCC2)C1 2219013917 YLGBJJOMALUASA-JTQLQIEISA-N 352.395 0.617 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCCC[C@@H]2[C@H]2CNC(=O)C2)cc1 785423926 IRJMUVGSCVFGNQ-NVXWUHKLSA-N 372.469 0.886 10 10 FCCE C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H](O)C(F)(F)F 819564424 GCYBIPCIDFJQGR-QUBYGPBYSA-N 356.322 0.805 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CC[C@@H]3C(N)=O)CC2)cc1 847399249 AKJGLQVKCFVOQD-DLBZAZTESA-N 360.458 0.445 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)N(C)CCN(C)c1ccc(OC)cc1 861796353 BBRKDLREHJHDHQ-DLBZAZTESA-N 362.474 0.847 10 10 FCCE O=S1(=O)CCNC[C@@H]1CCNCc1ccc(N2CCOCC2)cc1 903967626 DPBBCWGADGBACV-KRWDZBQOSA-N 353.488 0.390 10 10 FCCE Cn1cc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)nc1O 1538138543 SWDIOKJWQHEYDU-UHFFFAOYSA-N 357.414 0.757 10 10 FCCE COC(=O)N1CC(C)(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1634846394 LVVNPJOQHZIZTJ-UHFFFAOYSA-N 357.388 0.334 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N1CC(N=[N+]=[N-])C1 2010393628 VEIVZZZWVWZBMT-JTQLQIEISA-N 361.424 0.836 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@H]1C(=O)Nc1ccc(N)cc1 2311694506 URNHUDCAACXIKW-HZSPNIEDSA-N 351.403 0.939 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)Cn1cnc2c(cnn2C)c1=O 115280343 URUGUBXXUWKCTM-UHFFFAOYSA-N 354.414 0.821 10 10 FCCE C[C@@H]1C(=O)NC(=O)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 221251202 MLTBRYHMPBPERH-BLTYZCFWSA-N 353.176 0.252 10 10 FCCE COC(=O)c1c(CN2CC(O)(C(=O)OC)C2)c2cc(F)ccc2n1C 895469386 YVPDMHGNSFJNOQ-UHFFFAOYSA-N 350.346 0.824 10 10 FCCE CCCn1c(N)c(N(CCOC)C(=O)/C=C\c2cnccn2)c(O)nc1=O 918145013 OLYZHCHYEXGXAX-PLNGDYQASA-N 374.401 0.424 10 10 FCCE COC(=O)[C@@H]1CCCN(CC(=O)N[C@H](C)c2cc(OC)ccc2O)C1=O 1465993180 OSRTXHSRXOKMJM-DGCLKSJQSA-N 364.398 0.990 10 10 FCCE O=C(NCC1(O)CCS(=O)(=O)CC1)c1cc2cc(O)c(O)cc2s1 1556583248 WLZRGEYBYOHBDC-UHFFFAOYSA-N 371.436 0.982 10 10 FCCE O=C(CNC(=O)CNC(=O)c1cccc(O)c1O)NCc1ccccc1 1595174745 GCZPMNFURKFJLD-UHFFFAOYSA-N 357.366 0.260 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](C(=O)NCCCN=[N+]=[N-])C1 2020899749 LFSIFLKPCXVVAH-SNVBAGLBSA-N 361.424 0.837 10 10 FCCE OC[C@@H]1C[C@H](NCc2cc(Br)cc(F)c2O)[C@@H](O)[C@H]1O 2177947488 FZBUCDBLNYJBSQ-CETXONJKSA-N 350.184 0.486 10 10 FCCE COc1ccc(N2CCN(C(=O)N[C@@H]3CCS(=O)(=O)C3)CC2)cc1 53507347 FREWGKBBJBQLQZ-CYBMUJFWSA-N 353.444 0.714 10 10 FCCE CN(CCCO)C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 283799964 HRWXMBMRVFHGAU-UHFFFAOYSA-N 353.394 0.119 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCOCC3CC3)C2)cc1 827549742 TUBAXTASUZLQIV-OAHLLOKOSA-N 361.442 0.933 10 10 FCCE C[C@H]1C(=O)N(C)CN1C(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 843252185 GXKLPFLPSWBEMH-AWEZNQCLSA-N 374.441 0.128 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N1CC2CC1(CN)C2 852917413 JPWIXLGTUPJZQE-UHFFFAOYSA-N 372.469 0.431 10 10 FCCE CNCCOCCN(C)CC(=O)N1CCN(c2ccc(OC)cc2)CC1 863551373 JSNZHTBFPBQCJE-UHFFFAOYSA-N 364.490 0.512 10 10 FCCE CN1C[C@H](O)C[C@@]1(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 909856535 NQCQPRPLNGIJRA-ACJLOTCBSA-N 369.412 0.873 10 10 FCCE Cn1cc(/C=C/C(=O)N2C[C@H](CO)Cc3cccc(F)c32)c(=O)n(C)c1=O 911696279 LOZHZEBGXDGFEP-NNNHXZLVSA-N 373.384 0.434 10 10 FCCE O=S1(=O)CCN(Cc2ccc(N3CCOCC3)cc2)[C@@H]2CCOC[C@@H]21 930701937 WVIPRWPAPWRAKT-MSOLQXFVSA-N 366.483 0.911 10 10 FCCE COC(=O)c1cc(OCC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1N(C)C 1189968728 YIZGVTNIZIUOIX-NSHDSACASA-N 370.427 0.221 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)NCc1nnc2n1CCNC2=O 1246797463 ASBBTSZPVRSSBY-UHFFFAOYSA-N 358.402 0.849 10 10 FCCE COc1cc(N2CCN(C(=O)C3(O)COC3)CC2)cc(OC)c1OC 1611227901 RXLPBIYLOGJYKU-UHFFFAOYSA-N 352.387 0.122 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCNC(=O)CO 1637247215 ILYKIJUWMOJBGJ-UHFFFAOYSA-N 358.778 0.046 10 10 FCCE Cn1c(O)nc(NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1=O 1643193391 CXWIJDDZAPWXTC-UHFFFAOYSA-N 357.414 0.800 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(OCCO)nc2)c1 1647918107 MRNQTSIDQXKHRY-UHFFFAOYSA-N 367.383 0.782 10 10 FCCE COc1ccc(O)c(CNC[C@@H]2[C@@H](O)[C@H](O)CN2C(=O)OC(C)(C)C)c1 2225623613 QTGOCJQNPHMYHX-FVQBIDKESA-N 368.430 0.832 10 10 FCCE CCOC(=O)C[C@@H](O)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 773980010 RWOJGBGNDXKMPX-QGZVFWFLSA-N 364.442 0.826 10 10 FCCE CS(=O)(=O)N1CCC(CS(=O)(=O)NCc2ccccc2O)CC1 795111491 IWEBTYXWZRFURU-UHFFFAOYSA-N 362.473 0.483 10 10 FCCE COc1ccc(N2CCN(C(=O)COC(=O)c3cccnn3)CC2)cc1 860265328 OXPUPFLQGOUFCD-UHFFFAOYSA-N 356.382 0.991 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCc3nc(C)no3)C2)cc1 1328005057 ZRJFCHVNUWCJDM-ZDUSSCGKSA-N 373.413 0.440 10 10 FCCE Cn1ncc(CCC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)n1 1626094335 AFGDABXKGFOGBX-UHFFFAOYSA-N 370.457 0.766 10 10 FCCE COc1ccc(CNC(=O)NCCS(=O)(=O)C2CCOCC2)c(O)c1 1672892423 GJFHZAMKZHRGQP-UHFFFAOYSA-N 372.443 0.794 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc(O)nc(O)c2)[C@H](O)C1 2052705862 NDRPJWCUSXBXHM-WDEREUQCSA-N 353.375 0.593 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CCC(CN=[N+]=[N-])CC1 2332922706 GDFURQWESNQCCD-FRRDWIJNSA-N 369.422 0.876 10 10 FCCE COCCN1CCCN(Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1=O 365818557 SWHXXYWHHAZZMC-UHFFFAOYSA-N 353.375 0.990 10 10 FCCE COc1cc(N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)ncn1 763384486 RRRVSJZQFSDPQN-OAHLLOKOSA-N 358.398 0.939 10 10 FCCE O=C1NCC[C@H]1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 831560502 ACCUYODBJZYPKQ-GOSISDBHSA-N 356.470 0.971 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H]1CN(C)C(=O)N1 831706230 BTNSTFAFUZJBKO-LLVKDONJSA-N 355.778 0.571 10 10 FCCE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@](O)(C(N)=O)C2)cc1 861219399 VAXCBKNCZKHMKQ-HXUWFJFHSA-N 369.421 0.898 10 10 FCCE COc1ccc(N2CCN(CCNC[C@H](O)CC(C)(C)O)CC2)cc1 872198975 FKKBJFPADLCVPC-QGZVFWFLSA-N 351.491 0.929 10 10 FCCE COC(=O)[C@@H]1C[C@H]1[C@@H]1NC(=O)N(Cc2ccc(N3CCOCC3)cc2)C1=O 924483898 RJZVUOQQTBWUGW-OAGGEKHMSA-N 373.409 0.753 10 10 FCCE CN(C)c1ccc(CN(C(=O)C(=O)N2CCC[C@@](N)(CO)C2)C2CC2)cc1 926295614 GZMMDIDVPVFKAR-FQEVSTJZSA-N 374.485 0.556 10 10 FCCE O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccn(CCN2CCNC2=O)n1 1597084827 YESDOZYSJLSGPY-DUXPYHPUSA-N 357.370 0.971 10 10 FCCE COc1ccc(Br)c(CN[C@H](C)CS(N)(=O)=O)c1O 2227750543 KFMPGSBUHSFLQE-SSDOTTSWSA-N 353.238 0.930 10 10 FCCE CN(C)CCNC=C1C(=O)NC(=S)N(Cc2ccc(F)cc2)C1=O 2296125676 MUOJOBMIRTXASH-UHFFFAOYSA-N 350.419 0.604 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(C2CC2)CC1 288722519 ZKQQQECCBLGADZ-UHFFFAOYSA-N 354.454 0.986 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCc3cnn[nH]3)CC2)cc1 778312107 VTXZBBQPOBOLTB-VOTSOKGWSA-N 370.413 0.335 10 10 FCCE COc1ccc(N2CC[C@H](Nc3ccc(C(=O)NCCO)nn3)C2)cc1 853758802 KPIRFMRJPUJVIL-ZDUSSCGKSA-N 357.414 0.898 10 10 FCCE Cc1noc(CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)n1 1321829429 PDHVBCMPULUOTG-UHFFFAOYSA-N 357.414 0.953 10 10 FCCE CC(=O)OC[C@@H]1O[C@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O 16123742 NHNYHKRWHCWHAJ-NDKCEZKHSA-N 373.318 0.380 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@]3(CCCOC3)C2)c1 285764058 BNXGHMDEOMYNIJ-MRXNPFEDSA-N 370.427 0.785 10 10 FCCE CC(=O)N1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)[C@H](C)C1 288432860 DPLNRYFHRXJKKJ-OAHLLOKOSA-N 370.453 0.758 10 10 FCCE CNS(=O)(=O)c1cc(NS(=O)(=O)C[C@H](OC)C2CC2)ccc1O 842589078 QTNKCGUIFDNWHZ-LBPRGKRZSA-N 364.445 0.467 10 10 FCCE COc1ccc(N2CCN(C(=O)c3ccc4c(c3)B(O)OC4)CC2)cc1 863875930 IATYJMDHAVAFBY-UHFFFAOYSA-N 352.199 0.875 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1539302554 SHNVLUICEZTYGK-UHFFFAOYSA-N 369.487 0.763 10 10 FCCE CS(=O)(=O)N1CC[C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1623065737 GNLKOOVXHVXPMI-SNVBAGLBSA-N 353.404 0.860 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C(=O)NCC3CC3)cc2)CC1 1634974313 OEDMNYZQDRFNJN-UHFFFAOYSA-N 358.442 0.531 10 10 FCCE NC[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H]1C(F)(F)F 1119066067 GKTUDRGANLIBFO-ZYHUDNBSSA-N 357.332 0.830 10 10 FCCE CCOC(=O)N[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1329782778 OYMGSDXDRWRYJA-CYBMUJFWSA-N 361.398 0.972 10 10 FCCE COc1ccc(CNC(=O)N[C@@H]2CCN(c3cc(O)ncn3)C2)c(O)c1 1565441347 CLKRKWXHIUXXQC-GFCCVEGCSA-N 359.386 0.975 10 10 FCCE Cn1c(O)nnc1CNC(=O)NCc1cccc(Br)c1O 1684772563 KVYWESIEMFODFK-UHFFFAOYSA-N 356.180 0.988 10 10 FCCE C[C@H](N)CNC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2080869099 JBQCWRPEJZFADB-JQWIXIFHSA-N 353.419 0.997 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNCc1ccc(O)cc1O 2218621906 ZQCHSZGULYEAPK-VHDGCEQUSA-N 354.403 0.529 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@H]1C(=O)NCc1ccccc1O 2331510725 CHYVIMHGATZSRZ-QLFBSQMISA-N 366.414 0.740 10 10 FCCE CN(CCCCO)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 820987111 YBSSAKLBPQXIBJ-UHFFFAOYSA-N 369.487 0.835 10 10 FCCE NCCN(CCO)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 843367375 FDJGJUHATXHPJE-UHFFFAOYSA-N 367.405 0.654 10 10 FCCE CCN1OC[C@H](N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)C1=O 851936635 SJIJUPQKAXEXIW-AWEZNQCLSA-N 365.430 0.997 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCC(N4CC[C@H](O)C4)CC3)cc2N1 853966100 OSCBJHQJROHZTB-LBPRGKRZSA-N 362.386 0.961 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3CC(F)(F)C[C@@H]3CO)ccc21 1257536510 OVBCLWYSYCZSFV-CQSZACIVSA-N 367.396 0.914 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@H](NC(N)=O)C2)cc1 1340616822 MVJIZOSQTQLOJG-AWEZNQCLSA-N 361.446 0.418 10 10 FCCE O=C(C(=O)N1C[C@@H](CO)[C@H](C(F)(F)F)C1)N1Cc2cccc(O)c2C1 1348677159 CDJYVTMJDWXUFW-CMPLNLGQSA-N 358.316 0.864 10 10 FCCE CCS(=O)(=O)CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1584507711 RLRMEBTZOLSSEF-UHFFFAOYSA-N 367.471 0.439 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@H]3C[C@@H](CO)C3)cc2)CC1 1687632030 JXAYKJQNONCSGI-FZNQNYSPSA-N 360.458 0.958 10 10 FCCE CN1CCN(c2ccc(/C=C3/C(=O)NC(=O)N=C3O)cc2[N+](=O)[O-])CC1 59465201 ZIKITFLBVGBCSI-UHFFFAOYSA-N 359.342 0.936 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)Cn3ccnn3)CC2)cc1 175088368 CLJGWHPQGRSCFH-UHFFFAOYSA-N 358.446 0.615 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CC(=O)N(C)[C@H](C)C3)CC2)cc1 282204584 OCSFIWXVWJAHKP-OAHLLOKOSA-N 360.458 0.506 10 10 FCCE COC(=O)[C@H]1C[C@H](O)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 826816281 DVSANTALGMHVKQ-IUCAKERBSA-N 351.315 0.286 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)N2CC[C@H](Nc3ncccn3)C2)cc1 843261468 KOBCKTOTGLGLKB-HNNXBMFYSA-N 354.414 0.431 10 10 FCCE NCC12CC(CN1C(=O)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C2 852915522 HQFGCWYCCTZKEG-CZDRUDQFSA-N 373.453 0.850 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C3(n4cnnn4)CCOCC3)C2)cc1 855227566 XWZCCTVMOWJBFN-CQSZACIVSA-N 372.429 0.583 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@H]3[C@H]2CCCN3CCO)cc1 929236830 DMIOYSUEKDRQAE-ZWKOTPCHSA-N 374.485 0.426 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCN2C(=O)OCC[C@@H]2C1 1117974484 ZXDCBAWHWLDURY-MRXNPFEDSA-N 374.441 0.764 10 10 FCCE CCN(OC)C(=O)CNC(=O)C(=O)NCCCSc1nccs1 1326125889 DEZKHNMXBITJNH-UHFFFAOYSA-N 360.461 0.268 10 10 FCCE C[C@H]1CN([C@@H](C)CNC(=O)C(=O)N(C)Cc2ccccc2O)C[C@@H](C)O1 1327682459 NEIFRZATSHODLE-SOUVJXGZSA-N 363.458 0.965 10 10 FCCE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCc1ccc(O)cc1O 1638358217 XQPQTLVZFBLVHK-UHFFFAOYSA-N 351.403 0.524 10 10 FCCE Cc1cccc(CNC(=O)[C@@H]2[C@H](O)[C@H](O)CN2C(=O)OC(C)(C)C)c1O 2139763864 KWECPEJGFNWCCI-VNHYZAJKSA-N 366.414 0.658 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H](C)Cn1cncn1 286123128 OQPLIXPCERURSU-AWEZNQCLSA-N 358.446 0.898 10 10 FCCE C[C@@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)N1CCCCC1=O 788617667 YSDQKJIGOXHWKW-NSHDSACASA-N 369.443 0.895 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H](CO)NC(=O)c1cccc(Br)c1 808508997 HDIYIFSJMBPKOL-LLVKDONJSA-N 372.171 0.241 10 10 FCCE C[C@H]1CN(CCO)[C@H](C)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 841457849 WKIOJRFMFZUUTL-NEPJUHHUSA-N 371.459 0.291 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNC[C@@H]3CCC[C@H]3O)CC2)cc1 843070738 ZMRAMJUCDBQJJP-ILZDJORESA-N 363.502 0.929 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)Cn3nc4n(c3=O)CCCC4)C2)cc1 855227607 YRNQSEJNVHQLDZ-AWEZNQCLSA-N 371.441 0.785 10 10 FCCE COC(=O)[C@@H]1C[C@H](N2C(=O)CNC2=O)CN1Cc1ccc(N(C)C)cc1 856784140 SAKZNZNMXWSULZ-GJZGRUSLSA-N 360.414 0.420 10 10 FCCE CC(C)NS(=O)(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1142021607 KLORUQIJOSYJLO-UHFFFAOYSA-N 357.432 0.027 10 10 FCCE CS(=O)(=O)CCC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1538131586 DAKZYKRSYOOFPY-UHFFFAOYSA-N 367.471 0.439 10 10 FCCE COc1ccc(N2CCN(C(=O)CCn3nc(O)ccc3=O)CC2)cc1 1873831630 XZTGUTZARNEHSI-UHFFFAOYSA-N 358.398 0.696 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@H](C(=O)C(=O)C[C@H]3C[C@H](N)C3)O[C@H]2C1 2265036389 DYWXGOTZDPCYTE-IXDBCEGASA-N 368.430 0.655 10 10 FCCE CN1C[C@@H](NC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCC1=O 284290731 UGZMPDNMJJVDLK-HNNXBMFYSA-N 358.442 0.640 10 10 FCCE CN(C)S(=O)(=O)N1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 811789088 QXGFSCKRVXVONI-HNNXBMFYSA-N 371.459 0.132 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCO[C@H]([C@@H](C)O)C2)cc1 817705857 MEXRINZOUJMGAT-PBHICJAKSA-N 363.458 0.757 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H]3C[C@@](C)(O)C3)CC2)cc1 841448304 FKIVUKAHQCKDJP-DWQNUVFYSA-N 373.453 0.930 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3CC[C@H](N)[C@@H]3C)CC2)cc1 841749079 AALKAJJXFUPRHX-YJBOKZPZSA-N 361.490 0.948 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCS(=O)(=O)CC3)C2)cc1 849416902 YXFNSDJIMVEIDF-ZDUSSCGKSA-N 353.444 0.714 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CCCNC3)C2)cc1 851687909 KVZMBXLUZJMBRD-HUUCEWRRSA-N 360.458 0.506 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)c3cn(C)c(=O)n(C)c3=O)C2)cc1 855232042 QBILPALNEBTVBG-GFCCVEGCSA-N 358.398 0.101 10 10 FCCE COC[C@]1(C)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CCO1 863829627 NUZLUEKXUNJOJX-HNNXBMFYSA-N 358.416 0.641 10 10 FCCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2CCOC[C@]2(CO)C1 1124054072 WIHPDAUCZJZDEB-QGZVFWFLSA-N 364.423 0.832 10 10 FCCE COc1cccc(CNC(=O)NCc2nc(O)c3c(n2)CCOC3)c1O 1235542270 BUSAVZKHHGZSKL-UHFFFAOYSA-N 360.370 0.969 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC[C@]23CCOC3)cc1 1326576517 LCISRMFNRBNPTB-LJQANCHMSA-N 361.442 0.981 10 10 FCCE Cn1cc(O)c(=O)cc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1334528789 BOCZDCQNRPXYNZ-UHFFFAOYSA-N 367.383 0.098 10 10 FCCE O=C(CCN1C(=O)CSC1=S)N1CCN(c2ccccn2)CC1 1865765720 IJUJZIHVDGYSPE-UHFFFAOYSA-N 350.469 0.981 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(S(N)(=O)=O)cn1 539529921 GHOZXGMQHSLZES-UHFFFAOYSA-N 362.411 0.834 10 10 FCCE CN(C[C@H]1CCS(=O)(=O)C1)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 761907824 NGGDKGVHIQRCGQ-SECBINFHSA-N 355.372 0.797 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1CCN=C2C1=NNN2C 816826035 UUXDANOURHLHOG-INIZCTEOSA-N 370.457 0.706 10 10 FCCE C[C@@H]1CCNC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 842190660 GDKDRSDMNKFYPQ-PBHICJAKSA-N 360.458 0.254 10 10 FCCE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C1CS(=O)(=O)C1 865953005 AFPRLYWMPDTSTM-UHFFFAOYSA-N 352.456 0.556 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@H]2C(=O)OC[C@H]2C1 1348147261 YISHCDCHOAQYAH-GDBMZVCRSA-N 359.426 0.733 10 10 FCCE CS(=O)(=O)N[C@@H]1CCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 93531093 GDPYDQLPBVUHGM-CQSZACIVSA-N 357.451 0.786 10 10 FCCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCO[C@@]2(CCOC2)C1 283887839 FSUYYACDOWZXQD-FQEVSTJZSA-N 373.453 0.921 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3ccc(=O)[nH]n3)CC2)cc1 299489735 FVVXLXZPLCRBCH-UHFFFAOYSA-N 357.414 0.331 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)Cn3ccnc3)C2)cc1 827190224 SGEVAKJZADHJIF-GJZGRUSLSA-N 371.441 0.792 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N[C@@H]3CNCC[C@H]3C)CC2)cc1 842186702 JHFPLTHCAYMEDY-RDTXWAMCSA-N 374.485 0.894 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@]2(O)C[C@H]3C=C[C@H]2C3)c1 855751592 NXFSVANXJDSFAI-MMPTUQATSA-N 352.412 0.821 10 10 FCCE CCS(=O)(=O)C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1119015125 UCNMRLHZGVFQPM-UHFFFAOYSA-N 366.439 0.660 10 10 FCCE CN1CCN(c2ccc(CNC(=O)N[C@@H](CO)c3ncc[nH]3)cc2)CC1 1684878324 PDAWQQQJORCREQ-INIZCTEOSA-N 358.446 0.694 10 10 FCCE O=S1(=O)C[C@@H](c2cc(I)ccc2O)NCCN1 1952456983 HTMAHQYBHHVYPO-VIFPVBQESA-N 368.196 0.561 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](NC(=O)c2cc(O)nc(O)c2)C1 2063326980 VBPXDRBYCUYAKE-WDEREUQCSA-N 353.375 0.593 10 10 FCCE C[C@H](CN)NC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2080880439 KTEXUYQFILREFI-PWSUYJOCSA-N 353.419 0.997 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNC(=O)c2cc(O)c(O)c(O)c2)C1 2132351471 XOGXCOOLHCQJIV-GXFFZTMASA-N 368.386 0.761 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)N2CCCn3ncc(N)c32)=C[C@@H]1O 2136281355 TXHKAVGTNGZUKL-OLZOCXBDSA-N 363.418 0.786 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)N1CCC(CN=[N+]=[N-])CC1 2136334943 GDFURQWESNQCCD-AVGNSLFASA-N 369.422 0.876 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCCNC(=O)[C@H]3C)CC2)cc1 189331083 GUTOKDNCOVVDJV-OAHLLOKOSA-N 360.458 0.554 10 10 FCCE CC(=O)O[C@@H]1[C@@H](C(=O)O)O[C@@](C)(N=[N+]=[N-])[C@H](OC(C)=O)[C@H]1OC(C)=O 220060334 QCFRIBYRTMZITM-HKLXJQGRSA-N 359.291 0.291 10 10 FCCE C[C@H](NC(=O)C(=O)N1CCO[C@]2(CCOC2)C1)c1ccc(N(C)C)cc1 807673741 YHATWDVNGAXCMK-IFXJQAMLSA-N 361.442 0.948 10 10 FCCE Cn1cnc(NC(=O)C(=O)NCc2cc(Br)ccc2O)n1 815647544 NHGQALQMCWUCMY-UHFFFAOYSA-N 354.164 0.538 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@@H]1CNCC[C@H]1C)c1ccc(N2CCOCC2)cc1 842123539 OTAVBHNCLABRAB-RVKKMQEKSA-N 374.485 0.815 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCNC[C@@H]3C)C2)cc1 851688625 FDIQBKHONWVDQT-ZQIUZPCESA-N 360.458 0.504 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CCN(C(=O)N3CCNCC3)CC2)cc1 861549506 JNKHHGGWDIVWCV-UHFFFAOYSA-N 374.489 0.605 10 10 FCCE CCN1CC[C@H]1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 897565650 QKTPIXBGDJFEBM-YJBOKZPZSA-N 374.485 0.911 10 10 FCCE O=C(COc1nsnc1N1CCOCC1)NCc1c(O)cccc1F 928706859 XPHRZROSBDSHCK-UHFFFAOYSA-N 368.390 0.915 10 10 FCCE Cc1cc(C)nc(-n2[nH]c(C(=O)NCc3cc(O)ccc3O)cc2=O)n1 1471661206 JPFPCXLNFMPURI-UHFFFAOYSA-N 355.354 0.914 10 10 FCCE O=C(Cn1ncn2nccc2c1=O)NCc1ccc2cccnc2c1O 1570533592 JFAQKQCOHFTDIH-UHFFFAOYSA-N 350.338 0.461 10 10 FCCE COc1ccc(CN[C@@H](CO)CNC(=O)[C@H]2CC[C@@H](C(N)=O)C2)cc1C 1676582970 AHOHZWQCKCIAJT-OWCLPIDISA-N 363.458 0.472 10 10 FCCE [N-]=[N+]=NCCOCCN(CCOCCN=[N+]=[N-])C(=O)CCOCCN 2049382331 FVVJDYQHXWLKCG-UHFFFAOYSA-N 358.403 0.834 10 10 FCCE C[C@@H]1CO[C@H](CO)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 167230142 WCYXLNDCHUNNLS-UJVNDKKSSA-N 356.220 0.987 10 10 FCCE CN(C)S(=O)(=O)CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 752424920 GKVIXZWLECBXPM-UHFFFAOYSA-N 369.487 0.403 10 10 FCCE C[C@@H](CNC(=O)NCc1ccc(N2CCSCC2)cc1)S(N)(=O)=O 799887386 WKTLSVOVOXJJGC-LBPRGKRZSA-N 372.516 0.716 10 10 FCCE COc1ccc(O)c(CNC(=O)N[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)c1 800706503 DRSOAPWRXKXPEE-BXUZGUMPSA-N 371.459 0.918 10 10 FCCE CNC(=O)[C@@H]1CCN(C(=O)C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C1 817862028 QFULOCAZQNVUIN-GDBMZVCRSA-N 374.485 0.703 10 10 FCCE C[C@@H](NC(=O)[C@@H]1CCN=C2C1=NNN2C)c1ccc(N2CCOCC2)cc1 823834361 BHWWTLVEZULZSA-CZUORRHYSA-N 370.457 0.925 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H]3CCN(C4CC4)C3)C2)cc1 827489134 NXFBKTXMYWNHFZ-LSDHHAIUSA-N 372.469 0.743 10 10 FCCE COc1ccc(N2CC[C@@H](NS(=O)(=O)N3CCCOCC3)C2)cc1 849417362 PPFLJHGQGFJZJC-CQSZACIVSA-N 355.460 0.831 10 10 FCCE COC(=O)N(C)CCN(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 855886899 DQQOTLHZCOJEGB-UHFFFAOYSA-N 359.404 0.534 10 10 FCCE O=C(NC[C@@]1(O)CCS(=O)(=O)C1)c1cc2cc(O)c(O)cc2s1 1449703960 QPKDPZCJPSMVNC-AWEZNQCLSA-N 357.409 0.592 10 10 FCCE CNS(=O)(=O)NCC(=O)Nc1c(-c2ccccn2)nc2ccccn12 1629107444 JDCPRIIVFWSATB-UHFFFAOYSA-N 360.399 0.389 10 10 FCCE CC(C)(C)OC(=O)N1CCO[C@@H]2C[C@H](COc3nnc(=N)[nH]n3)C[C@@H]21 2219022134 UFWJMLLZBIVTQJ-OUAUKWLOSA-N 352.395 0.472 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCN2CCOC2=O)c1 264002307 GFZVJYGPUWSWNE-UHFFFAOYSA-N 357.388 0.336 10 10 FCCE CCN(CCNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)C1CC1 827812108 CHHIAHLORRWLOH-HNNXBMFYSA-N 374.485 0.991 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCC[C@H](N)C3)C2)cc1 851688338 XGHRFRKYGKJZRV-KKUMJFAQSA-N 360.458 0.776 10 10 FCCE C[C@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)S(C)(=O)=O 1598008633 DTWDRQXBQWDPDQ-GFCCVEGCSA-N 367.471 0.438 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)N1CC[C@H](N=[N+]=[N-])C1 2299124234 VCIWCQXBRCCHGE-UWVGGRQHSA-N 361.424 0.836 10 10 FCCE COC(=O)C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 327162576 SEUNZEVGGHNYOZ-SECBINFHSA-N 351.315 0.694 10 10 FCCE COCCN(C[C@@H](O)CN1CCOCC1)c1ccc(OC)c(OC)c1 749351147 HDRIGMXRZFTKBD-INIZCTEOSA-N 354.447 0.850 10 10 FCCE CN1CCCc2cc(CNC(=O)C3(n4cnnn4)CCOCC3)ccc21 824676854 TYBXBNLFLORCEW-UHFFFAOYSA-N 356.430 0.878 10 10 FCCE COC(=O)[C@H](CCC1OCCO1)NC(=O)/C=C/c1ccc(O)c(O)c1 1152646337 XKSKTJBOSBXHMM-UXONFWTHSA-N 351.355 0.922 10 10 FCCE O=C1CCCN1C[C@H]1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1329440616 BUANITYCEOOZPS-CYBMUJFWSA-N 357.410 0.705 10 10 FCCE N[C@@H]1CCO[C@@H]([C@@H]2CCCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)C2)C1 1329504630 NQYMCJRTMIOGJO-IIDMSEBBSA-N 373.453 0.979 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCCc3nn[nH]n3)cc2)C1 1626338832 JHVQPPVBAQZEGL-CQSZACIVSA-N 371.445 0.541 10 10 FCCE CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C[C@@H]1O)c1ccc(N)cc1 1890108342 MEXQQMLODYVQBV-KSSFIOAISA-N 365.430 0.964 10 10 FCCE CC(C)(C)OC(=O)NCCN(CCO)C(=O)c1cc(O)c(O)c(O)c1 2068624719 RVYXASNNTLXJJU-UHFFFAOYSA-N 356.375 0.763 10 10 FCCE CN(CC1(O)CN(C(=O)OC(C)(C)C)C1)C(=O)c1cc(O)c(O)c(O)c1 2271714058 KDMAZIJJMXSUNY-UHFFFAOYSA-N 368.386 0.857 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2312333157 ABZKFFOSWSEDPH-VSSNEEPJSA-N 355.395 0.675 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H]3CCC[C@H]3O)CC2)cc1 843119356 ZMRAMJUCDBQJJP-XKGZKEIXSA-N 363.502 0.929 10 10 FCCE N[C@]1(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CC1(F)F 867983542 GFTUALIPKIDTLR-AWEZNQCLSA-N 359.398 0.274 10 10 FCCE CN1CCN(c2ccc(CN[C@H]3C(=O)NCC34CCOCC4)cc2)CC1 895773057 XYWLGUNYSWWVRF-SFHVURJKSA-N 358.486 0.823 10 10 FCCE COc1cccc(CNC(=O)c2ccc(-n3[nH]c(O)nc3=O)cc2)c1O 1465993481 PTRKRPQVOVGELD-UHFFFAOYSA-N 356.338 0.910 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](CO)[C@@H](CCO)C3)C2)cc1 1519454739 JEMRWQVNECKNOL-JYJNAYRXSA-N 363.458 0.906 10 10 FCCE COc1cc(C(=O)N[C@H](C)CCNC(=O)[C@@]23COC[C@@H]2C3)cc(OC)n1 1527590551 JWFSFBIKMWHMAH-YNKQFZHNSA-N 363.414 0.760 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1CCC(=O)NC1 1632355868 FCRXANHXVPSCHT-OLZOCXBDSA-N 364.398 0.605 10 10 FCCE COC(=O)/C=C\c1ccc(N2CCN(S(C)(=O)=O)CC2)c([N+](=O)[O-])c1 1772821462 CNBKYVJQZWWHQP-XQRVVYSFSA-N 369.399 0.863 10 10 FCCE Cn1c2c(c(=O)[nH]c1=O)[C@H](c1cc(Br)ccc1O)NC(=O)N2 109808352 DOPDAHZMTVNJMG-VIFPVBQESA-N 367.159 0.766 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]2c2nc(N)n(C)n2)cc1 298485919 JJJHXPVGNBYMCX-OAHLLOKOSA-N 357.462 0.917 10 10 FCCE NC(=O)CNC(=S)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768296251 MEURZILCNGYRDR-UHFFFAOYSA-N 361.515 0.668 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN4CCOC[C@H]4C3)C2)cc1 854299834 SBWHGIUHVVEYQP-NVXWUHKLSA-N 360.458 1.000 10 10 FCCE CCCNC(=O)CN(C)C(=O)COc1ccc(N(C)C)c(C(=O)OC)c1 865396305 OHLYHUMPLZKOIL-UHFFFAOYSA-N 365.430 0.903 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@@]2(OCCO)CCOC2)cc1F 1328024356 PRNHDJRVMHYJDO-KRWDZBQOSA-N 355.410 0.859 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C[C@H]3CCC(=O)NC3)CC2)cc1 1631443358 ZEQPBWIXHIEYIB-MRXNPFEDSA-N 374.485 0.850 10 10 FCCE CN[C@H]1C(=O)Nc2cc(N3CCNC(=O)[C@@H]3C)c(Br)cc21 221247877 XRJZCWBRWLVHFB-JVXZTZIISA-N 353.220 0.986 10 10 FCCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N[C@H]1CCS(=O)(=O)C1 255049206 JCVVXLGJNQIBQF-BYPUDFOVSA-N 350.440 0.840 10 10 FCCE Cn1cc(N2CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC2=O)cn1 372013443 MUGKPUFRQDCWMG-UHFFFAOYSA-N 372.341 0.512 10 10 FCCE CCOC(=O)[C@H]1CCCN1S(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 391768109 BLLWJQOCSSGXCB-LLVKDONJSA-N 358.372 0.775 10 10 FCCE Cn1cc(C(=O)NCc2cc(Br)ccc2O)c(=O)n(C)c1=O 804736006 JUNDMWJRDLXMSG-UHFFFAOYSA-N 368.187 0.482 10 10 FCCE O=C1N[C@@H](CC2OCCO2)C(=O)N1Cc1ccc(N2CCOCC2)cc1 924484121 UJRQQDXOJXQZJA-HNNXBMFYSA-N 361.398 0.707 10 10 FCCE CN1CCN(c2ccc(CN3C(=O)N[C@@H](c4ccnn4C)C3=O)cc2)CC1 925079558 KRLLAJSOHIGZCD-KRWDZBQOSA-N 368.441 0.965 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CN1C(=O)CCC1=O 1137816219 DUSCMYHVGAZUFZ-UHFFFAOYSA-N 368.773 0.696 10 10 FCCE O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NCc1c(O)cccc1O 1178912933 ZXVOTKMUELTJJW-XOUADPBQSA-N 360.366 0.267 10 10 FCCE COc1ccc(CNC[C@H](O)CNC(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)cc1C 1268314662 OHMVSTFBIRULQI-HRVGUFCPSA-N 360.454 0.994 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)C1 2132348907 VIYPBOHQPGJEAS-MFKMUULPSA-N 368.386 0.904 10 10 FCCE CC(C)N1C(=O)NC(=O)C(=CN[C@@H](Cc2ccc(O)cc2)C(=O)O)C1=O 2296564606 XRKUGQLOJKMHRW-ZDUSSCGKSA-N 361.354 0.348 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNC(=O)Nc1ccc(N)cc1 2333604565 HBIXHBVOBUAQIX-MCIONIFRSA-N 366.418 0.731 10 10 FCCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 3604413 QPLWMBAYFYUFLE-KBPBESRZSA-N 360.366 0.485 10 10 FCCE CC(=O)N1N=C(c2c(O)[nH]c(=O)n(C)c2=O)C[C@H]1c1ccc(N(C)C)cc1 101765926 GNMPOBVQCFTYMP-AWEZNQCLSA-N 371.397 0.543 10 10 FCCE CN(CCCO)C(=O)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 297977634 WUTJWZHXRDIHMA-HNNXBMFYSA-N 350.415 0.741 10 10 FCCE CC(=O)OC[C@H]1O[C@@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O 616625457 NHNYHKRWHCWHAJ-XGFWRYKXSA-N 373.318 0.380 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CCN(C4CC4)CC3)CC2)cc1 754020125 POTFAMGVXNIFIO-HXUWFJFHSA-N 374.529 0.958 10 10 FCCE COc1ccc(CNC(=O)C(=O)Nc2cnn(CCN(C)C)c2)c(O)c1 797387485 KBQCPUCNRQYBCE-UHFFFAOYSA-N 361.402 0.414 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)COC3(C)CNC3)CC2)cc1 844190651 OIFMSHSJVIPSEC-UHFFFAOYSA-N 362.474 0.312 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@]2(CNC(=O)C2)C1 1261303666 VSEMKRSXXRDCFX-FQEVSTJZSA-N 372.469 0.840 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCCCS(N)(=O)=O)C2)cc1 1312936358 HJCJEPHUVMMATB-LBPRGKRZSA-N 356.448 0.252 10 10 FCCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCO[C@@]2(CCS(=O)(=O)C2)C1 1326349036 YCLHWOXAGKCRRF-OUMXJLHTSA-N 353.396 0.527 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3[C@H]4CNCC[C@H]43)cc2)CC1 1343647291 HMGCPTUJBZYTCE-CEXWTWQISA-N 356.470 0.827 10 10 FCCE O=C(Cc1c(O)ncnc1O)NCc1ccc(N2CCC(CO)CC2)cc1 1465395426 YMSMOBASSSBJDY-UHFFFAOYSA-N 372.425 0.955 10 10 FCCE COc1cc(N2CCN(CCS(N)(=O)=O)CC2)c([N+](=O)[O-])cc1OC 1472705854 JVAVXJQYQSFMAG-UHFFFAOYSA-N 374.419 0.023 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CN1CCCNC1=O 1631531651 XSPDYDFJJVTXLH-UHFFFAOYSA-N 369.805 0.963 10 10 FCCE C[C@@H](NC(=O)NCCCS(N)(=O)=O)c1ccc(N2CCOCC2)cc1 1674000500 GQPKWJVVFPWDGU-CYBMUJFWSA-N 370.475 0.562 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)C[C@@H]1CC(=O)N1CC(N=[N+]=[N-])C1 2060616025 VNKUNYOZNVPZDF-NSHDSACASA-N 373.435 0.932 10 10 FCCE COCCN1CCCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1=O 190793174 PVSNCSSPKZOKBI-UHFFFAOYSA-N 362.474 0.550 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N3CCC(CN)CC3)CC2)cc1 817934032 AJMCDEMPFHFOOB-UHFFFAOYSA-N 374.485 0.931 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCN(C2CC2)C(=O)C1 839219896 WPWVCHVIDHNWRL-UHFFFAOYSA-N 358.442 0.544 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@]34CNC[C@H]3COC4)CC2)cc1 846674818 UZVUBGJIFCOFTP-JXFKEZNVSA-N 374.485 0.169 10 10 FCCE C[C@@H]1[C@H](O)CCCN1C(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1332284626 HXGWWIRPKVNPCA-CRAIPNDOSA-N 374.485 0.426 10 10 FCCE CCS(=O)(=O)C1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1627509240 COULVTJIGLKPSI-UHFFFAOYSA-N 362.429 0.023 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 1635890906 QEUJAVAPRXPKRA-UHFFFAOYSA-N 373.450 0.764 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)c3nccnc3N)cc2)CC1 1652068066 GVZQZYSSVXMCRQ-UHFFFAOYSA-N 354.414 0.691 10 10 FCCE [N-]=[N+]=NCCOCCOCCOCCOCCOCCNCCCO 2049382450 QVTMKPNWEOZQRR-UHFFFAOYSA-N 364.443 0.352 10 10 FCCE O=C(O)[C@H](NCc1c(O)cccc1Br)C1CS(=O)(=O)C1 2197525236 NDHUCWZNQJMKBS-LLVKDONJSA-N 364.217 0.742 10 10 FCCE COc1cccc(O)c1CNC[C@@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C 2225658227 JYBJMBLTZQCWHQ-IVMMDQJWSA-N 368.430 0.832 10 10 FCCE CN1CCCc2cc(CNC(=O)Cn3cnc4c(cnn4C)c3=O)ccc21 58769362 WYHSZQXJQNEOLX-UHFFFAOYSA-N 366.425 0.829 10 10 FCCE Cn1cc(/C=C/C(=O)N(CCC(N)=O)c2ccccc2)c(=O)n(C)c1=O 73260681 HIHRMLJUEOXMPA-CMDGGOBGSA-N 356.382 0.006 10 10 FCCE Cc1n[nH]c([C@H]2CN(CC(=O)NCc3ccc(N(C)C)cc3)CCO2)n1 173668458 PFBNNBSLMPYIII-MRXNPFEDSA-N 358.446 0.869 10 10 FCCE COc1ccc(N(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c(OC)c1 269822754 WHDGVZZILBPYGN-RMKNXTFCSA-N 359.382 0.777 10 10 FCCE COC(=O)[C@]1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CCSC1 271397650 JPQNYKRATLEZCC-AWEZNQCLSA-N 374.440 0.542 10 10 FCCE CNS(=O)(=O)[C@@H]1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 749901214 GEVLVRMTPBJZMJ-TXNVCOODSA-N 369.399 0.909 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN(C)CCCCO)CC2)cc1 788281611 MEQKRQMOJMPPGT-GOSISDBHSA-N 351.491 0.882 10 10 FCCE CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OCCN=[N+]=[N-])O[C@@H]1C 2081161038 SWFHDHBVUMLTMW-ZJLMQMBBSA-N 359.335 0.853 10 10 FCCE CCN1C(=O)C(=Cc2cn(CC(N)=O)c3ccccc23)C(=O)NC1=S 2297365406 POWDFKWLJUEDCW-UHFFFAOYSA-N 356.407 0.773 10 10 FCCE COc1cc(N2CCOCC2)ccc1C=C1C(=O)NC(=S)N(C)C1=O 2313656647 RJSXKQSPXRNBKK-UHFFFAOYSA-N 361.423 0.788 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCOC[C@@H]3CCO)CC2)cc1 762338765 PEYKYIHRTGUJBG-KRWDZBQOSA-N 363.458 0.427 10 10 FCCE COc1ccnc(N2CCN(Cc3cc4c(cc3O)OC[C@H]4O)CC2)n1 768444300 XEYPFOJAKQUQRP-OAHLLOKOSA-N 358.398 0.939 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)N3CCOC4(CNC4)C3)C2)cc1 818655954 SNRHJPFHFMYCEU-OAHLLOKOSA-N 360.458 0.905 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCn3ccnc3)C2)cc1 826666505 GSDHIVFMBOFCLP-CQSZACIVSA-N 357.414 0.403 10 10 FCCE COc1ccc(N2CCCN(C(=O)[C@H]3CN(C(C)=O)CCO3)CC2)cc1 930308890 BCQXREOBKVVALN-GOSISDBHSA-N 361.442 0.981 10 10 FCCE Nc1nonc1N=NN(CC(=O)Nc1ccc(F)cc1)c1nonc1N 1084061230 SHKAAVMCEHJWOQ-UHFFFAOYSA-N 362.285 0.900 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@@H]1NC(=O)NC1=O 1152401377 KZOKJQATWAWARW-JTQLQIEISA-N 369.761 0.145 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2C[C@H](S(C)(=O)=O)C2)cc1 1333761469 XWHVGNMOKCZUJU-MQMHXKEQSA-N 353.444 0.061 10 10 FCCE COCCn1cc(N2C[C@@H](C(=O)NCc3cccc(O)c3O)CC2=O)cn1 1593738805 AKEYAYSONPKJHV-ZDUSSCGKSA-N 374.397 0.610 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CCC(=O)NC1 1632355869 FCRXANHXVPSCHT-STQMWFEESA-N 364.398 0.605 10 10 FCCE CC(C)(C)OC(=O)NOCC(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)O 2123829043 VBWZBYMNWXUNSR-SNVBAGLBSA-N 370.358 0.666 10 10 FCCE CC(C)(C)OC(=O)N1CCN[C@H](CNC(=O)Cc2ccc(O)c(O)c2)C1 2140606928 MKWWQDWCGXPFQW-CYBMUJFWSA-N 365.430 0.965 10 10 FCCE O=C(O)CN1C(=O)C(=C2SC(N3CCOCC3)=NC2=O)c2ccccc21 2296725971 DPGNAFSBVBXWPH-UHFFFAOYSA-N 373.390 0.791 10 10 FCCE COc1ccc(N2CCN(C(=O)CC(=O)N3CCN(C=O)CC3)CC2)cc1 243821783 QVQAHVVZMBMJIH-UHFFFAOYSA-N 374.441 0.035 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CN1CC(=O)NC1=O 272205785 IBYMGCNECBOXCE-UHFFFAOYSA-N 369.761 0.099 10 10 FCCE CN(C)c1ccc([C@H](N)CNC(=O)CS(=O)(=O)NC(C)(C)C)cc1 832272973 KTFJAFHQXFOSAP-CQSZACIVSA-N 356.492 0.587 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2CN(C3CC3)C(=O)O2)c1 848367099 VLGBEDKKJUFYNF-LLVKDONJSA-N 369.399 0.477 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC3(N)CCCC3)C2)cc1 851689344 NCQMPSVHYJVSFG-AWEZNQCLSA-N 360.458 0.778 10 10 FCCE Cc1cc(C(=O)CN2C[C@H](O)C[C@H]2C(N)=O)c(C)n1-c1ccc(F)cn1 859517007 AQPLJRPUCUCEAN-HIFRSBDPSA-N 360.389 0.731 10 10 FCCE C[C@H]1CN([C@H](C)CNC(=O)C(=O)N(C)Cc2ccccc2O)C[C@@H](C)O1 1327682457 NEIFRZATSHODLE-KFWWJZLASA-N 363.458 0.965 10 10 FCCE CN1CCN(c2ccc(CNC(=O)NCc3cc(C(N)=O)no3)cc2)CC1 1469499723 CDZZGWJHONVZRY-UHFFFAOYSA-N 372.429 0.525 10 10 FCCE C[C@H]1C(=O)NCCN1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1471370000 OOXIRZHIXVHUID-ZDUSSCGKSA-N 373.457 0.418 10 10 FCCE CCS(=O)(=O)N1CCC(CNC(=O)Cc2ccc(O)c(O)c2)CC1 1556140422 CIEXFZMINVPJFQ-UHFFFAOYSA-N 356.444 0.818 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2312333768 ABZKFFOSWSEDPH-CSYMLDBXSA-N 355.395 0.675 10 10 FCCE CCN(CCN=[N+]=[N-])C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C[C@H]1O 2315992112 HNGPKMIFIVCIGP-IAQYHMDHSA-N 357.411 0.878 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCSC[C@@H]2CCO)cc1F 803663404 YHLTUTQHQFDYLJ-ZDUSSCGKSA-N 369.462 0.834 10 10 FCCE CC(=O)NCC(=O)NCC(=O)NCc1cc(Br)ccc1O 804739501 HOCUJIBJYGQEBT-UHFFFAOYSA-N 358.192 0.023 10 10 FCCE NCCCNC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 842138672 LAOFEPSKQMEJOA-UHFFFAOYSA-N 370.400 0.838 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCC3(CN)CC3)C2)cc1 851689611 RILARNQEVKPZAI-AWEZNQCLSA-N 360.458 0.635 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H]2CCc3nnn(C)c3C2)cc1F 929800444 FTRDKUQPAATJJW-GFCCVEGCSA-N 374.420 0.310 10 10 FCCE COC1(C(=O)NCc2ccc(N3CCSCC3)cc2)CS(=O)(=O)C1 1341235675 MAMNVIHFMZQTEN-UHFFFAOYSA-N 370.496 0.670 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2CN(C3CC3)C(=O)O2)cc1 1349877616 HQWWEEVMVUAQKG-OAHLLOKOSA-N 360.414 0.468 10 10 FCCE O=C(Cc1ccc(F)cc1)N[C@@H](CO)C(=O)NCc1ccc(O)cc1O 1469163649 RUUZECBRAHSPLZ-HNNXBMFYSA-N 362.357 0.573 10 10 FCCE COCCn1cc(N2C[C@H](C(=O)NCc3cccc(O)c3O)CC2=O)cn1 1593738803 AKEYAYSONPKJHV-CYBMUJFWSA-N 374.397 0.610 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(CNC(=O)c2cc(O)c(O)c(O)c2)C1 2132348621 OZTXWGQPUVRNKX-QGZVFWFLSA-N 368.386 0.905 10 10 FCCE CC1(C)O[C@@H]2[C@@H]3OC(C)(C)O[C@]3(COS(=O)(=O)N=[N+]=[N-])OC[C@H]2O1 28001596 ULLWHTAOFMDWSA-ARHDFHRDSA-N 365.364 0.956 10 10 FCCE CON(C)S(=O)(=O)c1cc(C(=O)OCC(=O)C(C)=O)ccc1Cl 808497467 QCWMDFHZPQVVHP-UHFFFAOYSA-N 363.775 0.837 10 10 FCCE Cn1cnc(CCCNC(=O)C(=O)NCCCSc2nccs2)n1 1326099649 PJJVSBMOEGTHQV-UHFFFAOYSA-N 368.488 0.619 10 10 FCCE NC(=O)C[C@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 1328769916 FGXOTQWQYZRLDS-INIZCTEOSA-N 362.430 0.309 10 10 FCCE NC(=O)c1ccc(N2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)nc1 1469361089 VWYNKOOAMVHNGI-KXFIGUGUSA-N 368.393 0.954 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2332922614 DMJSWOAOWRRERV-FVCCEPFGSA-N 369.422 0.876 10 10 FCCE COc1cc(NS(=O)(=O)c2ccccc2S(N)(=O)=O)ccc1O 797820183 KGTZEYVRRWEHIC-UHFFFAOYSA-N 358.397 0.849 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCN(C2CC2)C(=O)C1 807288717 ZSVJHBVMPXNVGM-UHFFFAOYSA-N 368.437 0.512 10 10 FCCE CCOC(=O)C[C@H](O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856213249 DXHUHGJGTJINPU-INIZCTEOSA-N 350.415 0.578 10 10 FCCE CN(C)c1ccc([C@H](N)CNS(=O)(=O)[C@@H]2CC(=O)N(C3CC3)C2)cc1 866757026 HLJBIWCSSDBNCM-HZPDHXFCSA-N 366.487 0.435 10 10 FCCE CN1C[C@H](O)C[C@]1(C)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 900754508 JYZBETVXHFHNIK-UYAOXDASSA-N 361.486 0.967 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC=C[C@@H]3CO)CC2)cc1 922266729 LEJHYXAFRRCKNM-XZVRFQMRSA-N 371.437 0.659 10 10 FCCE Cc1nnc(N(C)Cc2ccccc2O)n1CCCNS(C)(=O)=O 1304794316 IDVZJFAUQSRKNX-UHFFFAOYSA-N 353.448 0.868 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N3C[C@H]4C[C@]4(CO)C3)C2)cc1 1326252135 AJOJMPDRSRVEJK-STXHMFSFSA-N 373.453 0.479 10 10 FCCE NC(=O)[C@@H]1CC(C(=O)NCc2c(O)cccc2O)=NN1c1ccc(F)cc1 1472063451 KSHWULLKVQPDFO-AWEZNQCLSA-N 372.356 0.973 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2312333154 ABZKFFOSWSEDPH-IYKVGLELSA-N 355.395 0.675 10 10 FCCE CN(C)c1ccc(CNC(=O)C(CO)(CO)NC(=O)OC(C)(C)C)cc1 2344088148 AKXHRTZUKPGIJI-UHFFFAOYSA-N 367.446 0.617 10 10 FCCE CNCCOCCN(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 861750070 NBTGHTKNUZYWCG-UHFFFAOYSA-N 354.426 0.202 10 10 FCCE CN(C)c1ccc(CN(C(=O)C(=O)NCC2(N)CCOCC2)C2CC2)cc1 861796824 IUHCNTFSVOKWFH-UHFFFAOYSA-N 374.485 0.868 10 10 FCCE O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)N1Cc2cccc(O)c2C1 871202907 OOPWQIHICRGIQB-MUIFIZLQSA-N 356.378 0.787 10 10 FCCE COC1(OC)CCN(CC(=O)NCc2ccc(N(C)C)cc2)C[C@H]1O 931635918 LKMZFHWXNJFDQT-MRXNPFEDSA-N 351.447 0.425 10 10 FCCE COCCn1cc(CNC(=O)/C=C\c2ccc(O)c(O)c2)c(O)nc1=O 1175594706 RAGHEGQUFIJGMR-HYXAFXHYSA-N 361.354 0.336 10 10 FCCE O=C(NC[C@]1(O)CCS(=O)(=O)C1)c1cc2cc(O)c(O)cc2s1 1449703991 QPKDPZCJPSMVNC-CQSZACIVSA-N 357.409 0.592 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)C[C@H](N)C(F)F)cc2)CC1 1521687660 ZCCQPUJXJCPUKW-HNNXBMFYSA-N 354.401 0.954 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2081034264 GBXAENVXUUQASV-RHYQMDGZSA-N 355.395 0.629 10 10 FCCE C[C@H]1OCCN(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)[C@@H]1C(N)=O 285264641 HNTJWBLITQBJBA-SXJDMRHMSA-N 359.426 0.638 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C[C@H](C(N)=O)CC[C@H]3C)CC2)cc1 728733783 QSZVNOUDNRVQKG-HZPDHXFCSA-N 374.485 0.930 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CC[C@H](C(N)=O)O3)C2)cc1 852202283 CQGPPHKZDUTGRM-APHBMKBZSA-N 362.430 0.606 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C3CN(C)CCN(C)C3)cc2)CC1 918911881 BGXZFFVHKYORBX-UHFFFAOYSA-N 359.518 0.548 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CCN2C(=O)OCC[C@H]2C1)c1ccc(N(C)C)cc1 1323502636 WEAGYOZHBZIAPX-CJNGLKHVSA-N 374.441 0.983 10 10 FCCE Cc1cc(C(=O)NS(=O)(=O)N(C)C)ccc1NC(=O)C1=S=CC=C1 1324480047 NOXVWFURUKZPLQ-UHFFFAOYSA-N 367.452 0.747 10 10 FCCE C[C@]1(O)CCCN(c2nnnn2Cc2ccc(N3CCOCC3)cc2)C1 1352233321 HPTJNDKQWAWFEF-SFHVURJKSA-N 358.446 0.909 10 10 FCCE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)C(=O)c1cc(O)c(O)c(O)c1 2068615253 NESHQEQPMMKQFS-JTQLQIEISA-N 356.375 0.761 10 10 FCCE COc1ccc(N2C[C@H](NC(=O)C(F)(F)F)C[C@@H](C(N)=O)C2)c(N)c1 2106883907 VWGUQZKTMBNRQE-RKDXNWHRSA-N 360.336 0.636 10 10 FCCE COc1ccc(N2N=C(C)/C(=C/c3c(O)[nH]c(=O)n(C)c3=O)C2=O)cc1 17150092 VENPPKPZSIYZPT-WQLSENKSSA-N 356.338 0.594 10 10 FCCE N[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(F)(F)F 827394942 HDKZTKZBUBMERR-GFCCVEGCSA-N 365.377 0.427 10 10 FCCE C[C@@H]1NCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 861786178 GSMPIQRJSGTROX-SUMWQHHRSA-N 360.458 0.131 10 10 FCCE CON1CCC(N(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 1141881373 HVLSZWUYDIVUHZ-UHFFFAOYSA-N 357.432 0.862 10 10 FCCE Cc1cc2c(N3CC(NC(=O)Cc4ccc(O)c(O)c4)C3)nccn2n1 1305731905 HNUZIKAXRSHCDZ-UHFFFAOYSA-N 353.382 0.996 10 10 FCCE C[C@H](NC(=O)Cn1cnnn1)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1463805827 GBNZRSUPACNHTM-AWEZNQCLSA-N 371.445 0.437 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNCc1c(O)cccc1F 2218633680 SIUFNHVQOWIRRN-AEGPPILISA-N 356.394 0.962 10 10 FCCE CC(C)(C)OC(=O)NCC(CO)(CO)NC(=O)Nc1ccc(N)cc1 2254568221 FTPMHMSWUBKATL-UHFFFAOYSA-N 354.407 0.638 10 10 FCCE NC(=O)COc1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1 39983411 LNUUVOYTGLGONO-YHYXMXQVSA-N 352.393 0.837 10 10 FCCE CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@H]1OC(C)=O 616625322 LJICGUPPWNZTFT-PEBLQZBPSA-N 373.318 0.380 10 10 FCCE COc1cc(O)c(CN[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)cc1OC 809726051 CQWPWVAQJKDVDN-CYBMUJFWSA-N 373.475 0.770 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCN(C)[C@H](C)C3)C2)cc1 828144109 SIONJHOSIIMMBH-PMPSAXMXSA-N 374.485 0.989 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N=c3nc[nH]n3C(C)C)C2)cc1 850537609 SKNQYMBRLPMDNW-CYBMUJFWSA-N 372.429 0.623 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 861743440 WAVVKGMPZHLHMX-FHLIZLRMSA-N 374.485 0.957 10 10 FCCE COc1ccc(N2CCN(CCCNS(=O)(=O)C3CNC3)CC2)cc1 923582771 KWONZBFFBYYUGA-UHFFFAOYSA-N 368.503 0.099 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1C[C@@H]2CCC[C@]2(C(N)=O)C1 1335758528 IPBFGBVWHUQICE-YWZLYKJASA-N 372.469 0.791 10 10 FCCE NC(=O)CC[C@H](N)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866105725 RCKGUWQBSBESEL-ZDUSSCGKSA-N 351.362 0.993 10 10 FCCE CN1CCN(C(=O)COc2ccc(N)cc2)[C@@H](CNC(=O)C(F)(F)F)C1 2162996211 BVNMXSRAADIDIQ-LBPRGKRZSA-N 374.363 0.469 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)NCC[C@@H]1CNC(=O)C1 1262289439 DDTKVDRKDTWSEG-GJZGRUSLSA-N 374.485 0.751 10 10 FCCE CN(CCN1CC2(CCOCC2)C1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1335683932 PNTOQOYTEQIPGY-UHFFFAOYSA-N 373.453 0.805 10 10 FCCE Cn1cc(S(N)(=O)=O)cc1C(=O)NCc1ccc2cccnc2c1O 1557121754 NMOWWSHWWDNICB-UHFFFAOYSA-N 360.395 0.856 10 10 FCCE COC(=O)[C@@H]1CCN(C(=O)Cc2ccc(O)c(O)c2)[C@@H](C(=O)OC)C1 1597208409 GRYJTDUMVCXXGK-VXGBXAGGSA-N 351.355 0.594 10 10 FCCE O=C1CC[C@@H](C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CN1 1629484027 CZUHLJNPTSVFDI-GFCCVEGCSA-N 353.369 0.944 10 10 FCCE Cn1c2c(c(=O)[nH]c1=O)[C@@H](c1cc(Br)ccc1O)NC(=O)N2 109808356 DOPDAHZMTVNJMG-SECBINFHSA-N 367.159 0.766 10 10 FCCE COc1ccc(N2CCN(CCN=c3ncnc4[nH][nH]cc3-4)CC2)cc1 742927944 AIENLXIYOYTISD-UHFFFAOYSA-N 353.430 0.969 10 10 FCCE CCN(C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCN(C)C1 827079107 SDDVLBGYFZLOJV-GOSISDBHSA-N 374.485 0.692 10 10 FCCE COC(=O)CC[C@@H](N)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 827363980 CAYPGHBQMSNGCU-OAHLLOKOSA-N 367.421 0.684 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CN(C)C(=O)[C@H]3C)C2)cc1 834862728 XQXCAFWSIWHSPN-KGLIPLIRSA-N 374.441 0.284 10 10 FCCE O=C(NCc1ccc2cccnc2c1O)[C@@H]1C[C@@H](O)CN1c1ccncn1 1162612799 QIYAIWPFCBFOAI-CABCVRRESA-N 365.393 0.986 10 10 FCCE COCc1cc(NC(=O)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ncn1 1255532285 XZOPFSKDGJTFLR-JTQLQIEISA-N 360.370 0.720 10 10 FCCE O=C(CNC(CO)CO)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1307783221 LBOPBAHRPFKKDU-UHFFFAOYSA-N 354.362 0.343 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCOC[C@H]1c1ccnn1C 1326536996 MOZGTJZLTJEAEI-HNNXBMFYSA-N 358.398 0.684 10 10 FCCE CO[C@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 1347071788 QRIRWTXZUUBJJI-RDJZCZTQSA-N 361.442 0.823 10 10 FCCE COC1(OC)CCOC[C@H]1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1633453317 QTASFXFUNDPZEK-CYBMUJFWSA-N 374.415 0.272 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC3(C[C@@H](O)CNC3=O)C2)c([N+](=O)[O-])c1 1640411810 FROJISFTYMRHGG-KTLBGCOUSA-N 361.354 0.468 10 10 FCCE COC(=O)CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)NCCO 2313681452 FIXWKMURRZRLJP-UHFFFAOYSA-N 362.342 0.716 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2331520084 IZUVKJOTHMTJER-QNWHQSFQSA-N 369.422 0.876 10 10 FCCE CNS(=O)(=O)c1cc(NS(=O)(=O)N2CCC[C@H](C)C2)ccc1O 790406156 CVCRNOJSXCNTHN-JTQLQIEISA-N 363.461 0.689 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3nccn3C)C2)cc1 827933706 COTXQWFRCDDISC-CYBMUJFWSA-N 357.414 0.440 10 10 FCCE CO[C@@H]1COCC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 897809749 WXKCUUGNIBJXMO-ZWKOTPCHSA-N 373.453 0.941 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCOC[C@H]3C)C2)cc1 1118632502 DRJZVLDNVICODT-KEYYUXOJSA-N 361.442 0.931 10 10 FCCE CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C[C@@H]1O)c1ccc(N)cc1 1890108340 MEXQQMLODYVQBV-KBXCAEBGSA-N 365.430 0.964 10 10 FCCE CC(C)(CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@]1(O)CCOC1 844038504 CCQCHPFJBCSGJV-MRXNPFEDSA-N 372.443 0.671 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(N2CCNC2=O)CC1 1331950374 LRTXMXGDMTXOBD-UHFFFAOYSA-N 358.398 0.251 10 10 FCCE CNC(=O)c1cncc(/C=C/C(=O)N2CCCc3ccc(C(N)=O)nc32)c1 1585630949 TYBKJYPRSKZHQY-QPJJXVBHSA-N 365.393 0.928 10 10 FCCE CCOC(=O)CN(CCC(=O)NCC(=O)OC)Cc1ccccc1O 1618720994 PJBVHZOPNYBWMB-UHFFFAOYSA-N 352.387 0.437 10 10 FCCE CC(=O)N1CCN(c2ccc(CNc3cc(C(N)=O)ncn3)cc2)CC1 1639882570 GBMQLNIPNLBEGJ-UHFFFAOYSA-N 354.414 0.856 10 10 FCCE COC(=O)[C@@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H]2C[C@H]21 1646233330 KZSKUCDHILFXBQ-XZUYRWCXSA-N 368.411 0.691 10 10 FCCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 1772914466 CULBRXPTRSPIOL-XOIDGJRKSA-N 359.382 0.256 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CCNC=C1C(=O)OC(C)(C)OC1=O)C(=O)O 100751495 OLJZDQDQJCQQFM-JTQLQIEISA-N 372.374 0.664 10 10 FCCE CC(=O)N1CCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H](C)C1 297811578 MPYAMIHJLNLBAG-CQSZACIVSA-N 360.458 0.790 10 10 FCCE COC(=O)[C@@H](F)CNC(=O)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1262151073 YNOWAPNBFRXOMF-WFASDCNBSA-N 367.421 0.736 10 10 FCCE Cc1noc(CCNC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)n1 1322226775 BEXBSCKGNXDMGO-UHFFFAOYSA-N 355.398 0.729 10 10 FCCE COCCN(CCF)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1328272465 HPDSONQLVRMVHK-UHFFFAOYSA-N 367.421 0.584 10 10 FCCE NC(=O)[C@@H]1CC[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1 1351134587 KUVCDZKEVPYVPN-OWCLPIDISA-N 372.469 0.906 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3CCCNC3=O)cc2)CC1 1471912679 UEFOPLXMHOMDQC-INIZCTEOSA-N 358.442 0.531 10 10 FCCE CN1CCCc2cc(CNS(=O)(=O)N3CCN(C=O)CC3)ccc21 195195173 CIOXLUNXTVPZOF-UHFFFAOYSA-N 352.460 0.177 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CCNC[C@H]3C)CC2)cc1 842266345 QDLDQAYTSRCWCG-QAPCUYQASA-N 374.485 0.848 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C3=NN(CCO)C(=O)CC3)C2)cc1 855233540 IGGDHOJGAUKGTI-CYBMUJFWSA-N 360.414 0.361 10 10 FCCE COC(=O)CCNC(=O)CCNC(=O)N[C@@H](C)c1cc(OC)ccc1O 858903480 BTGKKZCHTSXXIX-NSHDSACASA-N 367.402 0.830 10 10 FCCE CCO[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)CN(C)C 929235606 AAJIASNAWIVQRX-MRXNPFEDSA-N 350.463 0.452 10 10 FCCE CCOC(=O)[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)CCO1 1332553123 CSQSOWLCZFSGNP-OAHLLOKOSA-N 363.414 0.159 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3nsnc3O)CC2)cc1 1542431983 NPEJWVRRGQOJFU-UHFFFAOYSA-N 363.443 0.804 10 10 FCCE CN1C(=O)COc2ccc(NC(=O)c3nnn(-c4ccc(N)cc4)n3)cc21 1857878493 DSTNYFWHGZJITD-UHFFFAOYSA-N 365.353 0.852 10 10 FCCE O=C1C[C@@]2(CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)C2)CN1 279477329 MKHOARCSQHCGAO-IBGZPJMESA-N 358.442 0.945 10 10 FCCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(O)nc(O)c2)[C@H](C(=O)O)C1 687287694 LUZOVCHPZLYIRZ-JTQLQIEISA-N 367.358 0.639 10 10 FCCE COc1cc(C)cc(CN(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c1O 754727844 RDJIPDDBWTZEKJ-CYBMUJFWSA-N 356.444 0.444 10 10 FCCE CCN(Cc1cn(C)nn1)C(=O)C(=O)NCCCSc1nccs1 806279267 JSTYIGYOILLRGI-UHFFFAOYSA-N 368.488 0.919 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cnnc(O)c3)cc2)CC1 1558397964 VBIUUFLEWQBHAL-UHFFFAOYSA-N 355.398 0.814 10 10 FCCE O=C(NCc1ccc(O)c(O)c1)[C@@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1595596542 XQMCBPRFMFFFFK-RKDXNWHRSA-N 353.318 0.937 10 10 FCCE CN(C)c1ccc([C@H](NC(=O)CC[C@H](N)C(=O)O)c2nccn2C)cc1 1866021167 AKOHXOQHXGCTRT-HOCLYGCPSA-N 359.430 0.884 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CC[C@]4(CNC(=O)C4)C3)CC2)cc1 278796613 FMAUUQNBXVLTLN-FQEVSTJZSA-N 372.469 0.556 10 10 FCCE Cn1cnc2c1c(=O)n(CCCOC(=O)c1cc(O)cs1)c(=O)n2C 732354074 OFVKRRONFDHHIV-UHFFFAOYSA-N 364.383 0.448 10 10 FCCE COc1ccc(O)c(CNC(=O)N[C@H]2CCC[C@@H]2CNS(C)(=O)=O)c1 800706507 DRSOAPWRXKXPEE-RISCZKNCSA-N 371.459 0.918 10 10 FCCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)[C@@]1(O)CCOC1 840408719 LUYIDWSXKULIEB-HXUWFJFHSA-N 359.470 0.986 10 10 FCCE COc1ccc(N(CC(=O)O)CC(=O)NCC[C@@]2(O)CCOC2)cc1 853010690 JQBREGMSCBXPBZ-QGZVFWFLSA-N 352.387 0.244 10 10 FCCE O=C(NCc1cc(Br)ccc1O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1 854442019 DFTPHFZGCKMVQP-JHJVBQTASA-N 358.188 0.184 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(C)CCNC(=O)C3)cc2)CC1 898575976 XMPGJYPABICROE-HXUWFJFHSA-N 372.469 0.888 10 10 FCCE O=C(C(=O)N1CCC[C@H](CN2CCOCC2)C1)N1Cc2cccc(O)c2C1 1330430433 HCLBGOOCGDQXFS-OAHLLOKOSA-N 373.453 0.805 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2[C@H]3C[C@@H]4CO[C@H]2[C@H]4C3)c1 1454704672 UMHANGFKDXTZEF-LOCXDVHYSA-N 352.412 0.917 10 10 FCCE O=C(NCc1ccc(O)c(O)c1)[C@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1595596540 XQMCBPRFMFFFFK-DTWKUNHWSA-N 353.318 0.937 10 10 FCCE CC(C)(C)OC(=O)NCC1(O)CN(S(=O)(=O)Cc2ccc(N)cc2)C1 2044599049 YXAZTFLDVBTTKP-UHFFFAOYSA-N 371.459 0.670 10 10 FCCE CC(=O)C(=O)COC(=O)C(F)(F)c1ccccc1OCC(=O)N(C)C 808534578 OFFSUECFAUIXDX-UHFFFAOYSA-N 357.309 0.947 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@H]3CNCC[C@@H]3C)C2)cc1 818677762 VLCJEXOIAGYJOS-DAYGRLMNSA-N 374.485 0.752 10 10 FCCE CCS(=O)(=O)N[C@@H](C)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855223926 CWEOFEXTBUSHOT-QWHCGFSZSA-N 355.460 0.718 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)NCC3COC3)CC2)cc1 863353048 RLIGXZGIYQDKQQ-VOTSOKGWSA-N 359.426 0.663 10 10 FCCE C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C[C@H]1CN 868356862 ICTRHTOJHLLBFU-NVXWUHKLSA-N 374.485 0.535 10 10 FCCE C[C@@H](NC(=O)C(=O)NCCC1CS(=O)(=O)C1)c1ccc(N(C)C)cc1 1327465973 QUTUWXQSSOLSLR-GFCCVEGCSA-N 367.471 0.481 10 10 FCCE CN(C)c1ccc([C@H](CNC(=O)CNC(=O)CN)N2CCCCC2)cc1 1866015156 MXLBZOFSHSJCOF-KRWDZBQOSA-N 361.490 0.471 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)NCc1ccc(N)cc1 2080680681 CYUMTFCSJXBOFX-MELADBBJSA-N 351.403 0.226 10 10 FCCE Oc1c(Br)cc(Cl)cc1CN[C@@H]1C[C@H](O)[C@H](O)[C@H]1O 2108826826 YRRRWRKSVBABJQ-QCZKYFFMSA-N 352.612 0.753 10 10 FCCE CN1C[C@H](O)C[C@@]1(C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 900269539 PVPRNNYQCLACRB-KDOFPFPSSA-N 351.422 0.734 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@H]1C[C@H](S(C)(=O)=O)C1)c1ccc(N(C)C)cc1 1119476433 WHHLXIKTEXCSLZ-WHOFXGATSA-N 367.471 0.622 10 10 FCCE COC(=O)C[C@@H]1C(=O)NCCN1C(=O)c1cc2cc(O)c(O)cc2s1 1136205453 AMXOOPFZMINSFE-SECBINFHSA-N 364.379 0.816 10 10 FCCE Cn1ncc2c(O)nc(NC(=O)C3=S=C(NC(=O)C4CC4)C=C3)nc21 1530388932 IBXFCBLSVQBGJX-UHFFFAOYSA-N 358.383 0.139 10 10 FCCE Cc1cc(CC(=O)N2C[C@@H](C(N)=O)[C@H](C(N)=O)C2)c(C)n1-c1ccccc1 1634099303 CBQBLOQCDWPBFC-IAGOWNOFSA-N 368.437 0.682 10 10 FCCE CN(C)CCN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1ccccc1 1772824260 DSUBSRSCUJDYQK-KHPPLWFESA-N 356.426 0.692 10 10 FCCE O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)C1=CNN1CCOCC1 2296931447 NAJQETGFZULODG-UHFFFAOYSA-N 350.762 0.644 10 10 FCCE CNC(=O)CN1CCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1 255007603 SAPFPQDEYPGNTO-DAXSKMNVSA-N 372.469 0.427 10 10 FCCE C[C@@H]1C[C@@H]1N1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1=O 369817536 MYVLFLIGRQTMSY-CDMKHQONSA-N 367.427 0.503 10 10 FCCE CN(C)c1ccc(/C=C/CNCCN2CCN(S(C)(=O)=O)CC2)cc1 835036716 DYABFNFJOYOKPC-SNAWJCMRSA-N 366.531 0.933 10 10 FCCE NCC(F)(F)CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 846673162 PPIKEBCAIJFNAD-CYBMUJFWSA-N 354.401 0.989 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCN2C[C@H](O)C[C@H]2C1 848633488 OPMFBFRXSUAPIX-JKSUJKDBSA-N 361.442 0.408 10 10 FCCE O=C1C[C@H](C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CCN1 1161175413 VVCTWCQELYGGSD-GFCCVEGCSA-N 353.369 0.944 10 10 FCCE O=C(CNS(=O)(=O)c1cccc(F)c1)NCc1cc(O)ccc1O 1593868012 GIXFRLIMPXYNGJ-UHFFFAOYSA-N 354.359 0.832 10 10 FCCE NC(=O)[C@H]1CC(C(=O)NCc2c(O)cccc2O)=NN1c1ccccc1 1635842883 ALKIMTWLIOPIEG-CQSZACIVSA-N 354.366 0.834 10 10 FCCE CSc1ncc(CNS(=O)(=O)N2CC[C@@H](C(N)=S)C2)s1 2284712206 MPDZXJKFJSWHAP-SSDOTTSWSA-N 352.532 0.807 10 10 FCCE NC(=O)c1ccc(N/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1 100987019 SWGSNYQISNHHMF-MDWZMJQESA-N 354.322 0.953 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNCc3cnn(C)n3)CC2)cc1 819309800 WKDHBQOOHOKORN-QGZVFWFLSA-N 360.462 0.096 10 10 FCCE CO[C@H](CS(=O)(=O)NC[C@@H](N)c1ccc(N(C)C)cc1)[C@@H]1CCOC1 850587442 ZYZXUIMHWVXZDP-DJIMGWMZSA-N 371.503 0.723 10 10 FCCE CN1CCN(c2ccc(CNC(=O)c3ccc4c(c3)B(O)OC4)cc2)CC1 918911655 APQMTYFCOFKYLL-UHFFFAOYSA-N 365.242 0.586 10 10 FCCE CN1CCOC[C@@]1(CO)CNCc1ccc(N2CCOCC2)c(F)c1 922535564 IKXMSXNQJHTSAJ-SFHVURJKSA-N 353.438 0.445 10 10 FCCE COCc1n[nH]c(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)n1 1350545440 WIVCTPNPIOXQGT-UHFFFAOYSA-N 374.445 0.912 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CCn4nccc4C3)CC2)cc1 1473670606 LZPOPYDXZKVUKZ-IBGZPJMESA-N 371.485 0.890 10 10 FCCE C[C@@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCC(=O)N1 1517372698 KFSMVPMDMMLGKE-LIRRHRJNSA-N 358.442 0.673 10 10 FCCE COc1cccc(CNC(=O)c2cc(S(N)(=O)=O)ccc2O)c1O 1636061169 HVHIFGRRYDQNGM-UHFFFAOYSA-N 352.368 0.684 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 1772914465 CULBRXPTRSPIOL-JPVGGKMYSA-N 359.382 0.256 10 10 FCCE CN(C[C@H](O)CN1CCOCC1)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 761905364 PXHRCWHGZQGERL-NSHDSACASA-N 366.374 0.055 10 10 FCCE O=C(NCc1ccc(N2CCSCC2)cc1)C(=O)N1C[C@H]2CC[C@H]1CN2 817914630 WBLLSPOERCUQIS-WBVHZDCISA-N 374.510 0.819 10 10 FCCE COc1ccc(N2CCN(S(=O)(=O)C[C@@H]3CNCCO3)CC2)cc1F 866753405 RKXZANMGARFHHA-AWEZNQCLSA-N 373.450 0.275 10 10 FCCE CCOC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1323296551 BROATOVDJGBSIP-ZDUSSCGKSA-N 367.421 0.820 10 10 FCCE NC(=O)N[C@H](CO)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1442919549 FPNUQWWGDKNPDU-CYBMUJFWSA-N 372.372 0.402 10 10 FCCE CN(Cc1nnc2c(=O)n(C)ccn12)C(=O)/C=C\c1ccc(O)c(O)c1 1644709622 SCCFWBFKJXMXJX-XQRVVYSFSA-N 355.354 0.511 10 10 FCCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC(N=[N+]=[N-])C1)C1CS(=O)(=O)C1 2020694913 FMSPYDVPWOBASS-JTQLQIEISA-N 359.408 0.445 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc(O)nc(O)c2)[C@@H](CO)C1 2116259222 WVUHUMOGXVHSTG-VXGBXAGGSA-N 367.402 0.841 10 10 FCCE CCOC(=O)C[C@@H](O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 774012692 GRDRFYOVUXULNZ-MRXNPFEDSA-N 368.405 0.717 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@H]3CCCN(C)C3)C2)cc1 824973816 MFLOHXMJHNYMNW-CVEARBPZSA-N 374.485 0.848 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCN(C4CC4)C3)C2)cc1 827489132 NXFBKTXMYWNHFZ-GJZGRUSLSA-N 372.469 0.743 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@](O)(C(F)F)C1 1325557106 PIJKYISRBPSWLM-KRWDZBQOSA-N 355.385 0.940 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C3=C4CCCN=C4NN3)cc2)CC1 1643610551 WKHVMPUYBOTDEJ-UHFFFAOYSA-N 354.458 0.609 10 10 FCCE CN(Cc1nnc2c(=O)n(C)ccn12)C(=O)/C=C/c1ccc(O)c(O)c1 1644709621 SCCFWBFKJXMXJX-GQCTYLIASA-N 355.354 0.511 10 10 FCCE CN(Cc1ccccc1O)C(=O)[C@@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C 2136113610 NJFHBLLSMJBFEE-KKUMJFAQSA-N 366.414 0.692 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@@H]1C(=O)NCCCCN=[N+]=[N-] 2310483242 XYNGPUMKNGEGNX-IJLUTSLNSA-N 357.411 0.924 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)[C@H]3C[C@H](OC)CN3)cc2F)CC1 187982778 QWRFEZJQIQQJLJ-DOTOQJQBSA-N 364.465 0.961 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@@H](O)CN1CCOCC1 749298377 PVZTVMPAFBJQBO-HNNXBMFYSA-N 372.849 0.714 10 10 FCCE COCCN(C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H]1CCOC1 839356251 LVDUOEOFGUPANY-QGZVFWFLSA-N 363.458 0.975 10 10 FCCE O=S(=O)(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCCNC1 923616699 VCUTZTKENUWMFW-HNNXBMFYSA-N 371.478 0.958 10 10 FCCE CCN1CC[C@H]1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1146666684 OZMGRIHMFDWMHP-INIZCTEOSA-N 351.472 0.632 10 10 FCCE CCNC(=O)CCC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1303721267 VMQFVAQLTDCTNN-UHFFFAOYSA-N 360.458 0.921 10 10 FCCE CC(C)N(C[C@@H]1CCC(=O)N1)C(=O)C(=O)NCc1ccc(N(C)C)cc1 1331539042 JTCKUICWRJYJBM-HNNXBMFYSA-N 360.458 0.884 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCN(c2ccc3nncn3n2)C1 1640534007 SNZVFOBRCNLJRQ-GFCCVEGCSA-N 354.370 0.473 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)CNC(=O)c1cccc(O)c1O 2258269536 BCWVJLMBJXHUHP-UHFFFAOYSA-N 356.375 0.076 10 10 FCCE CN1CCCN(C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c2ccccc21 254981772 CRKKMKWHJLPNTA-KTKRTIGZSA-N 354.410 0.970 10 10 FCCE O=C(CN1CCOCC1=O)NCc1ccc(N2CCC(CO)CC2)cc1 280107752 KGKFBOJULFOLBB-UHFFFAOYSA-N 361.442 0.370 10 10 FCCE CCNC(=O)N1CC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 761610017 YCOOUBMYWTYLKJ-NSHDSACASA-N 370.431 0.297 10 10 FCCE C[C@H]1CN(CCO)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1 837816245 FCFKNIXGGQSDHA-INIZCTEOSA-N 362.474 0.731 10 10 FCCE O=C1N[C@H](CO)C(=O)N1Cc1ccc(N2CCN(CC3CC3)CC2)cc1 1332860516 ARDFLTGKPOGUDN-QGZVFWFLSA-N 358.442 0.631 10 10 FCCE C[C@@H](NCc1cc(=O)n2nc(N)[nH]c2n1)c1ccc(N2CCOCC2)cc1 1616865360 JRABNZMECSKASF-GFCCVEGCSA-N 369.429 0.687 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](N)[C@H](O)C(=O)O 1952345726 GMXPSKONXCQVOK-ICCXJUOJSA-N 356.375 0.306 10 10 FCCE Oc1c(Br)cc(Cl)cc1CN[C@@H]1C[C@H](O)[C@@H](O)[C@H]1O 2108826825 YRRRWRKSVBABJQ-LLHIFLOGSA-N 352.612 0.753 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](O)[C@@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2127629231 HQYSTDIYKAGWTJ-QJPTWQEYSA-N 369.422 0.924 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC[C@H]1C[C@H]1N 2136245314 SVKDOVYCQHODDY-UPJWGTAASA-N 365.430 0.997 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)NCCc1ccc(N)cc1 2332881314 GHUDDFPQEADHKG-RBSFLKMASA-N 365.430 0.269 10 10 FCCE O=C(NCCN1CCNCC1)NCc1cc(Br)ccc1O 841921710 UTTCPBGULMTJME-UHFFFAOYSA-N 357.252 0.859 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCN4C(=O)NC[C@H]4C3)C2)cc1 854300721 YXRUNCPNEUFXAB-ZFWWWQNUSA-N 359.430 0.693 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H](O)C(C)(C)O)CC2)cc1 900408202 XBFMERHOXILXHW-INIZCTEOSA-N 351.447 0.065 10 10 FCCE C[C@@H]([C@H](C)S(C)(=O)=O)N(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 1335574405 YGHFPLWASHBDDI-QWRGUYRKSA-N 354.428 0.514 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCO[C@H]([C@H](C)O)C2)cc1 817705862 MEXRINZOUJMGAT-YOEHRIQHSA-N 363.458 0.757 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCN(C)C3CC3)C2)cc1 827457467 YHIPAUCMZLATAT-CQSZACIVSA-N 360.458 0.601 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2C[C@H](N)C(C)(C)C2)cc1 903771052 KEPPMHKKPHMVCP-INIZCTEOSA-N 362.474 0.786 10 10 FCCE CC[C@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCNC1=O 1125257775 PACYIIAWYCZYIN-QRWLVFNGSA-N 372.469 0.921 10 10 FCCE COc1ccc(CNC(=O)c2c(F)ccc(O)c2O)cc1S(N)(=O)=O 1161442173 BHOQMVQHHXFZLP-UHFFFAOYSA-N 370.358 0.823 10 10 FCCE CCN1CC[C@@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1=O 1332601298 XNRNMGNEIMATIK-OAHLLOKOSA-N 358.442 0.422 10 10 FCCE NS(=O)(=O)c1cc(CNC(=O)Cc2ccc(O)c(O)c2)ccc1F 1642209645 UTPPKMBCFAGBOB-UHFFFAOYSA-N 354.359 0.743 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNCc1cccc(F)c1O 2218612039 CSXLPLNAUZGRLA-VNHYZAJKSA-N 356.394 0.962 10 10 FCCE COc1ccc(CNC[C@@H]2[C@H](O)[C@H](O)CN2C(=O)OC(C)(C)C)c(O)c1 2225621914 GSHOBHDPSBEONC-BMFZPTHFSA-N 368.430 0.832 10 10 FCCE CN(C)CCCNC=C1C(=O)NC(=S)N(Cc2ccc(F)cc2)C1=O 2296088888 VCEAOVFAGZGPRG-UHFFFAOYSA-N 364.446 0.994 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(CCO)C3)CC2)cc1 778420026 QVPUGGUVMGUXAS-SREVYHEPSA-N 373.453 0.741 10 10 FCCE Cn1cc(C[C@H](O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cn1 786795256 IMAIWERGGPRINC-KRWDZBQOSA-N 362.405 0.616 10 10 FCCE O=C(NCCCSc1nccs1)C1(n2cnnn2)CCOCC1 827474485 ACKBEEVGHBLXKK-UHFFFAOYSA-N 354.461 0.934 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1CN(C)C(=O)[C@H]1C 834857175 DQXBFQWKHFEODX-UONOGXRCSA-N 360.458 0.755 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC(Cn3cnnc3)CC2)cc1 846722532 LQGNGUIKPXHFEP-UHFFFAOYSA-N 370.457 0.899 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(C=O)n(C)n3)cc2)CC1 935569396 MCLLAKPPZAZNQR-UHFFFAOYSA-N 369.425 0.831 10 10 FCCE COC(=O)CC1CC(NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1333699106 OSFOLPOMRGWMTN-UHFFFAOYSA-N 365.405 0.966 10 10 FCCE CCn1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nn1 1626339616 WZGOUEXUOWKQQJ-CQSZACIVSA-N 356.430 0.930 10 10 FCCE Nc1ccc(N2C(=O)[C@H]3CS(=O)(=O)C[C@H]3C2=O)c(Br)c1 1924751438 NLBRPIKDMIQCKN-OCAPTIKFSA-N 359.201 0.565 10 10 FCCE CC(C)(C)OC(=O)N[C@H](CS(C)(=O)=O)C(=O)NCc1ccccc1O 2313913382 INSWJXTWQBJOQI-GFCCVEGCSA-N 372.443 0.946 10 10 FCCE CN[C@@H]1C(=O)Nc2cc(N3CC(=O)NC(=O)C3)c(Br)cc21 92776068 NRJJERCTZXPUDA-LBPRGKRZSA-N 353.176 0.125 10 10 FCCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN2CCOC[C@@H]2C1 788936216 INVPDONZJISAQL-SFHVURJKSA-N 372.469 0.446 10 10 FCCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@](O)(C(N)=O)C1 861218446 GEBDVNVFMWBISU-LJQANCHMSA-N 355.394 0.969 10 10 FCCE CCN1CC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 898129182 PVPJHEMBHPFHSP-KRWDZBQOSA-N 374.485 0.474 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)NCc3cn(C)nn3)CC2)cc1 1332728700 CPMXETRSLWFADY-UHFFFAOYSA-N 372.429 0.225 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2136334743 DMJSWOAOWRRERV-VOAKCMCISA-N 369.422 0.876 10 10 FCCE CN(C(=O)C1=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1cccn(C)c1=O 2224794925 TYTNPTSRSDLQTA-OCCSQVGLSA-N 363.414 0.932 10 10 FCCE CCN(CCN=[N+]=[N-])C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C[C@H]1O 2315992111 HNGPKMIFIVCIGP-ABAIWWIYSA-N 357.411 0.878 10 10 FCCE O=C(CN1C(=O)CSC1=S)N1CCC[C@@H](Oc2cccnn2)C1 238883428 PQKXWHGGOMIVFK-SNVBAGLBSA-N 352.441 0.707 10 10 FCCE C[C@H](CO)[C@H](C)NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 295686967 HVLJUDCNHBUTHB-KGLIPLIRSA-N 353.438 0.885 10 10 FCCE COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(C)nnc2N(C)C)c1 850373484 LPLJJSLYDWESSM-UHFFFAOYSA-N 359.386 0.820 10 10 FCCE CN1CCO[C@@H](CS(=O)(=O)NCc2ccc3c(c2)CCCN3C)C1 866673738 HEQHTTRZXSUHNK-MRXNPFEDSA-N 353.488 0.819 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCOC[C@@H]3C)C2)cc1 1118632503 DRJZVLDNVICODT-ZQIUZPCESA-N 361.442 0.931 10 10 FCCE C[C@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CCO1 1119816038 ITZXQPFYFWVDKV-INIZCTEOSA-N 374.485 0.692 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](C)NC(=O)Cn1cnnn1 1142422644 KIXDLJZVNRTQST-ZIAGYGMSSA-N 373.461 0.300 10 10 FCCE Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(O)CCS(=O)(=O)C1 1290719224 NOYJTLKZYOLORN-INIZCTEOSA-N 366.443 0.478 10 10 FCCE C[C@@H]1CC[C@@H](NC(=O)C(=O)C(=O)C(=O)NC[C@@H]2C[C@H]3C=C[C@H]2CC3)CN1 1331763223 WUMIJHOHFXXRQC-CAEXGNQWSA-N 361.442 0.100 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N[C@@H]3[C@H]4CCC[C@H]43)cc2)CC1 1350476781 WGRWZQDWJBJZRB-PIIMJCKOSA-N 356.470 0.969 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H]3CC[C@@H](C(N)=O)O3)CC2)c(OC)c1 1543633000 UKZSGTHBSXIZHB-LSDHHAIUSA-N 363.414 0.385 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\C(=O)N(C)C 1624658745 KEVWDHSKTLMTPT-KRZKBDHCSA-N 350.371 0.333 10 10 FCCE COC(=O)[C@@H]1CCCN(CC(=O)NCCc2ccc(O)c(O)c2)C1=O 1630335918 XNWBXXAJNGPGEE-GFCCVEGCSA-N 350.371 0.168 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)c3cc(C)[nH]n3)CC2)cc1 1868753044 AAUGVZHHXYAEJZ-UHFFFAOYSA-N 357.414 0.805 10 10 FCCE CN(C(=O)OC(C)(C)C)C1(C(N)=O)CN(C(=O)c2ccc(O)c(O)c2)C1 2118164845 UPMMVHXZBMPYEI-UHFFFAOYSA-N 365.386 0.645 10 10 FCCE CC(=O)OC[C@H]1O[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@@H]1OC(C)=O 207309055 LJICGUPPWNZTFT-ITGHMWBKSA-N 373.318 0.380 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCn2nncc2C1 847291744 VMWOSUPLJCODOH-UHFFFAOYSA-N 360.393 0.979 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCc4nnnn4CC3)C2)cc1 854183941 GTWLILCEOJZVOC-KGLIPLIRSA-N 371.445 0.965 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3[nH]nnc3C)CC2)cc1 1301571342 GXRZLXSDOHPTAE-FPLPWBNLSA-N 370.413 0.965 10 10 FCCE NC(=O)c1cc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ncn1 1458478680 ZPCHJQSOUYQQKC-UHFFFAOYSA-N 361.427 0.422 10 10 FCCE CNC(=O)c1cccc(N(C)C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c1 1538118289 LWNKYUGMNTWPQC-UHFFFAOYSA-N 374.422 0.507 10 10 FCCE CC[C@H](F)C(=O)N[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1O 1735772650 VRDNSZICZYLXRE-YNEHKIRRSA-N 365.365 0.899 10 10 FCCE CC(C)(C)OC(=O)NC[C@H](O)CNS(=O)(=O)Cc1ccc(N)cc1 2011423916 AMFOWEFAZXHGHT-ZDUSSCGKSA-N 359.448 0.574 10 10 FCCE NC(=O)[C@H]1C[C@H](NC(=O)C(F)(F)F)CN(C(=O)Cc2ccc(N)cc2)C1 2162969510 QHIRRQZYOLIBKF-JQWIXIFHSA-N 372.347 0.192 10 10 FCCE CC(C)(C)OC(=O)N1CCO[C@@H]2C[C@@H](COc3nnc(=N)[nH]n3)C[C@@H]21 2219022131 UFWJMLLZBIVTQJ-GARJFASQSA-N 352.395 0.472 10 10 FCCE COc1cccc(CNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)c1O 737285449 CLIRWCJJLRUURJ-UHFFFAOYSA-N 371.349 0.987 10 10 FCCE COc1ccc(N2CCN(C(=O)CS(=O)(=O)N(C)C)CC2)cc1F 752525978 MIDDJHOGTDYWLB-UHFFFAOYSA-N 359.423 0.374 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@@H]3CCCCNC3)C2)cc1 818678210 WWSOPNUERDRMOE-HZPDHXFCSA-N 374.485 0.896 10 10 FCCE NC(=O)c1cn(C2CN(Cc3ccc(Br)cc3O)C2)nn1 826113057 GVKLCQTZYBVQDG-UHFFFAOYSA-N 352.192 0.902 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](N)CC(F)F)CC2)cc1 829504094 AJLMZZQVWLDANN-HNNXBMFYSA-N 356.417 0.916 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(C)(CO)C3)CC2)cc1 836873043 NONZPAQIKZZWAI-FPLPWBNLSA-N 373.453 0.741 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3[C@H]4COC[C@H]3C4)CC2)cc1 848053647 TUENODKPVKCKSW-KGVXHEBISA-N 371.437 0.900 10 10 FCCE CCN1C[C@@H](S(=O)(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 867496838 IPSKYJBMRKBNBJ-BBRMVZONSA-N 367.471 0.814 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C(=O)O[C@H](C)C3=O)CC2)cc1 871990335 VJBNKYRVBVHTQN-HIFRSBDPSA-N 363.414 0.545 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCC(C)(C)CS(C)(=O)=O)cc1 1262223092 KMDQXLRZAOIGTD-UHFFFAOYSA-N 369.487 0.556 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1C[C@H](O)CN1c1ccncn1 1297562477 MBMVNRAVTRZWGV-QWHCGFSZSA-N 363.414 0.924 10 10 FCCE CN(C)S(=O)(=O)C[C@H](NC(=O)Cc1ccc(O)c(O)c1)C(F)(F)F 1449327877 BPPVTOYCSFLNDM-NSHDSACASA-N 370.349 0.579 10 10 FCCE O=C(Cn1cc(Br)c(O)nc1=O)N1Cc2cccc(O)c2C1 1455035644 BARUHUZEGDXIPP-UHFFFAOYSA-N 366.171 0.959 10 10 FCCE COc1cccc(CNC(=O)NC[C@]23COCCN2C(=O)OC3)c1O 1675402972 QJGJKONFTWVSIE-MRXNPFEDSA-N 351.359 0.421 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H](N)[C@@H](O)C(=O)O 1952345729 GMXPSKONXCQVOK-OASPWFOLSA-N 356.375 0.306 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NC(=O)c2cc(O)nc(O)c2)C1 2063326979 VBPXDRBYCUYAKE-QWRGUYRKSA-N 353.375 0.593 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCO[C@H](Cn3cccn3)C2)cc1 106192217 YBWMYQGQZGXDPV-SFHVURJKSA-N 357.458 0.966 10 10 FCCE CNC(=O)CN1CCCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 368828618 GQOHMSFZNDDDFA-UHFFFAOYSA-N 361.490 0.123 10 10 FCCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCS(=O)(=O)[C@@H]2COCC[C@@H]21 1161283378 CWRHYUPTTJLMGQ-NZIPDGCLSA-N 353.396 0.526 10 10 FCCE O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NCc1c(O)cccc1O 1178912932 ZXVOTKMUELTJJW-VDERGJSUSA-N 360.366 0.267 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)CCn1cc(C(N)=O)c(O)nc1=O 1293283243 PVDUNHBDONWPIS-UHFFFAOYSA-N 373.413 0.129 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 1544087846 QYNRTCAINHZHOJ-KBPBESRZSA-N 369.439 0.835 10 10 FCCE CS(=O)(=O)c1ccccc1C(=O)N1CCS(=O)(=O)[C@@H]2COCC[C@@H]21 1556959920 IZEZAMJYHGVHBB-GXTWGEPZSA-N 373.452 0.118 10 10 FCCE CCCCCCN1C(=O)NC(=O)C(=CNCCN2CCNCC2)C1=O 2296114166 OSXPBELEBDWIOK-UHFFFAOYSA-N 351.451 0.024 10 10 FCCE C[C@@H]1C[C@H]1C(=O)NCCC(=O)NCc1ccc(N2CCNC(=O)C2)cc1 106263872 PKRKONNMZPTUKZ-CZUORRHYSA-N 358.442 0.401 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C[C@@H]4C[C@H]3C[S@]4=O)CC2)cc1 844430263 MOQXLHOOJVLWGU-LMZHUWQESA-N 363.483 0.549 10 10 FCCE CC(C)(C)NS(=O)(=O)CC(=O)NCc1ccc(N2CCOCC2)cc1 919863429 LGMWOJSEYBZTLQ-UHFFFAOYSA-N 369.487 0.857 10 10 FCCE Cc1cc(C)nc(-n2[nH]c(C(=O)NCc3ccc(O)cc3O)cc2=O)n1 1142533037 CVBIYXGCURTZPC-UHFFFAOYSA-N 355.354 0.914 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H]3CC[C@@H](C2)[S@@]3=O)c1 1261842890 NZUFYIZMXLPROZ-YCDSQXFLSA-N 372.468 0.889 10 10 FCCE Cc1cc(S(N)(=O)=O)ccc1CNC(=O)Cc1ccc(O)c(O)c1 1297038262 AWMPZXBYCXFEFD-UHFFFAOYSA-N 350.396 0.913 10 10 FCCE Nc1ccc(CCNC(=O)C(=O)NC[C@@H]2COc3ccccc3O2)cc1 1325719023 LWKRKQUGMKIMHL-OAHLLOKOSA-N 355.394 0.884 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(CO[C@H]2CCNC2)CC1 1330567905 NVRNWEQLNJICTJ-INIZCTEOSA-N 373.453 0.852 10 10 FCCE Cn1cc(/C=C\C(=O)NCc2ccc3cccnc3c2O)c(=O)n(C)c1=O 1638572936 BHXJJMPHSNSGCE-FPLPWBNLSA-N 366.377 0.667 10 10 FCCE O=C1NC(=S)NC(=O)C1=CC=CC=Cc1c(O)nc(S)nc1O 2297311626 VQEXRNPMSNIPEO-UHFFFAOYSA-N 350.381 0.203 10 10 FCCE COC(=O)C[C@@H]1C[C@]2(OC)C(=O)c3cccc(O)c3C(=O)[C@@]2(O)[C@H](C)O1 248036236 QYARGOCFMSDSQR-JXDQDEQISA-N 364.350 0.628 10 10 FCCE biogenic O=C(/C=C\c1ccc(N2CCOCC2)cc1)N[C@@H]1CCS(=O)(=O)C1 255049208 JCVVXLGJNQIBQF-OMVNSRBRSA-N 350.440 0.840 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCN(C2CC2)C(=O)C1 839220211 DQHHMICVOVNFLB-UHFFFAOYSA-N 372.469 0.934 10 10 FCCE COc1ccc(N2CC[C@H](NS(=O)(=O)CCS(C)(=O)=O)C2)cc1 849416709 VPZLMGPGCXOSCX-LBPRGKRZSA-N 362.473 0.238 10 10 FCCE CNCCOCCNC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 861678373 ZZMRRHAUUBKILJ-UHFFFAOYSA-N 354.426 0.902 10 10 FCCE C=CC(=O)NCCC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCC 1116669303 NDIPZQSDDFLIRQ-LBPRGKRZSA-N 350.371 0.381 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H]3C[C@H]3C(=O)NCCN(C)C)CC2)cc1 244313662 XEWNCOHAYKZRCT-MSOLQXFVSA-N 374.485 0.658 10 10 FCCE COC[C@@H]1C[C@@H](O)CN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 823519269 GODWRNGRADAWGH-FUHWJXTLSA-N 363.458 0.939 10 10 FCCE CN1CC[C@@H](C(=O)NCc2ccc(N3CCOCC3)cc2)S1(=O)=O 843775858 UVJOZIBSJPHKMT-HNNXBMFYSA-N 353.444 0.173 10 10 FCCE C[C@@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)CCN1S(C)(=O)=O 852530352 ASEIXVIKSGBTQZ-CQSZACIVSA-N 368.503 0.335 10 10 FCCE CN1CCN(c2ccc(CNC(=O)NC[C@@H](O)c3ccnn3C)cc2)CC1 924008839 QZNQGADSJSDBLK-GOSISDBHSA-N 372.473 0.705 10 10 FCCE COC(=O)CCCCNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1117131178 KIYQWWWOOAKPDY-UHFFFAOYSA-N 353.394 0.967 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3CC[C@@H](C(N)=O)C3)cc2)CC1 1296401212 YIJYEVKSSNBEJC-SJORKVTESA-N 372.469 0.873 10 10 FCCE COC(=O)[C@H]1CC[C@H](C(=O)OC)N(C(=O)Cc2ccc(O)c(O)c2)C1 1453538448 IAPNSFLQYNYBJO-NWDGAFQWSA-N 351.355 0.594 10 10 FCCE COCCn1c(N)c(C(=O)CN[C@@H](C)c2ccccc2O)c(O)nc1=O 1644183384 LNYRSXNLMZZVEO-JTQLQIEISA-N 362.386 0.417 10 10 FCCE Cn1c(O)nc(N2CC[C@@H](NC(=O)/C=C\c3ccc(O)c(O)c3)C2)cc1=O 1652826925 DVOQABUDKMWDOZ-KTLBGCOUSA-N 372.381 0.305 10 10 FCCE CCCC(=O)NCC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742916087 BWKDFUQBXAHIST-UHFFFAOYSA-N 362.474 0.850 10 10 FCCE C[C@H](NC(=O)NCCc1nnnn1C)c1ccc(N2CCOCC2)cc1 771940161 XGJYMDQJFSJZID-ZDUSSCGKSA-N 359.434 0.650 10 10 FCCE C[C@H](N)CNC(=O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 842131039 OSESZGBQLQZNTA-HNNXBMFYSA-N 373.501 0.298 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@]3(C)CCCNC3)C2)cc1 851688594 DNYISEKQYKIQCY-FOIQADDNSA-N 374.485 0.896 10 10 FCCE NC(=O)c1ccc(N2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)nc1 1469361090 VWYNKOOAMVHNGI-QHHAFSJGSA-N 368.393 0.954 10 10 FCCE CO[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)c1cc2cc(O)c(O)cc2s1 1584122086 FOOOIFKZBJKLDV-GZMMTYOYSA-N 357.409 0.854 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1C[C@@H](O)[C@@H](CO)C1 1681849662 DSUXCQCIEWXWTQ-IUODEOHRSA-N 371.384 0.296 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNCc1cccc(O)c1O 2218617000 QQVMRAGTUDIIKE-ZLDLUXBVSA-N 354.403 0.529 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2218736570 ABZKFFOSWSEDPH-IIRVCBMXSA-N 355.395 0.675 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCN(C)[C@H](C)C3)C2)cc1 828144108 SIONJHOSIIMMBH-OAGGEKHMSA-N 374.485 0.989 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCc4nnnn4CC3)C2)cc1 854183940 GTWLILCEOJZVOC-KBPBESRZSA-N 371.445 0.965 10 10 FCCE CCOC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1118706711 DNYNMYFFRBVQAA-AWEZNQCLSA-N 363.458 0.805 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N1C[C@@H]2CC[C@H](C1)O2 1335491987 ROCJPYVLJCDIDL-HDICACEKSA-N 373.453 0.871 10 10 FCCE COC(=O)[C@@H]1CC[C@H](C(=O)OC)N(C(=O)Cc2ccc(O)c(O)c2)C1 1453538450 IAPNSFLQYNYBJO-VXGBXAGGSA-N 351.355 0.594 10 10 FCCE CCS(=O)(=O)N[C@@H](CCSC)C(=O)NCc1cc(O)ccc1O 1644752676 OUJLHHMEKPLSFS-LBPRGKRZSA-N 362.473 0.775 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3C(=O)N3CCOCC3)CC2)cc1 243473405 NKKACYROSHECRU-MSOLQXFVSA-N 373.453 0.839 10 10 FCCE CC(=O)N1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H](C)C1 271406201 NEDRYHLSCJKJIE-JTQLQIEISA-N 355.416 0.457 10 10 FCCE CCOC(=O)[C@H]1CCCN1S(=O)(=O)Nc1ccc(O)cc1C(=O)O 274928114 OHJXICNORIGGRE-GFCCVEGCSA-N 358.372 0.775 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H](O)Cc1cnn(C)c1 786859590 GNNDQHFRLWNIFR-QGZVFWFLSA-N 374.441 0.591 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CNCC[C@@H]3C)CC2)cc1 842265290 DHMNGGZUFLTDSP-MAUKXSAKSA-N 374.485 0.848 10 10 FCCE NCC1(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCOCC1 861652474 GODHQFGTQYKHRJ-UHFFFAOYSA-N 362.474 0.955 10 10 FCCE NC(=O)c1ccc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)nc1 1299843010 SNQRSHHJVOJNCR-UHFFFAOYSA-N 356.382 0.483 10 10 FCCE COC(=O)[C@@]1(N2CCN(Cc3c(O)cccc3OC)CC2)CCOC1 1329160577 HAXYYTLQPJKRQE-GOSISDBHSA-N 350.415 0.851 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(C(=O)[C@H]2CCCO2)CC1 1330379538 OFCHUQMDUWDBKC-MRXNPFEDSA-N 373.409 0.084 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CC=C[C@H]1CO)c1ccc(N2CCOCC2)cc1 1332105609 PDDAJACEDVRQFT-PBHICJAKSA-N 359.426 0.460 10 10 FCCE C[C@@H](NC(=O)[C@@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C)c1ccccc1O 2332888873 JSQBTKVTBHOFJU-KJEVXHAQSA-N 366.414 0.911 10 10 FCCE Cc1cc(Cl)cc(CN[C@H]2CS(=O)(=O)C[C@@H]2N2CCOCC2)c1O 271841030 GTINGIXQCDACIX-GJZGRUSLSA-N 374.890 0.941 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)NC[C@H](C)S(N)(=O)=O)C2)cc1 823732411 FLMPUZGSTLRUCD-QWHCGFSZSA-N 370.475 0.498 10 10 FCCE NC(=O)[C@H]1C[C@@H](NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 845253518 NYJOTTCSKUZDDY-TXEJJXNPSA-N 368.384 0.865 10 10 FCCE N[C@@H]1C[C@H]2C[C@@]2(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 870869804 KWKDNFORTUCGLL-HDMKZQKVSA-N 363.483 0.665 10 10 FCCE CN1CCOC[C@]1(CO)CNC(=O)NCc1ccc(N2CC=CC2)cc1 919908611 IRJDDTDIAOYGBP-LJQANCHMSA-N 360.458 0.555 10 10 FCCE NC(=O)N[C@H](CO)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1137082391 YAFGSJWDBKAWTH-ZWNOBZJWSA-N 372.372 0.402 10 10 FCCE CN1CCN(c2ccc(CNC(=O)c3nc(N)nc(N(C)C)n3)cc2)CC1 1176083149 BGVNJQKULPFMKE-UHFFFAOYSA-N 370.461 0.202 10 10 FCCE COc1nn(C)cc1CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1335883855 HHHDPUZSSKCTKO-GFCCVEGCSA-N 359.430 0.988 10 10 FCCE CCOCCS(=O)(=O)NCC(=O)NCc1cccc(Cl)c1O 1472316705 DGCCZEVZDOFZEC-UHFFFAOYSA-N 350.824 0.618 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3C(N)=O)cc2)CC1 1596355127 KBFPHWKOGLDMHM-INIZCTEOSA-N 373.457 0.548 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCNC(=O)CC3(C)C)nc12 1659797968 WLUCJSGDCYWDEA-UHFFFAOYSA-N 361.402 0.712 10 10 FCCE Cc1ccc(C(=O)N2CCCN(S(=O)(=O)N(C)C)CC2)c(O)c1O 367826510 ZRJBHVLELDQQDQ-UHFFFAOYSA-N 357.432 0.361 10 10 FCCE CN(C)c1ccc(CNC(=O)NCCCN2CCCS2(=O)=O)cc1 725860574 PJDWWULLZPUNQU-UHFFFAOYSA-N 354.476 0.977 10 10 FCCE C[C@@H](NC[C@H](O)CN1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 775258902 LYNURGUSCXCIBF-XLIONFOSSA-N 362.518 0.782 10 10 FCCE Cn1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nc1O 822759062 HYEXJFXKXGJBOX-UHFFFAOYSA-N 364.427 0.291 10 10 FCCE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(CC(N)=O)C(=O)C2)cc1 837974294 SGNAQNWLGYGAHL-UHFFFAOYSA-N 354.410 0.864 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCNC[C@@H]2c2cccnc2)cc1 842037204 XJGDGUSFYVWUIM-GOSISDBHSA-N 367.453 0.937 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCCNC(C)C)C2)cc1 851687776 IFNAMWBONMAYBI-HNNXBMFYSA-N 362.474 0.894 10 10 FCCE COC(=O)c1c(CN2CC(O)(c3ncnn3C)C2)c2cc(F)ccc2n1C 895616751 OSCUOUDRKMWXTL-UHFFFAOYSA-N 373.388 0.936 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C[C@H]3COC(=O)C3)cc2)CC1 1133847712 SEVQYERXEQHAQJ-CQSZACIVSA-N 359.426 0.958 10 10 FCCE COc1nn(C)cc1CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1335883856 HHHDPUZSSKCTKO-LBPRGKRZSA-N 359.430 0.988 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2CCS(=O)(=O)[C@@H]3COCC[C@@H]32)cc1 1570205179 KYSQLACCLCYZKO-QWHCGFSZSA-N 366.399 0.877 10 10 FCCE NS(=O)(=O)c1ccc(CNC(=O)CCN2C(=O)CSC2=S)cc1 1865765223 WHCQNLAFQSKEGC-UHFFFAOYSA-N 373.481 0.201 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](CC(=O)NCCN=[N+]=[N-])C1 2010391696 ARFQXQARQUGLSM-JTQLQIEISA-N 361.424 0.837 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)CNC(=O)COc1ccc(N)cc1 2270655448 WBQOXMGSWNUNFG-UHFFFAOYSA-N 369.418 0.012 10 10 FCCE COCCCNS(=O)(=O)[C@@H]1CON(C)[C@@H]1c1ccc(N(C)C)cc1 34738690 MVPQZVXUQKCGDJ-HZPDHXFCSA-N 357.476 0.995 10 10 FCCE CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@@H]1OC(C)=O 221702343 LJICGUPPWNZTFT-HPCHECBXSA-N 373.318 0.380 10 10 FCCE Cn1cc(/C=C\C(=O)NCc2c(O)ccc3c2CCCC3)c(=O)n(C)c1=O 255777209 VXWWVAYTPIRHPI-NTMALXAHSA-N 369.421 0.998 10 10 FCCE CC(C)(C)n1nnnc1COC(=O)c1cc(NS(C)(=O)=O)ccc1O 766199684 IWOPGKDOZAHWIC-UHFFFAOYSA-N 369.403 0.862 10 10 FCCE Cn1nncc1NC(=O)C(=O)NCc1cc(Br)ccc1O 810414318 PMUKJPDVLXMIRL-UHFFFAOYSA-N 354.164 0.538 10 10 FCCE COC(=O)N(C)CCN(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 827576152 ZGIGXFJWIYQXGD-UHFFFAOYSA-N 368.409 0.665 10 10 FCCE NC[C@@H]1CC(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)=NO1 852859882 CWPQWBQYSICEIY-ZDUSSCGKSA-N 350.394 0.507 10 10 FCCE O=C1N[C@H](CC2OCCO2)C(=O)N1Cc1ccc(N2CCOCC2)cc1 924484122 UJRQQDXOJXQZJA-OAHLLOKOSA-N 361.398 0.707 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@H]1C[C@H](S(C)(=O)=O)C1 1119514716 ZQCIHOZAHKSTSL-CTYIDZIISA-N 367.471 0.403 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)c2cn(C[C@H]3CNC(=O)O3)nn2)c1 1150543428 OIRCBZOFNUQUJL-GXSJLCMTSA-N 361.358 0.592 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C[C@H]3CCNC3=O)cc2)C1 1358167691 FUQBIPUKDSMEQE-HUUCEWRRSA-N 358.442 0.531 10 10 FCCE NC(=O)[C@H]1CC(C(=O)NCc2c(O)cccc2O)=NN1c1ccc(F)cc1 1472063453 KSHWULLKVQPDFO-CQSZACIVSA-N 372.356 0.973 10 10 FCCE NC(=O)COc1ccccc1C=C1SC(=S)N(CC(=O)O)C1=O 2293532024 ZZKQWNGQJRTBQR-UHFFFAOYSA-N 352.393 0.837 10 10 FCCE COc1ccc(N2CCN(C(=O)NCCc3nnnn3C)CC2)cc1F 772080505 BDTREHRWBRNPHM-UHFFFAOYSA-N 363.397 0.432 10 10 FCCE CC(=O)N1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)[C@H](C)C1 803687795 PVWCPHQGVJAASD-CQSZACIVSA-N 372.469 0.764 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCNC(=O)C3CC3)C2)cc1 1118644504 OETQDNMKNRDQPD-CQSZACIVSA-N 374.441 0.033 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCC2(CC1)CO[C@H](CN)C2 1119702803 BRDMOFJVSHOHMO-HNNXBMFYSA-N 361.442 0.707 10 10 FCCE COc1ccc(N2CCN(C(=O)C3=NN(CCO)C(=O)CC3)CC2)cc1 1635784442 MGRGGJGWINIALE-UHFFFAOYSA-N 360.414 0.315 10 10 FCCE Cn1c(=O)c(NC(=O)c2ccc(O)c(O)c2)c(N)n(-c2ccccc2)c1=O 39125229 BIUTUYYUSCGNIR-UHFFFAOYSA-N 368.349 0.782 10 10 FCCE O=C1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCN1 105160880 MBKPPCXIVGCLGY-UHFFFAOYSA-N 364.421 0.818 10 10 FCCE C[C@H](O)[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCO1 840261528 NNVSPJVHNRTFQO-GUYCJALGSA-N 367.421 0.954 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCCCCS(N)(=O)=O)C2)cc1 854093499 HWOOZRPKSAZSQY-CYBMUJFWSA-N 370.475 0.642 10 10 FCCE O=C(O)c1cnn2c(O)cc(CN3CCS[C@H]4COCC[C@H]43)nc12 1118318307 DPVGWMJMIBIZBO-NEPJUHHUSA-N 350.400 0.839 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N3CC[C@]34CCOC4)cc2)CC1 1333945691 XCJUXIJWDLBGPX-HXUWFJFHSA-N 372.469 0.446 10 10 FCCE CS(=O)(=O)CCN1CCC(NC(=O)c2c(F)ccc(O)c2O)CC1 1558929155 KWVJWEVFWPKYEB-UHFFFAOYSA-N 360.407 0.476 10 10 FCCE CC[S@](=O)c1ccccc1C(=O)N1CCS(=O)(=O)[C@@H]2COCC[C@H]21 1638771168 ADCJTSZKAKNXHZ-NHBFPYQTSA-N 371.480 0.842 10 10 FCCE Cn1nnnc1CCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 771940087 NJEJWEQIXXBAPD-UHFFFAOYSA-N 363.397 0.228 10 10 FCCE C[C@H](NC(=O)[C@@H]1CCN=C2C1=NNN2C)c1ccc(N2CCOCC2)cc1 823834362 BHWWTLVEZULZSA-XJKSGUPXSA-N 370.457 0.925 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3cnn(C)c3)C2)cc1 827451695 NRGXMZSUFVWNQZ-AWEZNQCLSA-N 357.414 0.440 10 10 FCCE CNC(=O)NC[C@H]1CN(Cc2ccc(N3CCN(C)CC3)cc2)CCO1 862458715 HWPLYPATEOYHRB-SFHVURJKSA-N 361.490 0.568 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCC2(CC1)CO[C@@H](CN)C2 1119702805 BRDMOFJVSHOHMO-OAHLLOKOSA-N 361.442 0.707 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H]1CCS(=O)(=O)C1 1275224572 OHFSJVJRAZFOJI-GFCCVEGCSA-N 374.409 0.852 10 10 FCCE O=C1C[C@]2(CCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2)CN1 1323266654 FZLFSTAARKPMAW-HXUWFJFHSA-N 370.453 0.642 10 10 FCCE O=C(N[C@@H]1[C@H]2COC[C@H]21)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1323274773 XBQDAWPOHZZEHA-LJIGWXMPSA-N 360.410 0.661 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCNC(=O)OC 1633473207 LHIOICPYXUPCPQ-LBPRGKRZSA-N 368.386 0.824 10 10 FCCE CN1CCN(C(=O)C=Cc2cn(C)c(=O)n(C)c2=O)c2ccc(F)cc21 2297707120 OBEWCHMQUAIKTA-UHFFFAOYSA-N 358.373 0.719 10 10 FCCE CN[C@@H]1C(=O)Nc2cc(N3CCO[C@@H](CO)C3)c(Br)cc21 221134312 LQLLEKJMPLYZEI-OQPBUACISA-N 356.220 0.859 10 10 FCCE C[C@@H]1CCNC[C@@H]1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 842265975 FAVLOJRSZCVUCG-QAPCUYQASA-N 374.485 0.596 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@@H]3CC[C@H](C)NC3)CC2)cc1 861804522 QYUGUPCNWOYQOV-JKSUJKDBSA-N 374.485 0.991 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCC[C@@H]3NCC[C@@H]32)cc1 868419354 WUERDQPBFMRQRV-ROUUACIJSA-N 374.485 0.943 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H]3COC[C@@H](C2)O3)cc1 1321659587 XQBRFJFWXHQFFX-CALCHBBNSA-N 361.442 0.775 10 10 FCCE CCON(C)C(=O)CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1326952735 PPLVBWFXYQKIKU-UHFFFAOYSA-N 362.430 0.429 10 10 FCCE COc1ccc(N2CCN(C(=O)Cn3nc(CO)ccc3=O)CC2)cc1 1329591261 ZLRHKTILUFYUDS-UHFFFAOYSA-N 358.398 0.093 10 10 FCCE CC(C)(C)OC(=O)N1CC(n2cc(C(=O)C(=O)C[C@H]3C[C@H](N)C3)nn2)C1 2112570343 YMVNNKQHSCLAEH-XYPYZODXSA-N 363.418 0.949 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@](C)(O)CN2CCOCC2)cc1 75491460 WWTLTSTVUDSKLX-SFHVURJKSA-N 350.463 0.635 10 10 FCCE O=C(c1cc(O)cc(O)c1)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 169824460 FZRCIXKAPFTMDZ-UHFFFAOYSA-N 374.349 0.813 10 10 FCCE CCn1nccc1S(=O)(=O)Nc1ccc(O)c(S(=O)(=O)NC)c1 790407819 SDGPRSRXFRREDN-UHFFFAOYSA-N 360.417 0.318 10 10 FCCE C[C@@](O)(Cn1ccccc1=O)C(=O)NCc1ccc(N2CCOCC2)cc1 790572066 IVGTZTBLAPTFFB-HXUWFJFHSA-N 371.437 0.752 10 10 FCCE CNC(=O)c1cc(S(=O)(=O)NCc2ccc(OC)cc2O)cn1C 795356808 HLBAKCJLYHPVER-UHFFFAOYSA-N 353.400 0.577 10 10 FCCE CN1C[C@@H](NC(=O)C(=O)NCCCSc2nccs2)CCC1=O 806188335 UAYRBHOETUJUOU-JTQLQIEISA-N 356.473 0.479 10 10 FCCE CN(C)c1ccc([C@H](N)CNC(=O)c2cn([C@@H]3CCCNC3)nn2)cc1 832278526 DQVSGBBCKSMBAQ-HZPDHXFCSA-N 357.462 0.698 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1CN(C)C(=O)[C@H]1C 834857177 DQXBFQWKHFEODX-ZIAGYGMSSA-N 360.458 0.755 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H]3CCN=C4C3=NNN4C)CC2)cc1 854198709 PUABVTRXFFIOMM-OAHLLOKOSA-N 356.430 0.568 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1c[nH]nc1S(N)(=O)=O 1136428615 GEMRUNQJMXOWQG-UHFFFAOYSA-N 351.432 0.785 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1529404718 YCCDNZHWZDCKCN-AWEZNQCLSA-N 369.487 0.919 10 10 FCCE CC(C)CC(=O)N[C@H](CC(N)=O)C(=O)NCc1ccc(N(C)C)c(F)c1 1598028893 PDAYOHPMCLHVCL-CQSZACIVSA-N 366.437 0.914 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2136334742 DMJSWOAOWRRERV-RVMXOQNASA-N 369.422 0.876 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNCc1ccc(O)c(O)c1O 2225620950 AJNQRNBCTDPDTJ-SCDSUCTJSA-N 370.402 0.234 10 10 FCCE CN1C(=O)[C@@H]2ON(CC(=O)NC3CC3)[C@@H](c3ccc(N(C)C)cc3)[C@H]2C1=O 102544339 JMJZZRHHCYQLKN-IXDOHACOSA-N 372.425 0.303 10 10 FCCE CN(C)c1ccc(CN2CCN(CC(=O)N3CCOCC3)CC2)cc1F 119963264 UZSMLVMJLOIACR-UHFFFAOYSA-N 364.465 0.868 10 10 FCCE CN1CC[C@@H](C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)S1(=O)=O 843836741 XLIKLMUVACXEQR-HOCLYGCPSA-N 368.455 0.934 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2CC(N3CCOCC3)C2)c1 862109166 GOSARRXQCVFNIO-UHFFFAOYSA-N 369.443 0.357 10 10 FCCE COc1ccc(N2CCN(C(=O)Cn3cncc(OC)c3=O)CC2)cc1 918481435 FJKCSDGSELSHIB-UHFFFAOYSA-N 358.398 0.609 10 10 FCCE COc1ccc(N2CC[C@@H](N3C(=O)N[C@H](CC4OCCO4)C3=O)C2)cc1 924980974 XADALRBYOFQSJN-UKRRQHHQSA-N 361.398 0.957 10 10 FCCE CCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCS(=O)(=O)C1 1261857009 XJAVQRLPLGSNHG-GFCCVEGCSA-N 352.412 0.270 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(c2cccnn2)CC1 1330416078 XYUYVYNUXTZWHH-UHFFFAOYSA-N 353.382 0.373 10 10 FCCE COc1cc(N2CCN([C@@H]3CCN(OC)C3=O)CC2)cc(OC)c1OC 1354611855 YWJGBNOMMZSXAC-CQSZACIVSA-N 365.430 0.997 10 10 FCCE CN(Cc1ccccc1O)C(=O)NCc1nc(CS(C)(=O)=O)n[nH]1 1685412069 XDCNHSHDMYMEGW-UHFFFAOYSA-N 353.404 0.397 10 10 FCCE CSCC[C@@]1(C(=O)O)N[C@H](c2ccccc2O)[C@@H]2C(=O)N(C)C(=O)[C@H]21 104879587 BRPXHRAJUASVQS-IPJQOSJUSA-N 364.423 0.844 10 10 FCCE CN1C[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCC1=O 285620421 DHWBRUNHRRRXDQ-GFCCVEGCSA-N 350.394 0.245 10 10 FCCE COc1ccc(N2CCN(C(=O)COC(=O)Cc3cncnc3)CC2)cc1 811332040 ZESKBVJEOFXUPB-UHFFFAOYSA-N 370.409 0.920 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCn2nncc2C1 823518714 ATNMVVBSHYFLCM-UHFFFAOYSA-N 356.430 0.965 10 10 FCCE O=C1CO[C@H]2CCN(C(=O)NCCCSc3nccs3)C[C@@H]2N1 838513313 HCPZGVDGWYJDFO-QWRGUYRKSA-N 356.473 0.924 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)NCCC3(CN)CC3)C2)cc1 846345478 XQLGCUHAPOSXCB-OAHLLOKOSA-N 374.485 0.883 10 10 FCCE COC(=O)c1ncoc1COCC(=O)NCCc1ccc(O)c(O)c1 860238242 YYKKQJUJMXCDCH-UHFFFAOYSA-N 350.327 0.748 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)C3(O)CCOCC3)CC2)c(OC)c1 931530613 KPRPULUGKUVVPD-GOSISDBHSA-N 366.458 0.728 10 10 FCCE COCc1cc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ncn1 1255532286 XZOPFSKDGJTFLR-SNVBAGLBSA-N 360.370 0.720 10 10 FCCE CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)CC1(CO)CC1 186789289 NRDVUUJRJOYGQK-UHFFFAOYSA-N 365.449 0.983 10 10 FCCE COc1cc(N2CCN(C(=O)[C@@H]3COC(=O)N3)CC2)cc(OC)c1OC 295948256 IKZONWHORWRSQH-LBPRGKRZSA-N 365.386 0.469 10 10 FCCE CC1(OCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CNC1 844176785 WHPIOGSUPLNHKW-HNNXBMFYSA-N 360.458 0.383 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CNCC[C@H]3C)C2)cc1 851688522 CEWNHENWAXWGEY-KEYYUXOJSA-N 360.458 0.504 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCCN3S(C)(=O)=O)C2)cc1 855230398 CWUJBVKNEQRSFS-CZUORRHYSA-N 367.471 0.814 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)[C@]3(OC)CCS(=O)(=O)C3)C2)cc1 892685529 SDUGHYGXESBGPJ-DYVFJYSZSA-N 368.455 0.594 10 10 FCCE COc1cccc(CNC(=O)[C@@H](CC(N)=O)NC(=O)CC(C)C)c1O 1566374218 YYCVEIIPJZNFIP-GFCCVEGCSA-N 351.403 0.423 10 10 FCCE COc1cc(C)cc(CN(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)c1O 754727852 RDJIPDDBWTZEKJ-ZDUSSCGKSA-N 356.444 0.444 10 10 FCCE COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2C(=O)c1ccc(C)c(O)c1O 780992780 DXLRWLBRBGRMFB-FDYHWXHSSA-N 363.366 0.971 10 10 FCCE COC(=O)[C@@H](NCC(=O)NCc1ccc(N(C)C)cc1)c1ccnn1C 830383650 WAYDTKNXZDZJPA-KRWDZBQOSA-N 359.430 0.606 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)c3coc(S(N)(=O)=O)c3)C2)cc1 855234217 VKHNVFIEUUYGJF-LBPRGKRZSA-N 365.411 0.944 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)CCc3cnn(C)n3)cc2)CC1 857493875 DZWMUQXVXFMEDC-UHFFFAOYSA-N 370.457 0.733 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H](C)N1CCN(C(=O)OC(C)(C)C)CC1=O 859976346 XIJNVHPSRMBFMY-JTQLQIEISA-N 356.375 0.156 10 10 FCCE CN1CCOC[C@@]1(CO)CNC(=O)NCc1ccc(N2CC=CC2)cc1 919908610 IRJDDTDIAOYGBP-IBGZPJMESA-N 360.458 0.555 10 10 FCCE Cc1cc(C(=O)NC[C@@H](O)CS(C)(=O)=O)c(C)n1-c1ccccn1 1456615428 WXJOXVVZPRIKOG-CYBMUJFWSA-N 351.428 0.624 10 10 FCCE O=C(NCc1cc(O)ccc1O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1 1637125737 DTYJBQZIZDTGHY-CQSZACIVSA-N 372.381 0.905 10 10 FCCE CN(CCO)c1nc(=Nc2cc(Cl)ccc2O)nc(N(C)CCO)[nH]1 1871732430 IGDFIRIPYPJXCG-UHFFFAOYSA-N 368.825 0.253 10 10 FCCE CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@H]1OC(C)=O 2054661983 LJICGUPPWNZTFT-VJTDZRGJSA-N 373.318 0.380 10 10 FCCE COC(=O)COCC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 287276712 ARAISQVYHJDKBH-UHFFFAOYSA-N 365.430 0.123 10 10 FCCE CN(C)CCN1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1=O 845635323 NVVNQPWNOWCTKQ-UHFFFAOYSA-N 363.374 0.136 10 10 FCCE COCCONC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1227568425 SGRXDBHYLKMIMI-UHFFFAOYSA-N 350.419 0.766 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CC(F)(F)C[C@@H]1CO 1329164574 LEVLDTKCYLBUKV-OAHLLOKOSA-N 365.380 0.908 10 10 FCCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1C[C@@H]2C[C@H]1C[S@@]2=O 1329794456 HWMTZSHXFUVFNA-NWLBTCKQSA-N 361.467 0.635 10 10 FCCE CS(=O)(=O)[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1351917518 ADCIHUUVMWTUDK-CYBMUJFWSA-N 366.439 0.660 10 10 FCCE O=C(Cn1c(O)nnc1O)NCc1ccc(N2CCC(CO)CC2)cc1 1465395419 YEZVCNWIXJEGHL-UHFFFAOYSA-N 361.402 0.214 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 1544087847 QYNRTCAINHZHOJ-KGLIPLIRSA-N 369.439 0.835 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CO)C[C@H]2CCCO2)c1 1652026325 SRLGKOAUHCACKI-VXGBXAGGSA-N 358.416 0.424 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H](C)NC(=O)c3cnccn3)CC2)cc1 1862038308 SSZACUNXYDEOII-CQSZACIVSA-N 369.425 0.952 10 10 FCCE CS(=O)(=O)C1=NN2C(=N)C(=Cc3ccc(O)c(O)c3)C(=O)N=C2S1 2297345990 UQRMYJNFQROHRE-UHFFFAOYSA-N 366.380 0.719 10 10 FCCE NC(=O)CN1CCN(C(=O)C=Cc2ccc(N3CCOCC3)cc2)CC1 2297505850 DDRLXRDVIHKNJD-UHFFFAOYSA-N 358.442 0.166 10 10 FCCE Cn1cnn(CCC(=O)NCc2cc(Br)ccc2O)c1=O 816654042 RNVXIZQMCZHBMZ-UHFFFAOYSA-N 355.192 0.756 10 10 FCCE CN1C[C@@H](O)C[C@@]1(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 900902796 ZSHPCEMDDRZQLS-KXBFYZLASA-N 365.449 0.858 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(N2CCCC2=O)CC1 1119006189 XIJJFMWVDFBFRD-UHFFFAOYSA-N 357.410 0.848 10 10 FCCE CC(C)(C)C(=O)NCC(=O)OCCC(=O)NCc1ccc(O)c(O)c1 1150378827 WPTCCLZKSZINRN-UHFFFAOYSA-N 352.387 0.810 10 10 FCCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(C(=O)c3ccc(N=NC(N)=O)cc3)C[C@@H]12 1470202763 OJLUXZVGPMVXEY-XQQFMLRXSA-N 366.399 0.733 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1526967342 GZIGCVSWVNVFRB-AWEZNQCLSA-N 369.487 0.982 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCc2cc(O)c(O)cc2C1 2318659303 ARIDPGCPPSMJPZ-LBPRGKRZSA-N 352.387 0.868 10 10 FCCE CN1CCN(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c2ccccc2C1 103447142 VKGVDBFAWIEDAP-CMDGGOBGSA-N 354.410 0.576 10 10 FCCE CCOC(=O)c1c2c(nn1C)CCN(C(=O)c1cc(O)c(O)c(O)c1)C2 170190785 MXAUPGHBGQZCML-UHFFFAOYSA-N 361.354 0.912 10 10 FCCE COC(=O)C1=C[C@H](N=[N+]=[N-])[C@H](NC(C)=O)[C@H]([C@@H](OC)[C@@H]2COC(=O)O2)O1 504791824 DMLIIKCIUVVBPP-IMDBTTTGSA-N 370.318 0.176 10 10 FCCE O=C(CN1C(=O)[C@@H]2C[C@H]2C1=O)NCc1ccc(N2CCOCC2)c(F)c1 760369415 AFORNUGZQMPCQI-CHWSQXEVSA-N 361.373 0.283 10 10 FCCE CS(=O)(=O)N[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 780524216 FJJDDWBZOQSKFP-VIFPVBQESA-N 370.387 0.444 10 10 FCCE O=C1CC[C@@H](CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)N1 853453102 NYKQBYSSRWZPRW-ZDUSSCGKSA-N 364.421 0.865 10 10 FCCE CCON(C)C(=O)CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1261542841 WGHHYDTXHIHCSS-UHFFFAOYSA-N 350.419 0.237 10 10 FCCE CC[C@@H]1C(=O)NCCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1652444786 MGFFYLFGWJROST-GFCCVEGCSA-N 355.416 0.504 10 10 FCCE CC(C)[C@@H](NC(N)=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 123676916 KVNVJQZMVKZBBZ-OAHLLOKOSA-N 352.410 0.971 10 10 FCCE CN1CN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC1=O 841587565 QXUZKPLYBXTXHR-UHFFFAOYSA-N 354.357 0.743 10 10 FCCE C[C@@H](CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)NC(N)=O 847538342 FUKKHDLAQHICTD-NSHDSACASA-N 352.410 0.850 10 10 FCCE CS(=O)(=O)C[C@@H](O)CNCc1cc(Br)cc(F)c1O 922826254 XFMMLOBXWFTUTC-VIFPVBQESA-N 356.213 0.789 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@]34COC[C@@H]3C4)CC2)cc1 923363867 BQJSGTNBEBXIKF-XVYOSBPZSA-N 371.437 0.805 10 10 FCCE CN(C)CCCNC=C1C(=O)NC(=O)N(CCc2ccc(F)cc2)C1=O 2296110236 IPVIDZYNWHDMHZ-UHFFFAOYSA-N 362.405 0.872 10 10 FCCE O=C1CN(CC(=O)Nc2c(-c3ccccn3)nc3ccccn23)C(=O)N1 820006025 GNMYCVSHXZFKJV-UHFFFAOYSA-N 350.338 0.887 10 10 FCCE CCN1C(=O)CO[C@H](C(=O)N2Cc3cccc(O)c3C2)[C@H]1c1nccn1C 871207055 JAYXOUZOIKATDV-IRXDYDNUSA-N 370.409 0.957 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H]3CCNC3=O)cc2)CC1 879688042 RNKLSLABTULXRP-INIZCTEOSA-N 358.442 0.498 10 10 FCCE CCN1CC[C@H]1CNC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 898319578 BAPJSKBBNWGJON-SFHVURJKSA-N 373.501 0.265 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H](N)C(C)(C)C3)CC2)cc1 923431947 YYHDJTDMJMKNMX-PKOBYXMFSA-N 362.518 0.847 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C3(CS(C)(=O)=O)COC3)C2)cc1 1352424347 VJPXCLFFPXHPID-CYBMUJFWSA-N 368.455 0.451 10 10 FCCE Cc1oncc1CN1CCN(C(=O)CN2C(=O)CSC2=S)CC1 238856699 KAFHQNKRXPXCGY-UHFFFAOYSA-N 354.457 0.488 10 10 FCCE CC(C)(C)OC(=O)N1CC(NCc2cc3c(cc2O)OCO3)(C(N)=O)C1 715488371 QVFMOPPBQLYHSD-UHFFFAOYSA-N 365.386 0.685 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCC3=CCNCC3)C2)cc1 851689521 QBQUKMFPBFRRRZ-MRXNPFEDSA-N 372.469 0.816 10 10 FCCE CCOCCS(=O)(=O)NCC(=O)NCc1ccc2cccnc2c1O 862027633 ZHJTXKAEEYUYRR-UHFFFAOYSA-N 367.427 0.513 10 10 FCCE O=S(=O)(C[C@@H]1CNCCO1)NCc1ccc(N2CCSCC2)cc1 866745516 GUWAKOVMVHUBFE-INIZCTEOSA-N 371.528 0.648 10 10 FCCE CCN1CCC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1=O 1456064391 KRIZQJKNNSYPGU-GFCCVEGCSA-N 355.416 0.504 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2CN(c3ccncn3)C2)c1 1558016306 WWRMRVNJNPCBIR-UHFFFAOYSA-N 363.399 0.172 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCNC3=O)cc2)C1 1597004870 YGDGZDJVFXLBOT-ZBFHGGJFSA-N 358.442 0.531 10 10 FCCE O=C(c1cc(O)nc(O)c1)N1CC(N2CCN(c3ccccn3)CC2)C1 585563800 QXBWKIKAPBSKIJ-UHFFFAOYSA-N 355.398 0.534 10 10 FCCE O=C([C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1)N1CCOCC1 768440525 FDTUZEGBVDWZRM-DYVFJYSZSA-N 362.426 0.889 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1 808509370 NCMOFAHCUPORQP-RZIFZGNASA-N 372.377 0.491 10 10 FCCE CCCN1CC[C@@H](NC(=O)C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 830454329 HSGFDGHXBCCHCI-HZPDHXFCSA-N 374.485 0.991 10 10 FCCE CO[C@H](COC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCOC1 849711987 DXLCCZXGALVDGO-QMTHXVAHSA-N 359.400 0.972 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@H]3CCCNC3)C2)cc1 851687910 KVZMBXLUZJMBRD-LSDHHAIUSA-N 360.458 0.506 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCc3nnc4n3CCOC4)C2)cc1 852275428 OUUAKYHSAHVORE-CYBMUJFWSA-N 372.429 0.895 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)c3nc(O)nc(O)c3OC)C2)cc1 855225088 IRJYBDQOGCOOPF-SNVBAGLBSA-N 360.370 0.914 10 10 FCCE Cn1cc(C(C)(C)NC(=O)c2cc(NS(C)(=O)=O)ccc2O)nn1 1162943842 XMAZCJOBZXGOTI-UHFFFAOYSA-N 353.404 0.557 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC3(CC2)COCCO3)cc1 1353637504 ILIWFFVMLBMHOV-UHFFFAOYSA-N 361.442 0.777 10 10 FCCE CC[C@H](NC(C)=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1356434762 VWQDSGVSSAQMFH-RDJZCZTQSA-N 360.458 0.919 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3CCOC(=O)N3)cc2)CC1 1471912788 YJUQKADNKBHRSD-OAHLLOKOSA-N 360.414 0.503 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCC3(C2)OCCO3)c1 1637395960 TZPDGBMBFWDGFA-NSHDSACASA-N 356.400 0.789 10 10 FCCE COc1ccc(N2CCN(C(=O)c3ns[nH]c3=O)CC2)c(OC)c1 1648343858 CRAGOJUXGXPXHX-UHFFFAOYSA-N 350.400 0.811 10 10 FCCE COCCS(=O)(=O)CC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855229883 AKXYNOQOKXBLBZ-CYBMUJFWSA-N 356.444 0.451 10 10 FCCE CO[C@H]1COCC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 897580199 QCQHZVLHKISYSW-CVEARBPZSA-N 367.421 0.770 10 10 FCCE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCNC(=O)CO)cc1 906463782 HDXYKWDQXRVVDI-KRWDZBQOSA-N 363.458 0.759 10 10 FCCE COC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCCOC1 1303725607 PBTKUNHCKWWFCT-FZMZJTMJSA-N 372.443 0.935 10 10 FCCE C[C@H]1CN(CC(C)(C)O)CCN1C(=O)C(=O)N1Cc2cccc(O)c2C1 1348638542 DZQQZKHEBIGJKU-ZDUSSCGKSA-N 361.442 0.538 10 10 FCCE CN(C)CCC[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCO1 1348662626 PTDMXLIOQSTNSD-OAHLLOKOSA-N 361.442 0.804 10 10 FCCE C[C@@H]1NC(=O)[C@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H]1C 1583302842 PMNKHBPTASZMIR-GUBZILKMSA-N 355.416 0.501 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3[C@@H](C)[C@@H](C)NC(=O)[C@H]3C)nc12 1643642931 TUYWUVJOBNYRJT-OUAUKWLOSA-N 361.402 0.709 10 10 FCCE Nc1ccc(CS(=O)(=O)N2C[C@H]3C[C@H]2CN3C(=O)C(F)(F)F)cc1 2044641114 JPSXWHIIIRZYIQ-NEPJUHHUSA-N 363.361 0.946 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CN1C(=O)NC(=O)C1(C)C 735836945 OBMVNGPGYQYYLS-UHFFFAOYSA-N 374.441 0.812 10 10 FCCE CC(C)CN1CCO[C@@H](CNC(=O)COC(=O)c2cccc(O)c2O)C1 758573101 OZPCFKZHFUYHHF-ZDUSSCGKSA-N 366.414 0.728 10 10 FCCE COC[C@@H](O)CNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 802013071 SMPQRJHJDRMSFC-HOCLYGCPSA-N 364.446 0.195 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)Cn3cncn3)C2)cc1 827607479 BEAPTDIFGPROEF-KBPBESRZSA-N 372.429 0.187 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)/C=C\C(=O)N(C)C)cc2)CC1 1447707359 GAXKQKHFDLLHHP-HJWRWDBZSA-N 358.442 0.616 10 10 FCCE COc1c(O)nc(O)nc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1558124959 WGTFOJOKNFCWDI-UHFFFAOYSA-N 373.413 0.578 10 10 FCCE C[C@H]1[C@H](C(N)=O)CC[C@@H](C)N1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1627712108 WKAWHTRBWCKPTL-JFGNBEQYSA-N 369.443 0.878 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCCCCN=[N+]=[N-])[C@@H](O)C1 2076823038 YHCIMQFRGKGJIM-XHDPSFHLSA-N 357.411 0.926 10 10 FCCE Cc1cc(=O)oc2cc(O[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3N=[N+]=[N-])ccc12 575417071 JZSHWIUBDQNWDV-DGVSKKNDSA-N 363.326 0.598 10 10 FCCE Cc1nc(CN2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)n[nH]1 735872695 QKFOGDQITSZVML-UHFFFAOYSA-N 371.489 0.613 10 10 FCCE CCN1C(=O)[C@@H]2CN(C(=O)NCc3ccc(N(C)C)cc3)CCN2C1=O 757582828 GZLNTCCXDNGZPB-HNNXBMFYSA-N 359.430 0.931 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H](CO)NC(=O)c1cccc(Br)c1 808509004 HDIYIFSJMBPKOL-NSHDSACASA-N 372.171 0.241 10 10 FCCE O=S1(=O)CCN(c2ccc(CNC[C@@H](O)C(F)(F)F)cc2)CC1 849326075 BWRQCEGYWIBORM-CYBMUJFWSA-N 352.378 0.934 10 10 FCCE COC(=O)CCNC(=O)CCNCc1ccc(N2CCOCC2)c(F)c1 858292822 NEMWIFKLHPWELO-UHFFFAOYSA-N 367.421 0.821 10 10 FCCE CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NCc1ccc2cccnc2c1O 862028178 SGECFYKLWMYGAZ-HNNXBMFYSA-N 370.409 0.684 10 10 FCCE CC1(C)O[C@H]2CO[C@]3(COS(=O)(=O)N=[N+]=[N-])OC(C)(C)O[C@@H]3[C@H]2O1 1085194953 ULLWHTAOFMDWSA-APOZVJGGSA-N 365.364 0.956 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCC(=O)N(C)OCC 1118364408 MUWRZMLHGHYZGC-UHFFFAOYSA-N 351.403 0.657 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 1148585893 CVOYZLFVPUAUSJ-BXKDBHETSA-N 354.359 0.513 10 10 FCCE COc1cc(N2CCN(C(C)(C)C(N)=O)CC2)c([N+](=O)[O-])cc1OC 1306990993 RLTULZZXFSETTC-UHFFFAOYSA-N 352.391 0.998 10 10 FCCE CN1CCN(c2ccc(CN3CCO[C@H](CC(N)=O)C3)cc2F)CC1 1329077292 BKVZPTCRGUPYNB-OAHLLOKOSA-N 350.438 0.654 10 10 FCCE CCON(C)C(=O)CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 1329831392 ZYUHPRZUIOXQGE-UHFFFAOYSA-N 350.419 0.203 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCc3nn[nH]n3)cc2)C1 1544929701 LPVIUVWIIWDYHK-CYBMUJFWSA-N 357.418 0.150 10 10 FCCE CCCNC(=O)CCC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCC 1624659548 WJBXVMWRJUWSRJ-ZDUSSCGKSA-N 366.414 0.995 10 10 FCCE NC(=O)CC[C@@H](N)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866105724 RCKGUWQBSBESEL-CYBMUJFWSA-N 351.362 0.993 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNCc1cccc(O)c1O 2312325101 QQVMRAGTUDIIKE-LNSITVRQSA-N 354.403 0.529 10 10 FCCE CC(=O)NCCC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCOCC1 41310356 OWQKIBFGSVVAPH-SFHVURJKSA-N 362.474 0.768 10 10 FCCE COCCN(C(=O)N(C(C)=O)c1ccc(N)cc1)[C@H]1CCS(=O)(=O)C1 244236704 WEVPXMLPDDVTBG-HNNXBMFYSA-N 369.443 0.877 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CN3CCCCC(=O)C3=O)C2)cc1 869229001 RCPBAWHWTAFKIF-CQSZACIVSA-N 359.426 0.972 10 10 FCCE CO[C@H]1COCC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 897809744 WXKCUUGNIBJXMO-MSOLQXFVSA-N 373.453 0.941 10 10 FCCE C[C@H]1[C@@H](C)N(C)C(=O)[C@@H](C)N1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1163828599 NSSPOQNBCDTIHZ-OUAUKWLOSA-N 369.443 0.843 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)CCC(=O)NC1 1256532823 NCKTXLALURUJLV-KPZWWZAWSA-N 364.398 0.605 10 10 FCCE C[C@@H]1[C@H](O)CCCN1C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1332795121 CDPYEGBJMBFPNA-RHSMWYFYSA-N 361.442 0.511 10 10 FCCE NC(=O)c1ccc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)[nH]1 1455865231 FTKPFGZNBAHTKJ-UHFFFAOYSA-N 369.425 0.745 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)CCCc3nn[nH]n3)cc2)CC1 1634974355 PRORPWYXMLMZJV-UHFFFAOYSA-N 371.445 0.541 10 10 FCCE CN(C)C(=O)/C=C\C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1644863772 RSOXAXVEBVPUHB-FPLPWBNLSA-N 358.442 0.649 10 10 FCCE CN(C)c1ccc([C@@H](NC(=O)[C@H](N)CCC(=O)O)c2nccn2C)cc1 1866022536 YKRPYIIMSUZXPW-GDBMZVCRSA-N 359.430 0.884 10 10 FCCE COC[C@@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CN(C(=O)OC(C)(C)C)CCO1 2112571286 NLZYQCUSVCDKDS-SNUQEOBHSA-N 370.446 0.905 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(CCNC(=O)c2cc(O)nc(O)c2)C1 2230125174 JSZJBMSCSRCVMK-KRWDZBQOSA-N 367.402 0.985 10 10 FCCE CN(Cc1ccc(N)cc1)C(=O)C(CO)(CO)NC(=O)OC(C)(C)C 2320915437 BHVYRYJGUGJKAD-UHFFFAOYSA-N 353.419 0.475 10 10 FCCE CS(=O)(=O)N1CCCN(Cc2ccc(N3CCOCC3)cc2)CC1 125114273 MGLBCBAPOJHABP-UHFFFAOYSA-N 353.488 0.991 10 10 FCCE CO[C@@](C)(CO)CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 847290853 AZYXBGRXOGJOCP-QGZVFWFLSA-N 355.410 0.859 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC[C@@H](F)[C@H](N)C1 852917853 RZRZLPUJWGNXBH-HZPDHXFCSA-N 350.438 0.999 10 10 FCCE C[C@@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CS1(=O)=O 1328780810 QTOMJXDHWITCKF-TZMCWYRMSA-N 367.471 0.451 10 10 FCCE CN1C(=O)C(=CN[C@H](Cc2c[nH]c3ccccc23)C(=O)O)C(=O)NC1=S 2296930338 QCMQWCNUTWQPTG-CYBMUJFWSA-N 372.406 0.510 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)Cn2cnc3c(cnn3C)c2=O)c1 728980107 VPSRDOOICOAVRA-JTQLQIEISA-N 357.370 0.722 10 10 FCCE C[C@H](COC(=O)c1cc(NS(C)(=O)=O)ccc1O)CS(C)(=O)=O 758003861 QEKQGFOHXPYBEG-SECBINFHSA-N 365.429 0.601 10 10 FCCE NC(=O)[C@H]1CC[C@H](CNC(=O)NCc2cc(Br)ccc2O)O1 805201361 UBBOZWXTFKNPOL-ZYHUDNBSSA-N 372.219 0.987 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNCCCn3ccnn3)CC2)cc1 819223880 OSOFEXIIVCIXOI-GOSISDBHSA-N 374.489 0.450 10 10 FCCE CN1NN=C2C1=NCC[C@@H]2C(=O)NCc1cccc(Br)c1O 834476217 RMTPQCIQMNOHNF-VIFPVBQESA-N 366.219 0.995 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](OCC)[C@H](CN)C1 846352896 YHPXFNGXLRHYBY-NVXWUHKLSA-N 363.458 0.953 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN(CCO)C[C@@H]3C)C2)cc1 854296686 FZNFNEDAWUDLON-JKSUJKDBSA-N 362.474 0.982 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCN(C)S3(=O)=O)C2)cc1 855225041 NKXYMBSFMNMHDO-IUODEOHRSA-N 353.444 0.424 10 10 FCCE CN(C)S(=O)(=O)N1CC(NCc2cc(Cl)cc([N+](=O)[O-])c2O)C1 858311609 JSDFUBBSHPXVDB-UHFFFAOYSA-N 364.811 0.534 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@@H](CC(N)=O)C1 859319754 SOYRJOKJAWNRLG-AWEZNQCLSA-N 363.414 0.234 10 10 FCCE CC(=O)NC(=N)SC1(CS(=O)(=O)O)C(=O)c2ccccc2C1=O 1088688054 HEPBGQSANCEPKV-UHFFFAOYSA-N 356.381 0.496 10 10 FCCE COc1ccc(S(N)(=O)=O)cc1NC(=O)Cc1ccc(O)c(O)c1 1136068835 ADXQLTBJEMQFJI-UHFFFAOYSA-N 352.368 0.935 10 10 FCCE C[C@H](NC(=O)C(=O)NCC[C@@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 1262269793 GIZCGQKWPVERHS-UONOGXRCSA-N 360.458 0.914 10 10 FCCE CN1CCN(c2ccc(CNC[C@]3(OCCO)CCOC3)cc2F)CC1 1327202747 ZHQRUVBVLCIGIS-LJQANCHMSA-N 367.465 0.835 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)NC3C[C@@H]4C[C@H]4C3)cc2)CC1 1331763765 AUCVUXIQAYHVIH-HOTGVXAUSA-N 356.470 0.969 10 10 FCCE COc1ccc(S(N)(=O)=O)c(OC)c1C(=O)NCc1ccccc1O 1630363047 GXJBYKPGUDMSTH-UHFFFAOYSA-N 366.395 0.987 10 10 FCCE CC(=O)C(=O)COC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C 808501488 QBWQZXOZKIHJNR-SFHVURJKSA-N 358.350 0.687 10 10 FCCE CC(=O)C(=O)COC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O 808544310 XFGBQBYJLYXSDR-UHFFFAOYSA-N 355.368 0.492 10 10 FCCE O=C(O)c1cc(O)ccc1NS(=O)(=O)C[C@H]1CCCS(=O)(=O)C1 844782501 ADMGSHSFYVKWSR-VIFPVBQESA-N 363.413 0.657 10 10 FCCE COC(=O)[C@]1(N2CCN(Cc3c(O)cccc3OC)CC2)CCOC1 1329160579 HAXYYTLQPJKRQE-SFHVURJKSA-N 350.415 0.851 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NC[C@]1(N2CCOCC2)CCSC1 1542293817 FNTIUVHAENYXNO-QGZVFWFLSA-N 352.456 0.964 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC[C@@H](CS(N)(=O)=O)C2)c([N+](=O)[O-])c1 1651480581 BKBHTDQPNHGPIT-KTLBGCOUSA-N 369.399 0.896 10 10 FCCE CN(Cc1ccccc1O)C(=O)[C@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C 2332890145 NJFHBLLSMJBFEE-ZNMIVQPWSA-N 366.414 0.692 10 10 FCCE COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)OCC(=O)C(C)=O)C1=O 808529765 SBXJTPQUKCWANE-QGZVFWFLSA-N 362.338 0.164 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCc3cnccn3)C2)cc1 827266169 PPGZZUKRJNRWBR-OAHLLOKOSA-N 369.425 0.539 10 10 FCCE NC1(CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CCOCC1 861562051 KHLHUJHBBRUBEO-UHFFFAOYSA-N 366.437 0.969 10 10 FCCE CN1C[C@H](O)C[C@]1(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 900902794 ZSHPCEMDDRZQLS-DNVCBOLYSA-N 365.449 0.858 10 10 FCCE CC(C)(/N=N/C(C)(C)NC(=O)N1CCOCC1)NC(=O)N1CCOCC1 1615949052 NCGZNZOHJRIFLK-FMQUCBEESA-N 370.454 0.994 10 10 FCCE CN(C)c1nc(N)nc(C(=O)NCc2cccc(Br)c2O)n1 1623364302 OYKLHMCEEWVIIP-UHFFFAOYSA-N 367.207 0.918 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3[C@H](C)C(=O)N[C@@H](C)[C@H]3C)nc12 1643642930 TUYWUVJOBNYRJT-HBNTYKKESA-N 361.402 0.709 10 10 FCCE CC(C)CN1C(=O)/C(=C\NCCCN2CCCC2=O)C(=O)NC1=S 60861225 PXEQCTVFDKKHFS-XFXZXTDPSA-N 352.460 0.372 10 10 FCCE Nc1ccc(NC(=O)CCn2cc(Br)c(=O)[nH]c2=O)cc1 88452901 FUACZQOXGZEPOZ-UHFFFAOYSA-N 353.176 0.910 10 10 FCCE COc1ccc(N2CCCN(C(=O)NCCc3nnnn3C)CC2)cc1 772084697 UBWRPVNMCULLGW-UHFFFAOYSA-N 359.434 0.683 10 10 FCCE CC(C)Oc1cncc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)n1 847500964 LOEPTKJWNOBTEO-UHFFFAOYSA-N 360.370 0.972 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)NCC[C@H]3CCOC3)cc2)CC1 897816300 JSQCSCAGVICVOU-KRWDZBQOSA-N 374.485 0.597 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N1C[C@H](N)C(C)(C)C1 903715375 ULBFGRXCPFCCPT-KRWDZBQOSA-N 374.485 0.677 10 10 FCCE COC[C@H](CCNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)OC 1328959511 OYYZZAHMKBOFIN-INIZCTEOSA-N 351.447 0.845 10 10 FCCE COC(=O)[C@@]12C[C@@H](NC(=O)c3cc(NS(C)(=O)=O)ccc3O)C[C@@H]1C2 1454833307 GHOZSYMJQWXFEY-RBIVETJNSA-N 368.411 0.835 10 10 FCCE O=C(CCNS(=O)(=O)c1cccnc1)NCc1c(O)cccc1O 1472063983 RCYFKDFMMAEXOD-UHFFFAOYSA-N 351.384 0.478 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H](C)NC(=O)c3cnccn3)CC2)cc1 1862038307 SSZACUNXYDEOII-AWEZNQCLSA-N 369.425 0.952 10 10 FCCE Cc1nn(C)c2c1[C@H](c1ccc(O)c(O)c1)C(C(=O)N1CC(O)C1)=C(N)O2 1865026848 BNRYURMOFABQIX-AWEZNQCLSA-N 372.381 0.037 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1C[C@@H](O)CN(C(=O)c2cc(O)c(O)c(O)c2)C1 2132348283 ICJCSPOXPYTOCE-WDEREUQCSA-N 368.386 0.904 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2311714771 HFWNOOKCTHKEAI-WHOHXGKFSA-N 355.395 0.486 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CC(=O)N(C)[C@@H](C)C1 297934848 VBTXFHKQOTUOTI-AWEZNQCLSA-N 360.458 0.790 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCC[C@H](C(N)=O)C2)c1 746885217 CXUOAQOSBYDRPD-UWVGGRQHSA-N 355.416 0.538 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CN3C(=O)NC(C)(C)C3=O)C2)cc1 855228548 CSABNQXAYNNNIV-LBPRGKRZSA-N 360.414 0.721 10 10 FCCE C[C@@H]1NCC[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 861813914 YFNFLHZISJHPSO-WMLDXEAASA-N 360.458 0.348 10 10 FCCE Cc1nnc(NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)n1C 863205103 CUWICBXSRPSJJW-UHFFFAOYSA-N 369.476 0.687 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCC[C@@H](C)CO)C2)cc1 1328092166 JKSAHOUCTSVZFF-CABCVRRESA-N 363.458 0.915 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@@H](CO)[C@@H](CCO)C1 1348483694 PLKZMLBTLPESHJ-IRXDYDNUSA-N 363.458 0.656 10 10 FCCE COC(=O)[C@@H]1CCCN(CC(=O)N[C@@H](C)c2cc(OC)ccc2O)C1=O 1465993182 OSRTXHSRXOKMJM-WCQYABFASA-N 364.398 0.990 10 10 FCCE CCS(=O)(=O)N[C@H](CCSC)C(=O)NCc1ccc(O)cc1O 1639444489 NIPOFKQCSUDBGY-GFCCVEGCSA-N 362.473 0.775 10 10 FCCE COc1ccc(CNC(=O)c2nnc(C(C)(C)S(C)(=O)=O)o2)c(O)c1 1639458792 HPFNTBXXNRDQOY-UHFFFAOYSA-N 369.399 0.994 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](CO)(NC(=O)c2cc(O)c(O)c(O)c2)C1 2133571127 LKNXUAMCVXVKLE-QGZVFWFLSA-N 368.386 0.905 10 10 FCCE Cc1ccc(N2C(=O)C(=CNN3CCN(C)CC3)C(=O)NC2=S)cc1 2296924187 YTUNVHFOCJTIER-UHFFFAOYSA-N 359.455 0.379 10 10 FCCE Cc1cc(=O)oc2cc(O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3N=[N+]=[N-])ccc12 77303625 JZSHWIUBDQNWDV-JZYAIQKZSA-N 363.326 0.598 10 10 FCCE in-vitro CN(CCCO)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 789834356 LZICODRJLHUNNP-UHFFFAOYSA-N 367.421 0.244 10 10 FCCE COc1ccc(N2CC[C@H](CNC[C@@H](O)CN3CCN(C)CC3)C2)cc1 819379735 KULIZDTYZUZIIG-IEBWSBKVSA-N 362.518 0.719 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3cc(OC)ncn3)C2)cc1 850536578 HJQGQAMBPKGIAH-GFCCVEGCSA-N 371.397 0.827 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCC3(CN)CC3)C2)cc1 851689612 RILARNQEVKPZAI-CQSZACIVSA-N 360.458 0.635 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CCN=C4C3=NNN4C)C2)cc1 855227652 ZVOKLYPULDQZIV-DOMZBBRYSA-N 356.430 0.615 10 10 FCCE C[C@@H]1CC[C@H](NC(=O)C(=O)N(C)Cc2ccccc2O)CS1(=O)=O 1118670740 XOOLPMXLCKJZHJ-YPMHNXCESA-N 354.428 0.433 10 10 FCCE CNC(=O)C1(NCc2ccc(N3CCN(C)CC3)c(F)c2)CCOCC1 1119452222 HXIURCBOCBLEIK-UHFFFAOYSA-N 364.465 0.962 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)c1cn(C[C@@H]2CNC(=O)O2)nn1 1126082224 JQKSOCHQHJDVLB-AWEZNQCLSA-N 358.402 0.691 10 10 FCCE O=C(C(=O)N1CC[C@@H](Nc2ncccn2)C1)N1Cc2cccc(O)c2C1 1351918712 HHMBFDYWEZEDJD-CYBMUJFWSA-N 353.382 0.737 10 10 FCCE CC(=O)C1=S=C(NC(=O)c2cc[n+]3[nH]ccc3n2)N=C1c1ccccc1 1567889600 IKXQYVKPOWXLOA-UHFFFAOYSA-O 364.410 0.963 10 10 FCCE CN(C)CCCN(C(=O)Cc1ccc(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1 1621639834 VIIPNAGYKYWFAM-CQSZACIVSA-N 370.471 0.608 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@H]1NCCNC1=O 1952208536 KICSMGFAAJUXNF-SMDDNHRTSA-N 351.403 0.622 10 10 FCCE COc1ccc(Br)c(CNC[C@H]2CCS(=O)(=O)N2)c1O 1965975031 AQEOFHOSCGXPSW-MRVPVSSYSA-N 365.249 0.945 10 10 FCCE C[C@H](C(=O)O)S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 49049428 WSFVCQDXNHVVFL-ZCFIWIBFSA-N 356.809 0.926 10 10 FCCE CN1CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1=O 764997545 ITBYXVPNYZQXFP-UHFFFAOYSA-N 350.394 0.010 10 10 FCCE CN(C)CCn1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)cn1 774356875 OGQMGDAKWALASP-UHFFFAOYSA-N 361.402 0.153 10 10 FCCE Cn1cc(/C=C\C(=O)N2CCCc3cc(CN)ccc32)c(=O)n(C)c1=O 843339893 JEKAIAJOJSNXSZ-VURMDHGXSA-N 354.410 0.535 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)COC1(C)CNC1 843489082 DGGPNYKAXIZWCN-UHFFFAOYSA-N 356.806 0.926 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC3CCNCC3)C2)cc1 851687924 LIOAVTHHKQUIHS-HNNXBMFYSA-N 360.458 0.506 10 10 FCCE COC(=O)c1ccc(O)c([C@H](C)NC2CN(S(=O)(=O)N(C)C)C2)c1 858570250 VMLFRFNMXRUTIO-JTQLQIEISA-N 357.432 0.320 10 10 FCCE CN(C)c1ccc([C@H](N)CNS(=O)(=O)[C@H]2CC(=O)N(C3CC3)C2)cc1 866757027 HLJBIWCSSDBNCM-JKSUJKDBSA-N 366.487 0.435 10 10 FCCE Cc1cc(C(=O)NCc2c(O)cccc2O)nc2c1c(=O)n(C)c(=O)n2C 1178912473 UQHXOXPQVDZWSK-UHFFFAOYSA-N 370.365 0.282 10 10 FCCE CCOC(=O)CC1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)COC1 1304530221 NWMALHUULGKVIH-UHFFFAOYSA-N 372.399 0.216 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(C[C@@H]2CCOC2)CC1 1329844636 VNVSEMJTRASFPI-AWEZNQCLSA-N 359.426 0.415 10 10 FCCE C[C@@H]1CC[C@H](NC(=O)C(=O)C(=O)C(=O)NC[C@H]2C[C@H]3C=C[C@H]2CC3)CN1 1331763225 WUMIJHOHFXXRQC-FQKPHLNHSA-N 361.442 0.100 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)NC[C@H]1C[C@@H]2COC[C@@H]2O1 1341091433 ABLHXOFFUZUJMI-NXHRZFHOSA-N 371.437 0.599 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCCc3nn[nH]n3)cc2)C1 1626338831 JHVQPPVBAQZEGL-AWEZNQCLSA-N 371.445 0.541 10 10 FCCE Cc1c(C(=O)NCc2c(O)cccc2F)cnc2c1c(=O)n(C)c(=O)n2C 1638864388 ZAFKAPALVOPQCU-UHFFFAOYSA-N 372.356 0.715 10 10 FCCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)C[C@@H](O)C1 2132404158 POOJKMPHSNUHCN-LLVKDONJSA-N 368.386 0.857 10 10 FCCE N[C@H](COCc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O 2151895842 XBRCHCXPWFKAAX-CABCVRRESA-N 374.393 0.754 10 10 FCCE O=C(O)[C@H](NCc1ccc(Br)cc1O)C1CS(=O)(=O)C1 2197524280 ISKGNNMSGCALBR-LLVKDONJSA-N 364.217 0.742 10 10 FCCE COc1ccc(N2CCN(c3nncc(N4CCN(C)CC4)n3)CC2)cc1 244251674 WHLGMLBUTMPBRH-UHFFFAOYSA-N 369.473 0.959 10 10 FCCE CN(C1CC1)S(=O)(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 736331373 FBXZFJSLUOWDKC-UHFFFAOYSA-N 373.500 0.350 10 10 FCCE COC(=O)/C=C/c1ccc(N2CCN3C(=O)NC(=O)[C@H]3C2)c([N+](=O)[O-])c1 778587842 FYYLZXLMPIPLLU-MASHWEEQSA-N 360.326 0.521 10 10 FCCE Cn1cnnc1N1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 848764046 SLKKRYPOIQOYOJ-UHFFFAOYSA-N 359.346 0.381 10 10 FCCE COc1ccc(N2CC[C@H](NS(=O)(=O)C[C@H]3CNCCO3)C2)cc1 866777667 VZVGCVWVCNGVQI-XJKSGUPXSA-N 355.460 0.182 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3C[C@@H]4C[C@H]3C[S@@]4=O)ccc21 1327495439 KBZAKXVHWMMGCD-XHQUFGICSA-N 361.467 0.417 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)NCc2nnc3c(=O)n(C)ccn23)c1 1683683680 WKHXAKJGNRRCLO-JTQLQIEISA-N 372.385 0.703 10 10 FCCE COCC(=O)NC[C@H]1CC[C@@H](NC(=O)c2cc(OC)nc(OC)c2)C1 1739848327 SUURGKQTGVOCPA-WCQYABFASA-N 351.403 0.760 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCn2c(CO)nnc2C1 750054630 UBTXSUBGGSLARI-UHFFFAOYSA-N 358.446 0.311 10 10 FCCE O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCCc2ccnc(O)c21 752933975 KUUVZQDZBBACPD-UHFFFAOYSA-N 360.395 0.564 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCc3cnccn3)C2)cc1 827266163 PPGZZUKRJNRWBR-HNNXBMFYSA-N 369.425 0.539 10 10 FCCE Cc1cc(O)c(CN2CCN(C(=O)Cn3cnnn3)CC2)c(Cl)c1 840946561 RLHUGEZACYUZGU-UHFFFAOYSA-N 350.810 0.685 10 10 FCCE C[C@H](NC(=O)C(=O)N1CCC(CN)CC1)c1ccc(N2CCOCC2)cc1 842123069 BHUZAWUPMYQFBI-HNNXBMFYSA-N 374.485 0.898 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCC12CC(CN1)C2 851691669 QEHGCCUBVWKGHI-UHFFFAOYSA-N 372.469 0.350 10 10 FCCE CN1CCN(c2ccc(CNC(=O)c3ccc4c(c3)COB4O)cc2)CC1 918914672 ZDAXCGVHAZZUFS-UHFFFAOYSA-N 365.242 0.586 10 10 FCCE CCOC(=O)N1C[C@H](CO)[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C1 1304839099 IKWPKLCDKADPCH-RMKKPPKKSA-N 350.371 0.676 10 10 FCCE COc1ccc(N2CCN(C(=O)C3(S(N)(=O)=O)CC3)CC2)c(OC)c1 1454470817 PBGSRRZBANAXHT-UHFFFAOYSA-N 369.443 0.174 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCNS(=O)(=O)c1cccnc1 1466241768 ADWOAMRVWNXWKQ-UHFFFAOYSA-N 351.384 0.130 10 10 FCCE CN(C(=O)C1=C[C@H](O)[C@H](NC(=O)OC(C)(C)C)C1)c1ccc(=O)n(C)c1 2224796781 PIHSAZIKOTVWFC-KGLIPLIRSA-N 363.414 0.932 10 10 FCCE NS(=O)(=O)c1ccc(CCNC(=O)Nc2cc(O)c(O)c(O)c2)cc1 217278885 ZBLIWYQMRLXNIS-UHFFFAOYSA-N 367.383 0.815 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCN(C)C3=O)CC2)cc1 772507973 GDXQIQLFTHUQSC-KRWDZBQOSA-N 360.458 0.412 10 10 FCCE COCC1(CNC(=O)C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 829767586 SHMRRUHLDXTXIS-AWEZNQCLSA-N 361.442 0.933 10 10 FCCE CN(C)[C@H]1C[C@@H](CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 848931093 DXTFBJZDPPCYNA-MAEOIBBWSA-N 374.485 0.596 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCC(=O)NCC(F)F)C2)cc1 852452406 XAWCVMSGZFFVMM-LLVKDONJSA-N 356.373 0.954 10 10 FCCE C[C@H](C(=O)N1Cc2cccc(O)c2C1)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 871202324 DPKGILGGCHUTCS-OUSDRQIFSA-N 356.378 0.785 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@]1(CO)COCCN1C 919081950 OYCGSAMQXLSRMM-GOSISDBHSA-N 350.463 0.553 10 10 FCCE O=C(CC1CS(=O)(=O)C1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1261877905 WFKLLFIZUDOVGL-UHFFFAOYSA-N 374.409 0.852 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(S(N)(=O)=O)nc1 1640259944 KUERWBKSIOEGHH-UHFFFAOYSA-N 356.400 0.850 10 10 FCCE CN1C[C@@H](NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCC1=O 285758893 QVANUXJYRUFHNP-HNNXBMFYSA-N 358.442 0.422 10 10 FCCE O=C(NCC[C@H]1CCCO1)C(=O)NCc1ccc(N2CCOCC2)cc1 786600070 TYJYBSBYKKMFEQ-QGZVFWFLSA-N 361.442 0.825 10 10 FCCE O=C(CCn1cc[nH]c(=O)c1=O)NCc1cc(Br)ccc1O 804739277 DFLQNBZTXFSXNJ-UHFFFAOYSA-N 368.187 0.711 10 10 FCCE Cc1nc(NC(=O)C(=O)NCc2cc(Br)ccc2O)nn1C 815647575 OJHUVDNCEMFZKG-UHFFFAOYSA-N 368.191 0.847 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCNC[C@H]3C(F)F)CC2)cc1 844224200 NFTXIFSRLNAOJY-INIZCTEOSA-N 368.428 0.883 10 10 FCCE COc1cc(N2CCN(CCN(C)C)C(=O)C2)c([N+](=O)[O-])cc1OC 845636227 UONSFICNCICLSH-UHFFFAOYSA-N 352.391 0.822 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCC3=CCNCC3)C2)cc1 851689520 QBQUKMFPBFRRRZ-INIZCTEOSA-N 372.469 0.816 10 10 FCCE CS(=O)(=O)CC1(C(=O)NCc2ccc3cccnc3c2O)COC1 1557122395 IOLLFDYFWHYFKH-UHFFFAOYSA-N 350.396 0.618 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C[C@H]3CC(=O)NC3=O)cc2)C1 1626338444 ANDCQVZEZMBYRE-KBPBESRZSA-N 372.425 0.057 10 10 FCCE O=C(N[C@@H](CO)CN1CCOCC1)c1cc2cc(O)c(O)cc2s1 1639274504 NYEJJHFLFBBILJ-LLVKDONJSA-N 352.412 0.735 10 10 FCCE O=C(/C=C/c1ccc(N2CCOCC2)cc1)N1CC[C@](O)(c2c[nH]nn2)C1 284563554 HLTCFIRBBLIFDM-MTGFJVSHSA-N 369.425 0.775 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c1 768909724 BJZLKILXSWEIGA-AYLMVEPYSA-N 359.382 0.689 10 10 FCCE C[C@@H](O)[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 817811735 PNYRGDRHJPCKHI-ABAIWWIYSA-N 353.394 0.116 10 10 FCCE CN1CCOC[C@@H]1CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 858154238 BJEFHURPGYONIO-HNNXBMFYSA-N 366.437 0.792 10 10 FCCE COc1ccc(N2CCN(C(=O)CC3CS(=O)(=O)C3)CC2)cc1F 866460971 ZULFEIGWGNFXPK-UHFFFAOYSA-N 356.419 0.918 10 10 FCCE COc1ccc(N2CCN(C(=O)c3cnn(C)c3-n3cnnc3)CC2)cc1 1294756678 YPYWELLJBDVDHC-UHFFFAOYSA-N 367.413 0.972 10 10 FCCE CC(C)OCCN1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329364517 FSMGVBWKVIAAES-UHFFFAOYSA-N 361.442 0.804 10 10 FCCE C[C@H](O)[C@@H](NS(=O)(=O)c1cccs1)C(=O)NCc1ccccc1O 1566373922 MCONJMKKRQROFS-IINYFYTJSA-N 370.452 0.798 10 10 FCCE CC1=NS(=O)(=O)N(C)C=C1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1633819940 XPKJQWDPJBLSDY-SECBINFHSA-N 353.400 0.680 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)CN(C)S(=O)(=O)CC 1643245889 XKLOSKACYZPNAU-UHFFFAOYSA-N 372.443 0.565 10 10 FCCE C[S@](=O)[C@H]1CC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1654842567 NYUYMSYYWLSCHR-MGEMXXMPSA-N 360.457 0.793 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN[C@@](C)(CCO)COC)nc12 267480715 SFVBUHZUAGJCFZ-INIZCTEOSA-N 352.391 0.489 10 10 FCCE CC(=O)O[C@@H]1O[C@H](CN=[N+]=[N-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O 616585992 LFQWTDKRDROWBN-XVIXHAIJSA-N 373.318 0.380 10 10 FCCE O=C(COC(=O)c1ccnnc1)NCc1ccc(N2CCOCC2)c(F)c1 778831379 GNCCEINSCLREJM-UHFFFAOYSA-N 374.372 0.926 10 10 FCCE COc1ccc(CNS(=O)(=O)c2cc(C(=O)N(C)C)n(C)c2)c(O)c1 795363384 WVJVTHITTCFHMR-UHFFFAOYSA-N 367.427 0.920 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CCN=C2C1=NNN2C 816826036 UUXDANOURHLHOG-MRXNPFEDSA-N 370.457 0.706 10 10 FCCE C[C@@H](O)[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCO1 817831453 MGWGOYUXKWZTOI-RHSMWYFYSA-N 359.426 0.287 10 10 FCCE CCO[C@@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)cc2C)C[C@H]1CN 846329537 NARDSBLQMHWZGA-NVXWUHKLSA-N 362.474 0.499 10 10 FCCE CO[C@H]1COCC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 897580200 QCQHZVLHKISYSW-HOTGVXAUSA-N 367.421 0.770 10 10 FCCE CN(Cc1ccccc1O)C(=O)c1cnn2c1S(=O)(=O)N(C)CC2 1123665968 XTRRUEJRZOEXGD-UHFFFAOYSA-N 350.400 0.495 10 10 FCCE CN1CCN(C2CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)CC1 1330541593 OSBKNURVKRUDIP-UHFFFAOYSA-N 372.469 0.473 10 10 FCCE Cc1cccc(CNC(=O)CNC(=O)CNC(=O)OC(C)(C)C)c1O 2084065514 YLTFAAKRZCYDFU-UHFFFAOYSA-N 351.403 0.958 10 10 FCCE Cc1ccncc1N1CCN(C(=O)C(=O)NCCc2ccc(N)cc2)CC1 842236265 NIXYBLOXEWRJPE-UHFFFAOYSA-N 367.453 0.980 10 10 FCCE CNS(=O)(=O)CCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852271017 MZFUBEPPDNKOKH-LBPRGKRZSA-N 356.448 0.122 10 10 FCCE NC[C@@H]1CC(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)=NO1 852861206 QJPYXXHYRFJNDL-ZFWWWQNUSA-N 359.430 0.108 10 10 FCCE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@](O)(C(N)=O)C1 861218445 GEBDVNVFMWBISU-IBGZPJMESA-N 355.394 0.969 10 10 FCCE Cc1ccc(C)n1-c1ccsc1C(=O)N1C[C@@H](C(N)=O)[C@@H](C(N)=O)C1 1149187598 QVHKFMMNRJCGRJ-TXEJJXNPSA-N 360.439 0.814 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N1CC(CO)C1 1327775260 RMAHZBAASVHXJV-UHFFFAOYSA-N 353.444 0.055 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C2=NNC(=O)C2)n1C 1339853886 DYVJFPOMKQXDCV-UHFFFAOYSA-N 369.429 0.512 10 10 FCCE Cn1c(=O)c2ccc(NC(=O)Cc3ccc(O)c(O)c3)cc2n(C)c1=O 1596906277 AUEMTKFYYDYBOA-UHFFFAOYSA-N 355.350 0.830 10 10 FCCE CC[C@@H](NCCNS(N)(=O)=O)c1cc(Br)ccc1O 2101330343 ZZYGNWQSLOUIJP-SNVBAGLBSA-N 352.254 0.989 10 10 FCCE COc1cc(N)c(N2CC(NC(=O)OC(C)(C)C)(C(N)=O)C2)cc1OC 2109493414 QOLWYTMSMCKCDA-UHFFFAOYSA-N 366.418 0.855 10 10 FCCE O=C(O)CNC(=O)CN1C(=O)C(=Cc2ccc(O)cc2)SC1=S 2314829223 ZRRVCIPCHZJSEL-UHFFFAOYSA-N 352.393 0.794 10 10 FCCE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CN2CC(=O)NC2=O)cc1 265701321 YSSFWICGUHVEDY-INIZCTEOSA-N 374.441 0.812 10 10 FCCE CNS(=O)(=O)[C@H]1CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])C1 372738278 GEVLVRMTPBJZMJ-FUEXJSSKSA-N 369.399 0.909 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC(NC3CCOCC3)C2)c1 1644780016 JCYMKQIUJWMXNB-UHFFFAOYSA-N 369.443 0.357 10 10 FCCE CC(C)(C)OC(=O)N1CC(CNCc2ccc(O)c(O)c2O)(C(N)=O)C1 2102948655 JVXPQKGQCRLNHV-UHFFFAOYSA-N 367.402 0.615 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](CS(C)(=O)=O)C(=O)NCc1ccccc1O 2313913383 INSWJXTWQBJOQI-LBPRGKRZSA-N 372.443 0.946 10 10 FCCE CCCCOC(=O)C[C@@H]1C(=O)NCCN1C=C1C(=O)OC(C)(C)OC1=O 10213610 YOZBHZFRPQRMTG-GFCCVEGCSA-N 368.386 0.240 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)Cn3cccn3)C2)cc1 826972719 LLVBVFNYEFGQTM-CABCVRRESA-N 371.441 0.792 10 10 FCCE Nc1ccc(NC(=O)C(=O)N2CC(S(=O)(=O)NC3CCCC3)C2)cc1 841092992 OMWDDROZMNREMH-UHFFFAOYSA-N 366.443 0.280 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCCNC1 842190734 HYRFFMKOVLYFGM-MRXNPFEDSA-N 360.458 0.398 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCCCN3CCNCC3)C2)cc1 851660847 ANPCKZMAKGRGAI-INIZCTEOSA-N 361.490 0.868 10 10 FCCE COc1ccc(N(C)CCN(C)c2nnc(C3=NNC(=O)C3)n2C)cc1 1262884035 DOZLMOHYUVORKX-UHFFFAOYSA-N 357.418 0.620 10 10 FCCE CN(CC(=O)NCc1ccc(O)cc1O)S(=O)(=O)c1cccnc1 1451770801 RITDVDVPHFFCMV-UHFFFAOYSA-N 351.384 0.430 10 10 FCCE COCCN1[C@@H]2CN(Cc3ccccc3O)C[C@H]2OCCS1(=O)=O 1614963273 OSNJNGHKYKEYKQ-GDBMZVCRSA-N 356.444 0.253 10 10 FCCE CNS(=O)(=O)C[C@@H]1CCCN1c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 761907042 KDCWRJYZCOAIBA-VIFPVBQESA-N 370.387 0.444 10 10 FCCE C[C@@H](NC(=O)C(=O)NCc1ccnn1C)c1ccc(N2CCOCC2)cc1 788506522 NBHMCXPEBDKFBR-CQSZACIVSA-N 371.441 0.750 10 10 FCCE O=C(O)C1CN(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 857100678 IXEKRGRJUCYPRR-UHFFFAOYSA-N 367.427 0.147 10 10 FCCE CCN1CC[C@@H]1CNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 897565648 QKTPIXBGDJFEBM-MAUKXSAKSA-N 374.485 0.911 10 10 FCCE NC(=O)c1ncn(CC(=O)NCc2cccc(Br)c2O)n1 1156792926 UVJAHAHZGDBANA-UHFFFAOYSA-N 354.164 0.162 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H]1CCS(=O)(=O)C1 1275224573 OHFSJVJRAZFOJI-LBPRGKRZSA-N 374.409 0.852 10 10 FCCE Nc1nc(C2CC2)nc(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)n1 1652909157 MOJPWJBGHBDYBW-UHFFFAOYSA-N 370.413 0.634 10 10 FCCE COC(=O)[C@@H]1CS(=O)(=O)CCN1Cc1ccc([N+](=O)[O-])c(OC)c1O 278481785 JMYNIBCNGWCPSI-NSHDSACASA-N 374.371 0.081 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCNC(=O)CC3)CC2)cc1 815135224 RTKGUYXAXCAPNX-INIZCTEOSA-N 374.485 0.850 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N[C@H](C)Cn1cncn1 817812552 SJWSGEBBCJTQNV-LSDHHAIUSA-N 372.473 0.905 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H]3CCN(C)S3(=O)=O)CC2)cc1F 843819304 UYICJWFYVFDURU-HNNXBMFYSA-N 371.434 0.517 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@]3(C)C[C@H](O)CN3C)CC2)cc1F 900999416 SMRYEVIWFNFRNL-KSSFIOAISA-N 351.422 0.938 10 10 FCCE C[C@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C(=O)O1 1254871297 FGJUPSDFGRQKOV-BLLLJJGKSA-N 374.441 0.892 10 10 FCCE C[C@H](NC(=O)CCc1nc2c(O)nc(=O)n(C)c2[nH]1)c1ccccc1O 1302532477 FDSCFULIAWGDAD-VIFPVBQESA-N 357.370 0.878 10 10 FCCE C[C@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1323222186 GNVLVXCCUUYRSI-YOEHRIQHSA-N 361.442 0.681 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)NC3CCC(C(N)=O)CC3)ccc21 1328610512 CGBGZRDBBUQALG-UHFFFAOYSA-N 372.469 0.846 10 10 FCCE C[C@@H](NC(=O)C1=NN(CCO)C(=O)CC1)c1ccc(N2CCOCC2)cc1 1625882079 CJHINDXUAGINGM-CQSZACIVSA-N 374.441 0.671 10 10 FCCE COC(=O)[C@H]1CCCN(CC(=O)NCCc2ccc(O)c(O)c2)C1=O 1630335919 XNWBXXAJNGPGEE-LBPRGKRZSA-N 350.371 0.168 10 10 FCCE Cc1ccc(CNS(=O)(=O)N(C)CC(=O)O)c(O)c1Br 2380815762 JXRIZGZCCLOVHJ-UHFFFAOYSA-N 367.221 0.814 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)NC(C)(C)C)CC2)cc1 56966416 YCNRBSVXUTZFSC-UHFFFAOYSA-N 362.474 0.848 10 10 FCCE O=C(/C=C\c1ccc(N2CCOCC2)cc1)N1CCN2C(=O)NC[C@H]2C1 104267088 NZGVHGTVTKJEAX-SVEBXFOSSA-N 356.426 0.772 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)c3cn([C@@H]4CC[C@H]4O)nn3)C2)cc1 912291914 FPYVQPHUEFMMAL-CSMYWGQOSA-N 357.414 0.991 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](OC)[C@@H]1CCOC1 1261737486 PPNUVLQVGIUSDM-WWGRRREGSA-N 367.398 0.740 10 10 FCCE Cc1ccc(C(=O)NC(C(N)=O)C(N)=O)cc1-n1c(C)cc(C=O)c1C 1540569140 FRMQVJXVTHHTJV-UHFFFAOYSA-N 356.382 0.284 10 10 FCCE COc1ccc(N2CCN(C(=O)NCCCS(N)(=O)=O)CC2)cc1F 1683658975 YAQAFNGMMDHQSO-UHFFFAOYSA-N 374.438 0.345 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2081034542 HFWNOOKCTHKEAI-RHYQMDGZSA-N 355.395 0.486 10 10 FCCE CN(C[C@H](O)COc1ccc(N)cc1)C[C@H](O)CNC(=O)OC(C)(C)C 2106663500 ALSXPHFPSQZVPS-CABCVRRESA-N 369.462 0.826 10 10 FCCE Cc1ccc(CNS(=O)(=O)C[C@@H](N)C(=O)O)c(O)c1Br 2380760337 WVFDPCORSKGLLQ-MRVPVSSYSA-N 367.221 0.294 10 10 FCCE C[C@@H]1CO[C@@H](CO)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 221139084 WCYXLNDCHUNNLS-OTPXZMOZSA-N 356.220 0.987 10 10 FCCE CCS(=O)(=O)C(=O)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 243721105 POONHSLYJWDBLV-UHFFFAOYSA-N 369.443 0.488 10 10 FCCE COC(=O)C1=C[C@H](N=[N+]=[N-])[C@H](NC(C)=O)[C@H]([C@H](OC)[C@@H]2COC(=O)O2)O1 504791836 DMLIIKCIUVVBPP-XENQEKTKSA-N 370.318 0.176 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3C[C@@H]4C[C@]4(CO)C3)cc2)C1 782945050 DCVCXMBAZAVDSN-GQIGUUNPSA-N 372.469 0.912 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@](O)(C(F)F)C3)nc12 831176444 VSWYFRFYGVTPPO-OAHLLOKOSA-N 356.329 0.814 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCCC(N)=O 1153662983 DLUTWEYGPSNOQE-LBPRGKRZSA-N 352.387 0.734 10 10 FCCE NS(=O)(=O)c1cc2c(s1)CCN(C(=O)Cc1ccc(O)c(O)c1)C2 1167358100 GAGFCNBWLUOSEZ-UHFFFAOYSA-N 368.436 0.934 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NC[C@H]1CS(=O)(=O)c2ccccc2O1 1299793639 BRAQMCKQQDUUEH-LBPRGKRZSA-N 363.391 0.991 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)NC[C@H](F)C(=O)OC)cc1F 1331883856 YQJIMGRHQAZKGW-ZDUSSCGKSA-N 371.384 0.915 10 10 FCCE COc1cc(C(=O)N[C@H](C)CNC(=O)[C@@H]2CCN(C)[C@@H]2C)cc(OC)n1 1526629900 FXHMXATWQJMFGT-YRGRVCCFSA-N 364.446 0.674 10 10 FCCE COc1ccc(N2CCC(NC(=O)CCCS(N)(=O)=O)CC2)cc1 1584361136 LBGBHPRBEQTPDW-UHFFFAOYSA-N 355.460 0.849 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H](C)[C@H](O)C3)CC2)cc1 1645117220 GEWVSPZITUORQS-XKGZKEIXSA-N 363.502 0.881 10 10 FCCE CC(C)(C)OC(=O)NC1(C(N)=O)CN(C(=O)c2cc(O)c(O)c(O)c2)C1 2132405863 CEZHVYDMUKTVEO-UHFFFAOYSA-N 367.358 0.008 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(CO)(CO)NC(=O)OC(C)(C)C 2320987590 SSOUXQMMSHMJEO-UHFFFAOYSA-N 354.403 0.599 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@](C)(O)Cn3ccccc3=O)CC2)cc1 790466530 SUQOYBRBHAUZCU-FQEVSTJZSA-N 371.437 0.957 10 10 FCCE C[C@@H]1C(=O)N(C)CN1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 825859903 WSWNVYWDZJWNLZ-HIFRSBDPSA-N 373.457 0.718 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@H](Cn2ccnn2)C1 828436559 CPMQQOUETOVSFA-HNNXBMFYSA-N 370.457 0.817 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3cncc(OC)n3)C2)cc1 850537291 ONZFICGNWPPFAE-LBPRGKRZSA-N 371.397 0.827 10 10 FCCE O=C1CC[C@@H](CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)N1 853452461 IXHXAAHZEDWPFO-ZDUSSCGKSA-N 350.394 0.740 10 10 FCCE C[C@H](NS(=O)(=O)C[C@@H]1CNCCO1)c1ccc(N2CCOCC2)cc1 866747066 OCCPCXLCIXTJDO-YOEHRIQHSA-N 369.487 0.492 10 10 FCCE CON(C)C[C@@H](O)Cn1cc(NC(=O)c2ccc(C)c(O)c2O)cn1 1151075371 LJQZSDLSONYGOR-GFCCVEGCSA-N 350.375 0.709 10 10 FCCE CC(C)(C)OC(=O)NCC(=O)NCC(=O)NCc1ccc(O)cc1O 1162278752 LFFWHELXHBJAGR-UHFFFAOYSA-N 353.375 0.355 10 10 FCCE CN1C(=O)c2ccccc2[C@H]1CNC(=O)C(=O)NCCc1ccc(N)cc1 1331603590 AMFIPYHTEYJWJV-QGZVFWFLSA-N 366.421 0.871 10 10 FCCE C[C@@H](O)[C@@H](NC(=O)C1CCCC1)C(=O)NCCc1ccc(O)c(O)c1 1545669255 RNDJKRVAJJVJQK-BDJLRTHQSA-N 350.415 0.812 10 10 FCCE CC(=O)c1cc(Cl)cc(CNC2(C(N)=O)CCS(=O)(=O)CC2)c1O 1560085714 IVBYLXCVQVTGGV-UHFFFAOYSA-N 374.846 0.771 10 10 FCCE C[C@@H](NC(=O)NCCc1nnc2c(=O)n(C)ccn12)c1ccccc1O 1638480096 ZMQOELWYHHRDBP-LLVKDONJSA-N 356.386 0.737 10 10 FCCE CN(CC(=O)NCc1c(O)cccc1O)S(=O)(=O)c1cccnc1 1652623388 WSHMPZPGECVCRF-UHFFFAOYSA-N 351.384 0.430 10 10 FCCE NS(=O)(=O)NCCNCc1cc(Cl)cc(Br)c1O 2039826954 MNDUIBFFZUQACV-UHFFFAOYSA-N 358.645 0.691 10 10 FCCE COCCN1C(=O)/C(=C/NC[C@H]2CC2(Cl)Cl)C(=O)NC1=S 105337970 OCXHYUXCTQMZLR-UQBZRGDZSA-N 352.243 0.543 10 10 FCCE O=C(NCCNC(=O)c1ccc2c(c1)OCO2)c1cc(O)c(O)c(O)c1 169839069 HNNXLCVRAKKVGK-UHFFFAOYSA-N 360.322 0.692 10 10 FCCE CCN(C(=O)C(=O)N(C(C)=O)c1ccc(N)cc1)[C@H]1CCS(=O)(=O)C1 170318714 ZEYNMTFUEXTRFB-AWEZNQCLSA-N 367.427 0.184 10 10 FCCE O=C(N[C@@H]1CCS(=O)(=O)C1)N1CCN(c2ccc3c(c2)OCO3)CC1 243011857 HWKOWXKHPYZUNN-GFCCVEGCSA-N 367.427 0.434 10 10 FCCE CCOc1ccc(O)c(CN2CCN(CC(=O)N3CCOCC3)CC2)c1 271056278 ZHYVPWCDSPBYES-UHFFFAOYSA-N 363.458 0.767 10 10 FCCE Nc1ccc(CNS(=O)(=O)CCN2C(=O)c3ccccc3C2=O)cc1 707474627 NKSBZXCKEGMMQZ-UHFFFAOYSA-N 359.407 0.984 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(c2nccnn2)CC1 859406851 PQRINNNNZFJFLM-UHFFFAOYSA-N 369.473 0.718 10 10 FCCE COC(=O)C1=CC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 862665940 LCBDNSFLWGUQLM-SNVBAGLBSA-N 354.384 0.755 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C(=O)NCC(F)F)cc2)CC1 1471911678 CLNATFFAPKNKJV-UHFFFAOYSA-N 368.384 0.386 10 10 FCCE C[C@]1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCNC1=O 1558397181 MPRYTCWBFXYLCD-IBGZPJMESA-N 358.442 0.531 10 10 FCCE Cc1ccc(O)c(CNC(=O)C(=O)c2cc(S(N)(=O)=O)cn2C)c1 1629740704 NQJFXTCSTGQTQW-UHFFFAOYSA-N 351.384 0.186 10 10 FCCE COc1ccc(N2CCN(C(=O)CCCS(N)(=O)=O)CC2)c(OC)c1 1634886922 XIMXUVKTSQFHKY-UHFFFAOYSA-N 371.459 0.421 10 10 FCCE CC(C)(C)OC(=O)NCC(=O)NCC(=O)NCc1cc(O)ccc1O 1644754015 NYRLTBMFXVFHIC-UHFFFAOYSA-N 353.375 0.355 10 10 FCCE CN(C)c1ccc([C@@H](NC(=O)[C@@H](N)Cc2cnc[nH]2)c2nccn2C)cc1 1866032147 DEEWCFSYNWIKIG-DLBZAZTESA-N 367.457 0.985 10 10 FCCE CC(C)(C)OC(=O)N(O)CC(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)O 2124122223 PACSAHJEZVILJE-SNVBAGLBSA-N 370.358 0.836 10 10 FCCE Cc1ccccc1N1C(=O)C(=CNCCN2CCOCC2)C(=O)NC1=S 2296560013 SPILQTIEQOCKAG-UHFFFAOYSA-N 374.466 0.548 10 10 FCCE CCCCOC(=O)C[C@H]1C(=O)NCCN1C=C1C(=O)OC(C)(C)OC1=O 10213616 YOZBHZFRPQRMTG-LBPRGKRZSA-N 368.386 0.240 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2S(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 599253447 MJDWALAMVOJQPR-UHFFFAOYSA-N 367.387 0.982 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3CC(C(=O)O)C3)CC2)cc1 857097519 UCSPZHUJXOAWHM-UHFFFAOYSA-N 362.430 0.543 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)CCCc3nn[nH]n3)CC2)cc1 874242761 CDLOLBLKJMJULH-UHFFFAOYSA-N 373.461 0.469 10 10 FCCE CN1CCN(c2ccc(CNC(=O)CN3C(=O)NC(C)(C)C3=O)cc2)CC1 1119605124 MLTPBKNQGZVDQS-UHFFFAOYSA-N 373.457 0.385 10 10 FCCE CC(C)(C)OC(=O)N1CC(CO)(CNC(=O)Cc2ccc(O)c(O)c2)C1 2137083102 BLUKCTRMYNEQMM-UHFFFAOYSA-N 366.414 0.986 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@@H]1CCCN(C)C1)c1ccc(N2CCOCC2)cc1 803308873 LTZXLVZBINSSCF-DOTOQJQBSA-N 374.485 0.911 10 10 FCCE COc1ccc(N2CC[C@@H](Nc3ccc(C(=O)NCCO)nn3)C2)cc1 853758800 KPIRFMRJPUJVIL-CYBMUJFWSA-N 357.414 0.898 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@@H]4CNC[C@]4(C)C3)CC2)cc1 923425149 IKWKLCBYTKUDRN-HFSMHLIXSA-N 374.529 0.719 10 10 FCCE Cn1cnc(S(=O)(=O)NCC(=O)NCc2cc(Cl)ccc2O)c1 1146233699 ZOOZKPFXDKNAGC-UHFFFAOYSA-N 358.807 0.374 10 10 FCCE Nc1c(S(=O)(=O)O)cc(NCCO)c2c1C(=O)c1ccccc1C2=O 1615945210 WZSACXCKDGRUGL-UHFFFAOYSA-N 362.363 0.695 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)Cc3coc(C)n3)CC2)cc1 1869014952 WFEBKCDNFUYYGC-UHFFFAOYSA-N 372.425 0.999 10 10 FCCE Cc1c(NC=C2C(=O)NC(=O)N(C)C2=O)c(=O)n(-c2ccccc2)n1C 2296114169 PAHKLOFICQXLBK-UHFFFAOYSA-N 355.354 0.488 10 10 FCCE O=C(CN1C(=O)CSC1=S)N1CCC[C@H](Oc2cnccn2)C1 238881213 PHKWMEUQXUDLIR-JTQLQIEISA-N 352.441 0.707 10 10 FCCE C[C@@H](O)CCNC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 820985976 IUYGDMZLMBGTGH-CYBMUJFWSA-N 355.460 0.492 10 10 FCCE COCCN(C(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H]1CCOC1 839356248 LVDUOEOFGUPANY-KRWDZBQOSA-N 363.458 0.975 10 10 FCCE CC(=O)c1cc(Cl)cc(CN2CCN[C@@H]3CS(=O)(=O)C[C@@H]32)c1O 923523249 NIRJVBYMQIMAFJ-KGLIPLIRSA-N 358.847 0.819 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)cc1 1136743456 RUZQSDRMJWJRIP-MRXNPFEDSA-N 374.445 0.985 10 10 FCCE COC(=O)[C@H]1CCCN(CC(=O)NCc2ccc3cccnc3c2O)C1=O 1451954335 HCMGUGXJJHTQBB-AWEZNQCLSA-N 371.393 0.968 10 10 FCCE CC(=O)N1CCN(c2ccc(CNc3nccnc3C(N)=O)cc2)CC1 1472776913 DOMUPIJFGWJYBG-UHFFFAOYSA-N 354.414 0.856 10 10 FCCE C[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CCN1c1nccn2cnnc12 1566543701 IHTAYVDCNRWCGH-GFCCVEGCSA-N 368.397 0.815 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1C(=O)NCc1ccccc1O 2311675536 GWVKIMSNCFRTFI-HZSPNIEDSA-N 352.387 0.350 10 10 FCCE COc1ccc(N2CCN(C=O)CC2)cc1NC(=O)Cc1noc(C)n1 62275229 AIULNOZZGWXCES-UHFFFAOYSA-N 359.386 0.846 10 10 FCCE COc1cccc(CNC(=O)C(=O)Nc2cnn(CCN(C)C)c2)c1O 768724660 KYHFQKZLNGUJBD-UHFFFAOYSA-N 361.402 0.414 10 10 FCCE Cc1ccc(C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)c(O)c1O 770469424 KLPPGBSYWLAXIQ-UHFFFAOYSA-N 363.414 0.023 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCSC[C@@H]2CCO)cc1 785428637 PVRZYHCXULHNOK-HNNXBMFYSA-N 351.472 0.695 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@H]3CCNC[C@H]3C)C2)cc1 818676853 QATLFSMZIRXHTI-RKVPGOIHSA-N 374.485 0.752 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN4CCOC[C@@H]4C3)C2)cc1 854299836 SBWHGIUHVVEYQP-WBVHZDCISA-N 360.458 1.000 10 10 FCCE CCc1cccc(CN2C[C@@H](N3C(=O)CNC3=O)C[C@H]2C(=O)OC)c1O 857057790 XLDSJMKAKYHKLQ-KBPBESRZSA-N 361.398 0.622 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)C3CS(=O)(=O)C3)cc2)CC1 867681233 YTCRDEFQMRSHFD-UHFFFAOYSA-N 365.455 0.016 10 10 FCCE C[C@H]1CN(c2ccc(CNC(=O)CCNC(=O)CO)cc2F)C[C@@H](C)O1 906316829 HMXVQMVWHVRTJB-BETUJISGSA-N 367.421 0.554 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3C[C@H](N)C(C)(C)C3)CC2)cc1 923431946 YYHDJTDMJMKNMX-MJGOQNOKSA-N 362.518 0.847 10 10 FCCE CO[C@@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1119815580 FJOLYBUUUMIOGJ-QZTJIDSGSA-N 374.485 0.690 10 10 FCCE CCN(CC)c1ccc(CN(C)C(=O)C(=O)N2CCNC(=O)CC2)cc1 1326992833 QOEJQRRLONTWOY-UHFFFAOYSA-N 360.458 0.840 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(CNC(=O)c2cc(O)nc(O)c2)C1 2028022915 CFTGVUJTTQGWAL-MRXNPFEDSA-N 353.375 0.595 10 10 FCCE CN(C)CCCNC=C1C(=O)NC(=S)N(c2ccc(F)cc2)C1=O 2296091479 QIGRVNGHQLMYNG-UHFFFAOYSA-N 350.419 0.999 10 10 FCCE COCCN1C(=O)/C(=C/Nc2cc(OC)cc(OC)c2)C(=O)NC1=S 105490554 DJVDCFBECRKUOG-UKTHLTGXSA-N 365.411 0.889 10 10 FCCE CNC(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 817812140 XJDWKFICLIKFIB-LBPRGKRZSA-N 350.394 0.102 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCC[C@@H]3NCC[C@H]32)cc1 868419355 WUERDQPBFMRQRV-ZWKOTPCHSA-N 374.485 0.943 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)CCC(=O)N1 1153664168 RDVIGCGMUAVSMG-GTNSWQLSSA-N 350.371 0.357 10 10 FCCE COC(=O)CCCNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1330821299 LDLDNCQDTKNXDQ-CYBMUJFWSA-N 363.414 0.460 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)N3CC4(C3)NC(=O)NC4=O)C2)cc1 1478861060 VRXBQGPZTYIDAV-LBPRGKRZSA-N 373.413 0.125 10 10 FCCE Cc1nn(C)c2c1[C@@H](c1ccc(O)c(O)c1)C(C(=O)NC[C@@H](C)O)=C(N)O2 1864008663 PEDSKCZNFBWZIG-XLKFXECMSA-N 374.397 0.331 10 10 FCCE O=S(=O)(CCO)CCNCc1cc(Br)cc(F)c1O 2335753342 WOENMOOGDDHFKL-UHFFFAOYSA-N 356.213 0.791 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCN(c3cccnn3)CC2)cc1 283378959 GLHKQULSAFRNBX-UHFFFAOYSA-N 368.441 0.508 10 10 FCCE O=C(CN1C(=O)CSC1=S)N1CCC(Oc2ccncn2)CC1 585334001 MTLIZXAAQQSWLN-UHFFFAOYSA-N 352.441 0.707 10 10 FCCE COc1ccc(N2CC[C@@H](CNC[C@H](O)CN3CCN(C)CC3)C2)cc1 819379733 KULIZDTYZUZIIG-HKUYNNGSSA-N 362.518 0.719 10 10 FCCE COc1cc(O)c(CN2C[C@H]3[C@H](OC)CS(=O)(=O)[C@H]3C2)cc1OC 853569891 IQNYHUMWLLDCQC-XZJROXQQSA-N 357.428 0.653 10 10 FCCE C[C@@]1(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CN2CCC1CC2 912377440 NDORXHQKTDNNIB-MRXNPFEDSA-N 353.444 0.978 10 10 FCCE CN(C)S(=O)(=O)c1cc(C(=O)NCc2cc(O)ccc2O)n(C)c1 1471661326 NJFBARYFEDFSBC-UHFFFAOYSA-N 353.400 0.617 10 10 FCCE CN1CCn2nc(C(=O)NCc3cccc(Cl)c3O)cc2S1(=O)=O 1472316875 KPFGFXNUAQACLJ-UHFFFAOYSA-N 370.818 0.806 10 10 FCCE Cn1c(=O)c2cc(C(=O)N3Cc4cccc(O)c4C3)cnc2n(C)c1=O 1644088354 QSBIGJIBJARGPL-UHFFFAOYSA-N 352.350 0.494 10 10 FCCE CC(C)(C)OC(=O)N1CCC[C@](O)(CNC(=O)c2cc(O)nc(O)c2)C1 2136606180 IHDWXFQSHIUTMR-KRWDZBQOSA-N 367.402 0.985 10 10 FCCE CC(=O)N1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)[C@H](C)C1 285702908 LONFLLNKPMRWFK-GFCCVEGCSA-N 364.421 0.587 10 10 FCCE CCN(Cc1cn(C)nn1)C(=O)C(=O)NCc1ccc2c(c1)CCCN2C 803687178 WPANGZIZTKKHCF-UHFFFAOYSA-N 370.457 0.862 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CN3CCCS3(=O)=O)C2)cc1 855233429 YLKVZOPEHBIXBZ-ZDUSSCGKSA-N 353.444 0.426 10 10 FCCE CCS(=O)(=O)c1cnc(O)c(C(=O)NCCc2ccc(O)c(O)c2)c1 1294913143 MMOOARHKMOIEHB-UHFFFAOYSA-N 366.395 0.965 10 10 FCCE COC[C@@H]1C[C@@H](O)CN1C(=O)C(=O)NCCCSc1nccs1 1326645799 NUDDJAJQLPUFHH-WDEREUQCSA-N 359.473 0.350 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CN1CCOCC1 1446818026 UPAUNKRWTXCWMS-UHFFFAOYSA-N 356.806 0.879 10 10 FCCE CO[C@H]1CS(=O)(=O)C[C@H]1NC(=O)c1cc2cc(O)c(O)cc2s1 1584122088 FOOOIFKZBJKLDV-KCJUWKMLSA-N 357.409 0.854 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H]2C[C@@H]3COC[C@@H]3O2)c1 1637692439 YXYBTQXFNXCYEO-PUYPPJJSSA-N 356.400 0.297 10 10 FCCE C[C@H](NC(=O)c1cc2n(n1)CCN(C)S2(=O)=O)c1ccccc1O 1648893715 CFCUFBLMARQZGL-JTQLQIEISA-N 350.400 0.714 10 10 FCCE CN(C[C@H](O)CNC(=O)OC(C)(C)C)c1cc2c(cc1N)OCC(=O)N2 2106704193 BSUYEPZTMGZDIB-SNVBAGLBSA-N 366.418 0.922 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](CO)[C@@H](NC(=O)c2cc(O)nc(O)c2)C1 2116256479 QSIPDZKDIVKULR-JQWIXIFHSA-N 367.402 0.841 10 10 FCCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@@H](COCc1ccccc1)C(=O)O 2151967504 LBZPWJKMBNHGMB-GJZGRUSLSA-N 374.393 0.754 10 10 FCCE Cc1cccn2c(=O)c(C=C3SC(=S)NC3=O)c(NCCO)nc12 2296716998 VNVDCLXCOCRQML-UHFFFAOYSA-N 362.436 0.896 10 10 FCCE COCCN1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1=O 768520066 DRGPFYRMPLKZDD-UHFFFAOYSA-N 350.331 0.221 10 10 FCCE Cc1cc(CCNC(=O)C(=O)NCC(=O)N(C)C)c(C)n1-c1ccccc1 782207495 ONVQKRRUODDTDG-UHFFFAOYSA-N 370.453 0.957 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCNC1=O 852408991 FATALYUYQDCHTF-AWEZNQCLSA-N 350.394 0.475 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3C[C@H]4COC[C@@H](C3)O4)ccc21 1117165064 RTLDGIHBNDXVQC-IYBDPMFKSA-N 359.426 0.311 10 10 FCCE CN[C@H]1C(=O)Nc2cc(N3CC(=O)NC(=O)C3)c(Br)cc21 118712647 NRJJERCTZXPUDA-GFCCVEGCSA-N 353.176 0.125 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(C)CCC(=O)NC3)cc2)CC1 282118061 FISAGPBUGCWOOK-FQEVSTJZSA-N 372.469 0.888 10 10 FCCE C[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CC(=O)N1C 285640963 FWNYHJNLZNSDQJ-NSHDSACASA-N 350.394 0.197 10 10 FCCE COCCN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCOC1 787845047 ZGJZQFZRBFXGOP-LBPRGKRZSA-N 358.416 0.641 10 10 FCCE C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H](O)C(F)(F)F 819564423 GCYBIPCIDFJQGR-LHLIQPBNSA-N 356.322 0.805 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CCN=C3C2=NNN3C)cc1 855020896 XARAYEYNWIKXFC-OAHLLOKOSA-N 358.446 0.814 10 10 FCCE O=C1CN(Cc2ccccc2O)C(=O)N1C[C@]12COCCN1C(=O)OC2 865322635 WWIYXPAXJQQUCN-QGZVFWFLSA-N 361.354 0.378 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCC[C@@H]2CNC(=O)C2)cc1F 1351248345 UGGZZAGOTZXKCB-LBPRGKRZSA-N 350.394 0.150 10 10 FCCE O=c1c(=Cc2cccnc2)sc2n1CN(c1ccc3c(c1)OCO3)CN=2 254855323 XOCGHEBSWKOVDA-UHFFFAOYSA-N 366.402 0.917 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3C[C@H]4CC[C@@H]3O4)C2)cc1 829753782 QNUMJGXCYGFGMB-DXEWXGHRSA-N 359.426 0.826 10 10 FCCE COCCN1C[C@@H](C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 855232571 SCHKKUSITWBYDR-GJZGRUSLSA-N 361.442 0.885 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CCS(=O)(=O)C[C@H]2CCO)cc1 913927240 YNSAVVNNRYHWOU-OAHLLOKOSA-N 355.460 0.444 10 10 FCCE C[C@@H](NC(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1nnc(O)n1C 924009025 VFCLRPDKMUIFIQ-CYBMUJFWSA-N 373.461 0.833 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@H](C)[C@@H](O)C3)CC2)cc1 1645117219 GEWVSPZITUORQS-QRFRQXIXSA-N 363.502 0.881 10 10 FCCE CC(C)(C)OC(=O)NCC1(O)CN(C(=O)c2cc(O)c(O)c(O)c2)C1 2068576723 KHDAMDNFPMSSNF-UHFFFAOYSA-N 354.359 0.515 10 10 FCCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)[C@H](CN)C1 2132403266 IROGUONXBIQDKJ-LLVKDONJSA-N 367.402 0.824 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CCC[C@H]2CS(N)(=O)=O)cc1F 785865396 TVRUNYALNARSNP-LBPRGKRZSA-N 358.439 0.854 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)NCC[C@@H]2CNC(=O)C2)cc1 1333801041 QKTQVWIEXXXIGQ-HNNXBMFYSA-N 360.458 0.791 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C3(CS(C)(=O)=O)COC3)C2)cc1 1352424348 VJPXCLFFPXHPID-ZDUSSCGKSA-N 368.455 0.451 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)/C=C/C(=O)N(C)C)CC2)cc1 1463773572 JAYNDQNETZMXDU-MDZDMXLPSA-N 374.485 0.968 10 10 FCCE COC(=O)N(C)CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1537840317 YVZCSVLHAYHCJS-UHFFFAOYSA-N 362.430 0.703 10 10 FCCE O=S1(=O)C[C@@H]2[C@H](C1)NCCN2Cc1cc(Br)ccc1O 2143714957 WXWRGOIHCSTAKR-NWDGAFQWSA-N 361.261 0.726 10 10 FCCE CC(C)(C)OC(=O)NCCCN(CCO)C(=O)c1cc(O)nc(O)c1 2255040171 PITGISIGMCBBAR-UHFFFAOYSA-N 355.391 0.842 10 10 FCCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NC[C@@H]1CN2CCN1CC2 2302718302 QTGLMUYVSWPMPD-LJQANCHMSA-N 356.470 0.652 10 10 FCCE C[C@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1cc(O)n2ncc(C(=O)O)c2n1 737567488 GOGCQOFMUSKDGG-RKDXNWHRSA-N 356.404 0.387 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)Cn3cncn3)CC2)cc1 818981358 RTOXWMNDOQZWPZ-FUHWJXTLSA-N 374.489 0.448 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3cnn(C)c3)C2)cc1 827451699 NRGXMZSUFVWNQZ-CQSZACIVSA-N 357.414 0.440 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCc3nccnc3C2)cc1F 827574559 CMUMOAWUGJAAAN-UHFFFAOYSA-N 357.389 0.883 10 10 FCCE O=C1COC[C@@]2(CNCc3ccc(N4CCOCC4)cc3)COCCN12 865799367 ADNNIGRLSGAPSN-LJQANCHMSA-N 361.442 0.241 10 10 FCCE CS(=O)(=O)[C@@H]1CCCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1119018994 ICRZDGXQESSPLG-CYBMUJFWSA-N 366.439 0.660 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)Cc3nnc(N)s3)cc2)CC1 1447716496 XHDWUZHHCSZREL-UHFFFAOYSA-N 374.470 0.648 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1c[nH]nc1S(N)(=O)=O 1629931844 VAEANAYIGKLLSH-UHFFFAOYSA-N 351.388 0.162 10 10 FCCE COc1ccc(O)c(CNC[C@H]2[C@@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c1 2333604852 QTGOCJQNPHMYHX-CWRNSKLLSA-N 368.430 0.832 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C3=NO[C@H](CN)C3)CC2)cc1 852872409 GNOMICSZWNGAOW-INIZCTEOSA-N 361.446 0.037 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H]3CC(C(N)=O)=NO3)C2)cc1 854050347 AKQXRMYKCGWXAK-BXUZGUMPSA-N 361.402 0.203 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCn4c(O)nnc4C3)C2)cc1 854298245 YRGVAIPSCSNLCE-GFCCVEGCSA-N 358.402 0.796 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3C[C@@H]4C[C@H]3C[S@]4=O)ccc21 1327495438 KBZAKXVHWMMGCD-XSKAOVLVSA-N 361.467 0.417 10 10 FCCE CN1C(=O)COc2cc(NC(=O)c3nnn(-c4ccc(N)cc4)n3)ccc21 1857878497 DXANWGFFJQIVHS-UHFFFAOYSA-N 365.353 0.852 10 10 FCCE O=C(O)CC[C@H](N/C=C1/C(=O)N(c2ccccc2)C(=O)N=C1O)C(=O)O 102706369 WJEWJEIMIJJIPN-UQSGXBNBSA-N 361.310 0.901 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2noc(C3CC3)n2)c1 765403555 OWRHGBKSMYTBKY-UHFFFAOYSA-N 352.372 0.954 10 10 FCCE COC(=O)c1c(CN2CCN(C(=O)CO)CC2)c2cc(F)ccc2n1C 894685545 FBGPKXOLVDTSIX-UHFFFAOYSA-N 363.389 0.741 10 10 FCCE CN1C[C@@H](O)C[C@@]1(C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 900269541 PVPRNNYQCLACRB-KSSFIOAISA-N 351.422 0.734 10 10 FCCE N[C@H]1CCO[C@H](C2CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)C1 1329504604 NJAXXGBQNGWTSR-YJBOKZPZSA-N 373.453 0.979 10 10 FCCE Cn1cc(N2CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)cn1 1329796777 GWGKUCUQSJEHMJ-UHFFFAOYSA-N 355.398 0.317 10 10 FCCE Cc1nnc(N(C)Cc2ccccc2O)n1CCN1CCCS1(=O)=O 1726357102 HVUOLTPQZZMDJM-UHFFFAOYSA-N 365.459 0.964 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2310482333 IECWPJKZVBUYOE-DDHJBXDOSA-N 355.395 0.629 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@H]4C[C@@]4(CO)C3)CC2)cc1 782611750 DUZPFFOAGXSIMD-KPFFTGBYSA-N 361.486 0.492 10 10 FCCE CC1(C)CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H]2COC[C@H]2O1 846624300 LZQFRFBMHSLYDM-TZMCWYRMSA-N 370.427 0.782 10 10 FCCE CC(C)CC(=O)N[C@@H](CC(N)=O)C(=O)NCc1ccc2cccnc2c1O 862026611 VAULYRNBODTXRP-AWEZNQCLSA-N 372.425 0.963 10 10 FCCE CN1C2(CCC2)COC[C@]1(CO)CNC(=O)/C=C/c1ccc(O)c(O)c1 862641921 DWURXAGZSUXDFC-FHHGHWCOSA-N 362.426 0.843 10 10 FCCE CNS(=O)(=O)C[C@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 863340301 KAVQYKWRFDAFKG-NHYWBVRUSA-N 356.444 0.579 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3nc(C)no3)C2)cc1 1118606178 KECBWSHODQKRFY-DGCLKSJQSA-N 373.413 0.959 10 10 FCCE CN(C)CCC[C@H]1CN(C(=O)C(=O)N(C)Cc2ccccc2O)CCO1 1261627868 JUXMMGXLYQCZMI-INIZCTEOSA-N 363.458 0.920 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CN1CCOC1=O 1447348477 NTKUVQHRZUHQDU-NSHDSACASA-N 352.343 0.140 10 10 FCCE NS(=O)(=O)Cc1cccc(CNC(=O)Cc2ccc(O)c(O)c2)c1 1584448084 GACIANBIJWOHQI-UHFFFAOYSA-N 350.396 0.745 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCNC3=O)cc2)C1 1597004868 YGDGZDJVFXLBOT-HOCLYGCPSA-N 358.442 0.531 10 10 FCCE Cc1cccc(CNC(=O)[C@@H]2[C@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c1O 2139763863 KWECPEJGFNWCCI-KCQAQPDRSA-N 366.414 0.658 10 10 FCCE C[C@](O)(CNC(=O)NCc1ccc(N2CC=CC2)cc1)CN1CCOCC1 175227396 BJHLYDXIQQSVOI-FQEVSTJZSA-N 374.485 0.945 10 10 FCCE COCCNC(=O)[C@@H]1C[C@@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 242954433 HGVTVJCTKUODMI-SJORKVTESA-N 361.442 0.743 10 10 FCCE CN1C(=O)[C@H]2[C@@H](c3ccc(N(C)C)cc3)N(CC(=O)NC3CC3)O[C@H]2C1=O 248036702 JMJZZRHHCYQLKN-GVDBMIGSSA-N 372.425 0.303 10 10 FCCE C[S@@](=O)CCN1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 771148777 YRNSMJYXVAZXDJ-RUZDIDTESA-N 368.415 0.426 10 10 FCCE CCN(CC)CC[C@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 798143747 HURFVIQNUYVJTO-CYBMUJFWSA-N 373.475 0.586 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNCCc3cn(C)cn3)CC2)cc1 819359188 DFMXLEYMAOHTEF-IBGZPJMESA-N 373.501 0.744 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN2CN(CCN(C)C)C(=O)[C@H]2C)c1O 843428959 PMCPIGFUJOPLLK-LLVKDONJSA-N 352.391 0.861 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4C[C@H]3C[S@]4=O)nc12 844433555 OFJXJCLUMDAONB-MAXLSHCHSA-N 350.400 0.317 10 10 FCCE COCCN1CC[C@@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 850355637 IRFDCKLEAGWKEF-QGZVFWFLSA-N 367.515 0.732 10 10 FCCE COCCn1nc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)ccc1=O 855229070 JVAFWBZALDFQIS-AWEZNQCLSA-N 372.425 0.907 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC(NS(C)(=O)=O)C2)c([N+](=O)[O-])c1 858725942 SAEAANVKINVERW-XQRVVYSFSA-N 355.372 0.519 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(COC(=O)Cn3cncc3C)nc12 859949388 MGHBJRKIKSDTPW-UHFFFAOYSA-N 359.342 0.860 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc2c(c1)COB2O 863886233 YGPQYJACMSLLRY-UHFFFAOYSA-N 366.226 0.795 10 10 FCCE CCCC(=O)NCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 918373068 RSMYFYVZOAUGNO-HNNXBMFYSA-N 360.458 0.921 10 10 FCCE CN1CCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CCC1=O 1328015316 FULKKOZNLFOSRO-UHFFFAOYSA-N 356.426 0.370 10 10 FCCE CC(C)(C)OC(=O)NCCN(CCO)C[C@H](O)COc1ccc(N)cc1 2106769193 UQTDFGCQKLWLRX-HNNXBMFYSA-N 369.462 0.828 10 10 FCCE CCN1C[C@H](S(=O)(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 867496840 IPSKYJBMRKBNBJ-CZUORRHYSA-N 367.471 0.814 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NC(=O)c2cc(O)nc(O)c2)C1 2063326977 VBPXDRBYCUYAKE-GHMZBOCLSA-N 353.375 0.593 10 10 FCCE CN1C(=O)NC(=O)C(=Cc2ccc(N3CCOCC3)c([N+](=O)[O-])c2)C1=O 2313526753 GHLJHSYTICSCHY-UHFFFAOYSA-N 360.326 0.523 10 10 FCCE CC(=O)N(C(=O)C(=O)N1CCN(c2ncccn2)CC1)c1ccc(N)cc1 170318962 XWJMCXHDNBAVTQ-UHFFFAOYSA-N 368.397 0.287 10 10 FCCE CC1=C(C(=O)O)N2C(=O)[C@H](NC(=O)[C@@H](N)c3ccccc3O)[C@@H]2SC1 503996011 CUXVKLLSHPANDN-PGUXBMHVSA-N 363.395 0.151 10 10 FCCE in-vitro COc1cccc(CNC(=O)N[C@H]2CCN(C3CCOCC3)C2=O)c1O 747594563 TZFDXUXVTXHQKP-AWEZNQCLSA-N 363.414 0.980 10 10 FCCE CNC(=O)[C@@H]1CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 817284067 JJUSKUFIICWNMM-OAHLLOKOSA-N 360.458 0.412 10 10 FCCE C[C@H]1CN(c2ccc(CNC(=O)C(=O)NCCCN)cc2F)C[C@H](C)O1 842217389 WMLKLNTVSISSTP-STQMWFEESA-N 366.437 0.521 10 10 FCCE CO[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCOC1 855211014 PFBCVUHJQNOWSX-IINYFYTJSA-N 358.416 0.545 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)C(=O)N(C)OC)C2)cc1 858599847 QTRSJFQZKIRXHT-OLZOCXBDSA-N 350.419 0.981 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3C[C@H]4CC[C@H]3[C@@H](N)C4)CC2)cc1 923398307 KIWZHNBXNWQKNM-OFCAXSSNSA-N 374.529 0.990 10 10 FCCE CN(C)c1ccc([C@@H](CNC(=O)C(=O)NCc2ccnn2C)N(C)C)cc1 929502049 DDOVMTPTEOWNDI-QGZVFWFLSA-N 372.473 0.521 10 10 FCCE CCS(=O)(=O)C1(CNC(=O)C(=O)NCCc2ccc(N)cc2)CC1 1327840886 JWOQYIXAZNGTOV-UHFFFAOYSA-N 353.444 0.011 10 10 FCCE CN(CCN1CCOC(C)(C)C1)C(=O)C(=O)N1Cc2cccc(O)c2C1 1351908502 NRQZUXFRAZCJTO-UHFFFAOYSA-N 361.442 0.804 10 10 FCCE CNC(=O)C1(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC1 1451054417 BFRMCLARAFCWEW-UHFFFAOYSA-N 353.369 0.944 10 10 FCCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1c[nH]nc1S(N)(=O)=O 1539469084 UTVUCHJXOTWSER-UHFFFAOYSA-N 363.443 0.930 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@]4(CNC(=O)C4)C3)nc12 278977532 YOASRGGFRSBXPH-KRWDZBQOSA-N 359.386 0.324 10 10 FCCE CCOC(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)NCc1ccc(OC)cc1O 793083443 CQIPOKWXTOQFOI-MNOVXSKESA-N 367.402 0.656 10 10 FCCE O=C(CN1CCn2nncc2C1)NCc1ccc(N2CCOCC2)c(F)c1 847035879 NTMJFJVJNKLSIX-UHFFFAOYSA-N 374.420 0.386 10 10 FCCE COc1ccc(N(CC(=O)O)CC(=O)NC[C@H](OC)[C@@H]2CCOC2)cc1 853010549 FOQDIDIFZSSODV-CJNGLKHVSA-N 366.414 0.754 10 10 FCCE COc1ccc(N2CC[C@H](NS(=O)(=O)N(C)C3CCNCC3)C2)cc1 866776502 HUCNAKWPBAEMEN-AWEZNQCLSA-N 368.503 0.792 10 10 FCCE COC(=O)[C@]12C[C@H](N)C[C@H]1CN(CC(=O)NCc1ccc(N(C)C)cc1)C2 903492419 CKTQYEDIVDONGW-YRNRMSPPSA-N 374.485 0.581 10 10 FCCE CN(C)C(=O)/C=C\C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1141996394 TVHDTIHOTQTDGM-FJVVXJACSA-N 358.442 0.649 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1c[nH]nc1S(N)(=O)=O 1162116373 ZHLQKBIFBVJSJC-LLVKDONJSA-N 365.459 0.793 10 10 FCCE CS(=O)(=O)NC[C@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1644182258 XIBAYVBGWDNCHJ-SNVBAGLBSA-N 353.404 0.860 10 10 FCCE CN1CCN(NC=C2C(=O)NC(=O)N(c3ccccc3Cl)C2=O)CC1 2296940559 FBGWWXLQDDYFFA-UHFFFAOYSA-N 363.805 0.559 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3CC[C@@H]3C(N)=O)cc2)CC1 1303721271 VORTZPMFFJDWAH-HOTGVXAUSA-N 358.442 0.516 10 10 FCCE CN1CCN(c2ccc(CNCC(C)(C)CS(N)(=O)=O)cc2F)CC1 1329290518 GLFWNWKPISQBOM-UHFFFAOYSA-N 372.510 0.982 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccc[n+]([O-])c3)cc2)CC1 1638488279 CNVSZEWZOHYNIM-UHFFFAOYSA-N 354.410 0.952 10 10 FCCE O=C1NC(=S)N(c2ccccc2)C(=O)C1=CNCCCN1CCOCC1 2296930163 DAVBPFLOVREREP-UHFFFAOYSA-N 374.466 0.630 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNCc1c(O)cccc1F 2312330938 SIUFNHVQOWIRRN-CFVMTHIKSA-N 356.394 0.962 10 10 FCCE CC(=O)OC[C@H]1O[C@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@H]1OC(C)=O 616626135 QKGHBQJLEHAMKJ-QMVSFRDZSA-N 373.318 0.380 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@H](C(F)F)C2)c1 801421818 GCPGCOZNSILCHL-NSHDSACASA-N 350.343 0.870 10 10 FCCE OCC1CCN(c2ccc(CNC[C@@H](O)CN3CCOCC3)cc2)CC1 843063385 ALYNYMPJSUVXTF-HXUWFJFHSA-N 363.502 0.678 10 10 FCCE NCC12CC(CN1C(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)C2 851686581 PSEGVUMKFDDZQU-UHFFFAOYSA-N 358.442 0.089 10 10 FCCE CCS(=O)(=O)NCCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852064929 UVXNMQHYABWSPF-ZDUSSCGKSA-N 370.475 0.512 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3OCCO[C@@H]3C)CC2)cc1 930940151 BURWMAQLUYTKMG-CRAIPNDOSA-N 363.458 0.737 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3CCCn4nncc4C3)ccc21 1119469657 UYPHAPDORQVOGM-UHFFFAOYSA-N 368.441 0.709 10 10 FCCE COCCN1CCn2cc(C(=O)NCc3ccc(N(C)C)cc3)nc2C1=O 1548361832 XDUXJIWTSJGUMN-UHFFFAOYSA-N 371.441 0.981 10 10 FCCE NS(=O)(=O)c1nc(C(=O)N2Cc3cccc(O)c3C2)n2ccccc12 1587933317 RAQJDOSADFIKBD-UHFFFAOYSA-N 358.379 0.843 10 10 FCCE Nc1nnn(CC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 1611011841 YQVYNFRKQXLDAA-UHFFFAOYSA-N 367.360 0.642 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1C[C@@H](O)CN(C(=O)c2cc(O)nc(O)c2)C1 2049116572 JHOGJQGJTXCGNR-WDEREUQCSA-N 353.375 0.593 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1C(=O)NCCc1ccc(N)cc1 2136169629 GHUDDFPQEADHKG-RRFJBIMHSA-N 365.430 0.269 10 10 FCCE CN1CC(NC(=O)[C@H](Cc2ccc(O)c(O)c2)NC(=O)OC(C)(C)C)C1 2136241016 TYGNHSKVGBPXLM-ZDUSSCGKSA-N 365.430 0.964 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CCOCC3)CC2)cc1F 151358708 XQHCCBAVMLRASE-INIZCTEOSA-N 353.438 0.649 10 10 FCCE CS(=O)(=O)Nc1ccc(NS(=O)(=O)CCCF)cc1C(=O)O 275163802 BAEGPZUYGKXPOK-UHFFFAOYSA-N 354.381 0.858 10 10 FCCE C[C@@H](NC(=O)C(=O)N[C@H]1CCCN(C)C1)c1ccc(N2CCOCC2)cc1 803308876 LTZXLVZBINSSCF-WBVHZDCISA-N 374.485 0.911 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC(S(N)(=O)=O)C1 922912146 FSVAQRUNEYIHAK-LBPRGKRZSA-N 354.476 0.674 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)c3nsnc3O)cc2)CC1 1178039056 LGRVBPFUVHVQHT-UHFFFAOYSA-N 361.427 0.875 10 10 FCCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1CCN(c2ccc3nncn3n2)C1 1632944117 PPZXAWBWUJEPSZ-XYRDXQRHSA-N 366.381 0.944 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NCCCCO)CC2)cc1 278372665 CALQFMOFBKDEKE-UHFFFAOYSA-N 350.463 0.889 10 10 FCCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H](O)C(N)=O)C1 614077942 VOGDTLCXCXFETP-QGZVFWFLSA-N 358.442 0.370 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1CCCN(S(=O)(=O)c2c(C)noc2C)C1 808497778 GKEVFGKHJBTEMC-LBPRGKRZSA-N 372.399 0.393 10 10 FCCE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCc1ccc(O)c(O)c1 860243601 RFFBBVHHZJBLPK-UHFFFAOYSA-N 351.403 0.524 10 10 FCCE O=C(NCc1ccc(S(=O)(=O)CCO)cc1)c1c(F)ccc(O)c1O 1183359407 ODLIWDDDZJWQLR-UHFFFAOYSA-N 369.370 0.933 10 10 FCCE CC(C)C[C@H](NC(=O)Cc1ccc(O)c(O)c1)C(=O)NCCN(C)C 1295921834 WMDZBERJGWQLIT-AWEZNQCLSA-N 351.447 0.849 10 10 FCCE CC(C)[C@H](N)CCNC(=O)C(=O)C(=O)C(=O)NC[C@H]1C[C@H]2C=C[C@H]1CC2 1347085842 MMZMBOGRDOXGAV-BYNSBNAKSA-N 363.458 0.333 10 10 FCCE O=C(N[C@@H](CO)C(=O)NCCc1ccc(O)c(O)c1)c1ccc(F)cc1 1465981939 UHCLDLBULPQTDN-AWEZNQCLSA-N 362.357 0.687 10 10 FCCE CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C1CS(=O)(=O)C1 2076837606 MLKVVYMWYDLTHG-MNOVXSKESA-N 373.435 0.836 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](CNC(=O)c2cc(O)c(O)c(O)c2)C1 2132351472 XOGXCOOLHCQJIV-MFKMUULPSA-N 368.386 0.761 10 10 FCCE CN1CCN(CC(=O)Nc2ccc(N)cc2)[C@H](CNC(=O)C(F)(F)F)C1 2163045021 YHKOQCATSDRRGI-CYBMUJFWSA-N 373.379 0.502 10 10 FCCE COc1ccc(CNC[C@@H]2[C@@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c(O)c1 2225621917 GSHOBHDPSBEONC-VNQPRFMTSA-N 368.430 0.832 10 10 FCCE Cc1cc(C(=O)N[C@@H](CO)CN2CCOCC2)c(C)n1-c1ccccn1 773370165 KWEAUMKXMCQLCK-MRXNPFEDSA-N 358.442 0.912 10 10 FCCE CC(=O)C(=O)COC(=O)C12CCC(C(=O)OCC(=O)C(C)=O)(CC1)CC2 808545479 CFVPGDURICBZMQ-UHFFFAOYSA-N 366.366 0.730 10 10 FCCE Nc1ccc(OCCOn2c(=O)c(=O)oc3ccc(C(=O)O)cc32)cc1 821297918 ZHEAICMDHMUDCG-UHFFFAOYSA-N 358.306 0.743 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCNC[C@H]2c2cccnc2)cc1 842037205 XJGDGUSFYVWUIM-SFHVURJKSA-N 367.453 0.937 10 10 FCCE COc1ccc(N2CCN(C(=O)c3nc(O)nc(O)c3OC)CC2)cc1 1150072345 YGFKMXFNVSIGHO-UHFFFAOYSA-N 360.370 0.867 10 10 FCCE CNC(=O)CCCN(C)c1nnnn1Cc1ccc(N2CCOCC2)cc1 1262396380 DMTKSALDGXDHOK-UHFFFAOYSA-N 373.461 0.520 10 10 FCCE COc1ccc(N2CCN(C(=O)Cn3c(O)nnc3O)CC2)cc1F 1545606452 PAFVNVJLMXDUEX-UHFFFAOYSA-N 351.338 0.186 10 10 FCCE CN1CCn2c(CCNC(=O)/C=C\c3ccc(O)c(O)c3)nnc2C1=O 1594081811 JPCSKIHJPDSOPN-HYXAFXHYSA-N 357.370 0.147 10 10 FCCE CC(C)NS(=O)(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCOCC1 62370936 XACVJKBEPXMNRI-KRWDZBQOSA-N 370.519 0.958 10 10 FCCE O=C(NC1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1)[C@H]1CCCO1 169869693 PPLDULLVPDWRLY-CQSZACIVSA-N 350.371 0.703 10 10 FCCE CCOC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)/C=C\c1ccc(O)c(O)c1 787663374 UORFEBHQPWCFOI-KXKUKXMYSA-N 350.371 0.684 10 10 FCCE CNC(=O)[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 817154653 NJSBEUSDYWWNDN-AWEZNQCLSA-N 364.421 0.940 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NCCC2(CN)CC2)cc1 846347080 LSKYMORPPVBTQZ-UHFFFAOYSA-N 362.474 0.835 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC34CC(CN3)C4)C2)cc1 851691397 NUKRBROVFCRBHR-SHYRYGCCSA-N 358.442 0.258 10 10 FCCE CO[C@@H]1COCC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 897580202 QCQHZVLHKISYSW-JKSUJKDBSA-N 367.421 0.770 10 10 FCCE COc1cccc(CNC(=O)NCCS(=O)(=O)N2CCCC2)c1O 1313346569 FPTXYEVXDJHTTJ-UHFFFAOYSA-N 357.432 0.626 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCN(c2cccnn2)CC1 1330997219 QHNGJLXOGHWHCQ-UHFFFAOYSA-N 355.398 0.489 10 10 FCCE C[C@H]1CN(c2ccc(CNC(=O)Cn3nnc(N)n3)cc2F)C[C@@H](C)O1 1441787992 RTHZLBLRWVZZOU-PHIMTYICSA-N 363.397 0.324 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2CCS(=O)(=O)[C@H]3COCC[C@H]32)cc1 1570205178 KYSQLACCLCYZKO-OLZOCXBDSA-N 366.399 0.877 10 10 FCCE O=C(CN1C(=O)c2ccccc2S1(=O)=O)NCc1c(O)cccc1F 1635360230 FFCZFBIIOWDQQN-UHFFFAOYSA-N 364.354 0.992 10 10 FCCE O=C(CNS(=O)(=O)c1c(F)cccc1F)NCc1ccc(O)cc1O 1638351688 BSTBBJMGFHYJDR-UHFFFAOYSA-N 372.349 0.971 10 10 FCCE COc1ccc(N2CCN(C(=O)Cc3c(O)ncnc3O)CC2)c(OC)c1 1642103991 QBASESNWTBTWSE-UHFFFAOYSA-N 374.397 0.796 10 10 FCCE CC(C)CN1C(=O)/C(=C/NCCCN2CCCC2=O)C(=O)NC1=S 1772821102 PXEQCTVFDKKHFS-FMIVXFBMSA-N 352.460 0.372 10 10 FCCE Cc1ccc(O)c(CNCCC(=O)NCCN2C(=O)CSC2=O)c1 1857861696 DWXCTECEUIYTHJ-UHFFFAOYSA-N 351.428 0.992 10 10 FCCE CC(C)(C)OC(=O)N[C@](C)(CO)CNS(=O)(=O)Cc1ccc(N)cc1 2060810418 YYNBNEWYYGKQBD-INIZCTEOSA-N 373.475 0.964 10 10 FCCE CC(C)(C)OC(=O)NCC1(O)CN(C(=O)Cc2ccc(O)c(O)c2)C1 2066533954 KRYFXODCJUNHDM-UHFFFAOYSA-N 352.387 0.738 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCN(CC(F)F)CC3)nc12 127109409 SRYDUVJUZRKXAN-UHFFFAOYSA-N 369.372 0.994 10 10 FCCE CCN(CC)c1ccc(CNS(=O)(=O)N2CCN(C=O)CC2)cc1 195114169 PNCKNJNBUOPNKR-UHFFFAOYSA-N 354.476 0.641 10 10 FCCE C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCS(=O)(=O)C1 365440518 VAZGNGXAALLKKJ-VIFPVBQESA-N 355.372 0.797 10 10 FCCE CC(=O)N1CCN(c2ccc(OC[C@H](O)CN3CCOCC3)cc2)CC1 755304321 NTGNHHRUTMKUMJ-GOSISDBHSA-N 363.458 0.427 10 10 FCCE COC(=O)C1(CS(=O)(=O)NCc2ccc(N3CCOCC3)cc2)CC1 866582816 MVSPSFVDUHXYHE-UHFFFAOYSA-N 368.455 0.896 10 10 FCCE O=C(CO)NCCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 906836060 WOUAYOCCBUZICO-GFCCVEGCSA-N 371.384 0.872 10 10 FCCE CNC1CCN(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC1 923288298 VAKFFECXGZJSSY-LJQANCHMSA-N 362.518 0.862 10 10 FCCE CO[C@]1(C(=O)NCc2ccc3cccnc3c2O)CCS(=O)(=O)C1 1142730640 CAHSUWCSFHMNLR-MRXNPFEDSA-N 350.396 0.760 10 10 FCCE CCS(=O)(=O)C1(CNC(=O)C(=O)NCc2ccc(N(C)C)cc2)CC1 1327903525 YMAPUHRSEOJPMM-UHFFFAOYSA-N 367.471 0.452 10 10 FCCE COC[C@H](CNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)OC 1328090411 BHHTYQPSTIAOKQ-BBRMVZONSA-N 365.430 0.168 10 10 FCCE CC(C)(C)OC(=O)N1CC(CO)(NC(=O)COc2ccc(N)cc2)C1 2044236228 ZCNUYYYXOMMVAV-UHFFFAOYSA-N 351.403 0.746 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNC(=O)c1cccc(O)c1O 2225627437 MXCDTEMPJCWYJP-JKOKRWQUSA-N 368.386 0.169 10 10 FCCE CC(C)(C)OC(=O)N1CC(C(=O)N2CC[C@H](N=[N+]=[N-])C2)(S(C)(=O)=O)C1 2326786786 NOUUKEHQRCXJQU-JTQLQIEISA-N 373.435 0.932 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N1CN(C)C(=O)[C@@H]1C 834857173 DQXBFQWKHFEODX-KGLIPLIRSA-N 360.458 0.755 10 10 FCCE C[C@H]1CCNC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 842190663 GDKDRSDMNKFYPQ-YOEHRIQHSA-N 360.458 0.254 10 10 FCCE CC(C)n1cnc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 845827341 APMSWOKLJTXYAH-UHFFFAOYSA-N 372.429 0.951 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1CCN2C[C@H](O)C[C@H]2C1 848936437 ZYBNRAHJCFULGH-NWDGAFQWSA-N 370.500 0.019 10 10 FCCE CCN1C[C@@H](S(=O)(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 867496839 IPSKYJBMRKBNBJ-CJNGLKHVSA-N 367.471 0.814 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNCC[C@@H](O)C(F)F)CC2)cc1 872222467 VINICKSPCUXNTA-NVXWUHKLSA-N 373.444 0.784 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3C[C@H]2C[S@]3=O)cc1F 1349698866 TTYJHSUOIRFDGM-BGBYCUJFSA-N 353.419 0.240 10 10 FCCE O=C(CCCc1nn[nH]n1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1628757078 LTOVWGRDKXCUCB-UHFFFAOYSA-N 362.409 0.939 10 10 FCCE CC(C)(C)OC(=O)N1CC(O)(CNC(=O)c2cc(O)c(O)c(O)c2)C1 2068579303 WSYUYGFPUDDLEN-UHFFFAOYSA-N 354.359 0.515 10 10 FCCE CC(=O)N[C@@H](C(=O)NCc1ccc(N2CCNC(=O)C2)cc1)C1CCCC1 42078230 UFGQLRMQIYKYDQ-LJQANCHMSA-N 372.469 0.934 10 10 FCCE C[C@@H]1C(=O)NC(=O)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 92776073 MLTBRYHMPBPERH-GCXOYZPQSA-N 353.176 0.252 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N[C@H]3CCCN(C)C3)CC2)cc1 804318547 NMQQWSHLBASPTK-INIZCTEOSA-N 374.485 0.991 10 10 FCCE CC(C)[C@H](N)CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 851685399 APMBIGMHTZMDAA-QGZVFWFLSA-N 362.474 0.629 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)NC[C@@H]3COCO3)cc2)CC1 1235605694 COUFFQAGKCKJIP-MRXNPFEDSA-N 362.430 0.560 10 10 FCCE CCN(C(=O)C(=O)N1Cc2cccc(O)c2C1)[C@H](C)CS(C)(=O)=O 1329421714 BILSHGRYGAANEH-LLVKDONJSA-N 354.428 0.516 10 10 FCCE CCCCN(Cc1ccccc1O)C(=O)[C@H](C)NC(=O)Cn1cnnn1 1467497707 MZSOOTZZODSLHK-ZDUSSCGKSA-N 360.418 0.712 10 10 FCCE CC(C)(C)OC(=O)N1CCO[C@@H]2C[C@@H](COc3nnc(=N)[nH]n3)C[C@H]21 2219022133 UFWJMLLZBIVTQJ-HBNTYKKESA-N 352.395 0.472 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC(F)(F)C[C@H]2CO)c1 781331182 MNAJLGBJJJRRJR-VIFPVBQESA-N 350.343 0.606 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3CCN(C4CC4)C(=O)C3)ccc21 803685867 NOZUAVRFMOAXGL-UHFFFAOYSA-N 370.453 0.518 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCOC2(CNC2)C1 841712094 LSMDLPLWUUOEPM-UHFFFAOYSA-N 364.421 0.546 10 10 FCCE O=C(Cn1ncc([N+](=O)[O-])n1)NCc1ccc(N2CCOCC2)c(F)c1 863374053 JEDOQLBVPIYPKB-UHFFFAOYSA-N 364.337 0.478 10 10 FCCE CN(C)c1ccc(CNC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)cc1 929402937 FVVTYSLJUQCSLB-UHFFFAOYSA-N 363.443 0.513 10 10 FCCE C[C@@H]1CN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC(=O)N1 1251103461 DJNLPOQOIWICAH-CYBMUJFWSA-N 373.457 0.418 10 10 FCCE COc1cc(N2CCN([C@H]3CCN(OC)C3=O)CC2)cc(OC)c1OC 1354611854 YWJGBNOMMZSXAC-AWEZNQCLSA-N 365.430 0.997 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1C[C@@H](O)[C@H](CO)C1 1681849664 DSUXCQCIEWXWTQ-SWLSCSKDSA-N 371.384 0.296 10 10 FCCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N1CCN2C(=O)NC[C@H]2C1 2042436716 NZGVHGTVTKJEAX-KRWDZBQOSA-N 356.426 0.772 10 10 FCCE COC[C@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CN(C(=O)OC(C)(C)C)CCO1 2112571285 NLZYQCUSVCDKDS-LXIYXOSZSA-N 370.446 0.905 10 10 FCCE C[C@@]1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCC(=O)NC1 1178039353 QIGUOROLCMDPHE-HXUWFJFHSA-N 372.469 0.921 10 10 FCCE NC(=O)CCCCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1261747782 ZPMYAWBPRDTFFP-UHFFFAOYSA-N 367.471 0.583 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)COc2ccc(N)cc2)[C@H](O)C1 2062449888 BVEHQESSBOFGGW-UONOGXRCSA-N 351.403 0.744 10 10 FCCE COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)OCC(=O)C(C)=O)C1=O 808529764 SBXJTPQUKCWANE-KRWDZBQOSA-N 362.338 0.164 10 10 FCCE CNC(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 817811559 LROCMKVILRMNPU-OAHLLOKOSA-N 358.442 0.280 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@@]3(C)CCOC3)C2)cc1 828142730 JLCZIXWQZZWFKD-AUUYWEPGSA-N 361.442 0.933 10 10 FCCE CCN(CC)c1ccc(CNC(=O)N2CCN(CC(N)=O)C(=O)C2)cc1 837725788 SBCAWPNLLMCULJ-UHFFFAOYSA-N 361.446 0.372 10 10 FCCE CN1CCCc2cc(CNC(=O)NC[C@@H](O)CS(C)(=O)=O)ccc21 915390692 NHRPRHXPFODEIZ-CQSZACIVSA-N 355.460 0.274 10 10 FCCE C[C@@H](NC(=O)C(=O)NC[C@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(N(C)C)cc1 1119838410 RSLPIYPRQLEGFG-WNOSKKOXSA-N 361.442 0.850 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@]23COCCN2C(=O)OC3)c1 1254433219 ROGBGDSPRAULFI-PIGZYNQJSA-N 365.386 0.982 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@H](CO)CCF)cc2)CC1 1255509109 MUILERIXNHXPSI-HNNXBMFYSA-N 366.437 0.908 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H]3C[C@H]2C[S@]3=O)cc1 1327490895 BEJPSMAVRYFKRD-DUOCMMSMSA-N 363.483 0.881 10 10 FCCE Cc1nn(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(=O)o1 1465395396 XKOHUWKEDPGSPC-UHFFFAOYSA-N 360.414 0.670 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnn(CCO)c1 1567306041 BOGBKRBAYXFHOA-ZDUSSCGKSA-N 363.370 0.191 10 10 FCCE C[C@@H](NC(=O)[C@@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C)c1ccccc1O 2332891373 JSQBTKVTBHOFJU-KJEVXHAQSA-N 366.414 0.911 10 10 FCCE CN(C)c1ccc(CN2CCN(S(=O)(=O)N3CCOCC3)CC2)cc1 194158456 OPNLTQOFSYPBMI-UHFFFAOYSA-N 368.503 0.447 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCN(C2CC2)CC1 284098400 PMSRHWARBJWXMH-UHFFFAOYSA-N 372.469 0.446 10 10 FCCE C[C@H](NS(C)(=O)=O)C(=O)NCc1cc(Br)ccc1O 804739527 IPXZBKDATIOULX-ZETCQYMHSA-N 351.222 0.709 10 10 FCCE CC(=O)C(=O)COC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1C 808486460 BUESCHTWAJOWNK-UHFFFAOYSA-N 369.395 0.331 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H]3CCN(C)S3(=O)=O)CC2)cc1 843516668 CUJRTBRGSJDCHX-OAHLLOKOSA-N 353.444 0.378 10 10 FCCE COc1ccc(N2CCN(S(=O)(=O)[C@H]3CCCNC3)CC2)c(OC)c1 923666120 PMQYFESXMWKFEM-HNNXBMFYSA-N 369.487 0.908 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@H]3[C@@H]2CCCN3CCO)cc1 929236827 DMIOYSUEKDRQAE-MSOLQXFVSA-N 374.485 0.426 10 10 FCCE C[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C(=O)O1 1254871300 FGJUPSDFGRQKOV-WBMJQRKESA-N 374.441 0.892 10 10 FCCE Cc1ccc(O)c(CNC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)c1 1301046795 LEKDNYFLTUBJMH-UHFFFAOYSA-N 350.400 0.461 10 10 FCCE O=C(c1c(F)ccc(O)c1O)N1CCC[C@H](N2CCCS2(=O)=O)C1 1650982520 HYHQFLUNHGUESI-JTQLQIEISA-N 358.391 0.877 10 10 FCCE CN(CCN=[N+]=[N-])C(=O)[C@H](NC(=O)OC(C)(C)C)C1CS(=O)(=O)C1 2020695822 JEISFGJQKBZMGG-SNVBAGLBSA-N 361.424 0.693 10 10 FCCE Oc1c(Br)cc(Cl)cc1CN[C@@H]1C[C@H](O)[C@H](O)[C@@H]1O 2108826824 YRRRWRKSVBABJQ-DMWPJOQESA-N 352.612 0.753 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)C[C@H]1CO 2122239374 JKOLSUZNEYTYLF-NWDGAFQWSA-N 367.402 0.841 10 10 FCCE CN1NN=C2C1=NCC[C@H]2C(=O)NCc1ccc(N2CCOCC2)c(F)c1 816891040 HCZYUHIWYYTZAF-CYBMUJFWSA-N 374.420 0.503 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCOC3CNC3)cc2)C1 827469287 TWYLCDLNTFEXGS-HNNXBMFYSA-N 360.458 0.383 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3ccc(=O)n(C)c3)C2)cc1 850536299 FACAEVHFJOALBZ-CQSZACIVSA-N 370.409 0.728 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC[C@H]3CCNC3)C2)cc1 851688116 QOBURIFZXNPVNO-HUUCEWRRSA-N 360.458 0.506 10 10 FCCE CO[C@@]1(CO)CCCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 855443974 HEUHUSKQSZWWRG-HNNXBMFYSA-N 358.416 0.377 10 10 FCCE Cn1cc(C(=O)NC[C@@H]2CCCN2C(=O)Cc2ccc(O)c(O)c2)cn1 1140723428 KQYOWNOPQNULJV-AWEZNQCLSA-N 358.398 0.795 10 10 FCCE CCON(C)C(=O)CNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 1326634792 WCYNILOQADKIGL-UHFFFAOYSA-N 362.430 0.211 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)C1(CS(C)(=O)=O)COC1 1351502181 SAJFCTBZCIFSBH-UHFFFAOYSA-N 354.428 0.539 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CN3CCOC3=O)cc2)C1 1542180368 JKBYSJNQTCMLRS-CQSZACIVSA-N 360.414 0.457 10 10 FCCE Cn1nc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C=O 1542180733 XFCQCWLADNBOTR-CQSZACIVSA-N 369.425 0.864 10 10 FCCE O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CCN(c2ccc3nncn3n2)C1 1632944115 PPZXAWBWUJEPSZ-IUAZIXFQSA-N 366.381 0.944 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3[C@H](C)C(=O)N[C@H](C)[C@H]3C)nc12 1643642929 TUYWUVJOBNYRJT-GMTAPVOTSA-N 361.402 0.709 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1CNC(=O)Cc1ccc(N)cc1 2225623293 OWJSZLQJKMFJBJ-IJEWVQPXSA-N 365.430 0.269 10 10 FCCE C=CC(=O)NCCC(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1 276123442 BSLMNEVYZDBUFM-UHFFFAOYSA-N 358.442 0.664 10 10 FCCE CC(=O)C(=O)COC(=O)CN1C(=O)N[C@@]2(C[C@@H](C)CC(C)(C)C2)C1=O 808497868 HFWHMHYHNRYLKA-DYZYQPBXSA-N 352.387 0.825 10 10 FCCE C[C@H](NS(=O)(=O)C[C@H]1CNCCO1)c1ccc(N2CCOCC2)cc1 866747065 OCCPCXLCIXTJDO-WMLDXEAASA-N 369.487 0.492 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@H](O)CS(C)(=O)=O 922917160 YAHJVGJKVOXLPI-BBRMVZONSA-N 371.503 0.697 10 10 FCCE CCOC(=O)CN(CC(N)=O)C(=O)c1cc2cc(O)c(O)cc2s1 1142366462 KGAMKSGKCUUJRQ-UHFFFAOYSA-N 352.368 0.803 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@@H]3C[C@H]2C[S@@]3=O)cc1F 1349698864 TTYJHSUOIRFDGM-CTRJTCCGSA-N 353.419 0.240 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CN(C3CC3)C(=O)O2)cc1 1349877615 HQWWEEVMVUAQKG-HNNXBMFYSA-N 360.414 0.468 10 10 FCCE CN1CCn2ncc(C(=O)NCc3c(O)cccc3F)c2S1(=O)=O 1596917072 UWKVXULLEBVWMW-UHFFFAOYSA-N 354.363 0.292 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCc2nnc(O)n2C1 1646435066 LIGGCKPGZBZPAR-CQSZACIVSA-N 371.441 0.824 10 10 FCCE N[C@@H](CCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(O)O 1865960185 LRBVWKXWUJACGO-ZDUSSCGKSA-N 354.362 0.819 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@H](Cn3ccnn3)C2)c1 855237543 NNACKNVYJMLFHC-LLVKDONJSA-N 365.415 0.518 10 10 FCCE C[C@H](C(=O)N1Cc2cccc(O)c2C1)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 871202325 DPKGILGGCHUTCS-SQSOSVTJSA-N 356.378 0.785 10 10 FCCE Cn1nccc1[C@H](O)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1253512055 QHYTXHATXJOHPK-GOSISDBHSA-N 373.457 0.914 10 10 FCCE C[C@H](C(=O)NCc1c(O)cccc1O)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1639289153 MBXKUUSYWZGTPT-FYIZZCSQSA-N 360.366 0.265 10 10 FCCE COCCN1C(=O)C(=CNc2ccsc2C(=O)OC)C(=O)NC1=S 2040480808 ZMUYHTWBGRUAHV-UHFFFAOYSA-N 369.424 0.720 10 10 FCCE CC(=O)N1CCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H](C)C1 297811576 MPYAMIHJLNLBAG-AWEZNQCLSA-N 360.458 0.790 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC3CCN(C)CC3)C2)cc1 826649559 AKAQUMCSDBBCLT-HNNXBMFYSA-N 360.458 0.601 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]2CS(N)(=O)=O)cc1 839516169 FPZSQTSFHWOMTI-HNNXBMFYSA-N 354.476 0.122 10 10 FCCE CN(C)c1ccc([C@H](N)CNC(=O)C2(n3cnnn3)CCOCC2)cc1 852792156 SLZOUYJFMFWKNJ-OAHLLOKOSA-N 359.434 0.061 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](F)[C@@H]3CCNC3)cc2)CC1 876909613 CXJMRJHVUMRXGM-SJLPKXTDSA-N 362.449 0.919 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1C[C@@H]2C[C@H]1C[S@@]2=O 1261535022 GDUQDUGCRNBQGY-IMXIGIQMSA-N 359.498 0.473 10 10 FCCE COC(=O)[C@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 1323028196 WNQSXVATDFLVNX-JTQLQIEISA-N 357.457 0.763 10 10 FCCE O=C(NCCCSc1nccs1)N1CCS(=O)(=O)CCO1 1346250715 YYUWFAIYNNHENB-UHFFFAOYSA-N 351.475 0.997 10 10 FCCE O=C(NCCNS(=O)(=O)c1cccnc1)c1c(F)ccc(O)c1O 1472533687 NEOWVWCYORUHFZ-UHFFFAOYSA-N 355.347 0.340 10 10 FCCE NC(=O)c1ncn(CC(=O)N(Cc2ccco2)Cc2ccccc2O)n1 1545496384 JIVDRQKPGPYMFH-UHFFFAOYSA-N 355.354 0.905 10 10 FCCE CC(C)NC(=O)C(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1626009211 SDEMKAPYAXWHKA-UHFFFAOYSA-N 374.401 0.658 10 10 FCCE NC(=O)[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CN(C(=O)Nc2ccc(N)cc2)C1 2162977516 UIGWLIRXPUTQSS-LDYMZIIASA-N 373.335 0.655 10 10 FCCE CC(CO)(CO)NC=C1C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O 2296548488 ZQTGJSNQYXXWSM-UHFFFAOYSA-N 353.762 0.140 10 10 FCCE C[C@H](Cn1cncn1)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 285853083 APYZOZMLCUXGMA-CQSZACIVSA-N 354.414 0.475 10 10 FCCE COCCN1CCC[C@H]1CNC(=O)C(=O)NCc1ccc(N(C)C)cc1 785443586 NMKNXLAVIIVRSL-KRWDZBQOSA-N 362.474 0.596 10 10 FCCE CO[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CCOC1 828497566 YYGHSGAIGIJWIQ-FUHWJXTLSA-N 373.453 0.847 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCCC23OCCO3)c1 1645952011 AMICIXOMTZFXRK-ZDUSSCGKSA-N 356.400 0.789 10 10 FCCE COCCOC1CCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)CC1 738067971 AIWZNHVRBXQHGI-UHFFFAOYSA-N 350.375 0.761 10 10 FCCE CCO[C@@H]1CN(C(=O)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C[C@H]1CN 846344195 PDLZCXNWLKNPGY-YSVLISHTSA-N 362.474 0.752 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCNC12CCC2 861761712 NIDXEOMQFNKUTG-KRWDZBQOSA-N 372.469 0.540 10 10 FCCE C[C@@H]1CN(c2ccc(CNC(=O)CCNC(=O)CO)cc2F)C[C@@H](C)O1 906316832 HMXVQMVWHVRTJB-CHWSQXEVSA-N 367.421 0.554 10 10 FCCE O=C(NCCCNC1CC1)C(=O)C(=O)C(=O)NC[C@@H]1C[C@H]2C=C[C@H]1CC2 1326036180 DPMSTXXVRPVCEU-IHRRRGAJSA-N 361.442 0.101 10 10 FCCE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](O)CN1C(=O)c1cc(O)nc(O)c1 2067395891 JUPGBXORPZKPRJ-QWRGUYRKSA-N 353.375 0.593 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)NCc1ccccc1O 2080587157 GWVKIMSNCFRTFI-IHRRRGAJSA-N 352.387 0.350 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)CNC(=O)c1ccc(O)c(O)c1 2258270165 GYDDVXWMOZNKGT-UHFFFAOYSA-N 356.375 0.076 10 10 FCCE COC[C@](C)(CCO)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 267442497 CEYNGNFIVODCJT-IBGZPJMESA-N 365.474 0.721 10 10 FCCE COC(=O)/C=C\c1ccc(N2CCn3c(CO)nnc3C2)c([N+](=O)[O-])c1 804698521 KUICEXPEEXKBQV-HYXAFXHYSA-N 359.342 0.885 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NCc3cnn(C)n3)CC2)cc1 805014160 RYDSUNRPKVNEGG-UHFFFAOYSA-N 373.461 0.445 10 10 FCCE NC(=O)NC(=O)CCNCc1ccc(N2CCN(CC3CC3)CC2)cc1 819200805 VNRXGJBTHPDKBZ-UHFFFAOYSA-N 359.474 0.893 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NC[C@H](N)C3CC3)CC2)cc1 841749702 HJIRPEGNJKYQDM-SFHVURJKSA-N 361.490 0.854 10 10 FCCE C[C@H]1CCNC[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 842265974 FAVLOJRSZCVUCG-MAUKXSAKSA-N 374.485 0.596 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)[C@H]3CCOC3)C2)cc1 1118693772 ZVZFCQXUYNWKAD-ILXRZTDVSA-N 361.442 0.931 10 10 FCCE C[C@@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CS1(=O)=O 1328780809 QTOMJXDHWITCKF-OCCSQVGLSA-N 367.471 0.451 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@H]4OCC(=O)N[C@@H]4C3)C2)cc1 1565055918 NFCKYZQWKQNIMO-KBRIMQKVSA-N 374.441 0.573 10 10 FCCE CC(C)CN1[C@H]2CN(Cc3ccc(O)c(O)c3)C[C@H]2OCCS1(=O)=O 1613880017 PZQDDCUEZCIIIB-WMLDXEAASA-N 370.471 0.969 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)NCc2nnc3c(=O)[nH]ccn23)c1 1638501594 YHMOWHUOIFNJDL-VIFPVBQESA-N 358.358 0.692 10 10 FCCE O=C(C=Cc1ccc(N2CCOCC2)cc1)NC[C@H]1CN2CCN1CC2 2302718301 QTGLMUYVSWPMPD-IBGZPJMESA-N 356.470 0.652 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NC[C@H]3C[C@@H](O)C3)CC2)cc1 875170781 BPCKFLZZZRSZOO-WOVMCDHWSA-N 362.474 0.887 10 10 FCCE CCN(OC)C(=O)CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1118210105 GBMBMJOUPVKLJO-UHFFFAOYSA-N 362.430 0.429 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CC[C@H](CNS(C)(=O)=O)C2)cc1 1460735218 UEIKCQFTLFAEHF-OAHLLOKOSA-N 368.503 0.240 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)c3ncccc3O)CC2)cc1 1622438074 FAJJZDONRHUOON-UHFFFAOYSA-N 370.409 0.874 10 10 FCCE CC(C)(C)OC(=O)N[C@]1(C(=O)C(=O)C[C@H]2C[C@H](N)C2)CCS(=O)(=O)C1 2052091328 KEQMXOLWOHTJTI-GLKRBJQHSA-N 374.459 0.334 10 10 FCCE NC(=O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2cccc(O)c2)SC1=S 2314541399 LDQQYGOIOHVGTF-VIFPVBQESA-N 352.393 0.922 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3C(=O)NCCN(C)C)CC2)cc1 244313663 XEWNCOHAYKZRCT-QZTJIDSGSA-N 374.485 0.658 10 10 FCCE C[C@H]1CC[C@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CN1 861761350 DEPJDNODOSELAK-HOCLYGCPSA-N 360.458 0.396 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@@H]3CCN[C@H]3C)C2)cc1 861782559 FAOFPNHXYFBBSR-JJRVBVJISA-N 360.458 0.504 10 10 FCCE CCN1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(CC)CC)cc2)C1=O 1119068793 FPVQKYXYRKRMOG-MRXNPFEDSA-N 360.458 0.886 10 10 FCCE COc1ccc(Br)c(CNCCNS(C)(=O)=O)c1O 1964033349 SUVLCIOVIMYGBC-UHFFFAOYSA-N 353.238 0.802 10 10 FCCE CC(=O)c1cc(F)cc(CN2CCN(CCS(C)(=O)=O)CC2)c1O 89933960 OLXKCDHMIIPSQC-UHFFFAOYSA-N 358.435 0.896 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@](C)(O)CN(C)C)C2)cc1 854299206 GIEJNUDAZDVFJR-RDTXWAMCSA-N 350.463 0.886 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H]4C(=O)N(C)C(=O)[C@H]4C3)C2)cc1 868761886 JDCJKGPUMVYVGJ-VBNZEHGJSA-N 372.425 0.530 10 10 FCCE COC(=O)[C@@]1(CNCc2ccc(N(C)C)c(F)c2)C[C@@H]1S(C)(=O)=O 895509093 OVEIHPAZDBYMMW-GOEBONIOSA-N 358.435 0.958 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C3CS(=O)(=O)C3)cc2)CC1 1455864530 BOIWFUULTAROOL-UHFFFAOYSA-N 365.455 0.049 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C1CC2(C1)CS(=O)(=O)C2 1527483268 OCVSMIHKBDDEIZ-UHFFFAOYSA-N 364.467 0.964 10 10 FCCE C[C@H](NC(=O)c1cc(O)nc(O)c1)C1(O)CN(C(=O)OC(C)(C)C)C1 1918772700 SYEOQBIMTDFMHQ-VIFPVBQESA-N 353.375 0.593 10 10 FCCE O=C1NC(=S)N(Cc2ccc(F)cc2)C(=O)C1=CNN1CCOCC1 2296088454 AIPJTSBTXWVHLT-UHFFFAOYSA-N 364.402 0.290 10 10 FCCE CN1CCCc2cc(CNC(=O)/C=C/c3cn(C)c(=O)n(C)c3=O)ccc21 57550157 WXZFYEYRXVGDGM-VQHVLOKHSA-N 368.437 0.796 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)C(C)C)CC2)cc1 285735985 HDMYHVQTZREIDH-UHFFFAOYSA-N 362.474 0.800 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC[C@@H](S(N)(=O)=O)C2)c([N+](=O)[O-])c1 732667331 NCHBGPCVRVSONZ-JOAKQRRISA-N 355.372 0.648 10 10 FCCE O=C1COc2cc(NC(=O)C(=O)NCCc3ccc(O)c(O)c3)ccc2N1 774356034 FRFLFQZBSBESOA-UHFFFAOYSA-N 371.349 0.726 10 10 FCCE CNC(=O)NC[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 858683820 LAXOEVDLXGLHMS-VIFPVBQESA-N 365.346 0.060 10 10 FCCE COc1cc(O)c(CN2CC[C@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1OC 872256468 UOUCUSWAEMUCDL-AHIWAGSCSA-N 363.414 0.776 10 10 FCCE CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCNC(=O)CC2)c1 913091140 WDISRINTFHTJDC-UHFFFAOYSA-N 361.442 0.749 10 10 FCCE O=C(C[C@@H]1NC(=O)NC1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1320230049 TZSYLAQEBYRKOL-ZDUSSCGKSA-N 364.377 0.001 10 10 FCCE Cn1cc([C@H](O)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cn1 1451054113 AIBZRMXGRAPTNQ-INIZCTEOSA-N 366.368 0.885 10 10 FCCE CC(C)(C)OC(=O)N(CCO)CC(=O)NCCOc1ccc(N)cc1 2080826302 FWYHAYWJOSRFOX-UHFFFAOYSA-N 353.419 0.993 10 10 FCCE CC(C)(C)OC(=O)N1CCN[C@@H](CNC(=O)c2cc(O)c(O)c(O)c2)C1 2140601451 JSSRDCVBFKXJFW-NSHDSACASA-N 367.402 0.742 10 10 FCCE Cc1ccc(CN(C)S(=O)(=O)N2CC(O)C2)c(O)c1Br 2381128914 BBUREPSJLRZDPC-UHFFFAOYSA-N 365.249 0.816 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)[C@@H]3COC(=O)N3)CC2)cc1 283095812 WTKGIKWWXGUOMQ-INIZCTEOSA-N 362.430 0.432 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@@H]1CCN[C@H]1C)c1ccc(N2CCOCC2)cc1 861743400 VVLVKHYLXWPNSS-GRDNDAEWSA-N 360.458 0.567 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C12CCN(CC1)C2 900278038 IJDUTDGYTBOYCS-UHFFFAOYSA-N 363.483 0.633 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2C[C@@H](N)C(C)(C)C2)cc1 903771053 KEPPMHKKPHMVCP-MRXNPFEDSA-N 362.474 0.786 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2081036066 NUBFXFPQKQRRLE-SRVKXCTJSA-N 355.395 0.629 10 10 FCCE COc1cccc(N2C(=O)NC(=O)C(=CNCCN3CCOCC3)C2=O)c1 2297062216 XTQKYRDKBQEKBZ-UHFFFAOYSA-N 374.397 0.084 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC(N3CCNC3=O)CC2)cc1 53283178 AUMCJAHUSXKCLV-UHFFFAOYSA-N 359.474 0.858 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)s1 808493534 IYFLNUKPDVQEEI-NSHDSACASA-N 359.425 0.911 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CC(N4CC[C@@H](O)C4)C3)C2)cc1 854296963 LWAGPWLXVJUBRO-WMLDXEAASA-N 360.458 0.734 10 10 FCCE CN(Cc1ccccc1O)S(=O)(=O)C[C@H]1CCN(S(C)(=O)=O)C1 866833349 AAJXUCOOZNNFFK-LBPRGKRZSA-N 362.473 0.435 10 10 FCCE CN(C)c1ccc([C@@H](CNC(=O)C(N)=O)NC(=O)OC(C)(C)C)cc1 1136904598 XBYXEHADYKFQAW-CYBMUJFWSA-N 350.419 0.920 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)NC[C@H]3COCO3)cc2)CC1 1235605692 COUFFQAGKCKJIP-INIZCTEOSA-N 362.430 0.560 10 10 FCCE COC(=O)[C@@H]1C[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1262150774 OBPYUYCHPFBETL-GDBMZVCRSA-N 359.426 0.828 10 10 FCCE CN(CCCCO)C(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1350939664 OMRPSQLQLLPSHG-UHFFFAOYSA-N 363.458 0.495 10 10 FCCE CC(C)(C)OC(=O)N(O)CC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O 2124122222 PACSAHJEZVILJE-JTQLQIEISA-N 370.358 0.836 10 10 FCCE COCCN(C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@H]1CCOC1 803665194 YOSZWGNNSREPBQ-AWEZNQCLSA-N 367.421 0.772 10 10 FCCE NC(=O)C1=NO[C@H](CNC(=O)NCc2cc(Br)ccc2O)C1 838588987 ZAWRNSYAHFCTCO-VIFPVBQESA-N 371.191 0.584 10 10 FCCE C[C@@H](NC(=O)[C@H]1CCN(C)S1(=O)=O)c1ccc(N2CCOCC2)cc1 843537341 SARDTKWQCOXEKN-CZUORRHYSA-N 367.471 0.734 10 10 FCCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC(O)(C(N)=O)C2)C1 913072889 ZSJOWQYVVFGUAQ-UHFFFAOYSA-N 370.453 0.466 10 10 FCCE O=C(c1cccc(O)c1O)N1CCN(C[C@H]2CCCS2(=O)=O)CC1 913127527 CYBYTRBDSUGJIN-GFCCVEGCSA-N 354.428 0.433 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](CN)[C@@H](C(F)(F)F)C1 1261891127 ZBEVPFAFEAKYNW-NEPJUHHUSA-N 359.348 0.946 10 10 FCCE CC(C)(C)OC(=O)N[C@H](CCNC(=O)c1cc(O)c(O)c(O)c1)C(=O)O 2132347959 ARYGPHOCNMQYBB-SECBINFHSA-N 370.358 0.901 10 10 FCCE COC(=O)C[C@@H]1O[C@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O 8951992 BUKUVEWCKMNEFV-RORMEEMCSA-N 373.318 0.380 10 10 FCCE CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@H]1OC(C)=O 141974708 LJICGUPPWNZTFT-YHQUGGNUSA-N 373.318 0.380 10 10 FCCE COC(=O)[C@H]1CN(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c2ccccc21 732175278 JQTSNDDXCBJKDQ-VFNNOXKTSA-N 369.377 0.401 10 10 FCCE CCO[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1)CN(C)C 929235605 AAJIASNAWIVQRX-INIZCTEOSA-N 350.463 0.452 10 10 FCCE N[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC[C@@H]1C(F)(F)F 1334054177 GEZNMHKMVRKQTE-NWDGAFQWSA-N 357.332 0.973 10 10 FCCE COC(=O)/C=C\c1ccc(N2CCN(C(=O)[C@@H](C)O)CC2)c([N+](=O)[O-])c1 1772906879 KXTZFQNCTZGTRM-TXNVCOODSA-N 363.370 0.810 10 10 FCCE NC(=O)C[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(O)c(O)c2)SC1=S 2314541065 DPLABDHOWARWSR-SSDOTTSWSA-N 368.392 0.628 10 10 FCCE NS(=O)(=O)c1ccc(CNC(=O)Nc2cc(O)c(O)c(O)c2)cc1 217278769 DDUUTQFLKZZRSP-UHFFFAOYSA-N 353.356 0.773 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)CCN3CCCC3=O)CC2)cc1 727735906 IDYPCLXHDABLDV-UHFFFAOYSA-N 374.485 0.946 10 10 FCCE COCCN(C[C@H](O)CN1CCOCC1)c1ccc(OC)c(OC)c1 749351149 HDRIGMXRZFTKBD-MRXNPFEDSA-N 354.447 0.850 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1[C@@H]2CCCO[C@@H]21 780390802 HTOYNFIQLXPIGS-BBWFWOEESA-N 364.467 0.963 10 10 FCCE Cc1nc(CN2CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC2)n[nH]1 784168063 MYMQXWYQQPHOLT-UHFFFAOYSA-N 373.373 0.674 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNC[C@H](O)C(C)C)CC2)cc1 843080047 DKRHLZJVBQHIQG-MJGOQNOKSA-N 351.491 0.785 10 10 FCCE CNS(=O)(=O)C[C@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 863825097 KZRQVEXQWRETRN-IYNGYCSASA-N 354.428 0.899 10 10 FCCE CN1CCOC[C@@]1(CO)CNC(=O)NCCCSc1nccs1 921447505 LEPTYXCAWREYRF-AWEZNQCLSA-N 360.505 0.618 10 10 FCCE O=C(CCc1nnc2ccccn2c1=O)NCCc1ccc(O)c(O)c1 1860379293 DYLXHSKCJJPKIV-UHFFFAOYSA-N 354.366 0.792 10 10 FCCE CC(C)(C)OC(=O)N1CC(CNC(=O)Cc2ccc(N)cc2)(C(N)=O)C1 2106261818 LVOBGWPVDLRGSC-UHFFFAOYSA-N 362.430 0.650 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2312333769 ABZKFFOSWSEDPH-DGORSVRFSA-N 355.395 0.675 10 10 FCCE CN(C)c1ncccc1N(C)C(=O)C1=CC=CN2CCS(=O)(=O)N=C12 750958995 ZJHXHSAAGGBQEV-UHFFFAOYSA-N 361.427 0.608 10 10 FCCE NC(=O)CC(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 787944411 QTWJZTHOKOLKPT-UHFFFAOYSA-N 366.329 0.819 10 10 FCCE CN1CC(=O)N(CC(=O)NCc2cc(Br)ccc2O)C1=O 804737598 UGTOHEVQXYIFQG-UHFFFAOYSA-N 356.176 0.665 10 10 FCCE CS(=O)(=O)NCCC(=O)NCc1cc(Br)ccc1O 804737854 RGWIORJLIMTBIL-UHFFFAOYSA-N 351.222 0.710 10 10 FCCE CC(=O)C(=O)COC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 808497528 SHNPQYDDINYROH-UHFFFAOYSA-N 350.283 0.984 10 10 FCCE O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)CN1CCOCC1 819361328 OWOIKPOHXUAKMF-HNNXBMFYSA-N 371.428 0.584 10 10 FCCE COC(=O)[C@@H]1C[C@@H](O)CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 826816282 DVSANTALGMHVKQ-RKDXNWHRSA-N 351.315 0.286 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]2CS(N)(=O)=O)cc1 839516170 FPZSQTSFHWOMTI-OAHLLOKOSA-N 354.476 0.122 10 10 FCCE COC(=O)[C@@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H]1C1CC1 1329435732 HPANVBJHVMNJBD-DZGCQCFKSA-N 358.394 0.892 10 10 FCCE COC(=O)[C@@H](F)CNC(=O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1333978516 KRPFLXIZHQNPOD-HNNXBMFYSA-N 365.405 0.871 10 10 FCCE C[C@@H]1C[C@H](NC(=O)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)[C@@H](C)O1 1353793681 JJPOEIVNDFVJIS-RKVPGOIHSA-N 374.485 0.737 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCCCCN=[N+]=[N-])[C@@H](O)C1 2076823037 YHCIMQFRGKGJIM-NHYWBVRUSA-N 357.411 0.926 10 10 FCCE Cn1[nH]c(CNC(=O)OC(C)(C)C)nc1=NCc1ccc(O)c(O)c1O 2126797895 UPRYVIGLMBQSOV-UHFFFAOYSA-N 365.390 0.991 10 10 FCCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN(C2CC2)C(=O)C1 788911703 PZNGRDRQAMTNNU-UHFFFAOYSA-N 370.453 0.736 10 10 FCCE C[C@@H]1C(=O)N(C)CN1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 825728438 VYENXKPMOIWZNW-GFCCVEGCSA-N 350.394 0.992 10 10 FCCE Cc1nnc(CC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)o1 1288912753 LDPGNVGJJHFMHL-UHFFFAOYSA-N 357.414 0.939 10 10 FCCE CNC1CCN(C(=O)C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 1327961920 PUJZDGIHPBRIFS-OAHLLOKOSA-N 374.485 0.848 10 10 FCCE CC(C)(C)OC(=O)N1CC(NC(=O)c2cccc(O)c2O)(C(N)=O)C1 2054398870 GEWPYYQUHGWZFZ-UHFFFAOYSA-N 351.359 0.302 10 10 FCCE O=S1(=O)C[C@@H]2NCCN(Cc3cc(Br)ccc3O)[C@H]2C1 2143714960 WXWRGOIHCSTAKR-RYUDHWBXSA-N 361.261 0.726 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3CCOCC3)CC2)cc1F 151358771 XQHCCBAVMLRASE-MRXNPFEDSA-N 353.438 0.649 10 10 FCCE CC(=O)O[C@@H]1O[C@@H](CN=[N+]=[N-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O 616585984 LFQWTDKRDROWBN-PDWCTOEPSA-N 373.318 0.380 10 10 FCCE CNC(=O)CNC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768919293 AWOMNXZGMHZZJU-UHFFFAOYSA-N 359.474 0.764 10 10 FCCE C[C@H](Cn1cncn1)NC(=O)C(=O)NCCCSc1nccs1 803916747 SPUBIYNEOPOTOC-SNVBAGLBSA-N 354.461 0.538 10 10 FCCE C[C@@H]1CCNC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 851689515 PXAWQXJSPCVANA-RDTXWAMCSA-N 374.485 0.378 10 10 FCCE C[C@H](C(=O)N1Cc2cccc(O)c2C1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 871202326 DPKGILGGCHUTCS-VRSYBVEWSA-N 356.378 0.785 10 10 FCCE CN1C[C@H](O)C[C@]1(C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 900269543 PVPRNNYQCLACRB-RDTXWAMCSA-N 351.422 0.734 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC(S(N)(=O)=O)C1 922912145 FSVAQRUNEYIHAK-GFCCVEGCSA-N 354.476 0.674 10 10 FCCE CNS(=O)(=O)c1cc(C(=O)NCc2ccc(O)cc2O)ccc1OC 1162278448 IEOGHGKPYDAKNQ-UHFFFAOYSA-N 366.395 0.945 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1C[C@@H](C(F)(F)F)[C@H](CN)C1 1261891130 ZBEVPFAFEAKYNW-VXGBXAGGSA-N 359.348 0.946 10 10 FCCE COc1ccc(N2CCN(C(=O)C(=O)N(C)[C@@H](C)CO)CC2)cc1F 1325243981 MNVMERDHQMCZSG-LBPRGKRZSA-N 353.394 0.322 10 10 FCCE C[C@@]1(O)CCCN(c2nnnn2Cc2ccc(N3CCOCC3)cc2)C1 1352233320 HPTJNDKQWAWFEF-GOSISDBHSA-N 358.446 0.909 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cn(C[C@H]2CNC(=O)O2)nn1 1354372047 UKUWDWCEFUDMGW-GFCCVEGCSA-N 372.385 0.492 10 10 FCCE NC(=O)NC1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 1455869748 XNUNKKFETBOLCP-UHFFFAOYSA-N 359.430 0.205 10 10 FCCE [N-]=[N+]=N[C@@H]1CCN(c2ccc3c(c2)C(=O)N([C@@H]2CCC(=O)NC2=O)C3=O)C1 2086865328 KNMSQFPTAKMIOX-NOZJJQNGSA-N 368.353 0.977 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2136334744 DMJSWOAOWRRERV-XQHKEYJVSA-N 369.422 0.876 10 10 FCCE CN(c1cc2c(cc1Br)[C@@H](O)C(=O)N2)C1CS(=O)(=O)C1 2152233510 IENWYACMJCCAGX-LLVKDONJSA-N 361.217 0.668 10 10 FCCE Cn1cc(/C=C\C(=O)N2CC[C@H](C(=O)O)c3ccccc32)c(=O)n(C)c1=O 841773220 GHGAROOPMWYGIO-DANTVBBOSA-N 369.377 0.702 10 10 FCCE CC(=O)NCc1ccc(CNC(=O)C(=O)NCCc2ccc(N)cc2)cc1 851688076 PXZBKBPTRZWOKT-UHFFFAOYSA-N 368.437 0.880 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)N1CCS(=O)(=O)C[C@H]1CCO 919081274 JNYMDAFZCJREAH-MRXNPFEDSA-N 369.487 0.752 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)NCc1ncc2c(n1)CCOC2 1332820463 WHFLQZYQHKIRPU-UHFFFAOYSA-N 356.382 0.530 10 10 FCCE Nc1ccc(N2C(=O)[C@H]3CS(=O)(=O)C[C@@H]3C2=O)cc1Br 1924755233 IIBCPZSWGCMBAD-YUMQZZPRSA-N 359.201 0.565 10 10 FCCE CN1C[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)N(C(=O)OC(C)(C)C)CC1=O 2060610304 GHQNMYQVNCVQOP-GHMZBOCLSA-N 352.395 0.975 10 10 FCCE O=C(NCCNS(=O)(=O)c1ccccc1)c1cc(O)c(O)c(O)c1 169911833 IXHDINDFHXTFGF-UHFFFAOYSA-N 352.368 0.512 10 10 FCCE CO[C@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1119815579 FJOLYBUUUMIOGJ-MSOLQXFVSA-N 374.485 0.690 10 10 FCCE CNC1CCN(C(=O)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 1261635852 QZNNDXDUWKFVBI-UHFFFAOYSA-N 374.485 0.474 10 10 FCCE NS(=O)(=O)c1ccc(F)c(CNC(=O)Cc2ccc(O)c(O)c2)c1 1300289917 IGZZTEJWAVIFFO-UHFFFAOYSA-N 354.359 0.743 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3cnn(C)c3OC)CC2)cc1 1325197037 MDRPOGIMIQBSIL-UHFFFAOYSA-N 373.457 0.989 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)N3CC(S(N)(=O)=O)C3)C2)cc1 1478860039 KNGDPZJGIXZEOB-GFCCVEGCSA-N 368.459 0.204 10 10 FCCE CNS(=O)(=O)c1cc(C(=O)NCc2cc(O)ccc2O)ccc1OC 1558174206 HJHRUTBQOLKUKI-UHFFFAOYSA-N 366.395 0.945 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](O)[C@H]1C(=O)NCC1(CN=[N+]=[N-])CC1 2127629232 HQYSTDIYKAGWTJ-SDDRHHMPSA-N 369.422 0.924 10 10 FCCE CONCCNC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2136246535 ZZALKFYCZDAMJZ-LBPRGKRZSA-N 369.418 0.801 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2218736571 ABZKFFOSWSEDPH-MJDLHHQISA-N 355.395 0.675 10 10 FCCE COc1ccc(N2CCN(CC(=O)NCC(=O)N3CCCC3)CC2)cc1 42289847 BLCCYWLNJLFZHW-UHFFFAOYSA-N 360.458 0.556 10 10 FCCE COc1ccc(N2CCN(C(=O)C3(C(=O)N4CCOCC4)CC3)CC2)cc1 243877792 RMVQIYUUSBHHTO-UHFFFAOYSA-N 373.453 0.983 10 10 FCCE COc1ccc(N2CCN(S(=O)(=O)[C@H](C)C(=O)N(C)C)CC2)cc1 278183851 HEESDBWVSUFJIO-CYBMUJFWSA-N 355.460 0.624 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C(=O)[C@@H]4C[C@H]4C3=O)CC2)cc1 758233781 WQTWVXCPFFQFGB-USXIJHARSA-N 359.426 0.183 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3C[C@H]4CC[C@@H]3O4)C2)cc1 829753787 QNUMJGXCYGFGMB-YYQUZTFQSA-N 359.426 0.826 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CCN=C4C3=NNN4C)C2)cc1 854981674 YOYQIIRVZPXQSO-CZUORRHYSA-N 370.457 0.862 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)c3ccc4c(c3)B(O)OC4)C2)cc1 863887042 SHKGRFMYRARXPT-OAHLLOKOSA-N 352.199 0.922 10 10 FCCE CO[C@@H]1CC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1119675857 KEXBEMPLYWXFGQ-IAGOWNOFSA-N 361.442 0.775 10 10 FCCE C[C@@H]1COCC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1323222184 GNVLVXCCUUYRSI-RHSMWYFYSA-N 361.442 0.681 10 10 FCCE CN(CCO)C(=O)c1ccc2c(c1NCCO)C(=O)c1ccccc1C2=O 4193992 IVDSWYDBMPMOAR-UHFFFAOYSA-N 368.389 0.931 10 10 FCCE COc1ccc(N2CCN(C(=O)Cn3ncn4cccc4c3=O)CC2)cc1 6780678 SDRIRYVXYXWWAC-UHFFFAOYSA-N 367.409 0.853 10 10 FCCE CC(=O)C(=O)COC(=O)CCCN(C)C1=NS(=O)(=O)c2ccccc21 808521481 SSECVLNTBCGWTN-UHFFFAOYSA-N 366.395 0.549 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)N1CCC2(COC2)C1 830620780 WRMSHBUUTZAOHA-UHFFFAOYSA-N 373.453 0.513 10 10 FCCE COc1ccc(N2CC[C@H](NC(=S)NCCS(C)(=O)=O)C2)cc1 849270295 AVQIRZIOFVKMDL-LBPRGKRZSA-N 357.501 0.783 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CCC3(CC2)C[C@@H](O)CNC3=O)cc1 913926849 OADJHJSYDXXLOX-MRXNPFEDSA-N 360.458 0.925 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCC(N2CC[C@@H](O)C2)CC1 1333366981 YUKVJBWIMHBKBZ-MRXNPFEDSA-N 361.442 0.408 10 10 FCCE CS(=O)(=O)C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1335585157 OYLOPRZXWMWCJE-UHFFFAOYSA-N 352.412 0.270 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1C[C@H]1C(=O)OC 1624659418 VEZFXQIONSGSFC-TUAOUCFPSA-N 351.355 0.497 10 10 FCCE C[C@H]1Cn2nnc(C(=O)NCc3ccc(N4CCOCC4)cc3)c2C(=O)N1 1857518601 JGIHKKKXLFTAPA-LBPRGKRZSA-N 370.413 0.177 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NOCC(N)=O 2136239799 FDGBIAKJYSIREO-JTQLQIEISA-N 369.374 0.067 10 10 FCCE Cn1nnc(Br)c1S(=O)(=O)NCc1cc(N)ccc1O 236093302 ARYBAVULOIACNI-UHFFFAOYSA-N 362.209 0.344 10 10 FCCE Cn1cc(NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)c(=O)n(C)c1=O 255636178 WQTWERHLSRCNQC-YVMONPNESA-N 370.409 0.573 10 10 FCCE COC(=O)CN(C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O)c1ccccc1 736221567 SSHGJGDYGCDHOD-MDZDMXLPSA-N 357.366 0.303 10 10 FCCE CCn1ncc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 815073978 DPGIEGVBDXEUPG-AWEZNQCLSA-N 356.430 0.930 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCNC2=O)cc1F 827986569 PVCHRYLRALSDLA-ZDUSSCGKSA-N 350.394 0.293 10 10 FCCE CO[C@H]1CC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1119675858 KEXBEMPLYWXFGQ-IRXDYDNUSA-N 361.442 0.775 10 10 FCCE COc1ccc(CNC/C=C\CNC(=O)[C@H]2CC[C@@H](C(N)=O)O2)cc1C 1497672964 BPZMNWGYFPXEPB-OPCNFVSTSA-N 361.442 0.799 10 10 FCCE COCc1noc(CN2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)n1 1625361979 ASLZKAFETFOTMW-UHFFFAOYSA-N 362.386 0.514 10 10 FCCE CCOCc1nnc(N(C)Cc2ccccc2O)n1Cc1nnn(C)n1 1696250026 DEWATIYZIQOCNQ-UHFFFAOYSA-N 358.406 0.728 10 10 FCCE O=C1NC(=S)N(c2ccccc2F)C(=O)C1=CNN1CCOCC1 2296215361 KNCGMBJHRAANDO-UHFFFAOYSA-N 350.375 0.294 10 10 FCCE CC(=O)O[C@@H]1[C@H](OCCN=[N+]=[N-])O[C@@H](C)[C@@H](OC(C)=O)[C@H]1OC(C)=O 36453275 SWFHDHBVUMLTMW-AJVHJNHVSA-N 359.335 0.853 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)Cn3cn[nH]c3=O)cc2F)CC1 153058807 MYEHUZTWXVPXRA-UHFFFAOYSA-N 362.409 0.169 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNCc3noc(C)n3)CC2)cc1 819073115 BOLUPMIRKSYUJN-INIZCTEOSA-N 361.446 0.659 10 10 FCCE COc1ccc(N(CC(=O)O)CC(=O)NCC[C@]2(O)CCOC2)cc1 853010689 JQBREGMSCBXPBZ-KRWDZBQOSA-N 352.387 0.244 10 10 FCCE CN1C2(CCC2)COC[C@@]1(CO)CNC(=O)/C=C\c1ccc(O)c(O)c1 862641931 DWURXAGZSUXDFC-UTSMFGRCSA-N 362.426 0.843 10 10 FCCE Cn1c(-c2sc3ncccc3c2O)nnc1N1CCO[C@H](C(N)=O)C1 1263606542 SCVNGHYSQRHWIX-VIFPVBQESA-N 360.399 0.488 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1C[C@H]2COC[C@@H](C1)O2 1325072403 RZMFGWMFFJPXLX-CALCHBBNSA-N 361.442 0.727 10 10 FCCE COC(=O)CCCNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1330821301 LDLDNCQDTKNXDQ-ZDUSSCGKSA-N 363.414 0.460 10 10 FCCE COc1ccc(N2CCN(C(=O)CCCn3c(O)nnc3O)CC2)cc1 1594800128 SCXDRXYMKBSUDW-UHFFFAOYSA-N 361.402 0.827 10 10 FCCE Cn1cc(/C=C/C(=O)NCc2ccc3cccnc3c2O)c(=O)n(C)c1=O 1638572935 BHXJJMPHSNSGCE-BQYQJAHWSA-N 366.377 0.667 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@H]1C(=O)NCc1ccc(N)cc1 2332901273 AJJIHISVEBMECL-QLFBSQMISA-N 365.430 0.616 10 10 FCCE CC1(C)O[C@H]2[C@@H](CO[C@@]3(COS(=O)(=O)N=[N+]=[N-])OC(C)(C)O[C@H]23)O1 28001606 ULLWHTAOFMDWSA-SREGZZRCSA-N 365.364 0.956 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCC[C@@H](N4CCNC4=O)C3)cc2N1 360485020 SOEVTCZQLGSBQZ-SNVBAGLBSA-N 361.358 0.920 10 10 FCCE CCN(CC(=O)OC)C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1 754030218 MXQPOCVQWLBTHU-KRWDZBQOSA-N 365.474 0.673 10 10 FCCE COCCS(=O)(=O)CC(=O)NCc1cc(Br)ccc1O 804739427 GAAXILQUQXSEOA-UHFFFAOYSA-N 366.233 0.832 10 10 FCCE COc1ccc(N2CCN(C(=O)Cn3nnn(C4CC4)c3=O)CC2)cc1 809976070 FUAJQBIEYYTSOJ-UHFFFAOYSA-N 358.402 0.132 10 10 FCCE COC[C@H](OC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 824285356 GJXLCTQHNSNMIN-KRWDZBQOSA-N 351.447 0.595 10 10 FCCE CCOC(=O)CN1C(=O)/C(=C/c2cn(CC(=O)OC)nn2)c2ccccc21 834430159 HXUPMODVIURHHM-RIYZIHGNSA-N 370.365 0.901 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2CNCC[C@@H]2C)cc1 846343764 OJNQBCFQSKSRPS-YOEHRIQHSA-N 362.474 0.704 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@](O)(C(F)F)C2)c1 857524449 JLNURHDYWOFGMB-CYBMUJFWSA-N 350.343 0.606 10 10 FCCE COc1ccc(N2CCN(C(=O)NC[C@H]3COCCN3C)CC2)cc1F 858840805 JSBSCNSAJWBFBE-HNNXBMFYSA-N 366.437 0.997 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)c3c(N)cnn3C)cc2)CC1 1122060924 DNXNTCNNXMAAEE-UHFFFAOYSA-N 356.430 0.601 10 10 FCCE Cc1nccnc1N1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1351847810 ZTUJOVZFODHVGC-UHFFFAOYSA-N 367.409 0.682 10 10 FCCE CN1C[C@@H]2[C@@H](CC[C@H]2NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1529330068 XXEGSYUEKNWDBN-ZLKJLUDKSA-N 353.444 0.834 10 10 FCCE NS(=O)(=O)c1ccc(CCC(=O)NCc2c(O)cccc2O)cc1 1635843543 WVKJXNMKHCFIJK-UHFFFAOYSA-N 350.396 0.994 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 1637266320 SNBQZBKGOPXYBR-LRDDRELGSA-N 355.412 0.493 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)C=Cc1cn(C)c(=O)n(C)c1=O 2297711920 JAYOJVPEFUTDOC-UHFFFAOYSA-N 370.409 0.589 10 10 FCCE COC(=O)[C@@H]1C[C@@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 727308841 VYSAESZULVKURI-CWRNSKLLSA-N 359.426 0.814 10 10 FCCE CNC(=O)[C@H]1CCN(C(=O)C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)C1 817764197 QQWCYWGWDDAKOP-HNNXBMFYSA-N 372.469 0.838 10 10 FCCE C[C@@H](O)[C@@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCO1 817811310 HJNPGGQQWRTVEV-DYVFJYSZSA-N 361.442 0.293 10 10 FCCE COc1cc(Br)cc(CN2CCN(CC(N)=O)C(=O)C2)c1O 839170635 QIFAQKPVWMRTIS-UHFFFAOYSA-N 372.219 0.293 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CN3C(=O)NC(=O)C3(C)C)C2)cc1 855231770 NUFBRWYYUBINKL-LBPRGKRZSA-N 360.414 0.721 10 10 FCCE COC1CCN(c2ccc(CN3C[C@@H](C(N)=O)[C@H](C(N)=O)C3)cc2)CC1 1196091804 CGNWNZFDIARKTF-IAGOWNOFSA-N 360.458 0.320 10 10 FCCE CC(C)[C@H](N)CCNC(=O)C(=O)C(=O)C(=O)NC[C@@H]1C[C@H]2C=C[C@H]1CC2 1347085845 MMZMBOGRDOXGAV-ZQDZILKHSA-N 363.458 0.333 10 10 FCCE NC(=O)C[C@@H](NC(=O)c1ccccc1F)C(=O)NCc1ccccc1O 1445973069 VDVVYSVLHGTZPE-CQSZACIVSA-N 359.357 0.822 10 10 FCCE CS(=O)(=O)N[C@@H]1CCCC[C@H]1CNC(=O)Cc1ccc(O)c(O)c1 1640371606 ZLHMSIWGINXNMW-QWHCGFSZSA-N 356.444 0.865 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@@H]1C[C@H]1CN 2136240475 MPJAHAQQLFAMRM-XQQFMLRXSA-N 365.430 0.997 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)C3=NNC(=O)C3)CC2)cc1 731893428 KLBPJERPTCRMKY-UHFFFAOYSA-N 359.430 0.199 10 10 FCCE CN(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1CCOC1 820993240 VEKYGAAAYMATPP-MRXNPFEDSA-N 367.471 0.852 10 10 FCCE CNC1CCN(C(=O)C(=O)N(C)CCN(C)c2ccc(OC)cc2)CC1 1118332045 BMACNUYLPZQUKT-UHFFFAOYSA-N 362.474 0.800 10 10 FCCE COC(=O)/C=C\c1ccc(N2C[C@H](O)C[C@@H]2C(=O)OC)c([N+](=O)[O-])c1 1651347585 CYZWSANTZGZEGM-CAMLPZEUSA-N 350.327 0.894 10 10 FCCE COc1ccc(Br)c(CN[C@@H]2CS(=O)(=O)C[C@H]2O)c1O 2236055863 SADKLOYUQZJKPF-NXEZZACHSA-N 366.233 0.411 10 10 FCCE COc1ccc(OC)c(N2C(=O)NC(=O)C(=CNCCN(C)C)C2=O)c1 2296223419 ONSNGYYZENWDQI-UHFFFAOYSA-N 362.386 0.322 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCn3ccnc3C)C2)cc1 827674874 WNAHPBBDJZVMHZ-OAHLLOKOSA-N 371.441 0.711 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)Cn3nc4n(c3=O)CCCC4)C2)cc1 855227608 YRNQSEJNVHQLDZ-CQSZACIVSA-N 371.441 0.785 10 10 FCCE CNCCOCCNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 861676285 BCUUAEJDLZYBFR-UHFFFAOYSA-N 350.463 0.901 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NCC2(N)CCOCC2)cc1F 861751174 ZFOZERIPBLBSQH-UHFFFAOYSA-N 352.410 0.132 10 10 FCCE CN1CCN(C)CC(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 906317993 VGZVBWNOQXYKSY-UHFFFAOYSA-N 364.465 0.772 10 10 FCCE O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NCc1ccc(O)cc1O 1639444751 YGEMUVNMGDLKQC-RRCSTGOVSA-N 360.366 0.267 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1 1640958379 MCPRCGCTROFSBW-AYRXBEOTSA-N 350.396 0.789 10 10 FCCE CN(C(=O)OC(C)(C)C)C1(C(N)=O)CN(C(=O)c2cccc(O)c2O)C1 2118162060 FSEFBCJFGBEFPJ-UHFFFAOYSA-N 365.386 0.645 10 10 FCCE CS(=O)(=O)NCC1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 287056934 SEQNSIQTINOCHR-HWKANZROSA-N 354.428 0.899 10 10 FCCE Cn1nnnc1CCNC(=O)NCc1ccc(N2CCSCC2)cc1 771936350 CGOMKMKUSOFKQF-UHFFFAOYSA-N 361.475 0.805 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C3CN([C@@H]4CCOC4)C3)cc2)CC1 899212162 QKZZNRVZEPJVIT-LJQANCHMSA-N 358.486 0.775 10 10 FCCE COc1cc(C)cc(CN2CCN(CC(=O)N3CCOCC3)CC2)c1O 918067029 VSDWBDLLEACGEI-UHFFFAOYSA-N 363.458 0.686 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@H](c3ncon3)C2)c1 1154811725 JIKLPFNABJYERY-SECBINFHSA-N 352.372 0.776 10 10 FCCE Cn1cc([C@@H](O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cn1 1291872052 RHASTLVTMCPFRJ-WMLDXEAASA-N 371.441 0.472 10 10 FCCE COC[C@@](C)(CC(=O)OC)NCC(=O)NCc1ccc(N(C)C)cc1 1652772633 IHRIINNNAJGCCL-GOSISDBHSA-N 351.447 0.927 10 10 FCCE CN1CCN(C(=O)c2cccc(O)c2O)[C@@H](CNC(=O)C(F)(F)F)C1 2118184720 NXGSZIHDHUSHBD-VIFPVBQESA-N 361.320 0.533 10 10 FCCE CC(=O)C(=O)COC(=O)CCNS(=O)(=O)c1ccc2c(c1)CCCC2 808495504 RMKYRCPSIVRVGQ-UHFFFAOYSA-N 367.423 0.935 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCO[C@@H]([C@@H](C)O)C1 840976644 DEVSEWIASPZTSE-RHSMWYFYSA-N 363.458 0.709 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@]3(CN)CCCOC3)cc2)CC1 876910410 ZAVLASJFATXNDY-HXUWFJFHSA-N 374.485 0.727 10 10 FCCE CN1C[C@@H](O)C[C@@]1(C)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 900754504 JYZBETVXHFHNIK-ICSRJNTNSA-N 361.486 0.967 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCN(CCN3CCOCC3)C2)cc1 1136743455 RUZQSDRMJWJRIP-INIZCTEOSA-N 374.445 0.985 10 10 FCCE Cc1nc(S(=O)(=O)NCCC(=O)N[C@H](C)c2ccccc2O)cn1C 1302530461 QIYHTOUOBHLWLL-LLVKDONJSA-N 366.443 0.980 10 10 FCCE COC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCCOC1 1303725609 PBTKUNHCKWWFCT-SMDDNHRTSA-N 372.443 0.935 10 10 FCCE C[C@H](NC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1ccccc1O 1471194996 RTZAYJQHWBKJPH-YNEHKIRRSA-N 366.439 0.605 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)C1(O)CCOCC1 1556946658 UAFKWKHDQPMCKD-UHFFFAOYSA-N 356.369 0.959 10 10 FCCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC[C@H](N=[N+]=[N-])C2)CCS(=O)(=O)C1 2060637073 GIOLUTNJTFPSLT-HZMBPMFUSA-N 373.435 0.980 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2077107258 PCFIHUZCOXUHRF-WDEREUQCSA-N 373.435 0.932 10 10 FCCE CN1CCN(C(=O)Cc2ccc(N)cc2)[C@@H](CNC(=O)C(F)(F)F)C1 2106719984 UPKJQJUWUUKDRI-ZDUSSCGKSA-N 358.364 0.632 10 10 FCCE CN(Cc1ccc(N)cc1)S(=O)(=O)c1c(Br)nnn1C 234303967 NGMOYCWFOKPKPY-UHFFFAOYSA-N 360.237 0.981 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H]2CCC(=O)N(C)C2)cc1 283985305 JIGLFABPLRHLFQ-OAHLLOKOSA-N 360.458 0.886 10 10 FCCE COc1cccc(CN2CCN(S(=O)(=O)N3CCOCC3)CC2)c1O 768265402 ZDOVCXQRBRJRLN-UHFFFAOYSA-N 371.459 0.095 10 10 FCCE CC(=O)C(=O)COC(=O)CNC(=O)[C@H]1c2ccccc2C(=O)N1C1CC1 808510453 UCBXEQBFJNURTA-MRXNPFEDSA-N 358.350 0.163 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc2c(c1)COB2O 863871563 SLIZVEZQZHWGPX-UHFFFAOYSA-N 352.199 0.671 10 10 FCCE C[C@H]1C(=O)N(C)[C@H](C)[C@@H](C)N1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1163828598 NSSPOQNBCDTIHZ-MXWKQRLJSA-N 369.443 0.843 10 10 FCCE COCc1ncc2c(n1)CCN(C(=O)C(=O)N(C)Cc1ccccc1O)C2 1351930582 DQQXQEADXHISCZ-UHFFFAOYSA-N 370.409 0.872 10 10 FCCE Cc1cc(C(=O)N2C[C@@H](C(N)=O)[C@H](C(N)=O)C2)c(C)n1-c1ccccn1 1630581287 RFOIIDPRNVDGEC-ZIAGYGMSSA-N 355.398 0.148 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@H]1C(=O)OCC 1633472754 FTYIGHULVPTAGF-UPJWGTAASA-N 365.382 0.887 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](CC)NC(C)=O 1638030569 OYPFWMSKIGBZAG-OLZOCXBDSA-N 352.387 0.603 10 10 FCCE COc1ccc(N2CCN(C(=O)CNC(=O)C3CCN(C)CC3)CC2)cc1 1861965443 MERIZQHTFSZELG-UHFFFAOYSA-N 374.485 0.802 10 10 FCCE CNCc1ccc(N2CC3(CNS(=O)(=O)C3)C2)c(Br)c1 2176159035 ABRCCSRTTNSUHD-UHFFFAOYSA-N 360.277 0.908 10 10 FCCE C[C@@H](NC(=O)C(CO)(CO)NC(=O)OC(C)(C)C)c1ccccc1O 2320983526 JBKLTLZWCQFCES-LLVKDONJSA-N 354.403 0.818 10 10 FCCE COc1cccc(CNC[C@H]2[C@@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c1O 2333604416 CBESSPBYVZWKII-HEHGZKQESA-N 368.430 0.832 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC2(CCO)CCOCC2)c1 765634498 FRJJOCDWXLPONQ-UHFFFAOYSA-N 358.416 0.425 10 10 FCCE COc1ccc(N2CCN(C(=O)C[C@H](C)NC(N)=O)CC2)c(OC)c1 870166492 PRJBKHPFAIQPHI-LBPRGKRZSA-N 350.419 0.799 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)C3(O)CCOCC3)CC2)cc1F 929820228 BHFCUASEYBYGGO-QGZVFWFLSA-N 354.422 0.859 10 10 FCCE CN1CCN(c2ccc(CN3CC[C@@H](NS(C)(=O)=O)C3)cc2F)CC1 1116444022 OANHVUPPZSSIKK-OAHLLOKOSA-N 370.494 0.701 10 10 FCCE CCN(OC)C(=O)CNC(=O)C(=O)NCc1ccc(N(CC)CC)cc1 1118210734 MGCTYODHBIYEJB-UHFFFAOYSA-N 364.446 0.675 10 10 FCCE O=C(C(=O)N1CC[C@H](Nc2ncccn2)C1)N1Cc2cccc(O)c2C1 1351918715 HHMBFDYWEZEDJD-ZDUSSCGKSA-N 353.382 0.737 10 10 FCCE C[C@@H](NC(=O)CCc1nc2c(O)nc(=O)n(C)c2[nH]1)c1ccccc1O 1471195354 FDSCFULIAWGDAD-SECBINFHSA-N 357.370 0.878 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)CN3CCCNC3=O)cc2)CC1 1652068334 MFNBBGIWEAFIFI-UHFFFAOYSA-N 373.457 0.420 10 10 FCCE Oc1ccccc1N=c1nc(N2CCOCC2)[nH]c(N2CCOCC2)n1 1871730218 MLKWAHFLESWLJK-UHFFFAOYSA-N 358.402 0.416 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C[C@@H]4CN(C)C[C@H]4C3)CC2)cc1 2320380078 HWKBODUYAVRZIQ-IRXDYDNUSA-N 358.486 0.837 10 10 FCCE Cc1ccc(CNS(=O)(=O)N2CC(CN)C2)c(O)c1Br 2381132960 IDXVREPMAVZNSF-UHFFFAOYSA-N 364.265 0.688 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3CCO[C@]4(CCOC4)C3)ccc21 285660673 HQGBORYHVOVNFI-HXUWFJFHSA-N 373.453 0.703 10 10 FCCE Cn1cc(/C=C/C(=O)N2CCN3CCOc4cccc2c43)c(=O)n(C)c1=O 371432073 ITYHCLGGLBFEFB-VOTSOKGWSA-N 368.393 0.343 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1CCN(C)S1(=O)=O 843757972 HVLGSRSAWASCIJ-INIZCTEOSA-N 367.471 0.516 10 10 FCCE O=S(=O)(c1cc[nH]n1)N1CCN(Cc2ccc(F)c(F)c2O)CC1 894979671 XLRZNWKBUMPXDJ-UHFFFAOYSA-N 358.370 0.900 10 10 FCCE C[C@@H]1C[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1257232477 MYBXANXJKCLVPD-VNQPRFMTSA-N 372.469 0.777 10 10 FCCE COc1cccc(CNC(=O)CNS(=O)(=O)c2ccccc2N)c1O 1465991848 GNBJLVJHRJWNDP-UHFFFAOYSA-N 365.411 0.578 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)/C=C/Cn3cncn3)cc2)C1 1544929607 INWUHIALAOABRC-WPTTZPOMSA-N 368.441 0.852 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@H](N=[N+]=[N-])C2)[C@H](O)C1 2076819569 DFHCKJXVVDDFSS-FIXISWKDSA-N 355.395 0.630 10 10 FCCE CN(Cc1ccc(N)cc1)C(=O)[C@@H]1[C@@H](O)[C@H](O)CN1C(=O)OC(C)(C)C 2136173215 QIKMPSHRSBFKNC-ILXRZTDVSA-N 365.430 0.568 10 10 FCCE COC(=O)/C=C/c1ccc(N2CCN(C(=O)[C@H](C)O)CC2)c([N+](=O)[O-])c1 270787007 KXTZFQNCTZGTRM-FUEXJSSKSA-N 363.370 0.810 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C3(C(N)=O)CCC3)CC2)cc1 747907411 HNMWGLCCGMXTEA-UHFFFAOYSA-N 360.458 0.589 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NCc3cn(C)nn3)CC2)cc1 782999559 OYJZOAUMSKWYNA-UHFFFAOYSA-N 373.461 0.445 10 10 FCCE O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1ccc2c(c1)OCCNC2 861498252 IJSOXQFOPWGSBN-UHFFFAOYSA-N 371.393 0.877 10 10 FCCE COc1ccc(N2CC[C@@H](CNS(=O)(=O)C[C@H]3CNCCO3)C2)cc1 866773826 KEOYYOPCTINDKI-WMLDXEAASA-N 369.487 0.429 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCC(Cn2cnnc2)CC1 1327336471 HAQJFTZGIUBJMA-UHFFFAOYSA-N 357.414 0.881 10 10 FCCE CNC(=O)CCN(C)c1nnnn1Cc1ccc(N2CCOCC2)cc1 1355493105 HQIHQOPHLGXYHW-UHFFFAOYSA-N 359.434 0.130 10 10 FCCE CCN(CC)c1ccc(CNC(=O)[C@H](C)NC(=O)Cn2cnnn2)cc1 1464291364 DGXCDRKEYXMCCP-ZDUSSCGKSA-N 359.434 0.340 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3CC[C@@H](C(N)=O)C3)cc2)CC1 1584506913 IRUVMKZAHXTPNE-CVEARBPZSA-N 372.469 0.906 10 10 FCCE O=C(CN1C(=O)[C@H]2C[C@H]2C1=O)NCc1ccc(N2CCOCC2)c(F)c1 760369414 AFORNUGZQMPCQI-BETUJISGSA-N 361.373 0.283 10 10 FCCE CNC(=O)[C@@H]1CCN(C(=O)C(=O)NCCCSc2nccs2)C1 817822161 AQEQEFZKIFFRGG-SNVBAGLBSA-N 356.473 0.336 10 10 FCCE CN(C)S(=O)(=O)N1CC(NCc2cc(Br)ccc2O)C1 858311309 DRJIKJXGLOOZEB-UHFFFAOYSA-N 364.265 0.735 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@@]2(CNC(=O)C2)C1 1323280167 SWJWPMPKVFRYLG-LJQANCHMSA-N 358.442 0.416 10 10 FCCE NS(=O)(=O)c1ccc(NC(=O)CCN2C(=O)CSC2=S)cc1 1865768312 JZQFPRRHWRINPI-UHFFFAOYSA-N 359.454 0.523 10 10 FCCE O=C1c2cc3c(c(O)c2C(=O)c2c(O)ccc(O)c21)[C@]1(O)C[C@H](O)O[C@@H]1O3 4098667 FBPGRTYADYGYRG-AHBCHLHISA-N 372.285 0.224 10 10 FCCE biogenic,in-vitro CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@@H](O)CN2CCCCC2)c1 271403093 MXBIRRBLGVGMEC-CYBMUJFWSA-N 371.459 0.340 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NCC(=O)N(C)C)CC2)cc1 299324002 DRXFINISJCPCNB-UHFFFAOYSA-N 363.462 0.205 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)[C@@H]3CCCNC3)C2)cc1 851688034 OYILWDXGIDAMKG-OAGGEKHMSA-N 374.485 0.894 10 10 FCCE O[C@@H](CNCc1ccc(N2CCOCC2)cc1)CC1(O)CCOCC1 872199535 PINFTFOAPNDBOC-GOSISDBHSA-N 350.459 0.905 10 10 FCCE C[C@@H](NC(=O)c1cn(C[C@@H]2CNC(=O)O2)nn1)c1ccc(N(C)C)cc1 1128247198 OBUMUIRVHPVVET-RISCZKNCSA-N 358.402 0.944 10 10 FCCE Cc1noc(CCNC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)n1 1321996335 DLZGUZCYOAFKOH-UHFFFAOYSA-N 357.414 0.736 10 10 FCCE Cc1nc(O)c2c(n1)CN(C(=O)c1cc(NS(C)(=O)=O)ccc1O)C2 1454286043 PTCRQZAAJZIAIT-UHFFFAOYSA-N 364.383 0.724 10 10 FCCE C[C@@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCNC(=O)C1 1534541344 WTXZLEMRPNKVEO-MGPUTAFESA-N 372.469 0.921 10 10 FCCE C[C@H](NCC(CO)(CO)NC(=O)OC(C)(C)C)c1cc(O)ccc1O 2258308917 OGCZKHOMANWBCV-NSHDSACASA-N 356.419 0.997 10 10 FCCE CC(=O)OC[C@@H]1O[C@@H](OC(C)=O)[C@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@H]1OC(C)=O 88284888 QKGHBQJLEHAMKJ-MEBFFEOJSA-N 373.318 0.380 10 10 FCCE in-vitro N[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(F)(F)F 827394943 HDKZTKZBUBMERR-LBPRGKRZSA-N 365.377 0.427 10 10 FCCE CN(C)c1ccc(/C=C\CNCCN2CCN(S(C)(=O)=O)CC2)cc1 835036710 DYABFNFJOYOKPC-PLNGDYQASA-N 366.531 0.933 10 10 FCCE COCCOCCS(=O)(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 849416822 XESQIXODTUWKMB-AWEZNQCLSA-N 358.460 0.856 10 10 FCCE O=C(COCC(F)F)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 858641308 AAPNOWZMHOJIEO-UHFFFAOYSA-N 362.398 0.819 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CC[C@@H](C)NC3)C2)cc1 861804516 QYQVMAHYIBTJMS-KFWWJZLASA-N 360.458 0.647 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1C[C@H]2C[C@@]2(CO)C1 1118052185 FDRZYHZNCSCXCJ-NBQZKYEYSA-N 359.470 0.949 10 10 FCCE CN1CCN(c2ccc(CNC[C@@H](O)CS(C)(=O)=O)cc2F)CC1 1262194616 YABHEAUPYRLSJA-CQSZACIVSA-N 359.467 0.073 10 10 FCCE COC[C@@H]1C[C@@H](O)CN1C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 1329795410 UTYIIELGZKTKFC-DLBZAZTESA-N 361.442 0.511 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC3=C(CCC(=O)N3)C2)cc1F 1334030234 JIBDVAYUDFTXLN-UHFFFAOYSA-N 374.416 0.904 10 10 FCCE NC(=O)C[C@H](NC(=O)c1ccccc1F)C(=O)NCc1ccccc1O 1445973063 VDVVYSVLHGTZPE-AWEZNQCLSA-N 359.357 0.822 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNC(=O)Nc1ccc(N)cc1 2333604566 HBIXHBVOBUAQIX-MJBXVCDLSA-N 366.418 0.731 10 10 FCCE C[C@@H](O)[C@H]1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 817811736 PNYRGDRHJPCKHI-IAQYHMDHSA-N 353.394 0.116 10 10 FCCE CCCN1CC[C@@H](NC(=O)C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)C1 830454327 HSGFDGHXBCCHCI-CVEARBPZSA-N 374.485 0.991 10 10 FCCE CCC[C@@H](C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)S(N)(=O)=O 855223521 BCUPCZRQGWCNQK-DOMZBBRYSA-N 355.460 0.847 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@]2(O)C[C@H]3C=C[C@H]2C3)c1 855751596 NXFSVANXJDSFAI-XMZIXOGTSA-N 352.412 0.821 10 10 FCCE C[C@H](C(=O)NCc1c(O)cccc1F)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 928706551 WVEBWGPQWNJAPN-QWPVENPASA-N 362.357 0.698 10 10 FCCE [N-]=[N+]=N[C@@H]1CCN(c2ccc3c(c2)C(=O)N([C@H]2CCC(=O)NC2=O)C3=O)C1 2086865329 KNMSQFPTAKMIOX-RNCFNFMXSA-N 368.353 0.977 10 10 FCCE CC(=O)C(=O)COC(=O)CCNS(=O)(=O)c1cccc(C(C)=O)c1 808495186 IJGVNWNGXUVFDF-UHFFFAOYSA-N 355.368 0.259 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCCn3ccnc3)C2)cc1 826604628 RDTBIJJPKJDHHR-HNNXBMFYSA-N 371.441 0.793 10 10 FCCE CCS(=O)(=O)N[C@H](C)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 855223922 CWEOFEXTBUSHOT-CHWSQXEVSA-N 355.460 0.718 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)CCn3cnnn3)cc2)CC1 1133629462 CCLQDCZAQNXKHD-UHFFFAOYSA-N 357.418 0.081 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)S(C)(=O)=O 1623927992 AAGIRAMWHULICW-VIFPVBQESA-N 363.819 0.980 10 10 FCCE Cn1ccc(CNC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n1 805700326 BBIWMSZJDQHCSE-INIZCTEOSA-N 372.425 0.950 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1CCN2CCOC[C@H]2C1 806281629 FAOHAVLGICAHOR-GFCCVEGCSA-N 370.500 0.285 10 10 FCCE COC(=O)CCN(C)S(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849415974 JAQPICQGKWIWSH-CYBMUJFWSA-N 371.459 0.603 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@H](CC(N)=O)C1 859319756 SOYRJOKJAWNRLG-CQSZACIVSA-N 363.414 0.234 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H](O)CC(F)(F)C2)cc1F 1321935248 OFSNJUNMUVTPFW-LLVKDONJSA-N 359.348 0.736 10 10 FCCE N[C@H]1CCO[C@@H](C2CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)C1 1329504602 NJAXXGBQNGWTSR-MAUKXSAKSA-N 373.453 0.979 10 10 FCCE CC[C@H](NC(C)=O)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1535156665 LYAPRHRABKRDDT-KRWDZBQOSA-N 360.458 0.919 10 10 FCCE CCO[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)CN(C)C 1645024809 SLCPTAVMOXIMKF-GFCCVEGCSA-N 359.448 0.460 10 10 FCCE CC(C)(C)OC(=O)NCC(CO)(CO)NC(=O)Cc1ccc(O)c(O)c1 2265770330 LGMWUSHXHABPPG-UHFFFAOYSA-N 370.402 0.005 10 10 FCCE C[C@H](CO)[C@@H](C)NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 295686978 HVLJUDCNHBUTHB-ZIAGYGMSSA-N 353.438 0.885 10 10 FCCE CN1CCC[C@H](NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1 830628997 ZHFATRYSEQZNEJ-INIZCTEOSA-N 374.485 0.474 10 10 FCCE COc1ccc(N2CCCN(C(=O)[C@@H]3CCN(C)S3(=O)=O)CC2)cc1 843533279 GSBWWMADTHXPJY-INIZCTEOSA-N 367.471 0.768 10 10 FCCE Cc1nc([C@@H]2COCCN2C(=O)C(=O)NCc2ccc(N(C)C)cc2)no1 1116975716 DCZOKSZYRWJDMC-HNNXBMFYSA-N 373.413 0.660 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)Cc3nnc(N)s3)cc2)CC1 1155604241 RFFSJIJJHDQDHA-UHFFFAOYSA-N 374.470 0.681 10 10 FCCE COC(=O)[C@@]1(N2CCN(C(=O)c3cccc(O)c3O)CC2)CCOC1 1261828536 NJENQUIFFGWARK-QGZVFWFLSA-N 350.371 0.188 10 10 FCCE CCn1nncc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1288913390 UTRSJYKWWIYZTA-UHFFFAOYSA-N 356.430 0.930 10 10 FCCE CS(=O)(=O)CCc1noc(-c2cc(NS(C)(=O)=O)ccc2O)n1 1339292349 AOKXFXJHUAIQBI-UHFFFAOYSA-N 361.401 0.401 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@H]3CCN=C4C3=NNN4C)CC2)cc1F 829869213 KTUYHCGSVAQKLI-ZDUSSCGKSA-N 374.420 0.707 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@H]2CC[C@H](C)NC2)cc1 861804848 UGSCXWLDEITLME-GJZGRUSLSA-N 362.474 0.847 10 10 FCCE CCN1CCN(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c2ccccc21 1318694845 RGEJFHCZFRGPTB-MDZDMXLPSA-N 354.410 0.970 10 10 FCCE C[C@@H](Cn1cncn1)NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 284365672 ZQAZREMWVAXNCK-AWEZNQCLSA-N 356.430 0.699 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H](C(N)=O)CC[C@H]3C)nc12 729266967 UOPBGNGFTKQGRM-GHMZBOCLSA-N 361.402 0.697 10 10 FCCE CO[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCOC1 827575003 LTMHJSUPDSWJRK-CZUORRHYSA-N 367.421 0.676 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2C[C@@H](N(C)C)C2)cc1F 848932590 SHYCGZGHHFKFLL-OKILXGFUSA-N 350.438 0.964 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)c1 856465380 ZGWLBOSTXMFQLS-WDMOLILDSA-N 354.428 0.997 10 10 FCCE Nc1nonc1N=NN(CC(=O)NC1CCCCC1)c1nonc1N 1084263876 AWDIVMNJYNYSOZ-UHFFFAOYSA-N 350.343 0.571 10 10 FCCE O=C(CC[C@@H]1NC(=O)NC1=O)NCc1ccc(N2CCC(O)CC2)cc1 1148701044 LDMJGAIPLXHQOV-HNNXBMFYSA-N 360.414 0.252 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN(C)C3CCS(=O)CC3)nc12 1191601151 MGEMHMZOJJFZTN-UHFFFAOYSA-N 366.443 0.955 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)Cn3ncn4nccc4c3=O)C2)cc1 1328437405 FDFWBHFZHIMXPQ-CYBMUJFWSA-N 368.397 0.295 10 10 FCCE C[C@@H](NC(=O)[C@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C)c1ccccc1O 2332888872 JSQBTKVTBHOFJU-KAOXEZKKSA-N 366.414 0.911 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3ccnc(C)n3)C2)cc1 827352950 UPMISJRJSCPWTE-OAHLLOKOSA-N 369.425 0.805 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCCn3ccnn3)C2)cc1 828413805 WUYLSGINUXUGEC-CQSZACIVSA-N 372.429 0.188 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@]3(C)C[C@@H](O)CN3C)CC2)cc1F 900999417 SMRYEVIWFNFRNL-RDTXWAMCSA-N 351.422 0.938 10 10 FCCE COc1cc(C(=O)N[C@H](C)CN(C)C(=O)[C@@]23COC[C@@H]2C3)cc(OC)n1 1487799367 SPVQRGHUXTTZJM-YNKQFZHNSA-N 363.414 0.712 10 10 FCCE C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CN(C)CCN1C 1544138996 IJQYJTLJGJFZRX-FZMZJTMJSA-N 370.475 0.128 10 10 FCCE CN(C)c1ccc([C@@H](NC(=O)CC[C@H](N)C(O)O)c2nccn2C)cc1 1865960368 URVCQDVWXBWOQZ-GOEBONIOSA-N 361.446 0.110 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](CNC(=O)COc2ccc(N)cc2)[C@@H](O)C1 2106246340 BMJDMOXEVYSEHN-WFASDCNBSA-N 365.430 0.992 10 10 FCCE CC(C)(C)OC(=O)NCC(F)(F)C(F)(F)COc1nnc(=N)[nH]n1 2299907604 VEMOUBDICADQQJ-UHFFFAOYSA-N 356.280 0.853 10 10 FCCE C[C@@H](Cn1cncn1)NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 285853082 APYZOZMLCUXGMA-AWEZNQCLSA-N 354.414 0.475 10 10 FCCE COC[C@@]1(C)CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 859276536 ICOKEBCWFJULPI-LJQANCHMSA-N 363.458 0.975 10 10 FCCE CCOCc1cc(CNC[C@]23COCCN2C(=O)COC3)ccc1OC 865800088 GFRXJMPBFHZEQY-LJQANCHMSA-N 364.442 0.949 10 10 FCCE COc1ccc(CNC[C@]2(CO)COCCN2C)cc1Cn1cccn1 922533077 KTUGGDDFEOWJDT-IBGZPJMESA-N 360.458 0.723 10 10 FCCE C[C@@]1(NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCOC1=O 1471369459 JYNAEJOOLQMIMZ-LJQANCHMSA-N 374.441 0.893 10 10 FCCE O=C(Cc1ccc(F)cc1)N[C@@H](CO)C(=O)NCc1cccc(O)c1O 1651175861 QKKZKFBZPCMTOG-AWEZNQCLSA-N 362.357 0.573 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)Cc3cnnn3C)cc2F)CC1 826718883 ASWBZSPNCOAVMG-UHFFFAOYSA-N 360.437 0.955 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@H]3C[C@@H](N(C)C)C3)C2)cc1 829768011 ZFHXYYWBHCCXKQ-YQQAZPJKSA-N 374.485 0.847 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NCCN(C)OC)CC2)cc1 853541004 CGKOVNUNSWDNCU-UHFFFAOYSA-N 365.478 0.610 10 10 FCCE CO[C@@H]1CC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1119815582 FJOLYBUUUMIOGJ-ZWKOTPCHSA-N 374.485 0.690 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCCCc1ncn(C)n1 1326940681 DPSWKSPAUPDRFO-UHFFFAOYSA-N 372.473 0.979 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@@H]3C[C@H]2C[S@@]3=O)cc1 1327490894 BEJPSMAVRYFKRD-NWLBTCKQSA-N 363.483 0.881 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)NCCN1C[C@H]2CCCCN2C1=O 1328609780 MPUIGFZQHTWTRU-OAHLLOKOSA-N 374.441 0.757 10 10 FCCE COc1ccc(N2CCN(C(=O)Cn3c(O)nnc3O)CC2)c(OC)c1 1643035378 GYCCPEAFMFBUMU-UHFFFAOYSA-N 363.374 0.055 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@H](C)[C@@H](O)C3)CC2)cc1 1645117218 GEWVSPZITUORQS-KPFFTGBYSA-N 363.502 0.881 10 10 FCCE COC(=O)[C@H]1CS(=O)(=O)CCN1Cc1ccc(N2CCOCC2)cc1 1655799457 BJZOPVFVKNIMKJ-MRXNPFEDSA-N 368.455 0.295 10 10 FCCE Cc1nnc(N2CCN(C)C(=O)C2)n1Cc1ccc(N2CCOCC2)cc1 1726401879 FZWJJIAEUSEJAZ-UHFFFAOYSA-N 370.457 0.750 10 10 FCCE CN1CCO[C@H](CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 104790468 WLNPSOPEUAPQGW-OAHLLOKOSA-N 366.437 0.792 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCO[C@@]4(CCOC4)C3)nc12 274395429 IPHRCABCZOBFHK-KRWDZBQOSA-N 362.386 0.603 10 10 FCCE COc1ccc(N2CCN(CN3C(=O)[C@H]4[C@H]5C=C[C@@H](O5)[C@@H]4C3=O)CC2)cc1 839948871 LEPFRBXKXCNZQR-BDXSIMOUSA-N 369.421 0.713 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(C)(C)NS(C)(=O)=O)C2)cc1 855230267 FGYFTBUAWYQDDM-GFCCVEGCSA-N 355.460 0.718 10 10 FCCE NC1(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCOCC1 861651807 CRCINQDKRDRBJA-UHFFFAOYSA-N 362.474 0.955 10 10 FCCE C[C@H](NC(=O)C(=O)NCCCc1ncn(C)n1)c1ccc(N(C)C)cc1 1326421969 HNOSYOJICLKONK-ZDUSSCGKSA-N 358.446 0.807 10 10 FCCE C[C@H](NC(=O)C(=O)N1CC=C[C@H]1CO)c1ccc(N2CCOCC2)cc1 1332105612 PDDAJACEDVRQFT-YOEHRIQHSA-N 359.426 0.460 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3CCNC(=O)CC3)cc2)CC1 1471912685 UNIZZDNBZIAKJM-INIZCTEOSA-N 372.469 0.921 10 10 FCCE CN1C[C@@H](CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1=O 1638503091 WJKPLCRTNRPDGW-JTQLQIEISA-N 355.416 0.362 10 10 FCCE CC(C)(C)OC(=O)NCC(=O)NCC(=O)NCc1c(O)cccc1O 1639292980 YMWYPPAHZUDDNZ-UHFFFAOYSA-N 353.375 0.355 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2081034159 GBXAENVXUUQASV-BJDJZHNGSA-N 355.395 0.629 10 10 FCCE N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N=c1nc(Br)[nH]s1 2166382013 AHBWWVBPIXMEAV-LURJTMIESA-N 359.205 0.642 10 10 FCCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 273135688 CULBRXPTRSPIOL-ZRQQLDRUSA-N 359.382 0.256 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCN3CCCC3=O)C2)cc1 829757800 VPLIYKBFDKUEGP-AWEZNQCLSA-N 374.441 0.129 10 10 FCCE C[C@@H](CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)NC(N)=O 847366566 KETFCCZLQRXZPO-GXTWGEPZSA-N 361.446 0.451 10 10 FCCE CN1C(=O)NC(=O)/C(=C\c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)C1=O 1084215374 GHLJHSYTICSCHY-DHZHZOJOSA-N 360.326 0.523 10 10 FCCE O=C(c1c(F)ccc(O)c1O)N1CCC(O)(CN2CCOCC2)CC1 1457729432 MONBSLJKCPMAOU-UHFFFAOYSA-N 354.378 0.536 10 10 FCCE O=C(N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)c1c(F)ccc(O)c1O 1654451275 ZFTZDHRQIKCINM-PSLIRLAXSA-N 359.375 0.703 10 10 FCCE CCn1cnc(S(=O)(=O)Nc2ccc(O)c(S(=O)(=O)NC)c2)c1 790406186 DKLABVQPNOYSSJ-UHFFFAOYSA-N 360.417 0.318 10 10 FCCE C[C@H](N)[C@@H](C)NC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 851669695 ZZSUBGNGLJHQQK-QWHCGFSZSA-N 354.476 0.456 10 10 FCCE CN(C)CCC[C@@H]1CN(C(=O)C(=O)NCCc2ccc(N)cc2)CCO1 851688084 PZCLUKQESNLYEB-QGZVFWFLSA-N 362.474 0.497 10 10 FCCE COCCCn1nc(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)ccc1=O 852792265 UNXAUSXQPQOPRE-INIZCTEOSA-N 373.457 0.776 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C[C@H]3[C@H]4CC[C@@H](CN4)[C@H]3C2)cc1 861735142 MZMRNSWUTVLVTH-DZOHQFGASA-N 356.470 0.825 10 10 FCCE C[C@H]1CN(c2ccc(CNC(=O)CCNC(=O)CO)cc2F)C[C@H](C)O1 906316834 HMXVQMVWHVRTJB-STQMWFEESA-N 367.421 0.554 10 10 FCCE CN1C[C@H]2[C@@H](NC(=O)c3cc(NS(C)(=O)=O)ccc3O)CC[C@H]2C1 1529330064 XXEGSYUEKNWDBN-GDLCADMTSA-N 353.444 0.834 10 10 FCCE CS(=O)(=O)c1ccccc1C(=O)N1CCS(=O)(=O)[C@@H]2COCC[C@H]21 1556959923 IZEZAMJYHGVHBB-TZMCWYRMSA-N 373.452 0.118 10 10 FCCE CON(C)C(=O)CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1683273753 LUVAQYXXHOLNGQ-UHFFFAOYSA-N 368.409 0.606 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC[C@@H](NS(C)(=O)=O)C2)c([N+](=O)[O-])c1 1772830226 LQIPZTOYHBMVSY-TXNVCOODSA-N 369.399 0.909 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NCc2ccc(N)cc2)[C@@H](O)C1 1890187384 SLCZAQZVGSQESP-KSSFIOAISA-N 365.430 0.618 10 10 FCCE CN(C)c1ccc(C=c2sc3nc4c(c(=O)nc(O)n4C)n3c2=O)cc1 254442171 XRJXWZNQKJTILC-UHFFFAOYSA-N 369.406 0.322 10 10 FCCE Cc1ccnc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1 792067568 VVJZWNXGVACHEJ-UHFFFAOYSA-N 360.439 0.950 10 10 FCCE COC(=O)CC[C@@H](N)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 844174348 WTNUTTOHBYGTDL-QGZVFWFLSA-N 363.458 0.792 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@]34CNC[C@H]3COC4)cc2)C1 846672854 LZJUYNVBBKDAJT-FTRWYGJKSA-N 372.469 0.241 10 10 FCCE CN1CCN(c2ccc(CNC[C@@]34COCCN3C(=O)OC4)cc2)CC1 865769523 KXSJFMXKHAEYMN-IBGZPJMESA-N 360.458 0.749 10 10 FCCE CO[C@@]1(CNC(=O)NCc2ccc(N(C)C)c(F)c2)CCS(=O)(=O)C1 915365424 DVZXHHPLUWLWDC-MRXNPFEDSA-N 373.450 0.895 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@@H]1[C@H]2COC[C@H]21)c1ccc(N2CCOCC2)cc1 1117154800 AYFSWJWZLVXEMO-KKBVYLPWSA-N 359.426 0.461 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c1 1640958381 MCPRCGCTROFSBW-QHSBEEBCSA-N 350.396 0.789 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2081034541 HFWNOOKCTHKEAI-KXNHARMFSA-N 355.395 0.486 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNC(=O)COc2ccc(N)cc2)C1 2106246338 BMJDMOXEVYSEHN-IUODEOHRSA-N 365.430 0.992 10 10 FCCE CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NCc1ccc(N(C)C)cc1 273100091 VNKPACBAXACPOJ-UHFFFAOYSA-N 373.413 0.918 10 10 FCCE Cn1cc(N2CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC2)cn1 376664061 FXTFOYDQZBWBSJ-UHFFFAOYSA-N 358.358 0.986 10 10 FCCE CO[C@](C)(CO)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 823519605 KRBVPMQYYQCDAV-SFHVURJKSA-N 351.447 0.844 10 10 FCCE COCCOCCNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 827216411 UYUCQNVSQJRARM-CQSZACIVSA-N 365.430 0.169 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CN(C)CCN3C)C2)cc1 852092893 WTTCMVAGMKCGQO-DOTOQJQBSA-N 361.490 0.819 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](CO)C3CCC3)CC2)cc1 852320513 LLQKNVMDWFEVME-ICSRJNTNSA-N 363.502 0.929 10 10 FCCE COc1ccc(N2CCN(C(=O)c3cn([C@@H]4CC[C@H]4O)nn3)CC2)cc1 899940546 QAZVFFKOIZXKEQ-IAGOWNOFSA-N 357.414 0.945 10 10 FCCE O=C(Cc1ccc(F)cc1)N[C@@H](CO)C(=O)NCc1cc(O)ccc1O 1176754291 ALLUQASYZSHMAM-HNNXBMFYSA-N 362.357 0.573 10 10 FCCE C[C@@H]1C[C@@H]1CNC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1257232475 MYBXANXJKCLVPD-FVQBIDKESA-N 372.469 0.777 10 10 FCCE N[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC[C@H]1C(F)(F)F 1334054175 GEZNMHKMVRKQTE-NEPJUHHUSA-N 357.332 0.973 10 10 FCCE COC(=O)[C@@H]1CC[C@@H](C(=O)OC)CN1C(=O)Cc1ccc(O)c(O)c1 1453538445 IAPNSFLQYNYBJO-NEPJUHHUSA-N 351.355 0.594 10 10 FCCE CC(=O)NC[C@@H]1CCn2ncc(C(=O)NCc3ccc(O)cc3O)c2C1 1469158625 FFRWLPXUKLQZLF-GFCCVEGCSA-N 358.398 0.923 10 10 FCCE O=C1COc2cc([N+](=O)[O-])c(N3CCN([C@@H]4CCC[C@@H]4O)CC3)cc2N1 378157444 HFINEUCJQRZSJN-DOMZBBRYSA-N 362.386 0.961 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC[C@H](S(N)(=O)=O)C2)c([N+](=O)[O-])c1 732667333 NCHBGPCVRVSONZ-TZNOJPMFSA-N 355.372 0.648 10 10 FCCE CCC(=O)N[C@@H](C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 742919350 GEQDREPOERJKQK-HNNXBMFYSA-N 362.474 0.848 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)NCc3cscn3)cc2)CC1 897601778 XAOGANFJCLVRQG-UHFFFAOYSA-N 373.482 0.828 10 10 FCCE CCN(OC)C(=O)CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C 1261468787 MSETWRFVVQFBJK-UHFFFAOYSA-N 350.419 0.203 10 10 FCCE CN(C)C(=O)Cn1c([C@@H]2CCC(=O)N2)nnc1N(C)Cc1ccccc1O 1298003440 HQLGEPIVNNXJMQ-ZDUSSCGKSA-N 372.429 0.659 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CC[C@H](Nc2ncccn2)C1 1345979151 GAUYWIWQZPEHCS-AWEZNQCLSA-N 355.398 0.854 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1C[C@H](O)CN(C(=O)c2cc(O)nc(O)c2)C1 2049116570 JHOGJQGJTXCGNR-MNOVXSKESA-N 353.375 0.593 10 10 FCCE C[C@@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CC(=O)N1C 806276405 OKCUYZAKMWTCTA-SNVBAGLBSA-N 356.473 0.431 10 10 FCCE CCOC(=O)C[C@H](O)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 819591147 PMKYTAGUWYACTO-BBRMVZONSA-N 350.415 0.952 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3ccn(C)n3)C2)cc1 828092246 FZYJLQSCPSHCDK-CQSZACIVSA-N 357.414 0.440 10 10 FCCE C[C@@H]1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CN1 861741854 AHQCAONSGPSRLM-INMHGKMJSA-N 374.485 0.957 10 10 FCCE O=C(CNS(=O)(=O)c1cccc(F)c1)NCc1c(O)cccc1O 1156881318 YJBXWIDJUDSGJQ-UHFFFAOYSA-N 354.359 0.832 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@@H](CO)CCF)cc2)CC1 1255509115 MUILERIXNHXPSI-OAHLLOKOSA-N 366.437 0.908 10 10 FCCE NC(=O)[C@@H]1CC(C(=O)NCc2cccc(O)c2O)=NN1c1ccccc1 1471644372 SAEJLHHQIPIADU-AWEZNQCLSA-N 354.366 0.834 10 10 FCCE O=C(CNS(=O)(=O)c1ccccc1F)NCc1c(O)cccc1O 1639289594 UQDPVFBLJGATRF-UHFFFAOYSA-N 354.359 0.832 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc(O)c(O)c(O)c2)[C@H](O)C1 2132348906 VIYPBOHQPGJEAS-GXFFZTMASA-N 368.386 0.904 10 10 FCCE CC(C)(C)OC(=O)N1CCCN(CCCOc2nnc(=N)[nH]n2)CC1 2318601778 NVZKJQKOMKRDAY-UHFFFAOYSA-N 353.427 0.391 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CC[C@@H](CN)C3)C2)cc1 851689031 KENUSRWILLWWNC-ILXRZTDVSA-N 360.458 0.634 10 10 FCCE Cn1ncc(C(F)(F)F)c1CNC(=O)C(=O)NCCc1ccc(N)cc1 861775670 BDDOIPZSROKXFE-UHFFFAOYSA-N 369.347 0.996 10 10 FCCE Cn1cc([C@@H](O)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cn1 1451054126 AIBZRMXGRAPTNQ-MRXNPFEDSA-N 366.368 0.885 10 10 FCCE COC1(OC)CC(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1607955638 FCRCPFXCZJGNCH-UHFFFAOYSA-N 358.416 0.893 10 10 FCCE Cc1nc(S(=O)(=O)NCCC(=O)NCc2cc(O)ccc2O)cn1C 1643881754 DFBLBLGJHNCITG-UHFFFAOYSA-N 368.415 0.125 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCCON 2080874712 WMLOPKLUVWCCTL-NSHDSACASA-N 355.391 0.540 10 10 FCCE CC(C)(C)OC(=O)NCC(CO)(CO)NCc1cc2c(cc1O)OCO2 2265732307 XGUDMWMDAGNZTQ-UHFFFAOYSA-N 370.402 0.459 10 10 FCCE CC(C)Oc1ccc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)nn1 793014084 SLVZIIZDAGUAAS-UHFFFAOYSA-N 360.370 0.972 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](N)C(F)(F)F)CC2)cc1 829499572 BATHRZJPMNOZHG-CQSZACIVSA-N 360.380 0.823 10 10 FCCE COC(=O)[C@H]1C[C@@H](N(C)C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 856213849 AEQCBERDOJFNNU-JGZJWPJOSA-N 356.400 0.787 10 10 FCCE C[C@@H]1CS(=O)(=O)CCCN1C(=O)C(=O)NCc1ccc(N(C)C)cc1 1262222973 HEUPUFZJXOUFKM-CYBMUJFWSA-N 367.471 0.404 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H]1C[C@@H]2CC[C@H]1N2 1340633070 CWUVBAFHPOEFCH-USXIJHARSA-N 363.483 0.678 10 10 FCCE C[S@](=O)[C@@H]1CC[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1654842568 NYUYMSYYWLSCHR-QRRAURDBSA-N 360.457 0.793 10 10 FCCE CC(C)(C)OC(=O)NCC1(O)CN(C[C@@H](O)COc2ccc(N)cc2)C1 2106764130 FXLUFDAEFVETRH-CQSZACIVSA-N 367.446 0.580 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1CNCc1c(O)cccc1F 2218633681 SIUFNHVQOWIRRN-QEJZJMRPSA-N 356.394 0.962 10 10 FCCE CC(=O)C(=O)COC(=O)CCc1ccc(N2CCCS2(=O)=O)cc1 869939822 AOYLFFJEUBQTAJ-UHFFFAOYSA-N 353.396 0.860 10 10 FCCE Cc1cc(CN2CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)no1 1118936667 WHLQURATFGQGNA-UHFFFAOYSA-N 370.409 0.875 10 10 FCCE CO[C@H]1C[C@H](CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 1331648199 HHHDBQWUXKRNAC-JCNLHEQBSA-N 361.442 0.681 10 10 FCCE CNS(=O)(=O)c1ccc(CC(=O)NCc2cccc(O)c2O)cc1 1651175626 GVUCREKOBXAJRD-UHFFFAOYSA-N 350.396 0.865 10 10 FCCE CC(C)COC(=O)C[C@@H]1C(=O)NCCN1C=C1C(=O)OC(C)(C)OC1=O 10213646 RTFYQKOJSKCNEG-GFCCVEGCSA-N 368.386 0.096 10 10 FCCE CCn1c(=C2C(=O)NN=C2C)sc(=C2Sc3ccccc3N2C)c1=O 254702101 AAPBUIHECAPVMY-UHFFFAOYSA-N 372.475 0.894 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cc1ccccc1F 808504582 IFSBCVCZBYTELZ-OCCSQVGLSA-N 351.330 0.031 10 10 FCCE CN1CC[C@@H](C(=O)NCc2cc(Br)ccc2O)S1(=O)=O 843884389 BKNHSNABPBARLI-NSHDSACASA-N 363.233 0.805 10 10 FCCE COC(=O)c1c(CNC[C@H](O)Cn2ccnn2)c2cc(F)ccc2n1C 894984175 IZDIXRIHUNEYRU-LBPRGKRZSA-N 361.377 0.846 10 10 FCCE COc1cc(N2C[C@@H](C)[C@H](CS(N)(=O)=O)C2)c([N+](=O)[O-])cc1OC 1164261172 MPBLZPFGOZLTPL-ZJUUUORDSA-N 359.404 0.973 10 10 FCCE CN(C)CCC[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCO1 1348662625 PTDMXLIOQSTNSD-HNNXBMFYSA-N 361.442 0.804 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2C[C@@H](O)[C@H](NC(=O)CCCF)C2)cc1 1489387054 VDWZOQJQVONQEX-CHWSQXEVSA-N 365.365 0.900 10 10 FCCE CC1=NNC(=O)[C@H]1CCNC(=O)c1cc(NS(C)(=O)=O)ccc1O 1628269769 HXNOSCHBZCJHRV-JTQLQIEISA-N 354.388 0.006 10 10 FCCE O=S1(=O)CC(O)(CNCc2cc(Br)cc(F)c2O)C1 2267902460 SISMSOVSBSCCGJ-UHFFFAOYSA-N 354.197 0.543 10 10 FCCE NC(=O)[C@H]1C[C@H](NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 858774122 XGCRMXYMYKQSKS-JOCQHMNTSA-N 364.421 0.850 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)NCC(=O)N(CC)OC 1349282539 YVXMNKWSBQNCQJ-UHFFFAOYSA-N 351.403 0.657 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C[C@H]3CCNC3=O)cc2)C1 1358167689 FUQBIPUKDSMEQE-CABCVRRESA-N 358.442 0.531 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)CCN3CCOC3=O)cc2)CC1 1652068642 SMQZQYLZBSESPP-UHFFFAOYSA-N 374.441 0.847 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H](CO)[C@H]1CCOC1 1684140718 AOSPHDWFRWUNOG-YJBOKZPZSA-N 363.458 0.844 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(=O)Nc1cnc(N(C)C)nc1 785293589 GMXGSDYRKWGZHB-SNVBAGLBSA-N 359.386 0.640 10 10 FCCE COc1ccc(N2CCC(NS(=O)(=O)C[C@H]3CNCCO3)CC2)cc1 866748087 FFVSLHHZVKVZEN-QGZVFWFLSA-N 369.487 0.572 10 10 FCCE NC(=O)N[C@@H](CO)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1137082390 YAFGSJWDBKAWTH-MFKMUULPSA-N 372.372 0.402 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)/C=C/Cn3cncn3)cc2)C1 1544929605 INWUHIALAOABRC-ICTCPBKTSA-N 368.441 0.852 10 10 FCCE C[C@@H](NC(=O)Cn1cnnn1)C(=O)NCc1c(O)ccc2c1CCCC2 1545639333 KXROTERVBDIIDC-LLVKDONJSA-N 358.402 0.079 10 10 FCCE Cc1nc(CC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)n[nH]1 1634974102 IHRRGSSYXHAXFG-UHFFFAOYSA-N 356.430 0.674 10 10 FCCE Cc1ccc(C(=O)N[C@@H]2CCN(c3cc(=O)n(C)c(O)n3)C2)c(O)c1O 1639533213 PCONNQXLOQSKRW-SNVBAGLBSA-N 360.370 0.214 10 10 FCCE CC(C)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1CC(=O)N(C)C 1692510101 QNBKFCCXYKATMV-UHFFFAOYSA-N 374.445 0.847 10 10 FCCE CC(C)(C)OC(=O)NC[C@H](CO)C(=O)NCCOc1ccc(N)cc1 2080928444 DHAMLBSQFAZCOK-GFCCVEGCSA-N 353.419 0.897 10 10 FCCE O=C(C(=O)N1CCN(Cc2cc3c(cc2O)CCC3)CC1)N1CCOCC1 798190868 PXQMKOPLWAAVIV-UHFFFAOYSA-N 373.453 0.384 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(CO)(CO)C3)C2)cc1 854188089 XBQNFMCIJXFJAB-HNNXBMFYSA-N 363.458 0.908 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CCn3cc[nH]c(=O)c3=O)C2)cc1 855228683 CYBXUGIGNLFJDG-CYBMUJFWSA-N 358.398 0.330 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCC[C@@](N)(CO)C3)CC2)cc1 923479853 XQBMLCUDBCEAJR-IBGZPJMESA-N 362.474 0.129 10 10 FCCE COC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCCOC1 1303725608 PBTKUNHCKWWFCT-RISCZKNCSA-N 372.443 0.935 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)N1CC=C[C@H]1CO 1334615333 KMJXYIJPINSOPU-INIZCTEOSA-N 359.426 0.023 10 10 FCCE NS(=O)(=O)c1ccc(OCCC(=O)NCc2c(O)cccc2O)cc1 1472064197 URQCQIQKWVXARY-UHFFFAOYSA-N 366.395 0.831 10 10 FCCE CO[C@@H]1CS(=O)(=O)C[C@H]1NC(=O)c1cc2cc(O)c(O)cc2s1 1584122093 FOOOIFKZBJKLDV-LDYMZIIASA-N 357.409 0.854 10 10 FCCE NS(=O)(=O)c1ccc(OCCC(=O)NCc2ccc(O)cc2O)cc1 1639444497 NMNWKSNUYNMKFT-UHFFFAOYSA-N 366.395 0.831 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNCc1cccc(O)c1O 2218616997 QQVMRAGTUDIIKE-CORIIIEPSA-N 354.403 0.529 10 10 FCCE COc1ccc(N2CCN(C(=O)CNCCN3CCOCC3)CC2)cc1 242497807 BTCWDHVOBDQHSQ-UHFFFAOYSA-N 362.474 0.266 10 10 FCCE CN(C[C@@H]1CCS(=O)(=O)C1)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 761907825 NGGDKGVHIQRCGQ-VIFPVBQESA-N 355.372 0.797 10 10 FCCE CN1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CCC1=O 1118669528 RUMVCZFDOOJVPZ-UHFFFAOYSA-N 358.442 0.376 10 10 FCCE COCCc1cc(NC(=O)C(=O)NCc2cccc(OC)c2O)n(C)n1 1319246620 BQSAIUXFSHJXIE-UHFFFAOYSA-N 362.386 0.578 10 10 FCCE CC[C@H](NC(C)=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1356434764 VWQDSGVSSAQMFH-WBVHZDCISA-N 360.458 0.919 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1=CCS(=O)(=O)C1 1466398715 QJTXRWASEPHPRI-UHFFFAOYSA-N 373.814 0.902 10 10 FCCE C[C@H](CO)NS(=O)(=O)c1ccc(C(=O)NCc2ccccc2O)cc1 1622773001 RFCUJIZHOGNJDQ-GFCCVEGCSA-N 364.423 0.981 10 10 FCCE Cc1nn(C)c2c1[C@H](c1ccc(O)c(O)c1)C(C(=O)N(C)CCO)=C(N)O2 1865028214 RTQXKSQELGJWMS-AWEZNQCLSA-N 374.397 0.285 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](O)[C@H]1C(=O)NCc1ccc(N)cc1 2136254821 AJJIHISVEBMECL-SOUVJXGZSA-N 365.430 0.616 10 10 FCCE CC(C)n1ncnc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 280804812 QNFJHKXCJCRJNU-UHFFFAOYSA-N 353.404 0.866 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN(CCO)[C@@H]3CCO[C@@H]3C)nc12 796573890 FLERFTJWPHLDAK-BXUZGUMPSA-N 364.402 0.583 10 10 FCCE CC1(C(N)=O)CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 829052350 YUZOVDRZECYPMS-UHFFFAOYSA-N 364.421 0.086 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CCC(CN)CC1)c1ccc(N2CCOCC2)cc1 842123071 BHUZAWUPMYQFBI-OAHLLOKOSA-N 374.485 0.898 10 10 FCCE NS(=O)(=O)N1CCC[C@H](C(=O)NCc2ccc3cccnc3c2O)C1 862025858 BMYDNTUEQJTOQK-ZDUSSCGKSA-N 364.427 0.472 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)c2cn(C[C@@H]3CNC(=O)O3)nn2)c1 1150543429 OIRCBZOFNUQUJL-KOLCDFICSA-N 361.358 0.592 10 10 FCCE Cn1c(=O)c2cc(C(=O)NCc3cc(O)ccc3O)sc2n(C)c1=O 1153885135 LILPZMRBTRKPPU-UHFFFAOYSA-N 361.379 0.640 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ncnn3C)C2)cc1 1334208234 LIHNJAZWZFXIOC-STQMWFEESA-N 372.429 0.396 10 10 FCCE CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)O[C@@H]1CN=[N+]=[N-] 2081163386 LFQWTDKRDROWBN-MBJXGIAVSA-N 373.318 0.380 10 10 FCCE CCOC(=O)COc1ccc(C=C2C(=O)NC(=O)N(C)C2=O)cc1OC 2294131111 ZZUZYUIFCODECY-UHFFFAOYSA-N 362.338 0.729 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3cc(C)[nH]n3)C2)cc1 828099184 FNAYXDPCHCUVRQ-CYBMUJFWSA-N 357.414 0.738 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC[C@@H]3CCOC3)C2)cc1 828506570 OTLSKYJUKNOTBS-CABCVRRESA-N 361.442 0.933 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N[C@@H](CN)C3CC3)CC2)cc1 841749083 AAPQGRQXAMYOKS-SFHVURJKSA-N 361.490 0.854 10 10 FCCE C[C@H]1CCN(CC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 847360989 GRDQBPXIZNPWND-HNNXBMFYSA-N 365.499 0.879 10 10 FCCE Cc1cnn(C)c1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1118472393 IZFXHQVSNPUKPO-UHFFFAOYSA-N 371.441 0.945 10 10 FCCE Cc1cc(C)nc(-n2[nH]c(C(=O)NCCc3ccc(O)c(O)c3)cc2=O)n1 1465981388 MCUAPHHKNSHVIN-UHFFFAOYSA-N 369.381 0.956 10 10 FCCE CC(C)(C)OC(=O)N1CC2(C[C@@H](O)CN2C(=O)c2cc(O)nc(O)c2)C1 2130055517 QTUHBNDYFLFPMR-LLVKDONJSA-N 365.386 0.689 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)Cn3nnnc3C)CC2)cc1 154610879 BCZNKPASUHIJGS-UHFFFAOYSA-N 373.461 0.319 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CSC(=O)N3)cc2)C1 746147433 OXLNWJAMDXGRRS-TZMCWYRMSA-N 362.455 0.830 10 10 FCCE CC(C)C(=O)N[C@@H](CO)C(=O)NCc1cc(Br)ccc1O 813610268 SEQRHVFUBKEFFR-NSHDSACASA-N 359.220 0.904 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H](C)Cn3ccnc3)C2)cc1 827190226 SGEVAKJZADHJIF-LSDHHAIUSA-N 371.441 0.792 10 10 FCCE CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)NCCCN 842222162 FSTQLUFJZHKZIH-UHFFFAOYSA-N 358.236 0.968 10 10 FCCE Cc1nn(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(=O)o1 849985251 XUKOWIYGNPWOKG-UHFFFAOYSA-N 350.350 0.437 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCC3(COC3)C2)cc1 850681122 ADEWLLXZAQPWHL-UHFFFAOYSA-N 361.442 0.839 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCC[C@@H](C)CO)C2)cc1 1328092168 JKSAHOUCTSVZFF-HUUCEWRRSA-N 363.458 0.915 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ncn(C)n3)C2)cc1 1331024011 VLKGTNHTGVVJQL-CHWSQXEVSA-N 372.429 0.396 10 10 FCCE Cc1ccc(O)c(CNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)c1 1645800645 NPIPUEVLCVQANI-UHFFFAOYSA-N 354.366 0.576 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2081034266 GBXAENVXUUQASV-YFKTTZPYSA-N 355.395 0.629 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNCc1ccc(O)cc1O 2218621905 ZQCHSZGULYEAPK-SNPRPXQTSA-N 354.403 0.529 10 10 FCCE CC(C)(C)OC(=O)NCC(CO)(CO)NC(=O)c1ccc(O)c(O)c1 2254562311 ULCWXOCOODGLLZ-UHFFFAOYSA-N 356.375 0.076 10 10 FCCE Cc1c(NC=C2C(=O)NC(=S)N(C)C2=O)c(=O)n(-c2ccccc2)n1C 2296079556 OWVBNHIXGZBGLJ-UHFFFAOYSA-N 371.422 0.653 10 10 FCCE COC(=O)C[C@H]1O[C@@H](N=[N+]=[N-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O 32107180 BUKUVEWCKMNEFV-RGCYKPLRSA-N 373.318 0.380 10 10 FCCE CC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCNCC2)c(F)c1 236820755 RZFOJVOHVMVHEW-INIZCTEOSA-N 366.462 0.773 10 10 FCCE CS(=O)(=O)N1CCN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])CC1 392106040 LFVLJLRAYPQACH-HYXAFXHYSA-N 355.372 0.774 10 10 FCCE COc1cc(O)c(CN2CCN(c3nccn(C)c3=O)CC2)cc1OC 768466584 SNUPTNAOPRHWAJ-UHFFFAOYSA-N 360.414 0.825 10 10 FCCE CCOC(=O)CN(CC(=O)N(C)CC(=O)OCC)Cc1ccccc1O 1460279489 MHCWPBAKTBZSJH-UHFFFAOYSA-N 366.414 0.779 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CCCN(CC(=O)N2CCCC2)CC1 1464887911 ARDZSGDVOVVQTG-UHFFFAOYSA-N 361.442 0.797 10 10 FCCE CCOC(=O)[C@H]1CSCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1467754313 SBJQOBRXTSMWPV-LLVKDONJSA-N 374.440 0.842 10 10 FCCE CN(CC(=O)NCc1c(O)cccc1F)S(=O)(=O)c1cccnc1 1558454358 FNNSJDOUXICAGL-UHFFFAOYSA-N 353.375 0.863 10 10 FCCE CN1CCN(c2ccc(CNC(=O)CCCn3c(O)nnc3O)cc2)CC1 1644526795 YLANHSHVWKXDNG-UHFFFAOYSA-N 374.445 0.538 10 10 FCCE COCCCNS(=O)(=O)[C@H]1CON(C)[C@@H]1c1ccc(N(C)C)cc1 105049457 MVPQZVXUQKCGDJ-JKSUJKDBSA-N 357.476 0.995 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)CCOC3CNC3)cc2F)CC1 828883180 JNQZSVNILXFGQQ-UHFFFAOYSA-N 364.465 0.962 10 10 FCCE CCON(C)C(=O)CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 852399773 UEOFNAUZABTEEK-UHFFFAOYSA-N 364.446 0.857 10 10 FCCE O=C(NC[C@H]1C[C@H]2C=C[C@H]1CC2)C(=O)C(=O)C(=O)N[C@H]1CCNC12CCC2 1329096013 VGFFZXRKZFOFBY-XQLPTFJDSA-N 373.453 0.244 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(CC)CCNC1=O 1447344854 DXQUXQHPJYPKFU-SGTLLEGYSA-N 364.398 0.605 10 10 FCCE CN1CCN(c2ccc(CNC(=O)N[C@H](CO)[C@H]3CCOC3)cc2)CC1 1479185774 UACPHOXQVMNQCO-FUHWJXTLSA-N 362.474 0.635 10 10 FCCE CN(C)S(=O)(=O)N1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1557814925 ZPRCWPKCYQCLJG-UHFFFAOYSA-N 354.392 0.069 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1nc2ncc(CCO)cn2n1 1629931352 IBLKRCBGQHIBCA-UHFFFAOYSA-N 368.397 0.764 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc(O)nc(O)c2)[C@H](CO)C1 2116259221 WVUHUMOGXVHSTG-RYUDHWBXSA-N 367.402 0.841 10 10 FCCE C=CC(=O)NCCC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 773287730 XYTJAHMTSXCAEE-HNNXBMFYSA-N 358.442 0.697 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCc3cc(C(N)=O)no3)C2)cc1 852222738 KDADIIUZZPVHGR-NSHDSACASA-N 359.386 0.860 10 10 FCCE CN1CCN(c2ccc(CNCC[C@@H]3CNCCS3(=O)=O)cc2)CC1 903969368 XVIRKTZENZGLPP-GOSISDBHSA-N 366.531 0.305 10 10 FCCE CCS(=O)(=O)c1cnc(O)c(C(=O)NCc2ccc(O)c(O)c2)c1 1150378000 NMJLZYLDUMBDTC-UHFFFAOYSA-N 352.368 0.922 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2[C@@H]3C[C@H]4[C@H](CO[C@H]42)C3)c1 1454704668 UMHANGFKDXTZEF-IOJWWUGISA-N 352.412 0.917 10 10 FCCE O=C(NCc1c(O)cccc1F)C1=CC=CN2CCS(=O)(=O)N=C12 1635360141 ARUIZOSZLJJTJV-UHFFFAOYSA-N 351.359 0.645 10 10 FCCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCS(=O)(=O)C1 2010406574 WGUSFUPFUBDLBZ-ZDUSSCGKSA-N 359.408 0.590 10 10 FCCE Cn1nccc1[C@@H](O)CNC(=O)NCc1ccc(N2CCOCC2)cc1 914334636 AUWQKOZOWIPIOH-KRWDZBQOSA-N 359.430 0.790 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NCCc2cnn(C)c2)cc1 1326951986 DEAGVQBKECNOIT-UHFFFAOYSA-N 373.457 0.682 10 10 FCCE C[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)N1CCCCC1=O 788617662 YSDQKJIGOXHWKW-LLVKDONJSA-N 369.443 0.895 10 10 FCCE COc1ccc(CNC(=O)NCCCN2CCCS2(=O)=O)c(O)c1 792892499 YFVKYGUDDZDWFW-UHFFFAOYSA-N 357.432 0.626 10 10 FCCE CN1CC[C@@H](C(=O)NCc2ccc(N3CCSCC3)cc2)S1(=O)=O 843769280 WTRLLEVSXIGNSD-HNNXBMFYSA-N 369.512 0.890 10 10 FCCE CN(C)c1ccc(CN(C(=O)C(=O)N2CCNCCNCC2)C2CC2)cc1 926298759 WCTLCJCLNLIYEP-UHFFFAOYSA-N 373.501 0.265 10 10 FCCE COc1ccc(N2CCN(C(=O)c3nc(C)n(-c4nc[nH]n4)n3)CC2)cc1 1150071584 VLRBKJBBUYACPX-UHFFFAOYSA-N 368.401 0.665 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H]4CCNC(=O)[C@@H]43)nc12 1659924740 ADTXFBGTOVJMQA-IAQYHMDHSA-N 373.413 0.712 10 10 FCCE O=C(NCc1cc(Cl)ccc1O)NC[C@@]12COCCN1C(=O)COC2 1684747012 RFAZEUASJIWSFJ-INIZCTEOSA-N 369.805 0.473 10 10 FCCE O=C1NC(=S)N=C(O)/C1=C\c1cc([N+](=O)[O-])ccc1N1CCNCC1 17085527 JZOSINKDUUPXIR-UHFFFAOYSA-N 361.383 0.759 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NCC[S@](=O)CC 805611359 WHRLLIKAHLQEQP-XMMPIXPASA-N 353.488 0.986 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1C[C@@H](O)CN1C(=O)Cc1ccccc1F 808504583 IFSBCVCZBYTELZ-TZMCWYRMSA-N 351.330 0.031 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCCNC3CC3)C2)cc1 851687683 HABNPDAJBUNITM-OAHLLOKOSA-N 360.458 0.648 10 10 FCCE Cn1c(=O)nc(O)c2nc(CCC(=O)NCc3c(O)cccc3F)[nH]c21 1156169989 AYMPPTOAZQSEFP-UHFFFAOYSA-N 361.333 0.456 10 10 FCCE CNC(=O)[C@@H]1CN(c2nnc(C)n2Cc2ccc(N(C)C)cc2C)CCO1 1315006750 UGHYQPYLZFZODY-KRWDZBQOSA-N 372.473 0.960 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCNC[C@@H]1c1cccnc1 1348857772 SIVGDARHJTVFNW-MRXNPFEDSA-N 354.410 0.919 10 10 FCCE NS(=O)(=O)CCCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1446571618 ZSGUIFJWTIJXMM-CQSZACIVSA-N 356.444 0.969 10 10 FCCE Cc1cc(C(=O)N2C[C@H](C(N)=O)[C@@H](C(N)=O)C2)c(C)n1-c1ccccn1 1630581285 RFOIIDPRNVDGEC-KBPBESRZSA-N 355.398 0.148 10 10 FCCE C[S@](=O)[C@@H]1CC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1654842566 NYUYMSYYWLSCHR-JOWVRCJESA-N 360.457 0.793 10 10 FCCE CSCC[C@@H](C(=O)OCC(=O)C(C)=O)N1C(=O)[C@H]2CCCC[C@H]2C1=O 808491145 MMBGOFPFLVFKIF-XQQFMLRXSA-N 369.439 0.985 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 808498875 YWUSSYARCPYKAW-GFCCVEGCSA-N 371.386 0.928 10 10 FCCE CCCN1CC[C@H](NC(=O)C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 830454331 HSGFDGHXBCCHCI-JKSUJKDBSA-N 374.485 0.991 10 10 FCCE C[C@@H]1C(=O)N(C)CN1C(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 843252186 GXKLPFLPSWBEMH-CQSZACIVSA-N 374.441 0.128 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N[C@@H]2CCNC[C@@H]2C)cc1 846344721 TWTTZUCLMJQINW-WMLDXEAASA-N 362.474 0.704 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CC3CC2(CN)C3)cc1 852920366 AFYXNQZVRKQTPN-UHFFFAOYSA-N 360.458 0.540 10 10 FCCE O=C(Nc1nnc(-c2ccncc2)s1)C1=S=c2c(cc[nH]c2=O)=C1 1151861865 UCXOLCGEBRRMNE-UHFFFAOYSA-N 355.404 0.878 10 10 FCCE O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NCc1cc(O)ccc1O 1153886185 ZMYMLUQFJWIVQG-XOUADPBQSA-N 360.366 0.267 10 10 FCCE CN(C)CCCN(C(=O)Cc1ccc(O)c(O)c1)[C@H]1CCS(=O)(=O)C1 1621639833 VIIPNAGYKYWFAM-AWEZNQCLSA-N 370.471 0.608 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNC(=O)c1cccc(O)c1O 2333598707 MXCDTEMPJCWYJP-SUHUHFCYSA-N 368.386 0.169 10 10 FCCE COc1ccc(N2CCN(CCN3C(=O)N[C@@]4(CCOC4)C3=O)CC2)cc1 277665628 FUFWRJYDEVSDHL-LJQANCHMSA-N 374.441 0.528 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H](C(N)=O)CC[C@@H]3C)nc12 729266969 UOPBGNGFTKQGRM-QWRGUYRKSA-N 361.402 0.697 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC[C@@]3(C)CCCNC3)C2)cc1 851688597 DNYISEKQYKIQCY-YWZLYKJASA-N 374.485 0.896 10 10 FCCE CN1CCN(c2ccc(CNCC(C)(C)CS(N)(=O)=O)cc2)CC1 865813015 BWLCIHQXJNGPTJ-UHFFFAOYSA-N 354.520 0.843 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@H]4C(=O)N(C)C(=O)[C@H]4C3)C2)cc1 868761887 JDCJKGPUMVYVGJ-WQVCFCJDSA-N 372.425 0.530 10 10 FCCE COC(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 1321934611 FQKUCWUUOHLXHE-OAHLLOKOSA-N 359.426 0.707 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCOCCF)C2)cc1 1328250414 JUPDFWWNTIVGFU-ZDUSSCGKSA-N 353.394 0.492 10 10 FCCE Cn1nnnc1CCCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1682986610 JOMSAAUPOYVWLL-UHFFFAOYSA-N 373.461 0.603 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC[C@H]1C[C@@H]1N 2136245312 SVKDOVYCQHODDY-AGIUHOORSA-N 365.430 0.997 10 10 FCCE O=C(N[C@H]1CCS(=O)(=O)C1)N1CCN(c2ccc3c(c2)OCO3)CC1 243011858 HWKOWXKHPYZUNN-LBPRGKRZSA-N 367.427 0.434 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CSC(=O)N3)CC2)cc1 266806940 DZDFUUDZLKRJDB-OAHLLOKOSA-N 364.471 0.758 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](O)Cc3cnn(C)c3)C2)cc1 819588185 KSQVLQNIXPHLNW-KDOFPFPSSA-N 358.442 0.975 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCS(=O)(=O)CC3)C2)cc1 849416900 YXFNSDJIMVEIDF-CYBMUJFWSA-N 353.444 0.714 10 10 FCCE CO[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@](C)(CO)C1 867702391 XQOJXXUUGXOLNG-LPHOPBHVSA-N 363.458 0.709 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)NC[C@H]1CN(C2CC2)C(=O)O1 1118390859 ZARHHUXBLBEIPB-INIZCTEOSA-N 374.441 0.810 10 10 FCCE Cn1cnc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1=O 1136339983 ABDWUFISEZHWIV-AWEZNQCLSA-N 369.425 0.412 10 10 FCCE C[C@H](CC(N)=O)NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1313304028 APUAREUSVJLHGE-GFCCVEGCSA-N 361.446 0.451 10 10 FCCE CN(C)C(=O)N(C)[C@@H]1CCN(C(=O)C(=O)N(C)Cc2ccccc2O)C1 1327316689 NYXJKZZPINEXLJ-CQSZACIVSA-N 362.430 0.565 10 10 FCCE CC[C@@H](NC(C)=O)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1356434758 VWQDSGVSSAQMFH-DOTOQJQBSA-N 360.458 0.919 10 10 FCCE C[C@H](C(=O)NCc1cc(O)ccc1O)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1558174971 VZXNWVRXCIYDCY-FYIZZCSQSA-N 360.366 0.265 10 10 FCCE Cn1cnc(-c2ccc(NC(=O)C3=S=c4c(cc[nH]c4=O)=C3)cc2)n1 1633782012 IMWUYTUEXWTPMO-UHFFFAOYSA-N 351.391 0.760 10 10 FCCE CC(C)(C)OC(=O)NC[C@@H](CO)C(=O)NCCc1ccc(O)c(O)c1 2067740244 OJWPTCRSDURAMD-LBPRGKRZSA-N 354.403 0.890 10 10 FCCE CN(C)CCN(C(=O)Nc1cc(O)c(O)c(O)c1)[C@H]1CCS(=O)(=O)C1 217278846 OMHOBMBAYLOTFT-NSHDSACASA-N 373.431 0.386 10 10 FCCE CC(C)(C(N)=O)N1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761908372 XNSSDEVNVLDHTQ-UHFFFAOYSA-N 363.374 0.312 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3cccnn3)C2)cc1 828276205 HVXUXIOTWPWWIC-AWEZNQCLSA-N 355.398 0.497 10 10 FCCE Cc1ccc(C(=O)N2CCN(C[C@@H]3CCCS3(=O)=O)CC2)c(O)c1O 913127822 GOYMYSODXKDZBY-ZDUSSCGKSA-N 368.455 0.741 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@]2(CO)COCCN2C)cc1F 915365698 HJHSCVAIJWFXRS-KRWDZBQOSA-N 354.426 0.384 10 10 FCCE C[C@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1338556655 POAINWLGLYXYAQ-YJBOKZPZSA-N 374.485 0.596 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H]2CN3CCC2CC3)c1 1636747200 AKKQNBAKOISVNW-LBPRGKRZSA-N 353.444 0.835 10 10 FCCE CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(O)c(O)c(O)c2)[C@@H](CO)C1 2132413421 MYYXUCRNYWJRBX-LLVKDONJSA-N 368.386 0.857 10 10 FCCE C[C@@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@H](C)CN1CCO 841457856 WKIOJRFMFZUUTL-VXGBXAGGSA-N 371.459 0.291 10 10 FCCE O=C1CNCCN1[C@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 843065838 QOPDHFCKECIVBD-IBGZPJMESA-N 358.486 0.919 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CCN(C)S2(=O)=O)cc1 844857343 UHGHLDXHJBUKPL-OAHLLOKOSA-N 355.460 0.624 10 10 FCCE C[C@H]1CCNC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 851689513 PXAWQXJSPCVANA-KSSFIOAISA-N 374.485 0.378 10 10 FCCE CC(=O)N1CCO[C@H](C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C1 891241493 ATUPFYQHOSWOTK-MSOLQXFVSA-N 362.474 0.719 10 10 FCCE C[C@]12COC[C@H]1CN(C(=O)C(=O)NCc1ccc(N3CCOCC3)cc1)C2 1347444480 KMRYLMWWCGPIQT-UZLBHIALSA-N 373.453 0.634 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNCc1cccc(F)c1O 2312324499 CSXLPLNAUZGRLA-GUTXKFCHSA-N 356.394 0.962 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)NC[C@@H](N)C3CC3)CC2)cc1 841749701 HJIRPEGNJKYQDM-GOSISDBHSA-N 361.490 0.854 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)/C=C\Cn3cncn3)CC2)cc1 900407652 SEFSRQNGRWVLOZ-IHWYPQMZSA-N 370.457 0.781 10 10 FCCE CN1CCN(c2ccc(CNC(=O)c3cn([C@@H]4CC[C@H]4O)nn3)cc2)CC1 918914059 QKJXSEPEWMNHAI-QZTJIDSGSA-N 370.457 0.656 10 10 FCCE O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NCc1c(O)cccc1F 928704922 GEFYEJUGRFYGFH-XOUADPBQSA-N 362.357 0.700 10 10 FCCE COC(=O)C[C@H]1CS(=O)(=O)CCN1C(=O)/C=C\c1ccc(O)c(O)c1 1454615932 IKOKMEGAPLNWSV-FHMRSRPSSA-N 369.395 0.300 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)NCc2nnc3n2CCNC3=O)c1 1479191411 QIUIOYJEUHZYCP-SECBINFHSA-N 360.374 0.296 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](NC(=O)Cc2ccc(O)c(O)c2)[C@H](O)C1 2062452115 SWBUPNNBUJXHDA-SMDDNHRTSA-N 352.387 0.737 10 10 FCCE C[C@H](NC(=O)[C@@H]1[C@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C)c1ccccc1O 2136132651 JSQBTKVTBHOFJU-FBUXBERBSA-N 366.414 0.911 10 10 FCCE COc1ccc(Br)c(CN[C@H]2CS(=O)(=O)C[C@H]2O)c1O 2236055868 SADKLOYUQZJKPF-VHSXEESVSA-N 366.233 0.411 10 10 FCCE COc1cc(N(C)CC(=O)N2CCN(C(C)=O)CC2)cc(OC)c1OC 265979090 AXTPPAZLMDKPJZ-UHFFFAOYSA-N 365.430 0.839 10 10 FCCE C[C@H](Cn1cncn1)NC(=O)C(=O)NCc1ccc2c(c1)CCCN2C 285613205 CSPWLAUGWIWGNB-CYBMUJFWSA-N 356.430 0.482 10 10 FCCE C[C@@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC(=O)N1C 285717829 NAGLZBJWCBIXEA-CYBMUJFWSA-N 358.442 0.374 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@](O)(C(F)(F)F)C2)cc1 785432384 BHHCCJGOPSKART-OAHLLOKOSA-N 359.348 0.895 10 10 FCCE COCCONC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 788923953 CEIIGDUVVZLGMF-UHFFFAOYSA-N 352.435 0.694 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 808516043 WOYWGBVCOJENDK-OAHLLOKOSA-N 367.423 0.930 10 10 FCCE CS(=O)(=O)N1CCCC[C@H]1CNC(=O)NCCc1ccc(N)cc1 841903228 LNGJEOOZVZFGDI-HNNXBMFYSA-N 354.476 0.925 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC=C[C@@H]3CO)CC2)cc1 922266727 LEJHYXAFRRCKNM-KBOKABMXSA-N 371.437 0.659 10 10 FCCE NC(=O)C1(N2CCCCC2)CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1153451552 NSXVBWGFYARYPC-UHFFFAOYSA-N 361.442 0.973 10 10 FCCE CCn1ncc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)n1 1288914097 AVTBDSPRPHEURC-UHFFFAOYSA-N 356.430 0.930 10 10 FCCE C[C@H](NCC(CO)(CO)NC(=O)OC(C)(C)C)c1ccc(O)cc1O 2258277547 UGPYIMPGXDREJF-NSHDSACASA-N 356.419 0.997 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(-c2nc(CC(=O)N3CCCC3)no2)c1 771018292 YBVCJCVHAPOJNW-UHFFFAOYSA-N 366.399 0.979 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 808517879 QMDITDKMWVZTHL-SECBINFHSA-N 354.340 0.962 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)N[C@H]1CCC(=O)N(C)C1 817822322 LVXPRCYHXOFOEL-ZBFHGGJFSA-N 374.485 0.845 10 10 FCCE C[C@@H](NS(=O)(=O)C[C@@H]1CNCCO1)c1ccc(N2CCOCC2)cc1 866747063 OCCPCXLCIXTJDO-PBHICJAKSA-N 369.487 0.492 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N[C@@H]1CC(=O)N(CC2CC2)C1 898567641 YGUSCVBEUPDLSH-MRXNPFEDSA-N 372.469 0.838 10 10 FCCE C[C@@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 1323222183 GNVLVXCCUUYRSI-PBHICJAKSA-N 361.442 0.681 10 10 FCCE CCOC(=O)CNC(=O)C1CCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1466249499 BJIPTXCAGTZWFO-UHFFFAOYSA-N 364.398 0.558 10 10 FCCE CCc1cccc2c(/C=C3\C(=O)NC(=S)N(C)C3=O)cn(CC(N)=O)c12 6568148 BIPHWWXLNDKIJK-NTUHNPAUSA-N 370.434 0.946 10 10 FCCE COc1ccc(N2CCN(CCNC3CCN(C(N)=O)CC3)CC2)cc1 268804720 HCKMLIDLQVGDBA-UHFFFAOYSA-N 361.490 0.950 10 10 FCCE Cn1nncc1CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 822938844 ZGIGTQIOXJZARF-CQSZACIVSA-N 356.430 0.376 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3cn(C)c(O)n3)CC2)cc1 824285624 PUFHIYNDLOMTLI-UHFFFAOYSA-N 359.430 0.686 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H](N)C(F)(F)F)cc2)C1 827468719 CPZNPSQZPWFCEG-AAEUAGOBSA-N 358.364 0.894 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NC3CCC(N)CC3)C2)cc1 851688031 OWXLTUFSNGHKAE-NRXISQOPSA-N 360.458 0.776 10 10 FCCE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN2[C@H](CNS2(=O)=O)C1 1156621706 LYUWPMDDIFDYDX-SECBINFHSA-N 369.424 0.287 10 10 FCCE COc1ccc(N2CCN(C(=O)CCS(=O)(=O)N(C)C)CC2)cc1F 1566346943 RLQXKUUZMNIKRG-UHFFFAOYSA-N 373.450 0.764 10 10 FCCE CN(C)c1ccc(CNCC(=O)N2CCN(c3ncccn3)CC2)cc1 1857865524 RFQMSBBXMRYNJS-UHFFFAOYSA-N 354.458 0.981 10 10 FCCE CC(C)(C)OC(=O)N[C@@](C)(CO)CNS(=O)(=O)Cc1ccc(N)cc1 2060810419 YYNBNEWYYGKQBD-MRXNPFEDSA-N 373.475 0.964 10 10 FCCE CC(CO)(CO)N/C=C1\C(=O)NC(=O)N(c2cccc3ccccc23)C1=O 102895359 XVGHRKKWCIBCIY-NTEUORMPSA-N 369.377 0.639 10 10 FCCE CN[C@@H]1C(=O)Nc2cc(N3CCOC[C@H]3CO)c(Br)cc21 253061248 DVNODLPYBLPRTM-OQPBUACISA-N 356.220 0.859 10 10 FCCE COc1ccc(N2CCN(CN3C(=O)[C@H]4[C@H](C3=O)[C@H]3C=C[C@H]4O3)CC2)cc1 839948872 LEPFRBXKXCNZQR-BRSBDYLESA-N 369.421 0.713 10 10 FCCE O=S(=O)(C[C@@H]1CNCCO1)NCc1ccc(N2CCC(O)CC2)cc1 866778719 JCACJMONRYDJSU-KRWDZBQOSA-N 369.487 0.056 10 10 FCCE O=C(CO)NCCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 906510842 FHOWXYIMNULNOP-UHFFFAOYSA-N 371.384 0.872 10 10 FCCE Cc1nn(CCS(=O)(=O)N2CCOc3cc(N(C)C)ccc32)c(=O)o1 914207474 PIMLAZKQYPIQPT-UHFFFAOYSA-N 368.415 0.440 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@@H]2C[C@@H]3COC[C@@H]3O2)cc1F 929801039 LZPSZEPEKINDIM-WWGRRREGSA-N 365.405 0.428 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC([C@@H]3COC(=O)N3)CC2)cc1 1119668015 PYUFWUJTESOJMQ-INIZCTEOSA-N 374.441 0.716 10 10 FCCE C[C@H](NC(=O)c1cn(C[C@@H]2CNC(=O)O2)nn1)c1ccc(N(C)C)cc1 1128247196 OBUMUIRVHPVVET-FZMZJTMJSA-N 358.402 0.944 10 10 FCCE C[C@H](CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)NC(N)=O 1638488900 QDHUALZQLFOFRC-GFCCVEGCSA-N 361.446 0.451 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cnnn3C)CC2)cc1 1645464042 ZPTZROMFKZFRDE-FPLPWBNLSA-N 370.413 0.667 10 10 FCCE CS(C)(=O)=NS(=O)(=O)CCNC(=O)/C=C/c1ccc(O)c(O)c1 1652112747 LNPNAYNPBIYLGM-GQCTYLIASA-N 362.429 0.285 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCN(c3cccnn3)CC2)cc1 170650074 DYKZASYJNNBWDG-UHFFFAOYSA-N 354.458 0.981 10 10 FCCE C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 769709613 OOUGIOQEAOSKMY-VHSXEESVSA-N 355.416 0.490 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCCCN3CCNCC3)C2)cc1 851660849 ANPCKZMAKGRGAI-MRXNPFEDSA-N 361.490 0.868 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN4C(=O)NC[C@H]4C3)C2)cc1 854300719 YXRUNCPNEUFXAB-HIFRSBDPSA-N 359.430 0.693 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H]3OCCO[C@H]3C)cc2)CC1 935568525 CWLSNEBVYDSAHJ-KSSFIOAISA-N 361.442 0.775 10 10 FCCE Cn1cnc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1=O 1136339984 ABDWUFISEZHWIV-CQSZACIVSA-N 369.425 0.412 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3CC[C@H]3C(N)=O)cc2)CC1 1303721269 VORTZPMFFJDWAH-CVEARBPZSA-N 358.442 0.516 10 10 FCCE COC(=O)[C@H]1CCCN(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)C1=O 1611430324 BMUAIESSUHWIJP-YPMHNXCESA-N 364.398 0.557 10 10 FCCE Cc1ccc(CNC(=O)[C@@H](N)CS(C)(=O)=O)c(O)c1Br 2380755812 FMSURGAHTQFDQQ-VIFPVBQESA-N 365.249 0.451 10 10 FCCE CC(=O)N1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)[C@H](C)C1 284326675 WVBRSEUNUGBVEB-OAHLLOKOSA-N 372.469 0.982 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@H]3CCN=C4C3=NNN4C)CC2)cc1F 829869212 KTUYHCGSVAQKLI-CYBMUJFWSA-N 374.420 0.707 10 10 FCCE COc1ccc(N2CC[C@H](NS(=O)(=O)[C@@H](C)C(=O)N(C)C)C2)cc1 849416224 MQQMXUUAHHCHAA-STQMWFEESA-N 355.460 0.670 10 10 FCCE Cn1cc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)n(C)c1=O 1155603706 HPGRNNYNUXNGTP-UHFFFAOYSA-N 371.441 0.356 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C3CS(=O)(=O)C3)cc2)C1 1544930253 WOATWMADSYHYMR-ZDUSSCGKSA-N 365.455 0.049 10 10 FCCE O=C(NCc1ccc(O)cc1O)[C@@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1630306867 PDPSIBGBKQCBHR-NXEZZACHSA-N 353.318 0.937 10 10 FCCE CO[C@@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)[C@H]1CCOC1 828497568 YYGHSGAIGIJWIQ-WMZOPIPTSA-N 373.453 0.847 10 10 FCCE CC(C)N(C[C@@H]1CCC(=O)N1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 857538682 FPJAEPYVHSOZRW-LBPRGKRZSA-N 369.443 0.893 10 10 FCCE O=C(NCCC1CS(=O)(=O)C1)NCc1ccc(N2CCOCC2)cc1 1321714619 ZOEDKLZVHCNTTB-UHFFFAOYSA-N 367.471 0.757 10 10 FCCE COc1ccc(CNC(=O)[C@H](CO)NC(=O)c2cccc(F)n2)c(O)c1 1448370564 FZENRPVXJOSZMM-ZDUSSCGKSA-N 363.345 0.342 10 10 FCCE C=CC(=O)N(CC)CC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCC 1556102142 SQRANHLSOOVAIT-ZDUSSCGKSA-N 364.398 0.723 10 10 FCCE O=C1NC[C@@H](Cn2cc(C(=O)NCc3cc(Cl)ccc3O)nn2)O1 1640924490 OITZQWJQKSLYOA-JTQLQIEISA-N 351.750 0.676 10 10 FCCE CN(CCS(C)(=O)=O)c1cc2c(cc1Br)[C@H](N)C(=O)N2 123614860 BPHWQBSZVVTVFT-NSHDSACASA-N 362.249 0.882 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@]3(O)CCSC3)CC2)cc1 270794025 HSNOPIKXUOYIGY-GOSISDBHSA-N 365.499 0.801 10 10 FCCE Cc1ccc(C(=O)NC[C@]2(CO)COCC3(CCC3)N2C)c(O)c1O 529749410 AJWMSMOIFNWNAL-SFHVURJKSA-N 350.415 0.752 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCNC(=O)CC3)cc2)C1 729599776 UAGFEGYCMOLEDR-OAHLLOKOSA-N 373.457 0.420 10 10 FCCE CNC(=O)c1cc(S(=O)(=O)Nc2ccc(O)cc2C(=O)OC)cn1C 775286987 TUCGUGIHLLYCJJ-UHFFFAOYSA-N 367.383 0.678 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCCS(=O)(=O)N(C)C)C2)cc1 852347811 INTPHBYRUDCYKH-ZDUSSCGKSA-N 370.475 0.465 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C[C@H]4C(=O)OC[C@H]4C3)CC2)cc1 860156360 LOKGHWBDTOPGTO-RHSMWYFYSA-N 359.426 0.449 10 10 FCCE CC[S@@](C)(=O)=NS(=O)(=O)NCc1ccc(N2CCOCC2)cc1 866581503 AIPZEKQHUHRHOF-JOCHJYFZSA-N 361.489 0.975 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1CCCn2nncc2C1 1334501401 HLDORGJDAVWVAJ-UHFFFAOYSA-N 366.472 0.766 10 10 FCCE COC(=O)[C@@H]1CCCN(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)C1=O 1611430323 BMUAIESSUHWIJP-WCQYABFASA-N 364.398 0.557 10 10 FCCE CN(C)c1ccc([C@@H](NC(=O)[C@@H](N)CCC(N)=O)c2nccn2C)cc1 1866105556 MTZXRCQOMWDJKJ-GOEBONIOSA-N 358.446 0.285 10 10 FCCE Cn1c(=O)c(C2=NNC(=O)/C2=C/Nc2ncccn2)c(O)c2ccccc21 100261110 ZLUIGLYKZHBKBS-PKNBQFBNSA-N 362.349 0.864 10 10 FCCE C[C@@H]1CO[C@H](CO)CN1c1cc2c(cc1Br)[C@@H](N)C(=O)N2 221139192 WCYXLNDCHUNNLS-BFHDXFOESA-N 356.220 0.987 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C(=O)N(C)CC3CC3)CC2)cc1 285825126 UJUNPAWIHZTBHL-UHFFFAOYSA-N 374.485 0.802 10 10 FCCE Cn1cnc2c1c(=O)n(CCCOC(=O)c1cccc(O)c1O)c(=O)n2C 776279716 MOHJXWAKSUDLRV-UHFFFAOYSA-N 374.353 0.092 10 10 FCCE COc1cccc(CNC(=O)N[C@@H]2CCC[C@H]2CNS(C)(=O)=O)c1O 800747765 PZDRQLOJKNRZKI-WCQYABFASA-N 371.459 0.918 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3cc(C)ncn3)C2)cc1 828196928 RHLZXBLVEMJGFN-CQSZACIVSA-N 369.425 0.805 10 10 FCCE CN1CCO[C@H](CS(=O)(=O)NCCCSc2nccs2)C1 866782426 TVOPAAQGRBCJGZ-NSHDSACASA-N 351.519 0.875 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)N[C@H]([C@@H](N)Cc2ccc(O)c(O)c2)C1 1952970883 NHIUAKOECKEEHB-RYUDHWBXSA-N 351.403 0.703 10 10 FCCE COc1cccc(O)c1CNC[C@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C 2333602524 JYBJMBLTZQCWHQ-DUVNUKRYSA-N 368.430 0.832 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC[C@H](O)C(F)(F)F)c1 748417001 ALBJBNHMYJGRHF-JTQLQIEISA-N 356.322 0.807 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1CCO[C@@]2(CCOC2)C1 806279018 BTLZLNXRGQDOGB-HNNXBMFYSA-N 371.484 0.759 10 10 FCCE CC(=O)C(=O)COC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O 808497870 HFWHMHYHNRYLKA-QGHHPUGFSA-N 352.387 0.825 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@]34CCNC4)CC2)cc1 829504286 CVQSKMQDWVTEFP-ICSRJNTNSA-N 358.486 0.933 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCC(=O)N3CCNCC3)C2)cc1 851662006 SZJDDLHQZNFEMH-AWEZNQCLSA-N 361.446 0.005 10 10 FCCE C[C@H]1CCNC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 851689511 PXAWQXJSPCVANA-KBXCAEBGSA-N 374.485 0.378 10 10 FCCE Nc1ccc(CCNC(=O)N2CCN(C(=O)N3CCNCC3)CC2)cc1 861640504 MDATZKPDYISSLB-UHFFFAOYSA-N 360.462 0.164 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)N[C@@H]1[C@H]2COC[C@H]21 1330501455 YULMKSCCTRQVQZ-FVQHAEBGSA-N 359.426 0.025 10 10 FCCE Cc1cn2nnc(C(=O)NCc3ccc(N4CCOCC4)cc3)c2c(O)n1 1464447102 AKDXZXDEUXEJMH-UHFFFAOYSA-N 368.397 0.905 10 10 FCCE COC(=O)[C@H]1CCCN(CC(=O)N[C@H](C)c2cc(OC)ccc2O)C1=O 1465993184 OSRTXHSRXOKMJM-YPMHNXCESA-N 364.398 0.990 10 10 FCCE Nc1cc2c(cc1N(Cc1ccccc1)CC1(O)CNC1)NC(=O)CO2 1876216107 UZTYPTDGPUMNPG-UHFFFAOYSA-N 354.410 0.941 10 10 FCCE CC(C)(C)OC(=O)N1CC(NCc2ccc(O)c(O)c2O)(C(=O)O)C1 1913949753 BPJGZPSMTCBLSJ-UHFFFAOYSA-N 354.359 0.967 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1CNC(=O)CN1 1952208847 NSYHPRKLZYEMLH-RYUDHWBXSA-N 351.403 0.622 10 10 FCCE CC(C)(C)OC(=O)N1CC(CNC(=O)c2ccc(O)c(O)c2)(C(N)=O)C1 2118187637 SDAHFUSSODYEJM-UHFFFAOYSA-N 365.386 0.550 10 10 FCCE NCc1cc(F)c(N2CC3(CNS(=O)(=O)C3)C2)cc1Br 2176158970 ZJEADLIPMKEQKS-UHFFFAOYSA-N 364.240 0.786 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCCN(C)C3=O)CC2)cc1 294796216 TZHYCAZGEVNQNW-SFHVURJKSA-N 374.485 0.802 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)[C@@H]1CCN(S(C)(=O)=O)C1 814171735 RAUBLZVTZDLQRC-QGZVFWFLSA-N 353.488 0.989 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCN(CCO)C[C@H]3C)nc12 832781641 CXOJVUIEZLDGPN-GFCCVEGCSA-N 363.418 0.110 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCn4c(O)nnc4C3)C2)cc1 854298246 YRGVAIPSCSNLCE-LBPRGKRZSA-N 358.402 0.796 10 10 FCCE O=S(=O)(C[C@H]1CNCCO1)NCc1ccc(N2CCC(O)CC2)cc1 866778721 JCACJMONRYDJSU-QGZVFWFLSA-N 369.487 0.056 10 10 FCCE C[C@]1(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CCNC1=O 1141996084 IBEGAEHZZSLKJI-LIRRHRJNSA-N 358.442 0.531 10 10 FCCE CCOc1cccc(CNCCC(=O)NCCN2CCOCC2)c1O 1857859905 MGJGDCBMPLYKIK-UHFFFAOYSA-N 351.447 0.719 10 10 FCCE CN(C(=O)OC(C)(C)C)C1(C(N)=O)CN(C(=O)Cc2ccc(N)cc2)C1 2109489378 NZYLGPSQBPKKHL-UHFFFAOYSA-N 362.430 0.745 10 10 FCCE COc1ccc2c(c1)c1c(n2CC(=O)N2CC[C@](O)(C(N)=O)C2)CCCC1 651860882 BPJWZZCZCTZABN-HXUWFJFHSA-N 371.437 0.977 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N[C@H]3CCCCNC3)C2)cc1 818678207 WWSOPNUERDRMOE-HOTGVXAUSA-N 374.485 0.896 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)Cc3cnnn3C)CC2)cc1 824285420 IKWUYJNVKYJUGV-UHFFFAOYSA-N 358.446 0.305 10 10 FCCE C[C@@H](NC(=O)N1CCOC2(CNC2)C1)c1ccc(N2CCOCC2)cc1 841742400 XBOAFXSHGKPFPW-OAHLLOKOSA-N 360.458 0.968 10 10 FCCE CN(C)c1ccc([C@@H](N)CNC(=O)C2(n3cnnn3)CCOCC2)cc1 852792154 SLZOUYJFMFWKNJ-HNNXBMFYSA-N 359.434 0.061 10 10 FCCE COC(=O)[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H](C)O1 859650721 ADHGKCPUTXNWJW-PBHICJAKSA-N 363.458 0.973 10 10 FCCE COc1ccc(CNC(=O)CN2CCCC3(CC3)S2(=O)=O)c(O)c1 1347018331 JGPUPCHGPROVMB-UHFFFAOYSA-N 354.428 0.975 10 10 FCCE O=C(CNC(=O)c1ncccc1O)NCc1ccc(N2CCOCC2)cc1 1597493366 HSIOAWOKFOWCMS-UHFFFAOYSA-N 370.409 0.670 10 10 FCCE COC(=O)CCNC(=O)CCNC(=O)NCc1cccc(OC)c1O 1637563008 BBYMWNUNDAVFIP-UHFFFAOYSA-N 353.375 0.269 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCO[C@H](C2CC2)C1 788313371 RQSQTUAEBSLRAS-SFHVURJKSA-N 373.453 0.777 10 10 FCCE COc1ccc(N2CC[C@@H](CNC[C@@H](O)CN3CCN(C)CC3)C2)cc1 819379738 KULIZDTYZUZIIG-PKOBYXMFSA-N 362.518 0.719 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CS(=O)(=O)N(C)C 785084715 FFHHVKVCZOAGDU-UHFFFAOYSA-N 355.460 0.373 10 10 FCCE O=C1N[C@H](CCF)C(=O)N1Cc1ccc(N2CCS(=O)(=O)CC2)cc1 849359067 JJXKJUJTELWOKT-CQSZACIVSA-N 369.418 0.701 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3nnn(C)c3C)C2)cc1 850537398 QAXKMHWHKHOZAQ-LBPRGKRZSA-N 358.402 0.466 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(CCCF)CC2)c1 862112610 PSYKSIZWTCTJDT-UHFFFAOYSA-N 359.423 0.881 10 10 FCCE CN1C2(CCC2)COC[C@@]1(CO)CNC(=O)/C=C/c1ccc(O)c(O)c1 862641928 DWURXAGZSUXDFC-OQBYNLHGSA-N 362.426 0.843 10 10 FCCE NS(=O)(=O)c1n[nH]cc1C(=O)NCc1cc(Cl)cc(Cl)c1O 1298840617 FBSBDURFAGBBGK-UHFFFAOYSA-N 365.198 1.000 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C[C@@H]3CCC(=O)NC3)cc2)CC1 1652071408 WVEQRPHTWQZWRE-HNNXBMFYSA-N 372.469 0.921 10 10 FCCE COc1ccc(N2C[C@@H](NC(=O)C(F)(F)F)C[C@@H](C(N)=O)C2)c(N)c1 2106883904 VWGUQZKTMBNRQE-BDAKNGLRSA-N 360.336 0.636 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2127629460 IZUVKJOTHMTJER-CYDGBPFRSA-N 369.422 0.876 10 10 FCCE O=C1NC(=S)N(CCC2=CCCCC2)C(=O)C1=CNN1CCOCC1 2296929623 PXSZZEJXNPLINM-UHFFFAOYSA-N 364.471 0.841 10 10 FCCE CC(=O)OC[C@@H]1O[C@@H](OC(C)=O)[C@@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@@H]1OC(C)=O 12379895 QKGHBQJLEHAMKJ-ODXJTPSBSA-N 373.318 0.380 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCc1nnnn1C 772096928 MYCFQTVSKXIQAB-UHFFFAOYSA-N 359.434 0.431 10 10 FCCE COc1ccc(CNC(=O)N[C@H]2CCC[C@@H]2CNS(C)(=O)=O)c(O)c1 800055036 MHBWGDQXYTYURO-RISCZKNCSA-N 371.459 0.918 10 10 FCCE COC[C@@H](OC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 824285357 GJXLCTQHNSNMIN-QGZVFWFLSA-N 351.447 0.595 10 10 FCCE COC[C@H](NC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)C1CC1 828579742 WBXDLXKSKDHVRZ-PBHICJAKSA-N 361.442 0.931 10 10 FCCE COc1ccc(N2CCN(CCCNC(=O)[C@H]3C[C@H]3C(N)=O)CC2)cc1 1182376377 AHLJCKRTDTYVGH-SJORKVTESA-N 360.458 0.445 10 10 FCCE CN(Cc1ccccc1O)C(=O)NCCc1nnc2c(=O)n(C)ccn12 1471366596 HYHKZPXFZIHLOO-UHFFFAOYSA-N 356.386 0.518 10 10 FCCE C[C@H](O)[C@H](NC(=O)C1CCCC1)C(=O)NCCc1ccc(O)c(O)c1 1545669258 RNDJKRVAJJVJQK-ZBEGNZNMSA-N 350.415 0.812 10 10 FCCE CC(=O)C(=O)COC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2 808493893 GZYMRQQNZTYEAK-UHFFFAOYSA-N 356.352 0.323 10 10 FCCE COC(=O)[C@H](NCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccnn1C 830388449 HIOAJPYREOYWLX-GOSISDBHSA-N 373.457 0.948 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1O 843425730 HDJDAEWKLFXFFS-HNNXBMFYSA-N 372.399 0.699 10 10 FCCE COCCN1CC[C@H](NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 850355632 IRFDCKLEAGWKEF-KRWDZBQOSA-N 367.515 0.732 10 10 FCCE NCC12CC(CN1C(=O)C(=O)NCc1ccc(N3CCSCC3)cc1)C2 851686412 NKZJRMGQOVACOU-UHFFFAOYSA-N 374.510 0.806 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN(C)[C@H]3C[C@@H](C(=O)OC)C3)nc12 852696790 RHOIXKZZGOTYMV-KLPPZKSPSA-N 362.386 0.995 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)CCNC(=O)[C@H]3CCCN3)C2)cc1 852844374 TWMDWKHSFCIUTG-WMLDXEAASA-N 360.458 0.648 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)Cn3[nH]cc4c(=O)ncnc3-4)C2)cc1 855232235 RNKWZCPGGAYOTN-GFCCVEGCSA-N 368.397 0.475 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC(F)(F)C[C@@H]1CO 1323279668 QYGPSIVIYQQXEA-CQSZACIVSA-N 355.385 0.906 10 10 FCCE CS(C)(=O)=NS(=O)(=O)CCNC(=O)N1Cc2cccc(O)c2C1 1471377839 GQIQGAYDBHMVLK-UHFFFAOYSA-N 361.445 0.475 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)Nc1ccn(CC(=O)N2CCOCC2)n1 1543565758 UJWSKAABUUKEFG-UHFFFAOYSA-N 360.370 0.334 10 10 FCCE COC(=O)[C@H]1CCCN(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)C1=O 1611430320 BMUAIESSUHWIJP-AAEUAGOBSA-N 364.398 0.557 10 10 FCCE O=C(NCc1c(O)cccc1F)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 1638863236 KYJIWQFNRVEAEO-WDEREUQCSA-N 370.402 0.183 10 10 FCCE CN(C)C(=O)/C=C/C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1644863771 RSOXAXVEBVPUHB-BQYQJAHWSA-N 358.442 0.649 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2064132165 IECWPJKZVBUYOE-YFKTTZPYSA-N 355.395 0.629 10 10 FCCE COc1ccccc1N1C(=O)C(=CNCCCN(C)C)C(=O)NC1=S 2296124723 QMJVBAGINOFRGG-UHFFFAOYSA-N 362.455 0.868 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCO[C@@]2(CCOC2)C1 288442114 FGGAJUKUVABXAS-FQEVSTJZSA-N 371.437 0.697 10 10 FCCE C[C@@H](NC[C@@H](O)CN1CCN(C)CC1)c1ccc(N2CCOCC2)cc1 775258903 LYNURGUSCXCIBF-YLJYHZDGSA-N 362.518 0.782 10 10 FCCE CNC(=O)[C@H]1CN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCO1 852453937 MKBIXXKWICZFDQ-XJKSGUPXSA-N 362.430 0.430 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](OC)C(=O)O)CC2)cc1 901718693 XKKXRMMQVWAVFV-OAHLLOKOSA-N 351.403 0.033 10 10 FCCE CN1C[C@H](O)C[C@]1(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 909856536 NQCQPRPLNGIJRA-FZKQIMNGSA-N 369.412 0.873 10 10 FCCE NC(=O)C12CCC(CC1)N2C(=O)C(=O)NCc1ccc(N2CCCC2)cc1 929523263 HLPKMZHQOVUYSK-UHFFFAOYSA-N 370.453 0.912 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)Cn3ncn4nccc4c3=O)C2)cc1 1328437406 FDFWBHFZHIMXPQ-ZDUSSCGKSA-N 368.397 0.295 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCC3(C2)OCCO3)c1 1637395958 TZPDGBMBFWDGFA-LLVKDONJSA-N 356.400 0.789 10 10 FCCE COC[C@@H](O)CNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 265417240 VGFAQGUSUZQWTN-AWEZNQCLSA-N 355.410 0.593 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCNC(=O)CC3)cc2)C1 815074399 RKTWHRWMYIIOKT-CVEARBPZSA-N 372.469 0.921 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CC(N4CC[C@@H](O)C4)C3)C2)cc1 854296962 LWAGPWLXVJUBRO-RHSMWYFYSA-N 360.458 0.734 10 10 FCCE COc1cc(O)c(CN2CC[C@@H](N3C(=O)O[C@H]4CNC[C@H]43)C2)cc1OC 872256470 UOUCUSWAEMUCDL-XNJGSVPQSA-N 363.414 0.776 10 10 FCCE CCCC(=O)NCC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918373070 RSMYFYVZOAUGNO-OAHLLOKOSA-N 360.458 0.921 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)NCC(C)(C)F)cc2)CC1 1334621882 DCIYLVMZGNAFSN-UHFFFAOYSA-N 350.438 0.919 10 10 FCCE C[C@@H](NC(=O)CCS(=O)(=O)N(C)C)c1ccc(N2CCOCC2)cc1 1442411629 LWFMSMWXLDWXBS-CQSZACIVSA-N 369.487 0.982 10 10 FCCE COc1cc(C(=O)N[C@@H](C)CN(C)C(=O)[C@@]23COC[C@@H]2C3)cc(OC)n1 1487799366 SPVQRGHUXTTZJM-FNFWKMNBSA-N 363.414 0.712 10 10 FCCE C[C@H](NC(=O)NCCCS(N)(=O)=O)c1ccc(N2CCOCC2)cc1 1674000501 GQPKWJVVFPWDGU-ZDUSSCGKSA-N 370.475 0.562 10 10 FCCE CC(C)(C)OC(=O)NCC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O 2059475802 SQRDBJKNBYWNKZ-JTQLQIEISA-N 354.359 0.734 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CC(O)C1 2059524264 UABUBOYIAKQAHX-LBPRGKRZSA-N 352.387 0.737 10 10 FCCE COC(=O)CN(CC(=O)N1CCN(c2ccc(OC)cc2)CC1)C1CC1 267628564 DJJMWQRLGFAIOP-UHFFFAOYSA-N 361.442 0.981 10 10 FCCE C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C[C@@H](C)S1(=O)=O 811867311 RFSDOBXNZXYGHY-RKDXNWHRSA-N 355.372 0.938 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)C[C@H](C)NC(N)=O)cc2)CC1 847858112 HMLVANWASVHYHF-ZDUSSCGKSA-N 361.446 0.418 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCNC[C@@H]3C)C2)cc1 851688622 FDIQBKHONWVDQT-GRDNDAEWSA-N 360.458 0.504 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)NCC[C@@H]3CCOC3)cc2)CC1 897816301 JSQCSCAGVICVOU-QGZVFWFLSA-N 374.485 0.597 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](O)c1ccccn1 1138054016 UHPHJRRCIIMXOZ-XJKSGUPXSA-N 360.366 0.817 10 10 FCCE CNC(=O)C1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 1155603537 DXIMOPVFDGFMDM-UHFFFAOYSA-N 358.442 0.531 10 10 FCCE Cc1nn(CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(=O)o1 1441948136 RKPFRKORVLSSGG-CQSZACIVSA-N 373.413 0.163 10 10 FCCE CO[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@](C)(CO)C1 867702392 XQOJXXUUGXOLNG-QFBILLFUSA-N 363.458 0.709 10 10 FCCE COc1ccc(N2CCN(C(=O)CN(C)C3CS(=O)(=O)C3)CC2)cc1 931239263 FMYWBTIDECTWHK-UHFFFAOYSA-N 367.471 0.073 10 10 FCCE CC(C)C[C@H](CN)NC(=O)C(=O)C(=O)C(=O)NC[C@@H]1C[C@H]2C=C[C@H]1CC2 1329023455 HZEOMQIXROTWCP-ZQDZILKHSA-N 363.458 0.333 10 10 FCCE CCO[C@@H]1CN(C(=O)c2ccc(N=NC(N)=O)cc2)C[C@H]1CNCCO 1707152031 FHVOBLDUNPZNKK-UKRRQHHQSA-N 363.418 0.908 10 10 FCCE OC[C@@H]1C[C@H](NCc2cc(Br)cc(F)c2O)[C@H](O)[C@H]1O 2177947489 FZBUCDBLNYJBSQ-QNWTXNENSA-N 350.184 0.486 10 10 FCCE CC(=O)OC[C@@H]1O[C@@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O 616625455 NHNYHKRWHCWHAJ-MQLXINIDSA-N 373.318 0.380 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@H]4[C@@H](C3)[C@@H]4C(=O)OC)nc12 794963541 DWNGZDDXCNLDLD-IMRBUKKESA-N 360.370 0.462 10 10 FCCE CN(C)S(=O)(=O)n1ccnc1CNc1ccccc1OCCC(N)=O 811469455 DISZGYMORUDTLK-UHFFFAOYSA-N 367.431 0.404 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1CN(C)C(=O)[C@@H]1C 834857170 DQXBFQWKHFEODX-KBPBESRZSA-N 360.458 0.755 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCN[C@H](C)C3)C2)cc1 851689730 SISUQRAIOJOTMR-KFWWJZLASA-N 360.458 0.647 10 10 FCCE O=C(CN1CCn2nccc2C1)NCc1ccc(N2CCOCC2)c(F)c1 1196410153 NNQWZWXHXBUTFE-UHFFFAOYSA-N 373.432 0.991 10 10 FCCE NC(=O)CSCC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1299099966 QYBSVGGONVMRKU-UHFFFAOYSA-N 359.398 0.636 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C4CCC3(C(N)=O)CC4)nc12 1656328607 OZIWCXOMOFBZJC-UHFFFAOYSA-N 359.386 0.594 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc(O)c(O)c(O)c2)[C@H](O)C1 2132348908 VIYPBOHQPGJEAS-ZWNOBZJWSA-N 368.386 0.904 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](COc3nnc(=N)[nH]n3)O[C@H]2C1 2260766198 PAXQCZBYUWEJMS-AXFHLTTASA-N 352.395 0.472 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@H]1C(=O)NCc1ccccc1O 2331521559 CHYVIMHGATZSRZ-QLFBSQMISA-N 366.414 0.740 10 10 FCCE O=C(CN1CCOCC1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 280127294 LJZIYHVRGOSTHE-UHFFFAOYSA-N 365.405 0.262 10 10 FCCE CC(=O)N1CCO[C@H](C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 930744876 OPMRAHAXEYSIAV-KDOFPFPSSA-N 361.442 0.948 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2136334741 DMJSWOAOWRRERV-CYDGBPFRSA-N 369.422 0.876 10 10 FCCE CCOCCS(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 275326477 SZGVPWVNGMLZLM-UHFFFAOYSA-N 366.417 0.535 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCc3nc[nH]c3C2)c1 378307876 MKJQYXRQXNDOCL-SECBINFHSA-N 350.400 0.774 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCOC[C@H]1CCO 758380124 FSCQJQHIHWOCKA-OAHLLOKOSA-N 367.421 0.955 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCN3CCOC[C@@H]3C2)cc1F 803664421 INIRTYHBMMKREE-AWEZNQCLSA-N 364.421 0.051 10 10 FCCE CO[C@@H](CNC(=O)C(=O)NCCCSc1nccs1)[C@H]1CCOC1 828239450 OSPXTXAXGCSBHC-RYUDHWBXSA-N 373.500 0.909 10 10 FCCE CN(C)c1ccc([C@@H](N)CNS(=O)(=O)CCCS(C)(=O)=O)cc1 842784691 KZIATDOKBYVNKL-AWEZNQCLSA-N 363.505 0.107 10 10 FCCE CN1CC[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)S1(=O)=O 843769283 WTRLLEVSXIGNSD-OAHLLOKOSA-N 369.512 0.890 10 10 FCCE COC(=O)[C@]1(OC)CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 859560122 DSYGUBUJHXMWFT-IBGZPJMESA-N 363.458 0.975 10 10 FCCE Cn1cc(/C=C\C(=O)N2C[C@@H](CO)Cc3cccc(F)c32)c(=O)n(C)c1=O 911696278 LOZHZEBGXDGFEP-DGMVEKRQSA-N 373.384 0.434 10 10 FCCE O=C(NCc1cccc(Cl)c1O)NC[C@]12COCCN1C(=O)COC2 1254322261 BRTYWNAVYFWVCJ-MRXNPFEDSA-N 369.805 0.473 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@H](CNS(=O)(=O)C2CC2)C1 1298888228 NVUYBZYKEYQXFW-CYBMUJFWSA-N 368.455 0.961 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cn(C[C@@H]2CNC(=O)O2)nn1 1354372050 UKUWDWCEFUDMGW-LBPRGKRZSA-N 372.385 0.492 10 10 FCCE C[C@@H](O)[C@H](NC(=O)C1CCCC1)C(=O)NCCc1ccc(O)c(O)c1 1545669256 RNDJKRVAJJVJQK-BZNIZROVSA-N 350.415 0.812 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)CC(C)C)c1 1630366486 RGUCCWCHFNDNSC-FZMZJTMJSA-N 365.430 0.984 10 10 FCCE CC(C)(C)OC(=O)N1CC(CO)(C(=O)NCCc2ccc(O)c(O)c2)C1 2124126860 ZPHUKNNQRUYTNK-UHFFFAOYSA-N 366.414 0.986 10 10 FCCE CC(C)(C)OC(=O)NC1CC(O)(CNC(=O)c2cc(O)c(O)c(O)c2)C1 2132351716 ZMIDUMMWMBQWQF-UHFFFAOYSA-N 368.386 0.951 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2311715422 VKCGAKBRQJXPTA-DDHJBXDOSA-N 355.395 0.629 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@@H](C(F)F)C2)c1 801421817 GCPGCOZNSILCHL-LLVKDONJSA-N 350.343 0.870 10 10 FCCE CN(C)c1ccc([C@@H](N)CNC(=O)c2cnnn2C2CCNCC2)cc1 852791800 MRLXHYDPQLDEKO-INIZCTEOSA-N 357.462 0.698 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](O)c1ccccn1 1138054015 UHPHJRRCIIMXOZ-BBRMVZONSA-N 360.366 0.817 10 10 FCCE O=C(O)c1cnn2c(O)cc(CN3CCC(O[C@@H]4CCOC4)CC3)nc12 1333570837 BTQOHEDYPOYAOQ-CYBMUJFWSA-N 362.386 0.903 10 10 FCCE CN1C[C@@H]2CC[C@H](NC(=O)c3cc(NS(C)(=O)=O)ccc3O)[C@H]2C1 1529330062 XXEGSYUEKNWDBN-BPNCWPANSA-N 353.444 0.834 10 10 FCCE COCC(=O)N[C@H]1CCN(Cc2nnnn2-c2ccc(OC)cc2)[C@@H]1C 1566077990 VKQOSNVIQFRQSM-DOMZBBRYSA-N 360.418 0.396 10 10 FCCE CCn1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nn1 1626339615 WZGOUEXUOWKQQJ-AWEZNQCLSA-N 356.430 0.930 10 10 FCCE COc1ccc(N2CCN(C(=O)Cc3nonc3OCCO)CC2)cc1 1872638002 JZYSGGJWTNNVNZ-UHFFFAOYSA-N 362.386 0.341 10 10 FCCE Cn1cccc1-c1noc(CNC(=O)CN2C(=O)CSC2=S)n1 238853471 JRWLTKGNYXLBDV-UHFFFAOYSA-N 351.413 0.552 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CN1CCOCC1=O 279606641 GSKVRYAZZYRGKC-UHFFFAOYSA-N 370.789 0.406 10 10 FCCE O=C(CCOC1CNC1)NCc1ccc(N2CCC(O)CC2)c(F)c1 827369843 PGTQSMUHFSRXIR-UHFFFAOYSA-N 351.422 0.782 10 10 FCCE CC[S@@](=O)CCNC(=O)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 828082169 CERGVKNQKWTUDG-ZJWNCGCPSA-N 367.471 0.275 10 10 FCCE CCNS(=O)(=O)CCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 852085349 AMNMULPRSUTRJJ-CYBMUJFWSA-N 370.475 0.512 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N(C)Cc3cc[nH]n3)cc2)CC1 898326542 PUIMENTUJZVXHH-UHFFFAOYSA-N 370.457 0.436 10 10 FCCE O=S(=O)(NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCCNC1 923659547 WWJHTPSETZITCF-QGZVFWFLSA-N 353.488 0.819 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCC(N2CCOC2=O)CC1 1119023745 VYTYBNROFCWEGF-UHFFFAOYSA-N 359.382 0.678 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCNC1=O 1638030363 KGIXROGTTBHNQV-RYUDHWBXSA-N 350.371 0.214 10 10 FCCE CCS(=O)(=O)c1cnc(O)c(C(=O)NCc2ccc(O)cc2O)c1 1643104208 QFLFVTLFIKAJKA-UHFFFAOYSA-N 352.368 0.922 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2068565496 CVOYZLFVPUAUSJ-SKDRFNHKSA-N 354.359 0.513 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNCc1ccc(O)c(O)c1O 2225620949 AJNQRNBCTDPDTJ-OSMZGAPFSA-N 370.402 0.234 10 10 FCCE O=C1NC(=S)S/C1=C/c1c(NCCCO)nc2ccccn2c1=O 102836363 FTZINFSJGJVNTL-CSKARUKUSA-N 362.436 0.978 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NC[C@H](CO)c2cccnc2)c1 807850720 KQAKZTVVQIMUGT-GFCCVEGCSA-N 365.411 0.665 10 10 FCCE O=C(C(=O)N1CC[C@@]2(O)C[C@H]2C1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1327288130 VKQBJVFYEGVVRG-TWOQFEAHSA-N 374.437 0.883 10 10 FCCE O=C(CC1CS(=O)(=O)C1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1444734452 HUMDYPYLEOVCRB-UHFFFAOYSA-N 370.446 0.838 10 10 FCCE CCc1nnc(N2CCNC(=O)C2)n1Cc1ccc(N2CCOCC2)cc1 1546543497 JOBFJYXPUGQLNP-UHFFFAOYSA-N 370.457 0.662 10 10 FCCE CNS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccc(O)c(O)c2)c1 1556890989 BMNOADBHNBBLKY-UHFFFAOYSA-N 352.368 0.893 10 10 FCCE CS(=O)(=O)N1CC[C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)C1 1623065736 GNLKOOVXHVXPMI-JTQLQIEISA-N 353.404 0.860 10 10 FCCE CN(Cc1ccc(N)cc1)C(=O)[C@@H]1[C@@H](O)[C@@H](O)CN1C(=O)OC(C)(C)C 2136173216 QIKMPSHRSBFKNC-KKUMJFAQSA-N 365.430 0.568 10 10 FCCE COc1ccc(O[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)C2)nn1 220403136 PDYKVGWDOQFYJI-VIFPVBQESA-N 368.440 0.325 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3c[nH]c(C(N)=O)c3)CC2)cc1 742919345 GBKPHKXRBXTBHD-UHFFFAOYSA-N 371.441 0.674 10 10 FCCE CN1C(=O)C(=O)N(CC(=O)NCc2cc(Br)ccc2O)C1=O 804738285 KFETWFYNVVWVFC-UHFFFAOYSA-N 370.159 0.192 10 10 FCCE COCCN1C[C@H](C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 855232573 SCHKKUSITWBYDR-HUUCEWRRSA-N 361.442 0.885 10 10 FCCE COc1ccc(N2CCCN(S(=O)(=O)C[C@H]3CNCCO3)CC2)cc1 866746991 NEJLKTKMGFAUTN-QGZVFWFLSA-N 369.487 0.526 10 10 FCCE CNS(=O)(=O)CCCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 868940878 ZNUAOPWPBRPDEQ-ZDUSSCGKSA-N 370.475 0.512 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H](C)c3nc(C)no3)C2)cc1 1118606180 KECBWSHODQKRFY-YPMHNXCESA-N 373.413 0.959 10 10 FCCE Cn1ccn2c(CCNC(=O)N3Cc4cccc(O)c4C3)nnc2c1=O 1638478619 DJJHVKBJYZXOLP-UHFFFAOYSA-N 354.370 0.402 10 10 FCCE COCCCNC(=O)CN(C)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 761872288 PQJUYNCFWKPMJF-UHFFFAOYSA-N 352.347 0.515 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)C3=NO[C@@H](CN)C3)CC2)cc1 852872410 GNOMICSZWNGAOW-MRXNPFEDSA-N 361.446 0.037 10 10 FCCE NC(=O)[C@H]1C[C@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C1 858773397 NBBRINXOQPGJJH-WKILWMFISA-N 360.458 0.958 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2CCNC(=O)CC23CCOCC3)cc1 872286249 YMCKLBHQGNXPON-UHFFFAOYSA-N 374.485 0.740 10 10 FCCE CCOC(=O)N1C[C@H](CO)[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C1 1304839094 IKWPKLCDKADPCH-FSMZVQOTSA-N 350.371 0.676 10 10 FCCE COCCc1cc(NC(=O)C(=O)NCCc2ccc(O)c(O)c2)n(C)n1 1324872081 SCAVGUHUFAKETB-UHFFFAOYSA-N 362.386 0.318 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)Cn3nccc3N)cc2)CC1 1644863790 SPKFZJUQNCEONY-UHFFFAOYSA-N 356.430 0.483 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H]1NCCNC1=O 1952208533 KICSMGFAAJUXNF-BXUZGUMPSA-N 351.403 0.622 10 10 FCCE CC(C)(C)OC(=O)N1CCS(=O)(=O)[C@H](C(=O)N2CC(N=[N+]=[N-])C2)C1 2020899782 LRLRSLVAPYEGBL-JTQLQIEISA-N 359.408 0.542 10 10 FCCE O=S1(=O)CCN(CCNCc2cc(Br)ccc2O)CC1 2184633921 BKZIAQYAOQRNOX-UHFFFAOYSA-N 363.277 0.975 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2331520083 IZUVKJOTHMTJER-FVCCEPFGSA-N 369.422 0.876 10 10 FCCE COc1cccc(CNC(=O)N[C@@H]2CCN(C3CCOCC3)C2=O)c1O 747594564 TZFDXUXVTXHQKP-CQSZACIVSA-N 363.414 0.980 10 10 FCCE COc1nn(C)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 789558667 SOJWEPWSASFVGS-UHFFFAOYSA-N 373.413 0.520 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CCNC(=O)CC3)CC2)cc1 815135226 RTKGUYXAXCAPNX-MRXNPFEDSA-N 374.485 0.850 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCn2nnc(CO)c2C1 821278843 HHGXLELKHCJZOO-UHFFFAOYSA-N 358.446 0.311 10 10 FCCE Cn1c(=O)c2cc(C(=O)NCc3cccc(Cl)c3O)cnc2n(C)c1=O 1159033161 CKHSOKOONYBRMB-UHFFFAOYSA-N 374.784 0.921 10 10 FCCE COc1cccc(CNC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)c1O 1622779947 YZDBQWRZGLXFSB-UHFFFAOYSA-N 366.399 0.161 10 10 FCCE CC(C)(C)C(=O)NCC(=O)OCCC(=O)NCc1ccc(O)cc1O 1643108366 ZYCQZTKKLNNQOK-UHFFFAOYSA-N 352.387 0.810 10 10 FCCE CC(C)(C)OC(=O)N1CC2(C[C@H](O)CN2C(=O)c2cc(O)nc(O)c2)C1 2130055519 QTUHBNDYFLFPMR-NSHDSACASA-N 365.386 0.689 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN2CCC[C@H](CS(N)(=O)=O)C2)c1O 278142076 BDTQEZPWLOBPFH-JTQLQIEISA-N 359.404 0.810 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CC[C@@H]2OCC(=O)N[C@H]2C1 374042974 COTHIMMHFDMUDB-IRXDYDNUSA-N 360.458 0.300 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H](N)C(F)(F)F)cc2)C1 827468722 CPZNPSQZPWFCEG-WCQYABFASA-N 358.364 0.894 10 10 FCCE CO[C@@H](CNC(=O)C(=O)NCCCSc1nccs1)[C@@H]1CCOC1 828239447 OSPXTXAXGCSBHC-NEPJUHHUSA-N 373.500 0.909 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCCNS(C)(=O)=O)C2)cc1 851943887 HIMUOIOQGVMROY-GFCCVEGCSA-N 356.448 0.122 10 10 FCCE CCOCc1cc(CNC2CN(S(=O)(=O)N(C)C)C2)ccc1OC 858312054 TVZXJEMVBFNCNC-UHFFFAOYSA-N 357.476 0.812 10 10 FCCE CNC(=O)NC[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CCO1 858683818 LAXOEVDLXGLHMS-SECBINFHSA-N 365.346 0.060 10 10 FCCE COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CCN[C@H]3C)CC2)cc1F 1330056843 OENVEGVPTFGQIH-SWLSCSKDSA-N 364.421 0.350 10 10 FCCE C[C@@H](NC(=O)Cn1cnnn1)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1440710854 GBNZRSUPACNHTM-CQSZACIVSA-N 371.445 0.437 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)CCc3nn[nH]n3)cc2)CC1 1638587457 ORSGDOIXRFZLLU-UHFFFAOYSA-N 357.418 0.117 10 10 FCCE COc1ccc(CNC[C@H](O)CNC(=O)[C@H]2CC[C@@H](C(N)=O)C2)cc1C 1667888370 NEUIUNFTJSYHBK-PMPSAXMXSA-N 363.458 0.472 10 10 FCCE C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)N(C)CC(=O)NC1CC1 759597823 SJKYHKSGECOAOZ-VUQUXZKVSA-N 362.382 0.780 10 10 FCCE C[C@H](NC(=O)C(=O)N[C@@H]1CCCCNC1)c1ccc(N2CCOCC2)cc1 842123427 KLVHFCGACSZZNR-DOTOQJQBSA-N 374.485 0.959 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNC[C@H](O)C(C)C)CC2)cc1 843080045 DKRHLZJVBQHIQG-HKUYNNGSSA-N 351.491 0.785 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cn1nc(C)oc1=O 1466398124 IOXHPPNENWSWTG-UHFFFAOYSA-N 369.761 0.706 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)CCN(C)C1=O 1633473936 XVQYJPWGHXREGH-SGTLLEGYSA-N 364.398 0.557 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]4CCNC(=O)[C@@H]43)nc12 1659924742 ADTXFBGTOVJMQA-XHDPSFHLSA-N 373.413 0.712 10 10 FCCE COc1ccc(N2CCN(S(=O)(=O)[C@H]3CCS(=O)(=O)C3)CC2)cc1 1890877572 HJOUECNDQCFNKQ-HNNXBMFYSA-N 374.484 0.334 10 10 FCCE CN(CCCN=[N+]=[N-])C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C[C@@H]1O 2076820620 KDYKNJNFSFIMLV-XHDPSFHLSA-N 357.411 0.878 10 10 FCCE O=S1(=O)C[C@@H]2[C@H](C1)NCCN2Cc1ccc(Br)cc1O 2143712082 IUASEWHMJNIFNH-NWDGAFQWSA-N 361.261 0.726 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNC(=O)c1cccc(O)c1O 2225627438 MXCDTEMPJCWYJP-OSMZGAPFSA-N 368.386 0.169 10 10 FCCE COc1ccc(N2CCN([C@H](CNC(=O)C(N)=O)c3ccco3)CC2)cc1 49486598 BWSSKIGBXOUJDA-MRXNPFEDSA-N 372.425 0.753 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H]2CCC(=O)N(C)C2)cc1 283985296 JIGLFABPLRHLFQ-HNNXBMFYSA-N 360.458 0.886 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3cccnn3)C2)cc1 828276206 HVXUXIOTWPWWIC-CQSZACIVSA-N 355.398 0.497 10 10 FCCE COc1ccc(N2CCN(CN3C(=O)[C@@H]4[C@H]5C=C[C@@H](O5)[C@@H]4C3=O)CC2)cc1 839948873 LEPFRBXKXCNZQR-TVFCKZIOSA-N 369.421 0.713 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H]3CN(C)CCN3C)C2)cc1 852092894 WTTCMVAGMKCGQO-NVXWUHKLSA-N 361.490 0.819 10 10 FCCE COc1ccc(CNC[C@@H](O)CS(C)(=O)=O)cc1Cn1cccn1 922825676 OQMKZMHRQFSSBX-OAHLLOKOSA-N 353.444 0.435 10 10 FCCE Cn1cc(CNC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)nn1 1118274910 ZYKMKYQYCUXMOI-UHFFFAOYSA-N 374.470 0.301 10 10 FCCE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCCN1CCNC(=O)C1 1680005554 WLYZHFFWDVRWDW-UHFFFAOYSA-N 359.474 0.860 10 10 FCCE C[C@H](O)CN(CCNC(=O)OC(C)(C)C)C(=O)c1cc(O)nc(O)c1 2257632725 DNGFWEJZJSCZKI-JTQLQIEISA-N 355.391 0.841 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)c3cncnc3N)cc2)CC1 192387335 YAAVPXXZZNMWTI-UHFFFAOYSA-N 354.414 0.657 10 10 FCCE C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 769709615 OOUGIOQEAOSKMY-ZJUUUORDSA-N 355.416 0.490 10 10 FCCE COC(=O)c1ccc2c(c1)CCN2C(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 819798448 DHRDKVPWJLNSLB-FNORWQNLSA-N 369.377 0.473 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)CCc3cn(C)nn3)CC2)cc1 824285975 ZGXGCCMPZDGYIT-UHFFFAOYSA-N 372.473 0.695 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CNCC[C@@H]3C)CC2)cc1 842265292 DHMNGGZUFLTDSP-YJBOKZPZSA-N 374.485 0.848 10 10 FCCE C[C@H](C(=O)NCc1c(O)cccc1F)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 928706550 WVEBWGPQWNJAPN-LPCRZITISA-N 362.357 0.698 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@H]3CC[C@@H](C2)[S@]3=O)c1 1261842891 NZUFYIZMXLPROZ-WCBZVUCDSA-N 372.468 0.889 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCc3nn[nH]n3)cc2)C1 1544929702 LPVIUVWIIWDYHK-ZDUSSCGKSA-N 357.418 0.150 10 10 FCCE O=C(NCc1ccc(O)cc1O)[C@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1630306869 PDPSIBGBKQCBHR-VHSXEESVSA-N 353.318 0.937 10 10 FCCE C[N@+]1(CC2CC2)CC[C@]23c4c5ccc(O)c4O[C@H]2C(=O)C(=O)C[C@@]3(O)[C@H]1C5 1848440356 KRQKCPYXUDVUPX-MPRQEMDOSA-O 370.425 0.849 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)NCc1ccc(N)cc1 2080680679 CYUMTFCSJXBOFX-IHRRRGAJSA-N 351.403 0.226 10 10 FCCE O=S1(=O)C[C@H]2NCCN(Cc3ccc(Br)cc3O)[C@H]2C1 2143712081 IUASEWHMJNIFNH-NEPJUHHUSA-N 361.261 0.726 10 10 FCCE O=C1NC(=O)[C@@H]2[C@@H]1[C@@H](c1ccccc1O)N[C@]2(Cc1ccccc1)C(=O)O 247433210 VCMNEVBKUKRYCY-ASKKUZCQSA-N 366.373 0.991 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@@H](C)S(N)(=O)=O 841588882 HNEJLBYLBGDPIR-QWHCGFSZSA-N 356.492 0.968 10 10 FCCE CNC(=O)NC[C@@H]1CN(Cc2ccc(N3CCOCC3)c(F)c2)CCO1 862458523 FUTVNCDTAAJAKD-OAHLLOKOSA-N 366.437 0.792 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)NC[C@H]2CCN2C2CCOCC2)cc1 929237603 UARQUKDCFJIAHP-GOSISDBHSA-N 374.485 0.738 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C(=O)N[C@H]3COC(C)(C)C3)cc2)CC1 1333257272 ONIBYUJVAFCMTF-MRXNPFEDSA-N 374.485 0.738 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NOCCO 2070166966 LIMGFYJBVNCKPK-NSHDSACASA-N 356.375 0.574 10 10 FCCE CCOC(=O)C1=S=C(NC(=O)C(=O)Nc2cc(C)nn2CC)C=C1C 600076183 KDVZRANEGIHKMV-UHFFFAOYSA-N 364.427 0.825 10 10 FCCE CN(C)S(=O)(=O)N1CCC[C@@H](NCc2cc([N+](=O)[O-])ccc2O)C1 808424538 JYXBPXFBXRACFF-GFCCVEGCSA-N 358.420 0.661 10 10 FCCE CC(=O)C(=O)COC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O 808495172 IFFLPMVYLCMAJE-LBPRGKRZSA-N 359.334 0.777 10 10 FCCE COC[C@@H]1C[C@@H](O)CN1CC(=O)N1CCN(c2ccc(OC)cc2)CC1 844392769 FUVODVCFKZSXRH-DLBZAZTESA-N 363.458 0.425 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@H](NC(=O)C3CC3)[C@H](C)O)C2)cc1 855228206 XFZNJVFHMFEASX-RVSPLBMKSA-N 361.442 0.666 10 10 FCCE CCN1C[C@H](S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)CC1=O 866757094 JCBCVVUSQFNNLI-CABCVRRESA-N 354.476 0.293 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(C2CCOCC2)CC1 1118946038 POOOBYAJKUFRBD-UHFFFAOYSA-N 359.426 0.558 10 10 FCCE O=C(C(=O)N1CCC[C@@H](CN2CCOCC2)C1)N1Cc2cccc(O)c2C1 1119018784 HCLBGOOCGDQXFS-HNNXBMFYSA-N 373.453 0.805 10 10 FCCE O=C(/C=C/c1ccc(O)c(O)c1)N1CCO[C@@]2(CCS(=O)(=O)C2)C1 1326349034 YCLHWOXAGKCRRF-ICTCPBKTSA-N 353.396 0.527 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC1CS(=O)(=O)C1 1466674558 ZXXSDQGBQZRFDW-LBPRGKRZSA-N 371.411 0.123 10 10 FCCE COc1ccc(N2CCN(C(=O)C(=O)N3CCC(C(N)=O)CC3)CC2)cc1 1858107285 YTLJYTDUVGZDOW-UHFFFAOYSA-N 374.441 0.068 10 10 FCCE COc1ccc2c(c1)c1c(n2CC(=O)N2CC[C@@](O)(C(N)=O)C2)CCCC1 651860881 BPJWZZCZCTZABN-FQEVSTJZSA-N 371.437 0.977 10 10 FCCE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1CCN2CCOC[C@H]2C1 788936213 INVPDONZJISAQL-GOSISDBHSA-N 372.469 0.446 10 10 FCCE OCCO[C@@]1(CNCc2ccc(N3CCOCC3)c(F)c2)CCOC1 850358180 JJBLGYNLTSQJQC-GOSISDBHSA-N 354.422 0.920 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCCN3S(C)(=O)=O)C2)cc1 855230400 CWUJBVKNEQRSFS-XJKSGUPXSA-N 367.471 0.814 10 10 FCCE COC(=O)[C@@H]1C[C@H](N2C(=O)CNC2=O)CN1Cc1cc(C)c(C)cc1O 857057169 CNGMLSJOSMRSME-KBPBESRZSA-N 361.398 0.677 10 10 FCCE CC(C)(C)OC(=O)N1CC(O)(CCNC(=O)c2cc(O)c(O)c(O)c2)C1 1148586702 UTRAMJGXCQWKLQ-UHFFFAOYSA-N 368.386 0.905 10 10 FCCE O=C(CNS(=O)(=O)c1ccc(F)cc1)NCc1ccc(O)c(O)c1 1150378327 PIFMITKTRBRRFX-UHFFFAOYSA-N 354.359 0.832 10 10 FCCE Cn1cc([C@H]2CS(=O)(=O)CCCN2C(=O)c2cccc(O)c2O)cn1 1303543501 KZHOAKDKNWGXKU-CYBMUJFWSA-N 365.411 0.833 10 10 FCCE O=C1NC[C@@H](Cn2cc(C(=O)NCc3ccc(N4CCCC4)cc3)nn2)O1 1464076301 FKGFHVAQPHGIQP-HNNXBMFYSA-N 370.413 0.917 10 10 FCCE COc1cccc(CNC(=O)N[C@H]2CCN(c3cc(O)ncn3)C2)c1O 1471523925 LSANUQGNMRFQIV-LBPRGKRZSA-N 359.386 0.975 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC[C@@](O)(C(=O)OC)C2)c([N+](=O)[O-])c1 1472861403 CLOJRVGPZMDERP-NBUZRDOWSA-N 350.327 0.895 10 10 FCCE CN1C(=O)[C@H](O)[C@H](C(=O)NCc2c(O)cccc2F)[C@H]1c1cnn(C)c1 1558455729 XLPCXZOHFUMPAL-RBSFLKMASA-N 362.361 0.071 10 10 FCCE COCCCS(=O)(=O)NCC(=O)NCc1cccc(Cl)c1O 1653567435 ZKUOEDFFQMQNJF-UHFFFAOYSA-N 350.824 0.618 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1C[C@H](CNC(=O)c2cc(O)nc(O)c2)C[C@H]1O 2116224598 LLGHTACCFOCUJS-MVWJERBFSA-N 367.402 0.887 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2132348948 VUMBUKRHJNTGNV-QWRGUYRKSA-N 368.386 0.904 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1CNCc1cc(F)ccc1O 2218612933 GZNFUZBHXZMMHV-AEGPPILISA-N 356.394 0.962 10 10 FCCE CNS(=O)(=O)[C@@H]1CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])C1 372738280 GEVLVRMTPBJZMJ-FVOPLDGLSA-N 369.399 0.909 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)NCCCn2ccnn2)cc1 788975453 OTDUINLCBIVQPE-UHFFFAOYSA-N 358.446 0.947 10 10 FCCE NC[C@H]1CC(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)=NO1 852861203 QJPYXXHYRFJNDL-DZGCQCFKSA-N 359.430 0.108 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)c3nc(N)nc(N(C)C)n3)C2)cc1 855223463 AJGRPHDAYXUCCD-NSHDSACASA-N 357.418 0.537 10 10 FCCE CC(C)(C)OC(=O)N1CC(O)(CNC(=O)Cc2ccc(O)c(O)c2)C1 1448226931 KLFRXKPWKVKGDI-UHFFFAOYSA-N 352.387 0.738 10 10 FCCE O=C(CO)NCCC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632528 OKIHGSRXNFMCOZ-CQSZACIVSA-N 369.849 0.625 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCn2ncnc21 1611049934 SFUXVRGOMGJYAD-STQMWFEESA-N 374.397 0.857 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CO)c2ccccn2)c1 1637574109 DLCQMOXDKILVJR-CYBMUJFWSA-N 351.384 0.622 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NCc2ccccc2O)[C@@H](O)C1 1890526092 NWJPHBZAFHOBNB-KBXCAEBGSA-N 366.414 0.741 10 10 FCCE CC(C)(C)OC(=O)NCCC[C@H](NC(=O)c1cc(O)nc(O)c1)C(=O)O 2103251906 TUCPLKAQRXTWJS-JTQLQIEISA-N 369.374 0.981 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2132348946 VUMBUKRHJNTGNV-GHMZBOCLSA-N 368.386 0.904 10 10 FCCE COc1ccc(Br)c(CNC[C@H](C)S(N)(=O)=O)c1O 2227746602 NZOMRCIIWSYANE-ZETCQYMHSA-N 353.238 0.930 10 10 FCCE O=C1c2c(O)ccc(O)c2C(=O)c2c(NCCNCCO)ccc(O)c21 5161756 UHSACPVLAHYVQL-UHFFFAOYSA-N 358.350 0.573 10 10 FCCE COc1nccnc1O[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)C1 220030915 DTMCIOMOSRRHNK-SECBINFHSA-N 368.440 0.325 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@](O)(C(F)(F)F)C2)c1 265955810 JSQBIUVCSRJNQB-GFCCVEGCSA-N 368.333 0.903 10 10 FCCE CCOC(=O)[C@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)CCO1 741247393 OLUXSBNOMXRKLU-QGZVFWFLSA-N 363.458 0.975 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCN(C2CC2)C(=O)C1 839274058 XMQGBNSPFOFJLF-UHFFFAOYSA-N 359.426 0.964 10 10 FCCE C[C@H]1CCNC[C@H]1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 842190662 GDKDRSDMNKFYPQ-WMLDXEAASA-N 360.458 0.254 10 10 FCCE CCC[C@H](C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)S(N)(=O)=O 855223522 BCUPCZRQGWCNQK-IUODEOHRSA-N 355.460 0.847 10 10 FCCE CN1CCOC[C@@]1(CO)CNC(=O)NCc1ccc(N2CCCC2)cc1 914180537 PWIXKTQCHHVVQN-IBGZPJMESA-N 362.474 0.779 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N[C@H]2CCc3nnn(C)c3C2)cc1 929237569 KTKHUJFRJQIALA-ZDUSSCGKSA-N 356.430 0.171 10 10 FCCE CC(=O)c1cn(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)nn1 1135946347 OYVCADDTOCPSLX-UHFFFAOYSA-N 357.414 0.976 10 10 FCCE O=C(NCC1CC1)[C@@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1335547868 HEVQYHBGOQEISR-OAHLLOKOSA-N 371.437 0.999 10 10 FCCE CO[C@@]1(C(=O)O)CC[C@@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@@H](O)[C@@H]1O 2296515851 GYMHHXBFGSLWQB-UTXMOHQDSA-N 368.338 0.008 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCO[C@]2(CCOC2)C1 297981704 ZBUTYYAGKMOLOS-LJQANCHMSA-N 361.442 0.729 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCC[C@@H](C(N)=O)C2)c1 746885215 CXUOAQOSBYDRPD-NXEZZACHSA-N 355.416 0.538 10 10 FCCE CC(=O)N1CCN(C(=O)C(=O)NCCCSc2nccs2)[C@H](C)C1 806278487 SJCRIDKBBCTUTR-LLVKDONJSA-N 370.500 0.821 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)[C@H](O)Cc3cnn(C)c3)C2)cc1 819588187 KSQVLQNIXPHLNW-RDTXWAMCSA-N 358.442 0.975 10 10 FCCE C[C@@H](CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1)S(N)(=O)=O 823523625 HKJZZRPSSPUMDY-LBPRGKRZSA-N 370.475 0.124 10 10 FCCE CCc1cc(CNC(=O)C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)n[nH]1 828114259 PVBSNBLPBPNDKP-CQSZACIVSA-N 371.441 0.992 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N3CCN[C@@H](C)C3)CC2)cc1 841749160 AWWCYXFUKICRNX-INIZCTEOSA-N 361.490 0.821 10 10 FCCE CCO[C@@H]1CN(C(=O)C(=O)NCCCSc2nccs2)C[C@H]1CN 846331867 PKSRMYCEVXPEQU-VXGBXAGGSA-N 372.516 0.564 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H](O)c3cnn(C)c3)CC2)cc1 1464540288 JHQMHGSIEVLIMT-GOSISDBHSA-N 373.457 0.401 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@]3(C)CCC(=O)NC3)CC2)cc1 281597056 LXUMVAJVDDEYDX-HXUWFJFHSA-N 374.485 0.850 10 10 FCCE COc1cc(N2CCN(C(=O)CNC(N)=O)CC2)cc(OC)c1OC 759406875 YCNFMZTYMLNGHG-UHFFFAOYSA-N 352.391 0.029 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](NS(C)(=O)=O)C(C)C)C2)cc1 855227879 QVDVLXYMBIICKF-BBRMVZONSA-N 369.487 0.964 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CC(=O)N(CCN(C)C)C3)C2)cc1 855232654 WGTPGJCLAPGPJX-JKSUJKDBSA-N 374.485 0.800 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)NC[C@H]1C[C@@H]2COC[C@@H]2O1 930196986 CQFXZQXQKFVHPG-UTUOFQBUSA-N 371.484 0.662 10 10 FCCE Cn1c(=O)c2cc(C(=O)NCc3cc(Cl)ccc3O)cnc2n(C)c1=O 1165498813 SKNMEHZYOOOZHV-UHFFFAOYSA-N 374.784 0.921 10 10 FCCE CN(C)C(=O)[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1299321824 OVEAWXXJTWVCIY-JTQLQIEISA-N 355.416 0.314 10 10 FCCE COc1ccc(CNC(=O)N[C@H]2CCN(c3cc(O)ncn3)C2)c(O)c1 1565441348 CLKRKWXHIUXXQC-LBPRGKRZSA-N 359.386 0.975 10 10 FCCE NC(=O)[C@@H]1CC(C(=O)NCc2cc(O)ccc2O)=NN1c1ccc(F)cc1 1637122647 LOTUBCUKAXTVIG-HNNXBMFYSA-N 372.356 0.973 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)NCCc1ccc(N)cc1 2136169632 GHUDDFPQEADHKG-ZNMIVQPWSA-N 365.430 0.269 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H]2OC[C@H](C(=O)N3CC(N=[N+]=[N-])C3)O[C@H]2C1 2253906403 LUKAXSSCGBMNTR-SDDRHHMPSA-N 353.379 0.911 10 10 FCCE CC1(C)CN(C(=O)c2ccccc2SCC(N)=O)CCS1(=O)=O 268398274 RISDENRCPWXXAA-UHFFFAOYSA-N 356.469 0.913 10 10 FCCE CN(C)S(=O)(=O)[C@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 286287391 MFZHJKLMHJWXAZ-CFNZNRNTSA-N 354.428 0.993 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3ccc(=O)n(C)n3)CC2)cc1 299490766 GLIJIHNOKNRTIK-UHFFFAOYSA-N 371.441 0.341 10 10 FCCE CO[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)cc1C)[C@@H]1CCOC1 828437477 OMEKOLAOZSIULL-WBVHZDCISA-N 363.458 0.845 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)NCC[C@H]2CCNC2)cc1 846342532 DRXQUVSUTZLRIP-OAHLLOKOSA-N 362.474 0.706 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(=O)N1C[C@@H]2C[C@]2(CO)C1 1118052184 FDRZYHZNCSCXCJ-DKICVRJWSA-N 359.470 0.949 10 10 FCCE O=C(Cc1ccc(F)cc1)N[C@@H](CO)C(=O)NCc1c(O)cccc1O 1304053490 MHQKZIOHFHARJM-AWEZNQCLSA-N 362.357 0.573 10 10 FCCE NC(=O)C12CCC(CC1)N2C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1351302798 XPQYDSDPUUQBCN-UHFFFAOYSA-N 368.437 0.688 10 10 FCCE CN(C)c1ccc([C@@H](NC(=O)CC[C@@H](N)C(=O)O)c2nccn2C)cc1 1866021164 AKOHXOQHXGCTRT-GDBMZVCRSA-N 359.430 0.884 10 10 FCCE O=C(Cn1cnnn1)N1CCN(Cc2cc(Cl)c(F)cc2O)CC1 294069377 YHRLFNHKHGXEAA-UHFFFAOYSA-N 354.773 0.516 10 10 FCCE CNC(=O)[C@H]1CN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CCO1 852453936 MKBIXXKWICZFDQ-CZUORRHYSA-N 362.430 0.430 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H]1COCCN1C 858842118 MXFAPDWKYXKBBW-GOSISDBHSA-N 362.474 0.995 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](C)NC(=O)Cn1cnnn1 1142422643 KIXDLJZVNRTQST-UONOGXRCSA-N 373.461 0.300 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC[C@@]3(CNC(=O)C3)C2)cc1F 1327967059 AJVNNWQZKJQVHG-GOSISDBHSA-N 362.405 0.247 10 10 FCCE O=C1C[C@H](CCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CN1 1332814911 ZVGCAGGZCMNWQR-HNNXBMFYSA-N 358.442 0.545 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCCn2cccnc2=O)c1 1467811832 ONNANLWOACFOFT-UHFFFAOYSA-N 366.399 0.141 10 10 FCCE CCS(=O)(=O)N(C)CC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1616857948 BZTOZTDQPUVEMD-MRXNPFEDSA-N 370.519 0.753 10 10 FCCE O=C(NC[C@@H](O)CO)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1648282277 OEQYXDHOUCARSQ-SNVBAGLBSA-N 372.424 0.338 10 10 FCCE COCCNC(=O)[C@H]1C[C@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 242954430 HGVTVJCTKUODMI-DLBZAZTESA-N 361.442 0.743 10 10 FCCE CCOCCOCC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 744325738 YIDBXDALXIGCIM-UHFFFAOYSA-N 370.471 0.591 10 10 FCCE C[C@H](NC(=O)C(=O)N(C)CCCCO)c1ccc(N2CCOCC2)cc1 803308175 UGNKIDINSQQSRK-HNNXBMFYSA-N 363.458 0.931 10 10 FCCE Cn1cc(C(=O)NCc2cc(Br)ccc2O)c(O)nc1=O 804733584 UXHLBGCHVHTOEV-UHFFFAOYSA-N 354.160 0.884 10 10 FCCE C[C@H]1CCNC[C@@H]1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 842265976 FAVLOJRSZCVUCG-YJBOKZPZSA-N 374.485 0.596 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3cncnc3OC)C2)cc1 850537782 ULSNETFLQCBUIO-GFCCVEGCSA-N 371.397 0.827 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)S(=O)(=O)C[C@H]1CNCCO1 866744338 LHWLDDKDXZJZRF-QGZVFWFLSA-N 369.487 0.273 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCCN(CCF)C2)c1 898490482 IWPNOLPKBGKUFK-GFCCVEGCSA-N 359.423 0.927 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3C[C@@H]4CNC[C@]4(C)C3)CC2)cc1 923425148 IKWKLCBYTKUDRN-FBBABVLZSA-N 374.529 0.719 10 10 FCCE N[C@H]1CCCO[C@H]1C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1118976138 OQFITHZCRKHBKB-WMZOPIPTSA-N 373.453 0.979 10 10 FCCE COc1ccc(CNC(=O)NC[C@@]23COCCN2C(=O)OC3)c(O)c1 1313180520 OJRIFUZJXMBVHF-INIZCTEOSA-N 351.359 0.421 10 10 FCCE C[C@@H]1CN(c2ccc(CNC(=O)Cn3nnc(N)n3)cc2F)C[C@@H](C)O1 1441787975 RTHZLBLRWVZZOU-GHMZBOCLSA-N 363.397 0.324 10 10 FCCE CC(C)(C)OC(=O)NCCN(CCO)C(=O)Cc1ccc(O)c(O)c1 2255042498 CWFNWRVLBDJVTI-UHFFFAOYSA-N 354.403 0.986 10 10 FCCE CN1C(=O)C(=CNc2cccc(S(=O)(=O)N(C)C)c2)C(=O)N(C)C1=O 60861599 DNVZZVQXVLESSJ-UHFFFAOYSA-N 366.399 0.283 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCCN(C)C(=O)C3)CC2)cc1 191085265 RHENWTXSTQCZNE-UHFFFAOYSA-N 360.458 0.508 10 10 FCCE COCCNC(=O)[C@@H]1C[C@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 242954431 HGVTVJCTKUODMI-IAGOWNOFSA-N 361.442 0.743 10 10 FCCE CCN(CC)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 826593207 ALFYQEPAUZMQQR-OAHLLOKOSA-N 362.474 0.848 10 10 FCCE NS(=O)(=O)N1CCC[C@@H](C(=O)NCc2ccc3cccnc3c2O)C1 862025855 BMYDNTUEQJTOQK-CYBMUJFWSA-N 364.427 0.472 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)NCC3COC3)CC2)cc1 863353046 RLIGXZGIYQDKQQ-SREVYHEPSA-N 359.426 0.663 10 10 FCCE CO[C@]1(CO)CCCN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1330332570 AVZHNSAKRSVFHD-LJQANCHMSA-N 363.458 0.711 10 10 FCCE NC(=O)C1CCN(c2ccc(CNc3nccn4nnnc34)cc2)CC1 1559281583 BFOMMUZFCMBZRT-UHFFFAOYSA-N 352.402 0.833 10 10 FCCE C[C@@H](O)[C@H](NS(=O)(=O)c1cccs1)C(=O)NCc1ccccc1O 1566373924 MCONJMKKRQROFS-YGRLFVJLSA-N 370.452 0.798 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)NC[C@H]1[C@@H](N)Cc1ccc(O)c(O)c1 1952911366 RMQFSDCNJKPCBC-RYUDHWBXSA-N 351.403 0.703 10 10 FCCE CS(=O)(=O)C1CN(c2cc3c(cc2Br)[C@@H](O)C(=O)N3)C1 2152281619 RRJLZMYGHFRWIO-LLVKDONJSA-N 361.217 0.668 10 10 FCCE COc1ccc(N2CC[C@@H](NS(=O)(=O)CCS(C)(=O)=O)C2)cc1 849416707 VPZLMGPGCXOSCX-GFCCVEGCSA-N 362.473 0.238 10 10 FCCE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1C[C@@H]2COC[C@]2(C(=O)O)C1 852733759 YKZYLFYMJWKABV-DNVCBOLYSA-N 361.442 0.744 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1CC(F)(F)C[C@H]1CO 1117372837 CCFUMQWHNAJQEK-VIFPVBQESA-N 365.427 0.970 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CC[C@]2(CNC(=O)C2)C1 1323280164 SWJWPMPKVFRYLG-IBGZPJMESA-N 358.442 0.416 10 10 FCCE CN(CCCn1cnc2c(N)ncnc21)C(=O)Cc1ccc(O)c(O)c1 1570454384 DPGBAATWYVVOAT-UHFFFAOYSA-N 356.386 0.911 10 10 FCCE O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NCc1cc(O)ccc1O 1633595423 VNSQJWUGUUIPCS-UHFFFAOYSA-N 367.361 0.986 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@H]3C[C@H](C(N)=O)C3)cc2)CC1 1636986923 IPHPJYQIUDNBJS-SHTZXODSSA-N 373.457 0.451 10 10 FCCE CN(C)S(=O)(=O)N(C)CC(=O)NCc1c(O)ccc2ccccc12 1639387524 MWUGWERGIVNXGN-UHFFFAOYSA-N 351.428 0.900 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](O)CN(C(=O)c2cc(O)c(O)c(O)c2)C1 2132348280 ICJCSPOXPYTOCE-GHMZBOCLSA-N 368.386 0.904 10 10 FCCE CCC(=O)N1CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 823491900 CSFMAPVARJSAPR-UHFFFAOYSA-N 360.458 0.856 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCCN3C(=O)CNC3=O)C2)cc1 852108853 OHSQWNYRAUMWDR-GFCCVEGCSA-N 361.402 0.125 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccc(O)nn3)cc2)CC1 1155603491 BUKZXYLPWILTKC-UHFFFAOYSA-N 355.398 0.814 10 10 FCCE NC(=O)C1CCC(NC(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 1346127798 LSJSZOJKOUMSHG-UHFFFAOYSA-N 370.453 0.839 10 10 FCCE O=C(NCCc1ccc(O)c(O)c1)[C@H]1CS(=O)(=O)C[C@@H]1C(F)(F)F 1445938035 MVWYACNKSZKTRW-UWVGGRQHSA-N 367.345 0.980 10 10 FCCE CN1CC2(CN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)C2)OC1=O 1451675697 DRJFUXTYEOWDBU-UHFFFAOYSA-N 355.372 0.040 10 10 FCCE CC(C)NS(=O)(=O)NCCNC(=O)NCc1cccc(Cl)c1O 1634213885 LJSWWWAJIZBAGQ-UHFFFAOYSA-N 364.855 0.677 10 10 FCCE CN1C(=O)N[C@@]2(CCC[C@H]2CNC(=O)c2c(F)ccc(O)c2O)C1=O 1638421616 CSOWEGOPJJNJOE-ZKANADHPSA-N 351.334 0.687 10 10 FCCE CNCCNC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2080881569 WYYSPVFGELRZQI-LBPRGKRZSA-N 353.419 0.869 10 10 FCCE NC(=O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(O)c(O)c2)SC1=S 2314541066 DPLABDHOWARWSR-ZETCQYMHSA-N 368.392 0.628 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1cn(C)c(=O)n(C)c1=O 273135686 CULBRXPTRSPIOL-OKPNEXGHSA-N 359.382 0.256 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3C[C@@H]4C[C@@]4(CO)C3)cc2)C1 782945055 DCVCXMBAZAVDSN-GUXCAODWSA-N 372.469 0.912 10 10 FCCE CN1CCN(C[C@H](O)CNCc2ccc(N3CCOCC3)c(F)c2)CC1 818965539 BMLGLAYXKVCWFT-QGZVFWFLSA-N 366.481 0.360 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCO[C@@H]([C@H](C)O)C3)CC2)cc1 839671488 BDSOXOAKRPHJDC-MAUKXSAKSA-N 363.458 0.425 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN[C@H](CO)C3CCC3)CC2)cc1 852320517 LLQKNVMDWFEVME-UYAOXDASSA-N 363.502 0.929 10 10 FCCE Cc1nn(CCS(=O)(=O)N[C@H](C)c2ccc(N(C)C)cc2)c(=O)o1 914391866 NPNLKEKRWNVKKP-LLVKDONJSA-N 354.432 0.891 10 10 FCCE CN1CCN(c2ccc(CNC(=O)NCC[C@@H]3CNC(=O)C3)cc2)CC1 924004965 CSHVGCODDSJBQD-INIZCTEOSA-N 359.474 0.764 10 10 FCCE CN1CCN(CCCN(C)C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1329421994 GBXCMWXGRZANEO-UHFFFAOYSA-N 360.458 0.330 10 10 FCCE O=C(Cn1ccc(NC(=O)N2Cc3cccc(O)c3C2)n1)N1CCOCC1 1351333189 XKEPOSRNZVWDHB-UHFFFAOYSA-N 371.397 0.995 10 10 FCCE C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NCc2ccccc2O)cc1 1445972156 QDYAMWOEQHVGQI-LBPRGKRZSA-N 364.423 0.981 10 10 FCCE CC(=O)NC[C@H]1CCn2ncc(C(=O)NCc3ccc(O)cc3O)c2C1 1469158626 FFRWLPXUKLQZLF-LBPRGKRZSA-N 358.398 0.923 10 10 FCCE CSCc1n[nH]c(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)n1 1558402009 UAQQKXIREHWNRH-UHFFFAOYSA-N 371.444 0.675 10 10 FCCE CC(C)(C)OC(=O)NC1(C(N)=O)CN(C(=O)c2cccc(O)c2O)C1 2054397676 KOZPMZPPBDEZMD-UHFFFAOYSA-N 351.359 0.302 10 10 FCCE C[C@@H](CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)S(N)(=O)=O 799887437 YGEVCZZUDFMHIS-NSHDSACASA-N 374.438 0.139 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1CCO[C@]2(CCOC2)C1 807099393 UKNGRFJJYWKYAB-LJQANCHMSA-N 361.442 0.695 10 10 FCCE CN(C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CCOC1 820993239 VEKYGAAAYMATPP-INIZCTEOSA-N 367.471 0.852 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3C[C@@H]4C[C@H]3C[S@@]4=O)nc12 844433556 OFJXJCLUMDAONB-GYHOXLMVSA-N 350.400 0.317 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N[C@H]3CCNC3=O)CC2)cc1 852023946 QUPMMYZPQWZNSJ-INIZCTEOSA-N 361.446 0.005 10 10 FCCE CCON(C)C(=O)CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852397526 LHHGSNDNIWEGQJ-ZDUSSCGKSA-N 350.419 0.983 10 10 FCCE C[C@@H]1C[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2ncnn21 855328406 SZONDPHNJDKTKO-KCJUWKMLSA-N 351.388 0.791 10 10 FCCE CN1CCN(c2ccc(CNC[C@]3(CO)COCCN3C)cc2F)CC1 1119614528 CMNBBWMIXYASPW-IBGZPJMESA-N 366.481 0.360 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCc3nnc(C)n3C)C2)cc1 1334029963 AIRLRFBBSPUVOA-CYBMUJFWSA-N 372.429 0.143 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@@H](CO)[C@H](CCO)C1 1348483695 PLKZMLBTLPESHJ-SJORKVTESA-N 363.458 0.656 10 10 FCCE C[C@H](C(=O)NCc1cc(O)ccc1O)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 1558174973 VZXNWVRXCIYDCY-QWPVENPASA-N 360.366 0.265 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2068565494 CVOYZLFVPUAUSJ-CABZTGNLSA-N 354.359 0.513 10 10 FCCE CC(=O)C(=O)COC(=O)c1ccc(S(N)(=O)=O)c(Br)c1 808530361 RUSCAQILEPCFSJ-UHFFFAOYSA-N 364.173 0.411 10 10 FCCE O=C(CC1CS(=O)(=O)C1)NCc1ccc(N2CCC(CO)CC2)cc1 1118990018 XYBZMPBRYYBJSR-UHFFFAOYSA-N 366.483 0.946 10 10 FCCE NC(=O)COC1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 1319145765 FJQWUHDQGZMBKC-UHFFFAOYSA-N 350.331 0.396 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CC(F)(F)C[C@H]2CO)cc1F 1327968318 NCBNVJREMXQZGT-NSHDSACASA-N 359.348 0.736 10 10 FCCE C[C@@H]1CC[C@H](NC(=O)C(=O)C(=O)C(=O)NC[C@@H]2C[C@H]3C=C[C@H]2CC3)CN1 1331763227 WUMIJHOHFXXRQC-QTVXIADOSA-N 361.442 0.100 10 10 FCCE COCCn1cc(N2C[C@@H](C(=O)NCc3ccc(O)cc3O)CC2=O)cn1 1643103606 BJWSZWVNEKMOHW-ZDUSSCGKSA-N 374.397 0.610 10 10 FCCE CN(Cc1ccccc1O)C(=O)[C@@H]1[C@H](O)[C@H](O)CN1C(=O)OC(C)(C)C 2136113612 NJFHBLLSMJBFEE-QLFBSQMISA-N 366.414 0.692 10 10 FCCE CC(C)NS(=O)(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCOCC1 62370937 XACVJKBEPXMNRI-QGZVFWFLSA-N 370.519 0.958 10 10 FCCE COc1ccc(N2CCCN(C(=O)[C@H]3CCN(C)S3(=O)=O)CC2)cc1 843533280 GSBWWMADTHXPJY-MRXNPFEDSA-N 367.471 0.768 10 10 FCCE CCS(=O)(=O)c1cnc(O)c(C(=O)NCc2cccc(O)c2O)c1 1303195076 OYTJBVOFINCJGS-UHFFFAOYSA-N 352.368 0.922 10 10 FCCE O=C(C(=O)N1Cc2cccc(O)c2C1)N1CCN(c2ncc(F)cn2)CC1 1330431734 PGGJEYQONYBPMC-UHFFFAOYSA-N 371.372 0.512 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCC[C@H]1CC(=O)N(C)C1 1335760033 PWKUFYHIJJZJNS-AWEZNQCLSA-N 360.458 0.662 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CC1CS(=O)(=O)C1 1351747346 MZBIHILRXZESQX-UHFFFAOYSA-N 352.456 0.916 10 10 FCCE COC(=O)/C=C\c1ccc(N2CC[C@H](CS(N)(=O)=O)C2)c([N+](=O)[O-])c1 1651480580 BKBHTDQPNHGPIT-FHMRSRPSSA-N 369.399 0.896 10 10 FCCE CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CCS(=O)(=O)C1 2060637076 GIOLUTNJTFPSLT-YGRLFVJLSA-N 373.435 0.980 10 10 FCCE CN1C2(CCC2)COC[C@@]1(CO)CNC(=O)c1c(F)ccc(O)c1O 530275480 UMZCVUWMTSRFQN-KRWDZBQOSA-N 354.378 0.583 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C[C@H](O)CN1CCOCC1 823582095 XLHBUGATVIXSJY-MRXNPFEDSA-N 352.431 0.450 10 10 FCCE COC[C@@H](NC(=O)C(=O)NCc1ccc(N(C)C)cc1)C1CCOCC1 826707865 YRZXCWYZMGUPTA-QGZVFWFLSA-N 363.458 0.927 10 10 FCCE CCN(OC)C(=O)CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 852392593 QZDJPXXJGJATTQ-ZDUSSCGKSA-N 350.419 0.983 10 10 FCCE CC(C)NC(=O)[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1332052701 CSXSDJFMCCRCQE-AWEZNQCLSA-N 359.426 0.998 10 10 FCCE COCCNC(=O)C1(C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 243191575 KAACNGJORLKZRT-UHFFFAOYSA-N 361.442 0.887 10 10 FCCE CN1CCN(CCNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1 255540414 AYIMVLHBWFZIAE-DAXSKMNVSA-N 358.486 0.900 10 10 FCCE O=S1(=O)CCN(c2ccc(CNS(=O)(=O)CC3CC3)cc2)CC1 748058126 CBMCWUXIEQVOBZ-UHFFFAOYSA-N 358.485 0.751 10 10 FCCE CNC(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 817812139 XJDWKFICLIKFIB-GFCCVEGCSA-N 350.394 0.102 10 10 FCCE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](O)Cc1cnn(C)c1 819697955 GKXXBTIWNYOZFR-MRXNPFEDSA-N 361.398 0.621 10 10 FCCE CNS(=O)(=O)Nc1ccc(NS(=O)(=O)C[C@@H](OC)C2CC2)cc1 842585560 DNQUCVIBMXWMBM-CYBMUJFWSA-N 363.461 0.729 10 10 FCCE CO[C@@](C)(CO)CNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 847384342 JSDWBCZNKPLKNR-QGZVFWFLSA-N 373.400 0.998 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNCc1cc(F)ccc1O 2218612935 GZNFUZBHXZMMHV-SNPRPXQTSA-N 356.394 0.962 10 10 FCCE COc1cccc(O)c1CNC[C@@H]1[C@H](O)[C@H](O)CN1C(=O)OC(C)(C)C 2225658229 JYBJMBLTZQCWHQ-XPKDYRNWSA-N 368.430 0.832 10 10 FCCE CC(C)(C)OC(=O)N1CC(O)(CCNC(=O)c2cc(O)nc(O)c2)C1 2260122179 DGJAIZOUAVTKBU-UHFFFAOYSA-N 353.375 0.595 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CN(C)CC(=O)NC(C)C)C2)cc1 855230574 PMZCZNKEHFHUPM-OAHLLOKOSA-N 362.474 0.847 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cnn[nH]3)CC2)cc1 1138325272 BVMZJDARBURCRE-VOTSOKGWSA-N 356.386 0.657 10 10 FCCE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1coc(CS(C)(=O)=O)n1 1154026566 NMILARVUXSGCLA-VIFPVBQESA-N 354.384 0.991 10 10 FCCE COc1ccc(CN[C@H](C)CN(C)C(=O)[C@H]2CC[C@@H](C(N)=O)O2)cc1C 1283679063 PTSYVVRNXVLAQJ-XOKHGSTOSA-N 363.458 0.973 10 10 FCCE NS(=O)(=O)c1n[nH]cc1C(=O)NCc1c(O)ccc2c1CCCC2 1445902451 QPXBTTZBIJTHKZ-UHFFFAOYSA-N 350.400 0.572 10 10 FCCE COc1ccc(CNC(=O)NCCc2nnc3c(=O)n(C)ccn23)c(O)c1 1471366111 FNKOHXHEJJKGSL-UHFFFAOYSA-N 372.385 0.184 10 10 FCCE C[C@H](CNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)S(N)(=O)=O 1479533440 HWUZNOHPNKTJJK-DOMZBBRYSA-N 371.507 0.332 10 10 FCCE NC(=O)[C@@H]1CC(C(=O)NCc2cc(O)ccc2O)=NN1c1ccccc1 1643879285 JNAGGNWCISMRDH-HNNXBMFYSA-N 354.366 0.834 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNCc1c(O)cccc1F 2312325198 SIUFNHVQOWIRRN-CFVMTHIKSA-N 356.394 0.962 10 10 FCCE CCn1ncc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)n1 294836937 HPFAWAFHAOEDIB-UHFFFAOYSA-N 356.430 0.897 10 10 FCCE COC(=O)[C@@H]1CN(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c2ccccc21 732175273 JQTSNDDXCBJKDQ-MYSGNRETSA-N 369.377 0.401 10 10 FCCE CN1CCN(C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c2cc(F)ccc21 742781440 XGAGYEUXUREIDS-QPJJXVBHSA-N 358.373 0.719 10 10 FCCE COCC(=O)N1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 757508820 NSZYXPAWZAALOS-UHFFFAOYSA-N 350.331 0.221 10 10 FCCE CN1NN=C2C1=NCC[C@H]2C(=O)NCc1cc(Br)ccc1O 854442371 PYABALUZPKFNFV-SNVBAGLBSA-N 366.219 0.995 10 10 FCCE O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCNC1 923592937 XHQKIUHERCQATQ-CQSZACIVSA-N 357.451 0.834 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NCCN3CCNC3=S)C2)cc1 1470774190 XIJDXOGMLBGTKF-CYBMUJFWSA-N 363.487 0.763 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3CCC(=O)NC3)cc2)CC1 1471912612 QXKHJRCZFOVXTL-HNNXBMFYSA-N 358.442 0.531 10 10 FCCE C[C@@H](O)C(=O)N1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1556066983 IESQFPDGUVUTJZ-SECBINFHSA-N 350.396 0.978 10 10 FCCE C[C@@H](N)CNC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2080869100 JBQCWRPEJZFADB-PWSUYJOCSA-N 353.419 0.997 10 10 FCCE CC(C)(C)OC(=O)N1CC(CNC(=O)c2cccc(O)c2O)(C(N)=O)C1 2118183956 XCUDTERDXMAJKV-UHFFFAOYSA-N 365.386 0.550 10 10 FCCE CC(C)(C)OC(=O)NCC(CO)(CO)NCc1ccc(O)c(O)c1O 2254544538 LZQFFJQCSZCLEJ-UHFFFAOYSA-N 358.391 0.141 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC(CN=[N+]=[N-])CC1 2332922707 GDFURQWESNQCCD-JHJVBQTASA-N 369.422 0.876 10 10 FCCE COC(=O)[C@@H]1CCN(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C1 298743480 SYMUKXQNFBAFKZ-OAHLLOKOSA-N 361.442 0.839 10 10 FCCE NCCCNC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 842216248 GTKHPGPUIBTUHR-LBPRGKRZSA-N 370.400 0.838 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CCC(CN)CC2)cc1 846360992 BAMQWZYIJOOJQL-UHFFFAOYSA-N 362.474 0.787 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H]3CC[C@@H]3C(N)=O)CC2)cc1 847399254 AKJGLQVKCFVOQD-IRXDYDNUSA-N 360.458 0.445 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@@H](O)C1CCC1 855396611 PQJUAAJMPDDXPE-INIZCTEOSA-N 352.456 0.699 10 10 FCCE CN(C)c1ccc(CNC(=O)N2CCC3(CC2)C[C@H](O)CNC3=O)cc1 913926848 OADJHJSYDXXLOX-INIZCTEOSA-N 360.458 0.925 10 10 FCCE O=C(NCCNS(=O)(=O)c1cccnc1)NCc1c(O)cccc1F 1224535327 ALIJRKJXZYEZRI-UHFFFAOYSA-N 368.390 0.704 10 10 FCCE COc1cccc(CNC(=O)NCc2nnc3c(=O)n(C)ccn23)c1O 1254667889 VBSZSPSZMSBQIP-UHFFFAOYSA-N 358.358 0.142 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(=O)NCC[C@@H]1CNC(=O)C1 1262289438 DDTKVDRKDTWSEG-CABCVRRESA-N 374.485 0.751 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)NC[C@@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2060641494 KATONPJHVNPYOA-WDEREUQCSA-N 352.395 0.881 10 10 FCCE CN1CCN(c2cc3c(cc2N)OCCO3)[C@@H](CNC(=O)C(F)(F)F)C1 2163080749 OPCVJLJMWFHCJK-JTQLQIEISA-N 374.363 0.839 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNCc1ccc(O)c(O)c1 2312325043 PLDUFYMFYOYJQO-GLQYFDAESA-N 354.403 0.529 10 10 FCCE CO[C@@H]1CN[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 187918182 RNEKZCSMGUHYHD-GOEBONIOSA-N 351.422 0.780 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)Nc1cnn(-c2ncccn2)c1 754931253 YFJBCUVTVHDPIM-UHFFFAOYSA-N 352.354 0.965 10 10 FCCE Cc1nccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)n1 788312223 DLZZQAXFOFPZTQ-UHFFFAOYSA-N 369.425 0.554 10 10 FCCE C[C@@H](O)[C@@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CCO1 817822405 DVNVDIZLWFOHRH-MNOVXSKESA-N 359.473 0.350 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=S)NCCNS(C)(=O)=O)C2)cc1 849270307 BERSVHYBHBMABJ-GFCCVEGCSA-N 372.516 0.287 10 10 FCCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(C(=O)/C=C\c3ccc(O)c(O)c3)C[C@@H]12 855959022 QXUAGSWKYDQGNV-NCVHZKOMSA-N 353.396 0.381 10 10 FCCE NCCCOCCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 861562810 YUHVEASQUIZPDA-UHFFFAOYSA-N 354.426 0.827 10 10 FCCE CC(=O)NC(C)(C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1133847658 RBVYOHHFRHMBJK-UHFFFAOYSA-N 360.458 0.919 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1nn[nH]n1 1295590652 MZXRWVASALAILC-UHFFFAOYSA-N 353.766 0.693 10 10 FCCE CS(=O)(=O)CC1(C(=O)NCc2c(O)ccc3c2CCCC3)COC1 1519816558 FGJMVEMKBILBCY-UHFFFAOYSA-N 353.440 0.948 10 10 FCCE COc1ccc(O)c([C@@H](C)NC(=O)NC2CN(S(=O)(=O)N(C)C)C2)c1 1684308797 SRVYSIYMLFOVNF-SNVBAGLBSA-N 372.447 0.252 10 10 FCCE COc1ccc(O)c(CNC[C@@H]2[C@H](O)[C@H](O)CN2C(=O)OC(C)(C)C)c1 2225623612 QTGOCJQNPHMYHX-BMFZPTHFSA-N 368.430 0.832 10 10 FCCE Cc1cc(Cl)cc(CN[C@@H]2CS(=O)(=O)C[C@@H]2N2CCOCC2)c1O 271841028 GTINGIXQCDACIX-CABCVRRESA-N 374.890 0.941 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@@H](C)S(N)(=O)=O)C2)cc1 823732410 FLMPUZGSTLRUCD-OLZOCXBDSA-N 370.475 0.498 10 10 FCCE CO[C@@H]1COCC[C@@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 897791602 RGCFCLSMIDEUMY-DLBZAZTESA-N 363.458 0.940 10 10 FCCE O=C(CO)NCCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 906836062 WOUAYOCCBUZICO-LBPRGKRZSA-N 371.384 0.872 10 10 FCCE COCCN(CCOC)C1CN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 911859575 LAWAISIKDPWHPY-XQRVVYSFSA-N 350.415 0.917 10 10 FCCE C[C@@H](NC(=O)C(=O)N[C@H]1C[C@H](S(C)(=O)=O)C1)c1ccc(N(C)C)cc1 1119476432 WHHLXIKTEXCSLZ-UXIGCNINSA-N 367.471 0.622 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@H]1CC(=O)NC1=O 1446816788 QUJYRZLDKHMGLW-SECBINFHSA-N 368.773 0.600 10 10 FCCE NS(=O)(=O)c1ccc(CCC(=O)NCc2cc(O)ccc2O)cc1 1558174400 MFENRGWZTVYZID-UHFFFAOYSA-N 350.396 0.994 10 10 FCCE CC(=O)N1CCCN(C[C@@H]2OC[C@@H](NCc3ccccc3O)[C@@H]2O)CC1 1615259190 DOMNJAYCCSHOQJ-NEWSRXKRSA-N 363.458 0.164 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)CCn1cc(C(N)=O)c(O)nc1=O 1635663687 XAVJFXFFQFOWFE-UHFFFAOYSA-N 374.397 0.582 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)NC[C@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2060641493 KATONPJHVNPYOA-QWRGUYRKSA-N 352.395 0.881 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2081037002 VKCGAKBRQJXPTA-KXNHARMFSA-N 355.395 0.629 10 10 FCCE CC(C)(C)OC(=O)N1CC(CO)(CNC(=O)c2cc(O)nc(O)c2)C1 2081961120 KEFUNKJGXOVHGC-UHFFFAOYSA-N 353.375 0.452 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1C[C@H](CNC(=O)c2cc(O)nc(O)c2)C[C@@H]1O 2116224599 LLGHTACCFOCUJS-WCQGTBRESA-N 367.402 0.887 10 10 FCCE CS(=O)(=O)C[C@H](O)CNCc1cc(Br)cc(F)c1O 922826253 XFMMLOBXWFTUTC-SECBINFHSA-N 356.213 0.789 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2C3CCC2(C(N)=O)CC3)cc1F 929801881 ZUNSRJYVEHAYCO-UHFFFAOYSA-N 362.405 0.517 10 10 FCCE CCn1cc(CC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)nn1 930940188 CNNHKEWPBUBBHO-UHFFFAOYSA-N 372.473 0.788 10 10 FCCE COC(=O)[C@]1(N2CCN(Cc3cc(OC)ccc3O)CC2)CCOC1 1329068474 VKJNMGAMRHWGAR-SFHVURJKSA-N 350.415 0.851 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1=NN(CCO)C(=O)CC1 1587456419 UKLQLTPDKXBRGH-UHFFFAOYSA-N 374.441 0.452 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3cnncc3O)CC2)cc1 1625951424 AQYKCWDJWRXCPL-UHFFFAOYSA-N 357.414 0.743 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 1637266319 SNBQZBKGOPXYBR-BLLLJJGKSA-N 355.412 0.493 10 10 FCCE CC(C)(C)OC(=O)NCC(=O)NCC(=O)NCc1c(O)cccc1F 1638862580 BZQRVSJRRRUXJM-UHFFFAOYSA-N 355.366 0.788 10 10 FCCE Nc1cc2c(cc1N1C[C@H]3C[C@H]1CN3C(=O)C(F)(F)F)NC(=O)CO2 2106817301 ZWKAEUNJFKVQFF-JGVFFNPUSA-N 356.304 0.952 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCO[C@]3(CCOC3)C2)c1 769626515 VZQZMDOLKAQJDV-OAHLLOKOSA-N 356.400 0.395 10 10 FCCE CN(C)c1ccc(CNC(=O)NC[C@]23COCCN2C(=O)COC3)cc1 866144334 CTBXDSKTQZVQEW-GOSISDBHSA-N 362.430 0.180 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NCCS(=O)(=O)NC[C@@H]1CCCCO1 1136814755 OINXVYTZZKZXRT-ZDUSSCGKSA-N 372.443 0.245 10 10 FCCE Cc1cc(C(=O)N2CC3(C[C@H](O)CNC3=O)C2)c(C)n1-c1ccccn1 1347371622 UMISFTDPPPDNBP-AWEZNQCLSA-N 354.410 0.812 10 10 FCCE COC[C@@H](CO)NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1685244068 IWOPYCUWZUKAOO-OAHLLOKOSA-N 364.446 0.195 10 10 FCCE CC(C)(C)OC(=O)NC1(CNS(=O)(=O)Cc2ccc(N)cc2)COC1 2044241528 FQTOXHUEHHRBGS-UHFFFAOYSA-N 371.459 0.982 10 10 FCCE CN(Cc1ccccc1O)C(=O)[C@@H]1[C@@H](O)[C@H](O)CN1C(=O)OC(C)(C)C 2136113609 NJFHBLLSMJBFEE-ILXRZTDVSA-N 366.414 0.692 10 10 FCCE COc1cc(N2CCN(CC(=O)NC(N)=O)CC2)cc(OC)c1OC 273615794 PHHNZFDBITYHST-UHFFFAOYSA-N 352.391 0.029 10 10 FCCE O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cnn(-c2ccncc2)c1 774361457 FBCAAFNILDQREY-UHFFFAOYSA-N 367.365 0.976 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(C)C 808484239 NHNZZKHFXDZVQC-HNNXBMFYSA-N 355.412 0.999 10 10 FCCE COC(=O)[C@](C)(O)CN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 808746588 QVKTUUJLAGIKCB-GOSISDBHSA-N 368.430 0.758 10 10 FCCE C[C@H](NC(=O)[C@H]1CCN(C)S1(=O)=O)c1ccc(N2CCOCC2)cc1 843537342 SARDTKWQCOXEKN-XJKSGUPXSA-N 367.471 0.734 10 10 FCCE CNC(=O)NC[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)cc2)CCO1 862458714 HWPLYPATEOYHRB-GOSISDBHSA-N 361.490 0.568 10 10 FCCE C[C@@]1(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CCNC1=O 1141996081 IBEGAEHZZSLKJI-AUUYWEPGSA-N 358.442 0.531 10 10 FCCE Cn1c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cnc1O 1146665444 FVXMBWGAHOANOK-UHFFFAOYSA-N 364.427 0.291 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2C(=O)NC3(CCC(=O)CC3)C2=O)cc1 1165925278 GDPAACFSZYTUPG-UHFFFAOYSA-N 372.425 0.803 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)CCNC(=O)C1 1447349751 SYLXJHOQCTTWEW-KPZWWZAWSA-N 364.398 0.605 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](O)[C@@H]1C(=O)NCc1ccc(N)cc1 2136254820 AJJIHISVEBMECL-RRFJBIMHSA-N 365.430 0.616 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cn(C)nn3)CC2)cc1 794605676 JHNMSPQQUOLOKZ-FPLPWBNLSA-N 370.413 0.667 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCN(C)C3CC3)C2)cc1 827457466 YHIPAUCMZLATAT-AWEZNQCLSA-N 360.458 0.601 10 10 FCCE C[C@@H]1CN(S(=O)(=O)NC[C@H](N)c2ccc(N(C)C)cc2)C[C@@H](C)O1 842784913 CGWWKVKDVCIJEM-IOASZLSFSA-N 356.492 0.696 10 10 FCCE Cc1cncn1CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 858641668 MISIUJHUEJYUJK-UHFFFAOYSA-N 362.455 0.743 10 10 FCCE O=C(CS(=O)(=O)C1CC1)NCc1ccc(N2CCOCC2)c(F)c1 1291756368 PVTHVQSYIOTGNV-UHFFFAOYSA-N 356.419 0.856 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cn(C[C@@H]2CNC(=O)O2)nn1 1638347094 CITFAMJULLWNAJ-KOLCDFICSA-N 361.358 0.159 10 10 FCCE CCS(=O)(=O)N[C@@H](CCSC)C(=O)NCc1ccc(O)cc1O 1639444490 NIPOFKQCSUDBGY-LBPRGKRZSA-N 362.473 0.775 10 10 FCCE Nc1ccc(CS(=O)(=O)N(Cc2ccccc2)CC2(O)CNC2)cc1 2071563854 OYERXXBZDLRWPT-UHFFFAOYSA-N 361.467 0.935 10 10 FCCE O=C(NCCn1cc(I)cn1)c1cc(O)nc(O)c1 2097166686 FZKFQBIVAZGOPZ-UHFFFAOYSA-N 374.138 0.724 10 10 FCCE CCOC(=O)C[C@H](O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 819591148 PMKYTAGUWYACTO-CJNGLKHVSA-N 350.415 0.952 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@H]3CCCOC3)C2)cc1 827312244 BZUCZQPAVOWGSC-HUUCEWRRSA-N 361.442 0.933 10 10 FCCE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)[C@]1(O)CCOC1 840408718 LUYIDWSXKULIEB-FQEVSTJZSA-N 359.470 0.986 10 10 FCCE CN(C)c1ccc(CNC(=O)CN2C(=O)NC3(CCOCC3)C2=O)cc1 1165634866 PTKTVGNZUAZAMG-UHFFFAOYSA-N 360.414 0.470 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(CO)(CO)C1 1330786337 KKOXKJNMAGLBRV-UHFFFAOYSA-N 363.458 0.534 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N3CC=C[C@H]3CO)C2)cc1 1331799850 UPUFFFFYNYSCJJ-HOCLYGCPSA-N 359.426 0.397 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2c1nnnn1CCN1CCOCC1 1340222172 XRVSEZJIPSEKEQ-UHFFFAOYSA-N 359.434 0.602 10 10 FCCE O=C(C[C@@H]1NC(=O)c2ccccc2NC1=O)NCCc1ccc(O)c(O)c1 1566370323 VZGLFMIILUSNFO-AWEZNQCLSA-N 369.377 0.897 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNCc1cc(F)ccc1O 2312324618 GZNFUZBHXZMMHV-CFVMTHIKSA-N 356.394 0.962 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@](O)(C(F)(F)F)C2)c1 265955813 JSQBIUVCSRJNQB-LBPRGKRZSA-N 368.333 0.903 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)Nc3nnn(C)c3C)C2)cc1 850537397 QAXKMHWHKHOZAQ-GFCCVEGCSA-N 358.402 0.466 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCN[C@H](C)C3)C2)cc1 851689729 SISUQRAIOJOTMR-ILXRZTDVSA-N 360.458 0.647 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@@H](O)CS(C)(=O)=O 922917162 YAHJVGJKVOXLPI-CZUORRHYSA-N 371.503 0.697 10 10 FCCE CN(C)c1ccc([C@@H](CNC(=O)NCCCS(N)(=O)=O)N(C)C)cc1 1252425469 ORNFPTVFZGUQBZ-OAHLLOKOSA-N 371.507 0.333 10 10 FCCE CC(C)(C)OC(=O)N[C@H]1C[C@H](O)CN(C(=O)c2cc(O)nc(O)c2)C1 2049116571 JHOGJQGJTXCGNR-QWRGUYRKSA-N 353.375 0.593 10 10 FCCE Cn1nc(Br)cc1S(=O)(=O)NCc1cc(N)ccc1O 2145970446 LAWILGNLORBCNQ-UHFFFAOYSA-N 361.221 0.949 10 10 FCCE C[C@H](NCC(CO)(CO)NC(=O)OC(C)(C)C)c1c(O)cccc1O 2258307244 VDWOWPHTEJBWSM-NSHDSACASA-N 356.419 0.997 10 10 FCCE Cc1ccc(CNS(=O)(=O)CS(C)(=O)=O)c(O)c1Br 2352620195 NTAYRJIAMJLBBM-UHFFFAOYSA-N 372.262 0.885 10 10 FCCE Cc1ccc(S(=O)(=O)NCCNC(=O)c2cc(O)c(O)c(O)c2)cc1 169911838 WNZPDEJPHZHFRN-UHFFFAOYSA-N 366.395 0.820 10 10 FCCE COC(=O)[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCO1 728750226 DGXFXKAZETWPRS-INIZCTEOSA-N 363.414 0.607 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)/C=C\c1cn(C)c(=O)n(C)c1=O 734466856 DLRWTWXYADSGNC-CLFYSBASSA-N 356.426 0.788 10 10 FCCE COc1ccc(CNC(=O)N[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)c(O)c1 800055032 MHBWGDQXYTYURO-BXUZGUMPSA-N 371.459 0.918 10 10 FCCE COc1cc(C(=O)OCC(=O)C(C)=O)ccc1OCC(=O)NC(C)C 808506626 OCOVJRKJEPBDCM-UHFFFAOYSA-N 351.355 0.914 10 10 FCCE CS(=O)(=O)N[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 819920751 YUSGCUAQFGPCLJ-MRVPVSSYSA-N 356.360 0.054 10 10 FCCE CN(C)CCN1CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1=O 844933500 GGAZEXNITBKBHS-UHFFFAOYSA-N 365.453 0.807 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N2CN(C)C(=O)[C@@H]2C)cc1 846282297 YNUZCOAHCIVTBF-ZDUSSCGKSA-N 362.430 0.236 10 10 FCCE CC(=O)N1CCO[C@H](C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C1 891241501 ATUPFYQHOSWOTK-ROUUACIJSA-N 362.474 0.719 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@@H](O)C1(O)CCOCC1 929973079 WTBRYHGNBCBMRT-OAHLLOKOSA-N 373.833 0.923 10 10 FCCE CCN1CCN(C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c2ccccc21 1318694844 RGEJFHCZFRGPTB-KTKRTIGZSA-N 354.410 0.970 10 10 FCCE O=C1C[C@@]2(CCN(C(=O)C(=O)NCc3ccc(N4CCCC4)cc3)C2)CN1 1323266653 FZLFSTAARKPMAW-FQEVSTJZSA-N 370.453 0.642 10 10 FCCE O=C(C1CCN(c2ccc3nnnn3n2)CC1)N1Cc2cccc(O)c2C1 1329667106 MPJSEBKERSGJQG-UHFFFAOYSA-N 365.397 0.984 10 10 FCCE CCOC[C@H](C)NC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1332215758 WTBLTVWDCZEWSQ-HNNXBMFYSA-N 362.474 0.596 10 10 FCCE O=C(CNS(=O)(=O)c1ccc(F)cc1)NCCc1ccc(O)c(O)c1 1630334619 CZGPIWQWOYYAMD-UHFFFAOYSA-N 368.386 0.874 10 10 FCCE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCCCS(N)(=O)=O 1683658960 XMPDQSZULPTOHY-ZDUSSCGKSA-N 356.492 0.970 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1COC[C@H]1NC(=O)c1cc(O)c(O)c(O)c1 2068618617 SCCDLEFNTDOPCF-NXEZZACHSA-N 354.359 0.825 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2081036067 NUBFXFPQKQRRLE-TUAOUCFPSA-N 355.395 0.629 10 10 FCCE COc1cccc(CNC(CO)(CO)CNC(=O)OC(C)(C)C)c1O 2254543606 FRDUKQXBRBTPJG-UHFFFAOYSA-N 356.419 0.739 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN2CCOC[C@@H]2C1 758395323 CYGBSEIXUQWIGF-SFHVURJKSA-N 360.458 0.749 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)N[C@H]3CCCN(C)C3)C2)cc1 824973817 MFLOHXMJHNYMNW-HOTGVXAUSA-N 374.485 0.848 10 10 FCCE CN1CCO[C@@H](CS(=O)(=O)NCCCSc2nccs2)C1 866782425 TVOPAAQGRBCJGZ-LLVKDONJSA-N 351.519 0.875 10 10 FCCE CC(C)(C)OC(=O)NC1(C(N)=O)CN(CCOc2ccc(N)cc2)C1 2047100574 LNYQBHHPUAKDPL-UHFFFAOYSA-N 350.419 0.712 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)C3(C(=O)N(C)C)CC3)cc2)CC1 807355367 QLJFUNJVAIGAQM-UHFFFAOYSA-N 372.469 0.840 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N=c3nc[nH]n3C(C)C)C2)cc1 850537610 SKNQYMBRLPMDNW-ZDUSSCGKSA-N 372.429 0.623 10 10 FCCE COC(=O)[C@@H]1C[C@H](N2C(=O)CNC2=O)CN1Cc1ccc(N(C)C)c(C)c1 856783992 MZYZBVRGNCMXKJ-HOCLYGCPSA-N 374.441 0.729 10 10 FCCE CS(=O)(=O)CCN1CCC(NC(=O)NCc2c(O)cccc2F)CC1 917783586 HKYMBIVUTJGGKN-UHFFFAOYSA-N 373.450 0.840 10 10 FCCE CS(=O)(=O)C[C@H](O)CNC(=O)NCc1ccc(N2CC=CC2)cc1 919919176 WASLRKRZEBKVFB-OAHLLOKOSA-N 353.444 0.268 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)N(C)CCS(N)(=O)=O)C2)cc1 1683340086 OWJIWBIKPIJMTR-ZDUSSCGKSA-N 370.475 0.451 10 10 FCCE COc1ccc(N(C)CCN(C)CN2C(=O)[C@H]3[C@H](C2=O)[C@H]2C=C[C@H]3O2)cc1 844725946 RBDOULGUECXIRG-BRSBDYLESA-N 371.437 0.959 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3CC[C@]4(CNC(=O)C4)C3)ccc21 1322546534 BQQZQSLSXCVCIL-FQEVSTJZSA-N 370.453 0.424 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](CCO)[C@@H](CO)C3)C2)cc1 1519454740 JEMRWQVNECKNOL-OAGGEKHMSA-N 363.458 0.906 10 10 FCCE C[C@H](NC(=O)C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1O 1635804717 ZZDXHNWGUIXJSN-JTQLQIEISA-N 363.395 0.856 10 10 FCCE COc1cccc(CNC(=O)NC[C@@]23COCCN2C(=O)OC3)c1O 1675402971 QJGJKONFTWVSIE-INIZCTEOSA-N 351.359 0.421 10 10 FCCE O=C(Cn1cnc([N+](=O)[O-])n1)NCc1cc(Br)ccc1O 804737988 YBLLUBQTJLXGQK-UHFFFAOYSA-N 356.136 0.971 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCCn3cccn3)C2)cc1 826872165 IFWQWZYTWCAPNL-OAHLLOKOSA-N 371.441 0.793 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCC3CCOCC3)C2)cc1 827072250 HQMMYCLBTHPIBW-HNNXBMFYSA-N 361.442 0.933 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CCN(C4CC4)C3)C2)cc1 827489131 NXFBKTXMYWNHFZ-CABCVRRESA-N 372.469 0.743 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCc4nnnn4CC3)C2)cc1 854183942 GTWLILCEOJZVOC-UONOGXRCSA-N 371.445 0.965 10 10 FCCE CN1CCN(c2ccc(CN3CCN(c4nccnn4)CC3)cc2)CC1 862442873 KPXSDRZTHQVWHZ-UHFFFAOYSA-N 353.474 0.946 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)N3C4CCC3(C(N)=O)CC4)ccc21 929803764 CKXQKORXPNEKLT-UHFFFAOYSA-N 370.453 0.694 10 10 FCCE COC(OC)C(=O)N1CCN(Cc2cc(F)cc(C(C)=O)c2O)CC1 930956343 IEIQXSFFDMZMTB-UHFFFAOYSA-N 354.378 0.997 10 10 FCCE COC(=O)N[C@H]1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)C1 1331665499 KAVONHLTQDBUKT-HNNXBMFYSA-N 374.441 0.642 10 10 FCCE COc1cc(N(C)C[C@@H](O)CN2CCOCC2)c([N+](=O)[O-])cc1OC 1458226857 ALJJZDQJLNSXEX-GFCCVEGCSA-N 355.391 0.741 10 10 FCCE COc1ccc(N2CCN(C(=O)NC[C@H]3CNC(=O)C3)CC2)cc1F 1478817624 AKISOQXJDHZGTD-GFCCVEGCSA-N 350.394 0.802 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC[C@H]1C(=O)OC 1633472605 BIERTEDPGVZRCR-XQQFMLRXSA-N 365.382 0.887 10 10 FCCE CC(C)(C)OC(=O)NCC1(O)CN(CC(=O)Nc2ccc(N)cc2)C1 2044680781 IIMQFBNXERJRFS-UHFFFAOYSA-N 350.419 0.779 10 10 FCCE Nc1ccc(-n2ccc(C(=O)N3CC(NC(=O)C(F)(F)F)C3)n2)cc1 2106719733 FUTHQXHSRSYRET-UHFFFAOYSA-N 353.304 0.957 10 10 FCCE O=S1(=O)C[C@@H]2NCCN(Cc3ccc(Br)cc3O)[C@H]2C1 2143712083 IUASEWHMJNIFNH-RYUDHWBXSA-N 361.261 0.726 10 10 FCCE CN1CCN(c2ccc(CN3CCC[C@@H](CS(N)(=O)=O)C3)cc2)CC1 775689075 ZCCJHQHPDZBVPH-QGZVFWFLSA-N 366.531 0.939 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1C[C@H](O)C[C@H]1CO 776117138 FDTCFVDGTBJETL-DZGCQCFKSA-N 367.421 0.424 10 10 FCCE O=C(NCCCn1ccnn1)C(=O)NCc1ccc(N2CCCC2)cc1 788932489 OENVMGMMSYQNSK-UHFFFAOYSA-N 356.430 0.701 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3cc(C)[nH]n3)C2)cc1 828099185 FNAYXDPCHCUVRQ-ZDUSSCGKSA-N 357.414 0.738 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1C[C@@H]2CCC[C@H](C1)N2 842192328 REZUZVLPFPHUOE-CALCHBBNSA-N 372.469 0.492 10 10 FCCE NC(=O)[C@H]1C[C@@H](NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 844896492 AZNSBDDOADHZRK-BETUJISGSA-N 350.394 0.725 10 10 FCCE CO[C@@H](COC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCOC1 849711985 DXLCCZXGALVDGO-HZMBPMFUSA-N 359.400 0.972 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N3CCN(C[C@H](C)O)CC3)C2)cc1 854298268 ZCHUUKXEFVEKSR-JKSUJKDBSA-N 362.474 0.982 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1CCNC1=O 1296055862 ZGGBZLRIQNOUTQ-NEPJUHHUSA-N 350.371 0.214 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCC[C@H](C)CO)C2)cc1 1328092167 JKSAHOUCTSVZFF-GJZGRUSLSA-N 363.458 0.915 10 10 FCCE Cn1ncc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1N 1471911606 ANVRCPJZTQLQFB-UHFFFAOYSA-N 356.430 0.634 10 10 FCCE CC[C@]1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCNC1=O 1616600392 RZNAPFQHMWUEQF-FQEVSTJZSA-N 372.469 0.921 10 10 FCCE CC(C)(C)OC(=O)N1CC(N2CC(C(=O)C(=O)C[C@H]3C[C@H](N)C3)C2)C1 2256797893 OUYJPZSAZLXVMT-AULYBMBSSA-N 351.447 0.803 10 10 FCCE N[C@@H]1C(=O)Nc2cc(N3CCN(CCO)CC3)c(Br)cc21 92775284 TYLPJWQDUPQZMD-ZDUSSCGKSA-N 355.236 0.515 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CC(=O)NC3=O)CC2)cc1F 267999557 SBQKFRYEVJFQFA-UHFFFAOYSA-N 350.350 0.035 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCOC[C@@H]3CCO)nc12 762333750 IWAKQMGGDNOTLE-LBPRGKRZSA-N 350.375 0.195 10 10 FCCE Cn1ncc(Br)c1/C=C1\SC(=S)N(CC(N)=O)C1=O 779205141 UMMAARGNKCOLJG-UQCOIBPSSA-N 361.246 0.869 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CN3CCC4(COC4)C3)CC2)cc1 852682883 BIPRYAOUKSCWQQ-GOSISDBHSA-N 361.486 0.900 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ncn(C)n3)C2)cc1 1331024014 VLKGTNHTGVVJQL-STQMWFEESA-N 372.429 0.396 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(C)C[C@H](O)CN3)cc2)CC1 1343649579 WGAPFKWVIFVIRO-HKUYNNGSSA-N 360.458 0.084 10 10 FCCE C[C@H](C(=O)NCc1c(O)cccc1O)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 1639289155 MBXKUUSYWZGTPT-QWPVENPASA-N 360.366 0.265 10 10 FCCE CN1NC(C(=O)N=NC(=O)CN2C(=O)COc3ccccc32)=CC=C1O 606347108 SERHCYBWMPDOPC-UHFFFAOYSA-N 357.326 0.651 10 10 FCCE COc1ccc(S(=O)(=O)N(C)CCCC(=O)OCC(=O)C(C)=O)cc1 808493669 LWCMIKFHQGYLTG-UHFFFAOYSA-N 371.411 0.797 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3CCCNCC3)C2)cc1 851689462 PGYSIKSKGZSGAM-HUUCEWRRSA-N 360.458 0.648 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 861798840 YZRQHDMUJHKEFL-ZWKOTPCHSA-N 374.485 0.738 10 10 FCCE O=C(NCc1nnc2c(=O)[nH]ccn12)c1cc2cc(O)c(O)cc2s1 1644892932 FERFDSAQLCOBOT-UHFFFAOYSA-N 357.351 0.974 10 10 FCCE C[C@@H](N)CNC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2080880242 JBQCWRPEJZFADB-PWSUYJOCSA-N 353.419 0.997 10 10 FCCE CN1C2(CCC2)COC[C@]1(CO)CNCc1cc2c(cc1O)OCO2 527751984 FAFNSCROGUHFPM-GOSISDBHSA-N 350.415 0.826 10 10 FCCE COC[C@]1(C)NC(=O)N(CN2CCN(c3ccc(OC)cc3)CC2)C1=O 733289224 GNMGOJGJNJHFAX-SFHVURJKSA-N 362.430 0.732 10 10 FCCE COCC(C)(C)N1CCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)CC1 846251699 IFBGFEDILNILKA-UHFFFAOYSA-N 363.418 0.676 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCN(CCO)C[C@@H]3C)C2)cc1 854296682 FZNFNEDAWUDLON-HOTGVXAUSA-N 362.474 0.982 10 10 FCCE CN(C)S(=O)(=O)N1CC(NCc2c(O)cccc2Br)C1 858314180 NFZLLDPNAGQVNS-UHFFFAOYSA-N 364.265 0.735 10 10 FCCE CC(=O)O[C@H]1[C@H](CN=[N+]=[N-])O[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O 1083804965 LFQWTDKRDROWBN-YHQUGGNUSA-N 373.318 0.380 10 10 FCCE Cc1nn(CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(=O)o1 1441948131 RKPFRKORVLSSGG-AWEZNQCLSA-N 373.413 0.163 10 10 FCCE CN(C)c1n[nH]c(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)n1 1684141093 FSGXXQZYRMTVMB-UHFFFAOYSA-N 373.461 0.831 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2320915823 FFWPLMCWCNSUAX-NSHDSACASA-N 357.411 0.783 10 10 FCCE O=C1NC(=O)C(/N=N/c2ccc(S(=O)(=O)O)c3ccccc23)C(=O)N1 104620930 HOQNLUTWNWSCHD-ISLYRVAYSA-N 362.323 0.905 10 10 FCCE CCOC(=O)c1nn(C)c2c1CN(C(=O)c1cc(O)c(O)c(O)c1)CC2 170190687 CKKNLSDKOSVXOC-UHFFFAOYSA-N 361.354 0.912 10 10 FCCE CO[C@H](CNC(=O)C(=O)NCCCSc1nccs1)[C@@H]1CCOC1 828239451 OSPXTXAXGCSBHC-VXGBXAGGSA-N 373.500 0.909 10 10 FCCE C[C@H](NC(=O)C(=O)N1CN(C)C(=O)[C@@H]1C)c1ccc(N2CCOCC2)cc1 834664617 IOKGUZBKBKKFGT-KBPBESRZSA-N 374.441 0.347 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@@]3(C)CCCNC3)C2)cc1 851688596 DNYISEKQYKIQCY-QRWLVFNGSA-N 374.485 0.896 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCNC[C@H]3C)C2)cc1 851688624 FDIQBKHONWVDQT-KEYYUXOJSA-N 360.458 0.504 10 10 FCCE COc1ccc(N2CCN(C(=O)NC[C@@H]3COCCN3C)CC2)cc1F 858840807 JSBSCNSAJWBFBE-OAHLLOKOSA-N 366.437 0.997 10 10 FCCE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1coc(CS(C)(=O)=O)n1 1154026565 NMILARVUXSGCLA-SECBINFHSA-N 354.384 0.991 10 10 FCCE COc1cccc(CNC(=O)NCc2cn(C3CC3)c(=O)nc2O)c1O 1479188204 LQNINMIIWIXNNM-UHFFFAOYSA-N 360.370 0.997 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)Nc2cccc(-n3cnnn3)c2)cc1 49153612 JBHLOXBIZYPSLF-UHFFFAOYSA-N 365.397 0.983 10 10 FCCE COC(=O)[C@@H]1C[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 727308844 VYSAESZULVKURI-VNQPRFMTSA-N 359.426 0.814 10 10 FCCE O=C(CN1CCCS1(=O)=O)NCc1cc(Br)ccc1O 804739293 FCBUJHYCUUGVEB-UHFFFAOYSA-N 363.233 0.806 10 10 FCCE C[C@H]1CN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H](C)CN1CCO 841457854 WKIOJRFMFZUUTL-RYUDHWBXSA-N 371.459 0.291 10 10 FCCE C[C@@H](C(=O)N(C)[C@H]1CCS(=O)(=O)C1)N1CCCc2cc(CN)ccc21 843349478 AXEKCQLMANUMJR-BBRMVZONSA-N 365.499 0.932 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)NC[C@](C)(O)CN(C)C)C2)cc1 854299204 GIEJNUDAZDVFJR-KDOFPFPSSA-N 350.463 0.886 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C3(n4cnnn4)CCOCC3)C2)cc1 855227565 XWZCCTVMOWJBFN-AWEZNQCLSA-N 372.429 0.583 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc2c(c1)COB2O 863871551 RXWUNTFKMDBION-UHFFFAOYSA-N 370.189 0.810 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(OC)ncn1 1153662958 CHQDNZFCQGATKA-LBPRGKRZSA-N 361.354 0.801 10 10 FCCE CC1(C)S[C@@H]2[C@H](NC(=O)c3cc(O)c(O)c(O)c3)C(=O)N2[C@H]1C(=O)O 1865875679 GWDDSXIHHJWKGC-DFAYQTQMSA-N 368.367 0.049 10 10 FCCE CCCCCCN1C(=O)NC(=O)C(=CNCCN2CCOCC2)C1=O 2296102868 DILHFVXQXRVIGZ-UHFFFAOYSA-N 352.435 0.451 10 10 FCCE CN1CCN(c2ccc(/C=C3\C(=O)NC(=O)N(C)C3=O)cc2[N+](=O)[O-])CC1 59859925 ZHOIDAMZSMGUJO-FMIVXFBMSA-N 373.369 0.438 10 10 FCCE CCNC(=O)CN1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761877500 YYXBIOCHTNNPFJ-UHFFFAOYSA-N 363.374 0.184 10 10 FCCE CS(=O)(=O)C1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761910180 APCJMHFIGSTWFN-UHFFFAOYSA-N 355.372 0.939 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1 808509368 NCMOFAHCUPORQP-AJHXJQRKSA-N 372.377 0.491 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CCCCN3)C2)cc1 851687456 BCIZBDJUTYLEOQ-LSDHHAIUSA-N 360.458 0.648 10 10 FCCE COc1ccc(N2CCN(C(=O)c3c[nH]nc3S(N)(=O)=O)CC2)cc1 1622438068 DVRANNQVSRJODN-UHFFFAOYSA-N 365.415 0.028 10 10 FCCE CN(C)c1ccc([C@H](NC(=O)[C@@H](N)Cc2cnc[nH]2)c2nccn2C)cc1 1866032149 DEEWCFSYNWIKIG-IRXDYDNUSA-N 367.457 0.985 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@@H]1CNCC(=O)N1 1952346473 MGSHGXRJILJDDQ-NEPJUHHUSA-N 351.403 0.622 10 10 FCCE CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC(N=[N+]=[N-])C2)CCS(=O)(=O)C1 2010406573 WGUSFUPFUBDLBZ-CYBMUJFWSA-N 359.408 0.590 10 10 FCCE O=S1(=O)CCN(CCNCc2cccc(Br)c2O)CC1 2184636337 ZENVSKSVVQUAKQ-UHFFFAOYSA-N 363.277 0.975 10 10 FCCE CC(=O)C(=O)COC(=O)CN1C(=O)N[C@]2(C[C@@H](C)CC(C)(C)C2)C1=O 808497865 HFWHMHYHNRYLKA-BTDLBPIBSA-N 352.387 0.825 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCO[C@@H]([C@@H](C)O)C2)cc1 817705858 MEXRINZOUJMGAT-RHSMWYFYSA-N 363.458 0.757 10 10 FCCE CC(C)(C(=O)O)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 844244533 MXTLMXHXKBIWQW-UHFFFAOYSA-N 354.428 0.648 10 10 FCCE CO[C@H](CS(=O)(=O)NC[C@H](N)c1ccc(N(C)C)cc1)[C@H]1CCOC1 850587441 ZYZXUIMHWVXZDP-BHYGNILZSA-N 371.503 0.723 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCOC(=O)N3)CC2)cc1 858839345 BMWODLAZURTPQJ-INIZCTEOSA-N 362.430 0.432 10 10 FCCE COC(=O)CCNC(=O)CCNC(=O)NCc1ccc(N(C)C)c(F)c1 858904306 PHWLFBWKMDFZHL-UHFFFAOYSA-N 368.409 0.760 10 10 FCCE COc1cc(N2CCN(C(=O)[C@@H](O)C(C)(C)O)CC2)cc(OC)c1OC 907369600 MWLQSVADOFOGOX-MRXNPFEDSA-N 368.430 0.493 10 10 FCCE N[C@@H]1CCO[C@@H](C2CCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)CC2)C1 1329504601 NJAXXGBQNGWTSR-CRAIPNDOSA-N 373.453 0.979 10 10 FCCE COC(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1 1345143491 XBBAJNJTHVTGAL-OAHLLOKOSA-N 359.426 0.925 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@]23CCCC[C@@H]2NC(=O)C3)c1 1606653607 FKWJSALBMAXCOS-XJKSGUPXSA-N 367.427 0.695 10 10 FCCE CCN=c1nc(N2CCN(c3ccc(OC)cc3)CC2)[nH]c(=NCC)[nH]1 1871469484 HFRGBDPRWJZQJX-UHFFFAOYSA-N 357.462 0.914 10 10 FCCE COc1ccc(CNC(CO)(CO)CNC(=O)OC(C)(C)C)c(O)c1 2254545214 PDLIIVXRNWESLK-UHFFFAOYSA-N 356.419 0.739 10 10 FCCE O=C(O)CC[C@@H](N/C=C1/C(=O)N(c2ccccc2)C(=O)N=C1O)C(=O)O 102706370 WJEWJEIMIJJIPN-RJCSOLBVSA-N 361.310 0.901 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC(OCCCO)CC2)cc1 785432318 AHPRCSWJHVROMZ-UHFFFAOYSA-N 363.458 0.759 10 10 FCCE C[C@@H]1CN(CCO)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1 837816247 FCFKNIXGGQSDHA-MRXNPFEDSA-N 362.474 0.731 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCCNS(C)(=O)=O)C2)cc1 851943888 HIMUOIOQGVMROY-LBPRGKRZSA-N 356.448 0.122 10 10 FCCE O=C(O)CNC(=O)CN1C(=O)/C(=C/c2ccccc2O)SC1=S 15036400 NDBSIJIGXQMBOU-YHYXMXQVSA-N 352.393 0.794 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C(=O)[C@H]4C[C@H]4C3=O)CC2)cc1 758233776 WQTWVXCPFFQFGB-BHYGNILZSA-N 359.426 0.183 10 10 FCCE CCOC(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)/C=C/c1ccc(O)c(O)c1 787663375 UORFEBHQPWCFOI-QISKZBHPSA-N 350.371 0.684 10 10 FCCE CC(=O)C(=O)COC(=O)CCNC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C 808536476 KXPNNRRKOWJXJW-GFCCVEGCSA-N 370.402 0.594 10 10 FCCE COc1ccc(N(C)CCN(C)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](O4)[C@@H]3C2=O)cc1 844725949 RBDOULGUECXIRG-TVFCKZIOSA-N 371.437 0.959 10 10 FCCE COC(=O)[C@@H]1C[C@H](N2C(=O)CNC2=O)CN1Cc1cccc(Cl)c1O 857057007 LCNSITWLZXLNNU-JQWIXIFHSA-N 367.789 0.713 10 10 FCCE CCN1CCN(c2nnnn2Cc2ccc(N3CCOCC3)cc2)CC1=O 1337058225 GWSONHZJMWASBY-UHFFFAOYSA-N 371.445 0.227 10 10 FCCE C[C@@]1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCNC(=O)C1 1462808674 POAMGPQQKUJZTI-HXUWFJFHSA-N 372.469 0.921 10 10 FCCE CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCc2cc(O)c(O)cc2C1 2318626539 PKZROOLFSVRHFA-CQSZACIVSA-N 352.387 0.868 10 10 FCCE CCOc1cccc(CN2CCN(CC(=O)N3CCOCC3)CC2)c1O 768197187 INZVMCKKSZXLNE-UHFFFAOYSA-N 363.458 0.767 10 10 FCCE C[C@@H]1C(=O)N(C)CN1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 830778201 NZGBKFARMZAGMC-CYBMUJFWSA-N 364.421 0.399 10 10 FCCE COC(=O)c1cc(OCC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1N(C)C 1189968727 YIZGVTNIZIUOIX-LLVKDONJSA-N 370.427 0.221 10 10 FCCE Cc1nnc(N2CCNC(=O)CC2)n1Cc1ccc(N2CCOCC2)cc1 1290881413 VRHNIUHVLOUWCJ-UHFFFAOYSA-N 370.457 0.798 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](O)c1cnn(C)c1 1611046106 VLFZIMTXZARQDG-SWLSCSKDSA-N 363.370 0.155 10 10 FCCE CN(C)c1ccc([C@@H](NC(=O)CC[C@H](N)C(=O)O)c2nccn2C)cc1 1866021165 AKOHXOQHXGCTRT-GOEBONIOSA-N 359.430 0.884 10 10 FCCE COc1cccc(CNC[C@@H]2[C@@H](O)[C@H](O)CN2C(=O)OC(C)(C)C)c1O 2225621295 CBESSPBYVZWKII-XJKCOSOUSA-N 368.430 0.832 10 10 FCCE COc1ccc(N2CCN([C@H](C)C(=O)N3CCN(C(C)=O)CC3)CC2)cc1 42290134 CAGWZKYHBHJELZ-MRXNPFEDSA-N 374.485 0.896 10 10 FCCE Cc1ccc(C(=O)O[C@@H](C)C(=O)N(C)CC(=O)NC2CC2)c(O)c1O 727003901 IILLYAZMQCUIMV-JTQLQIEISA-N 350.371 0.689 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN2CCN(CCC(=O)N(C)C)CC2)c1O 774904168 PGVLFHFACCRZDW-UHFFFAOYSA-N 366.418 0.905 10 10 FCCE COCCOCCS(=O)(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849416823 XESQIXODTUWKMB-CQSZACIVSA-N 358.460 0.856 10 10 FCCE COC(=O)COc1ccc(N(C)Cc2cc(=O)n3nc(N)[nH]c3n2)cc1 856736853 NTIKUYWXDSZWMC-UHFFFAOYSA-N 358.358 0.188 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N1[C@H]2CC[C@@H]1CN(C)C(=O)C2 897791571 QKISITHGSBPNFT-DLBZAZTESA-N 372.469 0.899 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CC(=O)N(CC2CC2)C1 897791616 RNZIYGYMEMYKMG-MRXNPFEDSA-N 372.469 0.804 10 10 FCCE COc1ccc(CNC[C@H](O)CS(C)(=O)=O)cc1Cn1cccn1 922825675 OQMKZMHRQFSSBX-HNNXBMFYSA-N 353.444 0.435 10 10 FCCE N[C@@H]1CCO[C@H]([C@H]2CCCN(C(=O)C(=O)N3Cc4cccc(O)c4C3)C2)C1 1329504628 NQYMCJRTMIOGJO-DAYGRLMNSA-N 373.453 0.979 10 10 FCCE COc1ccc(N2CCN(C(=O)C3=C4CCCN=C4NN3)CC2)c(OC)c1 1631372295 MPCJFUDQSUTQBJ-UHFFFAOYSA-N 371.441 0.907 10 10 FCCE COc1ccc(N2CCN(C(=O)CCn3ccc(O)nc3=O)CC2)cc1 1873831323 DOXJNSMWLWLQNJ-UHFFFAOYSA-N 358.398 0.696 10 10 FCCE CN[C@H]1C(=O)Nc2cc(N3CCNC(=O)CC3)c(Br)cc21 118712383 VZOAHKCSVOABLD-CYBMUJFWSA-N 353.220 0.988 10 10 FCCE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H]2CN(C)NC2=O)C1 569659881 LYJKYSGVINRIFG-INIZCTEOSA-N 369.469 0.869 10 10 FCCE CCN1CCC(NC(=O)C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 826668434 YIZTYOZTKMRELA-MRXNPFEDSA-N 374.485 0.991 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@@H](C)[C@@H]3CCC(=O)N3)CC2)cc1 858839436 DTTDGBSYHRXFCH-YJBOKZPZSA-N 374.485 0.848 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN3C[C@@H](F)C[C@H]3C2)c1 1468321016 QGYIXBZTWKOQIA-JQWIXIFHSA-N 357.407 0.632 10 10 FCCE CC(=O)N[C@@H](CC(=O)Nc1c(-c2ccccn2)nc2ccccn12)C(N)=O 1625656930 IRLVEFHHCKHZMH-ZDUSSCGKSA-N 366.381 0.715 10 10 FCCE O=C(CCN1C(=O)CSC1=S)N1CCN(c2ncccn2)CC1 1865766229 XUBNDAMLKWGXFC-UHFFFAOYSA-N 351.457 0.376 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC(N=[N+]=[N-])C1)C1CS(=O)(=O)C1 2020694917 FMSPYDVPWOBASS-SNVBAGLBSA-N 359.408 0.445 10 10 FCCE CC1(C)O[C@@H]2CO[C@]3(COS(=O)(=O)N=[N+]=[N-])OC(C)(C)O[C@H]3[C@@H]2O1 96030640 ULLWHTAOFMDWSA-KZFFXBSXSA-N 365.364 0.956 10 10 FCCE CCN(C(=O)C(=O)N(C(C)=O)c1ccc(N)cc1)[C@@H]1CCS(=O)(=O)C1 170318712 ZEYNMTFUEXTRFB-CQSZACIVSA-N 367.427 0.184 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CCN(C(C)=O)C[C@H]3C)CC2)cc1 268701547 RKRNAJKTGKNKQF-MRXNPFEDSA-N 374.485 0.896 10 10 FCCE CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC(=O)NCCc1ccc(N)cc1 841897474 UKALSYVAPWGZAN-ZFWWWQNUSA-N 354.476 0.828 10 10 FCCE CN1CCN(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2cccnc21 1126549382 FVYCTTOYJCGLTH-UHFFFAOYSA-N 359.411 0.362 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@H]3C[C@H](OC)C3)C2)cc1 1331843795 KJQZEZITTORPBU-CKEIUWERSA-N 361.442 0.931 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C(=O)[C@H]4C[C@@H]4C3=O)CC2)cc1 758233783 WQTWVXCPFFQFGB-XIRDDKMYSA-N 359.426 0.183 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@]3(C)CCN(C)C3=O)cc2)CC1 822321222 YAXFSWYDUSQSDH-FQEVSTJZSA-N 372.469 0.840 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCCn3ccnc3)C2)cc1 826604635 RDTBIJJPKJDHHR-OAHLLOKOSA-N 371.441 0.793 10 10 FCCE COc1ccc(N2CCN(S(=O)(=O)CCNC3CSC3)CC2)cc1 827049058 UYEPUDXLNDOCNA-UHFFFAOYSA-N 371.528 0.852 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@H]3CCC(=O)N(C)C3)C2)cc1 828188303 MJROZZGCJCKLKD-KBPBESRZSA-N 374.441 0.127 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N3CN(C)C(=O)[C@@H]3C)CC2)cc1 834698886 PPTCFSVTXDTWHE-ZDUSSCGKSA-N 374.441 0.427 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H]3C[C@@](C)(O)C3)CC2)cc1 841448302 FKIVUKAHQCKDJP-CDAGHINYSA-N 373.453 0.930 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)C(=O)N(C)CCCCO)cc1 846269279 VLQUHPQASDIGHO-UHFFFAOYSA-N 351.447 0.821 10 10 FCCE COC(=O)[C@](C)(CCF)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 855910199 KDPFKMACKQFPML-AWEZNQCLSA-N 362.379 0.785 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CC[C@@]2(O)C[C@H]2C1)c1ccc(N2CCOCC2)cc1 1118602628 DCZDQWMAZPHILT-PTSWNOGYSA-N 373.453 0.684 10 10 FCCE CCS(=O)(=O)N[C@@H](CCSC)C(=O)NCc1cccc(O)c1O 1455318086 LXFWJVBDMORXHV-NSHDSACASA-N 362.473 0.775 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C1(O)COC1 1464267570 FLLZKVWLOUBRCG-UHFFFAOYSA-N 360.332 0.920 10 10 FCCE COC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)NCc1cc(Cl)ccc1O 1565166023 GFYRQIQQRXICEI-IUCAKERBSA-N 357.794 0.911 10 10 FCCE CC(C)(C)OC(=O)N[C@@H]1CC(C(=O)N2CCCn3ncc(N)c32)=C[C@H]1O 2136281354 TXHKAVGTNGZUKL-CHWSQXEVSA-N 363.418 0.786 10 10 FCCE CS(=O)(=O)C1(C(=O)O)CN(Cc2c(O)cccc2Br)C1 2379835905 AVBSVJULIFVHEZ-UHFFFAOYSA-N 364.217 0.838 10 10 FCCE Cc1cn(C)nc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 850356626 QSEUXHPUSBRXBX-UHFFFAOYSA-N 357.414 0.820 10 10 FCCE O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)N1Cc2cccc(O)c2C1 871202908 OOPWQIHICRGIQB-SRABZTEZSA-N 356.378 0.787 10 10 FCCE Cn1cnc(CCCNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)n1 1326862301 ILDZPZHMTNKHNY-UHFFFAOYSA-N 370.457 0.781 10 10 FCCE COCc1noc(CN2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)n1 1558965033 DOCQHZVZKVVBOR-UHFFFAOYSA-N 366.349 0.724 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1CS(=O)(=O)C1 1631533727 DHNGTSARXZSDBS-UHFFFAOYSA-N 361.803 0.592 10 10 FCCE CN1C[C@H](CCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1=O 1638503092 WJKPLCRTNRPDGW-SNVBAGLBSA-N 355.416 0.362 10 10 FCCE O=C1NC(=S)N(C2CCCCC2)C(=O)C1=CNCCN1CCOCC1 2296079571 PLZKKYMZPVPGOK-UHFFFAOYSA-N 366.487 0.368 10 10 FCCE NC(=O)[C@@H]1CC[C@H](CNC(=O)NCc2cc(Br)ccc2O)O1 805201360 UBBOZWXTFKNPOL-PWSUYJOCSA-N 372.219 0.987 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H]3CCC(=O)N(C)C3)C2)cc1 828188306 MJROZZGCJCKLKD-UONOGXRCSA-N 374.441 0.127 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCCn3ccnn3)C2)cc1 828413802 WUYLSGINUXUGEC-AWEZNQCLSA-N 372.429 0.188 10 10 FCCE COc1ccc(N2CCCN(S(=O)(=O)C[C@@H]3CNCCO3)CC2)cc1 866746988 NEJLKTKMGFAUTN-KRWDZBQOSA-N 369.487 0.526 10 10 FCCE C[C@H](NC(=O)C(=O)N1CCCn2nncc2C1)c1ccc(N(C)C)cc1 1119475478 MCHUKQNLAVYYKQ-ZDUSSCGKSA-N 356.430 0.954 10 10 FCCE O=C(C[C@@H]1NC(=O)NC1=O)NCc1ccc(N2CCC(CO)CC2)cc1 1324844221 XDQXJGOEMHODOH-HNNXBMFYSA-N 360.414 0.110 10 10 FCCE CNC(=O)CCNC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1313304159 DQALSBPBGJOSCN-UHFFFAOYSA-N 361.446 0.324 10 10 FCCE CNC1CCN(C(=O)C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1 1331834514 LIMVJEBNVFZYTA-UHFFFAOYSA-N 374.485 0.944 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CNCc3noc(C)n3)CC2)cc1 819073117 BOLUPMIRKSYUJN-MRXNPFEDSA-N 361.446 0.659 10 10 FCCE CCCN(Cc1ccccc1O)C(=O)C(=O)N1CCO[C@H]([C@@H](C)O)C1 840981470 VFVUMKZHSAJBLX-CJNGLKHVSA-N 350.415 0.739 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@H](NC(=O)C3CC3)[C@@H](C)O)C2)cc1 855228203 XFZNJVFHMFEASX-HACGYAERSA-N 361.442 0.666 10 10 FCCE O=C(/C=C\c1ccc(O)c(O)c1)N1CCS(=O)(=O)[C@@H]2COCC[C@H]21 1161283371 CWRHYUPTTJLMGQ-GFEROUPYSA-N 353.396 0.526 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)N2CCS(=O)(=O)[C@H]3COCC[C@@H]32)cc1 1570205180 KYSQLACCLCYZKO-STQMWFEESA-N 366.399 0.877 10 10 FCCE COc1ccc(CNC[C@@H](O)CNC(=O)[C@H]2CC[C@@H](C(N)=O)C2)cc1C 1667888369 NEUIUNFTJSYHBK-OWCLPIDISA-N 363.458 0.472 10 10 FCCE COc1ccc(N2C[C@@H](NC(=O)C(F)(F)F)C[C@H](C(N)=O)C2)c(N)c1 2106883906 VWGUQZKTMBNRQE-IUCAKERBSA-N 360.336 0.636 10 10 FCCE CS(=O)(=O)N[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 819920754 YUSGCUAQFGPCLJ-QMMMGPOBSA-N 356.360 0.054 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](N)COC(C)C)cc2)CC1 852825448 KJSXXLUYRUTXCE-SFHVURJKSA-N 362.474 0.724 10 10 FCCE CN1C(=O)CN(CC(=O)NCc2cc(Br)ccc2O)C1=O 861687003 IQOPVXSBTBMFRK-UHFFFAOYSA-N 356.176 0.665 10 10 FCCE CC(C)(C)OC(=O)N1Cc2nncn2C[C@@H]1C(=O)C(=O)C[C@H]1C[C@H](N)C1 2112570535 BEYWILJFBMKTJR-IJLUTSLNSA-N 363.418 0.663 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@H]1CNCc1cccc(F)c1O 2312324500 CSXLPLNAUZGRLA-NFAWXSAZSA-N 356.394 0.962 10 10 FCCE COc1ccc(N2CCN(C(=O)c3cnc(O)n(C)c3=O)CC2)cc1F 267854929 BPAMWWPQLJMRGE-UHFFFAOYSA-N 362.361 0.596 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCC3(CC2)OCCO3)cc1F 803661332 XIHVNUOYDFGVNE-UHFFFAOYSA-N 365.405 0.873 10 10 FCCE C[C@H](NC(=O)N1CCN2[C@@H](CNS2(=O)=O)C1)c1ccc(N(C)C)cc1 922056219 WMZGGYIJUYNTMN-WFASDCNBSA-N 367.475 0.357 10 10 FCCE O=C(NCCc1ccc(O)c(O)c1)[C@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1445938038 MVWYACNKSZKTRW-VHSXEESVSA-N 367.345 0.980 10 10 FCCE O=C1NC[C@H](Cn2cc(C(=O)NCc3ccc(N4CCCC4)cc3)nn2)O1 1464076302 FKGFHVAQPHGIQP-OAHLLOKOSA-N 370.413 0.917 10 10 FCCE C[C@H](NC(=O)[C@@H]1[C@@H](c2cnn(C)c2)N(C)C(=O)[C@@H]1O)c1ccccc1O 1648893624 ACGLBCZTWIGWJD-ZWMNYZCKSA-N 358.398 0.493 10 10 FCCE COc1ccc(N2CCN(C(=O)CCNC(=O)c3cnccn3)CC2)cc1 1873831511 PXCZNRXCVXITII-UHFFFAOYSA-N 369.425 0.954 10 10 FCCE COCCN1C(=O)C(=CNC(=O)Nc2ccc(C)cc2)C(=O)NC1=S 2042447911 ABFCRVSAAIGKJQ-UHFFFAOYSA-N 362.411 0.890 10 10 FCCE CS(=O)(=O)NC1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 757508840 OBPRSYWGUGJSDS-UHFFFAOYSA-N 370.387 0.444 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCC3CCOCC3)C2)cc1 827072251 HQMMYCLBTHPIBW-OAHLLOKOSA-N 361.442 0.933 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)[C@H](OC)C(=O)O)CC2)cc1 901718692 XKKXRMMQVWAVFV-HNNXBMFYSA-N 351.403 0.033 10 10 FCCE CCC(N)(CC)CNC(=O)C(=O)C(=O)C(=O)NC[C@@H]1C[C@H]2C=C[C@H]1CC2 1348851635 FBOZTPVCHWPROX-IHRRRGAJSA-N 363.458 0.477 10 10 FCCE C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)N[C@H](C)c1ccccc1O 1587446867 AEEMNHOPDXGPMY-MNOVXSKESA-N 352.416 0.670 10 10 FCCE CC(=O)N1CC[C@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 816638737 WILUBVAEZXFSOT-LLVKDONJSA-N 355.416 0.362 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@@H]3CCNC[C@H]3C)C2)cc1 818676851 QATLFSMZIRXHTI-IIDMSEBBSA-N 374.485 0.752 10 10 FCCE NC1(CNC(=O)C(=O)NCCCSc2nccs2)CCOCC1 861742701 JCSRFKAXILWCFA-UHFFFAOYSA-N 358.489 0.366 10 10 FCCE NC[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C[C@H]1C(F)(F)F 1119066064 GKTUDRGANLIBFO-CMPLNLGQSA-N 357.332 0.830 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC[C@@]3(CNC(=O)C3)C2)c1 1320977645 ZEEJWQBLKAGKDJ-OAHLLOKOSA-N 353.400 0.116 10 10 FCCE CN(C)S(=O)(=O)C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)C(F)(F)F 1449327874 BPPVTOYCSFLNDM-LLVKDONJSA-N 370.349 0.579 10 10 FCCE CNC(=O)N[C@@H]1CCN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)C1 1471192430 YPBQHLXGKDOIKM-MRXNPFEDSA-N 374.489 0.651 10 10 FCCE Cn1cc(I)c(Cn2ccc3c(c2=O)CNCC3)n1 2341853292 UTFHOBVVKMJVOZ-UHFFFAOYSA-N 370.194 0.880 10 10 FCCE COc1ccc(CNC(=O)N[C@H]2CCN(C3CCOCC3)C2=O)c(O)c1 375687257 ARVJZMXOETVXLN-HNNXBMFYSA-N 363.414 0.980 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3C[C@H]4C[C@]4(CO)C3)CC2)cc1 782611733 DUZPFFOAGXSIMD-IMFGXOCKSA-N 361.486 0.492 10 10 FCCE OCCOCC1(O)CCN(Cc2ccc(N3CCC(O)CC3)cc2)CC1 895829300 PBTGRSFPTAAEFZ-UHFFFAOYSA-N 364.486 0.984 10 10 FCCE CN1CCC[C@@H](C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1=O 899473457 SHPAXZWHGLRXHQ-KRWDZBQOSA-N 372.469 0.873 10 10 FCCE CN(C)c1ccc([C@H](CNC(=O)C(N)=O)NC(=O)OC(C)(C)C)cc1 1136904599 XBYXEHADYKFQAW-ZDUSSCGKSA-N 350.419 0.920 10 10 FCCE C[C@@H](NC(=O)c1ccc2c(=O)n(C)c(=O)n(C)c2n1)c1ccccc1O 1151885763 GHQLVUIUFFJPPI-SNVBAGLBSA-N 354.366 0.829 10 10 FCCE COC(=O)[C@]1(N2CCN(C(=O)c3ccc(C)c(O)c3O)CC2)CCOC1 1331671172 PVKYGKKKTUPXBQ-SFHVURJKSA-N 364.398 0.496 10 10 FCCE CCCS(=O)(=O)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 41428789 GYMXRPYXGXTQTD-UHFFFAOYSA-N 355.460 0.673 10 10 FCCE CN(CC1(CO)CC1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 284240893 YQDWTAGGGRODAV-UHFFFAOYSA-N 361.442 0.370 10 10 FCCE CCN1C[C@H](S(=O)(=O)N2CCOc3cc(N(C)C)ccc32)CC1=O 632051189 FPNNNKHUKUIBFK-CYBMUJFWSA-N 353.444 0.902 10 10 FCCE CC(C)(CO)N1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC1 761897726 IWEKTVVKXIJACE-UHFFFAOYSA-N 350.375 0.819 10 10 FCCE CO[C@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@](C)(CO)C1 867702393 XQOJXXUUGXOLNG-VQIMIIECSA-N 363.458 0.709 10 10 FCCE COC(=O)[C@]1(N2CCN(C(=O)c3cccc(O)c3O)CC2)CCOC1 1261828535 NJENQUIFFGWARK-KRWDZBQOSA-N 350.371 0.188 10 10 FCCE CS(C)(=O)=NS(=O)(=O)CCNC(=O)/C=C\c1ccc(O)c(O)c1 1652112748 LNPNAYNPBIYLGM-XQRVVYSFSA-N 362.429 0.285 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC(CN=[N+]=[N-])CC1 2136334946 GDFURQWESNQCCD-YNEHKIRRSA-N 369.422 0.876 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1CNCc1ccc(F)cc1O 2312328654 XHXBGTIBESIPLU-CFVMTHIKSA-N 356.394 0.962 10 10 FCCE CC(=O)N1CC[C@@H](CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 816638738 WILUBVAEZXFSOT-NSHDSACASA-N 355.416 0.362 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNC[C@@H](O)C(C)C)CC2)cc1 843080048 DKRHLZJVBQHIQG-PKOBYXMFSA-N 351.491 0.785 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCC(=O)N(C)C3=O)C2)cc1 852388767 QTKPXFQXVPUURM-IUODEOHRSA-N 360.414 0.721 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)Cn3[nH]cc4c(=O)ncnc3-4)C2)cc1 855232236 RNKWZCPGGAYOTN-LBPRGKRZSA-N 368.397 0.475 10 10 FCCE CN1CCN(c2ccc(CNC(=O)C3CN([C@H]4CCOC4)C3)cc2)CC1 899212159 QKZZNRVZEPJVIT-IBGZPJMESA-N 358.486 0.775 10 10 FCCE O=S1(=O)CCN(Cc2ccc(N3CCOCC3)cc2)[C@H]2CCOC[C@@H]21 930701939 WVIPRWPAPWRAKT-ROUUACIJSA-N 366.483 0.911 10 10 FCCE C[C@@H](CC(N)=O)NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1313304029 APUAREUSVJLHGE-LBPRGKRZSA-N 361.446 0.451 10 10 FCCE C[C@@H]1CN(C(=O)C(=O)N(C)Cc2ccc(N(C)C)cc2)CCS1(=O)=O 1329391216 DPTQKJPVNQWYNW-CYBMUJFWSA-N 367.471 0.357 10 10 FCCE O=C(CCNS(=O)(=O)c1cccnc1)NCc1cccc(O)c1O 1651172828 HZWFGIQYQSCCMQ-UHFFFAOYSA-N 351.384 0.478 10 10 FCCE CC(C)(C)OC(=O)NC(CO)(CO)CNC(=O)Cc1ccc(N)cc1 2258301763 LZOQCHHVFCALRC-UHFFFAOYSA-N 353.419 0.176 10 10 FCCE CN[C@@H]1C(=O)Nc2cc(N3CCNC(=O)[C@H]3C)c(Br)cc21 92775868 XRJZCWBRWLVHFB-KRTXAFLBSA-N 353.220 0.986 10 10 FCCE O=C(CNC(=O)c1cccnc1)NCc1ccc(N2CCOCC2)cc1 161509745 NEERAOBHGYPTLD-UHFFFAOYSA-N 354.410 0.964 10 10 FCCE COc1ccc(O)c(CNC(=O)N[C@@H]2CCC[C@H]2CNS(C)(=O)=O)c1 800706509 DRSOAPWRXKXPEE-SMDDNHRTSA-N 371.459 0.918 10 10 FCCE CN(C)c1ccc([C@@H](N)CNC(=O)c2cn([C@@H]3CCCNC3)nn2)cc1 832278524 DQVSGBBCKSMBAQ-CVEARBPZSA-N 357.462 0.698 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)N[C@H]3CCNC3=O)cc2F)CC1 852412219 ZOUZPKJOUICPQY-HNNXBMFYSA-N 363.437 0.655 10 10 FCCE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@H](C(N)=O)C3)cc2)C1 858774346 ZTDUGPJHFYRPQI-KKUMJFAQSA-N 373.457 0.451 10 10 FCCE COc1ccc(N2CCN(C(=O)CONC(=N)c3cncn3C)CC2)cc1 871783221 OKYFPMWVDYNIFN-UHFFFAOYSA-N 372.429 0.624 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CC4CC3(CN)C4)CC2)cc1 923389579 DVVXPVPYWQUJJU-IPCDKGFNSA-N 360.502 0.601 10 10 FCCE NC(=O)N[C@@H](CO)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1137082388 YAFGSJWDBKAWTH-GWCFXTLKSA-N 372.372 0.402 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@]34CC[C@H]3CNC4)cc2)CC1 1340454396 YYRDKXVQJLKCHW-PXNSSMCTSA-N 356.470 0.971 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC[C@H](O)[C@@H]3C)CC2)cc1 1627689628 RPUVAMORCBKNDA-KJTGTQQJSA-N 373.453 0.882 10 10 FCCE COC(=O)/C=C/c1ccc(N2CC[C@H](CS(N)(=O)=O)C2)c([N+](=O)[O-])c1 1651480583 BKBHTDQPNHGPIT-PYEVWLCESA-N 369.399 0.896 10 10 FCCE CN[C@H]1C(=O)Nc2cc(N3CCOC[C@H]3CO)c(Br)cc21 253061247 DVNODLPYBLPRTM-AMIZOPFISA-N 356.220 0.859 10 10 FCCE CS(=O)(=O)[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 763543184 MIKSELHXNDUFDB-VIFPVBQESA-N 355.372 0.939 10 10 FCCE CN(C)c1ccc(/C=C/CN2CCN(C(=O)Cn3cnnn3)CC2)cc1 835053972 QOGQXZHXQKWXFL-ONEGZZNKSA-N 355.446 0.597 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N3CCN4C[C@H](O)C[C@H]4C3)C2)cc1 854296290 IFCDDQVPUMAVRQ-BHYGNILZSA-N 360.458 0.734 10 10 FCCE CN1C[C@H](O)C[C@@]1(C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 924251801 FOZRJDAZMGHTPZ-XLIONFOSSA-N 374.485 0.460 10 10 FCCE O=C(NCC1CC1)[C@H]1CCCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)C1 1335547867 HEVQYHBGOQEISR-HNNXBMFYSA-N 371.437 0.999 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)/C=C\Cn3cncn3)cc2)CC1 1558397124 KKBGJFRYEHTTQM-UPHRSURJSA-N 368.441 0.852 10 10 FCCE CCOC(=O)[C@H]1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1652977318 WJLCCOWGNSTGSB-JTQLQIEISA-N 356.400 0.789 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc(O)nc(O)c2)[C@@H](O)C1 2052705861 NDRPJWCUSXBXHM-QWRGUYRKSA-N 353.375 0.593 10 10 FCCE O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C/NCCCO 103766689 OJLZOERRGLHYOM-DHZHZOJOSA-N 368.187 0.888 10 10 FCCE COc1cccc(CNC(=O)C(C)(C)NC(=O)C(C)(C)NC(C)=O)c1O 860241183 PGQNEPZLAIEPEY-UHFFFAOYSA-N 365.430 0.827 10 10 FCCE COC(=O)CNC(=O)CNCc1c(C(=O)OC)n(C)c2ccc(F)cc12 895450848 DKQJNHVHGNCZPB-UHFFFAOYSA-N 365.361 0.483 10 10 FCCE NC(=O)[C@@H]1C[C@@H]1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 901286802 KMOGFOFAVWYEGK-MSOLQXFVSA-N 356.470 0.956 10 10 FCCE CCOC(=O)C[C@H](O)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 1150241369 ZBCQGPDBOSWWAU-AWEZNQCLSA-N 354.378 0.797 10 10 FCCE C[C@H]1[C@@H](O)CCN1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 1252843118 GNNXEMVDOQCRJV-BBRMVZONSA-N 367.471 0.586 10 10 FCCE COCCCOC1CN(C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1321989584 YETALHHPESYJEA-UHFFFAOYSA-N 367.421 0.772 10 10 FCCE O=C(NC[C@H]1C[C@H]2C=C[C@H]1CC2)C(=O)C(=O)C(=O)N[C@@H]1CCNC12CCC2 1329096012 VGFFZXRKZFOFBY-BYNSBNAKSA-N 373.453 0.244 10 10 FCCE C[C@@H]1COCC[C@@H]1NC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1338556654 POAINWLGLYXYAQ-QAPCUYQASA-N 374.485 0.596 10 10 FCCE CC(=O)N1CCN(C(=O)CCNCc2cc([N+](=O)[O-])ccc2O)CC1 1560314150 OCBASELPIAMXSC-UHFFFAOYSA-N 350.375 0.471 10 10 FCCE CC(C)(C)OC(=O)N1CC(CNCc2ccc(O)cc2O)(C(N)=O)C1 2041264158 AJKALGRYEYENFD-UHFFFAOYSA-N 351.403 0.910 10 10 FCCE O=C(NCCCSc1nccs1)C(=O)N1CCN2CCOC[C@@H]2C1 806281630 FAOHAVLGICAHOR-LBPRGKRZSA-N 370.500 0.285 10 10 FCCE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)N1CCC[C@@](N)(CO)C1 926288799 OTUAFOPQNLPGKA-IBGZPJMESA-N 362.474 0.413 10 10 FCCE CCN(OC)C(=O)CNC(=O)C(=O)N(C)Cc1ccc(N(C)C)cc1 1118232758 SQPDZZVAMBZTPH-UHFFFAOYSA-N 350.419 0.237 10 10 FCCE CN(Cc1ccccc1O)C(=O)C(=O)N1CCC(N2CC[C@H](O)C2)CC1 1333366979 YUKVJBWIMHBKBZ-INIZCTEOSA-N 361.442 0.408 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC3(CCNC(=O)O3)C2)c1 1645890725 QXXOGMBWGHFAHM-UHFFFAOYSA-N 355.372 0.088 10 10 FCCE C[S@](=O)[C@H]1CC[C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 1654842569 NYUYMSYYWLSCHR-RZPDLZAOSA-N 360.457 0.793 10 10 FCCE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1C[C@H](O)[C@@H](CO)C1 1681849651 DSUXCQCIEWXWTQ-DOMZBBRYSA-N 371.384 0.296 10 10 FCCE COc1ccc(CNCC(CO)(CO)NC(=O)OC(C)(C)C)c(O)c1 2258273767 FRLGNBMAXJVXSK-UHFFFAOYSA-N 356.419 0.739 10 10 FCCE COc1ccc(C(=O)OCC(=O)C(C)=O)cc1S(=O)(=O)NC1CC1 808497366 YUMWAYWZOQNMML-UHFFFAOYSA-N 355.368 0.451 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@@H]3COC(=O)C3)cc2)CC1 1313190705 GEBJSAUHEPOFRK-AWEZNQCLSA-N 360.414 0.503 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3CCNC3=O)cc2)C1 1358167692 FUQBIPUKDSMEQE-LSDHHAIUSA-N 358.442 0.531 10 10 FCCE C[C@H](NC(=O)Cn1cnnn1)C(=O)NCc1ccc(N2CCCC2)cc1 1464076203 DHZVCHSTOMBZCZ-ZDUSSCGKSA-N 357.418 0.094 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCC(=O)O 2059668870 BMWSOKOBFRCWAZ-JTQLQIEISA-N 354.359 0.734 10 10 FCCE COc1ccc(O)c(CNC[C@@H]2[C@H](O)[C@@H](O)CN2C(=O)OC(C)(C)C)c1 2225623614 QTGOCJQNPHMYHX-KBMXLJTQSA-N 368.430 0.832 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1CCO[C@]2(CCOC2)C1 288442118 FGGAJUKUVABXAS-HXUWFJFHSA-N 371.437 0.697 10 10 FCCE C[C@H](CS(C)(=O)=O)N(Cc1cc(O)n2ncc(C(=O)O)c2n1)C1CC1 737673635 GAHNGBBXUGWUPC-SECBINFHSA-N 368.415 0.531 10 10 FCCE CC(=O)C(=O)COC(=O)CNC(=O)[C@@H]1c2ccccc2C(=O)N1C1CC1 808510452 UCBXEQBFJNURTA-INIZCTEOSA-N 358.350 0.163 10 10 FCCE COc1ccc(N2CC[C@H](CNC(=O)C(=O)N[C@@H]3CCNC[C@@H]3C)C2)cc1 818676848 QATLFSMZIRXHTI-HDMKZQKVSA-N 374.485 0.752 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)N1CC[C@@H](OCCN2CCOCC2)C1 1294691640 XOLLSGDDJCEKOC-OAHLLOKOSA-N 350.415 0.590 10 10 FCCE O=C(NCc1cc(O)ccc1O)[C@H]1CS(=O)(=O)C[C@H]1C(F)(F)F 1303225158 ACRJFAOQBJODOX-VHSXEESVSA-N 353.318 0.937 10 10 FCCE O=C(N[C@@H](CO)C(=O)NCc1cccc(Cl)c1O)c1cccc(F)n1 1305085002 PYLDEODTQCYZPE-LBPRGKRZSA-N 367.764 0.987 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N(C)CCNS(C)(=O)=O)C2)cc1 1333778092 MFPKVCZSFPVAEE-ZDUSSCGKSA-N 370.475 0.465 10 10 FCCE O=C(C=Cc1ccc(N2CCOCC2)cc1)N1CCN2C(=O)NC[C@@H]2C1 2042436717 NZGVHGTVTKJEAX-QGZVFWFLSA-N 356.426 0.772 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@@H]1CNOC1 2136259979 YNWKDCFIGIVVNT-NEPJUHHUSA-N 367.402 0.553 10 10 FCCE CCOc1ccccc1N1C(=O)NC(=O)C(=CNN2CCN(C)CC2)C1=O 2297059842 LVPJEWOPWUCQFW-UHFFFAOYSA-N 373.413 0.304 10 10 FCCE NC(=O)C[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(O)cc2)SC1=S 2314541835 QWGMYMKQEQSUTM-SECBINFHSA-N 352.393 0.922 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3CC(=O)N(C)[C@@H](C)C3)CC2)cc1 282204583 OCSFIWXVWJAHKP-HNNXBMFYSA-N 360.458 0.506 10 10 FCCE Cn1ccnc(N2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)c1=O 769467390 WTLJLAJZJFFITO-UHFFFAOYSA-N 369.469 0.939 10 10 FCCE CN(Cc1cnccn1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 788323705 OCLLNNADPKMOTM-UHFFFAOYSA-N 369.425 0.588 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@H]2COC[C@H]2C1 827079590 YHQWNQRTCSAKEE-DLBZAZTESA-N 373.453 0.634 10 10 FCCE C[C@@H]1C(=O)N(CCN(C)C)CN1Cc1ccc(N2CCN(C)CC2)cc1 843428714 MBEZPZWXYRSNPJ-QGZVFWFLSA-N 359.518 0.990 10 10 FCCE CC(=O)NCCNC(=O)CCC(=O)NCc1ccc2cccnc2c1O 862027921 JUHBWLJCRDGJNN-UHFFFAOYSA-N 358.398 0.589 10 10 FCCE CNS(=O)(=O)C[C@@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 863825098 KZRQVEXQWRETRN-SCXUMTSISA-N 354.428 0.899 10 10 FCCE CN1CCN(c2ccc(CN3CCC(O)(COCCO)CC3)cc2)CC1 895829196 HWXJKMDWUULWNG-UHFFFAOYSA-N 363.502 0.774 10 10 FCCE CO[C@@]1(CNCc2ccc(N3CCOCC3)c(F)c2)CCS(=O)(=O)C1 922614490 CQXTYRZFFKRXLB-QGZVFWFLSA-N 372.462 0.956 10 10 FCCE COC(=O)[C@H]1C[C@@H](N(C)C(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)C1 1118604996 YEDNXFWMNSDCBS-BETUJISGSA-N 365.405 0.918 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CC[C@]3(CNC(=O)C3)C2)cc1 1321599306 VFYBRYLCCUVYBF-FQEVSTJZSA-N 372.469 0.888 10 10 FCCE COCCOC[C@@H]1CCN(Cc2cc(O)n3ncc(C(=O)O)c3n2)C1 1326500792 FIEXVRWLSRYRFW-LLVKDONJSA-N 350.375 0.618 10 10 FCCE O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)C1=CNCCCO 2297315693 OJLZOERRGLHYOM-UHFFFAOYSA-N 368.187 0.888 10 10 FCCE COC(=O)[C@@H]1CN(C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c2ccccc21 732175276 JQTSNDDXCBJKDQ-QIAWRQBBSA-N 369.377 0.401 10 10 FCCE C[C@@H](CS(C)(=O)=O)N(Cc1cc(O)n2ncc(C(=O)O)c2n1)C1CC1 737673636 GAHNGBBXUGWUPC-VIFPVBQESA-N 368.415 0.531 10 10 FCCE CN1CCN(c2ccc(CN3CCC[C@]4(C3)NC(=O)NC4=O)cc2)CC1 789770858 SAUPSEXVJHQWEX-LJQANCHMSA-N 357.458 0.612 10 10 FCCE O=S(=O)(C1CC1)N1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 802746468 PIINLKUEMGUDIU-MRXNPFEDSA-N 368.455 0.818 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCn2c(O)nnc2C1 853474985 VLJGWBHLPHSWHO-UHFFFAOYSA-N 358.402 0.546 10 10 FCCE COC[C@@H](CCCN)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 854220998 DMDWXASVPTZUSW-MRXNPFEDSA-N 355.504 0.765 10 10 FCCE O=C1COC[C@@]2(CNCc3c(O)cccc3Br)COCCN12 865796252 YZBFVGLGBBVALI-OAHLLOKOSA-N 371.231 0.872 10 10 FCCE NS(=O)(=O)C1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)C1 914200938 SPQGTJDAMLJPQN-UHFFFAOYSA-N 370.500 0.422 10 10 FCCE Cn1c(=O)c2cc(C(=O)NCc3c(O)cccc3O)sc2n(C)c1=O 1156886112 UJMQGYUHIDFKIM-UHFFFAOYSA-N 361.379 0.640 10 10 FCCE CN(CCCO)C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1331975026 VOHLZAHTBCFBNV-UHFFFAOYSA-N 361.442 0.540 10 10 FCCE CC(C)(C)OC(=O)N1CC(CNCc2cccc(O)c2O)(C(N)=O)C1 2041266589 SHGXASXIGVXPFX-UHFFFAOYSA-N 351.403 0.910 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N[C@H]1CNOC1 2136259980 YNWKDCFIGIVVNT-RYUDHWBXSA-N 367.402 0.553 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2332922616 DMJSWOAOWRRERV-UMSGYPCISA-N 369.422 0.876 10 10 FCCE CN[C@H]1C(=O)Nc2cc(N3CCS(=O)(=O)CC3)c(Br)cc21 118711698 UXOHLGNWVSBKEA-GFCCVEGCSA-N 374.260 0.897 10 10 FCCE O=C(NC1CCN(C(=O)c2cnccn2)CC1)c1cc(O)c(O)c(O)c1 169859808 OFWUVTZHDHBHKP-UHFFFAOYSA-N 358.354 0.628 10 10 FCCE COC[C@H](C)S(=O)(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 265370036 CNSSJRIVJBKKHE-HNNXBMFYSA-N 371.503 0.772 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)N[C@@H](C)CC(N)=O)CC2)cc1 745783838 FHMBCCVLWZKFHX-AWEZNQCLSA-N 363.462 0.380 10 10 FCCE CCS(=O)(=O)NCC(=O)NCc1cc(Br)ccc1O 804734670 VUMHLWIYFCFKID-UHFFFAOYSA-N 351.222 0.710 10 10 FCCE O=C(NCC12CC(CN1)C2)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 851691035 JQDKDENWABVLKT-CZDRUDQFSA-N 373.453 0.768 10 10 FCCE CC1(C)NC(=O)N(CC(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1=O 856208625 RGLQHXFLVQUDFB-UHFFFAOYSA-N 374.441 0.594 10 10 FCCE COC(=O)[C@@]1(CNC(=O)c2ccc(C)c(O)c2O)C[C@@H]1S(C)(=O)=O 1153953478 IAUQZYKSZNDEBJ-ZUZCIYMTSA-N 357.384 0.112 10 10 FCCE C[C@H]1CN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CCN1CC(C)(C)O 1351906770 JKQIEEQGHGBNDW-ZDUSSCGKSA-N 361.442 0.538 10 10 FCCE CN1CCn2ncc(C(=O)NCc3cc(Cl)ccc3O)c2S1(=O)=O 1469876179 DJHMQSUHLXBKDC-UHFFFAOYSA-N 370.818 0.806 10 10 FCCE COc1cc(C=C2SC(N3CCN(CCO)CC3)=NC2=O)ccc1O 2297315074 DZWOUCAOXZWQNA-UHFFFAOYSA-N 363.439 0.981 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C[C@@H](C(N)=O)CC[C@@H]3C)CC2)cc1 728733782 QSZVNOUDNRVQKG-HOTGVXAUSA-N 374.485 0.930 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCCC[C@H]2[C@@H]2CNC(=O)C2)cc1 785423928 IRJMUVGSCVFGNQ-RDJZCZTQSA-N 372.469 0.886 10 10 FCCE CC(=O)C(=O)COC(=O)c1cc(S(N)(=O)=O)ccc1Br 808495998 WTPBXSXEZQOHRC-UHFFFAOYSA-N 364.173 0.411 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)[C@@H]3CN(C)C(=O)N3)cc2F)CC1 826719709 UDABUPREQNTIID-HNNXBMFYSA-N 363.437 0.607 10 10 FCCE COc1ccc(N(CC(=O)O)CC(=O)NCCCc2ncn(C)n2)cc1 853010495 DDHZRRHEMRNHFL-UHFFFAOYSA-N 361.402 0.464 10 10 FCCE COC(=O)[C@@H]1CN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CCO1 854301531 QBVUFIYPGHMNRB-BBRMVZONSA-N 363.414 0.857 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(CC)CCNC1=O 1447343773 DXQUXQHPJYPKFU-KPZWWZAWSA-N 364.398 0.605 10 10 FCCE COC(=O)/C=C\c1ccc(N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)c([N+](=O)[O-])c1 1472856408 WGCRBHIDKITTKR-STNZKUDTSA-N 359.338 0.832 10 10 FCCE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](CO)NC(N)=O 1622328252 RJXREBGVMTZQFC-SNVBAGLBSA-N 360.208 0.532 10 10 FCCE O=C(O)[C@@H](NCc1cc(Br)ccc1O)C1CS(=O)(=O)C1 2197522626 ASPLSUPFMVLXRX-NSHDSACASA-N 364.217 0.742 10 10 FCCE N[C@H]1C(=O)Nc2cc(N3CCN(CCO)CC3)c(Br)cc21 118711725 TYLPJWQDUPQZMD-CYBMUJFWSA-N 355.236 0.515 10 10 FCCE COc1ccc(N2CCN(S(=O)(=O)C[C@H]3CNCCO3)CC2)cc1 326512982 BPOBYFVLWAWILN-MRXNPFEDSA-N 355.460 0.135 10 10 FCCE CN(C)S(=O)(=O)CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 752641913 VUZQDPJMLDIIOY-AWEZNQCLSA-N 356.444 0.791 10 10 FCCE CC(=O)N1CCN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)[C@@H](C)C1 803687793 PVWCPHQGVJAASD-AWEZNQCLSA-N 372.469 0.764 10 10 FCCE COc1ccc(N2CCN(C(=O)[C@@]3(C)C[C@H](O)CN3C)CC2)cc1F 900999411 SMRYEVIWFNFRNL-KBXCAEBGSA-N 351.422 0.938 10 10 FCCE CC(C)C[C@@H](CN)NC(=O)C(=O)C(=O)C(=O)NC[C@H]1C[C@H]2C=C[C@H]1CC2 1329023454 HZEOMQIXROTWCP-XQLPTFJDSA-N 363.458 0.333 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCS(=O)(=O)CCO1 1346141183 ULRDBPDIMCPEDM-UHFFFAOYSA-N 369.443 0.395 10 10 FCCE COc1ccc(CNC(=O)NC[C@]2(OC)CCS(=O)(=O)C2)c(O)c1 1565379325 JQAKDXYEWJTDFY-OAHLLOKOSA-N 358.416 0.404 10 10 FCCE NC(=O)[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(CCc2ccc(N)cc2)C1 2106666497 MFKGGNHLBKZHGL-YPMHNXCESA-N 358.364 0.666 10 10 FCCE CO[C@@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCOC1 827575002 LTMHJSUPDSWJRK-CJNGLKHVSA-N 367.421 0.676 10 10 FCCE COc1ccc(N2CC[C@H](NS(=O)(=O)C[C@@H]3CNCCO3)C2)cc1 866777664 VZVGCVWVCNGVQI-BBRMVZONSA-N 355.460 0.182 10 10 FCCE CN1CCN(c2ccc(CN[C@@H]3C(=O)NCC34CCOCC4)cc2)CC1 895773056 XYWLGUNYSWWVRF-GOSISDBHSA-N 358.486 0.823 10 10 FCCE CCCNC(=O)C1CCN(C(=O)C(=O)N2Cc3cccc(O)c3C2)CC1 1118999967 IWNMCCBRXXIWRF-UHFFFAOYSA-N 359.426 0.999 10 10 FCCE CN1C2(CCC2)COC[C@]1(CO)CNC(=O)Cc1ccc(O)c(O)c1 1147832352 TZZOBFMCRQKRAE-GOSISDBHSA-N 350.415 0.372 10 10 FCCE O=C(C(=O)N1CCNC[C@@H]1c1cccnc1)N1Cc2cccc(O)c2C1 1329563116 MBBZZWHEYGJZQU-MRXNPFEDSA-N 352.394 0.803 10 10 FCCE COC(=O)[C@@H]1CCCN(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)C1=O 1611430321 BMUAIESSUHWIJP-DGCLKSJQSA-N 364.398 0.557 10 10 FCCE O=C1C[C@]2(CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)C2)CN1 279477334 MKHOARCSQHCGAO-LJQANCHMSA-N 358.442 0.945 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCOC2(CNC2)C1 851680390 IZHMOXZTACMUAU-UHFFFAOYSA-N 360.458 0.532 10 10 FCCE O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N1C[C@@H]2C[C@H]1C[S@@]2=O 1326697183 XBKXKZFPINENOO-NWLBTCKQSA-N 359.451 0.411 10 10 FCCE COC(=O)[C@H]1CCN(C(=O)Cc2ccc(O)c(O)c2)[C@H](C(=O)OC)C1 1597208408 GRYJTDUMVCXXGK-RYUDHWBXSA-N 351.355 0.594 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](NS(=O)(=O)Cc2ccc(N)cc2)C1 2062451264 NGUZKCXLIRPSGN-KGLIPLIRSA-N 371.459 0.668 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@H]1C(=O)N1CC[C@H](CN=[N+]=[N-])C1 2127629462 IZUVKJOTHMTJER-VOAKCMCISA-N 369.422 0.876 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](O)[C@H]1C(=O)NCc1ccc(N)cc1 2136254819 AJJIHISVEBMECL-KKUMJFAQSA-N 365.430 0.616 10 10 FCCE COCCS(=O)(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCOCC1 21754670 ODCJDSPQUAKBSG-QGZVFWFLSA-N 371.503 0.692 10 10 FCCE CCOc1ccc(O)c(CN2CCN(CC(=O)NCCOC)CC2)c1 271028236 FYDCUESFXZGLRQ-UHFFFAOYSA-N 351.447 0.671 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)NCc1ccnn1C 284240740 VCLXNIXRLBSIGK-UHFFFAOYSA-N 371.441 0.532 10 10 FCCE O=C(COC(=O)C1COC1)NCc1ccc(N2CCOCC2)c(F)c1 785779569 SUOIANJHBKTKES-UHFFFAOYSA-N 352.362 0.468 10 10 FCCE O=S(=O)(NCc1cc(Br)ccc1O)N1CCOCC1 796191616 XUGPDKOJUHKBEV-UHFFFAOYSA-N 351.222 0.821 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCc3ccnn3C)C2)cc1 827132016 IREROHSAGDLJEZ-ZDUSSCGKSA-N 357.414 0.440 10 10 FCCE COC(=O)[C@@H]1[C@@H]2CC[C@H](O2)[C@@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 837755412 FYKQXSHGWAOCER-XQLPTFJDSA-N 350.323 0.790 10 10 FCCE CN1CCN(c2ccc(CNC[C@@]34COCCN3C(=O)COC4)cc2)CC1 865796111 QCCZVBKULQJCCX-FQEVSTJZSA-N 374.485 0.156 10 10 FCCE COc1ccc(N2CCC(NC(=O)C(=O)N3CCNC(=O)CC3)CC2)cc1 1257804614 ANBNGSXFJIBTBY-UHFFFAOYSA-N 374.441 0.129 10 10 FCCE CS(=O)(=O)N1CC(CNC(=O)c2cc3cc(O)c(O)cc3s2)C1 1296803989 XSMPOUFNZFUHBT-UHFFFAOYSA-N 356.425 0.934 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)C3(n4cnnn4)CC3)cc2)CC1 1626095595 WXUIRXLIVQSYNM-UHFFFAOYSA-N 369.429 0.180 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CO)c2ccccn2)c1 1637574111 DLCQMOXDKILVJR-ZDUSSCGKSA-N 351.384 0.622 10 10 FCCE CN(C)C(=O)Cn1cc(C(=O)NCc2ccc3cccnc3c2O)nn1 1643283445 WNJNRFZBLGOPGX-UHFFFAOYSA-N 354.370 0.550 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](COS(N)(=O)=O)Cc1ccc(O)c(O)c1 1951691834 AEQORDGPZXABAJ-SNVBAGLBSA-N 362.404 0.754 10 10 FCCE COc1ccc(Br)c(CNC[C@@H]2CCS(=O)(=O)N2)c1O 1965975032 AQEOFHOSCGXPSW-QMMMGPOBSA-N 365.249 0.945 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)NC[C@@H](O)CO 2124089545 SFOMZYGFUCGURA-NEPJUHHUSA-N 370.402 0.003 10 10 FCCE CO[C@H]1COCC[C@H]1N(C)C(=O)C(=O)NCc1ccc(N(C)C)cc1C 897791605 RGCFCLSMIDEUMY-SJORKVTESA-N 363.458 0.940 10 10 FCCE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)N1CC[C@]12CCOC2 1328212724 FXZYZMNCXOBHDC-HXUWFJFHSA-N 373.453 0.655 10 10 FCCE COC(=O)C1=S=C(NC(=O)c2cc(C(C)(C)C)n3ncnc3n2)C=C1 1523418889 YFCGUOVIKFVWSN-UHFFFAOYSA-N 359.411 0.930 10 10 FCCE CN(C(=O)[C@@H]1[C@H](O)[C@H](O)CCN1C(=O)OC(C)(C)C)c1ccc(N)cc1 2136255003 BZVBWQMBQZHYBZ-QLFBSQMISA-N 365.430 0.963 10 10 FCCE COc1cc(CNC=C2C(=O)N(C)C(=O)N(C)C2=O)cc(OC)c1OC 52529239 HIMAEMPYBCOSCS-UHFFFAOYSA-N 363.370 0.736 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C[C@H](C(N)=O)CC[C@@H]3C)CC2)cc1 728733784 QSZVNOUDNRVQKG-JKSUJKDBSA-N 374.485 0.930 10 10 FCCE COC(=O)[C@H]1CN(C(=O)/C=C\c2cn(C)c(=O)n(C)c2=O)c2ccccc21 732175271 JQTSNDDXCBJKDQ-CKXPSTMWSA-N 369.377 0.401 10 10 FCCE C[C@H](NC(=O)CS(=O)(=O)N(C)C)c1ccc(N2CCOCC2)cc1 751539119 TXTVNIPCYUCQIB-ZDUSSCGKSA-N 355.460 0.592 10 10 FCCE C[C@H]1C[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)c(F)c2)c2ncnn21 827574917 JAIKZSKNNDKFDK-GXFFZTMASA-N 360.393 0.922 10 10 FCCE CCN(CCNC(=O)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)C1CC1 827812109 CHHIAHLORRWLOH-OAHLLOKOSA-N 374.485 0.991 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@]34CNC[C@H]3COC4)cc2)CC1 846681486 ISJJSMZNYXPWFS-PXNSSMCTSA-N 372.469 0.207 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CNCC[C@H]3C)C2)cc1 851688521 CEWNHENWAXWGEY-JKIFEVAISA-N 360.458 0.504 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@@H](NC(=O)C3CC3)[C@H](C)O)C2)cc1 855228205 XFZNJVFHMFEASX-JDFRZJQESA-N 361.442 0.666 10 10 FCCE CC(=O)N1CCO[C@H](C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)C1 929537740 SCGPJEVIHKOVLZ-SFHVURJKSA-N 361.442 0.729 10 10 FCCE CCO[C@H](CNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1)CN(C)C 1119735466 QWYFCHGNGHAVOW-GOSISDBHSA-N 374.485 0.762 10 10 FCCE Cc1nc(S(=O)(=O)NCC(=O)N[C@@H](C)c2ccccc2O)cn1C 1171729433 CGXGTWLHGDZBCO-JTQLQIEISA-N 352.416 0.590 10 10 FCCE NC(=O)N=Nc1ccc(C(=O)NCC(=O)NCCN2CCOCC2)cc1 1565584549 ZSQKVPOLLOJFJM-UHFFFAOYSA-N 362.390 0.027 10 10 FCCE NC(=O)C1CCN(c2ccc(CNC(=O)c3cc(O)ncn3)cc2)CC1 1596355372 PMXIVUBIFBZAGB-UHFFFAOYSA-N 355.398 0.814 10 10 FCCE CN1CCC(CNC(=O)Cc2ccc(O)c(O)c2)(N2CCOCC2)CC1 1626500799 WLGREVUQSBYCBC-UHFFFAOYSA-N 363.458 0.553 10 10 FCCE COC(=O)[C@@]1(N2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)CCOC1 1640827335 FDCAOQDGSWVFGC-GOSISDBHSA-N 364.398 0.117 10 10 FCCE CC(C)(C)OC(=O)NC1(C(N)=O)CN(c2cc3c(cc2N)OCCO3)C1 2109490323 BYWQMPILGBECGW-UHFFFAOYSA-N 364.402 0.609 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](O)[C@@H]1C(=O)NCc1ccc(N)cc1 2332901274 AJJIHISVEBMECL-RBSFLKMASA-N 365.430 0.616 10 10 FCCE CCS(=O)(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 127235875 KRTQWJSWJJOOLH-UHFFFAOYSA-N 353.488 0.991 10 10 FCCE COc1cccc(CNC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c1O 715548417 IPKPPBZNASBLGU-UHFFFAOYSA-N 351.403 0.965 10 10 FCCE COc1ccc(O)c(CNS(=O)(=O)c2cc(C(=O)N(C)C)n(C)c2)c1 774773045 VFPCUJZCVPTYCH-UHFFFAOYSA-N 367.427 0.920 10 10 FCCE COc1cc(N2CCN(C(=O)C(=O)Nc3ccc(N)cc3)CC2)ncn1 841093869 VIIPJZLHIWJEHO-UHFFFAOYSA-N 356.386 0.355 10 10 FCCE CCS(=O)(=O)N[C@H](C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 854198236 FUXZLQUQRUCMPK-CYBMUJFWSA-N 355.460 0.672 10 10 FCCE Nc1ccc(CCNC(=O)N2CCC(N3C(=O)O[C@H]4CNC[C@H]43)CC2)cc1 861640387 KLRZTWOJSWYBGO-SJORKVTESA-N 373.457 0.778 10 10 FCCE CN1CCN(c2ccc(CNC[C@]34COCCN3C(=O)OC4)cc2)CC1 865769524 KXSJFMXKHAEYMN-LJQANCHMSA-N 360.458 0.749 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ncnn3C)C2)cc1 1334208233 LIHNJAZWZFXIOC-QWHCGFSZSA-N 372.429 0.396 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3CCN(C(C)=O)C3)C2)cc1 1334709378 DTNBKFSAKFXJKU-HUUCEWRRSA-N 374.441 0.127 10 10 FCCE CON(C)C[C@@H](O)Cn1cc(NC(=O)/C=C\c2ccc(O)c(O)c2)cn1 1466115069 UMHNUPFRXLDGRR-KXQLTZBTSA-N 362.386 0.800 10 10 FCCE CNC(=O)c1cncc(/C=C\C(=O)N2CCCc3ccc(C(N)=O)nc32)c1 1585630948 TYBKJYPRSKZHQY-DAXSKMNVSA-N 365.393 0.928 10 10 FCCE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cn(C(F)(F)CO)nn1 1618594766 ZIUXXOJJKFHIAQ-UHFFFAOYSA-N 353.329 0.925 10 10 FCCE CN1CCC(N(CCO)C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 1640279690 GRNTYUMLXNSWAE-UHFFFAOYSA-N 371.459 0.292 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)NCC(=O)N=S(C)(C)=O)C2)cc1 1687024049 YEUORGZJNKDWBT-LBPRGKRZSA-N 368.459 0.827 10 10 FCCE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)[C@@H]1NCCNC1=O 1952208534 KICSMGFAAJUXNF-FZMZJTMJSA-N 351.403 0.622 10 10 FCCE NC(=O)[C@@H]1C[C@@H](NC(=O)C(F)(F)F)CN(Cc2cc(N)ccc2O)C1 2106667243 UXSHGSZCQZZVAQ-MWLCHTKSSA-N 360.336 0.329 10 10 FCCE CNCCN(C)S(=O)(=O)NCc1ccc(C)c(Br)c1O 2380760487 XZQLTYUSWRZKIX-UHFFFAOYSA-N 366.281 0.949 10 10 FCCE COc1c([N+](=O)[O-])ccc(CN2CCC[C@@H](CS(N)(=O)=O)C2)c1O 278142079 BDTQEZPWLOBPFH-SNVBAGLBSA-N 359.404 0.810 10 10 FCCE COc1ccc(CNC2(C(N)=O)CN(C(=O)OC(C)(C)C)C2)c(O)c1 715550381 PVCZJFGLLWWLTR-UHFFFAOYSA-N 351.403 0.965 10 10 FCCE CN1CCC[C@@H](NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1 788331819 MJYRBDOFNAFTJD-MRXNPFEDSA-N 360.458 0.350 10 10 FCCE COc1cccc(CNC(=O)N[C@H]2CCC[C@@H]2CNS(C)(=O)=O)c1O 800747766 PZDRQLOJKNRZKI-YPMHNXCESA-N 371.459 0.918 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](N)C(F)(F)F)cc2)C1 827468721 CPZNPSQZPWFCEG-DGCLKSJQSA-N 358.364 0.894 10 10 FCCE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(=O)NC2CNC2)cc1 842234860 ICQKTJDOIRANHP-UHFFFAOYSA-N 356.426 0.962 10 10 FCCE CCN(CCO)CCNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 854299264 MQRWUGZIKXISOD-HNNXBMFYSA-N 350.463 0.887 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NCc1cnc2n1CCOC2 1119810855 UJUJANASARUVMY-UHFFFAOYSA-N 371.441 0.720 10 10 FCCE COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3[C@H]4COC[C@H]43)CC2)cc1F 1322980456 FWLQACWLKMLZHX-VIKVFOODSA-N 363.389 0.244 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 1341025367 MJDGYNXTPNZHQD-PVAVHDDUSA-N 361.442 0.597 10 10 FCCE C[C@@H]1NC(=O)[C@H](C)N(C(=O)c2cc(NS(C)(=O)=O)ccc2O)[C@@H]1C 1583302837 PMNKHBPTASZMIR-AEJSXWLSSA-N 355.416 0.501 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1 1640958380 MCPRCGCTROFSBW-DDHJSBNISA-N 350.396 0.789 10 10 FCCE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc(O)nc(O)c2)[C@H](CO)C1 2116259220 WVUHUMOGXVHSTG-NWDGAFQWSA-N 367.402 0.841 10 10 FCCE COc1ccc(O)c(CNC(=O)NCCCN2CCCS2(=O)=O)c1 734069174 NXDTZPGZRJHPHE-UHFFFAOYSA-N 357.432 0.626 10 10 FCCE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(C)[C@@H](C)CO)CC2)cc1 778394490 WEWUYBVFOJXSAV-HVHJFMEUSA-N 361.442 0.739 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1C[C@H](O)CN1C(=O)Cc1ccccc1F 808504580 IFSBCVCZBYTELZ-JSGCOSHPSA-N 351.330 0.031 10 10 FCCE NC(=O)C1=NO[C@@H](CNC(=O)NCc2cc(Br)ccc2O)C1 838588985 ZAWRNSYAHFCTCO-SECBINFHSA-N 371.191 0.584 10 10 FCCE CO[C@@H]1CS(=O)(=O)[C@H]2CN(C(=O)/C=C/c3ccc(O)c(O)c3)C[C@@H]12 855959021 QXUAGSWKYDQGNV-CTKOYHOVSA-N 353.396 0.381 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC(C(=O)O)C3)cc2)C1 857096872 JAZZMZWXFBITTF-CYBMUJFWSA-N 360.414 0.614 10 10 FCCE COc1ccc(N2CCN(C[C@@H](O)CNCC[C@@H](O)C(F)F)CC2)cc1 872222466 VINICKSPCUXNTA-DOTOQJQBSA-N 373.444 0.784 10 10 FCCE COC(=O)c1c(CN2CC[C@@H](S(N)(=O)=O)C2)c2cc(F)ccc2n1C 894535386 ZRSZPHCCONXWRL-LLVKDONJSA-N 369.418 0.967 10 10 FCCE O=C(Cn1cc(Br)c(O)nc1=O)NCc1ccc(O)cc1O 1299571492 WXXSEUSZJGWTJD-UHFFFAOYSA-N 370.159 0.439 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)NCC[C@H]2CNC(=O)C2)cc1 1333801043 QKTQVWIEXXXIGQ-OAHLLOKOSA-N 360.458 0.791 10 10 FCCE COc1ccc(CNC(=O)c2cc(S(N)(=O)=O)cnc2C)c(O)c1 1635041931 GBPVVGGOFYUBSL-UHFFFAOYSA-N 351.384 0.682 10 10 FCCE COc1cc(N2CCN(C(=O)[C@H](C)CC(N)=O)CC2)cc(OC)c1OC 1638186674 QQIUDOIGZGQEFY-GFCCVEGCSA-N 365.430 0.873 10 10 FCCE C[C@H](NC(=O)NC[C@]1(O)CCS(=O)(=O)C1)c1ccc(N(C)C)cc1 1680280182 JJKUZGZOELMCMY-BLLLJJGKSA-N 355.460 0.662 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@H](O)[C@@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2081034261 GBXAENVXUUQASV-KXNHARMFSA-N 355.395 0.629 10 10 FCCE CN1CCN(c2cc3c(cc2N)OCCO3)[C@H](CNC(=O)C(F)(F)F)C1 2163080750 OPCVJLJMWFHCJK-SNVBAGLBSA-N 374.363 0.839 10 10 FCCE C[C@@H](C(=O)O)S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 49049424 WSFVCQDXNHVVFL-LURJTMIESA-N 356.809 0.926 10 10 FCCE C[C@@H]1CO[C@@H](CO)CN1c1cc2c(cc1Br)[C@H](N)C(=O)N2 167230335 WCYXLNDCHUNNLS-RBDZCENOSA-N 356.220 0.987 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CCN(C(C)=O)C[C@@H]3C)nc12 268646169 FUEAZLQATSSLQS-NSHDSACASA-N 361.402 0.664 10 10 FCCE C[C@@H]([C@@H](C)N(C)Cc1cc(O)n2ncc(C(=O)O)c2n1)S(C)(=O)=O 737567482 GOGCQOFMUSKDGG-BDAKNGLRSA-N 356.404 0.387 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)NCCC3(CN)CC3)CC2)cc1 846351112 XAJPZAGFVKBMKW-UHFFFAOYSA-N 374.485 0.979 10 10 FCCE CO[C@H](CNC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCOC1 855211015 PFBCVUHJQNOWSX-QMTHXVAHSA-N 358.416 0.545 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1[C@H]2COC[C@H]21 1321856947 NTMASZMIAPQQOB-VIKVFOODSA-N 363.389 0.040 10 10 FCCE O=C(Cn1c(O)nnc1O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1628763377 FPAGMMWXPLOOHI-UHFFFAOYSA-N 365.365 0.106 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](CNC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)C1 2132351470 XOGXCOOLHCQJIV-GWCFXTLKSA-N 368.386 0.761 10 10 FCCE CCOC(=O)COc1ccc(/C=C2/C(=O)NC(=O)N(C)C2=O)cc1OC 33321643 ZZUZYUIFCODECY-XFFZJAGNSA-N 362.338 0.729 10 10 FCCE COc1ccc(OCCS(=O)(=O)NC[C@]2(OC)C=C[C@@H](OC)O2)cc1 70877774 UHOUWCDEZAXLOH-HOTGVXAUSA-N 373.427 0.895 10 10 FCCE Cc1nnnn1CC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 154612271 QRDGDRMHWAVCDD-UHFFFAOYSA-N 374.426 0.919 10 10 FCCE CC(C)(C)[C@@H](O)C[C@@H](CO)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 803570227 VQBWXVCLDPQBKN-FZMZJTMJSA-N 374.459 0.652 10 10 FCCE Cn1cc(/C=C\C(=O)N2CC[C@@H](C(=O)O)c3ccccc32)c(=O)n(C)c1=O 841773223 GHGAROOPMWYGIO-WBTMPAOCSA-N 369.377 0.702 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2CCN3C[C@H](O)C[C@H]3C2)cc1 848931625 MNLHHZKXDBCKNC-ZWKOTPCHSA-N 374.485 0.426 10 10 FCCE NC[C@@H]1CC(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)=NO1 852861204 QJPYXXHYRFJNDL-HIFRSBDPSA-N 359.430 0.108 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)Cn3nc4ccccn4c3=O)C2)cc1 855231785 NXBCRPJWQNKARR-CQSZACIVSA-N 367.409 0.900 10 10 FCCE CC[C@H](CNC(=O)[C@@]12COC[C@@H]1C2)NC(=O)c1cc(OC)nc(OC)c1 1582471283 XDUBTKBVJQCUGN-JCGVRSQUSA-N 363.414 0.760 10 10 FCCE COc1ccc(O)c([C@H](C)NC(=O)c2ccnc(S(N)(=O)=O)c2)c1 1595800375 WCDDUQNZXLAPHL-VIFPVBQESA-N 351.384 0.934 10 10 FCCE O=C(c1cccc(O)c1O)N(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 1597768965 FKUBNTSSHWTANL-RYUDHWBXSA-N 355.412 0.906 10 10 FCCE Cc1nnc(N(C)Cc2ccccc2O)n1CCS(=O)(=O)N(C)C 1762515563 BAXLCKXFWIIQRA-UHFFFAOYSA-N 353.448 0.820 10 10 FCCE COC[C@@](C)(CCO)NCC(=O)N1CCN(c2ccc(OC)cc2)CC1 267442501 CEYNGNFIVODCJT-LJQANCHMSA-N 365.474 0.721 10 10 FCCE CNS(=O)(=O)C[C@H]1CCCN1c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 761907040 KDCWRJYZCOAIBA-SECBINFHSA-N 370.387 0.444 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)NCCc3ccnn3C)C2)cc1 828848348 QLSNRPOEUCNBSW-AWEZNQCLSA-N 371.441 0.483 10 10 FCCE COC(=O)[C@@]1(OC)CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)C1 862744260 QGHHXPDMHYUPFB-OAHLLOKOSA-N 372.399 0.168 10 10 FCCE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](F)[C@H]3CCNC3)cc2)CC1 876909614 CXJMRJHVUMRXGM-WMZOPIPTSA-N 362.449 0.919 10 10 FCCE COc1ccc(N2CCN(C(=O)C[C@]3(C)CCS(=O)(=O)N3)CC2)cc1 929249692 INHMLSHQJUMIRB-KRWDZBQOSA-N 367.471 0.816 10 10 FCCE COC[C@@H]1C[C@@H](O)CN1C(=O)C(=O)NCc1ccc(N2CC=CC2)cc1 1261535835 BEQHZNAIAZAOJX-DLBZAZTESA-N 359.426 0.287 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@@H](CCO)[C@@H](CO)C1 1348483693 PLKZMLBTLPESHJ-IAGOWNOFSA-N 363.458 0.656 10 10 FCCE Cc1ccc(C(=O)NCC(=O)NCC(=O)NCc2ccccc2)c(O)c1O 1595176143 YVPUECKAWVRHDX-UHFFFAOYSA-N 371.393 0.569 10 10 FCCE CCS(=O)(=O)c1cnc(O)c(C(=O)NCc2c(O)cccc2O)c1 1647289886 LHHVBDLSMQGAFF-UHFFFAOYSA-N 352.368 0.922 10 10 FCCE CN(CC(=O)NCc1cc(O)ccc1O)S(=O)(=O)c1cccnc1 1651222966 UUPCMPZKPRTNDF-UHFFFAOYSA-N 351.384 0.430 10 10 FCCE CC(C)(C)OC(=O)N1CC(=O)N[C@@H]([C@H](N)Cc2ccc(O)c(O)c2)C1 1952970884 NHIUAKOECKEEHB-VXGBXAGGSA-N 351.403 0.703 10 10 FCCE COC(=O)/C=C\c1ccc(N2C[C@H](O)C[C@H]2C(=O)OC)c([N+](=O)[O-])c1 277484881 CYZWSANTZGZEGM-YBGXSUTOSA-N 350.327 0.894 10 10 FCCE COC(=O)C1=C[C@H](N=[N+]=[N-])[C@H](NC(C)=O)[C@H]([C@H](OC)[C@H]2COC(=O)O2)O1 504791833 DMLIIKCIUVVBPP-KICMGLQKSA-N 370.318 0.176 10 10 FCCE CC(=O)C(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 808500652 USWZURNJTAESEQ-SECBINFHSA-N 352.274 0.788 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H](NC(=O)c1cc(Cl)ccc1F)[C@H](C)O 808508184 VAGRFQRKILKPBC-ISVAXAHUSA-N 359.737 0.660 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)[C@H](O)Cc3cnn(C)c3)C2)cc1 819588184 KSQVLQNIXPHLNW-KBXCAEBGSA-N 358.442 0.975 10 10 FCCE O=C(NCC(=O)N1CCNCC1)NCc1cc(Br)ccc1O 841920552 PFHOIHQGWIWYTR-UHFFFAOYSA-N 371.235 0.386 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)Nc3cncnc3OC)C2)cc1 850537783 ULSNETFLQCBUIO-LBPRGKRZSA-N 371.397 0.827 10 10 FCCE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)N1CCC2(COC2)C1 850603268 VKBANZPQYSAMID-UHFFFAOYSA-N 373.453 0.731 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)C(=O)N[C@@H](C)[C@@H]3CCCNC3)C2)cc1 851688036 OYILWDXGIDAMKG-XHSDSOJGSA-N 374.485 0.894 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)CN(C)Cc3nnc(C)n3C)C2)cc1 855229342 ITJULKITKMNLOI-OAHLLOKOSA-N 372.473 0.959 10 10 FCCE CNS(=O)(=O)C[C@H]1CCCN(C(=O)NCCc2ccc(N)cc2)C1 861640706 NXBXSNIJSVOBDB-AWEZNQCLSA-N 354.476 0.782 10 10 FCCE CNC(=O)CN(CC(=O)NC)Cc1cc(Br)cc(F)c1O 895476765 ASZJXYLJPKQKSK-UHFFFAOYSA-N 362.199 0.588 10 10 FCCE C[C@H]1CC[C@@H](NC(=O)C(=O)NCc2ccc(N(C)C)cc2)CS1(=O)=O 1328780807 QTOMJXDHWITCKF-GXTWGEPZSA-N 367.471 0.451 10 10 FCCE Cc1cc(N(C)C)ccc1CNC(=O)C(=O)N[C@@H]1CCc2nnn(C)c2C1 1332868340 WGAKBMPONIZMHM-CQSZACIVSA-N 370.457 0.479 10 10 FCCE NC(=O)CN1CCN(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)CC1 255546591 DDRLXRDVIHKNJD-UTCJRWHESA-N 358.442 0.166 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(COC(=O)Cc3ccnn3C)nc12 769317180 WYARTMAKVRVQIJ-UHFFFAOYSA-N 359.342 0.631 10 10 FCCE COC(=O)[C@@H](F)CNC(=O)C(=O)N(C)CCN(C)c1ccc(OC)cc1 1332361736 XLYGMBFGPJWQFD-AWEZNQCLSA-N 369.393 0.217 10 10 FCCE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCCN(S(N)(=O)=O)C1 1467841232 UFTDNDGEHYWOFE-NSHDSACASA-N 362.448 0.410 10 10 FCCE COc1ccc(N2CCN(C(=O)CN3C[C@H]4CN(C)C[C@@H]4C3)CC2)cc1 2320380077 HWKBODUYAVRZIQ-IAGOWNOFSA-N 358.486 0.837 10 10 FCCE C[C@@H]1C[C@H]1N1C[C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1=O 369817538 MYVLFLIGRQTMSY-SUZMYJTESA-N 367.427 0.503 10 10 FCCE C[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(C)C1)c1ccc(N2CCOCC2)cc1 803308874 LTZXLVZBINSSCF-NVXWUHKLSA-N 374.485 0.911 10 10 FCCE COC(=O)c1cnc(SCC(=O)N(C)CC(=O)N2CCOCC2)s1 829687069 CHFAFMNKMCUIOM-UHFFFAOYSA-N 373.456 0.339 10 10 FCCE CCN(CCO)CCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 854299265 MQRWUGZIKXISOD-OAHLLOKOSA-N 350.463 0.887 10 10 FCCE NCc1ccc(N2CC3(CNS(=O)(=O)C3)C2)c(F)c1Br 2176156397 BUOCFZXFDVCOMR-UHFFFAOYSA-N 364.240 0.786 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2312333771 ABZKFFOSWSEDPH-WTPMCQDGSA-N 355.395 0.675 10 10 FCCE CC[C@@H](C)OC(=O)C[C@H]1C(=O)NCCN1C=C1C(=O)OC(C)(C)OC1=O 10213744 LLYSGMXKHIKDMU-PWSUYJOCSA-N 368.386 0.239 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)CSCC(=O)O)CC2)cc1 842586318 QBJLNLPOIQLEIY-UHFFFAOYSA-N 367.471 0.751 10 10 FCCE COc1ccc(N(C)CCN(C)C(=O)CN2C(=O)NC(C)(C)C2=O)cc1 844852857 UYJZMUAVRVSJCT-UHFFFAOYSA-N 362.430 0.920 10 10 FCCE CC[C@@H]1NCC[C@H]1NC(=O)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 861797020 KDFVCQHGJZVOOD-ZWKOTPCHSA-N 374.485 0.991 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)CCNC1=O 1153663203 JILVIRSQGDOGGL-APPDUMDISA-N 350.371 0.214 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@@H]1C(=O)NCc1ccc(N)cc1 2080680677 CYUMTFCSJXBOFX-BFHYXJOUSA-N 351.403 0.226 10 10 FCCE Cc1ccccc1N1C(=O)C(=CNN2CCN(C)CC2)C(=O)NC1=S 2296091298 JIVQMZAVSYUVBS-UHFFFAOYSA-N 359.455 0.379 10 10 FCCE CS(=O)(=O)C1=NN2C(=N)/C(=C\c3ccc(O)c(O)c3)C(=O)N=C2S1 20207830 UQRMYJNFQROHRE-SMNSQHBTSA-N 366.380 0.719 10 10 FCCE COCCCS(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 776509041 ZTICPXMHGJNLGF-UHFFFAOYSA-N 366.417 0.535 10 10 FCCE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C1=NO[C@@H](CN)C1 852884515 HDNGSZHIACRVLA-LLVKDONJSA-N 355.778 0.651 10 10 FCCE O=C1O[C@@H]2CNC[C@@H]2N1[C@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 872254557 HKHBIDTUGWNUTM-GBESFXJTSA-N 372.469 0.890 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N3C[C@@H](N)C(C)(C)C3)CC2)cc1 903727822 BRPBCRXMNHBTSF-QGZVFWFLSA-N 374.485 0.930 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCNC1=O 1638030362 KGIXROGTTBHNQV-NEPJUHHUSA-N 350.371 0.214 10 10 FCCE COCC(=O)Nc1nc(N2CCN(c3ccc(OC)cc3)CC2)nn1C 1869969529 PEIXPXZEVLTDCO-UHFFFAOYSA-N 360.418 0.735 10 10 FCCE C[C@H](NC(=O)[C@@H]1[C@@H](O)[C@H](O)CN1C(=O)OC(C)(C)C)c1ccccc1O 2136132654 JSQBTKVTBHOFJU-PUPMMZHASA-N 366.414 0.911 10 10 FCCE Cn1cc(/C=C\C(=O)N(CCC(N)=O)c2ccccc2)c(=O)n(C)c1=O 255229548 HIHRMLJUEOXMPA-HJWRWDBZSA-N 356.382 0.006 10 10 FCCE NC(=O)c1cc(O[C@H]2CCCN(C(=O)c3cc(O)nc(O)c3)C2)ccn1 585338448 YYBZXOHAHZBNTP-LBPRGKRZSA-N 358.354 0.670 10 10 FCCE CN(C)S(=O)(=O)N1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 794088071 QUPMTPBNMYUVDF-ALCCZGGFSA-N 369.443 0.452 10 10 FCCE O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@@H]2COC[C@@H]2C1 827079595 YHQWNQRTCSAKEE-SJORKVTESA-N 373.453 0.634 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NC[C@H]3C[C@@H](N(C)C)C3)C2)cc1 829768010 ZFHXYYWBHCCXKQ-INMHGKMJSA-N 374.485 0.847 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)C(=O)N(C)OC)C2)cc1 858599849 QTRSJFQZKIRXHT-STQMWFEESA-N 350.419 0.981 10 10 FCCE C[C@@H](NC(=O)C(=O)N[C@@H]1[C@H]2COC[C@H]21)c1ccc(N2CCOCC2)cc1 1117154803 AYFSWJWZLVXEMO-VZEFYGNVSA-N 359.426 0.461 10 10 FCCE CN(c1cc2c(cc1Br)[C@H](O)C(=O)N2)C1CS(=O)(=O)C1 2152233511 IENWYACMJCCAGX-NSHDSACASA-N 361.217 0.668 10 10 FCCE C[C@@H](NC(=O)c1cnc(O)n(C)c1=O)c1ccc(N2CCOCC2)cc1 751564771 KNOCVKWTFUDUAV-GFCCVEGCSA-N 358.398 0.814 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)N[C@H]3CC[C@H](O)CC3)C2)cc1 829700220 YOSYUMVQPSADHB-IIAWOOMASA-N 361.442 0.810 10 10 FCCE CN1CCN(c2ccc(CN3C(=O)[C@@H]4[C@H](O)CCCN4C3=O)cc2)CC1 925079735 NJUFLBDCCTWTFI-SJORKVTESA-N 358.442 0.726 10 10 FCCE CC[C@H](CN1CCOCC1)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1303791262 XGVWFANEZYWLDD-GFCCVEGCSA-N 371.459 0.604 10 10 FCCE CN1C[C@H]2CC[C@H]1[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C2 1472585830 KSLIWCGHFSOHAE-BPNCWPANSA-N 353.444 0.976 10 10 FCCE O=C(NCc1cccc(Cl)c1O)NCc1nnc2n1CCNC2=O 1684898072 UCWLFUNNFKUTMI-UHFFFAOYSA-N 350.766 0.380 10 10 FCCE CN(CCN)C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2080868930 HACLWJOFQOBAST-LBPRGKRZSA-N 353.419 0.951 10 10 FCCE CC(C)(C)OC(=O)NCCN(CCO)C[C@@H](O)COc1ccc(N)cc1 2106769194 UQTDFGCQKLWLRX-OAHLLOKOSA-N 369.462 0.828 10 10 FCCE COc1ccc(N2CCN(C(=O)CN(CCN(C)C)C(C)=O)CC2)cc1 244529734 ZSJPESQEZQSPRL-UHFFFAOYSA-N 362.474 0.754 10 10 FCCE COC(=O)CN(C(=O)/C=C\c1cn(C)c(=O)n(C)c1=O)c1ccccc1 736221566 SSHGJGDYGCDHOD-KTKRTIGZSA-N 357.366 0.303 10 10 FCCE CNC(=O)[C@@H](O)CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 839740058 MGOALYYLXMVBBP-SFHVURJKSA-N 372.469 0.631 10 10 FCCE CN(C)c1ccc(CNC(=O)C(=O)N2CCOC[C@H]2c2ccnn2C)cc1 846722625 MHWXKYFEBYZLBB-KRWDZBQOSA-N 371.441 0.702 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)c3cn(CC(=O)N(C)C)nn3)C2)cc1 855228444 ALGYUKSGAUZRLK-ZDUSSCGKSA-N 372.429 0.384 10 10 FCCE COc1ccc(N2CCCN(C(=O)C(=O)N[C@H]3CC[C@@H](C)NC3)CC2)cc1 861804519 QYUGUPCNWOYQOV-CVEARBPZSA-N 374.485 0.991 10 10 FCCE O=S1(=O)CCNC[C@H]1CCNCc1ccc(N2CCOCC2)c(F)c1 903968256 JZDDXVWDKCAWJB-OAHLLOKOSA-N 371.478 0.529 10 10 FCCE CO[C@H]1COCC[C@@H]1N(C)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1644526479 MTWWDGDYJWYOTB-JSGCOSHPSA-N 358.416 0.640 10 10 FCCE [N-]=[N+]=NCC1CN(c2ccc3c(c2)C(=O)N([C@H]2CCC(=O)NC2=O)C3=O)C1 2086865260 ATLMNQYVNPBVMG-ZDUSSCGKSA-N 368.353 0.834 10 10 FCCE CC(C)(C)OC(=O)N1C[C@H](O)[C@@H](O)[C@H]1CNCc1c(O)cccc1F 2218633682 SIUFNHVQOWIRRN-SNPRPXQTSA-N 356.394 0.962 10 10 FCCE CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](O)[C@@H]1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2332924060 DMJSWOAOWRRERV-UMSGYPCISA-N 369.422 0.876 10 10 FCCE C[C@@H](NC(=O)C(=O)N1CCO[C@@]2(CCOC2)C1)c1ccc(N(C)C)cc1 807673742 YHATWDVNGAXCMK-KUHUBIRLSA-N 361.442 0.948 10 10 FCCE NCC(F)(F)CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 846673393 SMDKMYHGWKLBHP-UHFFFAOYSA-N 361.414 0.522 10 10 FCCE CCN1CCN(c2ccc(CNC(=O)CCNC(=O)CO)cc2F)CC1 906601828 KKAXQKGUFKHHBH-UHFFFAOYSA-N 366.437 0.082 10 10 FCCE O=C1NC(=O)N(CCc2ccccc2)C(=O)C1=CNCCN1CCOCC1 2296114267 ULSBSXZBQJAZEH-UHFFFAOYSA-N 372.425 0.113 10 10 FCCE CC(=O)N1NC(=C2C(=O)NC(=O)N(C)C2=O)C[C@@H]1c1ccc(N(C)C)cc1 2296555997 LTBCJJDMBOVDQG-CQSZACIVSA-N 371.397 0.513 10 10 FCCE CC1(C)O[C@@H]2CO[C@]3(COS(=O)(=O)N=[N+]=[N-])OC(C)(C)O[C@@H]3[C@@H]2O1 196621864 ULLWHTAOFMDWSA-MFYTUXHUSA-N 365.364 0.956 10 10 FCCE C[C@H](O)[C@]1(N)Cc2c(O)c3c(c(O)c2[C@H](O)C1)C(=O)c1ccccc1C3=O 504672073 ZGPCATNYRXCKDP-LGDNQSIBSA-N 369.373 0.931 10 10 FCCE in-vitro C[C@@H](NC(=O)C(=O)N(C)CCCCO)c1ccc(N2CCOCC2)cc1 803308177 UGNKIDINSQQSRK-OAHLLOKOSA-N 363.458 0.931 10 10 FCCE COCCN(C(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCOC1 803665195 YOSZWGNNSREPBQ-CQSZACIVSA-N 367.421 0.772 10 10 FCCE CN1CCCc2cc(CNC(=O)C(=O)NCCCn3ccnn3)ccc21 803688326 OUZOVMSSCQFBBW-UHFFFAOYSA-N 356.430 0.483 10 10 FCCE C[C@@H](O)[C@H]1CN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)CCO1 817705337 DTVHJUXOOVDNKF-RHSMWYFYSA-N 361.442 0.511 10 10 FCCE COc1ccc(N2CC[C@@H](CNC(=O)C(=O)NCC34CC(CN3)C4)C2)cc1 851689757 SYZBWXILNJKUIC-BQTBQCLESA-N 372.469 0.506 10 10 FCCE COc1ccc(N2CCN(C[C@H](O)CN3CC[C@@]4(O)C[C@H]4C3)CC2)cc1 852539272 RMCJZBSTRHJWOF-XKGZKEIXSA-N 361.486 0.635 10 10 FCCE O=C(O)c1cnn2c(O)cc(CN3CCS[C@H]4COCC[C@@H]43)nc12 1118318314 DPVGWMJMIBIZBO-RYUDHWBXSA-N 350.400 0.839 10 10 FCCE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCC[C@@H]2CCOC2=O)c1 1644887563 RGDHNUYYVKZLEZ-SNVBAGLBSA-N 356.400 0.837 10 10 FCCE CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C\NC(CO)(CO)CO 13756145 YCQNICMHPFPQRH-WDZFZDKYSA-N 362.411 0.208 10 10 FCCE O=C1c2cc(O)cc(O)c2C(=O)c2c1cc1c(c2O)[C@H](CCO)[C@@H](O)O1 59066939 CMMJVRKBQZHKPV-VIIUKITBSA-N 358.302 0.756 10 10 FCCE biogenic,in-vitro COc1ccc(O)c(CNC(=O)N[C@H]2CCN(C3CCOCC3)C2=O)c1 371824722 NCHQEFWFDYGGKG-HNNXBMFYSA-N 363.414 0.980 10 10 FCCE NC(=O)c1cn(C2CN(Cc3cc(Br)ccc3O)C2)nn1 839144376 TUFPLZMMNIGGRH-UHFFFAOYSA-N 352.192 0.902 10 10 FCCE COc1ccc(N2CC[C@@H](NC(=O)C(=O)NCCCNC(C)C)C2)cc1 851687778 IFNAMWBONMAYBI-OAHLLOKOSA-N 362.474 0.894 10 10 FCCE COc1ccc(N2CC[C@H](NC(=O)[C@]3(OC)CCS(=O)(=O)C3)C2)cc1 892685532 SDUGHYGXESBGPJ-GUYCJALGSA-N 368.455 0.594 10 10 FCCE CN1C[C@H]2CN(C(=O)C(=O)NCc3ccc(N(C)C)c(F)c3)C[C@@]2(C)C1 929801452 AALCEKCHZDRINE-IFXJQAMLSA-N 362.449 0.918 10 10 FCCE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCN(C)C1=O 1119566924 JDUBGVXKQUHACX-OLZOCXBDSA-N 364.398 0.557 10 10 FCCE NCC1(CCNC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 1350340535 CDJQBWUARMVDFO-UHFFFAOYSA-N 374.485 0.509 10 10 FCCE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCn3cnnn3)cc2)C1 1355489374 MQNUJFPXDJRYPE-CQSZACIVSA-N 357.418 0.081 10 10 FCCE C[C@H](NC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1ccccc1O 1471194990 RTZAYJQHWBKJPH-AVGNSLFASA-N 366.439 0.605 10 10 FCCE CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)[C@H](O)[C@@H](N)C(=O)O 1952205355 WIPCCMLXTYNHQK-WQAKAFBOSA-N 356.375 0.306 10 10 FCCE O=C(O)[C@@H]1[C@H](O)[C@H](O)CN1Cc1cc(Br)cc(F)c1O 2200843481 JFVYVQJHEUHXLP-WCABBAIRSA-N 350.140 0.284 10 10 FCCE CN1C(=O)NC(=O)/C(=C/c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)C1=O 59498882 GHLJHSYTICSCHY-FLIBITNWSA-N 360.326 0.523 10 10 FCCE Cn1cc(/C=C\C(=O)NCCCSc2nccs2)c(=O)n(C)c1=O 255335602 RTNDAXKVRRTHQP-PLNGDYQASA-N 366.468 0.852 10 10 FCCE CC(=O)C(=O)COC(=O)[C@H](NC(=O)c1cc(Cl)ccc1F)[C@@H](C)O 808508183 VAGRFQRKILKPBC-AMIZOPFISA-N 359.737 0.660 10 10 FCCE COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2C(=O)c1c(F)ccc(O)c1O 827203648 WPLGWPDWEXUNPN-NRMKKVEVSA-N 367.329 0.802 10 10 FCCE COc1ccc(N2CCN(CCNC(=O)c3cnc(N)cn3)CC2)cc1 829504527 DYEKJLUBLLBDKP-UHFFFAOYSA-N 356.430 0.619 10 10 FCCE C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1nn(C)cc1O 1158308334 VRIMQSBXTFOKAK-QMMMGPOBSA-N 354.388 0.694 10 10 FCCE C[C@@H](C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)S(C)(=O)=O 1583379206 OJXXVHRBDHNEBZ-JTQLQIEISA-N 362.398 0.851 10 10 FCCE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](NC(=O)NC)C3)nc12 1653231476 YZWKSYPCPIPFAM-JTQLQIEISA-N 362.390 0.115 10 10 FCCE COc1ccc(N2CCN(C(=O)CCS(=O)(=O)NC3CC3)CC2)cc1 1858103144 AKTZMLHYNIAXEA-UHFFFAOYSA-N 367.471 0.816 10 10 FCCE O=C(N[C@H]1CCCCN1[C@H]1C(=O)CSC1=O)c1cc(O)c(O)c(O)c1 1865876444 LKAWOPLAVGXXIU-OLZOCXBDSA-N 366.395 0.556 10 10 FCCE CN(C[C@@H](O)CNC(=O)OC(C)(C)C)C[C@@H](O)COc1ccc(N)cc1 2106663503 ALSXPHFPSQZVPS-LSDHHAIUSA-N 369.462 0.826 10 10 FCCE O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N[C@@H]1[C@H]2COC[C@H]21 854033238 DLWCUMCTIYALGO-ZSHCYNCHSA-N 365.455 0.365 10 10 FCCE C[C@@H](NC(=O)c1cn(C[C@H]2CNC(=O)O2)nn1)c1ccc(N(C)C)cc1 1128247192 OBUMUIRVHPVVET-BXUZGUMPSA-N 358.402 0.944 10 10 FCCE CCN(CC)c1ccc(CNC(=O)C(=O)N2C[C@H](O)C[C@H]2COC)cc1 1326951708 AVSZRCRDPRPXNX-DLBZAZTESA-N 363.458 0.757 10 10 FCCE O=C(Cc1ccc(O)c(O)c1)NC[C@H](O)CS(=O)(=O)c1cccs1 1466307701 USMAXPBHFNWCCB-NSHDSACASA-N 371.436 0.653 10 10 FCCE COCC(=O)N1CCC[C@H]1C(=O)N1CCN(c2ccc(OC)cc2)CC1 1862277378 BFVFRCULCXVBMX-KRWDZBQOSA-N 361.442 0.981 10 10 FCCE